USER MOD reduce.3.24.130724 H: found=0, std=0, add=744, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 744 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 650 MET CE :methyl -155:sc= -3.08 (180deg=-0.891) USER MOD Set 1.2: B 650 MET CE :methyl -155:sc= -3.29 (180deg=-1.25) USER MOD Single : A 636 CYS SG : rot 180:sc= -0.0765 USER MOD Single : A 638 THR OG1 : rot 180:sc= 0 USER MOD Single : A 639 ASN : amide:sc= -0.372 K(o=-0.37,f=-2.4) USER MOD Single : A 642 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 645 SER OG : rot 180:sc= 0.0543 USER MOD Single : A 648 THR OG1 : rot 84:sc= 0.168 USER MOD Single : A 668 MET CE :methyl -133:sc= -5.88! (180deg=-7.75!) USER MOD Single : A 672 HIS : no HD1:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 676 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0889) USER MOD Single : B 636 CYS SG : rot 180:sc= 0 USER MOD Single : B 638 THR OG1 : rot 180:sc= 0 USER MOD Single : B 639 ASN : amide:sc= -0.0267 X(o=-0.027,f=-0.27) USER MOD Single : B 642 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 645 SER OG : rot 180:sc= 0.0496 USER MOD Single : B 648 THR OG1 : rot 83:sc= 0.445 USER MOD Single : B 668 MET CE :methyl -139:sc= -6.17! (180deg=-7.8!) USER MOD Single : B 672 HIS : no HD1:sc=-0.000422 X(o=-0.00042,f=0) USER MOD Single : B 676 LYS NZ :NH3+ -128:sc= -0.153 (180deg=-0.766) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 634 22.264 17.356 2.076 1.00 0.00 N ATOM 2 CA GLU A 634 21.994 18.783 1.941 1.00 0.00 C ATOM 3 C GLU A 634 21.510 19.372 3.263 1.00 0.00 C ATOM 4 O GLU A 634 21.715 20.552 3.542 1.00 0.00 O ATOM 5 CB GLU A 634 20.951 19.027 0.849 1.00 0.00 C ATOM 6 CG GLU A 634 19.574 18.483 1.191 1.00 0.00 C ATOM 7 CD GLU A 634 18.699 18.298 -0.033 1.00 0.00 C ATOM 8 OE1 GLU A 634 18.403 19.306 -0.708 1.00 0.00 O ATOM 9 OE2 GLU A 634 18.311 17.145 -0.317 1.00 0.00 O ATOM 0 HA GLU A 634 22.924 19.278 1.661 1.00 0.00 H new ATOM 0 HB2 GLU A 634 20.874 20.099 0.665 1.00 0.00 H new ATOM 0 HB3 GLU A 634 21.294 18.568 -0.078 1.00 0.00 H new ATOM 0 HG2 GLU A 634 19.682 17.527 1.703 1.00 0.00 H new ATOM 0 HG3 GLU A 634 19.081 19.163 1.886 1.00 0.00 H new ATOM 16 N GLY A 635 20.866 18.539 4.075 1.00 0.00 N ATOM 17 CA GLY A 635 20.362 18.994 5.357 1.00 0.00 C ATOM 18 C GLY A 635 19.166 18.191 5.829 1.00 0.00 C ATOM 19 O GLY A 635 19.296 17.015 6.172 1.00 0.00 O ATOM 0 H GLY A 635 20.684 17.557 3.867 1.00 0.00 H new ATOM 0 HA2 GLY A 635 21.156 18.927 6.100 1.00 0.00 H new ATOM 0 HA3 GLY A 635 20.083 20.045 5.282 1.00 0.00 H new ATOM 23 N CYS A 636 17.999 18.825 5.848 1.00 0.00 N ATOM 24 CA CYS A 636 16.775 18.162 6.283 1.00 0.00 C ATOM 25 C CYS A 636 15.559 18.742 5.568 1.00 0.00 C ATOM 26 O CYS A 636 14.711 19.402 6.170 1.00 0.00 O ATOM 27 CB CYS A 636 16.606 18.301 7.797 1.00 0.00 C ATOM 28 SG CYS A 636 15.648 16.970 8.558 1.00 0.00 S ATOM 0 H CYS A 636 17.875 19.798 5.567 1.00 0.00 H new ATOM 0 HA CYS A 636 16.853 17.105 6.029 1.00 0.00 H new ATOM 0 HB2 CYS A 636 17.592 18.335 8.260 1.00 0.00 H new ATOM 0 HB3 CYS A 636 16.120 19.253 8.012 1.00 0.00 H new ATOM 0 HG CYS A 636 15.562 17.175 9.839 1.00 0.00 H new ATOM 34 N PRO A 637 15.470 18.492 4.254 1.00 0.00 N ATOM 35 CA PRO A 637 14.362 18.981 3.428 1.00 0.00 C ATOM 36 C PRO A 637 13.046 18.280 3.749 1.00 0.00 C ATOM 37 O PRO A 637 11.968 18.793 3.449 1.00 0.00 O ATOM 38 CB PRO A 637 14.810 18.651 2.002 1.00 0.00 C ATOM 39 CG PRO A 637 15.748 17.504 2.155 1.00 0.00 C ATOM 40 CD PRO A 637 16.445 17.713 3.472 1.00 0.00 C ATOM 0 HA PRO A 637 14.167 20.041 3.594 1.00 0.00 H new ATOM 0 HB2 PRO A 637 13.961 18.387 1.372 1.00 0.00 H new ATOM 0 HB3 PRO A 637 15.301 19.504 1.534 1.00 0.00 H new ATOM 0 HG2 PRO A 637 15.210 16.556 2.144 1.00 0.00 H new ATOM 0 HG3 PRO A 637 16.465 17.474 1.334 1.00 0.00 H new ATOM 0 HD2 PRO A 637 16.683 16.766 3.956 1.00 0.00 H new ATOM 0 HD3 PRO A 637 17.384 18.252 3.349 1.00 0.00 H new ATOM 48 N THR A 638 13.142 17.105 4.363 1.00 0.00 N ATOM 49 CA THR A 638 11.959 16.333 4.724 1.00 0.00 C ATOM 50 C THR A 638 11.010 17.155 5.588 1.00 0.00 C ATOM 51 O THR A 638 9.806 16.901 5.619 1.00 0.00 O ATOM 52 CB THR A 638 12.338 15.046 5.480 1.00 0.00 C ATOM 53 OG1 THR A 638 11.154 14.352 5.889 1.00 0.00 O ATOM 54 CG2 THR A 638 13.192 15.364 6.698 1.00 0.00 C ATOM 0 H THR A 638 14.026 16.667 4.621 1.00 0.00 H new ATOM 0 HA THR A 638 11.459 16.065 3.793 1.00 0.00 H new ATOM 0 HB THR A 638 12.916 14.413 4.807 1.00 0.00 H new ATOM 0 HG1 THR A 638 11.403 13.534 6.368 1.00 0.00 H new ATOM 0 HG21 THR A 638 13.447 14.439 7.215 1.00 0.00 H new ATOM 0 HG22 THR A 638 14.106 15.866 6.381 1.00 0.00 H new ATOM 0 HG23 THR A 638 12.636 16.015 7.372 1.00 0.00 H new ATOM 62 N ASN A 639 11.559 18.142 6.289 1.00 0.00 N ATOM 63 CA ASN A 639 10.759 19.002 7.154 1.00 0.00 C ATOM 64 C ASN A 639 9.701 19.751 6.349 1.00 0.00 C ATOM 65 O ASN A 639 9.952 20.182 5.224 1.00 0.00 O ATOM 66 CB ASN A 639 11.657 19.999 7.888 1.00 0.00 C ATOM 67 CG ASN A 639 12.068 21.164 7.008 1.00 0.00 C ATOM 68 OD1 ASN A 639 12.355 20.991 5.824 1.00 0.00 O ATOM 69 ND2 ASN A 639 12.097 22.360 7.586 1.00 0.00 N ATOM 0 H ASN A 639 12.554 18.366 6.275 1.00 0.00 H new ATOM 0 HA ASN A 639 10.254 18.371 7.885 1.00 0.00 H new ATOM 0 HB2 ASN A 639 11.133 20.377 8.766 1.00 0.00 H new ATOM 0 HB3 ASN A 639 12.549 19.485 8.246 1.00 0.00 H new ATOM 0 HD21 ASN A 639 12.365 23.182 7.045 1.00 0.00 H new ATOM 0 HD22 ASN A 639 11.851 22.456 8.571 1.00 0.00 H new ATOM 76 N GLY A 640 8.517 19.902 6.934 1.00 0.00 N ATOM 77 CA GLY A 640 7.439 20.600 6.257 1.00 0.00 C ATOM 78 C GLY A 640 6.139 19.821 6.283 1.00 0.00 C ATOM 79 O GLY A 640 5.685 19.295 5.266 1.00 0.00 O ATOM 0 H GLY A 640 8.285 19.554 7.864 1.00 0.00 H new ATOM 0 HA2 GLY A 640 7.287 21.571 6.728 1.00 0.00 H new ATOM 0 HA3 GLY A 640 7.726 20.789 5.222 1.00 0.00 H new ATOM 83 N PRO A 641 5.517 19.738 7.469 1.00 0.00 N ATOM 84 CA PRO A 641 4.253 19.018 7.651 1.00 0.00 C ATOM 85 C PRO A 641 3.082 19.724 6.977 1.00 0.00 C ATOM 86 O PRO A 641 2.808 20.893 7.248 1.00 0.00 O ATOM 87 CB PRO A 641 4.068 19.007 9.171 1.00 0.00 C ATOM 88 CG PRO A 641 4.830 20.193 9.654 1.00 0.00 C ATOM 89 CD PRO A 641 6.001 20.340 8.722 1.00 0.00 C ATOM 0 HA PRO A 641 4.281 18.024 7.204 1.00 0.00 H new ATOM 0 HB2 PRO A 641 3.015 19.076 9.442 1.00 0.00 H new ATOM 0 HB3 PRO A 641 4.450 18.085 9.610 1.00 0.00 H new ATOM 0 HG2 PRO A 641 4.208 21.088 9.643 1.00 0.00 H new ATOM 0 HG3 PRO A 641 5.164 20.050 10.682 1.00 0.00 H new ATOM 0 HD2 PRO A 641 6.277 21.386 8.585 1.00 0.00 H new ATOM 0 HD3 PRO A 641 6.883 19.824 9.101 1.00 0.00 H new ATOM 97 N LYS A 642 2.393 19.006 6.096 1.00 0.00 N ATOM 98 CA LYS A 642 1.249 19.562 5.383 1.00 0.00 C ATOM 99 C LYS A 642 0.215 18.481 5.087 1.00 0.00 C ATOM 100 O LYS A 642 0.544 17.427 4.541 1.00 0.00 O ATOM 101 CB LYS A 642 1.705 20.218 4.077 1.00 0.00 C ATOM 102 CG LYS A 642 1.856 21.726 4.175 1.00 0.00 C ATOM 103 CD LYS A 642 2.800 22.261 3.111 1.00 0.00 C ATOM 104 CE LYS A 642 3.166 23.715 3.372 1.00 0.00 C ATOM 105 NZ LYS A 642 1.988 24.616 3.237 1.00 0.00 N ATOM 0 H LYS A 642 2.607 18.037 5.859 1.00 0.00 H new ATOM 0 HA LYS A 642 0.788 20.317 6.020 1.00 0.00 H new ATOM 0 HB2 LYS A 642 2.659 19.784 3.776 1.00 0.00 H new ATOM 0 HB3 LYS A 642 0.986 19.983 3.292 1.00 0.00 H new ATOM 0 HG2 LYS A 642 0.880 22.198 4.067 1.00 0.00 H new ATOM 0 HG3 LYS A 642 2.232 21.992 5.163 1.00 0.00 H new ATOM 0 HD2 LYS A 642 3.706 21.655 3.088 1.00 0.00 H new ATOM 0 HD3 LYS A 642 2.333 22.173 2.130 1.00 0.00 H new ATOM 0 HE2 LYS A 642 3.583 23.810 4.375 1.00 0.00 H new ATOM 0 HE3 LYS A 642 3.943 24.025 2.