From a2380467c65f4162bc4b5cc5a1f5728f64431b1a Mon Sep 17 00:00:00 2001 From: Anna Gruszka Date: Thu, 16 Dec 2021 17:37:22 +0100 Subject: [PATCH 1/3] Stripped arom numbers (SAM bugfix) --- peleffy/data/complexes/5XXD_SAM.pdb | 6963 +++++++++++++++++++++++++++ peleffy/data/ligands/SAM.pdb | 74 + peleffy/tests/test_utils.py | 23 +- peleffy/utils/input.py | 3 +- 4 files changed, 7054 insertions(+), 9 deletions(-) create mode 100644 peleffy/data/complexes/5XXD_SAM.pdb create mode 100644 peleffy/data/ligands/SAM.pdb diff --git a/peleffy/data/complexes/5XXD_SAM.pdb b/peleffy/data/complexes/5XXD_SAM.pdb new file mode 100644 index 00000000..83545729 --- /dev/null +++ b/peleffy/data/complexes/5XXD_SAM.pdb @@ -0,0 +1,6963 @@ +ATOM 1 N PRO A 3 -9.009 2.095 126.120 1.00 30.53 N1+ +ATOM 2 CA PRO A 3 -8.595 2.760 127.360 1.00 32.73 C +ATOM 3 C PRO A 3 -7.108 2.564 127.640 1.00 38.96 C +ATOM 4 O PRO A 3 -6.621 1.433 127.646 1.00 37.14 O +ATOM 5 CB PRO A 3 -9.451 2.075 128.428 1.00 33.17 C +ATOM 6 CG PRO A 3 -9.743 0.731 127.861 1.00 28.67 C +ATOM 7 CD PRO A 3 -9.883 0.939 126.381 1.00 42.02 C +ATOM 8 H1 PRO A 3 -8.191 1.790 125.613 1.00 0.00 H +ATOM 9 H2 PRO A 3 -9.494 2.756 125.530 1.00 0.00 H +ATOM 10 HA PRO A 3 -8.832 3.823 127.313 1.00 0.00 H +ATOM 11 HB3 PRO A 3 -10.384 2.625 128.551 1.00 0.00 H +ATOM 12 HB2 PRO A 3 -8.867 1.962 129.341 1.00 0.00 H +ATOM 13 HG3 PRO A 3 -10.686 0.365 128.266 1.00 0.00 H +ATOM 14 HG2 PRO A 3 -8.901 0.066 128.055 1.00 0.00 H +ATOM 15 HD2 PRO A 3 -9.492 0.067 125.857 1.00 0.00 H +ATOM 16 HD3 PRO A 3 -10.914 1.208 126.151 1.00 0.00 H +ATOM 17 N LEU A 4 -6.399 3.663 127.875 1.00 29.90 N +ATOM 18 CA LEU A 4 -4.952 3.628 128.022 1.00 28.81 C +ATOM 19 C LEU A 4 -4.560 3.359 129.469 1.00 24.86 C +ATOM 20 O LEU A 4 -5.204 3.843 130.404 1.00 31.55 O +ATOM 21 CB LEU A 4 -4.335 4.944 127.547 1.00 24.32 C +ATOM 22 CG LEU A 4 -3.984 5.038 126.059 1.00 26.92 C +ATOM 23 CD1 LEU A 4 -5.068 4.417 125.193 1.00 36.43 C +ATOM 24 CD2 LEU A 4 -3.760 6.484 125.664 1.00 35.02 C +ATOM 25 H LEU A 4 -6.864 4.556 127.957 1.00 0.00 H +ATOM 26 HA LEU A 4 -4.562 2.820 127.403 1.00 0.00 H +ATOM 27 HB3 LEU A 4 -3.446 5.158 128.140 1.00 0.00 H +ATOM 28 HB2 LEU A 4 -4.998 5.768 127.812 1.00 0.00 H +ATOM 29 HG LEU A 4 -3.057 4.490 125.891 1.00 0.00 H +ATOM 30 HD11 LEU A 4 -4.787 4.501 124.143 1.00 0.00 H +ATOM 31 HD12 LEU A 4 -5.185 3.365 125.455 1.00 0.00 H +ATOM 32 HD13 LEU A 4 -6.010 4.939 125.359 1.00 0.00 H +ATOM 33 HD21 LEU A 4 -3.511 6.537 124.604 1.00 0.00 H +ATOM 34 HD22 LEU A 4 -4.667 7.058 125.853 1.00 0.00 H +ATOM 35 HD23 LEU A 4 -2.940 6.899 126.250 1.00 0.00 H +ATOM 36 N LYS A 5 -3.498 2.577 129.642 1.00 24.51 N +ATOM 37 CA LYS A 5 -2.959 2.264 130.957 1.00 28.69 C +ATOM 38 C LYS A 5 -1.902 3.263 131.409 1.00 26.04 C +ATOM 39 O LYS A 5 -1.427 3.170 132.546 1.00 24.56 O +ATOM 40 CB LYS A 5 -2.363 0.851 130.953 1.00 28.07 C +ATOM 41 CG LYS A 5 -3.400 -0.256 131.029 1.00 32.31 C +ATOM 42 CD LYS A 5 -2.865 -1.561 130.458 1.00 27.95 C +ATOM 43 CE LYS A 5 -3.962 -2.611 130.368 1.00 29.40 C +ATOM 44 NZ LYS A 5 -3.415 -3.971 130.104 1.00 23.56 N1+ +ATOM 45 H LYS A 5 -3.032 2.174 128.842 1.00 0.00 H +ATOM 46 HA LYS A 5 -3.778 2.286 131.675 1.00 0.00 H +ATOM 47 HB3 LYS A 5 -1.666 0.751 131.785 1.00 0.00 H +ATOM 48 HB2 LYS A 5 -1.756 0.717 130.057 1.00 0.00 H +ATOM 49 HG3 LYS A 5 -4.291 0.043 130.477 1.00 0.00 H +ATOM 50 HG2 LYS A 5 -3.693 -0.408 132.068 1.00 0.00 H +ATOM 51 HD3 LYS A 5 -2.059 -1.931 131.092 1.00 0.00 H +ATOM 52 HD2 LYS A 5 -2.453 -1.381 129.465 1.00 0.00 H +ATOM 53 HE3 LYS A 5 -4.659 -2.340 129.575 1.00 0.00 H +ATOM 54 HE2 LYS A 5 -4.530 -2.623 131.298 1.00 0.00 H +ATOM 55 HZ1 LYS A 5 -4.174 -4.635 130.052 1.00 0.00 H +ATOM 56 HZ2 LYS A 5 -2.911 -3.968 129.229 1.00 0.00 H +ATOM 57 HZ3 LYS A 5 -2.789 -4.234 130.852 1.00 0.00 H +ATOM 58 N VAL A 6 -1.522 4.208 130.549 1.00 19.26 N +ATOM 59 CA VAL A 6 -0.492 5.191 130.847 1.00 22.60 C +ATOM 60 C VAL A 6 -1.049 6.579 130.552 1.00 21.22 C +ATOM 61 O VAL A 6 -2.080 6.735 129.898 1.00 22.31 O +ATOM 62 CB VAL A 6 0.801 4.941 130.043 1.00 18.20 C +ATOM 63 CG1 VAL A 6 1.219 3.483 130.157 1.00 19.73 C +ATOM 64 CG2 VAL A 6 0.604 5.327 128.588 1.00 19.09 C +ATOM 65 H VAL A 6 -1.955 4.266 129.638 1.00 0.00 H +ATOM 66 HA VAL A 6 -0.255 5.132 131.909 1.00 0.00 H +ATOM 67 HB VAL A 6 1.594 5.562 130.461 1.00 0.00 H +ATOM 68 HG11 VAL A 6 2.133 3.321 129.585 1.00 0.00 H +ATOM 69 HG12 VAL A 6 1.398 3.236 131.204 1.00 0.00 H +ATOM 70 HG13 VAL A 6 0.427 2.846 129.764 1.00 0.00 H +ATOM 71 HG21 VAL A 6 1.525 5.144 128.035 1.00 0.00 H +ATOM 72 HG22 VAL A 6 -0.201 4.730 128.159 1.00 0.00 H +ATOM 73 HG23 VAL A 6 0.346 6.384 128.524 1.00 0.00 H +ATOM 74 N GLU A 7 -0.349 7.597 131.050 1.00 18.72 N +ATOM 75 CA GLU A 7 -0.786 8.973 130.863 1.00 20.07 C +ATOM 76 C GLU A 7 0.413 9.907 130.921 1.00 18.72 C +ATOM 77 O GLU A 7 1.384 9.657 131.641 1.00 12.77 O +ATOM 78 CB GLU A 7 -1.826 9.383 131.915 1.00 14.44 C +ATOM 79 CG GLU A 7 -1.231 9.791 133.253 1.00 22.27 C +ATOM 80 CD GLU A 7 -2.283 10.032 134.314 1.00 25.96 C +ATOM 81 OE1 GLU A 7 -1.939 9.996 135.514 1.00 30.25 O +ATOM 82 OE2 GLU A 7 -3.454 10.258 133.947 1.00 21.96 O1- +ATOM 83 H GLU A 7 0.500 7.421 131.567 1.00 0.00 H +ATOM 84 HA GLU A 7 -1.242 9.059 129.877 1.00 0.00 H +ATOM 85 HB3 GLU A 7 -2.529 8.564 132.067 1.00 0.00 H +ATOM 86 HB2 GLU A 7 -2.432 10.201 131.525 1.00 0.00 H +ATOM 87 HG3 GLU A 7 -0.634 10.694 133.124 1.00 0.00 H +ATOM 88 HG2 GLU A 7 -0.543 9.018 133.594 1.00 0.00 H +ATOM 89 N LYS A 8 0.337 10.980 130.139 1.00 12.09 N +ATOM 90 CA LYS A 8 1.329 12.042 130.216 1.00 9.90 C +ATOM 91 C LYS A 8 1.105 12.871 131.474 1.00 13.24 C +ATOM 92 O LYS A 8 -0.034 13.107 131.887 1.00 14.75 O +ATOM 93 CB LYS A 8 1.244 12.926 128.970 1.00 13.98 C +ATOM 94 CG LYS A 8 2.046 14.216 129.036 1.00 10.74 C +ATOM 95 CD LYS A 8 1.571 15.203 127.980 1.00 12.63 C +ATOM 96 CE LYS A 8 2.503 16.399 127.875 1.00 20.61 C +ATOM 97 NZ LYS A 8 1.857 17.553 127.190 1.00 28.82 N1+ +ATOM 98 H LYS A 8 -0.420 11.069 129.476 1.00 0.00 H +ATOM 99 HA LYS A 8 2.321 11.594 130.262 1.00 0.00 H +ATOM 100 HB3 LYS A 8 0.199 13.161 128.765 1.00 0.00 H +ATOM 101 HB2 LYS A 8 1.557 12.351 128.098 1.00 0.00 H +ATOM 102 HG3 LYS A 8 3.102 13.996 128.878 1.00 0.00 H +ATOM 103 HG2 LYS A 8 1.936 14.661 130.025 1.00 0.00 H +ATOM 104 HD3 LYS A 8 0.567 15.546 128.230 1.00 0.00 H +ATOM 105 HD2 LYS A 8 1.514 14.701 127.014 1.00 0.00 H +ATOM 106 HE3 LYS A 8 3.402 16.111 127.330 1.00 0.00 H +ATOM 107 HE2 LYS A 8 2.819 16.701 128.873 1.00 0.00 H +ATOM 108 HZ1 LYS A 8 2.508 18.324 127.141 1.00 0.00 H +ATOM 109 HZ2 LYS A 8 1.587 17.282 126.255 1.00 0.00 H +ATOM 110 HZ3 LYS A 8 1.038 17.837 127.708 1.00 0.00 H +ATOM 111 N PHE A 9 2.200 13.301 132.098 1.00 11.76 N +ATOM 112 CA PHE A 9 2.100 14.146 133.279 1.00 12.20 C +ATOM 113 C PHE A 9 3.382 14.952 133.420 1.00 13.90 C +ATOM 114 O PHE A 9 4.409 14.636 132.813 1.00 16.53 O +ATOM 115 CB PHE A 9 1.826 13.323 134.544 1.00 10.81 C +ATOM 116 CG PHE A 9 3.056 12.719 135.163 1.00 14.09 C +ATOM 117 CD1 PHE A 9 3.463 13.102 136.432 1.00 17.47 C +ATOM 118 CD2 PHE A 9 3.794 11.760 134.489 1.00 15.45 C +ATOM 119 CE1 PHE A 9 4.589 12.548 137.013 1.00 13.26 C +ATOM 120 CE2 PHE A 9 4.922 11.201 135.065 1.00 16.86 C +ATOM 121 CZ PHE A 9 5.319 11.596 136.329 1.00 11.46 C +ATOM 122 H PHE A 9 3.113 13.041 131.753 1.00 0.00 H +ATOM 123 HA PHE A 9 1.272 14.840 133.135 1.00 0.00 H +ATOM 124 HB3 PHE A 9 1.112 12.532 134.313 1.00 0.00 H +ATOM 125 HB2 PHE A 9 1.321 13.949 135.280 1.00 0.00 H +ATOM 126 HD1 PHE A 9 2.898 13.842 136.980 1.00 0.00 H +ATOM 127 HD2 PHE A 9 3.491 11.440 133.503 1.00 0.00 H +ATOM 128 HE1 PHE A 9 4.896 12.860 138.000 1.00 0.00 H +ATOM 129 HE2 PHE A 9 5.491 10.457 134.527 1.00 0.00 H +ATOM 130 HZ PHE A 9 6.198 11.162 136.782 1.00 0.00 H +ATOM 131 N ALA A 10 3.301 16.008 134.225 1.00 11.48 N +ATOM 132 CA ALA A 10 4.431 16.899 134.461 1.00 15.07 C +ATOM 133 C ALA A 10 5.170 16.432 135.708 1.00 12.78 C +ATOM 134 O ALA A 10 4.623 16.469 136.815 1.00 15.18 O +ATOM 135 CB ALA A 10 3.959 18.343 134.610 1.00 18.60 C +ATOM 136 H ALA A 10 2.434 16.216 134.699 1.00 0.00 H +ATOM 137 HA ALA A 10 5.108 16.838 133.609 1.00 0.00 H +ATOM 138 HB1 ALA A 10 4.818 18.990 134.785 1.00 0.00 H +ATOM 139 HB2 ALA A 10 3.450 18.655 133.698 1.00 0.00 H +ATOM 140 HB3 ALA A 10 3.272 18.416 135.453 1.00 0.00 H +ATOM 141 N THR A 11 6.411 15.988 135.529 1.00 11.45 N +ATOM 142 CA THR A 11 7.219 15.573 136.662 1.00 13.94 C +ATOM 143 C THR A 11 7.708 16.795 137.439 1.00 14.84 C +ATOM 144 O THR A 11 7.569 17.943 137.008 1.00 17.70 O +ATOM 145 CB THR A 11 8.406 14.734 136.197 1.00 14.26 C +ATOM 146 OG1 THR A 11 9.372 15.588 135.576 1.00 17.17 O +ATOM 147 CG2 THR A 11 7.955 13.682 135.195 1.00 11.57 C +ATOM 148 H THR A 11 6.800 15.937 134.598 1.00 0.00 H +ATOM 149 HA THR A 11 6.602 14.965 137.324 1.00 0.00 H +ATOM 150 HB THR A 11 8.859 14.242 137.057 1.00 0.00 H +ATOM 151 HG1 THR A 11 10.121 15.064 135.282 1.00 0.00 H +ATOM 152 HG21 THR A 11 8.814 13.093 134.874 1.00 0.00 H +ATOM 153 HG22 THR A 11 7.220 13.027 135.662 1.00 0.00 H +ATOM 154 HG23 THR A 11 7.507 14.172 134.330 1.00 0.00 H +ATOM 155 N ALA A 12 8.299 16.531 138.603 1.00 21.14 N +ATOM 156 CA ALA A 12 8.728 17.611 139.482 1.00 20.93 C +ATOM 157 C ALA A 12 10.044 18.238 139.035 1.00 21.16 C +ATOM 158 O ALA A 12 10.261 19.435 139.259 1.00 23.59 O +ATOM 159 CB ALA A 12 8.846 17.095 140.916 1.00 24.11 C +ATOM 160 H ALA A 12 8.454 15.574 138.885 1.00 0.00 H +ATOM 161 HA ALA A 12 7.962 18.386 139.464 1.00 0.00 H +ATOM 162 HB1 ALA A 12 9.167 17.906 141.569 1.00 0.00 H +ATOM 163 HB2 ALA A 12 7.877 16.722 141.249 1.00 0.00 H +ATOM 164 HB3 ALA A 12 9.578 16.288 140.953 1.00 0.00 H +ATOM 165 N ASN A 13 10.932 17.457 138.407 1.00 15.79 N +ATOM 166 CA ASN A 13 12.208 18.010 137.965 1.00 25.36 C +ATOM 167 C ASN A 13 12.751 17.345 136.702 1.00 18.12 C +ATOM 168 O ASN A 13 13.951 17.463 136.429 1.00 22.44 O +ATOM 169 CB ASN A 13 13.251 17.905 139.090 1.00 22.61 C +ATOM 170 CG ASN A 13 13.398 16.493 139.624 1.00 27.44 C +ATOM 171 OD1 ASN A 13 12.979 15.527 138.991 1.00 24.39 O +ATOM 172 ND2 ASN A 13 13.997 16.370 140.801 1.00 26.66 N +ATOM 173 H ASN A 13 10.719 16.484 138.239 1.00 0.00 H +ATOM 174 HA ASN A 13 12.057 19.067 137.747 1.00 0.00 H +ATOM 175 HB3 ASN A 13 12.973 18.573 139.905 1.00 0.00 H +ATOM 176 HB2 ASN A 13 14.216 18.256 138.723 1.00 0.00 H +ATOM 177 HD22 ASN A 13 14.125 15.455 141.210 1.00 0.00 H +ATOM 178 HD21 ASN A 13 14.325 17.191 141.289 1.00 0.00 H +ATOM 179 N ARG A 14 11.914 16.655 135.926 1.00 17.83 N +ATOM 180 CA ARG A 14 12.362 15.938 134.738 1.00 18.21 C +ATOM 181 C ARG A 14 11.496 16.270 133.529 1.00 14.23 C +ATOM 182 O ARG A 14 11.367 15.456 132.613 1.00 16.96 O +ATOM 183 CB ARG A 14 12.373 14.429 134.986 1.00 16.51 C +ATOM 184 CG ARG A 14 13.548 13.956 135.815 1.00 24.03 C +ATOM 185 CD ARG A 14 13.106 13.180 137.041 1.00 27.22 C +ATOM 186 NE ARG A 14 12.389 11.957 136.700 1.00 23.63 N +ATOM 187 CZ ARG A 14 12.800 10.741 137.044 1.00 28.50 C +ATOM 188 NH1 ARG A 14 13.925 10.589 137.730 1.00 31.33 N +ATOM 189 NH2 ARG A 14 12.092 9.676 136.700 1.00 33.12 N1+ +ATOM 190 H ARG A 14 10.931 16.616 136.153 1.00 0.00 H +ATOM 191 HA ARG A 14 13.383 16.252 134.519 1.00 0.00 H +ATOM 192 HB3 ARG A 14 12.371 13.905 134.030 1.00 0.00 H +ATOM 193 HB2 ARG A 14 11.444 14.136 135.475 1.00 0.00 H +ATOM 194 HG3 ARG A 14 14.142 14.816 136.125 1.00 0.00 H +ATOM 195 HG2 ARG A 14 14.195 13.328 135.202 1.00 0.00 H +ATOM 196 HD3 ARG A 14 12.470 13.812 137.660 1.00 0.00 H +ATOM 197 HD2 ARG A 14 13.978 12.932 137.647 1.00 0.00 H +ATOM 198 HE ARG A 14 11.535 12.071 136.172 1.00 0.00 H +ATOM 199 HH12 ARG A 14 14.236 9.664 137.991 1.00 0.00 H +ATOM 200 HH11 ARG A 14 14.470 11.398 137.991 1.00 0.00 H +ATOM 201 HH22 ARG A 14 12.407 8.753 136.963 1.00 0.00 H +ATOM 202 HH21 ARG A 14 11.237 9.786 136.174 1.00 0.00 H +ATOM 203 N GLY A 15 10.891 17.455 133.512 1.00 12.10 N +ATOM 204 CA GLY A 15 9.993 17.782 132.420 1.00 11.04 C +ATOM 205 C GLY A 15 8.767 16.892 132.436 1.00 14.53 C +ATOM 206 O GLY A 15 8.208 16.579 133.493 1.00 13.75 O +ATOM 207 H GLY A 15 11.058 18.118 134.255 1.00 0.00 H +ATOM 208 HA3 GLY A 15 10.516 17.662 131.471 1.00 0.00 H +ATOM 209 HA2 GLY A 15 9.686 18.825 132.503 1.00 0.00 H +ATOM 210 N ASN A 16 8.339 16.473 131.250 1.00 12.78 N +ATOM 211 CA ASN A 16 7.183 15.601 131.115 1.00 13.06 C +ATOM 212 C ASN A 16 7.598 14.135 131.215 1.00 10.97 C +ATOM 213 O ASN A 16 8.757 13.774 130.999 1.00 10.74 O +ATOM 214 CB ASN A 16 6.470 15.858 129.788 1.00 15.62 C +ATOM 215 CG ASN A 16 5.872 17.246 129.712 1.00 14.43 C +ATOM 216 OD1 ASN A 16 5.361 17.767 130.702 1.00 13.02 O +ATOM 217 ND2 ASN A 16 5.948 17.862 128.537 1.00 9.21 N +ATOM 218 H ASN A 16 8.820 16.760 130.409 1.00 0.00 H +ATOM 219 HA ASN A 16 6.490 15.819 131.927 1.00 0.00 H +ATOM 220 HB3 ASN A 16 5.683 15.116 129.650 1.00 0.00 H +ATOM 221 HB2 ASN A 16 7.173 15.721 128.966 1.00 0.00 H +ATOM 222 HD22 ASN A 16 5.565 18.790 128.428 1.00 0.00 H +ATOM 223 HD21 ASN A 16 6.388 17.402 127.753 1.00 0.00 H +ATOM 224 N GLY A 17 6.628 13.289 131.552 1.00 16.19 N +ATOM 225 CA GLY A 17 6.883 11.868 131.682 1.00 12.13 C +ATOM 226 C GLY A 17 5.604 11.072 131.539 1.00 11.66 C +ATOM 227 O GLY A 17 4.521 11.622 131.327 1.00 12.49 O +ATOM 228 H GLY A 17 5.694 13.634 131.722 1.00 0.00 H +ATOM 229 HA3 GLY A 17 7.329 11.667 132.656 1.00 0.00 H +ATOM 230 HA2 GLY A 17 7.593 11.555 130.916 1.00 0.00 H +ATOM 231 N LEU A 18 5.750 9.754 131.650 1.00 17.96 N +ATOM 232 CA LEU A 18 4.636 8.818 131.614 1.00 15.16 C +ATOM 233 C LEU A 18 4.461 8.187 132.988 1.00 16.13 C +ATOM 234 O LEU A 18 5.444 7.891 133.674 1.00 16.46 O +ATOM 235 CB LEU A 18 4.867 7.721 130.570 1.00 11.39 C +ATOM 236 CG LEU A 18 4.379 7.941 129.137 1.00 16.64 C +ATOM 237 CD1 LEU A 18 4.605 6.684 128.312 1.00 13.63 C +ATOM 238 CD2 LEU A 18 2.915 8.340 129.110 1.00 14.43 C +ATOM 239 H LEU A 18 6.671 9.356 131.766 1.00 0.00 H +ATOM 240 HA LEU A 18 3.727 9.362 131.358 1.00 0.00 H +ATOM 241 HB3 LEU A 18 4.458 6.782 130.944 1.00 0.00 H +ATOM 242 HB2 LEU A 18 5.927 7.468 130.549 1.00 0.00 H +ATOM 243 HG LEU A 18 4.963 8.749 128.697 1.00 0.00 H +ATOM 244 HD11 LEU A 18 4.255 6.850 127.293 1.00 0.00 H +ATOM 245 HD12 LEU A 18 5.669 6.446 128.296 1.00 0.00 H +ATOM 246 HD13 LEU A 18 4.054 5.854 128.755 1.00 0.00 H +ATOM 247 HD21 LEU A 18 2.598 8.489 128.078 1.00 0.00 H +ATOM 248 HD22 LEU A 18 2.315 7.552 129.564 1.00 0.00 H +ATOM 249 HD23 LEU A 18 2.780 9.266 129.669 1.00 0.00 H +ATOM 250 N ARG A 19 3.208 7.981 133.388 1.00 13.55 N +ATOM 251 CA ARG A 19 2.903 7.336 134.655 1.00 15.02 C +ATOM 252 C ARG A 19 1.696 6.428 134.475 1.00 18.34 C +ATOM 253 O ARG A 19 0.924 6.565 133.523 1.00 17.20 O +ATOM 254 CB ARG A 19 2.651 8.358 135.771 1.00 13.24 C +ATOM 255 CG ARG A 19 1.314 9.067 135.682 1.00 13.84 C +ATOM 256 CD ARG A 19 1.157 10.077 136.805 1.00 17.02 C +ATOM 257 NE ARG A 19 0.092 11.038 136.534 1.00 15.50 N +ATOM 258 CZ ARG A 19 -0.075 12.173 137.203 1.00 14.54 C +ATOM 259 NH1 ARG A 19 0.755 12.493 138.187 1.00 13.22 N +ATOM 260 NH2 ARG A 19 -1.070 12.991 136.889 1.00 20.21 N1+ +ATOM 261 H ARG A 19 2.437 8.276 132.806 1.00 0.00 H +ATOM 262 HA ARG A 19 3.756 6.720 134.940 1.00 0.00 H +ATOM 263 HB3 ARG A 19 3.452 9.097 135.771 1.00 0.00 H +ATOM 264 HB2 ARG A 19 2.734 7.863 136.739 1.00 0.00 H +ATOM 265 HG3 ARG A 19 0.510 8.333 135.739 1.00 0.00 H +ATOM 266 HG2 ARG A 19 1.237 9.577 134.722 1.00 0.00 H +ATOM 267 HD3 ARG A 19 2.098 10.609 136.948 1.00 0.00 H +ATOM 268 HD2 ARG A 19 0.944 9.553 137.737 1.00 0.00 H +ATOM 269 HE ARG A 19 -0.541 10.795 135.785 1.00 0.00 H +ATOM 270 HH12 ARG A 19 0.627 13.356 138.695 1.00 0.00 H +ATOM 271 HH11 ARG A 19 1.515 11.873 138.428 1.00 0.00 H +ATOM 272 HH22 ARG A 19 -1.195 13.854 137.399 1.00 0.00 H +ATOM 273 HH21 ARG A 19 -1.703 12.752 136.139 1.00 0.00 H +ATOM 274 N ALA A 20 1.539 5.495 135.411 1.00 19.18 N +ATOM 275 CA ALA A 20 0.529 4.454 135.288 1.00 21.62 C +ATOM 276 C ALA A 20 -0.840 4.963 135.719 1.00 20.42 C +ATOM 277 O ALA A 20 -0.998 5.501 136.819 1.00 18.81 O +ATOM 278 CB ALA A 20 0.918 3.235 136.121 1.00 16.10 C +ATOM 279 H ALA A 20 2.128 5.498 136.231 1.00 0.00 H +ATOM 280 HA ALA A 20 0.471 4.152 134.242 1.00 0.00 H +ATOM 281 HB1 ALA A 20 0.153 2.465 136.019 1.00 0.00 H +ATOM 282 HB2 ALA A 20 1.874 2.845 135.771 1.00 0.00 H +ATOM 283 HB3 ALA A 20 1.005 3.523 137.169 1.00 0.00 H +ATOM 284 N VAL A 21 -1.831 4.789 134.840 1.00 19.80 N +ATOM 285 CA VAL A 21 -3.228 5.032 135.198 1.00 25.81 C +ATOM 286 C VAL A 21 -3.801 3.892 136.022 1.00 25.83 C +ATOM 287 O VAL A 21 -4.857 4.048 136.649 1.00 32.69 O +ATOM 288 CB VAL A 21 -4.040 5.246 133.904 1.00 24.44 C +ATOM 289 CG1 VAL A 21 -5.491 5.606 134.195 1.00 31.90 C +ATOM 290 CG2 VAL A 21 -3.395 6.314 133.043 1.00 25.66 C +ATOM 291 H VAL A 21 -1.624 4.482 133.900 1.00 0.00 H +ATOM 292 HA VAL A 21 -3.278 5.945 135.791 1.00 0.00 H +ATOM 293 HB VAL A 21 -4.031 4.311 133.343 1.00 0.00 H +ATOM 294 HG11 VAL A 21 -6.026 5.748 133.256 1.00 0.00 H +ATOM 295 HG12 VAL A 21 -5.959 4.801 134.761 1.00 0.00 H +ATOM 296 HG13 VAL A 21 -5.528 6.527 134.776 1.00 0.00 H +ATOM 297 HG21 VAL A 21 -3.981 6.452 132.134 1.00 0.00 H +ATOM 298 HG22 VAL A 21 -3.356 7.253 133.596 1.00 0.00 H +ATOM 299 HG23 VAL A 21 -2.383 6.006 132.779 1.00 0.00 H +ATOM 300 N THR A 22 -3.104 2.764 136.076 1.00 25.17 N +ATOM 301 CA THR A 22 -3.637 1.525 136.621 1.00 25.77 C +ATOM 302 C THR A 22 -2.463 0.681 137.105 1.00 26.10 C +ATOM 303 O THR A 22 -1.327 0.883 136.657 1.00 23.58 O +ATOM 304 CB THR A 22 -4.461 0.775 135.556 1.00 26.70 C +ATOM 305 OG1 THR A 22 -5.405 -0.102 136.184 1.00 34.47 O +ATOM 306 CG2 THR A 22 -3.557 -0.029 134.632 1.00 22.54 C +ATOM 307 H THR A 22 -2.156 2.739 135.728 1.00 0.00 H +ATOM 308 HA THR A 22 -4.281 1.758 137.469 1.00 0.00 H +ATOM 309 HB THR A 22 -5.007 1.506 134.960 1.00 0.00 H +ATOM 310 HG1 THR A 22 -5.911 -0.563 135.511 1.00 0.00 H +ATOM 311 HG21 THR A 22 -4.164 -0.548 133.890 1.00 0.00 H +ATOM 312 HG22 THR A 22 -2.863 0.643 134.127 1.00 0.00 H +ATOM 313 HG23 THR A 22 -2.996 -0.758 135.216 1.00 0.00 H +ATOM 314 N PRO A 23 -2.692 -0.248 138.037 1.00 29.64 N +ATOM 315 CA PRO A 23 -1.599 -1.135 138.457 1.00 23.33 C +ATOM 316 C PRO A 23 -1.127 -2.011 137.305 1.00 22.84 C +ATOM 317 O PRO A 23 -1.929 -2.598 136.576 1.00 28.63 O +ATOM 318 CB PRO A 23 -2.216 -1.964 139.592 1.00 25.11 C +ATOM 319 CG PRO A 23 -3.471 -1.257 139.975 1.00 27.99 C +ATOM 320 CD PRO A 23 -3.938 -0.521 138.772 1.00 35.26 C +ATOM 321 HA PRO A 23 -0.767 -0.544 138.839 1.00 0.00 H +ATOM 322 HB3 PRO A 23 -1.534 -1.977 140.442 1.00 0.00 H +ATOM 323 HB2 PRO A 23 -2.460 -2.960 139.222 1.00 0.00 H +ATOM 324 HG3 PRO A 23 -3.258 -0.547 140.774 1.00 0.00 H +ATOM 325 HG2 PRO A 23 -4.224 -1.988 140.268 1.00 0.00 H +ATOM 326 HD2 PRO A 23 -4.573 -1.175 138.174 1.00 0.00 H +ATOM 327 HD3 PRO A 23 -4.388 0.423 139.080 1.00 0.00 H +ATOM 328 N LEU A 24 0.190 -2.080 137.136 1.00 23.80 N +ATOM 329 CA LEU A 24 0.799 -2.841 136.058 1.00 25.64 C +ATOM 330 C LEU A 24 1.624 -3.983 136.631 1.00 21.69 C +ATOM 331 O LEU A 24 2.237 -3.859 137.696 1.00 21.55 O +ATOM 332 CB LEU A 24 1.676 -1.948 135.173 1.00 22.82 C +ATOM 333 CG LEU A 24 1.031 -0.637 134.717 1.00 18.63 C +ATOM 334 CD1 LEU A 24 2.070 0.294 134.110 1.00 17.19 C +ATOM 335 CD2 LEU A 24 -0.095 -0.908 133.732 1.00 22.95 C +ATOM 336 H LEU A 24 0.807 -1.592 137.770 1.00 0.00 H +ATOM 337 HA LEU A 24 0.005 -3.264 135.442 1.00 0.00 H +ATOM 338 HB3 LEU A 24 1.999 -2.513 134.299 1.00 0.00 H +ATOM 339 HB2 LEU A 24 2.608 -1.729 135.694 1.00 0.00 H +ATOM 340 HG LEU A 24 0.605 -0.146 135.592 1.00 0.00 H +ATOM 341 HD11 LEU A 24 1.589 1.219 133.793 1.00 0.00 H +ATOM 342 HD12 LEU A 24 2.835 0.519 134.853 1.00 0.00 H +ATOM 343 HD13 LEU A 24 2.532 -0.188 133.248 1.00 0.00 H +ATOM 344 HD21 LEU A 24 -0.541 0.037 133.420 1.00 0.00 H +ATOM 345 HD22 LEU A 24 0.302 -1.428 132.860 1.00 0.00 H +ATOM 346 HD23 LEU A 24 -0.855 -1.527 134.209 1.00 0.00 H +ATOM 347 N ARG A 25 1.626 -5.098 135.916 1.00 28.10 N +ATOM 348 CA ARG A 25 2.357 -6.294 136.295 1.00 24.91 C +ATOM 349 C ARG A 25 3.425 -6.598 135.253 1.00 20.65 C +ATOM 350 O ARG A 25 3.315 -6.170 134.098 1.00 18.08 O +ATOM 351 CB ARG A 25 1.405 -7.490 136.438 1.00 24.92 C +ATOM 352 CG ARG A 25 0.547 -7.444 137.694 1.00 35.37 C +ATOM 353 CD ARG A 25 -0.682 -8.340 137.583 1.00 43.89 C +ATOM 354 NE ARG A 25 -1.509 -8.015 136.423 1.00 46.77 N +ATOM 355 CZ ARG A 25 -1.535 -8.723 135.298 1.00 42.55 C +ATOM 356 NH1 ARG A 25 -0.775 -9.803 135.174 1.00 37.55 N +ATOM 357 NH2 ARG A 25 -2.319 -8.350 134.296 1.00 40.15 N1+ +ATOM 358 H ARG A 25 1.099 -5.147 135.056 1.00 0.00 H +ATOM 359 HA ARG A 25 2.844 -6.117 137.254 1.00 0.00 H +ATOM 360 HB3 ARG A 25 1.982 -8.415 136.428 1.00 0.00 H +ATOM 361 HB2 ARG A 25 0.760 -7.545 135.561 1.00 0.00 H +ATOM 362 HG3 ARG A 25 0.232 -6.417 137.880 1.00 0.00 H +ATOM 363 HG2 ARG A 25 1.144 -7.752 138.552 1.00 0.00 H +ATOM 364 HD3 ARG A 25 -1.279 -8.250 138.490 1.00 0.00 H +ATOM 365 HD2 ARG A 25 -0.367 -9.382 137.523 1.00 0.00 H +ATOM 366 HE ARG A 25 -2.087 -7.192 136.515 1.00 0.00 H +ATOM 367 HH12 ARG A 25 -0.796 -10.340 134.319 1.00 0.00 H +ATOM 368 HH11 ARG A 25 -0.175 -10.089 135.935 1.00 0.00 H +ATOM 369 HH22 ARG A 25 -2.338 -8.889 133.442 1.00 0.00 H +ATOM 370 HH21 ARG A 25 -2.897 -7.527 134.387 1.00 0.00 H +ATOM 371 N PRO A 26 4.484 -7.312 135.634 1.00 22.29 N +ATOM 372 CA PRO A 26 5.548 -7.629 134.672 1.00 19.65 C +ATOM 373 C PRO A 26 5.008 -8.322 133.429 1.00 17.17 C +ATOM 374 O PRO A 26 4.267 -9.304 133.511 1.00 20.64 O +ATOM 375 CB PRO A 26 6.482 -8.549 135.466 1.00 15.60 C +ATOM 376 CG PRO A 26 6.234 -8.230 136.892 1.00 22.28 C +ATOM 377 CD PRO A 26 4.846 -7.671 137.017 1.00 22.77 C +ATOM 378 HA PRO A 26 6.076 -6.718 134.389 1.00 0.00 H +ATOM 379 HB3 PRO A 26 7.517 -8.315 135.218 1.00 0.00 H +ATOM 380 HB2 PRO A 26 6.214 -9.588 135.276 1.00 0.00 H +ATOM 381 HG3 PRO A 26 6.956 -7.486 137.229 1.00 0.00 H +ATOM 382 HG2 PRO A 26 6.314 -9.140 137.487 1.00 0.00 H +ATOM 383 HD2 PRO A 26 4.174 -8.451 137.375 1.00 0.00 H +ATOM 384 HD3 PRO A 26 4.874 -6.769 137.628 1.00 0.00 H +ATOM 385 N GLY A 27 5.383 -7.792 132.266 1.00 14.23 N +ATOM 386 CA GLY A 27 4.982 -8.344 130.991 1.00 17.01 C +ATOM 387 C GLY A 27 3.782 -7.678 130.354 1.00 19.20 C +ATOM 388 O GLY A 27 3.494 -7.953 129.183 1.00 19.20 O +ATOM 389 H GLY A 27 5.971 -6.971 132.251 1.00 0.00 H +ATOM 390 HA3 GLY A 27 4.784 -9.410 131.106 1.00 0.00 H +ATOM 391 HA2 GLY A 27 5.824 -8.306 130.300 1.00 0.00 H +ATOM 392 N GLU A 28 3.079 -6.815 131.082 1.00 19.35 N +ATOM 393 CA GLU A 28 1.880 -6.187 130.545 1.00 18.62 C +ATOM 394 C GLU A 28 2.241 -5.186 129.454 1.00 17.94 C +ATOM 395 O GLU A 28 3.076 -4.300 129.658 1.00 18.25 O +ATOM 396 CB GLU A 28 1.099 -5.495 131.661 1.00 17.51 C +ATOM 397 CG GLU A 28 -0.399 -5.428 131.412 1.00 19.03 C +ATOM 398 CD GLU A 28 -1.163 -4.862 132.592 1.00 30.74 C +ATOM 399 OE1 GLU A 28 -0.572 -4.747 133.686 1.00 31.26 O +ATOM 400 OE2 GLU A 28 -2.357 -4.536 132.425 1.00 35.40 O1- +ATOM 401 H GLU A 28 3.375 -6.587 132.021 1.00 0.00 H +ATOM 402 HA GLU A 28 1.249 -6.962 130.109 1.00 0.00 H +ATOM 403 HB3 GLU A 28 1.487 -4.486 131.802 1.00 0.00 H +ATOM 404 HB2 GLU A 28 1.286 -6.008 132.605 1.00 0.00 H +ATOM 405 HG3 GLU A 28 -0.773 -6.426 131.183 1.00 0.00 H +ATOM 406 HG2 GLU A 28 -0.593 -4.819 130.529 1.00 0.00 H +ATOM 407 N LEU A 29 1.610 -5.336 128.292 1.00 23.65 N +ATOM 408 CA LEU A 29 1.803 -4.387 127.205 1.00 18.76 C +ATOM 409 C LEU A 29 1.227 -3.029 127.589 1.00 22.17 C +ATOM 410 O LEU A 29 0.083 -2.933 128.043 1.00 22.66 O +ATOM 411 CB LEU A 29 1.138 -4.905 125.929 1.00 19.02 C +ATOM 412 CG LEU A 29 1.285 -4.050 124.670 1.00 17.84 C +ATOM 413 CD1 LEU A 29 2.707 -4.112 124.132 1.00 16.52 C +ATOM 414 CD2 LEU A 29 0.287 -4.489 123.609 1.00 17.92 C +ATOM 415 H LEU A 29 0.986 -6.118 128.154 1.00 0.00 H +ATOM 416 HA LEU A 29 2.872 -4.275 127.023 1.00 0.00 H +ATOM 417 HB3 LEU A 29 0.080 -5.079 126.122 1.00 0.00 H +ATOM 418 HB2 LEU A 29 1.497 -5.913 125.722 1.00 0.00 H +ATOM 419 HG LEU A 29 1.067 -3.015 124.935 1.00 0.00 H +ATOM 420 HD11 LEU A 29 2.784 -3.495 123.237 1.00 0.00 H +ATOM 421 HD12 LEU A 29 3.399 -3.742 124.889 1.00 0.00 H +ATOM 422 HD13 LEU A 29 2.958 -5.144 123.885 1.00 0.00 H +ATOM 423 HD21 LEU A 29 0.405 -3.870 122.720 1.00 0.00 H +ATOM 424 HD22 LEU A 29 0.466 -5.533 123.351 1.00 0.00 H +ATOM 425 HD23 LEU A 29 -0.726 -4.379 123.995 1.00 0.00 H +ATOM 426 N LEU A 30 2.025 -1.978 127.409 1.00 19.22 N +ATOM 427 CA LEU A 30 1.620 -0.630 127.780 1.00 19.90 C +ATOM 428 C LEU A 30 1.307 0.264 126.593 1.00 16.92 C +ATOM 429 O LEU A 30 0.437 1.131 126.704 1.00 19.16 O +ATOM 430 CB LEU A 30 2.711 0.039 128.628 1.00 13.90 C +ATOM 431 CG LEU A 30 3.174 -0.728 129.869 1.00 15.79 C +ATOM 432 CD1 LEU A 30 4.076 0.134 130.737 1.00 13.60 C +ATOM 433 CD2 LEU A 30 1.984 -1.234 130.672 1.00 20.71 C +ATOM 434 H LEU A 30 2.942 -2.103 127.004 1.00 0.00 H +ATOM 435 HA LEU A 30 0.720 -0.706 128.390 1.00 0.00 H +ATOM 436 HB3 LEU A 30 2.376 1.033 128.924 1.00 0.00 H +ATOM 437 HB2 LEU A 30 3.573 0.256 127.998 1.00 0.00 H +ATOM 438 HG LEU A 30 3.750 -1.592 129.537 1.00 0.00 H +ATOM 439 HD11 LEU A 30 4.391 -0.435 131.612 1.00 0.00 H +ATOM 440 HD12 LEU A 30 4.954 0.434 130.164 1.00 0.00 H +ATOM 441 HD13 LEU A 30 3.531 1.022 131.058 1.00 0.00 H +ATOM 442 HD21 LEU A 30 2.340 -1.775 131.548 1.00 0.00 H +ATOM 443 HD22 LEU A 30 1.374 -0.389 130.991 1.00 0.00 H +ATOM 444 HD23 LEU A 30 1.384 -1.901 130.053 1.00 0.00 H +ATOM 445 N PHE A 31 1.984 0.072 125.462 1.00 17.52 N +ATOM 446 CA PHE A 31 1.790 0.924 124.298 1.00 14.29 C +ATOM 447 C PHE A 31 2.474 0.291 123.097 1.00 12.74 C +ATOM 448 O PHE A 31 3.590 -0.222 123.214 1.00 16.73 O +ATOM 449 CB PHE A 31 2.354 2.332 124.547 1.00 14.93 C +ATOM 450 CG PHE A 31 1.635 3.418 123.798 1.00 14.51 C +ATOM 451 CD1 PHE A 31 0.524 4.038 124.347 1.00 11.82 C +ATOM 452 CD2 PHE A 31 2.078 3.830 122.552 1.00 19.67 C +ATOM 453 CE1 PHE A 31 -0.137 5.039 123.662 1.00 21.42 C +ATOM 454 CE2 PHE A 31 1.421 4.832 121.862 1.00 15.48 C +ATOM 455 CZ PHE A 31 0.313 5.438 122.419 1.00 14.83 C +ATOM 456 H PHE A 31 2.653 -0.681 125.396 1.00 0.00 H +ATOM 457 HA PHE A 31 0.722 1.003 124.094 1.00 0.00 H +ATOM 458 HB3 PHE A 31 3.411 2.350 124.283 1.00 0.00 H +ATOM 459 HB2 PHE A 31 2.325 2.549 125.615 1.00 0.00 H +ATOM 460 HD1 PHE A 31 0.166 3.740 125.321 1.00 0.00 H +ATOM 461 HD2 PHE A 31 2.947 3.367 122.108 1.00 0.00 H +ATOM 462 HE1 PHE A 31 -1.006 5.509 124.099 1.00 0.00 H +ATOM 463 HE2 PHE A 31 1.775 5.139 120.889 1.00 0.00 H +ATOM 464 HZ PHE A 31 -0.202 6.223 121.885 1.00 0.00 H +ATOM 465 N ARG A 32 1.793 0.317 121.955 1.00 14.77 N +ATOM 466 CA ARG A 32 2.382 -0.020 120.669 1.00 17.27 C +ATOM 467 C ARG A 32 2.460 1.237 119.813 1.00 17.71 C +ATOM 468 O ARG A 32 1.640 2.148 119.951 1.00 18.36 O +ATOM 469 CB ARG A 32 1.568 -1.086 119.928 1.00 16.88 C +ATOM 470 CG ARG A 32 1.037 -2.220 120.779 1.00 22.07 C +ATOM 471 CD ARG A 32 0.183 -3.140 119.920 1.00 18.01 C +ATOM 472 NE ARG A 32 0.949 -3.694 118.805 1.00 13.60 N +ATOM 473 CZ ARG A 32 0.799 -4.924 118.324 1.00 15.11 C +ATOM 474 NH1 ARG A 32 -0.106 -5.739 118.847 1.00 13.29 N +ATOM 475 NH2 ARG A 32 1.548 -5.338 117.311 1.00 9.42 N1+ +ATOM 476 H ARG A 32 0.818 0.580 121.954 1.00 0.00 H +ATOM 477 HA ARG A 32 3.391 -0.398 120.832 1.00 0.00 H +ATOM 478 HB3 ARG A 32 2.168 -1.496 119.115 1.00 0.00 H +ATOM 479 HB2 ARG A 32 0.738 -0.608 119.408 1.00 0.00 H +ATOM 480 HG3 ARG A 32 0.431 -1.813 121.589 1.00 0.00 H +ATOM 481 HG2 ARG A 32 1.872 -2.783 121.195 1.00 0.00 H +ATOM 482 HD3 ARG A 32 -0.672 -2.585 119.533 1.00 0.00 H +ATOM 483 HD2 ARG A 32 -0.204 -3.953 120.534 1.00 0.00 H +ATOM 484 HE ARG A 32 1.631 -3.071 118.396 1.00 0.00 H +ATOM 485 HH12 ARG A 32 -0.217 -6.673 118.479 1.00 0.00 H +ATOM 486 HH11 ARG A 32 -0.684 -5.426 119.614 1.00 0.00 H +ATOM 487 HH22 ARG A 32 1.433 -6.273 116.947 1.00 0.00 H +ATOM 488 HH21 ARG A 32 2.234 -4.718 116.904 1.00 0.00 H +ATOM 489 N SER A 33 3.447 1.283 118.920 1.00 15.75 N +ATOM 490 CA SER A 33 3.599 2.458 118.072 1.00 17.52 C +ATOM 491 C SER A 33 4.463 2.138 116.863 1.00 17.88 C +ATOM 492 O SER A 33 5.554 1.578 117.005 1.00 14.75 O +ATOM 493 CB SER A 33 4.213 3.623 118.854 1.00 13.75 C +ATOM 494 OG SER A 33 4.294 4.784 118.046 1.00 15.17 O +ATOM 495 H SER A 33 4.086 0.506 118.833 1.00 0.00 H +ATOM 496 HA SER A 33 2.612 2.760 117.721 1.00 0.00 H +ATOM 497 HB3 SER A 33 5.211 3.346 119.193 1.00 0.00 H +ATOM 498 HB2 SER A 33 3.602 3.833 119.731 1.00 0.00 H +ATOM 499 HG SER A 33 4.681 5.501 118.553 1.00 0.00 H +ATOM 500 N ASP A 34 3.963 2.490 115.682 1.00 15.73 N +ATOM 501 CA ASP A 34 4.815 2.658 114.523 1.00 17.72 C +ATOM 502 C ASP A 34 5.614 3.950 114.682 1.00 17.12 C +ATOM 503 O ASP A 34 5.262 4.808 115.495 1.00 13.11 O +ATOM 504 CB ASP A 34 3.976 2.705 113.247 1.00 12.38 C +ATOM 505 CG ASP A 34 3.490 1.336 112.815 1.00 19.09 C +ATOM 506 OD1 ASP A 34 4.100 0.328 113.228 1.00 22.88 O +ATOM 507 OD2 ASP A 34 2.499 1.269 112.057 1.00 41.30 O1- +ATOM 508 H ASP A 34 2.970 2.646 115.580 1.00 0.00 H +ATOM 509 HA ASP A 34 5.506 1.817 114.464 1.00 0.00 H +ATOM 510 HB3 ASP A 34 4.563 3.151 112.444 1.00 0.00 H +ATOM 511 HB2 ASP A 34 3.120 3.362 113.401 1.00 0.00 H +ATOM 512 N PRO A 35 6.702 4.112 113.933 1.00 18.13 N +ATOM 513 CA PRO A 35 7.441 5.375 113.999 1.00 14.09 C +ATOM 514 C PRO A 35 6.684 6.497 113.310 1.00 16.60 C +ATOM 515 O PRO A 35 5.886 6.273 112.396 1.00 12.92 O +ATOM 516 CB PRO A 35 8.753 5.065 113.263 1.00 12.67 C +ATOM 517 CG PRO A 35 8.809 3.573 113.150 1.00 16.69 C +ATOM 518 CD PRO A 35 7.389 3.124 113.086 1.00 14.01 C +ATOM 519 HA PRO A 35 7.644 5.639 115.037 1.00 0.00 H +ATOM 520 HB3 PRO A 35 9.595 5.414 113.861 1.00 0.00 H +ATOM 521 HB2 PRO A 35 8.720 5.502 112.265 1.00 0.00 H +ATOM 522 HG3 PRO A 35 9.279 3.160 114.042 1.00 0.00 H +ATOM 523 HG2 PRO A 35 9.317 3.299 112.225 1.00 0.00 H +ATOM 524 HD2 PRO A 35 7.029 3.217 112.061 1.00 0.00 H +ATOM 525 HD3 PRO A 35 7.303 2.138 113.543 1.00 0.00 H +ATOM 526 N LEU A 36 6.933 7.724 113.774 1.00 16.19 N +ATOM 527 CA LEU A 36 6.553 8.887 112.981 1.00 15.64 C +ATOM 528 C LEU A 36 7.410 8.973 111.726 1.00 16.91 C +ATOM 529 O LEU A 36 6.908 9.276 110.637 1.00 12.88 O +ATOM 530 CB LEU A 36 6.686 10.163 113.813 1.00 15.77 C +ATOM 531 CG LEU A 36 6.545 11.490 113.061 1.00 14.53 C +ATOM 532 CD1 LEU A 36 5.111 11.697 112.597 1.00 11.27 C +ATOM 533 CD2 LEU A 36 7.008 12.658 113.921 1.00 11.43 C +ATOM 534 H LEU A 36 7.383 7.843 114.670 1.00 0.00 H +ATOM 535 HA LEU A 36 5.511 8.776 112.682 1.00 0.00 H +ATOM 536 HB3 LEU A 36 7.639 10.149 114.341 1.00 0.00 H +ATOM 537 HB2 LEU A 36 5.965 10.135 114.630 1.00 0.00 H +ATOM 538 HG LEU A 36 7.183 11.447 112.178 1.00 0.00 H +ATOM 539 HD11 LEU A 36 5.034 12.645 112.065 1.00 0.00 H +ATOM 540 HD12 LEU A 36 4.823 10.883 111.931 1.00 0.00 H +ATOM 541 HD13 LEU A 36 4.447 11.711 113.461 1.00 0.00 H +ATOM 542 HD21 LEU A 36 6.897 13.587 113.363 1.00 0.00 H +ATOM 543 HD22 LEU A 36 6.404 12.705 114.827 1.00 0.00 H +ATOM 544 HD23 LEU A 36 8.055 12.519 114.190 1.00 0.00 H +ATOM 545 N ALA A 37 8.704 8.696 111.865 1.00 14.27 N +ATOM 546 CA ALA A 37 9.628 8.596 110.748 1.00 14.16 C +ATOM 547 C ALA A 37 10.797 7.729 111.185 1.00 15.92 C +ATOM 548 O ALA A 37 11.161 7.708 112.364 1.00 15.72 O +ATOM 549 CB ALA A 37 10.118 9.973 110.288 1.00 10.30 C +ATOM 550 H ALA A 37 9.092 8.542 112.785 1.00 0.00 H +ATOM 551 HA ALA A 37 9.121 8.108 109.916 1.00 0.00 H +ATOM 552 HB1 ALA A 37 10.807 9.853 109.451 1.00 0.00 H +ATOM 553 HB2 ALA A 37 9.266 10.576 109.973 1.00 0.00 H +ATOM 554 HB3 ALA A 37 10.630 10.471 111.111 1.00 0.00 H +ATOM 555 N TYR A 38 11.375 7.009 110.227 1.00 11.26 N +ATOM 556 CA TYR A 38 12.503 6.137 110.522 1.00 15.47 C +ATOM 557 C TYR A 38 13.277 5.877 109.240 1.00 16.33 C +ATOM 558 O TYR A 38 12.760 6.043 108.134 1.00 16.02 O +ATOM 559 CB TYR A 38 12.048 4.815 111.151 1.00 13.70 C +ATOM 560 CG TYR A 38 11.428 3.849 110.167 1.00 14.67 C +ATOM 561 CD1 TYR A 38 12.162 2.791 109.642 1.00 19.82 C +ATOM 562 CD2 TYR A 38 10.108 3.994 109.765 1.00 15.58 C +ATOM 563 CE1 TYR A 38 11.596 1.908 108.742 1.00 18.58 C +ATOM 564 CE2 TYR A 38 9.535 3.118 108.868 1.00 14.37 C +ATOM 565 CZ TYR A 38 10.281 2.078 108.360 1.00 16.21 C +ATOM 566 OH TYR A 38 9.701 1.210 107.468 1.00 20.56 O +ATOM 567 H TYR A 38 11.032 7.063 109.278 1.00 0.00 H +ATOM 568 HA TYR A 38 13.160 6.647 111.226 1.00 0.00 H +ATOM 569 HB3 TYR A 38 11.338 5.021 111.952 1.00 0.00 H +ATOM 570 HB2 TYR A 38 12.896 4.337 111.641 1.00 0.00 H +ATOM 571 HD1 TYR A 38 13.191 2.649 109.936 1.00 0.00 H +ATOM 572 HD2 TYR A 38 9.510 4.804 110.156 1.00 0.00 H +ATOM 573 HE1 TYR A 38 12.182 1.093 108.344 1.00 0.00 H +ATOM 574 HE2 TYR A 38 8.506 3.249 108.567 1.00 0.00 H +ATOM 575 HH TYR A 38 8.790 1.471 107.313 1.00 0.00 H +ATOM 576 N THR A 39 14.529 5.457 109.410 1.00 13.88 N +ATOM 577 CA THR A 39 15.379 5.112 108.282 1.00 20.10 C +ATOM 578 C THR A 39 16.394 4.070 108.727 1.00 19.81 C +ATOM 579 O THR A 39 16.654 3.894 109.920 1.00 18.67 O +ATOM 580 CB THR A 39 16.093 6.343 107.708 1.00 20.38 C +ATOM 581 OG1 THR A 39 16.828 5.965 106.538 1.00 20.12 O +ATOM 582 CG2 THR A 39 17.048 6.935 108.734 1.00 12.23 C +ATOM 583 H THR A 39 14.911 5.371 110.341 1.00 0.00 H +ATOM 584 HA THR A 39 14.757 4.677 107.500 1.00 0.00 H +ATOM 585 HB THR A 39 15.350 7.093 107.437 1.00 0.00 H +ATOM 586 HG1 THR A 39 17.275 6.734 106.178 1.00 0.00 H +ATOM 587 HG21 THR A 39 17.545 7.807 108.308 1.00 0.00 H +ATOM 588 HG22 THR A 39 16.490 7.233 109.621 1.00 0.00 H +ATOM 589 HG23 THR A 39 17.795 6.190 109.008 1.00 0.00 H +ATOM 590 N VAL A 40 16.962 3.379 107.747 1.00 17.30 N +ATOM 591 CA VAL A 40 17.955 2.345 108.008 1.00 20.76 C +ATOM 592 C VAL A 40 19.284 3.004 108.354 1.00 23.76 C +ATOM 593 O VAL A 40 19.631 4.062 107.814 1.00 23.15 O +ATOM 594 CB VAL A 40 18.080 1.408 106.791 1.00 25.85 C +ATOM 595 CG1 VAL A 40 18.296 2.211 105.515 1.00 27.63 C +ATOM 596 CG2 VAL A 40 19.196 0.392 106.990 1.00 21.71 C +ATOM 597 H VAL A 40 16.709 3.563 106.787 1.00 0.00 H +ATOM 598 HA VAL A 40 17.626 1.757 108.865 1.00 0.00 H +ATOM 599 HB VAL A 40 17.142 0.862 106.690 1.00 0.00 H +ATOM 600 HG11 VAL A 40 18.382 1.531 104.667 1.00 0.00 H +ATOM 601 HG12 VAL A 40 17.450 2.881 105.359 1.00 0.00 H +ATOM 602 HG13 VAL A 40 19.211 2.797 105.604 1.00 0.00 H +ATOM 603 HG21 VAL A 40 19.260 -0.255 106.115 1.00 0.00 H +ATOM 604 HG22 VAL A 40 20.143 0.914 107.125 1.00 0.00 H +ATOM 605 HG23 VAL A 40 18.985 -0.212 107.873 1.00 0.00 H +ATOM 606 N CYS A 41 20.025 2.391 109.274 1.00 28.92 N +ATOM 607 CA CYS A 41 21.318 2.922 109.676 1.00 31.29 C +ATOM 608 C CYS A 41 22.325 2.829 108.531 1.00 26.63 C +ATOM 609 O CYS A 41 22.166 2.055 107.584 1.00 29.83 O +ATOM 610 CB CYS A 41 21.847 2.177 110.901 1.00 25.20 C +ATOM 611 SG CYS A 41 21.125 2.720 112.464 1.00 27.22 S +ATOM 612 H CYS A 41 19.692 1.541 109.707 1.00 0.00 H +ATOM 613 HA CYS A 41 21.192 3.972 109.939 1.00 0.00 H +ATOM 614 HB3 CYS A 41 22.931 2.282 110.948 1.00 0.00 H +ATOM 615 HB2 CYS A 41 21.675 1.108 110.776 1.00 0.00 H +ATOM 616 HG CYS A 41 21.650 2.012 113.468 1.00 0.00 H +ATOM 617 N LYS A 42 23.381 3.642 108.640 1.00 32.32 N +ATOM 618 CA LYS A 42 24.402 3.706 107.598 1.00 35.36 C +ATOM 619 C LYS A 42 25.022 2.342 107.327 1.00 35.99 C +ATOM 620 O LYS A 42 25.208 1.954 106.168 1.00 40.39 O +ATOM 621 CB LYS A 42 25.483 4.711 107.997 1.00 41.27 C +ATOM 622 CG LYS A 42 26.559 4.945 106.949 1.00 44.63 C +ATOM 623 CD LYS A 42 26.162 6.055 105.995 1.00 41.18 C +ATOM 624 CE LYS A 42 27.229 7.137 105.924 1.00 48.85 C +ATOM 625 NZ LYS A 42 26.645 8.475 105.624 1.00 40.79 N1+ +ATOM 626 H LYS A 42 23.485 4.228 109.456 1.00 0.00 H +ATOM 627 HA LYS A 42 23.932 4.056 106.679 1.00 0.00 H +ATOM 628 HB3 LYS A 42 25.950 4.388 108.927 1.00 0.00 H +ATOM 629 HB2 LYS A 42 25.015 5.662 108.252 1.00 0.00 H +ATOM 630 HG3 LYS A 42 26.724 4.026 106.387 1.00 0.00 H +ATOM 631 HG2 LYS A 42 27.495 5.208 107.442 1.00 0.00 H +ATOM 632 HD3 LYS A 42 25.220 6.495 106.323 1.00 0.00 H +ATOM 633 HD2 LYS A 42 26.001 5.638 105.001 1.00 0.00 H +ATOM 634 HE3 LYS A 42 27.957 6.878 105.155 1.00 0.00 H +ATOM 635 HE2 LYS A 42 27.766 7.180 106.872 1.00 0.00 H +ATOM 636 HZ1 LYS A 42 27.383 9.164 105.585 1.00 0.00 H +ATOM 637 HZ2 LYS A 42 26.168 8.443 104.734 1.00 0.00 H +ATOM 638 HZ3 LYS A 42 25.988 8.726 106.349 1.00 0.00 H +ATOM 639 N GLY A 43 25.348 1.595 108.386 1.00 32.15 N +ATOM 640 CA GLY A 43 25.998 0.309 108.214 1.00 28.07 C +ATOM 641 C GLY A 43 25.091 -0.806 107.740 1.00 31.53 C +ATOM 642 O GLY A 43 25.586 -1.802 107.204 1.00 29.24 O +ATOM 643 H GLY A 43 25.142 1.924 109.319 1.00 0.00 H +ATOM 644 HA3 GLY A 43 26.471 0.016 109.151 1.00 0.00 H +ATOM 645 HA2 GLY A 43 26.831 0.416 107.519 1.00 0.00 H +ATOM 646 N SER A 44 23.780 -0.668 107.929 1.00 35.68 N +ATOM 647 CA SER A 44 22.825 -1.690 107.525 1.00 31.30 C +ATOM 648 C SER A 44 22.143 -1.376 106.200 1.00 34.73 C +ATOM 649 O SER A 44 21.316 -2.171 105.741 1.00 29.85 O +ATOM 650 CB SER A 44 21.766 -1.883 108.616 1.00 26.38 C +ATOM 651 OG SER A 44 22.257 -2.702 109.663 1.00 32.63 O +ATOM 652 H SER A 44 23.418 0.168 108.366 1.00 0.00 H +ATOM 653 HA SER A 44 23.366 -2.630 107.411 1.00 0.00 H +ATOM 654 HB3 SER A 44 20.878 -2.342 108.182 1.00 0.00 H +ATOM 655 HB2 SER A 44 21.479 -0.912 109.019 1.00 0.00 H +ATOM 656 HG SER A 44 21.577 -2.808 110.333 1.00 0.00 H +ATOM 657 N ARG A 45 22.467 -0.244 105.578 1.00 33.13 N +ATOM 658 CA ARG A 45 21.844 0.123 104.314 1.00 38.33 C +ATOM 659 C ARG A 45 22.302 -0.825 103.214 1.00 37.87 C +ATOM 660 O ARG A 45 23.503 -1.029 103.013 1.00 38.04 O +ATOM 661 CB ARG A 45 22.184 1.568 103.953 1.00 37.92 C +ATOM 662 CG ARG A 45 22.064 1.892 102.475 1.00 46.80 C +ATOM 663 CD ARG A 45 22.176 3.386 102.243 1.00 43.48 C +ATOM 664 NE ARG A 45 23.535 3.866 102.472 1.00 50.47 N +ATOM 665 CZ ARG A 45 24.416 4.099 101.506 1.00 50.13 C +ATOM 666 NH1 ARG A 45 24.081 3.899 100.238 1.00 40.74 N +ATOM 667 NH2 ARG A 45 25.632 4.534 101.806 1.00 40.33 N1+ +ATOM 668 H ARG A 45 23.155 0.375 105.982 1.00 0.00 H +ATOM 669 HA ARG A 45 20.763 0.036 104.421 1.00 0.00 H +ATOM 670 HB3 ARG A 45 23.194 1.797 104.292 1.00 0.00 H +ATOM 671 HB2 ARG A 45 21.545 2.242 104.523 1.00 0.00 H +ATOM 672 HG3 ARG A 45 21.103 1.538 102.103 1.00 0.00 H +ATOM 673 HG2 ARG A 45 22.854 1.379 101.926 1.00 0.00 H +ATOM 674 HD3 ARG A 45 21.490 3.909 102.909 1.00 0.00 H +ATOM 675 HD2 ARG A 45 21.877 3.618 101.221 1.00 0.00 H +ATOM 676 HE ARG A 45 23.791 4.021 103.437 1.00 0.00 H +ATOM 677 HH12 ARG A 45 24.752 4.077 99.504 1.00 0.00 H +ATOM 678 HH11 ARG A 45 23.155 3.569 100.006 1.00 0.00 H +ATOM 679 HH22 ARG A 45 26.301 4.711 101.070 1.00 0.00 H +ATOM 680 HH21 ARG A 45 25.889 4.689 102.770 1.00 0.00 H +ATOM 681 N GLY A 46 21.342 -1.406 102.502 1.00 38.81 N +ATOM 682 CA GLY A 46 21.652 -2.449 101.552 1.00 33.86 C +ATOM 683 C GLY A 46 21.779 -3.827 102.153 1.00 33.18 C +ATOM 684 O GLY A 46 21.922 -4.802 101.405 1.00 40.19 O +ATOM 685 H GLY A 46 20.381 -1.120 102.622 1.00 0.00 H +ATOM 686 HA3 GLY A 46 22.574 -2.197 101.028 1.00 0.00 H +ATOM 687 HA2 GLY A 46 20.891 -2.464 100.772 1.00 0.00 H +ATOM 688 N VAL A 47 21.734 -3.940 103.476 1.00 36.39 N +ATOM 689 CA VAL A 47 21.772 -5.226 104.154 1.00 35.25 C +ATOM 690 C VAL A 47 20.390 -5.639 104.641 1.00 30.45 C +ATOM 691 O VAL A 47 20.048 -6.822 104.617 1.00 31.24 O +ATOM 692 CB VAL A 47 22.783 -5.176 105.319 1.00 36.20 C +ATOM 693 CG1 VAL A 47 22.972 -6.557 105.920 1.00 33.05 C +ATOM 694 CG2 VAL A 47 24.110 -4.605 104.841 1.00 31.55 C +ATOM 695 H VAL A 47 21.671 -3.113 104.052 1.00 0.00 H +ATOM 696 HA VAL A 47 22.116 -5.974 103.440 1.00 0.00 H +ATOM 697 HB VAL A 47 22.384 -4.518 106.091 1.00 0.00 H +ATOM 698 HG11 VAL A 47 23.688 -6.502 106.740 1.00 0.00 H +ATOM 699 HG12 VAL A 47 22.017 -6.924 106.296 1.00 0.00 H +ATOM 700 HG13 VAL A 47 23.347 -7.238 105.156 1.00 0.00 H +ATOM 701 HG21 VAL A 47 24.814 -4.575 105.673 1.00 0.00 H +ATOM 702 HG22 VAL A 47 24.512 -5.235 104.047 1.00 0.00 H +ATOM 703 HG23 VAL A 47 23.956 -3.595 104.460 1.00 0.00 H +ATOM 704 N VAL A 48 19.585 -4.674 105.080 1.00 25.10 N +ATOM 705 CA VAL A 48 18.213 -4.927 105.490 1.00 31.08 C +ATOM 706 C VAL A 48 17.279 -4.142 104.581 1.00 28.97 C +ATOM 707 O VAL A 48 17.661 -3.145 103.961 1.00 31.13 O +ATOM 708 CB VAL A 48 17.961 -4.563 106.969 1.00 30.31 C +ATOM 709 CG1 VAL A 48 18.915 -5.324 107.872 1.00 31.94 C +ATOM 710 CG2 VAL A 48 18.091 -3.063 107.180 1.00 22.63 C +ATOM 711 H VAL A 48 19.921 -3.723 105.138 1.00 0.00 H +ATOM 712 HA VAL A 48 18.006 -5.989 105.359 1.00 0.00 H +ATOM 713 HB VAL A 48 16.943 -4.856 107.224 1.00 0.00 H +ATOM 714 HG11 VAL A 48 18.724 -5.056 108.911 1.00 0.00 H +ATOM 715 HG12 VAL A 48 18.764 -6.395 107.740 1.00 0.00 H +ATOM 716 HG13 VAL A 48 19.943 -5.068 107.614 1.00 0.00 H +ATOM 717 HG21 VAL A 48 17.910 -2.826 108.228 1.00 0.00 H +ATOM 718 HG22 VAL A 48 19.096 -2.742 106.904 1.00 0.00 H +ATOM 719 HG23 VAL A 48 17.361 -2.544 106.559 1.00 0.00 H +ATOM 720 N CYS A 49 16.037 -4.616 104.501 1.00 24.78 N +ATOM 721 CA CYS A 49 15.020 -3.930 103.717 1.00 26.86 C +ATOM 722 C CYS A 49 14.770 -2.545 104.292 1.00 24.05 C +ATOM 723 O CYS A 49 14.677 -2.378 105.512 1.00 27.43 O +ATOM 724 CB CYS A 49 13.725 -4.735 103.707 1.00 22.58 C +ATOM 725 SG CYS A 49 12.304 -3.828 103.058 1.00 23.79 S1- +ATOM 726 H CYS A 49 15.788 -5.465 104.989 1.00 0.00 H +ATOM 727 HA CYS A 49 15.377 -3.826 102.692 1.00 0.00 H +ATOM 728 HB3 CYS A 49 13.504 -5.077 104.718 1.00 0.00 H +ATOM 729 HB2 CYS A 49 13.870 -5.645 103.125 1.00 0.00 H +ATOM 730 N ASP A 50 14.656 -1.546 103.411 1.00 25.81 N +ATOM 731 CA ASP A 50 14.543 -0.175 103.900 1.00 19.64 C +ATOM 732 C ASP A 50 13.292 0.042 104.737 1.00 19.90 C +ATOM 733 O ASP A 50 13.273 0.943 105.581 1.00 24.17 O +ATOM 734 CB ASP A 50 14.567 0.837 102.754 1.00 25.95 C +ATOM 735 CG ASP A 50 15.963 1.245 102.379 1.00 26.96 C +ATOM 736 OD1 ASP A 50 16.873 0.393 102.482 1.00 39.09 O +ATOM 737 OD2 ASP A 50 16.156 2.441 102.081 1.00 25.89 O1- +ATOM 738 H ASP A 50 14.649 -1.744 102.421 1.00 0.00 H +ATOM 739 HA ASP A 50 15.406 0.023 104.536 1.00 0.00 H +ATOM 740 HB3 ASP A 50 13.995 1.720 103.039 1.00 0.00 H +ATOM 741 HB2 ASP A 50 14.068 0.411 101.884 1.00 0.00 H +ATOM 742 N ARG A 51 12.243 -0.757 104.520 1.00 14.28 N +ATOM 743 CA ARG A 51 10.959 -0.535 105.180 1.00 20.00 C +ATOM 744 C ARG A 51 10.798 -1.454 106.381 1.00 19.84 C +ATOM 745 O ARG A 51 10.548 -0.985 107.492 1.00 17.97 O +ATOM 746 CB ARG A 51 9.782 -0.719 104.200 1.00 22.92 C +ATOM 747 CG ARG A 51 8.480 -1.041 104.907 1.00 26.30 C +ATOM 748 CD ARG A 51 7.298 -0.842 103.988 1.00 25.79 C +ATOM 749 NE ARG A 51 6.049 -0.861 104.735 1.00 36.85 N +ATOM 750 CZ ARG A 51 5.276 -1.932 104.806 1.00 38.57 C +ATOM 751 NH1 ARG A 51 5.654 -3.029 104.170 1.00 31.94 N +ATOM 752 NH2 ARG A 51 4.152 -1.915 105.507 1.00 33.34 N1+ +ATOM 753 H ARG A 51 12.326 -1.538 103.886 1.00 0.00 H +ATOM 754 HA ARG A 51 10.939 0.494 105.539 1.00 0.00 H +ATOM 755 HB3 ARG A 51 10.018 -1.516 103.495 1.00 0.00 H +ATOM 756 HB2 ARG A 51 9.658 0.188 103.608 1.00 0.00 H +ATOM 757 HG3 ARG A 51 8.373 -0.398 105.781 1.00 0.00 H +ATOM 758 HG2 ARG A 51 8.501 -2.074 105.253 1.00 0.00 H +ATOM 759 HD3 ARG A 51 7.284 -1.633 103.238 1.00 0.00 H +ATOM 760 HD2 ARG A 51 7.397 0.112 103.471 1.00 0.00 H +ATOM 761 HE ARG A 51 5.780 -0.012 105.211 1.00 0.00 H +ATOM 762 HH12 ARG A 51 5.080 -3.859 104.210 1.00 0.00 H +ATOM 763 HH11 ARG A 51 6.517 -3.036 103.645 1.00 0.00 H +ATOM 764 HH22 ARG A 51 3.572 -2.741 105.552 1.00 0.00 H +ATOM 765 HH21 ARG A 51 3.875 -1.076 105.997 1.00 0.00 H +ATOM 766 N CYS A 52 10.939 -2.754 106.169 1.00 17.04 N +ATOM 767 CA CYS A 52 10.690 -3.741 107.203 1.00 22.79 C +ATOM 768 C CYS A 52 11.938 -4.078 108.021 1.00 21.56 C +ATOM 769 O CYS A 52 11.835 -4.803 109.026 1.00 15.90 O +ATOM 770 CB CYS A 52 10.101 -5.017 106.581 1.00 16.96 C +ATOM 771 SG CYS A 52 11.252 -6.103 105.673 1.00 22.61 S1- +ATOM 772 H CYS A 52 11.229 -3.089 105.262 1.00 0.00 H +ATOM 773 HA CYS A 52 9.946 -3.329 107.885 1.00 0.00 H +ATOM 774 HB3 CYS A 52 9.272 -4.747 105.927 1.00 0.00 H +ATOM 775 HB2 CYS A 52 9.599 -5.595 107.357 1.00 0.00 H +ATOM 776 N LEU A 53 13.108 -3.589 107.609 1.00 19.59 N +ATOM 777 CA LEU A 53 14.342 -3.716 108.380 1.00 21.55 C +ATOM 778 C LEU A 53 14.731 -5.170 108.624 1.00 28.60 C +ATOM 779 O LEU A 53 15.407 -5.480 109.607 1.00 22.87 O +ATOM 780 CB LEU A 53 14.251 -2.961 109.707 1.00 16.54 C +ATOM 781 CG LEU A 53 13.858 -1.483 109.648 1.00 22.08 C +ATOM 782 CD1 LEU A 53 13.776 -0.882 111.048 1.00 19.25 C +ATOM 783 CD2 LEU A 53 14.847 -0.714 108.786 1.00 19.11 C +ATOM 784 H LEU A 53 13.170 -3.104 106.725 1.00 0.00 H +ATOM 785 HA LEU A 53 15.141 -3.257 107.797 1.00 0.00 H +ATOM 786 HB3 LEU A 53 15.197 -3.059 110.240 1.00 0.00 H +ATOM 787 HB2 LEU A 53 13.566 -3.487 110.372 1.00 0.00 H +ATOM 788 HG LEU A 53 12.873 -1.409 109.186 1.00 0.00 H +ATOM 789 HD11 LEU A 53 13.495 0.169 110.977 1.00 0.00 H +ATOM 790 HD12 LEU A 53 13.028 -1.419 111.631 1.00 0.00 H +ATOM 791 HD13 LEU A 53 14.746 -0.966 111.537 1.00 0.00 H +ATOM 792 HD21 LEU A 53 14.559 0.337 108.750 1.00 0.00 H +ATOM 793 HD22 LEU A 53 15.846 -0.802 109.212 1.00 0.00 H +ATOM 794 HD23 LEU A 53 14.846 -1.125 107.776 1.00 0.00 H +ATOM 795 N LEU A 54 14.309 -6.075 107.745 1.00 29.02 N +ATOM 796 CA LEU A 54 14.703 -7.477 107.819 1.00 27.70 C +ATOM 797 C LEU A 54 15.887 -7.733 106.890 1.00 32.18 C +ATOM 798 O LEU A 54 15.918 -7.229 105.764 1.00 38.29 O +ATOM 799 CB LEU A 54 13.532 -8.390 107.441 1.00 23.81 C +ATOM 800 CG LEU A 54 12.405 -8.526 108.466 1.00 23.92 C +ATOM 801 CD1 LEU A 54 11.343 -9.500 107.972 1.00 23.48 C +ATOM 802 CD2 LEU A 54 12.964 -8.966 109.809 1.00 22.40 C +ATOM 803 H LEU A 54 13.693 -5.800 106.993 1.00 0.00 H +ATOM 804 HA LEU A 54 15.006 -7.702 108.842 1.00 0.00 H +ATOM 805 HB3 LEU A 54 13.914 -9.381 107.195 1.00 0.00 H +ATOM 806 HB2 LEU A 54 13.114 -8.062 106.490 1.00 0.00 H +ATOM 807 HG LEU A 54 11.939 -7.549 108.593 1.00 0.00 H +ATOM 808 HD11 LEU A 54 10.551 -9.582 108.716 1.00 0.00 H +ATOM 809 HD12 LEU A 54 10.924 -9.136 107.034 1.00 0.00 H +ATOM 810 HD13 LEU A 54 11.794 -10.479 107.812 1.00 0.00 H +ATOM 811 HD21 LEU A 54 12.151 -9.059 110.529 1.00 0.00 H +ATOM 812 HD22 LEU A 54 13.462 -9.929 109.698 1.00 0.00 H +ATOM 813 HD23 LEU A 54 13.681 -8.226 110.165 1.00 0.00 H +ATOM 814 N GLY A 55 16.861 -8.515 107.359 1.00 31.89 N +ATOM 815 CA GLY A 55 18.064 -8.772 106.565 1.00 30.47 C +ATOM 816 C GLY A 55 17.858 -9.930 105.594 1.00 35.05 C +ATOM 817 O GLY A 55 17.141 -10.887 105.882 1.00 42.18 O +ATOM 818 H GLY A 55 16.774 -8.938 108.272 1.00 0.00 H +ATOM 819 HA3 GLY A 55 18.896 -9.001 107.231 1.00 0.00 H +ATOM 820 HA2 GLY A 55 18.329 -7.874 106.007 1.00 0.00 H +ATOM 821 N LYS A 56 18.471 -9.827 104.414 1.00 39.37 N +ATOM 822 CA LYS A 56 18.230 -10.824 103.376 1.00 48.03 C +ATOM 823 C LYS A 56 19.482 -11.068 102.547 1.00 53.89 C +ATOM 824 O LYS A 56 20.432 -10.293 102.569 1.00 44.82 O +ATOM 825 CB LYS A 56 17.084 -10.428 102.434 1.00 51.08 C +ATOM 826 CG LYS A 56 15.726 -10.381 103.086 1.00 50.54 C +ATOM 827 CD LYS A 56 15.023 -11.731 102.963 1.00 44.43 C +ATOM 828 CE LYS A 56 13.978 -11.913 104.052 1.00 51.52 C +ATOM 829 NZ LYS A 56 12.700 -11.237 103.686 1.00 46.91 N1+ +ATOM 830 H LYS A 56 19.102 -9.059 104.238 1.00 0.00 H +ATOM 831 HA LYS A 56 17.959 -11.761 103.863 1.00 0.00 H +ATOM 832 HB3 LYS A 56 17.056 -11.117 101.590 1.00 0.00 H +ATOM 833 HB2 LYS A 56 17.303 -9.459 101.986 1.00 0.00 H +ATOM 834 HG3 LYS A 56 15.120 -9.611 102.608 1.00 0.00 H +ATOM 835 HG2 LYS A 56 15.838 -10.125 104.140 1.00 0.00 H +ATOM 836 HD3 LYS A 56 15.760 -12.531 103.030 1.00 0.00 H +ATOM 837 HD2 LYS A 56 14.545 -11.804 101.986 1.00 0.00 H +ATOM 838 HE3 LYS A 56 14.353 -11.498 104.988 1.00 0.00 H +ATOM 839 HE2 LYS A 56 13.795 -12.977 104.205 1.00 0.00 H +ATOM 840 HZ1 LYS A 56 12.024 -11.372 104.424 1.00 0.00 H +ATOM 841 HZ2 LYS A 56 12.866 -10.249 103.559 1.00 0.00 H +ATOM 842 HZ3 LYS A 56 12.344 -11.631 102.827 1.00 0.00 H +ATOM 843 N GLU A 57 19.476 -12.180 101.809 1.00 59.51 N +ATOM 844 CA GLU A 57 20.516 -12.419 100.817 1.00 55.58 C +ATOM 845 C GLU A 57 20.643 -11.218 99.890 1.00 57.53 C +ATOM 846 O GLU A 57 21.625 -10.458 99.933 1.00 48.99 O +ATOM 847 CB GLU A 57 20.160 -13.645 100.012 1.00 59.06 C +ATOM 848 CG GLU A 57 19.943 -14.893 100.833 1.00 67.23 C +ATOM 849 CD GLU A 57 21.189 -15.738 101.009 1.00 72.27 C +ATOM 850 OE1 GLU A 57 21.058 -16.952 100.717 1.00 73.09 O +ATOM 851 OE2 GLU A 57 22.260 -15.214 101.413 1.00 69.49 O1- +ATOM 852 H GLU A 57 18.746 -12.866 101.935 1.00 0.00 H +ATOM 853 HA GLU A 57 21.466 -12.585 101.324 1.00 0.00 H +ATOM 854 HB3 GLU A 57 20.939 -13.830 99.273 1.00 0.00 H +ATOM 855 HB2 GLU A 57 19.267 -13.442 99.421 1.00 0.00 H +ATOM 856 HG3 GLU A 57 19.159 -15.496 100.374 1.00 0.00 H +ATOM 857 HG2 GLU A 57 19.552 -14.618 101.812 1.00 0.00 H +ATOM 858 N LYS A 58 19.611 -10.990 99.093 1.00 54.61 N +ATOM 859 CA LYS A 58 19.633 -9.996 98.033 1.00 51.32 C +ATOM 860 C LYS A 58 18.500 -8.992 98.235 1.00 53.96 C +ATOM 861 O LYS A 58 17.400 -9.356 98.672 1.00 48.52 O +ATOM 862 CB LYS A 58 19.482 -10.690 96.686 1.00 53.89 C +ATOM 863 CG LYS A 58 20.322 -11.966 96.456 1.00 62.73 C +ATOM 864 CD LYS A 58 21.801 -11.669 96.293 1.00 61.24 C +ATOM 865 CE LYS A 58 22.653 -12.413 97.310 1.00 63.62 C +ATOM 866 NZ LYS A 58 23.954 -11.695 97.478 1.00 50.40 N1+ +ATOM 867 H LYS A 58 18.758 -11.519 99.207 1.00 0.00 H +ATOM 868 HA LYS A 58 20.586 -9.468 98.058 1.00 0.00 H +ATOM 869 HB3 LYS A 58 19.690 -9.976 95.889 1.00 0.00 H +ATOM 870 HB2 LYS A 58 18.430 -10.918 96.516 1.00 0.00 H +ATOM 871 HG3 LYS A 58 19.957 -12.485 95.570 1.00 0.00 H +ATOM 872 HG2 LYS A 58 20.180 -12.649 97.293 1.00 0.00 H +ATOM 873 HD3 LYS A 58 21.969 -10.597 96.395 1.00 0.00 H +ATOM 874 HD2 LYS A 58 22.117 -11.942 95.286 1.00 0.00 H +ATOM 875 HE3 LYS A 58 22.841 -13.426 96.955 1.00 0.00 H +ATOM 876 HE2 LYS A 58 22.131 -12.446 98.266 1.00 0.00 H +ATOM 877 HZ1 LYS A 58 24.525 -12.184 98.153 1.00 0.00 H +ATOM 878 HZ2 LYS A 58 24.437 -11.660 96.592 1.00 0.00 H +ATOM 879 HZ3 LYS A 58 23.781 -10.755 97.804 1.00 0.00 H +ATOM 880 N LEU A 59 18.740 -7.750 97.847 1.00 54.00 N +ATOM 881 CA LEU A 59 17.705 -6.736 97.910 1.00 44.72 C +ATOM 882 C LEU A 59 17.514 -6.091 96.546 1.00 40.10 C +ATOM 883 O LEU A 59 18.482 -5.843 95.817 1.00 41.99 O +ATOM 884 CB LEU A 59 18.034 -5.658 98.957 1.00 38.67 C +ATOM 885 CG LEU A 59 18.406 -6.100 100.377 1.00 43.22 C +ATOM 886 CD1 LEU A 59 18.594 -4.898 101.280 1.00 32.28 C +ATOM 887 CD2 LEU A 59 17.359 -7.038 100.955 1.00 35.92 C +ATOM 888 H LEU A 59 19.654 -7.497 97.501 1.00 0.00 H +ATOM 889 HA LEU A 59 16.770 -7.218 98.196 1.00 0.00 H +ATOM 890 HB3 LEU A 59 17.208 -4.949 99.010 1.00 0.00 H +ATOM 891 HB2 LEU A 59 18.821 -5.012 98.568 1.00 0.00 H +ATOM 892 HG LEU A 59 19.353 -6.638 100.327 1.00 0.00 H +ATOM 893 HD11 LEU A 59 18.858 -5.234 102.283 1.00 0.00 H +ATOM 894 HD12 LEU A 59 19.392 -4.269 100.887 1.00 0.00 H +ATOM 895 HD13 LEU A 59 17.668 -4.325 101.321 1.00 0.00 H +ATOM 896 HD21 LEU A 59 17.652 -7.333 101.963 1.00 0.00 H +ATOM 897 HD22 LEU A 59 16.395 -6.530 100.991 1.00 0.00 H +ATOM 898 HD23 LEU A 59 17.278 -7.925 100.326 1.00 0.00 H +ATOM 899 N MET A 60 16.257 -5.824 96.199 1.00 31.69 N +ATOM 900 CA MET A 60 15.969 -5.031 95.014 1.00 33.69 C +ATOM 901 C MET A 60 16.049 -3.554 95.372 1.00 35.30 C +ATOM 902 O MET A 60 15.581 -3.131 96.433 1.00 36.02 O +ATOM 903 CB MET A 60 14.598 -5.380 94.436 1.00 28.70 C +ATOM 904 CG MET A 60 13.445 -5.233 95.410 1.00 33.91 C +ATOM 905 SD MET A 60 12.031 -6.267 94.979 1.00 51.43 S +ATOM 906 CE MET A 60 12.848 -7.718 94.321 1.00 34.91 C +ATOM 907 H MET A 60 15.493 -6.173 96.760 1.00 0.00 H +ATOM 908 HA MET A 60 16.727 -5.246 94.261 1.00 0.00 H +ATOM 909 HB3 MET A 60 14.618 -6.400 94.051 1.00 0.00 H +ATOM 910 HB2 MET A 60 14.409 -4.763 93.557 1.00 0.00 H +ATOM 911 HG3 MET A 60 13.133 -4.189 95.447 1.00 0.00 H +ATOM 912 HG2 MET A 60 13.785 -5.485 96.414 1.00 0.00 H +ATOM 913 HE1 MET A 60 12.100 -8.448 94.012 1.00 0.00 H +ATOM 914 HE2 MET A 60 13.456 -7.435 93.461 1.00 0.00 H +ATOM 915 HE3 MET A 60 13.487 -8.155 95.088 1.00 0.00 H +ATOM 916 N ARG A 61 16.669 -2.776 94.494 1.00 29.68 N +ATOM 917 CA ARG A 61 16.979 -1.384 94.774 1.00 33.71 C +ATOM 918 C ARG A 61 16.027 -0.460 94.026 1.00 31.47 C +ATOM 919 O ARG A 61 15.443 -0.830 93.003 1.00 31.09 O +ATOM 920 CB ARG A 61 18.430 -1.065 94.398 1.00 35.15 C +ATOM 921 CG ARG A 61 18.614 -0.605 92.965 1.00 36.61 C +ATOM 922 CD ARG A 61 20.083 -0.458 92.613 1.00 40.30 C +ATOM 923 NE ARG A 61 20.355 -0.867 91.238 1.00 38.66 N +ATOM 924 CZ ARG A 61 21.529 -0.722 90.633 1.00 33.49 C +ATOM 925 NH1 ARG A 61 22.548 -0.174 91.282 1.00 31.85 N +ATOM 926 NH2 ARG A 61 21.687 -1.121 89.378 1.00 29.94 N1+ +ATOM 927 H ARG A 61 16.942 -3.147 93.595 1.00 0.00 H +ATOM 928 HA ARG A 61 16.855 -1.213 95.843 1.00 0.00 H +ATOM 929 HB3 ARG A 61 19.051 -1.942 94.578 1.00 0.00 H +ATOM 930 HB2 ARG A 61 18.820 -0.304 95.074 1.00 0.00 H +ATOM 931 HG3 ARG A 61 18.110 0.351 92.823 1.00 0.00 H +ATOM 932 HG2 ARG A 61 18.150 -1.324 92.291 1.00 0.00 H +ATOM 933 HD3 ARG A 61 20.682 -1.061 93.296 1.00 0.00 H +ATOM 934 HD2 ARG A 61 20.386 0.580 92.749 1.00 0.00 H +ATOM 935 HE ARG A 61 19.580 -1.284 90.743 1.00 0.00 H +ATOM 936 HH12 ARG A 61 23.440 -0.064 90.821 1.00 0.00 H +ATOM 937 HH11 ARG A 61 22.432 0.133 92.237 1.00 0.00 H +ATOM 938 HH22 ARG A 61 22.581 -1.009 88.921 1.00 0.00 H +ATOM 939 HH21 ARG A 61 20.913 -1.537 88.879 1.00 0.00 H +ATOM 940 N CYS A 62 15.866 0.744 94.564 1.00 30.10 N +ATOM 941 CA CYS A 62 15.070 1.774 93.911 1.00 28.15 C +ATOM 942 C CYS A 62 15.774 2.212 92.633 1.00 29.88 C +ATOM 943 O CYS A 62 16.857 2.798 92.684 1.00 35.11 O +ATOM 944 CB CYS A 62 14.862 2.954 94.853 1.00 35.59 C +ATOM 945 SG CYS A 62 13.802 4.248 94.173 1.00 31.41 S1- +ATOM 946 H CYS A 62 16.301 0.964 95.448 1.00 0.00 H +ATOM 947 HA CYS A 62 14.098 1.355 93.651 1.00 0.00 H +ATOM 948 HB3 CYS A 62 15.830 3.381 95.117 1.00 0.00 H +ATOM 949 HB2 CYS A 62 14.439 2.597 95.792 1.00 0.00 H +ATOM 950 N SER A 63 15.158 1.932 91.485 1.00 33.55 N +ATOM 951 CA SER A 63 15.787 2.261 90.210 1.00 34.12 C +ATOM 952 C SER A 63 16.097 3.750 90.108 1.00 33.17 C +ATOM 953 O SER A 63 17.106 4.143 89.512 1.00 33.21 O +ATOM 954 CB SER A 63 14.883 1.821 89.063 1.00 23.55 C +ATOM 955 OG SER A 63 15.267 2.434 87.846 1.00 22.00 O +ATOM 956 H SER A 63 14.250 1.489 91.494 1.00 0.00 H +ATOM 957 HA SER A 63 16.725 1.710 90.138 1.00 0.00 H +ATOM 958 HB3 SER A 63 13.851 2.085 89.293 1.00 0.00 H +ATOM 959 HB2 SER A 63 14.934 0.738 88.956 1.00 0.00 H +ATOM 960 HG SER A 63 14.684 2.141 87.142 1.00 0.00 H +ATOM 961 N GLN A 64 15.245 4.589 90.694 1.00 30.25 N +ATOM 962 CA GLN A 64 15.430 6.034 90.656 1.00 34.07 C +ATOM 963 C GLN A 64 16.709 6.447 91.373 1.00 38.00 C +ATOM 964 O GLN A 64 17.626 6.990 90.748 1.00 39.66 O +ATOM 965 CB GLN A 64 14.221 6.734 91.278 1.00 37.71 C +ATOM 966 CG GLN A 64 14.070 8.200 90.903 1.00 46.19 C +ATOM 967 CD GLN A 64 12.711 8.760 91.287 1.00 58.49 C +ATOM 968 OE1 GLN A 64 11.704 8.053 91.256 1.00 61.07 O +ATOM 969 NE2 GLN A 64 12.680 10.035 91.662 1.00 51.17 N +ATOM 970 H GLN A 64 14.439 4.229 91.185 1.00 0.00 H +ATOM 971 HA GLN A 64 15.506 6.343 89.613 1.00 0.00 H +ATOM 972 HB3 GLN A 64 14.270 6.642 92.363 1.00 0.00 H +ATOM 973 HB2 GLN A 64 13.313 6.196 91.005 1.00 0.00 H +ATOM 974 HG3 GLN A 64 14.220 8.317 89.830 1.00 0.00 H +ATOM 975 HG2 GLN A 64 14.852 8.781 91.391 1.00 0.00 H +ATOM 976 HE22 GLN A 64 11.804 10.462 91.929 1.00 0.00 H +ATOM 977 HE21 GLN A 64 13.532 10.577 91.680 1.00 0.00 H +ATOM 978 N CYS A 65 16.786 6.189 92.679 1.00 31.76 N +ATOM 979 CA CYS A 65 17.916 6.650 93.477 1.00 39.98 C +ATOM 980 C CYS A 65 19.016 5.606 93.610 1.00 39.98 C +ATOM 981 O CYS A 65 20.200 5.961 93.633 1.00 40.53 O +ATOM 982 CB CYS A 65 17.446 7.063 94.874 1.00 35.47 C +ATOM 983 SG CYS A 65 16.613 5.756 95.802 1.00 37.08 S1- +ATOM 984 H CYS A 65 16.053 5.665 93.134 1.00 0.00 H +ATOM 985 HA CYS A 65 18.339 7.528 92.989 1.00 0.00 H +ATOM 986 HB3 CYS A 65 16.784 7.925 94.792 1.00 0.00 H +ATOM 987 HB2 CYS A 65 18.298 7.427 95.449 1.00 0.00 H +ATOM 988 N ARG A 66 18.645 4.328 93.715 1.00 40.86 N +ATOM 989 CA ARG A 66 19.540 3.197 93.954 1.00 38.30 C +ATOM 990 C ARG A 66 20.161 3.217 95.344 1.00 45.62 C +ATOM 991 O ARG A 66 21.051 2.407 95.628 1.00 45.37 O +ATOM 992 CB ARG A 66 20.641 3.104 92.891 1.00 38.55 C +ATOM 993 CG ARG A 66 20.106 3.147 91.470 1.00 36.30 C +ATOM 994 CD ARG A 66 21.160 2.742 90.463 1.00 37.27 C +ATOM 995 NE ARG A 66 20.559 2.223 89.239 1.00 30.12 N +ATOM 996 CZ ARG A 66 21.205 2.100 88.086 1.00 34.16 C +ATOM 997 NH1 ARG A 66 22.479 2.458 87.999 1.00 30.16 N +ATOM 998 NH2 ARG A 66 20.580 1.617 87.021 1.00 26.29 N1+ +ATOM 999 H ARG A 66 17.671 4.076 93.628 1.00 0.00 H +ATOM 1000 HA ARG A 66 18.941 2.289 93.880 1.00 0.00 H +ATOM 1001 HB3 ARG A 66 21.208 2.185 93.037 1.00 0.00 H +ATOM 1002 HB2 ARG A 66 21.352 3.917 93.035 1.00 0.00 H +ATOM 1003 HG3 ARG A 66 19.757 4.155 91.244 1.00 0.00 H +ATOM 1004 HG2 ARG A 66 19.248 2.480 91.385 1.00 0.00 H +ATOM 1005 HD3 ARG A 66 21.806 1.981 90.901 1.00 0.00 H +ATOM 1006 HD2 ARG A 66 21.783 3.604 90.224 1.00 0.00 H +ATOM 1007 HE ARG A 66 19.589 1.949 89.306 1.00 0.00 H +ATOM 1008 HH12 ARG A 66 22.971 2.365 87.122 1.00 0.00 H +ATOM 1009 HH11 ARG A 66 22.957 2.824 88.810 1.00 0.00 H +ATOM 1010 HH22 ARG A 66 21.074 1.524 86.145 1.00 0.00 H +ATOM 1011 HH21 ARG A 66 19.610 1.342 87.086 1.00 0.00 H +ATOM 1012 N VAL A 67 19.714 4.110 96.221 1.00 46.70 N +ATOM 1013 CA VAL A 67 20.153 4.089 97.613 1.00 38.58 C +ATOM 1014 C VAL A 67 19.219 3.235 98.463 1.00 39.53 C +ATOM 1015 O VAL A 67 19.662 2.552 99.390 1.00 43.93 O +ATOM 1016 CB VAL A 67 20.251 5.533 98.150 1.00 35.48 C +ATOM 1017 CG1 VAL A 67 20.456 5.547 99.664 1.00 33.38 C +ATOM 1018 CG2 VAL A 67 21.357 6.301 97.439 1.00 27.76 C +ATOM 1019 H VAL A 67 19.058 4.820 95.929 1.00 0.00 H +ATOM 1020 HA VAL A 67 21.148 3.644 97.649 1.00 0.00 H +ATOM 1021 HB VAL A 67 19.307 6.033 97.936 1.00 0.00 H +ATOM 1022 HG11 VAL A 67 20.521 6.578 100.013 1.00 0.00 H +ATOM 1023 HG12 VAL A 67 19.615 5.052 100.150 1.00 0.00 H +ATOM 1024 HG13 VAL A 67 21.378 5.021 99.911 1.00 0.00 H +ATOM 1025 HG21 VAL A 67 21.407 7.316 97.834 1.00 0.00 H +ATOM 1026 HG22 VAL A 67 22.311 5.800 97.603 1.00 0.00 H +ATOM 1027 HG23 VAL A 67 21.145 6.338 96.370 1.00 0.00 H +ATOM 1028 N ALA A 68 17.926 3.252 98.136 1.00 36.74 N +ATOM 1029 CA ALA A 68 16.901 2.533 98.884 1.00 31.07 C +ATOM 1030 C ALA A 68 16.764 1.112 98.348 1.00 34.04 C +ATOM 1031 O ALA A 68 16.615 0.914 97.138 1.00 32.97 O +ATOM 1032 CB ALA A 68 15.561 3.265 98.788 1.00 33.24 C +ATOM 1033 H ALA A 68 17.615 3.782 97.334 1.00 0.00 H +ATOM 1034 HA ALA A 68 17.200 2.485 99.931 1.00 0.00 H +ATOM 1035 HB1 ALA A 68 14.806 2.717 99.351 1.00 0.00 H +ATOM 1036 HB2 ALA A 68 15.664 4.268 99.201 1.00 0.00 H +ATOM 1037 HB3 ALA A 68 15.257 3.332 97.743 1.00 0.00 H +ATOM 1038 N LYS A 69 16.823 0.126 99.245 1.00 30.22 N +ATOM 1039 CA LYS A 69 16.730 -1.278 98.861 1.00 31.54 C +ATOM 1040 C LYS A 69 15.773 -2.003 99.801 1.00 28.20 C +ATOM 1041 O LYS A 69 15.539 -1.573 100.932 1.00 26.30 O +ATOM 1042 CB LYS A 69 18.115 -1.942 98.844 1.00 32.87 C +ATOM 1043 CG LYS A 69 19.153 -1.113 98.092 1.00 31.97 C +ATOM 1044 CD LYS A 69 20.576 -1.518 98.410 1.00 29.38 C +ATOM 1045 CE LYS A 69 21.454 -1.490 97.171 1.00 32.21 C +ATOM 1046 NZ LYS A 69 22.829 -1.978 97.468 1.00 37.62 N1+ +ATOM 1047 H LYS A 69 16.935 0.341 100.225 1.00 0.00 H +ATOM 1048 HA LYS A 69 16.318 -1.327 97.853 1.00 0.00 H +ATOM 1049 HB3 LYS A 69 18.038 -2.928 98.386 1.00 0.00 H +ATOM 1050 HB2 LYS A 69 18.452 -2.103 99.868 1.00 0.00 H +ATOM 1051 HG3 LYS A 69 19.015 -0.058 98.330 1.00 0.00 H +ATOM 1052 HG2 LYS A 69 18.982 -1.205 97.019 1.00 0.00 H +ATOM 1053 HD3 LYS A 69 20.581 -2.521 98.836 1.00 0.00 H +ATOM 1054 HD2 LYS A 69 20.986 -0.842 99.161 1.00 0.00 H +ATOM 1055 HE3 LYS A 69 21.506 -0.472 96.786 1.00 0.00 H +ATOM 1056 HE2 LYS A 69 21.008 -2.113 96.396 1.00 0.00 H +ATOM 1057 HZ1 LYS A 69 23.387 -1.947 96.627 1.00 0.00 H +ATOM 1058 HZ2 LYS A 69 23.251 -1.390 98.172 1.00 0.00 H +ATOM 1059 HZ3 LYS A 69 22.784 -2.928 97.807 1.00 0.00 H +ATOM 1060 N TYR A 70 15.217 -3.118 99.322 1.00 30.15 N +ATOM 1061 CA TYR A 70 14.013 -3.675 99.929 1.00 31.83 C +ATOM 1062 C TYR A 70 14.058 -5.197 99.968 1.00 36.09 C +ATOM 1063 O TYR A 70 14.814 -5.839 99.235 1.00 37.97 O +ATOM 1064 CB TYR A 70 12.771 -3.210 99.163 1.00 22.52 C +ATOM 1065 CG TYR A 70 12.597 -1.715 99.206 1.00 24.78 C +ATOM 1066 CD1 TYR A 70 12.069 -1.090 100.326 1.00 22.97 C +ATOM 1067 CD2 TYR A 70 13.005 -0.921 98.143 1.00 23.41 C +ATOM 1068 CE1 TYR A 70 11.922 0.280 100.375 1.00 23.46 C +ATOM 1069 CE2 TYR A 70 12.862 0.452 98.181 1.00 22.05 C +ATOM 1070 CZ TYR A 70 12.319 1.047 99.301 1.00 25.99 C +ATOM 1071 OH TYR A 70 12.172 2.414 99.354 1.00 22.43 O +ATOM 1072 H TYR A 70 15.630 -3.588 98.529 1.00 0.00 H +ATOM 1073 HA TYR A 70 13.943 -3.307 100.953 1.00 0.00 H +ATOM 1074 HB3 TYR A 70 11.886 -3.690 99.581 1.00 0.00 H +ATOM 1075 HB2 TYR A 70 12.842 -3.537 98.126 1.00 0.00 H +ATOM 1076 HD1 TYR A 70 11.765 -1.678 101.179 1.00 0.00 H +ATOM 1077 HD2 TYR A 70 13.443 -1.375 97.267 1.00 0.00 H +ATOM 1078 HE1 TYR A 70 11.498 0.747 101.252 1.00 0.00 H +ATOM 1079 HE2 TYR A 70 13.174 1.051 97.338 1.00 0.00 H +ATOM 1080 HH TYR A 70 12.492 2.803 98.537 1.00 0.00 H +ATOM 1081 N CYS A 71 13.210 -5.772 100.833 1.00 32.04 N +ATOM 1082 CA CYS A 71 13.117 -7.225 100.934 1.00 28.39 C +ATOM 1083 C CYS A 71 12.304 -7.834 99.800 1.00 37.47 C +ATOM 1084 O CYS A 71 12.582 -8.965 99.385 1.00 37.22 O +ATOM 1085 CB CYS A 71 12.500 -7.629 102.275 1.00 20.83 C +ATOM 1086 SG CYS A 71 10.693 -7.685 102.276 1.00 29.97 S1- +ATOM 1087 H CYS A 71 12.626 -5.198 101.425 1.00 0.00 H +ATOM 1088 HA CYS A 71 14.126 -7.634 100.887 1.00 0.00 H +ATOM 1089 HB3 CYS A 71 12.840 -6.943 103.051 1.00 0.00 H +ATOM 1090 HB2 CYS A 71 12.892 -8.601 102.574 1.00 0.00 H +ATOM 1091 N SER A 72 11.306 -7.117 99.292 1.00 32.58 N +ATOM 1092 CA SER A 72 10.419 -7.659 98.271 1.00 28.61 C +ATOM 1093 C SER A 72 9.746 -6.504 97.540 1.00 27.81 C +ATOM 1094 O SER A 72 9.966 -5.330 97.849 1.00 22.46 O +ATOM 1095 CB SER A 72 9.388 -8.607 98.888 1.00 26.24 C +ATOM 1096 OG SER A 72 8.457 -7.891 99.681 1.00 23.59 O +ATOM 1097 H SER A 72 11.148 -6.172 99.613 1.00 0.00 H +ATOM 1098 HA SER A 72 11.019 -8.220 97.554 1.00 0.00 H +ATOM 1099 HB3 SER A 72 9.898 -9.346 99.506 1.00 0.00 H +ATOM 1100 HB2 SER A 72 8.859 -9.134 98.094 1.00 0.00 H +ATOM 1101 HG SER A 72 7.820 -8.502 100.058 1.00 0.00 H +ATOM 1102 N ALA A 73 8.911 -6.855 96.558 1.00 22.00 N +ATOM 1103 CA ALA A 73 8.210 -5.840 95.780 1.00 24.18 C +ATOM 1104 C ALA A 73 7.137 -5.140 96.603 1.00 23.49 C +ATOM 1105 O ALA A 73 6.873 -3.952 96.388 1.00 22.37 O +ATOM 1106 CB ALA A 73 7.595 -6.467 94.529 1.00 15.47 C +ATOM 1107 H ALA A 73 8.760 -7.831 96.348 1.00 0.00 H +ATOM 1108 HA ALA A 73 8.937 -5.092 95.463 1.00 0.00 H +ATOM 1109 HB1 ALA A 73 7.074 -5.700 93.956 1.00 0.00 H +ATOM 1110 HB2 ALA A 73 8.383 -6.905 93.917 1.00 0.00 H +ATOM 1111 HB3 ALA A 73 6.888 -7.244 94.821 1.00 0.00 H +ATOM 1112 N LYS A 74 6.506 -5.855 97.538 1.00 18.81 N +ATOM 1113 CA LYS A 74 5.534 -5.215 98.418 1.00 26.93 C +ATOM 1114 C LYS A 74 6.194 -4.134 99.264 1.00 23.34 C +ATOM 1115 O LYS A 74 5.661 -3.027 99.398 1.00 21.29 O +ATOM 1116 CB LYS A 74 4.860 -6.258 99.311 1.00 25.14 C +ATOM 1117 CG LYS A 74 3.876 -5.669 100.314 1.00 29.66 C +ATOM 1118 CD LYS A 74 3.323 -6.730 101.255 1.00 28.56 C +ATOM 1119 CE LYS A 74 4.141 -6.816 102.536 1.00 41.98 C +ATOM 1120 NZ LYS A 74 3.320 -7.257 103.699 1.00 44.25 N1+ +ATOM 1121 H LYS A 74 6.701 -6.841 97.637 1.00 0.00 H +ATOM 1122 HA LYS A 74 4.768 -4.747 97.800 1.00 0.00 H +ATOM 1123 HB3 LYS A 74 5.623 -6.825 99.844 1.00 0.00 H +ATOM 1124 HB2 LYS A 74 4.346 -6.990 98.688 1.00 0.00 H +ATOM 1125 HG3 LYS A 74 3.053 -5.194 99.779 1.00 0.00 H +ATOM 1126 HG2 LYS A 74 4.372 -4.892 100.895 1.00 0.00 H +ATOM 1127 HD3 LYS A 74 3.330 -7.698 100.754 1.00 0.00 H +ATOM 1128 HD2 LYS A 74 2.288 -6.493 101.501 1.00 0.00 H +ATOM 1129 HE3 LYS A 74 4.581 -5.842 102.751 1.00 0.00 H +ATOM 1130 HE2 LYS A 74 4.968 -7.511 102.392 1.00 0.00 H +ATOM 1131 HZ1 LYS A 74 3.900 -7.300 104.524 1.00 0.00 H +ATOM 1132 HZ2 LYS A 74 2.569 -6.599 103.850 1.00 0.00 H +ATOM 1133 HZ3 LYS A 74 2.934 -8.171 103.512 1.00 0.00 H +ATOM 1134 N CYS A 75 7.367 -4.432 99.828 1.00 21.72 N +ATOM 1135 CA CYS A 75 8.049 -3.460 100.675 1.00 25.28 C +ATOM 1136 C CYS A 75 8.493 -2.239 99.878 1.00 19.12 C +ATOM 1137 O CYS A 75 8.440 -1.112 100.383 1.00 16.43 O +ATOM 1138 CB CYS A 75 9.243 -4.116 101.371 1.00 23.27 C +ATOM 1139 SG CYS A 75 8.843 -4.931 102.942 1.00 22.40 S1- +ATOM 1140 H CYS A 75 7.788 -5.336 99.669 1.00 0.00 H +ATOM 1141 HA CYS A 75 7.349 -3.128 101.442 1.00 0.00 H +ATOM 1142 HB3 CYS A 75 10.018 -3.368 101.539 1.00 0.00 H +ATOM 1143 HB2 CYS A 75 9.702 -4.838 100.696 1.00 0.00 H +ATOM 1144 N GLN A 76 8.929 -2.436 98.631 1.00 21.34 N +ATOM 1145 CA GLN A 76 9.345 -1.296 97.817 1.00 20.12 C +ATOM 1146 C GLN A 76 8.151 -0.435 97.426 1.00 22.01 C +ATOM 1147 O GLN A 76 8.231 0.799 97.457 1.00 19.55 O +ATOM 1148 CB GLN A 76 10.089 -1.772 96.569 1.00 18.14 C +ATOM 1149 CG GLN A 76 10.403 -0.650 95.585 1.00 19.25 C +ATOM 1150 CD GLN A 76 11.372 -1.070 94.497 1.00 22.67 C +ATOM 1151 OE1 GLN A 76 11.744 -2.239 94.397 1.00 27.27 O +ATOM 1152 NE2 GLN A 76 11.784 -0.114 93.672 1.00 15.60 N +ATOM 1153 H GLN A 76 8.971 -3.371 98.252 1.00 0.00 H +ATOM 1154 HA GLN A 76 10.027 -0.685 98.409 1.00 0.00 H +ATOM 1155 HB3 GLN A 76 9.499 -2.539 96.067 1.00 0.00 H +ATOM 1156 HB2 GLN A 76 11.016 -2.263 96.866 1.00 0.00 H +ATOM 1157 HG3 GLN A 76 10.814 0.202 96.127 1.00 0.00 H +ATOM 1158 HG2 GLN A 76 9.477 -0.298 95.129 1.00 0.00 H +ATOM 1159 HE22 GLN A 76 12.430 -0.333 92.927 1.00 0.00 H +ATOM 1160 HE21 GLN A 76 11.451 0.832 93.789 1.00 0.00 H +ATOM 1161 N LYS A 77 7.033 -1.066 97.064 1.00 22.53 N +ATOM 1162 CA LYS A 77 5.858 -0.308 96.650 1.00 22.19 C +ATOM 1163 C LYS A 77 5.188 0.367 97.842 1.00 25.96 C +ATOM 1164 O LYS A 77 4.673 1.485 97.719 1.00 30.00 O +ATOM 1165 CB LYS A 77 4.878 -1.227 95.922 1.00 21.35 C +ATOM 1166 CG LYS A 77 3.494 -0.637 95.706 1.00 22.93 C +ATOM 1167 CD LYS A 77 3.402 0.063 94.361 1.00 27.09 C +ATOM 1168 CE LYS A 77 2.091 -0.259 93.660 1.00 34.07 C +ATOM 1169 NZ LYS A 77 0.914 0.021 94.529 1.00 44.73 N1+ +ATOM 1170 H LYS A 77 6.996 -2.075 97.075 1.00 0.00 H +ATOM 1171 HA LYS A 77 6.180 0.468 95.955 1.00 0.00 H +ATOM 1172 HB3 LYS A 77 4.789 -2.165 96.469 1.00 0.00 H +ATOM 1173 HB2 LYS A 77 5.301 -1.516 94.960 1.00 0.00 H +ATOM 1174 HG3 LYS A 77 3.275 0.075 96.501 1.00 0.00 H +ATOM 1175 HG2 LYS A 77 2.749 -1.432 95.753 1.00 0.00 H +ATOM 1176 HD3 LYS A 77 4.236 -0.249 93.732 1.00 0.00 H +ATOM 1177 HD2 LYS A 77 3.481 1.140 94.507 1.00 0.00 H +ATOM 1178 HE3 LYS A 77 2.084 -1.309 93.368 1.00 0.00 H +ATOM 1179 HE2 LYS A 77 2.015 0.329 92.746 1.00 0.00 H +ATOM 1180 HZ1 LYS A 77 0.065 -0.205 94.030 1.00 0.00 H +ATOM 1181 HZ2 LYS A 77 0.972 -0.541 95.366 1.00 0.00 H +ATOM 1182 HZ3 LYS A 77 0.906 0.999 94.781 1.00 0.00 H +ATOM 1183 N LYS A 78 5.193 -0.287 99.007 1.00 24.32 N +ATOM 1184 CA LYS A 78 4.556 0.310 100.178 1.00 25.07 C +ATOM 1185 C LYS A 78 5.395 1.437 100.766 1.00 29.56 C +ATOM 1186 O LYS A 78 4.843 2.384 101.338 1.00 33.61 O +ATOM 1187 CB LYS A 78 4.284 -0.761 101.237 1.00 25.52 C +ATOM 1188 CG LYS A 78 3.235 -1.785 100.835 1.00 31.55 C +ATOM 1189 CD LYS A 78 2.331 -2.138 102.003 1.00 34.48 C +ATOM 1190 CE LYS A 78 1.077 -2.847 101.527 1.00 31.14 C +ATOM 1191 NZ LYS A 78 -0.154 -2.191 102.038 1.00 40.83 N1+ +ATOM 1192 H LYS A 78 5.636 -1.192 99.076 1.00 0.00 H +ATOM 1193 HA LYS A 78 3.599 0.728 99.866 1.00 0.00 H +ATOM 1194 HB3 LYS A 78 3.982 -0.280 102.167 1.00 0.00 H +ATOM 1195 HB2 LYS A 78 5.215 -1.274 101.480 1.00 0.00 H +ATOM 1196 HG3 LYS A 78 3.728 -2.687 100.473 1.00 0.00 H +ATOM 1197 HG2 LYS A 78 2.633 -1.387 100.018 1.00 0.00 H +ATOM 1198 HD3 LYS A 78 2.054 -1.228 102.535 1.00 0.00 H +ATOM 1199 HD2 LYS A 78 2.870 -2.782 102.698 1.00 0.00 H +ATOM 1200 HE3 LYS A 78 1.099 -3.885 101.859 1.00 0.00 H +ATOM 1201 HE2 LYS A 78 1.057 -2.856 100.437 1.00 0.00 H +ATOM 1202 HZ1 LYS A 78 -0.966 -2.689 101.702 1.00 0.00 H +ATOM 1203 HZ2 LYS A 78 -0.147 -2.202 103.048 1.00 0.00 H +ATOM 1204 HZ3 LYS A 78 -0.187 -1.236 101.712 1.00 0.00 H +ATOM 1205 N ALA A 79 6.720 1.353 100.651 1.00 27.26 N +ATOM 1206 CA ALA A 79 7.585 2.413 101.151 1.00 23.06 C +ATOM 1207 C ALA A 79 7.620 3.630 100.238 1.00 26.60 C +ATOM 1208 O ALA A 79 8.128 4.677 100.653 1.00 28.42 O +ATOM 1209 CB ALA A 79 9.006 1.885 101.354 1.00 15.64 C +ATOM 1210 H ALA A 79 7.139 0.546 100.212 1.00 0.00 H +ATOM 1211 HA ALA A 79 7.202 2.731 102.121 1.00 0.00 H +ATOM 1212 HB1 ALA A 79 9.642 2.687 101.728 1.00 0.00 H +ATOM 1213 HB2 ALA A 79 8.991 1.068 102.075 1.00 0.00 H +ATOM 1214 HB3 ALA A 79 9.399 1.523 100.404 1.00 0.00 H +ATOM 1215 N TRP A 80 7.082 3.522 99.022 1.00 29.77 N +ATOM 1216 CA TRP A 80 7.166 4.622 98.062 1.00 29.48 C +ATOM 1217 C TRP A 80 6.556 5.928 98.561 1.00 29.53 C +ATOM 1218 O TRP A 80 7.187 6.982 98.370 1.00 28.48 O +ATOM 1219 CB TRP A 80 6.528 4.197 96.735 1.00 29.14 C +ATOM 1220 CG TRP A 80 6.480 5.312 95.743 1.00 31.93 C +ATOM 1221 CD1 TRP A 80 5.374 5.996 95.328 1.00 27.25 C +ATOM 1222 CD2 TRP A 80 7.592 5.891 95.053 1.00 22.88 C +ATOM 1223 NE1 TRP A 80 5.729 6.959 94.415 1.00 32.07 N +ATOM 1224 CE2 TRP A 80 7.086 6.915 94.229 1.00 30.18 C +ATOM 1225 CE3 TRP A 80 8.967 5.639 95.048 1.00 22.54 C +ATOM 1226 CZ2 TRP A 80 7.905 7.686 93.410 1.00 31.13 C +ATOM 1227 CZ3 TRP A 80 9.779 6.405 94.235 1.00 30.84 C +ATOM 1228 CH2 TRP A 80 9.246 7.416 93.427 1.00 32.45 C +ATOM 1229 H TRP A 80 6.608 2.672 98.753 1.00 0.00 H +ATOM 1230 HA TRP A 80 8.223 4.808 97.871 1.00 0.00 H +ATOM 1231 HB3 TRP A 80 5.518 3.832 96.919 1.00 0.00 H +ATOM 1232 HB2 TRP A 80 7.088 3.362 96.315 1.00 0.00 H +ATOM 1233 HD1 TRP A 80 4.401 5.740 95.722 1.00 0.00 H +ATOM 1234 HE1 TRP A 80 5.021 7.552 94.006 1.00 0.00 H +ATOM 1235 HE3 TRP A 80 9.375 4.858 95.672 1.00 0.00 H +ATOM 1236 HZ2 TRP A 80 7.476 8.462 92.794 1.00 0.00 H +ATOM 1237 HZ3 TRP A 80 10.844 6.229 94.215 1.00 0.00 H +ATOM 1238 HH2 TRP A 80 9.920 7.989 92.807 1.00 0.00 H +ATOM 1239 N PRO A 81 5.358 5.956 99.168 1.00 33.33 N +ATOM 1240 CA PRO A 81 4.809 7.256 99.602 1.00 28.13 C +ATOM 1241 C PRO A 81 5.709 8.003 100.572 1.00 29.66 C +ATOM 1242 O PRO A 81 5.906 9.215 100.419 1.00 29.24 O +ATOM 1243 CB PRO A 81 3.467 6.878 100.246 1.00 27.65 C +ATOM 1244 CG PRO A 81 3.119 5.559 99.677 1.00 28.97 C +ATOM 1245 CD PRO A 81 4.403 4.855 99.397 1.00 27.74 C +ATOM 1246 HA PRO A 81 4.626 7.880 98.727 1.00 0.00 H +ATOM 1247 HB3 PRO A 81 2.710 7.607 99.958 1.00 0.00 H +ATOM 1248 HB2 PRO A 81 3.597 6.784 101.324 1.00 0.00 H +ATOM 1249 HG3 PRO A 81 2.572 5.699 98.745 1.00 0.00 H +ATOM 1250 HG2 PRO A 81 2.545 4.989 100.408 1.00 0.00 H +ATOM 1251 HD2 PRO A 81 4.706 4.293 100.281 1.00 0.00 H +ATOM 1252 HD3 PRO A 81 4.301 4.270 98.483 1.00 0.00 H +ATOM 1253 N ASP A 82 6.269 7.315 101.565 1.00 30.46 N +ATOM 1254 CA ASP A 82 7.198 7.937 102.501 1.00 32.06 C +ATOM 1255 C ASP A 82 8.600 8.097 101.928 1.00 31.08 C +ATOM 1256 O ASP A 82 9.476 8.633 102.616 1.00 27.43 O +ATOM 1257 CB ASP A 82 7.262 7.121 103.796 1.00 35.28 C +ATOM 1258 CG ASP A 82 5.939 7.099 104.537 1.00 37.88 C +ATOM 1259 OD1 ASP A 82 5.285 8.159 104.621 1.00 38.57 O +ATOM 1260 OD2 ASP A 82 5.554 6.021 105.038 1.00 47.89 O1- +ATOM 1261 H ASP A 82 6.054 6.336 101.685 1.00 0.00 H +ATOM 1262 HA ASP A 82 6.818 8.929 102.745 1.00 0.00 H +ATOM 1263 HB3 ASP A 82 8.034 7.533 104.446 1.00 0.00 H +ATOM 1264 HB2 ASP A 82 7.565 6.100 103.566 1.00 0.00 H +ATOM 1265 N HIS A 83 8.832 7.652 100.692 1.00 21.30 N +ATOM 1266 CA HIS A 83 10.146 7.709 100.070 1.00 28.08 C +ATOM 1267 C HIS A 83 10.209 8.628 98.858 1.00 32.08 C +ATOM 1268 O HIS A 83 11.307 9.055 98.487 1.00 33.19 O +ATOM 1269 CB HIS A 83 10.590 6.296 99.656 1.00 26.54 C +ATOM 1270 CG HIS A 83 11.833 6.262 98.824 1.00 25.94 C +ATOM 1271 ND1 HIS A 83 13.089 6.463 99.353 1.00 26.95 N +ATOM 1272 CD2 HIS A 83 12.012 6.055 97.498 1.00 25.31 C +ATOM 1273 CE1 HIS A 83 13.989 6.380 98.390 1.00 29.27 C +ATOM 1274 NE2 HIS A 83 13.362 6.135 97.254 1.00 29.55 N +ATOM 1275 H HIS A 83 8.079 7.256 100.148 1.00 0.00 H +ATOM 1276 HA HIS A 83 10.854 8.081 100.811 1.00 0.00 H +ATOM 1277 HB3 HIS A 83 9.780 5.807 99.115 1.00 0.00 H +ATOM 1278 HB2 HIS A 83 10.736 5.687 100.548 1.00 0.00 H +ATOM 1279 HD1 HIS A 83 13.198 6.640 100.341 1.00 0.00 H +ATOM 1280 HD2 HIS A 83 11.160 5.871 96.860 1.00 0.00 H +ATOM 1281 HE1 HIS A 83 15.037 6.509 98.618 1.00 0.00 H +ATOM 1282 N LYS A 84 9.063 8.970 98.262 1.00 27.17 N +ATOM 1283 CA LYS A 84 9.056 9.650 96.968 1.00 29.24 C +ATOM 1284 C LYS A 84 9.767 10.999 97.029 1.00 31.30 C +ATOM 1285 O LYS A 84 10.532 11.344 96.120 1.00 31.13 O +ATOM 1286 CB LYS A 84 7.616 9.813 96.479 1.00 24.44 C +ATOM 1287 CG LYS A 84 7.359 11.048 95.630 1.00 33.77 C +ATOM 1288 CD LYS A 84 5.952 11.023 95.050 1.00 39.19 C +ATOM 1289 CE LYS A 84 5.829 11.941 93.845 1.00 53.69 C +ATOM 1290 NZ LYS A 84 6.998 11.822 92.929 1.00 42.90 N1+ +ATOM 1291 H LYS A 84 8.181 8.759 98.706 1.00 0.00 H +ATOM 1292 HA LYS A 84 9.586 9.021 96.253 1.00 0.00 H +ATOM 1293 HB3 LYS A 84 6.943 9.818 97.336 1.00 0.00 H +ATOM 1294 HB2 LYS A 84 7.322 8.924 95.921 1.00 0.00 H +ATOM 1295 HG3 LYS A 84 8.085 11.088 94.818 1.00 0.00 H +ATOM 1296 HG2 LYS A 84 7.483 11.941 96.242 1.00 0.00 H +ATOM 1297 HD3 LYS A 84 5.239 11.331 95.815 1.00 0.00 H +ATOM 1298 HD2 LYS A 84 5.698 10.004 94.757 1.00 0.00 H +ATOM 1299 HE3 LYS A 84 5.737 12.973 94.183 1.00 0.00 H +ATOM 1300 HE2 LYS A 84 4.916 11.703 93.300 1.00 0.00 H +ATOM 1301 HZ1 LYS A 84 6.877 12.446 92.144 1.00 0.00 H +ATOM 1302 HZ2 LYS A 84 7.842 12.067 93.426 1.00 0.00 H +ATOM 1303 HZ3 LYS A 84 7.069 10.872 92.594 1.00 0.00 H +ATOM 1304 N ARG A 85 9.537 11.774 98.092 1.00 29.88 N +ATOM 1305 CA ARG A 85 10.160 13.092 98.179 1.00 30.76 C +ATOM 1306 C ARG A 85 11.638 12.985 98.538 1.00 34.15 C +ATOM 1307 O ARG A 85 12.461 13.758 98.033 1.00 31.58 O +ATOM 1308 CB ARG A 85 9.416 13.960 99.194 1.00 23.12 C +ATOM 1309 CG ARG A 85 7.932 14.092 98.900 1.00 28.65 C +ATOM 1310 CD ARG A 85 7.301 15.278 99.613 1.00 28.35 C +ATOM 1311 NE ARG A 85 8.008 16.536 99.391 1.00 30.44 N +ATOM 1312 CZ ARG A 85 7.720 17.671 100.020 1.00 33.19 C +ATOM 1313 NH1 ARG A 85 6.736 17.708 100.910 1.00 23.61 N +ATOM 1314 NH2 ARG A 85 8.413 18.770 99.761 1.00 31.30 N1+ +ATOM 1315 H ARG A 85 8.933 11.448 98.833 1.00 0.00 H +ATOM 1316 HA ARG A 85 10.082 13.569 97.202 1.00 0.00 H +ATOM 1317 HB3 ARG A 85 9.869 14.951 99.223 1.00 0.00 H +ATOM 1318 HB2 ARG A 85 9.551 13.545 100.193 1.00 0.00 H +ATOM 1319 HG3 ARG A 85 7.421 13.176 99.198 1.00 0.00 H +ATOM 1320 HG2 ARG A 85 7.783 14.194 97.825 1.00 0.00 H +ATOM 1321 HD3 ARG A 85 7.254 15.074 100.683 1.00 0.00 H +ATOM 1322 HD2 ARG A 85 6.265 15.384 99.292 1.00 0.00 H +ATOM 1323 HE ARG A 85 8.756 16.510 98.713 1.00 0.00 H +ATOM 1324 HH12 ARG A 85 6.519 18.571 101.387 1.00 0.00 H +ATOM 1325 HH11 ARG A 85 6.205 16.873 101.110 1.00 0.00 H +ATOM 1326 HH22 ARG A 85 8.192 19.631 100.240 1.00 0.00 H +ATOM 1327 HH21 ARG A 85 9.162 18.747 99.084 1.00 0.00 H +ATOM 1328 N GLU A 86 11.997 12.035 99.401 1.00 28.35 N +ATOM 1329 CA GLU A 86 13.396 11.835 99.757 1.00 31.27 C +ATOM 1330 C GLU A 86 14.185 11.126 98.665 1.00 31.13 C +ATOM 1331 O GLU A 86 15.415 11.248 98.633 1.00 31.86 O +ATOM 1332 CB GLU A 86 13.503 11.030 101.055 1.00 29.87 C +ATOM 1333 CG GLU A 86 13.734 9.537 100.837 1.00 27.32 C +ATOM 1334 CD GLU A 86 14.285 8.840 102.064 1.00 32.39 C +ATOM 1335 OE1 GLU A 86 14.851 9.529 102.937 1.00 30.19 O +ATOM 1336 OE2 GLU A 86 14.160 7.600 102.149 1.00 28.28 O1- +ATOM 1337 H GLU A 86 11.295 11.441 99.819 1.00 0.00 H +ATOM 1338 HA GLU A 86 13.848 12.813 99.924 1.00 0.00 H +ATOM 1339 HB3 GLU A 86 12.598 11.173 101.645 1.00 0.00 H +ATOM 1340 HB2 GLU A 86 14.309 11.435 101.666 1.00 0.00 H +ATOM 1341 HG3 GLU A 86 14.419 9.395 100.001 1.00 0.00 H +ATOM 1342 HG2 GLU A 86 12.797 9.065 100.543 1.00 0.00 H +ATOM 1343 N CYS A 87 13.505 10.395 97.777 1.00 31.60 N +ATOM 1344 CA CYS A 87 14.189 9.552 96.801 1.00 38.46 C +ATOM 1345 C CYS A 87 15.141 10.344 95.916 1.00 42.97 C +ATOM 1346 O CYS A 87 16.157 9.810 95.456 1.00 39.08 O +ATOM 1347 CB CYS A 87 13.151 8.828 95.940 1.00 36.47 C +ATOM 1348 SG CYS A 87 13.820 7.991 94.495 1.00 34.16 S1- +ATOM 1349 H CYS A 87 12.495 10.418 97.771 1.00 0.00 H +ATOM 1350 HA CYS A 87 14.768 8.803 97.342 1.00 0.00 H +ATOM 1351 HB3 CYS A 87 12.386 9.538 95.624 1.00 0.00 H +ATOM 1352 HB2 CYS A 87 12.610 8.109 96.555 1.00 0.00 H +ATOM 1353 N LYS A 88 14.841 11.614 95.678 1.00 42.99 N +ATOM 1354 CA LYS A 88 15.546 12.395 94.676 1.00 52.30 C +ATOM 1355 C LYS A 88 16.313 13.581 95.245 1.00 50.00 C +ATOM 1356 O LYS A 88 16.999 14.270 94.483 1.00 51.17 O +ATOM 1357 CB LYS A 88 14.548 12.876 93.624 1.00 60.94 C +ATOM 1358 CG LYS A 88 13.382 13.562 94.285 1.00 54.85 C +ATOM 1359 CD LYS A 88 12.860 14.685 93.447 1.00 60.86 C +ATOM 1360 CE LYS A 88 12.010 14.136 92.323 1.00 59.67 C +ATOM 1361 NZ LYS A 88 11.235 15.227 91.688 1.00 61.11 N1+ +ATOM 1362 H LYS A 88 14.104 12.065 96.200 1.00 0.00 H +ATOM 1363 HA LYS A 88 16.262 11.738 94.183 1.00 0.00 H +ATOM 1364 HB3 LYS A 88 14.189 12.023 93.048 1.00 0.00 H +ATOM 1365 HB2 LYS A 88 15.042 13.572 92.946 1.00 0.00 H +ATOM 1366 HG3 LYS A 88 13.691 13.948 95.256 1.00 0.00 H +ATOM 1367 HG2 LYS A 88 12.586 12.838 94.458 1.00 0.00 H +ATOM 1368 HD3 LYS A 88 13.696 15.245 93.029 1.00 0.00 H +ATOM 1369 HD2 LYS A 88 12.258 15.350 94.066 1.00 0.00 H +ATOM 1370 HE3 LYS A 88 11.325 13.387 92.719 1.00 0.00 H +ATOM 1371 HE2 LYS A 88 12.652 13.666 91.578 1.00 0.00 H +ATOM 1372 HZ1 LYS A 88 10.672 14.849 90.940 1.00 0.00 H +ATOM 1373 HZ2 LYS A 88 10.634 15.659 92.376 1.00 0.00 H +ATOM 1374 HZ3 LYS A 88 11.870 15.918 91.315 1.00 0.00 H +ATOM 1375 N CYS A 89 16.196 13.861 96.544 1.00 45.29 N +ATOM 1376 CA CYS A 89 17.296 14.508 97.246 1.00 43.43 C +ATOM 1377 C CYS A 89 18.437 13.524 97.433 1.00 43.27 C +ATOM 1378 O CYS A 89 19.610 13.910 97.412 1.00 45.28 O +ATOM 1379 CB CYS A 89 16.824 15.044 98.594 1.00 39.63 C +ATOM 1380 SG CYS A 89 15.324 16.039 98.510 1.00 45.30 S +ATOM 1381 H CYS A 89 15.347 13.624 97.037 1.00 0.00 H +ATOM 1382 HA CYS A 89 17.651 15.344 96.643 1.00 0.00 H +ATOM 1383 HB3 CYS A 89 17.622 15.631 99.049 1.00 0.00 H +ATOM 1384 HB2 CYS A 89 16.667 14.211 99.279 1.00 0.00 H +ATOM 1385 HG CYS A 89 14.997 16.458 99.736 1.00 0.00 H +ATOM 1386 N LEU A 90 18.095 12.250 97.603 1.00 46.48 N +ATOM 1387 CA LEU A 90 19.027 11.133 97.621 1.00 43.56 C +ATOM 1388 C LEU A 90 19.729 11.019 96.274 1.00 53.68 C +ATOM 1389 O LEU A 90 20.949 11.195 96.186 1.00 52.38 O +ATOM 1390 CB LEU A 90 18.265 9.853 97.953 1.00 38.86 C +ATOM 1391 CG LEU A 90 18.892 8.787 98.838 1.00 51.21 C +ATOM 1392 CD1 LEU A 90 19.809 9.418 99.860 1.00 43.67 C +ATOM 1393 CD2 LEU A 90 17.771 8.035 99.524 1.00 44.50 C +ATOM 1394 H LEU A 90 17.125 12.000 97.732 1.00 0.00 H +ATOM 1395 HA LEU A 90 19.774 11.309 98.395 1.00 0.00 H +ATOM 1396 HB3 LEU A 90 17.932 9.390 97.024 1.00 0.00 H +ATOM 1397 HB2 LEU A 90 17.289 10.119 98.358 1.00 0.00 H +ATOM 1398 HG LEU A 90 19.464 8.096 98.219 1.00 0.00 H +ATOM 1399 HD11 LEU A 90 20.248 8.640 100.484 1.00 0.00 H +ATOM 1400 HD12 LEU A 90 20.602 9.964 99.349 1.00 0.00 H +ATOM 1401 HD13 LEU A 90 19.239 10.106 100.485 1.00 0.00 H +ATOM 1402 HD21 LEU A 90 18.192 7.262 100.167 1.00 0.00 H +ATOM 1403 HD22 LEU A 90 17.183 8.728 100.126 1.00 0.00 H +ATOM 1404 HD23 LEU A 90 17.130 7.573 98.773 1.00 0.00 H +ATOM 1405 N LYS A 91 18.966 10.710 95.222 1.00 50.16 N +ATOM 1406 CA LYS A 91 19.422 10.887 93.848 1.00 52.86 C +ATOM 1407 C LYS A 91 19.800 12.349 93.650 1.00 63.07 C +ATOM 1408 O LYS A 91 19.356 13.207 94.417 1.00 65.56 O +ATOM 1409 CB LYS A 91 18.324 10.462 92.863 1.00 49.84 C +ATOM 1410 CG LYS A 91 18.805 9.969 91.502 1.00 57.54 C +ATOM 1411 CD LYS A 91 19.965 8.995 91.601 1.00 66.63 C +ATOM 1412 CE LYS A 91 20.538 8.703 90.219 1.00 57.50 C +ATOM 1413 NZ LYS A 91 21.254 7.399 90.173 1.00 43.25 N1+ +ATOM 1414 H LYS A 91 18.037 10.339 95.363 1.00 0.00 H +ATOM 1415 HA LYS A 91 20.304 10.268 93.685 1.00 0.00 H +ATOM 1416 HB3 LYS A 91 17.629 11.289 92.721 1.00 0.00 H +ATOM 1417 HB2 LYS A 91 17.704 9.694 93.325 1.00 0.00 H +ATOM 1418 HG3 LYS A 91 19.100 10.822 90.891 1.00 0.00 H +ATOM 1419 HG2 LYS A 91 17.977 9.494 90.976 1.00 0.00 H +ATOM 1420 HD3 LYS A 91 19.621 8.066 92.055 1.00 0.00 H +ATOM 1421 HD2 LYS A 91 20.743 9.421 92.234 1.00 0.00 H +ATOM 1422 HE3 LYS A 91 21.222 9.502 89.934 1.00 0.00 H +ATOM 1423 HE2 LYS A 91 19.732 8.700 89.486 1.00 0.00 H +ATOM 1424 HZ1 LYS A 91 21.616 7.246 89.243 1.00 0.00 H +ATOM 1425 HZ2 LYS A 91 22.018 7.410 90.834 1.00 0.00 H +ATOM 1426 HZ3 LYS A 91 20.614 6.655 90.411 1.00 0.00 H +ATOM 1427 N SER A 92 20.608 12.652 92.639 1.00 63.03 N +ATOM 1428 CA SER A 92 21.104 14.011 92.414 1.00 67.42 C +ATOM 1429 C SER A 92 21.744 14.569 93.689 1.00 61.97 C +ATOM 1430 O SER A 92 21.462 15.683 94.137 1.00 57.58 O +ATOM 1431 CB SER A 92 19.991 14.926 91.893 1.00 61.20 C +ATOM 1432 OG SER A 92 18.960 15.106 92.849 1.00 60.29 O +ATOM 1433 H SER A 92 20.901 11.933 91.993 1.00 0.00 H +ATOM 1434 HA SER A 92 21.878 13.960 91.648 1.00 0.00 H +ATOM 1435 HB3 SER A 92 19.570 14.502 90.981 1.00 0.00 H +ATOM 1436 HB2 SER A 92 20.413 15.895 91.628 1.00 0.00 H +ATOM 1437 HG SER A 92 18.284 15.683 92.486 1.00 0.00 H +ATOM 1438 N CYS A 93 22.604 13.730 94.269 1.00 58.19 N +ATOM 1439 CA CYS A 93 23.443 14.072 95.412 1.00 54.68 C +ATOM 1440 C CYS A 93 24.422 12.928 95.635 1.00 56.69 C +ATOM 1441 O CYS A 93 25.146 12.898 96.633 1.00 50.84 O +ATOM 1442 CB CYS A 93 22.609 14.326 96.665 1.00 0.00 C +ATOM 1443 SG CYS A 93 23.373 15.523 97.798 1.00 0.00 S +ATOM 1444 H CYS A 93 22.705 12.788 93.918 1.00 0.00 H +ATOM 1445 HA CYS A 93 24.006 14.975 95.176 1.00 0.00 H +ATOM 1446 HB2 CYS A 93 21.633 14.718 96.379 1.00 0.00 H +ATOM 1447 HB3 CYS A 93 22.480 13.391 97.211 1.00 0.00 H +ATOM 1448 HG CYS A 93 22.586 15.690 98.865 1.00 0.00 H +ATOM 1449 N LYS A 94 24.425 11.979 94.703 1.00 64.55 N +ATOM 1450 CA LYS A 94 25.341 10.857 94.748 1.00 61.98 C +ATOM 1451 C LYS A 94 26.750 11.337 94.402 1.00 56.50 C +ATOM 1452 O LYS A 94 26.916 12.283 93.627 1.00 59.14 O +ATOM 1453 CB LYS A 94 24.904 9.784 93.752 1.00 54.32 C +ATOM 1454 CG LYS A 94 23.497 9.240 93.962 1.00 52.43 C +ATOM 1455 CD LYS A 94 23.477 7.729 93.816 1.00 56.18 C +ATOM 1456 CE LYS A 94 23.681 7.331 92.365 1.00 66.51 C +ATOM 1457 NZ LYS A 94 23.306 5.916 92.106 1.00 57.58 N1+ +ATOM 1458 H LYS A 94 23.774 12.026 93.932 1.00 0.00 H +ATOM 1459 HA LYS A 94 25.342 10.435 95.753 1.00 0.00 H +ATOM 1460 HB3 LYS A 94 25.616 8.959 93.775 1.00 0.00 H +ATOM 1461 HB2 LYS A 94 24.991 10.176 92.739 1.00 0.00 H +ATOM 1462 HG3 LYS A 94 22.823 9.684 93.230 1.00 0.00 H +ATOM 1463 HG2 LYS A 94 23.147 9.513 94.958 1.00 0.00 H +ATOM 1464 HD3 LYS A 94 22.520 7.343 94.167 1.00 0.00 H +ATOM 1465 HD2 LYS A 94 24.269 7.295 94.426 1.00 0.00 H +ATOM 1466 HE3 LYS A 94 24.724 7.485 92.090 1.00 0.00 H +ATOM 1467 HE2 LYS A 94 23.091 7.985 91.723 1.00 0.00 H +ATOM 1468 HZ1 LYS A 94 23.459 5.700 91.131 1.00 0.00 H +ATOM 1469 HZ2 LYS A 94 23.873 5.307 92.678 1.00 0.00 H +ATOM 1470 HZ3 LYS A 94 22.331 5.779 92.332 1.00 0.00 H +ATOM 1471 N PRO A 95 27.789 10.702 94.962 1.00 61.10 N +ATOM 1472 CA PRO A 95 27.712 9.619 95.942 1.00 63.89 C +ATOM 1473 C PRO A 95 27.820 10.141 97.369 1.00 62.04 C +ATOM 1474 O PRO A 95 28.585 9.601 98.166 1.00 58.04 O +ATOM 1475 CB PRO A 95 28.921 8.763 95.583 1.00 63.68 C +ATOM 1476 CG PRO A 95 29.946 9.785 95.170 1.00 56.40 C +ATOM 1477 CD PRO A 95 29.177 10.922 94.516 1.00 57.39 C +ATOM 1478 HA PRO A 95 26.791 9.052 95.812 1.00 0.00 H +ATOM 1479 HB3 PRO A 95 28.675 8.134 94.727 1.00 0.00 H +ATOM 1480 HB2 PRO A 95 29.271 8.243 96.475 1.00 0.00 H +ATOM 1481 HG3 PRO A 95 30.626 9.342 94.443 1.00 0.00 H +ATOM 1482 HG2 PRO A 95 30.462 10.158 96.055 1.00 0.00 H +ATOM 1483 HD2 PRO A 95 29.536 11.873 94.910 1.00 0.00 H +ATOM 1484 HD3 PRO A 95 29.228 10.815 93.432 1.00 0.00 H +ATOM 1485 N ARG A 96 27.060 11.184 97.685 1.00 58.89 N +ATOM 1486 CA ARG A 96 27.192 11.901 98.949 1.00 61.74 C +ATOM 1487 C ARG A 96 25.971 11.596 99.815 1.00 61.35 C +ATOM 1488 O ARG A 96 24.963 12.303 99.772 1.00 67.07 O +ATOM 1489 CB ARG A 96 27.351 13.390 98.698 1.00 59.94 C +ATOM 1490 CG ARG A 96 28.016 14.106 99.832 1.00 59.18 C +ATOM 1491 CD ARG A 96 27.479 15.497 99.983 1.00 65.63 C +ATOM 1492 NE ARG A 96 27.866 16.052 101.271 1.00 72.65 N +ATOM 1493 CZ ARG A 96 27.877 17.349 101.540 1.00 67.58 C +ATOM 1494 NH1 ARG A 96 27.533 18.215 100.597 1.00 68.50 N +ATOM 1495 NH2 ARG A 96 28.245 17.775 102.739 1.00 59.79 N1+ +ATOM 1496 H ARG A 96 26.356 11.510 97.038 1.00 0.00 H +ATOM 1497 HA ARG A 96 28.082 11.538 99.463 1.00 0.00 H +ATOM 1498 HB3 ARG A 96 26.372 13.833 98.515 1.00 0.00 H +ATOM 1499 HB2 ARG A 96 27.927 13.544 97.785 1.00 0.00 H +ATOM 1500 HG3 ARG A 96 29.090 14.149 99.654 1.00 0.00 H +ATOM 1501 HG2 ARG A 96 27.853 13.552 100.756 1.00 0.00 H +ATOM 1502 HD3 ARG A 96 26.392 15.476 99.908 1.00 0.00 H +ATOM 1503 HD2 ARG A 96 27.871 16.126 99.184 1.00 0.00 H +ATOM 1504 HE ARG A 96 28.137 15.387 101.981 1.00 0.00 H +ATOM 1505 HH12 ARG A 96 27.539 19.205 100.794 1.00 0.00 H +ATOM 1506 HH11 ARG A 96 27.265 17.884 99.681 1.00 0.00 H +ATOM 1507 HH22 ARG A 96 28.253 18.764 102.943 1.00 0.00 H +ATOM 1508 HH21 ARG A 96 28.518 17.111 103.449 1.00 0.00 H +ATOM 1509 N TYR A 97 26.077 10.536 100.603 1.00 50.04 N +ATOM 1510 CA TYR A 97 24.992 10.114 101.480 1.00 40.10 C +ATOM 1511 C TYR A 97 25.015 10.938 102.764 1.00 31.52 C +ATOM 1512 O TYR A 97 26.081 11.109 103.363 1.00 36.10 O +ATOM 1513 CB TYR A 97 25.128 8.628 101.794 1.00 43.27 C +ATOM 1514 CG TYR A 97 23.963 8.032 102.542 1.00 39.33 C +ATOM 1515 CD1 TYR A 97 22.727 7.867 101.933 1.00 39.82 C +ATOM 1516 CD2 TYR A 97 24.104 7.623 103.858 1.00 36.70 C +ATOM 1517 CE1 TYR A 97 21.662 7.316 102.621 1.00 39.57 C +ATOM 1518 CE2 TYR A 97 23.050 7.071 104.553 1.00 34.16 C +ATOM 1519 CZ TYR A 97 21.831 6.920 103.931 1.00 36.10 C +ATOM 1520 OH TYR A 97 20.779 6.369 104.626 1.00 33.82 O +ATOM 1521 H TYR A 97 26.929 9.993 100.608 1.00 0.00 H +ATOM 1522 HA TYR A 97 24.043 10.281 100.971 1.00 0.00 H +ATOM 1523 HB3 TYR A 97 26.044 8.461 102.361 1.00 0.00 H +ATOM 1524 HB2 TYR A 97 25.282 8.076 100.867 1.00 0.00 H +ATOM 1525 HD1 TYR A 97 22.586 8.171 100.906 1.00 0.00 H +ATOM 1526 HD2 TYR A 97 25.054 7.734 104.359 1.00 0.00 H +ATOM 1527 HE1 TYR A 97 20.706 7.198 102.132 1.00 0.00 H +ATOM 1528 HE2 TYR A 97 23.183 6.760 105.579 1.00 0.00 H +ATOM 1529 HH TYR A 97 21.063 6.150 105.517 1.00 0.00 H +ATOM 1530 N PRO A 98 23.876 11.458 103.213 1.00 31.86 N +ATOM 1531 CA PRO A 98 23.869 12.341 104.383 1.00 30.04 C +ATOM 1532 C PRO A 98 23.904 11.545 105.675 1.00 28.60 C +ATOM 1533 O PRO A 98 23.684 10.324 105.667 1.00 30.12 O +ATOM 1534 CB PRO A 98 22.545 13.100 104.230 1.00 24.29 C +ATOM 1535 CG PRO A 98 21.649 12.108 103.568 1.00 30.93 C +ATOM 1536 CD PRO A 98 22.528 11.296 102.639 1.00 35.27 C +ATOM 1537 HA PRO A 98 24.710 13.033 104.341 1.00 0.00 H +ATOM 1538 HB3 PRO A 98 22.693 13.951 103.566 1.00 0.00 H +ATOM 1539 HB2 PRO A 98 22.151 13.339 105.218 1.00 0.00 H +ATOM 1540 HG3 PRO A 98 20.894 12.635 102.984 1.00 0.00 H +ATOM 1541 HG2 PRO A 98 21.216 11.451 104.322 1.00 0.00 H +ATOM 1542 HD2 PRO A 98 22.237 10.247 102.694 1.00 0.00 H +ATOM 1543 HD3 PRO A 98 22.505 11.739 101.643 1.00 0.00 H +ATOM 1544 N PRO A 99 24.194 12.195 106.804 1.00 19.99 N +ATOM 1545 CA PRO A 99 24.125 11.499 108.094 1.00 20.29 C +ATOM 1546 C PRO A 99 22.721 10.980 108.372 1.00 13.75 C +ATOM 1547 O PRO A 99 21.727 11.470 107.831 1.00 19.26 O +ATOM 1548 CB PRO A 99 24.533 12.571 109.116 1.00 21.41 C +ATOM 1549 CG PRO A 99 24.589 13.864 108.371 1.00 18.25 C +ATOM 1550 CD PRO A 99 24.749 13.554 106.923 1.00 15.25 C +ATOM 1551 HA PRO A 99 24.838 10.675 108.112 1.00 0.00 H +ATOM 1552 HB3 PRO A 99 25.522 12.337 109.511 1.00 0.00 H +ATOM 1553 HB2 PRO A 99 23.775 12.635 109.896 1.00 0.00 H +ATOM 1554 HG3 PRO A 99 25.445 14.444 108.715 1.00 0.00 H +ATOM 1555 HG2 PRO A 99 23.659 14.412 108.524 1.00 0.00 H +ATOM 1556 HD2 PRO A 99 24.141 14.244 106.338 1.00 0.00 H +ATOM 1557 HD3 PRO A 99 25.810 13.532 106.675 1.00 0.00 H +ATOM 1558 N ASP A 100 22.654 9.967 109.241 1.00 20.29 N +ATOM 1559 CA ASP A 100 21.379 9.319 109.536 1.00 15.36 C +ATOM 1560 C ASP A 100 20.372 10.304 110.118 1.00 14.68 C +ATOM 1561 O ASP A 100 19.169 10.202 109.852 1.00 15.52 O +ATOM 1562 CB ASP A 100 21.597 8.149 110.495 1.00 18.81 C +ATOM 1563 CG ASP A 100 22.375 7.011 109.862 1.00 28.31 C +ATOM 1564 OD1 ASP A 100 22.385 6.913 108.617 1.00 27.66 O +ATOM 1565 OD2 ASP A 100 22.977 6.213 110.611 1.00 33.44 O1- +ATOM 1566 H ASP A 100 23.491 9.641 109.702 1.00 0.00 H +ATOM 1567 HA ASP A 100 20.972 8.926 108.604 1.00 0.00 H +ATOM 1568 HB3 ASP A 100 20.632 7.779 110.841 1.00 0.00 H +ATOM 1569 HB2 ASP A 100 22.126 8.501 111.381 1.00 0.00 H +ATOM 1570 N SER A 101 20.845 11.267 110.912 1.00 11.55 N +ATOM 1571 CA SER A 101 19.936 12.231 111.524 1.00 14.16 C +ATOM 1572 C SER A 101 19.310 13.145 110.478 1.00 15.05 C +ATOM 1573 O SER A 101 18.128 13.495 110.580 1.00 13.77 O +ATOM 1574 CB SER A 101 20.676 13.053 112.578 1.00 15.15 C +ATOM 1575 OG SER A 101 21.641 13.898 111.975 1.00 13.57 O +ATOM 1576 H SER A 101 21.837 11.331 111.092 1.00 0.00 H +ATOM 1577 HA SER A 101 19.136 11.680 112.019 1.00 0.00 H +ATOM 1578 HB3 SER A 101 21.170 12.382 113.281 1.00 0.00 H +ATOM 1579 HB2 SER A 101 19.960 13.658 113.134 1.00 0.00 H +ATOM 1580 HG SER A 101 22.093 14.404 112.654 1.00 0.00 H +ATOM 1581 N VAL A 102 20.086 13.545 109.468 1.00 12.99 N +ATOM 1582 CA VAL A 102 19.552 14.413 108.424 1.00 13.54 C +ATOM 1583 C VAL A 102 18.489 13.682 107.613 1.00 15.53 C +ATOM 1584 O VAL A 102 17.419 14.234 107.326 1.00 16.50 O +ATOM 1585 CB VAL A 102 20.692 14.936 107.531 1.00 14.34 C +ATOM 1586 CG1 VAL A 102 20.140 15.484 106.225 1.00 16.20 C +ATOM 1587 CG2 VAL A 102 21.491 16.003 108.264 1.00 12.98 C +ATOM 1588 H VAL A 102 21.050 13.247 109.423 1.00 0.00 H +ATOM 1589 HA VAL A 102 19.080 15.269 108.905 1.00 0.00 H +ATOM 1590 HB VAL A 102 21.358 14.104 107.301 1.00 0.00 H +ATOM 1591 HG11 VAL A 102 20.961 15.849 105.608 1.00 0.00 H +ATOM 1592 HG12 VAL A 102 19.610 14.693 105.694 1.00 0.00 H +ATOM 1593 HG13 VAL A 102 19.453 16.303 106.436 1.00 0.00 H +ATOM 1594 HG21 VAL A 102 22.293 16.363 107.620 1.00 0.00 H +ATOM 1595 HG22 VAL A 102 20.835 16.833 108.525 1.00 0.00 H +ATOM 1596 HG23 VAL A 102 21.918 15.578 109.172 1.00 0.00 H +ATOM 1597 N ARG A 103 18.759 12.429 107.237 1.00 13.18 N +ATOM 1598 CA ARG A 103 17.757 11.642 106.524 1.00 15.67 C +ATOM 1599 C ARG A 103 16.531 11.396 107.395 1.00 17.26 C +ATOM 1600 O ARG A 103 15.400 11.362 106.895 1.00 13.31 O +ATOM 1601 CB ARG A 103 18.360 10.316 106.055 1.00 18.78 C +ATOM 1602 CG ARG A 103 17.350 9.388 105.396 1.00 29.87 C +ATOM 1603 CD ARG A 103 18.016 8.336 104.525 1.00 33.18 C +ATOM 1604 NE ARG A 103 17.038 7.627 103.704 1.00 32.68 N +ATOM 1605 CZ ARG A 103 17.248 6.441 103.141 1.00 30.51 C +ATOM 1606 NH1 ARG A 103 18.408 5.821 103.310 1.00 33.57 N +ATOM 1607 NH2 ARG A 103 16.298 5.874 102.411 1.00 24.90 N1+ +ATOM 1608 H ARG A 103 19.660 12.022 107.446 1.00 0.00 H +ATOM 1609 HA ARG A 103 17.444 12.205 105.645 1.00 0.00 H +ATOM 1610 HB3 ARG A 103 18.819 9.807 106.903 1.00 0.00 H +ATOM 1611 HB2 ARG A 103 19.175 10.515 105.360 1.00 0.00 H +ATOM 1612 HG3 ARG A 103 16.659 9.975 104.791 1.00 0.00 H +ATOM 1613 HG2 ARG A 103 16.753 8.897 106.165 1.00 0.00 H +ATOM 1614 HD3 ARG A 103 18.544 7.622 105.158 1.00 0.00 H +ATOM 1615 HD2 ARG A 103 18.754 8.813 103.880 1.00 0.00 H +ATOM 1616 HE ARG A 103 16.154 8.097 103.576 1.00 0.00 H +ATOM 1617 HH12 ARG A 103 18.566 4.920 102.882 1.00 0.00 H +ATOM 1618 HH11 ARG A 103 19.133 6.250 103.867 1.00 0.00 H +ATOM 1619 HH22 ARG A 103 16.459 4.973 101.984 1.00 0.00 H +ATOM 1620 HH21 ARG A 103 15.413 6.343 102.282 1.00 0.00 H +ATOM 1621 N LEU A 104 16.735 11.227 108.703 1.00 12.46 N +ATOM 1622 CA LEU A 104 15.609 11.037 109.611 1.00 8.53 C +ATOM 1623 C LEU A 104 14.721 12.275 109.648 1.00 11.49 C +ATOM 1624 O LEU A 104 13.493 12.176 109.543 1.00 12.78 O +ATOM 1625 CB LEU A 104 16.115 10.692 111.012 1.00 10.86 C +ATOM 1626 CG LEU A 104 15.035 10.391 112.054 1.00 11.24 C +ATOM 1627 CD1 LEU A 104 14.201 9.194 111.627 1.00 10.21 C +ATOM 1628 CD2 LEU A 104 15.651 10.159 113.427 1.00 10.58 C +ATOM 1629 H LEU A 104 17.675 11.230 109.072 1.00 0.00 H +ATOM 1630 HA LEU A 104 15.014 10.200 109.247 1.00 0.00 H +ATOM 1631 HB3 LEU A 104 16.749 11.501 111.375 1.00 0.00 H +ATOM 1632 HB2 LEU A 104 16.800 9.846 110.949 1.00 0.00 H +ATOM 1633 HG LEU A 104 14.376 11.257 112.120 1.00 0.00 H +ATOM 1634 HD11 LEU A 104 13.438 8.995 112.380 1.00 0.00 H +ATOM 1635 HD12 LEU A 104 13.721 9.407 110.672 1.00 0.00 H +ATOM 1636 HD13 LEU A 104 14.845 8.321 111.523 1.00 0.00 H +ATOM 1637 HD21 LEU A 104 14.862 9.947 114.149 1.00 0.00 H +ATOM 1638 HD22 LEU A 104 16.336 9.313 113.380 1.00 0.00 H +ATOM 1639 HD23 LEU A 104 16.196 11.051 113.737 1.00 0.00 H +ATOM 1640 N LEU A 105 15.328 13.457 109.792 1.00 8.92 N +ATOM 1641 CA LEU A 105 14.539 14.684 109.846 1.00 13.95 C +ATOM 1642 C LEU A 105 13.854 14.973 108.517 1.00 10.83 C +ATOM 1643 O LEU A 105 12.757 15.543 108.501 1.00 13.84 O +ATOM 1644 CB LEU A 105 15.416 15.868 110.255 1.00 9.98 C +ATOM 1645 CG LEU A 105 14.645 17.178 110.436 1.00 8.93 C +ATOM 1646 CD1 LEU A 105 13.669 17.060 111.596 1.00 11.85 C +ATOM 1647 CD2 LEU A 105 15.583 18.354 110.638 1.00 12.08 C +ATOM 1648 H LEU A 105 16.334 13.502 109.864 1.00 0.00 H +ATOM 1649 HA LEU A 105 13.767 14.557 110.604 1.00 0.00 H +ATOM 1650 HB3 LEU A 105 16.201 16.010 109.512 1.00 0.00 H +ATOM 1651 HB2 LEU A 105 15.941 15.627 111.179 1.00 0.00 H +ATOM 1652 HG LEU A 105 14.069 17.358 109.528 1.00 0.00 H +ATOM 1653 HD11 LEU A 105 13.128 17.999 111.713 1.00 0.00 H +ATOM 1654 HD12 LEU A 105 12.961 16.256 111.396 1.00 0.00 H +ATOM 1655 HD13 LEU A 105 14.217 16.841 112.512 1.00 0.00 H +ATOM 1656 HD21 LEU A 105 15.000 19.267 110.763 1.00 0.00 H +ATOM 1657 HD22 LEU A 105 16.190 18.186 111.528 1.00 0.00 H +ATOM 1658 HD23 LEU A 105 16.233 18.455 109.769 1.00 0.00 H +ATOM 1659 N GLY A 106 14.479 14.594 107.401 1.00 9.81 N +ATOM 1660 CA GLY A 106 13.825 14.757 106.113 1.00 13.54 C +ATOM 1661 C GLY A 106 12.507 14.011 106.035 1.00 16.90 C +ATOM 1662 O GLY A 106 11.522 14.525 105.501 1.00 14.82 O +ATOM 1663 H GLY A 106 15.405 14.194 107.452 1.00 0.00 H +ATOM 1664 HA3 GLY A 106 14.488 14.405 105.323 1.00 0.00 H +ATOM 1665 HA2 GLY A 106 13.653 15.817 105.925 1.00 0.00 H +ATOM 1666 N ARG A 107 12.467 12.795 106.583 1.00 14.21 N +ATOM 1667 CA ARG A 107 11.226 12.030 106.591 1.00 14.60 C +ATOM 1668 C ARG A 107 10.235 12.577 107.610 1.00 13.69 C +ATOM 1669 O ARG A 107 9.021 12.435 107.427 1.00 12.24 O +ATOM 1670 CB ARG A 107 11.523 10.558 106.864 1.00 12.92 C +ATOM 1671 CG ARG A 107 12.257 9.874 105.726 1.00 16.91 C +ATOM 1672 CD ARG A 107 12.715 8.484 106.116 1.00 23.96 C +ATOM 1673 NE ARG A 107 12.938 7.641 104.946 1.00 21.18 N +ATOM 1674 CZ ARG A 107 12.149 6.632 104.593 1.00 26.84 C +ATOM 1675 NH1 ARG A 107 11.080 6.338 105.321 1.00 22.48 N +ATOM 1676 NH2 ARG A 107 12.428 5.918 103.512 1.00 31.49 N1+ +ATOM 1677 H ARG A 107 13.300 12.399 106.996 1.00 0.00 H +ATOM 1678 HA ARG A 107 10.773 12.107 105.602 1.00 0.00 H +ATOM 1679 HB3 ARG A 107 10.589 10.031 107.061 1.00 0.00 H +ATOM 1680 HB2 ARG A 107 12.111 10.471 107.778 1.00 0.00 H +ATOM 1681 HG3 ARG A 107 13.121 10.474 105.439 1.00 0.00 H +ATOM 1682 HG2 ARG A 107 11.601 9.810 104.858 1.00 0.00 H +ATOM 1683 HD3 ARG A 107 11.965 8.022 106.758 1.00 0.00 H +ATOM 1684 HD2 ARG A 107 13.637 8.555 106.693 1.00 0.00 H +ATOM 1685 HE ARG A 107 13.751 7.864 104.390 1.00 0.00 H +ATOM 1686 HH12 ARG A 107 10.481 5.571 105.052 1.00 0.00 H +ATOM 1687 HH11 ARG A 107 10.865 6.881 106.145 1.00 0.00 H +ATOM 1688 HH22 ARG A 107 11.828 5.151 103.244 1.00 0.00 H +ATOM 1689 HH21 ARG A 107 13.241 6.141 102.956 1.00 0.00 H +ATOM 1690 N VAL A 108 10.727 13.196 108.686 1.00 16.48 N +ATOM 1691 CA VAL A 108 9.833 13.866 109.627 1.00 14.96 C +ATOM 1692 C VAL A 108 9.107 15.012 108.938 1.00 15.78 C +ATOM 1693 O VAL A 108 7.894 15.191 109.104 1.00 16.74 O +ATOM 1694 CB VAL A 108 10.618 14.358 110.857 1.00 10.93 C +ATOM 1695 CG1 VAL A 108 9.710 15.149 111.788 1.00 10.95 C +ATOM 1696 CG2 VAL A 108 11.240 13.189 111.589 1.00 14.93 C +ATOM 1697 H VAL A 108 11.723 13.203 108.853 1.00 0.00 H +ATOM 1698 HA VAL A 108 9.089 13.144 109.964 1.00 0.00 H +ATOM 1699 HB VAL A 108 11.418 15.015 110.515 1.00 0.00 H +ATOM 1700 HG11 VAL A 108 10.282 15.489 112.652 1.00 0.00 H +ATOM 1701 HG12 VAL A 108 9.307 16.012 111.257 1.00 0.00 H +ATOM 1702 HG13 VAL A 108 8.890 14.514 112.123 1.00 0.00 H +ATOM 1703 HG21 VAL A 108 11.791 13.554 112.456 1.00 0.00 H +ATOM 1704 HG22 VAL A 108 10.456 12.507 111.918 1.00 0.00 H +ATOM 1705 HG23 VAL A 108 11.922 12.662 110.921 1.00 0.00 H +ATOM 1706 N VAL A 109 9.836 15.797 108.144 1.00 16.19 N +ATOM 1707 CA VAL A 109 9.238 16.946 107.472 1.00 15.67 C +ATOM 1708 C VAL A 109 8.205 16.488 106.449 1.00 18.51 C +ATOM 1709 O VAL A 109 7.093 17.023 106.386 1.00 20.23 O +ATOM 1710 CB VAL A 109 10.334 17.812 106.824 1.00 18.58 C +ATOM 1711 CG1 VAL A 109 9.722 18.824 105.867 1.00 24.97 C +ATOM 1712 CG2 VAL A 109 11.161 18.509 107.896 1.00 15.21 C +ATOM 1713 H VAL A 109 10.816 15.600 108.001 1.00 0.00 H +ATOM 1714 HA VAL A 109 8.728 17.550 108.222 1.00 0.00 H +ATOM 1715 HB VAL A 109 10.994 17.158 106.254 1.00 0.00 H +ATOM 1716 HG11 VAL A 109 10.513 19.426 105.420 1.00 0.00 H +ATOM 1717 HG12 VAL A 109 9.177 18.299 105.082 1.00 0.00 H +ATOM 1718 HG13 VAL A 109 9.037 19.473 106.413 1.00 0.00 H +ATOM 1719 HG21 VAL A 109 11.932 19.117 107.423 1.00 0.00 H +ATOM 1720 HG22 VAL A 109 10.514 19.147 108.498 1.00 0.00 H +ATOM 1721 HG23 VAL A 109 11.631 17.762 108.536 1.00 0.00 H +ATOM 1722 N PHE A 110 8.553 15.484 105.639 1.00 16.98 N +ATOM 1723 CA PHE A 110 7.625 15.006 104.618 1.00 20.12 C +ATOM 1724 C PHE A 110 6.374 14.404 105.245 1.00 17.49 C +ATOM 1725 O PHE A 110 5.261 14.603 104.743 1.00 19.59 O +ATOM 1726 CB PHE A 110 8.314 13.985 103.712 1.00 17.10 C +ATOM 1727 CG PHE A 110 9.479 14.542 102.942 1.00 24.10 C +ATOM 1728 CD1 PHE A 110 9.452 15.842 102.464 1.00 25.25 C +ATOM 1729 CD2 PHE A 110 10.595 13.763 102.687 1.00 21.91 C +ATOM 1730 CE1 PHE A 110 10.520 16.356 101.754 1.00 20.78 C +ATOM 1731 CE2 PHE A 110 11.666 14.272 101.979 1.00 22.24 C +ATOM 1732 CZ PHE A 110 11.627 15.570 101.511 1.00 25.21 C +ATOM 1733 H PHE A 110 9.461 15.052 105.731 1.00 0.00 H +ATOM 1734 HA PHE A 110 7.324 15.856 104.006 1.00 0.00 H +ATOM 1735 HB3 PHE A 110 7.585 13.570 103.015 1.00 0.00 H +ATOM 1736 HB2 PHE A 110 8.648 13.138 104.311 1.00 0.00 H +ATOM 1737 HD1 PHE A 110 8.589 16.466 102.645 1.00 0.00 H +ATOM 1738 HD2 PHE A 110 10.635 12.744 103.043 1.00 0.00 H +ATOM 1739 HE1 PHE A 110 10.487 17.372 101.390 1.00 0.00 H +ATOM 1740 HE2 PHE A 110 12.532 13.655 101.792 1.00 0.00 H +ATOM 1741 HZ PHE A 110 12.462 15.970 100.955 1.00 0.00 H +ATOM 1742 N LYS A 111 6.533 13.667 106.347 1.00 20.94 N +ATOM 1743 CA LYS A 111 5.375 13.060 106.995 1.00 19.77 C +ATOM 1744 C LYS A 111 4.494 14.114 107.653 1.00 18.72 C +ATOM 1745 O LYS A 111 3.262 14.013 107.614 1.00 19.61 O +ATOM 1746 CB LYS A 111 5.831 12.020 108.018 1.00 19.55 C +ATOM 1747 CG LYS A 111 4.706 11.169 108.580 1.00 21.70 C +ATOM 1748 CD LYS A 111 4.741 9.769 107.991 1.00 32.05 C +ATOM 1749 CE LYS A 111 3.963 8.785 108.846 1.00 30.13 C +ATOM 1750 NZ LYS A 111 4.653 7.470 108.944 1.00 44.82 N1+ +ATOM 1751 H LYS A 111 7.456 13.529 106.733 1.00 0.00 H +ATOM 1752 HA LYS A 111 4.786 12.552 106.232 1.00 0.00 H +ATOM 1753 HB3 LYS A 111 6.349 12.521 108.836 1.00 0.00 H +ATOM 1754 HB2 LYS A 111 6.582 11.373 107.565 1.00 0.00 H +ATOM 1755 HG3 LYS A 111 3.748 11.636 108.350 1.00 0.00 H +ATOM 1756 HG2 LYS A 111 4.803 11.109 109.664 1.00 0.00 H +ATOM 1757 HD3 LYS A 111 5.776 9.437 107.906 1.00 0.00 H +ATOM 1758 HD2 LYS A 111 4.320 9.788 106.986 1.00 0.00 H +ATOM 1759 HE3 LYS A 111 2.969 8.642 108.421 1.00 0.00 H +ATOM 1760 HE2 LYS A 111 3.829 9.200 109.845 1.00 0.00 H +ATOM 1761 HZ1 LYS A 111 4.107 6.845 109.519 1.00 0.00 H +ATOM 1762 HZ2 LYS A 111 4.757 7.074 108.021 1.00 0.00 H +ATOM 1763 HZ3 LYS A 111 5.565 7.598 109.359 1.00 0.00 H +ATOM 1764 N LEU A 112 5.103 15.137 108.258 1.00 18.09 N +ATOM 1765 CA LEU A 112 4.318 16.204 108.868 1.00 15.73 C +ATOM 1766 C LEU A 112 3.647 17.079 107.817 1.00 15.48 C +ATOM 1767 O LEU A 112 2.584 17.654 108.076 1.00 23.10 O +ATOM 1768 CB LEU A 112 5.202 17.057 109.777 1.00 15.21 C +ATOM 1769 CG LEU A 112 5.642 16.433 111.103 1.00 15.87 C +ATOM 1770 CD1 LEU A 112 6.489 17.413 111.899 1.00 11.95 C +ATOM 1771 CD2 LEU A 112 4.436 15.979 111.912 1.00 16.34 C +ATOM 1772 H LEU A 112 6.112 15.174 108.295 1.00 0.00 H +ATOM 1773 HA LEU A 112 3.540 15.748 109.480 1.00 0.00 H +ATOM 1774 HB3 LEU A 112 4.703 18.005 109.975 1.00 0.00 H +ATOM 1775 HB2 LEU A 112 6.084 17.377 109.222 1.00 0.00 H +ATOM 1776 HG LEU A 112 6.252 15.558 110.881 1.00 0.00 H +ATOM 1777 HD11 LEU A 112 6.793 16.952 112.839 1.00 0.00 H +ATOM 1778 HD12 LEU A 112 7.375 17.680 111.323 1.00 0.00 H +ATOM 1779 HD13 LEU A 112 5.907 18.311 112.107 1.00 0.00 H +ATOM 1780 HD21 LEU A 112 4.772 15.539 112.851 1.00 0.00 H +ATOM 1781 HD22 LEU A 112 3.795 16.836 112.122 1.00 0.00 H +ATOM 1782 HD23 LEU A 112 3.875 15.237 111.344 1.00 0.00 H +ATOM 1783 N MET A 113 4.245 17.185 106.629 1.00 20.64 N +ATOM 1784 CA MET A 113 3.695 18.046 105.588 1.00 21.76 C +ATOM 1785 C MET A 113 2.609 17.343 104.782 1.00 22.94 C +ATOM 1786 O MET A 113 1.582 17.951 104.460 1.00 26.64 O +ATOM 1787 CB MET A 113 4.811 18.526 104.658 1.00 20.35 C +ATOM 1788 CG MET A 113 5.686 19.631 105.230 1.00 20.74 C +ATOM 1789 SD MET A 113 4.749 21.112 105.647 1.00 42.01 S +ATOM 1790 CE MET A 113 4.645 21.905 104.044 1.00 31.42 C +ATOM 1791 H MET A 113 5.090 16.665 106.441 1.00 0.00 H +ATOM 1792 HA MET A 113 3.252 18.919 106.067 1.00 0.00 H +ATOM 1793 HB3 MET A 113 4.377 18.861 103.716 1.00 0.00 H +ATOM 1794 HB2 MET A 113 5.437 17.679 104.378 1.00 0.00 H +ATOM 1795 HG3 MET A 113 6.465 19.885 104.511 1.00 0.00 H +ATOM 1796 HG2 MET A 113 6.198 19.264 106.119 1.00 0.00 H +ATOM 1797 HE1 MET A 113 4.091 22.839 104.136 1.00 0.00 H +ATOM 1798 HE2 MET A 113 5.649 22.113 103.675 1.00 0.00 H +ATOM 1799 HE3 MET A 113 4.131 21.246 103.345 1.00 0.00 H +ATOM 1800 N ASP A 114 2.814 16.067 104.447 1.00 22.78 N +ATOM 1801 CA ASP A 114 1.945 15.366 103.513 1.00 21.28 C +ATOM 1802 C ASP A 114 1.177 14.201 104.117 1.00 26.92 C +ATOM 1803 O ASP A 114 0.164 13.794 103.539 1.00 24.56 O +ATOM 1804 CB ASP A 114 2.764 14.844 102.323 1.00 17.12 C +ATOM 1805 CG ASP A 114 3.545 15.941 101.636 1.00 23.68 C +ATOM 1806 OD1 ASP A 114 3.063 17.093 101.604 1.00 31.88 O +ATOM 1807 OD2 ASP A 114 4.652 15.656 101.143 1.00 22.99 O1- +ATOM 1808 H ASP A 114 3.591 15.559 104.845 1.00 0.00 H +ATOM 1809 HA ASP A 114 1.218 16.083 103.130 1.00 0.00 H +ATOM 1810 HB3 ASP A 114 2.096 14.370 101.604 1.00 0.00 H +ATOM 1811 HB2 ASP A 114 3.451 