Browse entries in the PDBbind-CN Database
HEADER 6G2B_COMPLEX COMPND 6G2B_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 78 VAL LYS PHE GLN VAL GLY ASP LEU VAL TRP SER LYS VAL SEQRES 2 A 78 GLY THR TYR PRO TRP TRP PRO CYS MET VAL SER SER ASP SEQRES 3 A 78 PRO GLN LEU GLU VAL HIS THR LYS ILE ASN THR ARG GLY SEQRES 4 A 78 ALA ARG GLU TYR HIS VAL GLN PHE PHE SER ASN GLN PRO SEQRES 5 A 78 GLU ARG ALA TRP VAL HIS GLU LYS ARG VAL ARG GLU TYR SEQRES 6 A 78 LYS GLY HIS LYS GLN TYR GLU GLU LEU LEU ALA GLU ALA SEQRES 1 A 45 GLN LYS ILE ARG LYS PRO ARG PRO GLN ARG GLU ARG ALA SEQRES 2 A 45 GLN TRP ASP ILE GLY ILE ALA HIS ALA GLU LYS ALA LEU SEQRES 3 A 45 LYS MET THR ARG GLU GLU ARG ILE GLU GLN TYR THR PHE SEQRES 4 A 45 ILE TYR ILE ASP LYS GLN HET EH A 8 31 ATOM 1 N VAL A 266 -23.361 2.480 -7.593 1.00 36.54 N ATOM 2 CA VAL A 266 -22.561 3.711 -7.782 1.00 34.03 C ATOM 3 C VAL A 266 -21.902 4.134 -6.443 1.00 38.36 C ATOM 4 O VAL A 266 -22.593 4.206 -5.430 1.00 41.37 O ATOM 5 CB VAL A 266 -23.398 4.878 -8.384 1.00 37.52 C ATOM 6 CG1 VAL A 266 -22.494 6.021 -8.843 1.00 35.10 C ATOM 7 CG2 VAL A 266 -24.283 4.413 -9.535 1.00 38.62 C ATOM 8 HN3 VAL A 266 -24.105 2.656 -6.888 1.00 0.00 H ATOM 9 HN2 VAL A 266 -22.742 1.713 -7.261 1.00 0.00 H ATOM 10 HN1 VAL A 266 -23.796 2.209 -8.498 1.00 0.00 H ATOM 11 N LYS A 267 -20.584 4.427 -6.458 1.00 31.29 N ATOM 12 CA LYS A 267 -19.768 4.835 -5.306 1.00 30.77 C ATOM 13 C LYS A 267 -19.057 6.196 -5.546 1.00 29.98 C ATOM 14 O LYS A 267 -18.545 6.788 -4.595 1.00 29.50 O ATOM 15 CB LYS A 267 -18.693 3.773 -4.988 1.00 35.02 C ATOM 16 CG LYS A 267 -19.217 2.417 -4.525 1.00 54.92 C ATOM 17 CD LYS A 267 -18.060 1.456 -4.284 1.00 66.92 C ATOM 18 CE LYS A 267 -18.509 0.107 -3.780 1.00 82.05 C ATOM 19 NZ LYS A 267 -17.348 -0.773 -3.481 1.00 92.41 N ATOM 20 HZ1 LYS A 267 -16.788 -0.912 -4.346 1.00 0.00 H ATOM 21 HZ2 LYS A 267 -16.756 -0.327 -2.752 1.00 0.00 H ATOM 22 HZ3 LYS A 267 -17.691 -1.692 -3.137 1.00 0.00 H ATOM 23 H LYS A 267 -20.099 4.357 -7.375 1.00 0.00 H ATOM 24 N PHE A 268 -18.983 6.655 -6.801 1.00 23.74 N ATOM 25 CA PHE A 268 -18.342 7.924 -7.161 1.00 21.37 C ATOM 26 C PHE A 268 -19.287 8.812 -7.923 1.00 23.99 C ATOM 27 O PHE A 268 -20.137 8.311 -8.655 1.00 24.90 O ATOM 28 CB PHE A 268 -17.062 7.705 -7.983 1.00 20.78 C ATOM 29 CG PHE A 268 -16.017 6.908 -7.246 1.00 21.97 C ATOM 30 CD1 PHE A 268 -15.330 7.459 -6.165 1.00 23.67 C ATOM 31 CD2 PHE A 268 -15.724 5.605 -7.620 1.00 24.09 C ATOM 32 CE1 PHE A 268 -14.365 6.715 -5.474 1.00 24.95 C ATOM 33 CE2 PHE A 268 -14.781 4.850 -6.903 1.00 27.20 C ATOM 34 CZ PHE A 268 -14.117 5.412 -5.832 1.00 24.73 C ATOM 35 H PHE A 268 -19.402 6.082 -7.561 1.00 0.00 H ATOM 36 N GLN A 269 -19.141 10.130 -7.748 1.00 21.82 N ATOM 37 CA GLN A 269 -19.983 11.115 -8.431 1.00 21.14 C ATOM 38 C GLN A 269 -19.085 12.122 -9.164 1.00 21.04 C ATOM 39 O GLN A 269 -17.876 12.151 -8.947 1.00 19.77 O ATOM 40 CB GLN A 269 -20.939 11.837 -7.453 1.00 23.57 C ATOM 41 CG GLN A 269 -21.845 10.919 -6.599 1.00 37.63 C ATOM 42 CD GLN A 269 -22.827 10.049 -7.368 1.00 58.96 C ATOM 43 OE1 GLN A 269 -23.409 10.444 -8.388 1.00 49.66 O ATOM 44 NE2 GLN A 269 -23.080 8.855 -6.845 1.00 55.09 N ATOM 45 HE22 GLN A 269 -22.578 8.546 -5.988 1.00 0.00 H ATOM 46 HE21 GLN A 269 -23.780 8.229 -7.292 1.00 0.00 H ATOM 47 H GLN A 269 -18.400 10.469 -7.101 1.00 0.00 H ATOM 48 N VAL A 270 -19.688 12.933 -10.045 1.00 18.19 N ATOM 49 CA VAL A 270 -18.975 13.955 -10.818 1.00 16.82 C ATOM 50 C VAL A 270 -18.178 14.874 -9.901 1.00 20.63 C ATOM 51 O VAL A 270 -18.706 15.351 -8.895 1.00 20.70 O ATOM 52 CB VAL A 270 -19.971 14.742 -11.717 1.00 21.50 C ATOM 53 CG1 VAL A 270 -19.296 15.925 -12.398 1.00 21.15 C ATOM 54 CG2 VAL A 270 -20.593 13.816 -12.760 1.00 21.65 C ATOM 55 H VAL A 270 -20.713 12.832 -10.187 1.00 0.00 H ATOM 56 N GLY A 271 -16.909 15.083 -10.238 1.00 17.40 N ATOM 57 CA GLY A 271 -16.045 15.954 -9.451 1.00 17.01 C ATOM 58 C GLY A 271 -15.248 15.237 -8.386 1.00 19.76 C ATOM 59 O GLY A 271 -14.366 15.850 -7.801 1.00 17.91 O ATOM 60 H GLY A 271 -16.524 14.614 -11.083 1.00 0.00 H ATOM 61 N ASP A 272 -15.536 13.942 -8.129 1.00 17.02 N ATOM 62 CA ASP A 272 -14.728 13.173 -7.167 1.00 16.45 C ATOM 63 C ASP A 272 -13.330 12.966 -7.737 1.00 19.27 C ATOM 64 O ASP A 272 -13.163 12.745 -8.951 1.00 18.29 O ATOM 65 CB ASP A 272 -15.359 11.807 -6.866 1.00 18.68 C ATOM 66 CG ASP A 272 -16.543 11.856 -5.919 1.00 22.74 C ATOM 67 OD1 ASP A 272 -16.751 12.909 -5.279 1.00 25.50 O ATOM 68 OD2 ASP A 272 -17.231 10.824 -5.778 1.00 24.39 O ATOM 69 H ASP A 272 -16.334 13.485 -8.614 1.00 0.00 H ATOM 70 N LEU A 273 -12.320 13.050 -6.854 1.00 16.29 N ATOM 71 CA LEU A 273 -10.943 12.804 -7.249 1.00 15.63 C ATOM 72 C LEU A 273 -10.665 11.327 -7.010 1.00 18.22 C ATOM 73 O LEU A 273 -10.963 10.785 -5.934 1.00 18.97 O ATOM 74 CB LEU A 273 -9.974 13.653 -6.423 1.00 16.07 C ATOM 75 CG LEU A 273 -10.066 15.173 -6.615 1.00 19.39 C ATOM 76 CD1 LEU A 273 -9.084 15.871 -5.700 1.00 20.67 C ATOM 77 CD2 LEU A 273 -9.714 15.572 -8.039 1.00 20.84 C ATOM 78 H LEU A 273 -12.529 13.297 -5.865 1.00 0.00 H ATOM 79 N VAL A 274 -10.097 10.684 -8.020 1.00 14.58 N ATOM 80 CA VAL A 274 -9.788 9.258 -7.967 1.00 13.91 C ATOM 81 C VAL A 274 -8.429 8.957 -8.611 1.00 18.03 C ATOM 82 O VAL A 274 -7.918 9.757 -9.395 1.00 16.45 O ATOM 83 CB VAL A 274 -10.895 8.414 -8.681 1.00 16.94 C ATOM 84 CG1 VAL A 274 -12.264 8.544 -7.999 1.00 17.01 C ATOM 85 CG2 VAL A 274 -10.991 8.742 -10.187 1.00 16.89 C ATOM 86 H VAL A 274 -9.863 11.215 -8.883 1.00 0.00 H ATOM 87 N TRP A 275 -7.859 7.805 -8.273 1.00 15.36 N ATOM 88 CA TRP A 275 -6.694 7.271 -8.971 1.00 14.97 C ATOM 89 C TRP A 275 -7.289 6.241 -9.929 1.00 17.35 C ATOM 90 O TRP A 275 -8.170 5.477 -9.507 1.00 16.80 O ATOM 91 CB TRP A 275 -5.787 6.471 -8.028 1.00 14.85 C ATOM 92 CG TRP A 275 -5.081 7.257 -6.980 1.00 15.70 C ATOM 93 CD1 TRP A 275 -5.459 7.399 -5.676 1.00 19.22 C ATOM 94 CD2 TRP A 275 -3.774 7.838 -7.088 1.00 15.92 C ATOM 95 NE1 TRP A 275 -4.482 8.065 -4.970 1.00 18.95 N ATOM 96 CE2 TRP A 275 -3.420 8.315 -5.803 1.00 19.95 C ATOM 97 CE3 TRP A 275 -2.838 7.953 -8.136 1.00 16.37 C ATOM 98 CZ2 TRP A 275 -2.196 8.951 -5.549 1.00 19.19 C ATOM 99 CZ3 TRP A 275 -1.629 8.601 -7.886 1.00 17.36 C ATOM 100 CH2 TRP A 275 -1.325 9.100 -6.608 1.00 18.55 C ATOM 101 HE1 TRP A 275 -4.540 8.335 -3.967 1.00 0.00 H ATOM 102 H TRP A 275 -8.259 7.263 -7.480 1.00 0.00 H ATOM 103 N SER A 276 -6.785 6.150 -11.177 1.00 16.33 N ATOM 104 CA SER A 276 -7.235 5.123 -12.136 1.00 16.10 C ATOM 105 C SER A 276 -6.022 4.364 -12.655 1.00 18.13 C ATOM 106 O SER A 276 -4.994 4.984 -12.895 1.00 17.78 O ATOM 107 CB SER A 276 -7.958 5.743 -13.329 1.00 19.58 C ATOM 108 OG SER A 276 -9.023 6.585 -12.913 1.00 20.89 O ATOM 109 HG SER A 276 -9.469 6.969 -13.709 1.00 0.00 H ATOM 110 H SER A 276 -6.054 6.827 -11.474 1.00 0.00 H ATOM 111 N LYS A 277 -6.155 3.044 -12.828 1.00 17.03 N ATOM 112 CA LYS A 277 -5.090 2.187 -13.351 1.00 17.03 C ATOM 113 C LYS A 277 -5.577 1.723 -14.715 1.00 21.94 C ATOM 114 O LYS A 277 -6.491 0.893 -14.796 1.00 22.40 O ATOM 115 CB LYS A 277 -4.831 0.996 -12.400 1.00 19.44 C ATOM 116 CG LYS A 277 -3.653 0.130 -12.804 1.00 26.82 C ATOM 117 CD LYS A 277 -2.318 0.719 -12.359 1.00 27.96 C ATOM 118 CE LYS A 277 -1.192 -0.271 -12.588 1.00 30.16 C ATOM 119 NZ LYS A 277 -0.898 -0.408 -14.041 1.00 39.08 N ATOM 120 HZ1 LYS A 277 -1.749 -0.746 -14.535 1.00 0.00 H ATOM 121 HZ2 LYS A 277 -0.616 0.517 -14.425 1.00 0.00 H ATOM 122 HZ3 LYS A 277 -0.124 -1.090 -14.174 1.00 0.00 H ATOM 123 H LYS A 277 -7.063 2.604 -12.578 1.00 0.00 H ATOM 124 N VAL A 278 -4.997 2.296 -15.783 1.00 18.75 N ATOM 125 CA VAL A 278 -5.459 2.060 -17.153 1.00 18.72 C ATOM 126 C VAL A 278 -4.314 1.636 -18.062 1.00 23.93 C ATOM 127 O VAL A 278 -3.270 2.290 -18.086 1.00 22.04 O ATOM 128 CB VAL A 278 -6.167 3.340 -17.695 1.00 22.26 C ATOM 129 CG1 VAL A 278 -6.604 3.180 -19.154 1.00 23.65 C ATOM 130 CG2 VAL A 278 -7.352 3.754 -16.821 1.00 21.35 C ATOM 131 H VAL A 278 -4.188 2.932 -15.631 1.00 0.00 H ATOM 132 N GLY A 279 -4.559 0.586 -18.847 1.00 23.33 N ATOM 133 CA GLY A 279 -3.600 0.065 -19.809 1.00 23.65 C ATOM 134 C GLY A 279 -2.230 -0.191 -19.218 1.00 26.11 C ATOM 135 O GLY A 279 -2.110 -0.855 -18.190 1.00 27.04 O ATOM 136 H GLY A 279 -5.483 0.115 -18.767 1.00 0.00 H ATOM 137 N THR A 280 -1.200 0.399 -19.835 1.00 21.51 N ATOM 138 CA THR A 280 0.184 0.227 -19.405 1.00 21.05 C ATOM 139 C THR A 280 0.644 1.321 -18.448 1.00 22.18 C ATOM 140 O THR A 280 1.804 1.335 -18.059 1.00 22.54 O ATOM 141 CB THR A 280 1.113 0.191 -20.633 1.00 28.70 C ATOM 142 OG1 THR A 280 0.971 1.418 -21.361 1.00 25.96 O ATOM 143 CG2 THR A 280 0.842 -0.985 -21.533 1.00 27.09 C ATOM 144 HG1 THR A 280 1.218 2.178 -20.776 1.00 0.00 H ATOM 145 H THR A 280 -1.394 1.006 -20.657 1.00 0.00 H ATOM 146 N TYR A 281 -0.254 2.242 -18.077 1.00 18.15 N ATOM 147 CA TYR A 281 0.118 3.375 -17.235 1.00 17.14 C ATOM 148 C TYR A 281 0.074 3.070 -15.750 1.00 19.68 C ATOM 149 O TYR A 281 -0.714 2.220 -15.317 1.00 19.13 O ATOM 150 CB TYR A 281 -0.821 4.551 -17.527 1.00 18.16 C ATOM 151 CG TYR A 281 -0.592 5.191 -18.875 1.00 20.73 C ATOM 152 CD1 TYR A 281 0.342 6.214 -19.034 1.00 23.25 C ATOM 153 CD2 TYR A 281 -1.324 4.794 -19.988 1.00 22.84 C ATOM 154 CE1 TYR A 281 0.538 6.828 -20.270 1.00 26.65 C ATOM 155 CE2 TYR A 281 -1.143 5.406 -21.229 1.00 23.73 C ATOM 156 CZ TYR A 281 -0.207 6.416 -21.365 1.00 31.41 C ATOM 157 OH TYR A 281 -0.032 7.018 -22.584 1.00 36.22 O ATOM 158 HH TYR A 281 0.669 7.713 -22.510 1.00 0.00 H ATOM 159 H TYR A 281 -1.239 2.148 -18.396 1.00 0.00 H ATOM 160 N PRO A 282 0.859 3.807 -14.932 1.00 16.65 N ATOM 161 CA PRO A 282 0.766 3.614 -13.479 1.00 16.41 C ATOM 162 C PRO A 282 -0.529 4.223 -12.947 1.00 18.49 C ATOM 163 O PRO A 282 -1.197 4.978 -13.672 1.00 18.14 O ATOM 164 CB PRO A 282 1.954 4.428 -12.949 1.00 18.43 C ATOM 165 CG PRO A 282 2.127 5.528 -13.941 1.00 22.71 C ATOM 166 CD PRO A 282 1.814 4.886 -15.274 1.00 18.81 C ATOM 167 N TRP A 283 -0.855 3.957 -11.673 1.00 16.50 N ATOM 168 CA TRP A 283 -1.992 4.600 -10.998 1.00 16.14 C ATOM 169 C TRP A 283 -1.878 6.098 -11.245 1.00 18.30 C ATOM 170 O TRP A 283 -0.801 6.694 -11.052 1.00 15.86 O ATOM 171 CB TRP A 283 -1.958 4.303 -9.509 1.00 16.35 C ATOM 172 CG TRP A 283 -2.388 2.903 -9.187 1.00 18.03 C ATOM 173 CD1 TRP A 283 -1.579 1.841 -8.889 1.00 21.85 C ATOM 174 CD2 TRP A 283 -3.737 2.419 -9.095 1.00 18.03 C ATOM 175 NE1 TRP A 283 -2.342 0.734 -8.589 1.00 21.97 N ATOM 176 CE2 TRP A 283 -3.670 1.059 -8.716 1.00 22.30 C ATOM 177 CE3 TRP A 283 -4.996 3.006 -9.290 1.00 18.36 C ATOM 178 CZ2 TRP A 283 -4.824 0.273 -8.519 1.00 21.71 C ATOM 179 CZ3 TRP A 283 -6.135 2.239 -9.073 1.00 20.30 C ATOM 180 CH2 TRP A 283 -6.043 0.883 -8.712 1.00 21.85 C ATOM 181 HE1 TRP A 283 -1.972 -0.197 -8.311 1.00 0.00 H ATOM 182 H TRP A 283 -0.282 