USER MOD reduce.3.24.130724 H: found=0, std=0, add=731, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 733 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: A 505 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.442) USER MOD Set 1.2: A 514 SER OG : rot -80:sc= -1.97 USER MOD Set 2.1: A 469 THR OG1 : rot 98:sc= -0.18 USER MOD Set 2.2: A 470 THR OG1 : rot -100:sc= -0.958 USER MOD Single : A 453 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 455 THR OG1 : rot 180:sc= 0 USER MOD Single : A 462 TYR OH : rot 180:sc= 0 USER MOD Single : A 464 THR OG1 : rot 39:sc= 0.141 USER MOD Single : A 466 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 468 MET CE :methyl -159:sc= -5.88! (180deg=-7.13!) USER MOD Single : A 471 LYS NZ :NH3+ 158:sc=-0.00633 (180deg=-0.706) USER MOD Single : A 475 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0501) USER MOD Single : A 476 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 478 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 479 THR OG1 : rot -64:sc= 1.15 USER MOD Single : A 480 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 481 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 482 THR OG1 : rot 110:sc= -0.604 USER MOD Single : A 485 SER OG : rot 180:sc= -0.209 USER MOD Single : A 486 SER OG : rot 180:sc= 0 USER MOD Single : A 488 GLN : amide:sc= -0.0575 K(o=-0.057,f=-0.68) USER MOD Single : A 489 THR OG1 : rot 73:sc= 1.17 USER MOD Single : A 491 ASN : amide:sc= -0.231 X(o=-0.23,f=-0.071) USER MOD Single : A 495 GLN : amide:sc= -1.12 X(o=-1.1,f=-1) USER MOD Single : A 498 LYS NZ :NH3+ 161:sc= -0.764 (180deg=-1.67) USER MOD Single : A 501 ASN : amide:sc= -0.245 X(o=-0.24,f=-0.15) USER MOD Single : A 506 MET CE :methyl 179:sc= 0 (180deg=-0.0017) USER MOD Single : A 508 ASN : amide:sc= -0.133 X(o=-0.13,f=-0.14) USER MOD Single : A 510 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 511 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 512 HIS : no HE2:sc= -1.83 X(o=-1.8,f=-2.3!) USER MOD Single : A 516 LYS NZ :NH3+ 168:sc=-0.00209 (180deg=-0.122) USER MOD Single : B 942 SER OG : rot 180:sc= 0 USER MOD Single : B 943 SER OG : rot 180:sc= 0 USER MOD Single : B 944 SER OG : rot 10:sc= 0.288 USER MOD Single : B 949 MET CE :methyl 138:sc= -7.09! (180deg=-11.6!) USER MOD Single : B 951 LYS NZ :NH3+ -107:sc= 1 (180deg=-1.07) USER MOD Single : B 958 ASN : amide:sc= -0.585 X(o=-0.59,f=-0.54) USER MOD Single : B 961 MET CE :methyl -148:sc= -0.44 (180deg=-1.41!) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 451 -18.615 11.169 4.146 1.00 0.00 N ATOM 2 CA ASP A 451 -17.144 11.127 3.934 1.00 0.00 C ATOM 3 C ASP A 451 -16.721 9.837 3.239 1.00 0.00 C ATOM 4 O ASP A 451 -17.542 8.950 3.003 1.00 0.00 O ATOM 5 CB ASP A 451 -16.453 11.247 5.294 1.00 0.00 C ATOM 6 CG ASP A 451 -16.857 10.140 6.249 1.00 0.00 C ATOM 7 OD1 ASP A 451 -17.456 9.146 5.788 1.00 0.00 O ATOM 8 OD2 ASP A 451 -16.575 10.269 7.460 1.00 0.00 O ATOM 0 HA ASP A 451 -16.852 11.956 3.289 1.00 0.00 H new ATOM 0 HB2 ASP A 451 -15.372 11.224 5.152 1.00 0.00 H new ATOM 0 HB3 ASP A 451 -16.696 12.212 5.738 1.00 0.00 H new ATOM 13 N VAL A 452 -15.437 9.740 2.912 1.00 0.00 N ATOM 14 CA VAL A 452 -14.904 8.559 2.244 1.00 0.00 C ATOM 15 C VAL A 452 -13.834 7.882 3.094 1.00 0.00 C ATOM 16 O VAL A 452 -13.030 8.550 3.744 1.00 0.00 O ATOM 17 CB VAL A 452 -14.305 8.913 0.870 1.00 0.00 C ATOM 18 CG1 VAL A 452 -13.927 7.650 0.110 1.00 0.00 C ATOM 19 CG2 VAL A 452 -15.280 9.757 0.064 1.00 0.00 C ATOM 0 H VAL A 452 -14.746 10.466 3.099 1.00 0.00 H new ATOM 0 HA VAL A 452 -15.739 7.873 2.102 1.00 0.00 H new ATOM 0 HB VAL A 452 -13.399 9.498 1.029 1.00 0.00 H new ATOM 0 HG11 VAL A 452 -13.506 7.920 -0.858 1.00 0.00 H new ATOM 0 HG12 VAL A 452 -13.189 7.088 0.683 1.00 0.00 H new ATOM 0 HG13 VAL A 452 -14.815 7.036 -0.040 1.00 0.00 H new ATOM 0 HG21 VAL A 452 -14.840 9.997 -0.904 1.00 0.00 H new ATOM 0 HG22 VAL A 452 -16.205 9.200 -0.087 1.00 0.00 H new ATOM 0 HG23 VAL A 452 -15.495 10.679 0.604 1.00 0.00 H new ATOM 29 N GLN A 453 -13.830 6.553 3.083 1.00 0.00 N ATOM 30 CA GLN A 453 -12.858 5.785 3.854 1.00 0.00 C ATOM 31 C GLN A 453 -12.145 4.766 2.971 1.00 0.00 C ATOM 32 O GLN A 453 -12.537 4.542 1.825 1.00 0.00 O ATOM 33 CB GLN A 453 -13.547 5.074 5.021 1.00 0.00 C ATOM 34 CG GLN A 453 -14.572 4.041 4.584 1.00 0.00 C ATOM 35 CD GLN A 453 -15.171 3.285 5.754 1.00 0.00 C ATOM 36 OE1 GLN A 453 -14.751 3.454 6.899 1.00 0.00 O ATOM 37 NE2 GLN A 453 -16.159 2.443 5.471 1.00 0.00 N ATOM 0 H GLN A 453 -14.488 5.985 2.549 1.00 0.00 H new ATOM 0 HA GLN A 453 -12.116 6.479 4.248 1.00 0.00 H new ATOM 0 HB2 GLN A 453 -12.791 4.586 5.636 1.00 0.00 H new ATOM 0 HB3 GLN A 453 -14.038 5.817 5.650 1.00 0.00 H new ATOM 0 HG2 GLN A 453 -15.369 4.537 4.030 1.00 0.00 H new ATOM 0 HG3 GLN A 453 -14.101 3.334 3.901 1.00 0.00 H new ATOM 0 HE21 GLN A 453 -16.476 2.334 4.508 1.00 0.00 H new ATOM 0 HE22 GLN A 453 -16.601 1.906 6.217 1.00 0.00 H new ATOM 46 N VAL A 454 -11.097 4.153 3.511 1.00 0.00 N ATOM 47 CA VAL A 454 -10.329 3.159 2.771 1.00 0.00 C ATOM 48 C VAL A 454 -10.784 1.745 3.116 1.00 0.00 C ATOM 49 O VAL A 454 -11.044 1.430 4.277 1.00 0.00 O ATOM 50 CB VAL A 454 -8.821 3.285 3.061 1.00 0.00 C ATOM 51 CG1 VAL A 454 -8.021 2.369 2.147 1.00 0.00 C ATOM 52 CG2 VAL A 454 -8.368 4.729 2.912 1.00 0.00 C ATOM 0 H VAL A 454 -10.760 4.327 4.458 1.00 0.00 H new ATOM 0 HA VAL A 454 -10.505 3.347 1.712 1.00 0.00 H new ATOM 0 HB VAL A 454 -8.641 2.977 4.091 1.00 0.00 H new ATOM 0 HG11 VAL A 454 -6.959 2.473 2.367 1.00 0.00 H new ATOM 0 HG12 VAL A 454 -8.326 1.335 2.310 1.00 0.00 H new ATOM 0 HG13 VAL A 454 -8.204 2.642 1.108 1.00 0.00 H new ATOM 0 HG21 VAL A 454 -7.300 4.799 3.121 1.00 0.00 H new ATOM 0 HG22 VAL A 454 -8.562 5.068 1.894 1.00 0.00 H new ATOM 0 HG23 VAL A 454 -8.917 5.357 3.614 1.00 0.00 H new ATOM 62 N THR A 455 -10.878 0.895 2.097 1.00 0.00 N ATOM 63 CA THR A 455 -11.302 -0.487 2.289 1.00 0.00 C ATOM 64 C THR A 455 -10.242 -1.457 1.778 1.00 0.00 C ATOM 65 O THR A 455 -9.573 -1.191 0.780 1.00 0.00 O ATOM 66 CB THR A 455 -12.629 -0.740 1.573 1.00 0.00 C ATOM 67 OG1 THR A 455 -13.612 0.189 1.995 1.00 0.00 O ATOM 68 CG2 THR A 455 -13.180 -2.130 1.807 1.00 0.00 C ATOM 0 H THR A 455 -10.666 1.140 1.130 1.00 0.00 H new ATOM 0 HA THR A 455 -11.437 -0.654 3.358 1.00 0.00 H new ATOM 0 HB THR A 455 -12.410 -0.628 0.511 1.00 0.00 H new ATOM 0 HG1 THR A 455 -14.453 0.012 1.524 1.00 0.00 H new ATOM 0 HG21 THR A 455 -14.122 -2.243 1.271 1.00 0.00 H new ATOM 0 HG22 THR A 455 -12.466 -2.870 1.446 1.00 0.00 H new ATOM 0 HG23 THR A 455 -13.349 -2.280 2.873 1.00 0.00 H new ATOM 76 N GLU A 456 -10.095 -2.584 2.469 1.00 0.00 N ATOM 77 CA GLU A 456 -9.117 -3.594 2.084 1.00 0.00 C ATOM 78 C GLU A 456 -9.374 -4.092 0.665 1.00 0.00 C ATOM 79 O GLU A 456 -8.440 -4.364 -0.088 1.00 0.00 O ATOM 80 CB GLU A 456 -9.156 -4.770 3.063 1.00 0.00 C ATOM 81 CG GLU A 456 -8.102 -5.829 2.784 1.00 0.00 C ATOM 82 CD GLU A 456 -8.234 -7.040 3.689 1.00 0.00 C ATOM 83 OE1 GLU A 456 -9.177 -7.070 4.509 1.00 0.00 O ATOM 84 OE2 GLU A 456 -7.395 -7.958 3.578 1.00 0.00 O ATOM 0 H GLU A 456 -10.641 -2.820 3.298 1.00 0.00 H new ATOM 0 HA GLU A 456 -8.129 -3.135 2.114 1.00 0.00 H new ATOM 0 HB2 GLU A 456 -9.021 -4.393 4.077 1.00 0.00 H new ATOM 0 HB3 GLU A 456 -10.142 -5.232 3.024 1.00 0.00 H new ATOM 0 HG2 GLU A 456 -8.179 -6.147 1.744 1.00 0.00 H new ATOM 0 HG3 GLU A 456 -7.111 -5.392 2.911 1.00 0.00 H new ATOM 91 N ASP A 457 -10.649 -4.208 0.308 1.00 0.00 N ATOM 92 CA ASP A 457 -11.032 -4.673 -1.020 1.00 0.00 C ATOM 93 C ASP A 457 -10.465 -3.761 -2.103 1.00 0.00 C ATOM 94 O ASP A 457 -10.058 -4.225 -3.169 1.00 0.00 O ATOM 95 CB ASP A 457 -12.555 -4.739 -1.139 1.00 0.00 C ATOM 96 CG ASP A 457 -13.006 -5.398 -2.428 1.00 0.00 C ATOM 97 OD1 ASP A 457 -13.068 -6.644 -2.468 1.00 0.00 O ATOM 98 OD2 ASP A 457 -13.300 -4.666 -3.397 1.00 0.00 O ATOM 0 H ASP A 457 -11.434 -3.986 0.920 1.00 0.00 H new ATOM 0 HA ASP A 457 -10.619 -5.672 -1.160 1.00 0.00 H new ATOM 0 HB2 ASP A 457 -12.959 -5.291 -0.291 1.00 0.00 H new ATOM 0 HB3 ASP A 457 -12.965 -3.730 -1.087 1.00 0.00 H new ATOM 103 N ALA A 458 -10.441 -2.462 -1.824 1.00 0.00 N ATOM 104 CA ALA A 458 -9.924 -1.485 -2.777 1.00 0.00 C ATOM 105 C ALA A 458 -8.459 -1.753 -3.102 1.00 0.00 C ATOM 106 O ALA A 458 -8.068 -1.788 -4.268 1.00 0.00 O ATOM 107 CB ALA A 458 -10.097 -0.075 -2.231 1.00 0.00 C ATOM 0 H ALA A 458 -10.773 -2.061 -0.947 1.00 0.00 H new ATOM 0 HA ALA A 458 -10.495 -1.579 -3.701 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -9.707 0.644 -2.951 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -11.155 0.121 -2.058 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -9.552 0.021 -1.292 1.00 0.00 H new ATOM 113 N VAL A 459 -7.651 -1.941 -2.063 1.00 0.00 N ATOM 114 CA VAL A 459 -6.228 -2.205 -2.240 1.00 0.00 C ATOM 115 C VAL A 459 -6.001 -3.520 -2.981 1.00 0.00 C ATOM 116 O VAL A 459 -5.147 -3.607 -3.862 1.00 0.00 O ATOM 117 CB VAL A 459 -5.494 -2.257 -0.886 1.00 0.00 C ATOM 118 CG1 VAL A 459 -3.992 -2.388 -1.096 1.00 0.00 C ATOM 119 CG2 VAL A 459 -5.818 -1.025 -0.055 1.00 0.00 C ATOM 0 H VAL A 459 -7.958 -1.915 -1.091 1.00 0.00 H new ATOM 0 HA VAL A 459 -5.824 -1.384 -2.832 1.00 0.00 H new ATOM 0 HB VAL A 459 -5.839 -3.136 -0.341 1.00 0.00 H new ATOM 0 HG11 VAL A 459 -3.491 -2.423 -0.129 1.00 0.00 H new ATOM 0 HG12 VAL A 459 -3.780 -3.304 -1.648 1.00 0.00 H new ATOM 0 HG13 VAL A 459 -3.628 -1.531 -1.662 1.00 0.00 H new ATOM 0 HG21 VAL A 459 -5.291 -1.080 0.897 1.00 0.00 H new ATOM 0 HG22 VAL A 459 -5.504 -0.130 -0.593 1.00 0.00 H new ATOM 0 HG23 VAL A 459 -6.892 -0.981 0.127 1.00 0.00 H new ATOM 129 N ARG A 460 -6.771 -4.538 -2.614 1.00 0.00 N ATOM 130 CA ARG A 460 -6.656 -5.850 -3.241 1.00 0.00 C ATOM 131 C ARG A 460 -6.928 -5.766 -4.740 1.00 0.00 C ATOM 132 O ARG A 460 -6.313 -6.477 -5.534 1.00 0.00 O ATOM 133 CB ARG A 460 -7.624 -6.836 -2.587 1.00 0.00 C ATOM 134 CG ARG A 460 -7.319 -7.107 -1.123 1.00 0.00 C ATOM 135 CD ARG A 460 -8.432 -7.902 -0.459 1.00 0.00 C ATOM 136 NE ARG A 460 -8.466 -9.289 -0.918 1.00 0.00 N ATOM 137 CZ ARG A 460 -9.447 -10.140 -0.632 1.00 0.00 C ATOM 138 NH1 ARG A 460 -10.476 -9.752 0.110 1.00 0.00 N ATOM 139 NH2 ARG A 460 -9.399 -11.385 -1.089 1.00 0.00 N ATOM 0 H ARG A 460 -7.482 -4.480 -1.885 1.00 0.00 H new ATOM 0 HA ARG A 460 -5.635 -6.205 -3.098 1.00 0.00 H new ATOM 0 HB2 ARG A 460 -8.639 -6.447 -2.672 1.00 0.00 H new ATOM 0 