14.071 102.667 1.00 0.00 H +ATOM 1812 N GLY A 115 1.623 13.653 105.243 1.00 21.64 N +ATOM 1813 CA GLY A 115 0.930 12.543 105.854 1.00 25.64 C +ATOM 1814 C GLY A 115 -0.184 12.985 106.782 1.00 28.43 C +ATOM 1815 O GLY A 115 -0.210 14.113 107.272 1.00 23.61 O +ATOM 1816 H GLY A 115 2.458 14.012 105.683 1.00 0.00 H +ATOM 1817 HA3 GLY A 115 1.642 11.932 106.409 1.00 0.00 H +ATOM 1818 HA2 GLY A 115 0.519 11.900 105.076 1.00 0.00 H +ATOM 1819 N ALA A 116 -1.120 12.070 107.021 1.00 20.42 N +ATOM 1820 CA ALA A 116 -2.229 12.339 107.913 1.00 20.63 C +ATOM 1821 C ALA A 116 -1.743 12.357 109.358 1.00 25.52 C +ATOM 1822 O ALA A 116 -0.604 11.980 109.645 1.00 18.22 O +ATOM 1823 CB ALA A 116 -3.324 11.292 107.725 1.00 18.27 C +ATOM 1824 H ALA A 116 -1.066 11.165 106.576 1.00 0.00 H +ATOM 1825 HA ALA A 116 -2.640 13.319 107.672 1.00 0.00 H +ATOM 1826 HB1 ALA A 116 -4.152 11.506 108.401 1.00 0.00 H +ATOM 1827 HB2 ALA A 116 -3.680 11.319 106.695 1.00 0.00 H +ATOM 1828 HB3 ALA A 116 -2.923 10.302 107.944 1.00 0.00 H +ATOM 1829 N PRO A 117 -2.580 12.837 110.289 1.00 29.90 N +ATOM 1830 CA PRO A 117 -2.282 12.674 111.718 1.00 31.17 C +ATOM 1831 C PRO A 117 -1.748 11.297 112.074 1.00 23.52 C +ATOM 1832 O PRO A 117 -2.386 10.276 111.797 1.00 22.86 O +ATOM 1833 CB PRO A 117 -3.639 12.936 112.378 1.00 38.88 C +ATOM 1834 CG PRO A 117 -4.391 13.821 111.391 1.00 35.11 C +ATOM 1835 CD PRO A 117 -3.652 13.823 110.075 1.00 27.35 C +ATOM 1836 HA PRO A 117 -1.569 13.436 112.032 1.00 0.00 H +ATOM 1837 HB3 PRO A 117 -3.488 13.481 113.310 1.00 0.00 H +ATOM 1838 HB2 PRO A 117 -4.172 11.992 112.496 1.00 0.00 H +ATOM 1839 HG3 PRO A 117 -4.442 14.838 111.781 1.00 0.00 H +ATOM 1840 HG2 PRO A 117 -5.396 13.426 111.242 1.00 0.00 H +ATOM 1841 HD2 PRO A 117 -4.317 13.466 109.288 1.00 0.00 H +ATOM 1842 HD3 PRO A 117 -3.210 14.806 109.912 1.00 0.00 H +ATOM 1843 N SER A 118 -0.568 11.266 112.687 1.00 20.63 N +ATOM 1844 CA SER A 118 0.135 10.021 112.957 1.00 22.57 C +ATOM 1845 C SER A 118 -0.282 9.458 114.308 1.00 20.19 C +ATOM 1846 O SER A 118 -0.345 10.189 115.302 1.00 16.60 O +ATOM 1847 CB SER A 118 1.648 10.242 112.921 1.00 11.68 C +ATOM 1848 OG SER A 118 2.339 9.084 113.354 1.00 17.40 O +ATOM 1849 H SER A 118 -0.130 12.127 112.982 1.00 0.00 H +ATOM 1850 HA SER A 118 -0.129 9.299 112.184 1.00 0.00 H +ATOM 1851 HB3 SER A 118 1.908 11.082 113.566 1.00 0.00 H +ATOM 1852 HB2 SER A 118 1.955 10.489 111.905 1.00 0.00 H +ATOM 1853 HG SER A 118 3.285 9.245 113.323 1.00 0.00 H +ATOM 1854 N GLU A 119 -0.564 8.153 114.335 1.00 19.96 N +ATOM 1855 CA GLU A 119 -0.872 7.476 115.591 1.00 23.07 C +ATOM 1856 C GLU A 119 0.280 7.582 116.582 1.00 19.30 C +ATOM 1857 O GLU A 119 0.060 7.540 117.798 1.00 16.33 O +ATOM 1858 CB GLU A 119 -1.202 6.008 115.320 1.00 23.52 C +ATOM 1859 CG GLU A 119 -1.812 5.262 116.497 1.00 35.39 C +ATOM 1860 CD GLU A 119 -3.210 5.738 116.832 1.00 48.07 C +ATOM 1861 OE1 GLU A 119 -3.961 6.081 115.893 1.00 40.53 O +ATOM 1862 OE2 GLU A 119 -3.560 5.765 118.031 1.00 36.08 O1- +ATOM 1863 H GLU A 119 -0.566 7.619 113.478 1.00 0.00 H +ATOM 1864 HA GLU A 119 -1.749 7.950 116.031 1.00 0.00 H +ATOM 1865 HB3 GLU A 119 -0.300 5.490 114.993 1.00 0.00 H +ATOM 1866 HB2 GLU A 119 -1.873 5.941 114.464 1.00 0.00 H +ATOM 1867 HG3 GLU A 119 -1.171 5.378 117.371 1.00 0.00 H +ATOM 1868 HG2 GLU A 119 -1.836 4.195 116.276 1.00 0.00 H +ATOM 1869 N SER A 120 1.511 7.723 116.084 1.00 18.13 N +ATOM 1870 CA SER A 120 2.680 7.794 116.950 1.00 15.58 C +ATOM 1871 C SER A 120 2.713 9.059 117.798 1.00 18.82 C +ATOM 1872 O SER A 120 3.435 9.097 118.800 1.00 15.10 O +ATOM 1873 CB SER A 120 3.954 7.706 116.109 1.00 19.81 C +ATOM 1874 OG SER A 120 4.128 8.879 115.335 1.00 15.39 O +ATOM 1875 H SER A 120 1.648 7.783 115.085 1.00 0.00 H +ATOM 1876 HA SER A 120 2.657 6.936 117.622 1.00 0.00 H +ATOM 1877 HB3 SER A 120 3.894 6.841 115.449 1.00 0.00 H +ATOM 1878 HB2 SER A 120 4.814 7.574 116.766 1.00 0.00 H +ATOM 1879 HG SER A 120 4.932 8.804 114.815 1.00 0.00 H +ATOM 1880 N GLU A 121 1.956 10.092 117.426 1.00 18.12 N +ATOM 1881 CA GLU A 121 1.939 11.352 118.155 1.00 15.27 C +ATOM 1882 C GLU A 121 0.704 11.500 119.037 1.00 16.83 C +ATOM 1883 O GLU A 121 0.311 12.626 119.360 1.00 20.30 O +ATOM 1884 CB GLU A 121 2.033 12.528 117.181 1.00 10.96 C +ATOM 1885 CG GLU A 121 3.316 12.566 116.369 1.00 12.09 C +ATOM 1886 CD GLU A 121 3.441 13.832 115.545 1.00 17.46 C +ATOM 1887 OE1 GLU A 121 2.532 14.103 114.732 1.00 13.26 O +ATOM 1888 OE2 GLU A 121 4.447 14.554 115.708 1.00 16.23 O1- +ATOM 1889 H GLU A 121 1.365 10.017 116.610 1.00 0.00 H +ATOM 1890 HA GLU A 121 2.817 11.379 118.800 1.00 0.00 H +ATOM 1891 HB3 GLU A 121 1.926 13.463 117.732 1.00 0.00 H +ATOM 1892 HB2 GLU A 121 1.178 12.506 116.505 1.00 0.00 H +ATOM 1893 HG3 GLU A 121 3.353 11.699 115.709 1.00 0.00 H +ATOM 1894 HG2 GLU A 121 4.172 12.484 117.039 1.00 0.00 H +ATOM 1895 N LYS A 122 0.093 10.385 119.443 1.00 17.05 N +ATOM 1896 CA LYS A 122 -1.165 10.450 120.180 1.00 17.14 C +ATOM 1897 C LYS A 122 -0.972 11.078 121.557 1.00 16.69 C +ATOM 1898 O LYS A 122 -1.731 11.969 121.954 1.00 17.77 O +ATOM 1899 CB LYS A 122 -1.769 9.050 120.296 1.00 18.03 C +ATOM 1900 CG LYS A 122 -2.959 8.954 121.234 1.00 26.49 C +ATOM 1901 CD LYS A 122 -3.552 7.555 121.213 1.00 24.80 C +ATOM 1902 CE LYS A 122 -5.048 7.591 120.946 1.00 39.52 C +ATOM 1903 NZ LYS A 122 -5.832 7.486 122.206 1.00 45.68 N1+ +ATOM 1904 H LYS A 122 0.501 9.483 119.241 1.00 0.00 H +ATOM 1905 HA LYS A 122 -1.858 11.074 119.616 1.00 0.00 H +ATOM 1906 HB3 LYS A 122 -0.998 8.350 120.618 1.00 0.00 H +ATOM 1907 HB2 LYS A 122 -2.061 8.699 119.306 1.00 0.00 H +ATOM 1908 HG3 LYS A 122 -3.719 9.675 120.931 1.00 0.00 H +ATOM 1909 HG2 LYS A 122 -2.643 9.199 122.248 1.00 0.00 H +ATOM 1910 HD3 LYS A 122 -3.366 7.068 122.170 1.00 0.00 H +ATOM 1911 HD2 LYS A 122 -3.060 6.964 120.441 1.00 0.00 H +ATOM 1912 HE3 LYS A 122 -5.318 6.770 120.282 1.00 0.00 H +ATOM 1913 HE2 LYS A 122 -5.303 8.520 120.436 1.00 0.00 H +ATOM 1914 HZ1 LYS A 122 -6.819 7.513 121.992 1.00 0.00 H +ATOM 1915 HZ2 LYS A 122 -5.612 6.615 122.668 1.00 0.00 H +ATOM 1916 HZ3 LYS A 122 -5.598 8.258 122.814 1.00 0.00 H +ATOM 1917 N LEU A 123 0.040 10.629 122.300 1.00 21.16 N +ATOM 1918 CA LEU A 123 0.311 11.163 123.630 1.00 14.14 C +ATOM 1919 C LEU A 123 1.223 12.378 123.612 1.00 16.66 C +ATOM 1920 O LEU A 123 1.222 13.154 124.575 1.00 14.43 O +ATOM 1921 CB LEU A 123 0.957 10.091 124.514 1.00 15.84 C +ATOM 1922 CG LEU A 123 0.276 8.728 124.605 1.00 17.00 C +ATOM 1923 CD1 LEU A 123 1.093 7.782 125.471 1.00 18.65 C +ATOM 1924 CD2 LEU A 123 -1.127 8.882 125.156 1.00 19.92 C +ATOM 1925 H LEU A 123 0.643 9.900 121.945 1.00 0.00 H +ATOM 1926 HA LEU A 123 -0.637 11.454 124.082 1.00 0.00 H +ATOM 1927 HB3 LEU A 123 1.091 10.491 125.519 1.00 0.00 H +ATOM 1928 HB2 LEU A 123 1.994 9.952 124.207 1.00 0.00 H +ATOM 1929 HG LEU A 123 0.209 8.307 123.602 1.00 0.00 H +ATOM 1930 HD11 LEU A 123 0.593 6.815 125.525 1.00 0.00 H +ATOM 1931 HD12 LEU A 123 2.084 7.654 125.035 1.00 0.00 H +ATOM 1932 HD13 LEU A 123 1.188 8.198 126.474 1.00 0.00 H +ATOM 1933 HD21 LEU A 123 -1.604 7.904 125.217 1.00 0.00 H +ATOM 1934 HD22 LEU A 123 -1.081 9.325 126.151 1.00 0.00 H +ATOM 1935 HD23 LEU A 123 -1.708 9.528 124.498 1.00 0.00 H +ATOM 1936 N TYR A 124 1.994 12.555 122.544 1.00 16.85 N +ATOM 1937 CA TYR A 124 3.080 13.523 122.506 1.00 12.79 C +ATOM 1938 C TYR A 124 3.479 13.685 121.051 1.00 14.43 C +ATOM 1939 O TYR A 124 3.718 12.689 120.365 1.00 11.92 O +ATOM 1940 CB TYR A 124 4.266 13.033 123.342 1.00 12.47 C +ATOM 1941 CG TYR A 124 5.056 14.095 124.077 1.00 16.76 C +ATOM 1942 CD1 TYR A 124 4.421 15.088 124.812 1.00 14.78 C +ATOM 1943 CD2 TYR A 124 6.445 14.082 124.056 1.00 15.63 C +ATOM 1944 CE1 TYR A 124 5.153 16.047 125.495 1.00 11.12 C +ATOM 1945 CE2 TYR A 124 7.183 15.035 124.732 1.00 13.44 C +ATOM 1946 CZ TYR A 124 6.534 16.015 125.450 1.00 18.25 C +ATOM 1947 OH TYR A 124 7.270 16.963 126.123 1.00 12.61 O +ATOM 1948 H TYR A 124 1.838 12.005 121.712 1.00 0.00 H +ATOM 1949 HA TYR A 124 2.730 14.479 122.896 1.00 0.00 H +ATOM 1950 HB3 TYR A 124 4.940 12.459 122.707 1.00 0.00 H +ATOM 1951 HB2 TYR A 124 3.918 12.286 124.055 1.00 0.00 H +ATOM 1952 HD1 TYR A 124 3.342 15.120 124.857 1.00 0.00 H +ATOM 1953 HD2 TYR A 124 6.970 13.316 123.504 1.00 0.00 H +ATOM 1954 HE1 TYR A 124 4.644 16.815 126.059 1.00 0.00 H +ATOM 1955 HE2 TYR A 124 8.262 15.008 124.695 1.00 0.00 H +ATOM 1956 HH TYR A 124 8.206 16.797 125.988 1.00 0.00 H +ATOM 1957 N SER A 125 3.535 14.924 120.581 1.00 14.83 N +ATOM 1958 CA SER A 125 3.834 15.199 119.186 1.00 17.98 C +ATOM 1959 C SER A 125 5.298 15.589 119.024 1.00 15.09 C +ATOM 1960 O SER A 125 6.016 15.831 119.997 1.00 14.58 O +ATOM 1961 CB SER A 125 2.925 16.308 118.647 1.00 11.55 C +ATOM 1962 OG SER A 125 3.273 17.564 119.203 1.00 22.09 O +ATOM 1963 H SER A 125 3.368 15.706 121.198 1.00 0.00 H +ATOM 1964 HA SER A 125 3.652 14.292 118.609 1.00 0.00 H +ATOM 1965 HB3 SER A 125 1.888 16.078 118.891 1.00 0.00 H +ATOM 1966 HB2 SER A 125 3.014 16.354 117.562 1.00 0.00 H +ATOM 1967 HG SER A 125 2.691 18.242 118.852 1.00 0.00 H +ATOM 1968 N PHE A 126 5.738 15.642 117.764 1.00 16.48 N +ATOM 1969 CA PHE A 126 7.079 16.138 117.473 1.00 14.87 C +ATOM 1970 C PHE A 126 7.239 17.586 117.914 1.00 15.05 C +ATOM 1971 O PHE A 126 8.330 17.997 118.325 1.00 14.49 O +ATOM 1972 CB PHE A 126 7.381 15.998 115.979 1.00 12.18 C +ATOM 1973 CG PHE A 126 8.778 16.407 115.599 1.00 10.58 C +ATOM 1974 CD1 PHE A 126 9.820 15.495 115.648 1.00 17.83 C +ATOM 1975 CD2 PHE A 126 9.049 17.704 115.189 1.00 10.71 C +ATOM 1976 CE1 PHE A 126 11.107 15.869 115.299 1.00 12.55 C +ATOM 1977 CE2 PHE A 126 10.333 18.085 114.839 1.00 12.97 C +ATOM 1978 CZ PHE A 126 11.364 17.166 114.894 1.00 19.88 C +ATOM 1979 H PHE A 126 5.142 15.338 117.008 1.00 0.00 H +ATOM 1980 HA PHE A 126 7.796 15.531 118.026 1.00 0.00 H +ATOM 1981 HB3 PHE A 126 6.664 16.588 115.408 1.00 0.00 H +ATOM 1982 HB2 PHE A 126 7.210 14.967 115.671 1.00 0.00 H +ATOM 1983 HD1 PHE A 126 9.634 14.478 115.961 1.00 0.00 H +ATOM 1984 HD2 PHE A 126 8.253 18.432 115.140 1.00 0.00 H +ATOM 1985 HE1 PHE A 126 11.910 15.148 115.343 1.00 0.00 H +ATOM 1986 HE2 PHE A 126 10.528 19.099 114.523 1.00 0.00 H +ATOM 1987 HZ PHE A 126 12.368 17.458 114.622 1.00 0.00 H +ATOM 1988 N TYR A 127 6.162 18.370 117.837 1.00 16.23 N +ATOM 1989 CA TYR A 127 6.213 19.759 118.279 1.00 18.94 C +ATOM 1990 C TYR A 127 6.433 19.861 119.783 1.00 20.57 C +ATOM 1991 O TYR A 127 7.011 20.845 120.258 1.00 18.94 O +ATOM 1992 CB TYR A 127 4.927 20.476 117.860 1.00 21.49 C +ATOM 1993 CG TYR A 127 4.635 21.761 118.605 1.00 31.08 C +ATOM 1994 CD1 TYR A 127 5.124 22.975 118.143 1.00 38.54 C +ATOM 1995 CD2 TYR A 127 3.851 21.764 119.753 1.00 34.13 C +ATOM 1996 CE1 TYR A 127 4.857 24.153 118.812 1.00 36.65 C +ATOM 1997 CE2 TYR A 127 3.580 22.937 120.430 1.00 38.56 C +ATOM 1998 CZ TYR A 127 4.084 24.129 119.954 1.00 45.52 C +ATOM 1999 OH TYR A 127 3.815 25.300 120.624 1.00 45.47 O +ATOM 2000 H TYR A 127 5.296 18.004 117.469 1.00 0.00 H +ATOM 2001 HA TYR A 127 7.051 20.244 117.779 1.00 0.00 H +ATOM 2002 HB3 TYR A 127 4.083 19.796 117.970 1.00 0.00 H +ATOM 2003 HB2 TYR A 127 4.960 20.679 116.790 1.00 0.00 H +ATOM 2004 HD1 TYR A 127 5.724 23.009 117.246 1.00 0.00 H +ATOM 2005 HD2 TYR A 127 3.442 20.838 120.130 1.00 0.00 H +ATOM 2006 HE1 TYR A 127 5.253 25.087 118.440 1.00 0.00 H +ATOM 2007 HE2 TYR A 127 2.977 22.917 121.326 1.00 0.00 H +ATOM 2008 HH TYR A 127 3.269 25.112 121.391 1.00 0.00 H +ATOM 2009 N ASP A 128 5.992 18.859 120.545 1.00 15.23 N +ATOM 2010 CA ASP A 128 6.120 18.886 121.997 1.00 17.19 C +ATOM 2011 C ASP A 128 7.473 18.398 122.494 1.00 14.97 C +ATOM 2012 O ASP A 128 7.782 18.594 123.674 1.00 17.24 O +ATOM 2013 CB ASP A 128 5.027 18.032 122.645 1.00 15.59 C +ATOM 2014 CG ASP A 128 3.634 18.439 122.219 1.00 19.38 C +ATOM 2015 OD1 ASP A 128 3.313 19.643 122.299 1.00 25.14 O +ATOM 2016 OD2 ASP A 128 2.858 17.549 121.811 1.00 15.11 O1- +ATOM 2017 H ASP A 128 5.556 18.054 120.118 1.00 0.00 H +ATOM 2018 HA ASP A 128 5.988 19.915 122.330 1.00 0.00 H +ATOM 2019 HB3 ASP A 128 5.109 18.101 123.730 1.00 0.00 H +ATOM 2020 HB2 ASP A 128 5.190 16.984 122.395 1.00 0.00 H +ATOM 2021 N LEU A 129 8.276 17.771 121.635 1.00 14.42 N +ATOM 2022 CA LEU A 129 9.490 17.103 122.083 1.00 16.11 C +ATOM 2023 C LEU A 129 10.446 18.078 122.761 1.00 15.79 C +ATOM 2024 O LEU A 129 10.550 19.250 122.388 1.00 13.14 O +ATOM 2025 CB LEU A 129 10.192 16.423 120.908 1.00 10.31 C +ATOM 2026 CG LEU A 129 9.401 15.321 120.205 1.00 15.99 C +ATOM 2027 CD1 LEU A 129 10.224 14.693 119.091 1.00 12.87 C +ATOM 2028 CD2 LEU A 129 8.948 14.269 121.205 1.00 11.97 C +ATOM 2029 H LEU A 129 8.047 17.753 120.651 1.00 0.00 H +ATOM 2030 HA LEU A 129 9.212 16.336 122.806 1.00 0.00 H +ATOM 2031 HB3 LEU A 129 11.148 16.021 121.244 1.00 0.00 H +ATOM 2032 HB2 LEU A 129 10.484 17.178 120.178 1.00 0.00 H +ATOM 2033 HG LEU A 129 8.514 15.771 119.760 1.00 0.00 H +ATOM 2034 HD11 LEU A 129 9.641 13.911 118.604 1.00 0.00 H +ATOM 2035 HD12 LEU A 129 10.489 15.457 118.360 1.00 0.00 H +ATOM 2036 HD13 LEU A 129 11.133 14.261 119.509 1.00 0.00 H +ATOM 2037 HD21 LEU A 129 8.386 13.492 120.686 1.00 0.00 H +ATOM 2038 HD22 LEU A 129 9.820 13.826 121.687 1.00 0.00 H +ATOM 2039 HD23 LEU A 129 8.313 14.734 121.959 1.00 0.00 H +ATOM 2040 N GLU A 130 11.143 17.575 123.776 1.00 11.37 N +ATOM 2041 CA GLU A 130 12.131 18.376 124.482 1.00 9.46 C +ATOM 2042 C GLU A 130 13.324 18.654 123.578 1.00 11.29 C +ATOM 2043 O GLU A 130 13.817 17.762 122.883 1.00 10.58 O +ATOM 2044 CB GLU A 130 12.589 17.657 125.750 1.00 13.28 C +ATOM 2045 CG GLU A 130 13.760 18.322 126.456 1.00 14.59 C +ATOM 2046 CD GLU A 130 13.374 19.635 127.107 1.00 21.72 C +ATOM 2047 OE1 GLU A 130 12.563 19.612 128.056 1.00 25.89 O +ATOM 2048 OE2 GLU A 130 13.879 20.691 126.667 1.00 23.51 O1- +ATOM 2049 H GLU A 130 10.991 16.621 124.069 1.00 0.00 H +ATOM 2050 HA GLU A 130 11.676 19.326 124.763 1.00 0.00 H +ATOM 2051 HB3 GLU A 130 12.851 16.627 125.507 1.00 0.00 H +ATOM 2052 HB2 GLU A 130 11.750 17.574 126.441 1.00 0.00 H +ATOM 2053 HG3 GLU A 130 14.564 18.495 125.740 1.00 0.00 H +ATOM 2054 HG2 GLU A 130 14.158 17.646 127.212 1.00 0.00 H +ATOM 2055 N SER A 131 13.783 19.906 123.584 1.00 9.69 N +ATOM 2056 CA SER A 131 14.946 20.303 122.803 1.00 8.65 C +ATOM 2057 C SER A 131 16.195 20.513 123.649 1.00 11.53 C +ATOM 2058 O SER A 131 17.306 20.411 123.117 1.00 10.69 O +ATOM 2059 CB SER A 131 14.645 21.588 122.021 1.00 12.74 C +ATOM 2060 OG SER A 131 14.545 22.702 122.892 1.00 16.93 O +ATOM 2061 H SER A 131 13.321 20.610 124.141 1.00 0.00 H +ATOM 2062 HA SER A 131 15.155 19.511 122.083 1.00 0.00 H +ATOM 2063 HB3 SER A 131 13.709 21.469 121.475 1.00 0.00 H +ATOM 2064 HB2 SER A 131 15.438 21.765 121.295 1.00 0.00 H +ATOM 2065 HG SER A 131 14.357 23.493 122.381 1.00 0.00 H +ATOM 2066 N ASN A 132 16.036 20.799 124.945 1.00 9.22 N +ATOM 2067 CA ASN A 132 17.157 21.050 125.853 1.00 13.86 C +ATOM 2068 C ASN A 132 18.063 22.165 125.339 1.00 14.45 C +ATOM 2069 O ASN A 132 19.279 22.131 125.541 1.00 14.31 O +ATOM 2070 CB ASN A 132 17.970 19.774 126.095 1.00 12.28 C +ATOM 2071 CG ASN A 132 17.316 18.848 127.099 1.00 15.51 C +ATOM 2072 OD1 ASN A 132 16.715 19.297 128.075 1.00 15.84 O +ATOM 2073 ND2 ASN A 132 17.423 17.545 126.861 1.00 12.43 N +ATOM 2074 H ASN A 132 15.108 20.850 125.341 1.00 0.00 H +ATOM 2075 HA ASN A 132 16.745 21.370 126.810 1.00 0.00 H +ATOM 2076 HB3 ASN A 132 18.967 20.041 126.444 1.00 0.00 H +ATOM 2077 HB2 ASN A 132 18.106 19.247 125.151 1.00 0.00 H +ATOM 2078 HD22 ASN A 132 17.006 16.880 127.497 1.00 0.00 H +ATOM 2079 HD21 ASN A 132 17.921 17.220 126.045 1.00 0.00 H +ATOM 2080 N ILE A 133 17.476 23.166 124.678 1.00 13.24 N +ATOM 2081 CA ILE A 133 18.279 24.152 123.958 1.00 13.31 C +ATOM 2082 C ILE A 133 19.084 25.015 124.923 1.00 13.83 C +ATOM 2083 O ILE A 133 20.259 25.314 124.669 1.00 15.80 O +ATOM 2084 CB ILE A 133 17.383 24.999 123.034 1.00 18.54 C +ATOM 2085 CG1 ILE A 133 17.135 24.256 121.719 1.00 12.86 C +ATOM 2086 CG2 ILE A 133 18.007 26.361 122.770 1.00 13.93 C +ATOM 2087 CD1 ILE A 133 16.187 24.967 120.783 1.00 18.05 C +ATOM 2088 H ILE A 133 16.469 23.246 124.673 1.00 0.00 H +ATOM 2089 HA ILE A 133 18.985 23.610 123.329 1.00 0.00 H +ATOM 2090 HB ILE A 133 16.424 25.150 123.529 1.00 0.00 H +ATOM 2091 HG13 ILE A 133 16.751 23.259 121.934 1.00 0.00 H +ATOM 2092 HG12 ILE A 133 18.086 24.090 121.213 1.00 0.00 H +ATOM 2093 HG21 ILE A 133 17.355 26.939 122.115 1.00 0.00 H +ATOM 2094 HG22 ILE A 133 18.136 26.891 123.714 1.00 0.00 H +ATOM 2095 HG23 ILE A 133 18.978 26.230 122.292 1.00 0.00 H +ATOM 2096 HD11 ILE A 133 16.063 24.378 119.874 1.00 0.00 H +ATOM 2097 HD12 ILE A 133 15.220 25.091 121.270 1.00 0.00 H +ATOM 2098 HD13 ILE A 133 16.593 25.946 120.528 1.00 0.00 H +ATOM 2099 N ASN A 134 18.483 25.418 126.046 1.00 11.97 N +ATOM 2100 CA ASN A 134 19.172 26.268 127.014 1.00 18.85 C +ATOM 2101 C ASN A 134 20.204 25.510 127.843 1.00 14.03 C +ATOM 2102 O ASN A 134 20.800 26.095 128.754 1.00 14.82 O +ATOM 2103 CB ASN A 134 18.160 26.973 127.937 1.00 9.33 C +ATOM 2104 CG ASN A 134 17.363 26.010 128.823 1.00 17.48 C +ATOM 2105 OD1 ASN A 134 17.595 24.802 128.841 1.00 21.09 O +ATOM 2106 ND2 ASN A 134 16.426 26.569 129.588 1.00 15.06 N +ATOM 2107 H ASN A 134 17.533 25.135 126.240 1.00 0.00 H +ATOM 2108 HA ASN A 134 19.701 27.040 126.456 1.00 0.00 H +ATOM 2109 HB3 ASN A 134 17.471 27.564 127.334 1.00 0.00 H +ATOM 2110 HB2 ASN A 134 18.684 27.693 128.566 1.00 0.00 H +ATOM 2111 HD22 ASN A 134 15.862 25.994 130.197 1.00 0.00 H +ATOM 2112 HD21 ASN A 134 16.280 27.568 129.558 1.00 0.00 H +ATOM 2113 N LYS A 135 20.420 24.228 127.549 1.00 12.92 N +ATOM 2114 CA LYS A 135 21.465 23.442 128.182 1.00 15.00 C +ATOM 2115 C LYS A 135 22.571 23.027 127.222 1.00 16.60 C +ATOM 2116 O LYS A 135 23.584 22.482 127.673 1.00 9.26 O +ATOM 2117 CB LYS A 135 20.870 22.183 128.831 1.00 11.54 C +ATOM 2118 CG LYS A 135 20.102 22.445 130.113 1.00 11.04 C +ATOM 2119 CD LYS A 135 19.249 21.247 130.487 1.00 14.97 C +ATOM 2120 CE LYS A 135 18.525 21.472 131.802 1.00 18.08 C +ATOM 2121 NZ LYS A 135 18.269 20.194 132.524 1.00 19.00 N1+ +ATOM 2122 H LYS A 135 19.845 23.764 126.860 1.00 0.00 H +ATOM 2123 HA LYS A 135 21.912 24.048 128.970 1.00 0.00 H +ATOM 2124 HB3 LYS A 135 21.668 21.467 129.028 1.00 0.00 H +ATOM 2125 HB2 LYS A 135 20.218 21.682 128.116 1.00 0.00 H +ATOM 2126 HG3 LYS A 135 19.463 23.318 129.981 1.00 0.00 H +ATOM 2127 HG2 LYS A 135 20.804 22.657 130.920 1.00 0.00 H +ATOM 2128 HD3 LYS A 135 19.881 20.363 130.568 1.00 0.00 H +ATOM 2129 HD2 LYS A 135 18.520 21.061 129.699 1.00 0.00 H +ATOM 2130 HE3 LYS A 135 17.578 21.977 131.613 1.00 0.00 H +ATOM 2131 HE2 LYS A 135 19.118 22.133 132.434 1.00 0.00 H +ATOM 2132 HZ1 LYS A 135 17.787 20.387 133.391 1.00 0.00 H +ATOM 2133 HZ2 LYS A 135 17.698 19.591 131.949 1.00 0.00 H +ATOM 2134 HZ3 LYS A 135 19.148 19.737 132.722 1.00 0.00 H +ATOM 2135 N LEU A 136 22.410 23.267 125.922 1.00 12.26 N +ATOM 2136 CA LEU A 136 23.418 22.849 124.957 1.00 11.50 C +ATOM 2137 C LEU A 136 24.688 23.676 125.106 1.00 13.95 C +ATOM 2138 O LEU A 136 24.639 24.892 125.313 1.00 13.68 O +ATOM 2139 CB LEU A 136 22.881 22.983 123.532 1.00 8.91 C +ATOM 2140 CG LEU A 136 21.591 22.227 123.214 1.00 14.08 C +ATOM 2141 CD1 LEU A 136 21.056 22.630 121.850 1.00 10.33 C +ATOM 2142 CD2 LEU A 136 21.816 20.724 123.287 1.00 10.37 C +ATOM 2143 H LEU A 136 21.582 23.744 125.595 1.00 0.00 H +ATOM 2144 HA LEU A 136 23.661 21.802 125.140 1.00 0.00 H +ATOM 2145 HB3 LEU A 136 23.656 22.683 122.827 1.00 0.00 H +ATOM 2146 HB2 LEU A 136 22.745 24.039 123.297 1.00 0.00 H +ATOM 2147 HG LEU A 136 20.847 22.496 123.964 1.00 0.00 H +ATOM 2148 HD11 LEU A 136 20.138 22.081 121.643 1.00 0.00 H +ATOM 2149 HD12 LEU A 136 20.848 23.700 121.842 1.00 0.00 H +ATOM 2150 HD13 LEU A 136 21.798 22.399 121.085 1.00 0.00 H +ATOM 2151 HD21 LEU A 136 20.885 20.205 123.057 1.00 0.00 H +ATOM 2152 HD22 LEU A 136 22.580 20.435 122.565 1.00 0.00 H +ATOM 2153 HD23 LEU A 136 22.144 20.454 124.291 1.00 0.00 H +ATOM 2154 N THR A 137 25.831 23.006 125.002 1.00 13.72 N +ATOM 2155 CA THR A 137 27.106 23.701 124.986 1.00 17.13 C +ATOM 2156 C THR A 137 27.325 24.362 123.628 1.00 17.39 C +ATOM 2157 O THR A 137 26.693 24.012 122.628 1.00 20.82 O +ATOM 2158 CB THR A 137 28.257 22.740 125.290 1.00 17.32 C +ATOM 2159 OG1 THR A 137 28.370 21.776 124.235 1.00 22.39 O +ATOM 2160 CG2 THR A 137 28.013 22.017 126.605 1.00 13.40 C +ATOM 2161 H THR A 137 25.821 21.998 124.933 1.00 0.00 H +ATOM 2162 HA THR A 137 27.089 24.477 125.752 1.00 0.00 H +ATOM 2163 HB THR A 137 29.186 23.305 125.359 1.00 0.00 H +ATOM 2164 HG1 THR A 137 29.093 21.174 124.427 1.00 0.00 H +ATOM 2165 HG21 THR A 137 28.841 21.338 126.806 1.00 0.00 H +ATOM 2166 HG22 THR A 137 27.938 22.746 127.412 1.00 0.00 H +ATOM 2167 HG23 THR A 137 27.085 21.449 126.541 1.00 0.00 H +ATOM 2168 N GLU A 138 28.233 25.340 123.607 1.00 14.64 N +ATOM 2169 CA GLU A 138 28.567 26.001 122.350 1.00 19.90 C +ATOM 2170 C GLU A 138 29.106 25.007 121.329 1.00 19.26 C +ATOM 2171 O GLU A 138 28.869 25.160 120.125 1.00 22.19 O +ATOM 2172 CB GLU A 138 29.575 27.125 122.602 1.00 23.20 C +ATOM 2173 CG GLU A 138 30.168 27.754 121.344 1.00 36.51 C +ATOM 2174 CD GLU A 138 29.118 28.304 120.394 1.00 40.74 C +ATOM 2175 OE1 GLU A 138 28.048 28.754 120.861 1.00 34.75 O +ATOM 2176 OE2 GLU A 138 29.367 28.280 119.170 1.00 40.09 O1- +ATOM 2177 H GLU A 138 28.690 25.623 124.462 1.00 0.00 H +ATOM 2178 HA GLU A 138 27.657 26.444 121.946 1.00 0.00 H +ATOM 2179 HB3 GLU A 138 30.382 26.751 123.233 1.00 0.00 H +ATOM 2180 HB2 GLU A 138 29.106 27.901 123.206 1.00 0.00 H +ATOM 2181 HG3 GLU A 138 30.776 27.015 120.822 1.00 0.00 H +ATOM 2182 HG2 GLU A 138 30.853 28.553 121.627 1.00 0.00 H +ATOM 2183 N ASP A 139 29.817 23.977 121.791 1.00 21.22 N +ATOM 2184 CA ASP A 139 30.287 22.936 120.885 1.00 26.94 C +ATOM 2185 C ASP A 139 29.119 22.184 120.259 1.00 19.94 C +ATOM 2186 O ASP A 139 29.117 21.920 119.051 1.00 18.83 O +ATOM 2187 CB ASP A 139 31.208 21.973 121.632 1.00 29.95 C +ATOM 2188 CG ASP A 139 32.325 21.444 120.762 1.00 41.24 C +ATOM 2189 OD1 ASP A 139 33.248 22.223 120.442 1.00 46.79 O +ATOM 2190 OD2 ASP A 139 32.280 20.250 120.397 1.00 52.37 O1- +ATOM 2191 H ASP A 139 30.034 23.914 122.775 1.00 0.00 H +ATOM 2192 HA ASP A 139 30.859 23.408 120.086 1.00 0.00 H +ATOM 2193 HB3 ASP A 139 30.623 21.138 122.018 1.00 0.00 H +ATOM 2194 HB2 ASP A 139 31.633 22.478 122.500 1.00 0.00 H +ATOM 2195 N ARG A 140 28.113 21.833 121.066 1.00 19.23 N +ATOM 2196 CA ARG A 140 26.960 21.113 120.534 1.00 18.20 C +ATOM 2197 C ARG A 140 26.131 22.004 119.615 1.00 16.29 C +ATOM 2198 O ARG A 140 25.584 21.530 118.612 1.00 14.87 O +ATOM 2199 CB ARG A 140 26.107 20.569 121.682 1.00 19.71 C +ATOM 2200 CG ARG A 140 24.827 19.874 121.237 1.00 23.92 C +ATOM 2201 CD ARG A 140 25.123 18.683 120.335 1.00 29.80 C +ATOM 2202 NE ARG A 140 25.067 17.411 121.051 1.00 27.78 N +ATOM 2203 CZ ARG A 140 25.079 16.221 120.458 1.00 23.09 C +ATOM 2204 NH1 ARG A 140 25.139 16.137 119.136 1.00 31.56 N +ATOM 2205 NH2 ARG A 140 25.025 15.114 121.186 1.00 20.03 N1+ +ATOM 2206 H ARG A 140 28.149 22.066 122.048 1.00 0.00 H +ATOM 2207 HA ARG A 140 27.325 20.268 119.951 1.00 0.00 H +ATOM 2208 HB3 ARG A 140 25.858 21.382 122.364 1.00 0.00 H +ATOM 2209 HB2 ARG A 140 26.703 19.880 122.280 1.00 0.00 H +ATOM 2210 HG3 ARG A 140 24.195 20.584 120.704 1.00 0.00 H +ATOM 2211 HG2 ARG A 140 24.274 19.537 122.114 1.00 0.00 H +ATOM 2212 HD3 ARG A 140 26.110 18.804 119.888 1.00 0.00 H +ATOM 2213 HD2 ARG A 140 24.410 18.667 119.511 1.00 0.00 H +ATOM 2214 HE ARG A 140 25.017 17.473 122.058 1.00 0.00 H +ATOM 2215 HH12 ARG A 140 25.148 15.232 118.687 1.00 0.00 H +ATOM 2216 HH11 ARG A 140 25.176 16.978 118.578 1.00 0.00 H +ATOM 2217 HH22 ARG A 140 25.034 14.211 120.734 1.00 0.00 H +ATOM 2218 HH21 ARG A 140 24.975 15.174 122.193 1.00 0.00 H +ATOM 2219 N LYS A 141 26.028 23.295 119.940 1.00 17.65 N +ATOM 2220 CA LYS A 141 25.335 24.232 119.061 1.00 16.62 C +ATOM 2221 C LYS A 141 26.012 24.304 117.698 1.00 16.71 C +ATOM 2222 O LYS A 141 25.346 24.273 116.656 1.00 17.52 O +ATOM 2223 CB LYS A 141 25.284 25.618 119.704 1.00 15.88 C +ATOM 2224 CG LYS A 141 24.333 25.739 120.877 1.00 21.83 C +ATOM 2225 CD LYS A 141 24.448 27.117 121.505 1.00 22.24 C +ATOM 2226 CE LYS A 141 23.179 27.512 122.236 1.00 31.75 C +ATOM 2227 NZ LYS A 141 23.481 28.189 123.528 1.00 34.93 N1+ +ATOM 2228 H LYS A 141 26.432 23.633 120.802 1.00 0.00 H +ATOM 2229 HA LYS A 141 24.313 23.880 118.920 1.00 0.00 H +ATOM 2230 HB3 LYS A 141 25.020 26.357 118.948 1.00 0.00 H +ATOM 2231 HB2 LYS A 141 26.286 25.906 120.021 1.00 0.00 H +ATOM 2232 HG3 LYS A 141 24.575 24.980 121.621 1.00 0.00 H +ATOM 2233 HG2 LYS A 141 23.311 25.581 120.533 1.00 0.00 H +ATOM 2234 HD3 LYS A 141 24.664 27.852 120.730 1.00 0.00 H +ATOM 2235 HD2 LYS A 141 25.286 27.129 122.201 1.00 0.00 H +ATOM 2236 HE3 LYS A 141 22.577 26.623 122.424 1.00 0.00 H +ATOM 2237 HE2 LYS A 141 22.590 28.179 121.606 1.00 0.00 H +ATOM 2238 HZ1 LYS A 141 22.617 28.438 123.988 1.00 0.00 H +ATOM 2239 HZ2 LYS A 141 24.009 27.565 124.120 1.00 0.00 H +ATOM 2240 HZ3 LYS A 141 24.022 29.024 123.353 1.00 0.00 H +ATOM 2241 N GLU A 142 27.344 24.408 117.691 1.00 16.94 N +ATOM 2242 CA GLU A 142 28.094 24.444 116.439 1.00 18.93 C +ATOM 2243 C GLU A 142 27.812 23.216 115.585 1.00 17.22 C +ATOM 2244 O GLU A 142 27.630 23.324 114.367 1.00 16.01 O +ATOM 2245 CB GLU A 142 29.590 24.558 116.739 1.00 22.70 C +ATOM 2246 CG GLU A 142 30.503 24.641 115.518 1.00 15.09 C +ATOM 2247 CD GLU A 142 30.103 25.724 114.529 1.00 24.97 C +ATOM 2248 OE1 GLU A 142 29.596 26.782 114.962 1.00 23.95 O +ATOM 2249 OE2 GLU A 142 30.307 25.517 113.313 1.00 26.92 O1- +ATOM 2250 H GLU A 142 27.851 24.463 118.563 1.00 0.00 H +ATOM 2251 HA GLU A 142 27.787 25.328 115.880 1.00 0.00 H +ATOM 2252 HB3 GLU A 142 29.897 23.718 117.362 1.00 0.00 H +ATOM 2253 HB2 GLU A 142 29.764 25.424 117.378 1.00 0.00 H +ATOM 2254 HG3 GLU A 142 30.518 23.676 115.011 1.00 0.00 H +ATOM 2255 HG2 GLU A 142 31.529 24.811 115.845 1.00 0.00 H +ATOM 2256 N GLY A 143 27.771 22.037 116.209 1.00 14.17 N +ATOM 2257 CA GLY A 143 27.462 20.829 115.462 1.00 11.27 C +ATOM 2258 C GLY A 143 26.051 20.834 114.906 1.00 17.31 C +ATOM 2259 O GLY A 143 25.809 20.350 113.797 1.00 14.48 O +ATOM 2260 H GLY A 143 27.955 21.984 117.201 1.00 0.00 H +ATOM 2261 HA3 GLY A 143 27.594 19.960 116.107 1.00 0.00 H +ATOM 2262 HA2 GLY A 143 28.173 20.717 114.644 1.00 0.00 H +ATOM 2263 N LEU A 144 25.100 21.381 115.668 1.00 14.07 N +ATOM 2264 CA LEU A 144 23.725 21.457 115.187 1.00 13.01 C +ATOM 2265 C LEU A 144 23.594 22.412 114.008 1.00 15.24 C +ATOM 2266 O LEU A 144 22.769 22.183 113.117 1.00 17.80 O +ATOM 2267 CB LEU A 144 22.790 21.881 116.319 1.00 15.04 C +ATOM 2268 CG LEU A 144 22.607 20.893 117.472 1.00 10.92 C +ATOM 2269 CD1 LEU A 144 21.537 21.387 118.430 1.00 13.84 C +ATOM 2270 CD2 LEU A 144 22.265 19.509 116.947 1.00 12.66 C +ATOM 2271 H LEU A 144 25.332 21.744 116.582 1.00 0.00 H +ATOM 2272 HA LEU A 144 23.426 20.463 114.854 1.00 0.00 H +ATOM 2273 HB3 LEU A 144 21.814 22.131 115.903 1.00 0.00 H +ATOM 2274 HB2 LEU A 144 23.121 22.840 116.718 1.00 0.00 H +ATOM 2275 HG LEU A 144 23.549 20.828 118.017 1.00 0.00 H +ATOM 2276 HD11 LEU A 144 21.420 20.672 119.244 1.00 0.00 H +ATOM 2277 HD12 LEU A 144 21.831 22.355 118.836 1.00 0.00 H +ATOM 2278 HD13 LEU A 144 20.591 21.489 117.898 1.00 0.00 H +ATOM 2279 HD21 LEU A 144 22.139 18.823 117.785 1.00 0.00 H +ATOM 2280 HD22 LEU A 144 21.339 19.556 116.374 1.00 0.00 H +ATOM 2281 HD23 LEU A 144 23.071 19.154 116.305 1.00 0.00 H +ATOM 2282 N ARG A 145 24.393 23.482 113.984 1.00 17.90 N +ATOM 2283 CA ARG A 145 24.376 24.386 112.839 1.00 13.97 C +ATOM 2284 C ARG A 145 24.965 23.725 111.600 1.00 15.12 C +ATOM 2285 O ARG A 145 24.520 24.001 110.480 1.00 19.33 O +ATOM 2286 CB ARG A 145 25.130 25.674 113.170 1.00 15.71 C +ATOM 2287 CG ARG A 145 24.364 26.613 114.088 1.00 18.81 C +ATOM 2288 CD ARG A 145 25.126 27.906 114.332 1.00 21.13 C +ATOM 2289 NE ARG A 145 26.334 27.694 115.122 1.00 27.17 N +ATOM 2290 CZ ARG A 145 26.474 28.071 116.389 1.00 27.64 C +ATOM 2291 NH1 ARG A 145 25.476 28.679 117.016 1.00 20.55 N +ATOM 2292 NH2 ARG A 145 27.611 27.838 117.031 1.00 23.06 N1+ +ATOM 2293 H ARG A 145 25.012 23.668 114.760 1.00 0.00 H +ATOM 2294 HA ARG A 145 23.339 24.645 112.626 1.00 0.00 H +ATOM 2295 HB3 ARG A 145 25.379 26.195 112.246 1.00 0.00 H +ATOM 2296 HB2 ARG A 145 26.088 25.425 113.626 1.00 0.00 H +ATOM 2297 HG3 ARG A 145 24.177 26.117 115.040 1.00 0.00 H +ATOM 2298 HG2 ARG A 145 23.394 26.841 113.646 1.00 0.00 H +ATOM 2299 HD3 ARG A 145 24.478 28.617 114.844 1.00 0.00 H +ATOM 2300 HD2 ARG A 145 25.393 28.356 113.376 1.00 0.00 H +ATOM 2301 HE ARG A 145 27.094 27.228 114.647 1.00 0.00 H +ATOM 2302 HH12 ARG A 145 25.584 28.965 117.979 1.00 0.00 H +ATOM 2303 HH11 ARG A 145 24.608 28.856 116.531 1.00 0.00 H +ATOM 2304 HH22 ARG A 145 27.715 28.125 117.994 1.00 0.00 H +ATOM 2305 HH21 ARG A 145 28.372 27.373 116.557 1.00 0.00 H +ATOM 2306 N GLN A 146 25.961 22.854 111.779 1.00 13.68 N +ATOM 2307 CA GLN A 146 26.478 22.086 110.653 1.00 16.02 C +ATOM 2308 C GLN A 146 25.449 21.076 110.163 1.00 18.37 C +ATOM 2309 O GLN A 146 25.358 20.805 108.960 1.00 16.34 O +ATOM 2310 CB GLN A 146 27.777 21.385 111.048 1.00 19.10 C +ATOM 2311 CG GLN A 146 28.935 22.331 111.331 1.00 17.62 C +ATOM 2312 CD GLN A 146 29.160 23.329 110.212 1.00 20.20 C +ATOM 2313 OE1 GLN A 146 29.231 22.959 109.040 1.00 19.68 O +ATOM 2314 NE2 GLN A 146 29.271 24.602 110.569 1.00 19.02 N +ATOM 2315 H GLN A 146 26.360 22.725 112.698 1.00 0.00 H +ATOM 2316 HA GLN A 146 26.695 22.777 109.838 1.00 0.00 H +ATOM 2317 HB3 GLN A 146 28.065 20.687 110.262 1.00 0.00 H +ATOM 2318 HB2 GLN A 146 27.599 20.760 111.923 1.00 0.00 H +ATOM 2319 HG3 GLN A 146 29.845 21.752 111.489 1.00 0.00 H +ATOM 2320 HG2 GLN A 146 28.746 22.866 112.261 1.00 0.00 H +ATOM 2321 HE22 GLN A 146 29.422 25.312 109.867 1.00 0.00 H +ATOM 2322 HE21 GLN A 146 29.205 24.861 111.543 1.00 0.00 H +ATOM 2323 N LEU A 147 24.664 20.506 111.083 1.00 14.20 N +ATOM 2324 CA LEU A 147 23.590 19.605 110.683 1.00 16.22 C +ATOM 2325 C LEU A 147 22.473 20.352 109.968 1.00 14.61 C +ATOM 2326 O LEU A 147 21.815 19.786 109.087 1.00 12.37 O +ATOM 2327 CB LEU A 147 23.035 18.869 111.902 1.00 10.96 C +ATOM 2328 CG LEU A 147 23.846 17.686 112.432 1.00 16.11 C +ATOM 2329 CD1 LEU A 147 23.155 17.071 113.640 1.00 11.80 C +ATOM 2330 CD2 LEU A 147 24.058 16.645 111.343 1.00 15.86 C +ATOM 2331 H LEU A 147 24.813 20.698 112.063 1.00 0.00 H +ATOM 2332 HA LEU A 147 24.002 18.866 109.996 1.00 0.00 H +ATOM 2333 HB3 LEU A 147 22.018 18.539 111.689 1.00 0.00 H +ATOM 2334 HB2 LEU A 147 22.874 19.583 112.709 1.00 0.00 H +ATOM 2335 HG LEU A 147 24.822 18.055 112.747 1.00 0.00 H +ATOM 2336 HD11 LEU A 147 23.743 16.230 114.007 1.00 0.00 H +ATOM 2337 HD12 LEU A 147 23.063 17.820 114.427 1.00 0.00 H +ATOM 2338 HD13 LEU A 147 22.163 16.722 113.353 1.00 0.00 H +ATOM 2339 HD21 LEU A 147 24.637 15.813 111.743 1.00 0.00 H +ATOM 2340 HD22 LEU A 147 23.092 16.280 110.995 1.00 0.00 H +ATOM 2341 HD23 LEU A 147 24.597 17.095 110.510 1.00 0.00 H +ATOM 2342 N VAL A 148 22.242 21.615 110.334 1.00 15.81 N +ATOM 2343 CA VAL A 148 21.214 22.410 109.669 1.00 16.17 C +ATOM 2344 C VAL A 148 21.604 22.674 108.220 1.00 17.30 C +ATOM 2345 O VAL A 148 20.816 22.444 107.295 1.00 16.26 O +ATOM 2346 CB VAL A 148 20.972 23.722 110.437 1.00 12.37 C +ATOM 2347 CG1 VAL A 148 20.338 24.769 109.531 1.00 10.64 C +ATOM 2348 CG2 VAL A 148 20.100 23.468 111.652 1.00 12.56 C +ATOM 2349 H VAL A 148 22.782 22.032 111.079 1.00 0.00 H +ATOM 2350 HA VAL A 148 20.286 21.838 109.673 1.00 0.00 H +ATOM 2351 HB VAL A 148 21.935 24.102 110.779 1.00 0.00 H +ATOM 2352 HG11 VAL A 148 20.176 25.688 110.095 1.00 0.00 H +ATOM 2353 HG12 VAL A 148 21.001 24.972 108.690 1.00 0.00 H +ATOM 2354 HG13 VAL A 148 19.383 24.398 109.159 1.00 0.00 H +ATOM 2355 HG21 VAL A 148 19.937 24.405 112.185 1.00 0.00 H +ATOM 2356 HG22 VAL A 148 19.141 23.061 111.333 1.00 0.00 H +ATOM 2357 HG23 VAL A 148 20.595 22.756 112.312 1.00 0.00 H +ATOM 2358 N MET A 149 22.830 23.158 108.001 1.00 16.79 N +ATOM 2359 CA MET A 149 23.286 23.422 106.642 1.00 15.58 C +ATOM 2360 C MET A 149 23.419 22.136 105.835 1.00 17.67 C +ATOM 2361 O MET A 149 23.223 22.150 104.614 1.00 17.39 O +ATOM 2362 CB MET A 149 24.611 24.185 106.675 1.00 14.00 C +ATOM 2363 CG MET A 149 24.462 25.643 107.089 1.00 19.23 C +ATOM 2364 SD MET A 149 26.014 26.504 107.422 1.00 33.48 S +ATOM 2365 CE MET A 149 27.093 25.154 107.882 1.00 18.17 C +ATOM 2366 H MET A 149 23.446 23.343 108.779 1.00 0.00 H +ATOM 2367 HA MET A 149 22.544 24.053 106.153 1.00 0.00 H +ATOM 2368 HB3 MET A 149 25.082 24.134 105.694 1.00 0.00 H +ATOM 2369 HB2 MET A 149 25.300 23.684 107.355 1.00 0.00 H +ATOM 2370 HG3 MET A 149 23.820 25.705 107.968 1.00 0.00 H +ATOM 2371 HG2 MET A 149 23.909 26.182 106.320 1.00 0.00 H +ATOM 2372 HE1 MET A 149 28.084 25.543 108.114 1.00 0.00 H +ATOM 2373 HE2 MET A 149 26.688 24.647 108.758 1.00 0.00 H +ATOM 2374 HE3 MET A 149 27.165 24.448 107.055 1.00 0.00 H +ATOM 2375 N THR A 150 23.744 21.021 106.494 1.00 15.28 N +ATOM 2376 CA THR A 150 23.740 19.733 105.808 1.00 15.34 C +ATOM 2377 C THR A 150 22.332 19.361 105.361 1.00 18.84 C +ATOM 2378 O THR A 150 22.138 18.847 104.253 1.00 21.27 O +ATOM 2379 CB THR A 150 24.316 18.649 106.720 1.00 16.73 C +ATOM 2380 OG1 THR A 150 25.669 18.976 107.062 1.00 16.99 O +ATOM 2381 CG2 THR A 150 24.286 17.292 106.030 1.00 11.93 C +ATOM 2382 H THR A 150 23.994 21.067 107.471 1.00 0.00 H +ATOM 2383 HA THR A 150 24.373 19.812 104.924 1.00 0.00 H +ATOM 2384 HB THR A 150 23.721 18.598 107.632 1.00 0.00 H +ATOM 2385 HG1 THR A 150 26.029 18.294 107.634 1.00 0.00 H +ATOM 2386 HG21 THR A 150 24.700 16.536 106.697 1.00 0.00 H +ATOM 2387 HG22 THR A 150 23.257 17.033 105.782 1.00 0.00 H +ATOM 2388 HG23 THR A 150 24.879 17.335 105.117 1.00 0.00 H +ATOM 2389 N PHE A 151 21.337 19.622 106.211 1.00 17.28 N +ATOM 2390 CA PHE A 151 19.950 19.346 105.852 1.00 17.12 C +ATOM 2391 C PHE A 151 19.521 20.184 104.654 1.00 18.21 C +ATOM 2392 O PHE A 151 18.959 19.661 103.684 1.00 24.94 O +ATOM 2393 CB PHE A 151 19.044 19.606 107.060 1.00 15.88 C +ATOM 2394 CG PHE A 151 17.571 19.449 106.775 1.00 15.46 C +ATOM 2395 CD1 PHE A 151 16.918 18.270 107.095 1.00 18.31 C +ATOM 2396 CD2 PHE A 151 16.833 20.488 106.224 1.00 16.34 C +ATOM 2397 CE1 PHE A 151 15.567 18.119 106.848 1.00 16.41 C +ATOM 2398 CE2 PHE A 151 15.482 20.342 105.973 1.00 20.89 C +ATOM 2399 CZ PHE A 151 14.847 19.156 106.287 1.00 20.31 C +ATOM 2400 H PHE A 151 21.539 20.017 107.119 1.00 0.00 H +ATOM 2401 HA PHE A 151 19.868 18.293 105.582 1.00 0.00 H +ATOM 2402 HB3 PHE A 151 19.233 20.609 107.444 1.00 0.00 H +ATOM 2403 HB2 PHE A 151 19.327 18.939 107.874 1.00 0.00 H +ATOM 2404 HD1 PHE A 151 17.465 17.454 107.543 1.00 0.00 H +ATOM 2405 HD2 PHE A 151 17.314 21.425 105.986 1.00 0.00 H +ATOM 2406 HE1 PHE A 151 15.074 17.190 107.094 1.00 0.00 H +ATOM 2407 HE2 PHE A 151 14.924 21.155 105.532 1.00 0.00 H +ATOM 2408 HZ PHE A 151 13.791 19.038 106.095 1.00 0.00 H +ATOM 2409 N GLN A 152 19.778 21.494 104.707 1.00 15.20 N +ATOM 2410 CA GLN A 152 19.356 22.382 103.628 1.00 21.90 C +ATOM 2411 C GLN A 152 20.011 22.012 102.303 1.00 18.53 C +ATOM 2412 O GLN A 152 19.391 22.155 101.243 1.00 21.36 O +ATOM 2413 CB GLN A 152 19.674 23.834 103.989 1.00 13.35 C +ATOM 2414 CG GLN A 152 18.910 24.356 105.197 1.00 17.39 C +ATOM 2415 CD GLN A 152 19.536 25.605 105.792 1.00 20.52 C +ATOM 2416 OE1 GLN A 152 20.759 25.723 105.871 1.00 15.54 O +ATOM 2417 NE2 GLN A 152 18.696 26.544 106.216 1.00 12.60 N +ATOM 2418 H GLN A 152 20.270 21.881 105.500 1.00 0.00 H +ATOM 2419 HA GLN A 152 18.276 22.288 103.512 1.00 0.00 H +ATOM 2420 HB3 GLN A 152 19.471 24.473 103.129 1.00 0.00 H +ATOM 2421 HB2 GLN A 152 20.745 23.936 104.167 1.00 0.00 H +ATOM 2422 HG3 GLN A 152 18.861 23.578 105.958 1.00 0.00 H +ATOM 2423 HG2 GLN A 152 17.880 24.568 104.910 1.00 0.00 H +ATOM 2424 HE22 GLN A 152 19.055 27.397 106.621 1.00 0.00 H +ATOM 2425 HE21 GLN A 152 17.699 26.405 106.133 1.00 0.00 H +ATOM 2426 N HIS A 153 21.257 21.537 102.341 1.00 19.94 N +ATOM 2427 CA HIS A 153 21.926 21.129 101.110 1.00 22.89 C +ATOM 2428 C HIS A 153 21.369 19.811 100.589 1.00 28.84 C +ATOM 2429 O HIS A 153 21.203 19.636 99.376 1.00 34.71 O +ATOM 2430 CB HIS A 153 23.430 21.016 101.344 1.00 20.77 C +ATOM 2431 CG HIS A 153 24.170 20.382 100.209 1.00 34.08 C +ATOM 2432 ND1 HIS A 153 24.305 19.016 100.078 1.00 38.76 N +ATOM 2433 CD2 HIS A 153 24.828 20.926 99.158 1.00 33.06 C +ATOM 2434 CE1 HIS A 153 25.006 18.746 98.992 1.00 33.49 C +ATOM 2435 NE2 HIS A 153 25.337 19.888 98.416 1.00 34.12 N +ATOM 2436 H HIS A 153 21.741 21.459 103.224 1.00 0.00 H +ATOM 2437 HA HIS A 153 21.753 21.896 100.355 1.00 0.00 H +ATOM 2438 HB3 HIS A 153 23.612 20.448 102.257 1.00 0.00 H +ATOM 2439 HB2 HIS A 153 23.842 22.007 101.535 1.00 0.00 H +ATOM 2440 HD1 HIS A 153 23.892 18.400 100.764 1.00 0.00 H +ATOM 2441 HD2 HIS A 153 24.868 21.999 99.043 1.00 0.00 H +ATOM 2442 HE1 HIS A 153 25.210 17.720 98.722 1.00 0.00 H +ATOM 2443 N PHE A 154 21.087 18.867 101.488 1.00 28.34 N +ATOM 2444 CA PHE A 154 20.552 17.580 101.061 1.00 23.27 C +ATOM 2445 C PHE A 154 19.127 17.725 100.542 1.00 28.21 C +ATOM 2446 O PHE A 154 18.772 17.132 99.518 1.00 28.73 O +ATOM 2447 CB PHE A 154 20.628 16.582 102.220 1.00 28.42 C +ATOM 2448 CG PHE A 154 19.879 15.296 101.983 1.00 37.77 C +ATOM 2449 CD1 PHE A 154 20.084 14.559 100.828 1.00 47.00 C +ATOM 2450 CD2 PHE A 154 19.004 14.801 102.939 1.00 38.83 C +ATOM 2451 CE1 PHE A 154 19.411 13.371 100.616 1.00 40.55 C +ATOM 2452 CE2 PHE A 154 18.330 13.608 102.733 1.00 36.11 C +ATOM 2453 CZ PHE A 154 18.533 12.895 101.568 1.00 40.32 C +ATOM 2454 H PHE A 154 21.244 19.042 102.470 1.00 0.00 H +ATOM 2455 HA PHE A 154 21.174 17.206 100.248 1.00 0.00 H +ATOM 2456 HB3 PHE A 154 20.255 17.055 103.129 1.00 0.00 H +ATOM 2457 HB2 PHE A 154 21.673 16.357 102.435 1.00 0.00 H +ATOM 2458 HD1 PHE A 154 20.777 14.911 100.079 1.00 0.00 H +ATOM 2459 HD2 PHE A 154 18.842 15.347 103.857 1.00 0.00 H +ATOM 2460 HE1 PHE A 154 19.572 12.814 99.705 1.00 0.00 H +ATOM 2461 HE2 PHE A 154 17.647 13.237 103.483 1.00 0.00 H +ATOM 2462 HZ PHE A 154 18.007 11.967 101.401 1.00 0.00 H +ATOM 2463 N MET A 155 18.307 18.535 101.213 1.00 27.44 N +ATOM 2464 CA MET A 155 16.910 18.727 100.846 1.00 27.22 C +ATOM 2465 C MET A 155 16.705 19.868 99.850 1.00 36.58 C +ATOM 2466 O MET A 155 15.615 20.451 99.812 1.00 41.05 O +ATOM 2467 CB MET A 155 16.071 18.980 102.102 1.00 30.29 C +ATOM 2468 CG MET A 155 16.064 17.828 103.092 1.00 28.95 C +ATOM 2469 SD MET A 155 14.651 16.733 102.871 1.00 49.76 S +ATOM 2470 CE MET A 155 15.425 15.341 102.058 1.00 36.10 C +ATOM 2471 H MET A 155 18.647 19.048 102.014 1.00 0.00 H +ATOM 2472 HA MET A 155 16.554 17.807 100.382 1.00 0.00 H +ATOM 2473 HB3 MET A 155 15.047 19.213 101.811 1.00 0.00 H +ATOM 2474 HB2 MET A 155 16.428 19.882 102.600 1.00 0.00 H +ATOM 2475 HG3 MET A 155 16.061 18.223 104.108 1.00 0.00 H +ATOM 2476 HG2 MET A 155 16.986 17.255 102.988 1.00 0.00 H +ATOM 2477 HE1 MET A 155 14.676 14.576 101.854 1.00 0.00 H +ATOM 2478 HE2 MET A 155 15.872 15.670 101.120 1.00 0.00 H +ATOM 2479 HE3 MET A 155 16.200 14.927 102.704 1.00 0.00 H +ATOM 2480 N ARG A 156 17.724 20.192 99.046 1.00 34.83 N +ATOM 2481 CA ARG A 156 17.623 21.302 98.099 1.00 37.67 C +ATOM 2482 C ARG A 156 16.427 21.145 97.168 1.00 42.86 C +ATOM 2483 O ARG A 156 15.624 22.069 97.002 1.00 41.27 O +ATOM 2484 CB ARG A 156 18.904 21.401 97.268 1.00 42.03 C +ATOM 2485 CG ARG A 156 20.061 22.137 97.908 1.00 46.14 C +ATOM 2486 CD ARG A 156 21.232 22.192 96.935 1.00 47.96 C +ATOM 2487 NE ARG A 156 21.117 21.174 95.891 1.00 51.91 N +ATOM 2488 CZ ARG A 156 21.655 19.958 95.958 1.00 53.44 C +ATOM 2489 NH1 ARG A 156 22.351 19.591 97.026 1.00 51.20 N +ATOM 2490 NH2 ARG A 156 21.489 19.105 94.958 1.00 56.17 N1+ +ATOM 2491 H ARG A 156 18.585 19.666 99.085 1.00 0.00 H +ATOM 2492 HA ARG A 156 17.504 22.228 98.662 1.00 0.00 H +ATOM 2493 HB3 ARG A 156 18.674 21.860 96.306 1.00 0.00 H +ATOM 2494 HB2 ARG A 156 19.228 20.399 96.986 1.00 0.00 H +ATOM 2495 HG3 ARG A 156 20.367 21.615 98.815 1.00 0.00 H +ATOM 2496 HG2 ARG A 156 19.751 23.151 98.161 1.00 0.00 H +ATOM 2497 HD3 ARG A 156 22.164 22.048 97.481 1.00 0.00 H +ATOM 2498 HD2 ARG A 156 21.276 23.179 96.475 1.00 0.00 H +ATOM 2499 HE ARG A 156 20.585 21.447 95.077 1.00 0.00 H +ATOM 2500 HH12 ARG A 156 22.757 18.667 97.071 1.00 0.00 H +ATOM 2501 HH11 ARG A 156 22.475 20.235 97.794 1.00 0.00 H +ATOM 2502 HH22 ARG A 156 21.897 18.182 95.008 1.00 0.00 H +ATOM 2503 HH21 ARG A 156 20.955 19.377 94.145 1.00 0.00 H +ATOM 2504 N GLU A 157 16.296 19.969 96.553 1.00 40.28 N +ATOM 2505 CA GLU A 157 15.353 19.784 95.456 1.00 45.43 C +ATOM 2506 C GLU A 157 13.897 19.785 95.906 1.00 37.84 C +ATOM 2507 O GLU A 157 13.017 20.085 95.093 1.00 40.79 O +ATOM 2508 CB GLU A 157 15.667 18.481 94.724 1.00 41.00 C +ATOM 2509 CG GLU A 157 17.089 18.407 94.181 1.00 50.56 C +ATOM 2510 CD GLU A 157 17.526 19.701 93.524 0.78 54.53 C +ATOM 2511 OE1 GLU A 157 18.251 20.485 94.173 1.00 60.01 O +ATOM 2512 OE2 GLU A 157 17.141 19.939 92.361 1.00 56.69 O1- +ATOM 2513 H GLU A 157 16.857 19.181 96.845 1.00 0.00 H +ATOM 2514 HA GLU A 157 15.489 20.606 94.753 1.00 0.00 H +ATOM 2515 HB3 GLU A 157 14.960 18.347 93.905 1.00 0.00 H +ATOM 2516 HB2 GLU A 157 15.491 17.639 95.393 1.00 0.00 H +ATOM 2517 HG3 GLU A 157 17.160 17.593 93.460 1.00 0.00 H +ATOM 2518 HG2 GLU A 157 17.775 18.163 94.993 1.00 0.00 H +ATOM 2519 N GLU A 158 13.616 19.463 97.170 1.00 36.52 N +ATOM 2520 CA GLU A 158 12.241 19.356 97.637 1.00 32.24 C +ATOM 2521 C GLU A 158 11.823 20.446 98.609 1.00 39.09 C +ATOM 2522 O GLU A 158 10.621 20.609 98.840 1.00 40.47 O +ATOM 2523 CB GLU A 158 12.005 17.993 98.302 1.00 30.65 C +ATOM 2524 CG GLU A 158 12.085 16.830 97.341 1.00 32.17 C +ATOM 2525 CD GLU A 158 10.904 16.786 96.399 1.00 36.07 C +ATOM 2526 OE1 GLU A 158 9.803 17.220 96.796 1.00 32.71 O +ATOM 2527 OE2 GLU A 158 11.078 16.336 95.253 1.00 44.27 O1- +ATOM 2528 H GLU A 158 14.365 19.288 97.825 1.00 0.00 H +ATOM 2529 HA GLU A 158 11.588 19.419 96.766 1.00 0.00 H +ATOM 2530 HB3 GLU A 158 11.030 17.993 98.790 1.00 0.00 H +ATOM 2531 HB2 GLU A 158 12.730 17.851 99.103 1.00 0.00 H +ATOM 2532 HG3 GLU A 158 12.135 15.898 97.904 1.00 0.00 H +ATOM 2533 HG2 GLU A 158 13.007 16.900 96.764 1.00 0.00 H +ATOM 2534 N ILE A 159 12.767 21.184 99.187 1.00 37.30 N +ATOM 2535 CA ILE A 159 12.478 22.191 100.204 1.00 45.80 C +ATOM 2536 C ILE A 159 13.229 23.455 99.808 1.00 42.99 C +ATOM 2537 O ILE A 159 14.423 23.592 100.097 1.00 40.62 O +ATOM 2538 CB ILE A 159 12.876 21.732 101.611 1.00 43.45 C +ATOM 2539 CG1 ILE A 159 12.340 20.323 101.885 1.00 34.54 C +ATOM 2540 CG2 ILE A 159 12.379 22.723 102.652 1.00 43.94 C +ATOM 2541 CD1 ILE A 159 12.310 19.941 103.348 1.00 36.43 C +ATOM 2542 H ILE A 159 13.735 21.060 98.927 1.00 0.00 H +ATOM 2543 HA ILE A 159 11.409 22.402 100.194 1.00 0.00 H +ATOM 2544 HB ILE A 159 13.964 21.699 101.664 1.00 0.00 H +ATOM 2545 HG13 ILE A 159 12.937 19.596 101.334 1.00 0.00 H +ATOM 2546 HG12 ILE A 159 11.338 20.230 101.467 1.00 0.00 H +ATOM 2547 HG21 ILE A 159 12.670 22.383 103.646 1.00 0.00 H +ATOM 2548 HG22 ILE A 159 12.818 23.702 102.461 1.00 0.00 H +ATOM 2549 HG23 ILE A 159 11.293 22.795 102.596 1.00 0.00 H +ATOM 2550 HD11 ILE A 159 11.917 18.929 103.452 1.00 0.00 H +ATOM 2551 HD12 ILE A 159 13.320 19.982 103.756 1.00 0.00 H +ATOM 2552 HD13 ILE A 159 11.671 20.636 103.892 1.00 0.00 H +ATOM 2553 N GLN A 160 12.534 24.384 99.147 1.00 49.25 N +ATOM 2554 CA GLN A 160 13.162 25.638 98.744 1.00 58.21 C +ATOM 2555 C GLN A 160 13.126 26.672 99.858 1.00 58.15 C +ATOM 2556 O GLN A 160 14.039 27.499 99.965 1.00 52.99 O +ATOM 2557 CB GLN A 160 12.457 26.243 97.522 1.00 60.85 C +ATOM 2558 CG GLN A 160 11.901 25.295 96.449 1.00 60.08 C +ATOM 2559 CD GLN A 160 12.701 24.024 96.256 1.00 55.77 C +ATOM 2560 OE1 GLN A 160 12.179 22.922 96.415 1.00 49.19 O +ATOM 2561 NE2 GLN A 160 13.969 24.171 95.893 1.00 60.86 N +ATOM 2562 H GLN A 160 11.563 24.223 98.921 1.00 0.00 H +ATOM 2563 HA GLN A 160 14.202 25.440 98.485 1.00 0.00 H +ATOM 2564 HB3 GLN A 160 13.122 26.966 97.049 1.00 0.00 H +ATOM 2565 HB2 GLN A 160 11.659 26.903 97.862 1.00 0.00 H +ATOM 2566 HG3 GLN A 160 11.832 25.826 95.499 1.00 0.00 H +ATOM 2567 HG2 GLN A 160 10.870 25.039 96.693 1.00 0.00 H +ATOM 2568 HE22 GLN A 160 14.551 23.358 95.750 1.00 0.00 H +ATOM 2569 HE21 GLN A 160 14.352 25.096 95.760 1.00 0.00 H +ATOM 2570 N ASP A 161 12.086 26.640 100.686 1.00 55.12 N +ATOM 2571 CA ASP A 161 11.704 27.793 101.487 1.00 51.44 C +ATOM 2572 C ASP A 161 10.908 27.294 102.689 1.00 48.73 C +ATOM 2573 O ASP A 161 10.525 26.123 102.762 1.00 45.53 O +ATOM 2574 CB ASP A 161 10.919 28.789 100.613 1.00 55.31 C +ATOM 2575 CG ASP A 161 10.142 29.812 101.414 1.00 68.55 C +ATOM 2576 OD1 ASP A 161 10.747 30.805 101.870 1.00 74.81 O +ATOM 2577 OD2 ASP A 161 8.922 29.621 101.589 1.00 60.37 O1- +ATOM 2578 H ASP A 161 11.535 25.798 100.773 1.00 0.00 H +ATOM 2579 HA ASP A 161 12.609 28.283 101.847 1.00 0.00 H +ATOM 2580 HB3 ASP A 161 10.235 28.241 99.965 1.00 0.00 H +ATOM 2581 HB2 ASP A 161 11.608 29.302 99.942 1.00 0.00 H +ATOM 2582 N ALA A 162 10.686 28.196 103.650 1.00 45.90 N +ATOM 2583 CA ALA A 162 9.918 27.860 104.844 1.00 42.45 C +ATOM 2584 C ALA A 162 8.474 27.482 104.533 1.00 46.83 C +ATOM 2585 O ALA A 162 7.804 26.896 105.390 1.00 47.81 O +ATOM 2586 CB ALA A 162 9.942 29.029 105.830 1.00 34.12 C +ATOM 2587 H ALA A 162 11.053 29.133 103.558 1.00 0.00 H +ATOM 2588 HA ALA A 162 10.395 27.005 105.323 1.00 0.00 H +ATOM 2589 HB1 ALA A 162 9.366 28.768 106.718 1.00 0.00 H +ATOM 2590 HB2 ALA A 162 10.972 29.243 106.116 1.00 0.00 H +ATOM 2591 HB3 ALA A 162 9.505 29.910 105.360 1.00 0.00 H +ATOM 2592 N SER A 163 7.974 27.806 103.336 1.00 39.59 N +ATOM 2593 CA SER A 163 6.601 27.448 102.995 1.00 40.29 C +ATOM 2594 C SER A 163 6.427 25.941 102.863 1.00 41.76 C +ATOM 2595 O SER A 163 5.318 25.428 103.051 1.00 49.03 O +ATOM 2596 CB SER A 163 6.175 28.141 101.702 1.00 43.25 C +ATOM 2597 OG SER A 163 4.763 28.193 101.595 1.00 45.07 O +ATOM 2598 H SER A 163 8.547 28.299 102.666 1.00 0.00 H +ATOM 2599 HA SER A 163 5.950 27.796 103.797 1.00 0.00 H +ATOM 2600 HB3 SER A 163 6.584 27.600 100.849 1.00 0.00 H +ATOM 2601 HB2 SER A 163 6.578 29.154 101.683 1.00 0.00 H +ATOM 2602 HG SER A 163 4.520 28.632 100.777 1.00 0.00 H +ATOM 2603 N GLN A 164 7.499 25.220 102.540 1.00 40.69 N +ATOM 2604 CA GLN A 164 7.466 23.766 102.458 1.00 35.03 C +ATOM 2605 C GLN A 164 7.885 23.094 103.758 1.00 37.37 C +ATOM 2606 O GLN A 164 7.993 21.864 103.800 1.00 38.79 O +ATOM 2607 CB GLN A 164 8.341 23.278 101.304 1.00 40.84 C +ATOM 2608 CG GLN A 164 8.048 23.973 99.989 1.00 41.09 C +ATOM 2609 CD GLN A 164 9.229 23.957 99.044 1.00 51.70 C +ATOM 2610 OE1 GLN A 164 10.158 24.749 99.185 1.00 54.59 O +ATOM 2611 NE2 GLN A 164 9.196 23.056 98.069 1.00 44.27 N +ATOM 2612 H GLN A 164 8.376 25.680 102.341 1.00 0.00 H +ATOM 2613 HA GLN A 164 6.439 23.468 102.246 1.00 0.00 H +ATOM 2614 HB3 GLN A 164 8.212 22.203 101.182 1.00 0.00 H +ATOM 2615 HB2 GLN A 164 9.391 23.419 101.561 1.00 0.00 H +ATOM 2616 HG3 GLN A 164 7.753 25.004 100.182 1.00 0.00 H +ATOM 2617 HG2 GLN A 164 7.194 23.495 99.509 1.00 0.00 H +ATOM 2618 HE22 GLN A 164 9.958 22.999 97.408 1.00 0.00 H +ATOM 2619 HE21 GLN A 164 8.409 22.428 97.989 1.00 0.00 H +ATOM 2620 N LEU A 165 8.122 23.864 104.807 1.00 36.54 N +ATOM 2621 CA LEU A 165 8.269 23.346 106.154 1.00 37.20 C +ATOM 2622 C LEU A 165 6.980 23.554 106.935 1.00 33.85 C +ATOM 2623 O LEU A 165 6.161 24.410 106.587 1.00 36.70 O +ATOM 2624 CB LEU A 165 9.433 24.035 106.877 1.00 30.01 C +ATOM 2625 CG LEU A 165 10.841 23.903 106.292 1.00 35.80 C +ATOM 2626 CD1 LEU A 165 11.847 24.669 107.144 1.00 29.95 C +ATOM 2627 CD2 LEU A 165 11.240 22.441 106.173 1.00 28.19 C +ATOM 2628 H LEU A 165 8.209 24.863 104.690 1.00 0.00 H +ATOM 2629 HA LEU A 165 8.475 22.277 106.097 1.00 0.00 H +ATOM 2630 HB3 LEU A 165 9.448 23.711 107.918 1.00 0.00 H +ATOM 2631 HB2 LEU A 165 9.198 25.092 107.004 1.00 0.00 H +ATOM 2632 HG LEU A 165 10.838 24.339 105.293 1.00 0.00 H +ATOM 2633 HD11 LEU A 165 12.843 24.564 106.713 1.00 0.00 H +ATOM 2634 HD12 LEU A 165 11.573 25.724 107.171 1.00 0.00 H +ATOM 2635 HD13 LEU A 165 11.846 24.268 108.157 1.00 0.00 H +ATOM 2636 HD21 LEU A 165 12.244 22.371 105.755 1.00 0.00 H +ATOM 2637 HD22 LEU A 165 11.225 21.978 107.160 1.00 0.00 H +ATOM 2638 HD23 LEU A 165 10.538 21.924 105.519 1.00 0.00 H +ATOM 2639 N PRO A 166 6.754 22.770 107.986 1.00 31.86 N +ATOM 2640 CA PRO A 166 5.599 23.007 108.862 1.00 33.65 C +ATOM 2641 C PRO A 166 5.616 24.421 109.418 1.00 37.48 C +ATOM 2642 O PRO A 166 6.646 25.110 109.350 1.00 34.66 O +ATOM 2643 CB PRO A 166 5.788 21.961 109.972 1.00 35.68 C +ATOM 2644 CG PRO A 166 6.521 20.851 109.307 1.00 27.87 C +ATOM 2645 CD PRO A 166 7.426 21.493 108.288 1.00 26.96 C +ATOM 2646 HA PRO A 166 4.670 22.823 108.322 1.00 0.00 H +ATOM 2647 HB3 PRO A 166 4.812 21.603 110.300 1.00 0.00 H +ATOM 2648 HB2 PRO A 166 6.410 22.382 110.762 1.00 0.00 H +ATOM 2649 HG3 PRO A 166 5.809 20.199 108.800 1.00 0.00 H +ATOM 2650 HG2 PRO A 166 7.124 20.322 110.045 1.00 0.00 H +ATOM 2651 HD2 PRO A 166 8.395 21.695 108.744 1.00 0.00 H +ATOM 2652 HD3 PRO A 166 7.450 20.877 107.389 1.00 0.00 H +ATOM 2653 N PRO A 167 4.498 24.902 109.963 1.00 48.49 N +ATOM 2654 CA PRO A 167 4.480 26.275 110.486 1.00 43.12 C +ATOM 2655 C PRO A 167 5.291 26.397 111.767 1.00 42.24 C +ATOM 2656 O PRO A 167 5.265 25.514 112.628 1.00 43.82 O +ATOM 2657 CB PRO A 167 2.992 26.549 110.736 1.00 41.46 C +ATOM 2658 CG PRO A 167 2.350 25.219 110.846 1.00 45.37 C +ATOM 2659 CD PRO A 167 3.226 24.193 110.190 1.00 44.91 C +ATOM 2660 HA PRO A 167 4.865 26.965 109.735 1.00 0.00 H +ATOM 2661 HB3 PRO A 167 2.574 27.083 109.883 1.00 0.00 H +ATOM 2662 HB2 PRO A 167 2.876 27.086 111.678 1.00 0.00 H +ATOM 2663 HG3 PRO A 167 1.381 25.241 110.347 1.00 0.00 H +ATOM 2664 HG2 PRO A 167 2.219 24.965 111.898 1.00 0.00 H +ATOM 2665 HD2 PRO A 167 3.392 23.366 110.881 1.00 0.00 H +ATOM 2666 HD3 PRO A 167 2.794 23.911 109.230 1.00 0.00 H +ATOM 2667 N ALA A 168 6.016 27.514 111.880 1.00 43.54 N +ATOM 2668 CA ALA A 168 6.895 27.788 113.019 1.00 43.56 C +ATOM 2669 C ALA A 168 7.928 26.682 113.215 1.00 44.76 C +ATOM 2670 O ALA A 168 8.382 26.432 114.334 1.00 43.48 O +ATOM 2671 CB ALA A 168 6.092 28.008 114.305 1.00 39.73 C +ATOM 2672 H ALA A 168 5.973 28.219 111.158 1.00 0.00 H +ATOM 2673 HA ALA A 168 7.435 28.710 112.805 1.00 0.00 H +ATOM 2674 HB1 ALA A 168 6.775 28.209 115.130 1.00 0.00 H +ATOM 2675 HB2 ALA A 168 5.421 28.857 114.174 1.00 0.00 H +ATOM 2676 HB3 ALA A 168 5.508 27.115 114.526 1.00 0.00 H +ATOM 2677 N PHE A 169 8.312 26.019 112.126 1.00 41.69 N +ATOM 2678 CA PHE A 169 9.241 24.897 112.173 1.00 32.60 C +ATOM 2679 C PHE A 169 10.668 25.411 112.020 1.00 30.13 C +ATOM 2680 O PHE A 169 11.034 25.940 110.965 1.00 26.05 O +ATOM 2681 CB PHE A 169 8.909 23.889 111.074 1.00 24.68 C +ATOM 2682 CG PHE A 169 9.539 22.541 111.269 1.00 25.13 C +ATOM 2683 CD1 PHE A 169 8.868 21.548 111.962 1.00 25.13 C +ATOM 2684 CD2 PHE A 169 10.789 22.259 110.743 1.00 16.91 C +ATOM 2685 CE1 PHE A 169 9.435 20.304 112.141 1.00 18.33 C +ATOM 2686 CE2 PHE A 169 11.363 21.013 110.919 1.00 15.27 C +ATOM 2687 CZ PHE A 169 10.684 20.036 111.618 1.00 15.99 C +ATOM 2688 H PHE A 169 7.957 26.288 111.220 1.00 0.00 H +ATOM 2689 HA PHE A 169 9.147 24.404 113.141 1.00 0.00 H +ATOM 2690 