3.270 -11.143 1.00 0.00 H ATOM 183 N TRP A 284 -2.959 6.688 -11.765 1.00 15.15 N ATOM 184 CA TRP A 284 -2.923 8.072 -12.227 1.00 14.58 C ATOM 185 C TRP A 284 -3.996 8.941 -11.611 1.00 15.84 C ATOM 186 O TRP A 284 -5.129 8.501 -11.510 1.00 15.44 O ATOM 187 CB TRP A 284 -3.117 8.072 -13.749 1.00 13.60 C ATOM 188 CG TRP A 284 -2.500 9.246 -14.429 1.00 14.10 C ATOM 189 CD1 TRP A 284 -3.033 10.499 -14.577 1.00 16.47 C ATOM 190 CD2 TRP A 284 -1.210 9.277 -15.043 1.00 14.70 C ATOM 191 NE1 TRP A 284 -2.119 11.327 -15.211 1.00 16.39 N ATOM 192 CE2 TRP A 284 -0.997 10.593 -15.517 1.00 18.54 C ATOM 193 CE3 TRP A 284 -0.204 8.307 -15.244 1.00 16.21 C ATOM 194 CZ2 TRP A 284 0.171 10.959 -16.196 1.00 19.29 C ATOM 195 CZ3 TRP A 284 0.951 8.668 -15.915 1.00 18.51 C ATOM 196 CH2 TRP A 284 1.135 9.980 -16.383 1.00 19.64 C ATOM 197 HE1 TRP A 284 -2.259 12.336 -15.420 1.00 0.00 H ATOM 198 H TRP A 284 -3.845 6.149 -11.842 1.00 0.00 H ATOM 199 N PRO A 285 -3.664 10.193 -11.241 1.00 13.76 N ATOM 200 CA PRO A 285 -4.685 11.089 -10.679 1.00 12.88 C ATOM 201 C PRO A 285 -5.707 11.538 -11.717 1.00 16.39 C ATOM 202 O PRO A 285 -5.363 12.000 -12.808 1.00 15.12 O ATOM 203 CB PRO A 285 -3.862 12.286 -10.196 1.00 14.27 C ATOM 204 CG PRO A 285 -2.662 12.302 -11.098 1.00 18.40 C ATOM 205 CD PRO A 285 -2.335 10.854 -11.278 1.00 14.36 C ATOM 206 N CYS A 286 -6.987 11.403 -11.349 1.00 13.55 N ATOM 207 CA CYS A 286 -8.130 11.726 -12.210 1.00 13.06 C ATOM 208 C CYS A 286 -9.214 12.499 -11.493 1.00 14.43 C ATOM 209 O CYS A 286 -9.289 12.485 -10.270 1.00 14.37 O ATOM 210 CB CYS A 286 -8.738 10.436 -12.750 1.00 13.40 C ATOM 211 SG CYS A 286 -7.590 9.398 -13.667 1.00 16.21 S ATOM 212 H CYS A 286 -7.184 11.047 -10.392 1.00 0.00 H ATOM 213 N MET A 287 -10.171 12.991 -12.289 1.00 13.53 N ATOM 214 CA MET A 287 -11.426 13.530 -11.777 1.00 12.09 C ATOM 215 C MET A 287 -12.589 12.820 -12.491 1.00 14.79 C ATOM 216 O MET A 287 -12.582 12.698 -13.729 1.00 14.17 O ATOM 217 CB MET A 287 -11.543 15.043 -11.982 1.00 13.80 C ATOM 218 CG MET A 287 -12.798 15.593 -11.326 1.00 16.55 C ATOM 219 SD MET A 287 -13.067 17.363 -11.553 1.00 18.63 S ATOM 220 CE MET A 287 -13.471 17.434 -13.286 1.00 16.70 C ATOM 221 H MET A 287 -10.013 12.989 -13.317 1.00 0.00 H ATOM 222 N VAL A 288 -13.575 12.348 -11.719 1.00 13.38 N ATOM 223 CA VAL A 288 -14.761 11.718 -12.316 1.00 12.03 C ATOM 224 C VAL A 288 -15.572 12.818 -13.040 1.00 16.03 C ATOM 225 O VAL A 288 -15.734 13.919 -12.510 1.00 16.04 O ATOM 226 CB VAL A 288 -15.587 11.002 -11.209 1.00 16.51 C ATOM 227 CG1 VAL A 288 -16.923 10.477 -11.757 1.00 17.26 C ATOM 228 CG2 VAL A 288 -14.770 9.866 -10.593 1.00 17.12 C ATOM 229 H VAL A 288 -13.501 12.428 -10.685 1.00 0.00 H ATOM 230 N SER A 289 -16.059 12.528 -14.253 1.00 13.40 N ATOM 231 CA SER A 289 -16.824 13.504 -15.015 1.00 12.98 C ATOM 232 C SER A 289 -17.868 12.796 -15.834 1.00 17.57 C ATOM 233 O SER A 289 -17.784 11.586 -16.014 1.00 17.55 O ATOM 234 CB SER A 289 -15.889 14.276 -15.945 1.00 15.48 C ATOM 235 OG SER A 289 -15.394 13.425 -16.968 1.00 15.62 O ATOM 236 HG SER A 289 -14.791 13.940 -17.561 1.00 0.00 H ATOM 237 H SER A 289 -15.887 11.586 -14.659 1.00 0.00 H ATOM 238 N SER A 290 -18.823 13.564 -16.367 1.00 15.83 N ATOM 239 CA SER A 290 -19.871 13.043 -17.246 1.00 15.27 C ATOM 240 C SER A 290 -19.321 12.892 -18.675 1.00 20.32 C ATOM 241 O SER A 290 -18.650 13.794 -19.175 1.00 19.09 O ATOM 242 CB SER A 290 -21.062 13.994 -17.231 1.00 20.33 C ATOM 243 OG SER A 290 -22.109 13.519 -18.056 1.00 31.08 O ATOM 244 HG SER A 290 -22.866 14.156 -18.026 1.00 0.00 H ATOM 245 H SER A 290 -18.821 14.580 -16.147 1.00 0.00 H ATOM 246 N ASP A 291 -19.560 11.742 -19.316 1.00 18.65 N ATOM 247 CA ASP A 291 -19.123 11.540 -20.704 1.00 19.04 C ATOM 248 C ASP A 291 -19.829 12.597 -21.575 1.00 23.97 C ATOM 249 O ASP A 291 -21.038 12.804 -21.422 1.00 23.77 O ATOM 250 CB ASP A 291 -19.437 10.112 -21.178 1.00 21.10 C ATOM 251 CG ASP A 291 -19.027 9.818 -22.606 1.00 24.58 C ATOM 252 OD1 ASP A 291 -19.626 10.402 -23.523 1.00 28.66 O ATOM 253 OD2 ASP A 291 -18.215 8.906 -22.809 1.00 28.16 O ATOM 254 H ASP A 291 -20.064 10.978 -18.823 1.00 0.00 H ATOM 255 N PRO A 292 -19.073 13.318 -22.442 1.00 25.31 N ATOM 256 CA PRO A 292 -19.681 14.396 -23.248 1.00 27.03 C ATOM 257 C PRO A 292 -20.806 13.968 -24.183 1.00 35.04 C ATOM 258 O PRO A 292 -21.654 14.801 -24.513 1.00 37.29 O ATOM 259 CB PRO A 292 -18.494 14.956 -24.040 1.00 28.93 C ATOM 260 CG PRO A 292 -17.477 13.846 -24.061 1.00 31.59 C ATOM 261 CD PRO A 292 -17.620 13.222 -22.696 1.00 25.94 C ATOM 262 N GLN A 293 -20.805 12.691 -24.610 1.00 32.07 N ATOM 263 CA GLN A 293 -21.793 12.106 -25.524 1.00 33.78 C ATOM 264 C GLN A 293 -22.903 11.348 -24.787 1.00 36.91 C ATOM 265 O GLN A 293 -24.088 11.571 -25.073 1.00 38.87 O ATOM 266 CB GLN A 293 -21.093 11.169 -26.527 1.00 35.85 C ATOM 267 CG GLN A 293 -20.596 11.856 -27.798 1.00 49.86 C ATOM 268 CD GLN A 293 -19.368 12.702 -27.578 1.00 61.16 C ATOM 269 OE1 GLN A 293 -19.460 13.909 -27.339 1.00 49.85 O ATOM 270 NE2 GLN A 293 -18.195 12.091 -27.670 1.00 56.80 N ATOM 271 HE22 GLN A 293 -18.154 11.072 -27.873 1.00 0.00 H ATOM 272 HE21 GLN A 293 -17.316 12.631 -27.539 1.00 0.00 H ATOM 273 H GLN A 293 -20.045 12.071 -24.265 1.00 0.00 H ATOM 274 N LEU A 294 -22.531 10.448 -23.847 1.00 30.68 N ATOM 275 CA LEU A 294 -23.519 9.661 -23.109 1.00 30.48 C ATOM 276 C LEU A 294 -24.227 10.454 -22.018 1.00 31.54 C ATOM 277 O LEU A 294 -25.309 10.059 -21.587 1.00 32.31 O ATOM 278 CB LEU A 294 -22.922 8.358 -22.548 1.00 30.19 C ATOM 279 CG LEU A 294 -22.407 7.332 -23.573 1.00 35.30 C ATOM 280 CD1 LEU A 294 -21.642 6.226 -22.887 1.00 35.01 C ATOM 281 CD2 LEU A 294 -23.559 6.730 -24.411 1.00 38.67 C ATOM 282 H LEU A 294 -21.520 10.313 -23.645 1.00 0.00 H ATOM 283 N GLU A 295 -23.590 11.547 -21.538 1.00 25.61 N ATOM 284 CA GLU A 295 -24.119 12.435 -20.491 1.00 24.99 C ATOM 285 C GLU A 295 -24.377 11.691 -19.170 1.00 27.79 C ATOM 286 O GLU A 295 -25.282 12.029 -18.394 1.00 28.80 O ATOM 287 CB GLU A 295 -25.347 13.243 -20.971 1.00 27.78 C ATOM 288 CG GLU A 295 -25.122 13.977 -22.283 1.00 34.67 C ATOM 289 CD GLU A 295 -26.279 14.832 -22.761 1.00 54.46 C ATOM 290 OE1 GLU A 295 -27.413 14.308 -22.864 1.00 48.52 O ATOM 291 OE2 GLU A 295 -26.033 16.013 -23.100 1.00 43.81 O ATOM 292 H GLU A 295 -22.658 11.776 -21.939 1.00 0.00 H ATOM 293 N VAL A 296 -23.506 10.710 -18.893 1.00 23.78 N ATOM 294 CA VAL A 296 -23.467 9.916 -17.671 1.00 22.78 C ATOM 295 C VAL A 296 -22.004 9.794 -17.221 1.00 22.50 C ATOM 296 O VAL A 296 -21.100 9.757 -18.076 1.00 20.98 O ATOM 297 CB VAL A 296 -24.144 8.517 -17.800 1.00 28.51 C ATOM 298 CG1 VAL A 296 -25.654 8.638 -17.974 1.00 30.89 C ATOM 299 CG2 VAL A 296 -23.517 7.680 -18.920 1.00 27.88 C ATOM 300 H VAL A 296 -22.791 10.495 -19.618 1.00 0.00 H ATOM 301 N HIS A 297 -21.777 9.729 -15.898 1.00 19.21 N ATOM 302 CA HIS A 297 -20.418 9.566 -15.334 1.00 17.45 C ATOM 303 C HIS A 297 -20.128 8.100 -14.961 1.00 20.16 C ATOM 304 O HIS A 297 -19.019 7.755 -14.545 1.00 19.41 O ATOM 305 CB HIS A 297 -20.226 10.482 -14.114 1.00 17.66 C ATOM 306 CG HIS A 297 -20.923 9.997 -12.884 1.00 21.47 C ATOM 307 ND1 HIS A 297 -22.286 10.173 -12.706 1.00 24.46 N ATOM 308 CD2 HIS A 297 -20.422 9.327 -11.821 1.00 22.66 C ATOM 309 CE1 HIS A 297 -22.564 9.636 -11.528 1.00 24.57 C ATOM 310 NE2 HIS A 297 -21.473 9.103 -10.964 1.00 23.96 N ATOM 311 H HIS A 297 -22.585 9.796 -15.247 1.00 0.00 H ATOM 312 N THR A 298 -21.155 7.258 -15.035 1.00 19.84 N ATOM 313 CA THR A 298 -21.033 5.844 -14.709 1.00 19.29 C ATOM 314 C THR A 298 -21.960 5.034 -15.614 1.00 22.34 C ATOM 315 O THR A 298 -22.981 5.546 -16.064 1.00 22.13 O ATOM 316 CB THR A 298 -21.289 5.572 -13.212 1.00 23.87 C ATOM 317 OG1 THR A 298 -20.941 4.217 -12.930 1.00 22.55 O ATOM 318 CG2 THR A 298 -22.747 5.849 -12.775 1.00 26.02 C ATOM 319 HG1 THR A 298 -19.985 4.072 -13.141 1.00 0.00 H ATOM 320 H THR A 298 -22.081 7.623 -15.337 1.00 0.00 H ATOM 321 N LYS A 299 -21.582 3.788 -15.898 1.00 19.30 N ATOM 322 CA LYS A 299 -22.401 2.912 -16.744 1.00 21.09 C ATOM 323 C LYS A 299 -22.080 1.457 -16.480 1.00 24.20 C ATOM 324 O LYS A 299 -21.046 1.142 -15.890 1.00 24.55 O ATOM 325 CB LYS A 299 -22.167 3.234 -18.248 1.00 23.55 C ATOM 326 CG LYS A 299 -20.872 2.675 -18.828 1.00 29.19 C ATOM 327 CD LYS A 299 -20.607 3.136 -20.244 1.00 31.91 C ATOM 328 CE LYS A 299 -19.327 2.530 -20.757 1.00 35.17 C ATOM 329 NZ LYS A 299 -19.050 2.938 -22.156 1.00 39.61 N ATOM 330 HZ1 LYS A 299 -19.830 2.624 -22.768 1.00 0.00 H ATOM 331 HZ2 LYS A 299 -18.965 3.973 -22.204 1.00 0.00 H ATOM 332 HZ3 LYS A 299 -18.161 2.501 -22.474 1.00 0.00 H ATOM 333 H LYS A 299 -20.686 3.428 -15.511 1.00 0.00 H ATOM 334 N ILE A 300 -22.954 0.570 -16.949 1.00 22.27 N ATOM 335 CA ILE A 300 -22.695 -0.851 -16.911 1.00 21.33 C ATOM 336 C ILE A 300 -22.190 -1.170 -18.325 1.00 26.24 C ATOM 337 O ILE A 300 -22.879 -0.850 -19.313 1.00 26.08 O ATOM 338 CB ILE A 300 -23.975 -1.654 -16.548 1.00 25.73 C ATOM 339 CG1 ILE A 300 -24.582 -1.217 -15.171 1.00 26.44 C ATOM 340 CG2 ILE A 300 -23.715 -3.145 -16.626 1.00 27.48 C ATOM 341 CD1 ILE A 300 -23.606 -1.197 -13.951 1.00 30.97 C ATOM 342 H ILE A 300 -23.849 0.909 -17.355 1.00 0.00 H ATOM 343 N ASN A 301 -21.000 -1.790 -18.413 1.00 24.42 N ATOM 344 CA ASN A 301 -20.391 -2.128 -19.696 1.00 24.75 C ATOM 345 C ASN A 301 -21.007 -3.384 -20.345 1.00 30.00 C ATOM 346 O ASN A 301 -21.886 -4.054 -19.767 1.00 28.82 O ATOM 347 CB ASN A 301 -18.854 -2.223 -19.587 1.00 24.92 C ATOM 348 CG ASN A 301 -18.305 -3.390 -18.788 1.00 37.30 C ATOM 349 OD1 ASN A 301 -18.969 -4.415 -18.560 1.00 28.53 O ATOM 350 ND2 ASN A 301 -17.050 -3.267 -18.369 1.00 29.13 N ATOM 351 HD22 ASN A 301 -16.516 -2.398 -18.573 1.00 0.00 H ATOM 352 HD21 ASN A 301 -16.601 -4.040 -17.837 1.00 0.00 H ATOM 353 H ASN A 301 -20.496 -2.037 -17.537 1.00 0.00 H ATOM 354 N THR A 302 -20.508 -3.724 -21.550 1.00 29.33 N ATOM 355 CA THR A 302 -20.980 -4.867 -22.340 1.00 31.46 C ATOM 356 C THR A 302 -20.704 -6.238 -21.683 1.00 34.44 C ATOM 357 O THR A 302 -21.261 -7.255 -22.118 1.00 34.63 O ATOM 358 CB THR A 302 -20.429 -4.803 -23.770 1.00 43.64 C ATOM 359 OG1 THR A 302 -19.012 -4.920 -23.733 1.00 41.91 O ATOM 360 CG2 THR A 302 -20.851 -3.539 -24.512 1.00 43.73 C ATOM 361 HG1 THR A 302 -18.654 -4.879 -24.655 1.00 0.00 H ATOM 362 H THR A 302 -19.742 -3.141 -21.944 1.00 0.00 H ATOM 363 N ARG A 303 -19.861 -6.254 -20.636 1.00 30.06 N ATOM 364 CA ARG A 303 -19.543 -7.457 -19.869 1.00 31.84 C ATOM 365 C ARG A 303 -20.376 -7.501 -18.572 1.00 34.62 C ATOM 366 O ARG A 303 -20.297 -8.471 -17.819 1.00 36.31 O ATOM 367 CB ARG A 303 -18.032 -7.538 -19.582 1.00 34.47 C ATOM 368 CG ARG A 303 -17.241 -8.159 -20.730 1.00 51.75 C ATOM 369 CD ARG A 303 -15.747 -7.966 -20.539 1.00 71.10 C ATOM 370 NE ARG A 303 -15.013 -8.119 -21.797 1.00 89.44 N ATOM 