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 469 THR OG1 : rot 81:sc= 0.266 USER MOD Set 1.2: A 470 THR OG1 : rot 50:sc= -2.32 USER MOD Single : A 453 GLN : amide:sc= 0 K(o=0,f=-0.94) 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 44:sc= -1.05 USER MOD Single : A 466 LYS NZ :NH3+ -107:sc= -0.0184 (180deg=-0.917) USER MOD Single : A 468 MET CE :methyl -169:sc= -1.89 (180deg=-2.57!) USER MOD Single : A 471 LYS NZ :NH3+ 157:sc= 0.383 (180deg=0.149) USER MOD Single : A 475 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 476 LYS NZ :NH3+ -110:sc= 0.152 (180deg=0) USER MOD Single : A 478 GLN :FLIP amide:sc= -0.132 F(o=-1.2,f=-0.13) USER MOD Single : A 479 THR OG1 : rot 180:sc= 0 USER MOD Single : A 480 LYS NZ :NH3+ -163:sc= -0.601 (180deg=-0.916!) USER MOD Single : A 481 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 485 SER OG : rot 101:sc= -0.75 USER MOD Single : A 486 SER OG : rot -67:sc= 1.18 USER MOD Single : A 488 GLN : amide:sc= -0.305 X(o=-0.31,f=0) USER MOD Single : A 489 THR OG1 : rot 84:sc= 1.17 USER MOD Single : A 491 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 495 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 498 LYS NZ :NH3+ -125:sc= 0.0765 (180deg=0) USER MOD Single : A 501 ASN : amide:sc= -0.618 K(o=-0.62,f=-2.4) USER MOD Single : A 505 LYS NZ :NH3+ 143:sc= -3.14 (180deg=-5.78!) USER MOD Single : A 506 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 508 ASN : amide:sc= 0 K(o=0,f=-0.98) 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 HD1:sc= -2.09 X(o=-2.1,f=-2.5) USER MOD Single : A 514 SER OG : rot 180:sc= 0 USER MOD Single : A 516 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 180:sc= 0 USER MOD Single : B 949 MET CE :methyl 142:sc= -3.26 (180deg=-5.94!) USER MOD Single : B 951 LYS NZ :NH3+ -169:sc= -0.0431 (180deg=-0.257) USER MOD Single : B 958 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 961 MET CE :methyl -165:sc= -0.098 (180deg=-0.509) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 451 -18.070 11.729 -0.573 1.00 0.00 N ATOM 2 CA ASP A 451 -16.986 11.383 0.382 1.00 0.00 C ATOM 3 C ASP A 451 -16.243 10.125 -0.058 1.00 0.00 C ATOM 4 O ASP A 451 -16.858 9.139 -0.463 1.00 0.00 O ATOM 5 CB ASP A 451 -17.605 11.172 1.766 1.00 0.00 C ATOM 6 CG ASP A 451 -18.201 12.446 2.332 1.00 0.00 C ATOM 7 OD1 ASP A 451 -17.866 13.537 1.824 1.00 0.00 O ATOM 8 OD2 ASP A 451 -19.003 12.352 3.285 1.00 0.00 O ATOM 0 HA ASP A 451 -16.263 12.198 0.412 1.00 0.00 H new ATOM 0 HB2 ASP A 451 -18.380 10.408 1.702 1.00 0.00 H new ATOM 0 HB3 ASP A 451 -16.843 10.796 2.449 1.00 0.00 H new ATOM 13 N VAL A 452 -14.917 10.169 0.022 1.00 0.00 N ATOM 14 CA VAL A 452 -14.090 9.035 -0.369 1.00 0.00 C ATOM 15 C VAL A 452 -13.507 8.332 0.854 1.00 0.00 C ATOM 16 O VAL A 452 -13.069 8.980 1.805 1.00 0.00 O ATOM 17 CB VAL A 452 -12.941 9.474 -1.297 1.00 0.00 C ATOM 18 CG1 VAL A 452 -12.009 10.441 -0.581 1.00 0.00 C ATOM 19 CG2 VAL A 452 -12.175 8.265 -1.812 1.00 0.00 C ATOM 0 H VAL A 452 -14.393 10.978 0.354 1.00 0.00 H new ATOM 0 HA VAL A 452 -14.735 8.341 -0.907 1.00 0.00 H new ATOM 0 HB VAL A 452 -13.373 9.992 -2.153 1.00 0.00 H new ATOM 0 HG11 VAL A 452 -11.205 10.738 -1.255 1.00 0.00 H new ATOM 0 HG12 VAL A 452 -12.568 11.324 -0.272 1.00 0.00 H new ATOM 0 HG13 VAL A 452 -11.585 9.955 0.297 1.00 0.00 H new ATOM 0 HG21 VAL A 452 -11.368 8.597 -2.465 1.00 0.00 H new ATOM 0 HG22 VAL A 452 -11.757 7.714 -0.970 1.00 0.00 H new ATOM 0 HG23 VAL A 452 -12.851 7.617 -2.370 1.00 0.00 H new ATOM 29 N GLN A 453 -13.505 7.004 0.822 1.00 0.00 N ATOM 30 CA GLN A 453 -12.976 6.212 1.926 1.00 0.00 C ATOM 31 C GLN A 453 -12.056 5.109 1.413 1.00 0.00 C ATOM 32 O GLN A 453 -12.088 4.760 0.232 1.00 0.00 O ATOM 33 CB GLN A 453 -14.120 5.602 2.738 1.00 0.00 C ATOM 34 CG GLN A 453 -13.659 4.893 4.001 1.00 0.00 C ATOM 35 CD GLN A 453 -14.816 4.380 4.836 1.00 0.00 C ATOM 36 OE1 GLN A 453 -15.978 4.666 4.549 1.00 0.00 O ATOM 37 NE2 GLN A 453 -14.502 3.617 5.877 1.00 0.00 N ATOM 0 H GLN A 453 -13.864 6.453 0.043 1.00 0.00 H new ATOM 0 HA GLN A 453 -12.396 6.874 2.569 1.00 0.00 H new ATOM 0 HB2 GLN A 453 -14.822 6.390 3.010 1.00 0.00 H new ATOM 0 HB3 GLN A 453 -14.662 4.894 2.111 1.00 0.00 H new ATOM 0 HG2 GLN A 453 -13.013 4.058 3.730 1.00 0.00 H new ATOM 0 HG3 GLN A 453 -13.059 5.578 4.600 1.00 0.00 H new ATOM 0 HE21 GLN A 453 -13.525 3.405 6.078 1.00 0.00 H new ATOM 0 HE22 GLN A 453 -15.238 3.243 6.476 1.00 0.00 H new ATOM 46 N VAL A 454 -11.238 4.564 2.307 1.00 0.00 N ATOM 47 CA VAL A 454 -10.309 3.500 1.943 1.00 0.00 C ATOM 48 C VAL A 454 -10.834 2.139 2.384 1.00 0.00 C ATOM 49 O VAL A 454 -11.222 1.956 3.538 1.00 0.00 O ATOM 50 CB VAL A 454 -8.920 3.729 2.569 1.00 0.00 C ATOM 51 CG1 VAL A 454 -7.919 2.716 2.036 1.00 0.00 C ATOM 52 CG2 VAL A 454 -8.443 5.150 2.303 1.00 0.00 C ATOM 0 H VAL A 454 -11.199 4.841 3.288 1.00 0.00 H new ATOM 0 HA VAL A 454 -10.217 3.517 0.857 1.00 0.00 H new ATOM 0 HB VAL A 454 -9.001 3.592 3.647 1.00 0.00 H new ATOM 0 HG11 VAL A 454 -6.944 2.894 2.490 1.00 0.00 H new ATOM 0 HG12 VAL A 454 -8.255 1.709 2.282 1.00 0.00 H new ATOM 0 HG13 VAL A 454 -7.839 2.818 0.954 1.00 0.00 H new ATOM 0 HG21 VAL A 454 -7.460 5.294 2.752 1.00 0.00 H new ATOM 0 HG22 VAL A 454 -8.378 5.317 1.228 1.00 0.00 H new ATOM 0 HG23 VAL A 454 -9.148 5.858 2.738 1.00 0.00 H new ATOM 62 N THR A 455 -10.841 1.186 1.458 1.00 0.00 N ATOM 63 CA THR A 455 -11.319 -0.162 1.751 1.00 0.00 C ATOM 64 C THR A 455 -10.314 -1.208 1.281 1.00 0.00 C ATOM 65 O THR A 455 -9.656 -1.035 0.255 1.00 0.00 O ATOM 66 CB THR A 455 -12.674 -0.402 1.082 1.00 0.00 C ATOM 67 OG1 THR A 455 -13.589 0.626 1.420 1.00 0.00 O ATOM 68 CG2 THR A 455 -13.304 -1.723 1.464 1.00 0.00 C ATOM 0 H THR A 455 -10.522 1.321 0.499 1.00 0.00 H new ATOM 0 HA THR A 455 -11.434 -0.254 2.831 1.00 0.00 H new ATOM 0 HB THR A 455 -12.470 -0.412 0.011 1.00 0.00 H new ATOM 0 HG1 THR A 455 -14.449 0.456 0.981 1.00 0.00 H new ATOM 0 HG21 THR A 455 -14.262 -1.830 0.955 1.00 0.00 H new ATOM 0 HG22 THR A 455 -12.644 -2.539 1.170 1.00 0.00 H new ATOM 0 HG23 THR A 455 -13.461 -1.753 2.542 1.00 0.00 H new ATOM 76 N GLU A 456 -10.200 -2.294 2.039 1.00 0.00 N ATOM 77 CA GLU A 456 -9.273 -3.369 1.700 1.00 0.00 C ATOM 78 C GLU A 456 -9.592 -3.947 0.325 1.00 0.00 C ATOM 79 O GLU A 456 -8.691 -4.322 -0.426 1.00 0.00 O ATOM 80 CB GLU A 456 -9.332 -4.474 2.757 1.00 0.00 C ATOM 81 CG GLU A 456 -8.338 -5.599 2.516 1.00 0.00 C ATOM 82 CD GLU A 456 -8.470 -6.723 3.526 1.00 0.00 C ATOM 83 OE1 GLU A 456 -9.370 -6.644 4.390 1.00 0.00 O ATOM 84 OE2 GLU A 456 -7.675 -7.682 3.453 1.00 0.00 O ATOM 0 H GLU A 456 -10.737 -2.453 2.891 1.00 0.00 H new ATOM 0 HA GLU A 456 -8.266 -2.953 1.675 1.00 0.00 H new ATOM 0 HB2 GLU A 456 -9.144 -4.038 3.738 1.00 0.00 H new ATOM 0 HB3 GLU A 456 -10.340 -4.889 2.781 1.00 0.00 H new ATOM 0 HG2 GLU A 456 -8.484 -5.999 1.513 1.00 0.00 H new ATOM 0 HG3 GLU A 456 -7.325 -5.198 2.555 1.00 0.00 H new ATOM 91 N ASP A 457 -10.880 -4.018 0.002 1.00 0.00 N ATOM 92 CA ASP A 457 -11.317 -4.551 -1.282 1.00 0.00 C ATOM 93 C ASP A 457 -10.731 -3.744 -2.436 1.00 0.00 C ATOM 94 O ASP A 457 -10.343 -4.300 -3.463 1.00 0.00 O ATOM 95 CB ASP A 457 -12.844 -4.548 -1.366 1.00 0.00 C ATOM 96 CG ASP A 457 -13.358 -5.256 -2.605 1.00 0.00 C ATOM 97 OD1 ASP A 457 -13.486 -6.498 -2.568 1.00 0.00 O ATOM 98 OD2 ASP A 457 -13.633 -4.568 -3.611 1.00 0.00 O ATOM 0 H ASP A 457 -11.638 -3.713 0.612 1.00 0.00 H new ATOM 0 HA ASP A 457 -10.957 -5.577 -1.362 1.00 0.00 H new ATOM 0 HB2 ASP A 457 -13.255 -5.030 -0.479 1.00 0.00 H new ATOM 0 HB3 ASP A 457 -13.203 -3.519 -1.364 1.00 0.00 H new ATOM 103 N ALA A 458 -10.671 -2.428 -2.259 1.00 0.00 N ATOM 104 CA ALA A 458 -10.132 -1.542 -3.285 1.00 0.00 C ATOM 105 C ALA A 458 -8.647 -1.806 -3.512 1.00 0.00 C ATOM 106 O ALA A 458 -8.176 -1.825 -4.650 1.00 0.00 O ATOM 107 CB ALA A 458 -10.359 -0.089 -2.900 1.00 0.00 C ATOM 0 H ALA A 458 -10.989 -1.952 -1.415 1.00 0.00 H new ATOM 0 HA ALA A 458 -10.657 -1.745 -4.218 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -9.952 0.561 -3.675 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -11.428 0.097 -2.795 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -9.860 0.119 -1.953 1.00 0.00 H new ATOM 113 N VAL A 459 -7.914 -2.008 -2.422 1.00 0.00 N ATOM 114 CA VAL A 459 -6.482 -2.270 -2.503 1.00 0.00 C ATOM 115 C VAL A 459 -6.207 -3.604 -3.188 1.00 0.00 C ATOM 116 O VAL A 459 -5.315 -3.710 -4.030 1.00 0.00 O ATOM 117 CB VAL A 459 -5.833 -2.278 -1.105 1.00 0.00 C ATOM 118 CG1 VAL A 459 -4.322 -2.423 -1.214 1.00 0.00 C ATOM 119 CG2 VAL A 459 -6.200 -1.016 -0.338 1.00 0.00 C ATOM 0 H VAL A 459 -8.288 -1.995 -1.473 1.00 0.00 H new ATOM 0 HA VAL A 459 -6.044 -1.465 -3.093 1.00 0.00 H new ATOM 0 HB VAL A 459 -6.217 -3.136 -0.554 1.00 0.00 H new ATOM 0 HG11 VAL A 459 -3.884 -2.426 -0.216 1.00 0.00 H new ATOM 0 HG12 VAL A 459 -4.082 -3.359 -1.719 1.00 0.00 H new ATOM 0 HG13 VAL A 459 -3.917 -1.588 -1.785 1.00 0.00 H new ATOM 0 HG21 VAL A 459 -5.733 -1.040 0.646 1.00 0.00 H new ATOM 0 HG22 VAL A 459 -5.848 -0.142 -0.886 1.00 0.00 H new ATOM 0 HG23 VAL A 459 -7.283 -0.961 -0.224 1.00 0.00 H new ATOM 129 N ARG A 460 -6.978 -4.623 -2.820 1.00 0.00 N ATOM 130 CA ARG A 460 -6.818 -5.952 -3.398 1.00 0.00 C ATOM 131 C ARG A 460 -7.013 -5.918 -4.910 1.00 0.00 C ATOM 132 O ARG A 460 -6.339 -6.635 -5.649 1.00 0.00 O ATOM 133 CB ARG A 460 -7.812 -6.928 -2.766 1.00 0.00 C ATOM 134 CG ARG A 460 -7.682 -8.350 -3.286 1.00 0.00 C ATOM 135 CD ARG A 460 -8.650 -9.290 -2.586 1.00 0.00 C ATOM 136 NE ARG A 460 -10.038 -9.021 -2.954 1.00 0.00 N ATOM 137 CZ ARG A 460 -11.044 -9.860 -2.717 1.00 0.00 C ATOM 138 NH1 ARG A 460 -10.821 -11.020 -2.113 1.00 0.00 N ATOM 139 NH2 ARG A 460 -12.276 -9.538 -3.085 1.00 0.00 N ATOM 0 H ARG A 460 -7.720 -4.553 -2.124 1.00 0.00 H new ATOM 0 HA ARG A 460 -5.803 -6.290 -3.190 1.00 0.00 H new ATOM 0 HB2 ARG A 460 -7.669 -6.931 -1.685 1.00 0.00 H new ATOM 0 HB3 ARG A 460 -8.826 -6.573 -2.952 1.00 0.00 H new ATOM 0 HG2 ARG A 460 -7.871 -8.365 -4.359 1.00 0.00 H new ATOM 0 HG3 ARG A 460 -6.661 -8.701 -3.137 1.00 0.00 H new ATOM 0 HD2 ARG A 460 -8.401 -10.321 -2.839 1.00 0.00 H new ATOM 0 HD3 ARG A 460 -8.535 -9.190 -1.507 1.00 0.00 H new ATOM 0 HE ARG A 460 -10.249 -8.138 -3.420 1.00 0.00 H new ATOM 0 HH11 ARG A 460 -9.875 -11.273 -1.828 1.00 0.00 H new ATOM 0 HH12 ARG A 460 -11.596 -11.659 -1.934 1.00 0.00 H new ATOM 0 HH21 ARG A 460 -12.453 -8.647 -3.550 1.00 0.00 H new ATOM 0 HH22 ARG A 460 -13.047 -10.181 -2.903 1.00 0.00 H new ATOM 153 N ARG A 461 -7.941 -5.080 -5.364 1.00 0.00 N ATOM 154 CA ARG A 461 -8.226 -4.954 -6.789 1.00 0.00 C ATOM 155 C ARG A 461 -6.974 -4.559 -7.566 1.00 0.00 C ATOM 156 O ARG A 461 -6.704 -5.094 -8.640 1.00 0.00 O ATOM 157 CB ARG A 461 -9.330 -3.919 -7.019 1.00 0.00 C ATOM 158 CG ARG A 461 -9.783 -3.825 -8.466 1.00 0.00 C ATOM 159 CD ARG A 461 -10.824 -2.732 -8.654 1.00 0.00 C ATOM 160 NE ARG A 461 -12.021 -2.972 -7.852 1.00 0.00 N ATOM 161 CZ ARG A 461 -12.977 -3.835 -8.188 1.00 0.00 C ATOM 162 NH1 ARG A 461 -12.881 -4.542 -9.307 1.00 0.00 N ATOM 163 NH2 ARG A 461 -14.034 -3.993 -7.402 1.00 0.00 N ATOM 0 H ARG A 461 -8.508 -4.479 -4.766 1.00 0.00 H new ATOM 0 HA ARG A 461 -8.563 -5.925 -7.152 1.00 0.00 H new ATOM 0 HB2 ARG A 461 -10.187 -4.169 -6.394 1.00 0.00 H new ATOM 0 HB3 ARG A 461 -8.974 -2.941 -6.694 1.00 0.00 H new ATOM 0 HG2 ARG A 461 -8.923 -3.624 -9.105 1.00 0.00 H new ATOM 0 HG3 ARG A 461 -10.198 -4.782 -8.781 1.00 0.00 H new ATOM 0 HD2 ARG A 461 -10.392 -1.769 -8.381 1.00 0.00 H new ATOM 0 HD3 ARG A 461 -11.099 -2.671 -9.707 1.00 0.00 H new ATOM 0 HE ARG A 461 -12.131 -2.448 -6.984 1.00 0.00 H new ATOM 0 HH11 ARG A 461 -12.071 -4.426 -9.916 1.00 0.00 H new ATOM 0 HH12 ARG A 461 -13.617 -5.202 -9.558 1.00 0.00 H new ATOM 0 HH21 ARG A 461 -14.114 -3.453 -6.540 1.00 0.00 H new ATOM 0 HH22 ARG A 461 -14.767 -4.654 -7.659 1.00 0.00 H new ATOM 177 N TYR A 462 -6.212 -3.620 -7.014 1.00 0.00 N ATOM 178 CA TYR A 462 -4.989 -3.155 -7.656 1.00 0.00 C ATOM 179 C TYR A 462 -3.927 -4.250 -7.663 1.00 0.00 C ATOM 180 O TYR A 462 -3.270 -4.486 -8.677 1.00 0.00 O ATOM 181 CB TYR A 462 -4.453 -1.913 -6.942 1.00 0.00 C ATOM 182 CG TYR A 462 -5.390 -0.727 -7.000 1.00 0.00 C ATOM 183 CD1 TYR A 462 -5.481 0.054 -8.146 1.00 0.00 C ATOM 184 CD2 TYR A 462 -6.184 -0.390 -5.912 1.00 0.00 C ATOM 185 CE1 TYR A 462 -6.336 1.137 -8.204 1.00 0.00 C ATOM 186 CE2 TYR A 462 -7.042 0.691 -5.962 1.00 0.00 C ATOM 187 CZ TYR A 462 -7.115 1.452 -7.110 1.00 0.00 C ATOM 188 OH TYR A 462 -7.968 2.530 -7.164 1.00 0.00 O ATOM 0 H TYR A 462 -6.420 -3.167 -6.124 1.00 0.00 H new ATOM 0 HA TYR A 462 -5.226 -2.898 -8.688 1.00 0.00 H new ATOM 0 HB2 TYR A 462 -4.258 -2.160 -5.898 1.00 0.00 H new ATOM 0 HB3 TYR A 462 -3.498 -1.633 -7.387 1.00 0.00 H new ATOM 0 HD1 TYR A 462 -4.873 -0.190 -9.005 1.00 0.00 H new ATOM 0 HD2 TYR A 462 -6.130 -0.983 -5.011 1.00 0.00 H new ATOM 0 HE1 TYR A 462 -6.394 1.735 -9.102 1.00 0.00 H new ATOM 0 HE2 TYR A 462 -7.653 0.939 -5.107 1.00 0.00 H new ATOM 0 HH TYR A 462 -8.444 2.613 -6.312 1.00 0.00 H new ATOM 198 N LEU A 463 -3.763 -4.915 -6.524 1.00 0.00 N ATOM 199 CA LEU A 463 -2.780 -5.986 -6.399 1.00 0.00 C ATOM 200 C LEU A 463 -3.160 -7.177 -7.271 1.00 0.00 C ATOM 201 O LEU A 463 -2.295 -7.851 -7.830 1.00 0.00 O ATOM 202 CB LEU A 463 -2.656 -6.425 -4.939 1.00 0.00 C ATOM 203 CG LEU A 463 -2.091 -5.366 -3.991 1.00 0.00 C ATOM 204 CD1 LEU A 463 -2.440 -5.701 -2.548 1.00 0.00 C ATOM 205 CD2 LEU A 463 -0.585 -5.247 -4.164 1.00 0.00 C ATOM 0 H LEU A 463 -4.297 -4.732 -5.675 1.00 0.00 H new ATOM 0 HA LEU A 463 -1.817 -5.604 -6.738 1.00 0.00 H new ATOM 0 HB2 LEU A 463 -3.641 -6.724 -4.580 1.00 0.00 H new ATOM 0 HB3 LEU A 463 -2.019 -7.308 -4.894 1.00 0.00 H new ATOM 0 HG LEU A 463 -2.542 -4.405 -4.238 1.00 0.00 H new ATOM 0 HD11 LEU A 463 -2.030 -4.937 -1.888 1.00 0.00 H new ATOM 0 HD12 LEU A 463 -3.524 -5.735 -2.434 1.00 0.00 H new ATOM 0 HD13 LEU A 463 -2.017 -6.671 -2.287 1.00 0.00 H new ATOM 0 HD21 LEU A 463 -0.199 -4.489 -3.482 1.00 0.00 H new ATOM 0 HD22 LEU A 463 -0.116 -6.206 -3.943 1.00 0.00 H new ATOM 0 HD23 LEU A 463 -0.358 -4.960 -5.191 1.00 0.00 H new ATOM 217 N THR A 464 -4.459 -7.432 -7.382 1.00 0.00 N ATOM 218 CA THR A 464 -4.954 -8.540 -8.186 1.00 0.00 C ATOM 219 C THR A 464 -4.659 -8.314 -9.665 1.00 0.00 C ATOM 220 O THR A 464 -4.440 -9.263 -10.418 1.00 0.00 O ATOM 221 CB THR A 464 -6.458 -8.714 -7.974 1.00 0.00 C ATOM 222 OG1 THR A 464 -7.099 -7.455 -7.876 1.00 0.00 O ATOM 223 CG2 THR A 464 -6.799 -9.502 -6.726 1.00 0.00 C ATOM 0 H THR A 464 -5.188 -6.885 -6.924 1.00 0.00 H new ATOM 0 HA THR A 464 -4.440 -9.447 -7.868 1.00 0.00 H new ATOM 0 HB THR A 464 -6.810 -9.270 -8.843 1.00 0.00 H new ATOM 0 HG1 THR A 464 -6.753 -6.857 -8.571 1.00 0.00 H new ATOM 0 HG21 THR A 464 -7.882 -9.589 -6.635 1.00 0.00 H new ATOM 0 HG22 THR A 464 -6.360 -10.497 -6.793 1.00 0.00 H new ATOM 0 HG23 THR A 464 -6.401 -8.988 -5.851 1.00 0.00 H new ATOM 231 N ARG A 465 -4.656 -7.049 -10.074 1.00 0.00 N ATOM 232 CA ARG A 465 -4.387 -6.697 -11.464 1.00 0.00 C ATOM 233 C ARG A 465 -2.896 -6.776 -11.766 1.00 0.00 C ATOM 234 O ARG A 465 -2.469 -7.499 -12.666 1.00 0.00 O ATOM 235 CB ARG A 465 -4.906 -5.290 -11.765 1.00 0.00 C ATOM 236 CG ARG A 465 -4.779 -4.895 -13.227 1.00 0.00 C ATOM 237 CD ARG A 465 -5.258 -3.472 -13.467 1.00 0.00 C ATOM 238 NE ARG A 465 -6.691 -3.326 -13.219 1.00 0.00 N ATOM 239 CZ ARG A 465 -7.217 -3.036 -12.031 1.00 0.00 C ATOM 240 NH1 ARG A 465 -6.436 -2.861 -10.972 1.00 0.00 N ATOM 241 NH2 ARG A 465 -8.532 -2.921 -11.900 1.00 0.00 N ATOM 0 H ARG A 465 -4.836 -6.252 -9.464 1.00 0.00 H new ATOM 0 HA ARG A 465 -4.907 -7.413 -12.101 1.00 0.00 H new ATOM 0 HB2 ARG A 465 -5.953 -5.227 -11.470 1.00 0.00 H new ATOM 0 HB3 ARG A 465 -4.359 -4.572 -11.154 1.00 0.00 H new ATOM 0 HG2 ARG A 465 -3.739 -4.987 -13.540 1.00 0.00 H new ATOM 0 HG3 ARG A 465 -5.359 -5.583 -13.842 1.00 0.00 H new ATOM 0 HD2 ARG A 465 -4.707 -2.790 -12.819 1.00 0.00 H new ATOM 0 HD3 ARG A 465 -5.037 -3.184 -14.495 1.00 0.00 H new ATOM 0 HE ARG A 465 -7.328 -3.454 -14.005 1.00 0.00 H new ATOM 0 HH11 ARG A 465 -5.424 -2.948 -11.065 1.00 0.00 H new ATOM 0 HH12 ARG A 465 -6.848 -2.639 -10.066 1.00 0.00 H new ATOM 0 HH21 ARG A 465 -9.139 -3.055 -12.709 1.00 0.00 H new ATOM 0 HH22 ARG A 465 -8.936 -2.699 -10.990 1.00 0.00 H new ATOM 255 N LYS A 466 -2.110 -6.028 -11.004 1.00 0.00 N ATOM 256 CA LYS A 466 -0.664 -6.006 -11.182 1.00 0.00 C ATOM 257 C LYS A 466 0.047 -5.825 -9.844 1.00 0.00 C ATOM 258 O LYS A 466 -0.479 -5.182 -8.934 1.00 0.00 O ATOM 259 CB LYS A 466 -0.264 -4.883 -12.142 1.00 0.00 C ATOM 260 CG LYS A 466 -0.593 -3.494 -11.623 1.00 0.00 C ATOM 261 CD LYS A 466 -1.917 -2.992 -12.175 1.00 0.00 C ATOM 262 CE LYS A 466 -2.217 -1.578 -11.703 1.00 0.00 C ATOM 263 NZ LYS A 466 -2.894 -0.772 -12.757 1.00 0.00 N ATOM 0 H LYS A 466 -2.451 -5.426 -10.254 1.00 0.00 H new ATOM 0 HA LYS A 466 -0.361 -6.963 -11.607 1.00 0.00 H new ATOM 0 HB2 LYS A 466 0.807 -4.945 -12.335 1.00 0.00 H new ATOM 0 HB3 LYS A 466 -0.769 -5.035 -13.096 1.00 0.00 H new ATOM 0 HG2 LYS A 466 -0.635 -3.512 -10.534 1.00 0.00 H new ATOM 0 HG3 LYS A 466 0.203 -2.803 -11.900 1.00 0.00 H new ATOM 0 HD2 LYS A 466 -1.890 -3.015 -13.264 1.00 0.00 H new ATOM 0 HD3 LYS A 466 -2.720 -3.659 -11.861 1.00 0.00 H new ATOM 0 HE2 LYS A 466 -2.848 -1.618 -10.815 1.00 0.00 H new ATOM 0 HE3 LYS A 466 -1.288 -1.088 -11.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 466 -2.226 -0.076 -13.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 466 -3.220 -1.400 -13.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 466 -3.710 -0.276 -12.345 1.00 0.00 H new ATOM 277 N PRO A 467 1.259 -6.390 -9.704 1.00 0.00 N ATOM 278 CA PRO A 467 2.042 -6.286 -8.469 1.00 0.00 C ATOM 279 C PRO A 467 2.594 -4.881 -8.251 1.00 0.00 C ATOM 280 O PRO A 467 3.158 -4.277 -9.164 1.00 0.00 O ATOM 281 CB PRO A 467 3.182 -7.280 -8.688 1.00 0.00 C ATOM 282 CG PRO A 467 3.339 -7.356 -10.167 1.00 0.00 C ATOM 283 CD PRO A 467 1.960 -7.173 -10.740 1.00 0.00 C ATOM 0 HA PRO A 467 1.440 -6.496 -7.585 1.00 0.00 H new ATOM 0 HB2 PRO A 467 4.101 -6.941 -8.209 1.00 0.00 H new ATOM 0 HB3 PRO A 467 2.943 -8.256 -8.265 1.00 0.00 H new ATOM 0 HG2 PRO A 467 4.017 -6.583 -10.528 1.00 0.00 H new ATOM 0 HG3 PRO A 467 3.762 -8.315 -10.466 1.00 0.00 H new ATOM 0 HD2 PRO A 467 1.988 -6.644 -11.693 1.00 0.00 H new ATOM 0 HD3 PRO A 467 1.470 -8.130 -10.921 1.00 0.00 H new ATOM 291 N MET A 468 2.428 -4.366 -7.037 1.00 0.00 N ATOM 292 CA MET A 468 2.913 -3.032 -6.701 1.00 0.00 C ATOM 293 C MET A 468 3.490 -2.999 -5.291 1.00 0.00 C ATOM 294 O MET A 468 3.126 -3.811 -4.440 1.00 0.00 O ATOM 295 CB MET A 468 1.781 -2.010 -6.825 1.00 0.00 C ATOM 296 CG MET A 468 1.210 -1.903 -8.230 1.00 0.00 C ATOM 297 SD MET A 468 0.072 -0.516 -8.412 1.00 0.00 S ATOM 298 CE MET A 468 -1.138 -0.903 -7.150 1.00 0.00 C ATOM 0 H MET A 468 1.962 -4.851 -6.270 1.00 0.00 H new ATOM 0 HA MET A 468 3.706 -2.775 -7.403 1.00 0.00 H new ATOM 0 HB2 MET A 468 0.981 -2.281 -6.136 1.00 0.00 H new ATOM 0 HB3 MET A 468 2.150 -1.032 -6.516 1.00 0.00 H new ATOM 0 HG2 MET A 468 2.027 -1.794 -8.943 1.00 0.00 H new ATOM 0 HG3 MET A 468 0.691 -2.829 -8.479 1.00 0.00 H new ATOM 0 HE1 MET A 468 -2.005 -0.252 -7.265 1.00 0.00 H new ATOM 0 HE2 MET A 468 -1.449 -1.943 -7.251 1.00 0.00 H new ATOM 0 HE3 MET A 468 -0.698 -0.750 -6.165 1.00 0.00 H new ATOM 308 N THR A 469 4.392 -2.053 -5.048 1.00 0.00 N ATOM 309 CA THR A 469 5.020 -1.912 -3.740 1.00 0.00 C ATOM 310 C THR A 469 4.149 -1.075 -2.808 1.00 0.00 C ATOM 311 O THR A 469 3.192 -0.436 -3.245 1.00 0.00 O ATOM 312 CB THR A 469 6.403 -1.274 -3.881 1.00 0.00 C ATOM 313 OG1 THR A 469 7.067 -1.228 -2.629 1.00 0.00 O ATOM 314 CG2 THR A 469 6.361 0.136 -4.433 1.00 0.00 C ATOM 0 H THR A 469 4.704 -1.373 -5.741 1.00 0.00 H new ATOM 0 HA THR A 469 5.132 -2.906 -3.307 1.00 0.00 H new ATOM 0 HB THR A 469 6.940 -1.906 -4.588 1.00 0.00 H new ATOM 0 HG1 THR A 469 7.461 -2.104 -2.435 1.00 0.00 H new ATOM 0 HG21 THR A 469 7.375 0.528 -4.507 1.00 0.00 H new ATOM 0 HG22 THR A 469 5.903 0.126 -5.422 1.00 0.00 H new ATOM 0 HG23 THR A 469 5.775 0.770 -3.768 1.00 0.00 H new ATOM 322 N THR A 470 4.487 -1.084 -1.523 1.00 0.00 N ATOM 323 CA THR A 470 3.734 -0.325 -0.529 1.00 0.00 C ATOM 324 C THR A 470 3.707 1.159 -0.882 1.00 0.00 C ATOM 325 O THR A 470 2.696 1.834 -0.690 1.00 0.00 O ATOM 326 CB THR A 470 4.341 -0.522 0.861 1.00 0.00 C ATOM 327 OG1 THR A 470 5.711 -0.867 0.766 1.00 0.00 O ATOM 328 CG2 THR A 470 3.650 -1.600 1.669 1.00 0.00 C ATOM 0 H THR A 470 5.276 -1.608 -1.145 1.00 0.00 H new ATOM 0 HA THR A 470 2.709 -0.696 -0.525 1.00 0.00 H new ATOM 0 HB THR A 470 4.209 0.432 1.371 1.00 0.00 H new ATOM 0 HG1 THR A 470 6.167 -0.235 0.172 1.00 0.00 H new ATOM 0 HG21 THR A 470 4.130 -1.688 2.644 1.00 0.00 H new ATOM 0 HG22 THR A 470 2.601 -1.338 1.804 1.00 0.00 H new ATOM 0 HG23 THR A 470 3.721 -2.552 1.142 1.00 0.00 H new ATOM 336 N LYS A 471 4.824 1.660 -1.398 1.00 0.00 N ATOM 337 CA LYS A 471 4.926 3.064 -1.778 1.00 0.00 C ATOM 338 C LYS A 471 3.885 3.421 -2.833 1.00 0.00 C ATOM 339 O LYS A 471 3.250 4.473 -2.763 1.00 0.00 O ATOM 340 CB LYS A 471 6.329 3.371 -2.305 1.00 0.00 C ATOM 341 CG LYS A 471 6.566 4.845 -2.585 1.00 0.00 C ATOM 342 CD LYS A 471 7.949 5.087 -3.167 1.00 0.00 C ATOM 343 CE LYS A 471 8.246 6.572 -3.297 1.00 0.00 C ATOM 344 NZ LYS A 471 8.449 7.217 -1.970 1.00 0.00 N ATOM 0 H LYS A 471 5.671 1.115 -1.563 1.00 0.00 H new ATOM 0 HA LYS A 471 4.738 3.668 -0.890 1.00 0.00 H new ATOM 0 HB2 LYS A 471 7.064 3.025 -1.578 1.00 0.00 H new ATOM 0 HB3 LYS A 471 6.496 2.805 -3.221 1.00 0.00 H new ATOM 0 HG2 LYS A 471 5.809 5.211 -3.279 1.00 0.00 H new ATOM 0 HG3 LYS A 471 6.454 5.414 -1.662 1.00 0.00 H new ATOM 0 HD2 LYS A 471 8.700 4.619 -2.530 1.00 0.00 H new ATOM 0 HD3 LYS A 471 8.021 4.613 -4.146 1.00 0.00 H new ATOM 0 HE2 LYS A 471 9.137 6.712 -3.908 1.00 0.00 H new ATOM 0 HE3 LYS A 471 7.423 7.063 -3.