HB3 PHE A 169 9.213 24.294 110.109 1.00 0.00 H +ATOM 2691 HB2 PHE A 169 7.827 23.775 111.003 1.00 0.00 H +ATOM 2692 HD1 PHE A 169 7.887 21.743 112.371 1.00 0.00 H +ATOM 2693 HD2 PHE A 169 11.325 23.016 110.189 1.00 0.00 H +ATOM 2694 HE1 PHE A 169 8.902 19.541 112.690 1.00 0.00 H +ATOM 2695 HE2 PHE A 169 12.341 20.806 110.510 1.00 0.00 H +ATOM 2696 HZ PHE A 169 11.130 19.062 111.756 1.00 0.00 H +ATOM 2697 N ASP A 170 11.468 25.255 113.071 1.00 26.73 N +ATOM 2698 CA ASP A 170 12.850 25.715 113.095 1.00 21.22 C +ATOM 2699 C ASP A 170 13.780 24.511 113.023 1.00 16.53 C +ATOM 2700 O ASP A 170 13.638 23.565 113.805 1.00 19.15 O +ATOM 2701 CB ASP A 170 13.123 26.540 114.355 1.00 20.12 C +ATOM 2702 CG ASP A 170 14.602 26.771 114.597 1.00 23.01 C +ATOM 2703 OD1 ASP A 170 15.331 27.056 113.624 1.00 32.18 O +ATOM 2704 OD2 ASP A 170 15.032 26.678 115.766 1.00 27.15 O1- +ATOM 2705 H ASP A 170 11.124 24.799 113.904 1.00 0.00 H +ATOM 2706 HA ASP A 170 13.024 26.343 112.222 1.00 0.00 H +ATOM 2707 HB3 ASP A 170 12.689 26.036 115.219 1.00 0.00 H +ATOM 2708 HB2 ASP A 170 12.615 27.501 114.276 1.00 0.00 H +ATOM 2709 N LEU A 171 14.736 24.556 112.092 1.00 19.46 N +ATOM 2710 CA LEU A 171 15.568 23.387 111.820 1.00 16.21 C +ATOM 2711 C LEU A 171 16.574 23.136 112.938 1.00 13.55 C +ATOM 2712 O LEU A 171 16.847 21.980 113.284 1.00 13.59 O +ATOM 2713 CB LEU A 171 16.282 23.558 110.480 1.00 13.49 C +ATOM 2714 CG LEU A 171 15.400 23.383 109.243 1.00 19.06 C +ATOM 2715 CD1 LEU A 171 16.224 23.498 107.970 1.00 17.95 C +ATOM 2716 CD2 LEU A 171 14.664 22.051 109.291 1.00 17.23 C +ATOM 2717 H LEU A 171 14.890 25.405 111.567 1.00 0.00 H +ATOM 2718 HA LEU A 171 14.916 22.516 111.748 1.00 0.00 H +ATOM 2719 HB3 LEU A 171 17.120 22.862 110.427 1.00 0.00 H +ATOM 2720 HB2 LEU A 171 16.758 24.538 110.448 1.00 0.00 H +ATOM 2721 HG LEU A 171 14.658 24.181 109.240 1.00 0.00 H +ATOM 2722 HD11 LEU A 171 15.575 23.370 107.104 1.00 0.00 H +ATOM 2723 HD12 LEU A 171 16.695 24.480 107.929 1.00 0.00 H +ATOM 2724 HD13 LEU A 171 16.994 22.726 107.964 1.00 0.00 H +ATOM 2725 HD21 LEU A 171 14.042 21.947 108.402 1.00 0.00 H +ATOM 2726 HD22 LEU A 171 15.388 21.237 109.325 1.00 0.00 H +ATOM 2727 HD23 LEU A 171 14.035 22.015 110.180 1.00 0.00 H +ATOM 2728 N PHE A 172 17.145 24.201 113.506 1.00 13.70 N +ATOM 2729 CA PHE A 172 18.081 24.038 114.614 1.00 12.13 C +ATOM 2730 C PHE A 172 17.412 23.336 115.789 1.00 15.95 C +ATOM 2731 O PHE A 172 17.963 22.387 116.359 1.00 10.74 O +ATOM 2732 CB PHE A 172 18.631 25.404 115.034 1.00 11.87 C +ATOM 2733 CG PHE A 172 19.622 25.346 116.165 1.00 14.13 C +ATOM 2734 CD1 PHE A 172 20.979 25.228 115.909 1.00 14.16 C +ATOM 2735 CD2 PHE A 172 19.200 25.429 117.484 1.00 10.67 C +ATOM 2736 CE1 PHE A 172 21.894 25.183 116.946 1.00 12.88 C +ATOM 2737 CE2 PHE A 172 20.110 25.381 118.524 1.00 15.68 C +ATOM 2738 CZ PHE A 172 21.459 25.258 118.254 1.00 12.78 C +ATOM 2739 H PHE A 172 16.930 25.129 113.169 1.00 0.00 H +ATOM 2740 HA PHE A 172 18.913 23.422 114.274 1.00 0.00 H +ATOM 2741 HB3 PHE A 172 17.803 26.057 115.312 1.00 0.00 H +ATOM 2742 HB2 PHE A 172 19.093 25.888 114.173 1.00 0.00 H +ATOM 2743 HD1 PHE A 172 21.333 25.170 114.890 1.00 0.00 H +ATOM 2744 HD2 PHE A 172 18.149 25.533 117.709 1.00 0.00 H +ATOM 2745 HE1 PHE A 172 22.948 25.089 116.732 1.00 0.00 H +ATOM 2746 HE2 PHE A 172 19.766 25.440 119.546 1.00 0.00 H +ATOM 2747 HZ PHE A 172 22.173 25.220 119.064 1.00 0.00 H +ATOM 2748 N GLU A 173 16.212 23.788 116.158 1.00 13.31 N +ATOM 2749 CA GLU A 173 15.485 23.163 117.255 1.00 14.52 C +ATOM 2750 C GLU A 173 15.034 21.752 116.899 1.00 16.14 C +ATOM 2751 O GLU A 173 14.993 20.878 117.773 1.00 11.78 O +ATOM 2752 CB GLU A 173 14.288 24.033 117.639 1.00 14.11 C +ATOM 2753 CG GLU A 173 13.387 23.444 118.707 1.00 20.61 C +ATOM 2754 CD GLU A 173 11.992 24.034 118.673 1.00 25.35 C +ATOM 2755 OE1 GLU A 173 11.571 24.504 117.595 1.00 27.47 O +ATOM 2756 OE2 GLU A 173 11.318 24.032 119.724 1.00 26.28 O1- +ATOM 2757 H GLU A 173 15.797 24.572 115.675 1.00 0.00 H +ATOM 2758 HA GLU A 173 16.152 23.101 118.115 1.00 0.00 H +ATOM 2759 HB3 GLU A 173 13.698 24.248 116.748 1.00 0.00 H +ATOM 2760 HB2 GLU A 173 14.643 25.011 117.965 1.00 0.00 H +ATOM 2761 HG3 GLU A 173 13.829 23.615 119.689 1.00 0.00 H +ATOM 2762 HG2 GLU A 173 13.327 22.364 118.575 1.00 0.00 H +ATOM 2763 N ALA A 174 14.702 21.507 115.629 1.00 12.55 N +ATOM 2764 CA ALA A 174 14.288 20.169 115.218 1.00 11.87 C +ATOM 2765 C ALA A 174 15.417 19.163 115.401 1.00 8.41 C +ATOM 2766 O ALA A 174 15.188 18.040 115.866 1.00 10.99 O +ATOM 2767 CB ALA A 174 13.813 20.187 113.766 1.00 11.80 C +ATOM 2768 H ALA A 174 14.736 22.250 114.946 1.00 0.00 H +ATOM 2769 HA ALA A 174 13.452 19.862 115.847 1.00 0.00 H +ATOM 2770 HB1 ALA A 174 13.507 19.183 113.471 1.00 0.00 H +ATOM 2771 HB2 ALA A 174 12.967 20.868 113.668 1.00 0.00 H +ATOM 2772 HB3 ALA A 174 14.625 20.523 113.122 1.00 0.00 H +ATOM 2773 N PHE A 175 16.645 19.546 115.044 1.00 12.22 N +ATOM 2774 CA PHE A 175 17.780 18.656 115.259 1.00 11.64 C +ATOM 2775 C PHE A 175 18.098 18.504 116.740 1.00 12.21 C +ATOM 2776 O PHE A 175 18.583 17.449 117.162 1.00 12.11 O +ATOM 2777 CB PHE A 175 19.005 19.168 114.500 1.00 12.33 C +ATOM 2778 CG PHE A 175 19.073 18.694 113.077 1.00 13.08 C +ATOM 2779 CD1 PHE A 175 19.293 17.356 112.790 1.00 10.97 C +ATOM 2780 CD2 PHE A 175 18.916 19.583 112.026 1.00 11.82 C +ATOM 2781 CE1 PHE A 175 19.355 16.913 111.482 1.00 14.92 C +ATOM 2782 CE2 PHE A 175 18.979 19.147 110.716 1.00 13.31 C +ATOM 2783 CZ PHE A 175 19.198 17.810 110.443 1.00 14.53 C +ATOM 2784 H PHE A 175 16.789 20.453 114.624 1.00 0.00 H +ATOM 2785 HA PHE A 175 17.521 17.674 114.864 1.00 0.00 H +ATOM 2786 HB3 PHE A 175 19.910 18.864 115.026 1.00 0.00 H +ATOM 2787 HB2 PHE A 175 19.013 20.258 114.519 1.00 0.00 H +ATOM 2788 HD1 PHE A 175 19.418 16.645 113.593 1.00 0.00 H +ATOM 2789 HD2 PHE A 175 18.742 20.630 112.226 1.00 0.00 H +ATOM 2790 HE1 PHE A 175 19.526 15.867 111.274 1.00 0.00 H +ATOM 2791 HE2 PHE A 175 18.857 19.851 109.906 1.00 0.00 H +ATOM 2792 HZ PHE A 175 19.247 17.466 109.420 1.00 0.00 H +ATOM 2793 N ALA A 176 17.834 19.539 117.541 1.00 13.42 N +ATOM 2794 CA ALA A 176 17.992 19.408 118.986 1.00 15.18 C +ATOM 2795 C ALA A 176 17.020 18.379 119.550 1.00 14.65 C +ATOM 2796 O ALA A 176 17.362 17.631 120.473 1.00 13.98 O +ATOM 2797 CB ALA A 176 17.797 20.764 119.663 1.00 7.22 C +ATOM 2798 H ALA A 176 17.524 20.416 117.147 1.00 0.00 H +ATOM 2799 HA ALA A 176 19.007 19.067 119.189 1.00 0.00 H +ATOM 2800 HB1 ALA A 176 17.917 20.653 120.741 1.00 0.00 H +ATOM 2801 HB2 ALA A 176 18.538 21.469 119.286 1.00 0.00 H +ATOM 2802 HB3 ALA A 176 16.797 21.138 119.446 1.00 0.00 H +ATOM 2803 N LYS A 177 15.803 18.323 119.002 1.00 9.02 N +ATOM 2804 CA LYS A 177 14.843 17.309 119.429 1.00 11.43 C +ATOM 2805 C LYS A 177 15.274 15.917 118.987 1.00 11.76 C +ATOM 2806 O LYS A 177 15.041 14.934 119.699 1.00 12.57 O +ATOM 2807 CB LYS A 177 13.455 17.630 118.878 1.00 9.45 C +ATOM 2808 CG LYS A 177 12.921 18.997 119.260 1.00 10.66 C +ATOM 2809 CD LYS A 177 11.534 19.216 118.682 1.00 15.57 C +ATOM 2810 CE LYS A 177 10.922 20.508 119.189 1.00 15.68 C +ATOM 2811 NZ LYS A 177 9.441 20.409 119.273 1.00 17.43 N1+ +ATOM 2812 H LYS A 177 15.541 18.985 118.286 1.00 0.00 H +ATOM 2813 HA LYS A 177 14.791 17.322 120.518 1.00 0.00 H +ATOM 2814 HB3 LYS A 177 12.751 16.864 119.204 1.00 0.00 H +ATOM 2815 HB2 LYS A 177 13.468 17.538 117.792 1.00 0.00 H +ATOM 2816 HG3 LYS A 177 13.596 19.767 118.887 1.00 0.00 H +ATOM 2817 HG2 LYS A 177 12.879 19.080 120.346 1.00 0.00 H +ATOM 2818 HD3 LYS A 177 10.891 18.379 118.954 1.00 0.00 H +ATOM 2819 HD2 LYS A 177 11.595 19.246 117.594 1.00 0.00 H +ATOM 2820 HE3 LYS A 177 11.194 21.325 118.520 1.00 0.00 H +ATOM 2821 HE2 LYS A 177 11.327 20.739 120.174 1.00 0.00 H +ATOM 2822 HZ1 LYS A 177 9.063 21.282 119.613 1.00 0.00 H +ATOM 2823 HZ2 LYS A 177 9.064 20.213 118.357 1.00 0.00 H +ATOM 2824 HZ3 LYS A 177 9.188 19.664 119.907 1.00 0.00 H +ATOM 2825 N VAL A 178 15.899 15.812 117.812 1.00 11.62 N +ATOM 2826 CA VAL A 178 16.305 14.509 117.295 1.00 13.48 C +ATOM 2827 C VAL A 178 17.408 13.908 118.158 1.00 13.57 C +ATOM 2828 O VAL A 178 17.448 12.693 118.382 1.00 14.92 O +ATOM 2829 CB VAL A 178 16.739 14.637 115.822 1.00 12.33 C +ATOM 2830 CG1 VAL A 178 17.439 13.370 115.350 1.00 12.66 C +ATOM 2831 CG2 VAL A 178 15.538 14.943 114.943 1.00 12.28 C +ATOM 2832 H VAL A 178 16.096 16.641 117.269 1.00 0.00 H +ATOM 2833 HA VAL A 178 15.442 13.844 117.337 1.00 0.00 H +ATOM 2834 HB VAL A 178 17.442 15.466 115.743 1.00 0.00 H +ATOM 2835 HG11 VAL A 178 17.736 13.485 114.307 1.00 0.00 H +ATOM 2836 HG12 VAL A 178 18.324 13.194 115.962 1.00 0.00 H +ATOM 2837 HG13 VAL A 178 16.759 12.523 115.442 1.00 0.00 H +ATOM 2838 HG21 VAL A 178 15.860 15.031 113.905 1.00 0.00 H +ATOM 2839 HG22 VAL A 178 14.809 14.138 115.030 1.00 0.00 H +ATOM 2840 HG23 VAL A 178 15.083 15.881 115.262 1.00 0.00 H +ATOM 2841 N ILE A 179 18.307 14.751 118.672 1.00 11.93 N +ATOM 2842 CA ILE A 179 19.451 14.258 119.434 1.00 12.88 C +ATOM 2843 C ILE A 179 18.990 13.525 120.689 1.00 12.32 C +ATOM 2844 O ILE A 179 19.495 12.443 121.014 1.00 16.48 O +ATOM 2845 CB ILE A 179 20.402 15.421 119.777 1.00 15.73 C +ATOM 2846 CG1 ILE A 179 21.149 15.907 118.530 1.00 14.86 C +ATOM 2847 CG2 ILE A 179 21.390 15.006 120.858 1.00 19.43 C +ATOM 2848 CD1 ILE A 179 21.461 14.821 117.518 1.00 16.21 C +ATOM 2849 H ILE A 179 18.201 15.746 118.536 1.00 0.00 H +ATOM 2850 HA ILE A 179 19.994 13.550 118.809 1.00 0.00 H +ATOM 2851 HB ILE A 179 19.805 16.248 120.161 1.00 0.00 H +ATOM 2852 HG13 ILE A 179 22.075 16.396 118.832 1.00 0.00 H +ATOM 2853 HG12 ILE A 179 20.571 16.695 118.047 1.00 0.00 H +ATOM 2854 HG21 ILE A 179 22.052 15.841 121.086 1.00 0.00 H +ATOM 2855 HG22 ILE A 179 20.846 14.719 121.758 1.00 0.00 H +ATOM 2856 HG23 ILE A 179 21.981 14.160 120.506 1.00 0.00 H +ATOM 2857 HD11 ILE A 179 21.990 15.255 116.670 1.00 0.00 H +ATOM 2858 HD12 ILE A 179 22.086 14.059 117.983 1.00 0.00 H +ATOM 2859 HD13 ILE A 179 20.532 14.368 117.173 1.00 0.00 H +ATOM 2860 N CYS A 180 18.019 14.089 121.406 1.00 10.21 N +ATOM 2861 CA CYS A 180 17.622 13.570 122.708 1.00 12.81 C +ATOM 2862 C CYS A 180 16.290 12.829 122.683 1.00 12.92 C +ATOM 2863 O CYS A 180 15.739 12.535 123.749 1.00 12.61 O +ATOM 2864 CB CYS A 180 17.574 14.708 123.729 1.00 10.45 C +ATOM 2865 SG CYS A 180 16.127 15.775 123.595 1.00 16.45 S +ATOM 2866 H CYS A 180 17.535 14.901 121.050 1.00 0.00 H +ATOM 2867 HA CYS A 180 18.388 12.865 123.032 1.00 0.00 H +ATOM 2868 HB3 CYS A 180 18.477 15.312 123.639 1.00 0.00 H +ATOM 2869 HB2 CYS A 180 17.624 14.292 124.735 1.00 0.00 H +ATOM 2870 HG CYS A 180 16.188 16.728 124.529 1.00 0.00 H +ATOM 2871 N ASN A 181 15.759 12.512 121.500 1.00 13.28 N +ATOM 2872 CA ASN A 181 14.548 11.709 121.402 1.00 17.39 C +ATOM 2873 C ASN A 181 14.649 10.577 120.391 1.00 13.49 C +ATOM 2874 O ASN A 181 13.673 9.840 120.215 1.00 18.55 O +ATOM 2875 CB ASN A 181 13.338 12.591 121.059 1.00 11.46 C +ATOM 2876 CG ASN A 181 12.969 13.533 122.185 1.00 12.19 C +ATOM 2877 OD1 ASN A 181 12.386 13.119 123.187 1.00 12.27 O +ATOM 2878 ND2 ASN A 181 13.307 14.808 122.028 1.00 10.05 N +ATOM 2879 H ASN A 181 16.198 12.830 120.648 1.00 0.00 H +ATOM 2880 HA ASN A 181 14.366 11.264 122.380 1.00 0.00 H +ATOM 2881 HB3 ASN A 181 12.483 11.957 120.822 1.00 0.00 H +ATOM 2882 HB2 ASN A 181 13.554 13.168 120.160 1.00 0.00 H +ATOM 2883 HD22 ASN A 181 13.086 15.481 122.748 1.00 0.00 H +ATOM 2884 HD21 ASN A 181 13.785 15.104 121.189 1.00 0.00 H +ATOM 2885 N SER A 182 15.793 10.409 119.734 1.00 14.05 N +ATOM 2886 CA SER A 182 15.946 9.348 118.749 1.00 18.11 C +ATOM 2887 C SER A 182 15.951 7.981 119.419 1.00 15.24 C +ATOM 2888 O SER A 182 16.458 7.816 120.533 1.00 16.47 O +ATOM 2889 CB SER A 182 17.237 9.540 117.955 1.00 14.13 C +ATOM 2890 OG SER A 182 17.026 10.382 116.837 1.00 20.77 O +ATOM 2891 H SER A 182 16.574 11.023 119.915 1.00 0.00 H +ATOM 2892 HA SER A 182 15.104 9.392 118.058 1.00 0.00 H +ATOM 2893 HB3 SER A 182 17.602 8.571 117.615 1.00 0.00 H +ATOM 2894 HB2 SER A 182 17.998 9.978 118.601 1.00 0.00 H +ATOM 2895 HG SER A 182 17.850 10.487 116.355 1.00 0.00 H +ATOM 2896 N PHE A 183 15.379 6.999 118.730 1.00 15.08 N +ATOM 2897 CA PHE A 183 15.391 5.609 119.165 1.00 19.45 C +ATOM 2898 C PHE A 183 16.227 4.801 118.185 1.00 16.50 C +ATOM 2899 O PHE A 183 15.902 4.737 116.994 1.00 17.27 O +ATOM 2900 CB PHE A 183 13.975 5.034 119.242 1.00 15.84 C +ATOM 2901 CG PHE A 183 13.148 5.591 120.363 1.00 19.36 C +ATOM 2902 CD1 PHE A 183 12.956 4.862 121.525 1.00 18.71 C +ATOM 2903 CD2 PHE A 183 12.545 6.832 120.250 1.00 22.83 C +ATOM 2904 CE1 PHE A 183 12.191 5.364 122.558 1.00 20.30 C +ATOM 2905 CE2 PHE A 183 11.777 7.340 121.280 1.00 26.64 C +ATOM 2906 CZ PHE A 183 11.601 6.604 122.435 1.00 21.24 C +ATOM 2907 H PHE A 183 14.907 7.201 117.860 1.00 0.00 H +ATOM 2908 HA PHE A 183 15.850 5.552 120.152 1.00 0.00 H +ATOM 2909 HB3 PHE A 183 14.030 3.950 119.338 1.00 0.00 H +ATOM 2910 HB2 PHE A 183 13.463 5.206 118.295 1.00 0.00 H +ATOM 2911 HD1 PHE A 183 13.408 3.887 121.632 1.00 0.00 H +ATOM 2912 HD2 PHE A 183 12.672 7.414 119.349 1.00 0.00 H +ATOM 2913 HE1 PHE A 183 12.056 4.786 123.460 1.00 0.00 H +ATOM 2914 HE2 PHE A 183 11.315 8.311 121.181 1.00 0.00 H +ATOM 2915 HZ PHE A 183 11.002 6.999 123.242 1.00 0.00 H +ATOM 2916 N THR A 184 17.302 4.198 118.679 1.00 15.22 N +ATOM 2917 CA THR A 184 17.989 3.181 117.900 1.00 15.38 C +ATOM 2918 C THR A 184 17.071 1.974 117.757 1.00 15.11 C +ATOM 2919 O THR A 184 16.455 1.535 118.731 1.00 13.90 O +ATOM 2920 CB THR A 184 19.302 2.782 118.573 1.00 19.18 C +ATOM 2921 OG1 THR A 184 20.120 3.944 118.758 1.00 23.36 O +ATOM 2922 CG2 THR A 184 20.054 1.768 117.723 1.00 19.93 C +ATOM 2923 H THR A 184 17.643 4.446 119.597 1.00 0.00 H +ATOM 2924 HA THR A 184 18.206 3.580 116.909 1.00 0.00 H +ATOM 2925 HB THR A 184 19.084 2.341 119.546 1.00 0.00 H +ATOM 2926 HG1 THR A 184 20.944 3.692 119.181 1.00 0.00 H +ATOM 2927 HG21 THR A 184 20.986 1.497 118.219 1.00 0.00 H +ATOM 2928 HG22 THR A 184 19.440 0.877 117.592 1.00 0.00 H +ATOM 2929 HG23 THR A 184 20.275 2.203 116.748 1.00 0.00 H +ATOM 2930 N ILE A 185 16.949 1.456 116.540 1.00 17.08 N +ATOM 2931 CA ILE A 185 16.106 0.298 116.270 1.00 15.36 C +ATOM 2932 C ILE A 185 16.994 -0.929 116.140 1.00 20.12 C +ATOM 2933 O ILE A 185 17.953 -0.934 115.357 1.00 13.28 O +ATOM 2934 CB ILE A 185 15.255 0.501 115.005 1.00 11.40 C +ATOM 2935 CG1 ILE A 185 14.291 1.673 115.192 1.00 12.99 C +ATOM 2936 CG2 ILE A 185 14.484 -0.765 114.680 1.00 11.64 C +ATOM 2937 CD1 ILE A 185 13.846 2.308 113.894 1.00 13.53 C +ATOM 2938 H ILE A 185 17.450 1.865 115.764 1.00 0.00 H +ATOM 2939 HA ILE A 185 15.436 0.152 117.118 1.00 0.00 H +ATOM 2940 HB ILE A 185 15.920 0.727 114.171 1.00 0.00 H +ATOM 2941 HG13 ILE A 185 14.759 2.429 115.823 1.00 0.00 H +ATOM 2942 HG12 ILE A 185 13.416 1.336 115.748 1.00 0.00 H +ATOM 2943 HG21 ILE A 185 13.886 -0.607 113.782 1.00 0.00 H +ATOM 2944 HG22 ILE A 185 15.183 -1.584 114.510 1.00 0.00 H +ATOM 2945 HG23 ILE A 185 13.828 -1.015 115.513 1.00 0.00 H +ATOM 2946 HD11 ILE A 185 13.164 3.131 114.107 1.00 0.00 H +ATOM 2947 HD12 ILE A 185 14.716 2.687 113.357 1.00 0.00 H +ATOM 2948 HD13 ILE A 185 13.337 1.564 113.281 1.00 0.00 H +ATOM 2949 N CYS A 186 16.682 -1.967 116.910 1.00 19.41 N +ATOM 2950 CA CYS A 186 17.415 -3.222 116.875 1.00 20.76 C +ATOM 2951 C CYS A 186 16.477 -4.334 116.427 1.00 28.25 C +ATOM 2952 O CYS A 186 15.297 -4.347 116.792 1.00 24.18 O +ATOM 2953 CB CYS A 186 18.017 -3.548 118.246 1.00 24.99 C +ATOM 2954 SG CYS A 186 19.317 -2.403 118.785 1.00 35.15 S +ATOM 2955 H CYS A 186 15.907 -1.903 117.554 1.00 0.00 H +ATOM 2956 HA CYS A 186 18.224 -3.134 116.150 1.00 0.00 H +ATOM 2957 HB3 CYS A 186 18.412 -4.564 118.234 1.00 0.00 H +ATOM 2958 HB2 CYS A 186 17.223 -3.571 118.993 1.00 0.00 H +ATOM 2959 N ASN A 187 17.002 -5.262 115.632 1.00 31.67 N +ATOM 2960 CA ASN A 187 16.188 -6.334 115.074 1.00 27.32 C +ATOM 2961 C ASN A 187 15.924 -7.394 116.144 1.00 26.89 C +ATOM 2962 O ASN A 187 16.180 -7.192 117.334 1.00 30.81 O +ATOM 2963 CB ASN A 187 16.857 -6.914 113.828 1.00 33.20 C +ATOM 2964 CG ASN A 187 18.220 -7.521 114.116 1.00 33.05 C +ATOM 2965 OD1 ASN A 187 18.664 -7.578 115.262 1.00 30.66 O +ATOM 2966 ND2 ASN A 187 18.890 -7.983 113.066 1.00 33.63 N +ATOM 2967 H ASN A 187 17.985 -5.233 115.403 1.00 0.00 H +ATOM 2968 HA ASN A 187 15.229 -5.910 114.776 1.00 0.00 H +ATOM 2969 HB3 ASN A 187 16.960 -6.132 113.075 1.00 0.00 H +ATOM 2970 HB2 ASN A 187 16.209 -7.672 113.388 1.00 0.00 H +ATOM 2971 HD22 ASN A 187 19.802 -8.398 113.192 1.00 0.00 H +ATOM 2972 HD21 ASN A 187 18.487 -7.919 112.142 1.00 0.00 H +ATOM 2973 N ALA A 188 15.400 -8.547 115.721 1.00 28.12 N +ATOM 2974 CA ALA A 188 15.095 -9.612 116.671 1.00 29.06 C +ATOM 2975 C ALA A 188 16.363 -10.156 117.317 1.00 33.65 C +ATOM 2976 O ALA A 188 16.369 -10.486 118.509 1.00 39.60 O +ATOM 2977 CB ALA A 188 14.323 -10.732 115.974 1.00 24.30 C +ATOM 2978 H ALA A 188 15.212 -8.686 114.738 1.00 0.00 H +ATOM 2979 HA ALA A 188 14.462 -9.198 117.456 1.00 0.00 H +ATOM 2980 HB1 ALA A 188 14.100 -11.522 116.692 1.00 0.00 H +ATOM 2981 HB2 ALA A 188 13.391 -10.335 115.570 1.00 0.00 H +ATOM 2982 HB3 ALA A 188 14.926 -11.139 115.162 1.00 0.00 H +ATOM 2983 N GLU A 189 17.447 -10.248 116.550 1.00 31.57 N +ATOM 2984 CA GLU A 189 18.726 -10.745 117.041 1.00 25.65 C +ATOM 2985 C GLU A 189 19.502 -9.698 117.822 1.00 28.80 C +ATOM 2986 O GLU A 189 20.658 -9.949 118.183 1.00 26.46 O +ATOM 2987 CB GLU A 189 19.589 -11.254 115.878 1.00 26.31 C +ATOM 2988 CG GLU A 189 19.010 -12.423 115.075 1.00 29.30 C +ATOM 2989 CD GLU A 189 17.742 -12.068 114.316 1.00 36.82 C +ATOM 2990 OE1 GLU A 189 17.812 -11.199 113.420 1.00 35.30 O +ATOM 2991 OE2 GLU A 189 16.679 -12.655 114.615 1.00 42.07 O1- +ATOM 2992 H GLU A 189 17.405 -9.967 115.581 1.00 0.00 H +ATOM 2993 HA GLU A 189 18.528 -11.585 117.707 1.00 0.00 H +ATOM 2994 HB3 GLU A 189 20.574 -11.529 116.255 1.00 0.00 H +ATOM 2995 HB2 GLU A 189 19.807 -10.427 115.203 1.00 0.00 H +ATOM 2996 HG3 GLU A 189 18.808 -13.258 115.746 1.00 0.00 H +ATOM 2997 HG2 GLU A 189 19.761 -12.788 114.374 1.00 0.00 H +ATOM 2998 N MET A 190 18.891 -8.539 118.077 1.00 28.38 N +ATOM 2999 CA MET A 190 19.543 -7.419 118.757 1.00 27.83 C +ATOM 3000 C MET A 190 20.725 -6.895 117.944 1.00 28.82 C +ATOM 3001 O MET A 190 21.815 -6.661 118.467 1.00 29.01 O +ATOM 3002 CB MET A 190 19.968 -7.797 120.177 1.00 27.96 C +ATOM 3003 CG MET A 190 18.817 -7.848 121.168 1.00 24.91 C +ATOM 3004 SD MET A 190 17.841 -6.329 121.191 1.00 29.14 S +ATOM 3005 CE MET A 190 16.881 -6.564 122.685 1.00 18.46 C +ATOM 3006 H MET A 190 17.930 -8.402 117.797 1.00 0.00 H +ATOM 3007 HA MET A 190 18.814 -6.612 118.835 1.00 0.00 H +ATOM 3008 HB3 MET A 190 20.718 -7.090 120.530 1.00 0.00 H +ATOM 3009 HB2 MET A 190 20.472 -8.763 120.158 1.00 0.00 H +ATOM 3010 HG3 MET A 190 19.208 -8.043 122.167 1.00 0.00 H +ATOM 3011 HG2 MET A 190 18.169 -8.691 120.928 1.00 0.00 H +ATOM 3012 HE1 MET A 190 16.227 -5.705 122.836 1.00 0.00 H +ATOM 3013 HE2 MET A 190 16.278 -7.467 122.592 1.00 0.00 H +ATOM 3014 HE3 MET A 190 17.553 -6.663 123.538 1.00 0.00 H +ATOM 3015 N GLN A 191 20.508 -6.722 116.646 1.00 37.09 N +ATOM 3016 CA GLN A 191 21.451 -6.035 115.777 1.00 32.98 C +ATOM 3017 C GLN A 191 20.908 -4.642 115.493 1.00 32.46 C +ATOM 3018 O GLN A 191 19.732 -4.491 115.144 1.00 31.61 O +ATOM 3019 CB GLN A 191 21.658 -6.810 114.473 1.00 29.52 C +ATOM 3020 CG GLN A 191 23.069 -7.339 114.226 1.00 45.17 C +ATOM 3021 CD GLN A 191 24.077 -6.260 113.856 1.00 40.01 C +ATOM 3022 OE1 GLN A 191 23.904 -5.081 114.169 1.00 44.11 O +ATOM 3023 NE2 GLN A 191 25.134 -6.666 113.163 1.00 31.33 N +ATOM 3024 H GLN A 191 19.660 -7.074 116.224 1.00 0.00 H +ATOM 3025 HA GLN A 191 22.407 -5.945 116.292 1.00 0.00 H +ATOM 3026 HB3 GLN A 191 21.356 -6.186 113.632 1.00 0.00 H +ATOM 3027 HB2 GLN A 191 20.951 -7.638 114.431 1.00 0.00 H +ATOM 3028 HG3 GLN A 191 23.040 -8.092 113.438 1.00 0.00 H +ATOM 3029 HG2 GLN A 191 23.416 -7.870 115.113 1.00 0.00 H +ATOM 3030 HE22 GLN A 191 25.841 -6.001 112.885 1.00 0.00 H +ATOM 3031 HE21 GLN A 191 25.231 -7.640 112.914 1.00 0.00 H +ATOM 3032 N GLU A 192 21.750 -3.626 115.668 1.00 21.97 N +ATOM 3033 CA GLU A 192 21.341 -2.252 115.393 1.00 22.81 C +ATOM 3034 C GLU A 192 21.109 -2.100 113.895 1.00 31.26 C +ATOM 3035 O GLU A 192 22.048 -2.206 113.099 1.00 29.43 O +ATOM 3036 CB GLU A 192 22.395 -1.270 115.895 1.00 24.10 C +ATOM 3037 CG GLU A 192 22.325 0.100 115.245 1.00 30.89 C +ATOM 3038 CD GLU A 192 23.182 1.129 115.954 1.00 44.91 C +ATOM 3039 OE1 GLU A 192 23.751 0.803 117.017 1.00 44.71 O +ATOM 3040 OE2 GLU A 192 23.284 2.266 115.447 1.00 51.98 O1- +ATOM 3041 H GLU A 192 22.689 -3.799 115.996 1.00 0.00 H +ATOM 3042 HA GLU A 192 20.404 -2.055 115.914 1.00 0.00 H +ATOM 3043 HB3 GLU A 192 23.387 -1.694 115.739 1.00 0.00 H +ATOM 3044 HB2 GLU A 192 22.303 -1.162 116.976 1.00 0.00 H +ATOM 3045 HG3 GLU A 192 21.290 0.440 115.228 1.00 0.00 H +ATOM 3046 HG2 GLU A 192 22.638 0.023 114.204 1.00 0.00 H +ATOM 3047 N VAL A 193 19.858 -1.869 113.505 1.00 19.74 N +ATOM 3048 CA VAL A 193 19.492 -1.850 112.095 1.00 19.70 C +ATOM 3049 C VAL A 193 18.908 -0.521 111.638 1.00 19.24 C +ATOM 3050 O VAL A 193 18.954 -0.229 110.431 1.00 19.49 O +ATOM 3051 CB VAL A 193 18.515 -2.998 111.760 1.00 22.93 C +ATOM 3052 CG1 VAL A 193 19.175 -4.347 111.998 1.00 23.68 C +ATOM 3053 CG2 VAL A 193 17.238 -2.868 112.579 1.00 20.41 C +ATOM 3054 H VAL A 193 19.137 -1.702 114.193 1.00 0.00 H +ATOM 3055 HA VAL A 193 20.403 -2.020 111.520 1.00 0.00 H +ATOM 3056 HB VAL A 193 18.253 -2.927 110.704 1.00 0.00 H +ATOM 3057 HG11 VAL A 193 18.472 -5.144 111.757 1.00 0.00 H +ATOM 3058 HG12 VAL A 193 20.057 -4.437 111.364 1.00 0.00 H +ATOM 3059 HG13 VAL A 193 19.470 -4.428 113.044 1.00 0.00 H +ATOM 3060 HG21 VAL A 193 16.561 -3.685 112.330 1.00 0.00 H +ATOM 3061 HG22 VAL A 193 17.481 -2.909 113.641 1.00 0.00 H +ATOM 3062 HG23 VAL A 193 16.756 -1.917 112.353 1.00 0.00 H +ATOM 3063 N GLY A 194 18.361 0.302 112.529 1.00 15.80 N +ATOM 3064 CA GLY A 194 17.736 1.529 112.077 1.00 16.41 C +ATOM 3065 C GLY A 194 17.666 2.568 113.174 1.00 16.18 C +ATOM 3066 O GLY A 194 18.166 2.376 114.284 1.00 17.91 O +ATOM 3067 H GLY A 194 18.383 0.070 113.512 1.00 0.00 H +ATOM 3068 HA3 GLY A 194 16.730 1.312 111.718 1.00 0.00 H +ATOM 3069 HA2 GLY A 194 18.295 1.931 111.232 1.00 0.00 H +ATOM 3070 N VAL A 195 17.034 3.689 112.834 1.00 13.39 N +ATOM 3071 CA VAL A 195 16.826 4.795 113.760 1.00 15.08 C +ATOM 3072 C VAL A 195 15.484 5.435 113.431 1.00 12.46 C +ATOM 3073 O VAL A 195 15.115 5.569 112.261 1.00 13.05 O +ATOM 3074 CB VAL A 195 17.988 5.814 113.699 1.00 13.67 C +ATOM 3075 CG1 VAL A 195 18.003 6.555 112.368 1.00 12.29 C +ATOM 3076 CG2 VAL A 195 17.903 6.792 114.862 1.00 9.44 C +ATOM 3077 H VAL A 195 16.673 3.801 111.897 1.00 0.00 H +ATOM 3078 HA VAL A 195 16.776 4.392 114.771 1.00 0.00 H +ATOM 3079 HB VAL A 195 18.924 5.263 113.789 1.00 0.00 H +ATOM 3080 HG11 VAL A 195 18.831 7.264 112.356 1.00 0.00 H +ATOM 3081 HG12 VAL A 195 18.126 5.840 111.555 1.00 0.00 H +ATOM 3082 HG13 VAL A 195 17.063 7.092 112.240 1.00 0.00 H +ATOM 3083 HG21 VAL A 195 18.729 7.501 114.802 1.00 0.00 H +ATOM 3084 HG22 VAL A 195 16.957 7.332 114.815 1.00 0.00 H +ATOM 3085 HG23 VAL A 195 17.962 6.245 115.803 1.00 0.00 H +ATOM 3086 N GLY A 196 14.738 5.805 114.471 1.00 9.44 N +ATOM 3087 CA GLY A 196 13.409 6.344 114.268 1.00 11.29 C +ATOM 3088 C GLY A 196 12.969 7.208 115.429 1.00 13.13 C +ATOM 3089 O GLY A 196 13.619 7.270 116.475 1.00 11.70 O +ATOM 3090 H GLY A 196 15.098 5.711 115.410 1.00 0.00 H +ATOM 3091 HA3 GLY A 196 12.702 5.525 114.137 1.00 0.00 H +ATOM 3092 HA2 GLY A 196 13.393 6.933 113.351 1.00 0.00 H +ATOM 3093 N LEU A 197 11.839 7.880 115.225 1.00 13.62 N +ATOM 3094 CA LEU A 197 11.249 8.756 116.227 1.00 13.24 C +ATOM 3095 C LEU A 197 9.878 8.227 116.617 1.00 11.13 C +ATOM 3096 O LEU A 197 9.057 7.912 115.750 1.00 12.69 O +ATOM 3097 CB LEU A 197 11.142 10.193 115.712 1.00 10.84 C +ATOM 3098 CG LEU A 197 12.433 11.008 115.814 1.00 13.96 C +ATOM 3099 CD1 LEU A 197 12.579 11.942 114.631 1.00 12.68 C +ATOM 3100 CD2 LEU A 197 12.474 11.785 117.121 1.00 18.74 C +ATOM 3101 H LEU A 197 11.352 7.794 114.344 1.00 0.00 H +ATOM 3102 HA LEU A 197 11.887 8.751 117.111 1.00 0.00 H +ATOM 3103 HB3 LEU A 197 10.346 10.710 116.248 1.00 0.00 H +ATOM 3104 HB2 LEU A 197 10.804 10.181 114.676 1.00 0.00 H +ATOM 3105 HG LEU A 197 13.274 10.315 115.805 1.00 0.00 H +ATOM 3106 HD11 LEU A 197 13.504 12.510 114.728 1.00 0.00 H +ATOM 3107 HD12 LEU A 197 12.605 11.361 113.709 1.00 0.00 H +ATOM 3108 HD13 LEU A 197 11.733 12.629 114.603 1.00 0.00 H +ATOM 3109 HD21 LEU A 197 13.400 12.358 117.175 1.00 0.00 H +ATOM 3110 HD22 LEU A 197 11.623 12.465 117.167 1.00 0.00 H +ATOM 3111 HD23 LEU A 197 12.429 11.090 117.959 1.00 0.00 H +ATOM 3112 N TYR A 198 9.645 8.123 117.923 1.00 12.07 N +ATOM 3113 CA TYR A 198 8.374 7.671 118.485 1.00 10.17 C +ATOM 3114 C TYR A 198 7.981 8.693 119.542 1.00 13.15 C +ATOM 3115 O TYR A 198 8.257 8.509 120.736 1.00 12.96 O +ATOM 3116 CB TYR A 198 8.487 6.264 119.075 1.00 12.70 C +ATOM 3117 CG TYR A 198 9.058 5.222 118.132 1.00 14.48 C +ATOM 3118 CD1 TYR A 198 8.234 4.291 117.513 1.00 16.25 C +ATOM 3119 CD2 TYR A 198 10.424 5.159 117.876 1.00 15.50 C +ATOM 3120 CE1 TYR A 198 8.751 3.335 116.657 1.00 13.82 C +ATOM 3121 CE2 TYR A 198 10.949 4.210 117.020 1.00 12.81 C +ATOM 3122 CZ TYR A 198 10.109 3.300 116.415 1.00 14.69 C +ATOM 3123 OH TYR A 198 10.630 2.351 115.564 1.00 13.57 O +ATOM 3124 H TYR A 198 10.368 8.363 118.586 1.00 0.00 H +ATOM 3125 HA TYR A 198 7.620 7.666 117.698 1.00 0.00 H +ATOM 3126 HB3 TYR A 198 7.506 5.938 119.421 1.00 0.00 H +ATOM 3127 HB2 TYR A 198 9.092 6.300 119.981 1.00 0.00 H +ATOM 3128 HD1 TYR A 198 7.170 4.305 117.697 1.00 0.00 H +ATOM 3129 HD2 TYR A 198 11.095 5.860 118.350 1.00 0.00 H +ATOM 3130 HE1 TYR A 198 8.093 2.622 116.183 1.00 0.00 H +ATOM 3131 HE2 TYR A 198 12.012 4.184 116.828 1.00 0.00 H +ATOM 3132 HH TYR A 198 11.582 2.462 115.504 1.00 0.00 H +ATOM 3133 N PRO A 199 7.332 9.790 119.136 1.00 15.77 N +ATOM 3134 CA PRO A 199 7.142 10.916 120.066 1.00 13.81 C +ATOM 3135 C PRO A 199 6.346 10.569 121.313 1.00 13.67 C +ATOM 3136 O PRO A 199 6.678 11.058 122.400 1.00 12.38 O +ATOM 3137 CB PRO A 199 6.423 11.951 119.191 1.00 11.42 C +ATOM 3138 CG PRO A 199 6.877 11.627 117.801 1.00 13.40 C +ATOM 3139 CD PRO A 199 6.859 10.125 117.783 1.00 15.67 C +ATOM 3140 HA PRO A 199 8.116 11.308 120.359 1.00 0.00 H +ATOM 3141 HB3 PRO A 199 6.766 12.950 119.459 1.00 0.00 H +ATOM 3142 HB2 PRO A 199 5.346 11.798 119.263 1.00 0.00 H +ATOM 3143 HG3 PRO A 199 7.901 11.976 117.667 1.00 0.00 H +ATOM 3144 HG2 PRO A 199 6.145 12.004 117.087 1.00 0.00 H +ATOM 3145 HD2 PRO A 199 5.832 9.780 117.666 1.00 0.00 H +ATOM 3146 HD3 PRO A 199 7.583 9.766 117.051 1.00 0.00 H +ATOM 3147 N SER A 200 5.299 9.749 121.192 1.00 12.28 N +ATOM 3148 CA SER A 200 4.562 9.327 122.380 1.00 11.04 C +ATOM 3149 C SER A 200 5.454 8.526 123.319 1.00 9.95 C +ATOM 3150 O SER A 200 5.398 8.699 124.542 1.00 11.59 O +ATOM 3151 CB SER A 200 3.333 8.509 121.982 1.00 12.48 C +ATOM 3152 OG SER A 200 2.354 9.319 121.357 1.00 14.60 O +ATOM 3153 H SER A 200 5.017 9.421 120.279 1.00 0.00 H +ATOM 3154 HA SER A 200 4.223 10.219 122.907 1.00 0.00 H +ATOM 3155 HB3 SER A 200 2.905 8.042 122.869 1.00 0.00 H +ATOM 3156 HB2 SER A 200 3.633 7.712 121.302 1.00 0.00 H +ATOM 3157 HG SER A 200 1.596 8.780 121.119 1.00 0.00 H +ATOM 3158 N ILE A 201 6.287 7.643 122.762 1.00 10.92 N +ATOM 3159 CA ILE A 201 7.238 6.888 123.566 1.00 8.32 C +ATOM 3160 C ILE A 201 8.335 7.787 124.121 1.00 13.85 C +ATOM 3161 O ILE A 201 8.932 7.469 125.158 1.00 9.94 O +ATOM 3162 CB ILE A 201 7.823 5.737 122.725 1.00 8.81 C +ATOM 3163 CG1 ILE A 201 6.694 4.938 122.071 1.00 14.59 C +ATOM 3164 CG2 ILE A 201 8.687 4.819 123.572 1.00 7.81 C +ATOM 3165 CD1 ILE A 201 5.719 4.336 123.063 1.00 11.54 C +ATOM 3166 H ILE A 201 6.265 7.488 121.764 1.00 0.00 H +ATOM 3167 HA ILE A 201 6.699 6.452 124.407 1.00 0.00 H +ATOM 3168 HB ILE A 201 8.443 6.165 121.938 1.00 0.00 H +ATOM 3169 HG13 ILE A 201 7.121 4.145 121.457 1.00 0.00 H +ATOM 3170 HG12 ILE A 201 6.153 5.580 121.376 1.00 0.00 H +ATOM 3171 HG21 ILE A 201 9.085 4.017 122.950 1.00 0.00 H +ATOM 3172 HG22 ILE A 201 9.511 5.389 124.001 1.00 0.00 H +ATOM 3173 HG23 ILE A 201 8.086 4.391 124.374 1.00 0.00 H +ATOM 3174 HD11 ILE A 201 4.947 3.785 122.526 1.00 0.00 H +ATOM 3175 HD12 ILE A 201 6.251 3.658 123.730 1.00 0.00 H +ATOM 3176 HD13 ILE A 201 5.257 5.132 123.647 1.00 0.00 H +ATOM 3177 N SER A 202 8.603 8.921 123.470 1.00 15.14 N +ATOM 3178 CA SER A 202 9.619 9.857 123.937 1.00 12.34 C +ATOM 3179 C SER A 202 9.234 10.565 125.229 1.00 12.38 C +ATOM 3180 O SER A 202 10.001 11.413 125.692 1.00 15.20 O +ATOM 3181 CB SER A 202 9.921 10.893 122.854 1.00 8.90 C +ATOM 3182 OG SER A 202 10.537 10.290 121.730 1.00 19.59 O +ATOM 3183 H SER A 202 8.096 9.152 122.628 1.00 0.00 H +ATOM 3184 HA SER A 202 10.533 9.293 124.124 1.00 0.00 H +ATOM 3185 HB3 SER A 202 10.579 11.661 123.260 1.00 0.00 H +ATOM 3186 HB2 SER A 202 8.994 11.375 122.544 1.00 0.00 H +ATOM 3187 HG SER A 202 10.716 10.959 121.065 1.00 0.00 H +ATOM 3188 N LEU A 203 8.075 10.259 125.812 1.00 14.55 N +ATOM 3189 CA LEU A 203 7.742 10.783 127.130 1.00 13.44 C +ATOM 3190 C LEU A 203 8.468 10.045 128.244 1.00 13.45 C +ATOM 3191 O LEU A 203 8.603 10.589 129.345 1.00 11.82 O +ATOM 3192 CB LEU A 203 6.232 10.707 127.366 1.00 15.37 C +ATOM 3193 CG LEU A 203 5.379 11.831 126.779 1.00 17.41 C +ATOM 3194 CD1 LEU A 203 3.914 11.420 126.716 1.00 12.21 C +ATOM 3195 CD2 LEU A 203 5.550 13.101 127.593 1.00 12.63 C +ATOM 3196 H LEU A 203 7.416 9.657 125.340 1.00 0.00 H +ATOM 3197 HA LEU A 203 8.040 11.831 127.165 1.00 0.00 H +ATOM 3198 HB3 LEU A 203 6.040 10.633 128.436 1.00 0.00 H +ATOM 3199 HB2 LEU A 203 5.860 9.749 127.004 1.00 0.00 H +ATOM 3200 HG LEU A 203 5.723 12.027 125.763 1.00 0.00 H +ATOM 3201 HD11 LEU A 203 3.325 12.235 126.295 1.00 0.00 H +ATOM 3202 HD12 LEU A 203 3.811 10.536 126.087 1.00 0.00 H +ATOM 3203 HD13 LEU A 203 3.556 11.195 127.721 1.00 0.00 H +ATOM 3204 HD21 LEU A 203 4.937 13.894 127.164 1.00 0.00 H +ATOM 3205 HD22 LEU A 203 5.239 12.918 128.622 1.00 0.00 H +ATOM 3206 HD23 LEU A 203 6.597 13.404 127.579 1.00 0.00 H +ATOM 3207 N LEU A 204 8.942 8.830 127.980 1.00 9.36 N +ATOM 3208 CA LEU A 204 9.559 8.010 129.014 1.00 14.40 C +ATOM 3209 C LEU A 204 10.900 8.601 129.430 1.00 13.50 C +ATOM 3210 O LEU A 204 11.798 8.776 128.599 1.00 7.43 O +ATOM 3211 CB LEU A 204 9.735 6.580 128.512 1.00 9.58 C +ATOM 3212 CG LEU A 204 8.443 5.787 128.303 1.00 12.15 C +ATOM 3213 CD1 LEU A 204 8.595 4.793 127.166 1.00 17.51 C +ATOM 3214 CD2 LEU A 204 8.056 5.074 129.579 1.00 14.97 C +ATOM 3215 H LEU A 204 8.879 8.456 127.044 1.00 0.00 H +ATOM 3216 HA LEU A 204 8.902 7.994 129.883 1.00 0.00 H +ATOM 3217 HB3 LEU A 204 10.385 6.035 129.197 1.00 0.00 H +ATOM 3218 HB2 LEU A 204 10.304 6.592 127.582 1.00 0.00 H +ATOM 3219 HG LEU A 204 7.648 6.486 128.045 1.00 0.00 H +ATOM 3220 HD11 LEU A 204 7.663 4.242 127.037 1.00 0.00 H +ATOM 3221 HD12 LEU A 204 8.831 5.327 126.245 1.00 0.00 H +ATOM 3222 HD13 LEU A 204 9.400 4.096 127.398 1.00 0.00 H +ATOM 3223 HD21 LEU A 204 7.135 4.513 129.418 1.00 0.00 H +ATOM 3224 HD22 LEU A 204 8.852 4.388 129.869 1.00 0.00 H +ATOM 3225 HD23 LEU A 204 7.901 5.806 130.372 1.00 0.00 H +ATOM 3226 N ASN A 205 11.035 8.910 130.716 1.00 9.48 N +ATOM 3227 CA ASN A 205 12.302 9.375 131.252 1.00 8.85 C +ATOM 3228 C ASN A 205 13.224 8.191 131.532 1.00 11.86 C +ATOM 3229 O ASN A 205 12.796 7.035 131.594 1.00 8.52 O +ATOM 3230 CB ASN A 205 12.078 10.194 132.523 1.00 14.72 C +ATOM 3231 CG ASN A 205 11.570 11.592 132.230 1.00 13.03 C +ATOM 3232 OD1 ASN A 205 12.051 12.258 131.314 1.00 6.13 O +ATOM 3233 ND2 ASN A 205 10.589 12.042 133.005 1.00 13.83 N +ATOM 3234 H ASN A 205 10.247 8.823 131.342 1.00 0.00 H +ATOM 3235 HA ASN A 205 12.778 10.015 130.508 1.00 0.00 H +ATOM 3236 HB3 ASN A 205 13.011 10.257 133.082 1.00 0.00 H +ATOM 3237 HB2 ASN A 205 11.366 9.677 133.166 1.00 0.00 H +ATOM 3238 HD22 ASN A 205 10.211 12.967 132.856 1.00 0.00 H +ATOM 3239 HD21 ASN A 205 10.221 11.459 133.743 1.00 0.00 H +ATOM 3240 N HIS A 206 14.506 8.496 131.705 1.00 12.82 N +ATOM 3241 CA HIS A 206 15.533 7.475 131.845 1.00 12.29 C +ATOM 3242 C HIS A 206 15.694 7.034 133.295 1.00 11.25 C +ATOM 3243 O HIS A 206 15.477 7.806 134.233 1.00 13.70 O +ATOM 3244 CB HIS A 206 16.878 7.982 131.317 1.00 8.06 C +ATOM 3245 CG HIS A 206 18.052 7.186 131.796 1.00 8.38 C +ATOM 3246 ND1 HIS A 206 18.487 6.046 131.157 1.00 12.39 N +ATOM 3247 CD2 HIS A 206 18.872 7.355 132.861 1.00 9.05 C +ATOM 3248 CE1 HIS A 206 19.528 5.550 131.803 1.00 9.88 C +ATOM 3249 NE2 HIS A 206 19.781 6.326 132.841 1.00 9.19 N +ATOM 3250 H HIS A 206 14.794 9.463 131.743 1.00 0.00 H +ATOM 3251 HA HIS A 206 15.237 6.608 131.254 1.00 0.00 H +ATOM 3252 HB3 HIS A 206 17.008 9.026 131.602 1.00 0.00 H +ATOM 3253 HB2 HIS A 206 16.862 7.982 130.227 1.00 0.00 H +ATOM 3254 HD1 HIS A 206 18.013 5.721 130.326 1.00 0.00 H +ATOM 3255 HD2 HIS A 206 18.726 8.192 133.527 1.00 0.00 H +ATOM 3256 HE1 HIS A 206 20.009 4.652 131.444 1.00 0.00 H +ATOM 3257 N SER A 207 16.083 5.772 133.465 1.00 10.56 N +ATOM 3258 CA SER A 207 16.521 5.254 134.752 1.00 10.84 C +ATOM 3259 C SER A 207 17.547 4.159 134.504 1.00 13.18 C +ATOM 3260 O SER A 207 17.375 3.334 133.602 1.00 8.82 O +ATOM 3261 CB SER A 207 15.351 4.706 135.576 1.00 10.51 C +ATOM 3262 OG SER A 207 15.821 3.954 136.682 1.00 12.21 O +ATOM 3263 H SER A 207 16.081 5.133 132.683 1.00 0.00 H +ATOM 3264 HA SER A 207 16.996 6.060 135.311 1.00 0.00 H +ATOM 3265 HB3 SER A 207 14.728 4.072 134.945 1.00 0.00 H +ATOM 3266 HB2 SER A 207 14.740 5.534 135.934 1.00 0.00 H +ATOM 3267 HG SER A 207 15.074 3.621 137.184 1.00 0.00 H +ATOM 3268 N CYS A 208 18.616 4.159 135.302 1.00 14.73 N +ATOM 3269 CA CYS A 208 19.613 3.100 135.199 1.00 9.50 C +ATOM 3270 C CYS A 208 19.115 1.774 135.753 1.00 8.83 C +ATOM 3271 O CYS A 208 19.825 0.768 135.643 1.00 7.89 O +ATOM 3272 CB CYS A 208 20.903 3.515 135.908 1.00 12.76 C +ATOM 3273 SG CYS A 208 21.598 5.070 135.310 1.00 12.51 S1- +ATOM 3274 H CYS A 208 18.738 4.895 135.982 1.00 0.00 H +ATOM 3275 HA CYS A 208 19.842 2.957 134.143 1.00 0.00 H +ATOM 3276 HB3 CYS A 208 21.645 2.723 135.802 1.00 0.00 H +ATOM 3277 HB2 CYS A 208 20.718 3.590 136.980 1.00 0.00 H +ATOM 3278 N ASP A 209 17.923 1.755 136.341 1.00 10.03 N +ATOM 3279 CA ASP A 209 17.259 0.521 136.759 1.00 9.14 C +ATOM 3280 C ASP A 209 15.779 0.682 136.449 1.00 11.49 C +ATOM 3281 O ASP A 209 14.963 0.956 137.337 1.00 8.41 O +ATOM 3282 CB ASP A 209 17.502 0.234 138.240 1.00 10.86 C +ATOM 3283 CG ASP A 209 16.982 -1.121 138.664 1.00 17.71 C +ATOM 3284 OD1 ASP A 209 16.461 -1.865 137.806 1.00 19.63 O +ATOM 3285 OD2 ASP A 209 17.111 -1.450 139.858 1.00 19.48 O1- +ATOM 3286 H ASP A 209 17.433 2.620 136.518 1.00 0.00 H +ATOM 3287 HA ASP A 209 17.654 -0.307 136.171 1.00 0.00 H +ATOM 3288 HB3 ASP A 209 17.027 1.009 138.842 1.00 0.00 H +ATOM 3289 HB2 ASP A 209 18.570 0.294 138.450 1.00 0.00 H +ATOM 3290 N PRO A 210 15.397 0.520 135.185 1.00 9.84 N +ATOM 3291 CA PRO A 210 14.041 0.889 134.764 1.00 11.14 C +ATOM 3292 C PRO A 210 12.998 -0.097 135.267 1.00 14.34 C +ATOM 3293 O PRO A 210 13.297 -1.200 135.727 1.00 13.25 O +ATOM 3294 CB PRO A 210 14.129 0.865 133.236 1.00 11.65 C +ATOM 3295 CG PRO A 210 15.234 -0.092 132.941 1.00 10.61 C +ATOM 3296 CD PRO A 210 16.222 0.045 134.062 1.00 11.54 C +ATOM 3297 HA PRO A 210 13.802 1.895 135.109 1.00 0.00 H +ATOM 3298 HB3 PRO A 210 14.404 1.856 132.875 1.00 0.00 H +ATOM 3299 HB2 PRO A 210 13.196 0.477 132.827 1.00 0.00 H +ATOM 3300 HG3 PRO A 210 15.712 0.185 132.001 1.00 0.00 H +ATOM 3301 HG2 PRO A 210 14.839 -1.108 132.928 1.00 0.00 H +ATOM 3302 HD2 PRO A 210 16.629 -0.936 134.305 1.00 0.00 H +ATOM 3303 HD3 PRO A 210 16.954 0.810 133.805 1.00 0.00 H +ATOM 3304 N ASN A 211 11.740 0.334 135.170 1.00 13.67 N +ATOM 3305 CA ASN A 211 10.590 -0.520 135.430 1.00 14.84 C +ATOM 3306 C ASN A 211 9.847 -0.899 134.158 1.00 15.08 C +ATOM 3307 O ASN A 211 8.831 -1.599 134.232 1.00 19.47 O +ATOM 3308 CB ASN A 211 9.631 0.160 136.419 1.00 13.59 C +ATOM 3309 CG ASN A 211 9.157 1.528 135.944 1.00 15.31 C +ATOM 3310 OD1 ASN A 211 9.236 1.858 134.760 1.00 12.90 O +ATOM 3311 ND2 ASN A 211 8.655 2.329 136.877 1.00 13.22 N +ATOM 3312 H ASN A 211 11.553 1.291 134.906 1.00 0.00 H +ATOM 3313 HA ASN A 211 10.952 -1.438 135.892 1.00 0.00 H +ATOM 3314 HB3 ASN A 211 10.122 0.263 137.387 1.00 0.00 H +ATOM 3315 HB2 ASN A 211 8.768 -0.484 136.587 1.00 0.00 H +ATOM 3316 HD22 ASN A 211 8.323 3.250 136.627 1.00 0.00 H +ATOM 3317 HD21 ASN A 211 8.605 2.018 137.836 1.00 0.00 H +ATOM 3318 N CYS A 212 10.324 -0.454 132.997 1.00 14.84 N +ATOM 3319 CA CYS A 212 9.721 -0.780 131.714 1.00 13.20 C +ATOM 3320 C CYS A 212 10.826 -1.136 130.731 1.00 16.65 C +ATOM 3321 O CYS A 212 12.017 -0.997 131.024 1.00 19.21 O +ATOM 3322 CB CYS A 212 8.875 0.381 131.174 1.00 14.02 C +ATOM 3323 SG CYS A 212 7.422 0.777 132.167 1.00 14.80 S +ATOM 3324 H CYS A 212 11.141 0.139 132.981 1.00 0.00 H +ATOM 3325 HA CYS A 212 9.077 -1.650 131.843 1.00 0.00 H +ATOM 3326 HB3 CYS A 212 8.565 0.157 130.153 1.00 0.00 H +ATOM 3327 HB2 CYS A 212 9.500 1.269 131.079 1.00 0.00 H +ATOM 3328 HG CYS A 212 6.764 1.796 131.608 1.00 0.00 H +ATOM 3329 N SER A 213 10.423 -1.597 129.549 1.00 19.66 N +ATOM 3330 CA SER A 213 11.389 -1.966 128.526 1.00 16.39 C +ATOM 3331 C SER A 213 10.787 -1.772 127.144 1.00 12.33 C +ATOM 3332 O SER A 213 9.568 -1.845 126.960 1.00 15.72 O +ATOM 3333 CB SER A 213 11.862 -3.414 128.686 1.00 17.50 C +ATOM 3334 OG SER A 213 13.034 -3.639 127.923 1.00 24.95 O +ATOM 3335 H SER A 213 9.437 -1.694 129.354 1.00 0.00 H +ATOM 3336 HA SER A 213 12.255 -1.310 128.619 1.00 0.00 H +ATOM 3337 HB3 SER A 213 11.076 -4.092 128.352 1.00 0.00 H +ATOM 3338 HB2 SER A 213 12.069 -3.614 129.737 1.00 0.00 H +ATOM 3339 HG SER A 213 13.318 -4.549 128.033 1.00 0.00 H +ATOM 3340 N ILE A 214 11.666 -1.527 126.176 1.00 18.29 N +ATOM 3341 CA ILE A 214 11.303 -1.355 124.775 1.00 18.35 C +ATOM 3342 C ILE A 214 11.824 -2.557 124.000 1.00 15.29 C +ATOM 3343 O ILE A 214 12.954 -3.008 124.222 1.00 18.52 O +ATOM 3344 CB ILE A 214 11.881 -0.043 124.202 1.00 19.25 C +ATOM 3345 CG1 ILE A 214 11.023 1.167 124.586 1.00 17.18 C +ATOM 3346 CG2 ILE A 214 12.009 -0.117 122.688 1.00 21.51 C +ATOM 3347 CD1 ILE A 214 9.630 0.833 125.046 1.00 15.99 C +ATOM 3348 H ILE A 214 12.649 -1.450 126.394 1.00 0.00 H +ATOM 3349 HA ILE A 214 10.216 -1.327 124.693 1.00 0.00 H +ATOM 3350 HB ILE A 214 12.877 0.101 124.620 1.00 0.00 H +ATOM 3351 HG13 ILE A 214 10.969 1.854 123.741 1.00 0.00 H +ATOM 3352 HG12 ILE A 214 11.532 1.738 125.362 1.00 0.00 H +ATOM 3353 HG21 ILE A 214 12.419 0.820 122.311 1.00 0.00 H +ATOM 3354 HG22 ILE A 214 12.674 -0.938 122.419 1.00 0.00 H +ATOM 3355 HG23 ILE A 214 11.026 -0.287 122.248 1.00 0.00 H +ATOM 3356 HD11 ILE A 214 9.099 1.752 125.296 1.00 0.00 H +ATOM 3357 HD12 ILE A 214 9.099 0.312 124.249 1.00 0.00 H +ATOM 3358 HD13 ILE A 214 9.681 0.193 125.927 1.00 0.00 H +ATOM 3359 N VAL A 215 10.996 -3.085 123.102 1.00 14.49 N +ATOM 3360 CA VAL A 215 11.421 -4.128 122.178 1.00 14.46 C +ATOM 3361 C VAL A 215 10.845 -3.813 120.804 1.00 18.02 C +ATOM 3362 O VAL A 215 9.763 -3.230 120.680 1.00 16.20 O +ATOM 3363 CB VAL A 215 11.010 -5.539 122.663 1.00 16.81 C +ATOM 3364 CG1 VAL A 215 9.571 -5.857 122.284 1.00 13.40 C +ATOM 3365 CG2 VAL A 215 11.964 -6.584 122.109 1.00 14.50 C +ATOM 3366 H VAL A 215 10.040 -2.764 123.046 1.00 0.00 H +ATOM 3367 HA VAL A 215 12.508 -4.096 122.106 1.00 0.00 H +ATOM 3368 HB VAL A 215 11.084 -5.557 123.750 1.00 0.00 H +ATOM 3369 HG11 VAL A 215 9.313 -6.855 122.639 1.00 0.00 H +ATOM 3370 HG12 VAL A 215 8.904 -5.126 122.741 1.00 0.00 H +ATOM 3371 HG13 VAL A 215 9.463 -5.818 121.200 1.00 0.00 H +ATOM 3372 HG21 VAL A 215 11.664 -7.572 122.458 1.00 0.00 H +ATOM 3373 HG22 VAL A 215 11.937 -6.560 121.020 1.00 0.00 H +ATOM 3374 HG23 VAL A 215 12.976 -6.371 122.452 1.00 0.00 H +ATOM 3375 N PHE A 216 11.590 -4.182 119.767 1.00 15.93 N +ATOM 3376 CA PHE A 216 11.259 -3.824 118.396 1.00 14.01 C +ATOM 3377 C PHE A 216 10.884 -5.060 117.591 1.00 17.24 C +ATOM 3378 O PHE A 216 11.561 -6.091 117.661 1.00 19.18 O +ATOM 3379 CB PHE A 216 12.430 -3.104 117.721 1.00 15.57 C +ATOM 3380 CG PHE A 216 12.673 -1.719 118.244 1.00 13.42 C +ATOM 3381 CD1 PHE A 216 11.800 -0.689 117.940 1.00 11.52 C +ATOM 3382 CD2 PHE A 216 13.773 -1.446 119.041 1.00 14.71 C +ATOM 3383 CE1 PHE A 216 12.018 0.587 118.417 1.00 15.33 C +ATOM 3384 CE2 PHE A 216 13.997 -0.171 119.523 1.00 12.45 C +ATOM 3385 CZ PHE A 216 13.118 0.848 119.211 1.00 17.23 C +ATOM 3386 H PHE A 216 12.423 -4.733 119.915 1.00 0.00 H +ATOM 3387 HA PHE A 216 10.403 -3.150 118.412 1.00 0.00 H +ATOM 3388 HB3 PHE A 216 12.255 -3.059 116.646 1.00 0.00 H +ATOM 3389 HB2 PHE A 216 13.336 -3.699 117.838 1.00 0.00 H +ATOM 3390 HD1 PHE A 216 10.935 -0.879 117.322 1.00 0.00 H +ATOM 3391 HD2 PHE A 216 14.467 -2.235 119.292 1.00 0.00 H +ATOM 3392 HE1 PHE A 216 11.329 1.381 118.170 1.00 0.00 H +ATOM 3393 HE2 PHE A 216 14.859 0.028 120.143 1.00 0.00 H +ATOM 3394 HZ PHE A 216 13.289 1.846 119.586 1.00 0.00 H +ATOM 3395 N ASN A 217 9.799 -4.945 116.830 1.00 18.29 N +ATOM 3396 CA ASN A 217 9.366 -5.950 115.862 1.00 15.19 C +ATOM 3397 C ASN A 217 9.392 -5.256 114.504 1.00 17.65 C +ATOM 3398 O ASN A 217 8.396 -4.670 114.074 1.00 19.22 O +ATOM 3399 CB ASN A 217 7.981 -6.492 116.203 1.00 19.00 C +ATOM 3400 CG ASN A 217 7.726 -7.859 115.602 1.00 29.12 C +ATOM 3401 OD1 ASN A 217 8.452 -8.307 114.715 1.00 28.13 O +ATOM 3402 ND2 ASN A 217 6.687 -8.531 116.085 1.00 27.46 N +ATOM 3403 H ASN A 217 9.216 -4.123 116.902 1.00 0.00 H +ATOM 3404 HA ASN A 217 10.081 -6.773 115.857 1.00 0.00 H +ATOM 3405 HB3 ASN A 217 7.222 -5.794 115.850 1.00 0.00 H +ATOM 3406 HB2 ASN A 217 7.870 -6.546 117.286 1.00 0.00 H +ATOM 3407 HD22 ASN A 217 6.467 -9.448 115.724 1.00 0.00 H +ATOM 3408 HD21 ASN A 217 6.117 -8.125 116.813 1.00 0.00 H +ATOM 3409 N GLY A 218 10.539 -5.318 113.834 1.00 12.39 N +ATOM 3410 CA GLY A 218 10.790 -4.465 112.699 1.00 18.68 C +ATOM 3411 C GLY A 218 10.901 -3.026 113.161 1.00 19.78 C +ATOM 3412 O GLY A 218 11.609 -2.716 114.124 1.00 14.94 O +ATOM 3413 H GLY A 218 11.255 -5.972 114.117 1.00 0.00 H +ATOM 3414 HA3 GLY A 218 9.969 -4.556 111.988 1.00 0.00 H +ATOM 3415 HA2 GLY A 218 11.721 -4.765 112.218 1.00 0.00 H +ATOM 3416 N PRO A 219 10.190 -2.114 112.492 1.00 19.05 N +ATOM 3417 CA PRO A 219 10.107 -0.737 112.995 1.00 15.37 C +ATOM 3418 C PRO A 219 9.035 -0.543 114.054 1.00 19.33 C +ATOM 3419 O PRO A 219 8.993 0.526 114.679 1.00 17.14 O +ATOM 3420 CB PRO A 219 9.791 0.081 111.733 1.00 15.77 C +ATOM 3421 CG PRO A 219 9.253 -0.908 110.724 1.00 15.19 C +ATOM 3422 CD PRO A 219 9.402 -2.306 111.264 1.00 16.03 C +ATOM 3423 HA PRO A 219 11.075 -0.434 113.394 1.00 0.00 H +ATOM 3424 HB3 PRO A 219 10.710 0.525 111.350 1.00 0.00 H +ATOM 3425 HB2 PRO A 219 9.022 0.818 111.963 1.00 0.00 H +ATOM 3426 HG3 PRO A 219 9.812 -0.817 109.793 1.00 0.00 H +ATOM 3427 HG2 PRO A 219 8.199 -0.701 110.539 1.00 0.00 H +ATOM 3428 HD2 PRO A 219 8.419 -2.698 111.525 1.00 0.00 H +ATOM 3429 HD3 PRO A 219 9.976 -2.905 110.558 1.00 0.00 H +ATOM 3430 N HIS A 220 8.179 -1.537 114.278 1.00 13.13 N +ATOM 3431 CA HIS A 220 7.117 -1.426 115.266 1.00 16.39 C +ATOM 3432 C HIS A 220 7.673 -1.622 116.671 1.00 16.24 C +ATOM 3433 O HIS A 220 8.492 -2.514 116.914 1.00 16.42 O +ATOM 3434 CB HIS A 220 6.020 -2.453 114.981 1.00 16.84 C +ATOM 3435 CG HIS A 220 4.831 -2.330 115.880 1.00 13.71 C +ATOM 3436 ND1 HIS A 220 3.897 -1.326 115.745 1.00 15.30 N +ATOM 3437 CD2 HIS A 220 4.421 -3.088 116.924 1.00 13.22 C +ATOM 3438 CE1 HIS A 220 2.965 -1.468 116.671 1.00 14.19 C +ATOM 3439 NE2 HIS A 220 3.259 -2.530 117.399 1.00 18.28 N +ATOM 3440 H HIS A 220 8.257 -2.398 113.755 1.00 0.00 H +ATOM 3441 HA HIS A 220 6.684 -0.428 115.200 1.00 0.00 H +ATOM 3442 HB3 HIS A 220 6.435 -3.458 115.065 1.00 0.00 H +ATOM 3443 HB2 HIS A 220 5.700 -2.361 113.943 1.00 0.00 H +ATOM 3444 HD1 HIS A 220 4.000 -0.635 115.016 1.00 0.00 H +ATOM 3445 HD2 HIS A 220 4.998 -3.950 117.225 1.00 0.00 H +ATOM 3446 HE1 HIS A 220 2.145 -0.767 116.724 1.00 0.00 H +ATOM 3447 N LEU A 221 7.217 -0.784 117.598 1.00 12.40 N +ATOM 3448 CA LEU A 221 7.736 -0.740 118.958 1.00 14.54 C +ATOM 3449 C LEU A 221 6.675 -1.220 119.940 1.00 13.17 C +ATOM 3450 O LEU A 221 5.491 -0.899 119.797 1.00 18.31 O +ATOM 3451 CB LEU A 221 8.192 0.684 119.312 1.00 10.32 C +ATOM 3452 CG LEU A 221 8.960 0.984 120.607 1.00 16.79 C +ATOM 3453 CD1 LEU A 221 9.738 2.278 120.452 1.00 17.90 C +ATOM 3454 CD2 LEU A 221 8.042 1.090 121.817 1.00 12.01 C +ATOM 3455 H LEU A 221 6.475 -0.137 117.373 1.00 0.00 H +ATOM 3456 HA LEU A 221 8.596 -1.406 119.023 1.00 0.00 H +ATOM 3457 HB3 LEU A 221 7.334 1.353 119.250 1.00 0.00 H +ATOM 3458 HB2 LEU A 221 8.750 1.093 118.470 1.00 0.00 H +ATOM 3459 HG LEU A 221 9.669 0.175 120.782 1.00 0.00 H +ATOM 3460 HD11 LEU A 221 10.282 2.488 121.373 1.00 0.00 H +ATOM 3461 HD12 LEU A 221 10.444 2.181 119.627 1.00 0.00 H +ATOM 3462 HD13 LEU A 221 9.047 3.095 120.244 1.00 0.00 H +ATOM 3463 HD21 LEU A 221 8.635 1.303 122.706 1.00 0.00 H +ATOM 3464 HD22 LEU A 221 7.323 1.894 121.659 1.00 0.00 H +ATOM 3465 HD23 LEU A 221 7.509 0.149 121.953 1.00 0.00 H +ATOM 3466 N LEU A 222 7.105 -1.993 120.935 1.00 16.85 N +ATOM 3467 CA LEU A 222 6.246 -2.442 122.024 1.00 15.34 C +ATOM 3468 C LEU A 222 6.849 -2.007 123.352 1.00 12.32 C +ATOM 3469 O LEU A 222 8.028 -2.262 123.616 1.00 15.36 O +ATOM 3470 CB LEU A 222 6.059 -3.961 122.001 1.00 16.86 C +ATOM 3471 CG LEU A 222 5.766 -4.617 120.652 1.00 14.04 C +ATOM 3472 CD1 LEU A 222 5.896 -6.127 120.762 1.00 16.95 C +ATOM 3473 CD2 LEU A 222 4.379 -4.229 120.173 1.00 15.60 C +ATOM 3474 H LEU A 222 8.068 -2.296 120.959 1.00 0.00 H +ATOM 3475 HA LEU A 222 5.270 -1.970 121.914 1.00 0.00 H +ATOM 3476 HB3 LEU A 222 5.278 -4.236 122.710 1.00 0.00 H +ATOM 3477 HB2 LEU A 222 6.933 -4.436 122.447 1.00 0.00 H +ATOM 3478 HG LEU A 222 6.496 -4.258 119.926 1.00 0.00 H +ATOM 3479 HD11 LEU A 222 5.685 -6.582 119.794 1.00 0.00 H +ATOM 3480 HD12 LEU A 222 6.910 -6.383 121.070 1.00 0.00 H +ATOM 3481 HD13 LEU A 222 5.187 -6.500 121.501 1.00 0.00 H +ATOM 3482 HD21 LEU A 222 4.181 -4.702 119.211 1.00 0.00 H +ATOM 3483 HD22 LEU A 222 3.637 -4.560 120.900 1.00 0.00 H +ATOM 3484 HD23 LEU A 222 4.322 -3.146 120.064 1.00 0.00 H +ATOM 3485 N LEU A 223 6.039 -1.351 124.180 1.00 12.82 N +ATOM 3486 CA LEU A 223 6.446 -0.903 125.505 1.00 14.73 C +ATOM 3487 C LEU A 223 5.794 -1.794 126.552 1.00 14.38 C +ATOM 3488 O LEU A 223 4.566 -1.933 126.577 1.00 15.36 O +ATOM 3489 CB LEU A 223 6.066 0.564 125.729 1.00 13.00 C +ATOM 3490 CG LEU A 223 6.019 1.098 127.164 1.00 12.61 C +ATOM 3491 CD1 LEU A 223 7.393 1.064 127.814 1.00 11.39 C +ATOM 3492 CD2 LEU A 223 5.459 2.514 127.185 1.00 7.49 C +ATOM 3493 H LEU A 223 5.092 -1.142 123.899 1.00 0.00 H +ATOM 3494 HA LEU A 223 7.528 -1.000 125.589 1.00 0.00 H +ATOM 3495 HB3 LEU A 223 5.111 0.763 125.244 1.00 0.00 H +ATOM 3496 HB2 LEU A 223 6.725 1.197 125.135 1.00 0.00 H +ATOM 3497 HG LEU A 223 5.352 0.459 127.743 1.00 0.00 H +ATOM 3498 HD11 LEU A 223 7.324 1.450 128.831 1.00 0.00 H +ATOM 3499 HD12 LEU A 223 7.758 0.037 127.839 1.00 0.00 H +ATOM 3500 HD13 LEU A 223 8.083 1.681 127.238 1.00 0.00 H +ATOM 3501 HD21 LEU A 223 5.432 2.879 128.212 1.00 0.00 H +ATOM 3502 HD22 LEU A 223 6.094 3.165 126.585 1.00 0.00 H +ATOM 3503 HD23 LEU A 223 4.450 2.512 126.774 1.00 0.00 H +ATOM 3504 N ARG A 224 6.614 -2.393 127.411 1.00 15.28 N +ATOM 3505 CA ARG A 224 6.151 -3.370 128.382 1.00 17.45 C +ATOM 3506 C ARG A 224 6.608 -2.980 129.777 1.00 13.66 C +ATOM 3507 O ARG A 224 7.620 -2.296 129.948 1.00 12.54 O +ATOM 3508 CB ARG A 224 6.682 -4.772 128.065 1.00 16.87 C +ATOM 3509 CG ARG A 224 6.356 -5.254 126.672 1.00 19.34 C +ATOM 3510 CD ARG A 224 5.940 -6.711 126.674 1.00 16.67 C +ATOM 3511 NE ARG A 224 5.086 -7.003 125.531 1.00 24.87 N +ATOM 3512 CZ ARG A 224 3.824 -7.402 125.632 1.00 23.04 C +ATOM 3513 NH1 ARG A 224 3.275 -7.566 126.827 1.00 26.88 N +ATOM 3514 NH2 ARG A 224 3.111 -7.636 124.541 1.00 30.18 N1+ +ATOM 3515 H ARG A 224 7.600 -2.174 127.404 1.00 0.00 H +ATOM 3516 HA ARG A 224 5.061 -3.395 128.363 1.00 0.00 H +ATOM 3517 HB3 ARG A 224 6.289 -5.481 128.794 1.00 0.00 H +ATOM 3518 HB2 ARG A 224 7.762 -4.791 128.210 1.00 0.00 H +ATOM 3519 HG3 ARG A 224 7.228 -5.127 126.031 1.00 0.00 H +ATOM 3520 HG2 ARG A 224 5.551 -4.647 126.257 1.00 0.00 H +ATOM 3521 HD3 ARG A 224 5.402 -6.934 127.595 1.00 0.00 H +ATOM 3522 HD2 ARG A 224 6.828 -7.342 126.634 1.00 0.00 H +ATOM 3523 HE ARG A 224 5.507 -6.886 124.621 1.00 0.00 H +ATOM 3524 HH12 ARG A 224 2.315 -7.870 126.904 1.00 0.00 H +ATOM 3525 HH11 ARG A 224 3.817 -7.387 127.660 1.00 0.00 H +ATOM 3526 HH22 ARG A 224 2.151 -7.940 124.621 1.00 0.00 H +ATOM 3527 HH21 ARG A 224 3.527 -7.511 123.629 1.00 0.00 H +ATOM 3528 N ALA A 225 5.855 -3.433 130.774 1.00 12.43 N +ATOM 3529 CA ALA A 225 6.315 -3.377 132.152 1.00 12.67 C +ATOM 3530 C ALA A 225 7.188 -4.589 132.448 1.00 14.33 C +ATOM 3531 O ALA A 225 6.859 -5.716 132.066 1.00 15.98 O +ATOM 3532 CB ALA A 225 5.128 -3.333 133.115 1.00 13.45 C +ATOM 3533 H ALA A 225 4.945 -3.825 130.581 1.00 0.00 H +ATOM 3534 HA ALA A 225 6.910 -2.474 132.287 1.00 0.00 H +ATOM 3535 HB1 ALA A 225 5.493 -3.291 134.141 1.00 0.00 H +ATOM 3536 HB2 ALA A 225 4.525 -2.449 132.909 1.00 0.00 H +ATOM 3537 HB3 ALA A 225 4.519 -4.227 132.983 1.00 0.00 H +ATOM 3538 N VAL A 226 8.318 -4.351 133.111 1.00 10.47 N +ATOM 3539 CA VAL A 226 9.200 -5.420 133.562 1.00 13.53 C +ATOM 3540 C VAL A 226 9.270 -5.507 135.076 1.00 19.31 C +ATOM 3541 O VAL A 226 9.923 -6.412 135.606 1.00 16.87 O +ATOM 3542 CB VAL A 226 10.616 -5.278 132.966 1.00 13.99 C +ATOM 3543 CG1 VAL A 226 10.566 -5.423 131.453 1.00 11.84 C +ATOM 3544 CG2 VAL A 226 11.230 -3.947 133.360 1.00 11.48 C +ATOM 3545 H VAL A 226 8.591 -3.401 133.319 1.00 0.00 H +ATOM 3546 HA VAL A 226 8.786 -6.361 133.199 1.00 0.00 H +ATOM 3547 HB VAL A 226 11.240 -6.077 133.368 1.00 0.00 H +ATOM 3548 HG11 VAL A 226 11.571 -5.321 131.044 1.00 0.00 H +ATOM 3549 HG12 VAL A 226 10.167 -6.404 131.194 1.00 0.00 H +ATOM 3550 HG13 VAL A 226 9.924 -4.648 131.034 1.00 0.00 H +ATOM 3551 HG21 VAL A 226 12.228 -3.865 132.930 1.00 0.00 H +ATOM 3552 HG22 VAL A 226 10.607 -3.134 132.987 1.00 0.00 H +ATOM 3553 HG23 VAL A 226 11.296 -3.884 134.446 1.00 0.00 H +ATOM 3554 N ARG A 227 8.622 -4.590 135.786 1.00 15.53 N +ATOM 3555 CA ARG A 227 8.453 -4.648 137.228 1.00 18.28 C +ATOM 3556 C ARG A 227 6.970 -4.521 137.540 1.00 19.84 C +ATOM 3557 O ARG A 227 6.143 -4.306 136.650 1.00 24.88 O +ATOM 3558 CB ARG A 227 9.228 -3.528 137.939 1.00 19.27 C +ATOM 3559 CG ARG A 227 10.740 -3.615 137.837 1.00 22.21 C +ATOM 3560 CD ARG A 227 11.259 -4.982 138.243 1.00 23.11 C +ATOM 3561 NE ARG A 227 10.884 -5.326 139.611 1.00 36.23 N +ATOM 3562 CZ ARG A 227 11.474 -4.840 140.698 1.00 35.53 C +ATOM 3563 NH1 ARG A 227 12.476 -3.976 140.590 1.00 33.03 N +ATOM 3564 NH2 ARG A 227 11.059 -5.218 141.898 1.00 34.93 N1+ +ATOM 3565 H ARG A 227 8.210 -3.792 135.324 1.00 0.00 H +ATOM 3566 HA ARG A 227 8.811 -5.612 137.589 1.00 0.00 H +ATOM 3567 HB3 ARG A 227 8.939 -3.501 138.990 1.00 0.00 H +ATOM 3568 HB2 ARG A 227 8.896 -2.562 137.558 1.00 0.00 H +ATOM 3569 HG3 ARG A 227 11.191 -2.853 138.472 1.00 0.00 H +ATOM 3570 HG2 ARG A 227 11.047 -3.400 136.814 1.00 0.00 H +ATOM 3571 HD3 ARG A 227 12.345 -5.000 138.149 1.00 0.00 H +ATOM 3572 HD2 