371 CZ ARG A 303 -13.688 -8.077 -21.908 1.00107.42 C ATOM 372 NH1 ARG A 303 -12.929 -7.895 -20.833 1.00 95.87 N ATOM 373 NH2 ARG A 303 -13.111 -8.223 -23.093 1.00 95.07 N ATOM 374 HE ARG A 303 -15.566 -8.271 -22.664 1.00 0.00 H ATOM 375 HH12 ARG A 303 -11.894 -7.863 -20.927 1.00 0.00 H ATOM 376 HH11 ARG A 303 -13.370 -7.784 -19.898 1.00 0.00 H ATOM 377 HH22 ARG A 303 -12.075 -8.189 -23.174 1.00 0.00 H ATOM 378 HH21 ARG A 303 -13.695 -8.371 -23.941 1.00 0.00 H ATOM 379 H ARG A 303 -19.410 -5.360 -20.356 1.00 0.00 H ATOM 380 N GLY A 304 -21.161 -6.449 -18.340 1.00 29.64 N ATOM 381 CA GLY A 304 -22.052 -6.334 -17.188 1.00 30.47 C ATOM 382 C GLY A 304 -21.408 -5.749 -15.944 1.00 33.49 C ATOM 383 O GLY A 304 -22.005 -5.803 -14.866 1.00 34.00 O ATOM 384 H GLY A 304 -21.138 -5.663 -19.020 1.00 0.00 H ATOM 385 N ALA A 305 -20.206 -5.160 -16.085 1.00 28.55 N ATOM 386 CA ALA A 305 -19.481 -4.568 -14.963 1.00 26.81 C ATOM 387 C ALA A 305 -19.623 -3.053 -14.938 1.00 28.58 C ATOM 388 O ALA A 305 -19.745 -2.437 -16.003 1.00 27.02 O ATOM 389 CB ALA A 305 -18.012 -4.942 -15.039 1.00 27.22 C ATOM 390 H ALA A 305 -19.776 -5.125 -17.031 1.00 0.00 H ATOM 391 N ARG A 306 -19.571 -2.446 -13.732 1.00 24.43 N ATOM 392 CA ARG A 306 -19.635 -0.986 -13.608 1.00 23.60 C ATOM 393 C ARG A 306 -18.325 -0.327 -14.013 1.00 24.87 C ATOM 394 O ARG A 306 -17.238 -0.792 -13.643 1.00 24.18 O ATOM 395 CB ARG A 306 -20.012 -0.533 -12.177 1.00 24.58 C ATOM 396 CG ARG A 306 -20.208 1.000 -12.102 1.00 30.44 C ATOM 397 CD ARG A 306 -20.959 1.507 -10.890 1.00 30.78 C ATOM 398 NE ARG A 306 -22.307 0.934 -10.767 1.00 28.09 N ATOM 399 CZ ARG A 306 -23.394 1.376 -11.396 1.00 36.20 C ATOM 400 NH1 ARG A 306 -24.565 0.789 -11.200 1.00 30.26 N ATOM 401 NH2 ARG A 306 -23.314 2.395 -12.244 1.00 27.35 N ATOM 402 HE ARG A 306 -22.421 0.115 -10.136 1.00 0.00 H ATOM 403 HH12 ARG A 306 -25.411 1.138 -11.694 1.00 0.00 H ATOM 404 HH11 ARG A 306 -24.639 -0.021 -10.552 1.00 0.00 H ATOM 405 HH22 ARG A 306 -24.168 2.734 -12.731 1.00 0.00 H ATOM 406 HH21 ARG A 306 -22.398 2.854 -12.421 1.00 0.00 H ATOM 407 H ARG A 306 -19.484 -3.026 -12.873 1.00 0.00 H ATOM 408 N GLU A 307 -18.447 0.779 -14.768 1.00 20.38 N ATOM 409 CA GLU A 307 -17.339 1.638 -15.165 1.00 18.20 C ATOM 410 C GLU A 307 -17.642 3.084 -14.771 1.00 20.86 C ATOM 411 O GLU A 307 -18.810 3.467 -14.653 1.00 19.29 O ATOM 412 CB GLU A 307 -17.068 1.543 -16.667 1.00 19.44 C ATOM 413 CG GLU A 307 -16.565 0.174 -17.122 1.00 24.31 C ATOM 414 CD GLU A 307 -16.231 0.076 -18.596 1.00 32.69 C ATOM 415 OE1 GLU A 307 -16.660 0.967 -19.364 1.00 26.74 O ATOM 416 OE2 GLU A 307 -15.600 -0.930 -18.993 1.00 28.62 O ATOM 417 H GLU A 307 -19.400 1.040 -15.092 1.00 0.00 H ATOM 418 N TYR A 308 -16.580 3.885 -14.605 1.00 17.81 N ATOM 419 CA TYR A 308 -16.657 5.312 -14.318 1.00 17.07 C ATOM 420 C TYR A 308 -15.925 6.073 -15.403 1.00 19.16 C ATOM 421 O TYR A 308 -14.925 5.578 -15.946 1.00 17.31 O ATOM 422 CB TYR A 308 -16.034 5.666 -12.964 1.00 17.49 C ATOM 423 CG TYR A 308 -16.841 5.116 -11.812 1.00 19.20 C ATOM 424 CD1 TYR A 308 -17.989 5.764 -11.368 1.00 21.26 C ATOM 425 CD2 TYR A 308 -16.483 3.923 -11.196 1.00 20.82 C ATOM 426 CE1 TYR A 308 -18.750 5.247 -10.319 1.00 22.38 C ATOM 427 CE2 TYR A 308 -17.232 3.399 -10.145 1.00 22.26 C ATOM 428 CZ TYR A 308 -18.369 4.061 -9.714 1.00 27.40 C ATOM 429 OH TYR A 308 -19.108 3.550 -8.674 1.00 28.08 O ATOM 430 HH TYR A 308 -19.433 2.646 -8.914 1.00 0.00 H ATOM 431 H TYR A 308 -15.635 3.458 -14.687 1.00 0.00 H ATOM 432 N HIS A 309 -16.466 7.244 -15.751 1.00 14.38 N ATOM 433 CA HIS A 309 -15.867 8.127 -16.743 1.00 13.13 C ATOM 434 C HIS A 309 -14.954 9.075 -16.019 1.00 14.98 C ATOM 435 O HIS A 309 -15.363 9.724 -15.050 1.00 14.78 O ATOM 436 CB HIS A 309 -16.938 8.881 -17.539 1.00 14.29 C ATOM 437 CG HIS A 309 -16.352 9.715 -18.626 1.00 16.07 C ATOM 438 ND1 HIS A 309 -15.943 11.023 -18.396 1.00 16.31 N ATOM 439 CD2 HIS A 309 -16.069 9.386 -19.910 1.00 17.86 C ATOM 440 CE1 HIS A 309 -15.449 11.451 -19.553 1.00 15.95 C ATOM 441 NE2 HIS A 309 -15.510 10.504 -20.492 1.00 16.62 N ATOM 442 H HIS A 309 -17.353 7.538 -15.294 1.00 0.00 H ATOM 443 N VAL A 310 -13.673 9.110 -16.446 1.00 13.11 N ATOM 444 CA VAL A 310 -12.696 9.962 -15.770 1.00 12.20 C ATOM 445 C VAL A 310 -11.953 10.855 -16.719 1.00 14.52 C ATOM 446 O VAL A 310 -11.748 10.507 -17.895 1.00 14.78 O ATOM 447 CB VAL A 310 -11.684 9.132 -14.919 1.00 15.79 C ATOM 448 CG1 VAL A 310 -12.397 8.213 -13.914 1.00 15.60 C ATOM 449 CG2 VAL A 310 -10.734 8.326 -15.813 1.00 15.69 C ATOM 450 H VAL A 310 -13.381 8.529 -17.258 1.00 0.00 H ATOM 451 N GLN A 311 -11.459 11.972 -16.178 1.00 11.86 N ATOM 452 CA GLN A 311 -10.510 12.855 -16.850 1.00 11.94 C ATOM 453 C GLN A 311 -9.160 12.582 -16.190 1.00 15.00 C ATOM 454 O GLN A 311 -9.089 12.559 -14.971 1.00 15.30 O ATOM 455 CB GLN A 311 -10.826 14.329 -16.559 1.00 12.97 C ATOM 456 CG GLN A 311 -12.162 14.788 -17.142 1.00 14.42 C ATOM 457 CD GLN A 311 -12.398 16.277 -17.079 1.00 16.86 C ATOM 458 OE1 GLN A 311 -13.382 16.771 -17.635 1.00 15.95 O ATOM 459 NE2 GLN A 311 -11.518 17.042 -16.418 1.00 16.40 N ATOM 460 HE22 GLN A 311 -10.695 16.606 -15.956 1.00 0.00 H ATOM 461 HE21 GLN A 311 -11.659 18.071 -16.367 1.00 0.00 H ATOM 462 H GLN A 311 -11.769 12.228 -15.219 1.00 0.00 H ATOM 463 N PHE A 312 -8.091 12.420 -16.972 1.00 12.83 N ATOM 464 CA PHE A 312 -6.742 12.287 -16.404 1.00 12.64 C ATOM 465 C PHE A 312 -6.179 13.685 -16.206 1.00 15.90 C ATOM 466 O PHE A 312 -6.169 14.499 -17.156 1.00 15.42 O ATOM 467 CB PHE A 312 -5.784 11.554 -17.376 1.00 13.34 C ATOM 468 CG PHE A 312 -6.224 10.133 -17.643 1.00 14.02 C ATOM 469 CD1 PHE A 312 -5.897 9.109 -16.764 1.00 16.58 C ATOM 470 CD2 PHE A 312 -6.969 9.822 -18.768 1.00 15.91 C ATOM 471 CE1 PHE A 312 -6.334 7.803 -16.994 1.00 17.27 C ATOM 472 CE2 PHE A 312 -7.397 8.511 -19.003 1.00 18.72 C ATOM 473 CZ PHE A 312 -7.090 7.514 -18.113 1.00 17.52 C ATOM 474 H PHE A 312 -8.215 12.387 -18.004 1.00 0.00 H ATOM 475 N PHE A 313 -5.639 13.946 -14.999 1.00 13.96 N ATOM 476 CA PHE A 313 -4.923 15.194 -14.757 1.00 14.14 C ATOM 477 C PHE A 313 -3.577 15.031 -15.448 1.00 17.61 C ATOM 478 O PHE A 313 -2.897 14.018 -15.216 1.00 16.01 O ATOM 479 CB PHE A 313 -4.723 15.441 -13.265 1.00 15.29 C ATOM 480 CG PHE A 313 -5.947 15.936 -12.551 1.00 15.33 C ATOM 481 CD1 PHE A 313 -6.413 17.233 -12.752 1.00 17.59 C ATOM 482 CD2 PHE A 313 -6.617 15.126 -11.648 1.00 15.94 C ATOM 483 CE1 PHE A 313 -7.539 17.699 -12.070 1.00 17.71 C ATOM 484 CE2 PHE A 313 -7.732 15.598 -10.962 1.00 18.27 C ATOM 485 CZ PHE A 313 -8.187 16.885 -11.174 1.00 15.17 C ATOM 486 H PHE A 313 -5.734 13.250 -14.232 1.00 0.00 H ATOM 487 N SER A 314 -3.199 16.005 -16.297 1.00 17.27 N ATOM 488 CA SER A 314 -1.999 15.920 -17.132 1.00 17.62 C ATOM 489 C SER A 314 -1.855 17.201 -17.960 1.00 23.24 C ATOM 490 O SER A 314 -2.815 17.959 -18.082 1.00 23.69 O ATOM 491 CB SER A 314 -2.189 14.772 -18.128 1.00 19.68 C ATOM 492 OG SER A 314 -1.134 14.635 -19.064 1.00 21.18 O ATOM 493 HG SER A 314 -1.328 13.877 -19.670 1.00 0.00 H ATOM 494 H SER A 314 -3.788 16.860 -16.363 1.00 0.00 H ATOM 495 N ASN A 315 -0.701 17.376 -18.629 1.00 21.99 N ATOM 496 CA ASN A 315 -0.510 18.472 -19.586 1.00 23.25 C ATOM 497 C ASN A 315 -1.192 18.072 -20.916 1.00 28.81 C ATOM 498 O ASN A 315 -1.312 18.898 -21.828 1.00 30.60 O ATOM 499 CB ASN A 315 0.989 18.719 -19.835 1.00 23.70 C ATOM 500 CG ASN A 315 1.686 17.517 -20.427 1.00 33.88 C ATOM 501 OD1 ASN A 315 1.547 16.387 -19.951 1.00 27.48 O ATOM 502 ND2 ASN A 315 2.408 17.724 -21.508 1.00 33.34 N ATOM 503 HD22 ASN A 315 2.509 18.686 -21.889 1.00 0.00 H ATOM 504 HD21 ASN A 315 2.877 16.925 -21.981 1.00 0.00 H ATOM 505 H ASN A 315 0.082 16.712 -18.462 1.00 0.00 H ATOM 506 N GLN A 316 -1.608 16.784 -21.029 1.00 23.38 N ATOM 507 CA GLN A 316 -2.242 16.214 -22.217 1.00 22.94 C ATOM 508 C GLN A 316 -3.674 15.786 -21.824 1.00 25.16 C ATOM 509 O GLN A 316 -3.856 14.675 -21.352 1.00 24.03 O ATOM 510 CB GLN A 316 -1.408 15.019 -22.723 1.00 24.20 C ATOM 511 CG GLN A 316 -1.994 14.237 -23.919 1.00 28.93 C ATOM 512 CD GLN A 316 -1.356 12.868 -24.051 1.00 47.67 C ATOM 513 OE1 GLN A 316 -0.247 12.608 -23.558 1.00 44.38 O ATOM 514 NE2 GLN A 316 -2.043 11.951 -24.722 1.00 35.19 N ATOM 515 HE22 GLN A 316 -2.971 12.190 -25.127 1.00 0.00 H ATOM 516 HE21 GLN A 316 -1.653 10.994 -24.842 1.00 0.00 H ATOM 517 H GLN A 316 -1.465 16.158 -20.211 1.00 0.00 H ATOM 518 N PRO A 317 -4.699 16.648 -21.987 1.00 23.09 N ATOM 519 CA PRO A 317 -6.057 16.254 -21.545 1.00 21.93 C ATOM 520 C PRO A 317 -6.611 15.043 -22.292 1.00 22.52 C ATOM 521 O PRO A 317 -6.555 14.981 -23.509 1.00 22.88 O ATOM 522 CB PRO A 317 -6.903 17.515 -21.763 1.00 24.78 C ATOM 523 CG PRO A 317 -6.095 18.410 -22.621 1.00 29.79 C ATOM 524 CD PRO A 317 -4.656 18.045 -22.464 1.00 25.91 C ATOM 525 N GLU A 318 -7.071 14.038 -21.544 1.00 17.50 N ATOM 526 CA GLU A 318 -7.622 12.798 -22.091 1.00 15.94 C ATOM 527 C GLU A 318 -8.654 12.297 -21.114 1.00 17.25 C ATOM 528 O GLU A 318 -8.628 12.657 -19.936 1.00 15.95 O ATOM 529 CB GLU A 318 -6.543 11.702 -22.246 1.00 17.28 C ATOM 530 CG GLU A 318 -5.380 12.035 -23.178 1.00 23.08 C ATOM 531 CD GLU A 318 -5.677 12.058 -24.668 1.00 34.47 C ATOM 532 OE1 GLU A 318 -6.840 11.812 -25.062 1.00 24.74 O ATOM 533 OE2 GLU A 318 -4.723 12.264 -25.452 1.00 31.15 O ATOM 534 H GLU A 318 -7.036 14.143 -20.510 1.00 0.00 H ATOM 535 N ARG A 319 -9.540 11.447 -21.599 1.00 16.51 N ATOM 536 CA ARG A 319 -10.610 10.870 -20.790 1.00 15.57 C ATOM 537 C ARG A 319 -10.684 9.378 -21.055 1.00 18.47 C ATOM 538 O ARG A 319 -10.138 8.894 -22.060 1.00 18.76 O ATOM 539 CB ARG A 319 -11.970 11.542 -21.122 1.00 17.77 C ATOM 540 CG ARG A 319 -12.221 11.695 -22.639 1.00 25.68 C ATOM 541 CD ARG A 319 -13.655 11.603 -23.094 1.00 41.09 C ATOM 542 NE ARG A 319 -14.143 10.231 -22.985 1.00 55.77 N ATOM 543 CZ ARG A 319 -15.157 9.729 -23.679 1.00 68.90 C ATOM 544 NH1 ARG A 319 -15.531 8.470 -23.498 1.00 53.46 N ATOM 545 NH2 ARG A 319 -15.798 10.478 -24.569 1.00 62.72 N ATOM 546 HE ARG A 319 -13.660 9.600 -22.314 1.00 0.00 H ATOM 547 HH12 ARG A 319 -16.326 8.080 -24.044 1.00 0.00 H ATOM 548 HH11 ARG A 319 -15.029 7.872 -22.810 1.00 0.00 H ATOM 549 HH22 ARG A 319 -16.592 10.079 -25.109 1.00 0.00 H ATOM 550 HH21 ARG A 319 -15.506 11.464 -24.725 1.00 0.00 H ATOM 551 H ARG A 319 -9.473 11.177 -22.601 1.00 0.00 H ATOM 552 N ALA A 320 -11.379 8.645 -20.170 1.00 15.11 N ATOM 553 CA ALA A 320 -11.564 7.205 -20.371 1.00 15.71 C ATOM 554 C ALA A 320 -12.659 6.650 -19.523 1.00 17.52 C ATOM 555 O ALA A 320 -12.975 7.197 -18.472 1.00 17.32 O ATOM 556 CB ALA A 320 -10.280 6.443 -20.046 1.00 16.43 C ATOM 557 H ALA A 320 -11.791 9.104 -19.333 1.00 0.00 H ATOM 558 N TRP A 321 -13.212 5.521 -19.969 1.00 16.58 N ATOM 559 CA TRP A 321 -14.148 4.733 -19.181 1.00 16.28 C ATOM 560 C TRP A 321 -13.289 3.687 -18.485 1.00 19.58 C ATOM 561 O TRP A 321 -12.517 2.986 -19.148 1.00 19.78 O ATOM 562 CB TRP A 321 -15.199 4.050 -20.071 1.00 16.75 C ATOM 563 CG TRP A 321 -16.320 4.978 -20.417 1.00 18.17 C ATOM 564 CD1 TRP A 321 -16.496 5.666 -21.583 1.00 21.61 C ATOM 565 CD2 TRP A 321 -17.397 5.366 -19.552 1.00 17.95 C ATOM 566 NE1 TRP A 321 -17.647 6.426 -21.513 1.00 21.55 N ATOM 567 CE2 TRP A 321 -18.217 6.259 -20.276 1.00 22.59 C ATOM 568 CE3 TRP A 321 -17.777 5.003 -18.247 1.00 18.61 C ATOM 569 CZ2 TRP A 321 -19.371 6.827 -19.723 1.00 22.21 C ATOM 570 CZ3 TRP A 321 -18.920 5.572 -17.704 1.00 19.99 C ATOM 571 CH2 TRP A 321 -19.702 6.465 -18.442 1.00 20.61 C ATOM 572 HE1 TRP A 321 -18.021 7.027 -22.274 1.00 0.00 H ATOM 573 H TRP A 321 -12.963 5.189 -20.923 1.00 0.00 H ATOM 574 N VAL A 322 -13.406 3.599 -17.154 1.00 16.43 N ATOM 575 CA VAL A 322 -12.558 2.729 -16.330 1.00 16.96 C ATOM 576 C VAL A 322 -13.393 1.794 -15.465 1.00 21.31 C ATOM 577 O VAL A 322 -14.290 2.259 -14.763 1.00 19.71 O ATOM 578 CB VAL A 322 -11.571 3.572 -15.461 1.00 20.01 C ATOM 579 CG1 VAL A 322 -10.597 2.679 -14.700 1.00 20.54 C ATOM 580 CG2 VAL A 322 -10.801 4.597 -16.314 1.00 19.29 C ATOM 581 H VAL A 322 -14.132 4.174 -16.682 1.00 0.00 H ATOM 582 N HIS A 323 -13.041 0.485 -15.479 1.00 18.82 N ATOM 583 CA HIS A 323 -13.683 -0.546 -14.661 1.00 20.06 C ATOM 584 C HIS A 323 -13.561 -0.123 -13.196 1.00 22.85 C ATOM 585 O HIS A 323 -12.483 0.323 -12.784 1.00 22.47 O ATOM 586 CB HIS A 323 -12.963 -1.904 -14.868 1.00 21.91 C ATOM 587 CG HIS A 323 -13.691 -3.090 -14.315 1.00 27.08 C ATOM 588 ND1 HIS A 323 -13.826 -3.284 -12.953 1.00 29.21 N ATOM 589 CD2 HIS A 323 -14.291 -4.118 -14.961 1.00 30.45 C ATOM 590 CE1 HIS A 323 -14.518 -4.407 -12.816 1.00 30.54 C ATOM 591 NE2 HIS A 323 -14.805 -4.948 -13.994 1.00 31.59 N ATOM 592 H HIS A 323 -12.267 0.195 -16.110 1.00 0.00 H ATOM 593 N GLU A 324 -14.657 -0.227 -12.424 1.00 21.49 N ATOM 594 CA GLU A 324 -14.698 0.144 -11.000 1.00 21.93 C ATOM 595 C GLU A 324 -13.570 -0.465 -10.155 1.00 27.09 C ATOM 596 O GLU A 324 -13.121 0.185 -9.212 1.00 28.52 O ATOM 597 CB GLU A 324 -16.066 -0.159 -10.369 1.00 24.45 C ATOM 598 CG GLU A 324 -16.472 -1.627 -10.406 1.00 31.07 C ATOM 599 CD GLU A 324 -17.691 -1.989 -9.579 1.00 56.28 C ATOM 600 OE1 GLU A 324 -17.907 -3.201 -9.344 1.00 60.68 O ATOM 601 OE2 GLU A 324 -18.439 -1.068 -9.178 1.00 40.49 O ATOM 602 H GLU A 324 -15.528 -0.592 -12.859 1.00 0.00 H ATOM 603 N LYS A 325 -13.088 -1.680 -10.504 1.00 23.70 N ATOM 604 CA LYS A 325 -11.991 -2.341 -9.776 1.00 24.08 C ATOM 605 C LYS A 325 -10.647 -1.622 -9.985 1.00 26.56 C ATOM 606 O LYS A 325 -9.688 -1.896 -9.252 1.00 28.40 O ATOM 607 CB LYS A 325 -11.861 -3.813 -10.194 1.00 27.29 C ATOM 608 CG LYS A 325 -12.919 -4.709 -9.558 1.00 39.79 C ATOM 609 CD LYS A 325 -12.835 -6.128 -10.087 1.00 53.22 C ATOM 610 CE LYS A 325 -13.997 -6.967 -9.611 1.00 66.64 C ATOM 611 NZ LYS A 325 -14.014 -8.298 -10.270 1.00 79.07 N ATOM 612 HZ1 LYS A 325 -14.098 -8.173 -11.299 1.00 0.00 H ATOM 613 HZ2 LYS A 325 -13.131 -8.803 -10.051 1.00 0.00 H ATOM 614 HZ3 LYS A 325 -14.825 -8.847 -9.919 1.00 0.00 H ATOM 615 H LYS A 325 -13.509 -2.168 -11.320 1.00 0.00 H ATOM 616 N ARG A 326 -10.567 -0.758 -11.020 1.00 20.52 N ATOM 617 CA ARG A 326 -9.358 0.000 -11.370 1.00 19.26 C ATOM 618 C ARG A 326 -9.450 1.478 -10.962 1.00 22.04 C ATOM 619 O ARG A 326 -8.639 2.290 -11.411 1.00 20.76 O ATOM 620 CB ARG A 326 -9.057 -0.119 -12.870 1.00 21.18 C ATOM 621 CG ARG A 326 -8.958 -1.546 -13.406 1.00 37.12 C ATOM 622 CD ARG A 326 -7.566 -2.134 -13.326 1.00 53.45 C ATOM 623 NE ARG A 326 -7.381 -3.124 -14.386 1.00 66.97 N ATOM 624 CZ ARG A 326 -6.791 -2.875 -15.551 1.00 81.20 C ATOM 625 NH1 ARG A 326 -6.696 -3.826 -16.467 1.00 70.75 N ATOM 626 NH2 ARG A 326 -6.280 -1.677 -15.804 1.00 62.50 N ATOM 627 HE ARG A 326 -7.735 -4.087 -14.217 1.00 0.00 H ATOM 628 HH12 ARG A 326 -6.234 -3.627 -17.377 1.00 0.00 H ATOM 629 HH11 ARG A 326 -7.084 -4.772 -16.277 1.00 0.00 H ATOM 630 HH22 ARG A 326 -5.820 -1.490 -16.718 1.00 0.00 H ATOM 631 HH21 ARG A 326 -6.339 -0.925 -15.088 1.00 0.00 H ATOM 632 H ARG A 326 -11.415 -0.621 -11.606 1.00 0.00 H ATOM 633 N VAL A 327 -10.403 1.812 -10.084 1.00 20.95 N ATOM 634 CA VAL A 327 -10.611 3.180 -9.592 1.00 20.07 C ATOM 635 C VAL A 327 -10.496 3.165 -8.068 1.00 24.36 C ATOM 636 O VAL A 327 -11.011 2.245 -7.435 1.00 24.86 O ATOM 637 CB VAL A 327 -11.987 3.747 -10.063 1.00 23.88 C ATOM 638 CG1 VAL A 327 -12.230 5.150 -9.540 1.00 24.04 C ATOM 639 CG2 VAL A 327 -12.105 3.735 -11.583 1.00 22.81 C ATOM 640 H VAL A 327 -11.031 1.062 -9.731 1.00 0.00 H ATOM 641 N ARG A 328 -9.829 4.184 -7.474 1.00 20.81 N ATOM 642 CA ARG A 328 -9.701 4.283 -6.011 1.00 20.52 C ATOM 643 C ARG A 328 -9.895 5.730 -5.611 1.00 22.21 C ATOM 644 O ARG A 328 -9.487 6.606 -6.356 1.00 19.32 O ATOM 645 CB ARG A 328 -8.303 3.830 -5.520 1.00 20.33 C ATOM 646 CG ARG A 328 -7.902 2.379 -5.812 1.00 23.89 C ATOM 647 CD ARG A 328 -8.558 1.343 -4.890 1.00 26.63 C ATOM 648 NE ARG A 328 -8.083 -0.010 -5.194 1.00 31.50 N ATOM 649 CZ ARG A 328 -8.570 -0.781 -6.164 1.00 47.62 C ATOM 650 NH1 ARG A 328 -8.057 -1.983 -6.384 1.00 37.63 N ATOM 651 NH2 ARG A 328 -9.576 -0.356 -6.919 1.00 33.14 N ATOM 652 HE ARG A 328 -7.312 -0.394 -4.611 1.00 0.00 H ATOM 653 HH12 ARG A 328 -8.441 -2.581 -7.143 1.00 0.00 H ATOM 654 HH11 ARG A 328 -7.270 -2.328 -5.798 1.00 0.00 H ATOM 655 HH22 ARG A 328 -9.952 -0.963 -7.675 1.00 0.00 H ATOM 656 HH21 ARG A 328 -9.989 0.584 -6.754 1.00 0.00 H ATOM 657 H ARG A 328 -9.395 4.918 -8.069 1.00 0.00 H ATOM 658 N GLU A 329 -10.433 5.995 -4.420 1.00 20.48 N ATOM 659 CA GLU A 329 -10.551 7.379 -3.975 1.00 19.95 C ATOM 660 C GLU A 329 -9.141 8.016 -3.865 1.00 22.88 C ATOM 661 O GLU A 329 -8.196 7.363 -3.402 1.00 23.05 O ATOM 662 CB GLU A 329 -11.286 7.440 -2.625 1.00 22.92 C ATOM 663 CG GLU A 329 -11.454 8.847 -2.069 1.00 33.69 C ATOM 664 CD GLU A 329 -11.993 8.939 -0.652 1.00 54.84 C ATOM 665 OE1 GLU A 329 -11.805 10.002 -0.016 1.00 50.62 O ATOM 666 OE2 GLU A 329 -12.615 7.960 -0.180 1.00 47.26 O ATOM 667 H GLU A 329 -10.766 5.220 -3.812 1.00 0.00 H ATOM 668 N TYR A 330 -8.994 9.253 -4.343 1.00 18.49 N ATOM 669 CA TYR A 330 -7.737 9.976 -4.238 1.00 17.24 C ATOM 670 C TYR A 330 -7.775 10.779 -2.923 1.00 22.68 C ATOM 671 O TYR A 330 -8.552 11.736 -2.794 1.00 22.06 O ATOM 672 CB TYR A 330 -7.558 10.908 -5.448 1.00 16.77 C ATOM 673 CG TYR A 330 -6.236 11.638 -5.483 1.00 16.62 C ATOM 674 CD1 TYR A 330 -6.064 12.848 -4.811 1.00 19.49 C ATOM 675 CD2 TYR A 330 -5.164 11.140 -6.216 1.00 16.78 C ATOM 676 CE1 TYR A 330 -4.843 13.524 -4.838 1.00 18.12 C ATOM 677 CE2 TYR A 330 -3.944 11.820 -6.269 1.00 17.43 C ATOM 678 CZ TYR A 330 -3.789 13.012 -5.578 1.00 20.17 C ATOM 679 OH TYR A 330 -2.589 13.676 -5.640 1.00 19.85 O ATOM 680 HH TYR A 330 -2.642 14.502 -5.097 1.00 0.00 H ATOM 681 H TYR A 330 -9.804 9.714 -4.805 1.00 0.00 H ATOM 682 N LYS A 331 -6.956 10.362 -1.953 1.00 21.97 N ATOM 683 CA LYS A 331 -6.833 11.000 -0.637 1.00 22.81 C ATOM 684 C LYS A 331 -5.629 11.951 -0.584 1.00 28.02 C ATOM 685 O LYS A 331 -5.574 12.824 0.285 1.00 30.92 O ATOM 686 CB LYS A 331 -6.704 9.932 0.466 1.00 25.76 C ATOM 687 CG LYS A 331 -7.899 8.997 0.594 1.00 40.59 C ATOM 688 CD LYS A 331 -7.559 7.791 1.460 1.00 55.88 C ATOM 689 CE LYS A 331 -8.766 6.933 1.743 1.00 69.47 C ATOM 690 NZ LYS A 331 -8.428 5.799 2.643 1.00 81.74 N ATOM 691 HZ1 LYS A 331 -7.700 5.207 2.194 1.00 0.00 H ATOM 692 HZ2 LYS A 331 -8.068 6.170 3.545 1.00 0.00 H ATOM 693 HZ3 LYS A 331 -9.281 5.230 2.817 1.00 0.00 H ATOM 694 H LYS A 331 -6.365 9.528 -2.144 1.00 0.00 H ATOM 695 N GLY A 332 -4.680 11.763 -1.495 1.00 22.33 N ATOM 696 CA GLY A 332 -3.457 12.554 -1.567 1.00 21.93 C ATOM 697 C GLY A 332 -2.370 11.817 -2.313 1.00 23.16 C ATOM 698 O GLY A 332 -2.428 10.592 -2.424 1.00 21.16 O ATOM 699 H GLY A 332 -4.817 11.008 -2.197 1.00 0.00 H ATOM 700 N HIS A 333 -1.375 12.549 -2.839 1.00 21.05 N ATOM 701 CA HIS A 333 -0.311 11.949 -3.645 1.00 20.80 C ATOM 702 C HIS A 333 0.496 10.856 -2.913 1.00 23.19 C ATOM 703 O HIS A 333 0.939 9.903 -3.556 1.00 23.20 O ATOM 704 CB HIS A 333 0.617 13.025 -4.225 1.00 22.41 C ATOM 705 CG HIS A 333 1.537 13.649 -3.218 1.00 26.75 C ATOM 706 ND1 HIS A 333 1.098 14.639 -2.354 1.00 29.65 N ATOM 707 CD2 HIS A 333 2.843 13.399 -2.970 1.00 29.51 C ATOM 708 CE1 HIS A 333 2.148 14.957 -1.615 1.00 30.33 C ATOM 709 NE2 HIS A 333 3.217 14.233 -1.944 1.00 31.26 N ATOM 710 H HIS A 333 -1.360 13.575 -2.668 1.00 0.00 H ATOM 711 N LYS A 334 0.662 10.976 -1.573 1.00 22.61 N ATOM 712 CA LYS A 334 1.428 9.993 -0.792 1.00 23.86 C ATOM 713 C LYS A 334 0.772 8.601 -0.747 1.00 26.12 C ATOM 714 O LYS A 334 1.430 7.615 -0.410 1.00 28.06 O ATOM 715 CB LYS A 334 1.734 10.520 0.621 1.00 26.83 C ATOM 716 CG LYS A 334 2.678 11.722 0.617 1.00 32.23 C ATOM 717 CD LYS A 334 2.872 12.310 2.021 1.00 39.19 C ATOM 718 CE LYS A 334 3.836 13.471 2.028 1.00 47.34 C ATOM 719 NZ LYS A 334 3.873 14.157 3.355 1.00 50.59 N ATOM 720 HZ1 LYS A 334 2.925 14.519 3.583 1.00 0.00 H ATOM 721 HZ2 LYS A 334 4.172 13.480 4.086 1.00 0.00 H ATOM 722 HZ3 LYS A 334 4.547 14.948 3.316 1.00 0.00 H ATOM 723 H LYS A 334 0.235 11.788 -1.083 1.00 0.00 H ATOM 724 N GLN A 335 -0.500 8.515 -1.160 1.00 22.75 N ATOM 725 CA GLN A 335 -1.252 7.256 -1.226 1.00 22.26 C ATOM 726 C GLN A 335 -0.680 6.317 -2.315 1.00 23.54 C ATOM 727 O GLN A 335 -0.984 5.130 -2.308 1.00 23.95 O ATOM 728 CB GLN A 335 -2.720 7.598 -1.530 1.00 22.55 C ATOM 729 CG GLN A 335 -3.716 6.451 -1.514 1.00 30.26 C ATOM 730 CD GLN A 335 -5.075 6.923 -1.967 1.00 36.52 C ATOM 731 OE1 GLN A 335 -5.292 8.112 -2.262 1.00 24.38 O ATOM 732 NE2 GLN A 335 -6.019 5.995 -2.037 1.00 32.05 N ATOM 733 HE22 GLN A 335 -5.800 5.011 -1.782 1.00 0.00 H ATOM 734 HE21 GLN A 335 -6.978 6.251 -2.347 1.00 0.00 H ATOM 735 H GLN A 335 -0.982 9.390 -1.450 1.00 0.00 H ATOM 736 N TYR A 336 0.133 6.848 -3.253 1.00 20.85 N ATOM 737 CA TYR A 336 0.700 6.057 -4.350 1.00 19.79 C ATOM 738 C TYR A 336 1.381 4.765 -3.855 1.00 24.27 C ATOM 739 O TYR A 336 1.101 3.694 -4.396 1.00 24.20 O ATOM 740 CB TYR A 336 1.626 6.913 -5.238 1.00 20.09 C ATOM 741 CG TYR A 336 2.101 6.179 -6.473 1.00 20.37 C ATOM 742 CD1 TYR A 336 1.278 6.049 -7.590 1.00 19.94 C ATOM 743 CD2 TYR A 336 3.368 5.594 -6.521 1.00 22.54 C ATOM 744 CE1 TYR A 336 1.699 5.360 -8.724 1.00 21.83 C ATOM 745 CE2 TYR A 336 3.811 4.926 -7.661 1.00 23.57 C ATOM 746 CZ TYR A 336 2.962 4.791 -8.752 1.00 28.57 C ATOM 747 OH TYR A 336 3.364 4.134 -9.884 1.00 27.64 O ATOM 748 HH TYR A 336 4.157 4.589 -10.264 1.00 0.00 H ATOM 749 H TYR A 336 0.367 7.860 -3.195 1.00 0.00 H ATOM 750 N GLU A 337 2.181 4.853 -2.775 1.00 25.29 N ATOM 751 CA GLU A 337 2.855 3.695 -2.151 1.00 27.55 C ATOM 752 C GLU A 337 1.870 2.574 -1.749 1.00 32.18 C ATOM 753 O GLU A 337 2.178 1.389 -1.924 1.00 30.92 O