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 471 9.012 8.084 -2.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 471 7.526 7.457 -1.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 471 8.952 6.561 -1.338 1.00 0.00 H new ATOM 358 N ASP A 472 3.715 2.537 -3.811 1.00 0.00 N ATOM 359 CA ASP A 472 2.749 2.758 -4.882 1.00 0.00 C ATOM 360 C ASP A 472 1.329 2.818 -4.333 1.00 0.00 C ATOM 361 O ASP A 472 0.490 3.568 -4.833 1.00 0.00 O ATOM 362 CB ASP A 472 2.857 1.649 -5.930 1.00 0.00 C ATOM 363 CG ASP A 472 4.186 1.669 -6.660 1.00 0.00 C ATOM 364 OD1 ASP A 472 4.886 2.701 -6.592 1.00 0.00 O ATOM 365 OD2 ASP A 472 4.527 0.651 -7.300 1.00 0.00 O ATOM 0 H ASP A 472 4.233 1.661 -3.884 1.00 0.00 H new ATOM 0 HA ASP A 472 2.977 3.716 -5.350 1.00 0.00 H new ATOM 0 HB2 ASP A 472 2.727 0.681 -5.445 1.00 0.00 H new ATOM 0 HB3 ASP A 472 2.048 1.756 -6.652 1.00 0.00 H new ATOM 370 N LEU A 473 1.065 2.023 -3.302 1.00 0.00 N ATOM 371 CA LEU A 473 -0.256 1.985 -2.684 1.00 0.00 C ATOM 372 C LEU A 473 -0.646 3.357 -2.144 1.00 0.00 C ATOM 373 O LEU A 473 -1.789 3.790 -2.288 1.00 0.00 O ATOM 374 CB LEU A 473 -0.283 0.953 -1.553 1.00 0.00 C ATOM 375 CG LEU A 473 0.079 -0.473 -1.969 1.00 0.00 C ATOM 376 CD1 LEU A 473 -0.052 -1.422 -0.789 1.00 0.00 C ATOM 377 CD2 LEU A 473 -0.801 -0.930 -3.124 1.00 0.00 C ATOM 0 H LEU A 473 1.748 1.396 -2.876 1.00 0.00 H new ATOM 0 HA LEU A 473 -0.978 1.697 -3.448 1.00 0.00 H new ATOM 0 HB2 LEU A 473 0.407 1.274 -0.773 1.00 0.00 H new ATOM 0 HB3 LEU A 473 -1.280 0.945 -1.113 1.00 0.00 H new ATOM 0 HG LEU A 473 1.117 -0.482 -2.303 1.00 0.00 H new ATOM 0 HD11 LEU A 473 0.210 -2.432 -1.104 1.00 0.00 H new ATOM 0 HD12 LEU A 473 0.620 -1.105 0.009 1.00 0.00 H new ATOM 0 HD13 LEU A 473 -1.079 -1.410 -0.425 1.00 0.00 H new ATOM 0 HD21 LEU A 473 -0.530 -1.947 -3.408 1.00 0.00 H new ATOM 0 HD22 LEU A 473 -1.847 -0.905 -2.817 1.00 0.00 H new ATOM 0 HD23 LEU A 473 -0.657 -0.265 -3.976 1.00 0.00 H new ATOM 389 N LEU A 474 0.312 4.038 -1.523 1.00 0.00 N ATOM 390 CA LEU A 474 0.067 5.362 -0.962 1.00 0.00 C ATOM 391 C LEU A 474 -0.147 6.392 -2.066 1.00 0.00 C ATOM 392 O LEU A 474 -0.891 7.356 -1.891 1.00 0.00 O ATOM 393 CB LEU A 474 1.238 5.786 -0.073 1.00 0.00 C ATOM 394 CG LEU A 474 1.255 5.158 1.321 1.00 0.00 C ATOM 395 CD1 LEU A 474 2.637 5.275 1.943 1.00 0.00 C ATOM 396 CD2 LEU A 474 0.210 5.815 2.211 1.00 0.00 C ATOM 0 H LEU A 474 1.264 3.695 -1.396 1.00 0.00 H new ATOM 0 HA LEU A 474 -0.839 5.311 -0.359 1.00 0.00 H new ATOM 0 HB2 LEU A 474 2.169 5.533 -0.580 1.00 0.00 H new ATOM 0 HB3 LEU A 474 1.218 6.871 0.034 1.00 0.00 H new ATOM 0 HG LEU A 474 1.012 4.100 1.226 1.00 0.00 H new ATOM 0 HD11 LEU A 474 2.629 4.823 2.935 1.00 0.00 H new ATOM 0 HD12 LEU A 474 3.364 4.760 1.315 1.00 0.00 H new ATOM 0 HD13 LEU A 474 2.911 6.327 2.026 1.00 0.00 H new ATOM 0 HD21 LEU A 474 0.234 5.357 3.200 1.00 0.00 H new ATOM 0 HD22 LEU A 474 0.425 6.880 2.299 1.00 0.00 H new ATOM 0 HD23 LEU A 474 -0.779 5.679 1.773 1.00 0.00 H new ATOM 408 N LYS A 475 0.511 6.183 -3.203 1.00 0.00 N ATOM 409 CA LYS A 475 0.394 7.096 -4.335 1.00 0.00 C ATOM 410 C LYS A 475 -1.064 7.266 -4.757 1.00 0.00 C ATOM 411 O LYS A 475 -1.441 8.296 -5.315 1.00 0.00 O ATOM 412 CB LYS A 475 1.221 6.584 -5.516 1.00 0.00 C ATOM 413 CG LYS A 475 2.718 6.592 -5.259 1.00 0.00 C ATOM 414 CD LYS A 475 3.498 6.184 -6.499 1.00 0.00 C ATOM 415 CE LYS A 475 4.988 6.088 -6.212 1.00 0.00 C ATOM 416 NZ LYS A 475 5.807 6.579 -7.356 1.00 0.00 N ATOM 0 H LYS A 475 1.131 5.389 -3.364 1.00 0.00 H new ATOM 0 HA LYS A 475 0.776 8.068 -4.023 1.00 0.00 H new ATOM 0 HB2 LYS A 475 0.907 5.568 -5.755 1.00 0.00 H new ATOM 0 HB3 LYS A 475 1.008 7.198 -6.391 1.00 0.00 H new ATOM 0 HG2 LYS A 475 3.029 7.588 -4.944 1.00 0.00 H new ATOM 0 HG3 LYS A 475 2.951 5.911 -4.440 1.00 0.00 H new ATOM 0 HD2 LYS A 475 3.133 5.222 -6.860 1.00 0.00 H new ATOM 0 HD3 LYS A 475 3.325 6.909 -7.294 1.00 0.00 H new ATOM 0 HE2 LYS A 475 5.224 6.669 -5.321 1.00 0.00 H new ATOM 0 HE3 LYS A 475 5.250 5.052 -5.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 475 6.817 6.497 -7.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 475 5.601 6.008 -8.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 475 5.576 7.575 -7.546 1.00 0.00 H new ATOM 430 N LYS A 476 -1.878 6.250 -4.488 1.00 0.00 N ATOM 431 CA LYS A 476 -3.292 6.288 -4.843 1.00 0.00 C ATOM 432 C LYS A 476 -3.984 7.493 -4.209 1.00 0.00 C ATOM 433 O LYS A 476 -4.864 8.105 -4.816 1.00 0.00 O ATOM 434 CB LYS A 476 -3.986 4.998 -4.400 1.00 0.00 C ATOM 435 CG LYS A 476 -3.385 3.745 -5.014 1.00 0.00 C ATOM 436 CD LYS A 476 -3.526 3.744 -6.528 1.00 0.00 C ATOM 437 CE LYS A 476 -3.024 2.444 -7.135 1.00 0.00 C ATOM 438 NZ LYS A 476 -3.080 2.466 -8.622 1.00 0.00 N ATOM 0 H LYS A 476 -1.582 5.390 -4.025 1.00 0.00 H new ATOM 0 HA LYS A 476 -3.364 6.380 -5.927 1.00 0.00 H new ATOM 0 HB2 LYS A 476 -3.934 4.922 -3.314 1.00 0.00 H new ATOM 0 HB3 LYS A 476 -5.042 5.053 -4.666 1.00 0.00 H new ATOM 0 HG2 LYS A 476 -2.331 3.677 -4.746 1.00 0.00 H new ATOM 0 HG3 LYS A 476 -3.877 2.864 -4.601 1.00 0.00 H new ATOM 0 HD2 LYS A 476 -4.572 3.892 -6.797 1.00 0.00 H new ATOM 0 HD3 LYS A 476 -2.968 4.581 -6.947 1.00 0.00 H new ATOM 0 HE2 LYS A 476 -1.998 2.266 -6.813 1.00 0.00 H new ATOM 0 HE3 LYS A 476 -3.624 1.614 -6.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 476 -3.823 1.817 -8.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 476 -3.293 3.431 -8.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 476 -2.162 2.166 -9.008 1.00 0.00 H new ATOM 452 N PHE A 477 -3.580 7.829 -2.988 1.00 0.00 N ATOM 453 CA PHE A 477 -4.163 8.962 -2.275 1.00 0.00 C ATOM 454 C PHE A 477 -3.206 9.482 -1.206 1.00 0.00 C ATOM 455 O PHE A 477 -3.600 9.704 -0.060 1.00 0.00 O ATOM 456 CB PHE A 477 -5.493 8.558 -1.636 1.00 0.00 C ATOM 457 CG PHE A 477 -6.510 8.061 -2.624 1.00 0.00 C ATOM 458 CD1 PHE A 477 -7.358 8.947 -3.269 1.00 0.00 C ATOM 459 CD2 PHE A 477 -6.616 6.709 -2.908 1.00 0.00 C ATOM 460 CE1 PHE A 477 -8.295 8.492 -4.179 1.00 0.00 C ATOM 461 CE2 PHE A 477 -7.550 6.249 -3.816 1.00 0.00 C ATOM 462 CZ PHE A 477 -8.391 7.141 -4.452 1.00 0.00 C ATOM 0 H PHE A 477 -2.853 7.334 -2.472 1.00 0.00 H new ATOM 0 HA PHE A 477 -4.342 9.761 -2.995 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -5.309 7.780 -0.895 1.00 0.00 H new ATOM 0 HB3 PHE A 477 -5.905 9.415 -1.103 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -7.287 10.004 -3.059 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -5.961 6.007 -2.414 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -8.951 9.192 -4.676 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -7.622 5.193 -4.028 1.00 0.00 H new ATOM 0 HZ PHE A 477 -9.122 6.783 -5.161 1.00 0.00 H new ATOM 472 N GLN A 478 -1.947 9.674 -1.587 1.00 0.00 N ATOM 473 CA GLN A 478 -0.935 10.166 -0.659 1.00 0.00 C ATOM 474 C GLN A 478 -1.152 11.643 -0.346 1.00 0.00 C ATOM 475 O GLN A 478 -1.041 12.065 0.805 1.00 0.00 O ATOM 476 CB GLN A 478 0.465 9.957 -1.240 1.00 0.00 C ATOM 477 CG GLN A 478 0.665 10.605 -2.601 1.00 0.00 C ATOM 478 CD GLN A 478 2.090 10.479 -3.104 1.00 0.00 C ATOM 479 OE1 GLN A 478 2.647 9.277 -3.011 1.00 0.00 O flip ATOM 480 NE2 GLN A 478 2.684 11.451 -3.571 1.00 0.00 N flip ATOM 0 H GLN A 478 -1.604 9.497 -2.531 1.00 0.00 H new ATOM 0 HA GLN A 478 -1.025 9.600 0.268 1.00 0.00 H new ATOM 0 HB2 GLN A 478 1.201 10.359 -0.544 1.00 0.00 H new ATOM 0 HB3 GLN A 478 0.658 8.888 -1.325 1.00 0.00 H new ATOM 0 HG2 GLN A 478 -0.012 10.146 -3.321 1.00 0.00 H new ATOM 0 HG3 GLN A 478 0.397 11.660 -2.540 1.00 0.00 H new ATOM 0 HE21 GLN A 478 2.218 12.357 -3.624 1.00 0.00 H new ATOM 0 HE22 GLN A 478 3.642 11.351 -3.905 1.00 0.00 H new ATOM 489 N THR A 479 -1.461 12.423 -1.376 1.00 0.00 N ATOM 490 CA THR A 479 -1.692 13.853 -1.207 1.00 0.00 C ATOM 491 C THR A 479 -3.035 14.265 -1.803 1.00 0.00 C ATOM 492 O THR A 479 -3.212 15.408 -2.226 1.00 0.00 O ATOM 493 CB THR A 479 -0.564 14.653 -1.861 1.00 0.00 C ATOM 494 OG1 THR A 479 -0.565 14.465 -3.265 1.00 0.00 O ATOM 495 CG2 THR A 479 0.810 14.280 -1.348 1.00 0.00 C ATOM 0 H THR A 479 -1.557 12.090 -2.335 1.00 0.00 H new ATOM 0 HA THR A 479 -1.710 14.068 -0.138 1.00 0.00 H new ATOM 0 HB THR A 479 -0.760 15.693 -1.602 1.00 0.00 H new ATOM 0 HG1 THR A 479 0.162 14.986 -3.665 1.00 0.00 H new ATOM 0 HG21 THR A 479 1.563 14.884 -1.853 1.00 0.00 H new ATOM 0 HG22 THR A 479 0.859 14.461 -0.274 1.00 0.00 H new ATOM 0 HG23 THR A 479 0.998 13.225 -1.547 1.00 0.00 H new ATOM 503 N LYS A 480 -3.978 13.330 -1.836 1.00 0.00 N ATOM 504 CA LYS A 480 -5.303 13.600 -2.381 1.00 0.00 C ATOM 505 C LYS A 480 -6.297 13.915 -1.269 1.00 0.00 C ATOM 506 O LYS A 480 -6.182 13.401 -0.156 1.00 0.00 O ATOM 507 CB LYS A 480 -5.796 12.404 -3.199 1.00 0.00 C ATOM 508 CG LYS A 480 -4.988 12.157 -4.463 1.00 0.00 C ATOM 509 CD LYS A 480 -5.609 11.061 -5.314 1.00 0.00 C ATOM 510 CE LYS A 480 -4.739 10.730 -6.516 1.00 0.00 C ATOM 511 NZ LYS A 480 -3.491 10.018 -6.120 1.00 0.00 N ATOM 0 H LYS A 480 -3.849 12.378 -1.492 1.00 0.00 H new ATOM 0 HA LYS A 480 -5.228 14.471 -3.033 1.00 0.00 H new ATOM 0 HB2 LYS A 480 -5.763 11.510 -2.576 1.00 0.00 H new ATOM 0 HB3 LYS A 480 -6.839 12.565 -3.470 1.00 0.00 H new ATOM 0 HG2 LYS A 480 -4.926 13.078 -5.042 1.00 0.00 H new ATOM 0 HG3 LYS A 480 -3.968 11.879 -4.196 1.00 0.00 H new ATOM 0 HD2 LYS A 480 -5.752 10.166 -4.709 1.00 0.00 H new ATOM 0 HD3 LYS A 480 -6.595 11.377 -5.653 1.00 0.00 H new ATOM 0 HE2 LYS A 480 -5.304 10.112 -7.214 1.00 0.00 H new ATOM 0 HE3 LYS A 480 -4.481 11.649 -7.