ARG A 227 10.868 -5.736 137.560 1.00 0.00 H +ATOM 3573 HE ARG A 227 10.120 -5.981 139.701 1.00 0.00 H +ATOM 3574 HH12 ARG A 227 12.920 -3.611 141.421 1.00 0.00 H +ATOM 3575 HH11 ARG A 227 12.795 -3.684 139.677 1.00 0.00 H +ATOM 3576 HH22 ARG A 227 11.506 -4.850 142.726 1.00 0.00 H +ATOM 3577 HH21 ARG A 227 10.296 -5.874 141.985 1.00 0.00 H +ATOM 3578 N ASP A 228 6.633 -4.655 138.818 1.00 23.28 N +ATOM 3579 CA ASP A 228 5.325 -4.211 139.274 1.00 20.84 C +ATOM 3580 C ASP A 228 5.318 -2.692 139.379 1.00 24.42 C +ATOM 3581 O ASP A 228 6.262 -2.084 139.893 1.00 21.35 O +ATOM 3582 CB ASP A 228 4.976 -4.839 140.624 1.00 24.88 C +ATOM 3583 CG ASP A 228 4.510 -6.276 140.498 1.00 22.63 C +ATOM 3584 OD1 ASP A 228 3.384 -6.493 140.004 1.00 28.78 O +ATOM 3585 OD2 ASP A 228 5.265 -7.188 140.899 1.00 29.23 O1- +ATOM 3586 H ASP A 228 7.285 -5.065 139.472 1.00 0.00 H +ATOM 3587 HA ASP A 228 4.577 -4.515 138.542 1.00 0.00 H +ATOM 3588 HB3 ASP A 228 4.199 -4.248 141.109 1.00 0.00 H +ATOM 3589 HB2 ASP A 228 5.846 -4.797 141.279 1.00 0.00 H +ATOM 3590 N ILE A 229 4.259 -2.073 138.863 1.00 19.41 N +ATOM 3591 CA ILE A 229 4.111 -0.623 138.877 1.00 18.88 C +ATOM 3592 C ILE A 229 2.740 -0.292 139.444 1.00 22.89 C +ATOM 3593 O ILE A 229 1.728 -0.838 138.990 1.00 29.55 O +ATOM 3594 CB ILE A 229 4.278 -0.011 137.472 1.00 21.31 C +ATOM 3595 CG1 ILE A 229 5.386 -0.727 136.694 1.00 20.06 C +ATOM 3596 CG2 ILE A 229 4.584 1.473 137.574 1.00 17.84 C +ATOM 3597 CD1 ILE A 229 5.595 -0.195 135.292 1.00 20.50 C +ATOM 3598 H ILE A 229 3.516 -2.611 138.440 1.00 0.00 H +ATOM 3599 HA ILE A 229 4.871 -0.201 139.534 1.00 0.00 H +ATOM 3600 HB ILE A 229 3.341 -0.133 136.929 1.00 0.00 H +ATOM 3601 HG13 ILE A 229 5.163 -1.793 136.647 1.00 0.00 H +ATOM 3602 HG12 ILE A 229 6.321 -0.658 137.250 1.00 0.00 H +ATOM 3603 HG21 ILE A 229 4.699 1.890 136.574 1.00 0.00 H +ATOM 3604 HG22 ILE A 229 3.766 1.979 138.086 1.00 0.00 H +ATOM 3605 HG23 ILE A 229 5.507 1.616 138.135 1.00 0.00 H +ATOM 3606 HD11 ILE A 229 6.396 -0.753 134.807 1.00 0.00 H +ATOM 3607 HD12 ILE A 229 4.675 -0.308 134.719 1.00 0.00 H +ATOM 3608 HD13 ILE A 229 5.865 0.860 135.340 1.00 0.00 H +ATOM 3609 N GLU A 230 2.703 0.594 140.434 1.00 24.47 N +ATOM 3610 CA GLU A 230 1.452 1.001 141.054 1.00 23.22 C +ATOM 3611 C GLU A 230 0.936 2.291 140.424 1.00 21.51 C +ATOM 3612 O GLU A 230 1.634 2.972 139.669 1.00 26.10 O +ATOM 3613 CB GLU A 230 1.623 1.169 142.568 1.00 28.15 C +ATOM 3614 CG GLU A 230 2.808 2.019 142.994 1.00 28.78 C +ATOM 3615 CD GLU A 230 2.927 2.127 144.504 1.00 46.21 C +ATOM 3616 OE1 GLU A 230 3.932 1.639 145.064 1.00 31.79 O +ATOM 3617 OE2 GLU A 230 2.011 2.698 145.133 1.00 48.33 O1- +ATOM 3618 H GLU A 230 3.560 1.005 140.776 1.00 0.00 H +ATOM 3619 HA GLU A 230 0.714 0.218 140.879 1.00 0.00 H +ATOM 3620 HB3 GLU A 230 1.699 0.186 143.033 1.00 0.00 H +ATOM 3621 HB2 GLU A 230 0.709 1.588 142.990 1.00 0.00 H +ATOM 3622 HG3 GLU A 230 2.711 3.017 142.566 1.00 0.00 H +ATOM 3623 HG2 GLU A 230 3.725 1.592 142.588 1.00 0.00 H +ATOM 3624 N VAL A 231 -0.320 2.614 140.747 1.00 23.41 N +ATOM 3625 CA VAL A 231 -0.962 3.797 140.188 1.00 23.28 C +ATOM 3626 C VAL A 231 -0.172 5.043 140.563 1.00 19.31 C +ATOM 3627 O VAL A 231 0.257 5.212 141.711 1.00 29.73 O +ATOM 3628 CB VAL A 231 -2.417 3.895 140.679 1.00 21.05 C +ATOM 3629 CG1 VAL A 231 -3.114 5.103 140.067 1.00 20.19 C +ATOM 3630 CG2 VAL A 231 -3.172 2.618 140.357 1.00 23.29 C +ATOM 3631 H VAL A 231 -0.841 2.034 141.389 1.00 0.00 H +ATOM 3632 HA VAL A 231 -0.969 3.706 139.102 1.00 0.00 H +ATOM 3633 HB VAL A 231 -2.404 4.020 141.762 1.00 0.00 H +ATOM 3634 HG11 VAL A 231 -4.141 5.152 140.428 1.00 0.00 H +ATOM 3635 HG12 VAL A 231 -2.585 6.012 140.353 1.00 0.00 H +ATOM 3636 HG13 VAL A 231 -3.115 5.011 138.981 1.00 0.00 H +ATOM 3637 HG21 VAL A 231 -4.199 2.704 140.711 1.00 0.00 H +ATOM 3638 HG22 VAL A 231 -3.172 2.457 139.279 1.00 0.00 H +ATOM 3639 HG23 VAL A 231 -2.688 1.775 140.850 1.00 0.00 H +ATOM 3640 N GLY A 232 0.030 5.924 139.583 1.00 17.82 N +ATOM 3641 CA GLY A 232 0.769 7.149 139.793 1.00 16.01 C +ATOM 3642 C GLY A 232 2.273 7.023 139.697 1.00 19.92 C +ATOM 3643 O GLY A 232 2.960 8.052 139.638 1.00 20.28 O +ATOM 3644 H GLY A 232 -0.338 5.745 138.660 1.00 0.00 H +ATOM 3645 HA3 GLY A 232 0.504 7.568 140.764 1.00 0.00 H +ATOM 3646 HA2 GLY A 232 0.425 7.903 139.085 1.00 0.00 H +ATOM 3647 N GLU A 233 2.811 5.807 139.682 1.00 16.26 N +ATOM 3648 CA GLU A 233 4.252 5.625 139.571 1.00 16.58 C +ATOM 3649 C GLU A 233 4.717 5.923 138.151 1.00 16.20 C +ATOM 3650 O GLU A 233 4.086 5.513 137.174 1.00 15.03 O +ATOM 3651 CB GLU A 233 4.638 4.200 139.966 1.00 15.37 C +ATOM 3652 CG GLU A 233 6.135 3.961 140.076 1.00 19.55 C +ATOM 3653 CD GLU A 233 6.464 2.551 140.532 1.00 27.59 C +ATOM 3654 OE1 GLU A 233 5.593 1.911 141.159 1.00 25.58 O +ATOM 3655 OE2 GLU A 233 7.591 2.083 140.265 1.00 21.77 O1- +ATOM 3656 H GLU A 233 2.218 4.992 139.748 1.00 0.00 H +ATOM 3657 HA GLU A 233 4.744 6.320 140.251 1.00 0.00 H +ATOM 3658 HB3 GLU A 233 4.212 3.499 139.249 1.00 0.00 H +ATOM 3659 HB2 GLU A 233 4.161 3.946 140.913 1.00 0.00 H +ATOM 3660 HG3 GLU A 233 6.566 4.678 140.775 1.00 0.00 H +ATOM 3661 HG2 GLU A 233 6.604 4.148 139.110 1.00 0.00 H +ATOM 3662 N GLU A 234 5.831 6.643 138.043 1.00 17.04 N +ATOM 3663 CA GLU A 234 6.349 7.026 136.738 1.00 13.45 C +ATOM 3664 C GLU A 234 6.971 5.831 136.027 1.00 12.72 C +ATOM 3665 O GLU A 234 7.687 5.028 136.631 1.00 14.21 O +ATOM 3666 CB GLU A 234 7.384 8.143 136.880 1.00 12.53 C +ATOM 3667 CG GLU A 234 8.145 8.441 135.594 1.00 10.40 C +ATOM 3668 CD GLU A 234 8.893 9.759 135.637 1.00 14.82 C +ATOM 3669 OE1 GLU A 234 9.133 10.274 136.749 1.00 20.45 O +ATOM 3670 OE2 GLU A 234 9.243 10.278 134.557 1.00 14.76 O1- +ATOM 3671 H GLU A 234 6.329 6.931 138.873 1.00 0.00 H +ATOM 3672 HA GLU A 234 5.522 7.396 136.133 1.00 0.00 H +ATOM 3673 HB3 GLU A 234 8.092 7.882 137.667 1.00 0.00 H +ATOM 3674 HB2 GLU A 234 6.891 9.051 137.227 1.00 0.00 H +ATOM 3675 HG3 GLU A 234 7.449 8.447 134.755 1.00 0.00 H +ATOM 3676 HG2 GLU A 234 8.848 7.632 135.394 1.00 0.00 H +ATOM 3677 N LEU A 235 6.688 5.716 134.732 1.00 16.83 N +ATOM 3678 CA LEU A 235 7.319 4.706 133.896 1.00 12.40 C +ATOM 3679 C LEU A 235 8.711 5.164 133.484 1.00 15.84 C +ATOM 3680 O LEU A 235 8.930 6.344 133.193 1.00 13.21 O +ATOM 3681 CB LEU A 235 6.481 4.438 132.646 1.00 12.16 C +ATOM 3682 CG LEU A 235 5.200 3.601 132.659 1.00 19.04 C +ATOM 3683 CD1 LEU A 235 4.209 4.030 133.733 1.00 14.16 C +ATOM 3684 CD2 LEU A 235 4.564 3.681 131.284 1.00 19.27 C +ATOM 3685 H LEU A 235 6.019 6.340 134.304 1.00 0.00 H +ATOM 3686 HA LEU A 235 7.407 3.781 134.466 1.00 0.00 H +ATOM 3687 HB3 LEU A 235 7.137 4.057 131.863 1.00 0.00 H +ATOM 3688 HB2 LEU A 235 6.269 5.390 132.159 1.00 0.00 H +ATOM 3689 HG LEU A 235 5.475 2.563 132.846 1.00 0.00 H +ATOM 3690 HD11 LEU A 235 3.324 3.395 133.686 1.00 0.00 H +ATOM 3691 HD12 LEU A 235 4.672 3.934 134.715 1.00 0.00 H +ATOM 3692 HD13 LEU A 235 3.920 5.068 133.568 1.00 0.00 H +ATOM 3693 HD21 LEU A 235 3.648 3.090 131.272 1.00 0.00 H +ATOM 3694 HD22 LEU A 235 4.329 4.720 131.052 1.00 0.00 H +ATOM 3695 HD23 LEU A 235 5.257 3.291 130.539 1.00 0.00 H +ATOM 3696 N THR A 236 9.656 4.224 133.453 1.00 14.73 N +ATOM 3697 CA THR A 236 11.027 4.528 133.071 1.00 11.23 C +ATOM 3698 C THR A 236 11.582 3.427 132.179 1.00 12.21 C +ATOM 3699 O THR A 236 11.238 2.251 132.323 1.00 13.14 O +ATOM 3700 CB THR A 236 11.951 4.693 134.288 1.00 10.26 C +ATOM 3701 OG1 THR A 236 11.983 3.472 135.039 1.00 12.61 O +ATOM 3702 CG2 THR A 236 11.489 5.836 135.184 1.00 14.29 C +ATOM 3703 H THR A 236 9.429 3.271 133.699 1.00 0.00 H +ATOM 3704 HA THR A 236 11.029 5.461 132.508 1.00 0.00 H +ATOM 3705 HB THR A 236 12.959 4.912 133.934 1.00 0.00 H +ATOM 3706 HG1 THR A 236 12.561 3.578 135.798 1.00 0.00 H +ATOM 3707 HG21 THR A 236 12.164 5.926 136.035 1.00 0.00 H +ATOM 3708 HG22 THR A 236 11.493 6.767 134.617 1.00 0.00 H +ATOM 3709 HG23 THR A 236 10.479 5.633 135.541 1.00 0.00 H +ATOM 3710 N ILE A 237 12.453 3.831 131.254 1.00 7.93 N +ATOM 3711 CA ILE A 237 13.248 2.917 130.447 1.00 9.68 C +ATOM 3712 C ILE A 237 14.698 3.370 130.528 1.00 13.58 C +ATOM 3713 O ILE A 237 14.994 4.539 130.786 1.00 10.94 O +ATOM 3714 CB ILE A 237 12.787 2.856 128.974 1.00 8.94 C +ATOM 3715 CG1 ILE A 237 12.911 4.233 128.319 1.00 9.53 C +ATOM 3716 CG2 ILE A 237 11.365 2.328 128.874 1.00 9.83 C +ATOM 3717 CD1 ILE A 237 12.432 4.274 126.887 1.00 10.98 C +ATOM 3718 H ILE A 237 12.588 4.817 131.084 1.00 0.00 H +ATOM 3719 HA ILE A 237 13.172 1.918 130.877 1.00 0.00 H +ATOM 3720 HB ILE A 237 13.443 2.167 128.442 1.00 0.00 H +ATOM 3721 HG13 ILE A 237 13.949 4.562 128.362 1.00 0.00 H +ATOM 3722 HG12 ILE A 237 12.356 4.964 128.907 1.00 0.00 H +ATOM 3723 HG21 ILE A 237 11.062 2.294 127.827 1.00 0.00 H +ATOM 3724 HG22 ILE A 237 11.319 1.325 129.298 1.00 0.00 H +ATOM 3725 HG23 ILE A 237 10.693 2.986 129.425 1.00 0.00 H +ATOM 3726 HD11 ILE A 237 12.552 5.283 126.492 1.00 0.00 H +ATOM 3727 HD12 ILE A 237 13.018 3.578 126.287 1.00 0.00 H +ATOM 3728 HD13 ILE A 237 11.380 3.991 126.847 1.00 0.00 H +ATOM 3729 N CYS A 238 15.609 2.429 130.308 1.00 10.33 N +ATOM 3730 CA CYS A 238 17.032 2.737 130.298 1.00 10.55 C +ATOM 3731 C CYS A 238 17.436 3.182 128.898 1.00 9.21 C +ATOM 3732 O CYS A 238 17.288 2.425 127.933 1.00 9.14 O +ATOM 3733 CB CYS A 238 17.859 1.533 130.742 1.00 9.40 C +ATOM 3734 SG CYS A 238 19.600 1.926 130.998 1.00 9.76 S +ATOM 3735 H CYS A 238 15.320 1.475 130.143 1.00 0.00 H +ATOM 3736 HA CYS A 238 17.215 3.559 130.990 1.00 0.00 H +ATOM 3737 HB3 CYS A 238 17.772 0.740 129.999 1.00 0.00 H +ATOM 3738 HB2 CYS A 238 17.441 1.126 131.663 1.00 0.00 H +ATOM 3739 HG CYS A 238 20.253 0.826 131.383 1.00 0.00 H +ATOM 3740 N TYR A 239 17.942 4.413 128.791 1.00 11.36 N +ATOM 3741 CA TYR A 239 18.367 4.941 127.500 1.00 13.44 C +ATOM 3742 C TYR A 239 19.611 4.244 126.968 1.00 11.05 C +ATOM 3743 O TYR A 239 19.862 4.290 125.759 1.00 9.67 O +ATOM 3744 CB TYR A 239 18.659 6.443 127.598 1.00 11.82 C +ATOM 3745 CG TYR A 239 17.460 7.339 127.834 1.00 15.00 C +ATOM 3746 CD1 TYR A 239 16.183 6.814 127.984 1.00 10.00 C +ATOM 3747 CD2 TYR A 239 17.613 8.720 127.904 1.00 14.08 C +ATOM 3748 CE1 TYR A 239 15.093 7.637 128.200 1.00 11.28 C +ATOM 3749 CE2 TYR A 239 16.530 9.551 128.119 1.00 11.95 C +ATOM 3750 CZ TYR A 239 15.273 9.004 128.266 1.00 15.53 C +ATOM 3751 OH TYR A 239 14.191 9.826 128.481 1.00 10.17 O +ATOM 3752 H TYR A 239 18.035 4.994 129.612 1.00 0.00 H +ATOM 3753 HA TYR A 239 17.558 4.794 126.785 1.00 0.00 H +ATOM 3754 HB3 TYR A 239 19.179 6.768 126.697 1.00 0.00 H +ATOM 3755 HB2 TYR A 239 19.397 6.616 128.382 1.00 0.00 H +ATOM 3756 HD1 TYR A 239 16.029 5.746 127.933 1.00 0.00 H +ATOM 3757 HD2 TYR A 239 18.592 9.161 127.790 1.00 0.00 H +ATOM 3758 HE1 TYR A 239 14.108 7.209 128.316 1.00 0.00 H +ATOM 3759 HE2 TYR A 239 16.672 10.620 128.171 1.00 0.00 H +ATOM 3760 HH TYR A 239 14.482 10.741 128.500 1.00 0.00 H +ATOM 3761 N LEU A 240 20.389 3.601 127.834 1.00 7.44 N +ATOM 3762 CA LEU A 240 21.753 3.219 127.513 1.00 9.25 C +ATOM 3763 C LEU A 240 21.935 1.707 127.530 1.00 9.33 C +ATOM 3764 O LEU A 240 21.136 0.961 128.102 1.00 11.27 O +ATOM 3765 CB LEU A 240 22.741 3.853 128.499 1.00 8.84 C +ATOM 3766 CG LEU A 240 22.599 5.358 128.723 1.00 8.37 C +ATOM 3767 CD1 LEU A 240 23.572 5.827 129.789 1.00 8.06 C +ATOM 3768 CD2 LEU A 240 22.820 6.111 127.421 1.00 8.49 C +ATOM 3769 H LEU A 240 20.036 3.363 128.750 1.00 0.00 H +ATOM 3770 HA LEU A 240 21.985 3.582 126.512 1.00 0.00 H +ATOM 3771 HB3 LEU A 240 23.759 3.632 128.180 1.00 0.00 H +ATOM 3772 HB2 LEU A 240 22.672 3.339 129.458 1.00 0.00 H +ATOM 3773 HG LEU A 240 21.585 5.560 129.069 1.00 0.00 H +ATOM 3774 HD11 LEU A 240 23.459 6.901 129.938 1.00 0.00 H +ATOM 3775 HD12 LEU A 240 23.365 5.308 130.725 1.00 0.00 H +ATOM 3776 HD13 LEU A 240 24.592 5.610 129.472 1.00 0.00 H +ATOM 3777 HD21 LEU A 240 22.715 7.182 127.598 1.00 0.00 H +ATOM 3778 HD22 LEU A 240 23.821 5.901 127.045 1.00 0.00 H +ATOM 3779 HD23 LEU A 240 22.082 5.791 126.686 1.00 0.00 H +ATOM 3780 N ASP A 241 23.015 1.277 126.878 1.00 8.78 N +ATOM 3781 CA ASP A 241 23.504 -0.088 127.008 1.00 8.81 C +ATOM 3782 C ASP A 241 23.770 -0.406 128.474 1.00 10.42 C +ATOM 3783 O ASP A 241 24.293 0.426 129.220 1.00 10.64 O +ATOM 3784 CB ASP A 241 24.784 -0.249 126.180 1.00 11.61 C +ATOM 3785 CG ASP A 241 25.348 -1.660 126.213 1.00 16.94 C +ATOM 3786 OD1 ASP A 241 24.710 -2.567 126.787 1.00 22.61 O +ATOM 3787 OD2 ASP A 241 26.451 -1.858 125.659 1.00 22.16 O1- +ATOM 3788 H ASP A 241 23.522 1.905 126.271 1.00 0.00 H +ATOM 3789 HA ASP A 241 22.747 -0.774 126.628 1.00 0.00 H +ATOM 3790 HB3 ASP A 241 25.538 0.451 126.540 1.00 0.00 H +ATOM 3791 HB2 ASP A 241 24.585 0.037 125.147 1.00 0.00 H +ATOM 3792 N MET A 242 23.400 -1.621 128.887 1.00 9.21 N +ATOM 3793 CA MET A 242 23.597 -2.021 130.276 1.00 12.42 C +ATOM 3794 C MET A 242 25.065 -2.243 130.615 1.00 9.57 C +ATOM 3795 O MET A 242 25.438 -2.150 131.789 1.00 12.03 O +ATOM 3796 CB MET A 242 22.805 -3.294 130.579 1.00 10.95 C +ATOM 3797 CG MET A 242 21.296 -3.116 130.563 1.00 9.13 C +ATOM 3798 SD MET A 242 20.756 -1.608 131.386 1.00 12.70 S +ATOM 3799 CE MET A 242 21.143 -1.997 133.092 1.00 6.56 C +ATOM 3800 H MET A 242 22.981 -2.270 128.236 1.00 0.00 H +ATOM 3801 HA MET A 242 23.217 -1.224 130.916 1.00 0.00 H +ATOM 3802 HB3 MET A 242 23.112 -3.688 131.548 1.00 0.00 H +ATOM 3803 HB2 MET A 242 23.084 -4.071 129.867 1.00 0.00 H +ATOM 3804 HG3 MET A 242 20.825 -3.976 131.038 1.00 0.00 H +ATOM 3805 HG2 MET A 242 20.943 -3.112 129.532 1.00 0.00 H +ATOM 3806 HE1 MET A 242 20.865 -1.157 133.729 1.00 0.00 H +ATOM 3807 HE2 MET A 242 20.588 -2.884 133.398 1.00 0.00 H +ATOM 3808 HE3 MET A 242 22.212 -2.187 133.188 1.00 0.00 H +ATOM 3809 N LEU A 243 25.901 -2.534 129.621 1.00 9.46 N +ATOM 3810 CA LEU A 243 27.320 -2.803 129.852 1.00 11.75 C +ATOM 3811 C LEU A 243 28.128 -1.504 129.796 1.00 14.65 C +ATOM 3812 O LEU A 243 29.020 -1.315 128.969 1.00 11.86 O +ATOM 3813 CB LEU A 243 27.831 -3.826 128.845 1.00 7.64 C +ATOM 3814 CG LEU A 243 26.970 -5.086 128.723 1.00 13.05 C +ATOM 3815 CD1 LEU A 243 27.491 -6.003 127.626 1.00 10.93 C +ATOM 3816 CD2 LEU A 243 26.903 -5.817 130.056 1.00 6.55 C +ATOM 3817 H LEU A 243 25.561 -2.575 128.671 1.00 0.00 H +ATOM 3818 HA LEU A 243 27.427 -3.227 130.851 1.00 0.00 H +ATOM 3819 HB3 LEU A 243 28.851 -4.110 129.105 1.00 0.00 H +ATOM 3820 HB2 LEU A 243 27.922 -3.355 127.866 1.00 0.00 H +ATOM 3821 HG LEU A 243 25.959 -4.779 128.455 1.00 0.00 H +ATOM 3822 HD11 LEU A 243 26.860 -6.889 127.562 1.00 0.00 H +ATOM 3823 HD12 LEU A 243 27.473 -5.476 126.672 1.00 0.00 H +ATOM 3824 HD13 LEU A 243 28.514 -6.302 127.857 1.00 0.00 H +ATOM 3825 HD21 LEU A 243 26.287 -6.710 129.951 1.00 0.00 H +ATOM 3826 HD22 LEU A 243 27.908 -6.104 130.365 1.00 0.00 H +ATOM 3827 HD23 LEU A 243 26.466 -5.161 130.809 1.00 0.00 H +ATOM 3828 N MET A 244 27.788 -0.598 130.709 1.00 11.54 N +ATOM 3829 CA MET A 244 28.467 0.682 130.839 1.00 11.04 C +ATOM 3830 C MET A 244 28.728 0.962 132.310 1.00 13.18 C +ATOM 3831 O MET A 244 27.899 0.641 133.166 1.00 9.57 O +ATOM 3832 CB MET A 244 27.640 1.829 130.240 1.00 10.97 C +ATOM 3833 CG MET A 244 27.442 1.753 128.738 1.00 18.87 C +ATOM 3834 SD MET A 244 26.373 3.075 128.135 1.00 15.03 S +ATOM 3835 CE MET A 244 27.467 4.486 128.273 1.00 12.89 C +ATOM 3836 H MET A 244 27.030 -0.786 131.349 1.00 0.00 H +ATOM 3837 HA MET A 244 29.422 0.628 130.317 1.00 0.00 H +ATOM 3838 HB3 MET A 244 28.106 2.781 130.495 1.00 0.00 H +ATOM 3839 HB2 MET A 244 26.667 1.867 130.731 1.00 0.00 H +ATOM 3840 HG3 MET A 244 27.007 0.788 128.478 1.00 0.00 H +ATOM 3841 HG2 MET A 244 28.410 1.814 128.241 1.00 0.00 H +ATOM 3842 HE1 MET A 244 26.948 5.383 127.936 1.00 0.00 H +ATOM 3843 HE2 MET A 244 27.770 4.611 129.313 1.00 0.00 H +ATOM 3844 HE3 MET A 244 28.350 4.324 127.655 1.00 0.00 H +ATOM 3845 N THR A 245 29.881 1.556 132.600 1.00 12.40 N +ATOM 3846 CA THR A 245 30.139 2.015 133.953 1.00 13.93 C +ATOM 3847 C THR A 245 29.386 3.315 134.212 1.00 12.42 C +ATOM 3848 O THR A 245 28.904 3.979 133.291 1.00 14.47 O +ATOM 3849 CB THR A 245 31.634 2.227 134.192 1.00 9.78 C +ATOM 3850 OG1 THR A 245 32.096 3.333 133.406 1.00 12.85 O +ATOM 3851 CG2 THR A 245 32.419 0.979 133.815 1.00 9.86 C +ATOM 3852 H THR A 245 30.576 1.688 131.880 1.00 0.00 H +ATOM 3853 HA THR A 245 29.779 1.259 134.651 1.00 0.00 H +ATOM 3854 HB THR A 245 31.799 2.446 135.247 1.00 0.00 H +ATOM 3855 HG1 THR A 245 33.035 3.464 133.558 1.00 0.00 H +ATOM 3856 HG21 THR A 245 33.481 1.150 133.992 1.00 0.00 H +ATOM 3857 HG22 THR A 245 32.080 0.139 134.422 1.00 0.00 H +ATOM 3858 HG23 THR A 245 32.259 0.753 132.761 1.00 0.00 H +ATOM 3859 N SER A 246 29.288 3.677 135.493 1.00 9.72 N +ATOM 3860 CA SER A 246 28.608 4.917 135.849 1.00 11.45 C +ATOM 3861 C SER A 246 29.331 6.131 135.279 1.00 16.77 C +ATOM 3862 O SER A 246 28.700 7.160 135.011 1.00 16.55 O +ATOM 3863 CB SER A 246 28.482 5.032 137.368 1.00 14.37 C +ATOM 3864 OG SER A 246 29.735 5.311 137.965 1.00 14.17 O +ATOM 3865 H SER A 246 29.685 3.092 136.215 1.00 0.00 H +ATOM 3866 HA SER A 246 27.604 4.889 135.425 1.00 0.00 H +ATOM 3867 HB3 SER A 246 28.088 4.099 137.771 1.00 0.00 H +ATOM 3868 HB2 SER A 246 27.778 5.826 137.615 1.00 0.00 H +ATOM 3869 HG SER A 246 29.629 5.378 138.917 1.00 0.00 H +ATOM 3870 N GLU A 247 30.649 6.031 135.088 1.00 15.61 N +ATOM 3871 CA GLU A 247 31.387 7.112 134.443 1.00 12.92 C +ATOM 3872 C GLU A 247 30.983 7.258 132.981 1.00 12.71 C +ATOM 3873 O GLU A 247 30.769 8.378 132.501 1.00 12.20 O +ATOM 3874 CB GLU A 247 32.891 6.864 134.560 1.00 15.14 C +ATOM 3875 CG GLU A 247 33.484 7.232 135.909 1.00 28.80 C +ATOM 3876 CD GLU A 247 34.970 7.520 135.828 1.00 38.08 C +ATOM 3877 OE1 GLU A 247 35.599 7.125 134.823 1.00 31.57 O +ATOM 3878 OE2 GLU A 247 35.510 8.142 136.767 1.00 32.48 O1- +ATOM 3879 H GLU A 247 31.142 5.203 135.391 1.00 0.00 H +ATOM 3880 HA GLU A 247 31.152 8.043 134.958 1.00 0.00 H +ATOM 3881 HB3 GLU A 247 33.410 7.414 133.775 1.00 0.00 H +ATOM 3882 HB2 GLU A 247 33.102 5.816 134.347 1.00 0.00 H +ATOM 3883 HG3 GLU A 247 33.310 6.420 136.615 1.00 0.00 H +ATOM 3884 HG2 GLU A 247 32.967 8.105 136.306 1.00 0.00 H +ATOM 3885 N GLU A 248 30.878 6.139 132.257 1.00 13.01 N +ATOM 3886 CA GLU A 248 30.448 6.196 130.863 1.00 15.94 C +ATOM 3887 C GLU A 248 28.990 6.615 130.740 1.00 13.86 C +ATOM 3888 O GLU A 248 28.622 7.289 129.772 1.00 18.41 O +ATOM 3889 CB GLU A 248 30.671 4.843 130.180 1.00 10.19 C +ATOM 3890 CG GLU A 248 32.072 4.284 130.361 1.00 10.59 C +ATOM 3891 CD GLU A 248 32.171 2.812 130.002 1.00 13.71 C +ATOM 3892 OE1 GLU A 248 31.338 2.023 130.491 1.00 11.10 O +ATOM 3893 OE2 GLU A 248 33.091 2.443 129.241 1.00 13.04 O1- +ATOM 3894 H GLU A 248 31.097 5.245 132.674 1.00 0.00 H +ATOM 3895 HA GLU A 248 31.059 6.939 130.350 1.00 0.00 H +ATOM 3896 HB3 GLU A 248 30.453 4.935 129.116 1.00 0.00 H +ATOM 3897 HB2 GLU A 248 29.944 4.124 130.556 1.00 0.00 H +ATOM 3898 HG3 GLU A 248 32.388 4.427 131.394 1.00 0.00 H +ATOM 3899 HG2 GLU A 248 32.771 4.854 129.749 1.00 0.00 H +ATOM 3900 N ARG A 249 28.148 6.227 131.700 1.00 10.38 N +ATOM 3901 CA ARG A 249 26.757 6.665 131.672 1.00 12.43 C +ATOM 3902 C ARG A 249 26.647 8.164 131.925 1.00 14.30 C +ATOM 3903 O ARG A 249 25.836 8.847 131.291 1.00 11.02 O +ATOM 3904 CB ARG A 249 25.935 5.878 132.693 1.00 7.05 C +ATOM 3905 CG ARG A 249 25.858 4.386 132.401 1.00 8.97 C +ATOM 3906 CD ARG A 249 24.661 3.737 133.081 1.00 10.87 C +ATOM 3907 NE ARG A 249 24.613 4.012 134.514 1.00 12.60 N +ATOM 3908 CZ ARG A 249 25.294 3.328 135.429 1.00 16.22 C +ATOM 3909 NH1 ARG A 249 26.081 2.325 135.061 1.00 10.54 N +ATOM 3910 NH2 ARG A 249 25.187 3.646 136.712 1.00 14.13 N1+ +ATOM 3911 H ARG A 249 28.474 5.630 132.446 1.00 0.00 H +ATOM 3912 HA ARG A 249 26.355 6.458 130.680 1.00 0.00 H +ATOM 3913 HB3 ARG A 249 24.927 6.290 132.740 1.00 0.00 H +ATOM 3914 HB2 ARG A 249 26.353 6.031 133.688 1.00 0.00 H +ATOM 3915 HG3 ARG A 249 26.774 3.902 132.740 1.00 0.00 H +ATOM 3916 HG2 ARG A 249 25.792 4.230 131.324 1.00 0.00 H +ATOM 3917 HD3 ARG A 249 24.693 2.659 132.920 1.00 0.00 H +ATOM 3918 HD2 ARG A 249 23.742 4.091 132.613 1.00 0.00 H +ATOM 3919 HE ARG A 249 24.016 4.776 134.796 1.00 0.00 H +ATOM 3920 HH12 ARG A 249 26.597 1.807 135.757 1.00 0.00 H +ATOM 3921 HH11 ARG A 249 26.164 2.080 134.085 1.00 0.00 H +ATOM 3922 HH22 ARG A 249 25.705 3.126 137.406 1.00 0.00 H +ATOM 3923 HH21 ARG A 249 24.588 4.408 136.995 1.00 0.00 H +ATOM 3924 N ARG A 250 27.462 8.695 132.840 1.00 9.37 N +ATOM 3925 CA ARG A 250 27.427 10.127 133.123 1.00 10.84 C +ATOM 3926 C ARG A 250 27.801 10.940 131.890 1.00 12.48 C +ATOM 3927 O ARG A 250 27.149 11.941 131.570 1.00 14.65 O +ATOM 3928 CB ARG A 250 28.364 10.456 134.286 1.00 15.56 C +ATOM 3929 CG ARG A 250 28.763 11.924 134.356 1.00 11.72 C +ATOM 3930 CD ARG A 250 29.520 12.250 135.635 1.00 13.87 C +ATOM 3931 NE ARG A 250 28.776 11.872 136.833 1.00 14.92 N +ATOM 3932 CZ ARG A 250 29.106 10.860 137.630 1.00 15.35 C +ATOM 3933 NH1 ARG A 250 30.173 10.120 137.359 1.00 15.09 N +ATOM 3934 NH2 ARG A 250 28.370 10.587 138.698 1.00 13.25 N1+ +ATOM 3935 H ARG A 250 28.109 8.105 133.343 1.00 0.00 H +ATOM 3936 HA ARG A 250 26.411 10.394 133.415 1.00 0.00 H +ATOM 3937 HB3 ARG A 250 29.261 9.841 134.213 1.00 0.00 H +ATOM 3938 HB2 ARG A 250 27.892 10.164 135.224 1.00 0.00 H +ATOM 3939 HG3 ARG A 250 27.870 12.546 134.295 1.00 0.00 H +ATOM 3940 HG2 ARG A 250 29.383 12.173 133.495 1.00 0.00 H +ATOM 3941 HD3 ARG A 250 29.737 13.318 135.665 1.00 0.00 H +ATOM 3942 HD2 ARG A 250 30.481 11.736 135.628 1.00 0.00 H +ATOM 3943 HE ARG A 250 27.964 12.435 137.042 1.00 0.00 H +ATOM 3944 HH12 ARG A 250 30.422 9.352 137.966 1.00 0.00 H +ATOM 3945 HH11 ARG A 250 30.736 10.325 136.546 1.00 0.00 H +ATOM 3946 HH22 ARG A 250 28.622 9.818 139.302 1.00 0.00 H +ATOM 3947 HH21 ARG A 250 27.557 11.148 138.908 1.00 0.00 H +ATOM 3948 N LYS A 251 28.852 10.520 131.181 1.00 13.98 N +ATOM 3949 CA LYS A 251 29.287 11.251 129.996 1.00 17.86 C +ATOM 3950 C LYS A 251 28.213 11.244 128.915 1.00 17.82 C +ATOM 3951 O LYS A 251 27.957 12.272 128.277 1.00 14.28 O +ATOM 3952 CB LYS A 251 30.590 10.656 129.461 1.00 12.68 C +ATOM 3953 CG LYS A 251 31.186 11.416 128.284 1.00 17.68 C +ATOM 3954 CD LYS A 251 32.230 10.577 127.562 1.00 19.66 C +ATOM 3955 CE LYS A 251 32.528 11.122 126.172 1.00 24.11 C +ATOM 3956 NZ LYS A 251 32.385 12.603 126.104 1.00 26.38 N1+ +ATOM 3957 H LYS A 251 29.353 9.690 131.464 1.00 0.00 H +ATOM 3958 HA LYS A 251 29.476 12.285 130.283 1.00 0.00 H +ATOM 3959 HB3 LYS A 251 30.422 9.618 129.173 1.00 0.00 H +ATOM 3960 HB2 LYS A 251 31.322 10.606 130.267 1.00 0.00 H +ATOM 3961 HG3 LYS A 251 31.645 12.337 128.642 1.00 0.00 H +ATOM 3962 HG2 LYS A 251 30.392 11.686 127.587 1.00 0.00 H +ATOM 3963 HD3 LYS A 251 31.876 9.549 127.480 1.00 0.00 H +ATOM 3964 HD2 LYS A 251 33.149 10.558 128.149 1.00 0.00 H +ATOM 3965 HE3 LYS A 251 31.856 10.659 125.449 1.00 0.00 H +ATOM 3966 HE2 LYS A 251 33.541 10.842 125.882 1.00 0.00 H +ATOM 3967 HZ1 LYS A 251 32.591 12.919 125.167 1.00 0.00 H +ATOM 3968 HZ2 LYS A 251 31.439 12.862 126.345 1.00 0.00 H +ATOM 3969 HZ3 LYS A 251 33.027 13.034 126.753 1.00 0.00 H +ATOM 3970 N GLN A 252 27.568 10.097 128.700 1.00 18.51 N +ATOM 3971 CA GLN A 252 26.590 9.991 127.624 1.00 20.32 C +ATOM 3972 C GLN A 252 25.287 10.703 127.969 1.00 13.31 C +ATOM 3973 O GLN A 252 24.665 11.317 127.095 1.00 11.47 O +ATOM 3974 CB GLN A 252 26.330 8.522 127.292 1.00 13.17 C +ATOM 3975 CG GLN A 252 25.710 8.313 125.924 1.00 25.95 C +ATOM 3976 CD GLN A 252 26.569 8.875 124.807 1.00 37.47 C +ATOM 3977 OE1 GLN A 252 27.797 8.826 124.868 1.00 37.92 O +ATOM 3978 NE2 GLN A 252 25.923 9.422 123.783 1.00 33.88 N +ATOM 3979 H GLN A 252 27.756 9.295 129.284 1.00 0.00 H +ATOM 3980 HA GLN A 252 27.010 10.468 126.738 1.00 0.00 H +ATOM 3981 HB3 GLN A 252 25.681 8.088 128.053 1.00 0.00 H +ATOM 3982 HB2 GLN A 252 27.265 7.966 127.354 1.00 0.00 H +ATOM 3983 HG3 GLN A 252 24.727 8.783 125.896 1.00 0.00 H +ATOM 3984 HG2 GLN A 252 25.550 7.248 125.757 1.00 0.00 H +ATOM 3985 HE22 GLN A 252 26.442 9.813 123.009 1.00 0.00 H +ATOM 3986 HE21 GLN A 252 24.913 9.447 123.778 1.00 0.00 H +ATOM 3987 N LEU A 253 24.857 10.635 129.231 1.00 13.38 N +ATOM 3988 CA LEU A 253 23.646 11.347 129.624 1.00 13.65 C +ATOM 3989 C LEU A 253 23.862 12.855 129.629 1.00 12.83 C +ATOM 3990 O LEU A 253 22.905 13.618 129.456 1.00 15.27 O +ATOM 3991 CB LEU A 253 23.168 10.862 130.994 1.00 10.43 C +ATOM 3992 CG LEU A 253 22.768 9.385 131.059 1.00 10.14 C +ATOM 3993 CD1 LEU A 253 22.382 8.980 132.474 1.00 8.50 C +ATOM 3994 CD2 LEU A 253 21.643 9.083 130.081 1.00 11.99 C +ATOM 3995 H LEU A 253 25.370 10.092 129.911 1.00 0.00 H +ATOM 3996 HA LEU A 253 22.868 11.119 128.895 1.00 0.00 H +ATOM 3997 HB3 LEU A 253 22.330 11.477 131.322 1.00 0.00 H +ATOM 3998 HB2 LEU A 253 23.942 11.059 131.736 1.00 0.00 H +ATOM 3999 HG LEU A 253 23.634 8.791 130.766 1.00 0.00 H +ATOM 4000 HD11 LEU A 253 22.103 7.926 132.488 1.00 0.00 H +ATOM 4001 HD12 LEU A 253 23.228 9.140 133.142 1.00 0.00 H +ATOM 4002 HD13 LEU A 253 21.538 9.583 132.808 1.00 0.00 H +ATOM 4003 HD21 LEU A 253 21.377 8.028 130.147 1.00 0.00 H +ATOM 4004 HD22 LEU A 253 20.773 9.692 130.327 1.00 0.00 H +ATOM 4005 HD23 LEU A 253 21.971 9.312 129.067 1.00 0.00 H +ATOM 4006 N ARG A 254 25.106 13.301 129.818 1.00 10.96 N +ATOM 4007 CA ARG A 254 25.414 14.723 129.704 1.00 10.75 C +ATOM 4008 C ARG A 254 25.460 15.158 128.245 1.00 12.55 C +ATOM 4009 O ARG A 254 24.791 16.121 127.851 1.00 13.79 O +ATOM 4010 CB ARG A 254 26.747 15.031 130.386 1.00 11.76 C +ATOM 4011 CG ARG A 254 26.669 15.305 131.877 1.00 10.13 C +ATOM 4012 CD ARG A 254 28.060 15.266 132.490 1.00 13.06 C +ATOM 4013 NE ARG A 254 28.066 15.611 133.909 1.00 12.71 N +ATOM 4014 CZ ARG A 254 29.170 15.805 134.622 1.00 10.20 C +ATOM 4015 NH1 ARG A 254 30.361 15.686 134.049 1.00 10.60 N +ATOM 4016 NH2 ARG A 254 29.087 16.115 135.909 1.00 13.38 N1+ +ATOM 4017 H ARG A 254 25.847 12.652 130.043 1.00 0.00 H +ATOM 4018 HA ARG A 254 24.630 15.288 130.208 1.00 0.00 H +ATOM 4019 HB3 ARG A 254 27.219 15.878 129.888 1.00 0.00 H +ATOM 4020 HB2 ARG A 254 27.441 14.210 130.207 1.00 0.00 H +ATOM 4021 HG3 ARG A 254 26.042 14.551 132.352 1.00 0.00 H +ATOM 4022 HG2 ARG A 254 26.227 16.287 132.043 1.00 0.00 H +ATOM 4023 HD3 ARG A 254 28.714 15.950 131.948 1.00 0.00 H +ATOM 4024 HD2 ARG A 254 28.486 14.272 132.357 1.00 0.00 H +ATOM 4025 HE ARG A 254 27.160 15.700 134.347 1.00 0.00 H +ATOM 4026 HH12 ARG A 254 31.200 15.834 134.592 1.00 0.00 H +ATOM 4027 HH11 ARG A 254 30.429 15.448 133.070 1.00 0.00 H +ATOM 4028 HH22 ARG A 254 29.928 16.262 136.448 1.00 0.00 H +ATOM 4029 HH21 ARG A 254 28.183 16.204 136.350 1.00 0.00 H +ATOM 4030 N ASP A 255 26.244 14.451 127.426 1.00 11.96 N +ATOM 4031 CA ASP A 255 26.502 14.899 126.061 1.00 12.91 C +ATOM 4032 C ASP A 255 25.242 14.857 125.203 1.00 15.78 C +ATOM 4033 O ASP A 255 25.009 15.761 124.392 1.00 13.61 O +ATOM 4034 CB ASP A 255 27.602 14.045 125.428 1.00 11.87 C +ATOM 4035 CG ASP A 255 28.948 14.224 126.107 1.00 18.61 C +ATOM 4036 OD1 ASP A 255 29.116 15.213 126.851 1.00 18.29 O +ATOM 4037 OD2 ASP A 255 29.838 13.373 125.895 1.00 25.76 O1- +ATOM 4038 H ASP A 255 26.668 13.593 127.749 1.00 0.00 H +ATOM 4039 HA ASP A 255 26.852 15.930 126.101 1.00 0.00 H +ATOM 4040 HB3 ASP A 255 27.693 14.297 124.371 1.00 0.00 H +ATOM 4041 HB2 ASP A 255 27.313 12.995 125.468 1.00 0.00 H +ATOM 4042 N GLN A 256 24.421 13.820 125.360 1.00 13.86 N +ATOM 4043 CA GLN A 256 23.278 13.618 124.479 1.00 9.78 C +ATOM 4044 C GLN A 256 21.955 14.078 125.077 1.00 11.24 C +ATOM 4045 O GLN A 256 21.105 14.590 124.341 1.00 15.19 O +ATOM 4046 CB GLN A 256 23.169 12.138 124.089 1.00 12.31 C +ATOM 4047 CG GLN A 256 21.931 11.792 123.271 1.00 19.88 C +ATOM 4048 CD GLN A 256 22.062 10.473 122.536 1.00 22.94 C +ATOM 4049 OE1 GLN A 256 22.944 9.668 122.834 1.00 23.40 O +ATOM 4050 NE2 GLN A 256 21.180 10.244 121.570 1.00 22.51 N +ATOM 4051 H GLN A 256 24.585 13.154 126.101 1.00 0.00 H +ATOM 4052 HA GLN A 256 23.451 14.192 123.569 1.00 0.00 H +ATOM 4053 HB3 GLN A 256 23.190 11.525 124.990 1.00 0.00 H +ATOM 4054 HB2 GLN A 256 24.061 11.844 123.536 1.00 0.00 H +ATOM 4055 HG3 GLN A 256 21.737 12.589 122.553 1.00 0.00 H +ATOM 4056 HG2 GLN A 256 21.062 11.756 123.927 1.00 0.00 H +ATOM 4057 HE22 GLN A 256 21.218 9.382 121.045 1.00 0.00 H +ATOM 4058 HE21 GLN A 256 20.471 10.932 121.360 1.00 0.00 H +ATOM 4059 N TYR A 257 21.758 13.929 126.388 1.00 11.81 N +ATOM 4060 CA TYR A 257 20.460 14.179 126.996 1.00 9.38 C +ATOM 4061 C TYR A 257 20.442 15.330 127.992 1.00 9.49 C +ATOM 4062 O TYR A 257 19.354 15.711 128.441 1.00 9.60 O +ATOM 4063 CB TYR A 257 19.947 12.901 127.678 1.00 9.57 C +ATOM 4064 CG TYR A 257 19.791 11.750 126.709 1.00 12.53 C +ATOM 4065 CD1 TYR A 257 18.731 11.714 125.812 1.00 10.35 C +ATOM 4066 CD2 TYR A 257 20.715 10.712 126.673 1.00 14.65 C +ATOM 4067 CE1 TYR A 257 18.587 10.672 124.918 1.00 14.79 C +ATOM 4068 CE2 TYR A 257 20.579 9.663 125.780 1.00 14.16 C +ATOM 4069 CZ TYR A 257 19.512 9.650 124.905 1.00 17.45 C +ATOM 4070 OH TYR A 257 19.366 8.612 124.012 1.00 19.99 O +ATOM 4071 H TYR A 257 22.520 13.636 126.983 1.00 0.00 H +ATOM 4072 HA TYR A 257 19.764 14.426 126.195 1.00 0.00 H +ATOM 4073 HB3 TYR A 257 18.989 13.105 128.156 1.00 0.00 H +ATOM 4074 HB2 TYR A 257 20.634 12.614 128.474 1.00 0.00 H +ATOM 4075 HD1 TYR A 257 18.001 12.510 125.806 1.00 0.00 H +ATOM 4076 HD2 TYR A 257 21.557 10.715 127.349 1.00 0.00 H +ATOM 4077 HE1 TYR A 257 17.752 10.660 124.233 1.00 0.00 H +ATOM 4078 HE2 TYR A 257 21.305 8.863 125.772 1.00 0.00 H +ATOM 4079 HH TYR A 257 20.085 7.986 124.128 1.00 0.00 H +ATOM 4080 N CYS A 258 21.600 15.886 128.353 1.00 11.14 N +ATOM 4081 CA CYS A 258 21.686 17.128 129.128 1.00 12.19 C +ATOM 4082 C CYS A 258 21.023 17.002 130.501 1.00 11.28 C +ATOM 4083 O CYS A 258 20.219 17.845 130.904 1.00 12.44 O +ATOM 4084 CB CYS A 258 21.088 18.303 128.347 1.00 11.41 C +ATOM 4085 SG CYS A 258 21.937 18.716 126.805 1.00 14.09 S +ATOM 4086 H CYS A 258 22.473 15.450 128.092 1.00 0.00 H +ATOM 4087 HA CYS A 258 22.742 17.343 129.290 1.00 0.00 H +ATOM 4088 HB3 CYS A 258 21.057 19.184 128.988 1.00 0.00 H +ATOM 4089 HB2 CYS A 258 20.038 18.099 128.137 1.00 0.00 H +ATOM 4090 HG CYS A 258 21.324 19.750 126.222 1.00 0.00 H +ATOM 4091 N PHE A 259 21.369 15.943 131.229 1.00 10.13 N +ATOM 4092 CA PHE A 259 20.943 15.834 132.617 1.00 13.62 C +ATOM 4093 C PHE A 259 21.944 14.989 133.388 1.00 13.26 C +ATOM 4094 O PHE A 259 22.645 14.146 132.824 1.00 9.89 O +ATOM 4095 CB PHE A 259 19.531 15.241 132.754 1.00 10.97 C +ATOM 4096 CG PHE A 259 19.459 13.756 132.515 1.00 12.39 C +ATOM 4097 CD1 PHE A 259 19.509 12.869 133.580 1.00 13.25 C +ATOM 4098 CD2 PHE A 259 19.304 13.247 131.236 1.00 9.42 C +ATOM 4099 CE1 PHE A 259 19.430 11.508 133.374 1.00 12.21 C +ATOM 4100 CE2 PHE A 259 19.223 11.882 131.024 1.00 10.15 C +ATOM 4101 CZ PHE A 259 19.285 11.013 132.097 1.00 12.99 C +ATOM 4102 H PHE A 259 21.930 15.210 130.819 1.00 0.00 H +ATOM 4103 HA PHE A 259 20.936 16.834 133.051 1.00 0.00 H +ATOM 4104 HB3 PHE A 259 18.857 15.751 132.066 1.00 0.00 H +ATOM 4105 HB2 PHE A 259 19.139 15.467 133.746 1.00 0.00 H +ATOM 4106 HD1 PHE A 259 19.611 13.241 134.589 1.00 0.00 H +ATOM 4107 HD2 PHE A 259 19.245 13.918 130.391 1.00 0.00 H +ATOM 4108 HE1 PHE A 259 19.482 10.831 134.214 1.00 0.00 H +ATOM 4109 HE2 PHE A 259 19.111 11.497 130.021 1.00 0.00 H +ATOM 4110 HZ PHE A 259 19.220 9.947 131.935 1.00 0.00 H +ATOM 4111 N GLU A 260 21.998 15.233 134.693 1.00 12.18 N +ATOM 4112 CA GLU A 260 22.808 14.448 135.612 1.00 12.69 C +ATOM 4113 C GLU A 260 21.908 13.463 136.343 1.00 11.77 C +ATOM 4114 O GLU A 260 20.905 13.861 136.944 1.00 14.33 O +ATOM 4115 CB GLU A 260 23.528 15.350 136.615 1.00 10.85 C +ATOM 4116 CG GLU A 260 23.895 16.719 136.071 1.00 13.36 C +ATOM 4117 CD GLU A 260 25.090 16.676 135.141 1.00 12.15 C +ATOM 4118 OE1 GLU A 260 25.820 15.662 135.155 1.00 16.44 O +ATOM 4119 OE2 GLU A 260 25.301 17.658 134.399 1.00 9.91 O1- +ATOM 4120 H GLU A 260 21.461 15.992 135.087 1.00 0.00 H +ATOM 4121 HA GLU A 260 23.551 13.891 135.041 1.00 0.00 H +ATOM 4122 HB3 GLU A 260 24.429 14.849 136.970 1.00 0.00 H +ATOM 4123 HB2 GLU A 260 22.908 15.469 137.504 1.00 0.00 H +ATOM 4124 HG3 GLU A 260 24.106 17.394 136.901 1.00 0.00 H +ATOM 4125 HG2 GLU A 260 23.040 17.140 135.543 1.00 0.00 H +ATOM 4126 N CYS A 261 22.260 12.182 136.283 1.00 12.19 N +ATOM 4127 CA CYS A 261 21.486 11.143 136.947 1.00 13.39 C +ATOM 4128 C CYS A 261 22.006 10.943 138.363 1.00 18.13 C +ATOM 4129 O CYS A 261 23.212 10.770 138.569 1.00 18.12 O +ATOM 4130 CB CYS A 261 21.553 9.830 136.166 1.00 17.51 C +ATOM 4131 SG CYS A 261 20.582 8.489 136.897 1.00 18.91 S1- +ATOM 4132 H CYS A 261 23.084 11.908 135.767 1.00 0.00 H +ATOM 4133 HA CYS A 261 20.446 11.464 137.000 1.00 0.00 H +ATOM 4134 HB3 CYS A 261 22.593 9.516 136.076 1.00 0.00 H +ATOM 4135 HB2 CYS A 261 21.220 10.001 135.142 1.00 0.00 H +ATOM 4136 N ASP A 262 21.097 10.973 139.335 1.00 15.34 N +ATOM 4137 CA ASP A 262 21.442 10.735 140.731 1.00 24.88 C +ATOM 4138 C ASP A 262 20.676 9.544 141.296 1.00 20.93 C +ATOM 4139 O ASP A 262 20.379 9.496 142.491 1.00 18.75 O +ATOM 4140 CB ASP A 262 21.199 11.986 141.575 1.00 20.42 C +ATOM 4141 CG ASP A 262 19.729 12.329 141.706 1.00 22.39 C +ATOM 4142 OD1 ASP A 262 19.369 13.012 142.687 1.00 29.49 O +ATOM 4143 OD2 ASP A 262 18.936 11.926 140.828 1.00 28.54 O1- +ATOM 4144 H ASP A 262 20.130 11.166 139.116 1.00 0.00 H +ATOM 4145 HA ASP A 262 22.506 10.501 140.778 1.00 0.00 H +ATOM 4146 HB3 ASP A 262 21.730 12.829 141.134 1.00 0.00 H +ATOM 4147 HB2 ASP A 262 21.627 11.842 142.567 1.00 0.00 H +ATOM 4148 N CYS A 263 20.346 8.577 140.442 1.00 22.39 N +ATOM 4149 CA CYS A 263 19.753 7.338 140.911 1.00 16.02 C +ATOM 4150 C CYS A 263 20.730 6.610 141.833 1.00 13.47 C +ATOM 4151 O CYS A 263 21.913 6.950 141.927 1.00 14.25 O +ATOM 4152 CB CYS A 263 19.362 6.450 139.730 1.00 13.70 C +ATOM 4153 SG CYS A 263 20.737 5.528 139.002 1.00 14.81 S1- +ATOM 4154 H CYS A 263 20.508 8.700 139.453 1.00 0.00 H +ATOM 4155 HA CYS A 263 18.853 7.577 141.478 1.00 0.00 H +ATOM 4156 HB3 CYS A 263 18.889 7.060 138.961 1.00 0.00 H +ATOM 4157 HB2 CYS A 263 18.586 5.752 140.044 1.00 0.00 H +ATOM 4158 N PHE A 264 20.216 5.592 142.528 1.00 12.88 N +ATOM 4159 CA PHE A 264 21.042 4.862 143.484 1.00 9.96 C +ATOM 4160 C PHE A 264 22.266 4.253 142.812 1.00 9.68 C +ATOM 4161 O PHE A 264 23.357 4.231 143.394 1.00 12.55 O +ATOM 4162 CB PHE A 264 20.220 3.771 144.171 1.00 13.11 C +ATOM 4163 CG PHE A 264 21.057 2.735 144.865 1.00 15.29 C +ATOM 4164 CD1 PHE A 264 21.627 3.000 146.099 1.00 12.30 C +ATOM 4165 CD2 PHE A 264 21.286 1.501 144.278 1.00 14.01 C +ATOM 4166 CE1 PHE A 264 22.404 2.052 146.737 1.00 14.88 C +ATOM 4167 CE2 PHE A 264 22.063 0.549 144.911 1.00 15.92 C +ATOM 4168 CZ PHE A 264 22.621 0.825 146.143 1.00 17.47 C +ATOM 4169 H PHE A 264 19.252 5.324 142.393 1.00 0.00 H +ATOM 4170 HA PHE A 264 21.384 5.563 144.246 1.00 0.00 H +ATOM 4171 HB3 PHE A 264 19.578 3.285 143.436 1.00 0.00 H +ATOM 4172 HB2 PHE A 264 19.541 4.229 144.890 1.00 0.00 H +ATOM 4173 HD1 PHE A 264 21.466 3.957 146.574 1.00 0.00 H +ATOM 4174 HD2 PHE A 264 20.855 1.273 143.314 1.00 0.00 H +ATOM 4175 HE1 PHE A 264 22.841 2.271 147.700 1.00 0.00 H +ATOM 4176 HE2 PHE A 264 22.233 -0.409 144.442 1.00 0.00 H +ATOM 4177 HZ PHE A 264 23.226 0.083 146.642 1.00 0.00 H +ATOM 4178 N ARG A 265 22.105 3.758 141.584 1.00 7.93 N +ATOM 4179 CA ARG A 265 23.200 3.064 140.914 1.00 11.09 C +ATOM 4180 C ARG A 265 24.348 4.013 140.591 1.00 13.70 C +ATOM 4181 O ARG A 265 25.521 3.638 140.710 1.00 13.28 O +ATOM 4182 CB ARG A 265 22.684 2.387 139.645 1.00 10.06 C +ATOM 4183 CG ARG A 265 21.925 1.095 139.903 1.00 10.94 C +ATOM 4184 CD ARG A 265 21.771 0.279 138.630 1.00 8.74 C +ATOM 4185 NE ARG A 265 23.009 -0.415 138.288 1.00 8.89 N +ATOM 4186 CZ ARG A 265 23.589 -0.359 137.094 1.00 12.58 C +ATOM 4187 NH1 ARG A 265 23.037 0.353 136.121 1.00 14.87 N +ATOM 4188 NH2 ARG A 265 24.718 -1.017 136.870 1.00 7.01 N1+ +ATOM 4189 H ARG A 265 21.219 3.862 141.110 1.00 0.00 H +ATOM 4190 HA ARG A 265 23.575 2.291 141.585 1.00 0.00 H +ATOM 4191 HB3 ARG A 265 23.521 2.187 138.976 1.00 0.00 H +ATOM 4192 HB2 ARG A 265 22.043 3.080 139.100 1.00 0.00 H +ATOM 4193 HG3 ARG A 265 20.939 1.328 140.306 1.00 0.00 H +ATOM 4194 HG2 ARG A 265 22.456 0.505 140.650 1.00 0.00 H +ATOM 4195 HD3 ARG A 265 21.486 0.937 137.809 1.00 0.00 H +ATOM 4196 HD2 ARG A 265 20.971 -0.450 138.761 1.00 0.00 H +ATOM 4197 HE ARG A 265 23.426 -0.963 139.027 1.00 0.00 H +ATOM 4198 HH12 ARG A 265 23.478 0.395 135.213 1.00 0.00 H +ATOM 4199 HH11 ARG A 265 22.175 0.853 136.287 1.00 0.00 H +ATOM 4200 HH22 ARG A 265 25.157 -0.973 135.961 1.00 0.00 H +ATOM 4201 HH21 ARG A 265 25.139 -1.563 137.608 1.00 0.00 H +ATOM 4202 N CYS A 266 24.035 5.244 140.184 1.00 11.64 N +ATOM 4203 CA CYS A 266 25.083 6.207 139.869 1.00 13.81 C +ATOM 4204 C CYS A 266 25.738 6.773 141.122 1.00 15.42 C +ATOM 4205 O CYS A 266 26.927 7.108 141.095 1.00 13.43 O +ATOM 4206 CB CYS A 266 24.515 7.341 139.013 1.00 10.26 C +ATOM 4207 SG CYS A 266 23.971 6.829 137.366 1.00 13.55 S1- +ATOM 4208 H CYS A 266 23.066 5.514 140.092 1.00 0.00 H +ATOM 4209 HA CYS A 266 25.850 5.695 139.288 1.00 0.00 H +ATOM 4210 HB3 CYS A 266 25.261 8.130 138.918 1.00 0.00 H +ATOM 4211 HB2 CYS A 266 23.683 7.809 139.539 1.00 0.00 H +ATOM 4212 N GLN A 267 24.988 6.883 142.222 1.00 14.30 N +ATOM 4213 CA GLN A 267 25.560 7.411 143.456 1.00 15.31 C +ATOM 4214 C GLN A 267 26.553 6.440 144.082 1.00 16.24 C +ATOM 4215 O GLN A 267 27.530 6.871 144.704 1.00 14.94 O +ATOM 4216 CB GLN A 267 24.450 7.739 144.455 1.00 15.42 C +ATOM 4217 CG GLN A 267 23.812 9.100 144.252 1.00 18.36 C +ATOM 4218 CD GLN A 267 22.782 9.423 145.315 1.00 25.17 C +ATOM 4219 OE1 GLN A 267 21.588 9.179 145.135 1.00 25.96 O +ATOM 4220 NE2 GLN A 267 23.239 9.974 146.433 1.00 17.02 N +ATOM 4221 H GLN A 267 24.019 6.600 142.203 1.00 0.00 H +ATOM 4222 HA GLN A 267 26.089 8.334 143.219 1.00 0.00 H +ATOM 4223 HB3 GLN A 267 24.845 7.673 145.469 1.00 0.00 H +ATOM 4224 HB2 GLN A 267 23.681 6.968 144.406 1.00 0.00 H +ATOM 4225 HG3 GLN A 267 23.342 9.137 143.269 1.00 0.00 H +ATOM 4226 HG2 GLN A 267 24.586 9.867 144.253 1.00 0.00 H +ATOM 4227 HE22 GLN A 267 22.599 10.211 147.177 1.00 0.00 H +ATOM 4228 HE21 GLN A 267 24.227 10.156 146.539 1.00 0.00 H +ATOM 4229 N THR A 268 26.324 5.138 143.930 1.00 18.09 N +ATOM 4230 CA THR A 268 27.161 4.120 144.550 1.00 13.58 C +ATOM 4231 C THR A 268 28.069 3.414 143.551 1.00 14.49 C +ATOM 4232 O THR A 268 28.727 2.435 143.919 1.00 17.60 O +ATOM 4233 CB THR A 268 26.291 3.093 145.276 1.00 14.76 C +ATOM 4234 OG1 THR A 268 25.497 2.376 144.321 1.00 13.14 O +ATOM 4235 CG2 THR A 268 25.379 3.789 146.272 1.00 12.11 C +ATOM 4236 H THR A 268 25.546 4.824 143.368 1.00 0.00 H +ATOM 4237 HA THR A 268 27.793 4.610 145.291 1.00 0.00 H +ATOM 4238 HB THR A 268 26.933 2.391 145.808 1.00 0.00 H +ATOM 4239 HG1 THR A 268 24.951 1.732 144.777 1.00 0.00 H +ATOM 4240 HG21 THR A 268 24.765 3.047 146.783 1.00 0.00 H +ATOM 4241 HG22 THR A 268 25.982 4.326 147.004 1.00 0.00 H +ATOM 4242 HG23 THR A 268 24.735 4.493 145.745 1.00 0.00 H +ATOM 4243 N GLN A 269 28.124 3.890 142.306 1.00 16.25 N +ATOM 4244 CA GLN A 269 28.919 3.253 141.255 1.00 14.84 C +ATOM 4245 C GLN A 269 28.594 1.765 141.162 1.00 12.85 C +ATOM 4246 O GLN A 269 29.484 0.916 141.069 1.00 14.37 O +ATOM 4247 CB GLN A 269 30.415 3.477 141.484 1.00 12.01 C +ATOM 4248 CG GLN A 269 30.819 4.941 141.538 1.00 18.16 C +ATOM 4249 CD GLN A 269 32.317 5.128 141.667 1.00 23.99 C +ATOM 4250 OE1 GLN A 269 33.097 4.514 140.938 1.00 30.66 O +ATOM 4251 NE2 GLN A 269 32.728 5.981 142.598 1.00 26.64 N +ATOM 4252 H GLN A 269 27.605 4.720 142.059 1.00 0.00 H +ATOM 4253 HA GLN A 269 28.652 3.715 140.305 1.00 0.00 H +ATOM 4254 HB3 GLN A 269 30.980 2.975 140.699 1.00 0.00 H +ATOM 4255 HB2 GLN A 269 30.717 2.984 142.408 1.00 0.00 H +ATOM 4256 HG3 GLN A 269 30.320 5.424 142.378 1.00 0.00 H +ATOM 4257 HG2 GLN A 269 30.467 5.447 140.639 1.00 0.00 H +ATOM 4258 HE22 GLN A 269 33.715 6.147 142.730 1.00 0.00 H +ATOM 4259 HE21 GLN A 269 32.053 6.464 143.174 1.00 0.00 H +ATOM 4260 N ASP A 270 27.301 1.453 141.201 1.00 10.27 N +ATOM 4261 CA ASP A 270 26.834 0.075 141.279 1.00 13.12 C +ATOM 4262 C ASP A 270 27.388 -0.763 140.135 1.00 15.41 C +ATOM 4263 O ASP A 270 27.194 -0.434 138.960 1.00 9.29 O +ATOM 4264 CB ASP A 270 25.303 0.051 141.268 1.00 9.92 C +ATOM 4265 CG ASP A 270 24.741 -1.353 141.346 1.00 12.24 C +ATOM 4266 OD1 ASP A 270 24.983 -2.037 142.363 1.00 7.73 O +ATOM 4267 OD2 ASP A 270 24.052 -1.771 140.391 1.00 12.16 O1- +ATOM 4268 H ASP A 270 26.604 2.184 141.177 1.00 0.00 H +ATOM 4269 HA ASP A 270 27.179 -0.354 142.220 1.00 0.00 H +ATOM 4270 HB3 ASP A 270 24.940 0.537 140.362 1.00 0.00 H +ATOM 4271 HB2 ASP A 270 24.925 0.639 142.104 1.00 0.00 H +ATOM 4272 N LYS A 271 28.092 -1.837 140.496 1.00 11.45 N +ATOM 4273 CA LYS A 271 28.702 -2.833 139.616 1.00 10.33 C +ATOM 4274 C LYS A 271 29.937 -2.323 138.883 1.00 11.55 C +ATOM 4275 O LYS A 271 30.535 -3.091 138.123 1.00 15.34 O +ATOM 4276 CB LYS A 271 27.715 -3.387 138.576 1.00 12.35 C +ATOM 4277 CG LYS A 271 26.384 -3.839 139.152 1.00 10.93 C +ATOM 4278 CD LYS A 271 25.584 -4.628 138.131 1.00 14.88 C +ATOM 4279 CE LYS A 271 24.331 -5.219 138.754 1.00 6.79 C +ATOM 4280 NZ LYS A 271 23.310 -4.169 139.020 1.00 5.78 N1+ +ATOM 4281 H LYS A 271 28.251 -2.031 141.474 1.00 0.00 H +ATOM 4282 HA LYS A 271 29.018 -3.668 140.241 1.00 0.00 H +ATOM 4283 HB3 LYS A 271 28.179 -4.218 138.044 1.00 0.00 H +ATOM 4284 HB2 LYS A 271 27.539 -2.634 137.808 1.00 0.00 H +ATOM 4285 HG3 LYS A 271 25.810 -2.967 139.467 1.00 0.00 H +ATOM 4286 HG2 LYS A 271 26.561 -4.458 140.032 1.00 0.00 H +ATOM 4287 HD3 LYS A 271 26.202 -5.430 137.727 1.00 0.00 H +ATOM 4288 HD2 LYS A 271 25.305 -3.974 137.305 1.00 0.00 H +ATOM 4289 HE3 LYS A 271 24.591 -5.717 139.688 1.00 0.00 H +ATOM 4290 HE2 LYS A 271 23.913 -5.970 138.084 1.00 0.00 H +ATOM 4291 HZ1 LYS A 271 22.491 -4.592 139.433 1.00 0.00 H +ATOM 4292 HZ2 LYS A 271 23.690 -3.482 139.655 1.00 0.00 H +ATOM 4293 HZ3 LYS A 271 23.055 -3.719 138.152 1.00 0.00 H +ATOM 4294 N ASP A 272 30.350 -1.069 139.093 1.00 11.78 N +ATOM 4295 CA ASP A 272 31.490 -0.517 138.362 1.00 13.51 C +ATOM 4296 C ASP A 272 32.743 -1.366 138.545 1.00 14.96 C +ATOM 4297 O ASP A 272 33.456 -1.660 137.578 1.00 17.03 O +ATOM 4298 CB ASP A 272 31.760 0.922 138.810 1.00 14.99 C +ATOM 4299 CG ASP A 272 30.859 1.930 138.123 1.00 13.96 C +ATOM 4300 OD1 ASP A 272 29.923 1.510 137.412 1.00 21.72 O +ATOM 4301 OD2 ASP A 272 31.095 3.146 138.288 1.00 11.82 O1- +ATOM 4302 H ASP A 272 29.873 -0.486 139.766 1.00 0.00 H +ATOM 4303 HA ASP A 272 31.240 -0.503 137.301 1.00 0.00 H +ATOM 4304 HB3 ASP A 272 32.802 1.174 138.612 1.00 0.00 H +ATOM 4305 HB2 ASP A 272 31.629 0.996 139.890 1.00 0.00 H +ATOM 4306 N ALA A 273 33.024 -1.774 139.785 1.00 10.13 N +ATOM 4307 CA ALA A 273 34.258 -2.502 140.068 1.00 11.88 C +ATOM 4308 C ALA A 273 34.286 -3.849 139.354 1.00 12.96 C +ATOM 4309 O ALA A 273 35.286 -4.209 138.724 1.00 15.11 O +ATOM 4310 CB ALA A 273 34.424 -2.682 141.577 1.00 8.56 C +ATOM 4311 H ALA A 273 32.380 -1.580 140.539 1.00 0.00 H +ATOM 4312 HA ALA A 273 35.095 -1.907 139.703 1.00 0.00 H +ATOM 4313 HB1 ALA A 273 35.347 -3.226 141.779 1.00 0.00 H +ATOM 4314 HB2 ALA A 273 34.466 -1.705 142.058 1.00 0.00 H +ATOM 4315 HB3 ALA A 273 33.578 -3.244 141.972 1.00 0.00 H +ATOM 4316 N ASP A 274 33.190 -4.608 139.441 1.00 9.53 N +ATOM 4317 CA ASP A 274 33.130 -5.900 138.762 1.00 11.57 C +ATOM 4318 C ASP A 274 33.239 -5.748 137.250 1.00 13.66 C +ATOM 4319 O ASP A 274 33.803 -6.620 136.579 1.00 11.15 O +ATOM 4320 CB ASP A 274 31.837 -6.627 139.128 1.00 11.20 C +ATOM 4321 CG ASP A 274 31.808 -7.070 140.579 1.00 13.81 C +ATOM 4322 OD1 ASP A 274 32.832 -6.902 141.273 1.00 19.24 O +ATOM 4323 OD2 ASP A 274 30.761 -7.589 141.023 1.00 15.28 O1- +ATOM 4324 H ASP A 274 32.397 -4.289 139.979 1.00 0.00 H +ATOM 4325 HA ASP A 274 33.970 -6.505 139.105 1.00 0.00 H +ATOM 4326 HB3 ASP A 274 31.714 -7.496 138.481 1.00 0.00 H +ATOM 4327 HB2 ASP A 274 30.986 -5.974 138.931 1.00 0.00 H +ATOM 4328 N MET A 275 32.714 -4.651 136.698 1.00 12.32 N +ATOM 4329 CA MET A 275 32.774 -4.428 135.258 1.00 10.53 C +ATOM 4330 C MET A 275 34.198 -4.236 134.758 1.00 14.66 C +ATOM 4331 O MET A 275 34.460 -4.465 133.571 1.00 11.85 O +ATOM 4332 CB MET A 275 31.933 -3.206 134.881 1.00 12.49 C +ATOM 4333 CG MET A 275 30.437 -3.379 135.087 1.00 13.75 C +ATOM 4334 SD MET A 275 29.464 -2.098 134.271 1.00 16.74 S +ATOM 4335 CE MET A 275 27.882 -2.926 134.120 1.00 11.90 C +ATOM 4336 H MET A 275 32.265 -3.958 137.280 1.00 0.00 H +ATOM 4337 HA MET A 275 32.352 -5.300 134.759 1.00 0.00 H +ATOM 4338 HB3 MET A 275 32.126 -2.942 133.841 1.00 0.00 H +ATOM 4339 HB2 MET A 275 32.278 -2.342 135.448 1.00 0.00 H +ATOM 4340 HG3 MET A 275 30.216 -3.377 136.154 1.00 0.00 H +ATOM 4341 HG2 MET A 275 30.131 -4.357 134.716 1.00 0.00 H +ATOM 4342 HE1 MET A 275 27.169 -2.261 133.633 1.00 0.00 H +ATOM 4343 HE2 MET A 275 28.000 -3.831 133.524 1.00 0.00 H +ATOM 4344 HE3 MET A 275 27.513 -3.190 135.111 1.00 0.00 H +ATOM 4345 N LEU A 276 35.122 -3.822 135.630 1.00 11.68 N +ATOM 4346 CA LEU A 276 36.479 -3.461 135.234 1.00 13.35 C +ATOM 4347 C LEU A 276 37.532 -4.319 135.930 1.00 13.84 C +ATOM 4348 O LEU A 276 38.665 -3.877 136.129 1.00 12.55 O +ATOM 4349 CB LEU A 276 36.743 -1.980 135.508 1.00 10.75 C +ATOM 4350 CG LEU A 276 35.672 -1.009 135.011 1.00 15.41 C +ATOM 4351 CD1 LEU A 276 35.962 0.406 135.490 1.00 15.92 C +ATOM 4352 CD2 LEU A 276 35.569 -1.063 133.497 1.00 12.05 C +ATOM 4353 H LEU A 276 34.893 -3.748 136.611 1.00 0.00 H +ATOM 4354 HA LEU A 276 36.570 -3.625 134.160 1.00 0.00 H +ATOM 4355 HB3 LEU A 276 37.707 -1.702 135.082 1.00 0.00 H +ATOM 4356 HB2 LEU A 276 36.893 -1.833 136.578 1.00 0.00 H +ATOM 4357 HG LEU A 276 34.714 -1.319 135.428 1.00 0.00 H +ATOM 4358 HD11 LEU A 276 35.187 1.080 135.125 1.00 0.00 H +ATOM 4359 HD12 LEU A 276 35.975 0.426 136.580 1.00 0.00 H +ATOM 4360 HD13 LEU A 276 36.931 0.727 135.109 1.00 0.00 H +ATOM 4361 HD21 LEU A 276 34.802 -0.366 133.159 1.00 0.00 H +ATOM 4362 HD22 LEU A 276 36.528 -0.789 133.057 1.00 0.00 H +ATOM 4363 HD23 LEU A 276 35.303 -2.073 133.186 1.00 0.00 H +ATOM 4364 N THR A 277 37.180 -5.546 136.302 1.00 10.82 N +ATOM 4365 CA THR A 277 38.178 -6.445 136.858 1.00 13.66 C +ATOM 4366 C THR A 277 39.173 -6.868 135.778 1.00 15.92 C +ATOM 4367 O THR A 277 38.900 -6.797 134.576 1.00 11.51 O +ATOM 4368 CB THR A 277 37.520 -7.676 137.481 1.00 13.62 C +ATOM 4369 OG1 THR A 277 36.589 -8.245 136.552 1.00 13.86 O +ATOM 4370 CG2 THR A 277 36.795 -7.304 138.768 1.00 14.21 C +ATOM 4371 H THR A 277 36.223 -5.850 136.198 1.00 0.00 H +ATOM 4372 HA THR A 277 38.723 -5.914 137.639 1.00 0.00 H +ATOM 4373 HB THR A 277 38.290 -8.413 137.708 1.00 0.00 H +ATOM 4374 HG1 THR A 277 36.177 -9.018 136.944 1.00 0.00 H +ATOM 4375 HG21 THR A 277 36.333 -8.194 139.196 1.00 0.00 H +ATOM 4376 HG22 THR A 277 37.508 -6.887 139.480 1.00 0.00 H +ATOM 4377 HG23 THR A 277 36.024 -6.564 138.551 1.00 0.00 H +ATOM 4378 N GLY A 278 40.342 -7.312 136.225 1.00 17.00 N +ATOM 4379 CA GLY A 278 41.447 -7.604 135.332 1.00 17.40 C +ATOM 4380 C GLY A 278 42.413 -6.437 135.235 1.00 16.98 C +ATOM 4381 O GLY A 278 42.229 -5.374 135.836 1.00 19.56 O +ATOM 4382 H GLY A 278 40.482 -7.456 137.215 1.00 0.00 H +ATOM 4383 HA3 GLY A 278 41.060 -7.838 134.340 1.00 0.00 H +ATOM 4384 HA2 GLY A 278 41.979 -8.486 135.689 1.00 0.00 H +ATOM 4385 N ASP A 279 43.471 -6.649 134.454 1.00 16.30 N +ATOM 4386 CA ASP A 279 44.505 -5.630 134.318 1.00 20.51 C +ATOM 4387 C ASP A 279 43.980 -4.449 133.509 1.00 19.85 C +ATOM 4388 O ASP A 279 43.410 -4.629 132.429 1.00 20.50 O +ATOM 4389 CB ASP A 279 45.750 -6.214 133.654 1.00 27.25 C +ATOM 4390 CG ASP A 279 46.822 -5.167 133.409 1.00 31.63 C +ATOM 4391 OD1 ASP A 279 47.319 -4.590 134.397 1.00 34.87 O +ATOM 4392 OD2 ASP A 279 47.171 -4.920 132.235 1.00 38.19 O1- +ATOM 4393 H ASP A 279 43.561 -7.520 133.951 1.00 0.00 H +ATOM 4394 HA ASP A 279 44.776 -5.276 135.313 1.00 0.00 H +ATOM 4395 HB3 ASP A 279 45.472 -6.677 132.707 1.00 0.00 H +ATOM 4396 HB2 ASP A 279 46.156 -7.008 134.280 1.00 0.00 H +ATOM 4397 N GLU A 280 44.185 -3.237 134.034 1.00 17.41 N +ATOM 4398 CA GLU A 280 43.650 -2.041 133.390 1.00 21.24 C +ATOM 4399 C GLU A 280 44.225 -1.857 131.992 1.00 19.49 C +ATOM 4400 O GLU A 280 43.493 -1.563 131.040 1.00 14.03 O +ATOM 4401 CB GLU A 280 43.935 -0.808 134.248 1.00 16.86 C +ATOM 4402 CG GLU A 280 43.560 0.501 133.573 1.00 24.70 C +ATOM 4403 CD GLU A 280 43.817 1.708 134.451 1.00 30.99 C +ATOM 4404 OE1 GLU A 280 44.798 1.686 135.224 1.00 33.36 O +ATOM 4405 OE2 GLU A 280 43.040 2.682 134.367 1.00 36.07 O1- +ATOM 4406 H GLU A 280 44.716 -3.140 134.887 1.00 0.00 H +ATOM 4407 HA GLU A 280 42.569 -2.154 133.303 1.00 0.00 H +ATOM 4408 HB3 GLU A 280 44.992 -0.788 134.513 1.00 0.00 H +ATOM 4409 HB2 GLU A 280 43.400 -0.894 135.194 1.00 0.00 H +ATOM 4410 HG3 GLU A 280 42.507 0.475 133.292 1.00 0.00 H +ATOM 4411 HG2 GLU A 280 44.121 0.603 132.644 1.00 0.00 H +ATOM 4412 N GLN A 281 45.542 -2.024 131.850 1.00 16.05 N +ATOM 4413 CA GLN A 281 46.173 -1.837 130.548 1.00 17.08 C +ATOM 4414 C GLN A 281 45.630 -2.814 129.514 1.00 23.44 C +ATOM 4415 O GLN A 281 45.561 -2.483 128.325 1.00 26.62 O +ATOM 4416 CB GLN A 281 47.692 -1.978 130.679 1.00 18.79 C +ATOM 4417 CG GLN A 281 48.457 -1.930 129.360 1.00 33.45 C +ATOM 4418 CD GLN A 281 48.324 -0.601 128.633 1.00 43.65 C +ATOM 4419 OE1 GLN A 281 47.891 0.401 129.205 1.00 42.88 O +ATOM 4420 NE2 GLN A 281 48.692 -0.592 127.356 1.00 42.43 N +ATOM 4421 H GLN A 281 46.107 -2.281 132.647 1.00 0.00 H +ATOM 4422 HA GLN A 281 45.954 -0.825 130.207 1.00 0.00 H +ATOM 4423 HB3 GLN A 281 47.925 -2.908 131.197 1.00 0.00 H +ATOM 4424 HB2 GLN A 281 48.070 -1.201 131.344 1.00 0.00 H +ATOM 4425 HG3 GLN A 281 48.110 -2.734 128.711 1.00 0.00 H +ATOM 4426 HG2 GLN A 281 49.511 -2.137 129.545 1.00 0.00 H +ATOM 4427 HE22 GLN A 281 48.628 0.260 126.818 1.00 0.00 H +ATOM 4428 HE21 GLN A 281 49.036 -1.437 126.924 1.00 0.00 H +ATOM 4429 N VAL A 282 45.222 -4.010 129.942 1.00 17.22 N +ATOM 4430 CA VAL A 282 44.712 -4.994 128.993 1.00 15.97 C +ATOM 4431 C VAL A 282 43.336 -4.581 128.480 1.00 20.10 C +ATOM 4432 O VAL A 282 43.089 -4.580 127.268 1.00 22.57 O +ATOM 4433 CB VAL A 282 44.688 -6.397 129.624 1.00 25.80 C +ATOM 4434 CG1 VAL A 282 44.053 -7.390 128.667 1.00 19.81 C +ATOM 4435 CG2 VAL A 282 46.097 -6.842 129.977 1.00 21.12 C +ATOM 4436 H VAL A 282 45.266 -4.236 130.925 1.00 0.00 H +ATOM 4437 HA VAL A 282 45.392 -5.022 128.142 1.00 0.00 H +ATOM 4438 HB VAL A 282 44.093 -6.361 130.537 1.00 0.00 H +ATOM 4439 HG11 VAL A 282 44.041 -8.379 129.124 1.00 0.00 H +ATOM 4440 HG12 VAL A 282 43.031 -7.080 128.446 1.00 0.00 H +ATOM 4441 HG13 VAL A 282 44.630 -7.424 127.743 1.00 0.00 H +ATOM 4442 HG21 VAL A 282 46.064 -7.836 130.422 1.00 0.00 H +ATOM 4443 HG22 VAL A 282 46.707 -6.869 129.074 1.00 0.00 H +ATOM 4444 HG23 VAL A 282 46.533 -6.140 130.688 1.00 0.00 H +ATOM 4445 N TRP A 283 42.418 -4.221 129.384 1.00 18.95 N +ATOM 4446 CA TRP A 283 41.079 -3.874 128.918 1.00 20.08 C +ATOM 4447 C TRP A 283 40.994 -2.469 128.338 1.00 19.72 C +ATOM 4448 O TRP A 283 39.989 -2.148 127.695 1.00 16.26 O +ATOM 4449 CB TRP A 283 40.027 -4.052 130.029 1.00 16.68 C +ATOM 4450 CG TRP A 283 40.176 -3.250 131.299 1.00 16.09 C +ATOM 4451 CD1 TRP A 283 40.555 -3.727 132.522 1.00 20.47 C +ATOM 4452 CD2 TRP A 283 39.872 -1.859 131.492 1.00 16.04 C +ATOM 4453 NE1 TRP A 283 40.536 -2.718 133.454 1.00 16.49 N +ATOM 4454 CE2 TRP A 283 40.124 -1.561 132.848 1.00 17.20 C +ATOM 4455 CE3 TRP A 283 39.430 -0.834 130.650 1.00 16.62 C +ATOM 4456 CZ2 TRP A 283 39.949 -0.284 133.378 1.00 20.47 C +ATOM 4457 CZ3 TRP A 283 39.258 0.435 131.180 1.00 19.03 C +ATOM 4458 CH2 TRP A 283 39.517 0.698 132.530 1.00 18.39 C +ATOM 4459 H TRP A 283 42.658 -4.194 130.365 1.00 0.00 H +ATOM 4460 HA TRP A 283 40.825 -4.570 128.118 1.00 0.00 H +ATOM 4461 HB3 TRP A 283 39.952 -5.110 130.282 1.00 0.00 H +ATOM 4462 HB2 TRP A 283 39.035 -3.878 129.612 1.00 0.00 H +ATOM 4463 HD1 TRP A 283 40.815 -4.769 132.639 1.00 0.00 H +ATOM 4464 HE1 TRP A 283 40.803 -2.908 134.409 1.00 0.00 H +ATOM 4465 HE3 TRP A 283 39.230 -1.039 129.609 1.00 0.00 H +ATOM 4466 HZ2 TRP A 283 40.153 -0.100 134.422 1.00 0.00 H +ATOM 4467 HZ3 TRP A 283 38.918 1.243 130.548 1.00 0.00 H +ATOM 4468 HH2 TRP A 283 39.369 1.702 132.898 1.00 0.00 H +ATOM 4469 N LYS A 284 42.014 -1.631 128.532 1.00 16.61 N +ATOM 4470 CA LYS A 284 42.052 -0.363 127.813 1.00 15.57 C +ATOM 4471 C LYS A 284 42.342 -0.586 126.334 1.00 14.16 C +ATOM 4472 O LYS A 284 41.808 0.127 125.476 1.00 19.27 O +ATOM 4473 CB LYS A 284 43.089 0.571 128.436 1.00 17.27 C +ATOM 4474 CG LYS A 284 42.631 1.219 129.734 1.00 21.68 C +ATOM 4475 CD LYS A 284 42.947 2.705 129.761 1.00 28.92 C +ATOM 4476 CE LYS A 284 42.809 3.269 131.167 1.00 26.02 C +ATOM 4477 NZ LYS A 284 41.483 3.911 131.387 1.00 33.00 N1+ +ATOM 4478 H LYS A 284 42.754 -1.876 129.174 1.00 0.00 H +ATOM 4479 HA LYS A 284 41.073 0.108 127.901 1.00 0.00 H +ATOM 4480 HB3 LYS A 284 43.354 1.347 127.718 1.00 0.00 H +ATOM 4481 HB2 LYS A 284 44.012 0.019 128.613 1.00 0.00 H +ATOM 4482 HG3 LYS A 284 43.120 0.729 130.576 1.00 0.00 H +ATOM 4483 HG2 LYS A 284 41.557 1.074 129.852 1.00 0.00 H +ATOM 4484 HD3 LYS A 284 42.269 3.232 129.090 1.00 0.00 H +ATOM 4485 HD2 LYS A 284 43.964 2.866 129.404 1.00 0.00 H +ATOM 4486 HE3 LYS A 284 43.599 3.999 131.344 1.00 0.00 H +ATOM 4487 HE2 LYS A 284 42.949 2.469 131.894 1.00 0.00 H +ATOM 4488 HZ1 LYS A 284 41.435 4.270 132.330 1.00 0.00 H +ATOM 4489 HZ2 LYS A 284 41.363 4.670 130.731 1.00 0.00 H +ATOM 4490 HZ3 LYS A 284 40.751 3.229 131.249 1.00 0.00 H +ATOM 4491 N GLU A 285 43.181 -1.576 126.016 1.00 14.43 N +ATOM 4492 CA GLU A 285 43.414 -1.928 124.619 1.00 19.19 C +ATOM 4493 C GLU A 285 42.190 -2.599 124.010 1.00 19.95 C +ATOM 4494 O GLU A 285 41.815 -2.302 122.869 1.00 20.13 O +ATOM 4495 CB GLU A 285 44.632 -2.843 124.497 1.00 20.60 C +ATOM 4496 CG GLU A 285 45.893 -2.315 125.156 1.00 27.40 C +ATOM 4497 CD GLU A 285 47.015 -3.336 125.154 1.00 32.80 C +ATOM 4498 OE1 GLU A 285 46.946 -4.295 124.355 1.00 34.78 O +ATOM 4499 OE2 GLU A 285 47.963 -3.182 125.952 1.00 39.15 O1- +ATOM 4500 H GLU A 285 43.659 -2.086 126.745 1.00 0.00 H +ATOM 4501 HA GLU A 285 43.616 -1.012 124.063 1.00 0.00 H +ATOM 4502 HB3 GLU A 285 44.831 -3.040 123.444 1.00 0.00 H +ATOM 4503 HB2 GLU A 285 44.391 -3.822 124.912 1.00 0.00 H +ATOM 4504 HG3 GLU A 285 45.671 -2.023 126.182 1.00 0.00 H +ATOM 4505 HG2 GLU A 285 46.222 -1.414 124.639 1.00 0.00 H +ATOM 4506 N VAL A 286 41.562 -3.514 124.753 1.00 16.44 N +ATOM 4507 CA VAL A 286 40.356 -4.177 124.264 1.00 18.26 C +ATOM 4508 C VAL A 286 39.252 -3.156 124.022 1.00 17.59 C +ATOM 4509 O VAL A 286 38.522 -3.229 123.026 1.00 18.63 O +ATOM 4510 CB VAL A 286 39.913 -5.272 125.253 1.00 21.12 C +ATOM 4511 CG1 VAL A 286 38.505 -5.753 124.932 1.00 13.33 C +ATOM 4512 CG2 VAL A 286 40.897 -6.433 125.237 1.00 17.82 C +ATOM 4513 H VAL A 286 41.920 -3.756 125.666 1.00 0.00 H +ATOM 4514 HA VAL A 286 40.592 -4.654 123.313 1.00 0.00 H +ATOM 4515 HB VAL A 286 39.907 -4.844 126.255 1.00 0.00 H +ATOM 4516 HG11 VAL A 286 38.214 -6.526 125.643 1.00 0.00 H +ATOM 4517 HG12 VAL A 286 37.810 -4.916 125.001 1.00 0.00 H +ATOM 4518 HG13 VAL A 286 38.482 -6.162 123.922 1.00 0.00 H +ATOM 4519 HG21 VAL A 286 40.569 -7.198 125.941 1.00 0.00 H +ATOM 4520 HG22 VAL A 286 40.942 -6.858 124.234 1.00 0.00 H +ATOM 4521 HG23 VAL A 286 41.886 -6.076 125.524 1.00 0.00 H +ATOM 4522 N GLN A 287 39.119 -2.182 124.926 1.00 13.17 N +ATOM 4523 CA GLN A 287 38.135 -1.122 124.735 1.00 21.85 C +ATOM 4524 C GLN A 287 38.466 -0.280 123.508 1.00 19.57 C +ATOM 4525 O GLN A 287 37.570 0.087 122.739 1.00 21.18 O +ATOM 4526 CB GLN A 287 38.060 -0.250 125.988 1.00 14.68 C +ATOM 4527 CG GLN A 287 37.462 1.128 125.767 1.00 17.49 C +ATOM 4528 CD GLN A 287 37.389 1.938 127.046 1.00 23.64 C +ATOM 4529 OE1 GLN A 287 38.408 2.210 127.681 1.00 30.02 O +ATOM 4530 NE2 GLN A 287 36.178 2.323 127.434 1.00 20.57 N +ATOM 4531 H GLN A 287 39.702 -2.175 125.750 1.00 0.00 H +ATOM 4532 HA GLN A 287 37.160 -1.584 124.580 1.00 0.00 H +ATOM 4533 HB3 GLN A 287 39.057 -0.146 126.416 1.00 0.00 H +ATOM 4534 HB2 GLN A 287 37.490 -0.772 126.757 1.00 0.00 H +ATOM 4535 HG3 GLN A 287 36.462 1.026 125.345 1.00 0.00 H +ATOM 4536 HG2 GLN A 287 38.057 1.667 125.030 1.00 0.00 H +ATOM 4537 HE22 GLN A 287 36.067 2.865 128.279 1.00 0.00 H +ATOM 4538 HE21 GLN A 287 35.368 2.073 126.884 1.00 0.00 H +ATOM 4539 N GLU A 288 39.749 0.030 123.307 1.00 19.49 N +ATOM 4540 CA GLU A 288 40.159 0.749 122.105 1.00 24.75 C +ATOM 4541 C GLU A 288 39.885 -0.072 120.852 1.00 23.13 C +ATOM 4542 O GLU A 288 39.378 0.453 119.854 1.00 25.00 O +ATOM 4543 CB GLU A 288 41.642 1.108 122.193 1.00 26.53 C +ATOM 4544 CG GLU A 288 42.170 1.904 121.009 1.00 33.16 C +ATOM 4545 CD GLU A 288 41.641 3.324 120.972 1.00 40.84 C +ATOM 4546 OE1 GLU A 288 41.323 3.869 122.051 1.00 45.70 O +ATOM 4547 OE2 GLU A 288 41.548 3.897 119.865 1.00 41.39 O1- +ATOM 4548 H GLU A 288 40.445 -0.233 123.990 1.00 0.00 H +ATOM 4549 HA GLU A 288 39.584 1.673 122.044 1.00 0.00 H +ATOM 4550 HB3 GLU A 288 42.228 0.196 122.305 1.00 0.00 H +ATOM 4551 HB2 GLU A 288 41.825 1.664 123.112 1.00 0.00 H +ATOM 4552 HG3 GLU A 288 41.905 1.394 120.083 1.00 0.00 H +ATOM 4553 HG2 GLU A 288 43.259 1.924 121.043 1.00 0.00 H +ATOM 4554 N SER A 289 40.212 -1.366 120.888 1.00 21.85 N +ATOM 4555 CA SER A 289 40.020 -2.222 119.724 1.00 15.61 C +ATOM 4556 C SER A 289 38.553 -2.545 119.472 1.00 21.15 C +ATOM 4557 O SER A 289 38.201 -2.913 118.347 1.00 20.63 O +ATOM 4558 CB SER A 289 40.820 -3.516 119.890 1.00 18.54 C +ATOM 4559 OG SER A 289 40.189 -4.598 119.229 1.00 28.58 O +ATOM 4560 H SER A 289 40.599 -1.766 121.731 1.00 0.00 H +ATOM 4561 HA SER A 289 40.405 -1.696 118.850 1.00 0.00 H +ATOM 4562 HB3 SER A 289 40.920 -3.747 120.950 1.00 0.00 H +ATOM 4563 HB2 SER A 289 41.822 -3.378 119.484 1.00 0.00 H +ATOM 4564 HG SER A 289 40.711 -5.395 119.349 1.00 0.00 H +ATOM 4565 N LEU A 290 37.691 -2.419 120.486 1.00 22.91 N +ATOM 4566 CA LEU A 290 36.269 -2.676 120.278 1.00 19.75 C +ATOM 4567 C LEU A 290 35.646 -1.660 119.332 1.00 23.39 C +ATOM 4568 O LEU A 290 34.651 -1.968 118.665 1.00 21.19 O +ATOM 4569 CB LEU A 290 35.526 -2.670 121.613 1.00 18.94 C +ATOM 4570 CG LEU A 290 35.352 -4.015 122.316 1.00 18.46 C +ATOM 4571 CD1 LEU A 290 35.179 -3.801 123.807 1.00 13.76 C +ATOM 4572 CD2 LEU A 290 34.167 -4.773 121.738 1.00 12.65 C +ATOM 4573 H LEU A 290 38.023 -2.145 121.400 1.00 0.00 H +ATOM 4574 HA LEU A 290 36.163 -3.666 119.833 1.00 0.00 H +ATOM 4575 HB3 LEU A 290 34.548 -2.208 121.477 1.00 0.00 H +ATOM 4576 HB2 LEU A 290 36.015 -1.971 122.292 1.00 0.00 H +ATOM 4577 HG LEU A 290 36.252 -4.608 122.155 1.00 0.00 H +ATOM 4578 HD11 LEU A 290 35.056 -4.765 124.301 1.00 0.00 H +ATOM 4579 HD12 LEU A 290 36.060 -3.298 124.207 1.00 0.00 H +ATOM 4580 HD13 LEU A 290 34.297 -3.186 123.986 1.00 0.00 H +ATOM 4581 HD21 LEU A 290 34.060 -5.728 122.252 1.00 0.00 H +ATOM 4582 HD22 LEU A 290 33.259 -4.185 121.872 1.00 0.00 H +ATOM 4583 HD23 LEU A 290 34.331 -4.950 120.675 1.00 0.00 H +ATOM 4584 N LYS A 291 36.207 -0.449 119.268 1.00 19.90 N +ATOM 4585 CA LYS A 291 35.693 0.574 118.362 1.00 26.76 C +ATOM 4586 C LYS A 291 35.678 0.073 116.924 1.00 23.15 C +ATOM 4587 O LYS A 291 34.675 0.205 116.214 1.00 26.52 O +ATOM 4588 CB LYS A 291 36.539 1.843 118.478 1.00 23.54 C +ATOM 4589 CG LYS A 291 35.994 2.888 119.435 1.00 28.95 C +ATOM 4590 CD LYS A 291 37.046 3.281 120.459 1.00 33.80 C +ATOM 4591 CE LYS A 291 37.957 4.371 119.921 1.00 28.56 C +ATOM 4592 NZ LYS A 291 38.585 5.168 121.011 1.00 42.49 N1+ +ATOM 4593 H LYS A 291 37.001 -0.229 119.853 1.00 0.00 H +ATOM 4594 HA LYS A 291 34.671 0.813 118.655 1.00 0.00 H +ATOM 4595 HB3 LYS A 291 36.660 2.287 117.490 1.00 0.00 H +ATOM 4596 HB2 LYS A 291 37.553 1.575 118.776 1.00 0.00 H +ATOM 4597 HG3 LYS A 291 35.119 2.489 119.948 1.00 0.00 H +ATOM 4598 HG2 LYS A 291 35.687 3.770 118.873 1.00 0.00 H +ATOM 4599 HD3 LYS A 291 37.642 2.407 120.721 1.00 0.00 H +ATOM 4600 HD2 LYS A 291 36.555 3.633 121.366 1.00 0.00 H +ATOM 4601 HE3 LYS A 291 37.385 5.033 119.271 1.00 0.00 H +ATOM 4602 HE2 LYS A 291 38.736 3.921 119.306 1.00 0.00 H +ATOM 4603 HZ1 LYS A 291 39.180 5.878 120.609 1.00 0.00 H +ATOM 4604 HZ2 LYS A 291 37.864 5.607 121.566 1.00 0.00 H +ATOM 4605 HZ3 LYS A 291 39.137 4.560 121.598 1.00 0.00 H +ATOM 4606 N LYS A 292 36.792 -0.511 116.478 1.00 22.02 N +ATOM 4607 CA LYS A 292 36.847 -1.059 115.128 1.00 26.95 C +ATOM 4608 C LYS A 292 36.036 -2.346 115.024 1.00 24.80 C +ATOM 4609 O LYS A 292 35.379 -2.590 114.006 1.00 25.69 O +ATOM 4610 CB LYS A 292 38.301 -1.296 114.720 1.00 27.17 C +ATOM 4611 CG LYS A 292 38.472 -1.978 113.373 1.00 35.43 C +ATOM 4612 CD LYS A 292 39.763 -1.547 112.698 1.00 39.27 C +ATOM 4613 CE LYS A 292 40.775 -2.679 112.669 1.00 38.99 C +ATOM 4614 NZ LYS A 292 40.493 -3.650 111.576 1.00 40.24 N1+ +ATOM 4615 H LYS A 292 37.603 -0.575 117.077 1.00 0.00 H +ATOM 4616 HA LYS A 292 36.416 -0.327 114.445 1.00 0.00 H +ATOM 4617 HB3 LYS A 292 38.800 -1.885 115.489 1.00 0.00 H +ATOM 4618 HB2 LYS A 292 38.834 -0.345 114.713 1.00 0.00 H +ATOM 4619 HG3 LYS A 292 37.627 -1.730 112.731 1.00 0.00 H +ATOM 4620 HG2 LYS A 292 38.479 -3.059 113.512 1.00 0.00 H +ATOM 4621 HD3 LYS A 292 40.185 -0.696 113.233 1.00 0.00 H +ATOM 4622 HD2 LYS A 292 39.550 -1.225 111.679 1.00 0.00 H +ATOM 4623 HE3 LYS A 292 40.765 -3.199 113.627 1.00 0.00 H +ATOM 4624 HE2 LYS A 292 41.776 -2.267 112.539 1.00 0.00 H +ATOM 4625 HZ1 LYS A 292 41.186 -4.385 111.591 1.00 0.00 H +ATOM 4626 HZ2 LYS A 292 39.575 -4.051 111.709 1.00 0.00 H +ATOM 4627 HZ3 LYS A 292 40.526 -3.174 110.686 1.00 0.00 H +ATOM 4628 N ILE A 293 36.064 -3.175 116.072 1.00 22.97 N +ATOM 4629 CA ILE A 293 35.284 -4.411 116.071 1.00 24.17 C +ATOM 4630 C ILE A 293 33.799 -4.099 115.935 1.00 24.27 C +ATOM 4631 O ILE A 293 33.089 -4.701 115.121 1.00 18.96 O +ATOM 4632 CB ILE A 293 35.573 -5.231 117.342 1.00 24.56 C +ATOM 4633 CG1 ILE A 293 36.962 -5.868 117.270 1.00 21.37 C +ATOM 4634 CG2 ILE A 293 34.507 -6.298 117.545 1.00 21.20 C +ATOM 4635 CD1 ILE A 293 37.397 -6.525 118.564 1.00 20.76 C +ATOM 4636 H ILE A 293 36.629 -2.951 116.878 1.00 0.00 H +ATOM 4637 HA ILE A 293 35.587 -5.004 115.208 1.00 0.00 H +ATOM 4638 HB ILE A 293 35.550 -4.556 118.198 1.00 0.00 H +ATOM 4639 HG13 ILE A 293 37.693 -5.111 116.985 1.00 0.00 H +ATOM 4640 HG12 ILE A 293 36.981 -6.604 116.466 1.00 0.00 H +ATOM 4641 HG21 ILE A 293 34.729 -6.867 118.448 1.00 0.00 H +ATOM 4642 HG22 ILE A 293 33.531 -5.823 117.646 1.00 0.00 H +ATOM 4643 HG23 ILE A 293 34.496 -6.970 116.687 1.00 0.00 H +ATOM 4644 HD11 ILE A 293 38.391 -6.955 118.438 1.00 0.00 H +ATOM 4645 HD12 ILE A 293 37.422 -5.780 119.360 1.00 0.00 H +ATOM 4646 HD13 ILE A 293 36.692 -7.313 118.827 1.00 0.00 H +ATOM 4647 N GLU A 294 33.310 -3.144 116.730 1.00 21.05 N +ATOM 4648 CA GLU A 294 31.904 -2.764 116.647 1.00 24.37 C +ATOM 4649 C GLU A 294 31.595 -2.039 115.344 1.00 24.58 C +ATOM 4650 O GLU A 294 30.468 -2.123 114.843 1.00 19.17 O +ATOM 4651 CB GLU A 294 31.529 -1.896 117.848 1.00 15.50 C +ATOM 4652 CG GLU A 294 31.254 -2.693 119.114 1.00 21.09 C +ATOM 4653 CD GLU A 294 31.089 -1.811 120.338 1.00 24.51 C +ATOM 4654 OE1 GLU A 294 31.361 -0.596 120.241 1.00 33.85 O +ATOM 4655 OE2 GLU A 294 30.693 -2.336 121.399 1.00 24.11 O1- +ATOM 4656 H GLU A 294 33.914 -2.681 117.393 1.00 0.00 H +ATOM 4657 HA GLU A 294 31.303 -3.673 116.682 1.00 0.00 H +ATOM 4658 HB3 GLU A 294 30.653 -1.296 117.601 1.00 0.00 H +ATOM 4659 HB2 GLU A 294 32.327 -1.178 118.039 1.00 0.00 H +ATOM 4660 HG3 GLU A 294 32.068 -3.398 119.282 1.00 0.00 H +ATOM 4661 HG2 GLU A 294 30.355 -3.293 118.976 1.00 0.00 H +ATOM 4662 N GLU A 295 32.574 -1.325 114.784 1.00 26.69 N +ATOM 4663 CA GLU A 295 32.382 -0.705 113.478 1.00 25.47 C +ATOM 4664 C GLU A 295 32.192 -1.764 112.398 1.00 30.13 C +ATOM 4665 O GLU A 295 31.300 -1.651 111.549 1.00 30.81 O +ATOM 4666 CB GLU A 295 33.570 0.199 113.148 1.00 25.41 C +ATOM 4667 CG GLU A 295 33.585 0.715 111.719 1.00 31.44 C +ATOM 4668 CD GLU A 295 33.216 2.181 111.616 1.00 40.99 C +ATOM 4669 OE1 GLU A 295 33.849 2.893 110.809 1.00 48.59 O +ATOM 4670 OE2 GLU A 295 32.294 2.620 112.338 1.00 51.48 O1- +ATOM 4671 H GLU A 295 33.455 -1.211 115.265 1.00 0.00 H +ATOM 4672 HA GLU A 295 31.483 -0.090 113.518 1.00 0.00 H +ATOM 4673 HB3 GLU A 295 34.498 -0.337 113.348 1.00 0.00 H +ATOM 4674 HB2 GLU A 295 33.584 1.043 113.837 1.00 0.00 H +ATOM 4675 HG3 GLU A 295 32.897 0.125 111.114 1.00 0.00 H +ATOM 4676 HG2 GLU A 295 34.574 0.559 111.288 1.00 0.00 H +ATOM 4677 N LEU A 296 33.023 -2.809 112.421 1.00 22.72 N +ATOM 4678 CA LEU A 296 32.890 -3.882 111.440 1.00 23.12 C +ATOM 4679 C LEU A 296 31.579 -4.636 111.623 1.00 27.75 C +ATOM 4680 O LEU A 296 30.974 -5.091 110.645 1.00 26.46 O +ATOM 4681 CB LEU A 296 34.080 -4.835 111.547 1.00 21.28 C +ATOM 4682 CG LEU A 296 35.442 -4.232 111.206 1.00 20.56 C +ATOM 4683 CD1 LEU A 296 36.561 -5.099 111.758 1.00 25.09 C +ATOM 4684 CD2 LEU A 296 35.593 -4.050 109.703 1.00 21.77 C +ATOM 4685 H LEU A 296 33.750 -2.861 113.120 1.00 0.00 H +ATOM 4686 HA LEU A 296 32.894 -3.439 110.444 1.00 0.00 H +ATOM 4687 HB3 LEU A 296 33.903 -5.705 110.914 1.00 0.00 H +ATOM 4688 HB2 LEU A 296 34.114 -5.257 112.552 1.00 0.00 H +ATOM 4689 HG LEU A 296 35.508 -3.251 111.676 1.00 0.00 H +ATOM 4690 HD11 LEU A 296 37.524 -4.655 111.506 1.00 0.00 H +ATOM 4691 HD12 LEU A 296 36.466 -5.169 112.842 1.00 0.00 H +ATOM 4692 HD13 LEU A 296 36.497 -6.096 111.323 1.00 0.00 H +ATOM 4693 HD21 LEU A 296 36.570 -3.619 109.485 1.00 0.00 H +ATOM 4694 HD22 LEU A 296 35.504 -5.017 109.209 1.00 0.00 H +ATOM 4695 HD23 LEU A 296 34.813 -3.383 109.337 1.00 0.00 H +ATOM 4696 N LYS A 297 31.122 -4.776 112.871 1.00 17.88 N +ATOM 4697 CA LYS A 297 29.849 -5.445 113.119 1.00 20.64 C +ATOM 4698 C LYS A 297 28.682 -4.618 112.597 1.00 24.80 C +ATOM 4699 O LYS A 297 27.709 -5.170 112.070 1.00 24.75 O +ATOM 4700 CB LYS A 297 29.686 -5.725 114.613 1.00 21.43 C +ATOM 4701 CG LYS A 297 28.345 -6.337 114.992 1.00 19.46 C +ATOM 4702 CD LYS A 297 28.295 -6.685 116.470 1.00 15.40 C +ATOM 4703 CE LYS A 297 27.065 -6.088 117.133 1.00 23.32 C +ATOM 4704 NZ LYS A 297 27.110 -6.226 118.615 1.00 29.37 N1+ +ATOM 4705 H LYS A 297 31.658 -4.418 113.648 1.00 0.00 H +ATOM 4706 HA LYS A 297 29.855 -6.399 112.591 1.00 0.00 H +ATOM 4707 HB3 LYS A 297 29.832 -4.801 115.172 1.00 0.00 H +ATOM 4708 HB2 LYS A 297 30.490 -6.381 114.947 1.00 0.00 H +ATOM 4709 HG3 LYS A 297 28.177 -7.238 114.401 1.00 0.00 H +ATOM 4710 HG2 LYS A 297 27.546 -5.634 114.758 1.00 0.00 H +ATOM 4711 HD3 LYS A 297 29.192 -6.308 116.962 1.00 0.00 H +ATOM 4712 HD2 LYS A 297 28.281 -7.769 116.587 1.00 0.00 H +ATOM 4713 HE3 LYS A 297 26.171 -6.581 116.750 1.00 0.00 H +ATOM 4714 HE2 LYS A 297 26.987 -5.033 116.869 1.00 0.00 H +ATOM 4715 HZ1 LYS A 297 26.278 -5.819 119.017 1.00 0.00 H +ATOM 4716 HZ2 LYS A 297 27.158 -7.204 118.861 1.00 0.00 H +ATOM 4717 HZ3 LYS A 297 27.925 -5.749 118.973 1.00 0.00 H +ATOM 4718 N ALA A 298 28.762 -3.291 112.731 1.00 25.68 N +ATOM 4719 CA ALA A 298 27.709 -2.422 112.219 1.00 24.46 C +ATOM 4720 C ALA A 298 27.556 -2.530 110.708 1.00 27.73 C +ATOM 4721 O ALA A 298 26.474 -2.246 110.184 1.00 28.58 O +ATOM 4722 CB ALA A 298 27.986 -0.970 112.614 1.00 23.50 C +ATOM 4723 H ALA A 298 29.560 -2.877 113.192 1.00 0.00 H +ATOM 4724 HA ALA A 298 26.767 -2.724 112.677 1.00 0.00 H +ATOM 4725 HB1 ALA A 298 27.193 -0.330 112.226 1.00 0.00 H +ATOM 4726 HB2 ALA A 298 28.019 -0.889 113.700 1.00 0.00 H +ATOM 4727 HB3 ALA A 298 28.943 -0.656 112.197 1.00 0.00 H +ATOM 4728 N HIS A 299 28.611 -2.931 109.999 1.00 26.87 N +ATOM 4729 CA HIS A 299 28.547 -3.174 108.565 1.00 29.68 C +ATOM 4730 C HIS A 299 28.497 -4.662 108.233 1.00 28.16 C +ATOM 4731 O HIS A 299 28.753 -5.045 107.086 1.00 30.30 O +ATOM 4732 CB HIS A 299 29.727 -2.500 107.863 1.00 29.49 C +ATOM 4733 CG HIS A 299 29.664 -1.004 107.887 1.00 27.25 C +ATOM 4734 ND1 HIS A 299 30.024 -0.261 108.990 1.00 26.74 N +ATOM 4735 CD2 HIS A 299 29.272 -0.113 106.945 1.00 25.19 C +ATOM 4736 CE1 HIS A 299 29.863 1.023 108.726 1.00 25.26 C +ATOM 4737 NE2 HIS A 299 29.407 1.140 107.492 1.00 32.29 N +ATOM 4738 H HIS A 299 29.500 -3.078 110.455 1.00 0.00 H +ATOM 4739 HA HIS A 299 27.631 -2.718 108.190 1.00 0.00 H +ATOM 4740 HB3 HIS A 299 29.777 -2.843 106.830 1.00 0.00 H +ATOM 4741 HB2 HIS A 299 30.658 -2.830 108.323 1.00 0.00 H +ATOM 4742 HD1 HIS A 299 30.350 -0.724 109.826 1.00 0.00 H +ATOM 4743 HD2 HIS A 299 28.936 -0.461 105.979 1.00 0.00 H +ATOM 4744 HE1 HIS A 299 30.100 1.762 109.477 1.00 0.00 H +ATOM 4745 N TRP A 300 28.190 -5.504 109.223 1.00 27.17 N +ATOM 4746 CA TRP A 300 27.903 -6.925 109.019 1.00 27.03 C +ATOM 4747 C TRP A 300 29.077 -7.672 108.389 1.00 27.54 C +ATOM 4748 O TRP A 300 28.886 -8.671 107.690 1.00 25.50 O +ATOM 4749 CB TRP A 300 26.634 -7.121 108.182 1.00 33.38 C +ATOM 4750 CG TRP A 300 25.409 -6.444 108.745 1.00 33.52 C +ATOM 4751 CD1 TRP A 300 25.250 -5.111 109.003 1.00 30.29 C +ATOM 4752 CD2 TRP A 300 24.176 -7.072 109.118 1.00 35.32 C +ATOM 4753 NE1 TRP A 300 23.997 -4.873 109.513 1.00 33.15 N +ATOM 4754 CE2 TRP A 300 23.317 -6.059 109.592 1.00 35.73 C +ATOM 4755 CE3 TRP A 300 23.714 -8.391 109.095 1.00 36.44 C +ATOM 4756 CZ2 TRP A 300 22.025 -6.326 110.041 1.00 40.12 C +ATOM 4757 CZ3 TRP A 300 22.430 -8.653 109.541 1.00 36.78 C +ATOM 4758 CH2 TRP A 300 21.601 -7.625 110.007 1.00 40.41 C +ATOM 4759 H TRP A 300 28.146 -5.170 110.175 1.00 0.00 H +ATOM 4760 HA TRP A 300 27.721 -7.367 109.999 1.00 0.00 H +ATOM 4761 HB3 TRP A 300 26.437 -8.187 108.068 1.00 0.00 H +ATOM 4762 HB2 TRP A 300 26.811 -6.762 107.168 1.00 0.00 H +ATOM 4763 HD1 TRP A 300 26.056 -4.422 108.800 1.00 0.00 H +ATOM 4764 HE1 TRP A 300 23.722 -3.933 109.759 1.00 0.00 H +ATOM 4765 HE3 TRP A 300 24.355 -9.182 108.734 1.00 0.00 H +ATOM 4766 HZ2 TRP A 300 21.400 -5.521 110.398 1.00 0.00 H +ATOM 4767 HZ3 TRP A 300 22.052 -9.665 109.533 1.00 0.00 H +ATOM 4768 HH2 TRP A 300 20.607 -7.877 110.344 1.00 0.00 H +ATOM 4769 N LYS A 301 30.302 -7.200 108.630 1.00 30.07 N +ATOM 4770 CA LYS A 301 31.508 -7.866 108.136 1.00 28.10 C +ATOM 4771 C LYS A 301 31.962 -8.856 109.205 1.00 28.30 C +ATOM 4772 O LYS A 301 32.869 -8.602 110.001 1.00 29.40 O +ATOM 4773 CB LYS A 301 32.583 -6.842 107.796 1.00 28.13 C +ATOM 4774 CG LYS A 301 32.262 -6.025 106.553 1.00 31.67 C +ATOM 4775 CD LYS A 301 32.617 -4.555 106.728 1.00 30.45 C +ATOM 4776 CE LYS A 301 33.975 -4.225 106.123 1.00 31.07 C +ATOM 4777 NZ LYS A 301 34.323 -2.784 106.291 1.00 46.96 N1+ +ATOM 4778 H LYS A 301 30.420 -6.355 109.170 1.00 0.00 H +ATOM 4779 HA LYS A 301 31.255 -8.420 107.232 1.00 0.00 H +ATOM 4780 HB3 LYS A 301 33.537 -7.351 107.658 1.00 0.00 H +ATOM 4781 HB2 LYS A 301 32.725 -6.171 108.643 1.00 0.00 H +ATOM 4782 HG3 LYS A 301 31.200 -6.117 106.323 1.00 0.00 H +ATOM 4783 HG2 LYS A 301 32.808 -6.431 105.701 1.00 0.00 H +ATOM 4784 HD3 LYS A 301 32.623 -4.307 107.789 1.00 0.00 H +ATOM 4785 HD2 LYS A 301 31.851 -3.938 106.258 1.00 0.00 H +ATOM 4786 HE3 LYS A 301 33.970 -4.476 105.062 1.00 0.00 H +ATOM 4787 HE2 LYS A 301 34.741 -4.840 106.594 1.00 0.00 H +ATOM 4788 HZ1 LYS A 301 35.227 -2.605 105.878 1.00 0.00 H +ATOM 4789 HZ2 LYS A 301 33.626 -2.213 105.834 1.00 0.00 H +ATOM 4790 HZ3 LYS A 301 34.351 -2.556 107.275 1.00 0.00 H +ATOM 4791 N TRP A 302 31.305 -10.019 109.206 1.00 28.66 N +ATOM 4792 CA TRP A 302 31.408 -10.945 110.328 1.00 27.92 C +ATOM 4793 C TRP A 302 32.775 -11.614 110.408 1.00 29.08 C +ATOM 4794 O TRP A 302 33.261 -11.885 111.512 1.00 23.08 O +ATOM 4795 CB TRP A 302 30.300 -11.996 110.232 1.00 21.49 C +ATOM 4796 CG TRP A 302 28.925 -11.445 110.500 1.00 27.43 C +ATOM 4797 CD1 TRP A 302 27.856 -11.449 109.648 1.00 29.11 C +ATOM 4798 CD2 TRP A 302 28.477 -10.806 111.701 1.00 26.19 C +ATOM 4799 NE1 TRP A 302 26.771 -10.855 110.248 1.00 32.33 N +ATOM 4800 CE2 TRP A 302 27.126 -10.451 111.509 1.00 26.41 C +ATOM 4801 CE3 TRP A 302 29.087 -10.501 112.923 1.00 23.67 C +ATOM 4802 CZ2 TRP A 302 26.377 -9.807 112.492 1.00 27.37 C +ATOM 4803 CZ3 TRP A 302 28.342 -9.862 113.896 1.00 24.33 C +ATOM 4804 CH2 TRP A 302 27.001 -9.521 113.676 1.00 25.09 C +ATOM 4805 H TRP A 302 30.723 -10.271 108.420 1.00 0.00 H +ATOM 4806 HA TRP A 302 31.256 -10.379 111.247 1.00 0.00 H +ATOM 4807 HB3 TRP A 302 30.508 -12.806 110.931 1.00 0.00 H +ATOM 4808 HB2 TRP A 302 30.320 -12.453 109.243 1.00 0.00 H +ATOM 4809 HD1 TRP A 302 27.952 -11.882 108.663 1.00 0.00 H +ATOM 4810 HE1 TRP A 302 25.896 -10.780 109.749 1.00 0.00 H +ATOM 4811 HE3 TRP A 302 30.121 -10.765 113.091 1.00 0.00 H +ATOM 4812 HZ2 TRP A 302 25.344 -9.553 112.304 1.00 0.00 H +ATOM 4813 HZ3 TRP A 302 28.792 -9.617 114.847 1.00 0.00 H +ATOM 4814 HH2 TRP A 302 26.459 -9.022 114.465 1.00 0.00 H +ATOM 4815 N GLU A 303 33.407 -11.895 109.267 1.00 29.85 N +ATOM 4816 CA GLU A 303 34.717 -12.540 109.299 1.00 29.75 C +ATOM 4817 C GLU A 303 35.753 -11.642 109.962 1.00 25.75 C +ATOM 4818 O GLU A 303 36.534 -12.094 110.807 1.00 27.92 O +ATOM 4819 CB GLU A 303 35.158 -12.923 107.886 1.00 30.23 C +ATOM 4820 CG GLU A 303 34.415 -14.107 107.294 1.00 39.90 C +ATOM 4821 CD GLU A 303 33.276 -13.681 106.391 1.00 54.67 C +ATOM 4822 OE1 GLU A 303 32.726 -12.578 106.604 1.00 53.31 O +ATOM 4823 OE2 GLU A 303 32.931 -14.453 105.472 1.00 52.70 O1- +ATOM 4824 H GLU A 303 32.979 -11.662 108.382 1.00 0.00 H +ATOM 4825 HA GLU A 303 34.632 -13.453 109.888 1.00 0.00 H +ATOM 4826 HB3 GLU A 303 36.228 -13.131 107.886 1.00 0.00 H +ATOM 4827 HB2 GLU A 303 35.048 -12.062 107.227 1.00 0.00 H +ATOM 4828 HG3 GLU A 303 34.026 -14.730 108.099 1.00 0.00 H +ATOM 4829 HG2 GLU A 303 35.112 -14.727 106.730 1.00 0.00 H +ATOM 4830 N GLN A 304 35.769 -10.359 109.598 1.00 25.93 N +ATOM 4831 CA GLN A 304 36.707 -9.431 110.223 1.00 26.31 C +ATOM 4832 C GLN A 304 36.432 -9.291 111.715 1.00 22.12 C +ATOM 4833 O GLN A 304 37.364 -9.150 112.516 1.00 22.83 O +ATOM 4834 CB GLN A 304 36.634 -8.071 109.533 1.00 26.97 C +ATOM 4835 CG GLN A 304 37.450 -7.974 108.259 1.00 23.52 C +ATOM 4836 CD GLN A 304 37.534 -6.554 107.742 1.00 39.11 C +ATOM 4837 OE1 GLN A 304 36.757 -6.148 106.877 1.00 43.02 O +ATOM 4838 NE2 GLN A 304 38.472 -5.783 108.281 1.00 28.17 N +ATOM 4839 H GLN A 304 35.131 -10.027 108.888 1.00 0.00 H +ATOM 4840 HA GLN A 304 37.715 -9.826 110.096 1.00 0.00 H +ATOM 4841 HB3 GLN A 304 36.956 -7.296 110.228 1.00 0.00 H +ATOM 4842 HB2 GLN A 304 35.593 -7.832 109.314 1.00 0.00 H +ATOM 4843 HG3 GLN A 304 37.006 -8.612 107.495 1.00 0.00 H +ATOM 4844 HG2 GLN A 304 38.455 -8.353 108.443 1.00 0.00 H +ATOM 4845 HE22 GLN A 304 38.576 -4.826 107.976 1.00 0.00 H +ATOM 4846 HE21 GLN A 304 39.081 -6.154 108.996 1.00 0.00 H +ATOM 4847 N VAL A 305 35.156 -9.324 112.104 1.00 22.34 N +ATOM 4848 CA VAL A 305 34.800 -9.283 113.521 1.00 21.01 C +ATOM 4849 C VAL A 305 35.395 -10.481 114.249 1.00 17.74 C +ATOM 4850 O VAL A 305 36.021 -10.342 115.307 1.00 15.91 O +ATOM 4851 CB VAL A 305 33.270 -9.228 113.686 1.00 20.61 C +ATOM 4852 CG1 VAL A 305 32.880 -9.458 115.140 1.00 17.39 C +ATOM 4853 CG2 VAL A 305 32.728 -7.899 113.185 1.00 21.12 C +ATOM 4854 H VAL A 305 34.419 -9.378 111.415 1.00 0.00 H +ATOM 4855 HA VAL A 305 35.223 -8.376 113.953 1.00 0.00 H +ATOM 4856 HB VAL A 305 32.832 -10.025 113.084 1.00 0.00 H +ATOM 4857 HG11 VAL A 305 31.795 -9.416 115.237 1.00 0.00 H +ATOM 4858 HG12 VAL A 305 33.235 -10.437 115.461 1.00 0.00 H +ATOM 4859 HG13 VAL A 305 33.330 -8.686 115.764 1.00 0.00 H +ATOM 4860 HG21 VAL A 305 31.645 -7.878 113.309 1.00 0.00 H +ATOM 4861 HG22 VAL A 305 33.175 -7.085 113.756 1.00 0.00 H +ATOM 4862 HG23 VAL A 305 32.975 -7.780 112.130 1.00 0.00 H +ATOM 4863 N LEU A 306 35.224 -11.676 113.680 1.00 17.62 N +ATOM 4864 CA LEU A 306 35.667 -12.894 114.351 1.00 17.29 C +ATOM 4865 C LEU A 306 37.183 -12.934 114.499 1.00 21.65 C +ATOM 4866 O LEU A 306 37.700 -13.312 115.557 1.00 19.13 O +ATOM 4867 CB LEU A 306 35.170 -14.118 113.583 1.00 14.48 C +ATOM 4868 CG LEU A 306 35.605 -15.479 114.125 1.00 19.85 C +ATOM 4869 CD1 LEU A 306 35.242 -15.613 115.597 1.00 15.76 C +ATOM 4870 CD2 LEU A 306 34.977 -16.590 113.309 1.00 13.73 C +ATOM 4871 H LEU A 306 34.783 -11.745 112.774 1.00 0.00 H +ATOM 4872 HA LEU A 306 35.226 -12.914 115.348 1.00 0.00 H +ATOM 4873 HB3 LEU A 306 35.472 -14.034 112.539 1.00 0.00 H +ATOM 4874 HB2 LEU A 306 34.082 -14.087 113.522 1.00 0.00 H +ATOM 4875 HG LEU A 306 36.688 -15.555 114.031 1.00 0.00 H +ATOM 4876 HD11 LEU A 306 35.561 -16.589 115.963 1.00 0.00 H +ATOM 4877 HD12 LEU A 306 35.742 -14.831 116.168 1.00 0.00 H +ATOM 4878 HD13 LEU A 306 34.163 -15.515 115.716 1.00 0.00 H +ATOM 4879 HD21 LEU A 306 35.294 -17.555 113.704 1.00 0.00 H +ATOM 4880 HD22 LEU A 306 33.891 -16.514 113.365 1.00 0.00 H +ATOM 4881 HD23 LEU A 306 35.294 -16.502 112.270 1.00 0.00 H +ATOM 4882 N ALA A 307 37.913 -12.552 113.448 1.00 19.74 N +ATOM 4883 CA ALA A 307 39.371 -12.609 113.501 1.00 17.57 C +ATOM 4884 C ALA A 307 39.925 -11.672 114.567 1.00 17.53 C +ATOM 4885 O ALA A 307 40.845 -12.038 115.308 1.00 19.35 O +ATOM 4886 CB ALA A 307 39.961 -12.273 112.132 1.00 16.15 C +ATOM 4887 H ALA A 307 37.457 -12.221 112.610 1.00 0.00 H +ATOM 4888 HA ALA A 307 39.663 -13.627 113.757 1.00 0.00 H +ATOM 4889 HB1 ALA A 307 41.049 -12.319 112.183 1.00 0.00 H +ATOM 4890 HB2 ALA A 307 39.602 -12.991 111.395 1.00 0.00 H +ATOM 4891 HB3 ALA A 307 39.653 -11.269 111.840 1.00 0.00 H +ATOM 4892 N MET A 308 39.378 -10.458 114.660 1.00 19.90 N +ATOM 4893 CA MET A 308 39.822 -9.529 115.693 1.00 16.94 C +ATOM 4894 C MET A 308 39.417 -10.011 117.080 1.00 16.75 C +ATOM 4895 O MET A 308 40.181 -9.865 118.042 1.00 18.78 O +ATOM 4896 CB MET A 308 39.256 -8.135 115.424 1.00 18.73 C +ATOM 4897 CG MET A 308 39.927 -7.403 114.276 1.00 19.82 C +ATOM 4898 SD MET A 308 39.394 -5.685 114.153 1.00 28.84 S +ATOM 4899 CE MET A 308 40.251 -4.964 115.550 1.00 18.82 C +ATOM 4900 H MET A 308 38.654 -10.180 114.014 1.00 0.00 H +ATOM 4901 HA MET A 308 40.910 -9.470 115.655 1.00 0.00 H +ATOM 4902 HB3 MET A 308 39.332 -7.533 116.330 1.00 0.00 H +ATOM 4903 HB2 MET A 308 38.186 -8.211 115.228 1.00 0.00 H +ATOM 4904 HG3 MET A 308 39.708 -7.918 113.341 1.00 0.00 H +ATOM 4905 HG2 MET A 308 41.009 -7.438 114.406 1.00 0.00 H +ATOM 4906 HE1 MET A 308 40.021 -3.900 115.608 1.00 0.00 H +ATOM 4907 HE2 MET A 308 39.929 -5.456 116.468 1.00 0.00 H +ATOM 4908 HE3 MET A 308 41.326 -5.097 115.426 1.00 0.00 H +ATOM 4909 N CYS A 309 38.219 -10.589 117.202 1.00 13.59 N +ATOM 4910 CA CYS A 309 37.771 -11.100 118.493 1.00 17.93 C +ATOM 4911 C CYS A 309 38.598 -12.302 118.932 1.00 17.61 C +ATOM 4912 O CYS A 309 38.918 -12.442 120.118 1.00 15.54 O +ATOM 4913 CB CYS A 309 36.288 -11.465 118.428 1.00 13.64 C +ATOM 4914 SG CYS A 309 35.172 -10.049 118.305 1.00 12.39 S +ATOM 4915 H CYS A 309 37.615 -10.675 116.397 1.00 0.00 H +ATOM 4916 HA CYS A 309 37.896 -10.311 119.234 1.00 0.00 H +ATOM 4917 HB3 CYS A 309 36.024 -12.058 119.303 1.00 0.00 H +ATOM 4918 HB2 CYS A 309 36.117 -12.133 117.584 1.00 0.00 H +ATOM 4919 HG CYS A 309 33.908 -10.480 118.255 1.00 0.00 H +ATOM 4920 N GLN A 310 38.953 -13.181 117.991 1.00 15.73 N +ATOM 4921 CA GLN A 310 39.773 -14.340 118.332 1.00 15.42 C +ATOM 4922 C GLN A 310 41.154 -13.914 118.813 1.00 17.80 C +ATOM 4923 O GLN A 310 41.720 -14.530 119.724 1.00 17.45 O +ATOM 4924 CB GLN A 310 39.890 -15.274 117.128 1.00 16.17 C +ATOM 4925 CG GLN A 310 38.667 -16.145 116.896 1.00 17.99 C +ATOM 4926 CD GLN A 310 38.753 -16.932 115.604 1.00 18.57 C +ATOM 4927 OE1 GLN A 310 39.390 -16.501 114.643 1.00 21.25 O +ATOM 4928 NE2 GLN A 310 38.108 -18.091 115.573 1.00 15.14 N +ATOM 4929 H GLN A 310 38.654 -13.046 117.036 1.00 0.00 H +ATOM 4930 HA GLN A 310 39.281 -14.882 119.140 1.00 0.00 H +ATOM 4931 HB3 GLN A 310 40.768 -15.909 117.247 1.00 0.00 H +ATOM 4932 HB2 GLN A 310 40.090 -14.686 116.232 1.00 0.00 H +ATOM 4933 HG3 GLN A 310 37.774 -15.520 116.881 1.00 0.00 H +ATOM 4934 HG2 GLN A 310 38.549 -16.834 117.733 1.00 0.00 H +ATOM 4935 HE22 GLN A 310 38.130 -18.659 114.738 1.00 0.00 H +ATOM 4936 HE21 GLN A 310 37.595 -18.405 116.384 1.00 0.00 H +ATOM 4937 N ALA A 311 41.709 -12.856 118.215 1.00 17.13 N +ATOM 4938 CA ALA A 311 43.010 -12.354 118.639 1.00 13.97 C +ATOM 4939 C ALA A 311 42.987 -11.834 120.069 1.00 16.76 C +ATOM 4940 O ALA A 311 44.046 -11.729 120.696 1.00 18.19 O +ATOM 4941 CB ALA A 311 43.484 -11.253 117.690 1.00 9.37 C +ATOM 4942 H ALA A 311 41.226 -12.393 117.458 1.00 0.00 H +ATOM 4943 HA ALA A 311 43.724 -13.176 118.588 1.00 0.00 H +ATOM 4944 HB1 ALA A 311 44.457 -10.885 118.016 1.00 0.00 H +ATOM 4945 HB2 ALA A 311 43.568 -11.654 116.680 1.00 0.00 H +ATOM 4946 HB3 ALA A 311 42.766 -10.433 117.696 1.00 0.00 H +ATOM 4947 N ILE A 312 41.811 -11.504 120.594 1.00 15.99 N +ATOM 4948 CA ILE A 312 41.681 -11.072 121.981 1.00 16.76 C +ATOM 4949 C ILE A 312 41.316 -12.238 122.889 1.00 17.53 C +ATOM 4950 O ILE A 312 41.927 -12.436 123.942 1.00 17.81 O +ATOM 4951 CB ILE A 312 40.638 -9.938 122.082 1.00 15.41 C +ATOM 4952 CG1 ILE A 312 41.168 -8.660 121.429 1.00 10.02 C +ATOM 4953 CG2 ILE A 312 40.257 -9.689 123.533 1.00 12.02 C +ATOM 4954 CD1 ILE A 312 40.124 -7.573 121.290 1.00 11.88 C +ATOM 4955 H ILE A 312 40.975 -11.549 120.029 1.00 0.00 H +ATOM 4956 HA ILE A 312 42.644 -10.678 122.305 1.00 0.00 H +ATOM 4957 HB ILE A 312 39.743 -10.250 121.544 1.00 0.00 H +ATOM 4958 HG13 ILE A 312 41.575 -8.898 120.446 1.00 0.00 H +ATOM 4959 HG12 ILE A 312 42.010 -8.281 122.008 1.00 0.00 H +ATOM 4960 HG21 ILE A 312 39.521 -8.886 123.583 1.00 0.00 H +ATOM 4961 HG22 ILE A 312 39.832 -10.598 123.959 1.00 0.00 H +ATOM 4962 HG23 ILE A 312 41.144 -9.404 124.098 1.00 0.00 H +ATOM 4963 HD11 ILE A 312 40.571 -6.697 120.819 1.00 0.00 H +ATOM 4964 HD12 ILE A 312 39.301 -7.936 120.674 1.00 0.00 H +ATOM 4965 HD13 ILE A 312 39.747 -7.302 122.276 1.00 0.00 H +ATOM 4966 N ILE A 313 40.320 -13.029 122.484 1.00 14.99 N +ATOM 4967 CA ILE A 313 39.823 -14.107 123.333 1.00 19.46 C +ATOM 4968 C ILE A 313 40.878 -15.195 123.496 1.00 20.26 C +ATOM 4969 O ILE A 313 41.068 -15.736 124.592 1.00 15.12 O +ATOM 4970 CB ILE A 313 38.508 -14.664 122.758 1.00 15.97 C +ATOM 4971 CG1 ILE A 313 37.413 -13.595 122.814 1.00 11.37 C +ATOM 4972 CG2 ILE A 313 38.078 -15.918 123.505 1.00 15.34 C +ATOM 4973 CD1 ILE A 313 36.203 -13.908 121.959 1.00 14.60 C +ATOM 4974 H ILE A 313 39.898 -12.886 121.577 1.00 0.00 H +ATOM 4975 HA ILE A 313 39.612 -13.691 124.318 1.00 0.00 H +ATOM 4976 HB ILE A 313 38.676 -14.928 121.714 1.00 0.00 H +ATOM 4977 HG13 ILE A 313 37.830 -12.634 122.512 1.00 0.00 H +ATOM 4978 HG12 ILE A 313 37.098 -13.454 123.848 1.00 0.00 H +ATOM 4979 HG21 ILE A 313 37.147 -16.293 123.081 1.00 0.00 H +ATOM 4980 HG22 ILE A 313 38.852 -16.680 123.412 1.00 0.00 H +ATOM 4981 HG23 ILE A 313 37.927 -15.680 124.558 1.00 0.00 H +ATOM 4982 HD11 ILE A 313 35.473 -13.104 122.053 1.00 0.00 H +ATOM 4983 HD12 ILE A 313 36.508 -14.001 120.917 1.00 0.00 H +ATOM 4984 HD13 ILE A 313 35.755 -14.845 122.291 1.00 0.00 H +ATOM 4985 N SER A 314 41.586 -15.525 122.419 1.00 18.65 N +ATOM 4986 CA SER A 314 42.633 -16.540 122.432 1.00 19.77 C +ATOM 4987 C SER A 314 44.019 -15.906 122.330 1.00 21.70 C +ATOM 4988 O SER A 314 44.909 -16.423 121.653 1.00 23.55 O +ATOM 4989 CB SER A 314 42.416 -17.546 121.305 1.00 16.97 C +ATOM 4990 OG SER A 314 41.409 -18.484 121.643 1.00 22.81 O +ATOM 4991 H SER A 314 41.409 -15.065 121.538 1.00 0.00 H +ATOM 4992 HA SER A 314 42.574 -17.075 123.380 1.00 0.00 H +ATOM 4993 HB3 SER A 314 43.349 -18.072 121.104 1.00 0.00 H +ATOM 4994 HB2 SER A 314 42.129 -17.017 120.397 1.00 0.00 H +ATOM 4995 HG SER A 314 41.292 -19.104 120.919 1.00 0.00 H +ATOM 4996 N SER A 315 44.213 -14.781 123.015 1.00 21.86 N +ATOM 4997 CA SER A 315 45.435 -14.002 122.866 1.00 23.37 C +ATOM 4998 C SER A 315 46.621 -14.695 123.530 1.00 29.59 C +ATOM 4999 O SER A 315 46.476 -15.416 124.521 1.00 18.83 O +ATOM 5000 CB SER A 315 45.252 -12.606 123.465 1.00 18.57 C +ATOM 5001 OG SER A 315 45.419 -12.621 124.872 1.00 22.72 O +ATOM 5002 H SER A 315 43.505 -14.451 123.655 1.00 0.00 H +ATOM 5003 HA SER A 315 45.649 -13.896 121.802 1.00 0.00 H +ATOM 5004 HB3 SER A 315 44.257 -12.235 123.222 1.00 0.00 H +ATOM 5005 HB2 SER A 315 45.976 -11.923 123.021 1.00 0.00 H +ATOM 5006 HG SER A 315 45.299 -11.734 125.218 1.00 0.00 H +ATOM 5007 N ASN A 316 47.810 -14.469 122.964 1.00 27.38 N +ATOM 5008 CA ASN A 316 49.024 -14.974 123.595 1.00 26.96 C +ATOM 5009 C ASN A 316 49.411 -14.127 124.801 1.00 23.52 C +ATOM 5010 O ASN A 316 50.091 -14.616 125.709 1.00 29.13 O +ATOM 5011 CB ASN A 316 50.171 -15.017 122.582 1.00 34.64 C +ATOM 5012 CG ASN A 316 50.107 -16.230 121.670 1.00 49.37 C +ATOM 5013 OD1 ASN A 316 49.279 -17.125 121.857 1.00 55.79 O +ATOM 5014 ND2 ASN A 316 50.972 -16.255 120.665 1.00 46.55 N +ATOM 5015 H ASN A 316 47.867 -13.949 122.100 1.00 0.00 H +ATOM 5016 HA ASN A 316 48.833 -15.991 123.939 1.00 0.00 H +ATOM 5017 HB3 ASN A 316 51.123 -15.013 123.113 1.00 0.00 H +ATOM 5018 HB2 ASN A 316 50.156 -14.109 121.979 1.00 0.00 H +ATOM 5019 HD22 ASN A 316 50.979 -17.035 120.024 1.00 0.00 H +ATOM 5020 HD21 ASN A 316 51.624 -15.494 120.541 1.00 0.00 H +ATOM 5021 N SER A 317 48.984 -12.868 124.831 1.00 29.68 N +ATOM 5022 CA SER A 317 49.287 -11.980 125.940 1.00 23.83 C +ATOM 5023 C SER A 317 48.210 -12.100 127.017 1.00 23.30 C +ATOM 5024 O SER A 317 47.270 -12.891 126.909 1.00 22.60 O +ATOM 5025 CB SER A 317 49.434 -10.542 125.442 1.00 18.48 C +ATOM 5026 OG SER A 317 48.269 -10.116 124.758 1.00 24.58 O +ATOM 5027 H SER A 317 48.432 -12.504 124.068 1.00 0.00 H +ATOM 5028 HA SER A 317 50.238 -12.289 126.374 1.00 0.00 H +ATOM 5029 HB3 SER A 317 50.292 -10.476 124.773 1.00 0.00 H +ATOM 5030 HB2 SER A 317 49.619 -9.882 126.289 1.00 0.00 H +ATOM 5031 HG SER A 317 48.387 -9.212 124.456 1.00 0.00 H +ATOM 5032 N GLU A 318 48.353 -11.295 128.069 1.00 21.81 N +ATOM 5033 CA GLU A 318 47.482 -11.397 129.232 1.00 14.44 C +ATOM 5034 C GLU A 318 46.022 -11.188 128.845 1.00 19.95 C +ATOM 5035 O GLU A 318 45.691 -10.303 128.051 1.00 22.40 O +ATOM 5036 CB GLU A 318 47.905 -10.374 130.287 1.00 19.98 C +ATOM 5037 CG GLU A 318 47.009 -10.334 131.511 1.00 20.09 C +ATOM 5038 CD GLU A 318 47.568 -9.466 132.621 0.00 25.75 C +ATOM 5039 OE1 GLU A 318 46.859 -9.263 133.628 0.65 29.14 O +ATOM 5040 OE2 GLU A 318 48.715 -8.988 132.488 1.00 30.88 O1- +ATOM 5041 H GLU A 318 49.079 -10.593 128.073 1.00 0.00 H +ATOM 5042 HA GLU A 318 47.588 -12.395 129.657 1.00 0.00 H +ATOM 5043 HB3 GLU A 318 47.943 -9.383 129.835 1.00 0.00 H +ATOM 5044 HB2 GLU A 318 48.930 -10.577 130.596 1.00 0.00 H +ATOM 5045 HG3 GLU A 318 46.860 -11.347 131.884 1.00 0.00 H +ATOM 5046 HG2 GLU A 318 46.023 -9.967 131.226 1.00 0.00 H +ATOM 5047 N ARG A 319 45.150 -12.018 129.409 1.00 17.04 N +ATOM 5048 CA ARG A 319 43.730 -12.024 129.096 1.00 14.98 C +ATOM 5049 C ARG A 319 42.922 -11.440 130.250 1.00 15.90 C +ATOM 5050 O ARG A 319 43.433 -11.196 131.347 1.00 16.41 O +ATOM 5051 CB ARG A 319 43.255 -13.446 128.780 1.00 14.95 C +ATOM 5052 CG ARG A 319 44.057 -14.138 127.692 1.00 18.03 C +ATOM 5053 CD ARG A 319 43.528 -15.536 127.428 1.00 18.25 C +ATOM 5054 NE ARG A 319 44.245 -16.194 126.340 1.00 21.48 N +ATOM 5055 CZ ARG A 319 44.037 -17.451 125.964 1.00 18.16 C +ATOM 5056 NH1 ARG A 319 43.131 -18.190 126.590 1.00 16.01 N +ATOM 5057 NH2 ARG A 319 44.735 -17.970 124.964 1.00 15.55 N1+ +ATOM 5058 H ARG A 319 45.463 -12.690 130.095 1.00 0.00 H +ATOM 5059 HA ARG A 319 43.569 -11.403 128.214 1.00 0.00 H +ATOM 5060 HB3 ARG A 319 42.204 -13.420 128.493 1.00 0.00 H +ATOM 5061 HB2 ARG A 319 43.285 -14.047 129.689 1.00 0.00 H +ATOM 5062 HG3 ARG A 319 45.103 -14.197 127.994 1.00 0.00 H +ATOM 5063 HG2 ARG A 319 44.006 -13.551 126.775 1.00 0.00 H +ATOM 5064 HD3 ARG A 319 42.467 -15.482 127.183 1.00 0.00 H +ATOM 5065 HD2 ARG A 319 43.617 -16.134 128.335 1.00 0.00 H +ATOM 5066 HE ARG A 319 44.936 -15.632 125.863 1.00 0.00 H +ATOM 5067 HH12 ARG A 319 42.973 -19.146 126.304 1.00 0.00 H +ATOM 5068 HH11 ARG A 319 42.599 -17.797 127.353 1.00 0.00 H +ATOM 5069 HH22 ARG A 319 44.576 -18.926 124.679 1.00 0.00 H +ATOM 5070 HH21 ARG A 319 45.426 -17.410 124.486 1.00 0.00 H +ATOM 5071 N LEU A 320 41.632 -11.227 129.984 1.00 15.92 N +ATOM 5072 CA LEU A 320 40.695 -10.620 130.914 1.00 15.45 C +ATOM 5073 C LEU A 320 39.650 -11.630 131.376 1.00 14.68 C +ATOM 5074 O LEU A 320 39.344 -12.589 130.659 1.00 14.36 O +ATOM 5075 CB LEU A 320 39.973 -9.430 130.271 1.00 12.33 C +ATOM 5076 CG LEU A 320 40.815 -8.222 129.877 1.00 12.92 C +ATOM 5077 CD1 LEU A 320 40.067 -7.393 128.849 1.00 12.10 C +ATOM 5078 CD2 LEU A 320 41.168 -7.389 131.101 1.00 11.68 C +ATOM 5079 H LEU A 320 41.251 -11.493 129.088 1.00 0.00 H +ATOM 5080 HA LEU A 320 41.247 -10.265 131.784 1.00 0.00 H +ATOM 5081 HB3 LEU A 320 39.166 -9.105 130.927 1.00 0.00 H +ATOM 5082 HB2 LEU A 320 39.416 -9.777 129.401 1.00 0.00 H +ATOM 5083 HG LEU A 320 41.740 -8.579 129.425 1.00 0.00 H +ATOM 5084 HD11 LEU A 320 40.671 -6.530 128.569 1.00 0.00 H +ATOM 5085 HD12 LEU A 320 39.870 -8.000 127.966 1.00 0.00 H +ATOM 5086 HD13 LEU A 320 39.122 -7.053 129.273 1.00 0.00 H +ATOM 5087 HD21 LEU A 320 41.769 -6.532 130.797 1.00 0.00 H +ATOM 5088 HD22 LEU A 320 40.253 -7.039 131.579 1.00 0.00 H +ATOM 5089 HD23 LEU A 320 41.735 -7.998 131.805 1.00 0.00 H +ATOM 5090 N PRO A 321 39.081 -11.442 132.565 1.00 12.49 N +ATOM 5091 CA PRO A 321 37.945 -12.274 132.974 1.00 10.12 C +ATOM 5092 C PRO A 321 36.699 -11.930 132.175 1.00 9.26 C +ATOM 5093 O PRO A 321 36.541 -10.814 131.673 1.00 10.14 O +ATOM 5094 CB PRO A 321 37.765 -11.935 134.458 1.00 11.74 C +ATOM 5095 CG PRO A 321 38.383 -10.593 134.624 1.00 9.16 C +ATOM 5096 CD PRO A 321 39.481 -10.482 133.609 1.00 12.49 C +ATOM 5097 HA PRO A 321 38.189 -13.330 132.856 1.00 0.00 H +ATOM 5098 HB3 PRO A 321 38.309 -12.661 135.063 1.00 0.00 H +ATOM 5099 HB2 PRO A 321 36.701 -11.874 134.688 1.00 0.00 H +ATOM 5100 HG3 PRO A 321 38.805 -10.510 135.625 1.00 0.00 H +ATOM 5101 HG2 PRO A 321 37.635 -9.823 134.435 1.00 0.00 H +ATOM 5102 HD2 PRO A 321 39.484 -9.476 133.191 1.00 0.00 H +ATOM 5103 HD3 PRO A 321 40.420 -10.808 134.057 1.00 0.00 H +ATOM 5104 N ASP A 322 35.799 -12.909 132.072 1.00 8.55 N +ATOM 5105 CA ASP A 322 34.604 -12.750 131.253 1.00 7.85 C +ATOM 5106 C ASP A 322 33.615 -11.737 131.817 1.00 7.86 C +ATOM 5107 O ASP A 322 32.715 -11.313 131.084 1.00 6.20 O +ATOM 5108 CB ASP A 322 33.911 -14.101 131.067 1.00 7.61 C +ATOM 5109 CG ASP A 322 34.694 -15.037 130.167 1.00 10.03 C +ATOM 5110 OD1 ASP A 322 35.640 -14.568 129.497 1.00 10.77 O +ATOM 5111 OD2 ASP A 322 34.365 -16.241 130.129 1.00 6.93 O1- +ATOM 5112 H ASP A 322 35.940 -13.778 132.566 1.00 0.00 H +ATOM 5113 HA ASP A 322 34.918 -12.398 130.270 1.00 0.00 H +ATOM 5114 HB3 ASP A 322 32.917 -13.944 130.649 1.00 0.00 H +ATOM 5115 HB2 ASP A 322 33.766 -14.571 132.040 1.00 0.00 H +ATOM 5116 N ILE A 323 33.745 -11.341 133.087 1.00 6.64 N +ATOM 5117 CA ILE A 323 32.854 -10.315 133.631 1.00 12.64 C +ATOM 5118 C ILE A 323 33.322 -8.907 133.310 1.00 8.95 C +ATOM 5119 O ILE A 323 32.560 -7.953 133.514 1.00 9.00 O +ATOM 5120 CB ILE A 323 32.679 -10.434 135.156 1.00 10.98 C +ATOM 5121 CG1 ILE A 323 34.021 -10.691 135.841 1.00 11.30 C +ATOM 5122 CG2 ILE A 323 31.670 -11.521 135.496 1.00 13.49 C +ATOM 5123 CD1 ILE A 323 34.069 -10.185 137.265 1.00 20.79 C +ATOM 5124 H ILE A 323 34.459 -11.750 133.673 1.00 0.00 H +ATOM 5125 HA ILE A 323 31.874 -10.451 133.173 1.00 0.00 H +ATOM 5126 HB ILE A 323 32.289 -9.485 135.525 1.00 0.00 H +ATOM 5127 HG13 ILE A 323 34.818 -10.222 135.263 1.00 0.00 H +ATOM 5128 HG12 ILE A 323 34.235 -11.760 135.829 1.00 0.00 H +ATOM 5129 HG21 ILE A 323 31.560 -11.590 136.578 1.00 0.00 H +ATOM 5130 HG22 ILE A 323 30.707 -11.276 135.048 1.00 0.00 H +ATOM 5131 HG23 ILE A 323 32.019 -12.477 135.105 1.00 0.00 H +ATOM 5132 HD11 ILE A 323 35.048 -10.398 137.694 1.00 0.00 H +ATOM 5133 HD12 ILE A 323 33.895 -9.109 137.275 1.00 0.00 H +ATOM 5134 HD13 ILE A 323 33.298 -10.682 137.854 1.00 0.00 H +ATOM 5135 N ASN A 324 34.551 -8.744 132.826 1.00 9.13 N +ATOM 5136 CA ASN A 324 34.971 -7.456 132.291 1.00 11.47 C +ATOM 5137 C ASN A 324 34.104 -7.113 131.086 1.00 8.36 C +ATOM 5138 O ASN A 324 33.990 -7.906 130.147 1.00 13.20 O +ATOM 5139 CB ASN A 324 36.450 -7.497 131.906 1.00 10.21 C +ATOM 5140 CG ASN A 324 36.953 -6.170 131.369 1.00 12.19 C +ATOM 5141 OD1 ASN A 324 36.704 -5.817 130.217 1.00 13.29 O +ATOM 5142 ND2 ASN A 324 37.666 -5.427 132.207 1.00 14.18 N +ATOM 5143 H ASN A 324 35.201 -9.517 132.828 1.00 0.00 H +ATOM 5144 HA ASN A 324 34.828 -6.693 133.056 1.00 0.00 H +ATOM 5145 HB3 ASN A 324 36.608 -8.274 131.158 1.00 0.00 H +ATOM 5146 HB2 ASN A 324 37.043 -7.784 132.775 1.00 0.00 H +ATOM 5147 HD22 ASN A 324 38.028 -4.533 131.907 1.00 0.00 H +ATOM 5148 HD21 ASN A 324 37.846 -5.756 133.145 1.00 0.00 H +ATOM 5149 N ILE A 325 33.477 -5.934 131.126 1.00 7.05 N +ATOM 5150 CA ILE A 325 32.456 -5.597 130.135 1.00 10.34 C +ATOM 5151 C ILE A 325 33.036 -5.554 128.729 1.00 12.60 C +ATOM 5152 O ILE A 325 32.361 -5.924 127.760 1.00 13.27 O +ATOM 5153 CB ILE A 325 31.769 -4.267 130.501 1.00 9.98 C +ATOM 5154 CG1 ILE A 325 32.806 -3.174 130.773 1.00 14.79 C +ATOM 5155 CG2 ILE A 325 30.853 -4.458 131.694 1.00 14.36 C +ATOM 5156 CD1 ILE A 325 32.198 -1.836 131.144 1.00 10.36 C +ATOM 5157 H ILE A 325 33.707 -5.264 131.846 1.00 0.00 H +ATOM 5158 HA ILE A 325 31.698 -6.380 130.158 1.00 0.00 H +ATOM 5159 HB ILE A 325 31.161 -3.954 129.652 1.00 0.00 H +ATOM 5160 HG13 ILE A 325 33.441 -3.052 129.896 1.00 0.00 H +ATOM 5161 HG12 ILE A 325 33.475 -3.500 131.569 1.00 0.00 H +ATOM 5162 HG21 ILE A 325 30.375 -3.510 131.941 1.00 0.00 H +ATOM 5163 HG22 ILE A 325 30.090 -5.197 131.452 1.00 0.00 H +ATOM 5164 HG23 ILE A 325 31.435 -4.804 132.548 1.00 0.00 H +ATOM 5165 HD11 ILE A 325 32.993 -1.112 131.322 1.00 0.00 H +ATOM 5166 HD12 ILE A 325 31.564 -1.486 130.329 1.00 0.00 H +ATOM 5167 HD13 ILE A 325 31.599 -1.947 132.048 1.00 0.00 H +ATOM 5168 N TYR A 326 34.285 -5.109 128.586 1.00 7.39 N +ATOM 5169 CA TYR A 326 34.897 -5.066 127.263 1.00 14.77 C +ATOM 5170 C TYR A 326 35.266 -6.464 126.785 1.00 14.56 C +ATOM 5171 O TYR A 326 35.155 -6.769 125.592 1.00 11.50 O +ATOM 5172 CB TYR A 326 36.113 -4.144 127.288 1.00 9.79 C +ATOM 5173 CG TYR A 326 35.808 -2.831 127.967 1.00 14.79 C +ATOM 5174 CD1 TYR A 326 34.863 -1.962 127.439 1.00 11.64 C +ATOM 5175 CD2 TYR A 326 36.439 -2.474 129.151 1.00 12.37 C +ATOM 5176 CE1 TYR A 326 34.567 -0.765 128.060 1.00 14.67 C +ATOM 5177 CE2 TYR A 326 36.149 -1.278 129.780 1.00 12.60 C +ATOM 5178 CZ TYR A 326 35.212 -0.428 129.229 1.00 13.28 C +ATOM 5179 OH TYR A 326 34.918 0.764 129.849 1.00 15.64 O +ATOM 5180 H TYR A 326 34.807 -4.802 129.394 1.00 0.00 H +ATOM 5181 HA TYR A 326 34.170 -4.650 126.566 1.00 0.00 H +ATOM 5182 HB3 TYR A 326 36.446 -3.956 126.267 1.00 0.00 H +ATOM 5183 HB2 TYR A 326 36.933 -4.639 127.808 1.00 0.00 H +ATOM 5184 HD1 TYR A 326 34.345 -2.218 126.527 1.00 0.00 H +ATOM 5185 HD2 TYR A 326 37.169 -3.135 129.594 1.00 0.00 H +ATOM 5186 HE1 TYR A 326 33.834 -0.100 127.629 1.00 0.00 H +ATOM 5187 HE2 TYR A 326 36.655 -1.014 130.697 1.00 0.00 H +ATOM 5188 HH TYR A 326 35.447 0.850 130.645 1.00 0.00 H +ATOM 5189 N GLN A 327 35.701 -7.330 127.702 1.00 11.46 N +ATOM 5190 CA GLN A 327 35.854 -8.740 127.365 1.00 10.19 C +ATOM 5191 C GLN A 327 34.507 -9.363 127.022 1.00 12.89 C +ATOM 5192 O GLN A 327 34.398 -10.145 126.071 1.00 9.33 O +ATOM 5193 CB GLN A 327 36.513 -9.488 128.524 1.00 10.02 C +ATOM 5194 CG GLN A 327 36.440 -11.002 128.416 1.00 7.42 C +ATOM 5195 CD GLN A 327 37.500 -11.573 127.495 1.00 10.51 C +ATOM 5196 OE1 GLN A 327 38.315 -10.839 126.936 1.00 9.31 O +ATOM 5197 NE2 GLN A 327 37.495 -12.891 127.334 1.00 10.83 N +ATOM 5198 H GLN A 327 35.925 -7.009 128.633 1.00 0.00 H +ATOM 5199 HA GLN A 327 36.502 -8.817 126.492 1.00 0.00 H +ATOM 5200 HB3 GLN A 327 36.059 -9.171 129.463 1.00 0.00 H +ATOM 5201 HB2 GLN A 327 37.556 -9.182 128.605 1.00 0.00 H +ATOM 5202 HG3 GLN A 327 35.453 -11.292 128.056 1.00 0.00 H +ATOM 5203 HG2 GLN A 327 36.547 -11.441 129.408 1.00 0.00 H +ATOM 5204 HE22 GLN A 327 38.178 -13.329 126.732 1.00 0.00 H +ATOM 5205 HE21 GLN A 327 36.808 -13.456 127.813 1.00 0.00 H +ATOM 5206 N LEU A 328 33.468 -9.014 127.785 1.00 9.31 N +ATOM 5207 CA LEU A 328 32.133 -9.539 127.521 1.00 9.11 C +ATOM 5208 C LEU A 328 31.641 -9.132 126.138 1.00 9.78 C +ATOM 5209 O LEU A 328 31.060 -9.947 125.413 1.00 9.49 O +ATOM 5210 CB LEU A 328 31.164 -9.053 128.600 1.00 10.35 C +ATOM 5211 CG LEU A 328 29.750 -9.636 128.605 1.00 10.49 C +ATOM 5212 CD1 LEU A 328 29.791 -11.153 128.515 1.00 7.48 C +ATOM 5213 CD2 LEU A 328 28.993 -9.184 129.847 1.00 11.09 C +ATOM 5214 H LEU A 328 33.600 -8.378 128.558 1.00 0.00 H +ATOM 5215 HA LEU A 328 32.177 -10.627 127.564 1.00 0.00 H +ATOM 5216 HB3 LEU A 328 31.102 -7.965 128.561 1.00 0.00 H +ATOM 5217 HB2 LEU A 328 31.616 -9.204 129.580 1.00 0.00 H +ATOM 5218 HG LEU A 328 29.223 -9.258 127.729 1.00 0.00 H +ATOM 5219 HD11 LEU A 328 28.774 -11.545 128.520 1.00 0.00 H +ATOM 5220 HD12 LEU A 328 30.290 -11.449 127.592 1.00 0.00 H +ATOM 5221 HD13 LEU A 328 30.339 -11.553 129.368 1.00 0.00 H +ATOM 5222 HD21 LEU A 328 27.989 -9.608 129.835 1.00 0.00 H +ATOM 5223 HD22 LEU A 328 29.520 -9.525 130.738 1.00 0.00 H +ATOM 5224 HD23 LEU A 328 28.928 -8.096 129.858 1.00 0.00 H +ATOM 5225 N LYS A 329 31.870 -7.873 125.752 1.00 10.86 N +ATOM 5226 CA LYS A 329 31.428 -7.409 124.441 1.00 9.10 C +ATOM 5227 C LYS A 329 32.149 -8.149 123.322 1.00 12.13 C +ATOM 5228 O LYS A 329 31.538 -8.500 122.305 1.00 12.35 O +ATOM 5229 CB LYS A 329 31.648 -5.903 124.314 1.00 14.01 C +ATOM 5230 CG LYS A 329 30.544 -5.059 124.925 1.00 13.84 C +ATOM 5231 CD LYS A 329 31.011 -3.628 125.138 1.00 15.30 C +ATOM 5232 CE LYS A 329 30.207 -2.939 126.227 1.00 14.90 C +ATOM 5233 NZ LYS A 329 29.140 -2.067 125.660 1.00 24.76 N1+ +ATOM 5234 H LYS A 329 32.352 -7.235 126.369 1.00 0.00 H +ATOM 5235 HA LYS A 329 30.360 -7.608 124.350 1.00 0.00 H +ATOM 5236 HB3 LYS A 329 31.762 -5.642 123.262 1.00 0.00 H +ATOM 5237 HB2 LYS A 329 32.601 -5.637 124.771 1.00 0.00 H +ATOM 5238 HG3 LYS A 329 30.245 -5.489 125.881 1.00 0.00 H +ATOM 5239 HG2 LYS A 329 29.677 -5.063 124.265 1.00 0.00 H +ATOM 5240 HD3 LYS A 329 30.911 -3.071 124.206 1.00 0.00 H +ATOM 5241 HD2 LYS A 329 32.066 -3.628 125.411 1.00 0.00 H +ATOM 5242 HE3 LYS A 329 30.874 -2.340 126.846 1.00 0.00 H +ATOM 5243 HE2 LYS A 329 29.755 -3.690 126.875 1.00 0.00 H +ATOM 5244 HZ1 LYS A 329 28.629 -1.628 126.412 1.00 0.00 H +ATOM 5245 HZ2 LYS A 329 29.559 -1.356 125.078 1.00 0.00 H +ATOM 5246 HZ3 LYS A 329 28.508 -2.626 125.105 1.00 0.00 H +ATOM 5247 N VAL A 330 33.451 -8.394 123.489 1.00 10.83 N +ATOM 5248 CA VAL A 330 34.194 -9.171 122.500 1.00 14.31 C +ATOM 5249 C VAL A 330 33.658 -10.596 122.439 1.00 12.06 C +ATOM 5250 O VAL A 330 33.543 -11.187 121.357 1.00 16.15 O +ATOM 5251 CB VAL A 330 35.701 -9.140 122.818 1.00 12.74 C +ATOM 5252 CG1 VAL A 330 36.458 -10.105 121.920 1.00 15.29 C +ATOM 5253 CG2 VAL A 330 36.243 -7.729 122.662 1.00 8.26 C +ATOM 5254 H VAL A 330 33.931 -8.041 124.305 1.00 0.00 H +ATOM 5255 HA VAL A 330 34.044 -8.710 121.524 1.00 0.00 H +ATOM 5256 HB VAL A 330 35.841 -9.451 123.853 1.00 0.00 H +ATOM 5257 HG11 VAL A 330 37.521 -10.068 122.160 1.00 0.00 H +ATOM 5258 HG12 VAL A 330 36.085 -11.117 122.077 1.00 0.00 H +ATOM 5259 HG13 VAL A 330 36.312 -9.823 120.877 1.00 0.00 H +ATOM 5260 HG21 VAL A 330 37.309 -7.721 122.890 1.00 0.00 H +ATOM 5261 HG22 VAL A 330 36.088 -7.391 121.637 1.00 0.00 H +ATOM 5262 HG23 VAL A 330 35.721 -7.061 123.347 1.00 0.00 H +ATOM 5263 N LEU A 331 33.317 -11.167 123.598 1.00 9.53 N +ATOM 5264 CA LEU A 331 32.686 -12.484 123.622 1.00 10.90 C +ATOM 5265 C LEU A 331 31.376 -12.480 122.846 1.00 10.62 C +ATOM 5266 O LEU A 331 31.083 -13.423 122.100 1.00 12.51 O +ATOM 5267 CB LEU A 331 32.442 -12.926 125.066 1.00 11.29 C +ATOM 5268 CG LEU A 331 33.636 -13.269 125.959 1.00 15.26 C +ATOM 5269 CD1 LEU A 331 33.181 -13.488 127.396 1.00 9.33 C +ATOM 5270 CD2 LEU A 331 34.369 -14.494 125.437 1.00 15.46 C +ATOM 5271 H LEU A 331 33.495 -10.687 124.469 1.00 0.00 H +ATOM 5272 HA LEU A 331 33.362 -13.199 123.153 1.00 0.00 H +ATOM 5273 HB3 LEU A 331 31.745 -13.764 125.068 1.00 0.00 H +ATOM 5274 HB2 LEU A 331 31.827 -12.178 125.567 1.00 0.00 H +ATOM 5275 HG LEU A 331 34.327 -12.426 125.944 1.00 0.00 H +ATOM 5276 HD11 LEU A 331 34.043 -13.731 128.018 1.00 0.00 H +ATOM 5277 HD12 LEU A 331 32.708 -12.580 127.770 1.00 0.00 H +ATOM 5278 HD13 LEU A 331 32.466 -14.310 127.430 1.00 0.00 H +ATOM 5279 HD21 LEU A 331 35.214 -14.718 126.089 1.00 0.00 H +ATOM 5280 HD22 LEU A 331 33.689 -15.345 125.420 1.00 0.00 H +ATOM 5281 HD23 LEU A 331 34.731 -14.299 124.428 1.00 0.00 H +ATOM 5282 N ASP A 332 30.573 -11.426 123.009 1.00 11.27 N +ATOM 5283 CA ASP A 332 29.297 -11.356 122.306 1.00 13.00 C +ATOM 5284 C ASP A 332 29.505 -11.205 120.804 1.00 12.18 C +ATOM 5285 O ASP A 332 28.877 -11.914 120.009 1.00 16.77 O +ATOM 5286 CB ASP A 332 28.459 -10.203 122.857 1.00 11.49 C +ATOM 5287 CG ASP A 332 27.064 -10.171 122.274 1.00 12.19 C +ATOM 5288 OD1 ASP A 332 26.250 -11.045 122.637 1.00 16.91 O +ATOM 5289 OD2 ASP A 332 26.780 -9.274 121.453 1.00 14.54 O1- +ATOM 5290 H ASP A 332 30.848 -10.672 123.622 1.00 0.00 H +ATOM 5291 HA ASP A 332 28.757 -12.286 122.484 1.00 0.00 H +ATOM 5292 HB3 ASP A 332 28.961 -9.258 122.648 1.00 0.00 H +ATOM 5293 HB2 ASP A 332 28.396 -10.287 123.942 1.00 0.00 H +ATOM 5294 N CYS A 333 30.383 -10.284 120.397 1.00 12.60 N +ATOM 5295 CA CYS A 333 30.642 -10.081 118.974 1.00 12.05 C +ATOM 5296 C CYS A 333 31.171 -11.351 118.321 1.00 15.23 C +ATOM 5297 O CYS A 333 30.806 -11.672 117.184 1.00 19.31 O +ATOM 5298 CB CYS A 333 31.628 -8.929 118.778 1.00 7.30 C +ATOM 5299 SG CYS A 333 30.959 -7.297 119.160 1.00 15.16 S +ATOM 5300 H CYS A 333 30.875 -9.720 121.076 1.00 0.00 H +ATOM 5301 HA CYS A 333 29.703 -9.813 118.490 1.00 0.00 H +ATOM 5302 HB3 CYS A 333 31.994 -8.938 117.751 1.00 0.00 H +ATOM 5303 HB2 CYS A 333 32.516 -9.106 119.385 1.00 0.00 H +ATOM 5304 HG CYS A 333 31.899 -6.370 118.955 1.00 0.00 H +ATOM 5305 N ALA A 334 32.031 -12.089 119.026 1.00 14.44 N +ATOM 5306 CA ALA A 334 32.552 -13.335 118.474 1.00 15.07 C +ATOM 5307 C ALA A 334 31.456 -14.384 118.346 1.00 16.28 C +ATOM 5308 O ALA A 334 31.452 -15.171 117.392 1.00 19.37 O +ATOM 5309 CB ALA A 334 33.696 -13.856 119.341 1.00 10.66 C +ATOM 5310 H ALA A 334 32.323 -11.785 119.944 1.00 0.00 H +ATOM 5311 HA ALA A 334 32.945 -13.129 117.478 1.00 0.00 H +ATOM 5312 HB1 ALA A 334 34.077 -14.786 118.920 1.00 0.00 H +ATOM 5313 HB2 ALA A 334 34.496 -13.116 119.371 1.00 0.00 H +ATOM 5314 HB3 ALA A 334 33.332 -14.038 120.352 1.00 0.00 H +ATOM 5315 N MET A 335 30.521 -14.415 119.299 1.00 12.98 N +ATOM 5316 CA MET A 335 29.409 -15.358 119.216 1.00 16.90 C +ATOM 5317 C MET A 335 28.541 -15.071 117.998 1.00 18.59 C +ATOM 5318 O MET A 335 28.201 -15.982 117.234 1.00 16.95 O +ATOM 5319 CB MET A 335 28.572 -15.299 120.494 1.00 12.46 C +ATOM 5320 CG MET A 335 27.307 -16.143 120.437 1.00 15.09 C +ATOM 5321 SD MET A 335 26.109 -15.720 