ATOM 754 CB GLU A 337 3.578 4.136 -0.879 1.00 31.07 C ATOM 755 CG GLU A 337 4.937 4.779 -1.069 1.00 48.78 C ATOM 756 CD GLU A 337 5.614 5.132 0.246 1.00 72.82 C ATOM 757 OE1 GLU A 337 5.334 4.462 1.268 1.00 53.88 O ATOM 758 OE2 GLU A 337 6.420 6.090 0.256 1.00 74.76 O ATOM 759 H GLU A 337 2.334 5.792 -2.355 1.00 0.00 H ATOM 760 N GLU A 338 0.704 2.963 -1.178 1.00 28.47 N ATOM 761 CA GLU A 338 -0.353 2.042 -0.732 1.00 29.54 C ATOM 762 C GLU A 338 -0.966 1.307 -1.911 1.00 32.15 C ATOM 763 O GLU A 338 -1.340 0.142 -1.785 1.00 34.11 O ATOM 764 CB GLU A 338 -1.465 2.803 0.007 1.00 30.84 C ATOM 765 CG GLU A 338 -1.026 3.454 1.306 1.00 43.43 C ATOM 766 CD GLU A 338 -1.965 4.520 1.840 1.00 70.04 C ATOM 767 OE1 GLU A 338 -3.200 4.377 1.676 1.00 60.12 O ATOM 768 OE2 GLU A 338 -1.461 5.498 2.438 1.00 71.24 O ATOM 769 H GLU A 338 0.546 3.982 -1.046 1.00 0.00 H ATOM 770 N LEU A 339 -1.090 1.994 -3.051 1.00 25.70 N ATOM 771 CA LEU A 339 -1.650 1.388 -4.255 1.00 24.19 C ATOM 772 C LEU A 339 -0.721 0.322 -4.801 1.00 29.79 C ATOM 773 O LEU A 339 -1.197 -0.736 -5.212 1.00 28.80 O ATOM 774 CB LEU A 339 -1.944 2.461 -5.301 1.00 22.49 C ATOM 775 CG LEU A 339 -2.985 3.507 -4.880 1.00 26.63 C ATOM 776 CD1 LEU A 339 -3.061 4.603 -5.900 1.00 25.25 C ATOM 777 CD2 LEU A 339 -4.364 2.876 -4.690 1.00 29.95 C ATOM 778 H LEU A 339 -0.779 2.986 -3.081 1.00 0.00 H ATOM 779 N LEU A 340 0.603 0.573 -4.762 1.00 29.48 N ATOM 780 CA LEU A 340 1.609 -0.402 -5.207 1.00 31.33 C ATOM 781 C LEU A 340 1.610 -1.615 -4.282 1.00 37.38 C ATOM 782 O LEU A 340 1.829 -2.731 -4.746 1.00 38.13 O ATOM 783 CB LEU A 340 3.015 0.217 -5.261 1.00 32.17 C ATOM 784 CG LEU A 340 3.291 1.301 -6.311 1.00 35.61 C ATOM 785 CD1 LEU A 340 4.719 1.789 -6.200 1.00 36.45 C ATOM 786 CD2 LEU A 340 3.020 0.805 -7.730 1.00 36.72 C ATOM 787 H LEU A 340 0.926 1.494 -4.402 1.00 0.00 H ATOM 788 N ALA A 341 1.308 -1.396 -2.982 1.00 34.47 N ATOM 789 CA ALA A 341 1.216 -2.447 -1.967 1.00 36.17 C ATOM 790 C ALA A 341 0.054 -3.421 -2.215 1.00 41.70 C ATOM 791 O ALA A 341 0.167 -4.587 -1.826 1.00 43.44 O ATOM 792 CB ALA A 341 1.101 -1.831 -0.578 1.00 37.65 C ATOM 793 H ALA A 341 1.129 -0.416 -2.684 1.00 0.00 H ATOM 794 N GLU A 342 -1.044 -2.960 -2.872 1.00 37.48 N ATOM 795 CA GLU A 342 -2.217 -3.791 -3.200 1.00 38.05 C ATOM 796 C GLU A 342 -1.834 -5.023 -4.039 1.00 42.78 C ATOM 797 O GLU A 342 -2.398 -6.105 -3.840 1.00 44.13 O ATOM 798 CB GLU A 342 -3.269 -2.988 -3.974 1.00 38.08 C ATOM 799 CG GLU A 342 -4.135 -2.062 -3.142 1.00 45.53 C ATOM 800 CD GLU A 342 -5.277 -1.422 -3.913 1.00 56.16 C ATOM 801 OE1 GLU A 342 -5.588 -1.887 -5.034 1.00 55.06 O ATOM 802 OE2 GLU A 342 -5.881 -0.465 -3.380 1.00 44.69 O ATOM 803 H GLU A 342 -1.057 -1.961 -3.160 1.00 0.00 H ATOM 804 N ALA A 343 -0.889 -4.841 -4.982 1.00 37.40 N ATOM 805 CA ALA A 343 -0.409 -5.882 -5.890 1.00 64.69 C ATOM 806 C ALA A 343 0.533 -6.835 -5.177 1.00 95.16 C ATOM 807 O ALA A 343 0.543 -8.019 -5.493 1.00 62.65 O ATOM 808 CB ALA A 343 0.292 -5.253 -7.083 1.00 64.14 C ATOM 809 H ALA A 343 -0.471 -3.893 -5.070 1.00 0.00 H TER 810 ALA A 343 ATOM 811 N GLN A 354 12.925 -9.988 -1.433 1.00 57.86 N ATOM 812 CA GLN A 354 13.136 -8.595 -1.832 1.00 55.55 C ATOM 813 C GLN A 354 11.877 -7.966 -2.380 1.00 56.26 C ATOM 814 O GLN A 354 11.062 -8.651 -3.006 1.00 55.53 O ATOM 815 CB GLN A 354 14.233 -8.490 -2.909 1.00 56.99 C ATOM 816 CG GLN A 354 15.656 -8.721 -2.412 1.00 65.12 C ATOM 817 CD GLN A 354 16.664 -8.655 -3.537 1.00 74.79 C ATOM 818 OE1 GLN A 354 16.501 -9.271 -4.599 1.00 69.82 O ATOM 819 NE2 GLN A 354 17.751 -7.932 -3.315 1.00 58.05 N ATOM 820 HE22 GLN A 354 17.863 -7.424 -2.414 1.00 0.00 H ATOM 821 HE21 GLN A 354 18.493 -7.872 -4.041 1.00 0.00 H ATOM 822 HN3 GLN A 354 12.618 -10.541 -2.258 1.00 0.00 H ATOM 823 HN2 GLN A 354 12.193 -10.029 -0.695 1.00 0.00 H ATOM 824 HN1 GLN A 354 13.814 -10.380 -1.063 1.00 0.00 H ATOM 825 N LYS A 355 11.744 -6.640 -2.196 1.00 50.52 N ATOM 826 CA LYS A 355 10.655 -5.860 -2.763 1.00 47.55 C ATOM 827 C LYS A 355 11.007 -5.675 -4.221 1.00 48.53 C ATOM 828 O LYS A 355 12.187 -5.528 -4.559 1.00 49.00 O ATOM 829 CB LYS A 355 10.562 -4.472 -2.120 1.00 49.43 C ATOM 830 CG LYS A 355 9.869 -4.443 -0.780 1.00 68.34 C ATOM 831 CD LYS A 355 9.800 -3.016 -0.301 1.00 78.48 C ATOM 832 CE LYS A 355 9.148 -2.896 1.041 1.00 89.94 C ATOM 833 NZ LYS A 355 9.299 -1.521 1.565 1.00100.21 N ATOM 834 HZ1 LYS A 355 10.310 -1.295 1.657 1.00 0.00 H ATOM 835 HZ2 LYS A 355 8.851 -0.850 0.909 1.00 0.00 H ATOM 836 HZ3 LYS A 355 8.841 -1.454 2.497 1.00 0.00 H ATOM 837 H LYS A 355 12.456 -6.148 -1.619 1.00 0.00 H ATOM 838 N ILE A 356 9.998 -5.711 -5.080 1.00 42.05 N ATOM 839 CA ILE A 356 10.188 -5.529 -6.509 1.00 40.18 C ATOM 840 C ILE A 356 9.424 -4.285 -6.954 1.00 41.78 C ATOM 841 O ILE A 356 8.213 -4.174 -6.727 1.00 40.62 O ATOM 842 CB ILE A 356 9.821 -6.801 -7.329 1.00 42.79 C ATOM 843 CG1 ILE A 356 10.621 -8.051 -6.872 1.00 45.09 C ATOM 844 CG2 ILE A 356 10.034 -6.530 -8.799 1.00 42.48 C ATOM 845 CD1 ILE A 356 10.124 -9.433 -7.441 1.00 49.21 C ATOM 846 H ILE A 356 9.037 -5.875 -4.718 1.00 0.00 H ATOM 847 N ARG A 357 10.135 -3.346 -7.584 1.00 36.64 N ATOM 848 CA ARG A 357 9.543 -2.111 -8.071 1.00 34.07 C ATOM 849 C ARG A 357 9.825 -1.922 -9.545 1.00 34.19 C ATOM 850 O ARG A 357 10.947 -2.165 -10.007 1.00 34.49 O ATOM 851 CB ARG A 357 10.066 -0.899 -7.280 1.00 37.63 C ATOM 852 CG ARG A 357 9.313 -0.636 -5.982 1.00 57.66 C ATOM 853 CD ARG A 357 9.707 0.704 -5.392 1.00 80.75 C ATOM 854 NE ARG A 357 9.309 0.832 -3.989 1.00 98.51 N ATOM 855 CZ ARG A 357 9.661 1.841 -3.198 1.00117.72 C ATOM 856 NH1 ARG A 357 10.425 2.824 -3.662 1.00106.42 N ATOM 857 NH2 ARG A 357 9.256 1.874 -1.935 1.00107.23 N ATOM 858 HE ARG A 357 8.711 0.084 -3.584 1.00 0.00 H ATOM 859 HH12 ARG A 357 10.697 3.610 -3.038 1.00 0.00 H ATOM 860 HH11 ARG A 357 10.751 2.807 -4.649 1.00 0.00 H ATOM 861 HH22 ARG A 357 9.534 2.665 -1.320 1.00 0.00 H ATOM 862 HH21 ARG A 357 8.660 1.108 -1.560 1.00 0.00 H ATOM 863 H ARG A 357 11.152 -3.505 -7.732 1.00 0.00 H ATOM 864 N LYS A 358 8.799 -1.524 -10.281 1.00 28.81 N ATOM 865 CA LYS A 358 8.915 -1.200 -11.689 1.00 28.34 C ATOM 866 C LYS A 358 9.611 0.153 -11.771 1.00 34.65 C ATOM 867 O LYS A 358 9.273 1.049 -10.982 1.00 35.26 O ATOM 868 CB LYS A 358 7.544 -1.082 -12.345 1.00 28.72 C ATOM 869 CG LYS A 358 6.798 -2.390 -12.471 1.00 30.71 C ATOM 870 CD LYS A 358 5.553 -2.113 -13.262 1.00 32.28 C ATOM 871 CE LYS A 358 4.592 -3.252 -13.224 1.00 33.44 C ATOM 872 NZ LYS A 358 3.401 -2.946 -14.052 1.00 27.16 N ATOM 873 HZ1 LYS A 358 2.934 -2.093 -13.683 1.00 0.00 H ATOM 874 HZ2 LYS A 358 3.697 -2.782 -15.036 1.00 0.00 H ATOM 875 HZ3 LYS A 358 2.740 -3.748 -14.016 1.00 0.00 H ATOM 876 H LYS A 358 7.867 -1.440 -9.828 1.00 0.00 H ATOM 877 N PRO A 359 10.570 0.351 -12.701 1.00 32.36 N ATOM 878 CA PRO A 359 11.189 1.681 -12.820 1.00 33.05 C ATOM 879 C PRO A 359 10.201 2.665 -13.427 1.00 38.61 C ATOM 880 O PRO A 359 9.214 2.261 -14.065 1.00 36.91 O ATOM 881 CB PRO A 359 12.373 1.439 -13.749 1.00 35.71 C ATOM 882 CG PRO A 359 11.976 0.289 -14.562 1.00 39.08 C ATOM 883 CD PRO A 359 11.099 -0.577 -13.717 1.00 34.16 C ATOM 884 N ARG A 360 10.470 3.954 -13.230 1.00 38.18 N ATOM 885 CA ARG A 360 9.582 5.004 -13.712 1.00 37.87 C ATOM 886 C ARG A 360 10.164 5.758 -14.932 1.00 43.10 C ATOM 887 O ARG A 360 11.070 6.572 -14.749 1.00 43.84 O ATOM 888 CB ARG A 360 9.214 5.964 -12.560 1.00 39.84 C ATOM 889 CG ARG A 360 8.588 5.273 -11.345 1.00 49.74 C ATOM 890 CD ARG A 360 7.929 6.253 -10.397 1.00 60.44 C ATOM 891 NE ARG A 360 6.602 6.645 -10.877 1.00 66.00 N ATOM 892 CZ ARG A 360 5.711 7.329 -10.167 1.00 71.36 C ATOM 893 NH1 ARG A 360 4.532 7.628 -10.688 1.00 53.02 N ATOM 894 NH2 ARG A 360 5.989 7.710 -8.926 1.00 57.90 N ATOM 895 HE ARG A 360 6.338 6.368 -11.844 1.00 0.00 H ATOM 896 HH12 ARG A 360 3.837 8.163 -10.129 1.00 0.00 H ATOM 897 HH11 ARG A 360 4.300 7.328 -11.656 1.00 0.00 H ATOM 898 HH22 ARG A 360 5.287 8.245 -8.377 1.00 0.00 H ATOM 899 HH21 ARG A 360 6.909 7.473 -8.503 1.00 0.00 H ATOM 900 H ARG A 360 11.336 4.218 -12.719 1.00 0.00 H ATOM 901 N PRO A 361 9.660 5.493 -16.174 1.00 38.98 N ATOM 902 CA PRO A 361 10.165 6.216 -17.361 1.00 39.81 C ATOM 903 C PRO A 361 10.003 7.739 -17.259 1.00 42.09 C ATOM 904 O PRO A 361 8.957 8.216 -16.809 1.00 39.69 O ATOM 905 CB PRO A 361 9.336 5.634 -18.515 1.00 41.03 C ATOM 906 CG PRO A 361 8.157 5.023 -17.889 1.00 44.12 C ATOM 907 CD PRO A 361 8.608 4.529 -16.549 1.00 39.89 C ATOM 908 N GLN A 362 11.048 8.487 -17.682 1.00 39.25 N ATOM 909 CA GLN A 362 11.187 9.948 -17.582 1.00 38.41 C ATOM 910 C GLN A 362 10.021 10.789 -18.118 1.00 39.41 C ATOM 911 O GLN A 362 9.486 11.582 -17.336 1.00 37.75 O ATOM 912 CB GLN A 362 12.503 10.435 -18.208 1.00 41.55 C ATOM 913 CG GLN A 362 13.688 10.322 -17.251 1.00 59.62 C ATOM 914 CD GLN A 362 14.931 11.047 -17.725 1.00 79.48 C ATOM 915 OE1 GLN A 362 15.281 11.054 -18.913 1.00 76.91 O ATOM 916 NE2 GLN A 362 15.657 11.637 -16.789 1.00 69.93 N ATOM 917 HE22 GLN A 362 15.343 11.618 -15.798 1.00 0.00 H ATOM 918 HE21 GLN A 362 16.542 12.120 -17.045 1.00 0.00 H ATOM 919 H GLN A 362 11.837 7.974 -18.125 1.00 0.00 H ATOM 920 N ARG A 363 9.639 10.669 -19.417 1.00 35.26 N ATOM 921 CA ARG A 363 8.552 11.505 -19.952 1.00 34.56 C ATOM 922 C ARG A 363 7.271 11.245 -19.185 1.00 35.77 C ATOM 923 O ARG A 363 6.563 12.194 -18.841 1.00 34.83 O ATOM 924 CB ARG A 363 8.263 11.294 -21.452 1.00 36.50 C ATOM 925 CG ARG A 363 9.427 11.033 -22.397 1.00 54.24 C ATOM 926 CD ARG A 363 8.928 10.789 -23.827 1.00 66.18 C ATOM 927 NE ARG A 363 7.648 10.064 -23.882 1.00 73.02 N ATOM 928 CZ ARG A 363 7.518 8.744 -23.783 1.00 84.80 C ATOM 929 NH1 ARG A 363 6.316 8.184 -23.828 1.00 72.28 N ATOM 930 NH2 ARG A 363 8.589 7.975 -23.619 1.00 68.08 N ATOM 931 HE ARG A 363 6.782 10.625 -24.008 1.00 0.00 H ATOM 932 HH12 ARG A 363 6.220 7.151 -23.750 1.00 0.00 H ATOM 933 HH11 ARG A 363 5.470 8.778 -23.941 1.00 0.00 H ATOM 934 HH22 ARG A 363 8.482 6.943 -23.542 1.00 0.00 H ATOM 935 HH21 ARG A 363 9.535 8.405 -23.567 1.00 0.00 H ATOM 936 H ARG A 363 10.117 9.983 -20.036 1.00 0.00 H ATOM 937 N GLU A 364 6.977 9.947 -18.924 1.00 29.88 N ATOM 938 CA GLU A 364 5.786 9.510 -18.193 1.00 27.42 C ATOM 939 C GLU A 364 5.778 10.090 -16.767 1.00 29.36 C ATOM 940 O GLU A 364 4.751 10.625 -16.345 1.00 26.55 O ATOM 941 CB GLU A 364 5.691 7.974 -18.174 1.00 28.42 C ATOM 942 CG GLU A 364 4.396 7.446 -17.575 1.00 33.40 C ATOM 943 CD GLU A 364 4.293 5.934 -17.630 1.00 45.12 C ATOM 944 OE1 GLU A 364 3.673 5.421 -18.588 1.00 37.19 O ATOM 945 OE2 GLU A 364 4.863 5.263 -16.739 1.00 33.59 O ATOM 946 H GLU A 364 7.637 9.218 -19.263 1.00 0.00 H ATOM 947 N ARG A 365 6.919 10.012 -16.056 1.00 27.11 N ATOM 948 CA ARG A 365 7.061 10.564 -14.703 1.00 27.62 C ATOM 949 C ARG A 365 6.786 12.081 -14.703 1.00 31.14 C ATOM 950 O ARG A 365 