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 480 -2.803 10.064 -6.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 480 -3.087 10.469 -5.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 480 -3.710 9.023 -5.910 1.00 0.00 H new ATOM 525 N LYS A 481 -7.273 14.763 -1.577 1.00 0.00 N ATOM 526 CA LYS A 481 -8.288 15.147 -0.602 1.00 0.00 C ATOM 527 C LYS A 481 -9.160 13.954 -0.225 1.00 0.00 C ATOM 528 O LYS A 481 -10.249 13.772 -0.768 1.00 0.00 O ATOM 529 CB LYS A 481 -9.160 16.273 -1.162 1.00 0.00 C ATOM 530 CG LYS A 481 -9.658 16.011 -2.574 1.00 0.00 C ATOM 531 CD LYS A 481 -11.173 16.116 -2.664 1.00 0.00 C ATOM 532 CE LYS A 481 -11.755 15.035 -3.561 1.00 0.00 C ATOM 533 NZ LYS A 481 -13.238 14.963 -3.452 1.00 0.00 N ATOM 0 H LYS A 481 -7.383 15.197 -2.493 1.00 0.00 H new ATOM 0 HA LYS A 481 -7.780 15.500 0.295 1.00 0.00 H new ATOM 0 HB2 LYS A 481 -10.017 16.419 -0.505 1.00 0.00 H new ATOM 0 HB3 LYS A 481 -8.590 17.202 -1.153 1.00 0.00 H new ATOM 0 HG2 LYS A 481 -9.202 16.726 -3.259 1.00 0.00 H new ATOM 0 HG3 LYS A 481 -9.342 15.018 -2.893 1.00 0.00 H new ATOM 0 HD2 LYS A 481 -11.604 16.033 -1.666 1.00 0.00 H new ATOM 0 HD3 LYS A 481 -11.448 17.098 -3.050 1.00 0.00 H new ATOM 0 HE2 LYS A 481 -11.476 15.233 -4.596 1.00 0.00 H new ATOM 0 HE3 LYS A 481 -11.324 14.070 -3.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 481 -13.596 14.214 -4.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 481 -13.504 14.749 -2.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 481 -13.651 15.875 -3.732 1.00 0.00 H new ATOM 547 N THR A 482 -8.674 13.145 0.710 1.00 0.00 N ATOM 548 CA THR A 482 -9.410 11.970 1.162 1.00 0.00 C ATOM 549 C THR A 482 -9.871 12.135 2.607 1.00 0.00 C ATOM 550 O THR A 482 -10.079 11.152 3.318 1.00 0.00 O ATOM 551 CB THR A 482 -8.540 10.718 1.034 1.00 0.00 C ATOM 552 OG1 THR A 482 -7.293 10.906 1.679 1.00 0.00 O ATOM 553 CG2 THR A 482 -8.260 10.326 -0.401 1.00 0.00 C ATOM 0 H THR A 482 -7.774 13.281 1.170 1.00 0.00 H new ATOM 0 HA THR A 482 -10.291 11.861 0.530 1.00 0.00 H new ATOM 0 HB THR A 482 -9.113 9.920 1.506 1.00 0.00 H new ATOM 0 HG1 THR A 482 -6.752 10.094 1.587 1.00 0.00 H new ATOM 0 HG21 THR A 482 -7.638 9.431 -0.419 1.00 0.00 H new ATOM 0 HG22 THR A 482 -9.201 10.125 -0.913 1.00 0.00 H new ATOM 0 HG23 THR A 482 -7.739 11.140 -0.905 1.00 0.00 H new ATOM 561 N GLY A 483 -10.030 13.384 3.037 1.00 0.00 N ATOM 562 CA GLY A 483 -10.465 13.650 4.396 1.00 0.00 C ATOM 563 C GLY A 483 -9.349 13.474 5.407 1.00 0.00 C ATOM 564 O GLY A 483 -8.981 14.418 6.105 1.00 0.00 O ATOM 0 H GLY A 483 -9.865 14.215 2.469 1.00 0.00 H new ATOM 0 HA2 GLY A 483 -10.850 14.668 4.458 1.00 0.00 H new ATOM 0 HA3 GLY A 483 -11.288 12.982 4.648 1.00 0.00 H new ATOM 568 N LEU A 484 -8.810 12.261 5.486 1.00 0.00 N ATOM 569 CA LEU A 484 -7.730 11.964 6.418 1.00 0.00 C ATOM 570 C LEU A 484 -6.389 12.437 5.867 1.00 0.00 C ATOM 571 O LEU A 484 -6.147 12.381 4.662 1.00 0.00 O ATOM 572 CB LEU A 484 -7.675 10.461 6.700 1.00 0.00 C ATOM 573 CG LEU A 484 -9.008 9.829 7.107 1.00 0.00 C ATOM 574 CD1 LEU A 484 -8.935 8.315 6.998 1.00 0.00 C ATOM 575 CD2 LEU A 484 -9.384 10.246 8.521 1.00 0.00 C ATOM 0 H LEU A 484 -9.104 11.469 4.915 1.00 0.00 H new ATOM 0 HA LEU A 484 -7.928 12.497 7.348 1.00 0.00 H new ATOM 0 HB2 LEU A 484 -7.307 9.953 5.809 1.00 0.00 H new ATOM 0 HB3 LEU A 484 -6.948 10.282 7.493 1.00 0.00 H new ATOM 0 HG LEU A 484 -9.781 10.185 6.426 1.00 0.00 H new ATOM 0 HD11 LEU A 484 -9.892 7.883 7.291 1.00 0.00 H new ATOM 0 HD12 LEU A 484 -8.710 8.035 5.969 1.00 0.00 H new ATOM 0 HD13 LEU A 484 -8.151 7.940 7.656 1.00 0.00 H new ATOM 0 HD21 LEU A 484 -10.334 9.788 8.795 1.00 0.00 H new ATOM 0 HD22 LEU A 484 -8.610 9.918 9.215 1.00 0.00 H new ATOM 0 HD23 LEU A 484 -9.477 11.331 8.568 1.00 0.00 H new ATOM 587 N SER A 485 -5.520 12.904 6.758 1.00 0.00 N ATOM 588 CA SER A 485 -4.203 13.387 6.360 1.00 0.00 C ATOM 589 C SER A 485 -3.338 12.242 5.842 1.00 0.00 C ATOM 590 O SER A 485 -3.639 11.071 6.070 1.00 0.00 O ATOM 591 CB SER A 485 -3.509 14.071 7.539 1.00 0.00 C ATOM 592 OG SER A 485 -3.044 13.120 8.481 1.00 0.00 O ATOM 0 H SER A 485 -5.704 12.958 7.760 1.00 0.00 H new ATOM 0 HA SER A 485 -4.337 14.111 5.556 1.00 0.00 H new ATOM 0 HB2 SER A 485 -2.672 14.667 7.176 1.00 0.00 H new ATOM 0 HB3 SER A 485 -4.202 14.758 8.024 1.00 0.00 H new ATOM 0 HG SER A 485 -2.081 12.982 8.359 1.00 0.00 H new ATOM 598 N SER A 486 -2.262 12.589 5.142 1.00 0.00 N ATOM 599 CA SER A 486 -1.354 11.591 4.590 1.00 0.00 C ATOM 600 C SER A 486 -0.779 10.708 5.694 1.00 0.00 C ATOM 601 O SER A 486 -0.607 9.503 5.510 1.00 0.00 O ATOM 602 CB SER A 486 -0.218 12.273 3.824 1.00 0.00 C ATOM 603 OG SER A 486 -0.719 13.276 2.958 1.00 0.00 O ATOM 0 H SER A 486 -1.998 13.554 4.944 1.00 0.00 H new ATOM 0 HA SER A 486 -1.920 10.961 3.904 1.00 0.00 H new ATOM 0 HB2 SER A 486 0.486 12.715 4.529 1.00 0.00 H new ATOM 0 HB3 SER A 486 0.333 11.531 3.246 1.00 0.00 H new ATOM 0 HG SER A 486 -1.240 12.858 2.241 1.00 0.00 H new ATOM 609 N GLU A 487 -0.485 11.315 6.838 1.00 0.00 N ATOM 610 CA GLU A 487 0.069 10.582 7.971 1.00 0.00 C ATOM 611 C GLU A 487 -0.952 9.602 8.537 1.00 0.00 C ATOM 612 O GLU A 487 -0.639 8.436 8.781 1.00 0.00 O ATOM 613 CB GLU A 487 0.519 11.556 9.063 1.00 0.00 C ATOM 614 CG GLU A 487 1.234 10.881 10.223 1.00 0.00 C ATOM 615 CD GLU A 487 2.589 10.329 9.829 1.00 0.00 C ATOM 616 OE1 GLU A 487 3.178 10.842 8.853 1.00 0.00 O ATOM 617 OE2 GLU A 487 3.063 9.386 10.496 1.00 0.00 O ATOM 0 H GLU A 487 -0.621 12.312 7.006 1.00 0.00 H new ATOM 0 HA GLU A 487 0.932 10.016 7.619 1.00 0.00 H new ATOM 0 HB2 GLU A 487 1.181 12.301 8.623 1.00 0.00 H new ATOM 0 HB3 GLU A 487 -0.352 12.089 9.444 1.00 0.00 H new ATOM 0 HG2 GLU A 487 1.360 11.598 11.034 1.00 0.00 H new ATOM 0 HG3 GLU A 487 0.613 10.071 10.606 1.00 0.00 H new ATOM 624 N GLN A 488 -2.174 10.080 8.744 1.00 0.00 N ATOM 625 CA GLN A 488 -3.242 9.245 9.281 1.00 0.00 C ATOM 626 C GLN A 488 -3.600 8.127 8.308 1.00 0.00 C ATOM 627 O GLN A 488 -3.987 7.033 8.718 1.00 0.00 O ATOM 628 CB GLN A 488 -4.479 10.093 9.582 1.00 0.00 C ATOM 629 CG GLN A 488 -4.256 11.130 10.671 1.00 0.00 C ATOM 630 CD GLN A 488 -5.551 11.752 11.160 1.00 0.00 C ATOM 631 OE1 GLN A 488 -5.731 11.978 12.356 1.00 0.00 O ATOM 632 NE2 GLN A 488 -6.460 12.031 10.232 1.00 0.00 N ATOM 0 H GLN A 488 -2.450 11.042 8.548 1.00 0.00 H new ATOM 0 HA GLN A 488 -2.886 8.794 10.207 1.00 0.00 H new ATOM 0 HB2 GLN A 488 -4.793 10.599 8.669 1.00 0.00 H new ATOM 0 HB3 GLN A 488 -5.296 9.436 9.880 1.00 0.00 H new ATOM 0 HG2 GLN A 488 -3.741 10.664 11.511 1.00 0.00 H new ATOM 0 HG3 GLN A 488 -3.601 11.915 10.292 1.00 0.00 H new ATOM 0 HE21 GLN A 488 -6.267 11.826 9.252 1.00 0.00 H new ATOM 0 HE22 GLN A 488 -7.350 12.450 10.500 1.00 0.00 H new ATOM 641 N THR A 489 -3.471 8.410 7.015 1.00 0.00 N ATOM 642 CA THR A 489 -3.781 7.429 5.982 1.00 0.00 C ATOM 643 C THR A 489 -2.945 6.166 6.161 1.00 0.00 C ATOM 644 O THR A 489 -3.443 5.052 6.000 1.00 0.00 O ATOM 645 CB THR A 489 -3.538 8.023 4.594 1.00 0.00 C ATOM 646 OG1 THR A 489 -4.262 9.229 4.431 1.00 0.00 O ATOM 647 CG2 THR A 489 -3.933 7.093 3.467 1.00 0.00 C ATOM 0 H THR A 489 -3.154 9.311 6.658 1.00 0.00 H new ATOM 0 HA THR A 489 -4.834 7.162 6.076 1.00 0.00 H new ATOM 0 HB THR A 489 -2.463 8.197 4.539 1.00 0.00 H new ATOM 0 HG1 THR A 489 -3.750 9.972 4.813 1.00 0.00 H new ATOM 0 HG21 THR A 489 -3.735 7.576 2.510 1.00 0.00 H new ATOM 0 HG22 THR A 489 -3.354 6.172 3.535 1.00 0.00 H new ATOM 0 HG23 THR A 489 -4.995 6.860 3.543 1.00 0.00 H new ATOM 655 N VAL A 490 -1.670 6.348 6.493 1.00 0.00 N ATOM 656 CA VAL A 490 -0.766 5.223 6.694 1.00 0.00 C ATOM 657 C VAL A 490 -1.231 4.349 7.854 1.00 0.00 C ATOM 658 O VAL A 490 -1.192 3.122 7.775 1.00 0.00 O ATOM 659 CB VAL A 490 0.674 5.701 6.967 1.00 0.00 C ATOM 660 CG1 VAL A 490 1.627 4.516 7.056 1.00 0.00 C ATOM 661 CG2 VAL A 490 1.125 6.675 5.889 1.00 0.00 C ATOM 0 H VAL A 490 -1.241 7.264 6.628 1.00 0.00 H new ATOM 0 HA VAL A 490 -0.776 4.638 5.774 1.00 0.00 H new ATOM 0 HB VAL A 490 0.688 6.220 7.926 1.00 0.00 H new ATOM 0 HG11 VAL A 490 2.638 4.876 7.249 1.00 0.00 H new ATOM 0 HG12 VAL A 490 1.315 3.858 7.867 1.00 0.00 H new ATOM 0 HG13 VAL A 490 1.611 3.965 6.116 1.00 0.00 H new ATOM 0 HG21 VAL A 490 2.144 7.002 6.097 1.00 0.00 H new ATOM 0 HG22 VAL A 490 1.094 6.182 4.917 1.00 0.00 H new ATOM 0 HG23 VAL A 490 0.461 7.539 5.879 1.00 0.00 H new ATOM 671 N ASN A 491 -1.672 4.992 8.932 1.00 0.00 N ATOM 672 CA ASN A 491 -2.145 4.272 10.108 1.00 0.00 C ATOM 673 C ASN A 491 -3.341 3.391 9.763 1.00 0.00 C ATOM 674 O ASN A 491 -3.394 2.224 10.144 1.00 0.00 O ATOM 675 CB ASN A 491 -2.524 5.257 11.215 1.00 0.00 C ATOM 676 CG ASN A 491 -1.332 6.043 11.724 1.00 0.00 C ATOM 677 OD1 ASN A 491 -0.182 5.676 11.482 1.00 0.00 O ATOM 678 ND2 ASN A 491 -1.601 7.133 12.433 1.00 0.00 N ATOM 0 H ASN A 491 -1.711 6.008 9.014 1.00 0.00 H new ATOM 0 HA ASN A 491 -1.337 3.632 10.461 1.00 0.00 H new ATOM 0 HB2 ASN A 491 -3.278 5.949 10.839 1.00 0.00 H new ATOM 0 HB3 ASN A 491 -2.976 4.712 12.043 1.00 0.00 H new ATOM 0 HD21 ASN A 491 -0.839 7.703 12.801 1.00 0.00 H new ATOM 0 HD22 ASN A 491 -2.569 7.400 12.610 1.00 0.00 H new ATOM 685 N VAL A 492 -4.298 3.960 9.036 1.00 0.00 N ATOM 686 CA VAL A 492 -5.492 3.225 8.638 1.00 0.00 C ATOM 687 C VAL A 492 -5.162 2.174 7.584 1.00 0.00 C ATOM 688 O VAL A 492 -5.597 1.026 7.679 1.00 0.00 O ATOM 689 CB VAL A 492 -6.576 4.171 8.083 1.00 0.00 C ATOM 690 CG1 VAL A 492 -7.859 3.405 7.794 1.00 0.00 C ATOM 691 CG2 VAL A 492 -6.836 5.312 9.054 1.00 0.00 C ATOM 0 H VAL A 492 -4.269 4.927 8.711 1.00 0.00 H new ATOM 0 HA VAL A 492 -5.874 2.733 9.532 1.00 0.00 H new ATOM 0 HB VAL A 492 -6.216 4.596 7.146 1.00 0.00 H new ATOM 0 HG11 VAL A 492 -8.612 4.090 7.403 1.00 0.00 H new ATOM 0 HG12 VAL A 492 -7.660 2.626 7.058 1.00 0.00 H new ATOM 0 HG13 VAL A 492 -8.226 2.949 8.714 1.00 0.00 H new ATOM 0 HG21 VAL A 492 -7.604 5.969 8.646 1.00 0.00 H new ATOM 0 HG22 VAL A 492 -7.174 4.908 10.008 1.00 0.00 H new