USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1226 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 81 ASN : amide:sc= 0.444 K(o=2,f=-0.48) USER MOD Set 1.2: B 83 SER OG : rot 99:sc= 0.895 USER MOD Set 1.3: B 84 THR OG1 : rot 143:sc= 0.69 USER MOD Set 2.1: B 78 HIS : no HE2:sc= -1.11 K(o=-1.2,f=-3!) USER MOD Set 2.2: B 80 SER OG : rot -140:sc= -0.0789 USER MOD Set 3.1: B 66 GLN : amide:sc= -0.48! C(o=-2.7!,f=-5.3!) USER MOD Set 3.2: B 76 ASN : amide:sc= -2.2! C(o=-2.7!,f=-5.3!) USER MOD Set 4.1: B 62 LYS NZ :NH3+ 177:sc= 0.844! (180deg=-0.356!) USER MOD Set 4.2: B 64 GLN : amide:sc= -0.693! C(o=0.15!,f=-13!) USER MOD Set 5.1: B 13 LYS NZ :NH3+ -121:sc= 0.336 (180deg=-1.82!) USER MOD Set 5.2: B 25 TYR OH : rot 180:sc= 0.739 USER MOD Set 6.1: A 405 TYR OH : rot -36:sc= -0.134 USER MOD Set 6.2: A 426 TYR OH : rot 180:sc= -0.222 USER MOD Set 7.1: A 409 SER OG : rot -84:sc= 1.5 USER MOD Set 7.2: A 410 GLN : amide:sc= 0.0277 K(o=1.5,f=0.91) USER MOD Single : A 397 MET CE :methyl -133:sc= 0 (180deg=-1.9!) USER MOD Single : A 404 SER OG : rot 180:sc= 0 USER MOD Single : A 406 SER OG : rot -90:sc= 0.804 USER MOD Single : A 417 GLN : amide:sc= 0.997 K(o=1,f=-6.7!) USER MOD Single : A 418 MET CE :methyl -150:sc= -6.01! (180deg=-6.7!) USER MOD Single : A 419 THR OG1 : rot 180:sc= 0.0551 USER MOD Single : A 423 LYS NZ :NH3+ -143:sc= -2.45! (180deg=-4.51!) USER MOD Single : A 429 MET CE :methyl 148:sc= -5.46! (180deg=-7.61!) USER MOD Single : A 431 GLN : amide:sc= 1.26 K(o=1.3,f=-0.081) USER MOD Single : A 433 MET CE :methyl 165:sc= -2.71 (180deg=-3.23!) USER MOD Single : B 14 LYS NZ :NH3+ -175:sc= 1.12 (180deg=0.994) USER MOD Single : B 17 GLN : amide:sc= -0.778 K(o=-0.78,f=-1.6) USER MOD Single : B 18 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0345) USER MOD Single : B 19 LYS NZ :NH3+ -147:sc= 0.187 (180deg=-0.061) USER MOD Single : B 20 GLN : amide:sc= 0.768 K(o=0.77,f=0) USER MOD Single : B 27 MET CE :methyl -138:sc= -3.81! (180deg=-10.4!) USER MOD Single : B 38 LYS NZ :NH3+ 163:sc= 1.39 (180deg=-0.404!) USER MOD Single : B 42 THR OG1 : rot 180:sc=-0.00284 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 45 HIS : no HE2:sc= -0.0407 K(o=-0.041,f=-1.6!) USER MOD Single : B 46 MET CE :methyl 145:sc= -5.62! (180deg=-7.26!) USER MOD Single : B 47 TYR OH : rot 142:sc= 1.28 USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 CYS SG : rot 3:sc= -0.87 USER MOD Single : B 53 GLN : amide:sc= -2 K(o=-2,f=-2.9) USER MOD Single : B 54 LYS NZ :NH3+ -178:sc= 1.27 (180deg=1.18) USER MOD Single : B 56 SER OG : rot -56:sc= 1.07 USER MOD Single : B 60 LYS NZ :NH3+ -137:sc= 0.959! (180deg=-1.39!) USER MOD Single : B 70 HIS : no HD1:sc= -1.29 K(o=-1.3,f=-2.8) USER MOD Single : B 74 THR OG1 : rot 29:sc= 0.529 USER MOD Single : B 75 THR OG1 : rot 180:sc= 0 USER MOD Single : B 87 LYS NZ :NH3+ -171:sc= 0.0231 (180deg=-0.123) USER MOD Single : B 93 LYS NZ :NH3+ -177:sc= 2.96 (180deg=2.8) USER MOD Single : B 97 GLN : amide:sc= -2.29! K(o=-2.3!,f=-0.42) USER MOD Single : B 98 GLN : amide:sc= -0.0106 X(o=-0.011,f=-0.2) USER MOD Single : B 102 LYS NZ :NH3+ -166:sc= 0.0362 (180deg=-0.0332) USER MOD Single : B 104 LYS NZ :NH3+ -140:sc= 1.47 (180deg=0.162) USER MOD ----------------------------------------------------------------- ATOM 58 N GLU A 382 9.796 10.573 11.267 1.00 0.00 N ATOM 59 CA GLU A 382 8.818 9.660 10.639 1.00 0.00 C ATOM 60 C GLU A 382 7.478 9.706 11.393 1.00 0.00 C ATOM 61 O GLU A 382 6.418 9.849 10.787 1.00 0.00 O ATOM 62 CB GLU A 382 9.347 8.221 10.561 1.00 0.00 C ATOM 63 CG GLU A 382 10.295 7.979 9.394 1.00 0.00 C ATOM 64 CD GLU A 382 10.378 6.515 8.998 1.00 0.00 C ATOM 65 OE1 GLU A 382 9.416 5.764 9.278 1.00 0.00 O ATOM 66 OE2 GLU A 382 11.404 6.113 8.403 1.00 0.00 O ATOM 0 HA GLU A 382 8.658 10.003 9.617 1.00 0.00 H new ATOM 0 HB2 GLU A 382 9.862 7.982 11.491 1.00 0.00 H new ATOM 0 HB3 GLU A 382 8.502 7.537 10.479 1.00 0.00 H new ATOM 0 HG2 GLU A 382 9.965 8.565 8.536 1.00 0.00 H new ATOM 0 HG3 GLU A 382 11.290 8.336 9.660 1.00 0.00 H new ATOM 73 N GLU A 383 7.586 9.598 12.717 1.00 0.00 N ATOM 74 CA GLU A 383 6.486 9.639 13.685 1.00 0.00 C ATOM 75 C GLU A 383 5.112 9.186 13.146 1.00 0.00 C ATOM 76 O GLU A 383 4.980 8.089 12.599 1.00 0.00 O ATOM 77 CB GLU A 383 6.437 11.032 14.383 1.00 0.00 C ATOM 78 CG GLU A 383 5.862 12.209 13.579 1.00 0.00 C ATOM 79 CD GLU A 383 6.679 12.608 12.368 1.00 0.00 C ATOM 80 OE1 GLU A 383 7.895 12.837 12.504 1.00 0.00 O ATOM 81 OE2 GLU A 383 6.099 12.704 11.271 1.00 0.00 O ATOM 0 H GLU A 383 8.492 9.473 13.169 1.00 0.00 H new ATOM 0 HA GLU A 383 6.713 8.878 14.432 1.00 0.00 H new ATOM 0 HB2 GLU A 383 5.851 10.930 15.296 1.00 0.00 H new ATOM 0 HB3 GLU A 383 7.452 11.294 14.683 1.00 0.00 H new ATOM 0 HG2 GLU A 383 4.855 11.950 13.252 1.00 0.00 H new ATOM 0 HG3 GLU A 383 5.771 13.072 14.239 1.00 0.00 H new ATOM 88 N ASP A 384 4.108 10.032 13.334 1.00 0.00 N ATOM 89 CA ASP A 384 2.729 9.764 12.937 1.00 0.00 C ATOM 90 C ASP A 384 1.927 11.026 13.221 1.00 0.00 C ATOM 91 O ASP A 384 1.277 11.139 14.261 1.00 0.00 O ATOM 92 CB ASP A 384 2.148 8.581 13.733 1.00 0.00 C ATOM 93 CG ASP A 384 1.070 7.811 12.984 1.00 0.00 C ATOM 94 OD1 ASP A 384 -0.083 8.282 12.918 1.00 0.00 O ATOM 95 OD2 ASP A 384 1.367 6.707 12.478 1.00 0.00 O ATOM 0 H ASP A 384 4.230 10.943 13.776 1.00 0.00 H new ATOM 0 HA ASP A 384 2.685 9.499 11.881 1.00 0.00 H new ATOM 0 HB2 ASP A 384 2.956 7.897 13.993 1.00 0.00 H new ATOM 0 HB3 ASP A 384 1.732 8.954 14.669 1.00 0.00 H new ATOM 100 N ASP A 385 2.013 11.993 12.318 1.00 0.00 N ATOM 101 CA ASP A 385 1.333 13.267 12.502 1.00 0.00 C ATOM 102 C ASP A 385 -0.146 13.170 12.166 1.00 0.00 C ATOM 103 O ASP A 385 -0.969 13.826 12.808 1.00 0.00 O ATOM 104 CB ASP A 385 2.006 14.366 11.662 1.00 0.00 C ATOM 105 CG ASP A 385 1.743 14.241 10.170 1.00 0.00 C ATOM 106 OD1 ASP A 385 2.015 13.159 9.602 1.00 0.00 O ATOM 107 OD2 ASP A 385 1.283 15.232 9.561 1.00 0.00 O ATOM 0 H ASP A 385 2.546 11.920 11.452 1.00 0.00 H new ATOM 0 HA ASP A 385 1.414 13.532 13.556 1.00 0.00 H new ATOM 0 HB2 ASP A 385 1.654 15.339 12.004 1.00 0.00 H new ATOM 0 HB3 ASP A 385 3.082 14.337 11.836 1.00 0.00 H new ATOM 112 N GLU A 386 -0.486 12.339 11.186 1.00 0.00 N ATOM 113 CA GLU A 386 -1.853 12.176 10.760 1.00 0.00 C ATOM 114 C GLU A 386 -1.870 11.168 9.641 1.00 0.00 C ATOM 115 O GLU A 386 -1.579 11.500 8.490 1.00 0.00 O ATOM 116 CB GLU A 386 -2.394 13.508 10.270 1.00 0.00 C ATOM 117 CG GLU A 386 -3.839 13.790 10.637 1.00 0.00 C ATOM 118 CD GLU A 386 -4.811 13.278 9.598 1.00 0.00 C ATOM 119 OE1 GLU A 386 -5.234 12.114 9.700 1.00 0.00 O ATOM 120 OE2 GLU A 386 -5.142 14.048 8.669 1.00 0.00 O ATOM 0 H GLU A 386 0.183 11.766 10.672 1.00 0.00 H new ATOM 0 HA GLU A 386 -2.476 11.832 11.586 1.00 0.00 H new ATOM 0 HB2 GLU A 386 -1.771 14.306 10.673 1.00 0.00 H new ATOM 0 HB3 GLU A 386 -2.297 13.545 9.185 1.00 0.00 H new ATOM 0 HG2 GLU A 386 -4.063 13.328 11.598 1.00 0.00 H new ATOM 0 HG3 GLU A 386 -3.976 14.864 10.760 1.00 0.00 H new ATOM 127 N PHE A 387 -2.168 9.932 9.969 1.00 0.00 N ATOM 128 CA PHE A 387 -2.162 8.899 8.967 1.00 0.00 C ATOM 129 C PHE A 387 -3.477 8.146 8.903 1.00 0.00 C ATOM 130 O PHE A 387 -4.094 7.843 9.922 1.00 0.00 O ATOM 131 CB PHE A 387 -1.018 7.912 9.214 1.00 0.00 C ATOM 132 CG PHE A 387 0.342 8.496 8.984 1.00 0.00 C ATOM 133 CD1 PHE A 387 0.928 9.303 9.940 1.00 0.00 C ATOM 134 CD2 PHE A 387 1.032 8.248 7.808 1.00 0.00 C ATOM 135 CE1 PHE A 387 2.165 9.857 9.731 1.00 0.00 C ATOM 136 CE2 PHE A 387 2.275 8.797 7.599 1.00 0.00 C ATOM 137 CZ PHE A 387 2.839 9.604 8.564 1.00 0.00 C ATOM 0 H PHE A 387 -2.414 9.623 10.909 1.00 0.00 H new ATOM 0 HA PHE A 387 -2.016 9.397 8.008 1.00 0.00 H new ATOM 0 HB2 PHE A 387 -1.079 7.549 10.240 1.00 0.00 H new ATOM 0 HB3 PHE A 387 -1.148 7.048 8.562 1.00 0.00 H new ATOM 0 HD1 PHE A 387 0.405 9.500 10.864 1.00 0.00 H new ATOM 0 HD2 PHE A 387 0.590 7.619 7.050 1.00 0.00 H new ATOM 0 HE1 PHE A 387 2.608 10.492 10.484 1.00 0.00 H new ATOM 0 HE2 PHE A 387 2.808 8.597 6.681 1.00 0.00 H new ATOM 0 HZ PHE A 387 3.814 10.038 8.400 1.00 0.00 H new ATOM 147 N GLU A 388 -3.862 7.832 7.682 1.00 0.00 N ATOM 148 CA GLU A 388 -5.067 7.093 7.395 1.00 0.00 C ATOM 149 C GLU A 388 -4.667 5.658 7.203 1.00 0.00 C ATOM 150 O GLU A 388 -3.845 5.374 6.325 1.00 0.00 O ATOM 151 CB GLU A 388 -5.710 7.600 6.098 1.00 0.00 C ATOM 152 CG GLU A 388 -7.020 8.342 6.281 1.00 0.00 C ATOM 153 CD GLU A 388 -8.150 7.438 6.734 1.00 0.00 C ATOM 154 OE1 GLU A 388 -8.016 6.803 7.802 1.00 0.00 O ATOM 155 OE2 GLU A 388 -9.167 7.361 6.016 1.00 0.00 O ATOM 0 H GLU A 388 -3.333 8.090 6.849 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.783 7.211 8.208 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.004 8.259 5.593 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -5.880 6.750 5.438 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -6.882 9.138 7.013 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -7.297 8.818 5.340 1.00 0.00 H new ATOM 162 N GLU A 389 -5.177 4.763 8.025 1.00 0.00 N ATOM 163 CA GLU A 389 -4.835 3.368 7.868 1.00 0.00 C ATOM 164 C GLU A 389 -5.364 2.919 6.515 1.00 0.00 C ATOM 165 O GLU A 389 -6.566 2.721 6.338 1.00 0.00 O ATOM 166 CB GLU A 389 -5.446 2.527 8.992 1.00 0.00 C ATOM 167 CG GLU A 389 -4.513 1.452 9.530 1.00 0.00 C ATOM 168 CD GLU A 389 -3.535 1.980 10.563 1.00 0.00 C ATOM 169 OE1 GLU A 389 -3.815 3.037 11.172 1.00 0.00 O ATOM 170 OE2 GLU A 389 -2.486 1.337 10.772 1.00 0.00 O ATOM 0 H GLU A 389 -5.816 4.972 8.792 1.00 0.00 H new ATOM 0 HA GLU A 389 -3.754 3.235 7.920 1.00 0.00 H new ATOM 0 HB2 GLU A 389 -5.736 3.186 9.810 1.00 0.00 H new ATOM 0 HB3 GLU A 389 -6.357 2.054 8.625 1.00 0.00 H new ATOM 0 HG2 GLU A 389 -5.106 0.653 9.974 1.00 0.00 H new ATOM 0 HG3 GLU A 389 -3.957 1.013 8.702 1.00 0.00 H new ATOM 177 N VAL A 390 -4.465 2.761 5.557 1.00 0.00 N ATOM 178 CA VAL A 390 -4.869 2.367 4.236 1.00 0.00 C ATOM 179 C VAL A 390 -5.145 0.883 4.212 1.00 0.00 C ATOM 180 O VAL A 390 -4.298 0.078 4.604 1.00 0.00 O ATOM 181 CB VAL A 390 -3.831 2.663 3.137 1.00 0.00 C ATOM 182 CG1 VAL A 390 -4.487 2.582 1.769 1.00 0.00 C ATOM 183 CG2 VAL A 390 -3.180 4.011 3.320 1.00 0.00 C ATOM 0 H VAL A 390 -3.462 2.900 5.677 1.00 0.00 H new ATOM 0 HA VAL A 390 -5.757 2.961 4.017 1.00 0.00 H new ATOM 0 HB VAL A 390 -3.047 1.909 3.213 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -3.747 2.793 0.997 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -4.893 1.582 1.619 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -5.293 3.314 1.708 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -2.456 4.177 2.522 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -3.941 4.790 3.286 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -2.672 4.042 4.284 1.00 0.00 H new ATOM 193 N ALA A 391 -6.307 0.527 3.731 1.00 0.00 N ATOM 194 CA ALA A 391 -6.691 -0.861 3.657 1.00 0.00 C ATOM 195 C ALA A 391 -6.275 -1.439 2.320 1.00 0.00 C ATOM 196 O ALA A 391 -6.329 -0.757 1.301 1.00 0.00 O ATOM 197 CB ALA A 391 -8.189 -1.009 3.866 1.00 0.00 C ATOM 0 H ALA A 391 -7.008 1.181 3.383 1.00 0.00 H new ATOM 0 HA ALA A 391 -6.184 -1.413 4.448 1.00 0.00 H new ATOM 0 HB1 ALA A 391 -8.462 -2.063 3.807 1.00 0.00 H new ATOM 0 HB2 ALA A 391 -8.460 -0.618 4.847 1.00 0.00 H new ATOM 0 HB3 ALA A 391 -8.721 -0.453 3.094 1.00 0.00 H new ATOM 203 N ASP A 392 -5.796 -2.666 2.356 1.00 0.00 N ATOM 204 CA ASP A 392 -5.386 -3.399 1.164 1.00 0.00 C ATOM 205 C ASP A 392 -6.610 -3.759 0.332 1.00 0.00 C ATOM 206 O ASP A 392 -7.016 -4.918 0.249 1.00 0.00 O ATOM 207 CB ASP A 392 -4.618 -4.667 1.558 1.00 0.00 C ATOM 208 CG ASP A 392 -5.258 -5.433 2.705 1.00 0.00 C ATOM 209 OD1 ASP A 392 -5.338 -4.883 3.824 1.00 0.00 O ATOM 210 OD2 ASP A 392 -5.653 -6.601 2.500 1.00 0.00 O ATOM 0 H ASP A 392 -5.677 -3.193 3.221 1.00 0.00 H new ATOM 0 HA ASP A 392 -4.727 -2.767 0.568 1.00 0.00 H new ATOM 0 HB2 ASP A 392 -4.545 -5.322 0.690 1.00 0.00 H new ATOM 0 HB3 ASP A 392 -3.600 -4.394 1.837 1.00 0.00 H new ATOM 215 N ASP A 393 -7.186 -2.748 -0.288 1.00 0.00 N ATOM 216 CA ASP A 393 -8.385 -2.914 -1.081 1.00 0.00 C ATOM 217 C ASP A 393 -8.075 -3.055 -2.565 1.00 0.00 C ATOM 218 O ASP A 393 -7.507 -2.157 -3.185 1.00 0.00 O ATOM 219 CB ASP A 393 -9.300 -1.724 -0.847 1.00 0.00 C ATOM 220 CG ASP A 393 -10.758 -2.049 -1.122 1.00 0.00 C ATOM 221 OD1 ASP A 393 -11.328 -2.897 -0.408 1.00 0.00 O ATOM 222 OD2 ASP A 393 -11.348 -1.452 -2.053 1.00 0.00 O ATOM 0 H ASP A 393 -6.836 -1.791 -0.256 1.00 0.00 H new ATOM 0 HA ASP A 393 -8.877 -3.835 -0.769 1.00 0.00 H new ATOM 0 HB2 ASP A 393 -9.195 -1.386 0.184 1.00 0.00 H new ATOM 0 HB3 ASP A 393 -8.988 -0.898 -1.487 1.00 0.00 H new ATOM 227 N PRO A 394 -8.449 -4.199 -3.150 1.00 0.00 N ATOM 228 CA PRO A 394 -8.227 -4.478 -4.564 1.00 0.00 C ATOM 229 C PRO A 394 -9.289 -3.851 -5.466 1.00 0.00 C ATOM 230 O PRO A 394 -10.322 -3.365 -4.998 1.00 0.00 O ATOM 231 CB PRO A 394 -8.325 -6.000 -4.624 1.00 0.00 C ATOM 232 CG PRO A 394 -9.294 -6.347 -3.551 1.00 0.00 C ATOM 233 CD PRO A 394 -9.103 -5.323 -2.462 1.00 0.00 C ATOM 0 HA PRO A 394 -7.281 -4.068 -4.917 1.00 0.00 H new ATOM 0 HB2 PRO A 394 -8.674 -6.338 -5.600 1.00 0.00 H new ATOM 0 HB3 PRO A 394 -7.356 -6.468 -4.452 1.00 0.00 H new ATOM 0 HG2 PRO A 394 -10.316 -6.327 -3.929 1.00 0.00 H new ATOM 0 HG3 PRO A 394 -9.113 -7.354 -3.174 1.00 0.00 H new ATOM 0 HD2 PRO A 394 -10.055 -5.024 -2.022 1.00 0.00 H new ATOM 0 HD3 PRO A 394 -8.485 -5.711 -1.652 1.00 0.00 H new ATOM 241 N ILE A 395 -9.033 -3.888 -6.762 1.00 0.00 N ATOM 242 CA ILE A 395 -9.953 -3.342 -7.747 1.00 0.00 C ATOM 243 C ILE A 395 -10.738 -4.473 -8.402 1.00 0.00 C ATOM 244 O ILE A 395 -10.158 -5.384 -8.992 1.00 0.00 O ATOM 245 CB ILE A 395 -9.203 -2.523 -8.829 1.00 0.00 C ATOM 246 CG1 ILE A 395 -8.818 -1.147 -8.280 1.00 0.00 C ATOM 247 CG2 ILE A 395 -10.036 -2.374 -10.099 1.00 0.00 C ATOM 248 CD1 ILE A 395 -10.001 -0.320 -7.828 1.00 0.00 C ATOM 0 H ILE A 395 -8.187 -4.295 -7.161 1.00 0.00 H new ATOM 0 HA ILE A 395 -10.640 -2.669 -7.233 1.00 0.00 H new ATOM 0 HB ILE A 395 -8.296 -3.069 -9.090 1.00 0.00 H new ATOM 0 HG12 ILE A 395 -8.136 -1.279 -7.440 1.00 0.00 H new ATOM 0 HG13 ILE A 395 -8.275 -0.598 -9.049 1.00 0.00 H new ATOM 0 HG21 ILE A 395 -9.478 -1.794 -10.834 1.00 0.00 H new ATOM 0 HG22 ILE A 395 -10.258 -3.360 -10.507 1.00 0.00 H new ATOM 0 HG23 ILE A 395 -10.968 -1.861 -9.864 1.00 0.00 H new ATOM 0 HD11 ILE A 395 -9.651 0.641 -7.452 1.00 0.00 H new ATOM 0 HD12 ILE A 395 -10.674 -0.156 -8.670 1.00 0.00 H new ATOM 0 HD13 ILE A 395 -10.533 -0.848 -7.036 1.00 0.00 H new ATOM 260 N VAL A 396 -12.050 -4.416 -8.274 1.00 0.00 N ATOM 261 CA VAL A 396 -12.925 -5.421 -8.849 1.00 0.00 C ATOM 262 C VAL A 396 -13.906 -4.753 -9.801 1.00 0.00 C ATOM 263 O VAL A 396 -14.654 -3.852 -9.419 1.00 0.00 O ATOM 264 CB VAL A 396 -13.663 -6.241 -7.752 1.00 0.00 C ATOM 265 CG1 VAL A 396 -13.934 -5.400 -6.515 1.00 0.00 C ATOM 266 CG2 VAL A 396 -14.947 -6.863 -8.280 1.00 0.00 C ATOM 0 H VAL A 396 -12.538 -3.675 -7.771 1.00 0.00 H new ATOM 0 HA VAL A 396 -12.318 -6.132 -9.409 1.00 0.00 H new ATOM 0 HB VAL A 396 -12.999 -7.055 -7.463 1.00 0.00 H new ATOM 0 HG11 VAL A 396 -14.451 -6.005 -5.770 1.00 0.00 H new ATOM 0 HG12 VAL A 396 -12.990 -5.045 -6.103 1.00 0.00 H new ATOM 0 HG13 VAL A 396 -14.556 -4.547 -6.784 1.00 0.00 H new ATOM 0 HG21 VAL A 396 -15.432 -7.427 -7.484 1.00 0.00 H new ATOM 0 HG22 VAL A 396 -15.616 -6.076 -8.627 1.00 0.00 H new ATOM 0 HG23 VAL A 396 -14.713 -7.532 -9.108 1.00 0.00 H new ATOM 276 N MET A 397 -13.883 -5.183 -11.050 1.00 0.00 N ATOM 277 CA MET A 397 -14.737 -4.609 -12.061 1.00 0.00 C ATOM 278 C MET A 397 -16.107 -5.248 -12.017 1.00 0.00 C ATOM 279 O MET A 397 -16.237 -6.447 -11.787 1.00 0.00 O ATOM 280 CB MET A 397 -14.115 -4.785 -13.448 1.00 0.00 C ATOM 281 CG MET A 397 -12.612 -4.556 -13.469 1.00 0.00 C ATOM 282 SD MET A 397 -11.937 -4.460 -15.138 1.00 0.00 S ATOM 283 CE MET A 397 -12.424 -2.801 -15.593 1.00 0.00 C ATOM 0 H MET A 397 -13.277 -5.932 -11.384 1.00 0.00 H new ATOM 0 HA MET A 397 -14.843 -3.543 -11.860 1.00 0.00 H new ATOM 0 HB2 MET A 397 -14.327 -5.792 -13.808 1.00 0.00 H new ATOM 0 HB3 MET A 397 -14.590 -4.092 -14.142 1.00 0.00 H new ATOM 0 HG2 MET A 397 -12.383 -3.633 -12.937 1.00 0.00 H new ATOM 0 HG3 MET A 397 -12.119 -5.365 -12.930 1.00 0.00 H new ATOM 0 HE1 MET A 397 -12.867 -2.812 -16.589 1.00 0.00 H new ATOM 0 HE2 MET A 397 -13.154 -2.426 -14.875 1.00 0.00 H new ATOM 0 HE3 MET A 397 -11.548 -2.152 -15.593 1.00 0.00 H new ATOM 293 N VAL A 398 -17.119 -4.425 -12.190 1.00 0.00 N ATOM 294 CA VAL A 398 -18.490 -4.883 -12.204 1.00 0.00 C ATOM 295 C VAL A 398 -19.179 -4.355 -13.448 1.00 0.00 C ATOM 296 O VAL A 398 -19.327 -3.139 -13.613 1.00 0.00 O ATOM 297 CB VAL A 398 -19.265 -4.424 -10.961 1.00 0.00 C ATOM 298 CG1 VAL A 398 -20.727 -4.787 -11.103 1.00 0.00 C ATOM 299 CG2 VAL A 398 -18.680 -5.043 -9.702 1.00 0.00 C ATOM 0 H VAL A 398 -17.013 -3.419 -12.325 1.00 0.00 H new ATOM 0 HA VAL A 398 -18.478 -5.973 -12.203 1.00 0.00 H new ATOM 0 HB VAL A 398 -19.177 -3.341 -10.875 1.00 0.00 H new ATOM 0 HG11 VAL A 398 -21.271 -4.458 -10.218 1.00 0.00 H new ATOM 0 HG12 VAL A 398 -21.140 -4.297 -11.985 1.00 0.00 H new ATOM 0 HG13 VAL A 398 -20.825 -5.867 -11.209 1.00 0.00 H new ATOM 0 HG21 VAL A 398 -19.245 -4.704 -8.834 1.00 0.00 H new ATOM 0 HG22 VAL A 398 -18.737 -6.129 -9.770 1.00 0.00 H new ATOM 0 HG23 VAL A 398 -17.638 -4.740 -9.598 1.00 0.00 H new ATOM 309 N ALA A 399 -19.578 -5.269 -14.322 1.00 0.00 N ATOM 310 CA ALA A 399 -20.226 -4.925 -15.575 1.00 0.00 C ATOM 311 C ALA A 399 -19.253 -4.138 -16.448 1.00 0.00 C ATOM 312 O ALA A 399 -19.656 -3.307 -17.262 1.00 0.00 O ATOM 313 CB ALA A 399 -21.516 -4.147 -15.332 1.00 0.00 C ATOM 0 H ALA A 399 -19.460 -6.272 -14.179 1.00 0.00 H new ATOM 0 HA ALA A 399 -20.503 -5.841 -16.097 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -21.979 -3.903 -16.288 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -22.201 -4.754 -14.741 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -21.290 -3.227 -14.793 1.00 0.00 H new ATOM 319 N GLY A 400 -17.957 -4.400 -16.252 1.00 0.00 N ATOM 320 CA GLY A 400 -16.934 -3.716 -17.023 1.00 0.00 C ATOM 321 C GLY A 400 -16.483 -2.424 -16.368 1.00 0.00 C ATOM 322 O GLY A 400 -15.487 -1.826 -16.773 1.00 0.00 O ATOM 0 H GLY A 400 -17.602 -5.073 -15.573 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -16.075 -4.376 -17.148 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -17.318 -3.500 -18.020 1.00 0.00 H new ATOM 326 N ARG A 401 -17.214 -1.997 -15.349 1.00 0.00 N ATOM 327 CA ARG A 401 -16.888 -0.772 -14.634 1.00 0.00 C ATOM 328 C ARG A 401 -15.931 -1.084 -13.489 1.00 0.00 C ATOM 329 O ARG A 401 -16.252 -1.879 -12.609 1.00 0.00 O ATOM 330 CB ARG A 401 -18.158 -0.114 -14.093 1.00 0.00 C ATOM 331 CG ARG A 401 -19.216 0.144 -15.154 1.00 0.00 C ATOM 332 CD ARG A 401 -20.600 0.272 -14.537 1.00 0.00 C ATOM 333 NE ARG A 401 -21.004 -0.953 -13.844 1.00 0.00 N ATOM 334 CZ ARG A 401 -22.186 -1.128 -13.251 1.00 0.00 C ATOM 335 NH1 ARG A 401 -23.088 -0.154 -13.247 1.00 0.00 N ATOM 336 NH2 ARG A 401 -22.467 -2.282 -12.660 1.00 0.00 N ATOM 0 H ARG A 401 -18.039 -2.482 -14.998 1.00 0.00 H new ATOM 0 HA ARG A 401 -16.408 -0.079 -15.324 1.00 0.00 H new ATOM 0 HB2 ARG A 401 -18.583 -0.750 -13.317 1.00 0.00 H new ATOM 0 HB3 ARG A 401 -17.893 0.832 -13.620 1.00 0.00 H new ATOM 0 HG2 ARG A 401 -18.973 1.056 -15.698 1.00 0.00 H new ATOM 0 HG3 ARG A 401 -19.213 -0.670 -15.879 1.00 0.00 H new ATOM 0 HD2 ARG A 401 -20.609 1.106 -13.835 1.00 0.00 H new ATOM 0 HD3 ARG A 401 -21.325 0.504 -15.317 1.00 0.00 H new ATOM 0 HE ARG A 401 -20.337 -1.724 -13.813 1.00 0.00 H new ATOM 0 HH11 ARG A 401 -22.880 0.736 -13.700 1.00 0.00 H new ATOM 0 HH12 ARG A 401 -23.990 -0.296 -12.791 1.00 0.00 H new ATOM 0 HH21 ARG A 401 -21.779 -3.035 -12.659 1.00 0.00 H new ATOM 0 HH22 ARG A 401 -23.371 -2.416 -12.206 1.00 0.00 H new ATOM 350 N PRO A 402 -14.741 -0.472 -13.493 1.00 0.00 N ATOM 351 CA PRO A 402 -13.735 -0.706 -12.456 1.00 0.00 C ATOM 352 C PRO A 402 -14.095 -0.072 -11.114 1.00 0.00 C ATOM 353 O PRO A 402 -14.066 1.148 -10.960 1.00 0.00 O ATOM 354 CB PRO A 402 -12.475 -0.059 -13.034 1.00 0.00 C ATOM 355 CG PRO A 402 -12.979 1.004 -13.950 1.00 0.00 C ATOM 356 CD PRO A 402 -14.281 0.493 -14.508 1.00 0.00 C ATOM 0 HA PRO A 402 -13.629 -1.768 -12.235 1.00 0.00 H new ATOM 0 HB2 PRO A 402 -11.849 0.361 -12.247 1.00 0.00 H new ATOM 0 HB3 PRO A 402 -11.867 -0.787 -13.570 1.00 0.00 H new ATOM 0 HG2 PRO A 402 -13.126 1.942 -13.415 1.00 0.00 H new ATOM 0 HG3 PRO A 402 -12.264 1.201 -14.748 1.00 0.00 H new ATOM 0 HD2 PRO A 402 -15.000 1.300 -14.649 1.00 0.00 H new ATOM 0 HD3 PRO A 402 -14.141 0.017 -15.479 1.00 0.00 H new ATOM 364 N PHE A 403 -14.450 -0.912 -10.156 1.00 0.00 N ATOM 365 CA PHE A 403 -14.794 -0.456 -8.820 1.00 0.00 C ATOM 366 C PHE A 403 -13.806 -1.032 -7.824 1.00 0.00 C ATOM 367 O PHE A 403 -13.047 -1.939 -8.152 1.00 0.00 O ATOM 368 CB PHE A 403 -16.207 -0.906 -8.436 1.00 0.00 C ATOM 369 CG PHE A 403 -17.303 -0.263 -9.235 1.00 0.00 C ATOM 370 CD1 PHE A 403 -17.559 1.093 -9.124 1.00 0.00 C ATOM 371 CD2 PHE A 403 -18.085 -1.022 -10.088 1.00 0.00 C ATOM 372 CE1 PHE A 403 -18.575 1.681 -9.853 1.00 0.00 C ATOM 373 CE2 PHE A 403 -19.103 -0.441 -10.818 1.00 0.00 C ATOM 374 CZ PHE A 403 -19.348 0.913 -10.701 1.00 0.00 C ATOM 0 H PHE A 403 -14.508 -1.923 -10.281 1.00 0.00 H new ATOM 0 HA PHE A 403 -14.756 0.633 -8.807 1.00 0.00 H new ATOM 0 HB2 PHE A 403 -16.275 -1.987 -8.554 1.00 0.00 H new ATOM 0 HB3 PHE A 403 -16.369 -0.690 -7.380 1.00 0.00 H new ATOM 0 HD1 PHE A 403 -16.958 1.698 -8.461 1.00 0.00 H new ATOM 0 HD2 PHE A 403 -17.897 -2.081 -10.184 1.00 0.00 H new ATOM 0 HE1 PHE A 403 -18.764 2.740 -9.760 1.00 0.00 H new ATOM 0 HE2 PHE A 403 -19.707 -1.045 -11.479 1.00 0.00 H new ATOM 0 HZ PHE A 403 -20.143 1.370 -11.272 1.00 0.00 H new ATOM 384 N SER A 404 -13.794 -0.501 -6.623 1.00 0.00 N ATOM 385 CA SER A 404 -12.915 -1.015 -5.596 1.00 0.00 C ATOM 386 C SER A 404 -13.675 -2.065 -4.797 1.00 0.00 C ATOM 387 O SER A 404 -14.899 -2.139 -4.878 1.00 0.00 O ATOM 388 CB SER A 404 -12.442 0.117 -4.688 1.00 0.00 C ATOM 389 OG SER A 404 -12.379 1.343 -5.398 1.00 0.00 O ATOM 0 H SER A 404 -14.379 0.283 -6.333 1.00 0.00 H new ATOM 0 HA SER A 404 -12.032 -1.466 -6.049 1.00 0.00 H new ATOM 0 HB2 SER A 404 -13.121 0.217 -3.841 1.00 0.00 H new ATOM 0 HB3 SER A 404 -11.459 -0.124 -4.282 1.00 0.00 H new ATOM 0 HG SER A 404 -12.075 2.054 -4.796 1.00 0.00 H new ATOM 395 N TYR A 405 -12.971 -2.879 -4.042 1.00 0.00 N ATOM 396 CA TYR A 405 -13.614 -3.905 -3.245 1.00 0.00 C ATOM 397 C TYR A 405 -14.471 -3.247 -2.178 1.00 0.00 C ATOM 398 O TYR A 405 -15.588 -3.682 -1.917 1.00 0.00 O ATOM 399 CB TYR A 405 -12.585 -4.840 -2.613 1.00 0.00 C ATOM 400 CG TYR A 405 -13.197 -6.070 -1.986 1.00 0.00 C ATOM 401 CD1 TYR A 405 -13.717 -6.036 -0.697 1.00 0.00 C ATOM 402 CD2 TYR A 405 -13.263 -7.266 -2.687 1.00 0.00 C ATOM 403 CE1 TYR A 405 -14.284 -7.158 -0.127 1.00 0.00 C ATOM 404 CE2 TYR A 405 -13.827 -8.391 -2.123 1.00 0.00 C ATOM 405 CZ TYR A 405 -14.338 -8.332 -0.843 1.00 0.00 C ATOM 406 OH TYR A 405 -14.906 -9.451 -0.279 1.00 0.00 O ATOM 0 H TYR A 405 -11.955 -2.852 -3.962 1.00 0.00 H new ATOM 0 HA TYR A 405 -14.247 -4.510 -3.894 1.00 0.00 H new ATOM 0 HB2 TYR A 405 -11.869 -5.148 -3.375 1.00 0.00 H new ATOM 0 HB3 TYR A 405 -12.027 -4.293 -1.853 1.00 0.00 H new ATOM 0 HD1 TYR A 405 -13.677 -5.116 -0.132 1.00 0.00 H new ATOM 0 HD2 TYR A 405 -12.866 -7.316 -3.690 1.00 0.00 H new ATOM 0 HE1 TYR A 405 -14.683 -7.115 0.876 1.00 0.00 H new ATOM 0 HE2 TYR A 405 -13.868 -9.315 -2.681 1.00 0.00 H new ATOM 0 HH TYR A 405 -14.705 -9.472 0.680 1.00 0.00 H new ATOM 416 N SER A 406 -13.948 -2.179 -1.587 1.00 0.00 N ATOM 417 CA SER A 406 -14.669 -1.420 -0.571 1.00 0.00 C ATOM 418 C SER A 406 -15.922 -0.793 -1.180 1.00 0.00 C ATOM 419 O SER A 406 -16.841 -0.388 -0.479 1.00 0.00 O ATOM 420 CB SER A 406 -13.759 -0.334 0.007 1.00 0.00 C ATOM 421 OG SER A 406 -13.037 0.322 -1.024 1.00 0.00 O ATOM 0 H SER A 406 -13.018 -1.816 -1.797 1.00 0.00 H new ATOM 0 HA SER A 406 -14.970 -2.092 0.233 1.00 0.00 H new ATOM 0 HB2 SER A 406 -14.357 0.393 0.557 1.00 0.00 H new ATOM 0 HB3 SER A 406 -13.063 -0.778 0.719 1.00 0.00 H new ATOM 0 HG SER A 406 -12.187 -0.142 -1.175 1.00 0.00 H new ATOM 427 N GLU A 407 -15.937 -0.744 -2.501 1.00 0.00 N ATOM 428 CA GLU A 407 -17.045 -0.197 -3.255 1.00 0.00 C ATOM 429 C GLU A 407 -18.048 -1.291 -3.582 1.00 0.00 C ATOM 430 O GLU A 407 -19.229 -1.194 -3.256 1.00 0.00 O ATOM 431 CB GLU A 407 -16.511 0.438 -4.539 1.00 0.00 C ATOM 432 CG GLU A 407 -16.188 1.914 -4.409 1.00 0.00 C ATOM 433 CD GLU A 407 -17.419 2.774 -4.601 1.00 0.00 C ATOM 434 OE1 GLU A 407 -18.286 2.391 -5.413 1.00 0.00 O ATOM 435 OE2 GLU A 407 -17.542 3.820 -3.933 1.00 0.00 O ATOM 0 H GLU A 407 -15.172 -1.087 -3.083 1.00 0.00 H new ATOM 0 HA GLU A 407 -17.552 0.563 -2.660 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -15.612 -0.094 -4.849 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -17.248 0.306 -5.331 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -15.758 2.108 -3.426 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -15.434 2.188 -5.146 1.00 0.00 H new ATOM 442 N VAL A 408 -17.550 -2.346 -4.202 1.00 0.00 N ATOM 443 CA VAL A 408 -18.373 -3.478 -4.597 1.00 0.00 C ATOM 444 C VAL A 408 -19.013 -4.165 -3.388 1.00 0.00 C ATOM 445 O VAL A 408 -20.149 -4.627 -3.457 1.00 0.00 O ATOM 446 CB VAL A 408 -17.533 -4.511 -5.379 1.00 0.00 C ATOM 447 CG1 VAL A 408 -18.392 -5.663 -5.843 1.00 0.00 C ATOM 448 CG2 VAL A 408 -16.839 -3.869 -6.568 1.00 0.00 C ATOM 0 H VAL A 408 -16.564 -2.443 -4.446 1.00 0.00 H new ATOM 0 HA VAL A 408 -19.167 -3.088 -5.234 1.00 0.00 H new ATOM 0 HB VAL A 408 -16.770 -4.893 -4.701 1.00 0.00 H new ATOM 0 HG11 VAL A 408 -17.778 -6.377 -6.391 1.00 0.00 H new ATOM 0 HG12 VAL A 408 -18.837 -6.156 -4.979 1.00 0.00 H new ATOM 0 HG13 VAL A 408 -19.182 -5.289 -6.494 1.00 0.00 H new ATOM 0 HG21 VAL A 408 -16.255 -4.621 -7.099 1.00 0.00 H new ATOM 0 HG22 VAL A 408 -17.586 -3.448 -7.241 1.00 0.00 H new ATOM 0 HG23 VAL A 408 -16.177 -3.077 -6.219 1.00 0.00 H new ATOM 458 N SER A 409 -18.292 -4.201 -2.275 1.00 0.00 N ATOM 459 CA SER A 409 -18.783 -4.860 -1.065 1.00 0.00 C ATOM 460 C SER A 409 -19.866 -4.045 -0.374 1.00 0.00 C ATOM 461 O SER A 409 -20.809 -4.599 0.189 1.00 0.00 O ATOM 462 CB SER A 409 -17.633 -5.108 -0.085 1.00 0.00 C ATOM 463 OG SER A 409 -16.994 -3.894 0.275 1.00 0.00 O ATOM 0 H SER A 409 -17.366 -3.783 -2.182 1.00 0.00 H new ATOM 0 HA SER A 409 -19.216 -5.812 -1.373 1.00 0.00 H new ATOM 0 HB2 SER A 409 -18.014 -5.600 0.810 1.00 0.00 H new ATOM 0 HB3 SER A 409 -16.907 -5.784 -0.536 1.00 0.00 H new ATOM 0 HG SER A 409 -16.330 -3.660 -0.406 1.00 0.00 H new ATOM 469 N GLN A 410 -19.724 -2.730 -0.418 1.00 0.00 N ATOM 470 CA GLN A 410 -20.676 -1.846 0.234 1.00 0.00 C ATOM 471 C GLN A 410 -21.879 -1.569 -0.656 1.00 0.00 C ATOM 472 O GLN A 410 -22.878 -1.012 -0.203 1.00 0.00 O ATOM 473 CB GLN A 410 -20.003 -0.529 0.625 1.00 0.00 C ATOM 474 CG GLN A 410 -18.922 -0.669 1.691 1.00 0.00 C ATOM 475 CD GLN A 410 -19.270 -1.674 2.773 1.00 0.00 C ATOM 476 OE1 GLN A 410 -19.951 -1.351 3.742 1.00 0.00 O ATOM 477 NE2 GLN A 410 -18.781 -2.897 2.624 1.00 0.00 N ATOM 0 H GLN A 410 -18.961 -2.252 -0.897 1.00 0.00 H new ATOM 0 HA GLN A 410 -21.028 -2.349 1.134 1.00 0.00 H new ATOM 0 HB2 GLN A 410 -19.563 -0.081 -0.266 1.00 0.00 H new ATOM 0 HB3 GLN A 410 -20.765 0.162 0.986 1.00 0.00 H new ATOM 0 HG2 GLN A 410 -17.988 -0.968 1.214 1.00 0.00 H new ATOM 0 HG3 GLN A 410 -18.748 0.304 2.151 1.00 0.00 H new ATOM 0 HE21 GLN A 410 -18.219 -3.125 1.804 1.00 0.00 H new ATOM 0 HE22 GLN A 410 -18.966 -3.610 3.330 1.00 0.00 H new ATOM 486 N ARG A 411 -21.783 -1.952 -1.921 1.00 0.00 N ATOM 487 CA ARG A 411 -22.875 -1.732 -2.855 1.00 0.00 C ATOM 488 C ARG A 411 -23.474 -3.050 -3.334 1.00 0.00 C ATOM 489 O ARG A 411 -22.966 -3.688 -4.268 1.00 0.00 O ATOM 490 CB ARG A 411 -22.406 -0.905 -4.049 1.00 0.00 C ATOM 491 CG ARG A 411 -21.940 0.487 -3.669 1.00 0.00 C ATOM 492 CD ARG A 411 -21.711 1.348 -4.895 1.00 0.00 C ATOM 493 NE ARG A 411 -20.763 2.429 -4.629 1.00 0.00 N ATOM 494 CZ ARG A 411 -21.086 3.593 -4.074 1.00 0.00 C ATOM 495 NH1 ARG A 411 -22.356 3.865 -3.779 1.00 0.00 N ATOM 496 NH2 ARG A 411 -20.133 4.482 -3.816 1.00 0.00 N ATOM 0 H ARG A 411 -20.966 -2.413 -2.321 1.00 0.00 H new ATOM 0 HA ARG A 411 -23.651 -1.179 -2.326 1.00 0.00 H new ATOM 0 HB2 ARG A 411 -21.591 -1.430 -4.548 1.00 0.00 H new ATOM 0 HB3 ARG A 411 -23.221 -0.824 -4.768 1.00 0.00 H new ATOM 0 HG2 ARG A 411 -22.683 0.958 -3.026 1.00 0.00 H new ATOM 0 HG3 ARG A 411 -21.017 0.419 -3.093 1.00 0.00 H new ATOM 0 HD2 ARG A 411 -21.337 0.728 -5.710 1.00 0.00 H new ATOM 0 HD3 ARG A 411 -22.660 1.770 -5.226 1.00 0.00 H new ATOM 0 HE ARG A 411 -19.787 2.280 -4.887 1.00 0.00 H new ATOM 0 HH11 ARG A 411 -23.084 3.179 -3.979 1.00 0.00 H new ATOM 0 HH12 ARG A 411 -22.600 4.759 -3.353 1.00 0.00 H new ATOM 0 HH21 ARG A 411 -19.162 4.269 -4.044 1.00 0.00 H new ATOM 0 HH22 ARG A 411 -20.373 5.377 -3.390 1.00 0.00 H new ATOM 510 N PRO A 412 -24.577 -3.473 -2.699 1.00 0.00 N ATOM 511 CA PRO A 412 -25.271 -4.706 -3.057 1.00 0.00 C ATOM 512 C PRO A 412 -25.777 -4.671 -4.495 1.00 0.00 C ATOM 513 O PRO A 412 -25.956 -5.714 -5.120 1.00 0.00 O ATOM 514 CB PRO A 412 -26.447 -4.770 -2.072 1.00 0.00 C ATOM 515 CG PRO A 412 -26.606 -3.379 -1.563 1.00 0.00 C ATOM 516 CD PRO A 412 -25.231 -2.778 -1.577 1.00 0.00 C ATOM 0 HA PRO A 412 -24.616 -5.575 -2.998 1.00 0.00 H new ATOM 0 HB2 PRO A 412 -27.356 -5.115 -2.565 1.00 0.00 H new ATOM 0 HB3 PRO A 412 -26.242 -5.466 -1.259 1.00 0.00 H new ATOM 0 HG2 PRO A 412 -27.289 -2.808 -2.192 1.00 0.00 H new ATOM 0 HG3 PRO A 412 -27.023 -3.377 -0.556 1.00 0.00 H new ATOM 0 HD2 PRO A 412 -25.263 -1.700 -1.734 1.00 0.00 H new ATOM 0 HD3 PRO A 412 -24.707 -2.948 -0.637 1.00 0.00 H new ATOM 524 N GLU A 413 -25.985 -3.465 -5.023 1.00 0.00 N ATOM 525 CA GLU A 413 -26.459 -3.299 -6.387 1.00 0.00 C ATOM 526 C GLU A 413 -25.341 -3.639 -7.350 1.00 0.00 C ATOM 527 O GLU A 413 -25.580 -4.162 -8.431 1.00 0.00 O ATOM 528 CB GLU A 413 -26.933 -1.869 -6.660 1.00 0.00 C ATOM 529 CG GLU A 413 -27.485 -1.152 -5.445 1.00 0.00 C ATOM 530 CD GLU A 413 -26.421 -0.331 -4.749 1.00 0.00 C ATOM 531 OE1 GLU A 413 -25.641 -0.918 -3.979 1.00 0.00 O ATOM 532 OE2 GLU A 413 -26.348 0.889 -4.994 1.00 0.00 O ATOM 0 H GLU A 413 -25.831 -2.590 -4.522 1.00 0.00 H new ATOM 0 HA GLU A 413 -27.308 -3.968 -6.527 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -26.099 -1.292 -7.060 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -27.702 -1.895 -7.432 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -28.306 -0.502 -5.748 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -27.896 -1.882 -4.747 1.00 0.00 H new ATOM 539 N LEU A 414 -24.111 -3.345 -6.945 1.00 0.00 N ATOM 540 CA LEU A 414 -22.959 -3.633 -7.778 1.00 0.00 C ATOM 541 C LEU A 414 -22.803 -5.132 -7.930 1.00 0.00 C ATOM 542 O LEU A 414 -22.656 -5.633 -9.034 1.00 0.00 O ATOM 543 CB LEU A 414 -21.682 -3.021 -7.200 1.00 0.00 C ATOM 544 CG LEU A 414 -21.555 -1.507 -7.366 1.00 0.00 C ATOM 545 CD1 LEU A 414 -20.131 -1.065 -7.073 1.00 0.00 C ATOM 546 CD2 LEU A 414 -21.971 -1.082 -8.769 1.00 0.00 C ATOM 0 H LEU A 414 -23.891 -2.910 -6.049 1.00 0.00 H new ATOM 0 HA LEU A 414 -23.124 -3.184 -8.757 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -21.632 -3.260 -6.138 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -20.823 -3.496 -7.674 1.00 0.00 H new ATOM 0 HG LEU A 414 -22.223 -1.023 -6.654 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -20.053 0.015 -7.195 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -19.870 -1.335 -6.050 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -19.447 -1.558 -7.764 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -21.873 -0.001 -8.866 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -21.330 -1.571 -9.502 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -23.008 -1.369 -8.944 1.00 0.00 H new ATOM 558 N VAL A 415 -22.889 -5.851 -6.823 1.00 0.00 N ATOM 559 CA VAL A 415 -22.769 -7.307 -6.862 1.00 0.00 C ATOM 560 C VAL A 415 -23.997 -7.899 -7.556 1.00 0.00 C ATOM 561 O VAL A 415 -23.967 -9.012 -8.078 1.00 0.00 O ATOM 562 CB VAL A 415 -22.593 -7.890 -5.437 1.00 0.00 C ATOM 563 CG1 VAL A 415 -22.552 -9.413 -5.447 1.00 0.00 C ATOM 564 CG2 VAL A 415 -21.323 -7.342 -4.805 1.00 0.00 C ATOM 0 H VAL A 415 -23.040 -5.460 -5.893 1.00 0.00 H new ATOM 0 HA VAL A 415 -21.879 -7.576 -7.431 1.00 0.00 H new ATOM 0 HB VAL A 415 -23.458 -7.586 -4.847 1.00 0.00 H new ATOM 0 HG11 VAL A 415 -22.428 -9.780 -4.428 1.00 0.00 H new ATOM 0 HG12 VAL A 415 -23.483 -9.799 -5.861 1.00 0.00 H new ATOM 0 HG13 VAL A 415 -21.716 -9.750 -6.059 1.00 0.00 H new ATOM 0 HG21 VAL A 415 -21.207 -7.757 -3.804 1.00 0.00 H new ATOM 0 HG22 VAL A 415 -20.464 -7.620 -5.415 1.00 0.00 H new ATOM 0 HG23 VAL A 415 -21.387 -6.256 -4.743 1.00 0.00 H new ATOM 574 N ALA A 416 -25.063 -7.111 -7.591 1.00 0.00 N ATOM 575 CA ALA A 416 -26.302 -7.509 -8.241 1.00 0.00 C ATOM 576 C ALA A 416 -26.241 -7.206 -9.735 1.00 0.00 C ATOM 577 O ALA A 416 -27.057 -7.693 -10.515 1.00 0.00 O ATOM 578 CB ALA A 416 -27.471 -6.781 -7.609 1.00 0.00 C ATOM 0 H ALA A 416 -25.093 -6.182 -7.171 1.00 0.00 H new ATOM 0 HA ALA A 416 -26.438 -8.583 -8.111 1.00 0.00 H new ATOM 0 HB1 ALA A 416 -28.396 -7.083 -8.100 1.00 0.00 H new ATOM 0 HB2 ALA A 416 -27.525 -7.030 -6.549 1.00 0.00 H new ATOM 0 HB3 ALA A 416 -27.334 -5.706 -7.723 1.00 0.00 H new ATOM 584 N GLN A 417 -25.270 -6.386 -10.120 1.00 0.00 N ATOM 585 CA GLN A 417 -25.081 -6.017 -11.514 1.00 0.00 C ATOM 586 C GLN A 417 -23.807 -6.654 -12.007 1.00 0.00 C ATOM 587 O GLN A 417 -23.410 -6.484 -13.159 1.00 0.00 O ATOM 588 CB GLN A 417 -24.979 -4.498 -11.686 1.00 0.00 C ATOM 589 CG GLN A 417 -26.253 -3.742 -11.353 1.00 0.00 C ATOM 590 CD GLN A 417 -26.011 -2.260 -11.151 1.00 0.00 C ATOM 591 OE1 GLN A 417 -25.101 -1.676 -11.748 1.00 0.00 O ATOM 592 NE2 GLN A 417 -26.816 -1.640 -10.302 1.00 0.00 N ATOM 0 H GLN A 417 -24.598 -5.963 -9.480 1.00 0.00 H new ATOM 0 HA GLN A 417 -25.942 -6.364 -12.086 1.00 0.00 H new ATOM 0 HB2 GLN A 417 -24.174 -4.126 -11.052 1.00 0.00 H new ATOM 0 HB3 GLN A 417 -24.700 -4.279 -12.717 1.00 0.00 H new ATOM 0 HG2 GLN A 417 -26.976 -3.883 -12.156 1.00 0.00 H new ATOM 0 HG3 GLN A 417 -26.695 -4.161 -10.449 1.00 0.00 H new ATOM 0 HE21 GLN A 417 -27.556 -2.159 -9.829 1.00 0.00 H new ATOM 0 HE22 GLN A 417 -26.696 -0.643 -10.121 1.00 0.00 H new ATOM 601 N MET A 418 -23.153 -7.370 -11.107 1.00 0.00 N ATOM 602 CA MET A 418 -21.923 -8.030 -11.431 1.00 0.00 C ATOM 603 C MET A 418 -22.226 -9.407 -11.968 1.00 0.00 C ATOM 604 O MET A 418 -23.110 -10.115 -11.479 1.00 0.00 O ATOM 605 CB MET A 418 -20.986 -8.069 -10.214 1.00 0.00 C ATOM 606 CG MET A 418 -20.900 -9.405 -9.501 1.00 0.00 C ATOM 607 SD MET A 418 -20.123 -9.259 -7.878 1.00 0.00 S ATOM 608 CE MET A 418 -18.670 -8.294 -8.279 1.00 0.00 C ATOM 0 H MET A 418 -23.465 -7.502 -10.145 1.00 0.00 H new ATOM 0 HA MET A 418 -21.397 -7.472 -12.206 1.00 0.00 H new ATOM 0 HB2 MET A 418 -19.985 -7.784 -10.538 1.00 0.00 H new ATOM 0 HB3 MET A 418 -21.316 -7.315 -9.499 1.00 0.00 H new ATOM 0 HG2 MET A 418 -21.901 -9.820 -9.387 1.00 0.00 H new ATOM 0 HG3 MET A 418 -20.332 -10.106 -10.113 1.00 0.00 H new ATOM 0 HE1 MET A 418 -17.862 -8.551 -7.594 1.00 0.00 H new ATOM 0 HE2 MET A 418 -18.361 -8.510 -9.302 1.00 0.00 H new ATOM 0 HE3 MET A 418 -18.901 -7.233 -8.186 1.00 0.00 H new ATOM 618 N THR A 419 -21.503 -9.754 -12.992 1.00 0.00 N ATOM 619 CA THR A 419 -21.671 -11.033 -13.659 1.00 0.00 C ATOM 620 C THR A 419 -21.195 -12.160 -12.756 1.00 0.00 C ATOM 621 O THR A 419 -20.479 -11.908 -11.786 1.00 0.00 O ATOM 622 CB THR A 419 -20.875 -11.068 -14.977 1.00 0.00 C ATOM 623 OG1 THR A 419 -19.527 -10.650 -14.737 1.00 0.00 O ATOM 624 CG2 THR A 419 -21.514 -10.164 -16.022 1.00 0.00 C ATOM 0 H THR A 419 -20.776 -9.164 -13.397 1.00 0.00 H new ATOM 0 HA THR A 419 -22.730 -11.164 -13.880 1.00 0.00 H new ATOM 0 HB THR A 419 -20.881 -12.090 -15.356 1.00 0.00 H new ATOM 0 HG1 THR A 419 -19.022 -10.675 -15.577 1.00 0.00 H new ATOM 0 HG21 THR A 419 -20.933 -10.206 -16.944 1.00 0.00 H new ATOM 0 HG22 THR A 419 -22.532 -10.499 -16.219 1.00 0.00 H new ATOM 0 HG23 THR A 419 -21.534 -9.139 -15.653 1.00 0.00 H new ATOM 632 N PRO A 420 -21.613 -13.411 -13.020 1.00 0.00 N ATOM 633 CA PRO A 420 -21.162 -14.556 -12.232 1.00 0.00 C ATOM 634 C PRO A 420 -19.641 -14.556 -12.138 1.00 0.00 C ATOM 635 O PRO A 420 -19.068 -14.768 -11.071 1.00 0.00 O ATOM 636 CB PRO A 420 -21.660 -15.761 -13.030 1.00 0.00 C ATOM 637 CG PRO A 420 -22.840 -15.253 -13.786 1.00 0.00 C ATOM 638 CD PRO A 420 -22.558 -13.803 -14.082 1.00 0.00 C ATOM 0 HA PRO A 420 -21.535 -14.551 -11.208 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -20.889 -16.136 -13.704 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -21.936 -16.585 -12.372 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -22.984 -15.817 -14.707 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -23.753 -15.360 -13.200 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -22.124 -13.673 -15.073 1.00 0.00 H new ATOM 0 HD3 PRO A 420 -23.467 -13.203 -14.051 1.00 0.00 H new ATOM 646 N GLU A 421 -19.009 -14.263 -13.269 1.00 0.00 N ATOM 647 CA GLU A 421 -17.563 -14.188 -13.363 1.00 0.00 C ATOM 648 C GLU A 421 -17.024 -13.119 -12.419 1.00 0.00 C ATOM 649 O GLU A 421 -16.096 -13.371 -11.651 1.00 0.00 O ATOM 650 CB GLU A 421 -17.145 -13.864 -14.801 1.00 0.00 C ATOM 651 CG GLU A 421 -17.707 -14.824 -15.839 1.00 0.00 C ATOM 652 CD GLU A 421 -19.012 -14.337 -16.447 1.00 0.00 C ATOM 653 OE1 GLU A 421 -20.006 -14.211 -15.701 1.00 0.00 O ATOM 654 OE2 GLU A 421 -19.040 -14.083 -17.666 1.00 0.00 O ATOM 0 H GLU A 421 -19.491 -14.071 -14.147 1.00 0.00 H new ATOM 0 HA GLU A 421 -17.147 -15.154 -13.077 1.00 0.00 H new ATOM 0 HB2 GLU A 421 -17.469 -12.852 -15.044 1.00 0.00 H new ATOM 0 HB3 GLU A 421 -16.057 -13.874 -14.863 1.00 0.00 H new ATOM 0 HG2 GLU A 421 -16.973 -14.965 -16.632 1.00 0.00 H new ATOM 0 HG3 GLU A 421 -17.868 -15.798 -15.377 1.00 0.00 H new ATOM 661 N GLU A 422 -17.618 -11.927 -12.469 1.00 0.00 N ATOM 662 CA GLU A 422 -17.198 -10.831 -11.619 1.00 0.00 C ATOM 663 C GLU A 422 -17.479 -11.152 -10.154 1.00 0.00 C ATOM 664 O GLU A 422 -16.679 -10.831 -9.281 1.00 0.00 O ATOM 665 CB GLU A 422 -17.889 -9.546 -12.064 1.00 0.00 C ATOM 666 CG GLU A 422 -17.264 -8.959 -13.318 1.00 0.00 C ATOM 667 CD GLU A 422 -18.146 -7.939 -13.994 1.00 0.00 C ATOM 668 OE1 GLU A 422 -19.389 -8.042 -13.867 1.00 0.00 O ATOM 669 OE2 GLU A 422 -17.607 -7.028 -14.658 1.00 0.00 O ATOM 0 H GLU A 422 -18.393 -11.703 -13.093 1.00 0.00 H new ATOM 0 HA GLU A 422 -16.122 -10.687 -11.714 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -18.944 -9.748 -12.247 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -17.840 -8.813 -11.259 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -16.312 -8.494 -13.060 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -17.045 -9.764 -14.019 1.00 0.00 H new ATOM 676 N LYS A 423 -18.622 -11.778 -9.893 1.00 0.00 N ATOM 677 CA LYS A 423 -18.983 -12.187 -8.538 1.00 0.00 C ATOM 678 C LYS A 423 -17.957 -13.162 -7.986 1.00 0.00 C ATOM 679 O LYS A 423 -17.492 -13.006 -6.859 1.00 0.00 O ATOM 680 CB LYS A 423 -20.365 -12.841 -8.528 1.00 0.00 C ATOM 681 CG LYS A 423 -21.072 -12.747 -7.185 1.00 0.00 C ATOM 682 CD LYS A 423 -22.248 -13.708 -7.098 1.00 0.00 C ATOM 683 CE LYS A 423 -21.794 -15.122 -6.765 1.00 0.00 C ATOM 684 NZ LYS A 423 -21.325 -15.859 -7.969 1.00 0.00 N ATOM 0 H LYS A 423 -19.316 -12.014 -10.602 1.00 0.00 H new ATOM 0 HA LYS A 423 -19.004 -11.297 -7.909 1.00 0.00 H new ATOM 0 HB2 LYS A 423 -20.986 -12.370 -9.290 1.00 0.00 H new ATOM 0 HB3 LYS A 423 -20.263 -13.891 -8.803 1.00 0.00 H new ATOM 0 HG2 LYS A 423 -20.364 -12.965 -6.385 1.00 0.00 H new ATOM 0 HG3 LYS A 423 -21.424 -11.727 -7.030 1.00 0.00 H new ATOM 0 HD2 LYS A 423 -22.946 -13.361 -6.337 1.00 0.00 H new ATOM 0 HD3 LYS A 423 -22.786 -13.712 -8.046 1.00 0.00 H new ATOM 0 HE2 LYS A 423 -20.990 -15.080 -6.030 1.00 0.00 H new ATOM 0 HE3 LYS A 423 -22.618 -15.668 -6.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 -21.612 -16.856 -7.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 -21.746 -15.436 -8.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 -20.288 -15.801 -8.030 1.00 0.00 H new ATOM 698 N GLU A 424 -17.593 -14.153 -8.790 1.00 0.00 N ATOM 699 CA GLU A 424 -16.616 -15.148 -8.373 1.00 0.00 C ATOM 700 C GLU A 424 -15.273 -14.474 -8.173 1.00 0.00 C ATOM 701 O GLU A 424 -14.533 -14.794 -7.245 1.00 0.00 O ATOM 702 CB GLU A 424 -16.500 -16.268 -9.410 1.00 0.00 C ATOM 703 CG GLU A 424 -17.308 -17.511 -9.063 1.00 0.00 C ATOM 704 CD GLU A 424 -18.744 -17.202 -8.684 1.00 0.00 C ATOM 705 OE1 GLU A 424 -19.014 -16.961 -7.487 1.00 0.00 O ATOM 706 OE2 GLU A 424 -19.619 -17.193 -9.575 1.00 0.00 O ATOM 0 H GLU A 424 -17.959 -14.288 -9.732 1.00 0.00 H new ATOM 0 HA GLU A 424 -16.944 -15.595 -7.435 1.00 0.00 H new ATOM 0 HB2 GLU A 424 -16.829 -15.890 -10.378 1.00 0.00 H new ATOM 0 HB3 GLU A 424 -15.451 -16.545 -9.516 1.00 0.00 H new ATOM 0 HG2 GLU A 424 -17.302 -18.190 -9.915 1.00 0.00 H new ATOM 0 HG3 GLU A 424 -16.825 -18.032 -8.237 1.00 0.00 H new ATOM 713 N ALA A 425 -14.980 -13.527 -9.052 1.00 0.00 N ATOM 714 CA ALA A 425 -13.751 -12.766 -8.978 1.00 0.00 C ATOM 715 C ALA A 425 -13.725 -11.963 -7.685 1.00 0.00 C ATOM 716 O ALA A 425 -12.745 -11.993 -6.947 1.00 0.00 O ATOM 717 CB ALA A 425 -13.635 -11.851 -10.183 1.00 0.00 C ATOM 0 H ALA A 425 -15.586 -13.269 -9.831 1.00 0.00 H new ATOM 0 HA ALA A 425 -12.900 -13.447 -8.983 1.00 0.00 H new ATOM 0 HB1 ALA A 425 -12.708 -11.282 -10.120 1.00 0.00 H new ATOM 0 HB2 ALA A 425 -13.633 -12.448 -11.095 1.00 0.00 H new ATOM 0 HB3 ALA A 425 -14.481 -11.164 -10.201 1.00 0.00 H new ATOM 723 N TYR A 426 -14.826 -11.268 -7.412 1.00 0.00 N ATOM 724 CA TYR A 426 -14.968 -10.470 -6.207 1.00 0.00 C ATOM 725 C TYR A 426 -14.799 -11.349 -4.975 1.00 0.00 C ATOM 726 O TYR A 426 -14.076 -10.997 -4.043 1.00 0.00 O ATOM 727 CB TYR A 426 -16.344 -9.792 -6.204 1.00 0.00 C ATOM 728 CG TYR A 426 -16.797 -9.292 -4.852 1.00 0.00 C ATOM 729 CD1 TYR A 426 -16.399 -8.049 -4.381 1.00 0.00 C ATOM 730 CD2 TYR A 426 -17.624 -10.065 -4.048 1.00 0.00 C ATOM 731 CE1 TYR A 426 -16.809 -7.592 -3.145 1.00 0.00 C ATOM 732 CE2 TYR A 426 -18.037 -9.617 -2.812 1.00 0.00 C ATOM 733 CZ TYR A 426 -17.630 -8.381 -2.364 1.00 0.00 C ATOM 734 OH TYR A 426 -18.035 -7.940 -1.126 1.00 0.00 O ATOM 0 H TYR A 426 -15.643 -11.245 -8.023 1.00 0.00 H new ATOM 0 HA TYR A 426 -14.195 -9.701 -6.186 1.00 0.00 H new ATOM 0 HB2 TYR A 426 -16.322 -8.952 -6.898 1.00 0.00 H new ATOM 0 HB3 TYR A 426 -17.083 -10.498 -6.582 1.00 0.00 H new ATOM 0 HD1 TYR A 426 -15.758 -7.430 -4.991 1.00 0.00 H new ATOM 0 HD2 TYR A 426 -17.949 -11.034 -4.397 1.00 0.00 H new ATOM 0 HE1 TYR A 426 -16.490 -6.623 -2.791 1.00 0.00 H new ATOM 0 HE2 TYR A 426 -18.677 -10.233 -2.198 1.00 0.00 H new ATOM 0 HH TYR A 426 -18.609 -8.616 -0.710 1.00 0.00 H new ATOM 744 N ILE A 427 -15.465 -12.500 -4.986 1.00 0.00 N ATOM 745 CA ILE A 427 -15.388 -13.437 -3.876 1.00 0.00 C ATOM 746 C ILE A 427 -13.953 -13.934 -3.691 1.00 0.00 C ATOM 747 O ILE A 427 -13.406 -13.882 -2.589 1.00 0.00 O ATOM 748 CB ILE A 427 -16.333 -14.645 -4.079 1.00 0.00 C ATOM 749 CG1 ILE A 427 -17.794 -14.188 -4.037 1.00 0.00 C ATOM 750 CG2 ILE A 427 -16.080 -15.712 -3.019 1.00 0.00 C ATOM 751 CD1 ILE A 427 -18.783 -15.268 -4.422 1.00 0.00 C ATOM 0 H ILE A 427 -16.064 -12.804 -5.754 1.00 0.00 H new ATOM 0 HA ILE A 427 -15.706 -12.903 -2.981 1.00 0.00 H new ATOM 0 HB ILE A 427 -16.130 -15.080 -5.057 1.00 0.00 H new ATOM 0 HG12 ILE A 427 -18.026 -13.837 -3.032 1.00 0.00 H new ATOM 0 HG13 ILE A 427 -17.919 -13.338 -4.708 1.00 0.00 H new ATOM 0 HG21 ILE A 427 -16.755 -16.552 -3.180 1.00 0.00 H new ATOM 0 HG22 ILE A 427 -15.048 -16.057 -3.089 1.00 0.00 H new ATOM 0 HG23 ILE A 427 -16.256 -15.290 -2.029 1.00 0.00 H new ATOM 0 HD11 ILE A 427 -19.796 -14.869 -4.369 1.00 0.00 H new ATOM 0 HD12 ILE A 427 -18.578 -15.603 -5.439 1.00 0.00 H new ATOM 0 HD13 ILE A 427 -18.688 -16.110 -3.736 1.00 0.00 H new ATOM 763 N ALA A 428 -13.346 -14.388 -4.786 1.00 0.00 N ATOM 764 CA ALA A 428 -11.977 -14.894 -4.760 1.00 0.00 C ATOM 765 C ALA A 428 -11.001 -13.817 -4.293 1.00 0.00 C ATOM 766 O ALA A 428 -10.039 -14.104 -3.577 1.00 0.00 O ATOM 767 CB ALA A 428 -11.582 -15.412 -6.135 1.00 0.00 C ATOM 0 H ALA A 428 -13.784 -14.415 -5.707 1.00 0.00 H new ATOM 0 HA ALA A 428 -11.932 -15.718 -4.047 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -10.559 -15.787 -6.103 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -12.255 -16.218 -6.427 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -11.649 -14.602 -6.862 1.00 0.00 H new ATOM 773 N MET A 429 -11.252 -12.580 -4.709 1.00 0.00 N ATOM 774 CA MET A 429 -10.415 -11.457 -4.314 1.00 0.00 C ATOM 775 C MET A 429 -10.566 -11.214 -2.824 1.00 0.00 C ATOM 776 O MET A 429 -9.579 -11.090 -2.102 1.00 0.00 O ATOM 777 CB MET A 429 -10.801 -10.196 -5.097 1.00 0.00 C ATOM 778 CG MET A 429 -10.324 -10.204 -6.538 1.00 0.00 C ATOM 779 SD MET A 429 -11.061 -8.881 -7.514 1.00 0.00 S ATOM 780 CE MET A 429 -10.885 -7.507 -6.383 1.00 0.00 C ATOM 0 H MET A 429 -12.030 -12.331 -5.320 1.00 0.00 H new ATOM 0 HA MET A 429 -9.375 -11.694 -4.539 1.00 0.00 H new ATOM 0 HB2 MET A 429 -11.886 -10.088 -5.083 1.00 0.00 H new ATOM 0 HB3 MET A 429 -10.387 -9.324 -4.591 1.00 0.00 H new ATOM 0 HG2 MET A 429 -9.239 -10.106 -6.559 1.00 0.00 H new ATOM 0 HG3 MET A 429 -10.566 -11.165 -6.992 1.00 0.00 H new ATOM 0 HE1 MET A 429 -10.740 -6.587 -6.949 1.00 0.00 H new ATOM 0 HE2 MET A 429 -11.784 -7.420 -5.773 1.00 0.00 H new ATOM 0 HE3 MET A 429 -10.023 -7.676 -5.737 1.00 0.00 H new ATOM 790 N GLY A 430 -11.814 -11.193 -2.370 1.00 0.00 N ATOM 791 CA GLY A 430 -12.104 -10.969 -0.971 1.00 0.00 C ATOM 792 C GLY A 430 -11.468 -12.006 -0.077 1.00 0.00 C ATOM 793 O GLY A 430 -11.011 -11.686 1.018 1.00 0.00 O ATOM 0 H GLY A 430 -12.637 -11.329 -2.956 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -11.750 -9.979 -0.683 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -13.184 -10.977 -0.821 1.00 0.00 H new ATOM 797 N GLN A 431 -11.407 -13.238 -0.560 1.00 0.00 N ATOM 798 CA GLN A 431 -10.820 -14.340 0.194 1.00 0.00 C ATOM 799 C GLN A 431 -9.334 -14.112 0.477 1.00 0.00 C ATOM 800 O GLN A 431 -8.733 -14.819 1.283 1.00 0.00 O ATOM 801 CB GLN A 431 -11.003 -15.654 -0.564 1.00 0.00 C ATOM 802 CG GLN A 431 -12.408 -16.221 -0.465 1.00 0.00 C ATOM 803 CD GLN A 431 -12.483 -17.662 -0.920 1.00 0.00 C ATOM 804 OE1 GLN A 431 -12.819 -17.950 -2.069 1.00 0.00 O ATOM 805 NE2 GLN A 431 -12.147 -18.576 -0.027 1.00 0.00 N ATOM 0 H GLN A 431 -11.760 -13.503 -1.480 1.00 0.00 H new ATOM 0 HA GLN A 431 -11.339 -14.392 1.151 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -10.757 -15.496 -1.614 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -10.296 -16.388 -0.178 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -12.753 -16.150 0.566 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -13.084 -15.616 -1.070 1.00 0.00 H new ATOM 0 HE21 GLN A 431 -11.875 -18.293 0.914 1.00 0.00 H new ATOM 0 HE22 GLN A 431 -12.160 -19.564 -0.279 1.00 0.00 H new ATOM 814 N ARG A 432 -8.735 -13.133 -0.183 1.00 0.00 N ATOM 815 CA ARG A 432 -7.326 -12.846 0.028 1.00 0.00 C ATOM 816 C ARG A 432 -7.131 -11.866 1.174 1.00 0.00 C ATOM 817 O ARG A 432 -6.163 -11.967 1.917 1.00 0.00 O ATOM 818 CB ARG A 432 -6.682 -12.330 -1.254 1.00 0.00 C ATOM 819 CG ARG A 432 -6.584 -13.405 -2.316 1.00 0.00 C ATOM 820 CD ARG A 432 -5.367 -13.208 -3.214 1.00 0.00 C ATOM 821 NE ARG A 432 -4.111 -13.379 -2.478 1.00 0.00 N ATOM 822 CZ ARG A 432 -2.922 -13.507 -3.060 1.00 0.00 C ATOM 823 NH1 ARG A 432 -2.826 -13.529 -4.386 1.00 0.00 N ATOM 824 NH2 ARG A 432 -1.826 -13.609 -2.320 1.00 0.00 N ATOM 0 H ARG A 432 -9.198 -12.529 -0.863 1.00 0.00 H new ATOM 0 HA ARG A 432 -6.830 -13.777 0.303 1.00 0.00 H new ATOM 0 HB2 ARG A 432 -7.263 -11.492 -1.639 1.00 0.00 H new ATOM 0 HB3 ARG A 432 -5.685 -11.950 -1.031 1.00 0.00 H new ATOM 0 HG2 ARG A 432 -6.528 -14.383 -1.838 1.00 0.00 H new ATOM 0 HG3 ARG A 432 -7.489 -13.398 -2.924 1.00 0.00 H new ATOM 0 HD2 ARG A 432 -5.405 -13.921 -4.038 1.00 0.00 H new ATOM 0 HD3 ARG A 432 -5.398 -12.211 -3.653 1.00 0.00 H new ATOM 0 HE ARG A 432 -4.151 -13.401 -1.459 1.00 0.00 H new ATOM 0 HH11 ARG A 432 -3.666 -13.448 -4.960 1.00 0.00 H new ATOM 0 HH12 ARG A 432 -1.913 -13.627 -4.830 1.00 0.00 H new ATOM 0 HH21 ARG A 432 -1.894 -13.589 -1.302 1.00 0.00 H new ATOM 0 HH22 ARG A 432 -0.915 -13.707 -2.768 1.00 0.00 H new ATOM 838 N MET A 433 -8.049 -10.921 1.320 1.00 0.00 N ATOM 839 CA MET A 433 -7.956 -9.951 2.405 1.00 0.00 C ATOM 840 C MET A 433 -8.693 -10.471 3.627 1.00 0.00 C ATOM 841 O MET A 433 -8.231 -10.327 4.755 1.00 0.00 O ATOM 842 CB MET A 433 -8.542 -8.594 2.001 1.00 0.00 C ATOM 843 CG MET A 433 -7.945 -8.012 0.733 1.00 0.00 C ATOM 844 SD MET A 433 -8.807 -8.571 -0.747 1.00 0.00 S ATOM 845 CE MET A 433 -10.428 -7.868 -0.471 1.00 0.00 C ATOM 0 H MET A 433 -8.858 -10.804 0.710 1.00 0.00 H new ATOM 0 HA MET A 433 -6.900 -9.813 2.635 1.00 0.00 H new ATOM 0 HB2 MET A 433 -9.618 -8.701 1.867 1.00 0.00 H new ATOM 0 HB3 MET A 433 -8.391 -7.888 2.818 1.00 0.00 H new ATOM 0 HG2 MET A 433 -7.982 -6.924 0.783 1.00 0.00 H new ATOM 0 HG3 MET A 433 -6.894 -8.293 0.667 1.00 0.00 H new ATOM 0 HE1 MET A 433 -10.997 -7.890 -1.400 1.00 0.00 H new ATOM 0 HE2 MET A 433 -10.951 -8.448 0.289 1.00 0.00 H new ATOM 0 HE3 MET A 433 -10.325 -6.837 -0.133 1.00 0.00 H new ATOM 855 N PHE A 434 -9.837 -11.100 3.382 1.00 0.00 N ATOM 856 CA PHE A 434 -10.667 -11.640 4.448 1.00 0.00 C ATOM 857 C PHE A 434 -9.973 -12.784 5.172 1.00 0.00 C ATOM 858 O PHE A 434 -10.118 -12.934 6.383 1.00 0.00 O ATOM 859 CB PHE A 434 -12.015 -12.105 3.891 1.00 0.00 C ATOM 860 CG PHE A 434 -13.053 -11.018 3.853 1.00 0.00 C ATOM 861 CD1 PHE A 434 -12.913 -9.936 3.000 1.00 0.00 C ATOM 862 CD2 PHE A 434 -14.167 -11.080 4.675 1.00 0.00 C ATOM 863 CE1 PHE A 434 -13.864 -8.934 2.968 1.00 0.00 C ATOM 864 CE2 PHE A 434 -15.122 -10.083 4.647 1.00 0.00 C ATOM 865 CZ PHE A 434 -14.970 -9.008 3.792 1.00 0.00 C ATOM 0 H PHE A 434 -10.212 -11.248 2.445 1.00 0.00 H new ATOM 0 HA PHE A 434 -10.837 -10.842 5.171 1.00 0.00 H new ATOM 0 HB2 PHE A 434 -11.869 -12.493 2.883 1.00 0.00 H new ATOM 0 HB3 PHE A 434 -12.386 -12.930 4.499 1.00 0.00 H new ATOM 0 HD1 PHE A 434 -12.051 -9.875 2.352 1.00 0.00 H new ATOM 0 HD2 PHE A 434 -14.290 -11.918 5.345 1.00 0.00 H new ATOM 0 HE1 PHE A 434 -13.743 -8.094 2.300 1.00 0.00 H new ATOM 0 HE2 PHE A 434 -15.986 -10.143 5.292 1.00 0.00 H new ATOM 0 HZ PHE A 434 -15.715 -8.227 3.768 1.00 0.00 H new ATOM 875 N GLU A 435 -9.204 -13.583 4.443 1.00 0.00 N ATOM 876 CA GLU A 435 -8.505 -14.700 5.064 1.00 0.00 C ATOM 877 C GLU A 435 -7.066 -14.317 5.393 1.00 0.00 C ATOM 878 O GLU A 435 -6.181 -15.167 5.457 1.00 0.00 O ATOM 879 CB GLU A 435 -8.548 -15.933 4.161 1.00 0.00 C ATOM 880 CG GLU A 435 -9.922 -16.585 4.091 1.00 0.00 C ATOM 881 CD GLU A 435 -10.044 -17.576 2.951 1.00 0.00 C ATOM 882 OE1 GLU A 435 -9.126 -18.408 2.778 1.00 0.00 O ATOM 883 OE2 GLU A 435 -11.041 -17.509 2.208 1.00 0.00 O ATOM 0 H GLU A 435 -9.050 -13.482 3.440 1.00 0.00 H new ATOM 0 HA GLU A 435 -9.012 -14.946 5.997 1.00 0.00 H new ATOM 0 HB2 GLU A 435 -8.238 -15.649 3.156 1.00 0.00 H new ATOM 0 HB3 GLU A 435 -7.825 -16.664 4.523 1.00 0.00 H new ATOM 0 HG2 GLU A 435 -10.126 -17.095 5.033 1.00 0.00 H new ATOM 0 HG3 GLU A 435 -10.681 -15.811 3.977 1.00 0.00 H new ATOM 890 N ASP A 436 -6.849 -13.027 5.609 1.00 0.00 N ATOM 891 CA ASP A 436 -5.528 -12.514 5.945 1.00 0.00 C ATOM 892 C ASP A 436 -5.659 -11.300 6.855 1.00 0.00 C ATOM 893 O ASP A 436 -5.383 -10.165 6.456 1.00 0.00 O ATOM 894 CB ASP A 436 -4.746 -12.146 4.682 1.00 0.00 C ATOM 895 CG ASP A 436 -3.248 -12.057 4.918 1.00 0.00 C ATOM 896 OD1 ASP A 436 -2.829 -11.665 6.026 1.00 0.00 O ATOM 897 OD2 ASP A 436 -2.483 -12.374 3.985 1.00 0.00 O ATOM 0 H ASP A 436 -7.575 -12.313 5.557 1.00 0.00 H new ATOM 0 HA ASP A 436 -4.978 -13.296 6.468 1.00 0.00 H new ATOM 0 HB2 ASP A 436 -4.943 -12.889 3.909 1.00 0.00 H new ATOM 0 HB3 ASP A 436 -5.106 -11.189 4.304 1.00 0.00 H new ATOM 1036 N GLU B 7 7.063 -6.097 -13.017 1.00 0.00 N ATOM 1037 CA GLU B 7 6.190 -5.060 -13.536 1.00 0.00 C ATOM 1038 C GLU B 7 6.276 -3.832 -12.632 1.00 0.00 C ATOM 1039 O GLU B 7 5.495 -3.695 -11.697 1.00 0.00 O ATOM 1040 CB GLU B 7 4.724 -5.541 -13.625 1.00 0.00 C ATOM 1041 CG GLU B 7 4.454 -6.891 -12.962 1.00 0.00 C ATOM 1042 CD GLU B 7 3.011 -7.064 -12.498 1.00 0.00 C ATOM 1043 OE1 GLU B 7 2.098 -6.977 -13.339 1.00 0.00 O ATOM 1044 OE2 GLU B 7 2.791 -7.309 -11.285 1.00 0.00 O ATOM 0 HA GLU B 7 6.519 -4.809 -14.545 1.00 0.00 H new ATOM 0 HB2 GLU B 7 4.081 -4.791 -13.165 1.00 0.00 H new ATOM 0 HB3 GLU B 7 4.440 -5.604 -14.675 1.00 0.00 H new ATOM 0 HG2 GLU B 7 4.699 -7.687 -13.665 1.00 0.00 H new ATOM 0 HG3 GLU B 7 5.119 -7.006 -12.106 1.00 0.00 H new ATOM 1051 N VAL B 8 7.271 -2.973 -12.869 1.00 0.00 N ATOM 1052 CA VAL B 8 7.420 -1.757 -12.074 1.00 0.00 C ATOM 1053 C VAL B 8 6.157 -0.929 -12.186 1.00 0.00 C ATOM 1054 O VAL B 8 5.729 -0.563 -13.279 1.00 0.00 O ATOM 1055 CB VAL B 8 8.639 -0.926 -12.479 1.00 0.00 C ATOM 1056 CG1 VAL B 8 8.611 0.427 -11.780 1.00 0.00 C ATOM 1057 CG2 VAL B 8 9.894 -1.685 -12.111 1.00 0.00 C ATOM 0 H VAL B 8 7.976 -3.096 -13.596 1.00 0.00 H new ATOM 0 HA VAL B 8 7.583 -2.059 -11.039 1.00 0.00 H new ATOM 0 HB VAL B 8 8.623 -0.752 -13.555 1.00 0.00 H new ATOM 0 HG11 VAL B 8 9.484 1.008 -12.077 1.00 0.00 H new ATOM 0 HG12 VAL B 8 7.705 0.963 -12.062 1.00 0.00 H new ATOM 0 HG13 