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 2.278 25.597 3.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 1.605 24.545 2.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 1.257 24.336 3.922 1.00 0.00 H new ATOM 119 N ILE A 643 -1.035 18.749 5.448 1.00 0.00 N ATOM 120 CA ILE A 643 -2.117 17.800 5.218 1.00 0.00 C ATOM 121 C ILE A 643 -3.365 18.504 4.697 1.00 0.00 C ATOM 122 O ILE A 643 -4.393 18.579 5.371 1.00 0.00 O ATOM 123 CB ILE A 643 -2.475 17.031 6.504 1.00 0.00 C ATOM 124 CG1 ILE A 643 -1.212 16.451 7.145 1.00 0.00 C ATOM 125 CG2 ILE A 643 -3.477 15.928 6.200 1.00 0.00 C ATOM 126 CD1 ILE A 643 -1.476 15.711 8.438 1.00 0.00 C ATOM 0 H ILE A 643 -1.324 19.616 5.901 1.00 0.00 H new ATOM 0 HA ILE A 643 -1.762 17.093 4.468 1.00 0.00 H new ATOM 0 HB ILE A 643 -2.932 17.724 7.210 1.00 0.00 H new ATOM 0 HG12 ILE A 643 -0.734 15.772 6.438 1.00 0.00 H new ATOM 0 HG13 ILE A 643 -0.507 17.260 7.336 1.00 0.00 H new ATOM 0 HG21 ILE A 643 -3.720 15.394 7.119 1.00 0.00 H new ATOM 0 HG22 ILE A 643 -4.384 16.365 5.784 1.00 0.00 H new ATOM 0 HG23 ILE A 643 -3.046 15.233 5.479 1.00 0.00 H new ATOM 0 HD11 ILE A 643 -0.537 15.327 8.836 1.00 0.00 H new ATOM 0 HD12 ILE A 643 -1.925 16.391 9.161 1.00 0.00 H new ATOM 0 HD13 ILE A 643 -2.156 14.881 8.250 1.00 0.00 H new ATOM 138 N PRO A 644 -3.277 19.032 3.467 1.00 0.00 N ATOM 139 CA PRO A 644 -4.390 19.738 2.827 1.00 0.00 C ATOM 140 C PRO A 644 -5.530 18.799 2.448 1.00 0.00 C ATOM 141 O PRO A 644 -5.584 17.657 2.903 1.00 0.00 O ATOM 142 CB PRO A 644 -3.753 20.340 1.571 1.00 0.00 C ATOM 143 CG PRO A 644 -2.592 19.456 1.275 1.00 0.00 C ATOM 144 CD PRO A 644 -2.082 18.980 2.607 1.00 0.00 C ATOM 0 HA PRO A 644 -4.839 20.477 3.490 1.00 0.00 H new ATOM 0 HB2 PRO A 644 -4.458 20.359 0.740 1.00 0.00 H new ATOM 0 HB3 PRO A 644 -3.434 21.368 1.743 1.00 0.00 H new ATOM 0 HG2 PRO A 644 -2.891 18.615 0.649 1.00 0.00 H new ATOM 0 HG3 PRO A 644 -1.818 19.998 0.732 1.00 0.00 H new ATOM 0 HD2 PRO A 644 -1.675 17.971 2.544 1.00 0.00 H new ATOM 0 HD3 PRO A 644 -1.286 19.621 2.985 1.00 0.00 H new ATOM 152 N SER A 645 -6.440 19.288 1.611 1.00 0.00 N ATOM 153 CA SER A 645 -7.582 18.493 1.174 1.00 0.00 C ATOM 154 C SER A 645 -7.145 17.407 0.195 1.00 0.00 C ATOM 155 O SER A 645 -7.917 16.506 -0.134 1.00 0.00 O ATOM 156 CB SER A 645 -8.635 19.390 0.520 1.00 0.00 C ATOM 157 OG SER A 645 -8.486 20.737 0.936 1.00 0.00 O ATOM 0 H SER A 645 -6.409 20.230 1.222 1.00 0.00 H new ATOM 0 HA SER A 645 -8.017 18.014 2.051 1.00 0.00 H new ATOM 0 HB2 SER A 645 -8.546 19.329 -0.565 1.00 0.00 H new ATOM 0 HB3 SER A 645 -9.632 19.034 0.779 1.00 0.00 H new ATOM 0 HG SER A 645 -9.169 21.291 0.503 1.00 0.00 H new ATOM 163 N ILE A 646 -5.902 17.500 -0.265 1.00 0.00 N ATOM 164 CA ILE A 646 -5.361 16.526 -1.204 1.00 0.00 C ATOM 165 C ILE A 646 -5.223 15.153 -0.555 1.00 0.00 C ATOM 166 O ILE A 646 -4.993 14.154 -1.235 1.00 0.00 O ATOM 167 CB ILE A 646 -3.987 16.967 -1.743 1.00 0.00 C ATOM 168 CG1 ILE A 646 -4.040 18.423 -2.208 1.00 0.00 C ATOM 169 CG2 ILE A 646 -3.548 16.057 -2.881 1.00 0.00 C ATOM 170 CD1 ILE A 646 -5.110 18.688 -3.245 1.00 0.00 C ATOM 0 H ILE A 646 -5.251 18.240 -0.003 1.00 0.00 H new ATOM 0 HA ILE A 646 -6.065 16.463 -2.034 1.00 0.00 H new ATOM 0 HB ILE A 646 -3.256 16.889 -0.939 1.00 0.00 H new ATOM 0 HG12 ILE A 646 -4.215 19.065 -1.345 1.00 0.00 H new ATOM 0 HG13 ILE A 646 -3.070 18.700 -2.620 1.00 0.00 H new ATOM 0 HG21 ILE A 646 -2.575 16.381 -3.252 1.00 0.00 H new ATOM 0 HG22 ILE A 646 -3.475 15.031 -2.519 1.00 0.00 H new ATOM 0 HG23 ILE A 646 -4.279 16.106 -3.688 1.00 0.00 H new ATOM 0 HD11 ILE A 646 -5.090 19.740 -3.528 1.00 0.00 H new ATOM 0 HD12 ILE A 646 -4.925 18.072 -4.125 1.00 0.00 H new ATOM 0 HD13 ILE A 646 -6.088 18.443 -2.830 1.00 0.00 H new ATOM 182 N ALA A 647 -5.367 15.113 0.766 1.00 0.00 N ATOM 183 CA ALA A 647 -5.262 13.862 1.508 1.00 0.00 C ATOM 184 C ALA A 647 -6.175 12.794 0.914 1.00 0.00 C ATOM 185 O ALA A 647 -5.875 11.601 0.977 1.00 0.00 O ATOM 186 CB ALA A 647 -5.597 14.089 2.975 1.00 0.00 C ATOM 0 H ALA A 647 -5.557 15.932 1.344 1.00 0.00 H new ATOM 0 HA ALA A 647 -4.234 13.508 1.432 1.00 0.00 H new ATOM 0 HB1 ALA A 647 -5.515 13.147 3.517 1.00 0.00 H new ATOM 0 HB2 ALA A 647 -4.902 14.814 3.399 1.00 0.00 H new ATOM 0 HB3 ALA A 647 -6.615 14.469 3.061 1.00 0.00 H new ATOM 192 N THR A 648 -7.291 13.230 0.339 1.00 0.00 N ATOM 193 CA THR A 648 -8.249 12.311 -0.264 1.00 0.00 C ATOM 194 C THR A 648 -7.573 11.407 -1.288 1.00 0.00 C ATOM 195 O THR A 648 -7.752 10.190 -1.270 1.00 0.00 O ATOM 196 CB THR A 648 -9.402 13.070 -0.948 1.00 0.00 C ATOM 197 OG1 THR A 648 -9.915 14.076 -0.068 1.00 0.00 O ATOM 198 CG2 THR A 648 -10.519 12.116 -1.342 1.00 0.00 C ATOM 0 H THR A 648 -7.554 14.214 0.278 1.00 0.00 H new ATOM 0 HA THR A 648 -8.654 11.702 0.544 1.00 0.00 H new ATOM 0 HB THR A 648 -9.013 13.541 -1.851 1.00 0.00 H new ATOM 0 HG1 THR A 648 -9.364 14.884 -0.138 1.00 0.00 H new ATOM 0 HG21 THR A 648 -11.322 12.675 -1.823 1.00 0.00 H new ATOM 0 HG22 THR A 648 -10.132 11.368 -2.034 1.00 0.00 H new ATOM 0 HG23 THR A 648 -10.905 11.620 -0.451 1.00 0.00 H new ATOM 206 N GLY A 649 -6.794 12.010 -2.181 1.00 0.00 N ATOM 207 CA GLY A 649 -6.102 11.243 -3.200 1.00 0.00 C ATOM 208 C GLY A 649 -4.988 10.389 -2.628 1.00 0.00 C ATOM 209 O GLY A 649 -4.740 9.281 -3.102 1.00 0.00 O ATOM 0 H GLY A 649 -6.630 13.016 -2.217 1.00 0.00 H new ATOM 0 HA2 GLY A 649 -6.817 10.603 -3.717 1.00 0.00 H new ATOM 0 HA3 GLY A 649 -5.688 11.924 -3.944 1.00 0.00 H new ATOM 213 N MET A 650 -4.314 10.906 -1.605 1.00 0.00 N ATOM 214 CA MET A 650 -3.220 10.183 -0.968 1.00 0.00 C ATOM 215 C MET A 650 -3.736 8.943 -0.244 1.00 0.00 C ATOM 216 O MET A 650 -3.132 7.873 -0.318 1.00 0.00 O ATOM 217 CB MET A 650 -2.484 11.094 0.017 1.00 0.00 C ATOM 218 CG MET A 650 -1.837 12.302 -0.640 1.00 0.00 C ATOM 219 SD MET A 650 -0.648 11.846 -1.916 1.00 0.00 S ATOM 220 CE MET A 650 0.299 10.588 -1.062 1.00 0.00 C ATOM 0 H MET A 650 -4.507 11.822 -1.200 1.00 0.00 H new ATOM 0 HA MET A 650 -2.526 9.865 -1.746 1.00 0.00 H new ATOM 0 HB2 MET A 650 -3.186 11.437 0.777 1.00 0.00 H new ATOM 0 HB3 MET A 650 -1.716 10.515 0.530 1.00 0.00 H new ATOM 0 HG2 MET A 650 -2.612 12.930 -1.079 1.00 0.00 H new ATOM 0 HG3 MET A 650 -1.336 12.900 0.121 1.00 0.00 H new ATOM 0 HE1 MET A 650 1.295 10.523 -1.499 1.00 0.00 H new ATOM 0 HE2 MET A 650 0.382 10.849 -0.007 1.00 0.00 H new ATOM 0 HE3 MET A 650 -0.203 9.626 -1.159 1.00 0.00 H new ATOM 230 N VAL A 651 -4.857 9.095 0.454 1.00 0.00 N ATOM 231 CA VAL A 651 -5.454 7.987 1.191 1.00 0.00 C ATOM 232 C VAL A 651 -5.922 6.887 0.244 1.00 0.00 C ATOM 233 O VAL A 651 -5.674 5.705 0.478 1.00 0.00 O ATOM 234 CB VAL A 651 -6.648 8.459 2.042 1.00 0.00 C ATOM 235 CG1 VAL A 651 -7.294 7.280 2.755 1.00 0.00 C ATOM 236 CG2 VAL A 651 -6.204 9.517 3.041 1.00 0.00 C ATOM 0 H VAL A 651 -5.370 9.974 0.525 1.00 0.00 H new ATOM 0 HA VAL A 651 -4.681 7.591 1.850 1.00 0.00 H new ATOM 0 HB VAL A 651 -7.390 8.905 1.380 1.00 0.00 H new ATOM 0 HG11 VAL A 651 -8.136 7.632 3.351 1.00 0.00 H new ATOM 0 HG12 VAL A 651 -7.648 6.559 2.018 1.00 0.00 H new ATOM 0 HG13 VAL A 651 -6.562 6.803 3.407 1.00 0.00 H new ATOM 0 HG21 VAL A 651 -7.060 9.839 3.634 1.00 0.00 H new ATOM 0 HG22 VAL A 651 -5.443 9.099 3.700 1.00 0.00 H new ATOM 0 HG23 VAL A 651 -5.791 10.372 2.506 1.00 0.00 H new ATOM 246 N GLY A 652 -6.601 7.285 -0.827 1.00 0.00 N ATOM 247 CA GLY A 652 -7.093 6.321 -1.794 1.00 0.00 C ATOM 248 C GLY A 652 -5.975 5.537 -2.451 1.00 0.00 C ATOM 249 O GLY A 652 -6.104 4.335 -2.682 1.00 0.00 O ATOM 0 H GLY A 652 -6.819 8.258 -1.043 1.00 0.00 H new ATOM 0 HA2 GLY A 652 -7.775 5.630 -1.299 1.00 0.00 H new ATOM 0 HA3 GLY A 652 -7.667 6.841 -2.561 1.00 0.00 H new ATOM 253 N ALA A 653 -4.875 6.218 -2.754 1.00 0.00 N ATOM 254 CA ALA A 653 -3.730 5.577 -3.388 1.00 0.00 C ATOM 255 C ALA A 653 -2.994 4.672 -2.406 1.00 0.00 C ATOM 256 O ALA A 653 -2.668 3.528 -2.725 1.00 0.00 O ATOM 257 CB ALA A 653 -2.784 6.626 -3.954 1.00 0.00 C ATOM 0 H ALA A 653 -4.753 7.214 -2.571 1.00 0.00 H new ATOM 0 HA ALA A 653 -4.099 4.958 -4.206 1.00 0.00 H new ATOM 0 HB1 ALA A 653 -1.933 6.133 -4.425 1.00 0.00 H new ATOM 0 HB2 ALA A 653 -3.310 7.228 -4.695 1.00 0.00 H new ATOM 0 HB3 ALA A 653 -2.430 7.269 -3.148 1.00 0.00 H new ATOM 263 N LEU A 654 -2.733 5.192 -1.212 1.00 0.00 N ATOM 264 CA LEU A 654 -2.034 4.431 -0.182 1.00 0.00 C ATOM 265 C LEU A 654 -2.756 3.120 0.111 1.00 0.00 C ATOM 266 O LEU A 654 -2.137 2.057 0.169 1.00 0.00 O ATOM 267 CB LEU A 654 -1.915 5.258 1.099 1.00 0.00 C ATOM 268 CG LEU A 654 -0.952 6.445 1.044 1.00 0.00 C ATOM 269 CD1 LEU A 654 -1.327 7.485 2.088 1.00 0.00 C ATOM 270 CD2 LEU A 654 0.482 5.978 1.246 1.00 0.00 C ATOM 0 H LEU A 654 -2.995 6.138 -0.933 1.00 0.00 H new ATOM 0 HA LEU A 654 -1.035 4.200 -0.552 1.00 0.00 H new ATOM 0 HB2 LEU A 654 -2.905 5.631 1.360 1.00 0.00 H new ATOM 0 HB3 LEU A 654 -1.600 4.597 1.907 1.00 0.00 H new ATOM 0 HG LEU A 654 -1.028 6.905 0.059 1.00 0.00 H new ATOM 0 HD11 LEU A 654 -0.631 8.322 2.034 1.00 0.00 H new ATOM 0 HD12 LEU A 654 -2.339 7.842 1.899 1.00 0.00 H new ATOM 0 HD13 LEU A 654 -1.280 7.037 3.081 1.00 0.00 H new ATOM 0 HD21 LEU A 654 1.153 6.836 1.204 1.00 0.00 H new ATOM 0 HD22 LEU A 654 0.573 5.493 2.218 1.00 0.00 H new ATOM 0 HD23 LEU A 654 0.748 5.270 0.461 1.00 0.00 H new ATOM 282 N LEU A 655 -4.070 3.202 0.292 1.00 0.00 N ATOM 283 CA LEU A 655 -4.878 2.022 0.576 1.00 0.00 C ATOM 284 C LEU A 655 -4.831 1.036 -0.587 1.00 0.00 C ATOM 285 O LEU A 655 -4.621 -0.162 -0.391 1.00 0.00 O ATOM 286 CB LEU A 655 -6.326 2.427 0.858 1.00 0.00 C ATOM 287 CG LEU A 655 -6.576 3.149 2.182 1.00 0.00 C ATOM 288 CD1 LEU A 655 -8.036 3.560 2.299 1.00 0.00 C ATOM 289 CD2 LEU A 655 -6.173 2.268 3.355 1.00 0.00 C ATOM 0 H LEU A 655 -4.598 4.074 0.247 1.00 0.00 H new ATOM 0 HA LEU A 655 -4.465 1.534 1.459 1.00 0.00 H new ATOM 0 HB2 LEU A 655 -6.667 3.070 0.047 1.00 0.00 H new ATOM 0 HB3 LEU A 655 -6.944 1.530 0.834 1.00 0.00 H new ATOM 0 HG LEU A 655 -5.963 4.050 2.203 1.00 0.00 H new ATOM 0 HD11 LEU A 655 -8.195 4.072 3.248 1.00 0.00 H new ATOM 0 HD12 LEU A 655 -8.293 4.229 1.478 1.00 0.00 H new ATOM 0 HD13 LEU A 655 -8.668 2.673 2.255 1.00 0.00 H new ATOM 0 HD21 LEU A 655 -6.358 2.799 4.289 1.00 0.00 H new ATOM 0 HD22 LEU A 655 -6.759 1.349 3.338 1.00 0.00 H new ATOM 0 HD23 LEU A 655 -5.113 2.025 3.280 1.00 0.00 H new ATOM 301 N LEU A 656 -5.025 1.547 -1.797 1.00 0.00 N ATOM 302 CA LEU A 656 -5.002 0.712 -2.993 1.00 0.00 C ATOM 303 C LEU A 656 -3.640 0.048 -3.167 1.00 0.00 C ATOM 304 O LEU A 656 -3.551 -1.117 -3.559 1.00 0.00 O ATOM 305 CB LEU A 656 -5.336 1.549 -4.229 1.00 0.00 C ATOM 306 CG LEU A 656 -6.818 1.849 -4.457 1.00 0.00 C ATOM 307 CD1 LEU A 656 -6.994 2.831 -5.605 1.00 0.00 C ATOM 308 CD2 LEU A 656 -7.586 0.564 -4.730 1.00 0.00 C ATOM 0 H LEU A 656 -5.200 2.536 -1.976 1.00 0.00 H new ATOM 0 HA LEU A 656 -5.754 -0.069 -2.876 1.00 0.00 H new ATOM 0 HB2 LEU A 656 -4.801 2.496 -4.157 1.00 0.00 H new ATOM 0 HB3 LEU A 656 -4.951 1.032 -5.108 1.00 0.00 H new ATOM 0 HG LEU A 656 -7.220 2.304 -3.552 1.00 0.00 H new ATOM 0 HD11 LEU A 656 -8.055 3.032 -5.752 1.00 0.00 H new ATOM 0 HD12 LEU A 656 -6.477 3.762 -5.370 1.00 0.00 H new ATOM 0 HD13 LEU A 656 -6.576 2.404 -6.516 1.00 0.00 H new ATOM 0 HD21 LEU A 656 -8.639 0.796 -4.890 1.00 0.00 H new ATOM 0 HD22 LEU A 656 -7.182 0.081 -5.619 1.00 0.00 H new ATOM 0 HD23 LEU A 656 -7.488 -0.107 -3.876 1.00 0.00 H new ATOM 320 N LEU A 657 -2.582 0.794 -2.872 1.00 0.00 N ATOM 321 CA LEU A 657 -1.223 0.277 -2.994 1.00 0.00 C ATOM 322 C LEU A 657 -1.030 -0.958 -2.120 1.00 0.00 C ATOM 323 O LEU A 657 -0.577 -2.002 -2.592 1.00 0.00 O ATOM 324 CB LEU A 657 -0.209 1.354 -2.605 1.00 0.00 C ATOM 325 CG LEU A 657 0.112 2.393 -3.680 1.00 0.00 C ATOM 326 CD1 LEU A 657 1.058 3.451 -3.134 1.00 0.00 C ATOM 327 CD2 LEU A 657 0.710 1.723 -4.908 1.00 0.00 C ATOM 0 H LEU A 657 -2.638 1.759 -2.547 1.00 0.00 H new ATOM 0 HA LEU A 657 -1.061 -0.007 -4.034 1.00 0.00 H new ATOM 0 HB2 LEU A 657 -0.583 1.876 -1.724 1.00 0.00 H new ATOM 0 HB3 LEU A 657 0.719 0.863 -2.314 1.00 0.00 H new ATOM 0 HG LEU A 657 -0.817 2.882 -3.974 1.00 0.00 H new ATOM 0 HD11 LEU A 657 1.275 4.182 -3.913 1.00 0.00 H new ATOM 0 HD12 LEU A 657 0.592 3.953 -2.286 1.00 0.00 H new ATOM 0 HD13 LEU A 657 1.986 2.978 -2.811 1.00 0.00 H new ATOM 0 HD21 LEU A 657 0.932 2.478 -5.662 1.00 0.00 H new ATOM 0 HD22 LEU A 657 1.629 1.207 -4.630 1.00 0.00 H new ATOM 0 HD23 LEU A 657 -0.002 1.004 -5.313 1.00 0.00 H new ATOM 339 N LEU A 658 -1.380 -0.834 -0.844 1.00 0.00 N ATOM 340 CA LEU A 658 -1.248 -1.941 0.097 1.00 0.00 C ATOM 341 C LEU A 658 -2.023 -3.162 -0.387 1.00 0.00 C ATOM 342 O LEU A 658 -1.529 -4.288 -0.327 1.00 0.00 O ATOM 343 CB LEU A 658 -1.745 -1.522 1.481 1.00 0.00 C ATOM 344 CG LEU A 658 -0.764 -0.715 2.332 1.00 0.00 C ATOM 345 CD1 LEU A 658 -1.500 0.027 3.436 1.00 0.00 C ATOM 346 CD2 LEU A 658 0.306 -1.624 2.918 1.00 0.00 C ATOM 0 H LEU A 658 -1.757 0.022 -0.437 1.00 0.00 H new ATOM 0 HA LEU A 658 -0.193 -2.206 0.162 1.00 0.00 H new ATOM 0 HB2 LEU A 658 -2.654 -0.934 1.356 1.00 0.00 H new ATOM 0 HB3 LEU A 658 -2.020 -2.421 2.033 1.00 0.00 H new ATOM 0 HG LEU A 658 -0.277 0.020 1.692 1.00 0.00 H new ATOM 0 HD11 LEU A 658 -0.785 0.596 4.031 1.00 0.00 H new ATOM 0 HD12 LEU A 658 -2.228 0.708 2.994 1.00 0.00 H new ATOM 0 HD13 LEU A 658 -2.015 -0.690 4.075 1.00 0.00 H new ATOM 0 HD21 LEU A 658 0.995 -1.033 3.521 1.00 0.00 H new ATOM 0 HD22 LEU A 658 -0.164 -2.383 3.544 1.00 0.00 H new ATOM 0 HD23 LEU A 658 0.854 -2.109 2.110 1.00 0.00 H new ATOM 358 N VAL A 659 -3.240 -2.931 -0.869 1.00 0.00 N ATOM 359 CA VAL A 659 -4.083 -4.012 -1.366 1.00 0.00 C ATOM 360 C VAL A 659 -3.454 -4.685 -2.580 1.00 0.00 C ATOM 361 O VAL A 659 -3.563 -5.899 -2.757 1.00 0.00 O ATOM 362 CB VAL A 659 -5.485 -3.500 -1.746 1.00 0.00 C ATOM 363 CG1 VAL A 659 -6.372 -4.653 -2.192 1.00 0.00 C ATOM 364 CG2 VAL A 659 -6.114 -2.753 -0.580 1.00 0.00 C ATOM 0 H VAL A 659 -3.664 -2.005 -0.926 1.00 0.00 H new ATOM 0 HA VAL A 659 -4.176 -4.738 -0.559 1.00 0.00 H new ATOM 0 HB VAL A 659 -5.385 -2.806 -2.580 1.00 0.00 H new ATOM 0 HG11 VAL A 659 -7.358 -4.272 -2.456 1.00 0.00 H new ATOM 0 HG12 VAL A 659 -5.927 -5.140 -3.059 1.00 0.00 H new ATOM 0 HG13 VAL A 659 -6.467 -5.374 -1.380 1.00 0.00 H new ATOM 0 HG21 VAL A 659 -7.104 -2.398 -0.867 1.00 0.00 H new ATOM 0 HG22 VAL A 659 -6.202 -3.422 0.276 1.00 0.00 H new ATOM 0 HG23 VAL A 659 -5.487 -1.902 -0.312 1.00 0.00 H new ATOM 374 N VAL A 660 -2.793 -3.890 -3.416 1.00 0.00 N ATOM 375 CA VAL A 660 -2.144 -4.409 -4.613 1.00 0.00 C ATOM 376 C VAL A 660 -1.001 -5.352 -4.254 1.00 0.00 C ATOM 377 O VAL A 660 -0.858 -6.423 -4.842 1.00 0.00 O ATOM 378 CB VAL A 660 -1.597 -3.269 -5.494 1.00 0.00 C ATOM 379 CG1 VAL A 660 -0.770 -3.831 -6.641 1.00 0.00 C ATOM 380 CG2 VAL A 660 -2.736 -2.408 -6.018 1.00 0.00 C ATOM 0 H VAL A 660 -2.693 -2.883 -3.285 1.00 0.00 H new ATOM 0 HA VAL A 660 -2.902 -4.958 -5.171 1.00 0.00 H new ATOM 0 HB VAL A 660 -0.948 -2.640 -4.884 1.00 0.00 H new ATOM 0 HG11 VAL A 660 -0.392 -3.012 -7.253 1.00 0.00 H new ATOM 0 HG12 VAL A 660 0.068 -4.401 -6.240 1.00 0.00 H new ATOM 0 HG13 VAL A 660 -1.393 -4.483 -7.253 1.00 0.00 H new ATOM 0 HG21 VAL A 660 -2.332 -1.608 -6.638 1.00 0.00 H new ATOM 0 HG22 VAL A 660 -3.412 -3.022 -6.613 1.00 0.00 H new ATOM 0 HG23 VAL A 660 -3.282 -1.976 -5.179 1.00 0.00 H new ATOM 390 N ALA A 661 -0.189 -4.946 -3.283 1.00 0.00 N ATOM 391 CA ALA A 661 0.940 -5.756 -2.843 1.00 0.00 C ATOM 392 C ALA A 661 0.471 -7.098 -2.291 1.00 0.00 C ATOM 393 O ALA A 661 1.028 -8.146 -2.622 1.00 0.00 O ATOM 394 CB ALA A 661 1.751 -5.006 -1.796 1.00 0.00 C ATOM 0 H ALA A 661 -0.292 -4.061 -2.786 1.00 0.00 H new ATOM 0 HA ALA A 661 1.575 -5.951 -3.707 1.00 0.00 H new ATOM 0 HB1 ALA A 661 2.591 -5.623 -1.476 1.00 0.00 H new ATOM 0 HB2 ALA A 661 2.126 -4.076 -2.223 1.00 0.00 H new ATOM 0 HB3 ALA A 661 1.118 -4.782 -0.937 1.00 0.00 H new ATOM 400 N LEU A 662 -0.555 -7.059 -1.448 1.00 0.00 N ATOM 401 CA LEU A 662 -1.099 -8.273 -0.849 1.00 0.00 C ATOM 402 C LEU A 662 -1.559 -9.252 -1.925 1.00 0.00 C ATOM 403 O LEU A 662 -1.193 -10.427 -1.907 1.00 0.00 O ATOM 404 CB LEU A 662 -2.267 -7.930 0.076 1.00 0.00 C ATOM 405 CG LEU A 662 -1.893 -7.426 1.471 1.00 0.00 C ATOM 406 CD1 LEU A 662 -3.082 -6.742 2.129 1.00 0.00 C ATOM 407 CD2 LEU A 662 -1.390 -8.573 2.335 1.00 0.00 C ATOM 0 H LEU A 662 -1.027 -6.200 -1.164 1.00 0.00 H new ATOM 0 HA LEU A 662 -0.309 -8.746 -0.266 1.00 0.00 H new ATOM 0 HB2 LEU A 662 -2.879 -7.171 -0.411 1.00 0.00 H new ATOM 0 HB3 LEU A 662 -2.889 -8.818 0.187 1.00 0.00 H new ATOM 0 HG LEU A 662 -1.091 -6.695 1.369 1.00 0.00 H new ATOM 0 HD11 LEU A 662 -2.797 -6.390 3.120 1.00 0.00 H new ATOM 0 HD12 LEU A 662 -3.397 -5.895 1.520 1.00 0.00 H new ATOM 0 HD13 LEU A 662 -3.906 -7.450 2.219 1.00 0.00 H new ATOM 0 HD21 LEU A 662 -1.129 -8.196 3.324 1.00 0.00 H new ATOM 0 HD22 LEU A 662 -2.171 -9.327 2.429 1.00 0.00 H new ATOM 0 HD23 LEU A 662 -0.509 -9.018 1.872 1.00 0.00 H new ATOM 419 N GLY A 663 -2.363 -8.759 -2.862 1.00 0.00 N ATOM 420 CA GLY A 663 -2.857 -9.604 -3.934 1.00 0.00 C ATOM 421 C GLY A 663 -1.739 -10.248 -4.728 1.00 0.00 C ATOM 422 O GLY A 663 -1.731 -11.463 -4.928 1.00 0.00 O ATOM 0 H GLY A 663 -2.681 -7.790 -2.898 1.00 0.00 H new ATOM 0 HA2 GLY A 663 -3.495 -10.382 -3.514 1.00 0.00 H new ATOM 0 HA3 GLY A 663 -3.478 -9.009 -4.604 1.00 0.00 H new ATOM 426 N ILE A 664 -0.792 -9.434 -5.182 1.00 0.00 N ATOM 427 CA ILE A 664 0.336 -9.933 -5.959 1.00 0.00 C ATOM 428 C ILE A 664 1.084 -11.025 -5.203 1.00 0.00 C ATOM 429 O ILE A 664 1.446 -12.053 -5.773 1.00 0.00 O ATOM 430 CB ILE A 664 1.320 -8.802 -6.312 1.00 0.00 C ATOM 431 CG1 ILE A 664 0.617 -7.724 -7.140 1.00 0.00 C ATOM 432 CG2 ILE A 664 2.519 -9.359 -7.065 1.00 0.00 C ATOM 433 CD1 ILE A 664 1.316 -6.383 -7.105 1.00 0.00 C ATOM 0 H ILE A 664 -0.783 -8.426 -5.025 1.00 0.00 H new ATOM 0 HA ILE A 664 -0.074 -10.348 -6.880 1.00 0.00 H new ATOM 0 HB ILE A 664 1.676 -8.348 -5.387 1.00 0.00 H new ATOM 0 HG12 ILE A 664 0.546 -8.061 -8.174 1.00 0.00 H new ATOM 0 HG13 ILE A 664 -0.402 -7.603 -6.773 1.00 0.00 H new ATOM 0 HG21 ILE A 664 3.205 -8.548 -7.307 1.00 0.00 H new ATOM 0 HG22 ILE A 664 3.031 -10.093 -6.443 1.00 0.00 H new ATOM 0 HG23 ILE A 664 2.181 -9.836 -7.985 1.00 0.00 H new ATOM 0 HD11 ILE A 664 0.762 -5.668 -7.713 1.00 0.00 H new ATOM 0 HD12 ILE A 664 1.364 -6.024 -6.077 1.00 0.00 H new ATOM 0 HD13 ILE A 664 2.327 -6.489 -7.499 1.00 0.00 H new ATOM 445 N GLY A 665 1.311 -10.795 -3.913 1.00 0.00 N ATOM 446 CA GLY A 665 2.014 -11.769 -3.098 1.00 0.00 C ATOM 447 C GLY A 665 1.337 -13.126 -3.104 1.00 0.00 C ATOM 448 O GLY A 665 1.979 -14.147 -3.351 1.00 0.00 O ATOM 0 H GLY A 665 1.021 -9.952 -3.418 1.00 0.00 H new ATOM 0 HA2 GLY A 665 3.036 -11.874 -3.463 1.00 0.00 H new ATOM 0 HA3 GLY A 665 2.078 -11.403 -2.073 1.00 0.00 H new ATOM 452 N LEU A 666 0.037 -13.137 -2.829 1.00 0.00 N ATOM 453 CA LEU A 666 -0.728 -14.379 -2.802 1.00 0.00 C ATOM 454 C LEU A 666 -0.857 -14.971 -4.202 1.00 0.00 C ATOM 455 O LEU A 666 -0.874 -16.190 -4.373 1.00 0.00 O ATOM 456 CB LEU A 666 -2.117 -14.133 -2.210 1.00 0.00 C ATOM 457 CG LEU A 666 -2.154 -13.410 -0.863 1.00 0.00 C ATOM 458 CD1 LEU A 666 -3.564 -13.412 -0.295 1.00 0.00 C ATOM 459 CD2 LEU A 666 -1.182 -14.055 0.115 1.00 0.00 C ATOM 0 H LEU A 666 -0.509 -12.301 -2.622 1.00 0.00 H new ATOM 0 HA LEU A 666 -0.193 -15.092 -2.174 1.00 0.00 H new ATOM 0 HB2 LEU A 666 -2.698 -13.553 -2.927 1.00 0.00 H new ATOM 0 HB3 LEU A 666 -2.618 -15.095 -2.097 1.00 0.00 H new ATOM 0 HG LEU A 666 -1.849 -12.375 -1.019 1.00 0.00 H new ATOM 0 HD11 LEU A 666 -3.571 -12.893 0.664 1.00 0.00 H new ATOM 0 HD12 LEU A 666 -4.236 -12.904 -0.987 1.00 0.00 H new ATOM 0 HD13 LEU A 666 -3.898 -14.440 -0.154 1.00 0.00 H new ATOM 0 HD21 LEU A 666 -1.221 -13.528 1.068 1.00 0.00 H new ATOM 0 HD22 LEU A 666 -1.457 -15.099 0.266 1.00 0.00 H new ATOM 0 HD23 LEU A 666 -0.171 -14.001 -0.288 1.00 0.00 H new ATOM 471 N PHE A 667 -0.945 -14.099 -5.201 1.00 0.00 N ATOM 472 CA PHE A 667 -1.070 -14.534 -6.587 1.00 0.00 C ATOM 473 C PHE A 667 0.200 -15.240 -7.052 1.00 0.00 C ATOM 474 O PHE A 667 0.147 -16.349 -7.584 1.00 0.00 O ATOM 475 CB PHE A 667 -1.365 -13.338 -7.495 1.00 0.00 C ATOM 476 CG PHE A 667 -1.201 -13.641 -8.957 1.00 0.00 C ATOM 477 CD1 PHE A 667 0.022 -13.464 -9.582 1.00 0.00 C ATOM 478 CD2 PHE A 667 -2.272 -14.102 -9.706 1.00 0.00 C ATOM 479 CE1 PHE A 667 0.176 -13.742 -10.927 1.00 0.00 C ATOM 480 CE2 PHE A 667 -2.124 -14.382 -11.051 1.00 0.00 C ATOM 481 CZ PHE A 667 -0.898 -14.201 -11.663 1.00 0.00 C ATOM 0 H PHE A 667 -0.932 -13.087 -5.076 1.00 0.00 H new ATOM 0 HA PHE A 667 -1.899 -15.239 -6.647 1.00 0.00 H new ATOM 0 HB2 PHE A 667 -2.385 -12.998 -7.315 1.00 0.00 H new ATOM 0 HB3 PHE A 667 -0.702 -12.515 -7.226 1.00 0.00 H new ATOM 0 HD1 PHE A 667 0.866 -13.104 -9.012 1.00 0.00 H new ATOM 0 HD2 PHE A 667 -3.233 -14.244 -9.233 1.00 0.00 H new ATOM 0 HE1 PHE A 667 1.136 -13.600 -11.402 1.00 0.00 H new ATOM 0 HE2 PHE A 667 -2.966 -14.742 -11.624 1.00 0.00 H new ATOM 0 HZ PHE A 667 -0.781 -14.418 -12.714 1.00 0.00 H new ATOM 491 N MET A 668 1.340 -14.589 -6.849 1.00 0.00 N ATOM 492 CA MET A 668 2.624 -15.154 -7.248 1.00 0.00 C ATOM 493 C MET A 668 2.883 -16.475 -6.530 1.00 0.00 C ATOM 494 O MET A 668 3.421 -17.415 -7.115 1.00 0.00 O ATOM 495 CB MET A 668 3.754 -14.167 -6.948 1.00 0.00 C ATOM 496 CG MET A 668 3.696 -12.903 -7.790 1.00 0.00 C ATOM 497 SD MET A 668 4.967 -11.707 -7.336 1.00 0.00 S ATOM 498 CE MET A 668 4.616 -11.486 -5.593 1.00 0.00 C ATOM 0 H MET A 668 1.401 -13.670 -6.411 1.00 0.00 H new ATOM 0 HA MET A 668 2.592 -15.344 -8.321 1.00 0.00 H new ATOM 0 HB2 MET A 668 3.716 -13.893 -5.894 1.00 0.00 H new ATOM 0 HB3 MET A 668 4.711 -14.661 -7.115 1.00 0.00 H new ATOM 0 HG2 MET A 668 3.809 -13.166 -8.842 1.00 0.00 H new ATOM 0 HG3 MET A 668 2.714 -12.443 -7.681 1.00 0.00 H new ATOM 0 HE1 MET A 668 4.604 -10.422 -5.356 1.00 0.00 H new ATOM 0 HE2 MET A 668 3.644 -11.921 -5.360 1.00 0.00 H new ATOM 0 HE3 MET A 668 5.386 -11.981 -5.001 1.00 0.00 H new ATOM 508 N ARG A 669 2.497 -16.538 -5.260 1.00 0.00 N ATOM 509 CA ARG A 669 2.689 -17.743 -4.462 1.00 0.00 C ATOM 510 C ARG A 669 1.654 -18.805 -4.824 1.00 0.00 C ATOM 511 O ARG A 669 1.885 -20.000 -4.636 1.00 0.00 O ATOM 512 CB ARG A 669 2.598 -17.414 -2.971 1.00 0.00 C ATOM 513 CG ARG A 669 3.876 -16.824 -2.398 1.00 0.00 C ATOM 514 CD ARG A 669 4.197 -17.410 -1.032 1.00 0.00 C ATOM 515 NE ARG A 669 5.477 -16.931 -0.518 1.00 0.00 N ATOM 516 CZ ARG A 669 6.065 -17.426 0.566 1.00 0.00 C ATOM 517 NH1 ARG A 669 5.491 -18.409 1.245 1.00 0.00 N ATOM 518 NH2 ARG A 669 7.230 -16.937 0.971 1.00 0.00 N ATOM 0 H ARG A 669 2.049 -15.769 -4.762 1.00 0.00 H new ATOM 0 HA ARG A 669 3.681 -18.138 -4.679 1.00 0.00 H new ATOM 0 HB2 ARG A 669 1.780 -16.711 -2.812 1.00 0.00 H new ATOM 0 HB3 ARG A 669 2.349 -18.322 -2.422 1.00 0.00 H new ATOM 0 HG2 ARG A 669 4.704 -17.015 -3.081 1.00 0.00 H new ATOM 0 HG3 ARG A 669 3.774 -15.742 -2.316 1.00 0.00 H new ATOM 0 HD2 ARG A 669 3.404 -17.150 -0.331 1.00 0.00 H new ATOM 0 HD3 ARG A 669 4.218 -18.498 -1.100 1.00 0.00 H new ATOM 0 HE ARG A 669 5.945 -16.175 -1.018 1.00 0.00 H new ATOM 0 HH11 ARG A 669 4.596 -18.787 0.936 1.00 0.00 H new ATOM 0 HH12 ARG A 669 5.945 -18.787 2.077 1.00 0.00 H new ATOM 0 HH21 ARG A 669 7.674 -16.181 0.450 1.00 0.00 H new ATOM 0 HH22 ARG A 669 7.681 -17.317 1.803 1.00 0.00 H new ATOM 532 N ARG A 670 0.514 -18.361 -5.342 1.00 0.00 N ATOM 533 CA ARG A 670 -0.556 -19.272 -5.728 1.00 0.00 C ATOM 534 C ARG A 670 -0.292 -19.868 -7.108 1.00 0.00 C ATOM 535 O ARG A 670 -0.788 -20.946 -7.434 1.00 0.00 O ATOM 536 CB ARG A 670 -1.901 -18.543 -5.725 1.00 0.00 C ATOM 537 CG ARG A 670 -2.586 -18.534 -4.368 1.00 0.00 C ATOM 538 CD ARG A 670 -3.725 -17.527 -4.326 1.00 0.00 C ATOM 539 NE ARG A 670 -4.579 -17.617 -5.506 1.00 0.00 N ATOM 540 CZ ARG A 670 -5.516 -18.545 -5.667 1.00 0.00 C ATOM 541 NH1 ARG A 670 -5.718 -19.457 -4.726 1.00 0.00 N ATOM 542 NH2 ARG A 670 -6.254 -18.561 -6.769 1.00 0.00 N ATOM 0 H ARG A 670 0.308 -17.375 -5.504 1.00 0.00 H new ATOM 0 HA ARG A 670 -0.588 -20.083 -5.001 1.00 0.00 H new ATOM 0 HB2 ARG A 670 -1.748 -17.515 -6.052 1.00 0.00 H new ATOM 0 HB3 ARG A 670 -2.562 -19.014 -6.453 1.00 0.00 H new ATOM 0 HG2 ARG A 670 -2.971 -19.530 -4.147 1.00 0.00 H new ATOM 0 HG3 ARG A 670 -1.858 -18.294 -3.593 1.00 0.00 H new ATOM 0 HD2 ARG A 670 -4.324 -17.695 -3.431 1.00 0.00 H new ATOM 0 HD3 ARG A 670 -3.316 -16.520 -4.251 1.00 0.00 H new ATOM 0 HE ARG A 670 -4.449 -16.929 -6.248 1.00 0.00 H new ATOM 0 HH11 ARG A 670 -5.154 -19.447 -3.877 1.00 0.00 H new ATOM 0 HH12 ARG A 670 -6.438 -20.169 -4.852 1.00 0.00 H new ATOM 0 HH21 ARG A 670 -6.103 -17.860 -7.494 1.00 0.00 H new ATOM 0 HH22 ARG A 670 -6.973 -19.274 -6.891 1.00 0.00 H new ATOM 556 N ARG A 671 0.493 -19.159 -7.913 1.00 0.00 N ATOM 557 CA ARG A 671 0.822 -19.617 -9.257 1.00 0.00 C ATOM 558 C ARG A 671 1.511 -20.978 -9.214 1.00 0.00 C ATOM 559 O ARG A 671 1.428 -21.758 -10.163 1.00 0.00 O ATOM 560 CB ARG A 671 1.722 -18.599 -9.960 1.00 0.00 C ATOM 561 CG ARG A 671 1.386 -18.402 -11.429 1.00 0.00 C ATOM 562 CD ARG A 671 2.578 -17.862 -12.205 1.00 0.00 C ATOM 563 NE ARG A 671 2.675 -16.408 -12.116 1.00 0.00 N ATOM 564 CZ ARG A 671 3.605 -15.694 -12.741 1.00 0.00 C ATOM 565 NH1 ARG A 671 4.511 -16.297 -13.497 1.00 0.00 N ATOM 566 NH2 ARG A 671 3.628 -14.374 -12.611 1.00 0.00 N ATOM 0 H ARG A 671 0.913 -18.265 -7.657 1.00 0.00 H new ATOM 0 HA ARG A 671 -0.108 -19.717 -9.817 1.00 0.00 H new ATOM 0 HB2 ARG A 671 1.643 -17.641 -9.446 1.00 0.00 H new ATOM 0 HB3 ARG A 671 2.759 -18.923 -9.873 1.00 0.00 H new ATOM 0 HG2 ARG A 671 1.068 -19.351 -11.861 1.00 0.00 H new ATOM 0 HG3 ARG A 671 0.547 -17.713 -11.522 1.00 0.00 H new ATOM 0 HD2 ARG A 671 3.494 -18.311 -11.821 1.00 0.00 H new ATOM 0 HD3 ARG A 671 2.493 -18.156 -13.251 1.00 0.00 H new ATOM 0 HE ARG A 671 1.992 -15.913 -11.543 1.00 0.00 H new ATOM 0 HH11 ARG A 671 4.495 -17.312 -13.600 1.00 0.00 H new ATOM 0 HH12 ARG A 671 5.224 -15.746 -13.976 1.00 0.00 H new ATOM 0 HH21 ARG A 671 2.931 -13.906 -12.031 1.00 0.00 H new ATOM 0 HH22 ARG A 671 4.342 -13.827 -13.091 1.00 0.00 H new ATOM 580 N HIS A 672 2.193 -21.255 -8.107 1.00 0.00 N ATOM 581 CA HIS A 672 2.898 -22.522 -7.941 1.00 0.00 C ATOM 582 C HIS A 672 1.931 -23.632 -7.540 1.00 0.00 C ATOM 583 O HIS A 672 2.300 -24.807 -7.508 1.00 0.00 O ATOM 584 CB HIS A 672 3.998 -22.383 -6.888 1.00 0.00 C ATOM 585 CG HIS A 672 5.248 -21.744 -7.409 1.00 0.00 C ATOM 586 ND1 HIS A 672 5.248 -20.569 -8.130 1.00 0.00 N ATOM 587 CD2 HIS A 672 6.544 -22.122 -7.307 1.00 0.00 C ATOM 588 CE1 HIS A 672 6.490 -20.253 -8.452 1.00 0.00 C ATOM 589 NE2 HIS A 672 7.295 -21.179 -7.964 1.00 0.00 N ATOM 0 H HIS A 672 2.273 -20.620 -7.312 1.00 0.00 H new ATOM 0 HA HIS A 672 3.351 -22.786 -8.896 1.00 0.00 H new ATOM 0 HB2 HIS A 672 3.619 -21.793 -6.054 1.00 0.00 H new ATOM 0 HB3 HIS A 672 4.241 -23.370 -6.496 1.00 0.00 H new ATOM 0 HD2 HIS A 672 6.917 -23.001 -6.803 1.00 0.00 H new ATOM 0 HE1 HIS A 672 6.795 -19.385 -9.018 1.00 0.00 H new ATOM 0 HE2 HIS A 672 8.310 -21.192 -8.060 1.00 0.00 H new ATOM 597 N ILE A 673 0.695 -23.253 -7.236 1.00 0.00 N ATOM 598 CA ILE A 673 -0.324 -24.217 -6.838 1.00 0.00 C ATOM 599 C ILE A 673 -0.875 -24.964 -8.047 1.00 0.00 C ATOM 600 O ILE A 673 -1.736 -24.455 -8.766 1.00 0.00 O ATOM 601 CB ILE A 673 -1.487 -23.533 -6.096 1.00 0.00 C ATOM 602 CG1 ILE A 673 -0.965 -22.763 -4.882 1.00 0.00 C ATOM 603 CG2 ILE A 673 -2.523 -24.563 -5.672 1.00 0.00 C ATOM 604 CD1 ILE A 673 -2.047 -22.035 -4.116 1.00 0.00 C ATOM 0 H ILE A 673 0.374 -22.285 -7.258 1.00 0.00 H new ATOM 0 HA ILE A 673 0.158 -24.926 -6.165 1.00 0.00 H new ATOM 0 HB ILE A 673 -1.964 -22.824 -6.773 1.00 0.00 H new ATOM 0 HG12 ILE A 673 -0.461 -23.458 -4.211 1.00 0.00 H new ATOM 0 HG13 ILE A 673 -0.218 -22.042 -5.213 1.00 0.00 H new ATOM 0 HG21 ILE A 673 -3.339 -24.064 -5.149 1.00 0.00 H new ATOM 0 HG22 ILE A 673 -2.914 -25.070 -6.554 1.00 0.00 H new ATOM 0 HG23 ILE A 673 -2.060 -25.294 -5.009 1.00 0.00 H new ATOM 0 HD11 ILE A 673 -1.604 -21.511 -3.269 1.00 0.00 H new ATOM 0 HD12 ILE A 673 -2.536 -21.315 -4.772 1.00 0.00 H new ATOM 0 HD13 ILE A 673 -2.783 -22.753 -3.754 1.00 0.00 H new ATOM 616 N VAL A 674 -0.375 -26.176 -8.266 1.00 0.00 N ATOM 617 CA VAL A 674 -0.820 -26.996 -9.387 1.00 0.00 C ATOM 618 C VAL A 674 -0.502 -26.325 -10.719 1.00 0.00 C ATOM 619 O VAL A 674 -1.403 -25.979 -11.482 1.00 0.00 O ATOM 620 CB VAL A 674 -2.333 -27.274 -9.313 1.00 0.00 C ATOM 621 CG1 VAL A 674 -2.740 -28.299 -10.361 1.00 0.00 C ATOM 622 CG2 VAL A 674 -2.721 -27.741 -7.919 1.00 0.00 C ATOM 0 H VAL A 674 0.339 -26.612 -7.682 1.00 0.00 H new ATOM 0 HA VAL A 674 -0.281 -27.941 -9.322 1.00 0.00 H new ATOM 0 HB VAL A 674 -2.866 -26.346 -9.522 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -3.812 -28.482 -10.293 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -2.499 -27.920 -11.354 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -2.201 -29.230 -10.188 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -3.793 -27.933 -7.885 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -2.181 -28.657 -7.679 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -2.467 -26.969 -7.193 1.00 0.00 H new ATOM 632 N ARG A 675 0.786 -26.145 -10.991 1.00 0.00 N ATOM 633 CA ARG A 675 1.224 -25.515 -12.231 1.00 0.00 C ATOM 634 C ARG A 675 1.319 -26.539 -13.357 1.00 0.00 C ATOM 635 O ARG A 675 1.034 -26.233 -14.516 1.00 0.00 O ATOM 636 CB ARG A 675 2.580 -24.834 -12.031 1.00 0.00 C ATOM 637 CG ARG A 675 3.063 -24.069 -13.252 1.00 0.00 C ATOM 638 CD ARG A 675 2.108 -22.944 -13.619 1.00 0.00 C ATOM 639 NE ARG A 675 2.714 -21.992 -14.546 1.00 0.00 N ATOM 640 CZ ARG A 675 2.880 -22.232 -15.842 1.00 0.00 C ATOM 641 NH1 ARG A 675 2.488 -23.388 -16.361 1.00 0.00 N ATOM 642 NH2 ARG A 675 3.440 -21.316 -16.621 1.00 0.00 N ATOM 0 H ARG A 675 1.545 -26.426 -10.370 1.00 0.00 H new ATOM 0 HA ARG A 675 0.485 -24.763 -12.508 1.00 0.00 H new ATOM 0 HB2 ARG A 675 2.512 -24.148 -11.187 1.00 0.00 H new ATOM 0 HB3 ARG A 675 3.321 -25.589 -11.769 1.00 0.00 H new ATOM 0 HG2 ARG A 675 4.053 -23.658 -13.057 1.00 0.00 H new ATOM 0 HG3 ARG A 675 3.162 -24.753 -14.095 1.00 0.00 H new ATOM 0 HD2 ARG A 675 1.208 -23.364 -14.068 1.00 0.00 H new ATOM 0 HD3 ARG A 675 1.798 -22.422 -12.714 