ATOM 0 HG23 VAL A 492 -5.917 5.878 9.205 1.00 0.00 H new ATOM 701 N LEU A 493 -4.391 2.574 6.578 1.00 0.00 N ATOM 702 CA LEU A 493 -4.002 1.667 5.505 1.00 0.00 C ATOM 703 C LEU A 493 -3.172 0.507 6.047 1.00 0.00 C ATOM 704 O LEU A 493 -3.377 -0.645 5.668 1.00 0.00 O ATOM 705 CB LEU A 493 -3.207 2.422 4.437 1.00 0.00 C ATOM 706 CG LEU A 493 -4.040 2.994 3.287 1.00 0.00 C ATOM 707 CD1 LEU A 493 -4.535 1.878 2.381 1.00 0.00 C ATOM 708 CD2 LEU A 493 -5.209 3.805 3.826 1.00 0.00 C ATOM 0 H LEU A 493 -4.023 3.521 6.484 1.00 0.00 H new ATOM 0 HA LEU A 493 -4.909 1.262 5.057 1.00 0.00 H new ATOM 0 HB2 LEU A 493 -2.670 3.240 4.917 1.00 0.00 H new ATOM 0 HB3 LEU A 493 -2.457 1.749 4.021 1.00 0.00 H new ATOM 0 HG LEU A 493 -3.406 3.657 2.699 1.00 0.00 H new ATOM 0 HD11 LEU A 493 -5.125 2.303 1.569 1.00 0.00 H new ATOM 0 HD12 LEU A 493 -3.682 1.340 1.967 1.00 0.00 H new ATOM 0 HD13 LEU A 493 -5.153 1.189 2.957 1.00 0.00 H new ATOM 0 HD21 LEU A 493 -5.790 4.204 2.994 1.00 0.00 H new ATOM 0 HD22 LEU A 493 -5.844 3.165 4.438 1.00 0.00 H new ATOM 0 HD23 LEU A 493 -4.832 4.628 4.432 1.00 0.00 H new ATOM 720 N ALA A 494 -2.234 0.820 6.934 1.00 0.00 N ATOM 721 CA ALA A 494 -1.372 -0.195 7.524 1.00 0.00 C ATOM 722 C ALA A 494 -2.188 -1.265 8.242 1.00 0.00 C ATOM 723 O ALA A 494 -1.827 -2.441 8.236 1.00 0.00 O ATOM 724 CB ALA A 494 -0.380 0.448 8.482 1.00 0.00 C ATOM 0 H ALA A 494 -2.052 1.769 7.260 1.00 0.00 H new ATOM 0 HA ALA A 494 -0.821 -0.680 6.718 1.00 0.00 H new ATOM 0 HB1 ALA A 494 0.258 -0.322 8.916 1.00 0.00 H new ATOM 0 HB2 ALA A 494 0.235 1.167 7.940 1.00 0.00 H new ATOM 0 HB3 ALA A 494 -0.922 0.961 9.277 1.00 0.00 H new ATOM 730 N GLN A 495 -3.287 -0.850 8.860 1.00 0.00 N ATOM 731 CA GLN A 495 -4.152 -1.777 9.583 1.00 0.00 C ATOM 732 C GLN A 495 -4.710 -2.844 8.646 1.00 0.00 C ATOM 733 O GLN A 495 -4.786 -4.019 9.004 1.00 0.00 O ATOM 734 CB GLN A 495 -5.298 -1.021 10.255 1.00 0.00 C ATOM 735 CG GLN A 495 -4.875 -0.243 11.490 1.00 0.00 C ATOM 736 CD GLN A 495 -5.991 0.615 12.049 1.00 0.00 C ATOM 737 OE1 GLN A 495 -6.981 0.887 11.370 1.00 0.00 O ATOM 738 NE2 GLN A 495 -5.837 1.049 13.296 1.00 0.00 N ATOM 0 H GLN A 495 -3.601 0.120 8.876 1.00 0.00 H new ATOM 0 HA GLN A 495 -3.554 -2.269 10.350 1.00 0.00 H new ATOM 0 HB2 GLN A 495 -5.738 -0.331 9.535 1.00 0.00 H new ATOM 0 HB3 GLN A 495 -6.077 -1.731 10.533 1.00 0.00 H new ATOM 0 HG2 GLN A 495 -4.539 -0.941 12.257 1.00 0.00 H new ATOM 0 HG3 GLN A 495 -4.024 0.391 11.242 1.00 0.00 H new ATOM 0 HE21 GLN A 495 -5.000 0.800 13.823 1.00 0.00 H new ATOM 0 HE22 GLN A 495 -6.556 1.631 13.726 1.00 0.00 H new ATOM 747 N ILE A 496 -5.098 -2.427 7.445 1.00 0.00 N ATOM 748 CA ILE A 496 -5.645 -3.339 6.459 1.00 0.00 C ATOM 749 C ILE A 496 -4.529 -4.132 5.781 1.00 0.00 C ATOM 750 O ILE A 496 -4.654 -5.335 5.552 1.00 0.00 O ATOM 751 CB ILE A 496 -6.465 -2.558 5.405 1.00 0.00 C ATOM 752 CG1 ILE A 496 -7.958 -2.628 5.733 1.00 0.00 C ATOM 753 CG2 ILE A 496 -6.202 -3.077 4.002 1.00 0.00 C ATOM 754 CD1 ILE A 496 -8.820 -1.808 4.799 1.00 0.00 C ATOM 0 H ILE A 496 -5.041 -1.457 7.134 1.00 0.00 H new ATOM 0 HA ILE A 496 -6.305 -4.041 6.968 1.00 0.00 H new ATOM 0 HB ILE A 496 -6.147 -1.516 5.438 1.00 0.00 H new ATOM 0 HG12 ILE A 496 -8.282 -3.668 5.694 1.00 0.00 H new ATOM 0 HG13 ILE A 496 -8.114 -2.283 6.755 1.00 0.00 H new ATOM 0 HG21 ILE A 496 -6.794 -2.507 3.286 1.00 0.00 H new ATOM 0 HG22 ILE A 496 -5.143 -2.968 3.766 1.00 0.00 H new ATOM 0 HG23 ILE A 496 -6.480 -4.129 3.945 1.00 0.00 H new ATOM 0 HD11 ILE A 496 -9.866 -1.904 5.090 1.00 0.00 H new ATOM 0 HD12 ILE A 496 -8.523 -0.761 4.855 1.00 0.00 H new ATOM 0 HD13 ILE A 496 -8.693 -2.167 3.778 1.00 0.00 H new ATOM 766 N LEU A 497 -3.441 -3.440 5.459 1.00 0.00 N ATOM 767 CA LEU A 497 -2.299 -4.063 4.802 1.00 0.00 C ATOM 768 C LEU A 497 -1.587 -5.038 5.735 1.00 0.00 C ATOM 769 O LEU A 497 -1.073 -6.066 5.297 1.00 0.00 O ATOM 770 CB LEU A 497 -1.314 -2.991 4.327 1.00 0.00 C ATOM 771 CG LEU A 497 -1.645 -2.345 2.978 1.00 0.00 C ATOM 772 CD1 LEU A 497 -1.890 -3.408 1.918 1.00 0.00 C ATOM 773 CD2 LEU A 497 -2.848 -1.424 3.104 1.00 0.00 C ATOM 0 H LEU A 497 -3.327 -2.443 5.644 1.00 0.00 H new ATOM 0 HA LEU A 497 -2.672 -4.621 3.943 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -1.264 -2.207 5.083 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -0.321 -3.437 4.263 1.00 0.00 H new ATOM 0 HG LEU A 497 -0.789 -1.746 2.668 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -2.123 -2.927 0.968 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -0.996 -4.021 1.804 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -2.726 -4.038 2.221 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -3.066 -0.976 2.135 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -3.712 -1.997 3.441 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -2.630 -0.638 3.827 1.00 0.00 H new ATOM 785 N LYS A 498 -1.551 -4.703 7.022 1.00 0.00 N ATOM 786 CA LYS A 498 -0.888 -5.543 8.017 1.00 0.00 C ATOM 787 C LYS A 498 -1.298 -7.005 7.879 1.00 0.00 C ATOM 788 O LYS A 498 -0.451 -7.889 7.742 1.00 0.00 O ATOM 789 CB LYS A 498 -1.214 -5.050 9.428 1.00 0.00 C ATOM 790 CG LYS A 498 -0.510 -5.833 10.522 1.00 0.00 C ATOM 791 CD LYS A 498 0.969 -5.490 10.589 1.00 0.00 C ATOM 792 CE LYS A 498 1.720 -6.431 11.516 1.00 0.00 C ATOM 793 NZ LYS A 498 2.731 -5.712 12.339 1.00 0.00 N ATOM 0 H LYS A 498 -1.973 -3.855 7.401 1.00 0.00 H new ATOM 0 HA LYS A 498 0.186 -5.472 7.844 1.00 0.00 H new ATOM 0 HB2 LYS A 498 -0.938 -3.999 9.510 1.00 0.00 H new ATOM 0 HB3 LYS A 498 -2.291 -5.110 9.585 1.00 0.00 H new ATOM 0 HG2 LYS A 498 -0.978 -5.619 11.483 1.00 0.00 H new ATOM 0 HG3 LYS A 498 -0.629 -6.901 10.340 1.00 0.00 H new ATOM 0 HD2 LYS A 498 1.401 -5.542 9.589 1.00 0.00 H new ATOM 0 HD3 LYS A 498 1.090 -4.464 10.936 1.00 0.00 H new ATOM 0 HE2 LYS A 498 1.011 -6.936 12.172 1.00 0.00 H new ATOM 0 HE3 LYS A 498 2.215 -7.203 10.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 498 3.664 -6.151 12.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 498 2.772 -4.715 12.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 498 2.464 -5.767 13.343 1.00 0.00 H new ATOM 807 N ARG A 499 -2.599 -7.255 7.924 1.00 0.00 N ATOM 808 CA ARG A 499 -3.122 -8.611 7.813 1.00 0.00 C ATOM 809 C ARG A 499 -3.167 -9.092 6.364 1.00 0.00 C ATOM 810 O ARG A 499 -3.331 -10.286 6.109 1.00 0.00 O ATOM 811 CB ARG A 499 -4.516 -8.695 8.436 1.00 0.00 C ATOM 812 CG ARG A 499 -4.538 -8.383 9.923 1.00 0.00 C ATOM 813 CD ARG A 499 -5.926 -8.577 10.512 1.00 0.00 C ATOM 814 NE ARG A 499 -6.007 -8.097 11.890 1.00 0.00 N ATOM 815 CZ ARG A 499 -7.151 -7.847 12.522 1.00 0.00 C ATOM 816 NH1 ARG A 499 -8.312 -8.030 11.904 1.00 0.00 N ATOM 817 NH2 ARG A 499 -7.136 -7.412 13.774 1.00 0.00 N ATOM 0 H ARG A 499 -3.313 -6.536 8.037 1.00 0.00 H new ATOM 0 HA ARG A 499 -2.441 -9.266 8.357 1.00 0.00 H new ATOM 0 HB2 ARG A 499 -5.179 -8.002 7.918 1.00 0.00 H new ATOM 0 HB3 ARG A 499 -4.916 -9.697 8.278 1.00 0.00 H new ATOM 0 HG2 ARG A 499 -3.828 -9.027 10.442 1.00 0.00 H new ATOM 0 HG3 ARG A 499 -4.213 -7.355 10.085 1.00 0.00 H new ATOM 0 HD2 ARG A 499 -6.657 -8.048 9.900 1.00 0.00 H new ATOM 0 HD3 ARG A 499 -6.189 -9.634 10.480 1.00 0.00 H new ATOM 0 HE ARG A 499 -5.135 -7.945 12.397 1.00 0.00 H new ATOM 0 HH11 ARG A 499 -8.330 -8.364 10.940 1.00 0.00 H new ATOM 0 HH12 ARG A 499 -9.186 -7.837 12.393 1.00 0.00 H new ATOM 0 HH21 ARG A 499 -6.247 -7.269 14.253 1.00 0.00 H new ATOM 0 HH22 ARG A 499 -8.013 -7.221 14.258 1.00 0.00 H new ATOM 831 N LEU A 500 -3.043 -8.165 5.418 1.00 0.00 N ATOM 832 CA LEU A 500 -3.093 -8.507 3.998 1.00 0.00 C ATOM 833 C LEU A 500 -2.244 -9.734 3.679 1.00 0.00 C ATOM 834 O LEU A 500 -2.738 -10.718 3.128 1.00 0.00 O ATOM 835 CB LEU A 500 -2.635 -7.318 3.150 1.00 0.00 C ATOM 836 CG LEU A 500 -2.820 -7.490 1.641 1.00 0.00 C ATOM 837 CD1 LEU A 500 -4.298 -7.531 1.286 1.00 0.00 C ATOM 838 CD2 LEU A 500 -2.120 -6.369 0.889 1.00 0.00 C ATOM 0 H LEU A 500 -2.907 -7.172 5.608 1.00 0.00 H new ATOM 0 HA LEU A 500 -4.128 -8.747 3.755 1.00 0.00 H new ATOM 0 HB2 LEU A 500 -3.183 -6.431 3.469 1.00 0.00 H new ATOM 0 HB3 LEU A 500 -1.580 -7.131 3.353 1.00 0.00 H new ATOM 0 HG LEU A 500 -2.370 -8.437 1.344 1.00 0.00 H new ATOM 0 HD11 LEU A 500 -4.410 -7.654 0.209 1.00 0.00 H new ATOM 0 HD12 LEU A 500 -4.772 -8.368 1.798 1.00 0.00 H new ATOM 0 HD13 LEU A 500 -4.773 -6.600 1.596 1.00 0.00 H new ATOM 0 HD21 LEU A 500 -2.261 -6.506 -0.183 1.00 0.00 H new ATOM 0 HD22 LEU A 500 -2.541 -5.410 1.191 1.00 0.00 H new ATOM 0 HD23 LEU A 500 -1.055 -6.386 1.120 1.00 0.00 H new ATOM 850 N ASN A 501 -0.968 -9.670 4.027 1.00 0.00 N ATOM 851 CA ASN A 501 -0.050 -10.778 3.778 1.00 0.00 C ATOM 852 C ASN A 501 -0.031 -11.159 2.298 1.00 0.00 C ATOM 853 O ASN A 501 -0.186 -12.329 1.945 1.00 0.00 O ATOM 854 CB ASN A 501 -0.444 -11.991 4.625 1.00 0.00 C ATOM 855 CG ASN A 501 0.712 -12.951 4.833 1.00 0.00 C ATOM 856 OD1 ASN A 501 1.775 -12.801 4.230 1.00 0.00 O ATOM 857 ND2 ASN A 501 0.508 -13.945 5.690 1.00 0.00 N ATOM 0 H ASN A 501 -0.542 -8.863 4.483 1.00 0.00 H new ATOM 0 HA ASN A 501 0.952 -10.454 4.059 1.00 0.00 H new ATOM 0 HB2 ASN A 501 -0.809 -11.651 5.594 1.00 0.00 H new ATOM 0 HB3 ASN A 501 -1.267 -12.517 4.141 1.00 0.00 H new ATOM 0 HD21 ASN A 501 1.249 -14.623 5.871 1.00 0.00 H new ATOM 0 HD22 ASN A 501 -0.389 -14.031 6.168 1.00 0.00 H new ATOM 864 N PRO A 502 0.163 -10.171 1.409 1.00 0.00 N ATOM 865 CA PRO A 502 0.206 -10.405 -0.037 1.00 0.00 C ATOM 866 C PRO A 502 1.527 -11.024 -0.481 1.00 0.00 C ATOM 867 O PRO A 502 2.540 -10.907 0.208 1.00 0.00 O ATOM 868 CB PRO A 502 0.052 -9.000 -0.617 1.00 0.00 C ATOM 869 CG PRO A 502 0.650 -8.106 0.414 1.00 0.00 C ATOM 870 CD PRO A 502 0.359 -8.746 1.744 1.00 0.00 C ATOM 0 HA PRO A 502 -0.561 -11.106 -0.366 1.00 0.00 H new ATOM 0 HB2 PRO A 502 0.568 -8.906 -1.572 1.00 0.00 H new ATOM 0 HB3 PRO A 502 -0.995 -8.756 -0.795 1.00 0.00 H new ATOM 0 HG2 PRO A 502 1.724 -7.998 0.260 1.00 0.00 H new ATOM 0 HG3 PRO A 502 0.218 -7.106 0.360 1.00 0.00 H new ATOM 0 HD2 PRO A 502 1.183 -8.609 2.444 1.00 0.00 H new ATOM 0 HD3 PRO A 502 -0.529 -8.318 2.209 1.00 0.00 H new ATOM 878 N GLU A 503 1.512 -11.679 -1.639 1.00 0.00 N ATOM 879 CA GLU A 503 2.714 -12.310 -2.173 1.00 0.00 C ATOM 880 C GLU A 503 3.829 -11.284 -2.349 1.00 0.00 C ATOM 881 O GLU A 503 3.606 -10.200 -2.887 1.00 0.00 O ATOM 882 CB GLU A 503 2.410 -12.986 -3.511 1.00 0.00 C ATOM 883 CG GLU A 503 1.395 -14.112 -3.407 1.00 0.00 C ATOM 884 CD GLU A 503 1.861 -15.237 -2.504 1.00 0.00 C ATOM 885 OE1 GLU A 503 3.079 -15.322 -2.241 1.00 0.00 O ATOM 886 OE2 GLU A 503 1.009 -16.034 -2.059 1.00 0.00 O ATOM 0 H GLU A 503 0.683 -11.786 -2.224 1.00 0.00 H new ATOM 0 HA GLU A 503 3.047 -13.066 -1.462 1.00 0.00 H new ATOM 0 HB2 GLU A 503 2.039 -12.237 -4.211 1.00 0.00 H new ATOM 0 HB3 GLU A 503 3.337 -13.381 -3.928 1.00 0.00 H new ATOM 0 HG2 GLU A 503 0.454 -13.714 -3.028 1.00 0.00 H new ATOM 0 HG3 GLU A 503 1.196 -14.509 -4.402 1.00 0.00 H new ATOM 893 N ARG A 504 5.026 -11.628 -1.885 1.00 0.00 N ATOM 894 CA ARG A 504 6.170 -10.728 -1.987 1.00 0.00 C ATOM 895 C ARG A 504 7.033 -11.068 -3.198 1.00 0.00 C ATOM 896 O ARG A 504 7.856 -11.983 -3.149 1.00 0.00 O ATOM 897 CB ARG A 504 7.011 -10.800 -0.711 1.00 0.00 C ATOM 898 CG ARG A 504 6.229 -10.483 0.553 1.00 0.00 C ATOM 899 CD ARG A 504 7.079 -10.671 1.798 1.00 0.00 C ATOM 900 NE ARG A 504 8.107 -9.640 1.922 1.00 0.00 N ATOM 901 CZ ARG A 504 9.321 -9.727 1.380 1.00 0.00 C ATOM 902 NH1 ARG A 504 9.668 -10.797 0.673 1.00 0.00 N ATOM 903 NH2 ARG A 504 10.192 -8.741 1.544 1.00 0.00 N ATOM 0 H ARG A 504 5.229 -12.521 -1.436 1.00 0.00 H new ATOM 0 HA ARG A 504 5.791 -9.714 -2.113 1.00 0.00 H new ATOM 0 HB2 ARG A 504 7.438 -11.799 -0.623 1.00 0.00 H new ATOM 0 HB3 ARG A 504 7.845 -10.104 -0.796 1.00 0.00 H new ATOM 0 HG2 ARG A 504 5.868 -9.455 0.510 1.00 0.00 H new ATOM 0 HG3 ARG A 504 5.352 -11.127 0.610 1.00 0.00 H new ATOM 0 HD2 ARG A 504 6.439 -10.652 2.680 1.00 0.00 H new ATOM 0 HD3 ARG A 504 7.552 -11.653 1.769 1.00 0.00 H new ATOM 0 HE ARG A 504 7.881 -8.801 2.457 1.00 0.00 H new ATOM 0 HH11 ARG A 504 9.003 -11.559 0.542 1.00 0.00 H new ATOM 0 HH12 ARG A 504 10.599 -10.856 0.261 1.00 0.00 H new ATOM 0 HH21 ARG A 504 9.933 -7.916 2.085 1.00 0.00 H new ATOM 0 HH22 ARG A 504 11.121 -8.807 1.129 1.00 0.00 H new ATOM 917 N LYS A 505 6.842 -10.322 -4.281 1.00 0.00 N ATOM 918 CA LYS A 505 7.607 -10.539 -5.504 1.00 0.00 C ATOM 919 C LYS A 505 8.630 -9.426 -5.709 1.00 0.00 C ATOM 920 O LYS A 505 8.401 -8.280 -5.322 1.00 0.00 O ATOM 921 CB LYS A 505 6.667 -10.610 -6.707 1.00 0.00 C ATOM 922 CG LYS A 505 5.697 -11.777 -6.649 1.00 0.00 C ATOM 923 CD LYS A 505 4.687 -11.718 -7.782 1.00 0.00 C ATOM 924 CE LYS A 505 3.681 -12.855 -7.692 1.00 0.00 C ATOM 925 NZ LYS A 505 3.189 -13.055 -6.301 1.00 0.00 N ATOM 0 H LYS A 505 6.164 -9.562 -4.337 1.00 0.00 H new ATOM 0 HA LYS A 505 8.140 -11.485 -5.409 1.00 0.00 H new ATOM 0 HB2 LYS A 505 6.101 -9.680 -6.772 1.00 0.00 H new ATOM 0 HB3 LYS A 505 7.261 -10.686 -7.618 1.00 0.00 H new ATOM 0 HG2 LYS A 505 6.250 -12.715 -6.702 1.00 0.00 H new ATOM 0 HG3 LYS A 505 5.174 -11.769 -5.693 1.00 0.00 H new ATOM 0 HD2 LYS A 505 4.162 -10.763 -7.753 1.00 0.00 H new ATOM 0 HD3 LYS A 505 5.208 -11.767 -8.738 1.00 0.00 H new ATOM 0 HE2 LYS A 505 2.837 -12.645 -8.349 1.00 0.00 H new ATOM 0 HE3 LYS A 505 4.142 -13.776 -8.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 505 2.181 -13.310 -6.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 505 3.730 -13.819 -5.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 505 3.312 -12.176 -5.759 1.00 0.00 H new ATOM 939 N MET A 506 9.759 -9.771 -6.319 1.00 0.00 N ATOM 940 CA MET A 506 10.816 -8.799 -6.574 1.00 0.00 C ATOM 941 C MET A 506 10.719 -8.249 -7.994 1.00 0.00 C ATOM 942 O MET A 506 10.999 -8.954 -8.964 1.00 0.00 O ATOM 943 CB MET A 506 12.189 -9.439 -6.357 1.00 0.00 C ATOM 944 CG MET A 506 13.345 -8.465 -6.510 1.00 0.00 C ATOM 945 SD MET A 506 13.587 -7.438 -5.048 1.00 0.00 S ATOM 946 CE MET A 506 15.240 -7.926 -4.559 1.00 0.00 C ATOM 0 H MET A 506 9.965 -10.715 -6.646 1.00 0.00 H new ATOM 0 HA MET A 506 10.692 -7.973 -5.874 1.00 0.00 H new ATOM 0 HB2 MET A 506 12.223 -9.876 -5.359 1.00 0.00 H new ATOM 0 HB3 MET A 506 12.316 -10.256 -7.068 1.00 0.00 H new ATOM 0 HG2 MET A 506 14.260 -9.022 -6.713 1.00 0.00 H new ATOM 0 HG3 MET A 506 13.163 -7.824 -7.373 1.00 0.00 H new ATOM 0 HE1 MET A 506 15.533 -7.375 -3.665 1.00 0.00 H new ATOM 0 HE2 MET A 506 15.256 -8.995 -4.347 1.00 0.00 H new ATOM 0 HE3 MET A 506 15.938 -7.705 -5.366 1.00 0.00 H new ATOM 956 N ILE A 507 10.319 -6.987 -8.108 1.00 0.00 N ATOM 957 CA ILE A 507 10.185 -6.342 -9.409 1.00 0.00 C ATOM 958 C ILE A 507 11.056 -5.093 -9.496 1.00 0.00 C ATOM 959 O ILE A 507 10.914 -4.168 -8.696 1.00 0.00 O ATOM 960 CB ILE A 507 8.720 -5.954 -9.695 1.00 0.00 C ATOM 961 CG1 ILE A 507 7.795 -7.147 -9.449 1.00 0.00 C ATOM 962 CG2 ILE A 507 8.575 -5.450 -11.123 1.00 0.00 C ATOM 963 CD1 ILE A 507 8.158 -8.372 -10.260 1.00 0.00 C ATOM 0 H ILE A 507 10.082 -6.391 -7.315 1.00 0.00 H new ATOM 0 HA ILE A 507 10.515 -7.064 -10.156 1.00 0.00 H new ATOM 0 HB ILE A 507 8.434 -5.151 -9.016 1.00 0.00 H new ATOM 0 HG12 ILE A 507 7.819 -7.403 -8.390 1.00 0.00 H new ATOM 0 HG13 ILE A 507 6.771 -6.857 -9.684 1.00 0.00 H new ATOM 0 HG21 ILE A 507 7.536 -5.180 -11.310 1.00 0.00 H new ATOM 0 HG22 ILE A 507 9.209 -4.575 -11.266 1.00 0.00 H new ATOM 0 HG23 ILE A 507 8.877 -6.234 -11.818 1.00 0.00 H new ATOM 0 HD11 ILE A 507 7.460 -9.178 -10.034 1.00 0.00 H new ATOM 0 HD12 ILE A 507 8.106 -8.134 -11.322 1.00 0.00 H new ATOM 0 HD13 ILE A 507 9.170 -8.688 -10.008 1.00 0.00 H new ATOM 975 N ASN A 508 11.956 -5.072 -10.474 1.00 0.00 N ATOM 976 CA ASN A 508 12.850 -3.934 -10.667 1.00 0.00 C ATOM 977 C ASN A 508 13.660 -3.656 -9.405 1.00 0.00 C ATOM 978 O ASN A 508 13.818 -2.505 -8.996 1.00 0.00 O ATOM 979 CB ASN A 508 12.049 -2.691 -11.061 1.00 0.00 C ATOM 980 CG ASN A 508 11.307 -2.871 -12.370 1.00 0.00 C ATOM 981 OD1 ASN A 508 11.641 -3.745 -13.172 1.00 0.00 O ATOM 982 ND2 ASN A 508 10.294 -2.044 -12.595 1.00 0.00 N ATOM 0 H ASN A 508 12.086 -5.829 -11.145 1.00 0.00 H new ATOM 0 HA ASN A 508 13.543 -4.180 -11.472 1.00 0.00 H new ATOM 0 HB2 ASN A 508 11.335 -2.457 -10.271 1.00 0.00 H new ATOM 0 HB3 ASN A 508 12.724 -1.839 -11.143 1.00 0.00 H new ATOM 0 HD21 ASN A 508 9.758 -2.118 -13.460 1.00 0.00 H new ATOM 0 HD22 ASN A 508 10.052 -1.335 -11.903 1.00 0.00 H new ATOM 989 N ASP A 509 14.170 -4.717 -8.789 1.00 0.00 N ATOM 990 CA ASP A 509 14.963 -4.587 -7.572 1.00 0.00 C ATOM 991 C ASP A 509 14.150 -3.927 -6.462 1.00 0.00 C ATOM 992 O ASP A 509 14.701 -3.245 -5.597 1.00 0.00 O ATOM 993 CB ASP A 509 16.228 -3.773 -7.846 1.00 0.00 C ATOM 994 CG ASP A 509 17.182 -3.771 -6.667 1.00 0.00 C ATOM 995 OD1 ASP A 509 17.968 -4.734 -6.537 1.00 0.00 O ATOM 996 OD2 ASP A 509 17.142 -2.808 -5.873 1.00 0.00 O ATOM 0 H ASP A 509 14.048 -5.677 -9.112 1.00 0.00 H new ATOM 0 HA ASP A 509 15.248 -5.587 -7.245 1.00 0.00 H new ATOM 0 HB2 ASP A 509 16.736 -4.180 -8.720 1.00 0.00 H new ATOM 0 HB3 ASP A 509 15.951 -2.747 -8.087 1.00 0.00 H new ATOM 1001 N LYS A 510 12.837 -4.134 -6.493 1.00 0.00 N ATOM 1002 CA LYS A 510 11.948 -3.559 -5.490 1.00 0.00 C ATOM 1003 C LYS A 510 10.945 -4.596 -4.996 1.00 0.00 C ATOM 1004 O LYS A 510 10.552 -5.497 -5.737 1.00 0.00 O ATOM 1005 CB LYS A 510 11.208 -2.351 -6.066 1.00 0.00 C ATOM 1006 CG LYS A 510 12.110 -1.163 -6.352 1.00 0.00 C ATOM 1007 CD LYS A 510 11.317 0.033 -6.849 1.00 0.00 C ATOM 1008 CE LYS A 510 12.228 1.190 -7.225 1.00 0.00 C ATOM 1009 NZ LYS A 510 12.516 1.219 -8.686 1.00 0.00 N ATOM 0 H LYS A 510 12.365 -4.696 -7.202 1.00 0.00 H new ATOM 0 HA LYS A 510 12.555 -3.234 -4.645 1.00 0.00 H new ATOM 0 HB2 LYS A 510 10.709 -2.648 -6.989 1.00 0.00 H new ATOM 0 HB3 LYS A 510 10.430 -2.045 -5.367 1.00 0.00 H new ATOM 0 HG2 LYS A 510 12.652 -0.890 -5.446 1.00 0.00 H new ATOM 0 HG3 LYS A 510 12.855 -1.442 -7.097 1.00 0.00 H new ATOM 0 HD2 LYS A 510 10.722 -0.258 -7.714 1.00 0.00 H new ATOM 0 HD3 LYS A 510 10.619 0.355 -6.076 1.00 0.00 H new ATOM 0 HE2 LYS A 510 11.762 2.130 -6.928 1.00 0.00 H new ATOM 0 HE3 LYS A 510 13.164 1.109 -6.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 510 13.140 2.023 -8.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 510 12.984 0.333 -8.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 510 11.626 1.322 -9.213 1.00 0.00 H new ATOM 1023 N MET A 511 10.533 -4.463 -3.740 1.00 0.00 N ATOM 1024 CA MET A 511 9.575 -5.388 -3.148 1.00 0.00 C ATOM 1025 C MET A 511 8.152 -5.046 -3.581 1.00 0.00 C ATOM 1026 O MET A 511 7.613 -4.005 -3.210 1.00 0.00 O ATOM 1027 CB MET A 511 9.677 -5.356 -1.622 1.00 0.00 C ATOM 1028 CG MET A 511 11.003 -5.877 -1.091 1.00 0.00 C ATOM 1029 SD MET A 511 11.059 -5.923 0.711 1.00 0.00 S ATOM 1030 CE MET A 511 12.739 -6.482 0.983 1.00 0.00 C ATOM 0 H MET A 511 10.848 -3.723 -3.112 1.00 0.00 H new ATOM 0 HA MET A 511 9.813 -6.392 -3.499 1.00 0.00 H new ATOM 0 HB2 MET A 511 9.534 -4.332 -1.278 1.00 0.00 H new ATOM 0 HB3 MET A 511 8.867 -5.950 -1.199 1.00 0.00 H new ATOM 0 HG2 MET A 511 11.178 -6.879 -1.482 1.00 0.00 H new ATOM 0 HG3 MET A 511 11.811 -5.245 -1.460 1.00 0.00 H new ATOM 0 HE1 MET A 511 12.927 -6.561 2.054 1.00 0.00 H new ATOM 0 HE2 MET A 511 12.878 -7.458 0.518 1.00 0.00 H new ATOM 0 HE3 MET A 511 13.436 -5.768 0.543 1.00 0.00 H new ATOM 1040 N HIS A 512 7.552 -5.932 -4.369 1.00 0.00 N ATOM 1041 CA HIS A 512 6.192 -5.726 -4.855 1.00 0.00 C ATOM 1042 C HIS A 512 5.229 -6.718 -4.213 1.00 0.00 C ATOM 1043 O HIS A 512 5.586 -7.869 -3.957 1.00 0.00 O ATOM 1044 CB HIS A 512 6.145 -5.867 -6.377 1.00 0.00 C ATOM 1045 CG HIS A 512 6.676 -4.671 -7.106 1.00 0.00 C ATOM 1046 ND1 HIS A 512 7.796 -3.977 -6.700 1.00 0.00 N ATOM 1047 CD2 HIS A 512 6.233 -4.048 -8.224 1.00 0.00 C ATOM 1048 CE1 HIS A 512 8.018 -2.978 -7.537 1.00 0.00 C ATOM 1049 NE2 HIS A 512 7.085 -2.999 -8.470 1.00 0.00 N ATOM 0 H HIS A 512 7.986 -6.799 -4.685 1.00 0.00 H new ATOM 0 HA HIS A 512 5.884 -4.717 -4.580 1.00 0.00 H new ATOM 0 HB2 HIS A 512 6.720 -6.746 -6.670 1.00 0.00 H new ATOM 0 HB3 HIS A 512 5.114 -6.042 -6.686 1.00 0.00 H new ATOM 0 HD2 HIS A 512 5.371 -4.324 -8.812 1.00 0.00 H new ATOM 0 HE1 HIS A 512 8.826 -2.265 -7.469 1.00 0.00 H new ATOM 0 HE2 HIS A 512 7.009 -2.343 -9.247 1.00 0.00 H new ATOM 1058 N PHE A 513 4.006 -6.266 -3.955 1.00 0.00 N ATOM 1059 CA PHE A 513 2.990 -7.116 -3.345 1.00 0.00 C ATOM 1060 C PHE A 513 1.950 -7.541 -4.376 1.00 0.00 C ATOM 1061 O PHE A 513 1.500 -6.732 -5.188 1.00 0.00 O ATOM 1062 CB PHE A 513 2.307 -6.384 -2.189 1.00 0.00 C ATOM 1063 CG PHE A 513 3.260 -5.901 -1.132 1.00 0.00 C ATOM 1064 CD1 PHE A 513 3.811 -6.785 -0.219 1.00 0.00 C ATOM 1065 CD2 PHE