VAL B 8 8.624 0.279 -10.700 1.00 0.00 H new ATOM 0 HG21 VAL B 8 10.769 -1.101 -12.396 1.00 0.00 H new ATOM 0 HG22 VAL B 8 9.910 -1.862 -11.036 1.00 0.00 H new ATOM 0 HG23 VAL B 8 9.909 -2.640 -12.636 1.00 0.00 H new ATOM 1067 N LEU B 9 5.577 -0.648 -11.047 1.00 0.00 N ATOM 1068 CA LEU B 9 4.334 0.077 -10.979 1.00 0.00 C ATOM 1069 C LEU B 9 4.552 1.575 -10.916 1.00 0.00 C ATOM 1070 O LEU B 9 4.044 2.322 -11.749 1.00 0.00 O ATOM 1071 CB LEU B 9 3.562 -0.401 -9.749 1.00 0.00 C ATOM 1072 CG LEU B 9 3.832 -1.861 -9.384 1.00 0.00 C ATOM 1073 CD1 LEU B 9 3.647 -2.108 -7.904 1.00 0.00 C ATOM 1074 CD2 LEU B 9 2.933 -2.774 -10.180 1.00 0.00 C ATOM 0 H LEU B 9 5.955 -0.916 -10.138 1.00 0.00 H new ATOM 0 HA LEU B 9 3.764 -0.119 -11.887 1.00 0.00 H new ATOM 0 HB2 LEU B 9 3.822 0.231 -8.900 1.00 0.00 H new ATOM 0 HB3 LEU B 9 2.495 -0.272 -9.928 1.00 0.00 H new ATOM 0 HG LEU B 9 4.871 -2.077 -9.631 1.00 0.00 H new ATOM 0 HD11 LEU B 9 3.847 -3.156 -7.682 1.00 0.00 H new ATOM 0 HD12 LEU B 9 4.337 -1.480 -7.341 1.00 0.00 H new ATOM 0 HD13 LEU B 9 2.623 -1.866 -7.620 1.00 0.00 H new ATOM 0 HD21 LEU B 9 3.136 -3.810 -9.910 1.00 0.00 H new ATOM 0 HD22 LEU B 9 1.891 -2.540 -9.962 1.00 0.00 H new ATOM 0 HD23 LEU B 9 3.121 -2.633 -11.244 1.00 0.00 H new ATOM 1086 N LEU B 10 5.306 2.015 -9.931 1.00 0.00 N ATOM 1087 CA LEU B 10 5.544 3.432 -9.771 1.00 0.00 C ATOM 1088 C LEU B 10 6.948 3.740 -9.274 1.00 0.00 C ATOM 1089 O LEU B 10 7.418 3.168 -8.291 1.00 0.00 O ATOM 1090 CB LEU B 10 4.523 3.988 -8.798 1.00 0.00 C ATOM 1091 CG LEU B 10 4.250 5.482 -8.906 1.00 0.00 C ATOM 1092 CD1 LEU B 10 3.450 5.791 -10.161 1.00 0.00 C ATOM 1093 CD2 LEU B 10 3.515 5.961 -7.667 1.00 0.00 C ATOM 0 H LEU B 10 5.759 1.420 -9.237 1.00 0.00 H new ATOM 0 HA LEU B 10 5.447 3.901 -10.750 1.00 0.00 H new ATOM 0 HB2 LEU B 10 3.583 3.455 -8.942 1.00 0.00 H new ATOM 0 HB3 LEU B 10 4.860 3.772 -7.784 1.00 0.00 H new ATOM 0 HG LEU B 10 5.201 6.011 -8.976 1.00 0.00 H new ATOM 0 HD11 LEU B 10 3.265 6.864 -10.220 1.00 0.00 H new ATOM 0 HD12 LEU B 10 4.012 5.471 -11.039 1.00 0.00 H new ATOM 0 HD13 LEU B 10 2.499 5.260 -10.126 1.00 0.00 H new ATOM 0 HD21 LEU B 10 3.322 7.031 -7.749 1.00 0.00 H new ATOM 0 HD22 LEU B 10 2.569 5.427 -7.576 1.00 0.00 H new ATOM 0 HD23 LEU B 10 4.126 5.769 -6.785 1.00 0.00 H new ATOM 1105 N ILE B 11 7.610 4.640 -9.981 1.00 0.00 N ATOM 1106 CA ILE B 11 8.941 5.092 -9.623 1.00 0.00 C ATOM 1107 C ILE B 11 8.852 6.510 -9.080 1.00 0.00 C ATOM 1108 O ILE B 11 8.734 7.466 -9.847 1.00 0.00 O ATOM 1109 CB ILE B 11 9.884 5.077 -10.845 1.00 0.00 C ATOM 1110 CG1 ILE B 11 10.119 3.642 -11.314 1.00 0.00 C ATOM 1111 CG2 ILE B 11 11.205 5.765 -10.523 1.00 0.00 C ATOM 1112 CD1 ILE B 11 10.899 3.549 -12.607 1.00 0.00 C ATOM 0 H ILE B 11 7.237 5.079 -10.823 1.00 0.00 H new ATOM 0 HA ILE B 11 9.345 4.416 -8.869 1.00 0.00 H new ATOM 0 HB ILE B 11 9.408 5.632 -11.653 1.00 0.00 H new ATOM 0 HG12 ILE B 11 10.654 3.097 -10.536 1.00 0.00 H new ATOM 0 HG13 ILE B 11 9.156 3.148 -11.444 1.00 0.00 H new ATOM 0 HG21 ILE B 11 11.851 5.741 -11.400 1.00 0.00 H new ATOM 0 HG22 ILE B 11 11.016 6.801 -10.240 1.00 0.00 H new ATOM 0 HG23 ILE B 11 11.694 5.247 -9.698 1.00 0.00 H new ATOM 0 HD11 ILE B 11 11.028 2.502 -12.879 1.00 0.00 H new ATOM 0 HD12 ILE B 11 10.355 4.065 -13.398 1.00 0.00 H new ATOM 0 HD13 ILE B 11 11.877 4.013 -12.476 1.00 0.00 H new ATOM 1124 N VAL B 12 8.884 6.655 -7.766 1.00 0.00 N ATOM 1125 CA VAL B 12 8.795 7.967 -7.175 1.00 0.00 C ATOM 1126 C VAL B 12 10.166 8.444 -6.747 1.00 0.00 C ATOM 1127 O VAL B 12 10.988 7.653 -6.291 1.00 0.00 O ATOM 1128 CB VAL B 12 7.851 7.967 -5.961 1.00 0.00 C ATOM 1129 CG1 VAL B 12 7.441 9.383 -5.608 1.00 0.00 C ATOM 1130 CG2 VAL B 12 6.629 7.106 -6.232 1.00 0.00 C ATOM 0 H VAL B 12 8.970 5.887 -7.100 1.00 0.00 H new ATOM 0 HA VAL B 12 8.392 8.644 -7.929 1.00 0.00 H new ATOM 0 HB VAL B 12 8.384 7.542 -5.111 1.00 0.00 H new ATOM 0 HG11 VAL B 12 6.773 9.364 -4.747 1.00 0.00 H new ATOM 0 HG12 VAL B 12 8.328 9.969 -5.367 1.00 0.00 H new ATOM 0 HG13 VAL B 12 6.927 9.835 -6.456 1.00 0.00 H new ATOM 0 HG21 VAL B 12 5.974 7.119 -5.361 1.00 0.00 H new ATOM 0 HG22 VAL B 12 6.092 7.498 -7.096 1.00 0.00 H new ATOM 0 HG23 VAL B 12 6.943 6.082 -6.434 1.00 0.00 H new ATOM 1140 N LYS B 13 10.420 9.726 -6.922 1.00 0.00 N ATOM 1141 CA LYS B 13 11.689 10.316 -6.536 1.00 0.00 C ATOM 1142 C LYS B 13 11.457 11.361 -5.460 1.00 0.00 C ATOM 1143 O LYS B 13 10.315 11.709 -5.175 1.00 0.00 O ATOM 1144 CB LYS B 13 12.417 10.921 -7.732 1.00 0.00 C ATOM 1145 CG LYS B 13 12.707 9.922 -8.836 1.00 0.00 C ATOM 1146 CD LYS B 13 13.479 8.710 -8.331 1.00 0.00 C ATOM 1147 CE LYS B 13 14.116 7.933 -9.474 1.00 0.00 C ATOM 1148 NZ LYS B 13 14.963 6.808 -8.986 1.00 0.00 N ATOM 0 H LYS B 13 9.759 10.385 -7.333 1.00 0.00 H new ATOM 0 HA LYS B 13 12.328 9.527 -6.139 1.00 0.00 H new ATOM 0 HB2 LYS B 13 11.816 11.735 -8.139 1.00 0.00 H new ATOM 0 HB3 LYS B 13 13.356 11.357 -7.392 1.00 0.00 H new ATOM 0 HG2 LYS B 13 11.768 9.592 -9.281 1.00 0.00 H new ATOM 0 HG3 LYS B 13 13.279 10.411 -9.625 1.00 0.00 H new ATOM 0 HD2 LYS B 13 14.253 9.035 -7.636 1.00 0.00 H new ATOM 0 HD3 LYS B 13 12.807 8.056 -7.776 1.00 0.00 H new ATOM 0 HE2 LYS B 13 13.334 7.541 -10.125 1.00 0.00 H new ATOM 0 HE3 LYS B 13 14.724 8.608 -10.076 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 15.938 6.935 -9.326 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 14.958 6.795 -7.946 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 14.585 5.908 -9.345 1.00 0.00 H new ATOM 1162 N LYS B 14 12.544 11.843 -4.860 1.00 0.00 N ATOM 1163 CA LYS B 14 12.469 12.816 -3.774 1.00 0.00 C ATOM 1164 C LYS B 14 11.772 12.209 -2.564 1.00 0.00 C ATOM 1165 O LYS B 14 11.324 12.919 -1.660 1.00 0.00 O ATOM 1166 CB LYS B 14 11.752 14.075 -4.242 1.00 0.00 C ATOM 1167 CG LYS B 14 12.671 15.150 -4.799 1.00 0.00 C ATOM 1168 CD LYS B 14 13.300 15.970 -3.682 1.00 0.00 C ATOM 1169 CE LYS B 14 14.645 16.560 -4.095 1.00 0.00 C ATOM 1170 NZ LYS B 14 15.725 15.534 -4.147 1.00 0.00 N ATOM 0 H LYS B 14 13.495 11.572 -5.111 1.00 0.00 H new ATOM 0 HA LYS B 14 13.481 13.091 -3.478 1.00 0.00 H new ATOM 0 HB2 LYS B 14 11.026 13.802 -5.008 1.00 0.00 H new ATOM 0 HB3 LYS B 14 11.191 14.491 -3.405 1.00 0.00 H new ATOM 0 HG2 LYS B 14 13.454 14.687 -5.399 1.00 0.00 H new ATOM 0 HG3 LYS B 14 12.107 15.806 -5.462 1.00 0.00 H new ATOM 0 HD2 LYS B 14 12.623 16.775 -3.398 1.00 0.00 H new ATOM 0 HD3 LYS B 14 13.435 15.341 -2.802 1.00 0.00 H new ATOM 0 HE2 LYS B 14 14.547 17.030 -5.074 1.00 0.00 H new ATOM 0 HE3 LYS B 14 14.926 17.344 -3.392 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 16.634 15.997 -4.349 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 15.782 15.043 -3.232 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 15.513 14.845 -4.897 1.00 0.00 H new ATOM 1184 N VAL B 15 11.704 10.886 -2.556 1.00 0.00 N ATOM 1185 CA VAL B 15 11.077 10.149 -1.471 1.00 0.00 C ATOM 1186 C VAL B 15 12.033 10.089 -0.284 1.00 0.00 C ATOM 1187 O VAL B 15 12.965 9.292 -0.271 1.00 0.00 O ATOM 1188 CB VAL B 15 10.690 8.725 -1.934 1.00 0.00 C ATOM 1189 CG1 VAL B 15 9.765 8.049 -0.943 1.00 0.00 C ATOM 1190 CG2 VAL B 15 10.024 8.787 -3.293 1.00 0.00 C ATOM 0 H VAL B 15 12.080 10.296 -3.298 1.00 0.00 H new ATOM 0 HA VAL B 15 10.164 10.661 -1.169 1.00 0.00 H new ATOM 0 HB VAL B 15 11.605 8.136 -1.998 1.00 0.00 H new ATOM 0 HG11 VAL B 15 9.514 7.051 -1.302 1.00 0.00 H new ATOM 0 HG12 VAL B 15 10.261 7.973 0.025 1.00 0.00 H new ATOM 0 HG13 VAL B 15 8.853 8.636 -0.838 1.00 0.00 H new ATOM 0 HG21 VAL B 15 9.754 7.780 -3.612 1.00 0.00 H new ATOM 0 HG22 VAL B 15 9.125 9.401 -3.230 1.00 0.00 H new ATOM 0 HG23 VAL B 15 10.712 9.225 -4.016 1.00 0.00 H new ATOM 1200 N ARG B 16 11.800 10.941 0.705 1.00 0.00 N ATOM 1201 CA ARG B 16 12.666 11.027 1.870 1.00 0.00 C ATOM 1202 C ARG B 16 12.272 10.058 2.972 1.00 0.00 C ATOM 1203 O ARG B 16 11.316 10.294 3.702 1.00 0.00 O ATOM 1204 CB ARG B 16 12.664 12.445 2.459 1.00 0.00 C ATOM 1205 CG ARG B 16 12.680 13.560 1.432 1.00 0.00 C ATOM 1206 CD ARG B 16 13.188 14.862 2.037 1.00 0.00 C ATOM 1207 NE ARG B 16 14.633 15.017 1.868 1.00 0.00 N ATOM 1208 CZ ARG B 16 15.359 15.991 2.413 1.00 0.00 C ATOM 1209 NH1 ARG B 16 14.789 16.887 3.213 1.00 0.00 N ATOM 1210 NH2 ARG B 16 16.656 16.065 2.146 1.00 0.00 N ATOM 0 H ARG B 16 11.011 11.587 0.722 1.00 0.00 H new ATOM 0 HA ARG B 16 13.661 10.764 1.512 1.00 0.00 H new ATOM 0 HB2 ARG B 16 11.781 12.561 3.087 1.00 0.00 H new ATOM 0 HB3 ARG B 16 13.533 12.555 3.108 1.00 0.00 H new ATOM 0 HG2 ARG B 16 13.314 13.275 0.592 1.00 0.00 H new ATOM 0 HG3 ARG B 16 11.675 13.708 1.037 1.00 0.00 H new ATOM 0 HD2 ARG B 16 12.676 15.703 1.570 1.00 0.00 H new ATOM 0 HD3 ARG B 16 12.942 14.889 3.099 1.00 0.00 H new ATOM 0 HE ARG B 16 15.119 14.330 1.292 1.00 0.00 H new ATOM 0 HH11 ARG B 16 13.790 16.831 3.412 1.00 0.00 H new ATOM 0 HH12 ARG B 16 15.350 17.631 3.628 1.00 0.00 H new ATOM 0 HH21 ARG B 16 17.089 15.379 1.528 1.00 0.00 H new ATOM 0 HH22 ARG B 16 17.220 16.808 2.559 1.00 0.00 H new ATOM 1224 N GLN B 17 13.004 8.972 3.095 1.00 0.00 N ATOM 1225 CA GLN B 17 12.759 8.032 4.171 1.00 0.00 C ATOM 1226 C GLN B 17 13.749 8.378 5.262 1.00 0.00 C ATOM 1227 O GLN B 17 14.957 8.328 5.031 1.00 0.00 O ATOM 1228 CB GLN B 17 12.925 6.582 3.718 1.00 0.00 C ATOM 1229 CG GLN B 17 12.491 5.569 4.764 1.00 0.00 C ATOM 1230 CD GLN B 17 13.646 5.054 5.598 1.00 0.00 C ATOM 1231 OE1 GLN B 17 14.762 4.892 5.106 1.00 0.00 O ATOM 1232 NE2 GLN B 17 13.394 4.819 6.872 1.00 0.00 N ATOM 0 H GLN B 17 13.768 8.718 2.469 1.00 0.00 H new ATOM 0 HA GLN B 17 11.730 8.111 4.522 1.00 0.00 H new ATOM 0 HB2 GLN B 17 12.345 6.425 2.808 1.00 0.00 H new ATOM 0 HB3 GLN B 17 13.970 6.406 3.464 1.00 0.00 H new ATOM 0 HG2 GLN B 17 11.750 6.026 5.420 1.00 0.00 H new ATOM 0 HG3 GLN B 17 12.003 4.729 4.269 1.00 0.00 H new ATOM 0 HE21 GLN B 17 12.455 4.966 7.242 1.00 0.00 H new ATOM 0 HE22 GLN B 17 14.139 4.491 7.487 1.00 0.00 H new ATOM 1241 N LYS B 18 13.245 8.778 6.423 1.00 0.00 N ATOM 1242 CA LYS B 18 14.104 9.195 7.527 1.00 0.00 C ATOM 1243 C LYS B 18 14.853 10.467 7.128 1.00 0.00 C ATOM 1244 O LYS B 18 15.969 10.709 7.580 1.00 0.00 O ATOM 1245 CB LYS B 18 15.096 8.090 7.916 1.00 0.00 C ATOM 1246 CG LYS B 18 14.527 7.058 8.878 1.00 0.00 C ATOM 1247 CD LYS B 18 14.094 7.690 10.193 1.00 0.00 C ATOM 1248 CE LYS B 18 15.219 8.492 10.823 1.00 0.00 C ATOM 1249 NZ LYS B 18 16.387 7.641 11.169 1.00 0.00 N ATOM 0 H LYS B 18 12.246 8.823 6.626 1.00 0.00 H new ATOM 0 HA LYS B 18 13.480 9.393 8.398 1.00 0.00 H new ATOM 0 HB2 LYS B 18 15.432 7.582 7.012 1.00 0.00 H new ATOM 0 HB3 LYS B 18 15.975 8.548 8.369 1.00 0.00 H new ATOM 0 HG2 LYS B 18 13.674 6.561 8.415 1.00 0.00 H new ATOM 0 HG3 LYS B 18 15.276 6.291 9.073 1.00 0.00 H new ATOM 0 HD2 LYS B 18 13.236 8.339 10.020 1.00 0.00 H new ATOM 0 HD3 LYS B 18 13.771 6.911 10.883 1.00 0.00 H new ATOM 0 HE2 LYS B 18 15.534 9.276 10.135 1.00 0.00 H new ATOM 0 HE3 LYS B 18 14.852 8.986 11.723 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 17.110 8.220 11.642 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 16.083 6.877 11.806 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 16.786 7.230 10.301 1.00 0.00 H new ATOM 1263 N LYS B 19 14.202 11.259 6.260 1.00 0.00 N ATOM 1264 CA LYS B 19 14.729 12.532 5.741 1.00 0.00 C ATOM 1265 C LYS B 19 15.707 12.334 4.580 1.00 0.00 C ATOM 1266 O LYS B 19 16.246 13.306 4.052 1.00 0.00 O ATOM 1267 CB LYS B 19 15.377 13.379 6.841 1.00 0.00 C ATOM 1268 CG LYS B 19 14.373 13.997 7.802 1.00 0.00 C ATOM 1269 CD LYS B 19 15.060 14.681 8.973 1.00 0.00 C ATOM 1270 CE LYS B 19 16.055 13.757 9.658 1.00 0.00 C ATOM 1271 NZ LYS B 19 15.422 12.502 10.139 1.00 0.00 N ATOM 0 H LYS B 19 13.279 11.028 5.893 1.00 0.00 H new ATOM 0 HA LYS B 19 13.864 13.074 5.358 1.00 0.00 H new ATOM 0 HB2 LYS B 19 16.072 12.757 7.405 1.00 0.00 H new ATOM 0 HB3 LYS B 19 15.962 14.174 6.379 1.00 0.00 H new ATOM 0 HG2 LYS B 19 13.757 14.721 7.268 1.00 0.00 H new ATOM 0 HG3 LYS B 19 13.703 13.223 8.175 1.00 0.00 H new ATOM 0 HD2 LYS B 19 15.576 15.575 8.621 1.00 0.00 H new ATOM 0 HD3 LYS B 19 14.311 15.008 9.694 1.00 0.00 H new ATOM 0 HE2 LYS B 19 16.858 13.513 8.963 1.00 0.00 H new ATOM 0 HE3 LYS B 19 16.510 14.278 10.501 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 15.894 12.187 11.011 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 14.415 12.673 10.333 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 15.514 11.765 9.411 1.00 0.00 H new ATOM 1285 N GLN B 20 15.924 11.092 4.168 1.00 0.00 N ATOM 1286 CA GLN B 20 16.823 10.817 3.049 1.00 0.00 C ATOM 1287 C GLN B 20 16.014 10.818 1.764 1.00 0.00 C ATOM 1288 O GLN B 20 15.293 9.861 1.496 1.00 0.00 O ATOM 1289 CB GLN B 20 17.510 9.454 3.198 1.00 0.00 C ATOM 1290 CG GLN B 20 17.974 9.133 4.605 1.00 0.00 C ATOM 1291 CD GLN B 20 18.388 7.683 4.755 1.00 0.00 C ATOM 1292 OE1 GLN B 20 19.557 7.337 4.600 1.00 0.00 O ATOM 1293 NE2 GLN B 20 17.424 6.821 5.044 1.00 0.00 N ATOM 0 H GLN B 20 15.496 10.265 4.585 1.00 0.00 H new ATOM 0 HA GLN B 20 17.594 11.588 3.031 1.00 0.00 H new ATOM 0 HB2 GLN B 20 16.820 8.676 2.870 1.00 0.00 H new ATOM 0 HB3 GLN B 20 18.370 9.420 2.529 1.00 0.00 H new ATOM 0 HG2 GLN B 20 18.814 9.777 4.865 1.00 0.00 H new ATOM 0 HG3 GLN B 20 17.172 9.355 5.309 1.00 0.00 H new ATOM 0 HE21 GLN B 20 16.466 7.149 5.165 1.00 0.00 H new ATOM 0 HE22 GLN B 20 17.640 5.829 5.146 1.00 0.00 H new ATOM 1302 N ASP B 21 16.105 11.880 0.977 1.00 0.00 N ATOM 1303 CA ASP B 21 15.333 11.943 -0.255 1.00 0.00 C ATOM 1304 C ASP B 21 15.935 11.072 -1.332 1.00 0.00 C ATOM 1305 O ASP B 21 16.975 11.377 -1.909 1.00 0.00 O ATOM 1306 CB ASP B 21 15.151 13.368 -0.777 1.00 0.00 C ATOM 1307 CG ASP B 21 16.432 14.169 -0.858 1.00 0.00 C ATOM 1308 OD1 ASP B 21 17.098 14.334 0.186 1.00 0.00 O ATOM 1309 OD2 ASP B 21 16.743 14.669 -1.959 1.00 0.00 O ATOM 0 H ASP B 21 16.692 12.693 1.163 1.00 0.00 H new ATOM 0 HA ASP B 21 14.344 11.562 -0.001 1.00 0.00 H new ATOM 0 HB2 ASP B 21 14.700 13.325 -1.768 1.00 0.00 H new ATOM 0 HB3 ASP B 21 14.448 13.893 -0.130 1.00 0.00 H new ATOM 1314 N GLY B 22 15.266 9.974 -1.577 1.00 0.00 N ATOM 1315 CA GLY B 22 15.699 9.055 -2.580 1.00 0.00 C ATOM 1316 C GLY B 22 14.601 8.714 -3.549 1.00 0.00 C ATOM 1317 O GLY B 22 14.104 9.579 -4.275 1.00 0.00 O ATOM 0 H GLY B 22 14.414 9.700 -1.088 1.00 0.00 H new ATOM 0 HA2 GLY B 22 16.541 9.483 -3.124 1.00 0.00 H new ATOM 0 HA3 GLY B 22 16.058 8.142 -2.104 1.00 0.00 H new ATOM 1321 N ALA B 23 14.189 7.464 -3.531 1.00 0.00 N ATOM 1322 CA ALA B 23 13.179 6.990 -4.438 1.00 0.00 C ATOM 1323 C ALA B 23 12.369 5.862 -3.846 1.00 0.00 C ATOM 1324 O ALA B 23 12.905 4.991 -3.168 1.00 0.00 O ATOM 1325 CB ALA B 23 13.846 6.509 -5.701 1.00 0.00 C ATOM 0 H ALA B 23 14.546 6.756 -2.889 1.00 0.00 H new ATOM 0 HA ALA B 23 12.498 7.815 -4.645 1.00 0.00 H new ATOM 0 HB1 ALA B 23 13.089 6.147 -6.397 1.00 0.00 H new ATOM 0 HB2 ALA B 23 14.395 7.332 -6.158 1.00 0.00 H new ATOM 0 HB3 ALA B 23 14.536 5.700 -5.462 1.00 0.00 H new ATOM 1331 N LEU B 24 11.083 5.876 -4.126 1.00 0.00 N ATOM 1332 CA LEU B 24 10.194 4.840 -3.660 1.00 0.00 C ATOM 1333 C LEU B 24 9.731 4.070 -4.888 1.00 0.00 C ATOM 1334 O LEU B 24 8.932 4.566 -5.684 1.00 0.00 O ATOM 1335 CB LEU B 24 9.009 5.438 -2.910 1.00 0.00 C ATOM 1336 CG LEU B 24 8.453 4.574 -1.777 1.00 0.00 C ATOM 1337 CD1 LEU B 24 7.003 4.925 -1.499 1.00 0.00 C ATOM 1338 CD2 LEU B 24 8.600 3.094 -2.080 1.00 0.00 C ATOM 0 H LEU B 24 10.629 6.602 -4.680 1.00 0.00 H new ATOM 0 HA LEU B 24 10.704 4.178 -2.961 1.00 0.00 H new ATOM 0 HB2 LEU B 24 9.309 6.401 -2.497 1.00 0.00 H new ATOM 0 HB3 LEU B 24 8.208 5.633 -3.624 1.00 0.00 H new ATOM 0 HG LEU B 24 9.038 4.785 -0.882 1.00 0.00 H new ATOM 0 HD11 LEU B 24 6.626 4.299 -0.690 1.00 0.00 H new ATOM 0 HD12 LEU B 24 6.931 5.974 -1.210 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.409 4.754 -2.397 1.00 0.00 H new ATOM 0 HD21 LEU B 24 8.194 2.511 -1.253 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.057 2.854 -2.994 1.00 0.00 H new ATOM 0 HD23 LEU B 24 9.655 2.852 -2.211 1.00 0.00 H new ATOM 1350 N TYR B 25 10.267 2.881 -5.055 1.00 0.00 N ATOM 1351 CA TYR B 25 9.957 2.053 -6.208 1.00 0.00 C ATOM 1352 C TYR B 25 8.929 0.974 -5.908 1.00 0.00 C ATOM 1353 O TYR B 25 9.221 0.015 -5.194 1.00 0.00 O ATOM 1354 CB TYR B 25 11.220 1.356 -6.699 1.00 0.00 C ATOM 1355 CG TYR B 25 12.041 2.150 -7.672 1.00 0.00 C ATOM 1356 CD1 TYR B 25 12.517 3.405 -7.342 1.00 0.00 C ATOM 1357 CD2 TYR B 25 12.354 1.631 -8.917 1.00 0.00 C ATOM 1358 CE1 TYR B 25 13.280 4.127 -8.226 1.00 0.00 C ATOM 1359 CE2 TYR B 25 13.117 2.344 -9.812 1.00 0.00 C ATOM 1360 CZ TYR B 25 13.582 3.597 -9.463 1.00 0.00 C ATOM 1361 OH TYR B 25 14.348 4.327 -10.349 1.00 0.00 O ATOM 0 H TYR B 25 10.927 2.459 -4.401 1.00 0.00 H new ATOM 0 HA TYR B 25 9.545 2.725 -6.961 1.00 0.00 H new ATOM 0 HB2 TYR B 25 11.841 1.111 -5.837 1.00 0.00 H new ATOM 0 HB3 TYR B 25 10.938 0.413 -7.168 1.00 0.00 H new ATOM 0 HD1 TYR B 25 12.285 3.824 -6.374 1.00 0.00 H new ATOM 0 HD2 TYR B 25 11.993 0.650 -9.190 1.00 0.00 H new ATOM 0 HE1 TYR B 25 13.643 5.107 -7.954 1.00 0.00 H new ATOM 0 HE2 TYR B 25 13.351 1.927 -10.781 1.00 0.00 H new ATOM 0 HH TYR B 25 14.472 3.814 -11.175 1.00 0.00 H new ATOM 1371 N LEU B 26 7.732 1.115 -6.445 1.00 0.00 N ATOM 1372 CA LEU B 26 6.734 0.077 -6.274 1.00 0.00 C ATOM 1373 C LEU B 26 6.938 -0.910 -7.391 1.00 0.00 C ATOM 1374 O LEU B 26 6.605 -0.618 -8.539 1.00 0.00 O ATOM 1375 CB LEU B 26 5.295 0.592 -6.360 1.00 0.00 C ATOM 1376 CG LEU B 26 5.024 1.940 -5.728 1.00 0.00 C ATOM 1377 CD1 LEU B 26 3.638 2.423 -6.110 1.00 0.00 C ATOM 1378 CD2 LEU B 26 5.133 1.862 -4.223 1.00 0.00 C ATOM 0 H LEU B 26 7.431 1.921 -6.993 1.00 0.00 H new ATOM 0 HA LEU B 26 6.860 -0.353 -5.280 1.00 0.00 H new ATOM 0 HB2 LEU B 26 5.013 0.645 -7.412 1.00 0.00 H new ATOM 0 HB3 LEU B 26 4.641 -0.143 -5.891 1.00 0.00 H new ATOM 0 HG LEU B 26 5.771 2.643 -6.096 1.00 0.00 H new ATOM 0 HD11 LEU B 26 