HB3 ARG A 460 -7.596 -7.777 -3.136 1.00 0.00 H new ATOM 0 HG2 ARG A 460 -6.380 -7.655 -1.041 1.00 0.00 H new ATOM 0 HG3 ARG A 460 -7.183 -6.162 -0.598 1.00 0.00 H new ATOM 0 HD2 ARG A 460 -8.296 -7.882 0.622 1.00 0.00 H new ATOM 0 HD3 ARG A 460 -9.391 -7.428 -0.669 1.00 0.00 H new ATOM 0 HE ARG A 460 -7.692 -9.624 -1.491 1.00 0.00 H new ATOM 0 HH11 ARG A 460 -10.518 -8.796 0.464 1.00 0.00 H new ATOM 0 HH12 ARG A 460 -11.226 -10.409 0.326 1.00 0.00 H new ATOM 0 HH21 ARG A 460 -8.610 -11.689 -1.659 1.00 0.00 H new ATOM 0 HH22 ARG A 460 -10.151 -12.038 -0.870 1.00 0.00 H new ATOM 153 N ARG A 461 -7.857 -4.893 -5.120 1.00 0.00 N ATOM 154 CA ARG A 461 -8.212 -4.719 -6.525 1.00 0.00 C ATOM 155 C ARG A 461 -7.005 -4.270 -7.343 1.00 0.00 C ATOM 156 O ARG A 461 -6.808 -4.718 -8.473 1.00 0.00 O ATOM 157 CB ARG A 461 -9.344 -3.700 -6.664 1.00 0.00 C ATOM 158 CG ARG A 461 -10.702 -4.238 -6.242 1.00 0.00 C ATOM 159 CD ARG A 461 -11.230 -5.256 -7.238 1.00 0.00 C ATOM 160 NE ARG A 461 -12.516 -5.813 -6.823 1.00 0.00 N ATOM 161 CZ ARG A 461 -13.296 -6.546 -7.614 1.00 0.00 C ATOM 162 NH1 ARG A 461 -12.928 -6.811 -8.861 1.00 0.00 N ATOM 163 NH2 ARG A 461 -14.449 -7.015 -7.155 1.00 0.00 N ATOM 0 H ARG A 461 -8.376 -4.296 -4.476 1.00 0.00 H new ATOM 0 HA ARG A 461 -8.549 -5.682 -6.909 1.00 0.00 H new ATOM 0 HB2 ARG A 461 -9.107 -2.822 -6.063 1.00 0.00 H new ATOM 0 HB3 ARG A 461 -9.399 -3.370 -7.701 1.00 0.00 H new ATOM 0 HG2 ARG A 461 -10.622 -4.698 -5.257 1.00 0.00 H new ATOM 0 HG3 ARG A 461 -11.410 -3.414 -6.153 1.00 0.00 H new ATOM 0 HD2 ARG A 461 -11.337 -4.785 -8.215 1.00 0.00 H new ATOM 0 HD3 ARG A 461 -10.505 -6.062 -7.351 1.00 0.00 H new ATOM 0 HE ARG A 461 -12.834 -5.629 -5.872 1.00 0.00 H new ATOM 0 HH11 ARG A 461 -12.043 -6.452 -9.219 1.00 0.00 H new ATOM 0 HH12 ARG A 461 -13.530 -7.373 -9.462 1.00 0.00 H new ATOM 0 HH21 ARG A 461 -14.736 -6.814 -6.197 1.00 0.00 H new ATOM 0 HH22 ARG A 461 -15.048 -7.577 -7.760 1.00 0.00 H new ATOM 177 N TYR A 462 -6.200 -3.383 -6.768 1.00 0.00 N ATOM 178 CA TYR A 462 -5.014 -2.877 -7.447 1.00 0.00 C ATOM 179 C TYR A 462 -3.953 -3.965 -7.577 1.00 0.00 C ATOM 180 O TYR A 462 -3.316 -4.103 -8.622 1.00 0.00 O ATOM 181 CB TYR A 462 -4.440 -1.677 -6.692 1.00 0.00 C ATOM 182 CG TYR A 462 -5.356 -0.473 -6.681 1.00 0.00 C ATOM 183 CD1 TYR A 462 -5.437 0.372 -7.780 1.00 0.00 C ATOM 184 CD2 TYR A 462 -6.137 -0.183 -5.569 1.00 0.00 C ATOM 185 CE1 TYR A 462 -6.271 1.473 -7.772 1.00 0.00 C ATOM 186 CE2 TYR A 462 -6.975 0.916 -5.555 1.00 0.00 C ATOM 187 CZ TYR A 462 -7.038 1.740 -6.658 1.00 0.00 C ATOM 188 OH TYR A 462 -7.872 2.836 -6.646 1.00 0.00 O ATOM 0 H TYR A 462 -6.347 -3.000 -5.834 1.00 0.00 H new ATOM 0 HA TYR A 462 -5.308 -2.561 -8.448 1.00 0.00 H new ATOM 0 HB2 TYR A 462 -4.229 -1.972 -5.664 1.00 0.00 H new ATOM 0 HB3 TYR A 462 -3.489 -1.395 -7.144 1.00 0.00 H new ATOM 0 HD1 TYR A 462 -4.838 0.165 -8.655 1.00 0.00 H new ATOM 0 HD2 TYR A 462 -6.089 -0.826 -4.703 1.00 0.00 H new ATOM 0 HE1 TYR A 462 -6.322 2.121 -8.634 1.00 0.00 H new ATOM 0 HE2 TYR A 462 -7.577 1.128 -4.684 1.00 0.00 H new ATOM 0 HH TYR A 462 -8.342 2.880 -5.787 1.00 0.00 H new ATOM 198 N LEU A 463 -3.770 -4.736 -6.511 1.00 0.00 N ATOM 199 CA LEU A 463 -2.787 -5.813 -6.506 1.00 0.00 C ATOM 200 C LEU A 463 -3.181 -6.917 -7.482 1.00 0.00 C ATOM 201 O LEU A 463 -2.326 -7.525 -8.125 1.00 0.00 O ATOM 202 CB LEU A 463 -2.637 -6.390 -5.098 1.00 0.00 C ATOM 203 CG LEU A 463 -2.032 -5.435 -4.069 1.00 0.00 C ATOM 204 CD1 LEU A 463 -2.253 -5.959 -2.659 1.00 0.00 C ATOM 205 CD2 LEU A 463 -0.548 -5.233 -4.338 1.00 0.00 C ATOM 0 H LEU A 463 -4.290 -4.635 -5.639 1.00 0.00 H new ATOM 0 HA LEU A 463 -1.831 -5.398 -6.824 1.00 0.00 H new ATOM 0 HB2 LEU A 463 -3.619 -6.706 -4.745 1.00 0.00 H new ATOM 0 HB3 LEU A 463 -2.015 -7.283 -5.152 1.00 0.00 H new ATOM 0 HG LEU A 463 -2.532 -4.471 -4.158 1.00 0.00 H new ATOM 0 HD11 LEU A 463 -1.815 -5.266 -1.941 1.00 0.00 H new ATOM 0 HD12 LEU A 463 -3.322 -6.052 -2.469 1.00 0.00 H new ATOM 0 HD13 LEU A 463 -1.780 -6.936 -2.555 1.00 0.00 H new ATOM 0 HD21 LEU A 463 -0.133 -4.550 -3.596 1.00 0.00 H new ATOM 0 HD22 LEU A 463 -0.033 -6.192 -4.277 1.00 0.00 H new ATOM 0 HD23 LEU A 463 -0.413 -4.812 -5.334 1.00 0.00 H new ATOM 217 N THR A 464 -4.481 -7.169 -7.589 1.00 0.00 N ATOM 218 CA THR A 464 -4.988 -8.198 -8.488 1.00 0.00 C ATOM 219 C THR A 464 -4.675 -7.854 -9.941 1.00 0.00 C ATOM 220 O THR A 464 -4.491 -8.741 -10.774 1.00 0.00 O ATOM 221 CB THR A 464 -6.496 -8.367 -8.304 1.00 0.00 C ATOM 222 OG1 THR A 464 -7.104 -7.132 -7.974 1.00 0.00 O ATOM 223 CG2 THR A 464 -6.860 -9.362 -7.223 1.00 0.00 C ATOM 0 H THR A 464 -5.202 -6.675 -7.064 1.00 0.00 H new ATOM 0 HA THR A 464 -4.492 -9.137 -8.242 1.00 0.00 H new ATOM 0 HB THR A 464 -6.862 -8.743 -9.259 1.00 0.00 H new ATOM 0 HG1 THR A 464 -6.689 -6.413 -8.495 1.00 0.00 H new ATOM 0 HG21 THR A 464 -7.945 -9.434 -7.145 1.00 0.00 H new ATOM 0 HG22 THR A 464 -6.449 -10.340 -7.475 1.00 0.00 H new ATOM 0 HG23 THR A 464 -6.449 -9.030 -6.270 1.00 0.00 H new ATOM 231 N ARG A 465 -4.615 -6.559 -10.237 1.00 0.00 N ATOM 232 CA ARG A 465 -4.323 -6.098 -11.589 1.00 0.00 C ATOM 233 C ARG A 465 -2.843 -6.261 -11.909 1.00 0.00 C ATOM 234 O ARG A 465 -2.466 -7.042 -12.784 1.00 0.00 O ATOM 235 CB ARG A 465 -4.733 -4.634 -11.752 1.00 0.00 C ATOM 236 CG ARG A 465 -4.577 -4.113 -13.171 1.00 0.00 C ATOM 237 CD ARG A 465 -4.892 -2.628 -13.258 1.00 0.00 C ATOM 238 NE ARG A 465 -6.268 -2.335 -12.863 1.00 0.00 N ATOM 239 CZ ARG A 465 -6.711 -1.115 -12.571 1.00 0.00 C ATOM 240 NH1 ARG A 465 -5.893 -0.071 -12.630 1.00 0.00 N ATOM 241 NH2 ARG A 465 -7.978 -0.937 -12.221 1.00 0.00 N ATOM 0 H ARG A 465 -4.765 -5.812 -9.559 1.00 0.00 H new ATOM 0 HA ARG A 465 -4.898 -6.708 -12.286 1.00 0.00 H new ATOM 0 HB2 ARG A 465 -5.772 -4.520 -11.444 1.00 0.00 H new ATOM 0 HB3 ARG A 465 -4.133 -4.020 -11.080 1.00 0.00 H new ATOM 0 HG2 ARG A 465 -3.558 -4.290 -13.515 1.00 0.00 H new ATOM 0 HG3 ARG A 465 -5.239 -4.666 -13.837 1.00 0.00 H new ATOM 0 HD2 ARG A 465 -4.206 -2.074 -12.618 1.00 0.00 H new ATOM 0 HD3 ARG A 465 -4.726 -2.282 -14.278 1.00 0.00 H new ATOM 0 HE ARG A 465 -6.927 -3.111 -12.808 1.00 0.00 H new ATOM 0 HH11 ARG A 465 -4.918 -0.202 -12.901 1.00 0.00 H new ATOM 0 HH12 ARG A 465 -6.239 0.862 -12.405 1.00 0.00 H new ATOM 0 HH21 ARG A 465 -8.612 -1.735 -12.176 1.00 0.00 H new ATOM 0 HH22 ARG A 465 -8.319 -0.002 -11.997 1.00 0.00 H new ATOM 255 N LYS A 466 -2.011 -5.520 -11.191 1.00 0.00 N ATOM 256 CA LYS A 466 -0.567 -5.577 -11.390 1.00 0.00 C ATOM 257 C LYS A 466 0.173 -5.373 -10.069 1.00 0.00 C ATOM 258 O LYS A 466 -0.229 -4.548 -9.249 1.00 0.00 O ATOM 259 CB LYS A 466 -0.128 -4.518 -12.404 1.00 0.00 C ATOM 260 CG LYS A 466 -0.759 -3.154 -12.169 1.00 0.00 C ATOM 261 CD LYS A 466 0.275 -2.125 -11.737 1.00 0.00 C ATOM 262 CE LYS A 466 -0.088 -0.732 -12.227 1.00 0.00 C ATOM 263 NZ LYS A 466 0.324 -0.516 -13.642 1.00 0.00 N ATOM 0 H LYS A 466 -2.310 -4.871 -10.464 1.00 0.00 H new ATOM 0 HA LYS A 466 -0.317 -6.565 -11.777 1.00 0.00 H new ATOM 0 HB2 LYS A 466 0.957 -4.419 -12.367 1.00 0.00 H new ATOM 0 HB3 LYS A 466 -0.383 -4.859 -13.407 1.00 0.00 H new ATOM 0 HG2 LYS A 466 -1.249 -2.817 -13.083 1.00 0.00 H new ATOM 0 HG3 LYS A 466 -1.532 -3.237 -11.405 1.00 0.00 H new ATOM 0 HD2 LYS A 466 0.354 -2.121 -10.650 1.00 0.00 H new ATOM 0 HD3 LYS A 466 1.254 -2.405 -12.126 1.00 0.00 H new ATOM 0 HE2 LYS A 466 -1.164 -0.584 -12.136 1.00 0.00 H new ATOM 0 HE3 LYS A 466 0.391 0.013 -11.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 466 0.059 0.445 -13.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 466 1.354 -0.632 -13.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 466 -0.153 -1.210 -14.252 1.00 0.00 H new ATOM 277 N PRO A 467 1.267 -6.124 -9.842 1.00 0.00 N ATOM 278 CA PRO A 467 2.056 -6.014 -8.609 1.00 0.00 C ATOM 279 C PRO A 467 2.565 -4.596 -8.373 1.00 0.00 C ATOM 280 O PRO A 467 3.137 -3.975 -9.269 1.00 0.00 O ATOM 281 CB PRO A 467 3.231 -6.968 -8.842 1.00 0.00 C ATOM 282 CG PRO A 467 2.756 -7.917 -9.887 1.00 0.00 C ATOM 283 CD PRO A 467 1.819 -7.134 -10.762 1.00 0.00 C ATOM 0 HA PRO A 467 1.463 -6.258 -7.728 1.00 0.00 H new ATOM 0 HB2 PRO A 467 4.118 -6.428 -9.173 1.00 0.00 H new ATOM 0 HB3 PRO A 467 3.501 -7.493 -7.926 1.00 0.00 H new ATOM 0 HG2 PRO A 467 3.592 -8.311 -10.465 1.00 0.00 H new ATOM 0 HG3 PRO A 467 2.249 -8.771 -9.437 1.00 0.00 H new ATOM 0 HD2 PRO A 467 2.341 -6.673 -11.600 1.00 0.00 H new ATOM 0 HD3 PRO A 467 1.037 -7.766 -11.182 1.00 0.00 H new ATOM 291 N MET A 468 2.358 -4.091 -7.162 1.00 0.00 N ATOM 292 CA MET A 468 2.802 -2.747 -6.808 1.00 0.00 C ATOM 293 C MET A 468 3.393 -2.724 -5.403 1.00 0.00 C ATOM 294 O MET A 468 2.979 -3.487 -4.531 1.00 0.00 O ATOM 295 CB MET A 468 1.635 -1.762 -6.899 1.00 0.00 C ATOM 296 CG MET A 468 1.034 -1.660 -8.290 1.00 0.00 C ATOM 297 SD MET A 468 -0.073 -0.247 -8.467 1.00 0.00 S ATOM 298 CE MET A 468 -1.177 -0.507 -7.082 1.00 0.00 C ATOM 0 H MET A 468 1.886 -4.591 -6.409 1.00 0.00 H new ATOM 0 HA MET A 468 3.577 -2.448 -7.514 1.00 0.00 H new ATOM 0 HB2 MET A 468 0.858 -2.066 -6.198 1.00 0.00 H new ATOM 0 HB3 MET A 468 1.978 -0.775 -6.587 1.00 0.00 H new ATOM 0 HG2 MET A 468 1.837 -1.582 -9.023 1.00 0.00 H new ATOM 0 HG3 MET A 468 0.486 -2.576 -8.513 1.00 0.00 H new ATOM 0 HE1 MET A 468 -2.109 0.031 -7.254 1.00 0.00 H new ATOM 0 HE2 MET A 468 -1.387 -1.572 -6.979 1.00 0.00 H new ATOM 0 HE3 MET A 468 -0.708 -0.139 -6.169 1.00 0.00 H new ATOM 308 N THR A 469 4.364 -1.840 -5.187 1.00 0.00 N ATOM 309 CA THR A 469 5.009 -1.720 -3.886 1.00 0.00 C ATOM 310 C THR A 469 4.192 -0.829 -2.956 1.00 0.00 C ATOM 311 O THR A 469 3.299 -0.106 -3.399 1.00 0.00 O ATOM 312 CB THR A 469 6.425 -1.162 -4.043 1.00 0.00 C ATOM 313 OG1 THR A 469 7.041 -0.990 -2.779 1.00 0.00 O ATOM 314 CG2 THR A 469 6.470 0.169 -4.762 1.00 0.00 C ATOM 0 H THR A 469 4.720 -1.198 -5.896 1.00 0.00 H new ATOM 0 HA THR A 469 5.070 -2.714 -3.443 1.00 0.00 H new ATOM 0 HB THR A 469 6.958 -1.898 -4.645 1.00 0.00 H new ATOM 0 HG1 THR A 469 7.618 -1.759 -2.589 1.00 0.00 H new ATOM 0 HG21 THR A 469 7.504 0.506 -4.839 1.00 0.00 H new ATOM 0 HG22 THR A 469 6.050 0.057 -5.762 1.00 0.00 H new ATOM 0 HG23 THR A 469 5.889 0.904 -4.204 1.00 0.00 H new ATOM 322 N THR A 470 4.499 -0.888 -1.664 1.00 0.00 N ATOM 323 CA THR A 470 3.790 -0.091 -0.667 1.00 0.00 C ATOM 324 C THR A 470 3.775 1.387 -1.050 1.00 0.00 C ATOM 325 O THR A 470 2.743 2.052 -0.957 1.00 0.00 O