6.113 12.570 -13.796 1.00 28.26 O ATOM 951 CB ARG A 365 8.439 10.243 -14.086 1.00 29.77 C ATOM 952 CG ARG A 365 8.656 10.776 -12.663 1.00 39.36 C ATOM 953 CD ARG A 365 7.661 10.206 -11.670 1.00 46.48 C ATOM 954 NE ARG A 365 7.506 11.050 -10.487 1.00 49.07 N ATOM 955 CZ ARG A 365 8.148 10.859 -9.340 1.00 61.41 C ATOM 956 NH1 ARG A 365 7.931 11.665 -8.310 1.00 43.42 N ATOM 957 NH2 ARG A 365 9.015 9.861 -9.214 1.00 50.71 N ATOM 958 HE ARG A 365 6.849 11.854 -10.547 1.00 0.00 H ATOM 959 HH12 ARG A 365 8.436 11.511 -7.414 1.00 0.00 H ATOM 960 HH11 ARG A 365 7.256 12.451 -8.398 1.00 0.00 H ATOM 961 HH22 ARG A 365 9.515 9.717 -8.313 1.00 0.00 H ATOM 962 HH21 ARG A 365 9.194 9.224 -10.016 1.00 0.00 H ATOM 963 H ARG A 365 7.739 9.538 -16.486 1.00 0.00 H ATOM 964 N ALA A 366 7.296 12.810 -15.722 1.00 29.93 N ATOM 965 CA ALA A 366 7.086 14.258 -15.868 1.00 29.79 C ATOM 966 C ALA A 366 5.598 14.615 -16.021 1.00 31.23 C ATOM 967 O ALA A 366 5.141 15.559 -15.367 1.00 30.78 O ATOM 968 CB ALA A 366 7.887 14.793 -17.049 1.00 32.25 C ATOM 969 H ALA A 366 7.867 12.320 -16.440 1.00 0.00 H ATOM 970 N GLN A 367 4.832 13.847 -16.850 1.00 25.67 N ATOM 971 CA GLN A 367 3.387 14.064 -17.026 1.00 24.14 C ATOM 972 C GLN A 367 2.664 13.726 -15.711 1.00 23.38 C ATOM 973 O GLN A 367 1.741 14.445 -15.339 1.00 21.54 O ATOM 974 CB GLN A 367 2.793 13.177 -18.138 1.00 25.76 C ATOM 975 CG GLN A 367 3.152 13.576 -19.563 1.00 35.93 C ATOM 976 CD GLN A 367 2.304 12.813 -20.555 1.00 39.32 C ATOM 977 OE1 GLN A 367 2.375 11.590 -20.662 1.00 35.34 O ATOM 978 NE2 GLN A 367 1.468 13.513 -21.293 1.00 28.74 N ATOM 979 HE22 GLN A 367 1.422 14.547 -21.188 1.00 0.00 H ATOM 980 HE21 GLN A 367 0.853 13.032 -21.981 1.00 0.00 H ATOM 981 H GLN A 367 5.288 13.077 -17.379 1.00 0.00 H ATOM 982 N TRP A 368 3.085 12.618 -15.028 1.00 20.63 N ATOM 983 CA TRP A 368 2.496 12.185 -13.749 1.00 19.56 C ATOM 984 C TRP A 368 2.712 13.270 -12.676 1.00 21.55 C ATOM 985 O TRP A 368 1.765 13.627 -11.961 1.00 19.04 O ATOM 986 CB TRP A 368 3.076 10.828 -13.319 1.00 18.98 C ATOM 987 CG TRP A 368 2.414 10.195 -12.129 1.00 18.35 C ATOM 988 CD1 TRP A 368 1.375 9.311 -12.141 1.00 19.90 C ATOM 989 CD2 TRP A 368 2.802 10.344 -10.757 1.00 18.65 C ATOM 990 NE1 TRP A 368 1.090 8.898 -10.863 1.00 18.86 N ATOM 991 CE2 TRP A 368 1.954 9.513 -9.991 1.00 20.91 C ATOM 992 CE3 TRP A 368 3.832 11.050 -10.103 1.00 21.23 C ATOM 993 CZ2 TRP A 368 2.078 9.391 -8.601 1.00 21.44 C ATOM 994 CZ3 TRP A 368 3.932 10.961 -8.721 1.00 22.81 C ATOM 995 CH2 TRP A 368 3.064 10.139 -7.983 1.00 22.53 C ATOM 996 HE1 TRP A 368 0.340 8.227 -10.598 1.00 0.00 H ATOM 997 H TRP A 368 3.859 12.053 -15.432 1.00 0.00 H ATOM 998 N ASP A 369 3.929 13.852 -12.613 1.00 18.78 N ATOM 999 CA ASP A 369 4.187 14.922 -11.654 1.00 19.16 C ATOM 1000 C ASP A 369 3.284 16.123 -11.936 1.00 22.21 C ATOM 1001 O ASP A 369 2.801 16.746 -10.984 1.00 22.51 O ATOM 1002 CB ASP A 369 5.670 15.336 -11.663 1.00 22.12 C ATOM 1003 CG ASP A 369 6.603 14.319 -11.032 1.00 27.94 C ATOM 1004 OD1 ASP A 369 6.127 13.493 -10.221 1.00 26.29 O ATOM 1005 OD2 ASP A 369 7.820 14.380 -11.306 1.00 32.89 O ATOM 1006 H ASP A 369 4.687 13.536 -13.251 1.00 0.00 H ATOM 1007 N ILE A 370 3.040 16.441 -13.233 1.00 19.80 N ATOM 1008 CA ILE A 370 2.141 17.562 -13.605 1.00 20.27 C ATOM 1009 C ILE A 370 0.709 17.228 -13.128 1.00 21.06 C ATOM 1010 O ILE A 370 0.042 18.047 -12.499 1.00 20.38 O ATOM 1011 CB ILE A 370 2.186 17.890 -15.130 1.00 24.49 C ATOM 1012 CG1 ILE A 370 3.563 18.465 -15.551 1.00 27.42 C ATOM 1013 CG2 ILE A 370 1.059 18.860 -15.535 1.00 26.24 C ATOM 1014 CD1 ILE A 370 3.900 18.280 -17.064 1.00 35.73 C ATOM 1015 H ILE A 370 3.495 15.885 -13.985 1.00 0.00 H ATOM 1016 N GLY A 371 0.268 16.019 -13.431 1.00 17.66 N ATOM 1017 CA GLY A 371 -1.045 15.545 -13.015 1.00 15.73 C ATOM 1018 C GLY A 371 -1.245 15.615 -11.513 1.00 18.65 C ATOM 1019 O GLY A 371 -2.276 16.109 -11.039 1.00 18.32 O ATOM 1020 H GLY A 371 0.879 15.385 -13.985 1.00 0.00 H ATOM 1021 N ILE A 372 -0.217 15.177 -10.750 1.00 16.91 N ATOM 1022 CA ILE A 372 -0.260 15.216 -9.290 1.00 16.37 C ATOM 1023 C ILE A 372 -0.357 16.641 -8.773 1.00 19.70 C ATOM 1024 O ILE A 372 -1.128 16.890 -7.852 1.00 19.17 O ATOM 1025 CB ILE A 372 0.912 14.419 -8.676 1.00 19.36 C ATOM 1026 CG1 ILE A 372 0.675 12.897 -8.860 1.00 18.83 C ATOM 1027 CG2 ILE A 372 1.191 14.809 -7.207 1.00 21.63 C ATOM 1028 CD1 ILE A 372 -0.453 12.268 -8.028 1.00 21.94 C ATOM 1029 H ILE A 372 0.632 14.800 -11.218 1.00 0.00 H ATOM 1030 N ALA A 373 0.416 17.578 -9.362 1.00 17.99 N ATOM 1031 CA ALA A 373 0.364 18.982 -8.986 1.00 19.79 C ATOM 1032 C ALA A 373 -1.073 19.518 -9.154 1.00 21.30 C ATOM 1033 O ALA A 373 -1.571 20.205 -8.269 1.00 21.29 O ATOM 1034 CB ALA A 373 1.344 19.787 -9.831 1.00 21.69 C ATOM 1035 H ALA A 373 1.073 17.285 -10.113 1.00 0.00 H ATOM 1036 N HIS A 374 -1.762 19.163 -10.259 1.00 18.09 N ATOM 1037 CA HIS A 374 -3.146 19.601 -10.451 1.00 17.24 C ATOM 1038 C HIS A 374 -4.078 18.927 -9.446 1.00 19.06 C ATOM 1039 O HIS A 374 -4.962 19.588 -8.897 1.00 18.72 O ATOM 1040 CB HIS A 374 -3.647 19.269 -11.854 1.00 17.48 C ATOM 1041 CG HIS A 374 -3.055 20.108 -12.932 1.00 20.87 C ATOM 1042 ND1 HIS A 374 -3.417 21.428 -13.095 1.00 23.89 N ATOM 1043 CD2 HIS A 374 -2.252 19.746 -13.957 1.00 22.87 C ATOM 1044 CE1 HIS A 374 -2.731 21.861 -14.141 1.00 24.20 C ATOM 1045 NE2 HIS A 374 -2.038 20.877 -14.705 1.00 23.98 N ATOM 1046 H HIS A 374 -1.305 18.572 -10.982 1.00 0.00 H ATOM 1047 N ALA A 375 -3.880 17.616 -9.204 1.00 15.96 N ATOM 1048 CA ALA A 375 -4.740 16.895 -8.271 1.00 16.14 C ATOM 1049 C ALA A 375 -4.604 17.427 -6.844 1.00 18.41 C ATOM 1050 O ALA A 375 -5.614 17.544 -6.157 1.00 20.48 O ATOM 1051 CB ALA A 375 -4.449 15.409 -8.330 1.00 15.65 C ATOM 1052 H ALA A 375 -3.108 17.114 -9.686 1.00 0.00 H ATOM 1053 N GLU A 376 -3.401 17.839 -6.444 1.00 17.47 N ATOM 1054 CA GLU A 376 -3.141 18.409 -5.114 1.00 18.86 C ATOM 1055 C GLU A 376 -3.827 19.766 -4.960 1.00 25.20 C ATOM 1056 O GLU A 376 -4.339 20.080 -3.890 1.00 25.59 O ATOM 1057 CB GLU A 376 -1.635 18.476 -4.839 1.00 20.86 C ATOM 1058 CG GLU A 376 -1.037 17.110 -4.534 1.00 25.42 C ATOM 1059 CD GLU A 376 -1.647 16.396 -3.341 1.00 31.69 C ATOM 1060 OE1 GLU A 376 -1.675 16.986 -2.235 1.00 26.56 O ATOM 1061 OE2 GLU A 376 -2.138 15.259 -3.524 1.00 23.65 O ATOM 1062 H GLU A 376 -2.605 17.753 -7.107 1.00 0.00 H ATOM 1063 N LYS A 377 -3.877 20.543 -6.052 1.00 20.78 N ATOM 1064 CA LYS A 377 -4.567 21.827 -6.115 1.00 22.59 C ATOM 1065 C LYS A 377 -6.103 21.548 -6.026 1.00 24.23 C ATOM 1066 O LYS A 377 -6.802 22.199 -5.240 1.00 24.37 O ATOM 1067 CB LYS A 377 -4.144 22.532 -7.428 1.00 25.96 C ATOM 1068 CG LYS A 377 -4.761 23.890 -7.713 1.00 39.62 C ATOM 1069 CD LYS A 377 -3.803 24.764 -8.511 1.00 47.12 C ATOM 1070 CE LYS A 377 -4.433 26.070 -8.924 1.00 61.15 C ATOM 1071 NZ LYS A 377 -3.975 27.195 -8.065 1.00 73.91 N ATOM 1072 HZ1 LYS A 377 -4.235 27.003 -7.076 1.00 0.00 H ATOM 1073 HZ2 LYS A 377 -2.942 27.290 -8.141 1.00 0.00 H ATOM 1074 HZ3 LYS A 377 -4.429 28.076 -8.379 1.00 0.00 H ATOM 1075 H LYS A 377 -3.393 20.209 -6.909 1.00 0.00 H ATOM 1076 N ALA A 378 -6.602 20.535 -6.776 1.00 19.58 N ATOM 1077 CA ALA A 378 -8.015 20.162 -6.803 1.00 20.04 C ATOM 1078 C ALA A 378 -8.513 19.642 -5.453 1.00 24.12 C ATOM 1079 O ALA A 378 -9.673 19.862 -5.106 1.00 22.72 O ATOM 1080 CB ALA A 378 -8.262 19.121 -7.881 1.00 19.47 C ATOM 1081 H ALA A 378 -5.941 19.991 -7.367 1.00 0.00 H ATOM 1082 N LEU A 379 -7.634 18.957 -4.706 1.00 22.92 N ATOM 1083 CA LEU A 379 -7.958 18.411 -3.394 1.00 23.88 C ATOM 1084 C LEU A 379 -8.281 19.543 -2.400 1.00 28.78 C ATOM 1085 O LEU A 379 -9.111 19.339 -1.517 1.00 30.23 O ATOM 1086 CB LEU A 379 -6.794 17.515 -2.922 1.00 24.74 C ATOM 1087 CG LEU A 379 -6.987 16.590 -1.702 1.00 29.95 C ATOM 1088 CD1 LEU A 379 -8.084 15.557 -1.928 1.00 28.24 C ATOM 1089 CD2 LEU A 379 -5.694 15.891 -1.373 1.00 32.11 C ATOM 1090 H LEU A 379 -6.675 18.808 -5.081 1.00 0.00 H ATOM 1091 N LYS A 380 -7.709 20.758 -2.616 1.00 24.53 N ATOM 1092 CA LYS A 380 -7.917 21.946 -1.771 1.00 25.86 C ATOM 1093 C LYS A 380 -9.201 22.718 -2.116 1.00 29.94 C ATOM 1094 O LYS A 380 -9.564 23.665 -1.417 1.00 31.48 O ATOM 1095 CB LYS A 380 -6.689 22.876 -1.836 1.00 28.36 C ATOM 1096 CG LYS A 380 -5.423 22.278 -1.237 1.00 28.90 C ATOM 1097 CD LYS A 380 -4.223 23.171 -1.526 1.00 37.15 C ATOM 1098 CE LYS A 380 -2.918 22.550 -1.088 1.00 52.13 C ATOM 1099 NZ LYS A 380 -2.695 22.706 0.374 1.00 66.11 N ATOM 1100 HZ1 LYS A 380 -2.673 23.718 0.614 1.00 0.00 H ATOM 1101 HZ2 LYS A 380 -3.468 22.242 0.893 1.00 0.00 H ATOM 1102 HZ3 LYS A 380 -1.789 22.267 0.634 1.00 0.00 H ATOM 1103 H LYS A 380 -7.079 20.855 -3.438 1.00 0.00 H ATOM 1104 N MET A 381 -9.884 22.309 -3.195 1.00 25.51 N ATOM 1105 CA MET A 381 -11.121 22.930 -3.669 1.00 25.28 C ATOM 1106 C MET A 381 -12.319 22.121 -3.189 1.00 27.80 C ATOM 1107 O MET A 381 -12.182 20.951 -2.830 1.00 27.10 O ATOM 1108 CB MET A 381 -11.145 22.935 -5.224 1.00 25.95 C ATOM 1109 CG MET A 381 -9.986 23.665 -5.882 1.00 28.84 C ATOM 1110 SD MET A 381 -10.171 23.624 -7.668 1.00 32.03 S ATOM 1111 CE MET A 381 -8.680 24.345 -8.166 1.00 30.30 C ATOM 1112 H MET A 381 -9.511 21.499 -3.729 1.00 0.00 H ATOM 1113 N THR A 382 -13.513 22.703 -3.288 1.00 26.78 N ATOM 1114 CA THR A 382 -14.737 21.950 -3.020 1.00 26.22 C ATOM 1115 C THR A 382 -15.057 21.209 -4.339 1.00 27.97 C ATOM 1116 O THR A 382 -14.505 21.560 -5.396 1.00 25.47 O ATOM 1117 CB THR A 382 -15.910 22.900 -2.700 1.00 32.75 C ATOM 1118 OG1 THR A 382 -16.141 23.738 -3.832 1.00 30.02 O ATOM 1119 CG2 THR A 382 -15.677 23.746 -1.442 1.00 33.56 C ATOM 1120 HG1 THR A 382 -16.892 24.353 -3.638 1.00 0.00 H ATOM 1121 H THR A 382 -13.575 23.705 -3.559 1.00 0.00 H ATOM 1122 N ARG A 383 -15.969 20.217 -4.289 1.00 24.90 N ATOM 1123 CA ARG A 383 -16.393 19.476 -5.478 1.00 23.95 C ATOM 1124 C ARG A 383 -16.946 20.418 -6.582 1.00 28.63 C ATOM 1125 O ARG A 383 -16.588 20.242 -7.747 1.00 26.67 O ATOM 1126 CB ARG A 383 -17.407 18.383 -5.102 1.00 25.93 C ATOM 1127 CG ARG A 383 -17.608 17.305 -6.168 1.00 32.63 C ATOM 1128 CD ARG A 383 -18.545 16.189 -5.703 1.00 39.91 C ATOM 1129 NE ARG A 383 -19.880 16.703 -5.377 1.00 44.31 N ATOM 1130 CZ ARG A 383 -20.954 16.628 -6.165 1.00 52.95 C ATOM 1131 NH1 ARG A 383 -22.110 17.146 -5.770 1.00 30.88 N ATOM 1132 NH2 ARG A 383 -20.884 16.016 -7.347 1.00 34.43 N ATOM 1133 HE ARG A 383 -19.999 17.165 -4.453 1.00 0.00 H ATOM 1134 HH12 ARG A 383 -22.945 17.085 -6.387 1.00 0.00 H ATOM 1135 HH11 ARG A 383 -22.181 17.613 -4.843 1.00 0.00 H ATOM 1136 HH22 ARG A 383 -21.726 15.962 -7.955 1.00 0.00 H ATOM 1137 HH21 ARG A 383 -19.988 15.593 -7.661 1.00 0.00 H ATOM 1138 H ARG A 383 -16.387 19.969 -3.370 1.00 0.00 H ATOM 1139 N GLU A 384 -17.761 21.439 -6.212 1.00 26.61 N ATOM 1140 CA GLU A 384 -18.294 22.424 -7.171 1.00 26.13 C ATOM 1141 