1.00 0.00 H new ATOM 0 HE ARG A 675 3.027 -21.094 -14.178 1.00 0.00 H new ATOM 0 HH11 ARG A 675 2.058 -24.095 -15.765 1.00 0.00 H new ATOM 0 HH12 ARG A 675 2.617 -23.570 -17.356 1.00 0.00 H new ATOM 0 HH21 ARG A 675 3.744 -20.426 -16.225 1.00 0.00 H new ATOM 0 HH22 ARG A 675 3.567 -21.501 -17.616 1.00 0.00 H new ATOM 656 N LYS A 676 1.722 -27.757 -13.010 1.00 0.00 N ATOM 657 CA LYS A 676 1.854 -28.828 -13.991 1.00 0.00 C ATOM 658 C LYS A 676 0.509 -29.140 -14.641 1.00 0.00 C ATOM 659 O LYS A 676 -0.523 -29.166 -13.971 1.00 0.00 O ATOM 660 CB LYS A 676 2.416 -30.088 -13.328 1.00 0.00 C ATOM 661 CG LYS A 676 3.934 -30.131 -13.294 1.00 0.00 C ATOM 662 CD LYS A 676 4.492 -29.263 -12.179 1.00 0.00 C ATOM 663 CE LYS A 676 4.374 -29.950 -10.827 1.00 0.00 C ATOM 664 NZ LYS A 676 5.221 -29.291 -9.794 1.00 0.00 N ATOM 0 H LYS A 676 1.963 -28.027 -12.056 1.00 0.00 H new ATOM 0 HA LYS A 676 2.543 -28.494 -14.766 1.00 0.00 H new ATOM 0 HB2 LYS A 676 2.036 -30.152 -12.308 1.00 0.00 H new ATOM 0 HB3 LYS A 676 2.048 -30.964 -13.861 1.00 0.00 H new ATOM 0 HG2 LYS A 676 4.267 -31.160 -13.156 1.00 0.00 H new ATOM 0 HG3 LYS A 676 4.330 -29.793 -14.252 1.00 0.00 H new ATOM 0 HD2 LYS A 676 5.538 -29.035 -12.383 1.00 0.00 H new ATOM 0 HD3 LYS A 676 3.958 -28.313 -12.154 1.00 0.00 H new ATOM 0 HE2 LYS A 676 3.333 -29.939 -10.504 1.00 0.00 H new ATOM 0 HE3 LYS A 676 4.667 -30.995 -10.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 676 5.261 -29.889 -8.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 676 6.182 -29.156 -10.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 676 4.812 -28.367 -9.548 1.00 0.00 H new ATOM 678 N ARG A 677 0.530 -29.378 -15.948 1.00 0.00 N ATOM 679 CA ARG A 677 -0.687 -29.688 -16.687 1.00 0.00 C ATOM 680 C ARG A 677 -0.903 -31.196 -16.771 1.00 0.00 C ATOM 681 O ARG A 677 -1.955 -31.678 -16.353 1.00 0.00 O ATOM 682 CB ARG A 677 -0.620 -29.093 -18.095 1.00 0.00 C ATOM 683 CG ARG A 677 0.616 -29.511 -18.875 1.00 0.00 C ATOM 684 CD ARG A 677 0.569 -29.004 -20.307 1.00 0.00 C ATOM 685 NE ARG A 677 1.105 -27.650 -20.427 1.00 0.00 N ATOM 686 CZ ARG A 677 0.912 -26.874 -21.488 1.00 0.00 C ATOM 687 NH1 ARG A 677 0.199 -27.316 -22.515 1.00 0.00 N ATOM 688 NH2 ARG A 677 1.432 -25.654 -21.522 1.00 0.00 N ATOM 0 H ARG A 677 1.377 -29.362 -16.517 1.00 0.00 H new ATOM 0 HA ARG A 677 -1.528 -29.247 -16.153 1.00 0.00 H new ATOM 0 HB2 ARG A 677 -1.508 -29.394 -18.650 1.00 0.00 H new ATOM 0 HB3 ARG A 677 -0.643 -28.006 -18.022 1.00 0.00 H new ATOM 0 HG2 ARG A 677 1.507 -29.125 -18.380 1.00 0.00 H new ATOM 0 HG3 ARG A 677 0.697 -30.598 -18.875 1.00 0.00 H new ATOM 0 HD2 ARG A 677 1.138 -29.677 -20.949 1.00 0.00 H new ATOM 0 HD3 ARG A 677 -0.461 -29.019 -20.663 1.00 0.00 H new ATOM 0 HE ARG A 677 1.658 -27.280 -19.654 1.00 0.00 H new ATOM 0 HH11 ARG A 677 -0.202 -28.253 -22.491 1.00 0.00 H new ATOM 0 HH12 ARG A 677 0.052 -26.719 -23.329 1.00 0.00 H new ATOM 0 HH21 ARG A 677 1.980 -25.311 -20.733 1.00 0.00 H new ATOM 0 HH22 ARG A 677 1.283 -25.059 -22.337 1.00 0.00 H new TER 702 ARG A 677 ATOM 703 N GLU B 634 -10.284 28.140 -4.780 1.00 0.00 N ATOM 704 CA GLU B 634 -10.073 29.564 -5.012 1.00 0.00 C ATOM 705 C GLU B 634 -9.934 29.858 -6.503 1.00 0.00 C ATOM 706 O GLU B 634 -10.711 30.623 -7.072 1.00 0.00 O ATOM 707 CB GLU B 634 -8.827 30.046 -4.267 1.00 0.00 C ATOM 708 CG GLU B 634 -9.106 30.508 -2.847 1.00 0.00 C ATOM 709 CD GLU B 634 -9.291 29.353 -1.883 1.00 0.00 C ATOM 710 OE1 GLU B 634 -8.306 28.628 -1.632 1.00 0.00 O ATOM 711 OE2 GLU B 634 -10.420 29.173 -1.381 1.00 0.00 O ATOM 0 HA GLU B 634 -10.943 30.100 -4.634 1.00 0.00 H new ATOM 0 HB2 GLU B 634 -8.095 29.238 -4.240 1.00 0.00 H new ATOM 0 HB3 GLU B 634 -8.376 30.867 -4.825 1.00 0.00 H new ATOM 0 HG2 GLU B 634 -8.282 31.134 -2.504 1.00 0.00 H new ATOM 0 HG3 GLU B 634 -10.002 31.129 -2.840 1.00 0.00 H new ATOM 718 N GLY B 635 -8.936 29.243 -7.130 1.00 0.00 N ATOM 719 CA GLY B 635 -8.711 29.451 -8.549 1.00 0.00 C ATOM 720 C GLY B 635 -8.984 28.206 -9.368 1.00 0.00 C ATOM 721 O GLY B 635 -10.109 27.986 -9.820 1.00 0.00 O ATOM 0 H GLY B 635 -8.279 28.605 -6.681 1.00 0.00 H new ATOM 0 HA2 GLY B 635 -9.351 30.261 -8.900 1.00 0.00 H new ATOM 0 HA3 GLY B 635 -7.680 29.768 -8.708 1.00 0.00 H new ATOM 725 N CYS B 636 -7.955 27.389 -9.561 1.00 0.00 N ATOM 726 CA CYS B 636 -8.089 26.159 -10.334 1.00 0.00 C ATOM 727 C CYS B 636 -7.757 24.940 -9.479 1.00 0.00 C ATOM 728 O CYS B 636 -6.707 24.315 -9.627 1.00 0.00 O ATOM 729 CB CYS B 636 -7.175 26.201 -11.560 1.00 0.00 C ATOM 730 SG CYS B 636 -7.690 27.387 -12.824 1.00 0.00 S ATOM 0 H CYS B 636 -7.018 27.556 -9.193 1.00 0.00 H new ATOM 0 HA CYS B 636 -9.125 26.077 -10.664 1.00 0.00 H new ATOM 0 HB2 CYS B 636 -6.163 26.446 -11.237 1.00 0.00 H new ATOM 0 HB3 CYS B 636 -7.135 25.207 -12.005 1.00 0.00 H new ATOM 0 HG CYS B 636 -6.854 27.351 -13.819 1.00 0.00 H new ATOM 736 N PRO B 637 -8.672 24.595 -8.561 1.00 0.00 N ATOM 737 CA PRO B 637 -8.499 23.449 -7.663 1.00 0.00 C ATOM 738 C PRO B 637 -8.590 22.117 -8.399 1.00 0.00 C ATOM 739 O PRO B 637 -8.069 21.102 -7.935 1.00 0.00 O ATOM 740 CB PRO B 637 -9.658 23.595 -6.675 1.00 0.00 C ATOM 741 CG PRO B 637 -10.696 24.363 -7.418 1.00 0.00 C ATOM 742 CD PRO B 637 -9.947 25.295 -8.330 1.00 0.00 C ATOM 0 HA PRO B 637 -7.517 23.445 -7.191 1.00 0.00 H new ATOM 0 HB2 PRO B 637 -10.035 22.622 -6.361 1.00 0.00 H new ATOM 0 HB3 PRO B 637 -9.345 24.122 -5.773 1.00 0.00 H new ATOM 0 HG2 PRO B 637 -11.342 23.695 -7.988 1.00 0.00 H new ATOM 0 HG3 PRO B 637 -11.336 24.918 -6.732 1.00 0.00 H new ATOM 0 HD2 PRO B 637 -10.487 25.465 -9.262 1.00 0.00 H new ATOM 0 HD3 PRO B 637 -9.792 26.270 -7.869 1.00 0.00 H new ATOM 750 N THR B 638 -9.255 22.126 -9.550 1.00 0.00 N ATOM 751 CA THR B 638 -9.415 20.918 -10.350 1.00 0.00 C ATOM 752 C THR B 638 -8.063 20.308 -10.701 1.00 0.00 C ATOM 753 O THR B 638 -7.932 19.090 -10.817 1.00 0.00 O ATOM 754 CB THR B 638 -10.190 21.204 -11.650 1.00 0.00 C ATOM 755 OG1 THR B 638 -9.684 22.390 -12.271 1.00 0.00 O ATOM 756 CG2 THR B 638 -11.677 21.366 -11.369 1.00 0.00 C ATOM 0 H THR B 638 -9.692 22.957 -9.949 1.00 0.00 H new ATOM 0 HA THR B 638 -9.983 20.211 -9.745 1.00 0.00 H new ATOM 0 HB THR B 638 -10.054 20.357 -12.322 1.00 0.00 H new ATOM 0 HG1 THR B 638 -10.181 22.564 -13.098 1.00 0.00 H new ATOM 0 HG21 THR B 638 -12.204 21.567 -12.302 1.00 0.00 H new ATOM 0 HG22 THR B 638 -12.065 20.450 -10.924 1.00 0.00 H new ATOM 0 HG23 THR B 638 -11.829 22.197 -10.680 1.00 0.00 H new ATOM 764 N ASN B 639 -7.059 21.163 -10.869 1.00 0.00 N ATOM 765 CA ASN B 639 -5.716 20.707 -11.207 1.00 0.00 C ATOM 766 C ASN B 639 -4.662 21.525 -10.467 1.00 0.00 C ATOM 767 O ASN B 639 -4.729 22.752 -10.426 1.00 0.00 O ATOM 768 CB ASN B 639 -5.487 20.804 -12.716 1.00 0.00 C ATOM 769 CG ASN B 639 -5.938 19.557 -13.452 1.00 0.00 C ATOM 770 OD1 ASN B 639 -5.597 18.439 -13.067 1.00 0.00 O ATOM 771 ND2 ASN B 639 -6.709 19.745 -14.517 1.00 0.00 N ATOM 0 H ASN B 639 -7.150 22.175 -10.777 1.00 0.00 H new ATOM 0 HA ASN B 639 -5.624 19.665 -10.899 1.00 0.00 H new ATOM 0 HB2 ASN B 639 -6.025 21.668 -13.107 1.00 0.00 H new ATOM 0 HB3 ASN B 639 -4.428 20.973 -12.910 1.00 0.00 H new ATOM 0 HD21 ASN B 639 -7.043 18.944 -15.052 1.00 0.00 H new ATOM 0 HD22 ASN B 639 -6.967 20.691 -14.800 1.00 0.00 H new ATOM 778 N GLY B 640 -3.686 20.834 -9.884 1.00 0.00 N ATOM 779 CA GLY B 640 -2.631 21.512 -9.154 1.00 0.00 C ATOM 780 C GLY B 640 -1.845 20.571 -8.263 1.00 0.00 C ATOM 781 O GLY B 640 -1.956 20.604 -7.038 1.00 0.00 O ATOM 0 H GLY B 640 -3.608 19.817 -9.905 1.00 0.00 H new ATOM 0 HA2 GLY B 640 -1.953 21.989 -9.861 