ATOM 326 CB THR A 470 4.439 -0.263 0.707 1.00 0.00 C ATOM 327 OG1 THR A 470 5.830 -0.003 0.640 1.00 0.00 O ATOM 328 CG2 THR A 470 4.259 -1.651 1.284 1.00 0.00 C ATOM 0 H THR A 470 5.236 -1.481 -1.282 1.00 0.00 H new ATOM 0 HA THR A 470 2.760 -0.445 -0.627 1.00 0.00 H new ATOM 0 HB THR A 470 3.934 0.452 1.357 1.00 0.00 H new ATOM 0 HG1 THR A 470 6.320 -0.851 0.600 1.00 0.00 H new ATOM 0 HG21 THR A 470 4.743 -1.705 2.259 1.00 0.00 H new ATOM 0 HG22 THR A 470 3.196 -1.864 1.394 1.00 0.00 H new ATOM 0 HG23 THR A 470 4.709 -2.384 0.615 1.00 0.00 H new ATOM 336 N LYS A 471 4.926 1.895 -1.480 1.00 0.00 N ATOM 337 CA LYS A 471 5.043 3.294 -1.875 1.00 0.00 C ATOM 338 C LYS A 471 4.076 3.625 -3.009 1.00 0.00 C ATOM 339 O LYS A 471 3.367 4.629 -2.959 1.00 0.00 O ATOM 340 CB LYS A 471 6.477 3.606 -2.305 1.00 0.00 C ATOM 341 CG LYS A 471 6.715 5.076 -2.608 1.00 0.00 C ATOM 342 CD LYS A 471 8.136 5.323 -3.086 1.00 0.00 C ATOM 343 CE LYS A 471 8.424 6.808 -3.236 1.00 0.00 C ATOM 344 NZ LYS A 471 8.046 7.313 -4.585 1.00 0.00 N ATOM 0 H LYS A 471 5.790 1.359 -1.564 1.00 0.00 H new ATOM 0 HA LYS A 471 4.787 3.910 -1.013 1.00 0.00 H new ATOM 0 HB2 LYS A 471 7.161 3.291 -1.517 1.00 0.00 H new ATOM 0 HB3 LYS A 471 6.718 3.017 -3.190 1.00 0.00 H new ATOM 0 HG2 LYS A 471 6.011 5.410 -3.370 1.00 0.00 H new ATOM 0 HG3 LYS A 471 6.523 5.669 -1.714 1.00 0.00 H new ATOM 0 HD2 LYS A 471 8.840 4.885 -2.379 1.00 0.00 H new ATOM 0 HD3 LYS A 471 8.291 4.823 -4.042 1.00 0.00 H new ATOM 0 HE2 LYS A 471 7.877 7.363 -2.474 1.00 0.00 H new ATOM 0 HE3 LYS A 471 9.485 6.991 -3.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 471 7.899 8.342 -4.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 471 8.807 7.100 -5.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 471 7.168 6.851 -4.895 1.00 0.00 H new ATOM 358 N ASP A 472 4.057 2.775 -4.030 1.00 0.00 N ATOM 359 CA ASP A 472 3.178 2.979 -5.177 1.00 0.00 C ATOM 360 C ASP A 472 1.713 2.957 -4.754 1.00 0.00 C ATOM 361 O ASP A 472 0.892 3.705 -5.286 1.00 0.00 O ATOM 362 CB ASP A 472 3.432 1.906 -6.238 1.00 0.00 C ATOM 363 CG ASP A 472 4.790 2.051 -6.896 1.00 0.00 C ATOM 364 OD1 ASP A 472 5.413 3.123 -6.745 1.00 0.00 O ATOM 365 OD2 ASP A 472 5.232 1.091 -7.562 1.00 0.00 O ATOM 0 H ASP A 472 4.639 1.939 -4.087 1.00 0.00 H new ATOM 0 HA ASP A 472 3.398 3.959 -5.601 1.00 0.00 H new ATOM 0 HB2 ASP A 472 3.358 0.920 -5.779 1.00 0.00 H new ATOM 0 HB3 ASP A 472 2.655 1.962 -7.000 1.00 0.00 H new ATOM 370 N LEU A 473 1.392 2.094 -3.799 1.00 0.00 N ATOM 371 CA LEU A 473 0.025 1.973 -3.305 1.00 0.00 C ATOM 372 C LEU A 473 -0.450 3.282 -2.683 1.00 0.00 C ATOM 373 O LEU A 473 -1.588 3.703 -2.891 1.00 0.00 O ATOM 374 CB LEU A 473 -0.071 0.843 -2.277 1.00 0.00 C ATOM 375 CG LEU A 473 0.176 -0.561 -2.833 1.00 0.00 C ATOM 376 CD1 LEU A 473 0.303 -1.567 -1.699 1.00 0.00 C ATOM 377 CD2 LEU A 473 -0.943 -0.962 -3.782 1.00 0.00 C ATOM 0 H LEU A 473 2.059 1.467 -3.350 1.00 0.00 H new ATOM 0 HA LEU A 473 -0.619 1.741 -4.153 1.00 0.00 H new ATOM 0 HB2 LEU A 473 0.649 1.034 -1.481 1.00 0.00 H new ATOM 0 HB3 LEU A 473 -1.062 0.868 -1.823 1.00 0.00 H new ATOM 0 HG LEU A 473 1.112 -0.552 -3.391 1.00 0.00 H new ATOM 0 HD11 LEU A 473 0.478 -2.560 -2.112 1.00 0.00 H new ATOM 0 HD12 LEU A 473 1.139 -1.288 -1.057 1.00 0.00 H new ATOM 0 HD13 LEU A 473 -0.617 -1.574 -1.114 1.00 0.00 H new ATOM 0 HD21 LEU A 473 -0.751 -1.963 -4.168 1.00 0.00 H new ATOM 0 HD22 LEU A 473 -1.893 -0.955 -3.248 1.00 0.00 H new ATOM 0 HD23 LEU A 473 -0.988 -0.256 -4.611 1.00 0.00 H new ATOM 389 N LEU A 474 0.428 3.921 -1.917 1.00 0.00 N ATOM 390 CA LEU A 474 0.097 5.183 -1.264 1.00 0.00 C ATOM 391 C LEU A 474 -0.061 6.303 -2.287 1.00 0.00 C ATOM 392 O LEU A 474 -0.896 7.191 -2.121 1.00 0.00 O ATOM 393 CB LEU A 474 1.176 5.552 -0.244 1.00 0.00 C ATOM 394 CG LEU A 474 1.059 4.841 1.105 1.00 0.00 C ATOM 395 CD1 LEU A 474 2.423 4.729 1.769 1.00 0.00 C ATOM 396 CD2 LEU A 474 0.082 5.577 2.010 1.00 0.00 C ATOM 0 H LEU A 474 1.374 3.586 -1.733 1.00 0.00 H new ATOM 0 HA LEU A 474 -0.854 5.056 -0.746 1.00 0.00 H new ATOM 0 HB2 LEU A 474 2.153 5.327 -0.673 1.00 0.00 H new ATOM 0 HB3 LEU A 474 1.142 6.628 -0.075 1.00 0.00 H new ATOM 0 HG LEU A 474 0.678 3.834 0.933 1.00 0.00 H new ATOM 0 HD11 LEU A 474 2.320 4.221 2.728 1.00 0.00 H new ATOM 0 HD12 LEU A 474 3.095 4.160 1.126 1.00 0.00 H new ATOM 0 HD13 LEU A 474 2.833 5.726 1.929 1.00 0.00 H new ATOM 0 HD21 LEU A 474 0.010 5.058 2.966 1.00 0.00 H new ATOM 0 HD22 LEU A 474 0.435 6.595 2.175 1.00 0.00 H new ATOM 0 HD23 LEU A 474 -0.900 5.606 1.538 1.00 0.00 H new ATOM 408 N LYS A 475 0.746 6.257 -3.342 1.00 0.00 N ATOM 409 CA LYS A 475 0.690 7.272 -4.388 1.00 0.00 C ATOM 410 C LYS A 475 -0.685 7.300 -5.047 1.00 0.00 C ATOM 411 O LYS A 475 -1.227 8.369 -5.330 1.00 0.00 O ATOM 412 CB LYS A 475 1.768 7.011 -5.442 1.00 0.00 C ATOM 413 CG LYS A 475 3.184 7.195 -4.922 1.00 0.00 C ATOM 414 CD LYS A 475 3.453 8.641 -4.538 1.00 0.00 C ATOM 415 CE LYS A 475 4.904 8.852 -4.142 1.00 0.00 C ATOM 416 NZ LYS A 475 5.169 8.410 -2.745 1.00 0.00 N ATOM 0 H LYS A 475 1.445 5.530 -3.495 1.00 0.00 H new ATOM 0 HA LYS A 475 0.872 8.242 -3.926 1.00 0.00 H new ATOM 0 HB2 LYS A 475 1.657 5.994 -5.819 1.00 0.00 H new ATOM 0 HB3 LYS A 475 1.610 7.683 -6.286 1.00 0.00 H new ATOM 0 HG2 LYS A 475 3.341 6.552 -4.056 1.00 0.00 H new ATOM 0 HG3 LYS A 475 3.897 6.881 -5.685 1.00 0.00 H new ATOM 0 HD2 LYS A 475 3.205 9.293 -5.376 1.00 0.00 H new ATOM 0 HD3 LYS A 475 2.804 8.925 -3.710 1.00 0.00 H new ATOM 0 HE2 LYS A 475 5.550 8.302 -4.826 1.00 0.00 H new ATOM 0 HE3 LYS A 475 5.158 9.907 -4.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 475 6.142 8.663 -2.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 475 4.501 8.878 -2.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 475 5.049 7.379 -2.678 1.00 0.00 H new ATOM 430 N LYS A 476 -1.245 6.120 -5.289 1.00 0.00 N ATOM 431 CA LYS A 476 -2.558 6.009 -5.914 1.00 0.00 C ATOM 432 C LYS A 476 -3.635 6.637 -5.035 1.00 0.00 C ATOM 433 O LYS A 476 -4.594 7.226 -5.533 1.00 0.00 O ATOM 434 CB LYS A 476 -2.895 4.542 -6.186 1.00 0.00 C ATOM 435 CG LYS A 476 -1.880 3.840 -7.074 1.00 0.00 C ATOM 436 CD LYS A 476 -1.857 4.434 -8.472 1.00 0.00 C ATOM 437 CE LYS A 476 -0.959 3.635 -9.403 1.00 0.00 C ATOM 438 NZ LYS A 476 -1.476 3.621 -10.798 1.00 0.00 N ATOM 0 H LYS A 476 -0.810 5.226 -5.062 1.00 0.00 H new ATOM 0 HA LYS A 476 -2.528 6.548 -6.861 1.00 0.00 H new ATOM 0 HB2 LYS A 476 -2.963 4.011 -5.236 1.00 0.00 H new ATOM 0 HB3 LYS A 476 -3.877 4.484 -6.655 1.00 0.00 H new ATOM 0 HG2 LYS A 476 -0.889 3.919 -6.628 1.00 0.00 H new ATOM 0 HG3 LYS A 476 -2.119 2.778 -7.133 1.00 0.00 H new ATOM 0 HD2 LYS A 476 -2.870 4.459 -8.874 1.00 0.00 H new ATOM 0 HD3 LYS A 476 -1.508 5.465 -8.424 1.00 0.00 H new ATOM 0 HE2 LYS A 476 0.045 4.060 -9.392 1.00 0.00 H new ATOM 0 HE3 LYS A 476 -0.876 2.612 -9.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 476 -0.835 3.066 -11.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 476 -2.423 3.192 -10.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 476 -1.532 4.595 -11.157 1.00 0.00 H new ATOM 452 N PHE A 477 -3.470 6.504 -3.722 1.00 0.00 N ATOM 453 CA PHE A 477 -4.427 7.055 -2.771 1.00 0.00 C ATOM 454 C PHE A 477 -3.709 7.825 -1.664 1.00 0.00 C ATOM 455 O PHE A 477 -3.887 7.540 -0.479 1.00 0.00 O ATOM 456 CB PHE A 477 -5.277 5.935 -2.168 1.00 0.00 C ATOM 457 CG PHE A 477 -6.732 6.288 -2.034 1.00 0.00 C ATOM 458 CD1 PHE A 477 -7.414 6.878 -3.085 1.00 0.00 C ATOM 459 CD2 PHE A 477 -7.415 6.029 -0.857 1.00 0.00 C ATOM 460 CE1 PHE A 477 -8.752 7.203 -2.966 1.00 0.00 C ATOM 461 CE2 PHE A 477 -8.752 6.352 -0.731 1.00 0.00 C ATOM 462 CZ PHE A 477 -9.422 6.940 -1.786 1.00 0.00 C ATOM 0 H PHE A 477 -2.682 6.019 -3.293 1.00 0.00 H new ATOM 0 HA PHE A 477 -5.079 7.747 -3.303 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -5.184 5.045 -2.790 1.00 0.00 H new ATOM 0 HB3 PHE A 477 -4.882 5.680 -1.185 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -6.894 7.087 -4.008 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -6.896 5.569 -0.029 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -9.273 7.662 -3.793 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -9.273 6.145 0.192 1.00 0.00 H new ATOM 0 HZ PHE A 477 -10.467 7.194 -1.689 1.00 0.00 H new ATOM 472 N GLN A 478 -2.896 8.798 -2.060 1.00 0.00 N ATOM 473 CA GLN A 478 -2.149 9.605 -1.102 1.00 0.00 C ATOM 474 C GLN A 478 -3.090 10.356 -0.166 1.00 0.00 C ATOM 475 O GLN A 478 -2.989 10.241 1.054 1.00 0.00 O ATOM 476 CB GLN A 478 -1.244 10.596 -1.836 1.00 0.00 C ATOM 477 CG GLN A 478 -0.289 11.342 -0.918 1.00 0.00 C ATOM 478 CD GLN A 478 0.568 12.348 -1.663 1.00 0.00 C ATOM 479 OE1 GLN A 478 1.539 11.985 -2.325 1.00 0.00 O ATOM 480 NE2 GLN A 478 0.212 13.623 -1.554 1.00 0.00 N ATOM 0 H GLN A 478 -2.737 9.047 -3.036 1.00 0.00 H new ATOM 0 HA GLN A 478 -1.534 8.933 -0.504 1.00 0.00 H new ATOM 0 HB2 GLN A 478 -0.667 10.059 -2.589 1.00 0.00 H new ATOM 0 HB3 GLN A 478 -1.865 11.319 -2.366 1.00 0.00 H new ATOM 0 HG2 GLN A 478 -0.861 11.858 -0.146 1.00 0.00 H new ATOM 0 HG3 GLN A 478 0.357 10.625 -0.411 1.00 0.00 H new ATOM 0 HE21 GLN A 478 -0.601 13.879 -0.994 1.00 0.00 H new ATOM 0 HE22 GLN A 478 0.752 14.346 -2.030 1.00 0.00 H new ATOM 489 N THR A 479 -4.006 11.124 -0.748 1.00 0.00 N ATOM 490 CA THR A 479 -4.967 11.895 0.034 1.00 0.00 C ATOM 491 C THR A 479 -5.883 12.707 -0.878 1.00 0.00 C ATOM 492 O THR A 479 -6.212 13.856 -0.580 1.00 0.00 O ATOM 493 CB THR A 479 -4.238 12.828 1.004 1.00 0.00 C ATOM 494 OG1 THR A 479 -5.157 13.678 1.668 1.00 0.00 O ATOM 495 CG2 THR A 479 -3.206 13.705 0.330 1.00 0.00 C ATOM 0 H THR A 479 -4.103 11.229 -1.758 1.00 0.00 H new ATOM 0 HA THR A 479 -5.578 11.195 0.604 1.00 0.00 H new ATOM 0 HB THR A 479 -3.728 12.171 1.708 1.00 0.00 H new ATOM 0 HG1 THR A 479 -5.592 14.264 1.014 1.00 0.00 H new ATOM 0 HG21 THR A 479 -2.727 14.341 1.074 1.00 0.00 H new ATOM 0 HG22 THR A 479 -2.454 13.079 -0.150 1.00 0.00 H new ATOM 0 HG23 THR A 479 -3.692 14.328 -0.421 1.00 0.00 H new ATOM 503 N LYS A 480 -6.291 12.104 -1.990 1.00 0.00 N ATOM 504 CA LYS A 480 -7.168 12.775 -2.943 1.00 0.00 C ATOM 505 C LYS A 480 -8.601 12.828 -2.422 1.00 0.00 C ATOM 506 O LYS A 480 -9.067 13.872 -1.965 1.00 0.00 O ATOM 507 CB LYS A 480 -7.129 12.062 -4.298 1.00 0.00 C ATOM 508 CG LYS A 480 -5.791 12.182 -5.012 1.00 0.00 C ATOM 509 CD LYS A 480 -5.971 12.443 -6.499 1.00 0.00 C ATOM 510 CE LYS A 480 -6.401 11.186 -7.239 1.00 0.00 C ATOM 511 NZ LYS A 480 -7.186 11.502 -8.466 1.00 0.00 N ATOM 0 H LYS A 480 -6.029 11.154 -2.253 1.00 0.00 H new ATOM 0 HA LYS A 480 -6.810 13.797 -3.069 1.00 0.00 H new ATOM 0 HB2 LYS A 480 -7.359 11.007 -4.150 1.00 0.00 H new ATOM 0 HB3 LYS A 480 -7.911 12.472 -4.938 1.00 0.00 H new ATOM 0 HG2 LYS A 480 -5.212 12.992 -4.567 1.00 0.00 H new ATOM 0 HG3 LYS A 480 -5.219 11.265 -4.870 1.00 0.00 H new ATOM 0 HD2 LYS A 480 -6.717 13.225 -6.644 1.00 0.00 H new ATOM 0 HD3 LYS A 480 -5.036 12.812 -6.920 1.00 0.00 H new ATOM 0 HE2 LYS A 480 -5.519 10.606 -7.512 1.00 0.00 H new ATOM 0 HE3 LYS A 480 -7.000 10.562 -6.