C GLU A 384 -17.164 23.266 -7.778 1.00 27.06 C ATOM 1142 O GLU A 384 -17.203 23.546 -8.973 1.00 25.73 O ATOM 1143 CB GLU A 384 -19.347 23.357 -6.530 1.00 29.72 C ATOM 1144 CG GLU A 384 -20.613 22.671 -6.053 1.00 42.46 C ATOM 1145 CD GLU A 384 -21.756 23.602 -5.679 1.00 71.18 C ATOM 1146 OE1 GLU A 384 -22.927 23.209 -5.886 1.00 69.41 O ATOM 1147 OE2 GLU A 384 -21.488 24.721 -5.180 1.00 65.86 O ATOM 1148 H GLU A 384 -18.020 21.530 -5.209 1.00 0.00 H ATOM 1149 N GLU A 385 -16.146 23.650 -6.967 1.00 24.54 N ATOM 1150 CA GLU A 385 -15.011 24.420 -7.471 1.00 23.39 C ATOM 1151 C GLU A 385 -14.192 23.601 -8.462 1.00 23.88 C ATOM 1152 O GLU A 385 -13.793 24.138 -9.502 1.00 23.23 O ATOM 1153 CB GLU A 385 -14.108 24.885 -6.337 1.00 25.11 C ATOM 1154 CG GLU A 385 -14.544 26.198 -5.711 1.00 30.17 C ATOM 1155 CD GLU A 385 -13.589 26.679 -4.637 1.00 44.76 C ATOM 1156 OE1 GLU A 385 -13.745 27.832 -4.174 1.00 42.67 O ATOM 1157 OE2 GLU A 385 -12.682 25.902 -4.259 1.00 37.96 O ATOM 1158 H GLU A 385 -16.174 23.389 -5.961 1.00 0.00 H ATOM 1159 N ARG A 386 -13.928 22.306 -8.140 1.00 19.97 N ATOM 1160 CA ARG A 386 -13.183 21.395 -9.013 1.00 19.06 C ATOM 1161 C ARG A 386 -13.920 21.239 -10.339 1.00 20.95 C ATOM 1162 O ARG A 386 -13.292 21.224 -11.392 1.00 20.56 O ATOM 1163 CB ARG A 386 -13.074 19.982 -8.397 1.00 21.14 C ATOM 1164 CG ARG A 386 -12.143 19.806 -7.236 1.00 32.13 C ATOM 1165 CD ARG A 386 -12.282 18.385 -6.720 1.00 24.87 C ATOM 1166 NE ARG A 386 -12.008 18.323 -5.288 1.00 38.64 N ATOM 1167 CZ ARG A 386 -12.685 17.579 -4.422 1.00 53.67 C ATOM 1168 NH1 ARG A 386 -13.686 16.811 -4.835 1.00 31.76 N ATOM 1169 NH2 ARG A 386 -12.359 17.588 -3.139 1.00 51.85 N ATOM 1170 HE ARG A 386 -11.227 18.903 -4.920 1.00 0.00 H ATOM 1171 HH12 ARG A 386 -14.212 16.230 -4.151 1.00 0.00 H ATOM 1172 HH11 ARG A 386 -13.944 16.790 -5.842 1.00 0.00 H ATOM 1173 HH22 ARG A 386 -12.891 17.004 -2.463 1.00 0.00 H ATOM 1174 HH21 ARG A 386 -11.570 18.179 -2.807 1.00 0.00 H ATOM 1175 H ARG A 386 -14.272 21.944 -7.228 1.00 0.00 H ATOM 1176 N ILE A 387 -15.255 21.053 -10.281 1.00 18.28 N ATOM 1177 CA ILE A 387 -16.051 20.881 -11.508 1.00 17.38 C ATOM 1178 C ILE A 387 -15.863 22.099 -12.431 1.00 22.07 C ATOM 1179 O ILE A 387 -15.588 21.940 -13.615 1.00 20.97 O ATOM 1180 CB ILE A 387 -17.530 20.556 -11.167 1.00 20.10 C ATOM 1181 CG1 ILE A 387 -17.638 19.129 -10.605 1.00 19.54 C ATOM 1182 CG2 ILE A 387 -18.431 20.706 -12.385 1.00 21.07 C ATOM 1183 CD1 ILE A 387 -18.976 18.834 -9.800 1.00 22.83 C ATOM 1184 H ILE A 387 -15.729 21.031 -9.356 1.00 0.00 H ATOM 1185 N GLU A 388 -15.953 23.299 -11.876 1.00 19.80 N ATOM 1186 CA GLU A 388 -15.780 24.533 -12.634 1.00 20.41 C ATOM 1187 C GLU A 388 -14.358 24.683 -13.193 1.00 23.30 C ATOM 1188 O GLU A 388 -14.198 25.031 -14.366 1.00 23.14 O ATOM 1189 CB GLU A 388 -16.184 25.747 -11.761 1.00 22.94 C ATOM 1190 CG GLU A 388 -16.031 27.111 -12.424 1.00 34.34 C ATOM 1191 CD GLU A 388 -16.970 27.461 -13.566 1.00 56.21 C ATOM 1192 OE1 GLU A 388 -18.036 26.817 -13.710 1.00 52.61 O ATOM 1193 OE2 GLU A 388 -16.632 28.403 -14.317 1.00 44.24 O ATOM 1194 H GLU A 388 -16.155 23.364 -10.858 1.00 0.00 H ATOM 1195 N GLN A 389 -13.335 24.408 -12.365 1.00 20.20 N ATOM 1196 CA GLN A 389 -11.945 24.595 -12.752 1.00 20.97 C ATOM 1197 C GLN A 389 -11.437 23.596 -13.783 1.00 23.49 C ATOM 1198 O GLN A 389 -10.628 23.970 -14.649 1.00 21.99 O ATOM 1199 CB GLN A 389 -11.041 24.511 -11.499 1.00 22.41 C ATOM 1200 CG GLN A 389 -9.542 24.731 -11.783 1.00 34.38 C ATOM 1201 CD GLN A 389 -9.056 26.097 -11.379 1.00 43.69 C ATOM 1202 OE1 GLN A 389 -9.829 26.963 -10.974 1.00 37.62 O ATOM 1203 NE2 GLN A 389 -7.756 26.315 -11.469 1.00 34.83 N ATOM 1204 HE22 GLN A 389 -7.126 25.564 -11.815 1.00 0.00 H ATOM 1205 HE21 GLN A 389 -7.363 27.238 -11.194 1.00 0.00 H ATOM 1206 H GLN A 389 -13.545 24.048 -11.412 1.00 0.00 H ATOM 1207 N TYR A 390 -11.884 22.333 -13.684 1.00 19.32 N ATOM 1208 CA TYR A 390 -11.295 21.258 -14.464 1.00 17.64 C ATOM 1209 C TYR A 390 -12.134 20.571 -15.521 1.00 19.21 C ATOM 1210 O TYR A 390 -11.529 19.923 -16.374 1.00 18.84 O ATOM 1211 CB TYR A 390 -10.765 20.176 -13.512 1.00 17.52 C ATOM 1212 CG TYR A 390 -9.677 20.694 -12.601 1.00 19.23 C ATOM 1213 CD1 TYR A 390 -8.421 21.028 -13.102 1.00 20.39 C ATOM 1214 CD2 TYR A 390 -9.922 20.914 -11.251 1.00 21.14 C ATOM 1215 CE1 TYR A 390 -7.432 21.568 -12.273 1.00 19.57 C ATOM 1216 CE2 TYR A 390 -8.932 21.412 -10.408 1.00 22.70 C ATOM 1217 CZ TYR A 390 -7.692 21.747 -10.926 1.00 26.12 C ATOM 1218 OH TYR A 390 -6.735 22.265 -10.093 1.00 31.00 O ATOM 1219 HH TYR A 390 -5.913 22.450 -10.612 1.00 0.00 H ATOM 1220 H TYR A 390 -12.668 22.120 -13.035 1.00 0.00 H ATOM 1221 N THR A 391 -13.483 20.670 -15.507 1.00 14.85 N ATOM 1222 CA THR A 391 -14.231 19.939 -16.523 1.00 15.02 C ATOM 1223 C THR A 391 -13.823 20.339 -17.926 1.00 18.96 C ATOM 1224 O THR A 391 -13.868 21.514 -18.269 1.00 19.93 O ATOM 1225 CB THR A 391 -15.742 20.073 -16.328 1.00 20.54 C ATOM 1226 OG1 THR A 391 -16.059 19.698 -14.989 1.00 17.48 O ATOM 1227 CG2 THR A 391 -16.533 19.212 -17.320 1.00 19.15 C ATOM 1228 HG1 THR A 391 -15.582 20.294 -14.359 1.00 0.00 H ATOM 1229 H THR A 391 -13.971 21.249 -14.794 1.00 0.00 H ATOM 1230 N PHE A 392 -13.430 19.351 -18.749 1.00 15.48 N ATOM 1231 CA PHE A 392 -13.012 19.636 -20.106 1.00 16.05 C ATOM 1232 C PHE A 392 -14.102 20.204 -20.988 1.00 20.23 C ATOM 1233 O PHE A 392 -15.295 19.931 -20.802 1.00 18.22 O ATOM 1234 CB PHE A 392 -12.508 18.352 -20.776 1.00 16.88 C ATOM 1235 CG PHE A 392 -11.324 17.662 -20.143 1.00 16.54 C ATOM 1236 CD1 PHE A 392 -10.311 18.401 -19.531 1.00 19.23 C ATOM 1237 CD2 PHE A 392 -11.149 16.290 -20.283 1.00 18.42 C ATOM 1238 CE1 PHE A 392 -9.180 17.766 -18.999 1.00 20.00 C ATOM 1239 CE2 PHE A 392 -10.007 15.657 -19.775 1.00 18.73 C ATOM 1240 CZ PHE A 392 -9.038 16.399 -19.124 1.00 17.01 C ATOM 1241 H PHE A 392 -13.426 18.369 -18.407 1.00 0.00 H ATOM 1242 N ILE A 393 -13.649 20.960 -22.000 1.00 19.92 N ATOM 1243 CA ILE A 393 -14.444 21.507 -23.079 1.00 21.66 C ATOM 1244 C ILE A 393 -14.149 20.579 -24.251 1.00 25.53 C ATOM 1245 O ILE A 393 -12.979 20.340 -24.563 1.00 26.76 O ATOM 1246 CB ILE A 393 -14.037 22.973 -23.389 1.00 26.73 C ATOM 1247 CG1 ILE A 393 -14.227 23.875 -22.141 1.00 27.20 C ATOM 1248 CG2 ILE A 393 -14.809 23.510 -24.607 1.00 29.40 C ATOM 1249 CD1 ILE A 393 -13.458 25.193 -22.183 1.00 36.38 C ATOM 1250 H ILE A 393 -12.631 21.173 -22.010 1.00 0.00 H ATOM 1251 N TYR A 394 -15.191 20.009 -24.837 1.00 22.80 N ATOM 1252 CA TYR A 394 -15.074 19.089 -25.964 1.00 23.61 C ATOM 1253 C TYR A 394 -15.511 19.782 -27.237 1.00 29.91 C ATOM 1254 O TYR A 394 -16.570 20.417 -27.267 1.00 29.69 O ATOM 1255 CB TYR A 394 -15.911 17.828 -25.716 1.00 24.17 C ATOM 1256 CG TYR A 394 -15.396 16.997 -24.565 1.00 23.04 C ATOM 1257 CD1 TYR A 394 -14.418 16.026 -24.764 1.00 24.43 C ATOM 1258 CD2 TYR A 394 -15.880 17.185 -23.272 1.00 22.46 C ATOM 1259 CE1 TYR A 394 -13.933 15.264 -23.704 1.00 22.12 C ATOM 1260 CE2 TYR A 394 -15.410 16.422 -22.208 1.00 21.17 C ATOM 1261 CZ TYR A 394 -14.451 15.451 -22.431 1.00 23.97 C ATOM 1262 OH TYR A 394 -13.993 14.706 -21.372 1.00 20.30 O ATOM 1263 HH TYR A 394 -14.750 14.216 -20.963 1.00 0.00 H ATOM 1264 H TYR A 394 -16.141 20.228 -24.476 1.00 0.00 H ATOM 1265 N ILE A 395 -14.681 19.677 -28.280 1.00 27.54 N ATOM 1266 CA ILE A 395 -14.938 20.306 -29.579 1.00 29.27 C ATOM 1267 C ILE A 395 -14.962 19.210 -30.631 1.00 34.35 C ATOM 1268 O ILE A 395 -13.959 18.518 -30.823 1.00 33.68 O ATOM 1269 CB ILE A 395 -13.881 21.413 -29.901 1.00 32.88 C ATOM 1270 CG1 ILE A 395 -13.783 22.478 -28.783 1.00 33.13 C ATOM 1271 CG2 ILE A 395 -14.176 22.081 -31.243 1.00 34.57 C ATOM 1272 CD1 ILE A 395 -12.691 22.247 -27.743 1.00 42.86 C ATOM 1273 H ILE A 395 -13.810 19.121 -28.164 1.00 0.00 H ATOM 1274 N ASP A 396 -16.105 19.047 -31.299 1.00 33.64 N ATOM 1275 CA ASP A 396 -16.282 18.043 -32.352 1.00 35.53 C ATOM 1276 C ASP A 396 -15.338 18.316 -33.522 1.00 41.70 C ATOM 1277 O ASP A 396 -15.110 19.481 -33.868 1.00 42.49 O ATOM 1278 CB ASP A 396 -17.736 18.034 -32.868 1.00 39.36 C ATOM 1279 CG ASP A 396 -18.783 18.001 -31.771 1.00 57.18 C ATOM 1280 OD1 ASP A 396 -19.311 19.083 -31.421 1.00 59.67 O ATOM 1281 OD2 ASP A 396 -19.047 16.902 -31.236 1.00 64.11 O ATOM 1282 H ASP A 396 -16.909 19.662 -31.061 1.00 0.00 H ATOM 1283 N LYS A 397 -14.782 17.241 -34.116 1.00 38.48 N ATOM 1284 CA LYS A 397 -13.932 17.330 -35.305 1.00 40.26 C ATOM 1285 C LYS A 397 -14.834 17.841 -36.440 1.00 46.62 C ATOM 1286 O LYS A 397 -15.886 17.249 -36.702 1.00 47.87 O ATOM 1287 CB LYS A 397 -13.322 15.947 -35.642 1.00 42.47 C ATOM 1288 CG LYS A 397 -12.488 15.903 -36.930 1.00 54.36 C ATOM 1289 CD LYS A 397 -11.092 16.495 -36.754 1.00 60.96 C ATOM 1290 CE LYS A 397 -10.386 16.671 -38.075 1.00 67.83 C ATOM 1291 NZ LYS A 397 -9.004 17.190 -37.896 1.00 72.85 N ATOM 1292 HZ1 LYS A 397 -9.041 18.113 -37.419 1.00 0.00 H ATOM 1293 HZ2 LYS A 397 -8.456 16.521 -37.318 1.00 0.00 H ATOM 1294 HZ3 LYS A 397 -8.552 17.297 -38.827 1.00 0.00 H ATOM 1295 H LYS A 397 -14.966 16.302 -33.709 1.00 0.00 H ATOM 1296 N GLN A 398 -14.455 18.971 -37.061 1.00 43.23 N ATOM 1297 CA GLN A 398 -15.253 19.603 -38.112 1.00 42.36 C ATOM 1298 C GLN A 398 -14.990 19.013 -39.493 1.00 82.84 C ATOM 1299 O GLN A 398 -14.067 18.224 -39.660 1.00 47.13 O ATOM 1300 CB GLN A 398 -15.042 21.128 -38.134 1.00 44.18 C ATOM 1301 CG GLN A 398 -15.401 21.878 -36.845 1.00 46.67 C ATOM 1302 CD GLN A 398 -16.847 21.703 -36.437 1.00 58.94 C ATOM 1303 OE1 GLN A 398 -17.775 22.199 -37.078 1.00 58.79 O ATOM 1304 NE2 GLN A 398 -17.070 20.979 -35.365 1.00 41.16 N ATOM 1305 HE22 GLN A 398 -16.272 20.570 -34.839 1.00 0.00 H ATOM 1306 HE21 GLN A 398 -18.045 20.815 -35.042 1.00 0.00 H ATOM 1307 H GLN A 398 -13.557 19.415 -36.783 1.00 0.00 H TER 1308 GLN A 398 HETATM 1309 O HOH 1 -4.178 14.071 -27.303 1.00 40.78 O HETATM 1310 O HOH 2 -25.596 5.171 -15.778 1.00 29.57 O HETATM 1311 O HOH 3 -17.663 16.250 -18.888 1.00 20.93 O HETATM 1312 O HOH 4 -5.531 16.049 -25.724 1.00 30.98 O HETATM 1313 O HOH 5 -15.088 15.222 -18.999 1.00 16.48 O HETATM 1314 O HOH 6 -18.435 1.162 -7.677 1.00 35.52 O HETATM 1315 O HOH 7 -15.535 14.880 -3.940 1.00 34.11 O HETATM 1316 O HOH 8 -15.966 24.918 -16.373 1.00 39.77 O HETATM 1317 O HOH 9 5.923 3.414 -10.225 1.00 40.63 O HETATM 1318 O HOH 10 -9.247 10.815 -24.425 1.00 20.74 O HETATM 1319 O HOH 11 -9.597 6.593 -23.336 1.00 29.52 O HETATM 1320 O HOH 12 -4.503 23.171 -11.282 1.00 31.72 O HETATM 1321 O HOH 13 -12.039 18.359 -41.418 1.00 39.28 O HETATM 1322 O HOH 14 -0.038 21.657 -6.596 1.00 30.73 O HETATM 1323 O HOH 15 -15.838 23.330 -18.568 1.00 25.50 O HETATM 1324 O HOH 16 -0.924 21.497 -17.088 1.00 31.72 O HETATM 1325 O HOH 17 -16.599 1.079 -22.065 1.00 40.93 O HETATM 1326 O HOH 18 0.184 18.869 -1.677 1.00 39.26 O HETATM 1327 O