1.00 0.00 H new ATOM 0 HA3 GLY B 640 -3.066 22.305 -8.546 1.00 0.00 H new ATOM 785 N PRO B 641 -1.029 19.706 -8.884 1.00 0.00 N ATOM 786 CA PRO B 641 -0.206 18.734 -8.158 1.00 0.00 C ATOM 787 C PRO B 641 0.927 19.397 -7.384 1.00 0.00 C ATOM 788 O PRO B 641 1.633 20.257 -7.911 1.00 0.00 O ATOM 789 CB PRO B 641 0.355 17.844 -9.270 1.00 0.00 C ATOM 790 CG PRO B 641 0.345 18.705 -10.486 1.00 0.00 C ATOM 791 CD PRO B 641 -0.847 19.610 -10.342 1.00 0.00 C ATOM 0 HA PRO B 641 -0.782 18.191 -7.408 1.00 0.00 H new ATOM 0 HB2 PRO B 641 1.363 17.504 -9.034 1.00 0.00 H new ATOM 0 HB3 PRO B 641 -0.257 16.953 -9.411 1.00 0.00 H new ATOM 0 HG2 PRO B 641 1.266 19.282 -10.563 1.00 0.00 H new ATOM 0 HG3 PRO B 641 0.270 18.102 -11.391 1.00 0.00 H new ATOM 0 HD2 PRO B 641 -0.666 20.587 -10.789 1.00 0.00 H new ATOM 0 HD3 PRO B 641 -1.728 19.194 -10.830 1.00 0.00 H new ATOM 799 N LYS B 642 1.097 18.992 -6.130 1.00 0.00 N ATOM 800 CA LYS B 642 2.146 19.546 -5.281 1.00 0.00 C ATOM 801 C LYS B 642 3.148 18.468 -4.883 1.00 0.00 C ATOM 802 O LYS B 642 2.854 17.612 -4.048 1.00 0.00 O ATOM 803 CB LYS B 642 1.536 20.179 -4.029 1.00 0.00 C ATOM 804 CG LYS B 642 2.390 21.282 -3.428 1.00 0.00 C ATOM 805 CD LYS B 642 1.535 22.367 -2.795 1.00 0.00 C ATOM 806 CE LYS B 642 1.196 22.038 -1.349 1.00 0.00 C ATOM 807 NZ LYS B 642 1.109 23.264 -0.507 1.00 0.00 N ATOM 0 H LYS B 642 0.521 18.281 -5.678 1.00 0.00 H new ATOM 0 HA LYS B 642 2.672 20.314 -5.849 1.00 0.00 H new ATOM 0 HB2 LYS B 642 0.556 20.585 -4.278 1.00 0.00 H new ATOM 0 HB3 LYS B 642 1.379 19.403 -3.280 1.00 0.00 H new ATOM 0 HG2 LYS B 642 3.057 20.859 -2.677 1.00 0.00 H new ATOM 0 HG3 LYS B 642 3.019 21.719 -4.203 1.00 0.00 H new ATOM 0 HD2 LYS B 642 2.063 23.319 -2.838 1.00 0.00 H new ATOM 0 HD3 LYS B 642 0.615 22.487 -3.367 1.00 0.00 H new ATOM 0 HE2 LYS B 642 0.247 21.503 -1.311 1.00 0.00 H new ATOM 0 HE3 LYS B 642 1.955 21.370 -0.941 1.00 0.00 H new ATOM 0 HZ1 LYS B 642 0.876 22.998 0.471 1.00 0.00 H new ATOM 0 HZ2 LYS B 642 2.022 23.761 -0.522 1.00 0.00 H new ATOM 0 HZ3 LYS B 642 0.368 23.890 -0.881 1.00 0.00 H new ATOM 821 N ILE B 643 4.333 18.517 -5.483 1.00 0.00 N ATOM 822 CA ILE B 643 5.379 17.546 -5.187 1.00 0.00 C ATOM 823 C ILE B 643 6.644 18.236 -4.687 1.00 0.00 C ATOM 824 O ILE B 643 7.679 18.249 -5.354 1.00 0.00 O ATOM 825 CB ILE B 643 5.726 16.698 -6.425 1.00 0.00 C ATOM 826 CG1 ILE B 643 5.465 17.494 -7.705 1.00 0.00 C ATOM 827 CG2 ILE B 643 4.921 15.407 -6.425 1.00 0.00 C ATOM 828 CD1 ILE B 643 6.319 18.736 -7.829 1.00 0.00 C ATOM 0 H ILE B 643 4.592 19.218 -6.177 1.00 0.00 H new ATOM 0 HA ILE B 643 4.991 16.892 -4.406 1.00 0.00 H new ATOM 0 HB ILE B 643 6.785 16.443 -6.387 1.00 0.00 H new ATOM 0 HG12 ILE B 643 5.646 16.851 -8.566 1.00 0.00 H new ATOM 0 HG13 ILE B 643 4.414 17.781 -7.737 1.00 0.00 H new ATOM 0 HG21 ILE B 643 5.177 14.818 -7.306 1.00 0.00 H new ATOM 0 HG22 ILE B 643 5.151 14.835 -5.527 1.00 0.00 H new ATOM 0 HG23 ILE B 643 3.857 15.642 -6.442 1.00 0.00 H new ATOM 0 HD11 ILE B 643 6.080 19.250 -8.760 1.00 0.00 H new ATOM 0 HD12 ILE B 643 6.121 19.399 -6.987 1.00 0.00 H new ATOM 0 HD13 ILE B 643 7.372 18.455 -7.829 1.00 0.00 H new ATOM 840 N PRO B 644 6.561 18.823 -3.484 1.00 0.00 N ATOM 841 CA PRO B 644 7.691 19.524 -2.866 1.00 0.00 C ATOM 842 C PRO B 644 8.799 18.569 -2.433 1.00 0.00 C ATOM 843 O PRO B 644 8.831 17.411 -2.849 1.00 0.00 O ATOM 844 CB PRO B 644 7.063 20.202 -1.646 1.00 0.00 C ATOM 845 CG PRO B 644 5.872 19.369 -1.320 1.00 0.00 C ATOM 846 CD PRO B 644 5.359 18.847 -2.634 1.00 0.00 C ATOM 0 HA PRO B 644 8.168 20.218 -3.558 1.00 0.00 H new ATOM 0 HB2 PRO B 644 7.762 20.238 -0.810 1.00 0.00 H new ATOM 0 HB3 PRO B 644 6.778 21.230 -1.868 1.00 0.00 H new ATOM 0 HG2 PRO B 644 6.140 18.550 -0.652 1.00 0.00 H new ATOM 0 HG3 PRO B 644 5.110 19.959 -0.811 1.00 0.00 H new ATOM 0 HD2 PRO B 644 4.921 17.854 -2.529 1.00 0.00 H new ATOM 0 HD3 PRO B 644 4.586 19.494 -3.049 1.00 0.00 H new ATOM 854 N SER B 645 9.705 19.063 -1.596 1.00 0.00 N ATOM 855 CA SER B 645 10.817 18.254 -1.109 1.00 0.00 C ATOM 856 C SER B 645 10.324 17.175 -0.149 1.00 0.00 C ATOM 857 O SER B 645 11.061 16.249 0.192 1.00 0.00 O ATOM 858 CB SER B 645 11.852 19.139 -0.411 1.00 0.00 C ATOM 859 OG SER B 645 11.712 20.493 -0.804 1.00 0.00 O ATOM 0 H SER B 645 9.691 20.019 -1.241 1.00 0.00 H new ATOM 0 HA SER B 645 11.283 17.768 -1.966 1.00 0.00 H new ATOM 0 HB2 SER B 645 11.736 19.057 0.670 1.00 0.00 H new ATOM 0 HB3 SER B 645 12.856 18.789 -0.651 1.00 0.00 H new ATOM 0 HG SER B 645 12.383 21.038 -0.343 1.00 0.00 H new ATOM 865 N ILE B 646 9.074 17.301 0.282 1.00 0.00 N ATOM 866 CA ILE B 646 8.482 16.337 1.201 1.00 0.00 C ATOM 867 C ILE B 646 8.315 14.975 0.536 1.00 0.00 C ATOM 868 O ILE B 646 8.048 13.976 1.203 1.00 0.00 O ATOM 869 CB ILE B 646 7.111 16.817 1.714 1.00 0.00 C ATOM 870 CG1 ILE B 646 7.200 18.269 2.189 1.00 0.00 C ATOM 871 CG2 ILE B 646 6.621 15.915 2.837 1.00 0.00 C ATOM 872 CD1 ILE B 646 8.251 18.493 3.254 1.00 0.00 C ATOM 0 H ILE B 646 8.451 18.061 0.010 1.00 0.00 H new ATOM 0 HA ILE B 646 9.165 16.245 2.046 1.00 0.00 H new ATOM 0 HB ILE B 646 6.394 16.766 0.895 1.00 0.00 H new ATOM 0 HG12 ILE B 646 7.418 18.910 1.334 1.00 0.00 H new ATOM 0 HG13 ILE B 646 6.229 18.576 2.578 1.00 0.00 H new ATOM 0 HG21 ILE B 646 5.651 16.267 3.189 1.00 0.00 H new ATOM 0 HG22 ILE B 646 6.525 14.894 2.468 1.00 0.00 H new ATOM 0 HG23 ILE B 646 7.336 15.937 3.660 1.00 0.00 H new ATOM 0 HD11 ILE B 646 8.258 19.544 3.543 1.00 0.00 H new ATOM 0 HD12 ILE B 646 8.023 17.879 4.125 1.00 0.00 H new ATOM 0 HD13 ILE B 646 9.230 18.218 2.862 1.00 0.00 H new ATOM 884 N ALA B 647 8.475 14.943 -0.783 1.00 0.00 N ATOM 885 CA ALA B 647 8.346 13.703 -1.538 1.00 0.00 C ATOM 886 C ALA B 647 9.214 12.602 -0.938 1.00 0.00 C ATOM 887 O ALA B 647 8.881 11.419 -1.021 1.00 0.00 O ATOM 888 CB ALA B 647 8.714 13.932 -2.997 1.00 0.00 C ATOM 0 H ALA B 647 8.694 15.762 -1.351 1.00 0.00 H new ATOM 0 HA ALA B 647 7.306 13.380 -1.484 1.00 0.00 H new ATOM 0 HB1 ALA B 647 8.613 12.997 -3.549 1.00 0.00 H new ATOM 0 HB2 ALA B 647 8.049 14.681 -3.427 1.00 0.00 H new ATOM 0 HB3 ALA B 647 9.744 14.282 -3.062 1.00 0.00 H new ATOM 894 N THR B 648 10.331 12.997 -0.335 1.00 0.00 N ATOM 895 CA THR B 648 11.248 12.044 0.277 1.00 0.00 C ATOM 896 C THR B 648 10.527 11.160 1.289 1.00 0.00 C ATOM 897 O THR B 648 10.692 9.941 1.290 1.00 0.00 O ATOM 898 CB THR B 648 12.416 12.761 0.980 1.00 0.00 C ATOM 899 OG1 THR B 648 12.843 13.883 0.200 1.00 0.00 O ATOM 900 CG2 THR B 648 13.585 11.810 1.191 1.00 0.00 C ATOM 0 H THR B 648 10.622 13.971 -0.258 1.00 0.00 H new ATOM 0 HA THR B 648 11.643 11.424 -0.528 1.00 0.00 H new ATOM 0 HB THR B 648 12.068 13.107 1.953 1.00 0.00 H new ATOM 0 HG1 THR B 648 12.269 14.653 0.394 1.00 0.00 H new ATOM 0 HG21 THR B 648 14.398 12.338 1.689 1.00 0.00 H new ATOM 0 HG22 THR B 648 13.265 10.971 1.809 1.00 0.00 H new ATOM 0 HG23 THR B 648 13.931 11.439 0.226 1.00 0.00 H new ATOM 908 N GLY B 649 9.727 11.783 2.149 1.00 0.00 N ATOM 909 CA GLY B 649 8.993 11.036 3.154 1.00 0.00 C ATOM 910 C GLY B 649 7.864 10.218 2.558 1.00 0.00 C ATOM 911 O GLY B 649 7.576 9.115 3.023 1.00 0.00 O ATOM 0 H GLY B 649 9.574 12.791 2.168 1.00 0.00 H new ATOM 0 HA2 GLY B 649 9.678 10.373 3.682 1.00 0.00 H new ATOM 0 HA3 GLY B 649 8.586 11.728 3.892 1.00 0.00 H new ATOM 915 N MET B 650 7.223 10.759 1.527 1.00 0.00 N ATOM 916 CA MET B 650 6.119 10.071 0.868 1.00 0.00 C ATOM 917 C MET B 650 6.612 8.821 0.145 1.00 0.00 C ATOM 918 O MET B 650 5.989 7.761 0.222 1.00 0.00 O ATOM 919 CB MET B 650 5.426 11.007 -0.123 1.00 0.00 C ATOM 920 CG MET B 650 