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 480 -7.459 10.618 -8.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 480 -8.041 12.033 -8.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 480 -6.606 12.076 -9.111 1.00 0.00 H new ATOM 525 N LYS A 481 -9.295 11.697 -2.495 1.00 0.00 N ATOM 526 CA LYS A 481 -10.676 11.618 -2.029 1.00 0.00 C ATOM 527 C LYS A 481 -10.779 10.793 -0.749 1.00 0.00 C ATOM 528 O LYS A 481 -11.842 10.258 -0.430 1.00 0.00 O ATOM 529 CB LYS A 481 -11.566 11.009 -3.114 1.00 0.00 C ATOM 530 CG LYS A 481 -11.505 11.752 -4.439 1.00 0.00 C ATOM 531 CD LYS A 481 -12.025 13.173 -4.306 1.00 0.00 C ATOM 532 CE LYS A 481 -12.137 13.855 -5.661 1.00 0.00 C ATOM 533 NZ LYS A 481 -12.864 15.151 -5.573 1.00 0.00 N ATOM 0 H LYS A 481 -8.925 10.824 -2.871 1.00 0.00 H new ATOM 0 HA LYS A 481 -11.016 12.631 -1.812 1.00 0.00 H new ATOM 0 HB2 LYS A 481 -11.271 9.972 -3.275 1.00 0.00 H new ATOM 0 HB3 LYS A 481 -12.597 10.996 -2.761 1.00 0.00 H new ATOM 0 HG2 LYS A 481 -10.476 11.772 -4.799 1.00 0.00 H new ATOM 0 HG3 LYS A 481 -12.093 11.217 -5.185 1.00 0.00 H new ATOM 0 HD2 LYS A 481 -13.002 13.160 -3.822 1.00 0.00 H new ATOM 0 HD3 LYS A 481 -11.358 13.747 -3.663 1.00 0.00 H new ATOM 0 HE2 LYS A 481 -11.139 14.026 -6.065 1.00 0.00 H new ATOM 0 HE3 LYS A 481 -12.654 13.195 -6.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 481 -12.918 15.583 -6.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 481 -13.825 14.986 -5.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 481 -12.357 15.790 -4.928 1.00 0.00 H new ATOM 547 N THR A 482 -9.673 10.693 -0.019 1.00 0.00 N ATOM 548 CA THR A 482 -9.645 9.933 1.226 1.00 0.00 C ATOM 549 C THR A 482 -10.302 10.717 2.357 1.00 0.00 C ATOM 550 O THR A 482 -10.997 10.149 3.199 1.00 0.00 O ATOM 551 CB THR A 482 -8.206 9.582 1.602 1.00 0.00 C ATOM 552 OG1 THR A 482 -7.453 10.756 1.853 1.00 0.00 O ATOM 553 CG2 THR A 482 -7.482 8.793 0.532 1.00 0.00 C ATOM 0 H THR A 482 -8.785 11.128 -0.268 1.00 0.00 H new ATOM 0 HA THR A 482 -10.207 9.012 1.072 1.00 0.00 H new ATOM 0 HB THR A 482 -8.284 8.963 2.496 1.00 0.00 H new ATOM 0 HG1 THR A 482 -7.249 10.816 2.810 1.00 0.00 H new ATOM 0 HG21 THR A 482 -6.466 8.577 0.863 1.00 0.00 H new ATOM 0 HG22 THR A 482 -8.010 7.857 0.350 1.00 0.00 H new ATOM 0 HG23 THR A 482 -7.447 9.375 -0.389 1.00 0.00 H new ATOM 561 N GLY A 483 -10.075 12.027 2.370 1.00 0.00 N ATOM 562 CA GLY A 483 -10.650 12.869 3.403 1.00 0.00 C ATOM 563 C GLY A 483 -9.692 13.112 4.553 1.00 0.00 C ATOM 564 O GLY A 483 -9.775 14.137 5.231 1.00 0.00 O ATOM 0 H GLY A 483 -9.503 12.520 1.684 1.00 0.00 H new ATOM 0 HA2 GLY A 483 -10.941 13.825 2.968 1.00 0.00 H new ATOM 0 HA3 GLY A 483 -11.559 12.403 3.784 1.00 0.00 H new ATOM 568 N LEU A 484 -8.783 12.169 4.774 1.00 0.00 N ATOM 569 CA LEU A 484 -7.807 12.285 5.851 1.00 0.00 C ATOM 570 C LEU A 484 -6.414 12.564 5.295 1.00 0.00 C ATOM 571 O LEU A 484 -6.114 12.234 4.148 1.00 0.00 O ATOM 572 CB LEU A 484 -7.786 11.006 6.690 1.00 0.00 C ATOM 573 CG LEU A 484 -9.151 10.551 7.210 1.00 0.00 C ATOM 574 CD1 LEU A 484 -9.007 9.303 8.066 1.00 0.00 C ATOM 575 CD2 LEU A 484 -9.817 11.667 8.000 1.00 0.00 C ATOM 0 H LEU A 484 -8.702 11.315 4.221 1.00 0.00 H new ATOM 0 HA LEU A 484 -8.101 13.122 6.484 1.00 0.00 H new ATOM 0 HB2 LEU A 484 -7.356 10.203 6.091 1.00 0.00 H new ATOM 0 HB3 LEU A 484 -7.122 11.159 7.541 1.00 0.00 H new ATOM 0 HG LEU A 484 -9.783 10.309 6.355 1.00 0.00 H new ATOM 0 HD11 LEU A 484 -9.988 8.994 8.427 1.00 0.00 H new ATOM 0 HD12 LEU A 484 -8.571 8.501 7.470 1.00 0.00 H new ATOM 0 HD13 LEU A 484 -8.359 9.517 8.916 1.00 0.00 H new ATOM 0 HD21 LEU A 484 -10.787 11.327 8.363 1.00 0.00 H new ATOM 0 HD22 LEU A 484 -9.187 11.939 8.847 1.00 0.00 H new ATOM 0 HD23 LEU A 484 -9.955 12.536 7.357 1.00 0.00 H new ATOM 587 N SER A 485 -5.567 13.176 6.117 1.00 0.00 N ATOM 588 CA SER A 485 -4.204 13.501 5.707 1.00 0.00 C ATOM 589 C SER A 485 -3.435 12.242 5.319 1.00 0.00 C ATOM 590 O SER A 485 -3.862 11.126 5.614 1.00 0.00 O ATOM 591 CB SER A 485 -3.472 14.232 6.834 1.00 0.00 C ATOM 592 OG SER A 485 -2.147 14.561 6.455 1.00 0.00 O ATOM 0 H SER A 485 -5.799 13.457 7.070 1.00 0.00 H new ATOM 0 HA SER A 485 -4.260 14.152 4.835 1.00 0.00 H new ATOM 0 HB2 SER A 485 -4.015 15.141 7.095 1.00 0.00 H new ATOM 0 HB3 SER A 485 -3.453 13.605 7.726 1.00 0.00 H new ATOM 0 HG SER A 485 -1.702 15.029 7.193 1.00 0.00 H new ATOM 598 N SER A 486 -2.299 12.432 4.656 1.00 0.00 N ATOM 599 CA SER A 486 -1.467 11.312 4.226 1.00 0.00 C ATOM 600 C SER A 486 -1.023 10.474 5.419 1.00 0.00 C ATOM 601 O SER A 486 -0.845 9.260 5.307 1.00 0.00 O ATOM 602 CB SER A 486 -0.243 11.824 3.464 1.00 0.00 C ATOM 603 OG SER A 486 0.612 12.568 4.314 1.00 0.00 O ATOM 0 H SER A 486 -1.933 13.350 4.404 1.00 0.00 H new ATOM 0 HA SER A 486 -2.062 10.682 3.565 1.00 0.00 H new ATOM 0 HB2 SER A 486 0.304 10.982 3.040 1.00 0.00 H new ATOM 0 HB3 SER A 486 -0.565 12.448 2.630 1.00 0.00 H new ATOM 0 HG SER A 486 1.387 12.883 3.804 1.00 0.00 H new ATOM 609 N GLU A 487 -0.847 11.126 6.563 1.00 0.00 N ATOM 610 CA GLU A 487 -0.424 10.439 7.777 1.00 0.00 C ATOM 611 C GLU A 487 -1.508 9.481 8.263 1.00 0.00 C ATOM 612 O GLU A 487 -1.228 8.333 8.606 1.00 0.00 O ATOM 613 CB GLU A 487 -0.094 11.454 8.874 1.00 0.00 C ATOM 614 CG GLU A 487 -1.297 12.260 9.339 1.00 0.00 C ATOM 615 CD GLU A 487 -0.925 13.349 10.327 1.00 0.00 C ATOM 616 OE1 GLU A 487 0.232 13.354 10.801 1.00 0.00 O ATOM 617 OE2 GLU A 487 -1.790 14.198 10.628 1.00 0.00 O ATOM 0 H GLU A 487 -0.991 12.130 6.675 1.00 0.00 H new ATOM 0 HA GLU A 487 0.471 9.861 7.546 1.00 0.00 H new ATOM 0 HB2 GLU A 487 0.332 10.928 9.728 1.00 0.00 H new ATOM 0 HB3 GLU A 487 0.671 12.138 8.507 1.00 0.00 H new ATOM 0 HG2 GLU A 487 -1.784 12.711 8.474 1.00 0.00 H new ATOM 0 HG3 GLU A 487 -2.022 11.589 9.800 1.00 0.00 H new ATOM 624 N GLN A 488 -2.746 9.963 8.287 1.00 0.00 N ATOM 625 CA GLN A 488 -3.874 9.152 8.729 1.00 0.00 C ATOM 626 C GLN A 488 -4.159 8.029 7.737 1.00 0.00 C ATOM 627 O GLN A 488 -4.512 6.916 8.128 1.00 0.00 O ATOM 628 CB GLN A 488 -5.118 10.024 8.903 1.00 0.00 C ATOM 629 CG GLN A 488 -4.981 11.066 10.002 1.00 0.00 C ATOM 630 CD GLN A 488 -6.217 11.934 10.139 1.00 0.00 C ATOM 631 OE1 GLN A 488 -7.311 11.439 10.414 1.00 0.00 O ATOM 632 NE2 GLN A 488 -6.047 13.238 9.948 1.00 0.00 N ATOM 0 H GLN A 488 -2.994 10.912 8.005 1.00 0.00 H new ATOM 0 HA GLN A 488 -3.615 8.706 9.689 1.00 0.00 H new ATOM 0 HB2 GLN A 488 -5.333 10.528 7.961 1.00 0.00 H new ATOM 0 HB3 GLN A 488 -5.972 9.384 9.125 1.00 0.00 H new ATOM 0 HG2 GLN A 488 -4.786 10.565 10.950 1.00 0.00 H new ATOM 0 HG3 GLN A 488 -4.118 11.699 9.792 1.00 0.00 H new ATOM 0 HE21 GLN A 488 -5.122 13.604 9.722 1.00 0.00 H new ATOM 0 HE22 GLN A 488 -6.841 13.873 10.028 1.00 0.00 H new ATOM 641 N THR A 489 -4.003 8.327 6.450 1.00 0.00 N ATOM 642 CA THR A 489 -4.243 7.341 5.403 1.00 0.00 C ATOM 643 C THR A 489 -3.329 6.132 5.574 1.00 0.00 C ATOM 644 O THR A 489 -3.751 4.991 5.391 1.00 0.00 O ATOM 645 CB THR A 489 -4.026 7.968 4.024 1.00 0.00 C ATOM 646 OG1 THR A 489 -4.756 9.176 3.902 1.00 0.00 O ATOM 647 CG2 THR A 489 -4.440 7.065 2.883 1.00 0.00 C ATOM 0 H THR A 489 -3.712 9.243 6.108 1.00 0.00 H new ATOM 0 HA THR A 489 -5.277 7.006 5.484 1.00 0.00 H new ATOM 0 HB THR A 489 -2.953 8.145 3.954 1.00 0.00 H new ATOM 0 HG1 THR A 489 -4.324 9.875 4.436 1.00 0.00 H new ATOM 0 HG21 THR A 489 -4.260 7.571 1.935 1.00 0.00 H new ATOM 0 HG22 THR A 489 -3.859 6.144 2.919 1.00 0.00 H new ATOM 0 HG23 THR A 489 -5.500 6.829 2.972 1.00 0.00 H new ATOM 655 N VAL A 490 -2.075 6.393 5.925 1.00 0.00 N ATOM 656 CA VAL A 490 -1.099 5.327 6.121 1.00 0.00 C ATOM 657 C VAL A 490 -1.453 4.475 7.336 1.00 0.00 C ATOM 658 O VAL A 490 -1.209 3.269 7.353 1.00 0.00 O ATOM 659 CB VAL A 490 0.323 5.895 6.303 1.00 0.00 C ATOM 660 CG1 VAL A 490 1.345 4.770 6.376 1.00 0.00 C ATOM 661 CG2 VAL A 490 0.662 6.860 5.177 1.00 0.00 C ATOM 0 H VAL A 490 -1.710 7.333 6.080 1.00 0.00 H new ATOM 0 HA VAL A 490 -1.123 4.706 5.225 1.00 0.00 H new ATOM 0 HB VAL A 490 0.355 6.445 7.244 1.00 0.00 H new ATOM 0 HG11 VAL A 490 2.342 5.192 6.504 1.00 0.00 H new ATOM 0 HG12 VAL A 490 1.113 4.122 7.222 1.00 0.00 H new ATOM 0 HG13 VAL A 490 1.313 4.189 5.454 1.00 0.00 H new ATOM 0 HG21 VAL A 490 1.669 7.250 5.323 1.00 0.00 H new ATOM 0 HG22 VAL A 490 0.610 6.337 4.222 1.00 0.00 H new ATOM 0 HG23 VAL A 490 -0.050 7.685 5.178 1.00 0.00 H new ATOM 671 N ASN A 491 -2.028 5.112 8.351 1.00 0.00 N ATOM 672 CA ASN A 491 -2.415 4.412 9.572 1.00 0.00 C ATOM 673 C ASN A 491 -3.387 3.276 9.268 1.00 0.00 C ATOM 674 O ASN A 491 -3.117 2.118 9.582 1.00 0.00 O ATOM 675 CB ASN A 491 -3.048 5.388 10.565 1.00 0.00 C ATOM 676 CG ASN A 491 -2.014 6.094 11.421 1.00 0.00 C ATOM 677 OD1 ASN A 491 -2.099 6.086 12.648 1.00 0.00 O ATOM 678 ND2 ASN A 491 -1.031 6.710 10.775 1.00 0.00 N ATOM 0 H ASN A 491 -2.236 6.110 8.353 1.00 0.00 H new ATOM 0 HA ASN A 491 -1.515 3.985 10.015 1.00 0.00 H new ATOM 0 HB2 ASN A 491 -3.632 6.130 10.019 1.00 0.00 H new ATOM 0 HB3 ASN A 491 -3.741 4.848 11.209 1.00 0.00 H new ATOM 0 HD21 ASN A 491 -0.307 7.202 11.298 1.00 0.00 H new ATOM 0 HD22 ASN A 491 -1.000 6.691 9.756 1.00 0.00 H new ATOM 685 N VAL A 492 -4.517 3.615 8.655 1.00 0.00 N ATOM 686 CA VAL A 492 -5.526 2.620 8.310 1.00 0.00 C ATOM 687 C VAL A 492 -5.000 1.641 7.267 1.00 0.00 C ATOM 688 O VAL A 492 -5.421 0.486 7.216 1.00 0.00 O ATOM 689 CB VAL A 492 -6.814 3.278 7.782 1.00 0.00 C ATOM 690 CG1 VAL A 492 -7.902 2.234 7.582 1.00 0.00 C ATOM 691 CG2 VAL A 492 -7.281 4.372 8.730 1.00 0.00 C ATOM 0 H VAL A 492 -4.757 4.570 8.387 1.00 0.00 H new ATOM 0 HA VAL A 492 -5.758 2.078 9.227 1.00 0.00 H new ATOM 0 HB VAL A 492 -6.599 3.735 6.816 1.00 0.00 H new ATOM 0 HG11 VAL A 492 -8.805 2.717 7.209 1.00 0.00 H new ATOM 