HOH 19 -17.703 22.864 -27.523 1.00 36.89 O HETATM 1328 O HOH 20 -6.805 -6.210 -17.754 1.00 35.32 O HETATM 1329 O HOH 21 -3.356 19.100 -1.559 1.00 28.67 O HETATM 1330 O HOH 22 4.084 2.690 -17.104 1.00 42.91 O HETATM 1331 O HOH 23 -19.117 -4.242 -11.542 1.00 42.80 O HETATM 1332 O HOH 24 -12.274 27.886 -11.715 1.00 43.07 O HETATM 1333 O HOH 25 2.082 3.847 -20.859 1.00 45.61 O HETATM 1334 O HOH 26 8.742 16.455 -12.805 1.00 42.90 O HETATM 1335 O HOH 27 -13.365 26.826 -9.406 1.00 40.62 O HETATM 1336 O HOH 28 -3.999 14.745 1.402 1.00 34.94 O HETATM 1337 O HOH 29 -10.786 12.907 -1.761 1.00 43.06 O HETATM 1338 O HOH 30 1.155 5.307 3.181 1.00 67.50 O HETATM 1339 O HOH 31 -23.045 -1.321 -21.994 1.00 35.45 O HETATM 1340 O HOH 32 -9.892 2.320 -19.477 1.00 41.89 O HETATM 1341 O HOH 33 0.207 2.601 -23.698 1.00 52.30 O HETATM 1342 O HOH 34 -18.322 25.270 -3.232 1.00 40.40 O HETATM 1343 O HOH 35 1.180 9.847 -22.394 1.00 51.22 O HETATM 1344 O HOH 36 -13.667 1.392 -6.822 1.00 38.96 O HETATM 1345 O HOH 37 -19.336 -8.938 -15.302 1.00 45.54 O HETATM 1346 O HOH 38 -18.199 7.301 -25.026 1.00 42.06 O HETATM 1347 O HOH 39 -8.423 23.270 -16.114 1.00 26.34 O HETATM 1348 O HOH 40 3.344 -3.427 -6.925 1.00 36.11 O HETATM 1349 O HOH 41 -1.029 -1.620 -7.804 1.00 32.35 O HETATM 1350 O HOH 42 -17.475 21.547 -20.370 1.00 27.17 O HETATM 1351 O HOH 43 -3.440 4.687 -15.237 1.00 19.34 O HETATM 1352 O HOH 44 -5.663 17.120 -17.887 1.00 19.61 O HETATM 1353 O HOH 45 -13.190 10.685 -4.292 1.00 26.55 O HETATM 1354 O HOH 46 -1.749 15.347 0.002 1.00 27.24 O HETATM 1355 O HOH 47 2.162 -0.531 -13.471 1.00 36.70 O HETATM 1356 O HOH 48 -25.848 -0.932 -9.424 1.00 35.86 O HETATM 1357 O HOH 49 -16.869 17.123 -14.294 1.00 27.18 O HETATM 1358 O HOH 50 4.960 14.387 -7.852 1.00 36.47 O HETATM 1359 O HOH 51 -11.600 3.887 -3.009 1.00 31.55 O HETATM 1360 O HOH 52 3.643 9.754 -4.245 1.00 31.75 O HETATM 1361 O HOH 53 -5.844 24.840 -12.892 1.00 31.47 O HETATM 1362 O HOH 54 -23.442 15.739 -19.129 1.00 49.24 O HETATM 1363 O HOH 55 -25.474 3.144 -13.871 1.00 41.77 O HETATM 1364 O HOH 56 -11.009 -0.500 -17.185 1.00 28.11 O HETATM 1365 O HOH 57 -5.451 4.373 -22.353 1.00 36.67 O HETATM 1366 O HOH 58 -7.685 11.783 -27.771 1.00 48.17 O HETATM 1367 O HOH 59 7.262 1.389 -9.004 1.00 35.93 O HETATM 1368 O HOH 60 -8.872 20.623 -17.129 1.00 20.32 O HETATM 1369 O HOH 61 3.936 16.891 -8.373 1.00 29.17 O HETATM 1370 O HOH 62 7.299 -6.503 -4.598 1.00 31.40 O HETATM 1371 O HOH 63 -0.836 8.312 2.486 1.00 49.03 O HETATM 1372 O HOH 64 1.273 2.239 -10.478 1.00 21.17 O HETATM 1373 O HOH 65 -22.109 -1.421 -9.105 1.00 55.17 O HETATM 1374 O HOH 66 -24.282 9.101 -14.500 1.00 37.97 O HETATM 1375 O HOH 67 -11.798 20.127 -37.053 1.00 34.55 O HETATM 1376 O HOH 68 3.656 7.539 -2.264 1.00 38.91 O HETATM 1377 O HOH 69 -13.297 0.684 -20.735 1.00 50.32 O HETATM 1378 O HOH 70 -13.003 13.756 -4.109 1.00 23.98 O HETATM 1379 O HOH 71 -15.820 -1.754 -21.781 1.00 33.77 O HETATM 1380 O HOH 72 -0.932 -6.706 -0.148 1.00 65.89 O HETATM 1381 O HOH 73 -9.547 26.498 -2.152 1.00 37.73 O HETATM 1382 O HOH 74 -8.897 16.749 -15.142 1.00 16.34 O HETATM 1383 O HOH 75 -18.814 16.490 -16.170 1.00 21.54 O HETATM 1384 O HOH 76 -5.424 20.670 -15.105 1.00 35.29 O HETATM 1385 O HOH 77 8.099 7.595 -20.739 1.00 37.72 O HETATM 1386 O HOH 78 -22.635 13.042 -10.092 1.00 24.84 O HETATM 1387 O HOH 79 -15.958 -7.549 -13.212 1.00 46.95 O HETATM 1388 O HOH 80 6.116 -1.277 -9.075 1.00 30.41 O HETATM 1389 O HOH 81 8.153 -8.286 -2.638 1.00 57.07 O HETATM 1390 O HOH 82 -0.523 12.892 0.342 1.00 26.45 O HETATM 1391 O HOH 83 -18.030 20.435 -24.060 1.00 32.69 O HETATM 1392 O HOH 84 -19.725 20.579 -34.068 1.00 42.35 O HETATM 1393 O HOH 85 -12.493 4.675 -22.744 1.00 29.62 O HETATM 1394 O HOH 86 -21.302 2.698 -24.112 1.00 55.78 O HETATM 1395 O HOH 87 -1.721 21.441 -23.355 1.00 41.68 O HETATM 1396 O HOH 88 -7.130 -0.935 -19.179 1.00 39.89 O HETATM 1397 O HOH 89 10.911 12.539 -14.842 1.00 42.94 O HETATM 1398 O HOH 90 10.466 3.083 -9.044 1.00 44.90 O HETATM 1399 O HOH 91 -17.878 21.743 -30.852 1.00 51.54 O HETATM 1400 O HOH 92 2.747 20.581 -22.616 1.00 42.69 O HETATM 1401 O HOH 93 -27.272 1.835 -12.308 1.00 31.09 O HETATM 1402 O HOH 94 -2.113 2.092 -22.317 1.00 30.13 O HETATM 1403 O HOH 95 -18.818 -1.362 -22.811 1.00 40.84 O HETATM 1404 O HOH 96 -19.288 28.607 -11.395 1.00 42.60 O HETATM 1405 O HOH 97 -3.748 10.110 -27.597 1.00 55.88 O HETATM 1406 O HOH 98 -18.130 18.466 -20.498 1.00 44.09 O HETATM 1407 O HOH 99 -22.853 23.888 -9.036 1.00 44.11 O HETATM 1408 O HOH 100 4.514 8.040 2.024 1.00 47.21 O HETATM 1409 O HOH 101 -19.558 -10.849 -19.956 1.00 41.02 O HETATM 1410 O HOH 102 10.302 7.304 -7.609 1.00 61.64 O HETATM 1411 O HOH 103 -26.364 9.432 -26.152 1.00 40.83 O HETATM 1412 O HOH 104 -26.315 6.875 -21.517 1.00 54.08 O HETATM 1413 O HOH 105 -19.254 20.800 -3.246 1.00 40.26 O HETATM 1414 O HOH 106 -10.393 19.713 -39.739 1.00 41.35 O HETATM 1415 O HOH 107 -6.987 -5.885 -12.406 1.00 63.01 O HETATM 1416 O HOH 108 -19.760 19.829 -26.140 1.00 67.72 O HETATM 1417 O HOH 109 4.393 17.430 -2.397 1.00 62.39 O HETATM 1418 O HOH 110 -15.441 30.965 -12.268 1.00 41.30 O HETATM 1419 O HOH 111 11.785 7.318 -22.243 1.00 43.26 O HETATM 1420 O HOH 112 -12.738 1.819 -4.315 1.00 40.63 O HETATM 1421 O HOH 113 -9.628 8.177 -25.552 1.00 52.39 O HETATM 1422 O HOH 114 -11.897 -2.861 -5.770 1.00 61.63 O HETATM 1423 O HOH 115 -20.015 23.192 -2.215 1.00 37.58 O HETATM 1424 O HOH 116 2.547 16.665 0.963 1.00 67.56 O HETATM 1425 O HOH 117 -11.930 -0.784 -3.987 1.00 57.90 O HETATM 1426 O HOH 118 -24.563 10.481 -28.666 1.00 53.22 O HETATM 1427 O HOH 119 -21.580 13.405 -4.383 1.00 40.25 O HETATM 1428 O HOH 120 5.800 19.087 -10.030 1.00 51.98 O HETATM 1429 O HOH 121 -5.886 23.586 -15.318 1.00 43.37 O HETATM 1430 O HOH 122 -5.517 16.539 -39.663 1.00 43.81 O HETATM 1431 O HOH 123 -19.900 26.562 -9.594 1.00 38.14 O HETATM 1432 O HOH 124 -4.776 19.201 0.759 1.00 43.73 O HETATM 1433 O HOH 125 -11.451 10.957 -26.047 1.00 26.12 O HETATM 1434 O HOH 126 1.748 -0.428 -10.811 1.00 36.17 O HETATM 1435 O HOH 127 -8.658 14.373 -41.010 1.00 49.75 O HETATM 1436 O HOH 128 -3.286 5.061 -24.698 1.00 44.76 O HETATM 1437 O HOH 129 -7.137 18.637 -16.092 1.00 21.04 O HETATM 1438 O HOH 130 -21.970 7.119 -1.882 1.00 35.77 O HETATM 1439 O HOH 131 2.739 17.750 -4.973 1.00 61.98 O HETATM 1440 O HOH 132 -7.752 13.031 -38.710 1.00 35.86 O HETATM 1441 O HOH 133 -14.434 2.363 -23.118 1.00 50.61 O HETATM 1442 O HOH 134 -15.959 28.019 -9.133 1.00 53.76 O HETATM 1443 O HOH 135 -5.339 16.965 2.196 1.00 49.49 O HETATM 1444 O HOH 136 -20.305 7.105 -26.992 1.00 59.41 O HETATM 1445 O HOH 137 12.314 -12.677 3.474 1.00 45.64 O HETATM 1446 O HOH 138 -14.258 -1.938 -24.410 1.00 54.87 O HETATM 1447 O HOH 139 -22.881 9.557 -30.644 1.00 48.90 O HETATM 1448 O HOH 140 12.672 12.585 -28.404 1.00 56.20 O HETATM 1449 N1 EH A 8 -3.439 7.217 -18.750 1.00 -0.24 N HETATM 1450 C5 EH A 8 -3.442 8.111 -19.869 1.00 0.10 C HETATM 1451 C4 EH A 8 -4.169 7.456 -20.841 1.00 0.04 C HETATM 1452 N3 EH A 8 -4.560 6.205 -20.379 1.00 -0.31 N HETATM 1453 C2 EH A 8 -4.105 6.111 -19.156 1.00 0.11 C HETATM 1454 H8 EH A 8 -4.248 5.232 -18.529 1.00 0.13 H HETATM 1455 C6 EH A 8 -4.528 7.877 -22.213 1.00 -0.02 C HETATM 1456 C8 EH A 8 -5.838 7.734 -22.681 1.00 -0.06 C HETATM 1457 C9 EH A 8 -6.170 8.122 -23.970 1.00 -0.06 C HETATM 1458 C10 EH A 8 -5.206 8.655 -24.808 1.00 -0.07 C HETATM 1459 C11 EH A 8 -3.904 8.796 -24.356 1.00 -0.06 C HETATM 1460 C12 EH A 8 -3.563 8.409 -23.070 1.00 -0.06 C HETATM 1461 H11 EH A 8 -2.541 8.520 -22.727 1.00 0.06 H HETATM 1462 H10 EH A 8 -3.148 9.211 -25.012 1.00 0.06 H HETATM 1463 H2 EH A 8 -5.469 8.961 -25.814 1.00 0.06 H HETATM 1464 H9 EH A 8 -7.189 8.008 -24.323 1.00 0.06 H HETATM 1465 H1 EH A 8 -6.599 7.317 -22.032 1.00 0.06 H HETATM 1466 C7 EH A 8 -2.836 9.460 -19.850 1.00 0.02 C HETATM 1467 C14 EH A 8 -3.573 10.579 -20.250 1.00 -0.03 C HETATM 1468 C15 EH A 8 -2.967 11.820 -20.220 1.00 0.01 C HETATM 1469 N16 EH A 8 -1.712 12.021 -19.800 1.00 -0.30 N HETATM 1470 C17 EH A 8 -1.008 10.940 -19.437 1.00 0.01 C HETATM 1471 C18 EH A 8 -1.522 9.654 -19.439 1.00 -0.03 C HETATM 1472 H13 EH A 8 -0.911 8.815 -19.126 1.00 0.07 H HETATM 1473 H7 EH A 8 0.021 11.080 -19.125 1.00 0.08 H HETATM 1474 H6 EH A 8 -3.539 12.678 -20.555 1.00 0.08 H HETATM 1475 H12 EH A 8 -4.601 10.475 -20.578 1.00 0.07 H HETATM 1476 C13 EH A 8 -2.839 7.427 -17.435 1.00 0.05 C HETATM 1477 H3 EH A 8 -3.018 6.543 -16.805 1.00 0.06 H HETATM 1478 H4 EH A 8 -3.292 8.311 -16.962 1.00 0.06 H HETATM 1479 H5 EH A 8 -1.756 7.585 -17.547 1.00 0.06 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 811 812 822 823 824 CONECT 822 811 CONECT 823 811 CONECT 824 811 CONECT 1449 1450 1453 1476 CONECT 1450 1449 1451 1466 CONECT 1451 1450 1452 1455 CONECT 1452 1451 1453 CONECT 1453 1449 1452 1454 CONECT 1454 1453 CONECT 1455 1451 1456 1460 CONECT 1456 1455 1457 1465 CONECT 1457 1456 1458 1464 CONECT 1458 1457 1459 1463 CONECT 1459 1458 1460 1462 CONECT 1460 1455 1459 1461 CONECT 1461 1460 CONECT 1462 1459 CONECT 1463 1458 CONECT 1464 1457 CONECT 1465 1456 CONECT 1466 1450 1467 1471 CONECT 1467 1466 1468 1475 CONECT 1468 1467 1469 1474 CONECT 1469 1468 1470 CONECT 1470 1469 1471 1473 CONECT 1471 1466 1470 1472 CONECT 1472 1471 CONECT 1473 1470 CONECT 1474 1468 CONECT 1475 1467 CONECT 1476 1449 1477 1478 1479 CONECT 1477 1476 CONECT 1478 1476 CONECT 1479 1476 MASTER 0 0 0 0 0 0 0 0 1477 2 39 10 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 6g2b
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6g2o
RCSB PDB
PDBbind
136aa, >6G2O_1|Chain... at 100%
6g2f
RCSB PDB
PDBbind
136aa, >6G2F_1|Chain... at 100%
6g2e
RCSB PDB
PDBbind
136aa, >6G2E_1|Chain... at 100%
6g2c
RCSB PDB
PDBbind
136aa, >6G2C_1|Chain... at 100%
6g29
RCSB PDB
PDBbind
136aa, >6G29_1|Chain... at 100%
6g27
RCSB PDB
PDBbind
136aa, >6G27_1|Chain... at 100%
6g25
RCSB PDB
PDBbind
136aa, >6G25_1|Chain... at 100%
6g24
RCSB PDB
PDBbind
136aa, >6G24_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6g2b
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Histone-lysine N-methyltransferase NSD3
Ligand Name
EH8
EC.Number
E.C.2.1.1.43
Resolution
1.61(Å)
Affinity (Kd/Ki/IC50)
Kd=160uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Nat.Chem.Biol. Vol. 15: pp. 822-829
Ligand Properties
Formula
C
1
5
H
1
3
N
3
Molecular Weight
235.284
Exact Mass
235.111
No. of atoms
31
No. of bonds
33
Polar Surface Area
30.71
LOGP Value
2.27 (
Computed with XLOGP3
)
3.15 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 3
Canonical SMILES
Cn1cnc(c1c1ccncc1)c1ccccc1
InChI String
InChI=1S/C15H13N3/c1-18-11-17-14(12-5-3-2-4-6-12)15(18)13-7-9-16-10-8-13/h2-11H,1H3
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9BZ95
Entrez Gene ID
NCBI Entrez Gene ID:
54904
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com