3.452 3.394 -5.651 1.00 0.00 H new ATOM 0 HD12 LEU B 26 3.571 2.516 -7.194 1.00 0.00 H new ATOM 0 HD13 LEU B 26 2.894 1.707 -5.760 1.00 0.00 H new ATOM 0 HD21 LEU B 26 4.934 2.843 -3.792 1.00 0.00 H new ATOM 0 HD22 LEU B 26 4.406 1.144 -3.842 1.00 0.00 H new ATOM 0 HD23 LEU B 26 6.138 1.542 -3.947 1.00 0.00 H new ATOM 1390 N MET B 27 7.528 -2.044 -7.101 1.00 0.00 N ATOM 1391 CA MET B 27 7.738 -3.020 -8.138 1.00 0.00 C ATOM 1392 C MET B 27 6.686 -4.088 -8.077 1.00 0.00 C ATOM 1393 O MET B 27 5.980 -4.213 -7.078 1.00 0.00 O ATOM 1394 CB MET B 27 9.138 -3.625 -8.089 1.00 0.00 C ATOM 1395 CG MET B 27 10.152 -2.873 -8.927 1.00 0.00 C ATOM 1396 SD MET B 27 11.797 -2.887 -8.204 1.00 0.00 S ATOM 1397 CE MET B 27 11.484 -1.929 -6.730 1.00 0.00 C ATOM 0 H MET B 27 7.865 -2.309 -6.175 1.00 0.00 H new ATOM 0 HA MET B 27 7.653 -2.502 -9.093 1.00 0.00 H new ATOM 0 HB2 MET B 27 9.479 -3.648 -7.054 1.00 0.00 H new ATOM 0 HB3 MET B 27 9.091 -4.659 -8.432 1.00 0.00 H new ATOM 0 HG2 MET B 27 10.194 -3.315 -9.923 1.00 0.00 H new ATOM 0 HG3 MET B 27 9.822 -1.841 -9.050 1.00 0.00 H new ATOM 0 HE1 MET B 27 12.307 -1.233 -6.567 1.00 0.00 H new ATOM 0 HE2 MET B 27 10.555 -1.371 -6.849 1.00 0.00 H new ATOM 0 HE3 MET B 27 11.398 -2.597 -5.873 1.00 0.00 H new ATOM 1407 N ALA B 28 6.683 -4.907 -9.109 1.00 0.00 N ATOM 1408 CA ALA B 28 5.691 -5.943 -9.309 1.00 0.00 C ATOM 1409 C ALA B 28 5.238 -6.636 -8.038 1.00 0.00 C ATOM 1410 O ALA B 28 4.049 -6.661 -7.726 1.00 0.00 O ATOM 1411 CB ALA B 28 6.242 -6.987 -10.241 1.00 0.00 C ATOM 0 H ALA B 28 7.385 -4.870 -9.848 1.00 0.00 H new ATOM 0 HA ALA B 28 4.818 -5.438 -9.722 1.00 0.00 H new ATOM 0 HB1 ALA B 28 5.497 -7.768 -10.393 1.00 0.00 H new ATOM 0 HB2 ALA B 28 6.487 -6.527 -11.199 1.00 0.00 H new ATOM 0 HB3 ALA B 28 7.142 -7.423 -9.807 1.00 0.00 H new ATOM 1417 N GLU B 29 6.185 -7.178 -7.296 1.00 0.00 N ATOM 1418 CA GLU B 29 5.856 -7.908 -6.086 1.00 0.00 C ATOM 1419 C GLU B 29 6.506 -7.303 -4.855 1.00 0.00 C ATOM 1420 O GLU B 29 6.161 -7.667 -3.734 1.00 0.00 O ATOM 1421 CB GLU B 29 6.314 -9.365 -6.233 1.00 0.00 C ATOM 1422 CG GLU B 29 6.237 -9.883 -7.663 1.00 0.00 C ATOM 1423 CD GLU B 29 6.764 -11.294 -7.818 1.00 0.00 C ATOM 1424 OE1 GLU B 29 7.995 -11.467 -7.966 1.00 0.00 O ATOM 1425 OE2 GLU B 29 5.954 -12.238 -7.836 1.00 0.00 O ATOM 0 H GLU B 29 7.182 -7.128 -7.507 1.00 0.00 H new ATOM 0 HA GLU B 29 4.776 -7.854 -5.951 1.00 0.00 H new ATOM 0 HB2 GLU B 29 7.341 -9.453 -5.878 1.00 0.00 H new ATOM 0 HB3 GLU B 29 5.700 -9.997 -5.592 1.00 0.00 H new ATOM 0 HG2 GLU B 29 5.200 -9.851 -7.998 1.00 0.00 H new ATOM 0 HG3 GLU B 29 6.804 -9.217 -8.314 1.00 0.00 H new ATOM 1432 N ARG B 30 7.382 -6.330 -5.045 1.00 0.00 N ATOM 1433 CA ARG B 30 8.116 -5.769 -3.916 1.00 0.00 C ATOM 1434 C ARG B 30 8.230 -4.250 -4.000 1.00 0.00 C ATOM 1435 O ARG B 30 8.536 -3.693 -5.051 1.00 0.00 O ATOM 1436 CB ARG B 30 9.519 -6.386 -3.858 1.00 0.00 C ATOM 1437 CG ARG B 30 10.374 -6.113 -5.087 1.00 0.00 C ATOM 1438 CD ARG B 30 11.225 -7.317 -5.450 1.00 0.00 C ATOM 1439 NE ARG B 30 10.802 -7.918 -6.713 1.00 0.00 N ATOM 1440 CZ ARG B 30 10.053 -9.011 -6.814 1.00 0.00 C ATOM 1441 NH1 ARG B 30 9.653 -9.663 -5.727 1.00 0.00 N ATOM 1442 NH2 ARG B 30 9.710 -9.453 -8.012 1.00 0.00 N ATOM 0 H ARG B 30 7.602 -5.917 -5.951 1.00 0.00 H new ATOM 0 HA ARG B 30 7.559 -6.008 -3.010 1.00 0.00 H new ATOM 0 HB2 ARG B 30 10.036 -6.003 -2.978 1.00 0.00 H new ATOM 0 HB3 ARG B 30 9.424 -7.464 -3.728 1.00 0.00 H new ATOM 0 HG2 ARG B 30 9.732 -5.853 -5.928 1.00 0.00 H new ATOM 0 HG3 ARG B 30 11.018 -5.254 -4.900 1.00 0.00 H new ATOM 0 HD2 ARG B 30 12.270 -7.015 -5.523 1.00 0.00 H new ATOM 0 HD3 ARG B 30 11.162 -8.060 -4.655 1.00 0.00 H new ATOM 0 HE ARG B 30 11.103 -7.467 -7.577 1.00 0.00 H new ATOM 0 HH11 ARG B 30 9.921 -9.325 -4.802 1.00 0.00 H new ATOM 0 HH12 ARG B 30 9.078 -10.501 -5.817 1.00 0.00 H new ATOM 0 HH21 ARG B 30 10.020 -8.956 -8.847 1.00 0.00 H new ATOM 0 HH22 ARG B 30 9.135 -10.291 -8.101 1.00 0.00 H new ATOM 1456 N ILE B 31 7.968 -3.592 -2.891 1.00 0.00 N ATOM 1457 CA ILE B 31 8.096 -2.153 -2.802 1.00 0.00 C ATOM 1458 C ILE B 31 9.472 -1.854 -2.218 1.00 0.00 C ATOM 1459 O ILE B 31 9.743 -2.145 -1.052 1.00 0.00 O ATOM 1460 CB ILE B 31 6.966 -1.516 -1.949 1.00 0.00 C ATOM 1461 CG1 ILE B 31 7.289 -0.054 -1.631 1.00 0.00 C ATOM 1462 CG2 ILE B 31 6.718 -2.309 -0.668 1.00 0.00 C ATOM 1463 CD1 ILE B 31 6.149 0.692 -0.973 1.00 0.00 C ATOM 0 H ILE B 31 7.661 -4.039 -2.027 1.00 0.00 H new ATOM 0 HA ILE B 31 7.998 -1.712 -3.794 1.00 0.00 H new ATOM 0 HB ILE B 31 6.048 -1.546 -2.537 1.00 0.00 H new ATOM 0 HG12 ILE B 31 8.160 -0.018 -0.977 1.00 0.00 H new ATOM 0 HG13 ILE B 31 7.561 0.458 -2.554 1.00 0.00 H new ATOM 0 HG21 ILE B 31 5.921 -1.835 -0.095 1.00 0.00 H new ATOM 0 HG22 ILE B 31 6.426 -3.328 -0.922 1.00 0.00 H new ATOM 0 HG23 ILE B 31 7.630 -2.331 -0.071 1.00 0.00 H new ATOM 0 HD11 ILE B 31 6.452 1.721 -0.778 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.282 0.688 -1.634 1.00 0.00 H new ATOM 0 HD13 ILE B 31 5.891 0.205 -0.033 1.00 0.00 H new ATOM 1475 N ALA B 32 10.356 -1.320 -3.042 1.00 0.00 N ATOM 1476 CA ALA B 32 11.712 -1.043 -2.609 1.00 0.00 C ATOM 1477 C ALA B 32 12.063 0.432 -2.714 1.00 0.00 C ATOM 1478 O ALA B 32 11.803 1.081 -3.719 1.00 0.00 O ATOM 1479 CB ALA B 32 12.697 -1.882 -3.404 1.00 0.00 C ATOM 0 H ALA B 32 10.159 -1.071 -4.011 1.00 0.00 H new ATOM 0 HA ALA B 32 11.778 -1.312 -1.555 1.00 0.00 H new ATOM 0 HB1 ALA B 32 13.712 -1.666 -3.070 1.00 0.00 H new ATOM 0 HB2 ALA B 32 12.482 -2.939 -3.250 1.00 0.00 H new ATOM 0 HB3 ALA B 32 12.605 -1.644 -4.464 1.00 0.00 H new ATOM 1485 N TRP B 33 12.658 0.944 -1.659 1.00 0.00 N ATOM 1486 CA TRP B 33 13.064 2.332 -1.591 1.00 0.00 C ATOM 1487 C TRP B 33 14.588 2.433 -1.541 1.00 0.00 C ATOM 1488 O TRP B 33 15.259 1.538 -1.017 1.00 0.00 O ATOM 1489 CB TRP B 33 12.429 2.961 -0.338 1.00 0.00 C ATOM 1490 CG TRP B 33 12.849 4.377 -0.044 1.00 0.00 C ATOM 1491 CD1 TRP B 33 12.105 5.508 -0.203 1.00 0.00 C ATOM 1492 CD2 TRP B 33 14.115 4.806 0.471 1.00 0.00 C ATOM 1493 NE1 TRP B 33 12.835 6.608 0.178 1.00 0.00 N ATOM 1494 CE2 TRP B 33 14.072 6.201 0.592 1.00 0.00 C ATOM 1495 CE3 TRP B 33 15.278 4.137 0.831 1.00 0.00 C ATOM 1496 CZ2 TRP B 33 15.156 6.938 1.065 1.00 0.00 C ATOM 1497 CZ3 TRP B 33 16.353 4.856 1.287 1.00 0.00 C ATOM 1498 CH2 TRP B 33 16.290 6.251 1.406 1.00 0.00 C ATOM 0 H TRP B 33 12.875 0.407 -0.819 1.00 0.00 H new ATOM 0 HA TRP B 33 12.727 2.869 -2.478 1.00 0.00 H new ATOM 0 HB2 TRP B 33 11.345 2.937 -0.449 1.00 0.00 H new ATOM 0 HB3 TRP B 33 12.675 2.340 0.524 1.00 0.00 H new ATOM 0 HD1 TRP B 33 11.091 5.535 -0.574 1.00 0.00 H new ATOM 0 HE1 TRP B 33 12.506 7.573 0.155 1.00 0.00 H new ATOM 0 HE3 TRP B 33 15.335 3.061 0.753 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 15.103 8.013 1.159 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 17.262 4.340 1.558 1.00 0.00 H new ATOM 0 HH2 TRP B 33 17.150 6.793 1.772 1.00 0.00 H new ATOM 1509 N ALA B 34 15.126 3.519 -2.087 1.00 0.00 N ATOM 1510 CA ALA B 34 16.565 3.772 -2.073 1.00 0.00 C ATOM 1511 C ALA B 34 16.821 5.273 -1.968 1.00 0.00 C ATOM 1512 O ALA B 34 15.956 6.059 -2.322 1.00 0.00 O ATOM 1513 CB ALA B 34 17.217 3.207 -3.307 1.00 0.00 C ATOM 0 H ALA B 34 14.581 4.246 -2.550 1.00 0.00 H new ATOM 0 HA ALA B 34 17.003 3.276 -1.207 1.00 0.00 H new ATOM 0 HB1 ALA B 34 18.288 3.406 -3.276 1.00 0.00 H new ATOM 0 HB2 ALA B 34 17.049 2.131 -3.347 1.00 0.00 H new ATOM 0 HB3 ALA B 34 16.786 3.674 -4.193 1.00 0.00 H new ATOM 1519 N PRO B 35 17.991 5.702 -1.464 1.00 0.00 N ATOM 1520 CA PRO B 35 18.309 7.118 -1.311 1.00 0.00 C ATOM 1521 C PRO B 35 18.931 7.728 -2.568 1.00 0.00 C ATOM 1522 O PRO B 35 19.601 7.031 -3.338 1.00 0.00 O ATOM 1523 CB PRO B 35 19.315 7.134 -0.153 1.00 0.00 C ATOM 1524 CG PRO B 35 19.772 5.714 0.043 1.00 0.00 C ATOM 1525 CD PRO B 35 19.093 4.858 -0.999 1.00 0.00 C ATOM 0 HA PRO B 35 17.414 7.713 -1.129 1.00 0.00 H new ATOM 0 HB2 PRO B 35 20.159 7.784 -0.383 1.00 0.00 H new ATOM 0 HB3 PRO B 35 18.853 7.521 0.755 1.00 0.00 H new ATOM 0 HG2 PRO B 35 20.855 5.645 -0.054 1.00 0.00 H new ATOM 0 HG3 PRO B 35 19.519 5.367 1.045 1.00 0.00 H new ATOM 0 HD2 PRO B 35 19.772 4.600 -1.812 1.00 0.00 H new ATOM 0 HD3 PRO B 35 18.731 3.921 -0.576 1.00 0.00 H new ATOM 1533 N GLU B 36 18.709 9.036 -2.748 1.00 0.00 N ATOM 1534 CA GLU B 36 19.216 9.792 -3.897 1.00 0.00 C ATOM 1535 C GLU B 36 18.934 9.061 -5.209 1.00 0.00 C ATOM 1536 O GLU B 36 17.800 9.037 -5.697 1.00 0.00 O ATOM 1537 CB GLU B 36 20.720 10.060 -3.763 1.00 0.00 C ATOM 1538 CG GLU B 36 21.161 10.447 -2.363 1.00 0.00 C ATOM 1539 CD GLU B 36 22.223 9.511 -1.828 1.00 0.00 C ATOM 1540 OE1 GLU B 36 23.340 9.484 -2.389 1.00 0.00 O ATOM 1541 OE2 GLU B 36 21.945 8.775 -0.858 1.00 0.00 O ATOM 0 H GLU B 36 18.168 9.603 -2.095 1.00 0.00 H new ATOM 0 HA GLU B 36 18.691 10.747 -3.912 1.00 0.00 H new ATOM 0 HB2 GLU B 36 21.265 9.168 -4.070 1.00 0.00 H new ATOM 0 HB3 GLU B 36 20.999 10.857 -4.453 1.00 0.00 H new ATOM 0 HG2 GLU B 36 21.547 11.466 -2.372 1.00 0.00 H new ATOM 0 HG3 GLU B 36 20.299 10.438 -1.695 1.00 0.00 H new ATOM 1548 N GLY B 37 19.974 8.459 -5.764 1.00 0.00 N ATOM 1549 CA GLY B 37 19.848 7.725 -7.000 1.00 0.00 C ATOM 1550 C GLY B 37 20.616 6.426 -6.946 1.00 0.00 C ATOM 1551 O GLY B 37 21.171 5.982 -7.950 1.00 0.00 O ATOM 0 H GLY B 37 20.915 8.468 -5.372 1.00 0.00 H new ATOM 0 HA2 GLY B 37 18.796 7.520 -7.198 1.00 0.00 H new ATOM 0 HA3 GLY B 37 20.216 8.334 -7.826 1.00 0.00 H new ATOM 1555 N LYS B 38 20.662 5.828 -5.761 1.00 0.00 N ATOM 1556 CA LYS B 38 21.367 4.570 -5.564 1.00 0.00 C ATOM 1557 C LYS B 38 20.649 3.433 -6.279 1.00 0.00 C ATOM 1558 O LYS B 38 19.420 3.353 -6.255 1.00 0.00 O ATOM 1559 CB LYS B 38 21.482 4.243 -4.072 1.00 0.00 C ATOM 1560 CG LYS B 38 22.847 4.549 -3.474 1.00 0.00 C ATOM 1561 CD LYS B 38 22.864 5.893 -2.765 1.00 0.00 C ATOM 1562 CE LYS B 38 24.131 6.071 -1.943 1.00 0.00 C ATOM 1563 NZ LYS B 38 24.117 7.336 -1.164 1.00 0.00 N ATOM 0 H LYS B 38 20.217 6.197 -4.920 1.00 0.00 H new ATOM 0 HA LYS B 38 22.367 4.679 -5.983 1.00 0.00 H new ATOM 0 HB2 LYS B 38 20.724 4.806 -3.528 1.00 0.00 H new ATOM 0 HB3 LYS B 38 21.261 3.186 -3.924 1.00 0.00 H new ATOM 0 HG2 LYS B 38 23.120 3.763 -2.770 1.00 0.00 H new ATOM 0 HG3 LYS B 38 23.599 4.545 -4.263 1.00 0.00 H new ATOM 0 HD2 LYS B 38 22.790 6.695 -3.500 1.00 0.00 H new ATOM 0 HD3 LYS B 38 21.993 5.974 -2.115 1.00 0.00 H new ATOM 0 HE2 LYS B 38 24.243 5.227 -1.262 1.00 0.00 H new ATOM 0 HE3 LYS B 38 24.997 6.063 -2.605 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 24.837 7.290 -0.415 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 24.326 8.135 -1.796 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 23.179 7.469 -0.735 1.00 0.00 H new ATOM 1577 N ASP B 39 21.423 2.566 -6.919 1.00 0.00 N ATOM 1578 CA ASP B 39 20.868 1.421 -7.631 1.00 0.00 C ATOM 1579 C ASP B 39 20.509 0.322 -6.638 1.00 0.00 C ATOM 1580 O ASP B 39 19.636 -0.509 -6.886 1.00 0.00 O ATOM 1581 CB ASP B 39 21.865 0.910 -8.684 1.00 0.00 C ATOM 1582 CG ASP B 39 22.655 -0.310 -8.235 1.00 0.00 C ATOM 1583 OD1 ASP B 39 23.397 -0.217 -7.230 1.00 0.00 O ATOM 1584 OD2 ASP B 39 22.542 -1.366 -8.888 1.00 0.00 O ATOM 0 H ASP B 39 22.440 2.634 -6.960 1.00 0.00 H new ATOM 0 HA ASP B 39 19.961 1.728 -8.151 1.00 0.00 H new ATOM 0 HB2 ASP B 39 21.322 0.665 -9.597 1.00 0.00 H new ATOM 0 HB3 ASP B 39 22.561 1.712 -8.932 1.00 0.00 H new ATOM 1589 N ARG B 40 21.191 0.339 -5.504 1.00 0.00 N ATOM 1590 CA ARG B 40 20.954 -0.633 -4.459 1.00 0.00 C ATOM 1591 C ARG B 40 19.845 -0.143 -3.540 1.00 0.00 C ATOM 1592 O ARG B 40 19.962 0.913 -2.916 1.00 0.00 O ATOM 1593 CB ARG B 40 22.234 -0.869 -3.657 1.00 0.00 C ATOM 1594 CG ARG B 40 22.674 -2.322 -3.627 1.00 0.00 C ATOM 1595 CD ARG B 40 23.865 -2.571 -4.543 1.00 0.00 C ATOM 1596 NE ARG B 40 23.482 -2.623 -5.953 1.00 0.00 N ATOM 1597 CZ ARG B 40 23.315 -3.751 -6.643 1.00 0.00 C ATOM 1598 NH1 ARG B 40 23.503 -4.931 -6.055 1.00 0.00 N ATOM 1599 NH2 ARG B 40 22.962 -3.699 -7.919 1.00 0.00 N ATOM 0 H ARG B 40 21.917 1.022 -5.287 1.00 0.00 H new ATOM 0 HA ARG B 40 20.649 -1.575 -4.915 1.00 0.00 H new ATOM 0 HB2 ARG B 40 23.035 -0.264 -4.081 1.00 0.00 H new ATOM 0 HB3 ARG B 40 22.081 -0.523 -2.635 1.00 0.00 H new ATOM 0 HG2 ARG B 40 22.936 -2.602 -2.606 1.00 0.00 H new ATOM 0 HG3 ARG B 40 21.843 -2.960 -3.929 1.00 0.00 H new ATOM 0 HD2 ARG B 40 24.602 -1.781 -4.398 1.00 0.00 H new ATOM 0 HD3 ARG B 40 24.344 -3.510 -4.265 1.00 0.00 H new ATOM 0 HE ARG B 40 23.333 -1.739 -6.440 1.00 0.00 H new ATOM 0 HH11 ARG B 40 23.776 -4.974 -5.073 1.00 0.00 H new ATOM 0 HH12 ARG B 40 23.374 -5.792 -6.587 1.00 0.00 H new ATOM 0 HH21 ARG B 40 22.818 -2.796 -8.372 1.00 0.00 H new ATOM 0 HH22 ARG B 40 22.834 -4.561 -8.448 1.00 0.00 H new ATOM 1613 N PHE B 41 18.773 -0.913 -3.463 1.00 0.00 N ATOM 1614 CA PHE B 41 17.641 -0.557 -2.627 1.00 0.00 C ATOM 1615 C PHE B 41 17.946 -0.821 -1.160 1.00 0.00 C ATOM 1616 O PHE B 41 18.610 -1.797 -0.817 1.00 0.00 O ATOM 1617 CB PHE B 41 16.395 -1.327 -3.061 1.00 0.00 C ATOM 1618 CG PHE B 41 15.944 -0.985 -4.452 1.00 0.00 C ATOM 1619 CD1 PHE B 41 15.396 0.257 -4.730 1.00 0.00 C ATOM 1620 CD2 PHE B 41 16.070 -1.903 -5.481 1.00 0.00 C ATOM 1621 CE1 PHE B 41 14.982 0.577 -6.008 1.00 0.00 C ATOM 1622 CE2 PHE B 41 15.657 -1.589 -6.762 1.00 0.00 C ATOM 1623 CZ PHE B 41 15.112 -0.348 -7.026 1.00 0.00 C ATOM 0 H PHE B 41 18.663 -1.791 -3.971 1.00 0.00 H new ATOM 0 HA PHE B 41 17.451 0.509 -2.747 1.00 0.00 H new ATOM 0 HB2 PHE B 41 16.598 -2.396 -3.004 1.00 0.00 H new ATOM 0 HB3 PHE B 41 15.585 -1.119 -2.362 1.00 0.00 H new ATOM 0 HD1 PHE B 41 15.291 0.983 -3.938 1.00 0.00 H new ATOM 0 HD2 PHE B 41 16.496 -2.875 -5.280 1.00 0.00 H new ATOM 0 HE1 PHE B 41 14.557 1.549 -6.211 1.00 0.00 H new ATOM 0 HE2 PHE B 41 15.760 -2.314 -7.556 1.00 0.00 H new ATOM 0 HZ PHE B 41 14.788 -0.101 -8.026 1.00 0.00 H new ATOM 1633 N THR B 42 17.458 0.061 -0.308 1.00 0.00 N ATOM 1634 CA THR B 42 17.671 -0.043 1.123 1.00 0.00 C ATOM 1635 C THR B 42 16.552 -0.833 1.795 1.00 0.00 C ATOM 1636 O THR B 42 16.801 -1.757 2.569 1.00 0.00 O ATOM 1637 CB THR B 42 17.748 1.364 1.747 1.00 0.00 C ATOM 1638 OG1 THR B 42 18.862 2.077 1.195 1.00 0.00 O ATOM 1639 CG2 THR B 42 17.869 1.297 3.263 1.00 0.00 C ATOM 0 H THR B 42 16.903 0.869 -0.589 1.00 0.00 H new ATOM 0 HA THR B 42 18.611 -0.571 1.283 1.00 0.00 H new ATOM 0 HB THR B 42 16.823 1.891 1.511 1.00 0.00 H new ATOM 0 HG1 THR B 42 18.907 2.972 1.592 1.00 0.00 H new ATOM 0 HG21 THR B 42 17.921 2.307 3.669 1.00 0.00 H new ATOM 0 HG22 THR B 42 17.000 0.785 3.675 1.00 0.00 H new ATOM 0 HG23 THR B 42 18.773 0.751 3.532 1.00 0.00 H new ATOM 1647 N ILE B 43 15.321 -0.473 1.480 1.00 0.00 N ATOM 1648 CA ILE B 43 14.161 -1.119 2.066 1.00 0.00 C ATOM 1649 C ILE B 43 13.331 -1.808 0.991 1.00 0.00 C ATOM 1650 O ILE B 43 12.819 -1.155 0.087 1.00 0.00 O ATOM 1651 CB ILE B 43 13.302 -0.083 2.826 1.00 0.00 C ATOM 1652 CG1 ILE B 43 13.976 0.294 4.145 1.00 0.00 C ATOM 1653 CG2 ILE B 43 11.892 -0.604 3.079 1.00 0.00 C ATOM 1654 CD1 ILE B 43 13.403 1.541 4.776 1.00 0.00 C ATOM 0 H ILE B 43 15.098 0.269 0.817 1.00 0.00 H new ATOM 0 HA ILE B 43 14.505 -1.876 2.771 1.00 0.00 H new ATOM 0 HB ILE B 43 13.219 0.807 2.202 1.00 0.00 H new ATOM 0 HG12 ILE B 43 13.878 -0.536 4.845 1.00 0.00 H new ATOM 0 HG13 ILE B 43 15.042 0.441 3.971 1.00 0.00 H new ATOM 0 HG21 ILE B 43 11.316 0.150 3.615 1.00 0.00 H new ATOM 0 HG22 ILE B 43 11.408 -0.821 2.127 1.00 0.00 H new ATOM 0 HG23 ILE B 43 11.942 -1.514 3.676 1.00 0.00 H new ATOM 0 HD11 ILE B 43 13.927 1.751 5.708 1.00 0.00 H new ATOM 0 HD12 ILE B 43 13.525 2.383 4.094 1.00 0.00 H new ATOM 0 HD13 ILE B 43 12.343 1.391 4.981 1.00 0.00 H new ATOM 1666 N SER B 44 13.234 -3.127 1.077 1.00 0.00 N ATOM 1667 CA SER B 44 12.466 -3.904 0.116 1.00 0.00 C ATOM 1668 C SER B 44 11.474 -4.809 0.835 1.00 0.00 C ATOM 1669 O SER B 44 11.865 -5.638 1.656 1.00 0.00 O ATOM 1670 CB SER B 44 13.403 -4.737 -0.767 1.00 0.00 C ATOM 1671 OG SER B 44 12.674 -5.557 -1.667 1.00 0.00 O ATOM 0 H SER B 44 13.680 -3.683 1.806 1.00 0.00 H new ATOM 0 HA SER B 44 11.909 -3.215 -0.520 1.00 0.00 H new ATOM 0 HB2 SER B 44 14.061 -4.074 -1.328 1.00 0.00 H new ATOM 0 HB3 SER B 44 14.039 -5.360 -0.138 1.00 0.00 H new ATOM 0 HG SER B 44 13.298 -6.074 -2.217 1.00 0.00 H new ATOM 1677 N HIS B 45 10.197 -4.650 0.517 1.00 0.00 N ATOM 1678 CA HIS B 45 9.146 -5.446 1.124 1.00 0.00 C ATOM 1679 C HIS B 45 8.152 -5.860 0.078 1.00 0.00 C ATOM 1680 O HIS B 45 7.798 -5.086 -0.798 1.00 0.00 O ATOM 1681 CB HIS B 45 8.410 -4.669 2.221 1.00 0.00 C ATOM 1682 CG HIS B 45 9.235 -4.406 3.435 1.00 0.00 C ATOM 1683 ND1 HIS B 45 9.484 -5.341 4.411 1.00 0.00 N ATOM 1684 CD2 HIS B 45 9.898 -3.287 3.803 1.00 0.00 C ATOM 1685 CE1 HIS B 45 10.285 -4.776 5.323 1.00 0.00 C ATOM 1686 NE2 HIS B 45 10.567 -3.527 5.000 1.00 0.00 N ATOM 0 H HIS B 45 9.864 -3.969 -0.165 1.00 0.00 H new ATOM 0 HA HIS B 45 9.616 -6.322 1.572 1.00 0.00 H new ATOM 0 HB2 HIS B 45 8.070 -3.718 1.812 1.00 0.00 H new ATOM 0 HB3 HIS B 45 7.520 -5.227 2.513 1.00 0.00 H new ATOM 0 HD1 HIS B 45 9.123 -6.295 4.436 1.00 0.00 H new ATOM 0 HD2 HIS B 45 9.907 -2.356 3.256 1.00 0.00 H new ATOM 0 HE1 HIS B 45 10.652 -5.276 6.207 1.00 0.00 H new ATOM 1694 N MET B 46 7.721 -7.084 0.151 1.00 0.00 N ATOM 1695 CA MET B 46 6.733 -7.570 -0.771 1.00 0.00 C ATOM 1696 C MET B 46 5.384 -7.220 -0.218 1.00 0.00 C ATOM 1697 O MET B 46 5.224 -7.078 0.988 1.00 0.00 O ATOM 1698 CB MET B 46 6.837 -9.084 -0.972 1.00 0.00 C ATOM 1699 CG MET B 46 7.728 -9.521 -2.133 1.00 0.00 C ATOM 1700 SD MET B 46 9.470 -9.167 -1.867 1.00 0.00 S ATOM 1701 CE MET B 46 9.552 -9.464 -0.113 1.00 0.00 C ATOM 0 H MET B 46 8.037 -7.767 0.840 1.00 0.00 H new ATOM 0 HA MET B 46 6.892 -7.108 -1.745 1.00 0.00 H new ATOM 0 HB2 MET B 46 7.217 -9.532 -0.054 1.00 0.00 H new ATOM 0 HB3 MET B 46 5.836 -9.484 -1.132 1.00 0.00 H new ATOM 0 HG2 MET B 46 7.603 -10.592 -2.295 1.00 0.00 H new ATOM 0 HG3 MET B 