0 HG12 VAL A 492 -7.564 1.490 6.861 1.00 0.00 H new ATOM 0 HG13 VAL A 492 -8.118 1.747 8.533 1.00 0.00 H new ATOM 0 HG21 VAL A 492 -8.192 4.826 8.341 1.00 0.00 H new ATOM 0 HG22 VAL A 492 -7.480 3.942 9.712 1.00 0.00 H new ATOM 0 HG23 VAL A 492 -6.505 5.133 8.818 1.00 0.00 H new ATOM 701 N LEU A 493 -4.079 2.110 6.432 1.00 0.00 N ATOM 702 CA LEU A 493 -3.497 1.270 5.394 1.00 0.00 C ATOM 703 C LEU A 493 -2.498 0.289 5.996 1.00 0.00 C ATOM 704 O LEU A 493 -2.418 -0.866 5.580 1.00 0.00 O ATOM 705 CB LEU A 493 -2.811 2.130 4.332 1.00 0.00 C ATOM 706 CG LEU A 493 -3.754 2.792 3.328 1.00 0.00 C ATOM 707 CD1 LEU A 493 -3.105 4.023 2.719 1.00 0.00 C ATOM 708 CD2 LEU A 493 -4.152 1.803 2.242 1.00 0.00 C ATOM 0 H LEU A 493 -3.721 3.065 6.454 1.00 0.00 H new ATOM 0 HA LEU A 493 -4.301 0.705 4.923 1.00 0.00 H new ATOM 0 HB2 LEU A 493 -2.234 2.907 4.833 1.00 0.00 H new ATOM 0 HB3 LEU A 493 -2.101 1.509 3.786 1.00 0.00 H new ATOM 0 HG LEU A 493 -4.655 3.106 3.855 1.00 0.00 H new ATOM 0 HD11 LEU A 493 -3.791 4.481 2.007 1.00 0.00 H new ATOM 0 HD12 LEU A 493 -2.870 4.738 3.507 1.00 0.00 H new ATOM 0 HD13 LEU A 493 -2.188 3.734 2.205 1.00 0.00 H new ATOM 0 HD21 LEU A 493 -4.824 2.290 1.535 1.00 0.00 H new ATOM 0 HD22 LEU A 493 -3.260 1.460 1.718 1.00 0.00 H new ATOM 0 HD23 LEU A 493 -4.658 0.950 2.694 1.00 0.00 H new ATOM 720 N ALA A 494 -1.740 0.758 6.980 1.00 0.00 N ATOM 721 CA ALA A 494 -0.750 -0.078 7.644 1.00 0.00 C ATOM 722 C ALA A 494 -1.417 -1.249 8.354 1.00 0.00 C ATOM 723 O ALA A 494 -0.943 -2.383 8.288 1.00 0.00 O ATOM 724 CB ALA A 494 0.065 0.748 8.629 1.00 0.00 C ATOM 0 H ALA A 494 -1.793 1.713 7.335 1.00 0.00 H new ATOM 0 HA ALA A 494 -0.078 -0.480 6.886 1.00 0.00 H new ATOM 0 HB1 ALA A 494 0.801 0.110 9.118 1.00 0.00 H new ATOM 0 HB2 ALA A 494 0.577 1.549 8.096 1.00 0.00 H new ATOM 0 HB3 ALA A 494 -0.598 1.178 9.380 1.00 0.00 H new ATOM 730 N GLN A 495 -2.522 -0.964 9.033 1.00 0.00 N ATOM 731 CA GLN A 495 -3.262 -1.994 9.759 1.00 0.00 C ATOM 732 C GLN A 495 -4.000 -2.919 8.796 1.00 0.00 C ATOM 733 O GLN A 495 -3.950 -4.141 8.935 1.00 0.00 O ATOM 734 CB GLN A 495 -4.258 -1.369 10.744 1.00 0.00 C ATOM 735 CG GLN A 495 -4.901 -0.081 10.257 1.00 0.00 C ATOM 736 CD GLN A 495 -6.385 -0.018 10.559 1.00 0.00 C ATOM 737 OE1 GLN A 495 -7.137 -0.935 10.228 1.00 0.00 O ATOM 738 NE2 GLN A 495 -6.815 1.068 11.190 1.00 0.00 N ATOM 0 H GLN A 495 -2.926 -0.030 9.097 1.00 0.00 H new ATOM 0 HA GLN A 495 -2.536 -2.580 10.322 1.00 0.00 H new ATOM 0 HB2 GLN A 495 -5.043 -2.094 10.957 1.00 0.00 H new ATOM 0 HB3 GLN A 495 -3.744 -1.171 11.684 1.00 0.00 H new ATOM 0 HG2 GLN A 495 -4.403 0.768 10.724 1.00 0.00 H new ATOM 0 HG3 GLN A 495 -4.749 0.012 9.182 1.00 0.00 H new ATOM 0 HE21 GLN A 495 -6.156 1.804 11.446 1.00 0.00 H new ATOM 0 HE22 GLN A 495 -7.804 1.167 11.419 1.00 0.00 H new ATOM 747 N ILE A 496 -4.687 -2.331 7.822 1.00 0.00 N ATOM 748 CA ILE A 496 -5.436 -3.109 6.843 1.00 0.00 C ATOM 749 C ILE A 496 -4.503 -3.990 6.018 1.00 0.00 C ATOM 750 O ILE A 496 -4.783 -5.166 5.784 1.00 0.00 O ATOM 751 CB ILE A 496 -6.261 -2.190 5.909 1.00 0.00 C ATOM 752 CG1 ILE A 496 -7.530 -2.905 5.445 1.00 0.00 C ATOM 753 CG2 ILE A 496 -5.443 -1.724 4.709 1.00 0.00 C ATOM 754 CD1 ILE A 496 -8.660 -1.963 5.093 1.00 0.00 C ATOM 0 H ILE A 496 -4.740 -1.321 7.690 1.00 0.00 H new ATOM 0 HA ILE A 496 -6.126 -3.749 7.393 1.00 0.00 H new ATOM 0 HB ILE A 496 -6.541 -1.305 6.480 1.00 0.00 H new ATOM 0 HG12 ILE A 496 -7.294 -3.518 4.575 1.00 0.00 H new ATOM 0 HG13 ILE A 496 -7.864 -3.582 6.231 1.00 0.00 H new ATOM 0 HG21 ILE A 496 -6.057 -1.081 4.078 1.00 0.00 H new ATOM 0 HG22 ILE A 496 -4.573 -1.167 5.056 1.00 0.00 H new ATOM 0 HG23 ILE A 496 -5.114 -2.590 4.134 1.00 0.00 H new ATOM 0 HD11 ILE A 496 -9.528 -2.539 4.772 1.00 0.00 H new ATOM 0 HD12 ILE A 496 -8.923 -1.367 5.967 1.00 0.00 H new ATOM 0 HD13 ILE A 496 -8.345 -1.302 4.285 1.00 0.00 H new ATOM 766 N LEU A 497 -3.394 -3.407 5.583 1.00 0.00 N ATOM 767 CA LEU A 497 -2.410 -4.127 4.784 1.00 0.00 C ATOM 768 C LEU A 497 -1.674 -5.165 5.625 1.00 0.00 C ATOM 769 O LEU A 497 -1.195 -6.171 5.102 1.00 0.00 O ATOM 770 CB LEU A 497 -1.407 -3.149 4.167 1.00 0.00 C ATOM 771 CG LEU A 497 -1.963 -2.279 3.039 1.00 0.00 C ATOM 772 CD1 LEU A 497 -1.224 -0.952 2.975 1.00 0.00 C ATOM 773 CD2 LEU A 497 -1.867 -3.009 1.707 1.00 0.00 C ATOM 0 H LEU A 497 -3.152 -2.434 5.771 1.00 0.00 H new ATOM 0 HA LEU A 497 -2.941 -4.646 3.985 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -1.026 -2.498 4.954 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -0.558 -3.716 3.784 1.00 0.00 H new ATOM 0 HG LEU A 497 -3.014 -2.077 3.246 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -1.633 -0.346 2.166 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -1.343 -0.423 3.921 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -0.165 -1.134 2.792 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -2.267 -2.376 0.915 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -0.824 -3.241 1.494 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -2.442 -3.934 1.757 1.00 0.00 H new ATOM 785 N LYS A 498 -1.583 -4.919 6.928 1.00 0.00 N ATOM 786 CA LYS A 498 -0.901 -5.840 7.831 1.00 0.00 C ATOM 787 C LYS A 498 -1.504 -7.239 7.744 1.00 0.00 C ATOM 788 O LYS A 498 -0.791 -8.223 7.567 1.00 0.00 O ATOM 789 CB LYS A 498 -0.970 -5.330 9.272 1.00 0.00 C ATOM 790 CG LYS A 498 -0.177 -6.177 10.253 1.00 0.00 C ATOM 791 CD LYS A 498 1.253 -6.390 9.777 1.00 0.00 C ATOM 792 CE LYS A 498 2.050 -7.255 10.740 1.00 0.00 C ATOM 793 NZ LYS A 498 1.215 -8.320 11.363 1.00 0.00 N ATOM 0 H LYS A 498 -1.972 -4.092 7.381 1.00 0.00 H new ATOM 0 HA LYS A 498 0.144 -5.895 7.525 1.00 0.00 H new ATOM 0 HB2 LYS A 498 -0.598 -4.306 9.305 1.00 0.00 H new ATOM 0 HB3 LYS A 498 -2.012 -5.301 9.589 1.00 0.00 H new ATOM 0 HG2 LYS A 498 -0.168 -5.693 11.229 1.00 0.00 H new ATOM 0 HG3 LYS A 498 -0.667 -7.142 10.381 1.00 0.00 H new ATOM 0 HD2 LYS A 498 1.242 -6.859 8.793 1.00 0.00 H new ATOM 0 HD3 LYS A 498 1.745 -5.424 9.664 1.00 0.00 H new ATOM 0 HE2 LYS A 498 2.884 -7.714 10.209 1.00 0.00 H new ATOM 0 HE3 LYS A 498 2.477 -6.627 11.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 498 1.831 -9.065 11.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 498 0.648 -7.911 12.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 498 0.582 -8.728 10.646 1.00 0.00 H new ATOM 807 N ARG A 499 -2.822 -7.315 7.871 1.00 0.00 N ATOM 808 CA ARG A 499 -3.533 -8.588 7.807 1.00 0.00 C ATOM 809 C ARG A 499 -3.715 -9.054 6.362 1.00 0.00 C ATOM 810 O ARG A 499 -4.066 -10.208 6.113 1.00 0.00 O ATOM 811 CB ARG A 499 -4.897 -8.468 8.489 1.00 0.00 C ATOM 812 CG ARG A 499 -5.614 -9.797 8.656 1.00 0.00 C ATOM 813 CD ARG A 499 -6.987 -9.615 9.283 1.00 0.00 C ATOM 814 NE ARG A 499 -7.633 -10.894 9.567 1.00 0.00 N ATOM 815 CZ ARG A 499 -7.271 -11.703 10.560 1.00 0.00 C ATOM 816 NH1 ARG A 499 -6.271 -11.369 11.366 1.00 0.00 N ATOM 817 NH2 ARG A 499 -7.912 -12.849 10.748 1.00 0.00 N ATOM 0 H ARG A 499 -3.425 -6.506 8.020 1.00 0.00 H new ATOM 0 HA ARG A 499 -2.931 -9.331 8.331 1.00 0.00 H new ATOM 0 HB2 ARG A 499 -4.764 -8.011 9.470 1.00 0.00 H new ATOM 0 HB3 ARG A 499 -5.527 -7.796 7.906 1.00 0.00 H new ATOM 0 HG2 ARG A 499 -5.718 -10.280 7.684 1.00 0.00 H new ATOM 0 HG3 ARG A 499 -5.013 -10.460 9.279 1.00 0.00 H new ATOM 0 HD2 ARG A 499 -6.891 -9.044 10.207 1.00 0.00 H new ATOM 0 HD3 ARG A 499 -7.617 -9.032 8.612 1.00 0.00 H new ATOM 0 HE ARG A 499 -8.407 -11.184 8.969 1.00 0.00 H new ATOM 0 HH11 ARG A 499 -5.776 -10.488 11.226 1.00 0.00 H new ATOM 0 HH12 ARG A 499 -5.998 -11.993 12.125 1.00 0.00 H new ATOM 0 HH21 ARG A 499 -8.682 -13.110 10.132 1.00 0.00 H new ATOM 0 HH22 ARG A 499 -7.635 -13.469 11.509 1.00 0.00 H new ATOM 831 N LEU A 500 -3.506 -8.142 5.415 1.00 0.00 N ATOM 832 CA LEU A 500 -3.677 -8.446 3.995 1.00 0.00 C ATOM 833 C LEU A 500 -3.041 -9.776 3.595 1.00 0.00 C ATOM 834 O LEU A 500 -3.620 -10.534 2.816 1.00 0.00 O ATOM 835 CB LEU A 500 -3.101 -7.316 3.139 1.00 0.00 C ATOM 836 CG LEU A 500 -3.235 -7.515 1.629 1.00 0.00 C ATOM 837 CD1 LEU A 500 -4.689 -7.388 1.201 1.00 0.00 C ATOM 838 CD2 LEU A 500 -2.368 -6.514 0.882 1.00 0.00 C ATOM 0 H LEU A 500 -3.217 -7.183 5.606 1.00 0.00 H new ATOM 0 HA LEU A 500 -4.749 -8.535 3.818 1.00 0.00 H new ATOM 0 HB2 LEU A 500 -3.597 -6.385 3.413 1.00 0.00 H new ATOM 0 HB3 LEU A 500 -2.045 -7.199 3.382 1.00 0.00 H new ATOM 0 HG LEU A 500 -2.892 -8.519 1.381 1.00 0.00 H new ATOM 0 HD11 LEU A 500 -4.765 -7.533 0.123 1.00 0.00 H new ATOM 0 HD12 LEU A 500 -5.286 -8.144 1.711 1.00 0.00 H new ATOM 0 HD13 LEU A 500 -5.060 -6.396 1.461 1.00 0.00 H new ATOM 0 HD21 LEU A 500 -2.475 -6.670 -0.191 1.00 0.00 H new ATOM 0 HD22 LEU A 500 -2.681 -5.501 1.135 1.00 0.00 H new ATOM 0 HD23 LEU A 500 -1.325 -6.653 1.166 1.00 0.00 H new ATOM 850 N ASN A 501 -1.855 -10.054 4.113 1.00 0.00 N ATOM 851 CA ASN A 501 -1.160 -11.297 3.786 1.00 0.00 C ATOM 852 C ASN A 501 -0.971 -11.437 2.275 1.00 0.00 C ATOM 853 O ASN A 501 -1.277 -12.479 1.696 1.00 0.00 O ATOM 854 CB ASN A 501 -1.937 -12.498 4.329 1.00 0.00 C ATOM 855 CG ASN A 501 -1.122 -13.776 4.295 1.00 0.00 C ATOM 856 OD1 ASN A 501 -1.448 -14.715 3.568 1.00 0.00 O ATOM 857 ND2 ASN A 501 -0.057 -13.821 5.087 1.00 0.00 N ATOM 0 H ASN A 501 -1.353 -9.443 4.757 1.00 0.00 H new ATOM 0 HA ASN A 501 -0.176 -11.267 4.254 1.00 0.00 H new ATOM 0 HB2 ASN A 501 -2.246 -12.294 5.354 1.00 0.00 H new ATOM 0 HB3 ASN A 501 -2.846 -12.634 3.743 1.00 0.00 H new ATOM 0 HD21 ASN A 501 0.527 -14.657 5.109 1.00 0.00 H new ATOM 0 HD22 ASN A 501 0.177 -13.020 5.673 1.00 0.00 H new ATOM 864 N PRO A 502 -0.461 -10.381 1.615 1.00 0.00 N ATOM 865 CA PRO A 502 -0.231 -10.388 0.168 1.00 0.00 C ATOM 866 C PRO A 502 1.000 -11.200 -0.221 1.00 0.00 C ATOM 867 O PRO A 502 1.560 -11.930 0.597 1.00 0.00 O ATOM 868 CB PRO A 502 -0.014 -8.911 -0.153 1.00 0.00 C ATOM 869 CG PRO A 502 0.573 -8.347 1.093 1.00 0.00 C ATOM 870 CD PRO A 502 -0.067 -9.096 2.228 1.00 0.00 C ATOM 0 HA PRO A 502 -1.057 -10.846 -0.376 1.00 0.00 H new ATOM 0 HB2 PRO A 502 0.657 -8.783 -1.002 1.00 0.00 H new ATOM 0 HB3 PRO A 502 -0.951 -8.418 -0.410 1.00 0.00 H new ATOM 0 HG2 PRO A 502 1.656 -8.471 1.105 1.00 0.00 H new ATOM 0 HG3 PRO A 502 0.374 -7.278 1.169 1.00 0.00 H new ATOM 0 HD2 PRO A 502 0.628 -9.242 3.055 1.00 0.00 H new ATOM 0 HD3 PRO A 502 -0.929 -8.561 2.627 1.00 0.00 H new ATOM 878 N GLU A 503 1.419 -11.063 -1.475 1.00 0.00 N ATOM 879 CA GLU A 503 2.588 -11.776 -1.975 1.00 0.00 C ATOM 880 C GLU A 503 3.752 -10.814 -2.189 1.00 0.00 C ATOM 881 O GLU A 503 3.559 -9.601 -2.274 1.00 0.00 O ATOM 882 CB GLU A 503 2.253 -12.493 -3.285 1.00 0.00 C ATOM 883 CG GLU A 503 1.151 -13.531 -3.146 1.00 0.00 C ATOM 884 CD GLU A 503 0.883 -14.275 -4.439 1.00 0.00 C ATOM 885 OE1 GLU A 503 1.387 -13.835 -5.494 1.00 0.00 O ATOM 886 OE2 GLU A 503 0.168 -15.298 -4.397 1.00 0.00 O ATOM 0 H GLU A 503 0.965 -10.464 -2.164 1.00 0.00 H new ATOM 0 HA GLU A 503 2.881 -12.517 -1.232 1.00 0.00 H new ATOM 0 HB2 GLU A 503 1.953 -11.754 -4.028 1.00 0.00 H new ATOM 0 HB3 GLU A 503 3.152 -12.979 -3.664 1.00 0.00 H new ATOM 0 HG2 GLU A 503 1.426 -14.246 -2.370 1.00 0.00 H new ATOM 0 HG3 GLU A 503 0.235 -13.041 -2.817 1.00 0.00 H new ATOM 893 N ARG A 504 4.960 -11.360 -2.274 1.00 0.00 N ATOM 894 CA ARG A 504 6.152 -10.544 -2.476 1.00 0.00 C ATOM 895 C ARG A 504 6.854 -10.909 -3.779 1.00 0.00 C ATOM 896 O ARG A 504 7.093 -12.083 -4.063 1.00 0.00 O ATOM 897 CB ARG A 504 7.116 -10.713 -1.300 1.00 0.00 C ATOM 898 CG ARG A 504 6.605 -10.109 -0.003 1.00 0.00 C ATOM 899 CD ARG A 504 7.670 -10.133 1.081 1.00 0.00 C ATOM 900 NE ARG A 504 7.566 -8.983 1.977 1.00 0.00 N ATOM 901 CZ ARG A 504 7.768 -7.725 1.595 1.00 0.00 C ATOM 902 NH1 ARG A 504 8.085 -7.448 0.336 1.00 0.00 N ATOM 903 NH2 ARG A 504 7.652 -6.739 2.474 1.00 0.00 N ATOM 0 H ARG A 504 5.140 -12.362 -2.206 1.00 0.00 H new ATOM 0 HA ARG A 504 5.839 -9.502 -2.536 1.00 0.00 H new ATOM 0 HB2 ARG A 504 7.306 -11.775 -1.146 1.00 0.00 H new ATOM 0 HB3 ARG A 504 8.071 -10.252 -1.554 1.00 0.00 H new ATOM 0 HG2 ARG A 504 6.287 -9.081 -0.179 1.00 0.00 H new ATOM 0 HG3 ARG A 504 5.728 -10.660 0.335 1.00 0.00 H new ATOM 0 HD2 ARG A 504 7.578 -11.052 1.659 1.00 0.00 H new ATOM 0 HD3 ARG A 504 8.657 -10.144 0.619 1.00 0.00 H new ATOM 0 HE ARG A 504 7.324 -9.155 2.953 1.00 0.00 H new ATOM 0 HH11 ARG A 504 8.175 -8.202 -0.345 1.00 0.00 H new ATOM 0 HH12 ARG A 504 8.239 -6.481 0.050 1.00 0.00 H new ATOM 0 HH21 ARG A 504 7.408 -6.945 3.443 1.00 0.00 H new ATOM 0 HH22 ARG A 504 7.807 -5.774 2.182 1.00 0.00 H new ATOM 917 N LYS A 505 7.185 -9.891 -4.569 1.00 0.00 N ATOM 918 CA LYS A 505 7.864 -10.099 -5.843 1.00 0.00 C ATOM 919 C LYS A 505 8.934 -9.035 -6.064 1.00 0.00 C ATOM 920 O LYS A 505 8.727 -7.860 -5.760 1.00 0.00 O ATOM 921 CB LYS A 505 6.855 -10.071 -6.992 1.00 0.00 C ATOM 922 CG LYS A 505 5.841 -11.202 -6.940 1.00 0.00 C ATOM 923 CD LYS A 505 4.947 -11.207 -8.170 1.00 0.00 C ATOM 924 CE LYS A 505 3.877 -12.283 -8.078 1.00 0.00 C ATOM 925 NZ LYS A 505 2.685 -11.955 -8.907 1.00 0.00 N ATOM 0 H LYS A 505 6.994 -8.914 -4.348 1.00 0.00 H new ATOM 0 HA LYS A 505 8.346 -11.076 -5.817 1.00 0.00 H new ATOM 0 HB2 LYS A 505 6.325 -9.118 -6.976 1.00 0.00 H new ATOM 0 HB3 LYS A 505 7.393 -10.120 -7.938 1.00 0.00 H new ATOM 0 HG2 LYS A 505 6.362 -12.156 -6.864 1.00 0.00 H new ATOM 0 HG3 LYS A 505 5.228 -11.102 -6.044 1.00 0.00 H new ATOM 0 HD2 LYS A 505 4.474 -10.231 -8.281 1.00 0.00 H new ATOM 0 HD3 LYS A 505 5.553 -11.371 -9.061 1.00 0.00 H new ATOM 0 HE2 LYS A 505 4.293 -13.237 -8.402 1.00 0.00 H new ATOM 0 HE3 LYS A 505 3.573 -12.405 -7.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 505 1.837 -11.943 -8.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 505 2.813 -11.020 -9.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 505 2.572 -12.673 -9.651 1.00 0.00 H new ATOM 939 N MET A 506 10.079 -9.454 -6.592 1.00 0.00 N ATOM 940 CA MET A 506 11.182 -8.534 -6.850 1.00 0.00 C ATOM 941 C MET A 506 11.110 -7.982 -8.271 1.00 0.00 C ATOM 942 O MET A 506 11.517 -8.644 -9.225 1.00 0.00 O ATOM 943 CB MET A 506 12.525 -9.232 -6.628 1.00 0.00 C ATOM 944 CG MET A 506 12.615 -10.605 -7.277 1.00 0.00 C ATOM 945 SD MET A 506 14.290 -11.272 -7.259 1.00 0.00 S ATOM 946 CE MET A 506 14.451 -11.736 -5.536 1.00 0.00 C ATOM 0 H MET A 506 10.268 -10.423 -6.849 1.00 0.00 H new ATOM 0 HA MET A 506 11.096 -7.702 -6.151 1.00 0.00 H new ATOM 0 HB2 MET A 506 13.322 -8.601 -7.021 1.00 0.00 H new ATOM 0 HB3 MET A 506 12.699 -9.334 -5.557 1.00 0.00 H new ATOM 0 HG2 MET A 506 11.948 -11.293 -6.757 1.00 0.00 H new ATOM 0 HG3 MET A 506 12.265 -10.539 -8.307 1.00 0.00 H new ATOM 0 HE1 MET A 506 15.431 -12.182 -5.369 1.00 0.00 H new ATOM 0 HE2 MET A 506 14.344 -10.851 -4.909 1.00 0.00 H new ATOM 0 HE3 MET A 506 13.675 -12.458 -5.280 1.00 0.00 H new ATOM 956 N ILE A 507 10.591 -6.766 -8.402 1.00 0.00 N ATOM 957 CA ILE A 507 10.467 -6.124 -9.705 1.00 0.00 C ATOM 958 C ILE A 507 11.316 -4.858 -9.773 1.00 0.00 C ATOM 959 O ILE A 507 11.224 -3.991 -8.905 1.00 0.00 O ATOM 960 CB ILE A 507 9.001 -5.764 -10.018 1.00 0.00 C ATOM 961 CG1 ILE A 507 8.100 -6.983 -9.818 1.00 0.00 C ATOM 962 CG2 ILE A 507 8.875 -5.234 -11.439 1.00 0.00 C ATOM 963 CD1 ILE A 507 6.637 -6.704 -10.083 1.00 0.00 C ATOM 0 H ILE A 507 10.249 -6.205 -7.621 1.00 0.00 H new ATOM 0 HA ILE A 507 10.822 -6.839 -10.447 1.00 0.00 H new ATOM 0 HB ILE A 507 8.681 -4.981 -9.330 1.00 0.00 H new ATOM 0 HG12 ILE A 507 8.434 -7.784 -10.478 1.00 0.00 H new ATOM 0 HG13 ILE A 507 8.213 -7.344 -8.796 1.00 0.00 H new ATOM 0 HG21 ILE A 507 7.834 -4.985 -11.643 1.00 0.00 H new ATOM 0 HG22 ILE A 507 9.490 -4.341 -11.550 1.00 0.00 H new ATOM 0 HG23 ILE A 507 9.210 -5.996 -12.143 1.00 0.00 H new ATOM 0 HD11 ILE A 507 6.058 -7.613 -9.922 1.00 0.00 H new ATOM 0 HD12 ILE A 507 6.286 -5.926 -9.405 1.00 0.00 H new ATOM 0 HD13 ILE A 507 6.511 -6.372 -11.113 1.00 0.00 H new ATOM 975 N ASN A 508 12.141 -4.759 -10.810 1.00 0.00 N ATOM 976 CA ASN A 508 13.007 -3.599 -10.990 1.00 0.00 C ATOM 977 C ASN A 508 13.939 -3.426 -9.796 1.00 0.00 C ATOM 978 O ASN A 508 14.154 -2.311 -9.319 1.00 0.00 O ATOM 979 CB ASN A 508 12.166 -2.337 -11.188 1.00 0.00 C ATOM 980 CG ASN A 508 12.969 -1.193 -11.776 1.00 0.00 C ATOM 981 OD1 ASN A 508 13.465 -1.281 -12.900 1.00 0.00 O ATOM 982 ND2 ASN A 508 13.103 -0.111 -11.017 1.00 0.00 N ATOM 0 H ASN A 508 12.228 -5.468 -11.538 1.00 0.00 H new ATOM 0 HA ASN A 508 13.616 -3.763 -11.879 1.00 0.00 H new ATOM 0 HB2 ASN A 508 11.326 -2.563 -11.845 1.00 0.00 H new ATOM 0 HB3 ASN A 508 11.747 -2.029 -10.230 1.00 0.00 H new ATOM 0 HD21 ASN A 508 13.634 0.690 -11.360 1.00 0.00 H new ATOM 0 HD22 ASN A 508 12.675 -0.081 -10.092 1.00 0.00 H new ATOM 989 N ASP A 509 14.490 -4.536 -9.316 1.00 0.00 N ATOM 990 CA ASP A 509 15.399 -4.510 -8.176 1.00 0.00 C ATOM 991 C ASP A 509 14.716 -3.920 -6.947 1.00 0.00 C ATOM 992 O ASP A 509 15.361 -3.298 -6.104 1.00 0.00 O ATOM 993 CB ASP A 509 16.651 -3.698 -8.516 1.00 0.00 C ATOM 994 CG ASP A 509 17.480 -4.343 -9.610 1.00 0.00 C ATOM 995 OD1 ASP A 509 17.277 -5.546 -9.878 1.00 0.00 O ATOM 996 OD2 ASP A 509 18.333 -3.646 -10.197 1.00 0.00 O ATOM 0 H ASP A 509 14.322 -5.466 -9.700 1.00 0.00 H new ATOM 0 HA ASP A 509 15.688 -5.536 -7.950 1.00 0.00 H new ATOM 0 HB2 ASP A 509 16.357 -2.696 -8.830 1.00 0.00 H new ATOM 0 HB3 ASP A 509 17.262 -3.585 -7.620 1.00 0.00 H new ATOM 1001 N LYS A 510 13.405 -4.124 -6.850 1.00 0.00 N ATOM 1002 CA LYS A 510 12.633 -3.615 -5.722 1.00 0.00 C ATOM 1003 C LYS A 510 11.565 -4.619 -5.299 1.00 0.00 C ATOM 1004 O LYS A 510 11.070 -5.395 -6.117 1.00 0.00 O ATOM 1005 CB LYS A 510 11.976 -2.281 -6.082 1.00 0.00 C ATOM 1006 CG LYS A 510 12.968 -1.188 -6.442 1.00 0.00 C ATOM 1007 CD LYS A 510 13.818 -0.791 -5.246 1.00 0.00 C ATOM 1008 CE LYS A 510 14.741 0.370 -5.579 1.00 0.00 C ATOM 1009 NZ LYS A 510 14.937 1.275 -4.414 1.00 0.00 N ATOM 0 H LYS A 510 12.856 -4.638 -7.539 1.00 0.00 H new ATOM 0 HA LYS A 510 13.317 -3.461 -4.888 1.00 0.00 H new ATOM 0 HB2 LYS A 510 11.298 -2.435 -6.922 1.00 0.00 H new ATOM 0 HB3 LYS A 510 11.370 -1.946 -5.240 1.00 0.00 H new ATOM 0 HG2 LYS A 510 13.613 -1.533 -7.250 1.00 0.00 H new ATOM 0 HG3 LYS A 510 12.431 -0.315 -6.813 1.00 0.00 H new ATOM 0 HD2 LYS A 510 13.170 -0.515 -4.414 1.00 0.00 H new ATOM 0 HD3 LYS A 510 14.410 -1.646 -4.919 1.00 0.00 H new ATOM 0 HE2 LYS A 510 15.707 -0.016 -5.905 1.00 0.00 H new ATOM 0 HE3 LYS A 510 14.326 0.936 -6.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 510 15.572 2.053 -4.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 510 14.019 1.664 -4.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 510 15.357 0.741 -3.626 1.00 0.00 H new ATOM 1023 N MET A 511 11.212 -4.594 -4.019 1.00 0.00 N ATOM 1024 CA MET A 511 10.200 -5.500 -3.488 1.00 0.00 C ATOM 1025 C MET A 511 8.799 -4.935 -3.709 1.00 0.00 C ATOM 1026 O MET A 511 8.471 -3.854 -3.219 1.00 0.00 O ATOM 1027 CB MET A 511 10.436 -5.747 -1.998 1.00 0.00 C ATOM 1028 CG MET A 511 11.569 -6.722 -1.717 1.00 0.00 C ATOM 1029 SD MET A 511 12.301 -6.488 -0.085 1.00 0.00 S ATOM 1030 CE MET A 511 14.038 -6.719 -0.457 1.00 0.00 C ATOM 0 H MET A 511 11.611 -3.957 -3.330 1.00 0.00 H new ATOM 0 HA MET A 511 10.279 -6.448 -4.020 1.00 0.00 H new ATOM 0 HB2 MET A 511 10.655 -4.797 -1.511 1.00 0.00 H new ATOM 0 HB3 MET A 511 9.518 -6.130 -1.551 1.00 0.00 H new ATOM 0 HG2 MET A 511 11.194 -7.742 -1.799 1.00 0.00 H new ATOM 0 HG3 MET A 511 12.341 -6.604 -2.477 1.00 0.00 H new ATOM 0 HE1 MET A 511 14.624 -6.605 0.455 1.00 0.00 H new ATOM 0 HE2 MET A 511 14.193 -7.718 -0.865 1.00 0.00 H new ATOM 0 HE3 MET A 511 14.356 -5.975 -1.188 1.00 0.00 H new ATOM 1040 N HIS A 512 7.980 -5.671 -4.452 1.00 0.00 N ATOM 1041 CA HIS A 512 6.616 -5.242 -4.740 1.00 0.00 C ATOM 1042 C HIS A 512 5.599 -6.199 -4.127 1.00 0.00 C ATOM 1043 O HIS A 512 5.946 -7.303 -3.706 1.00 0.00 O ATOM 1044 CB HIS A 512 6.397 -5.149 -6.251 1.00 0.00 C ATOM 1045 CG HIS A 512 7.066 -3.968 -6.883 1.00 0.00 C ATOM 1046 ND1 HIS A 512 8.415 -3.927 -7.167 1.00 0.00 N ATOM 1047 CD2 HIS A 512 6.561 -2.779 -7.293 1.00 0.00 C ATOM 1048 CE1 HIS A 512 8.711 -2.765 -7.721 1.00 0.00 C ATOM 1049 NE2 HIS A 512 7.604 -2.051 -7.810 1.00 0.00 N ATOM 0 H HIS A 512 8.237 -6.567 -4.866 1.00 0.00 H new ATOM 0 HA HIS A 512 6.473 -4.257 -4.296 1.00 0.00 H new ATOM 0 HB2 HIS A 512 6.768 -6.060 -6.720 1.00 0.00 H new ATOM 0 HB3 HIS A 512 5.327 -5.100 -6.452 1.00 0.00 H new ATOM 0 HD1 HIS A 512 9.080 -4.677 -6.979 1.00 0.00 H new ATOM 0 HD2 HIS A 512 5.530 -2.463 -7.226 1.00 0.00 H new ATOM 0 HE1 HIS A 512 9.692 -2.452 -8.046 1.00 0.00 H new ATOM 1058 N PHE A 513 4.342 -5.769 -4.083 1.00 0.00 N ATOM 1059 CA PHE A 513 3.271 -6.585 -3.524 1.00 0.00 C ATOM 1060 C PHE A 513 2.317 -7.051 -4.620 1.00 0.00 C ATOM 1061 O PHE A 513 1.978 -6.288 -5.525 1.00 0.00 O ATOM 1062 CB PHE A 513 2.501 -5.798 -2.463 1.00 0.00 C ATOM 1063 