A 513 3.600 -4.560 -1.051 1.00 0.00 C ATOM 1066 CE1 PHE A 513 4.683 -6.342 0.758 1.00 0.00 C ATOM 1067 CE2 PHE A 513 4.472 -4.111 -0.079 1.00 0.00 C ATOM 1068 CZ PHE A 513 5.015 -5.002 0.826 1.00 0.00 C ATOM 0 H PHE A 513 3.695 -5.316 -4.159 1.00 0.00 H new ATOM 0 HA PHE A 513 3.483 -8.009 -2.959 1.00 0.00 H new ATOM 0 HB2 PHE A 513 1.756 -5.531 -2.586 1.00 0.00 H new ATOM 0 HB3 PHE A 513 1.576 -7.050 -1.730 1.00 0.00 H new ATOM 0 HD1 PHE A 513 3.556 -7.833 -0.271 1.00 0.00 H new ATOM 0 HD2 PHE A 513 3.178 -3.859 -1.756 1.00 0.00 H new ATOM 0 HE1 PHE A 513 5.104 -7.041 1.466 1.00 0.00 H new ATOM 0 HE2 PHE A 513 4.729 -3.063 -0.026 1.00 0.00 H new ATOM 0 HZ PHE A 513 5.698 -4.652 1.586 1.00 0.00 H new ATOM 1078 N SER A 514 1.570 -8.814 -4.339 1.00 0.00 N ATOM 1079 CA SER A 514 0.581 -9.341 -5.272 1.00 0.00 C ATOM 1080 C SER A 514 -0.330 -10.355 -4.587 1.00 0.00 C ATOM 1081 O SER A 514 0.121 -11.152 -3.762 1.00 0.00 O ATOM 1082 CB SER A 514 1.276 -9.991 -6.470 1.00 0.00 C ATOM 1083 OG SER A 514 0.351 -10.268 -7.508 1.00 0.00 O ATOM 0 H SER A 514 1.931 -9.498 -3.674 1.00 0.00 H new ATOM 0 HA SER A 514 -0.031 -8.509 -5.621 1.00 0.00 H new ATOM 0 HB2 SER A 514 2.059 -9.330 -6.843 1.00 0.00 H new ATOM 0 HB3 SER A 514 1.762 -10.915 -6.155 1.00 0.00 H new ATOM 0 HG SER A 514 0.820 -10.681 -8.263 1.00 0.00 H new ATOM 1089 N LEU A 515 -1.611 -10.322 -4.934 1.00 0.00 N ATOM 1090 CA LEU A 515 -2.586 -11.238 -4.354 1.00 0.00 C ATOM 1091 C LEU A 515 -3.288 -12.047 -5.438 1.00 0.00 C ATOM 1092 O LEU A 515 -3.660 -11.512 -6.483 1.00 0.00 O ATOM 1093 CB LEU A 515 -3.618 -10.464 -3.530 1.00 0.00 C ATOM 1094 CG LEU A 515 -3.197 -10.148 -2.095 1.00 0.00 C ATOM 1095 CD1 LEU A 515 -4.112 -9.096 -1.490 1.00 0.00 C ATOM 1096 CD2 LEU A 515 -3.201 -11.412 -1.249 1.00 0.00 C ATOM 0 H LEU A 515 -1.999 -9.670 -5.615 1.00 0.00 H new ATOM 0 HA LEU A 515 -2.052 -11.928 -3.701 1.00 0.00 H new ATOM 0 HB2 LEU A 515 -3.840 -9.527 -4.042 1.00 0.00 H new ATOM 0 HB3 LEU A 515 -4.543 -11.039 -3.502 1.00 0.00 H new ATOM 0 HG LEU A 515 -2.183 -9.750 -2.113 1.00 0.00 H new ATOM 0 HD11 LEU A 515 -3.797 -8.884 -0.468 1.00 0.00 H new ATOM 0 HD12 LEU A 515 -4.059 -8.183 -2.083 1.00 0.00 H new ATOM 0 HD13 LEU A 515 -5.137 -9.466 -1.484 1.00 0.00 H new ATOM 0 HD21 LEU A 515 -2.899 -11.169 -0.230 1.00 0.00 H new ATOM 0 HD22 LEU A 515 -4.204 -11.839 -1.238 1.00 0.00 H new ATOM 0 HD23 LEU A 515 -2.503 -12.135 -1.672 1.00 0.00 H new ATOM 1108 N LYS A 516 -3.468 -13.338 -5.183 1.00 0.00 N ATOM 1109 CA LYS A 516 -4.128 -14.222 -6.138 1.00 0.00 C ATOM 1110 C LYS A 516 -5.393 -14.824 -5.535 1.00 0.00 C ATOM 1111 O LYS A 516 -5.340 -15.840 -4.842 1.00 0.00 O ATOM 1112 CB LYS A 516 -3.176 -15.338 -6.574 1.00 0.00 C ATOM 1113 CG LYS A 516 -1.972 -14.840 -7.357 1.00 0.00 C ATOM 1114 CD LYS A 516 -1.127 -15.993 -7.872 1.00 0.00 C ATOM 1115 CE LYS A 516 0.123 -15.494 -8.579 1.00 0.00 C ATOM 1116 NZ LYS A 516 1.041 -16.610 -8.937 1.00 0.00 N ATOM 0 H LYS A 516 -3.166 -13.796 -4.323 1.00 0.00 H new ATOM 0 HA LYS A 516 -4.407 -13.631 -7.010 1.00 0.00 H new ATOM 0 HB2 LYS A 516 -2.828 -15.873 -5.690 1.00 0.00 H new ATOM 0 HB3 LYS A 516 -3.725 -16.054 -7.185 1.00 0.00 H new ATOM 0 HG2 LYS A 516 -2.309 -14.231 -8.196 1.00 0.00 H new ATOM 0 HG3 LYS A 516 -1.363 -14.197 -6.721 1.00 0.00 H new ATOM 0 HD2 LYS A 516 -0.843 -16.638 -7.040 1.00 0.00 H new ATOM 0 HD3 LYS A 516 -1.717 -16.600 -8.559 1.00 0.00 H new ATOM 0 HE2 LYS A 516 -0.162 -14.954 -9.482 1.00 0.00 H new ATOM 0 HE3 LYS A 516 0.646 -14.786 -7.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 1.881 -16.228 -9.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 1.333 -17.110 -8.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 0.551 -17.273 -9.571 1.00 0.00 H new ATOM 1130 N GLU A 517 -6.530 -14.189 -5.803 1.00 0.00 N ATOM 1131 CA GLU A 517 -7.809 -14.661 -5.286 1.00 0.00 C ATOM 1132 C GLU A 517 -8.111 -16.070 -5.786 1.00 0.00 C ATOM 1133 O GLU A 517 -9.134 -16.643 -5.355 1.00 0.00 O ATOM 1134 CB GLU A 517 -8.932 -13.708 -5.699 1.00 0.00 C ATOM 1135 CG GLU A 517 -9.159 -13.649 -7.202 1.00 0.00 C ATOM 1136 CD GLU A 517 -10.190 -12.610 -7.597 1.00 0.00 C ATOM 1137 OE1 GLU A 517 -10.871 -12.074 -6.697 1.00 0.00 O ATOM 1138 OE2 GLU A 517 -10.318 -12.332 -8.808 1.00 0.00 O ATOM 1139 OXT GLU A 517 -7.323 -16.589 -6.605 1.00 0.00 O ATOM 0 H GLU A 517 -6.591 -13.347 -6.375 1.00 0.00 H new ATOM 0 HA GLU A 517 -7.746 -14.687 -4.198 1.00 0.00 H new ATOM 0 HB2 GLU A 517 -9.857 -14.017 -5.212 1.00 0.00 H new ATOM 0 HB3 GLU A 517 -8.700 -12.707 -5.336 1.00 0.00 H new ATOM 0 HG2 GLU A 517 -8.215 -13.426 -7.700 1.00 0.00 H new ATOM 0 HG3 GLU A 517 -9.482 -14.628 -7.555 1.00 0.00 H new TER 1146 GLU A 517 ATOM 1147 N GLY B 941 8.032 20.195 -5.826 1.00 0.00 N ATOM 1148 CA GLY B 941 9.187 20.711 -5.040 1.00 0.00 C ATOM 1149 C GLY B 941 10.070 19.598 -4.510 1.00 0.00 C ATOM 1150 O GLY B 941 10.716 18.888 -5.280 1.00 0.00 O ATOM 0 HA2 GLY B 941 9.782 21.375 -5.667 1.00 0.00 H new ATOM 0 HA3 GLY B 941 8.818 21.307 -4.205 1.00 0.00 H new ATOM 1154 N SER B 942 10.099 19.447 -3.189 1.00 0.00 N ATOM 1155 CA SER B 942 10.909 18.414 -2.555 1.00 0.00 C ATOM 1156 C SER B 942 10.038 17.463 -1.740 1.00 0.00 C ATOM 1157 O SER B 942 9.026 17.868 -1.168 1.00 0.00 O ATOM 1158 CB SER B 942 11.971 19.049 -1.656 1.00 0.00 C ATOM 1159 OG SER B 942 12.807 19.925 -2.393 1.00 0.00 O ATOM 0 H SER B 942 9.571 20.027 -2.538 1.00 0.00 H new ATOM 0 HA SER B 942 11.403 17.842 -3.340 1.00 0.00 H new ATOM 0 HB2 SER B 942 11.487 19.598 -0.848 1.00 0.00 H new ATOM 0 HB3 SER B 942 12.575 18.268 -1.194 1.00 0.00 H new ATOM 0 HG SER B 942 13.476 20.319 -1.795 1.00 0.00 H new ATOM 1165 N SER B 943 10.439 16.197 -1.689 1.00 0.00 N ATOM 1166 CA SER B 943 9.695 15.188 -0.943 1.00 0.00 C ATOM 1167 C SER B 943 10.574 14.542 0.124 1.00 0.00 C ATOM 1168 O SER B 943 11.780 14.387 -0.063 1.00 0.00 O ATOM 1169 CB SER B 943 9.156 14.116 -1.892 1.00 0.00 C ATOM 1170 OG SER B 943 8.323 14.688 -2.887 1.00 0.00 O ATOM 0 H SER B 943 11.275 15.845 -2.155 1.00 0.00 H new ATOM 0 HA SER B 943 8.858 15.681 -0.449 1.00 0.00 H new ATOM 0 HB2 SER B 943 9.987 13.594 -2.365 1.00 0.00 H new ATOM 0 HB3 SER B 943 8.594 13.373 -1.325 1.00 0.00 H new ATOM 0 HG SER B 943 7.993 13.983 -3.482 1.00 0.00 H new ATOM 1176 N SER B 944 9.960 14.170 1.242 1.00 0.00 N ATOM 1177 CA SER B 944 10.687 13.541 2.339 1.00 0.00 C ATOM 1178 C SER B 944 9.734 12.785 3.260 1.00 0.00 C ATOM 1179 O SER B 944 9.877 11.579 3.463 1.00 0.00 O ATOM 1180 CB SER B 944 11.459 14.595 3.137 1.00 0.00 C ATOM 1181 OG SER B 944 10.925 15.891 2.924 1.00 0.00 O ATOM 0 H SER B 944 8.962 14.293 1.412 1.00 0.00 H new ATOM 0 HA SER B 944 11.393 12.828 1.913 1.00 0.00 H new ATOM 0 HB2 SER B 944 11.419 14.352 4.199 1.00 0.00 H new ATOM 0 HB3 SER B 944 12.509 14.579 2.845 1.00 0.00 H new ATOM 0 HG SER B 944 11.435 16.545 3.446 1.00 0.00 H new ATOM 1187 N GLU B 945 8.761 13.501 3.814 1.00 0.00 N ATOM 1188 CA GLU B 945 7.785 12.897 4.713 1.00 0.00 C ATOM 1189 C GLU B 945 6.999 11.797 4.005 1.00 0.00 C ATOM 1190 O GLU B 945 6.641 10.788 4.611 1.00 0.00 O ATOM 1191 CB GLU B 945 6.825 13.962 5.248 1.00 0.00 C ATOM 1192 CG GLU B 945 5.843 13.433 6.281 1.00 0.00 C ATOM 1193 CD GLU B 945 6.517 13.059 7.586 1.00 0.00 C ATOM 1194 OE1 GLU B 945 7.599 13.610 7.875 1.00 0.00 O ATOM 1195 OE2 GLU B 945 5.964 12.211 8.319 1.00 0.00 O ATOM 0 H GLU B 945 8.628 14.500 3.656 1.00 0.00 H new ATOM 0 HA GLU B 945 8.325 12.452 5.548 1.00 0.00 H new ATOM 0 HB2 GLU B 945 7.405 14.772 5.691 1.00 0.00 H new ATOM 0 HB3 GLU B 945 6.268 14.388 4.414 1.00 0.00 H new ATOM 0 HG2 GLU B 945 5.081 14.188 6.473 1.00 0.00 H new ATOM 0 HG3 GLU B 945 5.331 12.560 5.877 1.00 0.00 H new ATOM 1202 N ALA B 946 6.735 12.001 2.719 1.00 0.00 N ATOM 1203 CA ALA B 946 5.992 11.027 1.929 1.00 0.00 C ATOM 1204 C ALA B 946 6.741 9.701 1.844 1.00 0.00 C ATOM 1205 O ALA B 946 6.136 8.631 1.898 1.00 0.00 O ATOM 1206 CB ALA B 946 5.723 11.573 0.535 1.00 0.00 C ATOM 0 H ALA B 946 7.024 12.831 2.202 1.00 0.00 H new ATOM 0 HA ALA B 946 5.039 10.845 2.426 1.00 0.00 H new ATOM 0 HB1 ALA B 946 5.167 10.835 -0.044 1.00 0.00 H new ATOM 0 HB2 ALA B 946 5.139 12.490 0.610 1.00 0.00 H new ATOM 0 HB3 ALA B 946 6.670 11.786 0.039 1.00 0.00 H new ATOM 1212 N ASP B 947 8.061 9.782 1.710 1.00 0.00 N ATOM 1213 CA ASP B 947 8.892 8.587 1.617 1.00 0.00 C ATOM 1214 C ASP B 947 8.756 7.729 2.870 1.00 0.00 C ATOM 1215 O ASP B 947 8.709 6.502 2.793 1.00 0.00 O ATOM 1216 CB ASP B 947 10.358 8.977 1.409 1.00 0.00 C ATOM 1217 CG ASP B 947 10.596 9.646 0.070 1.00 0.00 C ATOM 1218 OD1 ASP B 947 9.716 9.539 -0.812 1.00 0.00 O ATOM 1219 OD2 ASP B 947 11.660 10.277 -0.098 1.00 0.00 O ATOM 0 H ASP B 947 8.577 10.661 1.663 1.00 0.00 H new ATOM 0 HA ASP B 947 8.551 8.004 0.762 1.00 0.00 H new ATOM 0 HB2 ASP B 947 10.668 9.650 2.208 1.00 0.00 H new ATOM 0 HB3 ASP B 947 10.982 8.086 1.482 1.00 0.00 H new ATOM 1224 N GLU B 948 8.692 8.384 4.025 1.00 0.00 N ATOM 1225 CA GLU B 948 8.561 7.681 5.296 1.00 0.00 C ATOM 1226 C GLU B 948 7.245 6.912 5.361 1.00 0.00 C ATOM 1227 O GLU B 948 7.186 5.808 5.902 1.00 0.00 O ATOM 1228 CB GLU B 948 8.644 8.670 6.461 1.00 0.00 C ATOM 1229 CG GLU B 948 8.664 8.001 7.826 1.00 0.00 C ATOM 1230 CD GLU B 948 8.647 9.000 8.968 1.00 0.00 C ATOM 1231 OE1 GLU B 948 8.576 10.218 8.693 1.00 0.00 O ATOM 1232 OE2 GLU B 948 8.704 8.566 10.137 1.00 0.00 O ATOM 0 H GLU B 948 8.729 9.400 4.107 1.00 0.00 H new ATOM 0 HA GLU B 948 9.382 6.968 5.373 1.00 0.00 H new ATOM 0 HB2 GLU B 948 9.543 9.276 6.349 1.00 0.00 H new ATOM 0 HB3 GLU B 948 7.793 9.350 6.411 1.00 0.00 H new ATOM 0 HG2 GLU B 948 7.802 7.339 7.915 1.00 0.00 H new ATOM 0 HG3 GLU B 948 9.554 7.377 7.907 1.00 0.00 H new ATOM 1239 N MET B 949 6.193 7.503 4.804 1.00 0.00 N ATOM 1240 CA MET B 949 4.877 6.872 4.799 1.00 0.00 C ATOM 1241 C MET B 949 4.911 5.544 4.049 1.00 0.00 C ATOM 1242 O MET B 949 4.263 4.577 4.449 1.00 0.00 O ATOM 1243 CB MET B 949 3.844 7.804 4.162 1.00 0.00 C ATOM 1244 CG MET B 949 3.562 9.052 4.982 1.00 0.00 C ATOM 1245 SD MET B 949 2.083 9.926 4.433 1.00 0.00 S ATOM 1246 CE MET B 949 2.546 10.363 2.759 1.00 0.00 C ATOM 0 H MET B 949 6.225 8.416 4.351 1.00 0.00 H new ATOM 0 HA MET B 949 4.592 6.677 5.833 1.00 0.00 H new ATOM 0 HB2 MET B 949 4.195 8.101 3.174 1.00 0.00 H new ATOM 0 HB3 MET B 949 2.913 7.256 4.018 1.00 0.00 H new ATOM 0 HG2 MET B 