46 7.398 -9.021 -3.043 1.00 0.00 H new ATOM 0 HE1 MET B 46 10.519 -9.900 0.137 1.00 0.00 H new ATOM 0 HE2 MET B 46 9.429 -8.522 0.422 1.00 0.00 H new ATOM 0 HE3 MET B 46 8.758 -10.152 0.177 1.00 0.00 H new ATOM 1711 N TYR B 47 4.412 -7.085 -1.082 1.00 0.00 N ATOM 1712 CA TYR B 47 3.055 -6.771 -0.653 1.00 0.00 C ATOM 1713 C TYR B 47 2.428 -7.998 0.029 1.00 0.00 C ATOM 1714 O TYR B 47 1.211 -8.141 0.103 1.00 0.00 O ATOM 1715 CB TYR B 47 2.220 -6.326 -1.857 1.00 0.00 C ATOM 1716 CG TYR B 47 2.951 -5.339 -2.738 1.00 0.00 C ATOM 1717 CD1 TYR B 47 3.541 -4.208 -2.195 1.00 0.00 C ATOM 1718 CD2 TYR B 47 3.074 -5.549 -4.104 1.00 0.00 C ATOM 1719 CE1 TYR B 47 4.229 -3.314 -2.985 1.00 0.00 C ATOM 1720 CE2 TYR B 47 3.767 -4.660 -4.901 1.00 0.00 C ATOM 1721 CZ TYR B 47 4.341 -3.543 -4.334 1.00 0.00 C ATOM 1722 OH TYR B 47 5.039 -2.656 -5.119 1.00 0.00 O ATOM 0 H TYR B 47 4.525 -7.186 -2.091 1.00 0.00 H new ATOM 0 HA TYR B 47 3.080 -5.953 0.067 1.00 0.00 H new ATOM 0 HB2 TYR B 47 1.945 -7.200 -2.447 1.00 0.00 H new ATOM 0 HB3 TYR B 47 1.292 -5.875 -1.505 1.00 0.00 H new ATOM 0 HD1 TYR B 47 3.460 -4.025 -1.134 1.00 0.00 H new ATOM 0 HD2 TYR B 47 2.621 -6.421 -4.551 1.00 0.00 H new ATOM 0 HE1 TYR B 47 4.679 -2.436 -2.545 1.00 0.00 H new ATOM 0 HE2 TYR B 47 3.859 -4.839 -5.962 1.00 0.00 H new ATOM 0 HH TYR B 47 5.537 -3.148 -5.805 1.00 0.00 H new ATOM 1732 N ALA B 48 3.303 -8.867 0.523 1.00 0.00 N ATOM 1733 CA ALA B 48 2.938 -10.100 1.186 1.00 0.00 C ATOM 1734 C ALA B 48 3.090 -9.973 2.698 1.00 0.00 C ATOM 1735 O ALA B 48 2.235 -10.437 3.457 1.00 0.00 O ATOM 1736 CB ALA B 48 3.825 -11.223 0.664 1.00 0.00 C ATOM 0 H ALA B 48 4.311 -8.723 0.469 1.00 0.00 H new ATOM 0 HA ALA B 48 1.892 -10.322 0.973 1.00 0.00 H new ATOM 0 HB1 ALA B 48 3.558 -12.157 1.158 1.00 0.00 H new ATOM 0 HB2 ALA B 48 3.684 -11.328 -0.412 1.00 0.00 H new ATOM 0 HB3 ALA B 48 4.869 -10.989 0.872 1.00 0.00 H new ATOM 1742 N ASP B 49 4.186 -9.348 3.129 1.00 0.00 N ATOM 1743 CA ASP B 49 4.460 -9.166 4.549 1.00 0.00 C ATOM 1744 C ASP B 49 3.907 -7.839 5.034 1.00 0.00 C ATOM 1745 O ASP B 49 3.916 -7.552 6.231 1.00 0.00 O ATOM 1746 CB ASP B 49 5.967 -9.258 4.832 1.00 0.00 C ATOM 1747 CG ASP B 49 6.808 -8.371 3.927 1.00 0.00 C ATOM 1748 OD1 ASP B 49 6.880 -8.660 2.709 1.00 0.00 O ATOM 1749 OD2 ASP B 49 7.409 -7.400 4.433 1.00 0.00 O ATOM 0 H ASP B 49 4.898 -8.959 2.511 1.00 0.00 H new ATOM 0 HA ASP B 49 3.962 -9.967 5.095 1.00 0.00 H new ATOM 0 HB2 ASP B 49 6.151 -8.983 5.871 1.00 0.00 H new ATOM 0 HB3 ASP B 49 6.289 -10.293 4.714 1.00 0.00 H new ATOM 1754 N ILE B 50 3.420 -7.034 4.104 1.00 0.00 N ATOM 1755 CA ILE B 50 2.841 -5.752 4.451 1.00 0.00 C ATOM 1756 C ILE B 50 1.374 -5.943 4.811 1.00 0.00 C ATOM 1757 O ILE B 50 0.593 -6.469 4.020 1.00 0.00 O ATOM 1758 CB ILE B 50 2.964 -4.724 3.310 1.00 0.00 C ATOM 1759 CG1 ILE B 50 4.365 -4.763 2.703 1.00 0.00 C ATOM 1760 CG2 ILE B 50 2.662 -3.328 3.828 1.00 0.00 C ATOM 1761 CD1 ILE B 50 4.536 -3.835 1.522 1.00 0.00 C ATOM 0 H ILE B 50 3.415 -7.247 3.106 1.00 0.00 H new ATOM 0 HA ILE B 50 3.396 -5.359 5.303 1.00 0.00 H new ATOM 0 HB ILE B 50 2.241 -4.980 2.536 1.00 0.00 H new ATOM 0 HG12 ILE B 50 5.093 -4.499 3.471 1.00 0.00 H new ATOM 0 HG13 ILE B 50 4.588 -5.783 2.389 1.00 0.00 H new ATOM 0 HG21 ILE B 50 2.752 -2.610 3.013 1.00 0.00 H new ATOM 0 HG22 ILE B 50 1.648 -3.299 4.226 1.00 0.00 H new ATOM 0 HG23 ILE B 50 3.369 -3.072 4.617 1.00 0.00 H new ATOM 0 HD11 ILE B 50 5.554 -3.914 1.141 1.00 0.00 H new ATOM 0 HD12 ILE B 50 3.832 -4.112 0.737 1.00 0.00 H new ATOM 0 HD13 ILE B 50 4.345 -2.809 1.835 1.00 0.00 H new ATOM 1773 N LYS B 51 1.017 -5.523 6.011 1.00 0.00 N ATOM 1774 CA LYS B 51 -0.341 -5.657 6.508 1.00 0.00 C ATOM 1775 C LYS B 51 -1.245 -4.588 5.918 1.00 0.00 C ATOM 1776 O LYS B 51 -2.223 -4.885 5.236 1.00 0.00 O ATOM 1777 CB LYS B 51 -0.337 -5.541 8.033 1.00 0.00 C ATOM 1778 CG LYS B 51 -1.723 -5.446 8.645 1.00 0.00 C ATOM 1779 CD LYS B 51 -1.680 -4.756 9.992 1.00 0.00 C ATOM 1780 CE LYS B 51 -2.899 -5.101 10.824 1.00 0.00 C ATOM 1781 NZ LYS B 51 -2.687 -4.794 12.262 1.00 0.00 N ATOM 0 H LYS B 51 1.659 -5.080 6.668 1.00 0.00 H new ATOM 0 HA LYS B 51 -0.725 -6.633 6.210 1.00 0.00 H new ATOM 0 HB2 LYS B 51 0.176 -6.406 8.452 1.00 0.00 H new ATOM 0 HB3 LYS B 51 0.237 -4.660 8.319 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -2.383 -4.897 7.973 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -2.143 -6.446 8.759 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -0.777 -5.051 10.526 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -1.628 -3.677 9.849 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -3.760 -4.544 10.456 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -3.131 -6.160 10.708 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -3.542 -5.043 12.800 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -1.880 -5.345 12.619 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -2.490 -3.779 12.375 1.00 0.00 H new ATOM 1795 N CYS B 52 -0.901 -3.343 6.187 1.00 0.00 N ATOM 1796 CA CYS B 52 -1.676 -2.208 5.717 1.00 0.00 C ATOM 1797 C CYS B 52 -0.745 -1.042 5.459 1.00 0.00 C ATOM 1798 O CYS B 52 0.475 -1.177 5.540 1.00 0.00 O ATOM 1799 CB CYS B 52 -2.736 -1.822 6.755 1.00 0.00 C ATOM 1800 SG CYS B 52 -4.015 -3.077 7.006 1.00 0.00 S ATOM 0 H CYS B 52 -0.079 -3.089 6.736 1.00 0.00 H new ATOM 0 HA CYS B 52 -2.185 -2.476 4.791 1.00 0.00 H new ATOM 0 HB2 CYS B 52 -2.243 -1.626 7.707 1.00 0.00 H new ATOM 0 HB3 CYS B 52 -3.211 -0.891 6.445 1.00 0.00 H new ATOM 0 HG CYS B 52 -3.749 -4.119 6.276 1.00 0.00 H new ATOM 1806 N GLN B 53 -1.311 0.095 5.138 1.00 0.00 N ATOM 1807 CA GLN B 53 -0.522 1.279 4.884 1.00 0.00 C ATOM 1808 C GLN B 53 -1.107 2.427 5.678 1.00 0.00 C ATOM 1809 O GLN B 53 -2.110 2.255 6.352 1.00 0.00 O ATOM 1810 CB GLN B 53 -0.517 1.626 3.393 1.00 0.00 C ATOM 1811 CG GLN B 53 -0.557 0.420 2.465 1.00 0.00 C ATOM 1812 CD GLN B 53 -1.732 0.471 1.509 1.00 0.00 C ATOM 1813 OE1 GLN B 53 -1.676 1.145 0.487 1.00 0.00 O ATOM 1814 NE2 GLN B 53 -2.803 -0.247 1.829 1.00 0.00 N ATOM 0 H GLN B 53 -2.318 0.228 5.046 1.00 0.00 H new ATOM 0 HA GLN B 53 0.509 1.095 5.187 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -1.375 2.263 3.178 1.00 0.00 H new ATOM 0 HB3 GLN B 53 0.376 2.210 3.172 1.00 0.00 H new ATOM 0 HG2 GLN B 53 0.371 0.372 1.895 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -0.614 -0.492 3.059 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -2.811 -0.795 2.689 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -3.617 -0.250 1.215 1.00 0.00 H new ATOM 1823 N LYS B 54 -0.465 3.572 5.633 1.00 0.00 N ATOM 1824 CA LYS B 54 -0.960 4.756 6.311 1.00 0.00 C ATOM 1825 C LYS B 54 -0.556 5.984 5.517 1.00 0.00 C ATOM 1826 O LYS B 54 0.617 6.191 5.235 1.00 0.00 O ATOM 1827 CB LYS B 54 -0.438 4.838 7.747 1.00 0.00 C ATOM 1828 CG LYS B 54 -1.179 3.927 8.712 1.00 0.00 C ATOM 1829 CD LYS B 54 -0.653 4.058 10.128 1.00 0.00 C ATOM 1830 CE LYS B 54 -1.466 5.049 10.941 1.00 0.00 C ATOM 1831 NZ LYS B 54 -0.848 5.317 12.265 1.00 0.00 N ATOM 0 H LYS B 54 0.411 3.712 5.129 1.00 0.00 H new ATOM 0 HA LYS B 54 -2.047 4.702 6.371 1.00 0.00 H new ATOM 0 HB2 LYS B 54 0.621 4.580 7.756 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -0.518 5.867 8.097 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -2.242 4.168 8.696 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -1.082 2.893 8.382 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -0.675 3.083 10.616 1.00 0.00 H new ATOM 0 HD3 LYS B 54 0.389 4.378 10.101 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -1.558 5.983 10.388 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -2.475 4.661 11.083 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -1.450 5.972 12.803 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -0.752 4.425 12.790 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 0.091 5.742 12.130 1.00 0.00 H new ATOM 1845 N ILE B 55 -1.528 6.783 5.139 1.00 0.00 N ATOM 1846 CA ILE B 55 -1.263 7.980 4.354 1.00 0.00 C ATOM 1847 C ILE B 55 -1.579 9.225 5.132 1.00 0.00 C ATOM 1848 O ILE B 55 -2.223 9.164 6.158 1.00 0.00 O ATOM 1849 CB ILE B 55 -2.118 8.015 3.084 1.00 0.00 C ATOM 1850 CG1 ILE B 55 -3.548 7.589 3.409 1.00 0.00 C ATOM 1851 CG2 ILE B 55 -1.515 7.137 2.013 1.00 0.00 C ATOM 1852 CD1 ILE B 55 -4.408 7.398 2.190 1.00 0.00 C ATOM 0 H ILE B 55 -2.512 6.630 5.360 1.00 0.00 H new ATOM 0 HA ILE B 55 -0.204 7.947 4.100 1.00 0.00 H new ATOM 0 HB ILE B 55 -2.142 9.035 2.699 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -3.522 6.658 3.975 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -4.005 8.340 4.053 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -2.137 7.175 1.119 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -0.513 7.492 1.773 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.460 6.110 2.373 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -5.410 7.096 2.495 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -4.465 8.334 1.634 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -3.974 6.625 1.556 1.00 0.00 H new ATOM 1864 N SER B 56 -1.122 10.348 4.633 1.00 0.00 N ATOM 1865 CA SER B 56 -1.402 11.617 5.255 1.00 0.00 C ATOM 1866 C SER B 56 -2.628 12.220 4.563 1.00 0.00 C ATOM 1867 O SER B 56 -2.523 12.785 3.476 1.00 0.00 O ATOM 1868 CB SER B 56 -0.178 12.518 5.134 1.00 0.00 C ATOM 1869 OG SER B 56 0.876 11.851 4.455 1.00 0.00 O ATOM 0 H SER B 56 -0.550 10.407 3.791 1.00 0.00 H new ATOM 0 HA SER B 56 -1.619 11.502 6.317 1.00 0.00 H new ATOM 0 HB2 SER B 56 -0.443 13.429 4.597 1.00 0.00 H new ATOM 0 HB3 SER B 56 0.157 12.819 6.127 1.00 0.00 H new ATOM 0 HG SER B 56 1.082 11.011 4.916 1.00 0.00 H new ATOM 1875 N PRO B 57 -3.810 12.094 5.182 1.00 0.00 N ATOM 1876 CA PRO B 57 -5.068 12.567 4.605 1.00 0.00 C ATOM 1877 C PRO B 57 -5.158 14.089 4.591 1.00 0.00 C ATOM 1878 O PRO B 57 -4.383 14.762 5.273 1.00 0.00 O ATOM 1879 CB PRO B 57 -6.143 11.958 5.509 1.00 0.00 C ATOM 1880 CG PRO B 57 -5.418 11.035 6.430 1.00 0.00 C ATOM 1881 CD PRO B 57 -4.018 11.538 6.517 1.00 0.00 C ATOM 0 HA PRO B 57 -5.174 12.271 3.561 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -6.671 12.732 6.066 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -6.889 11.421 4.923 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -5.887 11.021 7.414 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -5.440 10.013 6.052 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -3.903 12.292 7.295 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -3.311 10.739 6.741 1.00 0.00 H new ATOM 1889 N GLU B 58 -6.088 14.622 3.785 1.00 0.00 N ATOM 1890 CA GLU B 58 -6.298 16.072 3.650 1.00 0.00 C ATOM 1891 C GLU B 58 -5.194 16.707 2.801 1.00 0.00 C ATOM 1892 O GLU B 58 -5.450 17.593 1.988 1.00 0.00 O ATOM 1893 CB GLU B 58 -6.419 16.736 5.036 1.00 0.00 C ATOM 1894 CG GLU B 58 -6.011 18.200 5.086 1.00 0.00 C ATOM 1895 CD GLU B 58 -4.727 18.408 5.862 1.00 0.00 C ATOM 1896 OE1 GLU B 58 -4.759 18.317 7.107 1.00 0.00 O ATOM 1897 OE2 GLU B 58 -3.678 18.630 5.229 1.00 0.00 O ATOM 0 H GLU B 58 -6.715 14.061 3.209 1.00 0.00 H new ATOM 0 HA GLU B 58 -7.240 16.240 3.127 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -7.452 16.651 5.374 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -5.805 16.179 5.744 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -5.885 18.576 4.071 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -6.810 18.783 5.545 1.00 0.00 H new ATOM 1904 N GLY B 59 -3.984 16.215 2.972 1.00 0.00 N ATOM 1905 CA GLY B 59 -2.851 16.719 2.240 1.00 0.00 C ATOM 1906 C GLY B 59 -1.612 16.625 3.084 1.00 0.00 C ATOM 1907 O GLY B 59 -0.676 15.893 2.748 1.00 0.00 O ATOM 0 H GLY B 59 -3.764 15.459 3.620 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -2.719 16.149 1.320 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -3.026 17.755 1.950 1.00 0.00 H new ATOM 1911 N LYS B 60 -1.652 17.325 4.217 1.00 0.00 N ATOM 1912 CA LYS B 60 -0.554 17.359 5.186 1.00 0.00 C ATOM 1913 C LYS B 60 0.707 18.002 4.619 1.00 0.00 C ATOM 1914 O LYS B 60 0.969 17.956 3.420 1.00 0.00 O ATOM 1915 CB LYS B 60 -0.236 15.946 5.673 1.00 0.00 C ATOM 1916 CG LYS B 60 -1.451 15.208 6.187 1.00 0.00 C ATOM 1917 CD LYS B 60 -1.417 15.076 7.688 1.00 0.00 C ATOM 1918 CE LYS B 60 -2.356 16.062 8.348 1.00 0.00 C ATOM 1919 NZ LYS B 60 -3.716 16.017 7.748 1.00 0.00 N ATOM 0 H LYS B 60 -2.455 17.891 4.492 1.00 0.00 H new ATOM 0 HA LYS B 60 -0.888 17.974 6.022 1.00 0.00 H new ATOM 0 HB2 LYS B 60 0.208 15.378 4.856 1.00 0.00 H new ATOM 0 HB3 LYS B 60 0.511 16.001 6.465 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -2.355 15.738 5.887 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -1.496 14.218 5.734 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -1.694 14.061 7.972 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -0.401 15.242 8.047 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -2.422 15.844 9.414 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -1.950 17.069 8.253 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -4.070 16.986 7.618 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -3.673 15.537 6.826 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -4.357 15.496 8.380 1.00 0.00 H new ATOM 1933 N ALA B 61 1.481 18.618 5.498 1.00 0.00 N ATOM 1934 CA ALA B 61 2.732 19.242 5.098 1.00 0.00 C ATOM 1935 C ALA B 61 3.779 18.163 4.907 1.00 0.00 C ATOM 1936 O ALA B 61 4.677 18.273 4.075 1.00 0.00 O ATOM 1937 CB ALA B 61 3.182 20.242 6.141 1.00 0.00 C ATOM 0 H ALA B 61 1.266 18.699 6.492 1.00 0.00 H new ATOM 0 HA ALA B 61 2.589 19.779 4.160 1.00 0.00 H new ATOM 0 HB1 ALA B 61 4.120 20.700 5.826 1.00 0.00 H new ATOM 0 HB2 ALA B 61 2.422 21.015 6.256 1.00 0.00 H new ATOM 0 HB3 ALA B 61 3.329 19.733 7.094 1.00 0.00 H new ATOM 1943 N LYS B 62 3.650 17.122 5.709 1.00 0.00 N ATOM 1944 CA LYS B 62 4.531 15.981 5.642 1.00 0.00 C ATOM 1945 C LYS B 62 3.848 14.916 4.803 1.00 0.00 C ATOM 1946 O LYS B 62 2.988 14.194 5.305 1.00 0.00 O ATOM 1947 CB LYS B 62 4.797 15.426 7.048 1.00 0.00 C ATOM 1948 CG LYS B 62 6.256 15.438 7.489 1.00 0.00 C ATOM 1949 CD LYS B 62 6.389 14.947 8.929 1.00 0.00 C ATOM 1950 CE LYS B 62 7.823 14.577 9.289 1.00 0.00 C ATOM 1951 NZ LYS B 62 7.994 13.115 9.511 1.00 0.00 N ATOM 0 H LYS B 62 2.928 17.048 6.426 1.00 0.00 H new ATOM 0 HA LYS B 62 5.484 16.274 5.202 1.00 0.00 H new ATOM 0 HB2 LYS B 62 4.213 16.004 7.765 1.00 0.00 H new ATOM 0 HB3 LYS B 62 4.430 14.400 7.091 1.00 0.00 H new ATOM 0 HG2 LYS B 62 6.846 14.804 6.827 1.00 0.00 H new ATOM 0 HG3 LYS B 62 6.658 16.448 7.405 1.00 0.00 H new ATOM 0 HD2 LYS B 62 6.036 15.723 9.608 1.00 0.00 H new ATOM 0 HD3 LYS B 62 5.746 14.079 9.075 1.00 0.00 H new ATOM 0 HE2 LYS B 62 8.490 14.901 8.490 1.00 0.00 H new ATOM 0 HE3 LYS B 62 8.119 15.115 10.189 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 8.995 12.908 9.703 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 7.417 12.817 10.323 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 7.690 12.597 8.662 1.00 0.00 H new ATOM 1965 N ILE B 63 4.178 14.833 3.523 1.00 0.00 N ATOM 1966 CA ILE B 63 3.559 13.831 2.680 1.00 0.00 C ATOM 1967 C ILE B 63 4.217 12.491 2.976 1.00 0.00 C ATOM 1968 O ILE B 63 5.156 12.091 2.309 1.00 0.00 O ATOM 1969 CB ILE B 63 3.691 14.177 1.186 1.00 0.00 C ATOM 1970 CG1 ILE B 63 2.906 15.453 0.874 1.00 0.00 C ATOM 1971 CG2 ILE B 63 3.179 13.029 0.328 1.00 0.00 C ATOM 1972 CD1 ILE B 63 3.695 16.735 1.024 1.00 0.00 C ATOM 0 H ILE B 63 4.856 15.435 3.056 1.00 0.00 H new ATOM 0 HA ILE B 63 2.492 13.790 2.899 1.00 0.00 H new ATOM 0 HB ILE B 63 4.744 14.341 0.957 1.00 0.00 H new ATOM 0 HG12 ILE B 63 2.530 15.391 -0.147 1.00 0.00 H new ATOM 0 HG13 ILE B 63 2.037 15.498 1.531 1.00 0.00 H new ATOM 0 HG21 ILE B 63 3.279 13.289 -0.726 1.00 0.00 H new ATOM 0 HG22 ILE B 63 3.761 12.131 0.537 1.00 0.00 H new ATOM 0 HG23 ILE B 63 2.130 12.843 0.558 1.00 0.00 H new ATOM 0 HD11 ILE B 63 3.057 17.585 0.782 1.00 0.00 H new ATOM 0 HD12 ILE B 63 4.048 16.827 2.051 1.00 0.00 H new ATOM 0 HD13 ILE B 63 4.549 16.718 0.347 1.00 0.00 H new ATOM 1984 N GLN B 64 3.740 11.797 3.990 1.00 0.00 N ATOM 1985 CA GLN B 64 4.352 10.534 4.356 1.00 0.00 C ATOM 1986 C GLN B 64 3.403 9.355 4.236 1.00 0.00 C ATOM 1987 O GLN B 64 2.191 9.473 4.427 1.00 0.00 O ATOM 1988 CB GLN B 64 4.946 10.597 5.766 1.00 0.00 C ATOM 1989 CG GLN B 64 4.371 11.694 6.648 1.00 0.00 C ATOM 1990 CD GLN B 64 5.175 11.877 7.920 1.00 0.00 C ATOM 1991 OE1 GLN B 64 6.390 11.679 7.924 1.00 0.00 O ATOM 1992 NE2 GLN B 64 4.514 12.263 9.003 1.00 0.00 N ATOM 0 H GLN B 64 2.946 12.078 4.566 1.00 0.00 H new ATOM 0 HA GLN B 64 5.155 10.369 3.638 1.00 0.00 H new ATOM 0 HB2 GLN B 64 4.789 9.636 6.255 1.00 0.00 H new ATOM 0 HB3 GLN B 64 6.023 10.741 5.686 1.00 0.00 H new ATOM 0 HG2 GLN B 64 4.351 12.632 6.093 1.00 0.00 H new ATOM 0 HG3 GLN B 64 3.339 11.452 6.903 1.00 0.00 H new ATOM 0 HE21 GLN B 64 3.507 12.416 8.958 1.00 0.00 H new ATOM 0 HE22 GLN B 64 5.013 12.406 9.881 1.00 0.00 H new ATOM 2001 N LEU B 65 3.990 8.223 3.894 1.00 0.00 N ATOM 2002 CA LEU B 65 3.280 6.971 3.736 1.00 0.00 C ATOM 2003 C LEU B 65 3.880 5.929 4.672 1.00 0.00 C ATOM 2004 O LEU B 65 5.044 5.569 4.529 1.00 0.00 O ATOM 2005 CB LEU B 65 3.425 6.477 2.306 1.00 0.00 C ATOM 2006 CG LEU B 65 2.609 5.236 1.970 1.00 0.00 C ATOM 2007 CD1 LEU B 65 1.246 5.609 1.407 1.00 0.00 C ATOM 2008 CD2 LEU B 65 3.394 4.346 1.029 1.00 0.00 C ATOM 0 H LEU B 65 4.991 8.148 3.715 1.00 0.00 H new ATOM 0 HA LEU B 65 2.227 7.126 3.970 1.00 0.00 H new ATOM 0 HB2 LEU B 65 3.134 7.280 1.629 1.00 0.00 H new ATOM 0 HB3 LEU B 65 4.477 6.265 2.115 1.00 0.00 H new ATOM 0 HG LEU B 65 2.421 4.675 2.885 1.00 0.00 H new ATOM 0 HD11 LEU B 65 0.687 4.702 1.177 1.00 0.00 H new ATOM 0 HD12 LEU B 65 0.697 6.197 2.143 1.00 0.00 H new ATOM 0 HD13 LEU B 65 1.376 6.196 0.498 1.00 0.00 H new ATOM 0 HD21 LEU B 65 2.806 3.459 0.792 1.00 0.00 H new ATOM 0 HD22 LEU B 65 3.615 4.892 0.112 1.00 0.00 H new ATOM 0 HD23 LEU B 65 