CG PHE A 513 3.152 -5.813 -1.109 1.00 0.00 C ATOM 1064 CD1 PHE A 513 2.956 -6.877 -0.244 1.00 0.00 C ATOM 1065 CD2 PHE A 513 3.957 -4.761 -0.701 1.00 0.00 C ATOM 1066 CE1 PHE A 513 3.551 -6.893 1.004 1.00 0.00 C ATOM 1067 CE2 PHE A 513 4.554 -4.772 0.546 1.00 0.00 C ATOM 1068 CZ PHE A 513 4.351 -5.839 1.399 1.00 0.00 C ATOM 0 H PHE A 513 4.040 -4.858 -4.429 1.00 0.00 H new ATOM 0 HA PHE A 513 3.721 -7.462 -3.059 1.00 0.00 H new ATOM 0 HB2 PHE A 513 2.396 -4.765 -2.794 1.00 0.00 H new ATOM 0 HB3 PHE A 513 1.495 -6.209 -2.377 1.00 0.00 H new ATOM 0 HD1 PHE A 513 2.331 -7.704 -0.548 1.00 0.00 H new ATOM 0 HD2 PHE A 513 4.120 -3.924 -1.364 1.00 0.00 H new ATOM 0 HE1 PHE A 513 3.390 -7.729 1.669 1.00 0.00 H new ATOM 0 HE2 PHE A 513 5.179 -3.946 0.853 1.00 0.00 H new ATOM 0 HZ PHE A 513 4.817 -5.849 2.373 1.00 0.00 H new ATOM 1078 N SER A 514 1.887 -8.305 -4.532 1.00 0.00 N ATOM 1079 CA SER A 514 0.971 -8.869 -5.517 1.00 0.00 C ATOM 1080 C SER A 514 -0.065 -9.765 -4.847 1.00 0.00 C ATOM 1081 O SER A 514 0.173 -10.304 -3.765 1.00 0.00 O ATOM 1082 CB SER A 514 1.747 -9.663 -6.569 1.00 0.00 C ATOM 1083 OG SER A 514 2.350 -10.812 -5.999 1.00 0.00 O ATOM 0 H SER A 514 2.158 -8.950 -3.789 1.00 0.00 H new ATOM 0 HA SER A 514 0.450 -8.046 -6.005 1.00 0.00 H new ATOM 0 HB2 SER A 514 1.074 -9.962 -7.373 1.00 0.00 H new ATOM 0 HB3 SER A 514 2.514 -9.029 -7.015 1.00 0.00 H new ATOM 0 HG SER A 514 3.177 -10.554 -5.540 1.00 0.00 H new ATOM 1089 N LEU A 515 -1.214 -9.921 -5.496 1.00 0.00 N ATOM 1090 CA LEU A 515 -2.286 -10.753 -4.963 1.00 0.00 C ATOM 1091 C LEU A 515 -3.085 -11.398 -6.090 1.00 0.00 C ATOM 1092 O LEU A 515 -3.814 -10.720 -6.815 1.00 0.00 O ATOM 1093 CB LEU A 515 -3.211 -9.917 -4.073 1.00 0.00 C ATOM 1094 CG LEU A 515 -3.362 -10.427 -2.638 1.00 0.00 C ATOM 1095 CD1 LEU A 515 -3.565 -9.263 -1.679 1.00 0.00 C ATOM 1096 CD2 LEU A 515 -4.521 -11.408 -2.541 1.00 0.00 C ATOM 0 H LEU A 515 -1.427 -9.482 -6.392 1.00 0.00 H new ATOM 0 HA LEU A 515 -1.837 -11.546 -4.364 1.00 0.00 H new ATOM 0 HB2 LEU A 515 -2.834 -8.895 -4.042 1.00 0.00 H new ATOM 0 HB3 LEU A 515 -4.198 -9.879 -4.535 1.00 0.00 H new ATOM 0 HG LEU A 515 -2.447 -10.948 -2.358 1.00 0.00 H new ATOM 0 HD11 LEU A 515 -3.671 -9.643 -0.663 1.00 0.00 H new ATOM 0 HD12 LEU A 515 -2.705 -8.596 -1.729 1.00 0.00 H new ATOM 0 HD13 LEU A 515 -4.465 -8.715 -1.957 1.00 0.00 H new ATOM 0 HD21 LEU A 515 -4.614 -11.761 -1.514 1.00 0.00 H new ATOM 0 HD22 LEU A 515 -5.444 -10.911 -2.839 1.00 0.00 H new ATOM 0 HD23 LEU A 515 -4.336 -12.256 -3.200 1.00 0.00 H new ATOM 1108 N LYS A 516 -2.944 -12.712 -6.233 1.00 0.00 N ATOM 1109 CA LYS A 516 -3.655 -13.447 -7.273 1.00 0.00 C ATOM 1110 C LYS A 516 -4.976 -13.995 -6.744 1.00 0.00 C ATOM 1111 O LYS A 516 -5.027 -14.587 -5.666 1.00 0.00 O ATOM 1112 CB LYS A 516 -2.789 -14.592 -7.801 1.00 0.00 C ATOM 1113 CG LYS A 516 -1.531 -14.124 -8.515 1.00 0.00 C ATOM 1114 CD LYS A 516 -0.707 -15.297 -9.019 1.00 0.00 C ATOM 1115 CE LYS A 516 -1.385 -15.993 -10.188 1.00 0.00 C ATOM 1116 NZ LYS A 516 -1.363 -15.159 -11.421 1.00 0.00 N ATOM 0 H LYS A 516 -2.345 -13.289 -5.643 1.00 0.00 H new ATOM 0 HA LYS A 516 -3.869 -12.757 -8.089 1.00 0.00 H new ATOM 0 HB2 LYS A 516 -2.506 -15.236 -6.968 1.00 0.00 H new ATOM 0 HB3 LYS A 516 -3.381 -15.198 -8.486 1.00 0.00 H new ATOM 0 HG2 LYS A 516 -1.804 -13.483 -9.353 1.00 0.00 H new ATOM 0 HG3 LYS A 516 -0.929 -13.521 -7.836 1.00 0.00 H new ATOM 0 HD2 LYS A 516 0.278 -14.946 -9.325 1.00 0.00 H new ATOM 0 HD3 LYS A 516 -0.554 -16.010 -8.209 1.00 0.00 H new ATOM 0 HE2 LYS A 516 -0.887 -16.943 -10.383 1.00 0.00 H new ATOM 0 HE3 LYS A 516 -2.417 -16.223 -9.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 -1.647 -15.738 -12.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 -2.025 -14.364 -11.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 -0.402 -14.792 -11.575 1.00 0.00 H new ATOM 1130 N GLU A 517 -6.043 -13.793 -7.509 1.00 0.00 N ATOM 1131 CA GLU A 517 -7.366 -14.266 -7.116 1.00 0.00 C ATOM 1132 C GLU A 517 -8.237 -14.528 -8.340 1.00 0.00 C ATOM 1133 O GLU A 517 -9.199 -15.317 -8.223 1.00 0.00 O ATOM 1134 CB GLU A 517 -8.043 -13.244 -6.202 1.00 0.00 C ATOM 1135 CG GLU A 517 -7.228 -12.898 -4.966 1.00 0.00 C ATOM 1136 CD GLU A 517 -7.950 -11.941 -4.037 1.00 0.00 C ATOM 1137 OE1 GLU A 517 -9.000 -11.397 -4.441 1.00 0.00 O ATOM 1138 OE2 GLU A 517 -7.466 -11.736 -2.904 1.00 0.00 O ATOM 1139 OXT GLU A 517 -7.952 -13.941 -9.405 1.00 0.00 O ATOM 0 H GLU A 517 -6.018 -13.305 -8.404 1.00 0.00 H new ATOM 0 HA GLU A 517 -7.244 -15.204 -6.574 1.00 0.00 H new ATOM 0 HB2 GLU A 517 -8.233 -12.332 -6.768 1.00 0.00 H new ATOM 0 HB3 GLU A 517 -9.012 -13.634 -5.890 1.00 0.00 H new ATOM 0 HG2 GLU A 517 -6.991 -13.814 -4.424 1.00 0.00 H new ATOM 0 HG3 GLU A 517 -6.281 -12.455 -5.273 1.00 0.00 H new TER 1146 GLU A 517 ATOM 1147 N GLY B 941 12.564 17.174 -7.304 1.00 0.00 N ATOM 1148 CA GLY B 941 12.815 17.809 -5.980 1.00 0.00 C ATOM 1149 C GLY B 941 13.127 16.793 -4.900 1.00 0.00 C ATOM 1150 O GLY B 941 12.596 15.682 -4.909 1.00 0.00 O ATOM 0 HA2 GLY B 941 13.646 18.508 -6.068 1.00 0.00 H new ATOM 0 HA3 GLY B 941 11.940 18.389 -5.687 1.00 0.00 H new ATOM 1154 N SER B 942 13.992 17.173 -3.965 1.00 0.00 N ATOM 1155 CA SER B 942 14.375 16.287 -2.872 1.00 0.00 C ATOM 1156 C SER B 942 13.168 15.937 -2.007 1.00 0.00 C ATOM 1157 O SER B 942 12.204 16.699 -1.932 1.00 0.00 O ATOM 1158 CB SER B 942 15.459 16.940 -2.013 1.00 0.00 C ATOM 1159 OG SER B 942 16.596 17.271 -2.792 1.00 0.00 O ATOM 0 H SER B 942 14.441 18.089 -3.943 1.00 0.00 H new ATOM 0 HA SER B 942 14.769 15.368 -3.305 1.00 0.00 H new ATOM 0 HB2 SER B 942 15.062 17.840 -1.543 1.00 0.00 H new ATOM 0 HB3 SER B 942 15.749 16.262 -1.210 1.00 0.00 H new ATOM 0 HG SER B 942 17.274 17.689 -2.220 1.00 0.00 H new ATOM 1165 N SER B 943 13.229 14.780 -1.355 1.00 0.00 N ATOM 1166 CA SER B 943 12.141 14.329 -0.495 1.00 0.00 C ATOM 1167 C SER B 943 12.683 13.733 0.800 1.00 0.00 C ATOM 1168 O SER B 943 13.834 13.301 0.863 1.00 0.00 O ATOM 1169 CB SER B 943 11.279 13.297 -1.225 1.00 0.00 C ATOM 1170 OG SER B 943 12.003 12.100 -1.455 1.00 0.00 O ATOM 0 H SER B 943 14.020 14.138 -1.406 1.00 0.00 H new ATOM 0 HA SER B 943 11.526 15.194 -0.246 1.00 0.00 H new ATOM 0 HB2 SER B 943 10.388 13.080 -0.635 1.00 0.00 H new ATOM 0 HB3 SER B 943 10.939 13.709 -2.175 1.00 0.00 H new ATOM 0 HG SER B 943 11.430 11.456 -1.921 1.00 0.00 H new ATOM 1176 N SER B 944 11.844 13.709 1.830 1.00 0.00 N ATOM 1177 CA SER B 944 12.240 13.165 3.125 1.00 0.00 C ATOM 1178 C SER B 944 11.036 12.584 3.861 1.00 0.00 C ATOM 1179 O SER B 944 11.013 11.400 4.197 1.00 0.00 O ATOM 1180 CB SER B 944 12.898 14.249 3.978 1.00 0.00 C ATOM 1181 OG SER B 944 14.224 14.503 3.546 1.00 0.00 O ATOM 0 H SER B 944 10.887 14.059 1.794 1.00 0.00 H new ATOM 0 HA SER B 944 12.959 12.364 2.950 1.00 0.00 H new ATOM 0 HB2 SER B 944 12.312 15.166 3.922 1.00 0.00 H new ATOM 0 HB3 SER B 944 12.906 13.939 5.023 1.00 0.00 H new ATOM 0 HG SER B 944 14.383 14.048 2.693 1.00 0.00 H new ATOM 1187 N GLU B 945 10.036 13.425 4.106 1.00 0.00 N ATOM 1188 CA GLU B 945 8.829 12.995 4.802 1.00 0.00 C ATOM 1189 C GLU B 945 7.945 12.150 3.889 1.00 0.00 C ATOM 1190 O GLU B 945 7.218 11.272 4.352 1.00 0.00 O ATOM 1191 CB GLU B 945 8.049 14.209 5.309 1.00 0.00 C ATOM 1192 CG GLU B 945 7.500 15.088 4.197 1.00 0.00 C ATOM 1193 CD GLU B 945 6.834 16.346 4.722 1.00 0.00 C ATOM 1194 OE1 GLU B 945 6.626 16.441 5.950 1.00 0.00 O ATOM 1195 OE2 GLU B 945 6.521 17.237 3.904 1.00 0.00 O ATOM 0 H GLU B 945 10.038 14.408 3.833 1.00 0.00 H new ATOM 0 HA GLU B 945 9.128 12.383 5.653 1.00 0.00 H new ATOM 0 HB2 GLU B 945 7.222 13.865 5.931 1.00 0.00 H new ATOM 0 HB3 GLU B 945 8.700 14.808 5.946 1.00 0.00 H new ATOM 0 HG2 GLU B 945 8.311 15.365 3.524 1.00 0.00 H new ATOM 0 HG3 GLU B 945 6.780 14.518 3.610 1.00 0.00 H new ATOM 1202 N ALA B 946 8.011 12.424 2.589 1.00 0.00 N ATOM 1203 CA ALA B 946 7.214 11.691 1.613 1.00 0.00 C ATOM 1204 C ALA B 946 7.597 10.214 1.586 1.00 0.00 C ATOM 1205 O ALA B 946 6.731 9.340 1.548 1.00 0.00 O ATOM 1206 CB ALA B 946 7.380 12.305 0.231 1.00 0.00 C ATOM 0 H ALA B 946 8.608 13.148 2.188 1.00 0.00 H new ATOM 0 HA ALA B 946 6.167 11.762 1.909 1.00 0.00 H new ATOM 0 HB1 ALA B 946 6.780 11.749 -0.489 1.00 0.00 H new ATOM 0 HB2 ALA B 946 7.050 13.344 0.252 1.00 0.00 H new ATOM 0 HB3 ALA B 946 8.429 12.263 -0.062 1.00 0.00 H new ATOM 1212 N ASP B 947 8.898 9.944 1.605 1.00 0.00 N ATOM 1213 CA ASP B 947 9.393 8.572 1.583 1.00 0.00 C ATOM 1214 C ASP B 947 8.970 7.818 2.840 1.00 0.00 C ATOM 1215 O ASP B 947 8.727 6.612 2.800 1.00 0.00 O ATOM 1216 CB ASP B 947 10.917 8.559 1.452 1.00 0.00 C ATOM 1217 CG ASP B 947 11.605 9.237 2.620 1.00 0.00 C ATOM 1218 OD1 ASP B 947 11.457 8.751 3.761 1.00 0.00 O ATOM 1219 OD2 ASP B 947 12.292 10.255 2.394 1.00 0.00 O ATOM 0 H ASP B 947 9.628 10.656 1.636 1.00 0.00 H new ATOM 0 HA ASP B 947 8.958 8.070 0.719 1.00 0.00 H new ATOM 0 HB2 ASP B 947 11.264 7.528 1.379 1.00 0.00 H new ATOM 0 HB3 ASP B 947 11.203 9.058 0.526 1.00 0.00 H new ATOM 1224 N GLU B 948 8.884 8.538 3.954 1.00 0.00 N ATOM 1225 CA GLU B 948 8.490 7.936 5.223 1.00 0.00 C ATOM 1226 C GLU B 948 7.078 7.365 5.140 1.00 0.00 C ATOM 1227 O GLU B 948 6.754 6.382 5.805 1.00 0.00 O ATOM 1228 CB GLU B 948 8.569 8.969 6.347 1.00 0.00 C ATOM 1229 CG GLU B 948 9.983 9.447 6.635 1.00 0.00 C ATOM 1230 CD GLU B 948 10.900 8.323 7.076 1.00 0.00 C ATOM 1231 OE1 GLU B 948 10.386 7.260 7.481 1.00 0.00 O ATOM 1232 OE2 GLU B 948 12.135 8.506 7.016 1.00 0.00 O ATOM 0 H GLU B 948 9.081 9.537 4.004 1.00 0.00 H new ATOM 0 HA GLU B 948 9.180 7.120 5.439 1.00 0.00 H new ATOM 0 HB2 GLU B 948 7.951 9.827 6.085 1.00 0.00 H new ATOM 0 HB3 GLU B 948 8.148 8.538 7.255 1.00 0.00 H new ATOM 0 HG2 GLU B 948 10.393 9.916 5.741 1.00 0.00 H new ATOM 0 HG3 GLU B 948 9.953 10.212 7.411 1.00 0.00 H new ATOM 1239 N MET B 949 6.240 7.990 4.318 1.00 0.00 N ATOM 1240 CA MET B 949 4.861 7.546 4.146 1.00 0.00 C ATOM 1241 C MET B 949 4.810 6.099 3.663 1.00 0.00 C ATOM 1242 O MET B 949 3.952 5.324 4.084 1.00 0.00 O ATOM 1243 CB MET B 949 4.133 8.454 3.152 1.00 0.00 C ATOM 1244 CG MET B 949 2.635 8.205 3.081 1.00 0.00 C ATOM 1245 SD MET B 949 1.829 9.179 1.794 1.00 0.00 S ATOM 1246 CE MET B 949 0.116 8.718 2.038 1.00 0.00 C ATOM 0 H MET B 949 6.492 8.806 3.760 1.00 0.00 H new ATOM 0 HA MET B 949 4.363 7.604 5.114 1.00 0.00 H new ATOM 0 HB2 MET B 949 4.307 9.494 3.429 1.00 0.00 H