949 3.447 8.775 6.030 1.00 0.00 H new ATOM 0 HG3 MET B 949 4.419 9.723 4.922 1.00 0.00 H new ATOM 0 HE1 MET B 949 1.679 10.268 2.105 1.00 0.00 H new ATOM 0 HE2 MET B 949 2.906 11.392 2.738 1.00 0.00 H new ATOM 0 HE3 MET B 949 3.335 9.695 2.414 1.00 0.00 H new ATOM 1256 N ALA B 950 5.672 5.504 2.960 1.00 0.00 N ATOM 1257 CA ALA B 950 5.791 4.295 2.154 1.00 0.00 C ATOM 1258 C ALA B 950 6.690 3.267 2.833 1.00 0.00 C ATOM 1259 O ALA B 950 6.351 2.086 2.910 1.00 0.00 O ATOM 1260 CB ALA B 950 6.325 4.635 0.771 1.00 0.00 C ATOM 0 H ALA B 950 6.216 6.295 2.616 1.00 0.00 H new ATOM 0 HA ALA B 950 4.798 3.857 2.051 1.00 0.00 H new ATOM 0 HB1 ALA B 950 6.409 3.723 0.179 1.00 0.00 H new ATOM 0 HB2 ALA B 950 5.642 5.326 0.277 1.00 0.00 H new ATOM 0 HB3 ALA B 950 7.307 5.099 0.864 1.00 0.00 H new ATOM 1266 N LYS B 951 7.839 3.724 3.321 1.00 0.00 N ATOM 1267 CA LYS B 951 8.788 2.843 3.991 1.00 0.00 C ATOM 1268 C LYS B 951 8.154 2.180 5.210 1.00 0.00 C ATOM 1269 O LYS B 951 8.426 1.016 5.507 1.00 0.00 O ATOM 1270 CB LYS B 951 10.031 3.629 4.414 1.00 0.00 C ATOM 1271 CG LYS B 951 11.127 2.762 5.012 1.00 0.00 C ATOM 1272 CD LYS B 951 12.311 3.598 5.469 1.00 0.00 C ATOM 1273 CE LYS B 951 13.467 2.722 5.925 1.00 0.00 C ATOM 1274 NZ LYS B 951 13.039 1.720 6.940 1.00 0.00 N ATOM 0 H LYS B 951 8.135 4.699 3.265 1.00 0.00 H new ATOM 0 HA LYS B 951 9.078 2.063 3.288 1.00 0.00 H new ATOM 0 HB2 LYS B 951 10.429 4.156 3.547 1.00 0.00 H new ATOM 0 HB3 LYS B 951 9.741 4.386 5.142 1.00 0.00 H new ATOM 0 HG2 LYS B 951 10.728 2.201 5.857 1.00 0.00 H new ATOM 0 HG3 LYS B 951 11.459 2.032 4.273 1.00 0.00 H new ATOM 0 HD2 LYS B 951 12.640 4.241 4.653 1.00 0.00 H new ATOM 0 HD3 LYS B 951 12.003 4.251 6.286 1.00 0.00 H new ATOM 0 HE2 LYS B 951 13.894 2.207 5.064 1.00 0.00 H new ATOM 0 HE3 LYS B 951 14.254 3.349 6.344 1.00 0.00 H new ATOM 0 HZ1 LYS B 951 13.878 1.271 7.360 1.00 0.00 H new ATOM 0 HZ2 LYS B 951 12.490 2.194 7.685 1.00 0.00 H new ATOM 0 HZ3 LYS B 951 12.450 0.994 6.484 1.00 0.00 H new ATOM 1288 N ALA B 952 7.308 2.926 5.911 1.00 0.00 N ATOM 1289 CA ALA B 952 6.637 2.410 7.098 1.00 0.00 C ATOM 1290 C ALA B 952 5.737 1.229 6.753 1.00 0.00 C ATOM 1291 O ALA B 952 5.789 0.185 7.404 1.00 0.00 O ATOM 1292 CB ALA B 952 5.830 3.512 7.768 1.00 0.00 C ATOM 0 H ALA B 952 7.070 3.890 5.678 1.00 0.00 H new ATOM 0 HA ALA B 952 7.401 2.059 7.792 1.00 0.00 H new ATOM 0 HB1 ALA B 952 5.334 3.113 8.653 1.00 0.00 H new ATOM 0 HB2 ALA B 952 6.496 4.324 8.060 1.00 0.00 H new ATOM 0 HB3 ALA B 952 5.081 3.889 7.072 1.00 0.00 H new ATOM 1298 N LEU B 953 4.910 1.400 5.727 1.00 0.00 N ATOM 1299 CA LEU B 953 3.996 0.348 5.297 1.00 0.00 C ATOM 1300 C LEU B 953 4.758 -0.826 4.691 1.00 0.00 C ATOM 1301 O LEU B 953 4.363 -1.982 4.845 1.00 0.00 O ATOM 1302 CB LEU B 953 2.992 0.899 4.281 1.00 0.00 C ATOM 1303 CG LEU B 953 1.761 0.022 4.047 1.00 0.00 C ATOM 1304 CD1 LEU B 953 0.637 0.417 4.991 1.00 0.00 C ATOM 1305 CD2 LEU B 953 1.304 0.120 2.600 1.00 0.00 C ATOM 0 H LEU B 953 4.854 2.258 5.178 1.00 0.00 H new ATOM 0 HA LEU B 953 3.457 -0.009 6.175 1.00 0.00 H new ATOM 0 HB2 LEU B 953 2.661 1.882 4.617 1.00 0.00 H new ATOM 0 HB3 LEU B 953 3.503 1.043 3.329 1.00 0.00 H new ATOM 0 HG LEU B 953 2.032 -1.014 4.252 1.00 0.00 H new ATOM 0 HD11 LEU B 953 -0.230 -0.218 4.810 1.00 0.00 H new ATOM 0 HD12 LEU B 953 0.968 0.294 6.022 1.00 0.00 H new ATOM 0 HD13 LEU B 953 0.366 1.459 4.819 1.00 0.00 H new ATOM 0 HD21 LEU B 953 0.427 -0.510 2.452 1.00 0.00 H new ATOM 0 HD22 LEU B 953 1.051 1.154 2.368 1.00 0.00 H new ATOM 0 HD23 LEU B 953 2.106 -0.214 1.942 1.00 0.00 H new ATOM 1317 N GLU B 954 5.851 -0.523 3.996 1.00 0.00 N ATOM 1318 CA GLU B 954 6.667 -1.554 3.363 1.00 0.00 C ATOM 1319 C GLU B 954 7.165 -2.568 4.388 1.00 0.00 C ATOM 1320 O GLU B 954 6.944 -3.771 4.245 1.00 0.00 O ATOM 1321 CB GLU B 954 7.856 -0.919 2.639 1.00 0.00 C ATOM 1322 CG GLU B 954 8.686 -1.914 1.844 1.00 0.00 C ATOM 1323 CD GLU B 954 9.914 -1.283 1.216 1.00 0.00 C ATOM 1324 OE1 GLU B 954 10.130 -0.069 1.421 1.00 0.00 O ATOM 1325 OE2 GLU B 954 10.659 -2.002 0.518 1.00 0.00 O ATOM 0 H GLU B 954 6.192 0.428 3.857 1.00 0.00 H new ATOM 0 HA GLU B 954 6.043 -2.077 2.638 1.00 0.00 H new ATOM 0 HB2 GLU B 954 7.489 -0.144 1.966 1.00 0.00 H new ATOM 0 HB3 GLU B 954 8.496 -0.427 3.371 1.00 0.00 H new ATOM 0 HG2 GLU B 954 8.996 -2.728 2.499 1.00 0.00 H new ATOM 0 HG3 GLU B 954 8.068 -2.353 1.061 1.00 0.00 H new ATOM 1332 N ALA B 955 7.839 -2.075 5.421 1.00 0.00 N ATOM 1333 CA ALA B 955 8.368 -2.938 6.470 1.00 0.00 C ATOM 1334 C ALA B 955 7.253 -3.483 7.357 1.00 0.00 C ATOM 1335 O ALA B 955 7.413 -4.515 8.008 1.00 0.00 O ATOM 1336 CB ALA B 955 9.388 -2.182 7.309 1.00 0.00 C ATOM 0 H ALA B 955 8.032 -1.082 5.554 1.00 0.00 H new ATOM 0 HA ALA B 955 8.859 -3.785 5.991 1.00 0.00 H new ATOM 0 HB1 ALA B 955 9.775 -2.838 8.089 1.00 0.00 H new ATOM 0 HB2 ALA B 955 10.209 -1.851 6.673 1.00 0.00 H new ATOM 0 HB3 ALA B 955 8.912 -1.315 7.767 1.00 0.00 H new ATOM 1342 N GLU B 956 6.122 -2.781 7.382 1.00 0.00 N ATOM 1343 CA GLU B 956 4.982 -3.193 8.194 1.00 0.00 C ATOM 1344 C GLU B 956 4.543 -4.613 7.849 1.00 0.00 C ATOM 1345 O GLU B 956 4.178 -5.390 8.731 1.00 0.00 O ATOM 1346 CB GLU B 956 3.815 -2.225 7.997 1.00 0.00 C ATOM 1347 CG GLU B 956 2.655 -2.469 8.948 1.00 0.00 C ATOM 1348 CD GLU B 956 2.991 -2.107 10.382 1.00 0.00 C ATOM 1349 OE1 GLU B 956 3.891 -1.265 10.586 1.00 0.00 O ATOM 1350 OE2 GLU B 956 2.355 -2.665 11.300 1.00 0.00 O ATOM 0 H GLU B 956 5.972 -1.924 6.849 1.00 0.00 H new ATOM 0 HA GLU B 956 5.291 -3.176 9.239 1.00 0.00 H new ATOM 0 HB2 GLU B 956 4.174 -1.204 8.130 1.00 0.00 H new ATOM 0 HB3 GLU B 956 3.456 -2.306 6.971 1.00 0.00 H new ATOM 0 HG2 GLU B 956 1.794 -1.886 8.622 1.00 0.00 H new ATOM 0 HG3 GLU B 956 2.365 -3.519 8.900 1.00 0.00 H new ATOM 1357 N LEU B 957 4.575 -4.948 6.562 1.00 0.00 N ATOM 1358 CA LEU B 957 4.174 -6.276 6.110 1.00 0.00 C ATOM 1359 C LEU B 957 5.354 -7.245 6.114 1.00 0.00 C ATOM 1360 O LEU B 957 5.176 -8.451 5.941 1.00 0.00 O ATOM 1361 CB LEU B 957 3.561 -6.205 4.705 1.00 0.00 C ATOM 1362 CG LEU B 957 2.218 -5.462 4.586 1.00 0.00 C ATOM 1363 CD1 LEU B 957 1.232 -6.275 3.760 1.00 0.00 C ATOM 1364 CD2 LEU B 957 1.624 -5.150 5.954 1.00 0.00 C ATOM 0 H LEU B 957 4.874 -4.320 5.816 1.00 0.00 H new ATOM 0 HA LEU B 957 3.424 -6.648 6.808 1.00 0.00 H new ATOM 0 HB2 LEU B 957 4.279 -5.723 4.042 1.00 0.00 H new ATOM 0 HB3 LEU B 957 3.423 -7.223 4.340 1.00 0.00 H new ATOM 0 HG LEU B 957 2.411 -4.515 4.082 1.00 0.00 H new ATOM 0 HD11 LEU B 957 0.288 -5.735 3.686 1.00 0.00 H new ATOM 0 HD12 LEU B 957 1.638 -6.434 2.761 1.00 0.00 H new ATOM 0 HD13 LEU B 957 1.062 -7.239 4.241 1.00 0.00 H new ATOM 0 HD21 LEU B 957 0.677 -4.625 5.828 1.00 0.00 H new ATOM 0 HD22 LEU B 957 1.455 -6.079 6.498 1.00 0.00 H new ATOM 0 HD23 LEU B 957 2.315 -4.522 6.516 1.00 0.00 H new ATOM 1376 N ASN B 958 6.561 -6.717 6.310 1.00 0.00 N ATOM 1377 CA ASN B 958 7.763 -7.544 6.335 1.00 0.00 C ATOM 1378 C ASN B 958 7.625 -8.676 7.350 1.00 0.00 C ATOM 1379 O ASN B 958 8.169 -9.764 7.159 1.00 0.00 O ATOM 1380 CB ASN B 958 8.988 -6.691 6.669 1.00 0.00 C ATOM 1381 CG ASN B 958 10.286 -7.461 6.523 1.00 0.00 C ATOM 1382 OD1 ASN B 958 10.872 -7.906 7.510 1.00 0.00 O ATOM 1383 ND2 ASN B 958 10.744 -7.621 5.287 1.00 0.00 N ATOM 0 H ASN B 958 6.731 -5.722 6.453 1.00 0.00 H new ATOM 0 HA ASN B 958 7.892 -7.982 5.345 1.00 0.00 H new ATOM 0 HB2 ASN B 958 9.010 -5.820 6.014 1.00 0.00 H new ATOM 0 HB3 ASN B 958 8.902 -6.320 7.690 1.00 0.00 H new ATOM 0 HD21 ASN B 958 11.614 -8.129 5.127 1.00 0.00 H new ATOM 0 HD22 ASN B 958 10.226 -7.235 4.497 1.00 0.00 H new ATOM 1390 N ASP B 959 6.894 -8.410 8.427 1.00 0.00 N ATOM 1391 CA ASP B 959 6.684 -9.404 9.473 1.00 0.00 C ATOM 1392 C ASP B 959 5.823 -10.556 8.963 1.00 0.00 C ATOM 1393 O ASP B 959 5.976 -11.698 9.397 1.00 0.00 O ATOM 1394 CB ASP B 959 6.023 -8.760 10.693 1.00 0.00 C ATOM 1395 CG ASP B 959 6.922 -7.741 11.367 1.00 0.00 C ATOM 1396 OD1 ASP B 959 8.138 -7.741 11.084 1.00 0.00 O ATOM 1397 OD2 ASP B 959 6.408 -6.942 12.178 1.00 0.00 O ATOM 0 H ASP B 959 6.437 -7.514 8.598 1.00 0.00 H new ATOM 0 HA ASP B 959 7.657 -9.801 9.763 1.00 0.00 H new ATOM 0 HB2 ASP B 959 5.095 -8.276 10.387 1.00 0.00 H new ATOM 0 HB3 ASP B 959 5.756 -9.536 11.410 1.00 0.00 H new ATOM 1402 N LEU B 960 4.915 -10.248 8.040 1.00 0.00 N ATOM 1403 CA LEU B 960 4.029 -11.259 7.472 1.00 0.00 C ATOM 1404 C LEU B 960 4.832 -12.377 6.814 1.00 0.00 C ATOM 1405 O LEU B 960 4.428 -13.539 6.834 1.00 0.00 O ATOM 1406 CB LEU B 960 3.084 -10.624 6.450 1.00 0.00 C ATOM 1407 CG LEU B 960 2.349 -9.371 6.931 1.00 0.00 C ATOM 1408 CD1 LEU B 960 1.366 -8.894 5.874 1.00 0.00 C ATOM 1409 CD2 LEU B 960 1.628 -9.643 8.243 1.00 0.00 C ATOM 0 H LEU B 960 4.774 -9.308 7.670 1.00 0.00 H new ATOM 0 HA LEU B 960 3.440 -11.687 8.283 1.00 0.00 H new ATOM 0 HB2 LEU B 960 3.657 -10.369 5.558 1.00 0.00 H new ATOM 0 HB3 LEU B 960 2.345 -11.367 6.152 1.00 0.00 H new ATOM 0 HG LEU B 960 3.085 -8.585 7.100 1.00 0.00 H new ATOM 0 HD11 LEU B 960 0.851 -8.002 6.232 1.00 0.00 H new ATOM 0 HD12 LEU B 960 1.905 -8.659 4.956 1.00 0.00 H new ATOM 0 HD13 LEU B 960 0.636 -9.679 5.675 1.00 0.00 H new ATOM 0 HD21 LEU B 960 1.112 -8.740 8.568 1.00 0.00 H new ATOM 0 HD22 LEU B 960 0.903 -10.444 8.100 1.00 0.00 H new ATOM 0 HD23 LEU B 960 2.352 -9.940 9.001 1.00 0.00 H new ATOM 1421 N MET B 961 5.970 -12.016 6.230 1.00 0.00 N ATOM 1422 CA MET B 961 6.830 -12.987 5.565 1.00 0.00 C ATOM 1423 C MET B 961 6.091 -13.672 4.419 1.00 0.00 C ATOM 1424 O MET B 961 5.171 -13.046 3.852 1.00 0.00 O ATOM 1425 CB MET B 961 7.323 -14.033 6.567 1.00 0.00 C ATOM 1426 CG MET B 961 8.570 -14.772 6.112 1.00 0.00 C ATOM 1427 SD MET B 961 9.017 -16.125 7.216 1.00 0.00 S ATOM 1428 CE MET B 961 9.295 -15.237 8.746 1.00 0.00 C ATOM 1429 OXT MET B 961 6.440 -14.826 4.096 1.00 0.00 O ATOM 0 H MET B 961 6.318 -11.057 6.204 1.00 0.00 H new ATOM 0 HA MET B 961 7.688 -12.455 5.154 1.00 0.00 H new ATOM 0 HB2 MET B 961 7.528 -13.543 7.519 1.00 0.00 H new ATOM 0 HB3 MET B 961 6.527 -14.756 6.745 1.00 0.00 H new ATOM 0 HG2 MET B 961 8.409 -15.165 5.108 1.00 0.00 H new ATOM 0 HG3 MET B 961 9.401 -14.070 6.049 1.00 0.00 H new ATOM 0 HE1 MET B 961 9.828 -15.879 9.447 1.00 0.00 H new ATOM 0 HE2 MET B 961 9.889 -14.345 8.546 1.00 0.00 H new ATOM 0 HE3 MET B 961 8.337 -14.946 9.177 1.00 0.00 H new TER 1439 MET B 961