4.327 4.046 1.506 1.00 0.00 H new ATOM 2020 N GLN B 66 3.091 5.439 5.607 1.00 0.00 N ATOM 2021 CA GLN B 66 3.567 4.453 6.564 1.00 0.00 C ATOM 2022 C GLN B 66 3.233 3.032 6.126 1.00 0.00 C ATOM 2023 O GLN B 66 2.069 2.656 6.027 1.00 0.00 O ATOM 2024 CB GLN B 66 2.971 4.732 7.933 1.00 0.00 C ATOM 2025 CG GLN B 66 3.307 3.692 8.990 1.00 0.00 C ATOM 2026 CD GLN B 66 2.781 4.069 10.363 1.00 0.00 C ATOM 2027 OE1 GLN B 66 2.311 3.219 11.115 1.00 0.00 O ATOM 2028 NE2 GLN B 66 2.882 5.343 10.707 1.00 0.00 N ATOM 0 H GLN B 66 2.114 5.707 5.727 1.00 0.00 H new ATOM 0 HA GLN B 66 4.653 4.535 6.615 1.00 0.00 H new ATOM 0 HB2 GLN B 66 3.320 5.706 8.276 1.00 0.00 H new ATOM 0 HB3 GLN B 66 1.887 4.797 7.837 1.00 0.00 H new ATOM 0 HG2 GLN B 66 2.888 2.730 8.695 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.389 3.566 9.041 1.00 0.00 H new ATOM 0 HE21 GLN B 66 3.279 6.018 10.053 1.00 0.00 H new ATOM 0 HE22 GLN B 66 2.563 5.650 11.626 1.00 0.00 H new ATOM 2037 N LEU B 67 4.264 2.256 5.839 1.00 0.00 N ATOM 2038 CA LEU B 67 4.093 0.868 5.449 1.00 0.00 C ATOM 2039 C LEU B 67 3.962 0.012 6.693 1.00 0.00 C ATOM 2040 O LEU B 67 4.960 -0.321 7.325 1.00 0.00 O ATOM 2041 CB LEU B 67 5.289 0.373 4.633 1.00 0.00 C ATOM 2042 CG LEU B 67 5.314 0.788 3.166 1.00 0.00 C ATOM 2043 CD1 LEU B 67 6.399 0.018 2.432 1.00 0.00 C ATOM 2044 CD2 LEU B 67 3.957 0.559 2.517 1.00 0.00 C ATOM 0 H LEU B 67 5.235 2.567 5.869 1.00 0.00 H new ATOM 0 HA LEU B 67 3.195 0.793 4.835 1.00 0.00 H new ATOM 0 HB2 LEU B 67 6.202 0.733 5.108 1.00 0.00 H new ATOM 0 HB3 LEU B 67 5.312 -0.716 4.683 1.00 0.00 H new ATOM 0 HG LEU B 67 5.537 1.853 3.106 1.00 0.00 H new ATOM 0 HD11 LEU B 67 6.413 0.318 1.384 1.00 0.00 H new ATOM 0 HD12 LEU B 67 7.367 0.234 2.884 1.00 0.00 H new ATOM 0 HD13 LEU B 67 6.196 -1.051 2.501 1.00 0.00 H new ATOM 0 HD21 LEU B 67 3.998 0.862 1.471 1.00 0.00 H new ATOM 0 HD22 LEU B 67 3.698 -0.498 2.579 1.00 0.00 H new ATOM 0 HD23 LEU B 67 3.201 1.149 3.036 1.00 0.00 H new ATOM 2056 N VAL B 68 2.741 -0.326 7.056 1.00 0.00 N ATOM 2057 CA VAL B 68 2.510 -1.145 8.230 1.00 0.00 C ATOM 2058 C VAL B 68 2.613 -2.612 7.859 1.00 0.00 C ATOM 2059 O VAL B 68 1.734 -3.157 7.200 1.00 0.00 O ATOM 2060 CB VAL B 68 1.137 -0.871 8.861 1.00 0.00 C ATOM 2061 CG1 VAL B 68 1.065 -1.512 10.230 1.00 0.00 C ATOM 2062 CG2 VAL B 68 0.882 0.622 8.955 1.00 0.00 C ATOM 0 H VAL B 68 1.896 -0.048 6.557 1.00 0.00 H new ATOM 0 HA VAL B 68 3.272 -0.889 8.966 1.00 0.00 H new ATOM 0 HB VAL B 68 0.364 -1.306 8.228 1.00 0.00 H new ATOM 0 HG11 VAL B 68 0.089 -1.315 10.673 1.00 0.00 H new ATOM 0 HG12 VAL B 68 1.210 -2.588 10.136 1.00 0.00 H new ATOM 0 HG13 VAL B 68 1.844 -1.095 10.868 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -0.096 0.797 9.405 1.00 0.00 H new ATOM 0 HG22 VAL B 68 1.653 1.085 9.571 1.00 0.00 H new ATOM 0 HG23 VAL B 68 0.905 1.059 7.957 1.00 0.00 H new ATOM 2072 N LEU B 69 3.688 -3.248 8.279 1.00 0.00 N ATOM 2073 CA LEU B 69 3.910 -4.642 7.951 1.00 0.00 C ATOM 2074 C LEU B 69 3.429 -5.556 9.070 1.00 0.00 C ATOM 2075 O LEU B 69 3.310 -5.131 10.219 1.00 0.00 O ATOM 2076 CB LEU B 69 5.392 -4.882 7.702 1.00 0.00 C ATOM 2077 CG LEU B 69 6.157 -3.675 7.163 1.00 0.00 C ATOM 2078 CD1 LEU B 69 7.641 -3.922 7.236 1.00 0.00 C ATOM 2079 CD2 LEU B 69 5.759 -3.355 5.740 1.00 0.00 C ATOM 0 H LEU B 69 4.421 -2.823 8.847 1.00 0.00 H new ATOM 0 HA LEU B 69 3.340 -4.872 7.051 1.00 0.00 H new ATOM 0 HB2 LEU B 69 5.856 -5.200 8.636 1.00 0.00 H new ATOM 0 HB3 LEU B 69 5.498 -5.706 6.996 1.00 0.00 H new ATOM 0 HG LEU B 69 5.902 -2.818 7.786 1.00 0.00 H new ATOM 0 HD11 LEU B 69 8.174 -3.054 6.849 1.00 0.00 H new ATOM 0 HD12 LEU B 69 7.931 -4.093 8.273 1.00 0.00 H new ATOM 0 HD13 LEU B 69 7.894 -4.799 6.639 1.00 0.00 H new ATOM 0 HD21 LEU B 69 6.324 -2.491 5.390 1.00 0.00 H new ATOM 0 HD22 LEU B 69 5.973 -4.212 5.101 1.00 0.00 H new ATOM 0 HD23 LEU B 69 4.693 -3.132 5.702 1.00 0.00 H new ATOM 2091 N HIS B 70 3.187 -6.818 8.727 1.00 0.00 N ATOM 2092 CA HIS B 70 2.723 -7.818 9.690 1.00 0.00 C ATOM 2093 C HIS B 70 3.816 -8.149 10.697 1.00 0.00 C ATOM 2094 O HIS B 70 3.561 -8.748 11.739 1.00 0.00 O ATOM 2095 CB HIS B 70 2.318 -9.110 8.973 1.00 0.00 C ATOM 2096 CG HIS B 70 1.014 -9.035 8.248 1.00 0.00 C ATOM 2097 ND1 HIS B 70 -0.198 -8.834 8.867 1.00 0.00 N ATOM 2098 CD2 HIS B 70 0.745 -9.166 6.926 1.00 0.00 C ATOM 2099 CE1 HIS B 70 -1.150 -8.855 7.927 1.00 0.00 C ATOM 2100 NE2 HIS B 70 -0.629 -9.052 6.728 1.00 0.00 N ATOM 0 H HIS B 70 3.305 -7.177 7.780 1.00 0.00 H new ATOM 0 HA HIS B 70 1.862 -7.396 10.209 1.00 0.00 H new ATOM 0 HB2 HIS B 70 3.100 -9.376 8.261 1.00 0.00 H new ATOM 0 HB3 HIS B 70 2.266 -9.916 9.705 1.00 0.00 H new ATOM 0 HD2 HIS B 70 1.478 -9.332 6.151 1.00 0.00 H new ATOM 0 HE1 HIS B 70 -2.205 -8.728 8.122 1.00 0.00 H new ATOM 0 HE2 HIS B 70 -1.130 -9.109 5.841 1.00 0.00 H new ATOM 2108 N ALA B 71 5.043 -7.772 10.364 1.00 0.00 N ATOM 2109 CA ALA B 71 6.182 -8.036 11.226 1.00 0.00 C ATOM 2110 C ALA B 71 6.170 -7.142 12.460 1.00 0.00 C ATOM 2111 O ALA B 71 6.782 -7.471 13.473 1.00 0.00 O ATOM 2112 CB ALA B 71 7.479 -7.848 10.452 1.00 0.00 C ATOM 0 H ALA B 71 5.273 -7.281 9.500 1.00 0.00 H new ATOM 0 HA ALA B 71 6.112 -9.070 11.565 1.00 0.00 H new ATOM 0 HB1 ALA B 71 8.326 -8.048 11.108 1.00 0.00 H new ATOM 0 HB2 ALA B 71 7.502 -8.537 9.608 1.00 0.00 H new ATOM 0 HB3 ALA B 71 7.539 -6.823 10.085 1.00 0.00 H new ATOM 2118 N GLY B 72 5.479 -6.010 12.373 1.00 0.00 N ATOM 2119 CA GLY B 72 5.436 -5.102 13.494 1.00 0.00 C ATOM 2120 C GLY B 72 6.384 -3.968 13.246 1.00 0.00 C ATOM 2121 O GLY B 72 6.958 -3.388 14.165 1.00 0.00 O ATOM 0 H GLY B 72 4.954 -5.711 11.552 1.00 0.00 H new ATOM 0 HA2 GLY B 72 4.424 -4.722 13.631 1.00 0.00 H new ATOM 0 HA3 GLY B 72 5.707 -5.625 14.411 1.00 0.00 H new ATOM 2125 N ASP B 73 6.523 -3.658 11.970 1.00 0.00 N ATOM 2126 CA ASP B 73 7.400 -2.621 11.508 1.00 0.00 C ATOM 2127 C ASP B 73 6.594 -1.737 10.607 1.00 0.00 C ATOM 2128 O ASP B 73 5.789 -2.223 9.810 1.00 0.00 O ATOM 2129 CB ASP B 73 8.581 -3.197 10.726 1.00 0.00 C ATOM 2130 CG ASP B 73 9.662 -2.161 10.474 1.00 0.00 C ATOM 2131 OD1 ASP B 73 9.444 -1.267 9.630 1.00 0.00 O ATOM 2132 OD2 ASP B 73 10.724 -2.242 11.125 1.00 0.00 O ATOM 0 H ASP B 73 6.018 -4.132 11.221 1.00 0.00 H new ATOM 0 HA ASP B 73 7.806 -2.073 12.359 1.00 0.00 H new ATOM 0 HB2 ASP B 73 9.006 -4.036 11.278 1.00 0.00 H new ATOM 0 HB3 ASP B 73 8.227 -3.589 9.773 1.00 0.00 H new ATOM 2137 N THR B 74 6.758 -0.460 10.756 1.00 0.00 N ATOM 2138 CA THR B 74 6.037 0.464 9.937 1.00 0.00 C ATOM 2139 C THR B 74 7.003 1.533 9.409 1.00 0.00 C ATOM 2140 O THR B 74 7.603 2.265 10.196 1.00 0.00 O ATOM 2141 CB THR B 74 4.909 1.121 10.747 1.00 0.00 C ATOM 2142 OG1 THR B 74 5.450 1.769 11.907 1.00 0.00 O ATOM 2143 CG2 THR B 74 3.872 0.095 11.175 1.00 0.00 C ATOM 0 H THR B 74 7.385 -0.033 11.438 1.00 0.00 H new ATOM 0 HA THR B 74 5.592 -0.068 9.096 1.00 0.00 H new ATOM 0 HB THR B 74 4.422 1.859 10.109 1.00 0.00 H new ATOM 0 HG1 THR B 74 6.366 2.063 11.720 1.00 0.00 H new ATOM 0 HG21 THR B 74 3.086 0.589 11.746 1.00 0.00 H new ATOM 0 HG22 THR B 74 3.438 -0.374 10.292 1.00 0.00 H new ATOM 0 HG23 THR B 74 4.347 -0.666 11.794 1.00 0.00 H new ATOM 2151 N THR B 75 7.148 1.629 8.095 1.00 0.00 N ATOM 2152 CA THR B 75 8.066 2.598 7.493 1.00 0.00 C ATOM 2153 C THR B 75 7.323 3.806 6.917 1.00 0.00 C ATOM 2154 O THR B 75 6.476 3.647 6.046 1.00 0.00 O ATOM 2155 CB THR B 75 8.877 1.934 6.364 1.00 0.00 C ATOM 2156 OG1 THR B 75 9.603 0.805 6.868 1.00 0.00 O ATOM 2157 CG2 THR B 75 9.838 2.922 5.723 1.00 0.00 C ATOM 0 H THR B 75 6.645 1.051 7.422 1.00 0.00 H new ATOM 0 HA THR B 75 8.731 2.943 8.285 1.00 0.00 H new ATOM 0 HB THR B 75 8.174 1.597 5.603 1.00 0.00 H new ATOM 0 HG1 THR B 75 10.112 0.392 6.140 1.00 0.00 H new ATOM 0 HG21 THR B 75 10.396 2.424 4.930 1.00 0.00 H new ATOM 0 HG22 THR B 75 9.276 3.756 5.303 1.00 0.00 H new ATOM 0 HG23 THR B 75 10.532 3.295 6.476 1.00 0.00 H new ATOM 2165 N ASN B 76 7.653 5.009 7.383 1.00 0.00 N ATOM 2166 CA ASN B 76 6.996 6.221 6.888 1.00 0.00 C ATOM 2167 C ASN B 76 7.846 6.912 5.822 1.00 0.00 C ATOM 2168 O ASN B 76 8.829 7.585 6.130 1.00 0.00 O ATOM 2169 CB ASN B 76 6.706 7.220 8.022 1.00 0.00 C ATOM 2170 CG ASN B 76 5.985 6.607 9.202 1.00 0.00 C ATOM 2171 OD1 ASN B 76 4.762 6.676 9.293 1.00 0.00 O ATOM 2172 ND2 ASN B 76 6.735 6.006 10.114 1.00 0.00 N ATOM 0 H ASN B 76 8.364 5.172 8.096 1.00 0.00 H new ATOM 0 HA ASN B 76 6.050 5.903 6.450 1.00 0.00 H new ATOM 0 HB2 ASN B 76 7.647 7.649 8.366 1.00 0.00 H new ATOM 0 HB3 ASN B 76 6.107 8.040 7.627 1.00 0.00 H new ATOM 0 HD21 ASN B 76 6.299 5.578 10.931 1.00 0.00 H new ATOM 0 HD22 ASN B 76 7.748 5.972 9.999 1.00 0.00 H new ATOM 2179 N PHE B 77 7.466 6.733 4.565 1.00 0.00 N ATOM 2180 CA PHE B 77 8.169 7.365 3.455 1.00 0.00 C ATOM 2181 C PHE B 77 7.673 8.796 3.314 1.00 0.00 C ATOM 2182 O PHE B 77 6.490 9.016 3.071 1.00 0.00 O ATOM 2183 CB PHE B 77 7.928 6.597 2.154 1.00 0.00 C ATOM 2184 CG PHE B 77 8.538 5.226 2.135 1.00 0.00 C ATOM 2185 CD1 PHE B 77 9.888 5.053 2.378 1.00 0.00 C ATOM 2186 CD2 PHE B 77 7.762 4.112 1.862 1.00 0.00 C ATOM 2187 CE1 PHE B 77 10.455 3.793 2.351 1.00 0.00 C ATOM 2188 CE2 PHE B 77 8.322 2.851 1.833 1.00 0.00 C ATOM 2189 CZ PHE B 77 9.670 2.691 2.077 1.00 0.00 C ATOM 0 H PHE B 77 6.673 6.154 4.287 1.00 0.00 H new ATOM 0 HA PHE B 77 9.240 7.359 3.657 1.00 0.00 H new ATOM 0 HB2 PHE B 77 6.854 6.508 1.990 1.00 0.00 H new ATOM 0 HB3 PHE B 77 8.331 7.175 1.322 1.00 0.00 H new ATOM 0 HD1 PHE B 77 10.506 5.912 2.591 1.00 0.00 H new ATOM 0 HD2 PHE B 77 6.706 4.231 1.669 1.00 0.00 H new ATOM 0 HE1 PHE B 77 11.511 3.671 2.544 1.00 0.00 H new ATOM 0 HE2 PHE B 77 7.705 1.990 1.619 1.00 0.00 H new ATOM 0 HZ PHE B 77 10.111 1.705 2.054 1.00 0.00 H new ATOM 2199 N HIS B 78 8.567 9.761 3.447 1.00 0.00 N ATOM 2200 CA HIS B 78 8.178 11.161 3.378 1.00 0.00 C ATOM 2201 C HIS B 78 8.500 11.774 2.019 1.00 0.00 C ATOM 2202 O HIS B 78 9.652 12.026 1.690 1.00 0.00 O ATOM 2203 CB HIS B 78 8.866 11.951 4.500 1.00 0.00 C ATOM 2204 CG HIS B 78 8.552 13.416 4.499 1.00 0.00 C ATOM 2205 ND1 HIS B 78 9.488 14.399 4.733 1.00 0.00 N ATOM 2206 CD2 HIS B 78 7.382 14.062 4.275 1.00 0.00 C ATOM 2207 CE1 HIS B 78 8.872 15.584 4.645 1.00 0.00 C ATOM 2208 NE2 HIS B 78 7.593 15.434 4.369 1.00 0.00 N ATOM 0 H HIS B 78 9.563 9.603 3.603 1.00 0.00 H new ATOM 0 HA HIS B 78 7.097 11.214 3.509 1.00 0.00 H new ATOM 0 HB2 HIS B 78 8.572 11.528 5.461 1.00 0.00 H new ATOM 0 HB3 HIS B 78 9.945 11.822 4.412 1.00 0.00 H new ATOM 0 HD1 HIS B 78 10.476 14.250 4.937 1.00 0.00 H new ATOM 0 HD2 HIS B 78 6.436 13.587 4.058 1.00 0.00 H new ATOM 0 HE1 HIS B 78 9.360 16.538 4.782 1.00 0.00 H new ATOM 2216 N PHE B 79 7.467 12.025 1.246 1.00 0.00 N ATOM 2217 CA PHE B 79 7.609 12.623 -0.068 1.00 0.00 C ATOM 2218 C PHE B 79 7.693 14.134 0.110 1.00 0.00 C ATOM 2219 O PHE B 79 6.853 14.730 0.779 1.00 0.00 O ATOM 2220 CB PHE B 79 6.420 12.250 -0.959 1.00 0.00 C ATOM 2221 CG PHE B 79 6.183 10.768 -1.072 1.00 0.00 C ATOM 2222 CD1 PHE B 79 5.579 10.064 -0.042 1.00 0.00 C ATOM 2223 CD2 PHE B 79 6.560 10.080 -2.212 1.00 0.00 C ATOM 2224 CE1 PHE B 79 5.356 8.706 -0.148 1.00 0.00 C ATOM 2225 CE2 PHE B 79 6.339 8.721 -2.323 1.00 0.00 C ATOM 2226 CZ PHE B 79 5.737 8.034 -1.290 1.00 0.00 C ATOM 0 H PHE B 79 6.503 11.821 1.509 1.00 0.00 H new ATOM 0 HA PHE B 79 8.512 12.253 -0.554 1.00 0.00 H new ATOM 0 HB2 PHE B 79 5.521 12.723 -0.564 1.00 0.00 H new ATOM 0 HB3 PHE B 79 6.584 12.659 -1.956 1.00 0.00 H new ATOM 0 HD1 PHE B 79 5.279 10.585 0.855 1.00 0.00 H new ATOM 0 HD2 PHE B 79 7.033 10.612 -3.024 1.00 0.00 H new ATOM 0 HE1 PHE B 79 4.884 8.171 0.662 1.00 0.00 H new ATOM 0 HE2 PHE B 79 6.638 8.197 -3.219 1.00 0.00 H new ATOM 0 HZ PHE B 79 5.564 6.971 -1.375 1.00 0.00 H new ATOM 2236 N SER B 80 8.704 14.751 -0.467 1.00 0.00 N ATOM 2237 CA SER B 80 8.889 16.186 -0.309 1.00 0.00 C ATOM 2238 C SER B 80 8.892 16.946 -1.633 1.00 0.00 C ATOM 2239 O SER B 80 9.221 18.132 -1.661 1.00 0.00 O ATOM 2240 CB SER B 80 10.184 16.453 0.453 1.00 0.00 C ATOM 2241 OG SER B 80 10.201 15.733 1.674 1.00 0.00 O ATOM 0 H SER B 80 9.406 14.290 -1.045 1.00 0.00 H new ATOM 0 HA SER B 80 8.033 16.557 0.255 1.00 0.00 H new ATOM 0 HB2 SER B 80 11.039 16.163 -0.158 1.00 0.00 H new ATOM 0 HB3 SER B 80 10.282 17.520 0.652 1.00 0.00 H new ATOM 0 HG SER B 80 10.588 16.293 2.379 1.00 0.00 H new ATOM 2247 N ASN B 81 8.523 16.299 -2.730 1.00 0.00 N ATOM 2248 CA ASN B 81 8.473 16.985 -3.998 1.00 0.00 C ATOM 2249 C ASN B 81 7.028 17.390 -4.181 1.00 0.00 C ATOM 2250 O ASN B 81 6.360 16.880 -5.057 1.00 0.00 O ATOM 2251 CB ASN B 81 8.934 16.051 -5.124 1.00 0.00 C ATOM 2252 CG ASN B 81 8.867 16.685 -6.499 1.00 0.00 C ATOM 2253 OD1 ASN B 81 9.074 17.889 -6.659 1.00 0.00 O ATOM 2254 ND2 ASN B 81 8.560 15.877 -7.498 1.00 0.00 N ATOM 0 H ASN B 81 8.259 15.314 -2.761 1.00 0.00 H new ATOM 0 HA ASN B 81 9.132 17.853 -4.023 1.00 0.00 H new ATOM 0 HB2 ASN B 81 9.959 15.736 -4.927 1.00 0.00 H new ATOM 0 HB3 ASN B 81 8.317 15.153 -5.116 1.00 0.00 H new ATOM 0 HD21 ASN B 81 8.486 16.244 -8.447 1.00 0.00 H new ATOM 0 HD22 ASN B 81 8.397 14.886 -7.321 1.00 0.00 H new ATOM 2261 N GLU B 82 6.556 18.298 -3.311 1.00 0.00 N ATOM 2262 CA GLU B 82 5.139 18.727 -3.278 1.00 0.00 C ATOM 2263 C GLU B 82 4.514 18.973 -4.641 1.00 0.00 C ATOM 2264 O GLU B 82 3.290 18.976 -4.759 1.00 0.00 O ATOM 2265 CB GLU B 82 4.905 19.928 -2.374 1.00 0.00 C ATOM 2266 CG GLU B 82 3.739 19.713 -1.404 1.00 0.00 C ATOM 2267 CD GLU B 82 2.548 18.978 -2.028 1.00 0.00 C ATOM 2268 OE1 GLU B 82 2.592 17.724 -2.147 1.00 0.00 O ATOM 2269 OE2 GLU B 82 1.568 19.644 -2.426 1.00 0.00 O ATOM 0 H GLU B 82 7.140 18.757 -2.611 1.00 0.00 H new ATOM 0 HA GLU B 82 4.628 17.863 -2.854 1.00 0.00 H new ATOM 0 HB2 GLU B 82 5.812 20.134 -1.806 1.00 0.00 H new ATOM 0 HB3 GLU B 82 4.706 20.807 -2.987 1.00 0.00 H new ATOM 0 HG2 GLU B 82 4.094 19.147 -0.543 1.00 0.00 H new ATOM 0 HG3 GLU B 82 3.403 20.681 -1.033 1.00 0.00 H new ATOM 2276 N SER B 83 5.311 19.206 -5.663 1.00 0.00 N ATOM 2277 CA SER B 83 4.754 19.341 -6.987 1.00 0.00 C ATOM 2278 C SER B 83 3.887 18.102 -7.227 1.00 0.00 C ATOM 2279 O SER B 83 2.808 18.163 -7.817 1.00 0.00 O ATOM 2280 CB SER B 83 5.886 19.425 -8.006 1.00 0.00 C ATOM 2281 OG SER B 83 7.092 19.840 -7.378 1.00 0.00 O ATOM 0 H SER B 83 6.325 19.304 -5.604 1.00 0.00 H new ATOM 0 HA SER B 83 4.154 20.246 -7.086 1.00 0.00 H new ATOM 0 HB2 SER B 83 6.031 18.453 -8.478 1.00 0.00 H new ATOM 0 HB3 SER B 83 5.620 20.127 -8.796 1.00 0.00 H new ATOM 0 HG SER B 83 7.654 19.057 -7.199 1.00 0.00 H new ATOM 2287 N THR B 84 4.386 16.978 -6.712 1.00 0.00 N ATOM 2288 CA THR B 84 3.711 15.704 -6.792 1.00 0.00 C ATOM 2289 C THR B 84 3.579 14.980 -5.445 1.00 0.00 C ATOM 2290 O THR B 84 2.696 14.163 -5.310 1.00 0.00 O ATOM 2291 CB THR B 84 4.471 14.761 -7.698 1.00 0.00 C ATOM 2292 OG1 THR B 84 5.875 14.903 -7.459 1.00 0.00 O ATOM 2293 CG2 THR B 84 4.194 15.047 -9.145 1.00 0.00 C ATOM 0 H THR B 84 5.281 16.937 -6.224 1.00 0.00 H new ATOM 0 HA THR B 84 2.716 15.944 -7.168 1.00 0.00 H new ATOM 0 HB THR B 84 4.144 13.745 -7.477 1.00 0.00 H new ATOM 0 HG1 THR B 84 6.308 14.026 -7.523 1.00 0.00 H new ATOM 0 HG21 THR B 84 4.756 14.351 -9.768 1.00 0.00 H new ATOM 0 HG22 THR B 84 3.128 14.930 -9.341 1.00 0.00 H new ATOM 0 HG23 THR B 84 4.496 16.068 -9.378 1.00 0.00 H new ATOM 2301 N ALA B 85 4.438 15.311 -4.469 1.00 0.00 N ATOM 2302 CA ALA B 85 4.518 14.626 -3.154 1.00 0.00 C ATOM 2303 C ALA B 85 3.209 13.999 -2.706 1.00 0.00 C ATOM 2304 O ALA B 85 3.079 12.777 -2.689 1.00 0.00 O ATOM 2305 CB ALA B 85 5.027 15.577 -2.089 1.00 0.00 C ATOM 0 H ALA B 85 5.110 16.072 -4.565 1.00 0.00 H new ATOM 0 HA ALA B 85 5.222 13.805 -3.290 1.00 0.00 H new ATOM 0 HB1 ALA B 85 5.079 15.058 -1.132 1.00 0.00 H new ATOM 0 HB2 ALA B 85 6.020 15.933 -2.363 1.00 0.00 H new ATOM 0 HB3 ALA B 85 4.348 16.426 -2.005 1.00 0.00 H new ATOM 2311 N VAL B 86 2.265 14.828 -2.313 1.00 0.00 N ATOM 2312 CA VAL B 86 0.941 14.367 -1.909 1.00 0.00 C ATOM 2313 C VAL B 86 0.356 13.340 -2.877 1.00 0.00 C ATOM 2314 O VAL B 86 -0.085 12.267 -2.472 1.00 0.00 O ATOM 2315 CB VAL B 86 0.027 15.595 -1.800 1.00 0.00 C ATOM 2316 CG1 VAL B 86 -1.391 15.265 -2.218 1.00 0.00 C ATOM 2317 CG2 VAL B 86 0.027 16.141 -0.385 1.00 0.00 C ATOM 0 H VAL B 86 2.387 15.839 -2.262 1.00 0.00 H new ATOM 0 HA VAL B 86 1.022 13.859 -0.948 1.00 0.00 H new ATOM 0 HB VAL B 86 0.420 16.354 -2.476 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -2.013 16.156 -2.129 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -1.395 14.921 -3.252 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -1.787 14.480 -1.573 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -0.627 17.011 -0.331 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -0.332 15.374 0.301 1.00 0.00 H new ATOM 0 HG23 VAL B 86 1.040 16.431 -0.107 1.00 0.00 H new ATOM 2327 N LYS B 87 0.408 13.662 -4.150 1.00 0.00 N ATOM 2328 CA LYS B 87 -0.120 12.806 -5.193 1.00 0.00 C ATOM 2329 C LYS B 87 0.761 11.565 -5.355 1.00 0.00 C ATOM 2330 O LYS B 87 0.284 10.527 -5.776 1.00 0.00 O ATOM 2331 CB LYS B 87 -0.212 13.602 -6.507 1.00 0.00 C ATOM 2332 CG LYS B 87 -0.779 15.018 -6.335 1.00 0.00 C ATOM 2333 CD LYS B 87 0.310 16.043 -6.000 1.00 0.00 C ATOM 2334 CE LYS B 87 -0.238 17.227 -5.206 1.00 0.00 C ATOM 2335 NZ LYS B 87 0.839 17.978 -4.488 1.00 0.00 N ATOM 0 H LYS B 87 0.820 14.529 -4.495 1.00 0.00 H new ATOM 0 HA LYS B 87 -1.120 12.468 -4.921 1.00 0.00 H new ATOM 0 HB2 LYS B 87 0.782 13.670 -6.950 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -0.838 13.053 -7.210 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -1.287 15.317 -7.252 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -1.527 15.014 -5.542 1.00 0.00 H new ATOM 0 HD2 LYS B 87 1.100 15.557 -5.427 1.00 0.00 H new ATOM 0 HD3 LYS B 87 0.763 16.405 -6.923 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -0.761 17.904 -5.882 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -0.971 16.869 -4.484 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 0.408 18.673 -3.846 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 1.419 17.312 -3.939 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 1.439 18.471 -5.180 1.00 0.00 H new ATOM 2349 N GLU B 88 2.042 11.688 -5.011 1.00 0.00 N ATOM 2350 CA GLU B 88 2.982 10.571 -5.082 1.00 0.00 C ATOM 2351 C GLU B 88 2.644 9.566 -3.997 1.00 0.00 C ATOM 2352 O GLU B 88 2.480 8.379 -4.262 1.00 0.00 O ATOM 2353 CB GLU B 88 4.422 11.047 -4.882 1.00 0.00 C ATOM 2354 CG GLU B 88 4.962 11.902 -6.010 1.00 0.00 C ATOM 2355 CD GLU B 88 6.294 12.545 -5.660 1.00 0.00 C ATOM 2356 OE1 GLU B 88 6.540 12.799 -4.463 1.00 0.00 O ATOM 2357 OE2 GLU B 88 7.086 12.809 -6.590 1.00 0.00 O ATOM 0 H GLU B 88 2.455 12.559 -4.677 1.00 0.00 H new ATOM 0 HA GLU B 88 2.899 10.115 -6.069 1.00 0.00 H new ATOM 0 HB2 GLU B 88 4.478 11.615 -3.953 1.00 0.00 H new ATOM 0 HB3 GLU B 88 5.066 10.176 -4.762 1.00 0.00 H new ATOM 0 HG2 GLU B 88 5.081 11.288 -6.903 1.00 0.00 H new ATOM 0 HG3 GLU B 88 4.238 12.680 -6.252 1.00 0.00 H new ATOM 2364 N ARG B 89 2.549 10.064 -2.767 1.00 0.00 N ATOM 2365 CA ARG B 89 2.203 9.238 -1.620 1.00 0.00 C ATOM 2366 C ARG B 89 0.869 8.574 -1.873 1.00 0.00 C ATOM 2367 O ARG B 89 0.710 7.369 -1.686 1.00 0.00 O ATOM 2368 CB ARG B 89 2.122 10.093 -0.359 1.00 0.00 C ATOM 2369 CG ARG B 89 1.308 9.480 0.768 1.00 0.00 C ATOM 2370 CD ARG B 89 0.691 10.554 1.649 1.00 0.00 C ATOM 2371 NE ARG B 89 -0.330 11.332 0.944 1.00 0.00 N ATOM 2372 CZ ARG B 89 -0.577 12.625 1.167 1.00 0.00 C ATOM 2373 NH1 ARG B 89 0.115 13.298 2.079 1.00 0.00 N ATOM 2374 NH2 ARG B 89 -1.531 13.236 0.483 1.00 0.00 N ATOM 0 H ARG B 89 2.709 11.046 -2.541 1.00 0.00 H new ATOM 0 HA ARG B 89 2.972 8.479 -1.478 1.00 0.00 H new ATOM 0 HB2 ARG B 89 3.133 10.282 0.002 1.00 0.00 H new ATOM 0 HB3 ARG B 89 1.690 11.060 -0.618 1.00 0.00 H new ATOM 0 HG2 ARG B 89 0.521 8.852 0.351 1.00 0.00 H new ATOM 0 HG3 ARG B 89 1.946 8.834 1.371 1.00 0.00 H new ATOM 0 HD2 ARG B 89 0.247 10.088 2.529 1.00 0.00 H new ATOM 0 HD3 ARG B 89 1.474 11.224 2.004 1.00 0.00 H new ATOM 0 HE ARG B 89 -0.889 10.855 0.237 1.00 0.00 H new ATOM 0 HH11 ARG B 89 0.843 12.827 2.617 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -0.081 14.286 2.242 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -2.073 12.719 -0.210 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -1.725 14.224 0.649 1.00 0.00 H new ATOM 2388 N ASP B 90 -0.081 9.381 -2.310 1.00 0.00 N ATOM 2389 CA ASP B 90 -1.409 8.901 -2.620 1.00 0.00 C ATOM 2390 C ASP B 90 -1.390 7.920 -3.777 1.00 0.00 C ATOM 2391 O ASP B 90 -2.164 6.969 -3.793 1.00 0.00 O ATOM 2392 CB ASP B 90 -2.345 10.071 -2.912 1.00 0.00 C ATOM 2393 CG ASP B 90 -3.075 10.518 -1.667 1.00 0.00 C ATOM 2394 OD1 ASP B 90 -4.003 9.794 -1.241 1.00 0.00 O ATOM 2395 OD2 ASP B 90 -2.711 11.569 -1.101 1.00 0.00 O ATOM 0 H ASP B 90 0.048 10.382 -2.458 1.00 0.00 H new ATOM 0 HA ASP B 90 -1.784 8.368 -1.747 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -1.772 10.904 -3.318 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -3.068 9.779 -3.674 1.00 0.00 H new ATOM 2400 N ALA B 91 -0.484 8.132 -4.716 1.00 0.00 N ATOM 2401 CA ALA B 91 -0.365 7.250 -5.881 1.00 0.00 C ATOM 2402 C ALA B 91 0.209 5.920 -5.469 1.00 0.00 C ATOM 2403 O ALA B 91 -0.294 4.856 -5.834 1.00 0.00 O ATOM 2404 CB ALA B 91 0.543 7.863 -6.923 1.00 0.00 C ATOM 0 H ALA B 91 0.182 8.904 -4.701 1.00 0.00 H new ATOM 0 HA ALA B 91 -1.362 7.113 -6.301 1.00 0.00 H new ATOM 0 HB1 ALA B 91 0.618 7.193 -7.780 1.00 0.00 H new ATOM 0 HB2 ALA B 91 0.133 8.820 -7.246 1.00 0.00 H new ATOM 0 HB3 ALA B 91 1.534 8.019 -6.496 1.00 0.00 H new ATOM 2410 N VAL B 92 1.281 6.007 -4.714 1.00 0.00 N ATOM 2411 CA VAL B 92 1.967 4.852 -4.206 1.00 0.00 C ATOM 2412 C VAL B 92 0.991 4.042 -3.379 1.00 0.00 C ATOM 2413 O VAL B 92 0.885 2.833 -3.529 1.00 0.00 O ATOM 2414 CB VAL B 92 3.159 5.312 -3.357 1.00 0.00 C ATOM 2415 CG1 VAL B 92 3.562 4.276 -2.333 1.00 0.00 C ATOM 2416 CG2 VAL B 92 4.334 5.663 -4.243 1.00 0.00 C ATOM 0 H VAL B 92 1.701 6.894 -4.435 1.00 0.00 H new ATOM 0 HA VAL B 92 2.343 4.232 -5.019 1.00 0.00 H new ATOM 0 HB VAL B 92 2.844 6.202 -2.812 1.00 0.00 H new ATOM 0 HG11 VAL B 92 4.409 4.646 -1.756 1.00 0.00 H new ATOM 0 HG12 VAL B 92 2.724 4.081 -1.664 1.00 0.00 H new ATOM 0 HG13 VAL B 92 3.843 3.353 -2.840 1.00 0.00 H new ATOM 0 HG21 VAL B 92 5.171 5.987 -3.625 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.628 4.787 -4.822 1.00 0.00 H new ATOM 0 HG23 VAL B 92 4.051 6.468 -4.921 1.00 0.00 H new ATOM 2426 N LYS B 93 0.252 4.755 -2.545 1.00 0.00 N ATOM 2427 CA LYS B 93 -0.764 4.169 -1.694 1.00 0.00 C ATOM 2428 C LYS B 93 -1.822 3.507 -2.541 1.00 0.00 C ATOM 2429 O LYS B 93 -2.242 2.390 -2.263 1.00 0.00 O ATOM 2430 CB LYS B 93 -1.417 5.278 -0.863 1.00 0.00 C ATOM 2431 CG LYS B 93 -2.707 4.865 -0.164 1.00 0.00 C ATOM 2432 CD LYS B 93 -3.929 5.102 -1.046 1.00 0.00 C ATOM 2433 CE LYS B 93 -4.444 6.521 -0.940 1.00 0.00 C ATOM 2434 NZ LYS B 93 -4.467 7.217 -2.256 1.00 0.00 N ATOM 0 H LYS B 93 0.343 5.766 -2.441 1.00 0.00 H new ATOM 0 HA LYS B 93 -0.305 3.427 -1.041 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -0.705 5.620 -0.112 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -1.626 6.127 -1.514 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -2.653 3.810 0.106 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -2.814 5.427 0.764 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -3.673 4.887 -2.083 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -4.720 4.408 -0.762 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -5.450 6.509 -0.521 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -3.817 7.081 -0.247 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -4.779 8.200 -2.123 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -3.513 7.209 -2.670 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -5.126 6.728 -2.896 1.00 0.00 H new ATOM 2448 N ASP B 94 -2.262 4.225 -3.564 1.00 0.00 N ATOM 2449 CA ASP B 94 -3.297 3.724 -4.439 1.00 0.00 C ATOM 2450 C ASP B 94 -2.895 2.372 -4.999 1.00 0.00 C ATOM 2451 O ASP B 94 -3.636 1.394 -4.897 1.00 0.00 O ATOM 2452 CB ASP B 94 -3.581 4.700 -5.576 1.00 0.00 C ATOM 2453 CG ASP B 94 -4.674 5.688 -5.218 1.00 0.00 C ATOM 2454 OD1 ASP B 94 -5.294 5.530 -4.137 1.00 0.00 O ATOM 2455 OD2 ASP B 94 -4.909 6.627 -5.998 1.00 0.00 O ATOM 0 H ASP B 94 -1.916 5.154 -3.803 1.00 0.00 H new ATOM 0 HA ASP B 94 -4.210 3.614 -3.854 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -2.669 5.243 -5.824 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -3.873 4.144 -6.467 1.00 0.00 H new ATOM 2460 N LEU B 95 -1.692 2.331 -5.560 1.00 0.00 N ATOM 2461 CA LEU B 95 -1.141 1.112 -6.131 1.00 0.00 C ATOM 2462 C LEU B 95 -0.930 0.067 -5.043 1.00 0.00 C ATOM 2463 O LEU B 95 -1.328 -1.086 -5.191 1.00 0.00 O ATOM 2464 CB LEU B 95 0.172 1.421 -6.857 1.00 0.00 C ATOM 2465 CG LEU B 95 0.130 1.254 -8.381 1.00 0.00 C ATOM 2466 CD1 LEU B 95 -1.231 1.654 -8.936 1.00 0.00 C ATOM 2467 CD2 LEU B 95 1.223 2.082 -9.034 1.00 0.00 C ATOM 0 H LEU B 95 -1.075 3.140 -5.631 1.00 0.00 H new ATOM 0 HA LEU B 95 -1.847 0.707 -6.856 1.00 0.00 H new ATOM 0 HB2 LEU B 95 0.463 2.446 -6.628 1.00 0.00 H new ATOM 0 HB3 LEU B 95 0.951 0.772 -6.458 1.00 0.00 H new ATOM 0 HG LEU B 95 0.298 0.202 -8.610 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -1.234 1.526 -10.018 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -2.003 1.025 -8.494 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -1.430 2.698 -8.693 1.00 0.00 H new ATOM 0 HD21 LEU B 95 1.180 1.953 -10.115 1.00 0.00 H new ATOM 0 HD22 LEU B 95 1.079 3.134 -8.788 1.00 0.00 H new ATOM 0 HD23 LEU B 95 2.196 1.754 -8.668 1.00 0.00 H new ATOM 2479 N LEU B 96 -0.331 0.497 -3.944 1.00 0.00 N ATOM 2480 CA LEU B 96 -0.053 -0.367 -2.803 1.00 0.00 C ATOM 2481 C LEU B 96 -1.312 -1.070 -2.317 1.00 0.00 C ATOM 2482 O LEU B 96 -1.380 -2.296 -2.287 1.00 0.00 O ATOM 2483 CB LEU B 96 0.543 0.477 -1.683 1.00 0.00 C ATOM 2484 CG LEU B 96 2.046 0.677 -1.781 1.00 0.00 C ATOM 2485 CD1 LEU B 96 2.522 1.632 -0.707 1.00 0.00 C ATOM 2486 CD2 LEU B 96 2.768 -0.653 -1.684 1.00 0.00 C ATOM 0 H LEU B 96 -0.021 1.460 -3.816 1.00 0.00 H new ATOM 0 HA LEU B 96 0.654 -1.138 -3.109 1.00 0.00 H new ATOM 0 HB2 LEU B 96 0.058 1.453 -1.682 1.00 0.00 H new ATOM 0 HB3 LEU B 96 0.313 0.006 -0.727 1.00 0.00 H new ATOM 0 HG LEU B 96 2.276 1.115 -2.752 1.00 0.00 H new ATOM 0 HD11 LEU B 96 3.601 1.765 -0.790 1.00 0.00 H new ATOM 0 HD12 LEU B 96 2.027 2.595 -0.831 1.00 0.00 H new ATOM 0 HD13 LEU B 96 2.282 1.224 0.275 1.00 0.00 H new ATOM 0 HD21 LEU B 96 3.843 -0.489 -1.756 1.00 0.00 H new ATOM 0 HD22 LEU B 96 2.536 -1.124 -0.729 1.00 0.00 H new ATOM 0 HD23 LEU B 96 2.444 -1.303 -2.497 1.00 0.00 H new ATOM 2498 N GLN B 97 -2.301 -0.273 -1.952 1.00 0.00 N ATOM 2499 CA GLN B 97 -3.582 -0.762 -1.468 1.00 0.00 C ATOM 2500 C GLN B 97 -4.223 -1.774 -2.425 1.00 0.00 C ATOM 2501 O GLN B 97 -4.707 -2.817 -1.996 1.00 0.00 O ATOM 2502 CB GLN B 97 -4.500 0.439 -1.222 1.00 0.00 C ATOM 2503 CG GLN B 97 -5.975 0.195 -1.467 1.00 0.00 C ATOM 2504 CD GLN B 97 -6.676 1.436 -1.988 1.00 0.00 C ATOM 2505 OE1 GLN B 97 -7.832 1.695 -1.667 1.00 0.00 O ATOM 2506 NE2 GLN B 97 -5.977 2.213 -2.808 1.00 0.00 N ATOM 0 H GLN B 97 -2.237 0.745 -1.983 1.00 0.00 H new ATOM 0 HA GLN B 97 -3.422 -1.302 -0.535 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -4.371 0.768 -0.191 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -4.174 1.260 -1.861 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -6.094 -0.617 -2.184 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -6.449 -0.127 -0.539 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -5.018 1.965 -3.052 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -6.399 3.058 -3.194 1.00 0.00 H new ATOM 2515 N GLN B 98 -4.176 -1.483 -3.716 1.00 0.00 N ATOM 2516 CA GLN B 98 -4.788 -2.346 -4.727 1.00 0.00 C ATOM 2517 C GLN B 98 -3.982 -3.614 -5.011 1.00 0.00 C ATOM 2518 O GLN B 98 -4.553 -4.663 -5.307 1.00 0.00 O ATOM 2519 CB GLN B 98 -4.971 -1.571 -6.029 1.00 0.00 C ATOM 2520 CG GLN B 98 -6.060 -0.513 -5.961 1.00 0.00 C ATOM 2521 CD GLN B 98 -5.961 0.504 -7.082 1.00 0.00 C ATOM 2522 OE1 GLN B 98 -5.531 0.187 -8.190 1.00 0.00 O ATOM 2523 NE2 GLN B 98 -6.355 1.735 -6.798 1.00 0.00 N ATOM 0 H GLN B 98 -3.719 -0.653 -4.094 1.00 0.00 H new ATOM 0 HA GLN B 98 -5.750 -2.659 -4.321 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -4.028 -1.093 -6.293 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -5.207 -2.272 -6.829 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -7.035 -0.998 -6.002 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -6.000 0.002 -5.002 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -6.705 1.956 -5.866 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -6.308 2.463 -7.511 1.00 0.00 H new ATOM 2532 N LEU B 99 -2.664 -3.523 -4.925 1.00 0.00 N ATOM 2533 CA LEU B 99 -1.804 -4.663 -5.227 1.00 0.00 C ATOM 2534 C LEU B 99 -1.506 -5.528 -4.006 1.00 0.00 C ATOM 2535 O LEU B 99 -1.029 -6.656 -4.146 1.00 0.00 O ATOM 2536 CB LEU B 99 -0.505 -4.171 -5.852 1.00 0.00 C ATOM 2537 CG LEU B 99 -0.669 -3.504 -7.216 1.00 0.00 C ATOM 2538 CD1 LEU B 99 0.402 -2.451 -7.417 1.00 0.00 C ATOM 2539 CD2 LEU B 99 -0.613 -4.543 -8.324 1.00 0.00 C ATOM 0 H LEU B 99 -2.166 -2.677 -4.650 1.00 0.00 H new ATOM 0 HA LEU B 99 -2.345 -5.296 -5.930 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -0.034 -3.463 -5.170 1.00 0.00 H new ATOM 0 HB3 LEU B 99 0.176 -5.016 -5.955 1.00 0.00 H new ATOM 0 HG LEU B 99 -1.643 -3.017 -7.252 1.00 0.00 H new ATOM 0 HD11 LEU B 99 0.274 -1.983 -8.393 1.00 0.00 H new ATOM 0 HD12 LEU B 99 0.318 -1.693 -6.638 1.00 0.00 H new ATOM 0 HD13 LEU B 99 1.386 -2.918 -7.365 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -0.731 -4.052 -9.290 1.00 0.00 H new ATOM 0 HD22 LEU B 99 0.348 -5.056 -8.293 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -1.416 -5.267 -8.185 1.00 0.00 H new ATOM 2551 N LEU B 100 -1.777 -5.004 -2.820 1.00 0.00 N ATOM 2552 CA LEU B 100 -1.544 -5.743 -1.578 1.00 0.00 C ATOM 2553 C LEU B 100 -2.241 -7.106 -1.570 1.00 0.00 C ATOM 2554 O LEU B 100 -1.590 -8.130 -1.340 1.00 0.00 O ATOM 2555 CB LEU B 100 -2.002 -4.930 -0.375 1.00 0.00 C ATOM 2556 CG LEU B 100 -0.945 -4.036 0.247 1.00 0.00 C ATOM 2557 CD1 LEU B 100 -1.580 -3.168 1.324 1.00 0.00 C ATOM 2558 CD2 LEU B 100 0.184 -4.892 0.808 1.00 0.00 C ATOM 0 H LEU B 100 -2.160 -4.068 -2.686 1.00 0.00 H new ATOM 0 HA LEU B 100 -0.470 -5.917 -1.516 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -2.846 -4.310 -0.677 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -2.368 -5.617 0.388 1.00 0.00 H new ATOM 0 HG LEU B 100 -0.521 -3.376 -0.510 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -0.820 -2.527 1.770 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -2.361 -2.550 0.880 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -2.015 -3.804 2.095 1.00 0.00 H new ATOM 0 HD21 LEU B 100 0.942 -4.248 1.254 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -0.213 -5.565 1.568 1.00 0.00 H new ATOM 0 HD23 LEU B 100 0.632 -5.476 0.004 1.00 0.00 H new ATOM 2570 N PRO B 101 -3.567 -7.158 -1.827 1.00 0.00 N ATOM 2571 CA PRO B 101 -4.317 -8.418 -1.840 1.00 0.00 C ATOM 2572 C PRO B 101 -3.827 -9.397 -2.904 1.00 0.00 C ATOM 2573 O PRO B 101 -4.332 -10.505 -3.004 1.00 0.00 O ATOM 2574 CB PRO B 101 -5.755 -7.991 -2.144 1.00 0.00 C ATOM 2575 CG PRO B 101 -5.635 -6.641 -2.751 1.00 0.00 C ATOM 2576 CD PRO B 101 -4.451 -6.009 -2.096 1.00 0.00 C ATOM 0 HA PRO B 101 -4.203 -8.948 -0.894 1.00 0.00 H new ATOM 0 HB2 PRO B 101 -6.238 -8.689 -2.827 1.00 0.00 H new ATOM 0 HB3 PRO B 101 -6.359 -7.964 -1.237 1.00 0.00 H new ATOM 0 HG2 PRO B 101 -5.497 -6.708 -3.830 1.00 0.00 H new ATOM 0 HG3 PRO B 101 -6.537 -6.053 -2.581 1.00 0.00 H new ATOM 0 HD2 PRO B 101 -3.973 -5.276 -2.746 1.00 0.00 H new ATOM 0 HD3 PRO B 101 -4.727 -5.489 -1.179 1.00 0.00 H new ATOM 2584 N LYS B 102 -2.853 -8.988 -3.703 1.00 0.00 N ATOM 2585 CA LYS B 102 -2.315 -9.857 -4.731 1.00 0.00 C ATOM 2586 C LYS B 102 -1.086 -10.598 -4.216 1.00 0.00 C ATOM 2587 O LYS B 102 -0.676 -11.605 -4.796 1.00 0.00 O ATOM 2588 CB LYS B 102 -1.951 -9.061 -5.994 1.00 0.00 C ATOM 2589 CG LYS B 102 -1.853 -9.925 -7.245 1.00 0.00 C ATOM 2590 CD LYS B 102 -0.529 -9.723 -7.992 1.00 0.00 C ATOM 2591 CE LYS B 102 -0.469 -8.391 -8.743 1.00 0.00 C ATOM 2592 NZ LYS B 102 0.837 -8.197 -9.457 1.00 0.00 N ATOM 0 H LYS B 102 -2.423 -8.064 -3.658 1.00 0.00 H new ATOM 0 HA LYS B 102 -3.087 -10.582 -4.989 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -2.700 -8.286 -6.154 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -0.998 -8.556 -5.834 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -1.954 -10.974 -6.968 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -2.683 -9.690 -7.912 1.00 0.00 H new ATOM 0 HD2 LYS B 102 0.295 -9.771 -7.280 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -0.388 -10.540 -8.699 1.00 0.00 H new ATOM 0 HE2 LYS B 102 -1.285 -8.346 -9.464 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -0.621 -7.573 -8.039 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 0.929 -7.203 -9.748 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 1.621 -8.446 -8.820 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 0.867 -8.808 -10.298 1.00 0.00 H new ATOM 2606 N PHE B 103 -0.504 -10.118 -3.118 1.00 0.00 N ATOM 2607 CA PHE B 103 0.688 -10.747 -2.582 1.00 0.00 C ATOM 2608 C PHE B 103 0.523 -11.199 -1.149 1.00 0.00 C ATOM 2609 O PHE B 103 1.239 -12.098 -0.711 1.00 0.00 O ATOM 2610 CB PHE B 103 1.894 -9.834 -2.750 1.00 0.00 C ATOM 2611 CG PHE B 103 2.260 -9.691 -4.191 1.00 0.00 C ATOM 2612 CD1 PHE B 103 2.861 -10.738 -4.866 1.00 0.00 C ATOM 2613 CD2 PHE B 103 1.957 -8.534 -4.882 1.00 0.00 C ATOM 2614 CE1 PHE B 103 3.154 -10.634 -6.208 1.00 0.00 C ATOM 2615 CE2 PHE B 103 2.256 -8.420 -6.222 1.00 0.00 C ATOM 2616 CZ PHE B 103 2.853 -9.473 -6.887 1.00 0.00 C ATOM 0 H PHE B 103 -0.836 -9.309 -2.594 1.00 0.00 H new ATOM 0 HA PHE B 103 0.859 -11.655 -3.160 1.00 0.00 H new ATOM 0 HB2 PHE B 103 1.674 -8.853 -2.328 1.00 0.00 H new ATOM 0 HB3 PHE B 103 2.740 -10.238 -2.194 1.00 0.00 H new ATOM 0 HD1 PHE B 103 3.103 -11.647 -4.335 1.00 0.00 H new ATOM 0 HD2 PHE B 103 1.482 -7.712 -4.368 1.00 0.00 H new ATOM 0 HE1 PHE B 103 3.618 -11.460 -6.727 1.00 0.00 H new ATOM 0 HE2 PHE B 103 2.024 -7.508 -6.752 1.00 0.00 H new ATOM 0 HZ PHE B 103 3.084 -9.387 -7.939 1.00 0.00 H new ATOM 2626 N LYS B 104 -0.412 -10.603 -0.418 1.00 0.00 N ATOM 2627 CA LYS B 104 -0.623 -11.004 0.961 1.00 0.00 C ATOM 2628 C LYS B 104 -0.958 -12.497 1.009 1.00 0.00 C ATOM 2629 O LYS B 104 -1.862 -12.975 0.315 1.00 0.00 O ATOM 2630 CB LYS B 104 -1.677 -10.131 1.655 1.00 0.00 C ATOM 2631 CG LYS B 104 -3.118 -10.381 1.239 1.00 0.00 C ATOM 2632 CD LYS B 104 -4.068 -9.405 1.931 1.00 0.00 C ATOM 2633 CE LYS B 104 -3.616 -9.084 3.354 1.00 0.00 C ATOM 2634 NZ LYS B 104 -4.658 -8.365 4.134 1.00 0.00 N ATOM 0 H LYS B 104 -1.022 -9.857 -0.751 1.00 0.00 H new ATOM 0 HA LYS B 104 0.296 -10.847 1.525 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -1.597 -10.284 2.731 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -1.439 -9.085 1.463 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -3.211 -10.278 0.158 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -3.399 -11.404 1.487 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -4.127 -8.483 1.352 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -5.071 -9.831 1.956 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -3.357 -10.010 3.867 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -2.711 -8.477 3.316 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -4.210 -7.625 4.712 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -5.341 -7.929 3.482 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -5.153 -9.037 4.754 1.00 0.00 H new