new ATOM 0 HB3 MET B 949 4.563 8.312 2.161 1.00 0.00 H new ATOM 0 HG2 MET B 949 2.455 7.146 2.896 1.00 0.00 H new ATOM 0 HG3 MET B 949 2.185 8.441 4.045 1.00 0.00 H new ATOM 0 HE1 MET B 949 -0.514 9.603 1.955 1.00 0.00 H new ATOM 0 HE2 MET B 949 -0.177 7.991 1.280 1.00 0.00 H new ATOM 0 HE3 MET B 949 -0.005 8.278 3.028 1.00 0.00 H new ATOM 1256 N ALA B 950 5.735 5.744 2.777 1.00 0.00 N ATOM 1257 CA ALA B 950 5.795 4.392 2.236 1.00 0.00 C ATOM 1258 C ALA B 950 6.605 3.467 3.138 1.00 0.00 C ATOM 1259 O ALA B 950 6.183 2.350 3.437 1.00 0.00 O ATOM 1260 CB ALA B 950 6.387 4.413 0.834 1.00 0.00 C ATOM 0 H ALA B 950 6.453 6.374 2.419 1.00 0.00 H new ATOM 0 HA ALA B 950 4.777 4.004 2.188 1.00 0.00 H new ATOM 0 HB1 ALA B 950 6.427 3.397 0.441 1.00 0.00 H new ATOM 0 HB2 ALA B 950 5.765 5.029 0.185 1.00 0.00 H new ATOM 0 HB3 ALA B 950 7.394 4.827 0.871 1.00 0.00 H new ATOM 1266 N LYS B 951 7.773 3.938 3.567 1.00 0.00 N ATOM 1267 CA LYS B 951 8.644 3.149 4.432 1.00 0.00 C ATOM 1268 C LYS B 951 7.923 2.735 5.711 1.00 0.00 C ATOM 1269 O LYS B 951 8.090 1.615 6.194 1.00 0.00 O ATOM 1270 CB LYS B 951 9.904 3.944 4.781 1.00 0.00 C ATOM 1271 CG LYS B 951 10.777 4.261 3.577 1.00 0.00 C ATOM 1272 CD LYS B 951 12.136 4.794 3.998 1.00 0.00 C ATOM 1273 CE LYS B 951 12.009 6.111 4.747 1.00 0.00 C ATOM 1274 NZ LYS B 951 13.196 6.986 4.536 1.00 0.00 N ATOM 0 H LYS B 951 8.137 4.861 3.330 1.00 0.00 H new ATOM 0 HA LYS B 951 8.926 2.246 3.890 1.00 0.00 H new ATOM 0 HB2 LYS B 951 9.613 4.877 5.264 1.00 0.00 H new ATOM 0 HB3 LYS B 951 10.490 3.380 5.506 1.00 0.00 H new ATOM 0 HG2 LYS B 951 10.908 3.362 2.975 1.00 0.00 H new ATOM 0 HG3 LYS B 951 10.276 4.996 2.947 1.00 0.00 H new ATOM 0 HD2 LYS B 951 12.636 4.061 4.631 1.00 0.00 H new ATOM 0 HD3 LYS B 951 12.762 4.934 3.117 1.00 0.00 H new ATOM 0 HE2 LYS B 951 11.110 6.632 4.416 1.00 0.00 H new ATOM 0 HE3 LYS B 951 11.889 5.913 5.812 1.00 0.00 H new ATOM 0 HZ1 LYS B 951 13.771 7.005 5.402 1.00 0.00 H new ATOM 0 HZ2 LYS B 951 13.766 6.614 3.750 1.00 0.00 H new ATOM 0 HZ3 LYS B 951 12.880 7.951 4.309 1.00 0.00 H new ATOM 1288 N ALA B 952 7.123 3.644 6.258 1.00 0.00 N ATOM 1289 CA ALA B 952 6.381 3.371 7.482 1.00 0.00 C ATOM 1290 C ALA B 952 5.328 2.290 7.258 1.00 0.00 C ATOM 1291 O ALA B 952 5.182 1.375 8.069 1.00 0.00 O ATOM 1292 CB ALA B 952 5.730 4.645 7.999 1.00 0.00 C ATOM 0 H ALA B 952 6.972 4.576 5.872 1.00 0.00 H new ATOM 0 HA ALA B 952 7.085 3.005 8.230 1.00 0.00 H new ATOM 0 HB1 ALA B 952 5.179 4.427 8.914 1.00 0.00 H new ATOM 0 HB2 ALA B 952 6.500 5.388 8.208 1.00 0.00 H new ATOM 0 HB3 ALA B 952 5.044 5.034 7.247 1.00 0.00 H new ATOM 1298 N LEU B 953 4.596 2.403 6.155 1.00 0.00 N ATOM 1299 CA LEU B 953 3.555 1.435 5.826 1.00 0.00 C ATOM 1300 C LEU B 953 4.155 0.071 5.504 1.00 0.00 C ATOM 1301 O LEU B 953 3.619 -0.964 5.898 1.00 0.00 O ATOM 1302 CB LEU B 953 2.725 1.933 4.641 1.00 0.00 C ATOM 1303 CG LEU B 953 1.471 1.112 4.338 1.00 0.00 C ATOM 1304 CD1 LEU B 953 0.377 2.001 3.766 1.00 0.00 C ATOM 1305 CD2 LEU B 953 1.795 -0.022 3.376 1.00 0.00 C ATOM 0 H LEU B 953 4.704 3.155 5.474 1.00 0.00 H new ATOM 0 HA LEU B 953 2.908 1.327 6.697 1.00 0.00 H new ATOM 0 HB2 LEU B 953 2.428 2.964 4.833 1.00 0.00 H new ATOM 0 HB3 LEU B 953 3.357 1.943 3.753 1.00 0.00 H new ATOM 0 HG LEU B 953 1.110 0.679 5.271 1.00 0.00 H new ATOM 0 HD11 LEU B 953 -0.508 1.400 3.556 1.00 0.00 H new ATOM 0 HD12 LEU B 953 0.125 2.778 4.488 1.00 0.00 H new ATOM 0 HD13 LEU B 953 0.729 2.463 2.843 1.00 0.00 H new ATOM 0 HD21 LEU B 953 0.891 -0.595 3.172 1.00 0.00 H new ATOM 0 HD22 LEU B 953 2.181 0.391 2.444 1.00 0.00 H new ATOM 0 HD23 LEU B 953 2.545 -0.675 3.822 1.00 0.00 H new ATOM 1317 N GLU B 954 5.270 0.076 4.780 1.00 0.00 N ATOM 1318 CA GLU B 954 5.942 -1.163 4.401 1.00 0.00 C ATOM 1319 C GLU B 954 6.436 -1.918 5.630 1.00 0.00 C ATOM 1320 O GLU B 954 6.262 -3.131 5.737 1.00 0.00 O ATOM 1321 CB GLU B 954 7.116 -0.863 3.468 1.00 0.00 C ATOM 1322 CG GLU B 954 7.753 -2.109 2.873 1.00 0.00 C ATOM 1323 CD GLU B 954 8.998 -1.799 2.064 1.00 0.00 C ATOM 1324 OE1 GLU B 954 9.538 -0.681 2.210 1.00 0.00 O ATOM 1325 OE2 GLU B 954 9.434 -2.673 1.286 1.00 0.00 O ATOM 0 H GLU B 954 5.727 0.924 4.444 1.00 0.00 H new ATOM 0 HA GLU B 954 5.220 -1.792 3.880 1.00 0.00 H new ATOM 0 HB2 GLU B 954 6.771 -0.219 2.659 1.00 0.00 H new ATOM 0 HB3 GLU B 954 7.874 -0.305 4.018 1.00 0.00 H new ATOM 0 HG2 GLU B 954 8.009 -2.800 3.676 1.00 0.00 H new ATOM 0 HG3 GLU B 954 7.027 -2.615 2.236 1.00 0.00 H new ATOM 1332 N ALA B 955 7.057 -1.192 6.555 1.00 0.00 N ATOM 1333 CA ALA B 955 7.583 -1.794 7.775 1.00 0.00 C ATOM 1334 C ALA B 955 6.492 -2.526 8.551 1.00 0.00 C ATOM 1335 O ALA B 955 6.768 -3.485 9.271 1.00 0.00 O ATOM 1336 CB ALA B 955 8.229 -0.729 8.650 1.00 0.00 C ATOM 0 H ALA B 955 7.208 -0.186 6.483 1.00 0.00 H new ATOM 0 HA ALA B 955 8.337 -2.527 7.489 1.00 0.00 H new ATOM 0 HB1 ALA B 955 8.618 -1.191 9.558 1.00 0.00 H new ATOM 0 HB2 ALA B 955 9.046 -0.256 8.105 1.00 0.00 H new ATOM 0 HB3 ALA B 955 7.486 0.024 8.915 1.00 0.00 H new ATOM 1342 N GLU B 956 5.254 -2.067 8.403 1.00 0.00 N ATOM 1343 CA GLU B 956 4.125 -2.679 9.095 1.00 0.00 C ATOM 1344 C GLU B 956 3.768 -4.028 8.478 1.00 0.00 C ATOM 1345 O GLU B 956 3.872 -5.066 9.132 1.00 0.00 O ATOM 1346 CB GLU B 956 2.913 -1.749 9.056 1.00 0.00 C ATOM 1347 CG GLU B 956 3.112 -0.457 9.833 1.00 0.00 C ATOM 1348 CD GLU B 956 3.364 -0.698 11.309 1.00 0.00 C ATOM 1349 OE1 GLU B 956 3.054 -1.808 11.790 1.00 0.00 O ATOM 1350 OE2 GLU B 956 3.872 0.223 11.982 1.00 0.00 O ATOM 0 H GLU B 956 5.007 -1.274 7.811 1.00 0.00 H new ATOM 0 HA GLU B 956 4.415 -2.844 10.133 1.00 0.00 H new ATOM 0 HB2 GLU B 956 2.684 -1.507 8.018 1.00 0.00 H new ATOM 0 HB3 GLU B 956 2.048 -2.276 9.459 1.00 0.00 H new ATOM 0 HG2 GLU B 956 3.953 0.092 9.409 1.00 0.00 H new ATOM 0 HG3 GLU B 956 2.230 0.172 9.717 1.00 0.00 H new ATOM 1357 N LEU B 957 3.342 -4.007 7.220 1.00 0.00 N ATOM 1358 CA LEU B 957 2.966 -5.230 6.519 1.00 0.00 C ATOM 1359 C LEU B 957 4.161 -6.165 6.362 1.00 0.00 C ATOM 1360 O LEU B 957 4.004 -7.385 6.307 1.00 0.00 O ATOM 1361 CB LEU B 957 2.371 -4.899 5.146 1.00 0.00 C ATOM 1362 CG LEU B 957 2.003 -6.107 4.277 1.00 0.00 C ATOM 1363 CD1 LEU B 957 1.325 -7.188 5.107 1.00 0.00 C ATOM 1364 CD2 LEU B 957 1.106 -5.680 3.123 1.00 0.00 C ATOM 0 H LEU B 957 3.248 -3.157 6.664 1.00 0.00 H new ATOM 0 HA LEU B 957 2.212 -5.740 7.118 1.00 0.00 H new ATOM 0 HB2 LEU B 957 1.477 -4.294 5.294 1.00 0.00 H new ATOM 0 HB3 LEU B 957 3.085 -4.284 4.599 1.00 0.00 H new ATOM 0 HG LEU B 957 2.923 -6.522 3.867 1.00 0.00 H new ATOM 0 HD11 LEU B 957 1.074 -8.034 4.467 1.00 0.00 H new ATOM 0 HD12 LEU B 957 2.000 -7.518 5.896 1.00 0.00 H new ATOM 0 HD13 LEU B 957 0.414 -6.787 5.552 1.00 0.00 H new ATOM 0 HD21 LEU B 957 0.855 -6.550 2.516 1.00 0.00 H new ATOM 0 HD22 LEU B 957 0.192 -5.236 3.518 1.00 0.00 H new ATOM 0 HD23 LEU B 957 1.629 -4.948 2.508 1.00 0.00 H new ATOM 1376 N ASN B 958 5.358 -5.588 6.291 1.00 0.00 N ATOM 1377 CA ASN B 958 6.578 -6.375 6.140 1.00 0.00 C ATOM 1378 C ASN B 958 6.720 -7.386 7.275 1.00 0.00 C ATOM 1379 O ASN B 958 7.282 -8.466 7.091 1.00 0.00 O ATOM 1380 CB ASN B 958 7.802 -5.457 6.103 1.00 0.00 C ATOM 1381 CG ASN B 958 9.096 -6.223 5.906 1.00 0.00 C ATOM 1382 OD1 ASN B 958 9.628 -6.817 6.843 1.00 0.00 O ATOM 1383 ND2 ASN B 958 9.610 -6.211 4.681 1.00 0.00 N ATOM 0 H ASN B 958 5.509 -4.580 6.336 1.00 0.00 H new ATOM 0 HA ASN B 958 6.513 -6.921 5.199 1.00 0.00 H new ATOM 0 HB2 ASN B 958 7.685 -4.733 5.296 1.00 0.00 H new ATOM 0 HB3 ASN B 958 7.856 -4.891 7.033 1.00 0.00 H new ATOM 0 HD21 ASN B 958 10.480 -6.708 4.488 1.00 0.00 H new ATOM 0 HD22 ASN B 958 9.135 -5.705 3.934 1.00 0.00 H new ATOM 1390 N ASP B 959 6.208 -7.028 8.448 1.00 0.00 N ATOM 1391 CA ASP B 959 6.280 -7.905 9.613 1.00 0.00 C ATOM 1392 C ASP B 959 5.411 -9.144 9.416 1.00 0.00 C ATOM 1393 O ASP B 959 5.780 -10.244 9.827 1.00 0.00 O ATOM 1394 CB ASP B 959 5.840 -7.155 10.871 1.00 0.00 C ATOM 1395 CG ASP B 959 6.085 -7.952 12.137 1.00 0.00 C ATOM 1396 OD1 ASP B 959 6.840 -8.946 12.077 1.00 0.00 O ATOM 1397 OD2 ASP B 959 5.523 -7.583 13.189 1.00 0.00 O ATOM 0 H ASP B 959 5.739 -6.138 8.618 1.00 0.00 H new ATOM 0 HA ASP B 959 7.315 -8.224 9.732 1.00 0.00 H new ATOM 0 HB2 ASP B 959 6.376 -6.208 10.932 1.00 0.00 H new ATOM 0 HB3 ASP B 959 4.779 -6.916 10.795 1.00 0.00 H new ATOM 1402 N LEU B 960 4.256 -8.956 8.785 1.00 0.00 N ATOM 1403 CA LEU B 960 3.334 -10.058 8.532 1.00 0.00 C ATOM 1404 C LEU B 960 3.871 -10.977 7.438 1.00 0.00 C ATOM 1405 O LEU B 960 3.600 -12.177 7.434 1.00 0.00 O ATOM 1406 CB LEU B 960 1.958 -9.515 8.137 1.00 0.00 C ATOM 1407 CG LEU B 960 0.949 -10.573 7.672 1.00 0.00 C ATOM 1408 CD1 LEU B 960 -0.230 -10.651 8.631 1.00 0.00 C ATOM 1409 CD2 LEU B 960 0.472 -10.267 6.260 1.00 0.00 C ATOM 0 H LEU B 960 3.936 -8.051 8.440 1.00 0.00 H new ATOM 0 HA LEU B 960 3.237 -10.639 9.449 1.00 0.00 H new ATOM 0 HB2 LEU B 960 1.536 -8.983 8.990 1.00 0.00 H new ATOM 0 HB3 LEU B 960 2.089 -8.784 7.339 1.00 0.00 H new ATOM 0 HG LEU B 960 1.446 -11.543 7.666 1.00 0.00 H new ATOM 0 HD11 LEU B 960 -0.933 -11.407 8.282 1.00 0.00 H new ATOM 0 HD12 LEU B 960 0.127 -10.918 9.626 1.00 0.00 H new ATOM 0 HD13 LEU B 960 -0.729 -9.683 8.673 1.00 0.00 H new ATOM 0 HD21 LEU B 960 -0.243 -11.027 5.945 1.00 0.00 H new ATOM 0 HD22 LEU B 960 -0.007 -9.288 6.242 1.00 0.00 H new ATOM 0 HD23 LEU B 960 1.324 -10.267 5.580 1.00 0.00 H new ATOM 1421 N MET B 961 4.631 -10.400 6.507 1.00 0.00 N ATOM 1422 CA MET B 961 5.211 -11.157 5.398 1.00 0.00 C ATOM 1423 C MET B 961 4.185 -12.096 4.766 1.00 0.00 C ATOM 1424 O MET B 961 4.598 -13.142 4.222 1.00 0.00 O ATOM 1425 CB MET B 961 6.439 -11.948 5.870 1.00 0.00 C ATOM 1426 CG MET B 961 6.111 -13.155 6.739 1.00 0.00 C ATOM 1427 SD MET B 961 6.245 -12.799 8.501 1.00 0.00 S ATOM 1428 CE MET B 961 7.970 -12.330 8.621 1.00 0.00 C ATOM 1429 OXT MET B 961 2.979 -11.776 4.822 1.00 0.00 O ATOM 0 H MET B 961 4.860 -9.406 6.499 1.00 0.00 H new ATOM 0 HA MET B 961 5.524 -10.442 4.637 1.00 0.00 H new ATOM 0 HB2 MET B 961 6.997 -12.285 4.997 1.00 0.00 H new ATOM 0 HB3 MET B 961 7.094 -11.280 6.429 1.00 0.00 H new ATOM 0 HG2 MET B 961 5.099 -13.494 6.517 1.00 0.00 H new ATOM 0 HG3 MET B 961 6.784 -13.974 6.486 1.00 0.00 H new ATOM 0 HE1 MET B 961 8.360 -12.622 9.596 1.00 0.00 H new ATOM 0 HE2 MET B 961 8.539 -12.831 7.838 1.00 0.00 H new ATOM 0 HE3 MET B 961 8.063 -11.250 8.502 1.00 0.00 H new TER 1439 MET B 961