121.718 1.00 16.85 S +ATOM 5322 CE MET A 335 25.354 -14.255 121.014 1.00 19.91 C +ATOM 5323 H MET A 335 30.580 -13.783 120.085 1.00 0.00 H +ATOM 5324 HA MET A 335 29.817 -16.364 119.118 1.00 0.00 H +ATOM 5325 HB3 MET A 335 28.306 -14.263 120.705 1.00 0.00 H +ATOM 5326 HB2 MET A 335 29.181 -15.617 121.340 1.00 0.00 H +ATOM 5327 HG3 MET A 335 27.571 -17.197 120.522 1.00 0.00 H +ATOM 5328 HG2 MET A 335 26.843 -16.033 119.457 1.00 0.00 H +ATOM 5329 HE1 MET A 335 24.590 -13.877 121.694 1.00 0.00 H +ATOM 5330 HE2 MET A 335 26.116 -13.490 120.862 1.00 0.00 H +ATOM 5331 HE3 MET A 335 24.896 -14.506 120.057 1.00 0.00 H +ATOM 5332 N ASP A 336 28.171 -13.803 117.802 1.00 16.35 N +ATOM 5333 CA ASP A 336 27.329 -13.442 116.666 1.00 16.43 C +ATOM 5334 C ASP A 336 28.047 -13.687 115.346 1.00 21.83 C +ATOM 5335 O ASP A 336 27.419 -14.063 114.349 1.00 22.94 O +ATOM 5336 CB ASP A 336 26.896 -11.981 116.780 1.00 14.96 C +ATOM 5337 CG ASP A 336 25.694 -11.801 117.685 1.00 16.82 C +ATOM 5338 OD1 ASP A 336 24.865 -12.731 117.762 1.00 18.68 O +ATOM 5339 OD2 ASP A 336 25.579 -10.732 118.320 1.00 19.00 O1- +ATOM 5340 H ASP A 336 28.474 -13.084 118.443 1.00 0.00 H +ATOM 5341 HA ASP A 336 26.436 -14.066 116.690 1.00 0.00 H +ATOM 5342 HB3 ASP A 336 26.664 -11.593 115.788 1.00 0.00 H +ATOM 5343 HB2 ASP A 336 27.727 -11.385 117.158 1.00 0.00 H +ATOM 5344 N ALA A 337 29.365 -13.480 115.318 1.00 17.54 N +ATOM 5345 CA ALA A 337 30.125 -13.750 114.102 1.00 21.53 C +ATOM 5346 C ALA A 337 30.141 -15.239 113.783 1.00 24.46 C +ATOM 5347 O ALA A 337 30.051 -15.633 112.615 1.00 21.85 O +ATOM 5348 CB ALA A 337 31.549 -13.214 114.242 1.00 15.83 C +ATOM 5349 H ALA A 337 29.840 -13.135 116.140 1.00 0.00 H +ATOM 5350 HA ALA A 337 29.643 -13.228 113.275 1.00 0.00 H +ATOM 5351 HB1 ALA A 337 32.107 -13.421 113.329 1.00 0.00 H +ATOM 5352 HB2 ALA A 337 31.518 -12.138 114.412 1.00 0.00 H +ATOM 5353 HB3 ALA A 337 32.040 -13.700 115.085 1.00 0.00 H +ATOM 5354 N CYS A 338 30.243 -16.084 114.811 1.00 18.14 N +ATOM 5355 CA CYS A 338 30.343 -17.522 114.588 1.00 20.95 C +ATOM 5356 C CYS A 338 29.001 -18.124 114.185 1.00 20.49 C +ATOM 5357 O CYS A 338 28.935 -18.939 113.258 1.00 21.24 O +ATOM 5358 CB CYS A 338 30.885 -18.208 115.841 1.00 11.65 C +ATOM 5359 SG CYS A 338 32.640 -17.952 116.150 1.00 18.38 S +ATOM 5360 H CYS A 338 30.252 -15.730 115.757 1.00 0.00 H +ATOM 5361 HA CYS A 338 31.049 -17.692 113.775 1.00 0.00 H +ATOM 5362 HB3 CYS A 338 30.681 -19.277 115.783 1.00 0.00 H +ATOM 5363 HB2 CYS A 338 30.314 -17.877 116.709 1.00 0.00 H +ATOM 5364 HG CYS A 338 32.995 -18.596 117.265 1.00 0.00 H +ATOM 5365 N ILE A 339 27.926 -17.740 114.877 1.00 20.60 N +ATOM 5366 CA ILE A 339 26.569 -18.172 114.550 1.00 22.64 C +ATOM 5367 C ILE A 339 26.304 -17.921 113.073 1.00 30.86 C +ATOM 5368 O ILE A 339 25.669 -18.734 112.390 1.00 29.03 O +ATOM 5369 CB ILE A 339 25.524 -17.440 115.417 1.00 22.90 C +ATOM 5370 CG1 ILE A 339 25.609 -17.879 116.881 1.00 20.57 C +ATOM 5371 CG2 ILE A 339 24.114 -17.666 114.877 1.00 24.27 C +ATOM 5372 CD1 ILE A 339 24.531 -17.271 117.757 1.00 20.29 C +ATOM 5373 H ILE A 339 28.030 -17.122 115.669 1.00 0.00 H +ATOM 5374 HA ILE A 339 26.490 -19.242 114.740 1.00 0.00 H +ATOM 5375 HB ILE A 339 25.736 -16.372 115.372 1.00 0.00 H +ATOM 5376 HG13 ILE A 339 26.589 -17.619 117.280 1.00 0.00 H +ATOM 5377 HG12 ILE A 339 25.550 -18.966 116.937 1.00 0.00 H +ATOM 5378 HG21 ILE A 339 23.395 -17.140 115.505 1.00 0.00 H +ATOM 5379 HG22 ILE A 339 24.050 -17.287 113.857 1.00 0.00 H +ATOM 5380 HG23 ILE A 339 23.889 -18.732 114.883 1.00 0.00 H +ATOM 5381 HD11 ILE A 339 24.651 -17.625 118.781 1.00 0.00 H +ATOM 5382 HD12 ILE A 339 24.615 -16.184 117.737 1.00 0.00 H +ATOM 5383 HD13 ILE A 339 23.550 -17.566 117.384 1.00 0.00 H +ATOM 5384 N ASN A 340 26.821 -16.802 112.566 1.00 26.80 N +ATOM 5385 CA ASN A 340 26.474 -16.317 111.240 1.00 24.78 C +ATOM 5386 C ASN A 340 27.448 -16.762 110.156 1.00 27.93 C +ATOM 5387 O ASN A 340 27.090 -16.719 108.974 1.00 27.28 O +ATOM 5388 CB ASN A 340 26.382 -14.788 111.265 1.00 28.06 C +ATOM 5389 CG ASN A 340 25.012 -14.302 111.698 1.00 47.51 C +ATOM 5390 OD1 ASN A 340 24.022 -14.462 110.984 1.00 48.14 O +ATOM 5391 ND2 ASN A 340 24.944 -13.737 112.898 1.00 30.92 N +ATOM 5392 H ASN A 340 27.478 -16.259 113.107 1.00 0.00 H +ATOM 5393 HA ASN A 340 25.489 -16.708 110.987 1.00 0.00 H +ATOM 5394 HB3 ASN A 340 26.610 -14.395 110.274 1.00 0.00 H +ATOM 5395 HB2 ASN A 340 27.138 -14.390 111.942 1.00 0.00 H +ATOM 5396 HD22 ASN A 340 24.060 -13.393 113.245 1.00 0.00 H +ATOM 5397 HD21 ASN A 340 25.776 -13.652 113.464 1.00 0.00 H +ATOM 5398 N LEU A 341 28.656 -17.190 110.516 1.00 27.44 N +ATOM 5399 CA LEU A 341 29.525 -17.891 109.581 1.00 22.20 C +ATOM 5400 C LEU A 341 29.335 -19.399 109.644 1.00 24.80 C +ATOM 5401 O LEU A 341 30.062 -20.134 108.968 1.00 33.17 O +ATOM 5402 CB LEU A 341 30.994 -17.534 109.830 1.00 25.23 C +ATOM 5403 CG LEU A 341 31.352 -16.047 109.770 1.00 25.03 C +ATOM 5404 CD1 LEU A 341 32.755 -15.797 110.305 1.00 28.94 C +ATOM 5405 CD2 LEU A 341 31.204 -15.516 108.353 1.00 26.66 C +ATOM 5406 H LEU A 341 28.989 -17.031 111.456 1.00 0.00 H +ATOM 5407 HA LEU A 341 29.267 -17.563 108.574 1.00 0.00 H +ATOM 5408 HB3 LEU A 341 31.621 -18.083 109.128 1.00 0.00 H +ATOM 5409 HB2 LEU A 341 31.304 -17.939 110.793 1.00 0.00 H +ATOM 5410 HG LEU A 341 30.650 -15.507 110.405 1.00 0.00 H +ATOM 5411 HD11 LEU A 341 32.981 -14.732 110.250 1.00 0.00 H +ATOM 5412 HD12 LEU A 341 32.813 -16.127 111.342 1.00 0.00 H +ATOM 5413 HD13 LEU A 341 33.477 -16.353 109.707 1.00 0.00 H +ATOM 5414 HD21 LEU A 341 31.463 -14.457 108.332 1.00 0.00 H +ATOM 5415 HD22 LEU A 341 31.869 -16.066 107.687 1.00 0.00 H +ATOM 5416 HD23 LEU A 341 30.173 -15.644 108.022 1.00 0.00 H +ATOM 5417 N GLY A 342 28.366 -19.871 110.425 1.00 25.55 N +ATOM 5418 CA GLY A 342 28.106 -21.288 110.549 1.00 22.63 C +ATOM 5419 C GLY A 342 28.981 -22.019 111.540 1.00 28.96 C +ATOM 5420 O GLY A 342 28.901 -23.250 111.619 1.00 31.65 O +ATOM 5421 H GLY A 342 27.787 -19.233 110.953 1.00 0.00 H +ATOM 5422 HA3 GLY A 342 28.199 -21.758 109.570 1.00 0.00 H +ATOM 5423 HA2 GLY A 342 27.059 -21.441 110.811 1.00 0.00 H +ATOM 5424 N LEU A 343 29.814 -21.307 112.298 1.00 24.05 N +ATOM 5425 CA LEU A 343 30.690 -21.928 113.293 1.00 26.12 C +ATOM 5426 C LEU A 343 29.911 -22.039 114.596 1.00 21.82 C +ATOM 5427 O LEU A 343 30.014 -21.194 115.485 1.00 18.47 O +ATOM 5428 CB LEU A 343 31.970 -21.121 113.461 1.00 19.88 C +ATOM 5429 CG LEU A 343 32.866 -21.052 112.222 1.00 31.17 C +ATOM 5430 CD1 LEU A 343 33.801 -19.855 112.295 1.00 21.87 C +ATOM 5431 CD2 LEU A 343 33.652 -22.342 112.052 1.00 34.46 C +ATOM 5432 H LEU A 343 29.856 -20.303 112.196 1.00 0.00 H +ATOM 5433 HA LEU A 343 30.950 -22.931 112.954 1.00 0.00 H +ATOM 5434 HB3 LEU A 343 32.542 -21.523 114.297 1.00 0.00 H +ATOM 5435 HB2 LEU A 343 31.719 -20.110 113.781 1.00 0.00 H +ATOM 5436 HG LEU A 343 32.226 -20.928 111.348 1.00 0.00 H +ATOM 5437 HD11 LEU A 343 34.427 -19.828 111.403 1.00 0.00 H +ATOM 5438 HD12 LEU A 343 33.214 -18.938 112.355 1.00 0.00 H +ATOM 5439 HD13 LEU A 343 34.432 -19.940 113.179 1.00 0.00 H +ATOM 5440 HD21 LEU A 343 34.282 -22.270 111.165 1.00 0.00 H +ATOM 5441 HD22 LEU A 343 34.278 -22.505 112.929 1.00 0.00 H +ATOM 5442 HD23 LEU A 343 32.961 -23.177 111.939 1.00 0.00 H +ATOM 5443 N LEU A 344 29.132 -23.111 114.719 1.00 15.93 N +ATOM 5444 CA LEU A 344 28.144 -23.211 115.786 1.00 19.61 C +ATOM 5445 C LEU A 344 28.711 -23.755 117.089 1.00 22.07 C +ATOM 5446 O LEU A 344 28.213 -23.397 118.163 1.00 20.14 O +ATOM 5447 CB LEU A 344 26.974 -24.076 115.318 1.00 15.98 C +ATOM 5448 CG LEU A 344 26.409 -23.557 113.994 1.00 29.68 C +ATOM 5449 CD1 LEU A 344 25.527 -24.589 113.323 1.00 25.68 C +ATOM 5450 CD2 LEU A 344 25.650 -22.256 114.211 1.00 25.42 C +ATOM 5451 H LEU A 344 29.219 -23.876 114.065 1.00 0.00 H +ATOM 5452 HA LEU A 344 27.761 -22.209 115.981 1.00 0.00 H +ATOM 5453 HB3 LEU A 344 26.190 -24.067 116.075 1.00 0.00 H +ATOM 5454 HB2 LEU A 344 27.311 -25.105 115.190 1.00 0.00 H +ATOM 5455 HG LEU A 344 27.248 -23.349 113.330 1.00 0.00 H +ATOM 5456 HD11 LEU A 344 25.144 -24.186 112.386 1.00 0.00 H +ATOM 5457 HD12 LEU A 344 26.109 -25.488 113.120 1.00 0.00 H +ATOM 5458 HD13 LEU A 344 24.693 -24.837 113.980 1.00 0.00 H +ATOM 5459 HD21 LEU A 344 25.255 -21.902 113.259 1.00 0.00 H +ATOM 5460 HD22 LEU A 344 24.826 -22.427 114.904 1.00 0.00 H +ATOM 5461 HD23 LEU A 344 26.324 -21.506 114.626 1.00 0.00 H +ATOM 5462 N GLU A 345 29.735 -24.609 117.033 1.00 18.09 N +ATOM 5463 CA GLU A 345 30.374 -25.050 118.268 1.00 21.26 C +ATOM 5464 C GLU A 345 31.245 -23.950 118.861 1.00 19.77 C +ATOM 5465 O GLU A 345 31.289 -23.781 120.085 1.00 16.00 O +ATOM 5466 CB GLU A 345 31.199 -26.312 118.029 1.00 22.37 C +ATOM 5467 CG GLU A 345 30.409 -27.472 117.456 1.00 26.83 C +ATOM 5468 CD GLU A 345 30.605 -27.626 115.966 1.00 30.47 C +ATOM 5469 OE1 GLU A 345 30.091 -28.616 115.405 1.00 31.61 O +ATOM 5470 OE2 GLU A 345 31.274 -26.761 115.359 1.00 31.73 O1- +ATOM 5471 H GLU A 345 30.063 -24.946 116.139 1.00 0.00 H +ATOM 5472 HA GLU A 345 29.591 -25.288 118.988 1.00 0.00 H +ATOM 5473 HB3 GLU A 345 31.667 -26.620 118.964 1.00 0.00 H +ATOM 5474 HB2 GLU A 345 32.032 -26.079 117.365 1.00 0.00 H +ATOM 5475 HG3 GLU A 345 29.350 -27.329 117.669 1.00 0.00 H +ATOM 5476 HG2 GLU A 345 30.704 -28.394 117.957 1.00 0.00 H +ATOM 5477 N GLU A 346 31.947 -23.198 118.011 1.00 16.18 N +ATOM 5478 CA GLU A 346 32.696 -22.046 118.498 1.00 17.93 C +ATOM 5479 C GLU A 346 31.754 -20.957 118.997 1.00 18.00 C +ATOM 5480 O GLU A 346 32.067 -20.251 119.962 1.00 19.34 O +ATOM 5481 CB GLU A 346 33.611 -21.507 117.398 1.00 17.94 C +ATOM 5482 CG GLU A 346 34.627 -20.485 117.883 1.00 15.16 C +ATOM 5483 CD GLU A 346 35.590 -20.045 116.795 1.00 17.23 C +ATOM 5484 OE1 GLU A 346 35.483 -20.548 115.657 1.00 23.24 O +ATOM 5485 OE2 GLU A 346 36.454 -19.187 117.079 1.00 15.81 O1- +ATOM 5486 H GLU A 346 31.960 -23.426 117.027 1.00 0.00 H +ATOM 5487 HA GLU A 346 33.318 -22.370 119.333 1.00 0.00 H +ATOM 5488 HB3 GLU A 346 33.004 -21.066 116.607 1.00 0.00 H +ATOM 5489 HB2 GLU A 346 34.133 -22.338 116.923 1.00 0.00 H +ATOM 5490 HG3 GLU A 346 35.190 -20.902 118.718 1.00 0.00 H +ATOM 5491 HG2 GLU A 346 34.104 -19.614 118.278 1.00 0.00 H +ATOM 5492 N ALA A 347 30.594 -20.810 118.352 1.00 12.94 N +ATOM 5493 CA ALA A 347 29.605 -19.839 118.810 1.00 13.08 C +ATOM 5494 C ALA A 347 29.084 -20.204 120.192 1.00 20.16 C +ATOM 5495 O ALA A 347 28.986 -19.348 121.079 1.00 18.28 O +ATOM 5496 CB ALA A 347 28.450 -19.751 117.814 1.00 17.37 C +ATOM 5497 H ALA A 347 30.394 -21.374 117.538 1.00 0.00 H +ATOM 5498 HA ALA A 347 30.084 -18.862 118.869 1.00 0.00 H +ATOM 5499 HB1 ALA A 347 27.719 -19.023 118.167 1.00 0.00 H +ATOM 5500 HB2 ALA A 347 28.831 -19.439 116.841 1.00 0.00 H +ATOM 5501 HB3 ALA A 347 27.974 -20.727 117.721 1.00 0.00 H +ATOM 5502 N LEU A 348 28.741 -21.479 120.391 1.00 13.93 N +ATOM 5503 CA LEU A 348 28.244 -21.909 121.691 1.00 15.12 C +ATOM 5504 C LEU A 348 29.307 -21.760 122.769 1.00 13.30 C +ATOM 5505 O LEU A 348 28.980 -21.457 123.921 1.00 14.83 O +ATOM 5506 CB LEU A 348 27.756 -23.356 121.617 1.00 16.39 C +ATOM 5507 CG LEU A 348 27.271 -23.935 122.946 1.00 17.07 C +ATOM 5508 CD1 LEU A 348 26.049 -23.173 123.428 1.00 12.28 C +ATOM 5509 CD2 LEU A 348 26.965 -25.410 122.807 1.00 18.55 C +ATOM 5510 H LEU A 348 28.826 -22.148 119.639 1.00 0.00 H +ATOM 5511 HA LEU A 348 27.397 -21.277 121.958 1.00 0.00 H +ATOM 5512 HB3 LEU A 348 28.552 -23.985 121.218 1.00 0.00 H +ATOM 5513 HB2 LEU A 348 26.958 -23.430 120.878 1.00 0.00 H +ATOM 5514 HG LEU A 348 28.064 -23.816 123.684 1.00 0.00 H +ATOM 5515 HD11 LEU A 348 25.710 -23.592 124.375 1.00 0.00 H +ATOM 5516 HD12 LEU A 348 26.306 -22.123 123.567 1.00 0.00 H +ATOM 5517 HD13 LEU A 348 25.253 -23.257 122.688 1.00 0.00 H +ATOM 5518 HD21 LEU A 348 26.621 -25.802 123.764 1.00 0.00 H +ATOM 5519 HD22 LEU A 348 26.187 -25.551 122.057 1.00 0.00 H +ATOM 5520 HD23 LEU A 348 27.866 -25.941 122.500 1.00 0.00 H +ATOM 5521 N PHE A 349 30.580 -21.955 122.417 1.00 14.08 N +ATOM 5522 CA PHE A 349 31.652 -21.776 123.390 1.00 12.64 C +ATOM 5523 C PHE A 349 31.669 -20.351 123.928 1.00 16.18 C +ATOM 5524 O PHE A 349 31.775 -20.132 125.141 1.00 17.01 O +ATOM 5525 CB PHE A 349 32.998 -22.131 122.760 1.00 10.70 C +ATOM 5526 CG PHE A 349 34.169 -21.900 123.670 1.00 14.10 C +ATOM 5527 CD1 PHE A 349 34.237 -22.525 124.905 1.00 13.96 C +ATOM 5528 CD2 PHE A 349 35.199 -21.054 123.294 1.00 10.81 C +ATOM 5529 CE1 PHE A 349 35.313 -22.313 125.746 1.00 13.64 C +ATOM 5530 CE2 PHE A 349 36.278 -20.838 124.131 1.00 10.38 C +ATOM 5531 CZ PHE A 349 36.334 -21.468 125.358 1.00 15.00 C +ATOM 5532 H PHE A 349 30.806 -22.228 121.471 1.00 0.00 H +ATOM 5533 HA PHE A 349 31.474 -22.455 124.224 1.00 0.00 H +ATOM 5534 HB3 PHE A 349 33.132 -21.555 121.845 1.00 0.00 H +ATOM 5535 HB2 PHE A 349 32.986 -23.174 122.444 1.00 0.00 H +ATOM 5536 HD1 PHE A 349 33.443 -23.186 125.220 1.00 0.00 H +ATOM 5537 HD2 PHE A 349 35.165 -20.554 122.337 1.00 0.00 H +ATOM 5538 HE1 PHE A 349 35.354 -22.808 126.705 1.00 0.00 H +ATOM 5539 HE2 PHE A 349 37.075 -20.177 123.825 1.00 0.00 H +ATOM 5540 HZ PHE A 349 37.175 -21.301 126.014 1.00 0.00 H +ATOM 5541 N TYR A 350 31.556 -19.364 123.037 1.00 13.03 N +ATOM 5542 CA TYR A 350 31.515 -17.974 123.479 1.00 13.24 C +ATOM 5543 C TYR A 350 30.182 -17.643 124.137 1.00 13.38 C +ATOM 5544 O TYR A 350 30.147 -16.984 125.183 1.00 12.70 O +ATOM 5545 CB TYR A 350 31.778 -17.040 122.299 1.00 11.40 C +ATOM 5546 CG TYR A 350 33.078 -17.311 121.580 1.00 12.47 C +ATOM 5547 CD1 TYR A 350 34.229 -17.640 122.285 1.00 12.03 C +ATOM 5548 CD2 TYR A 350 33.157 -17.237 120.196 1.00 13.49 C +ATOM 5549 CE1 TYR A 350 35.420 -17.888 121.633 1.00 12.19 C +ATOM 5550 CE2 TYR A 350 34.343 -17.479 119.535 1.00 11.78 C +ATOM 5551 CZ TYR A 350 35.472 -17.806 120.257 1.00 16.22 C +ATOM 5552 OH TYR A 350 36.657 -18.052 119.603 1.00 16.26 O +ATOM 5553 H TYR A 350 31.498 -19.577 122.051 1.00 0.00 H +ATOM 5554 HA TYR A 350 32.305 -17.826 124.215 1.00 0.00 H +ATOM 5555 HB3 TYR A 350 31.766 -16.007 122.646 1.00 0.00 H +ATOM 5556 HB2 TYR A 350 30.952 -17.110 121.591 1.00 0.00 H +ATOM 5557 HD1 TYR A 350 34.202 -17.705 123.363 1.00 0.00 H +ATOM 5558 HD2 TYR A 350 32.280 -16.986 119.618 1.00 0.00 H +ATOM 5559 HE1 TYR A 350 36.303 -18.144 122.200 1.00 0.00 H +ATOM 5560 HE2 TYR A 350 34.384 -17.412 118.458 1.00 0.00 H +ATOM 5561 HH TYR A 350 36.527 -17.955 118.657 1.00 0.00 H +ATOM 5562 N GLY A 351 29.076 -18.097 123.542 1.00 9.20 N +ATOM 5563 CA GLY A 351 27.767 -17.791 124.097 1.00 8.91 C +ATOM 5564 C GLY A 351 27.580 -18.323 125.505 1.00 14.64 C +ATOM 5565 O GLY A 351 27.051 -17.626 126.375 1.00 14.17 O +ATOM 5566 H GLY A 351 29.147 -18.655 122.703 1.00 0.00 H +ATOM 5567 HA3 GLY A 351 26.994 -18.203 123.449 1.00 0.00 H +ATOM 5568 HA2 GLY A 351 27.616 -16.711 124.095 1.00 0.00 H +ATOM 5569 N THR A 352 28.008 -19.565 125.750 1.00 16.65 N +ATOM 5570 CA THR A 352 27.874 -20.118 127.091 1.00 14.67 C +ATOM 5571 C THR A 352 28.723 -19.350 128.099 1.00 13.75 C +ATOM 5572 O THR A 352 28.353 -19.264 129.276 1.00 14.73 O +ATOM 5573 CB THR A 352 28.225 -21.611 127.093 1.00 14.54 C +ATOM 5574 OG1 THR A 352 27.658 -22.238 128.251 1.00 17.49 O +ATOM 5575 CG2 THR A 352 29.732 -21.834 127.088 1.00 13.65 C +ATOM 5576 H THR A 352 28.421 -20.113 125.008 1.00 0.00 H +ATOM 5577 HA THR A 352 26.830 -20.020 127.390 1.00 0.00 H +ATOM 5578 HB THR A 352 27.800 -22.072 126.202 1.00 0.00 H +ATOM 5579 HG1 THR A 352 27.879 -23.172 128.250 1.00 0.00 H +ATOM 5580 HG21 THR A 352 29.942 -22.904 127.090 1.00 0.00 H +ATOM 5581 HG22 THR A 352 30.164 -21.381 126.196 1.00 0.00 H +ATOM 5582 HG23 THR A 352 30.170 -21.377 127.975 1.00 0.00 H +ATOM 5583 N ARG A 353 29.831 -18.749 127.655 1.00 14.95 N +ATOM 5584 CA ARG A 353 30.683 -17.997 128.569 1.00 11.27 C +ATOM 5585 C ARG A 353 30.036 -16.685 128.997 1.00 11.47 C +ATOM 5586 O ARG A 353 30.276 -16.215 130.115 1.00 11.53 O +ATOM 5587 CB ARG A 353 32.040 -17.735 127.918 1.00 12.10 C +ATOM 5588 CG ARG A 353 33.060 -18.837 128.151 1.00 10.67 C +ATOM 5589 CD ARG A 353 34.246 -18.685 127.219 1.00 10.02 C +ATOM 5590 NE ARG A 353 35.165 -17.652 127.686 1.00 8.42 N +ATOM 5591 CZ ARG A 353 36.417 -17.518 127.263 1.00 11.95 C +ATOM 5592 NH1 ARG A 353 36.905 -18.354 126.356 1.00 12.13 N +ATOM 5593 NH2 ARG A 353 37.182 -16.549 127.746 1.00 8.22 N1+ +ATOM 5594 H ARG A 353 30.084 -18.814 126.679 1.00 0.00 H +ATOM 5595 HA ARG A 353 30.845 -18.603 129.460 1.00 0.00 H +ATOM 5596 HB3 ARG A 353 32.440 -16.789 128.284 1.00 0.00 H +ATOM 5597 HB2 ARG A 353 31.905 -17.589 126.846 1.00 0.00 H +ATOM 5598 HG3 ARG A 353 32.591 -19.807 127.986 1.00 0.00 H +ATOM 5599 HG2 ARG A 353 33.404 -18.801 129.185 1.00 0.00 H +ATOM 5600 HD3 ARG A 353 33.892 -18.431 126.220 1.00 0.00 H +ATOM 5601 HD2 ARG A 353 34.775 -19.635 127.147 1.00 0.00 H +ATOM 5602 HE ARG A 353 34.794 -17.014 128.375 1.00 0.00 H +ATOM 5603 HH12 ARG A 353 37.857 -18.251 126.035 1.00 0.00 H +ATOM 5604 HH11 ARG A 353 36.324 -19.093 125.986 1.00 0.00 H +ATOM 5605 HH22 ARG A 353 38.134 -16.449 127.423 1.00 0.00 H +ATOM 5606 HH21 ARG A 353 36.813 -15.911 128.437 1.00 0.00 H +ATOM 5607 N THR A 354 29.221 -16.083 128.131 1.00 11.25 N +ATOM 5608 CA THR A 354 28.530 -14.845 128.468 1.00 12.29 C +ATOM 5609 C THR A 354 27.341 -15.062 129.394 1.00 11.36 C +ATOM 5610 O THR A 354 26.768 -14.078 129.873 1.00 16.04 O +ATOM 5611 CB THR A 354 28.045 -14.142 127.195 1.00 10.72 C +ATOM 5612 OG1 THR A 354 26.900 -14.827 126.674 1.00 12.45 O +ATOM 5613 CG2 THR A 354 29.138 -14.135 126.142 1.00 10.10 C +ATOM 5614 H THR A 354 29.070 -16.484 127.216 1.00 0.00 H +ATOM 5615 HA THR A 354 29.238 -14.187 128.972 1.00 0.00 H +ATOM 5616 HB THR A 354 27.771 -13.115 127.435 1.00 0.00 H +ATOM 5617 HG1 THR A 354 26.598 -14.385 125.877 1.00 0.00 H +ATOM 5618 HG21 THR A 354 28.776 -13.632 125.245 1.00 0.00 H +ATOM 5619 HG22 THR A 354 30.011 -13.607 126.527 1.00 0.00 H +ATOM 5620 HG23 THR A 354 29.413 -15.161 125.897 1.00 0.00 H +ATOM 5621 N MET A 355 26.973 -16.317 129.666 1.00 12.87 N +ATOM 5622 CA MET A 355 25.733 -16.603 130.383 1.00 11.87 C +ATOM 5623 C MET A 355 25.747 -16.008 131.787 1.00 13.74 C +ATOM 5624 O MET A 355 24.814 -15.298 132.181 1.00 11.80 O +ATOM 5625 CB MET A 355 25.504 -18.114 130.438 1.00 8.22 C +ATOM 5626 CG MET A 355 24.801 -18.664 129.208 1.00 12.43 C +ATOM 5627 SD MET A 355 23.095 -18.099 129.073 1.00 19.37 S +ATOM 5628 CE MET A 355 23.229 -16.967 127.696 1.00 12.21 C +ATOM 5629 H MET A 355 27.556 -17.089 129.375 1.00 0.00 H +ATOM 5630 HA MET A 355 24.908 -16.153 129.830 1.00 0.00 H +ATOM 5631 HB3 MET A 355 24.923 -18.360 131.327 1.00 0.00 H +ATOM 5632 HB2 MET A 355 26.461 -18.621 130.565 1.00 0.00 H +ATOM 5633 HG3 MET A 355 24.821 -19.753 129.236 1.00 0.00 H +ATOM 5634 HG2 MET A 355 25.352 -18.370 128.314 1.00 0.00 H +ATOM 5635 HE1 MET A 355 22.252 -16.531 127.487 1.00 0.00 H +ATOM 5636 HE2 MET A 355 23.934 -16.174 127.944 1.00 0.00 H +ATOM 5637 HE3 MET A 355 23.583 -17.505 126.816 1.00 0.00 H +ATOM 5638 N GLU A 356 26.796 -16.282 132.556 1.00 12.65 N +ATOM 5639 CA GLU A 356 26.834 -15.821 133.939 1.00 12.94 C +ATOM 5640 C GLU A 356 27.037 -14.309 134.042 1.00 13.72 C +ATOM 5641 O GLU A 356 26.356 -13.666 134.851 1.00 12.24 O +ATOM 5642 CB GLU A 356 27.916 -16.568 134.729 1.00 13.15 C +ATOM 5643 CG GLU A 356 28.119 -16.069 136.160 1.00 15.41 C +ATOM 5644 CD GLU A 356 26.914 -16.291 137.067 1.00 17.39 C +ATOM 5645 OE1 GLU A 356 25.912 -16.898 136.629 1.00 23.43 O +ATOM 5646 OE2 GLU A 356 26.974 -15.847 138.234 1.00 18.94 O1- +ATOM 5647 H GLU A 356 27.571 -16.811 132.183 1.00 0.00 H +ATOM 5648 HA GLU A 356 25.871 -16.057 134.393 1.00 0.00 H +ATOM 5649 HB3 GLU A 356 28.861 -16.511 134.189 1.00 0.00 H +ATOM 5650 HB2 GLU A 356 27.679 -17.632 134.748 1.00 0.00 H +ATOM 5651 HG3 GLU A 356 28.367 -15.008 136.141 1.00 0.00 H +ATOM 5652 HG2 GLU A 356 28.992 -16.557 136.593 1.00 0.00 H +ATOM 5653 N PRO A 357 27.949 -13.695 133.275 1.00 13.22 N +ATOM 5654 CA PRO A 357 28.021 -12.224 133.305 1.00 11.05 C +ATOM 5655 C PRO A 357 26.731 -11.547 132.875 1.00 8.61 C +ATOM 5656 O PRO A 357 26.391 -10.486 133.413 1.00 12.02 O +ATOM 5657 CB PRO A 357 29.173 -11.910 132.341 1.00 11.62 C +ATOM 5658 CG PRO A 357 30.017 -13.122 132.360 1.00 8.30 C +ATOM 5659 CD PRO A 357 29.060 -14.268 132.490 1.00 8.25 C +ATOM 5660 HA PRO A 357 28.287 -11.894 134.309 1.00 0.00 H +ATOM 5661 HB3 PRO A 357 29.745 -11.065 132.725 1.00 0.00 H +ATOM 5662 HB2 PRO A 357 28.774 -11.763 131.337 1.00 0.00 H +ATOM 5663 HG3 PRO A 357 30.669 -13.095 133.233 1.00 0.00 H +ATOM 5664 HG2 PRO A 357 30.553 -13.204 131.415 1.00 0.00 H +ATOM 5665 HD2 PRO A 357 28.696 -14.547 131.501 1.00 0.00 H +ATOM 5666 HD3 PRO A 357 29.531 -15.067 133.063 1.00 0.00 H +ATOM 5667 N TYR A 358 25.996 -12.129 131.923 1.00 10.88 N +ATOM 5668 CA TYR A 358 24.733 -11.531 131.500 1.00 13.35 C +ATOM 5669 C TYR A 358 23.690 -11.599 132.608 1.00 10.93 C +ATOM 5670 O TYR A 358 22.880 -10.678 132.761 1.00 13.28 O +ATOM 5671 CB TYR A 358 24.218 -12.219 130.237 1.00 12.01 C +ATOM 5672 CG TYR A 358 24.554 -11.487 128.958 1.00 13.11 C +ATOM 5673 CD1 TYR A 358 23.564 -11.166 128.037 1.00 11.15 C +ATOM 5674 CD2 TYR A 358 25.861 -11.120 128.668 1.00 9.01 C +ATOM 5675 CE1 TYR A 358 23.867 -10.498 126.866 1.00 7.55 C +ATOM 5676 CE2 TYR A 358 26.174 -10.452 127.500 1.00 12.24 C +ATOM 5677 CZ TYR A 358 25.173 -10.144 126.603 1.00 13.57 C +ATOM 5678 OH TYR A 358 25.476 -9.479 125.437 1.00 11.92 O +ATOM 5679 H TYR A 358 26.313 -12.986 131.493 1.00 0.00 H +ATOM 5680 HA TYR A 358 24.914 -10.482 131.267 1.00 0.00 H +ATOM 5681 HB3 TYR A 358 23.138 -12.344 130.309 1.00 0.00 H +ATOM 5682 HB2 TYR A 358 24.617 -13.232 130.189 1.00 0.00 H +ATOM 5683 HD1 TYR A 358 22.537 -11.439 128.231 1.00 0.00 H +ATOM 5684 HD2 TYR A 358 26.655 -11.356 129.361 1.00 0.00 H +ATOM 5685 HE1 TYR A 358 23.083 -10.256 126.164 1.00 0.00 H +ATOM 5686 HE2 TYR A 358 27.197 -10.174 127.294 1.00 0.00 H +ATOM 5687 HH TYR A 358 26.420 -9.306 125.403 1.00 0.00 H +ATOM 5688 N ARG A 359 23.690 -12.685 133.387 1.00 13.31 N +ATOM 5689 CA ARG A 359 22.766 -12.786 134.512 1.00 13.33 C +ATOM 5690 C ARG A 359 23.023 -11.696 135.544 1.00 12.28 C +ATOM 5691 O ARG A 359 22.088 -11.239 136.212 1.00 14.74 O +ATOM 5692 CB ARG A 359 22.874 -14.167 135.161 1.00 11.50 C +ATOM 5693 CG ARG A 359 21.895 -14.398 136.304 1.00 14.47 C +ATOM 5694 CD ARG A 359 22.188 -15.694 137.046 1.00 15.91 C +ATOM 5695 NE ARG A 359 23.458 -15.643 137.765 1.00 16.57 N +ATOM 5696 CZ ARG A 359 23.634 -15.036 138.935 1.00 22.64 C +ATOM 5697 NH1 ARG A 359 22.618 -14.425 139.530 1.00 19.84 N +ATOM 5698 NH2 ARG A 359 24.828 -15.041 139.513 1.00 18.99 N1+ +ATOM 5699 H ARG A 359 24.332 -13.442 133.199 1.00 0.00 H +ATOM 5700 HA ARG A 359 21.751 -12.665 134.133 1.00 0.00 H +ATOM 5701 HB3 ARG A 359 23.892 -14.318 135.521 1.00 0.00 H +ATOM 5702 HB2 ARG A 359 22.730 -14.935 134.401 1.00 0.00 H +ATOM 5703 HG3 ARG A 359 20.879 -14.427 135.911 1.00 0.00 H +ATOM 5704 HG2 ARG A 359 21.947 -13.561 137.001 1.00 0.00 H +ATOM 5705 HD3 ARG A 359 22.206 -16.522 136.337 1.00 0.00 H +ATOM 5706 HD2 ARG A 359 21.381 -15.899 137.750 1.00 0.00 H +ATOM 5707 HE ARG A 359 24.233 -16.109 137.316 1.00 0.00 H +ATOM 5708 HH12 ARG A 359 22.756 -13.965 140.419 1.00 0.00 H +ATOM 5709 HH11 ARG A 359 21.707 -14.420 139.094 1.00 0.00 H +ATOM 5710 HH22 ARG A 359 24.961 -14.580 140.402 1.00 0.00 H +ATOM 5711 HH21 ARG A 359 25.604 -15.506 139.064 1.00 0.00 H +ATOM 5712 N ILE A 360 24.275 -11.260 135.680 1.00 15.84 N +ATOM 5713 CA ILE A 360 24.610 -10.256 136.683 1.00 14.04 C +ATOM 5714 C ILE A 360 24.314 -8.851 136.171 1.00 11.28 C +ATOM 5715 O ILE A 360 23.764 -8.017 136.898 1.00 12.72 O +ATOM 5716 CB ILE A 360 26.083 -10.407 137.105 1.00 16.34 C +ATOM 5717 CG1 ILE A 360 26.306 -11.761 137.781 1.00 15.27 C +ATOM 5718 CG2 ILE A 360 26.499 -9.271 138.027 1.00 11.82 C +ATOM 5719 CD1 ILE A 360 27.757 -12.184 137.834 1.00 17.91 C +ATOM 5720 H ILE A 360 25.004 -11.625 135.085 1.00 0.00 H +ATOM 5721 HA ILE A 360 23.988 -10.434 137.560 1.00 0.00 H +ATOM 5722 HB ILE A 360 26.702 -10.365 136.209 1.00 0.00 H +ATOM 5723 HG13 ILE A 360 25.726 -12.524 137.262 1.00 0.00 H +ATOM 5724 HG12 ILE A 360 25.901 -11.731 138.792 1.00 0.00 H +ATOM 5725 HG21 ILE A 360 27.543 -9.398 138.313 1.00 0.00 H +ATOM 5726 HG22 ILE A 360 26.378 -8.319 137.510 1.00 0.00 H +ATOM 5727 HG23 ILE A 360 25.875 -9.280 138.921 1.00 0.00 H +ATOM 5728 HD11 ILE A 360 27.836 -13.153 138.327 1.00 0.00 H +ATOM 5729 HD12 ILE A 360 28.151 -12.259 136.821 1.00 0.00 H +ATOM 5730 HD13 ILE A 360 28.331 -11.445 138.393 1.00 0.00 H +ATOM 5731 N PHE A 361 24.660 -8.567 134.916 1.00 9.89 N +ATOM 5732 CA PHE A 361 24.571 -7.216 134.379 1.00 8.45 C +ATOM 5733 C PHE A 361 23.211 -6.884 133.777 1.00 9.56 C +ATOM 5734 O PHE A 361 22.937 -5.705 133.529 1.00 7.48 O +ATOM 5735 CB PHE A 361 25.663 -7.000 133.328 1.00 9.81 C +ATOM 5736 CG PHE A 361 27.055 -7.114 133.877 1.00 9.89 C +ATOM 5737 CD1 PHE A 361 27.344 -6.674 135.158 1.00 12.24 C +ATOM 5738 CD2 PHE A 361 28.073 -7.665 133.118 1.00 10.41 C +ATOM 5739 CE1 PHE A 361 28.623 -6.777 135.672 1.00 10.46 C +ATOM 5740 CE2 PHE A 361 29.355 -7.772 133.626 1.00 12.97 C +ATOM 5741 CZ PHE A 361 29.629 -7.327 134.906 1.00 8.55 C +ATOM 5742 H PHE A 361 24.996 -9.299 134.307 1.00 0.00 H +ATOM 5743 HA PHE A 361 24.753 -6.519 135.197 1.00 0.00 H +ATOM 5744 HB3 PHE A 361 25.534 -6.020 132.869 1.00 0.00 H +ATOM 5745 HB2 PHE A 361 25.533 -7.719 132.519 1.00 0.00 H +ATOM 5746 HD1 PHE A 361 26.565 -6.243 135.770 1.00 0.00 H +ATOM 5747 HD2 PHE A 361 27.871 -8.017 132.117 1.00 0.00 H +ATOM 5748 HE1 PHE A 361 28.833 -6.427 136.672 1.00 0.00 H +ATOM 5749 HE2 PHE A 361 30.141 -8.203 133.023 1.00 0.00 H +ATOM 5750 HZ PHE A 361 30.629 -7.410 135.306 1.00 0.00 H +ATOM 5751 N PHE A 362 22.357 -7.879 133.536 1.00 9.65 N +ATOM 5752 CA PHE A 362 20.991 -7.661 133.063 1.00 9.12 C +ATOM 5753 C PHE A 362 20.021 -8.236 134.090 1.00 13.61 C +ATOM 5754 O PHE A 362 19.395 -9.279 133.856 1.00 12.51 O +ATOM 5755 CB PHE A 362 20.762 -8.290 131.690 1.00 12.91 C +ATOM 5756 CG PHE A 362 21.667 -7.756 130.613 1.00 9.61 C +ATOM 5757 CD1 PHE A 362 21.252 -6.720 129.792 1.00 12.94 C +ATOM 5758 CD2 PHE A 362 22.925 -8.300 130.409 1.00 9.48 C +ATOM 5759 CE1 PHE A 362 22.077 -6.229 128.796 1.00 13.56 C +ATOM 5760 CE2 PHE A 362 23.755 -7.814 129.413 1.00 12.32 C +ATOM 5761 CZ PHE A 362 23.330 -6.777 128.607 1.00 6.88 C +ATOM 5762 H PHE A 362 22.644 -8.837 133.679 1.00 0.00 H +ATOM 5763 HA PHE A 362 20.818 -6.588 132.986 1.00 0.00 H +ATOM 5764 HB3 PHE A 362 19.723 -8.144 131.394 1.00 0.00 H +ATOM 5765 HB2 PHE A 362 20.885 -9.371 131.762 1.00 0.00 H +ATOM 5766 HD1 PHE A 362 20.273 -6.285 129.925 1.00 0.00 H +ATOM 5767 HD2 PHE A 362 23.269 -9.113 131.031 1.00 0.00 H +ATOM 5768 HE1 PHE A 362 21.741 -5.418 128.167 1.00 0.00 H +ATOM 5769 HE2 PHE A 362 24.734 -8.246 129.267 1.00 0.00 H +ATOM 5770 HZ PHE A 362 23.975 -6.394 127.830 1.00 0.00 H +ATOM 5771 N PRO A 363 19.867 -7.578 135.237 1.00 11.79 N +ATOM 5772 CA PRO A 363 19.030 -8.140 136.300 1.00 13.58 C +ATOM 5773 C PRO A 363 17.553 -8.075 135.946 1.00 16.12 C +ATOM 5774 O PRO A 363 17.112 -7.274 135.119 1.00 16.38 O +ATOM 5775 CB PRO A 363 19.354 -7.253 137.505 1.00 12.38 C +ATOM 5776 CG PRO A 363 19.687 -5.937 136.892 1.00 12.69 C +ATOM 5777 CD PRO A 363 20.432 -6.272 135.623 1.00 15.35 C +ATOM 5778 HA PRO A 363 19.322 -9.170 136.503 1.00 0.00 H +ATOM 5779 HB3 PRO A 363 20.234 -7.646 138.015 1.00 0.00 H +ATOM 5780 HB2 PRO A 363 18.463 -7.147 138.124 1.00 0.00 H +ATOM 5781 HG3 PRO A 363 20.345 -5.382 137.561 1.00 0.00 H +ATOM 5782 HG2 PRO A 363 18.766 -5.411 136.642 1.00 0.00 H +ATOM 5783 HD2 PRO A 363 20.189 -5.535 134.858 1.00 0.00 H +ATOM 5784 HD3 PRO A 363 21.492 -6.391 135.849 1.00 0.00 H +ATOM 5785 N GLY A 364 16.786 -8.948 136.590 1.00 17.30 N +ATOM 5786 CA GLY A 364 15.354 -8.983 136.340 1.00 11.58 C +ATOM 5787 C GLY A 364 15.064 -9.498 134.945 1.00 18.53 C +ATOM 5788 O GLY A 364 15.604 -10.521 134.509 1.00 14.29 O +ATOM 5789 H GLY A 364 17.197 -9.588 137.254 1.00 0.00 H +ATOM 5790 HA3 GLY A 364 14.942 -7.980 136.450 1.00 0.00 H +ATOM 5791 HA2 GLY A 364 14.873 -9.631 137.073 1.00 0.00 H +ATOM 5792 N SER A 365 14.203 -8.780 134.227 1.00 13.65 N +ATOM 5793 CA SER A 365 13.806 -9.142 132.870 1.00 16.17 C +ATOM 5794 C SER A 365 14.294 -8.061 131.914 1.00 15.91 C +ATOM 5795 O SER A 365 13.738 -6.958 131.880 1.00 10.74 O +ATOM 5796 CB SER A 365 12.292 -9.319 132.771 1.00 12.77 C +ATOM 5797 OG SER A 365 11.806 -10.147 133.813 1.00 20.37 O +ATOM 5798 H SER A 365 13.793 -7.944 134.618 1.00 0.00 H +ATOM 5799 HA SER A 365 14.286 -10.084 132.606 1.00 0.00 H +ATOM 5800 HB3 SER A 365 12.041 -9.763 131.808 1.00 0.00 H +ATOM 5801 HB2 SER A 365 11.808 -8.344 132.827 1.00 0.00 H +ATOM 5802 HG SER A 365 10.854 -10.243 133.729 1.00 0.00 H +ATOM 5803 N HIS A 366 15.331 -8.378 131.143 1.00 13.14 N +ATOM 5804 CA HIS A 366 15.858 -7.492 130.122 1.00 13.34 C +ATOM 5805 C HIS A 366 15.827 -8.206 128.778 1.00 12.07 C +ATOM 5806 O HIS A 366 16.255 -9.365 128.689 1.00 12.27 O +ATOM 5807 CB HIS A 366 17.296 -7.054 130.456 1.00 9.94 C +ATOM 5808 CG HIS A 366 17.734 -5.817 129.735 1.00 13.51 C +ATOM 5809 ND1 HIS A 366 18.073 -5.815 128.399 1.00 10.98 N +ATOM 5810 CD2 HIS A 366 17.886 -4.542 130.163 1.00 13.80 C +ATOM 5811 CE1 HIS A 366 18.415 -4.591 128.036 1.00 15.30 C +ATOM 5812 NE2 HIS A 366 18.310 -3.800 129.088 1.00 11.59 N +ATOM 5813 H HIS A 366 15.789 -9.271 131.255 1.00 0.00 H +ATOM 5814 HA HIS A 366 15.225 -6.606 130.064 1.00 0.00 H +ATOM 5815 HB3 HIS A 366 17.984 -7.868 130.228 1.00 0.00 H +ATOM 5816 HB2 HIS A 366 17.386 -6.897 131.531 1.00 0.00 H +ATOM 5817 HD1 HIS A 366 18.033 -6.672 127.867 1.00 0.00 H +ATOM 5818 HD2 HIS A 366 17.677 -4.289 131.192 1.00 0.00 H +ATOM 5819 HE1 HIS A 366 18.714 -4.393 127.017 1.00 0.00 H +ATOM 5820 N PRO A 367 15.331 -7.563 127.718 1.00 10.81 N +ATOM 5821 CA PRO A 367 15.220 -8.262 126.426 1.00 8.89 C +ATOM 5822 C PRO A 367 16.556 -8.695 125.854 1.00 10.53 C +ATOM 5823 O PRO A 367 16.607 -9.667 125.090 1.00 10.50 O +ATOM 5824 CB PRO A 367 14.527 -7.231 125.524 1.00 10.69 C +ATOM 5825 CG PRO A 367 14.758 -5.912 126.181 1.00 9.28 C +ATOM 5826 CD PRO A 367 14.851 -6.173 127.652 1.00 12.08 C +ATOM 5827 HA PRO A 367 14.576 -9.134 126.540 1.00 0.00 H +ATOM 5828 HB3 PRO A 367 13.457 -7.438 125.494 1.00 0.00 H +ATOM 5829 HB2 PRO A 367 15.000 -7.234 124.542 1.00 0.00 H +ATOM 5830 HG3 PRO A 367 13.911 -5.255 125.982 1.00 0.00 H +ATOM 5831 HG2 PRO A 367 15.699 -5.491 125.827 1.00 0.00 H +ATOM 5832 HD2 PRO A 367 15.600 -5.512 128.088 1.00 0.00 H +ATOM 5833 HD3 PRO A 367 13.855 -6.115 128.091 1.00 0.00 H +ATOM 5834 N VAL A 368 17.644 -8.006 126.202 1.00 10.37 N +ATOM 5835 CA VAL A 368 18.951 -8.369 125.666 1.00 10.23 C +ATOM 5836 C VAL A 368 19.405 -9.709 126.229 1.00 10.75 C +ATOM 5837 O VAL A 368 19.987 -10.534 125.514 1.00 13.63 O +ATOM 5838 CB VAL A 368 19.967 -7.251 125.956 1.00 17.51 C +ATOM 5839 CG1 VAL A 368 21.385 -7.704 125.626 1.00 14.02 C +ATOM 5840 CG2 VAL A 368 19.598 -6.009 125.180 1.00 14.05 C +ATOM 5841 H VAL A 368 17.566 -7.227 126.841 1.00 0.00 H +ATOM 5842 HA VAL A 368 18.858 -8.470 124.585 1.00 0.00 H +ATOM 5843 HB VAL A 368 19.922 -7.016 127.019 1.00 0.00 H +ATOM 5844 HG11 VAL A 368 22.084 -6.896 125.840 1.00 0.00 H +ATOM 5845 HG12 VAL A 368 21.639 -8.574 126.232 1.00 0.00 H +ATOM 5846 HG13 VAL A 368 21.446 -7.967 124.570 1.00 0.00 H +ATOM 5847 HG21 VAL A 368 20.321 -5.221 125.390 1.00 0.00 H +ATOM 5848 HG22 VAL A 368 19.603 -6.232 124.113 1.00 0.00 H +ATOM 5849 HG23 VAL A 368 18.603 -5.677 125.477 1.00 0.00 H +ATOM 5850 N ARG A 369 19.139 -9.956 127.513 1.00 8.80 N +ATOM 5851 CA ARG A 369 19.515 -11.238 128.098 1.00 10.88 C +ATOM 5852 C ARG A 369 18.628 -12.362 127.577 1.00 13.15 C +ATOM 5853 O ARG A 369 19.121 -13.454 127.270 1.00 10.80 O +ATOM 5854 CB ARG A 369 19.452 -11.169 129.623 1.00 9.64 C +ATOM 5855 CG ARG A 369 19.657 -12.521 130.283 1.00 11.78 C +ATOM 5856 CD ARG A 369 19.910 -12.409 131.775 1.00 10.91 C +ATOM 5857 NE ARG A 369 20.251 -13.709 132.343 1.00 13.81 N +ATOM 5858 CZ ARG A 369 19.610 -14.272 133.362 1.00 15.10 C +ATOM 5859 NH1 ARG A 369 18.590 -13.647 133.933 1.00 10.64 N +ATOM 5860 NH2 ARG A 369 19.989 -15.461 133.809 1.00 12.44 N1+ +ATOM 5861 H ARG A 369 18.678 -9.256 128.077 1.00 0.00 H +ATOM 5862 HA ARG A 369 20.544 -11.455 127.810 1.00 0.00 H +ATOM 5863 HB3 ARG A 369 18.489 -10.760 129.928 1.00 0.00 H +ATOM 5864 HB2 ARG A 369 20.207 -10.471 129.985 1.00 0.00 H +ATOM 5865 HG3 ARG A 369 20.496 -13.031 129.811 1.00 0.00 H +ATOM 5866 HG2 ARG A 369 18.780 -13.145 130.110 1.00 0.00 H +ATOM 5867 HD3 ARG A 369 19.018 -12.021 132.266 1.00 0.00 H +ATOM 5868 HD2 ARG A 369 20.727 -11.710 131.953 1.00 0.00 H +ATOM 5869 HE ARG A 369 21.030 -14.186 131.911 1.00 0.00 H +ATOM 5870 HH12 ARG A 369 18.104 -14.076 134.707 1.00 0.00 H +ATOM 5871 HH11 ARG A 369 18.299 -12.741 133.594 1.00 0.00 H +ATOM 5872 HH22 ARG A 369 19.501 -15.888 134.583 1.00 0.00 H +ATOM 5873 HH21 ARG A 369 20.765 -15.940 133.375 1.00 0.00 H +ATOM 5874 N GLY A 370 17.320 -12.113 127.468 1.00 10.67 N +ATOM 5875 CA GLY A 370 16.421 -13.140 126.966 1.00 10.01 C +ATOM 5876 C GLY A 370 16.782 -13.606 125.569 1.00 13.40 C +ATOM 5877 O GLY A 370 16.689 -14.796 125.258 1.00 11.81 O +ATOM 5878 H GLY A 370 16.954 -11.210 127.734 1.00 0.00 H +ATOM 5879 HA3 GLY A 370 15.399 -12.760 126.968 1.00 0.00 H +ATOM 5880 HA2 GLY A 370 16.429 -13.992 127.646 1.00 0.00 H +ATOM 5881 N VAL A 371 17.206 -12.677 124.710 1.00 10.69 N +ATOM 5882 CA VAL A 371 17.635 -13.049 123.365 1.00 11.80 C +ATOM 5883 C VAL A 371 18.945 -13.824 123.420 1.00 10.40 C +ATOM 5884 O VAL A 371 19.112 -14.836 122.727 1.00 10.83 O +ATOM 5885 CB VAL A 371 17.751 -11.796 122.477 1.00 15.43 C +ATOM 5886 CG1 VAL A 371 18.473 -12.125 121.177 1.00 13.11 C +ATOM 5887 CG2 VAL A 371 16.373 -11.218 122.194 1.00 11.08 C +ATOM 5888 H VAL A 371 17.232 -11.706 124.988 1.00 0.00 H +ATOM 5889 HA VAL A 371 16.874 -13.700 122.935 1.00 0.00 H +ATOM 5890 HB VAL A 371 18.334 -11.047 123.014 1.00 0.00 H +ATOM 5891 HG11 VAL A 371 18.545 -11.227 120.563 1.00 0.00 H +ATOM 5892 HG12 VAL A 371 19.474 -12.493 121.400 1.00 0.00 H +ATOM 5893 HG13 VAL A 371 17.917 -12.891 120.636 1.00 0.00 H +ATOM 5894 HG21 VAL A 371 16.472 -10.333 121.565 1.00 0.00 H +ATOM 5895 HG22 VAL A 371 15.765 -11.962 121.680 1.00 0.00 H +ATOM 5896 HG23 VAL A 371 15.893 -10.944 123.134 1.00 0.00 H +ATOM 5897 N GLN A 372 19.894 -13.365 124.242 1.00 16.77 N +ATOM 5898 CA GLN A 372 21.161 -14.075 124.390 1.00 11.85 C +ATOM 5899 C GLN A 372 20.941 -15.497 124.887 1.00 10.41 C +ATOM 5900 O GLN A 372 21.553 -16.444 124.378 1.00 16.28 O +ATOM 5901 CB GLN A 372 22.078 -13.315 125.346 1.00 12.06 C +ATOM 5902 CG GLN A 372 23.525 -13.782 125.332 1.00 13.53 C +ATOM 5903 CD GLN A 372 24.356 -13.069 124.283 1.00 12.74 C +ATOM 5904 OE1 GLN A 372 23.822 -12.364 123.427 1.00 14.42 O +ATOM 5905 NE2 GLN A 372 25.670 -13.244 124.350 1.00 14.38 N +ATOM 5906 H GLN A 372 19.739 -12.518 124.769 1.00 0.00 H +ATOM 5907 HA GLN A 372 21.645 -14.123 123.414 1.00 0.00 H +ATOM 5908 HB3 GLN A 372 21.684 -13.389 126.360 1.00 0.00 H +ATOM 5909 HB2 GLN A 372 22.040 -12.251 125.114 1.00 0.00 H +ATOM 5910 HG3 GLN A 372 23.557 -14.856 125.151 1.00 0.00 H +ATOM 5911 HG2 GLN A 372 23.967 -13.621 126.315 1.00 0.00 H +ATOM 5912 HE22 GLN A 372 26.274 -12.794 123.678 1.00 0.00 H +ATOM 5913 HE21 GLN A 372 26.066 -13.827 125.073 1.00 0.00 H +ATOM 5914 N VAL A 373 20.069 -15.666 125.882 1.00 9.02 N +ATOM 5915 CA VAL A 373 19.783 -16.998 126.402 1.00 11.29 C +ATOM 5916 C VAL A 373 19.090 -17.845 125.342 1.00 16.08 C +ATOM 5917 O VAL A 373 19.350 -19.049 125.220 1.00 12.49 O +ATOM 5918 CB VAL A 373 18.946 -16.891 127.691 1.00 11.38 C +ATOM 5919 CG1 VAL A 373 18.384 -18.242 128.086 1.00 12.16 C +ATOM 5920 CG2 VAL A 373 19.782 -16.307 128.821 1.00 11.06 C +ATOM 5921 H VAL A 373 19.599 -14.867 126.283 1.00 0.00 H +ATOM 5922 HA VAL A 373 20.731 -17.475 126.652 1.00 0.00 H +ATOM 5923 HB VAL A 373 18.111 -16.217 127.501 1.00 0.00 H +ATOM 5924 HG11 VAL A 373 17.797 -18.139 128.999 1.00 0.00 H +ATOM 5925 HG12 VAL A 373 17.747 -18.619 127.286 1.00 0.00 H +ATOM 5926 HG13 VAL A 373 19.203 -18.941 128.258 1.00 0.00 H +ATOM 5927 HG21 VAL A 373 19.176 -16.238 129.724 1.00 0.00 H +ATOM 5928 HG22 VAL A 373 20.641 -16.951 129.009 1.00 0.00 H +ATOM 5929 HG23 VAL A 373 20.129 -15.313 128.540 1.00 0.00 H +ATOM 5930 N MET A 374 18.208 -17.230 124.548 1.00 14.21 N +ATOM 5931 CA MET A 374 17.542 -17.962 123.475 1.00 14.02 C +ATOM 5932 C MET A 374 18.540 -18.432 122.424 1.00 15.93 C +ATOM 5933 O MET A 374 18.435 -19.555 121.918 1.00 15.18 O +ATOM 5934 CB MET A 374 16.461 -17.091 122.834 1.00 9.90 C +ATOM 5935 CG MET A 374 15.658 -17.802 121.757 1.00 18.15 C +ATOM 5936 SD MET A 374 14.444 -16.729 120.969 1.00 19.71 S +ATOM 5937 CE MET A 374 13.929 -17.754 119.594 1.00 23.59 C +ATOM 5938 H MET A 374 17.998 -16.252 124.688 1.00 0.00 H +ATOM 5939 HA MET A 374 17.062 -18.840 123.907 1.00 0.00 H +ATOM 5940 HB3 MET A 374 16.920 -16.197 122.412 1.00 0.00 H +ATOM 5941 HB2 MET A 374 15.785 -16.726 123.607 1.00 0.00 H +ATOM 5942 HG3 MET A 374 15.152 -18.664 122.192 1.00 0.00 H +ATOM 5943 HG2 MET A 374 16.336 -18.198 121.001 1.00 0.00 H +ATOM 5944 HE1 MET A 374 13.176 -17.226 119.009 1.00 0.00 H +ATOM 5945 HE2 MET A 374 14.790 -17.976 118.963 1.00 0.00 H +ATOM 5946 HE3 MET A 374 13.507 -18.685 119.972 1.00 0.00 H +ATOM 5947 N LYS A 375 19.511 -17.582 122.077 1.00 13.79 N +ATOM 5948 CA LYS A 375 20.541 -17.983 121.122 1.00 14.28 C +ATOM 5949 C LYS A 375 21.342 -19.169 121.641 1.00 15.35 C +ATOM 5950 O LYS A 375 21.615 -20.118 120.897 1.00 13.65 O +ATOM 5951 CB LYS A 375 21.472 -16.808 120.824 1.00 14.65 C +ATOM 5952 CG LYS A 375 20.901 -15.760 119.886 1.00 11.27 C +ATOM 5953 CD LYS A 375 21.963 -14.732 119.526 1.00 20.84 C +ATOM 5954 CE LYS A 375 21.399 -13.630 118.644 1.00 20.45 C +ATOM 5955 NZ LYS A 375 22.062 -12.322 118.908 1.00 16.60 N1+ +ATOM 5956 H LYS A 375 19.536 -16.654 122.476 1.00 0.00 H +ATOM 5957 HA LYS A 375 20.052 -18.278 120.193 1.00 0.00 H +ATOM 5958 HB3 LYS A 375 22.409 -17.185 120.415 1.00 0.00 H +ATOM 5959 HB2 LYS A 375 21.764 -16.333 121.760 1.00 0.00 H +ATOM 5960 HG3 LYS A 375 20.061 -15.260 120.368 1.00 0.00 H +ATOM 5961 HG2 LYS A 375 20.541 -16.243 118.978 1.00 0.00 H +ATOM 5962 HD3 LYS A 375 22.785 -15.226 119.008 1.00 0.00 H +ATOM 5963 HD2 LYS A 375 22.368 -14.295 120.438 1.00 0.00 H +ATOM 5964 HE3 LYS A 375 20.328 -13.536 118.822 1.00 0.00 H +ATOM 5965 HE2 LYS A 375 21.533 -13.900 117.596 1.00 0.00 H +ATOM 5966 HZ1 LYS A 375 21.664 -11.615 118.307 1.00 0.00 H +ATOM 5967 HZ2 LYS A 375 21.920 -12.061 119.873 1.00 0.00 H +ATOM 5968 HZ3 LYS A 375 23.052 -12.402 118.723 1.00 0.00 H +ATOM 5969 N VAL A 376 21.728 -19.130 122.919 1.00 15.93 N +ATOM 5970 CA VAL A 376 22.513 -20.217 123.497 1.00 13.39 C +ATOM 5971 C VAL A 376 21.698 -21.504 123.528 1.00 13.81 C +ATOM 5972 O VAL A 376 22.195 -22.580 123.172 1.00 16.80 O +ATOM 5973 CB VAL A 376 23.017 -19.823 124.898 1.00 11.46 C +ATOM 5974 CG1 VAL A 376 23.409 -21.056 125.696 1.00 14.10 C +ATOM 5975 CG2 VAL A 376 24.189 -18.859 124.783 1.00 10.68 C +ATOM 5976 H VAL A 376 21.477 -18.342 123.498 1.00 0.00 H +ATOM 5977 HA VAL A 376 23.382 -20.382 122.860 1.00 0.00 H +ATOM 5978 HB VAL A 376 22.207 -19.317 125.424 1.00 0.00 H +ATOM 5979 HG11 VAL A 376 23.762 -20.754 126.682 1.00 0.00 H +ATOM 5980 HG12 VAL A 376 22.543 -21.709 125.805 1.00 0.00 H +ATOM 5981 HG13 VAL A 376 24.203 -21.590 125.174 1.00 0.00 H +ATOM 5982 HG21 VAL A 376 24.536 -18.588 125.780 1.00 0.00 H +ATOM 5983 HG22 VAL A 376 25.000 -19.336 124.234 1.00 0.00 H +ATOM 5984 HG23 VAL A 376 23.871 -17.961 124.253 1.00 0.00 H +ATOM 5985 N GLY A 377 20.432 -21.414 123.941 1.00 16.86 N +ATOM 5986 CA GLY A 377 19.578 -22.591 123.927 1.00 16.35 C +ATOM 5987 C GLY A 377 19.351 -23.128 122.527 1.00 20.20 C +ATOM 5988 O GLY A 377 19.240 -24.340 122.327 1.00 21.05 O +ATOM 5989 H GLY A 377 20.068 -20.529 124.263 1.00 0.00 H +ATOM 5990 HA3 GLY A 377 18.618 -22.347 124.382 1.00 0.00 H +ATOM 5991 HA2 GLY A 377 20.024 -23.370 124.546 1.00 0.00 H +ATOM 5992 N LYS A 378 19.283 -22.233 121.539 1.00 20.27 N +ATOM 5993 CA LYS A 378 19.127 -22.669 120.156 1.00 21.49 C +ATOM 5994 C LYS A 378 20.384 -23.360 119.643 1.00 23.90 C +ATOM 5995 O LYS A 378 20.292 -24.303 118.850 1.00 24.74 O +ATOM 5996 CB LYS A 378 18.769 -21.475 119.270 1.00 14.92 C +ATOM 5997 CG LYS A 378 18.490 -21.826 117.819 1.00 18.66 C +ATOM 5998 CD LYS A 378 17.951 -20.622 117.063 1.00 18.37 C +ATOM 5999 CE LYS A 378 17.826 -20.907 115.577 1.00 19.83 C +ATOM 6000 NZ LYS A 378 17.599 -19.659 114.797 1.00 30.94 N1+ +ATOM 6001 H LYS A 378 19.340 -21.246 121.747 1.00 0.00 H +ATOM 6002 HA LYS A 378 18.304 -23.383 120.114 1.00 0.00 H +ATOM 6003 HB3 LYS A 378 19.571 -20.739 119.315 1.00 0.00 H +ATOM 6004 HB2 LYS A 378 17.904 -20.961 119.690 1.00 0.00 H +ATOM 6005 HG3 LYS A 378 17.763 -22.637 117.775 1.00 0.00 H +ATOM 6006 HG2 LYS A 378 19.410 -22.170 117.346 1.00 0.00 H +ATOM 6007 HD3 LYS A 378 18.615 -19.771 117.215 1.00 0.00 H +ATOM 6008 HD2 LYS A 378 16.975 -20.350 117.463 1.00 0.00 H +ATOM 6009 HE3 LYS A 378 16.998 -21.596 115.408 1.00 0.00 H +ATOM 6010 HE2 LYS A 378 18.734 -21.395 115.224 1.00 0.00 H +ATOM 6011 HZ1 LYS A 378 17.521 -19.884 113.816 1.00 0.00 H +ATOM 6012 HZ2 LYS A 378 16.746 -19.217 115.109 1.00 0.00 H +ATOM 6013 HZ3 LYS A 378 18.376 -19.028 114.936 1.00 0.00 H +ATOM 6014 N LEU A 379 21.561 -22.912 120.087 1.00 22.01 N +ATOM 6015 CA LEU A 379 22.798 -23.581 119.697 1.00 19.54 C +ATOM 6016 C LEU A 379 22.924 -24.940 120.374 1.00 23.38 C +ATOM 6017 O LEU A 379 23.420 -25.898 119.769 1.00 27.60 O +ATOM 6018 CB LEU A 379 24.001 -22.700 120.032 1.00 18.54 C +ATOM 6019 CG LEU A 379 24.246 -21.494 119.124 1.00 17.69 C +ATOM 6020 CD1 LEU A 379 25.109 -20.460 119.831 1.00 15.35 C +ATOM 6021 CD2 LEU A 379 24.889 -21.928 117.816 1.00 19.39 C +ATOM 6022 H LEU A 379 21.598 -22.107 120.696 1.00 0.00 H +ATOM 6023 HA LEU A 379 22.778 -23.737 118.618 1.00 0.00 H +ATOM 6024 HB3 LEU A 379 24.900 -23.316 120.061 1.00 0.00 H +ATOM 6025 HB2 LEU A 379 23.921 -22.361 121.065 1.00 0.00 H +ATOM 6026 HG LEU A 379 23.283 -21.037 118.896 1.00 0.00 H +ATOM 6027 HD11 LEU A 379 25.273 -19.609 119.170 1.00 0.00 H +ATOM 6028 HD12 LEU A 379 24.605 -20.124 120.737 1.00 0.00 H +ATOM 6029 HD13 LEU A 379 26.069 -20.905 120.094 1.00 0.00 H +ATOM 6030 HD21 LEU A 379 25.055 -21.055 117.185 1.00 0.00 H +ATOM 6031 HD22 LEU A 379 25.843 -22.413 118.023 1.00 0.00 H +ATOM 6032 HD23 LEU A 379 24.231 -22.628 117.302 1.00 0.00 H +ATOM 6033 N GLN A 380 22.479 -25.043 121.629 1.00 19.72 N +ATOM 6034 CA GLN A 380 22.541 -26.319 122.334 1.00 22.37 C +ATOM 6035 C GLN A 380 21.559 -27.324 121.744 1.00 23.60 C +ATOM 6036 O GLN A 380 21.877 -28.513 121.625 1.00 22.33 O +ATOM 6037 CB GLN A 380 22.265 -26.109 123.823 1.00 19.38 C +ATOM 6038 CG GLN A 380 23.364 -25.366 124.564 1.00 15.33 C +ATOM 6039 CD GLN A 380 22.946 -24.949 125.961 1.00 18.44 C +ATOM 6040 OE1 GLN A 380 21.767 -24.711 126.223 1.00 16.89 O +ATOM 6041 NE2 GLN A 380 23.913 -24.862 126.867 1.00 12.84 N +ATOM 6042 H GLN A 380 22.096 -24.234 122.097 1.00 0.00 H +ATOM 6043 HA GLN A 380 23.548 -26.721 122.226 1.00 0.00 H +ATOM 6044 HB3 GLN A 380 22.098 -27.075 124.299 1.00 0.00 H +ATOM 6045 HB2 GLN A 380 21.323 -25.574 123.944 1.00 0.00 H +ATOM 6046 HG3 GLN A 380 23.653 -24.483 123.994 1.00 0.00 H +ATOM 6047 HG2 GLN A 380 24.251 -25.997 124.624 1.00 0.00 H +ATOM 6048 HE22 GLN A 380 23.694 -24.589 127.814 1.00 0.00 H +ATOM 6049 HE21 GLN A 380 24.867 -25.069 126.609 1.00 0.00 H +ATOM 6050 N LEU A 381 20.362 -26.866 121.374 1.00 23.74 N +ATOM 6051 CA LEU A 381 19.367 -27.761 120.790 1.00 25.70 C +ATOM 6052 C LEU A 381 19.847 -28.320 119.457 1.00 28.04 C +ATOM 6053 O LEU A 381 19.727 -29.522 119.192 1.00 30.57 O +ATOM 6054 CB LEU A 381 18.039 -27.023 120.620 1.00 23.85 C +ATOM 6055 CG LEU A 381 17.011 -27.671 119.690 1.00 29.87 C +ATOM 6056 CD1 LEU A 381 16.548 -29.014 120.241 1.00 31.55 C +ATOM 6057 CD2 LEU A 381 15.828 -26.742 119.461 1.00 27.90 C +ATOM 6058 H LEU A 381 20.135 -25.890 121.497 1.00 0.00 H +ATOM 6059 HA LEU A 381 19.211 -28.594 121.475 1.00 0.00 H +ATOM 6060 HB3 LEU A 381 18.235 -26.004 120.285 1.00 0.00 H +ATOM 6061 HB2 LEU A 381 17.588 -26.866 121.600 1.00 0.00 H +ATOM 6062 HG LEU A 381 17.491 -27.849 118.728 1.00 0.00 H +ATOM 6063 HD11 LEU A 381 15.818 -29.454 119.562 1.00 0.00 H +ATOM 6064 HD12 LEU A 381 17.404 -29.683 120.336 1.00 0.00 H +ATOM 6065 HD13 LEU A 381 16.091 -28.868 121.220 1.00 0.00 H +ATOM 6066 HD21 LEU A 381 15.110 -27.224 118.797 1.00 0.00 H +ATOM 6067 HD22 LEU A 381 15.349 -26.521 120.415 1.00 0.00 H +ATOM 6068 HD23 LEU A 381 16.176 -25.814 119.007 1.00 0.00 H +ATOM 6069 N HIS A 382 20.401 -27.455 118.604 1.00 26.98 N +ATOM 6070 CA HIS A 382 20.901 -27.872 117.300 1.00 31.25 C +ATOM 6071 C HIS A 382 22.054 -28.864 117.406 1.00 33.72 C +ATOM 6072 O HIS A 382 22.381 -29.520 116.410 1.00 37.88 O +ATOM 6073 CB HIS A 382 21.312 -26.626 116.500 1.00 33.24 C +ATOM 6074 CG HIS A 382 22.102 -26.922 115.262 1.00 38.23 C +ATOM 6075 ND1 HIS A 382 23.455 -27.186 115.286 1.00 39.28 N +ATOM 6076 CD2 HIS A 382 21.727 -27.000 113.963 1.00 45.12 C +ATOM 6077 CE1 HIS A 382 23.878 -27.414 114.056 1.00 41.27 C +ATOM 6078 NE2 HIS A 382 22.850 -27.305 113.234 1.00 40.89 N +ATOM 6079 H HIS A 382 20.483 -26.480 118.855 1.00 0.00 H +ATOM 6080 HA HIS A 382 20.085 -28.360 116.767 1.00 0.00 H +ATOM 6081 HB3 HIS A 382 21.884 -25.957 117.142 1.00 0.00 H +ATOM 6082 HB2 HIS A 382 20.421 -26.058 116.233 1.00 0.00 H +ATOM 6083 HD1 HIS A 382 23.955 -27.181 116.164 1.00 0.00 H +ATOM 6084 HD2 HIS A 382 20.697 -26.830 113.687 1.00 0.00 H +ATOM 6085 HE1 HIS A 382 24.918 -27.642 113.876 1.00 0.00 H +ATOM 6086 N GLN A 383 22.663 -29.007 118.584 1.00 30.20 N +ATOM 6087 CA GLN A 383 23.767 -29.936 118.786 1.00 33.94 C +ATOM 6088 C GLN A 383 23.396 -31.099 119.702 1.00 24.48 C +ATOM 6089 O GLN A 383 24.283 -31.805 120.191 1.00 28.74 O +ATOM 6090 CB GLN A 383 24.989 -29.195 119.330 1.00 26.75 C +ATOM 6091 CG GLN A 383 25.747 -28.419 118.265 1.00 30.89 C +ATOM 6092 CD GLN A 383 26.633 -27.336 118.846 1.00 37.15 C +ATOM 6093 OE1 GLN A 383 26.382 -26.145 118.655 1.00 31.14 O +ATOM 6094 NE2 GLN A 383 27.679 -27.743 119.555 1.00 34.51 N +ATOM 6095 H GLN A 383 22.362 -28.460 119.378 1.00 0.00 H +ATOM 6096 HA GLN A 383 24.035 -30.351 117.814 1.00 0.00 H +ATOM 6097 HB3 GLN A 383 25.662 -29.908 119.806 1.00 0.00 H +ATOM 6098 HB2 GLN A 383 24.676 -28.513 120.121 1.00 0.00 H +ATOM 6099 HG3 GLN A 383 25.037 -27.972 117.569 1.00 0.00 H +ATOM 6100 HG2 GLN A 383 26.355 -29.108 117.678 1.00 0.00 H +ATOM 6101 HE22 GLN A 383 28.305 -27.065 119.967 1.00 0.00 H +ATOM 6102 HE21 GLN A 383 27.849 -28.730 119.683 1.00 0.00 H +ATOM 6103 N GLY A 384 22.104 -31.313 119.947 1.00 18.94 N +ATOM 6104 CA GLY A 384 21.648 -32.483 120.669 1.00 26.93 C +ATOM 6105 C GLY A 384 21.753 -32.416 122.177 1.00 27.47 C +ATOM 6106 O GLY A 384 21.444 -33.411 122.844 1.00 28.29 O +ATOM 6107 H GLY A 384 21.413 -30.650 119.627 1.00 0.00 H +ATOM 6108 HA3 GLY A 384 22.187 -33.360 120.310 1.00 0.00 H +ATOM 6109 HA2 GLY A 384 20.617 -32.699 120.390 1.00 0.00 H +ATOM 6110 N MET A 385 22.177 -31.285 122.740 1.00 24.66 N +ATOM 6111 CA MET A 385 22.254 -31.123 124.193 1.00 25.03 C +ATOM 6112 C MET A 385 20.870 -30.748 124.725 1.00 28.06 C +ATOM 6113 O MET A 385 20.611 -29.629 125.171 1.00 31.12 O +ATOM 6114 CB MET A 385 23.306 -30.084 124.552 1.00 24.11 C +ATOM 6115 CG MET A 385 24.446 -30.017 123.553 1.00 18.87 C +ATOM 6116 SD MET A 385 25.642 -28.722 123.914 1.00 23.64 S +ATOM 6117 CE MET A 385 26.805 -28.976 122.576 1.00 23.72 C +ATOM 6118 H MET A 385 22.457 -30.507 122.161 1.00 0.00 H +ATOM 6119 HA MET A 385 22.546 -32.077 124.632 1.00 0.00 H +ATOM 6120 HB3 MET A 385 23.705 -30.301 125.543 1.00 0.00 H +ATOM 6121 HB2 MET A 385 22.835 -29.104 124.630 1.00 0.00 H +ATOM 6122 HG3 MET A 385 24.041 -29.867 122.552 1.00 0.00 H +ATOM 6123 HG2 MET A 385 24.955 -30.980 123.520 1.00 0.00 H +ATOM 6124 HE1 MET A 385 27.614 -28.249 122.654 1.00 0.00 H +ATOM 6125 HE2 MET A 385 27.216 -29.984 122.637 1.00 0.00 H +ATOM 6126 HE3 MET A 385 26.294 -28.850 121.621 1.00 0.00 H +ATOM 6127 N PHE A 386 19.969 -31.738 124.683 1.00 23.36 N +ATOM 6128 CA PHE A 386 18.552 -31.456 124.912 1.00 22.27 C +ATOM 6129 C PHE A 386 18.257 -30.990 126.333 1.00 25.68 C +ATOM 6130 O PHE A 386 17.565 -29.968 126.489 1.00 29.34 O +ATOM 6131 CB PHE A 386 17.713 -32.678 124.527 1.00 22.26 C +ATOM 6132 CG PHE A 386 17.871 -33.091 123.092 1.00 22.88 C +ATOM 6133 CD1 PHE A 386 17.629 -32.190 122.068 1.00 26.62 C +ATOM 6134 CD2 PHE A 386 18.266 -34.378 122.767 1.00 29.47 C +ATOM 6135 CE1 PHE A 386 17.775 -32.567 120.747 1.00 27.71 C +ATOM 6136 CE2 PHE A 386 18.413 -34.761 121.447 1.00 29.94 C +ATOM 6137 CZ PHE A 386 18.168 -33.854 120.436 1.00 26.29 C +ATOM 6138 H PHE A 386 20.267 -32.684 124.493 1.00 0.00 H +ATOM 6139 HA PHE A 386 18.270 -30.645 124.240 1.00 0.00 H +ATOM 6140 HB3 PHE A 386 16.662 -32.474 124.731 1.00 0.00 H +ATOM 6141 HB2 PHE A 386 17.974 -33.515 125.175 1.00 0.00 H +ATOM 6142 HD1 PHE A 386 17.323 -31.180 122.298 1.00 0.00 H +ATOM 6143 HD2 PHE A 386 18.463 -35.096 123.549 1.00 0.00 H +ATOM 6144 HE1 PHE A 386 17.582 -31.855 119.958 1.00 0.00 H +ATOM 6145 HE2 PHE A 386 18.719 -35.769 121.208 1.00 0.00 H +ATOM 6146 HZ PHE A 386 18.283 -34.149 119.403 1.00 0.00 H +ATOM 6147 N PRO A 387 18.712 -31.667 127.399 1.00 22.59 N +ATOM 6148 CA PRO A 387 18.422 -31.142 128.746 1.00 20.89 C +ATOM 6149 C PRO A 387 19.005 -29.763 128.984 1.00 22.13 C +ATOM 6150 O PRO A 387 18.349 -28.911 129.597 1.00 22.01 O +ATOM 6151 CB PRO A 387 19.051 -32.195 129.671 1.00 23.63 C +ATOM 6152 CG PRO A 387 19.071 -33.438 128.854 1.00 17.37 C +ATOM 6153 CD PRO A 387 19.417 -32.959 127.477 1.00 24.14 C +ATOM 6154 HA PRO A 387 17.344 -31.115 128.903 1.00 0.00 H +ATOM 6155 HB3 PRO A 387 18.408 -32.344 130.538 1.00 0.00 H +ATOM 6156 HB2 PRO A 387 20.074 -31.902 129.908 1.00 0.00 H +ATOM 6157 HG3 PRO A 387 18.074 -33.878 128.843 1.00 0.00 H +ATOM 6158 HG2 PRO A 387 19.862 -34.095 129.216 1.00 0.00 H +ATOM 6159 HD2 PRO A 387 20.491 -32.786 127.416 1.00 0.00 H +ATOM 6160 HD3 PRO A 387 18.994 -33.644 126.742 1.00 0.00 H +ATOM 6161 N GLN A 388 20.227 -29.518 128.509 1.00 24.39 N +ATOM 6162 CA GLN A 388 20.825 -28.197 128.655 1.00 24.96 C +ATOM 6163 C GLN A 388 20.069 -27.161 127.834 1.00 27.98 C +ATOM 6164 O GLN A 388 19.875 -26.024 128.282 1.00 25.86 O +ATOM 6165 CB GLN A 388 22.300 -28.229 128.246 1.00 20.94 C +ATOM 6166 CG GLN A 388 23.185 -29.200 129.029 1.00 25.36 C +ATOM 6167 CD GLN A 388 22.900 -30.661 128.721 1.00 30.95 C +ATOM 6168 OE1 GLN A 388 22.716 -31.041 127.563 1.00 25.62 O +ATOM 6169 NE2 GLN A 388 22.859 -31.486 129.759 1.00 37.71 N +ATOM 6170 H GLN A 388 20.744 -30.250 128.044 1.00 0.00 H +ATOM 6171 HA GLN A 388 20.767 -27.910 129.705 1.00 0.00 H +ATOM 6172 HB3 GLN A 388 22.716 -27.224 128.319 1.00 0.00 H +ATOM 6173 HB2 GLN A 388 22.374 -28.453 127.182 1.00 0.00 H +ATOM 6174 HG3 GLN A 388 23.058 -29.024 130.097 1.00 0.00 H +ATOM 6175 HG2 GLN A 388 24.233 -28.984 128.820 1.00 0.00 H +ATOM 6176 HE22 GLN A 388 22.674 -32.469 129.616 1.00 0.00 H +ATOM 6177 HE21 GLN A 388 23.013 -31.132 130.692 1.00 0.00 H +ATOM 6178 N ALA A 389 19.632 -27.536 126.630 1.00 27.18 N +ATOM 6179 CA ALA A 389 18.902 -26.600 125.780 1.00 23.51 C +ATOM 6180 C ALA A 389 17.558 -26.233 126.396 1.00 23.30 C +ATOM 6181 O ALA A 389 17.177 -25.057 126.423 1.00 24.22 O +ATOM 6182 CB ALA A 389 18.709 -27.197 124.385 1.00 19.95 C +ATOM 6183 H ALA A 389 19.805 -28.475 126.300 1.00 0.00 H +ATOM 6184 HA ALA A 389 19.495 -25.690 125.684 1.00 0.00 H +ATOM 6185 HB1 ALA A 389 18.163 -26.491 123.759 1.00 0.00 H +ATOM 6186 HB2 ALA A 389 19.682 -27.401 123.939 1.00 0.00 H +ATOM 6187 HB3 ALA A 389 18.144 -28.126 124.462 1.00 0.00 H +ATOM 6188 N MET A 390 16.826 -27.232 126.895 1.00 21.49 N +ATOM 6189 CA MET A 390 15.513 -26.975 127.481 1.00 21.21 C +ATOM 6190 C MET A 390 15.600 -25.994 128.640 1.00 22.04 C +ATOM 6191 O MET A 390 14.762 -25.092 128.764 1.00 26.20 O +ATOM 6192 CB MET A 390 14.883 -28.284 127.950 1.00 29.80 C +ATOM 6193 CG MET A 390 13.493 -28.113 128.529 1.00 30.22 C +ATOM 6194 SD MET A 390 12.346 -27.516 127.282 1.00 43.79 S +ATOM 6195 CE MET A 390 12.178 -29.008 126.332 1.00 27.66 C +ATOM 6196 H MET A 390 17.179 -28.178 126.870 1.00 0.00 H +ATOM 6197 HA MET A 390 14.873 -26.542 126.712 1.00 0.00 H +ATOM 6198 HB3 MET A 390 15.530 -28.751 128.693 1.00 0.00 H +ATOM 6199 HB2 MET A 390 14.844 -28.986 127.117 1.00 0.00 H +ATOM 6200 HG3 MET A 390 13.529 -27.405 129.357 1.00 0.00 H +ATOM 6201 HG2 MET A 390 13.142 -29.069 128.917 1.00 0.00 H +ATOM 6202 HE1 MET A 390 11.495 -28.835 125.501 1.00 0.00 H +ATOM 6203 HE2 MET A 390 13.153 -29.305 125.945 1.00 0.00 H +ATOM 6204 HE3 MET A 390 11.783 -29.801 126.967 1.00 0.00 H +ATOM 6205 N LYS A 391 16.600 -26.164 129.506 1.00 24.16 N +ATOM 6206 CA LYS A 391 16.746 -25.281 130.657 1.00 22.69 C +ATOM 6207 C LYS A 391 16.905 -23.830 130.222 1.00 21.44 C +ATOM 6208 O LYS A 391 16.293 -22.928 130.805 1.00 21.65 O +ATOM 6209 CB LYS A 391 17.939 -25.729 131.502 1.00 23.07 C +ATOM 6210 CG LYS A 391 18.348 -24.755 132.591 1.00 24.99 C +ATOM 6211 CD LYS A 391 18.841 -25.500 133.822 1.00 24.58 C +ATOM 6212 CE LYS A 391 18.834 -24.609 135.054 1.00 28.59 C +ATOM 6213 NZ LYS A 391 19.006 -23.171 134.703 1.00 26.68 N1+ +ATOM 6214 H LYS A 391 17.266 -26.911 129.368 1.00 0.00 H +ATOM 6215 HA LYS A 391 15.845 -25.360 131.266 1.00 0.00 H +ATOM 6216 HB3 LYS A 391 18.791 -25.920 130.850 1.00 0.00 H +ATOM 6217 HB2 LYS A 391 17.721 -26.699 131.949 1.00 0.00 H +ATOM 6218 HG3 LYS A 391 17.495 -24.133 132.861 1.00 0.00 H +ATOM 6219 HG2 LYS A 391 19.140 -24.106 132.218 1.00 0.00 H +ATOM 6220 HD3 LYS A 391 19.853 -25.865 133.644 1.00 0.00 H +ATOM 6221 HD2 LYS A 391 18.206 -26.368 133.999 1.00 0.00 H +ATOM 6222 HE3 LYS A 391 19.634 -24.916 135.728 1.00 0.00 H +ATOM 6223 HE2 LYS A 391 17.895 -24.741 135.592 1.00 0.00 H +ATOM 6224 HZ1 LYS A 391 18.996 -22.615 135.546 1.00 0.00 H +ATOM 6225 HZ2 LYS A 391 19.887 -23.043 134.227 1.00 0.00 H +ATOM 6226 HZ3 LYS A 391 18.252 -22.879 134.098 1.00 0.00 H +ATOM 6227 N ASN A 392 17.708 -23.588 129.184 1.00 17.00 N +ATOM 6228 CA ASN A 392 17.909 -22.227 128.701 1.00 21.88 C +ATOM 6229 C ASN A 392 16.708 -21.731 127.905 1.00 18.77 C +ATOM 6230 O ASN A 392 16.310 -20.569 128.042 1.00 18.04 O +ATOM 6231 CB ASN A 392 19.182 -22.153 127.856 1.00 17.57 C +ATOM 6232 CG ASN A 392 20.440 -22.089 128.703 1.00 22.11 C +ATOM 6233 OD1 ASN A 392 20.545 -21.274 129.620 1.00 24.78 O +ATOM 6234 ND2 ASN A 392 21.402 -22.953 128.399 1.00 19.63 N +ATOM 6235 H ASN A 392 18.184 -24.351 128.725 1.00 0.00 H +ATOM 6236 HA ASN A 392 18.037 -21.575 129.565 1.00 0.00 H +ATOM 6237 HB3 ASN A 392 19.136 -21.278 127.208 1.00 0.00 H +ATOM 6238 HB2 ASN A 392 19.232 -23.021 127.199 1.00 0.00 H +ATOM 6239 HD22 ASN A 392 22.262 -22.958 128.928 1.00 0.00 H +ATOM 6240 HD21 ASN A 392 21.273 -23.605 127.639 1.00 0.00 H +ATOM 6241 N LEU A 393 16.116 -22.592 127.074 1.00 15.41 N +ATOM 6242 CA LEU A 393 14.944 -22.186 126.304 1.00 16.94 C +ATOM 6243 C LEU A 393 13.794 -21.782 127.220 1.00 21.06 C +ATOM 6244 O LEU A 393 13.079 -20.813 126.939 1.00 19.44 O +ATOM 6245 CB LEU A 393 14.516 -23.312 125.363 1.00 15.33 C +ATOM 6246 CG LEU A 393 15.438 -23.584 124.173 1.00 21.10 C +ATOM 6247 CD1 LEU A 393 14.847 -24.656 123.269 1.00 18.77 C +ATOM 6248 CD2 LEU A 393 15.709 -22.305 123.393 1.00 15.47 C +ATOM 6249 H LEU A 393 16.479 -23.529 126.976 1.00 0.00 H +ATOM 6250 HA LEU A 393 15.217 -21.322 125.699 1.00 0.00 H +ATOM 6251 HB3 LEU A 393 13.508 -23.112 124.999 1.00 0.00 H +ATOM 6252 HB2 LEU A 393 14.388 -24.230 125.936 1.00 0.00 H +ATOM 6253 HG LEU A 393 16.388 -23.953 124.559 1.00 0.00 H +ATOM 6254 HD11 LEU A 393 15.518 -24.834 122.429 1.00 0.00 H +ATOM 6255 HD12 LEU A 393 14.720 -25.579 123.834 1.00 0.00 H +ATOM 6256 HD13 LEU A 393 13.879 -24.323 122.895 1.00 0.00 H +ATOM 6257 HD21 LEU A 393 16.367 -22.524 122.552 1.00 0.00 H +ATOM 6258 HD22 LEU A 393 14.768 -21.899 123.022 1.00 0.00 H +ATOM 6259 HD23 LEU A 393 16.186 -21.575 124.046 1.00 0.00 H +ATOM 6260 N ARG A 394 13.606 -22.508 128.325 1.00 17.14 N +ATOM 6261 CA ARG A 394 12.578 -22.127 129.289 1.00 20.78 C +ATOM 6262 C ARG A 394 12.948 -20.835 130.005 1.00 19.31 C +ATOM 6263 O ARG A 394 12.088 -19.974 130.227 1.00 22.98 O +ATOM 6264 CB ARG A 394 12.359 -23.252 130.299 1.00 18.27 C +ATOM 6265 CG ARG A 394 11.695 -24.487 129.722 1.00 26.13 C +ATOM 6266 CD ARG A 394 10.963 -25.265 130.799 1.00 35.02 C +ATOM 6267 NE ARG A 394 10.685 -26.637 130.390 1.00 37.42 N +ATOM 6268 CZ ARG A 394 9.646 -27.346 130.817 1.00 46.18 C +ATOM 6269 NH1 ARG A 394 8.781 -26.811 131.668 1.00 46.87 N +ATOM 6270 NH2 ARG A 394 9.470 -28.590 130.393 1.00 41.30 N1+ +ATOM 6271 H ARG A 394 14.176 -23.324 128.496 1.00 0.00 H +ATOM 6272 HA ARG A 394 11.645 -21.965 128.749 1.00 0.00 H +ATOM 6273 HB3 ARG A 394 11.764 -22.878 131.133 1.00 0.00 H +ATOM 6274 HB2 ARG A 394 13.315 -23.530 130.743 1.00 0.00 H +ATOM 6275 HG3 ARG A 394 12.451 -25.125 129.264 1.00 0.00 H +ATOM 6276 HG2 ARG A 394 10.990 -24.191 128.946 1.00 0.00 H +ATOM 6277 HD3 ARG A 394 10.026 -24.761 131.037 1.00 0.00 H +ATOM 6278 HD2 ARG A 394 11.561 -25.272 131.710 1.00 0.00 H +ATOM 6279 HE ARG A 394 11.342 -27.045 129.741 1.00 0.00 H +ATOM 6280 HH12 ARG A 394 7.991 -27.351 131.992 1.00 0.00 H +ATOM 6281 HH11 ARG A 394 8.912 -25.863 131.992 1.00 0.00 H +ATOM 6282 HH22 ARG A 394 8.679 -29.127 130.719 1.00 0.00 H +ATOM 6283 HH21 ARG A 394 10.127 -29.000 129.744 1.00 0.00 H +ATOM 6284 N LEU A 395 14.221 -20.686 130.379 1.00 18.71 N +ATOM 6285 CA LEU A 395 14.668 -19.447 131.006 1.00 17.22 C +ATOM 6286 C LEU A 395 14.530 -18.272 130.048 1.00 15.68 C +ATOM 6287 O LEU A 395 14.180 -17.160 130.461 1.00 14.81 O +ATOM 6288 CB LEU A 395 16.114 -19.594 131.485 1.00 18.76 C +ATOM 6289 CG LEU A 395 16.858 -18.329 131.917 1.00 19.11 C +ATOM 6290 CD1 LEU A 395 16.279 -17.790 133.213 1.00 11.09 C +ATOM 6291 CD2 LEU A 395 18.347 -18.606 132.068 1.00 16.95 C +ATOM 6292 H LEU A 395 14.882 -21.434 130.228 1.00 0.00 H +ATOM 6293 HA LEU A 395 14.038 -19.256 131.874 1.00 0.00 H +ATOM 6294 HB3 LEU A 395 16.694 -20.105 130.717 1.00 0.00 H +ATOM 6295 HB2 LEU A 395 16.150 -20.323 132.294 1.00 0.00 H +ATOM 6296 HG LEU A 395 16.727 -17.573 131.143 1.00 0.00 H +ATOM 6297 HD11 LEU A 395 16.819 -16.890 133.506 1.00 0.00 H +ATOM 6298 HD12 LEU A 395 15.226 -17.550 133.069 1.00 0.00 H +ATOM 6299 HD13 LEU A 395 16.376 -18.543 133.995 1.00 0.00 H +ATOM 6300 HD21 LEU A 395 18.857 -17.693 132.376 1.00 0.00 H +ATOM 6301 HD22 LEU A 395 18.499 -19.378 132.822 1.00 0.00 H +ATOM 6302 HD23 LEU A 395 18.753 -18.945 131.115 1.00 0.00 H +ATOM 6303 N ALA A 396 14.797 -18.501 128.759 1.00 18.70 N +ATOM 6304 CA ALA A 396 14.547 -17.466 127.762 1.00 18.67 C +ATOM 6305 C ALA A 396 13.065 -17.124 127.694 1.00 20.81 C +ATOM 6306 O ALA A 396 12.697 -15.953 127.548 1.00 15.25 O +ATOM 6307 CB ALA A 396 15.059 -17.916 126.393 1.00 14.40 C +ATOM 6308 H ALA A 396 15.173 -19.393 128.472 1.00 0.00 H +ATOM 6309 HA ALA A 396 15.093 -16.569 128.054 1.00 0.00 H +ATOM 6310 HB1 ALA A 396 14.866 -17.135 125.658 1.00 0.00 H +ATOM 6311 HB2 ALA A 396 16.131 -18.105 126.450 1.00 0.00 H +ATOM 6312 HB3 ALA A 396 14.545 -18.830 126.095 1.00 0.00 H +ATOM 6313 N PHE A 397 12.198 -18.133 127.807 1.00 16.12 N +ATOM 6314 CA PHE A 397 10.765 -17.867 127.823 1.00 19.76 C +ATOM 6315 C PHE A 397 10.347 -17.142 129.094 1.00 19.53 C +ATOM 6316 O PHE A 397 9.431 -16.314 129.058 1.00 21.86 O +ATOM 6317 CB PHE A 397 9.978 -19.168 127.673 1.00 21.01 C +ATOM 6318 CG PHE A 397 8.515 -18.961 127.396 1.00 22.42 C +ATOM 6319 CD1 PHE A 397 8.079 -18.616 126.127 1.00 21.19 C +ATOM 6320 CD2 PHE A 397 7.576 -19.104 128.405 1.00 27.32 C +ATOM 6321 CE1 PHE A 397 6.735 -18.421 125.869 1.00 25.66 C +ATOM 6322 CE2 PHE A 397 6.230 -18.911 128.153 1.00 18.46 C +ATOM 6323 CZ PHE A 397 5.809 -18.568 126.883 1.00 20.38 C +ATOM 6324 H PHE A 397 12.535 -19.082 127.882 1.00 0.00 H +ATOM 6325 HA PHE A 397 10.529 -17.227 126.973 1.00 0.00 H +ATOM 6326 HB3 PHE A 397 10.094 -19.767 128.576 1.00 0.00 H +ATOM 6327 HB2 PHE A 397 10.416 -19.766 126.874 1.00 0.00 H +ATOM 6328 HD1 PHE A 397 8.792 -18.496 125.325 1.00 0.00 H +ATOM 6329 HD2 PHE A 397 7.892 -19.369 129.403 1.00 0.00 H +ATOM 6330 HE1 PHE A 397 6.409 -18.154 124.875 1.00 0.00 H +ATOM 6331 HE2 PHE A 397 5.509 -19.028 128.949 1.00 0.00 H +ATOM 6332 HZ PHE A 397 4.759 -18.415 126.682 1.00 0.00 H +ATOM 6333 N ASP A 398 11.001 -17.431 130.220 1.00 16.37 N +ATOM 6334 CA ASP A 398 10.660 -16.740 131.458 1.00 20.97 C +ATOM 6335 C ASP A 398 11.058 -15.270 131.410 1.00 20.41 C +ATOM 6336 O ASP A 398 10.412 -14.434 132.053 1.00 19.21 O +ATOM 6337 CB ASP A 398 11.317 -17.434 132.651 1.00 25.85 C +ATOM 6338 CG ASP A 398 10.631 -18.736 133.014 1.00 33.07 C +ATOM 6339 OD1 ASP A 398 9.452 -18.911 132.639 1.00 31.29 O +ATOM 6340 OD2 ASP A 398 11.268 -19.583 133.676 1.00 33.73 O1- +ATOM 6341 H ASP A 398 11.732 -18.128 130.215 1.00 0.00 H +ATOM 6342 HA ASP A 398 9.579 -16.794 131.589 1.00 0.00 H +ATOM 6343 HB3 ASP A 398 11.304 -16.765 133.512 1.00 0.00 H +ATOM 6344 HB2 ASP A 398 12.366 -17.628 132.425 1.00 0.00 H +ATOM 6345 N ILE A 399 12.108 -14.936 130.661 1.00 17.17 N +ATOM 6346 CA ILE A 399 12.489 -13.538 130.495 1.00 16.79 C +ATOM 6347 C ILE A 399 11.688 -12.896 129.372 1.00 12.13 C +ATOM 6348 O ILE A 399 11.067 -11.843 129.552 1.00 12.73 O +ATOM 6349 CB ILE A 399 14.002 -13.418 130.233 1.00 17.71 C +ATOM 6350 CG1 ILE A 399 14.805 -13.788 131.479 1.00 14.27 C +ATOM 6351 CG2 ILE A 399 14.352 -12.009 129.772 1.00 12.83 C +ATOM 6352 CD1 ILE A 399 16.146 -14.414 131.165 1.00 8.10 C +ATOM 6353 H ILE A 399 12.649 -15.654 130.201 1.00 0.00 H +ATOM 6354 HA ILE A 399 12.261 -13.010 131.421 1.00 0.00 H +ATOM 6355 HB ILE A 399 14.267 -14.114 129.437 1.00 0.00 H +ATOM 6356 HG13 ILE A 399 14.222 -14.472 132.095 1.00 0.00 H +ATOM 6357 HG12 ILE A 399 14.955 -12.898 132.090 1.00 0.00 H +ATOM 6358 HG21 ILE A 399 15.425 -11.941 129.591 1.00 0.00 H +ATOM 6359 HG22 ILE A 399 13.814 -11.783 128.851 1.00 0.00 H +ATOM 6360 HG23 ILE A 399 14.068 -11.293 130.543 1.00 0.00 H +ATOM 6361 HD11 ILE A 399 16.663 -14.652 132.095 1.00 0.00 H +ATOM 6362 HD12 ILE A 399 15.995 -15.327 130.590 1.00 0.00 H +ATOM 6363 HD13 ILE A 399 16.747 -13.714 130.584 1.00 0.00 H +ATOM 6364 N MET A 400 11.687 -13.528 128.196 1.00 19.71 N +ATOM 6365 CA MET A 400 11.130 -12.892 127.012 1.00 15.76 C +ATOM 6366 C MET A 400 9.613 -12.802 127.045 1.00 19.48 C +ATOM 6367 O MET A 400 9.055 -11.938 126.371 1.00 19.90 O +ATOM 6368 CB MET A 400 11.579 -13.626 125.749 1.00 20.12 C +ATOM 6369 CG MET A 400 13.053 -13.445 125.433 1.00 12.06 C +ATOM 6370 SD MET A 400 13.558 -14.395 123.993 1.00 15.41 S +ATOM 6371 CE MET A 400 12.423 -13.750 122.767 1.00 18.52 C +ATOM 6372 H MET A 400 12.076 -14.457 128.122 1.00 0.00 H +ATOM 6373 HA MET A 400 11.523 -11.876 126.964 1.00 0.00 H +ATOM 6374 HB3 MET A 400 10.983 -13.286 124.902 1.00 0.00 H +ATOM 6375 HB2 MET A 400 11.359 -14.689 125.851 1.00 0.00 H +ATOM 6376 HG3 MET A 400 13.648 -13.748 126.294 1.00 0.00 H +ATOM 6377 HG2 MET A 400 13.260 -12.389 125.261 1.00 0.00 H +ATOM 6378 HE1 MET A 400 12.605 -14.239 121.810 1.00 0.00 H +ATOM 6379 HE2 MET A 400 11.398 -13.942 123.083 1.00 0.00 H +ATOM 6380 HE3 MET A 400 12.574 -12.676 122.660 1.00 0.00 H +ATOM 6381 N ARG A 401 8.928 -13.659 127.804 1.00 18.40 N +ATOM 6382 CA ARG A 401 7.483 -13.498 127.926 1.00 23.52 C +ATOM 6383 C ARG A 401 7.125 -12.197 128.637 1.00 22.62 C +ATOM 6384 O ARG A 401 6.046 -11.644 128.394 1.00 22.20 O +ATOM 6385 CB ARG A 401 6.876 -14.713 128.639 1.00 20.24 C +ATOM 6386 CG ARG A 401 5.657 -14.441 129.502 1.00 23.92 C +ATOM 6387 CD ARG A 401 5.353 -15.625 130.400 1.00 41.35 C +ATOM 6388 NE ARG A 401 6.519 -16.041 131.170 1.00 33.90 N +ATOM 6389 CZ ARG A 401 6.833 -15.547 132.362 1.00 41.48 C +ATOM 6390 NH1 ARG A 401 6.065 -14.618 132.915 1.00 46.05 N +ATOM 6391 NH2 ARG A 401 7.909 -15.982 133.002 1.00 35.80 N1+ +ATOM 6392 H ARG A 401 9.410 -14.406 128.284 1.00 0.00 H +ATOM 6393 HA ARG A 401 7.065 -13.456 126.920 1.00 0.00 H +ATOM 6394 HB3 ARG A 401 7.644 -15.196 129.243 1.00 0.00 H +ATOM 6395 HB2 ARG A 401 6.631 -15.477 127.901 1.00 0.00 H +ATOM 6396 HG3 ARG A 401 4.797 -14.240 128.863 1.00 0.00 H +ATOM 6397 HG2 ARG A 401 5.836 -13.557 130.115 1.00 0.00 H +ATOM 6398 HD3 ARG A 401 5.003 -16.460 129.793 1.00 0.00 H +ATOM 6399 HD2 ARG A 401 4.543 -15.365 131.081 1.00 0.00 H +ATOM 6400 HE ARG A 401 7.103 -16.748 130.746 1.00 0.00 H +ATOM 6401 HH12 ARG A 401 6.302 -14.241 133.822 1.00 0.00 H +ATOM 6402 HH11 ARG A 401 5.243 -14.288 132.430 1.00 0.00 H +ATOM 6403 HH22 ARG A 401 8.145 -15.604 133.908 1.00 0.00 H +ATOM 6404 HH21 ARG A 401 8.493 -16.692 132.583 1.00 0.00 H +ATOM 6405 N VAL A 402 8.023 -11.677 129.469 1.00 17.16 N +ATOM 6406 CA VAL A 402 7.821 -10.376 130.098 1.00 14.26 C +ATOM 6407 C VAL A 402 8.321 -9.243 129.207 1.00 17.40 C +ATOM 6408 O VAL A 402 7.652 -8.216 129.067 1.00 13.11 O +ATOM 6409 CB VAL A 402 8.508 -10.355 131.479 1.00 17.60 C +ATOM 6410 CG1 VAL A 402 8.767 -8.925 131.934 1.00 13.48 C +ATOM 6411 CG2 VAL A 402 7.664 -11.101 132.503 1.00 19.52 C +ATOM 6412 H VAL A 402 8.870 -12.185 129.679 1.00 0.00 H +ATOM 6413 HA VAL A 402 6.751 -10.238 130.251 1.00 0.00 H +ATOM 6414 HB VAL A 402 9.468 -10.865 131.391 1.00 0.00 H +ATOM 6415 HG11 VAL A 402 9.252 -8.936 132.910 1.00 0.00 H +ATOM 6416 HG12 VAL A 402 9.414 -8.425 131.213 1.00 0.00 H +ATOM 6417 HG13 VAL A 402 7.821 -8.389 132.005 1.00 0.00 H +ATOM 6418 HG21 VAL A 402 8.162 -11.077 133.472 1.00 0.00 H +ATOM 6419 HG22 VAL A 402 6.687 -10.625 132.586 1.00 0.00 H +ATOM 6420 HG23 VAL A 402 7.537 -12.136 132.186 1.00 0.00 H +ATOM 6421 N THR A 403 9.489 -9.412 128.584 1.00 13.85 N +ATOM 6422 CA THR A 403 10.093 -8.361 127.773 1.00 15.69 C +ATOM 6423 C THR A 403 9.527 -8.331 126.356 1.00 18.90 C +ATOM 6424 O THR A 403 9.164 -7.264 125.852 1.00 20.13 O +ATOM 6425 CB THR A 403 11.615 -8.536 127.732 1.00 15.14 C +ATOM 6426 OG1 THR A 403 11.941 -9.773 127.088 1.00 12.56 O +ATOM 6427 CG2 THR A 403 12.183 -8.539 129.142 1.00 11.69 C +ATOM 6428 H THR A 403 9.983 -10.289 128.666 1.00 0.00 H +ATOM 6429 HA THR A 403 9.875 -7.403 128.245 1.00 0.00 H +ATOM 6430 HB THR A 403 12.055 -7.712 127.170 1.00 0.00 H +ATOM 6431 HG1 THR A 403 12.895 -9.880 127.064 1.00 0.00 H +ATOM 6432 HG21 THR A 403 13.265 -8.664 129.098 1.00 0.00 H +ATOM 6433 HG22 THR A 403 11.946 -7.594 129.632 1.00 0.00 H +ATOM 6434 HG23 THR A 403 11.745 -9.361 129.709 1.00 0.00 H +ATOM 6435 N HIS A 404 9.462 -9.483 125.700 1.00 18.76 N +ATOM 6436 CA HIS A 404 8.790 -9.613 124.417 1.00 15.24 C +ATOM 6437 C HIS A 404 7.346 -10.032 124.651 1.00 22.28 C +ATOM 6438 O HIS A 404 6.979 -10.533 125.717 1.00 33.40 O +ATOM 6439 CB HIS A 404 9.500 -10.630 123.519 1.00 14.81 C +ATOM 6440 CG HIS A 404 10.910 -10.256 123.183 1.00 14.98 C +ATOM 6441 ND1 HIS A 404 11.864 -10.006 124.146 1.00 14.14 N +ATOM 6442 CD2 HIS A 404 11.529 -10.092 121.989 1.00 11.98 C +ATOM 6443 CE1 HIS A 404 13.008 -9.702 123.560 1.00 14.74 C +ATOM 6444 NE2 HIS A 404 12.832 -9.749 122.252 1.00 14.24 N +ATOM 6445 H HIS A 404 9.889 -10.311 126.090 1.00 0.00 H +ATOM 6446 HA HIS A 404 8.796 -8.643 123.919 1.00 0.00 H +ATOM 6447 HB3 HIS A 404 8.931 -10.759 122.598 1.00 0.00 H +ATOM 6448 HB2 HIS A 404 9.490 -11.607 124.002 1.00 0.00 H +ATOM 6449 HD1 HIS A 404 11.623 -10.072 125.125 1.00 0.00 H +ATOM 6450 HD2 HIS A 404 10.979 -10.236 121.071 1.00 0.00 H +ATOM 6451 HE1 HIS A 404 13.877 -9.471 124.159 1.00 0.00 H +ATOM 6452 N GLY A 405 6.522 -9.814 123.652 1.00 29.51 N +ATOM 6453 CA GLY A 405 5.104 -10.002 123.813 1.00 34.28 C +ATOM 6454 C GLY A 405 4.560 -11.223 123.111 1.00 27.85 C +ATOM 6455 O GLY A 405 5.212 -11.834 122.266 1.00 19.56 O +ATOM 6456 H GLY A 405 6.881 -9.511 122.758 1.00 0.00 H +ATOM 6457 HA3 GLY A 405 4.579 -9.116 123.456 1.00 0.00 H +ATOM 6458 HA2 GLY A 405 4.865 -10.060 124.875 1.00 0.00 H +ATOM 6459 N ARG A 406 3.339 -11.575 123.506 1.00 33.10 N +ATOM 6460 CA ARG A 406 2.413 -12.292 122.645 1.00 27.58 C +ATOM 6461 C ARG A 406 2.481 -11.620 121.279 1.00 25.28 C +ATOM 6462 O ARG A 406 2.454 -12.275 120.234 1.00 23.17 O +ATOM 6463 CB ARG A 406 0.978 -12.230 123.195 1.00 29.07 C +ATOM 6464 CG ARG A 406 0.708 -12.741 124.639 1.00 52.45 C +ATOM 6465 CD ARG A 406 1.466 -11.998 125.761 1.00 43.13 C +ATOM 6466 NE ARG A 406 1.220 -10.555 125.827 1.00 42.07 N +ATOM 6467 CZ ARG A 406 0.053 -9.977 126.102 1.00 41.37 C +ATOM 6468 NH1 ARG A 406 -1.026 -10.701 126.367 1.00 48.10 N +ATOM 6469 NH2 ARG A 406 -0.027 -8.654 126.126 1.00 41.98 N1+ +ATOM 6470 H ARG A 406 3.023 -11.344 124.437 1.00 0.00 H +ATOM 6471 HA ARG A 406 2.726 -13.332 122.557 1.00 0.00 H +ATOM 6472 HB3 ARG A 406 0.310 -12.744 122.505 1.00 0.00 H +ATOM 6473 HB2 ARG A 406 0.605 -11.210 123.103 1.00 0.00 H +ATOM 6474 HG3 ARG A 406 0.937 -13.805 124.693 1.00 0.00 H +ATOM 6475 HG2 ARG A 406 -0.362 -12.702 124.841 1.00 0.00 H +ATOM 6476 HD3 ARG A 406 2.536 -12.177 125.653 1.00 0.00 H +ATOM 6477 HD2 ARG A 406 1.221 -12.450 126.722 1.00 0.00 H +ATOM 6478 HE ARG A 406 2.034 -9.986 125.641 1.00 0.00 H +ATOM 6479 HH12 ARG A 406 -1.903 -10.244 126.573 1.00 0.00 H +ATOM 6480 HH11 ARG A 406 -0.971 -11.709 126.362 1.00 0.00 H +ATOM 6481 HH22 ARG A 406 -0.908 -8.205 126.334 1.00 0.00 H +ATOM 6482 HH21 ARG A 406 0.793 -8.095 125.937 1.00 0.00 H +ATOM 6483 N GLU A 407 2.584 -10.293 121.304 1.00 23.60 N +ATOM 6484 CA GLU A 407 2.610 -9.445 120.125 1.00 21.11 C +ATOM 6485 C GLU A 407 3.951 -9.449 119.397 1.00 15.47 C +ATOM 6486 O GLU A 407 4.028 -8.920 118.283 1.00 19.56 O +ATOM 6487 CB GLU A 407 2.252 -8.022 120.544 1.00 19.07 C +ATOM 6488 CG GLU A 407 0.818 -7.873 121.052 1.00 24.40 C +ATOM 6489 CD GLU A 407 0.660 -8.222 122.526 1.00 27.87 C +ATOM 6490 OE1 GLU A 407 -0.465 -8.096 123.060 1.00 27.91 O +ATOM 6491 OE2 GLU A 407 1.656 -8.640 123.146 1.00 22.30 O1- +ATOM 6492 H GLU A 407 2.651 -9.808 122.188 1.00 0.00 H +ATOM 6493 HA GLU A 407 1.846 -9.799 119.433 1.00 0.00 H +ATOM 6494 HB3 GLU A 407 2.410 -7.347 119.703 1.00 0.00 H +ATOM 6495 HB2 GLU A 407 2.945 -7.687 121.315 1.00 0.00 H +ATOM 6496 HG3 GLU A 407 0.156 -8.503 120.458 1.00 0.00 H +ATOM 6497 HG2 GLU A 407 0.479 -6.851 120.884 1.00 0.00 H +ATOM 6498 N HIS A 408 5.003 -10.021 119.981 1.00 20.38 N +ATOM 6499 CA HIS A 408 6.312 -10.067 119.339 1.00 18.12 C +ATOM 6500 C HIS A 408 6.499 -11.409 118.641 1.00 23.81 C +ATOM 6501 O HIS A 408 6.254 -12.465 119.235 1.00 19.67 O +ATOM 6502 CB HIS A 408 7.441 -9.830 120.346 1.00 18.14 C +ATOM 6503 CG HIS A 408 8.728 -9.393 119.713 1.00 18.80 C +ATOM 6504 ND1 HIS A 408 9.483 -10.220 118.909 1.00 20.50 N +ATOM 6505 CD2 HIS A 408 9.387 -8.210 119.755 1.00 19.29 C +ATOM 6506 CE1 HIS A 408 10.553 -9.569 118.489 1.00 18.13 C +ATOM 6507 NE2 HIS A 408 10.519 -8.346 118.988 1.00 17.61 N +ATOM 6508 H HIS A 408 4.907 -10.440 120.895 1.00 0.00 H +ATOM 6509 HA HIS A 408 6.353 -9.280 118.586 1.00 0.00 H +ATOM 6510 HB3 HIS A 408 7.611 -10.741 120.920 1.00 0.00 H +ATOM 6511 HB2 HIS A 408 7.125 -9.084 121.075 1.00 0.00 H +ATOM 6512 HD1 HIS A 408 9.178 -11.166 118.729 1.00 0.00 H +ATOM 6513 HD2 HIS A 408 8.984 -7.388 120.327 1.00 0.00 H +ATOM 6514 HE1 HIS A 408 11.267 -10.062 117.846 1.00 0.00 H +ATOM 6515 N SER A 409 6.950 -11.361 117.385 1.00 20.72 N +ATOM 6516 CA SER A 409 7.044 -12.570 116.571 1.00 25.28 C +ATOM 6517 C SER A 409 8.089 -13.544 117.101 1.00 26.25 C +ATOM 6518 O SER A 409 7.953 -14.757 116.906 1.00 23.11 O +ATOM 6519 CB SER A 409 7.357 -12.203 115.121 1.00 26.47 C +ATOM 6520 OG SER A 409 8.660 -11.658 115.002 1.00 34.81 O +ATOM 6521 H SER A 409 7.233 -10.479 116.983 1.00 0.00 H +ATOM 6522 HA SER A 409 6.075 -13.069 116.592 1.00 0.00 H +ATOM 6523 HB3 SER A 409 6.626 -11.477 114.765 1.00 0.00 H +ATOM 6524 HB2 SER A 409 7.277 -13.093 114.496 1.00 0.00 H +ATOM 6525 HG SER A 409 8.832 -11.436 114.084 1.00 0.00 H +ATOM 6526 N LEU A 410 9.133 -13.041 117.765 1.00 27.34 N +ATOM 6527 CA LEU A 410 10.198 -13.919 118.243 1.00 22.57 C +ATOM 6528 C LEU A 410 9.697 -14.886 119.308 1.00 20.98 C +ATOM 6529 O LEU A 410 10.273 -15.965 119.485 1.00 21.58 O +ATOM 6530 CB LEU A 410 11.360 -13.085 118.782 1.00 25.57 C +ATOM 6531 CG LEU A 410 12.733 -13.756 118.841 1.00 26.42 C +ATOM 6532 CD1 LEU A 410 13.188 -14.169 117.451 1.00 24.09 C +ATOM 6533 CD2 LEU A 410 13.752 -12.827 119.482 1.00 26.20 C +ATOM 6534 H LEU A 410 9.190 -12.048 117.939 1.00 0.00 H +ATOM 6535 HA LEU A 410 10.562 -14.503 117.398 1.00 0.00 H +ATOM 6536 HB3 LEU A 410 11.102 -12.709 119.772 1.00 0.00 H +ATOM 6537 HB2 LEU A 410 11.436 -12.163 118.206 1.00 0.00 H +ATOM 6538 HG LEU A 410 12.651 -14.652 119.456 1.00 0.00 H +ATOM 6539 HD11 LEU A 410 14.167 -14.644 117.515 1.00 0.00 H +ATOM 6540 HD12 LEU A 410 12.470 -14.871 117.027 1.00 0.00 H +ATOM 6541 HD13 LEU A 410 13.254 -13.288 116.813 1.00 0.00 H +ATOM 6542 HD21 LEU A 410 14.723 -13.320 119.516 1.00 0.00 H +ATOM 6543 HD22 LEU A 410 13.830 -11.912 118.895 1.00 0.00 H +ATOM 6544 HD23 LEU A 410 13.434 -12.582 120.495 1.00 0.00 H +ATOM 6545 N ILE A 411 8.629 -14.521 120.022 1.00 25.56 N +ATOM 6546 CA ILE A 411 8.054 -15.423 121.017 1.00 24.57 C +ATOM 6547 C ILE A 411 7.492 -16.668 120.341 1.00 25.08 C +ATOM 6548 O ILE A 411 7.588 -17.781 120.874 1.00 28.17 O +ATOM 6549 CB ILE A 411 6.989 -14.681 121.849 1.00 21.57 C +ATOM 6550 CG1 ILE A 411 7.655 -13.935 123.008 1.00 24.77 C +ATOM 6551 CG2 ILE A 411 5.918 -15.636 122.362 1.00 29.09 C +ATOM 6552 CD1 ILE A 411 7.986 -14.814 124.197 1.00 25.15 C +ATOM 6553 H ILE A 411 8.211 -13.613 119.877 1.00 0.00 H +ATOM 6554 HA ILE A 411 8.852 -15.735 121.691 1.00 0.00 H +ATOM 6555 HB ILE A 411 6.507 -13.946 121.205 1.00 0.00 H +ATOM 6556 HG13 ILE A 411 7.009 -13.118 123.331 1.00 0.00 H +ATOM 6557 HG12 ILE A 411 8.565 -13.452 122.652 1.00 0.00 H +ATOM 6558 HG21 ILE A 411 5.183 -15.080 122.944 1.00 0.00 H +ATOM 6559 HG22 ILE A 411 5.424 -16.116 121.517 1.00 0.00 H +ATOM 6560 HG23 ILE A 411 6.380 -16.396 122.992 1.00 0.00 H +ATOM 6561 HD11 ILE A 411 8.455 -14.212 124.975 1.00 0.00 H +ATOM 6562 HD12 ILE A 411 7.071 -15.260 124.586 1.00 0.00 H +ATOM 6563 HD13 ILE A 411 8.671 -15.603 123.887 1.00 0.00 H +ATOM 6564 N GLU A 412 6.914 -16.504 119.148 1.00 28.50 N +ATOM 6565 CA GLU A 412 6.456 -17.660 118.383 1.00 26.99 C +ATOM 6566 C GLU A 412 7.622 -18.565 118.005 1.00 26.53 C +ATOM 6567 O GLU A 412 7.505 -19.795 118.054 1.00 27.35 O +ATOM 6568 CB GLU A 412 5.710 -17.201 117.130 1.00 31.36 C +ATOM 6569 CG GLU A 412 4.293 -16.717 117.384 1.00 45.11 C +ATOM 6570 CD GLU A 412 3.970 -15.447 116.620 1.00 57.80 C +ATOM 6571 OE1 GLU A 412 3.794 -14.390 117.263 1.00 61.67 O +ATOM 6572 OE2 GLU A 412 3.897 -15.505 115.375 1.00 63.21 O1- +ATOM 6573 H GLU A 412 6.791 -15.576 118.770 1.00 0.00 H +ATOM 6574 HA GLU A 412 5.766 -18.231 119.004 1.00 0.00 H +ATOM 6575 HB3 GLU A 412 5.689 -18.014 116.404 1.00 0.00 H +ATOM 6576 HB2 GLU A 412 6.279 -16.411 116.640 1.00 0.00 H +ATOM 6577 HG3 GLU A 412 4.155 -16.543 118.451 1.00 0.00 H +ATOM 6578 HG2 GLU A 412 3.587 -17.499 117.103 1.00 0.00 H +ATOM 6579 N ASP A 413 8.756 -17.972 117.621 1.00 24.21 N +ATOM 6580 CA ASP A 413 9.931 -18.768 117.281 1.00 27.77 C +ATOM 6581 C ASP A 413 10.443 -19.537 118.490 1.00 24.71 C +ATOM 6582 O ASP A 413 10.900 -20.679 118.363 1.00 26.18 O +ATOM 6583 CB ASP A 413 11.031 -17.866 116.721 1.00 25.99 C +ATOM 6584 CG ASP A 413 10.622 -17.175 115.438 1.00 25.39 C +ATOM 6585 OD1 ASP A 413 9.647 -17.626 114.802 1.00 31.68 O +ATOM 6586 OD2 ASP A 413 11.276 -16.179 115.065 1.00 28.41 O1- +ATOM 6587 H ASP A 413 8.805 -16.965 117.564 1.00 0.00 H +ATOM 6588 HA ASP A 413 9.649 -19.486 116.511 1.00 0.00 H +ATOM 6589 HB3 ASP A 413 11.929 -18.458 116.543 1.00 0.00 H +ATOM 6590 HB2 ASP A 413 11.300 -17.117 117.466 1.00 0.00 H +ATOM 6591 N LEU A 414 10.374 -18.926 119.675 1.00 22.58 N +ATOM 6592 CA LEU A 414 10.858 -19.585 120.883 1.00 24.27 C +ATOM 6593 C LEU A 414 9.970 -20.762 121.266 1.00 25.58 C +ATOM 6594 O LEU A 414 10.466 -21.796 121.727 1.00 25.40 O +ATOM 6595 CB LEU A 414 10.940 -18.573 122.025 1.00 16.74 C +ATOM 6596 CG LEU A 414 11.400 -19.058 123.400 1.00 14.89 C +ATOM 6597 CD1 LEU A 414 12.707 -19.828 123.300 1.00 14.80 C +ATOM 6598 CD2 LEU A 414 11.548 -17.874 124.336 1.00 13.87 C +ATOM 6599 H LEU A 414 9.983 -17.997 119.742 1.00 0.00 H +ATOM 6600 HA LEU A 414 11.862 -19.963 120.688 1.00 0.00 H +ATOM 6601 HB3 LEU A 414 9.977 -18.073 122.127 1.00 0.00 H +ATOM 6602 HB2 LEU A 414 11.565 -17.736 121.715 1.00 0.00 H +ATOM 6603 HG LEU A 414 10.637 -19.724 123.804 1.00 0.00 H +ATOM 6604 HD11 LEU A 414 13.010 -20.161 124.293 1.00 0.00 H +ATOM 6605 HD12 LEU A 414 12.570 -20.694 122.653 1.00 0.00 H +ATOM 6606 HD13 LEU A 414 13.479 -19.182 122.883 1.00 0.00 H +ATOM 6607 HD21 LEU A 414 11.876 -18.223 125.315 1.00 0.00 H +ATOM 6608 HD22 LEU A 414 12.286 -17.181 123.932 1.00 0.00 H +ATOM 6609 HD23 LEU A 414 10.589 -17.366 124.435 1.00 0.00 H +ATOM 6610 N ILE A 415 8.655 -20.623 121.080 1.00 24.73 N +ATOM 6611 CA ILE A 415 7.733 -21.705 121.417 1.00 23.46 C +ATOM 6612 C ILE A 415 8.001 -22.924 120.543 1.00 27.86 C +ATOM 6613 O ILE A 415 7.920 -24.069 121.005 1.00 30.07 O +ATOM 6614 CB ILE A 415 6.277 -21.220 121.292 1.00 29.61 C +ATOM 6615 CG1 ILE A 415 5.971 -20.179 122.371 1.00 23.62 C +ATOM 6616 CG2 ILE A 415 5.304 -22.388 121.389 1.00 26.19 C +ATOM 6617 CD1 ILE A 415 4.697 -19.405 122.128 1.00 24.21 C +ATOM 6618 H ILE A 415 8.287 -19.762 120.702 1.00 0.00 H +ATOM 6619 HA ILE A 415 7.908 -21.988 122.455 1.00 0.00 H +ATOM 6620 HB ILE A 415 6.154 -20.750 120.316 1.00 0.00 H +ATOM 6621 HG13 ILE A 415 6.807 -19.484 122.450 1.00 0.00 H +ATOM 6622 HG12 ILE A 415 5.916 -20.671 123.342 1.00 0.00 H +ATOM 6623 HG21 ILE A 415 4.282 -22.019 121.298 1.00 0.00 H +ATOM 6624 HG22 ILE A 415 5.506 -23.098 120.587 1.00 0.00 H +ATOM 6625 HG23 ILE A 415 5.426 -22.884 122.352 1.00 0.00 H +ATOM 6626 HD11 ILE A 415 4.548 -18.687 122.934 1.00 0.00 H +ATOM 6627 HD12 ILE A 415 4.769 -18.875 121.179 1.00 0.00 H +ATOM 6628 HD13 ILE A 415 3.853 -20.094 122.095 1.00 0.00 H +ATOM 6629 N LEU A 416 8.334 -22.698 119.270 1.00 28.90 N +ATOM 6630 CA LEU A 416 8.659 -23.808 118.380 1.00 27.72 C +ATOM 6631 C LEU A 416 9.907 -24.543 118.853 1.00 30.82 C +ATOM 6632 O LEU A 416 9.944 -25.779 118.873 1.00 32.16 O +ATOM 6633 CB LEU A 416 8.844 -23.298 116.950 1.00 30.75 C +ATOM 6634 CG LEU A 416 7.659 -23.419 115.986 1.00 35.99 C +ATOM 6635 CD1 LEU A 416 6.371 -23.782 116.718 1.00 29.62 C +ATOM 6636 CD2 LEU A 416 7.483 -22.133 115.191 1.00 26.84 C +ATOM 6637 H LEU A 416 8.363 -21.753 118.916 1.00 0.00 H +ATOM 6638 HA LEU A 416 7.825 -24.509 118.388 1.00 0.00 H +ATOM 6639 HB3 LEU A 416 9.715 -23.782 116.508 1.00 0.00 H +ATOM 6640 HB2 LEU A 416 9.175 -22.260 116.981 1.00 0.00 H +ATOM 6641 HG LEU A 416 7.881 -24.220 115.281 1.00 0.00 H +ATOM 6642 HD11 LEU A 416 5.554 -23.859 116.001 1.00 0.00 H +ATOM 6643 HD12 LEU A 416 6.498 -24.738 117.226 1.00 0.00 H +ATOM 6644 HD13 LEU A 416 6.139 -23.009 117.451 1.00 0.00 H +ATOM 6645 HD21 LEU A 416 6.637 -22.238 114.512 1.00 0.00 H +ATOM 6646 HD22 LEU A 416 7.299 -21.305 115.875 1.00 0.00 H +ATOM 6647 HD23 LEU A 416 8.387 -21.934 114.616 1.00 0.00 H +ATOM 6648 N LEU A 417 10.945 -23.793 119.237 1.00 28.57 N +ATOM 6649 CA LEU A 417 12.149 -24.419 119.773 1.00 25.76 C +ATOM 6650 C LEU A 417 11.849 -25.165 121.066 1.00 25.84 C +ATOM 6651 O LEU A 417 12.392 -26.250 121.306 1.00 27.66 O +ATOM 6652 CB LEU A 417 13.233 -23.364 120.004 1.00 26.40 C +ATOM 6653 CG LEU A 417 13.666 -22.518 118.805 1.00 21.88 C +ATOM 6654 CD1 LEU A 417 14.720 -21.505 119.224 1.00 21.00 C +ATOM 6655 CD2 LEU A 417 14.184 -23.401 117.681 1.00 16.68 C +ATOM 6656 H LEU A 417 10.898 -22.787 119.157 1.00 0.00 H +ATOM 6657 HA LEU A 417 12.518 -25.136 119.040 1.00 0.00 H +ATOM 6658 HB3 LEU A 417 14.110 -23.842 120.440 1.00 0.00 H +ATOM 6659 HB2 LEU A 417 12.923 -22.704 120.814 1.00 0.00 H +ATOM 6660 HG LEU A 417 12.796 -21.974 118.439 1.00 0.00 H +ATOM 6661 HD11 LEU A 417 15.018 -20.911 118.360 1.00 0.00 H +ATOM 6662 HD12 LEU A 417 14.309 -20.849 119.991 1.00 0.00 H +ATOM 6663 HD13 LEU A 417 15.590 -22.028 119.622 1.00 0.00 H +ATOM 6664 HD21 LEU A 417 14.486 -22.778 116.839 1.00 0.00 H +ATOM 6665 HD22 LEU A 417 15.041 -23.974 118.034 1.00 0.00 H +ATOM 6666 HD23 LEU A 417 13.397 -24.084 117.363 1.00 0.00 H +ATOM 6667 N LEU A 418 10.986 -24.597 121.910 1.00 21.16 N +ATOM 6668 CA LEU A 418 10.598 -25.269 123.147 1.00 24.92 C +ATOM 6669 C LEU A 418 9.848 -26.561 122.853 1.00 29.35 C +ATOM 6670 O LEU A 418 10.139 -27.611 123.438 1.00 30.71 O +ATOM 6671 CB LEU A 418 9.743 -24.334 124.002 1.00 21.37 C +ATOM 6672 CG LEU A 418 10.475 -23.400 124.966 1.00 23.99 C +ATOM 6673 CD1 LEU A 418 9.534 -22.313 125.463 1.00 23.01 C +ATOM 6674 CD2 LEU A 418 11.056 -24.183 126.131 1.00 22.38 C +ATOM 6675 H LEU A 418 10.593 -23.692 121.697 1.00 0.00 H +ATOM 6676 HA LEU A 418 11.502 -25.515 123.704 1.00 0.00 H +ATOM 6677 HB3 LEU A 418 9.015 -24.924 124.559 1.00 0.00 H +ATOM 6678 HB2 LEU A 418 9.098 -23.743 123.351 1.00 0.00 H +ATOM 6679 HG LEU A 418 11.295 -22.925 124.428 1.00 0.00 H +ATOM 6680 HD11 LEU A 418 10.068 -21.655 126.149 1.00 0.00 H +ATOM 6681 HD12 LEU A 418 9.167 -21.734 124.616 1.00 0.00 H +ATOM 6682 HD13 LEU A 418 8.691 -22.770 125.982 1.00 0.00 H +ATOM 6683 HD21 LEU A 418 11.573 -23.501 126.806 1.00 0.00 H +ATOM 6684 HD22 LEU A 418 10.252 -24.686 126.669 1.00 0.00 H +ATOM 6685 HD23 LEU A 418 11.760 -24.925 125.755 1.00 0.00 H +ATOM 6686 N GLU A 419 8.873 -26.502 121.943 1.00 27.26 N +ATOM 6687 CA GLU A 419 8.114 -27.695 121.582 1.00 30.39 C +ATOM 6688 C GLU A 419 9.014 -28.746 120.942 1.00 32.59 C +ATOM 6689 O GLU A 419 8.922 -29.937 121.262 1.00 28.64 O +ATOM 6690 CB GLU A 419 6.970 -27.318 120.641 1.00 29.59 C +ATOM 6691 CG GLU A 419 5.810 -26.609 121.320 1.00 34.67 C +ATOM 6692 CD GLU A 419 4.720 -26.216 120.343 1.00 36.50 C +ATOM 6693 OE1 GLU A 419 4.862 -26.516 119.138 1.00 29.78 O +ATOM 6694 OE2 GLU A 419 3.724 -25.602 120.779 1.00 36.60 O1- +ATOM 6695 H GLU A 419 8.653 -25.624 121.495 1.00 0.00 H +ATOM 6696 HA GLU A 419 7.686 -28.117 122.491 1.00 0.00 H +ATOM 6697 HB3 GLU A 419 6.603 -28.215 120.142 1.00 0.00 H +ATOM 6698 HB2 GLU A 419 7.355 -26.691 119.837 1.00 0.00 H +ATOM 6699 HG3 GLU A 419 6.178 -25.719 121.830 1.00 0.00 H +ATOM 6700 HG2 GLU A 419 5.390 -27.256 122.090 1.00 0.00 H +ATOM 6701 N GLU A 420 9.887 -28.320 120.025 1.00 28.33 N +ATOM 6702 CA GLU A 420 10.821 -29.249 119.395 1.00 32.44 C +ATOM 6703 C GLU A 420 11.713 -29.918 120.432 1.00 34.30 C +ATOM 6704 O GLU A 420 11.849 -31.147 120.455 1.00 32.53 O +ATOM 6705 CB GLU A 420 11.670 -28.517 118.356 1.00 29.17 C +ATOM 6706 CG GLU A 420 12.897 -29.298 117.915 1.00 30.22 C +ATOM 6707 CD GLU A 420 13.571 -28.697 116.700 1.00 32.17 C +ATOM 6708 OE1 GLU A 420 13.207 -27.565 116.318 1.00 36.98 O +ATOM 6709 OE2 GLU A 420 14.470 -29.352 116.131 1.00 30.62 O1- +ATOM 6710 H GLU A 420 9.906 -27.346 119.760 1.00 0.00 H +ATOM 6711 HA GLU A 420 10.246 -30.022 118.886 1.00 0.00 H +ATOM 6712 HB3 GLU A 420 11.980 -27.552 118.757 1.00 0.00 H +ATOM 6713 HB2 GLU A 420 11.056 -28.286 117.485 1.00 0.00 H +ATOM 6714 HG3 GLU A 420 12.612 -30.328 117.699 1.00 0.00 H +ATOM 6715 HG2 GLU A 420 13.610 -29.347 118.738 1.00 0.00 H +ATOM 6716 N CYS A 421 12.334 -29.117 121.303 1.00 29.81 N +ATOM 6717 CA CYS A 421 13.192 -29.678 122.340 1.00 32.35 C +ATOM 6718 C CYS A 421 12.411 -30.579 123.288 1.00 35.73 C +ATOM 6719 O CYS A 421 12.975 -31.529 123.843 1.00 35.72 O +ATOM 6720 CB CYS A 421 13.879 -28.552 123.116 1.00 27.15 C +ATOM 6721 SG CYS A 421 15.205 -29.097 124.222 1.00 25.66 S +ATOM 6722 H CYS A 421 12.210 -28.116 121.246 1.00 0.00 H +ATOM 6723 HA CYS A 421 13.963 -30.278 121.857 1.00 0.00 H +ATOM 6724 HB3 CYS A 421 13.133 -28.002 123.690 1.00 0.00 H +ATOM 6725 HB2 CYS A 421 14.274 -27.818 122.413 1.00 0.00 H +ATOM 6726 HG CYS A 421 15.730 -28.038 124.844 1.00 0.00 H +ATOM 6727 N ASP A 422 11.118 -30.304 123.482 1.00 35.90 N +ATOM 6728 CA ASP A 422 10.310 -31.145 124.361 1.00 38.01 C +ATOM 6729 C ASP A 422 10.011 -32.489 123.713 1.00 36.81 C +ATOM 6730 O ASP A 422 10.003 -33.524 124.390 1.00 37.68 O +ATOM 6731 CB ASP A 422 9.016 -30.424 124.737 1.00 39.54 C +ATOM 6732 CG ASP A 422 8.421 -30.932 126.038 1.00 51.83 C +ATOM 6733 OD1 ASP A 422 9.192 -31.172 126.991 1.00 54.71 O +ATOM 6734 OD2 ASP A 422 7.183 -31.088 126.109 1.00 42.17 O1- +ATOM 6735 H ASP A 422 10.695 -29.512 123.020 1.00 0.00 H +ATOM 6736 HA ASP A 422 10.877 -31.326 125.274 1.00 0.00 H +ATOM 6737 HB3 ASP A 422 8.288 -30.544 123.935 1.00 0.00 H +ATOM 6738 HB2 ASP A 422 9.208 -29.354 124.820 1.00 0.00 H +ATOM 6739 N ALA A 423 9.763 -32.494 122.401 1.00 36.59 N +ATOM 6740 CA ALA A 423 9.560 -33.754 121.696 1.00 35.39 C +ATOM 6741 C ALA A 423 10.815 -34.615 121.745 1.00 32.82 C +ATOM 6742 O ALA A 423 10.730 -35.842 121.872 1.00 36.81 O +ATOM 6743 CB ALA A 423 9.146 -33.487 120.249 1.00 27.71 C +ATOM 6744 H ALA A 423 9.715 -31.623 121.893 1.00 0.00 H +ATOM 6745 HA ALA A 423 8.753 -34.296 122.189 1.00 0.00 H +ATOM 6746 HB1 ALA A 423 8.997 -34.435 119.732 1.00 0.00 H +ATOM 6747 HB2 ALA A 423 8.217 -32.917 120.236 1.00 0.00 H +ATOM 6748 HB3 ALA A 423 9.928 -32.918 119.746 1.00 0.00 H +ATOM 6749 N ASN A 424 11.990 -33.988 121.654 1.00 32.98 N +ATOM 6750 CA ASN A 424 13.240 -34.740 121.710 1.00 36.77 C +ATOM 6751 C ASN A 424 13.423 -35.394 123.074 1.00 33.40 C +ATOM 6752 O ASN A 424 13.804 -36.566 123.168 1.00 33.08 O +ATOM 6753 CB ASN A 424 14.418 -33.822 121.384 1.00 29.55 C +ATOM 6754 CG ASN A 424 14.551 -33.552 119.898 1.00 33.03 C +ATOM 6755 OD1 ASN A 424 15.273 -34.255 119.190 1.00 32.90 O +ATOM 6756 ND2 ASN A 424 13.855 -32.529 119.417 1.00 31.58 N +ATOM 6757 H ASN A 424 12.020 -32.984 121.545 1.00 0.00 H +ATOM 6758 HA ASN A 424 13.200 -35.526 120.956 1.00 0.00 H +ATOM 6759 HB3 ASN A 424 15.340 -34.270 121.755 1.00 0.00 H +ATOM 6760 HB2 ASN A 424 14.299 -32.877 121.915 1.00 0.00 H +ATOM 6761 HD22 ASN A 424 13.905 -32.302 118.434 1.00 0.00 H +ATOM 6762 HD21 ASN A 424 13.276 -31.978 120.034 1.00 0.00 H +ATOM 6763 N ILE A 425 13.154 -34.652 124.143 1.00 29.88 N +ATOM 6764 CA ILE A 425 13.225 -35.205 125.489 1.00 37.29 C +ATOM 6765 C ILE A 425 12.022 -36.106 125.740 1.00 35.85 C +ATOM 6766 O ILE A 425 12.162 -37.320 125.881 1.00 42.29 O +ATOM 6767 CB ILE A 425 13.308 -34.096 126.553 1.00 30.08 C +ATOM 6768 CG1 ILE A 425 14.704 -33.469 126.568 1.00 27.02 C +ATOM 6769 CG2 ILE A 425 12.956 -34.647 127.927 1.00 26.17 C +ATOM 6770 CD1 ILE A 425 14.803 -32.229 127.429 1.00 24.89 C +ATOM 6771 H ILE A 425 12.894 -33.682 124.032 1.00 0.00 H +ATOM 6772 HA ILE A 425 14.127 -35.813 125.560 1.00 0.00 H +ATOM 6773 HXT ILE A 425 11.037 -35.666 125.794 1.00 0.00 H +ATOM 6774 HB ILE A 425 12.586 -33.321 126.298 1.00 0.00 H +ATOM 6775 HG13 ILE A 425 15.002 -33.226 125.548 1.00 0.00 H +ATOM 6776 HG12 ILE A 425 15.428 -34.207 126.912 1.00 0.00 H +ATOM 6777 HG21 ILE A 425 13.020 -33.849 128.666 1.00 0.00 H +ATOM 6778 HG22 ILE A 425 11.942 -35.046 127.910 1.00 0.00 H +ATOM 6779 HG23 ILE A 425 13.654 -35.442 128.190 1.00 0.00 H +ATOM 6780 HD11 ILE A 425 15.821 -31.840 127.391 1.00 0.00 H +ATOM 6781 HD12 ILE A 425 14.111 -31.473 127.058 1.00 0.00 H +ATOM 6782 HD13 ILE A 425 14.549 -32.480 128.459 1.00 0.00 H +TER 6783 ILE A 425 +HETATM 6784 N1 SAM A 501 11.254 14.727 130.068 1.00 11.67 N1+ +HETATM 6785 C1 SAM A 501 11.140 14.583 128.621 1.00 14.71 C +HETATM 6786 C2 SAM A 501 10.111 15.549 128.042 1.00 12.67 C +HETATM 6787 O1 SAM A 501 9.527 16.358 128.763 1.00 10.25 O +HETATM 6788 O2 SAM A 501 9.844 15.549 126.839 1.00 11.76 O1- +HETATM 6789 C3 SAM A 501 10.780 13.147 128.258 1.00 8.86 C +HETATM 6790 C4 SAM A 501 11.984 12.236 128.043 1.00 11.62 C +HETATM 6791 S1 SAM A 501 12.990 12.763 126.632 1.00 10.50 S1+ +HETATM 6792 C5 SAM A 501 13.157 11.213 125.715 1.00 9.40 C +HETATM 6793 C6 SAM A 501 14.636 12.851 127.376 1.00 11.94 C +HETATM 6794 C7 SAM A 501 14.886 14.142 128.140 1.00 10.41 C +HETATM 6795 O3 SAM A 501 14.211 14.108 129.386 1.00 16.21 O +HETATM 6796 C8 SAM A 501 16.366 14.330 128.436 1.00 13.82 C +HETATM 6797 O4 SAM A 501 16.962 15.199 127.502 1.00 15.56 O +HETATM 6798 C9 SAM A 501 16.388 14.932 129.820 1.00 12.80 C +HETATM 6799 O5 SAM A 501 16.376 16.334 129.709 1.00 14.87 O +HETATM 6800 C10 SAM A 501 15.076 14.497 130.436 1.00 14.63 C +HETATM 6801 N2 SAM A 501 15.296 13.330 131.307 1.00 14.59 N +HETATM 6802 C11 SAM A 501 15.062 12.026 130.956 1.00 10.75 C +HETATM 6803 N3 SAM A 501 15.381 11.236 132.003 1.00 12.26 N +HETATM 6804 C12 SAM A 501 15.825 12.012 133.015 1.00 14.55 C +HETATM 6805 C13 SAM A 501 16.275 11.708 134.293 1.00 13.87 C +HETATM 6806 N4 SAM A 501 16.322 10.444 134.704 1.00 10.42 N +HETATM 6807 N5 SAM A 501 16.675 12.728 135.130 1.00 16.71 N +HETATM 6808 C14 SAM A 501 16.628 14.038 134.693 1.00 13.41 C +HETATM 6809 N6 SAM A 501 16.174 14.329 133.422 1.00 15.71 N +HETATM 6810 C15 SAM A 501 15.776 13.334 132.593 1.00 15.16 C +HETATM 6811 H1 SAM A 501 11.941 14.075 130.419 1.00 0.00 H +HETATM 6812 H2 SAM A 501 11.540 15.670 130.292 1.00 0.00 H +HETATM 6813 H3 SAM A 501 10.360 14.536 130.497 1.00 0.00 H +HETATM 6814 H4 SAM A 501 12.109 14.813 128.179 1.00 0.00 H +HETATM 6815 H5 SAM A 501 10.161 13.146 127.361 1.00 0.00 H +HETATM 6816 H6 SAM A 501 10.143 12.726 129.036 1.00 0.00 H +HETATM 6817 H7 SAM A 501 11.641 11.214 127.882 1.00 0.00 H +HETATM 6818 H8 SAM A 501 12.598 12.228 128.943 1.00 0.00 H +HETATM 6819 H9 SAM A 501 13.754 11.383 124.819 1.00 0.00 H +HETATM 6820 H10 SAM A 501 13.649 10.470 126.343 1.00 0.00 H +HETATM 6821 H11 SAM A 501 12.169 10.851 125.430 1.00 0.00 H +HETATM 6822 H12 SAM A 501 15.391 12.739 126.598 1.00 0.00 H +HETATM 6823 H13 SAM A 501 14.777 12.002 128.045 1.00 0.00 H +HETATM 6824 H14 SAM A 501 14.523 14.986 127.554 1.00 0.00 H +HETATM 6825 H15 SAM A 501 16.877 13.367 128.435 1.00 0.00 H +HETATM 6826 H16 SAM A 501 17.894 15.302 127.709 1.00 0.00 H +HETATM 6827 H17 SAM A 501 17.242 14.580 130.399 1.00 0.00 H +HETATM 6828 H18 SAM A 501 16.390 16.725 130.586 1.00 0.00 H +HETATM 6829 H19 SAM A 501 14.636 15.316 131.005 1.00 0.00 H +HETATM 6830 H20 SAM A 501 14.683 11.791 129.972 1.00 0.00 H +HETATM 6831 H21 SAM A 501 16.650 10.227 135.634 1.00 0.00 H +HETATM 6832 H22 SAM A 501 16.030 9.701 134.086 1.00 0.00 H +CONECT 6765 6773 +CONECT 6784 6785 6811 6812 6813 +CONECT 6785 6784 6786 6789 6814 +CONECT 6786 6785 6787 6788 +CONECT 6786 6787 +CONECT 6787 6786 +CONECT 6787 6786 +CONECT 6788 6786 +CONECT 6789 6785 6790 6815 6816 +CONECT 6790 6789 6791 6817 6818 +CONECT 6791 6790 6792 6793 +CONECT 6792 6791 6819 6820 6821 +CONECT 6793 6791 6794 6822 6823 +CONECT 6794 6793 6795 6796 6824 +CONECT 6795 6794 6800 +CONECT 6796 6794 6797 6798 6825 +CONECT 6797 6796 6826 +CONECT 6798 6796 6799 6800 6827 +CONECT 6799 6798 6828 +CONECT 6800 6795 6798 6801 6829 +CONECT 6801 6800 6802 6810 +CONECT 6802 6801 6803 6830 +CONECT 6802 6803 +CONECT 6803 6802 6804 +CONECT 6803 6802 +CONECT 6804 6803 6805 6810 +CONECT 6804 6810 +CONECT 6805 6804 6806 6807 +CONECT 6805 6807 +CONECT 6806 6805 6831 6832 +CONECT 6807 6805 6808 +CONECT 6807 6805 +CONECT 6808 6807 6809 6833 +CONECT 6808 6809 +CONECT 6809 6808 6810 +CONECT 6809 6808 +CONECT 6810 6801 6804 6809 +CONECT 6810 6804 +CONECT 6834 3273 4131 4153 4207 +CONECT 6835 945 983 1274 1348 +CONECT 6836 725 771 1086 1139 +CONECT 6837 6838 6842 6864 +CONECT 6837 6842 +CONECT 6838 6837 6839 6865 +CONECT 6838 6839 +CONECT 6839 6838 6840 6850 +CONECT 6839 6838 +CONECT 6840 6839 6841 6866 +CONECT 6840 6841 +CONECT 6841 6840 6842 6858 +CONECT 6841 6840 +CONECT 6842 6837 6841 6845 +CONECT 6842 6837 +CONECT 6843 6844 6846 6858 +CONECT 6843 6858 +CONECT 6844 6843 6845 6849 +CONECT 6844 6845 +CONECT 6845 2954 6842 6844 +CONECT 6845 6844 +CONECT 6846 6843 6847 6867 6868 +CONECT 6847 6846 6848 6869 6870 +CONECT 6848 6847 6849 6871 6872 +CONECT 6849 6844 6848 6873 6874 +CONECT 6850 6839 6859 6861 +CONECT 6850 6861 +CONECT 6851 6852 6859 6875 6876 +CONECT 6852 6851 6860 6877 6878 +CONECT 6853 6854 6860 6879 6880 +CONECT 6854 6853 6859 6881 6882 +CONECT 6855 6860 6862 6863 +CONECT 6855 6862 +CONECT 6856 6857 6863 6883 6884 +CONECT 6857 6856 6885 6886 6887 +CONECT 6858 6841 6843 +CONECT 6858 6843 +CONECT 6859 6850 6851 6854 +CONECT 6860 6852 6853 6855 +CONECT 6861 6850 +CONECT 6861 6850 +CONECT 6862 6855 +CONECT 6862 6855 +CONECT 6863 6855 6856 +CONECT 6773 6765 +CONECT 6811 6784 +CONECT 6812 6784 +CONECT 6813 6784 +CONECT 6814 6785 +CONECT 6815 6789 +CONECT 6816 6789 +CONECT 6817 6790 +CONECT 6818 6790 +CONECT 6819 6792 +CONECT 6820 6792 +CONECT 6821 6792 +CONECT 6822 6793 +CONECT 6823 6793 +CONECT 6824 6794 +CONECT 6825 6796 +CONECT 6826 6797 +CONECT 6827 6798 +CONECT 6828 6799 +CONECT 6829 6800 +CONECT 6830 6802 +CONECT 6831 6806 +CONECT 6832 6806 +CONECT 6833 6808 +CONECT 6864 6837 +CONECT 6865 6838 +CONECT 6866 6840 +CONECT 6867 6846 +CONECT 6868 6846 +CONECT 6869 6847 +CONECT 6870 6847 +CONECT 6871 6848 +CONECT 6872 6848 +CONECT 6873 6849 +CONECT 6874 6849 +CONECT 6875 6851 +CONECT 6876 6851 +CONECT 6877 6852 +CONECT 6878 6852 +CONECT 6879 6853 +CONECT 6880 6853 +CONECT 6881 6854 +CONECT 6882 6854 +CONECT 6883 6856 +CONECT 6884 6856 +CONECT 6885 6857 +CONECT 6886 6857 +CONECT 6887 6857 +END diff --git a/peleffy/data/ligands/SAM.pdb b/peleffy/data/ligands/SAM.pdb new file mode 100644 index 00000000..07380a1f --- /dev/null +++ b/peleffy/data/ligands/SAM.pdb @@ -0,0 +1,74 @@ +HETATM 1 N1 SAM A 501 11.254 14.727 130.068 1.00 11.67 N1+ +HETATM 2 C1 SAM A 501 11.140 14.583 128.621 1.00 14.71 C +HETATM 3 C2 SAM A 501 10.111 15.549 128.042 1.00 12.67 C +HETATM 4 O1 SAM A 501 9.527 16.358 128.763 1.00 10.25 O +HETATM 5 O2 SAM A 501 9.844 15.549 126.839 1.00 11.76 O1- +HETATM 6 C3 SAM A 501 10.780 13.147 128.258 1.00 8.86 C +HETATM 7 C4 SAM A 501 11.984 12.236 128.043 1.00 11.62 C +HETATM 8 S1 SAM A 501 12.990 12.763 126.632 1.00 10.50 S1+ +HETATM 9 C5 SAM A 501 13.157 11.213 125.715 1.00 9.40 C +HETATM 10 C6 SAM A 501 14.636 12.851 127.376 1.00 11.94 C +HETATM 11 C7 SAM A 501 14.886 14.142 128.140 1.00 10.41 C +HETATM 12 O3 SAM A 501 14.211 14.108 129.386 1.00 16.21 O +HETATM 13 C8 SAM A 501 16.366 14.330 128.436 1.00 13.82 C +HETATM 14 O4 SAM A 501 16.962 15.199 127.502 1.00 15.56 O +HETATM 15 C9 SAM A 501 16.388 14.932 129.820 1.00 12.80 C +HETATM 16 O5 SAM A 501 16.376 16.334 129.709 1.00 14.87 O +HETATM 17 C10 SAM A 501 15.076 14.497 130.436 1.00 14.63 C +HETATM 18 N2 SAM A 501 15.296 13.330 131.307 1.00 14.59 N +HETATM 19 C11 SAM A 501 15.062 12.026 130.956 1.00 10.75 C +HETATM 20 N3 SAM A 501 15.381 11.236 132.003 1.00 12.26 N +HETATM 21 C12 SAM A 501 15.825 12.012 133.015 1.00 14.55 C +HETATM 22 C13 SAM A 501 16.275 11.708 134.293 1.00 13.87 C +HETATM 23 N4 SAM A 501 16.322 10.444 134.704 1.00 10.42 N +HETATM 24 N5 SAM A 501 16.675 12.728 135.130 1.00 16.71 N +HETATM 25 C14 SAM A 501 16.628 14.038 134.693 1.00 13.41 C +HETATM 26 N6 SAM A 501 16.174 14.329 133.422 1.00 15.71 N +HETATM 27 C15 SAM A 501 15.776 13.334 132.593 1.00 15.16 C +HETATM 28 H1 SAM A 501 11.941 14.075 130.419 1.00 0.00 H +HETATM 29 H2 SAM A 501 11.540 15.670 130.292 1.00 0.00 H +HETATM 30 H3 SAM A 501 10.360 14.536 130.497 1.00 0.00 H +HETATM 31 H4 SAM A 501 12.109 14.813 128.179 1.00 0.00 H +HETATM 32 H5 SAM A 501 10.161 13.146 127.361 1.00 0.00 H +HETATM 33 H6 SAM A 501 10.143 12.726 129.036 1.00 0.00 H +HETATM 34 H7 SAM A 501 11.641 11.214 127.882 1.00 0.00 H +HETATM 35 H8 SAM A 501 12.598 12.228 128.943 1.00 0.00 H +HETATM 36 H9 SAM A 501 13.754 11.383 124.819 1.00 0.00 H +HETATM 37 H10 SAM A 501 13.649 10.470 126.343 1.00 0.00 H +HETATM 38 H11 SAM A 501 12.169 10.851 125.430 1.00 0.00 H +HETATM 39 H12 SAM A 501 15.391 12.739 126.598 1.00 0.00 H +HETATM 40 H13 SAM A 501 14.777 12.002 128.045 1.00 0.00 H +HETATM 41 H14 SAM A 501 14.523 14.986 127.554 1.00 0.00 H +HETATM 42 H15 SAM A 501 16.877 13.367 128.435 1.00 0.00 H +HETATM 43 H16 SAM A 501 17.894 15.302 127.709 1.00 0.00 H +HETATM 44 H17 SAM A 501 17.242 14.580 130.399 1.00 0.00 H +HETATM 45 H18 SAM A 501 16.390 16.725 130.586 1.00 0.00 H +HETATM 46 H19 SAM A 501 14.636 15.316 131.005 1.00 0.00 H +HETATM 47 H20 SAM A 501 14.683 11.791 129.972 1.00 0.00 H +HETATM 48 H21 SAM A 501 16.650 10.227 135.634 1.00 0.00 H +HETATM 49 H22 SAM A 501 16.030 9.701 134.086 1.00 0.00 H +CONECT 1 2 28 29 30 +CONECT 2 3 6 31 +CONECT 3 4 4 5 +CONECT 6 7 32 33 +CONECT 7 8 34 35 +CONECT 8 9 10 +CONECT 9 36 37 38 +CONECT 10 11 39 40 +CONECT 11 12 13 41 +CONECT 12 17 +CONECT 13 14 15 42 +CONECT 14 43 +CONECT 15 16 17 44 +CONECT 16 45 +CONECT 17 18 46 +CONECT 18 19 27 +CONECT 19 20 20 47 +CONECT 20 21 +CONECT 21 22 27 27 +CONECT 22 23 24 24 +CONECT 23 48 49 +CONECT 24 25 +CONECT 25 26 26 50 +CONECT 26 27 +END diff --git a/peleffy/tests/test_utils.py b/peleffy/tests/test_utils.py index 20b01eb4..ce81fe7a 100644 --- a/peleffy/tests/test_utils.py +++ b/peleffy/tests/test_utils.py @@ -720,7 +720,14 @@ class TestPDBFile(object): """ It contains all the tests to validate the PDBFile class. """ - def test_get_molecule_from_chain(self): + + @pytest.mark.parametrize(("complex_path", "ligand_path", "chain"), + [ + ('complexes/LYS_BNZ.pdb', 'ligands/BNZ.pdb', "L"), + ('complexes/5XXD_SAM.pdb', 'ligands/SAM.pdb', "A") + ] + ) + def test_get_molecule_from_chain(self, complex_path, ligand_path, chain): """ It tests the method that returns a molecule from a selected chain from an input PDB file. @@ -757,19 +764,19 @@ def compare_molecules(mol1, mol2): from peleffy.utils import get_data_file_path from peleffy.topology import Molecule - PATH_COMPLEX_PDB = get_data_file_path('complexes/LYS_BNZ.pdb') - PATH_LIGAND_PDB = get_data_file_path('ligands/BNZ.pdb') + PATH_COMPLEX_PDB = get_data_file_path(complex_path) + PATH_LIGAND_PDB = get_data_file_path(ligand_path) # Test method get_molecule_from_chain PDBreader = PDBFile(PATH_COMPLEX_PDB) - molecules = PDBreader.get_molecules_from_chain(selected_chain='L') + molecules = PDBreader.get_molecules_from_chain(selected_chain=chain) assert len(molecules) == 1, 'Unexpected number of molecules' assert compare_molecules(molecules[0], Molecule(PATH_LIGAND_PDB)) is True # Test allow_undefined_stereo flag PDBreader = PDBFile(PATH_COMPLEX_PDB) molecules = \ - PDBreader.get_molecules_from_chain(selected_chain='L', + PDBreader.get_molecules_from_chain(selected_chain=chain, allow_undefined_stereo=True) assert len(molecules) == 1, 'Unexpected number of molecules' assert compare_molecules(molecules[0], @@ -779,7 +786,7 @@ def compare_molecules(mol1, mol2): # Test exclude_terminal_rotamers flag PDBreader = PDBFile(PATH_COMPLEX_PDB) molecules = \ - PDBreader.get_molecules_from_chain(selected_chain='L', + PDBreader.get_molecules_from_chain(selected_chain=chain, exclude_terminal_rotamers=False) assert len(molecules) == 1, 'Unexpected number of molecules' assert compare_molecules(molecules[0], Molecule( @@ -787,7 +794,7 @@ def compare_molecules(mol1, mol2): # Test rotamer_resolution flag PDBreader = PDBFile(PATH_COMPLEX_PDB) - molecules = PDBreader.get_molecules_from_chain(selected_chain='L', + molecules = PDBreader.get_molecules_from_chain(selected_chain=chain, rotamer_resolution=10) assert compare_molecules(molecules[0], Molecule(PATH_LIGAND_PDB, @@ -795,7 +802,7 @@ def compare_molecules(mol1, mol2): # Test core_constraints flag PDBreader = PDBFile(PATH_COMPLEX_PDB) - molecules = PDBreader.get_molecules_from_chain(selected_chain='L', + molecules = PDBreader.get_molecules_from_chain(selected_chain=chain, core_constraints=[1,2]) assert len(molecules) == 1, 'Unexpected number of molecules' assert molecules[0].core_constraints == [1,2] diff --git a/peleffy/utils/input.py b/peleffy/utils/input.py index ecbb9fcb..db4e8cc4 100644 --- a/peleffy/utils/input.py +++ b/peleffy/utils/input.py @@ -105,8 +105,9 @@ def _extract_molecules_from_chain(self, chain, rotamer_resolution, if line.startswith('CONECT'): stripped_line = line.replace("CONECT", "") ids_in_line = [stripped_line[i:i + 5] for i in range(0, len(stripped_line), 5)] + stripped_ids_in_line = [element.strip() for element in ids_in_line] - if any([atom_id in ids_in_line for atom_id in atom_ids]): + if any([atom_id in stripped_ids_in_line for atom_id in atom_ids]): pdb_block.append(line) try: From 438ad982260f50c1a37bef5dd6f0ed27fb6c5ea3 Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Mart=C3=AD=20Municoy?= Date: Thu, 16 Dec 2021 19:21:50 +0100 Subject: [PATCH 2/3] Minor changes and release history update --- devtools/conda/meta.yaml | 1 + docs/releasehistory.rst | 14 ++++++++++++++ peleffy/utils/input.py | 11 ++++++++--- 3 files changed, 23 insertions(+), 3 deletions(-) diff --git a/devtools/conda/meta.yaml b/devtools/conda/meta.yaml index 0c914db6..1ed9e228 100644 --- a/devtools/conda/meta.yaml +++ b/devtools/conda/meta.yaml @@ -19,6 +19,7 @@ requirements: run: - python - numpy + - ipython - matplotlib - pytest - networkx diff --git a/docs/releasehistory.rst b/docs/releasehistory.rst index bf49771a..04cafbdb 100644 --- a/docs/releasehistory.rst +++ b/docs/releasehistory.rst @@ -8,6 +8,20 @@ Releases follow the ``major.minor.micro`` scheme recommended by `PEP440 `_: Fix problem when extracting heteromolecules from a specific chain + +Tests added +""""""""""" +- `PR #163 `_: Adds a test to validate heteromolecule extraction + + 1.4.0 - Alchemistry and AMBER support --------------------------------------------------------- diff --git a/peleffy/utils/input.py b/peleffy/utils/input.py index db4e8cc4..d900b65c 100644 --- a/peleffy/utils/input.py +++ b/peleffy/utils/input.py @@ -104,10 +104,15 @@ def _extract_molecules_from_chain(self, chain, rotamer_resolution, if line.startswith('CONECT'): stripped_line = line.replace("CONECT", "") - ids_in_line = [stripped_line[i:i + 5] for i in range(0, len(stripped_line), 5)] - stripped_ids_in_line = [element.strip() for element in ids_in_line] + ids_in_line = [stripped_line[i:i + 5] for i in + range(0, len(stripped_line), 5)] - if any([atom_id in stripped_ids_in_line for atom_id in atom_ids]): + # Strip out whitespaces from ids + stripped_ids_in_line = [element.strip() for + element in ids_in_line] + + if any([atom_id in stripped_ids_in_line for + atom_id in atom_ids]): pdb_block.append(line) try: From fbab374553bc3bd40c6ffb1b8f2cbee167f66c72 Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Mart=C3=AD=20Municoy?= Date: Thu, 16 Dec 2021 19:25:18 +0100 Subject: [PATCH 3/3] Static docs version --- docs/conf.py | 5 +++-- 1 file changed, 3 insertions(+), 2 deletions(-) diff --git a/docs/conf.py b/docs/conf.py index 3edfb4c7..a48d96c0 100644 --- a/docs/conf.py +++ b/docs/conf.py @@ -83,8 +83,9 @@ def add_source_parser(_old_add_source_parser, self, *args, **kwargs): source_suffix = ['.rst', '.md'] master_doc = 'index' -import peleffy -version = peleffy.__version__ +#import peleffy +#version = peleffy.__version__ +version = '1.4.1' pygments_style = 'sphinx'