4.825 12.242 0.526 1.00 0.00 C ATOM 921 SD MET B 650 3.639 11.838 1.823 1.00 0.00 S ATOM 922 CE MET B 650 2.712 10.522 1.036 1.00 0.00 C ATOM 0 H MET B 650 7.449 11.671 1.130 1.00 0.00 H new ATOM 0 HA MET B 650 5.403 9.769 1.633 1.00 0.00 H new ATOM 0 HB2 MET B 650 6.146 11.318 -0.880 1.00 0.00 H new ATOM 0 HB3 MET B 650 4.638 10.458 -0.639 1.00 0.00 H new ATOM 0 HG2 MET B 650 5.624 12.852 0.947 1.00 0.00 H new ATOM 0 HG3 MET B 650 4.332 12.845 -0.237 1.00 0.00 H new ATOM 0 HE1 MET B 650 1.716 10.466 1.474 1.00 0.00 H new ATOM 0 HE2 MET B 650 2.628 10.724 -0.032 1.00 0.00 H new ATOM 0 HE3 MET B 650 3.228 9.574 1.186 1.00 0.00 H new ATOM 932 N VAL B 651 7.733 8.951 -0.557 1.00 0.00 N ATOM 933 CA VAL B 651 8.309 7.832 -1.292 1.00 0.00 C ATOM 934 C VAL B 651 8.754 6.723 -0.346 1.00 0.00 C ATOM 935 O VAL B 651 8.491 5.545 -0.585 1.00 0.00 O ATOM 936 CB VAL B 651 9.513 8.280 -2.143 1.00 0.00 C ATOM 937 CG1 VAL B 651 10.142 7.087 -2.847 1.00 0.00 C ATOM 938 CG2 VAL B 651 9.089 9.340 -3.149 1.00 0.00 C ATOM 0 H VAL B 651 8.260 9.821 -0.632 1.00 0.00 H new ATOM 0 HA VAL B 651 7.529 7.451 -1.951 1.00 0.00 H new ATOM 0 HB VAL B 651 10.261 8.718 -1.482 1.00 0.00 H new ATOM 0 HG11 VAL B 651 10.991 7.422 -3.443 1.00 0.00 H new ATOM 0 HG12 VAL B 651 10.483 6.365 -2.105 1.00 0.00 H new ATOM 0 HG13 VAL B 651 9.404 6.618 -3.498 1.00 0.00 H new ATOM 0 HG21 VAL B 651 9.952 9.645 -3.742 1.00 0.00 H new ATOM 0 HG22 VAL B 651 8.323 8.931 -3.807 1.00 0.00 H new ATOM 0 HG23 VAL B 651 8.689 10.205 -2.620 1.00 0.00 H new ATOM 948 N GLY B 652 9.431 7.108 0.732 1.00 0.00 N ATOM 949 CA GLY B 652 9.902 6.135 1.700 1.00 0.00 C ATOM 950 C GLY B 652 8.767 5.372 2.354 1.00 0.00 C ATOM 951 O GLY B 652 8.871 4.167 2.582 1.00 0.00 O ATOM 0 H GLY B 652 9.662 8.077 0.952 1.00 0.00 H new ATOM 0 HA2 GLY B 652 10.572 5.431 1.206 1.00 0.00 H new ATOM 0 HA3 GLY B 652 10.484 6.644 2.468 1.00 0.00 H new ATOM 955 N ALA B 653 7.680 6.074 2.657 1.00 0.00 N ATOM 956 CA ALA B 653 6.522 5.456 3.288 1.00 0.00 C ATOM 957 C ALA B 653 5.770 4.566 2.304 1.00 0.00 C ATOM 958 O ALA B 653 5.416 3.430 2.622 1.00 0.00 O ATOM 959 CB ALA B 653 5.595 6.522 3.853 1.00 0.00 C ATOM 0 H ALA B 653 7.578 7.072 2.475 1.00 0.00 H new ATOM 0 HA ALA B 653 6.877 4.830 4.106 1.00 0.00 H new ATOM 0 HB1 ALA B 653 4.734 6.045 4.321 1.00 0.00 H new ATOM 0 HB2 ALA B 653 6.131 7.113 4.596 1.00 0.00 H new ATOM 0 HB3 ALA B 653 5.255 7.173 3.047 1.00 0.00 H new ATOM 965 N LEU B 654 5.527 5.090 1.107 1.00 0.00 N ATOM 966 CA LEU B 654 4.816 4.344 0.075 1.00 0.00 C ATOM 967 C LEU B 654 5.510 3.017 -0.214 1.00 0.00 C ATOM 968 O LEU B 654 4.869 1.967 -0.269 1.00 0.00 O ATOM 969 CB LEU B 654 4.721 5.172 -1.207 1.00 0.00 C ATOM 970 CG LEU B 654 3.801 6.392 -1.151 1.00 0.00 C ATOM 971 CD1 LEU B 654 4.211 7.418 -2.196 1.00 0.00 C ATOM 972 CD2 LEU B 654 2.350 5.976 -1.350 1.00 0.00 C ATOM 0 H LEU B 654 5.812 6.029 0.828 1.00 0.00 H new ATOM 0 HA LEU B 654 3.811 4.135 0.441 1.00 0.00 H new ATOM 0 HB2 LEU B 654 5.723 5.509 -1.473 1.00 0.00 H new ATOM 0 HB3 LEU B 654 4.380 4.521 -2.012 1.00 0.00 H new ATOM 0 HG LEU B 654 3.895 6.849 -0.166 1.00 0.00 H new ATOM 0 HD11 LEU B 654 3.545 8.279 -2.141 1.00 0.00 H new ATOM 0 HD12 LEU B 654 5.236 7.739 -2.008 1.00 0.00 H new ATOM 0 HD13 LEU B 654 4.147 6.972 -3.189 1.00 0.00 H new ATOM 0 HD21 LEU B 654 1.710 6.857 -1.307 1.00 0.00 H new ATOM 0 HD22 LEU B 654 2.240 5.494 -2.321 1.00 0.00 H new ATOM 0 HD23 LEU B 654 2.060 5.278 -0.564 1.00 0.00 H new ATOM 984 N LEU B 655 6.825 3.071 -0.395 1.00 0.00 N ATOM 985 CA LEU B 655 7.609 1.872 -0.675 1.00 0.00 C ATOM 986 C LEU B 655 7.535 0.889 0.488 1.00 0.00 C ATOM 987 O LEU B 655 7.317 -0.307 0.291 1.00 0.00 O ATOM 988 CB LEU B 655 9.066 2.245 -0.952 1.00 0.00 C ATOM 989 CG LEU B 655 9.341 2.930 -2.291 1.00 0.00 C ATOM 990 CD1 LEU B 655 10.808 3.318 -2.401 1.00 0.00 C ATOM 991 CD2 LEU B 655 8.940 2.023 -3.446 1.00 0.00 C ATOM 0 H LEU B 655 7.371 3.932 -0.353 1.00 0.00 H new ATOM 0 HA LEU B 655 7.190 1.391 -1.559 1.00 0.00 H new ATOM 0 HB2 LEU B 655 9.410 2.902 -0.153 1.00 0.00 H new ATOM 0 HB3 LEU B 655 9.668 1.338 -0.900 1.00 0.00 H new ATOM 0 HG LEU B 655 8.741 3.839 -2.343 1.00 0.00 H new ATOM 0 HD11 LEU B 655 10.985 3.804 -3.360 1.00 0.00 H new ATOM 0 HD12 LEU B 655 11.064 4.004 -1.594 1.00 0.00 H new ATOM 0 HD13 LEU B 655 11.427 2.424 -2.328 1.00 0.00 H new ATOM 0 HD21 LEU B 655 9.143 2.526 -4.391 1.00 0.00 H new ATOM 0 HD22 LEU B 655 9.513 1.097 -3.398 1.00 0.00 H new ATOM 0 HD23 LEU B 655 7.876 1.795 -3.377 1.00 0.00 H new ATOM 1003 N LEU B 656 7.717 1.400 1.701 1.00 0.00 N ATOM 1004 CA LEU B 656 7.669 0.568 2.898 1.00 0.00 C ATOM 1005 C LEU B 656 6.291 -0.064 3.067 1.00 0.00 C ATOM 1006 O LEU B 656 6.172 -1.221 3.471 1.00 0.00 O ATOM 1007 CB LEU B 656 8.017 1.398 4.134 1.00 0.00 C ATOM 1008 CG LEU B 656 9.506 1.654 4.373 1.00 0.00 C ATOM 1009 CD1 LEU B 656 9.699 2.717 5.443 1.00 0.00 C ATOM 1010 CD2 LEU B 656 10.213 0.365 4.765 1.00 0.00 C ATOM 0 H LEU B 656 7.899 2.387 1.881 1.00 0.00 H new ATOM 0 HA LEU B 656 8.403 -0.230 2.786 1.00 0.00 H new ATOM 0 HB2 LEU B 656 7.511 2.360 4.055 1.00 0.00 H new ATOM 0 HB3 LEU B 656 7.610 0.895 5.011 1.00 0.00 H new ATOM 0 HG LEU B 656 9.946 2.018 3.445 1.00 0.00 H new ATOM 0 HD11 LEU B 656 10.764 2.886 5.600 1.00 0.00 H new ATOM 0 HD12 LEU B 656 9.227 3.646 5.122 1.00 0.00 H new ATOM 0 HD13 LEU B 656 9.244 2.382 6.375 1.00 0.00 H new ATOM 0 HD21 LEU B 656 11.271 0.566 4.931 1.00 0.00 H new ATOM 0 HD22 LEU B 656 9.771 -0.029 5.680 1.00 0.00 H new ATOM 0 HD23 LEU B 656 10.104 -0.367 3.965 1.00 0.00 H new ATOM 1022 N LEU B 657 5.252 0.702 2.753 1.00 0.00 N ATOM 1023 CA LEU B 657 3.881 0.217 2.868 1.00 0.00 C ATOM 1024 C LEU B 657 3.665 -1.016 1.997 1.00 0.00 C ATOM 1025 O LEU B 657 3.182 -2.046 2.469 1.00 0.00 O ATOM 1026 CB LEU B 657 2.895 1.316 2.468 1.00 0.00 C ATOM 1027 CG LEU B 657 2.595 2.369 3.536 1.00 0.00 C ATOM 1028 CD1 LEU B 657 1.689 3.454 2.976 1.00 0.00 C ATOM 1029 CD2 LEU B 657 1.961 1.722 4.759 1.00 0.00 C ATOM 0 H LEU B 657 5.333 1.662 2.417 1.00 0.00 H new ATOM 0 HA LEU B 657 3.706 -0.059 3.908 1.00 0.00 H new ATOM 0 HB2 LEU B 657 3.285 1.823 1.586 1.00 0.00 H new ATOM 0 HB3 LEU B 657 1.956 0.846 2.176 1.00 0.00 H new ATOM 0 HG LEU B 657 3.535 2.830 3.839 1.00 0.00 H new ATOM 0 HD11 LEU B 657 1.486 4.194 3.750 1.00 0.00 H new ATOM 0 HD12 LEU B 657 2.180 3.937 2.131 1.00 0.00 H new ATOM 0 HD13 LEU B 657 0.751 3.009 2.645 1.00 0.00 H new ATOM 0 HD21 LEU B 657 1.754 2.486 5.509 1.00 0.00 H new ATOM 0 HD22 LEU B 657 1.030 1.235 4.471 1.00 0.00 H new ATOM 0 HD23 LEU B 657 2.645 0.982 5.174 1.00 0.00 H new ATOM 1041 N LEU B 658 4.028 -0.906 0.723 1.00 0.00 N ATOM 1042 CA LEU B 658 3.876 -2.013 -0.214 1.00 0.00 C ATOM 1043 C LEU B 658 4.630 -3.247 0.273 1.00 0.00 C ATOM 1044 O LEU B 658 4.124 -4.366 0.197 1.00 0.00 O ATOM 1045 CB LEU B 658 4.382 -1.607 -1.600 1.00 0.00 C ATOM 1046 CG LEU B 658 3.416 -0.784 -2.452 1.00 0.00 C ATOM 1047 CD1 LEU B 658 4.164 -0.067 -3.566 1.00 0.00 C ATOM 1048 CD2 LEU B 658 2.322 -1.672 -3.027 1.00 0.00 C ATOM 0 H LEU B 658 4.430 -0.061 0.316 1.00 0.00 H new ATOM 0 HA LEU B 658 2.816 -2.259 -0.278 1.00 0.00 H new ATOM 0 HB2 LEU B 658 5.302 -1.036 -1.476 1.00 0.00 H new ATOM 0 HB3 LEU B 658 4.640 -2.512 -2.150 1.00 0.00 H new ATOM 0 HG LEU B 658 2.949 -0.033 -1.814 1.00 0.00 H new ATOM 0 HD11 LEU B 658 3.460 0.514 -4.162 1.00 0.00 H new ATOM 0 HD12 LEU B 658 4.909 0.600 -3.133 1.00 0.00 H new ATOM 0 HD13 LEU B 658 4.659 -0.800 -4.202 1.00 0.00 H new ATOM 0 HD21 LEU B 658 1.644 -1.069 -3.631 1.00 0.00 H new ATOM 0 HD22 LEU B 658 2.771 -2.446 -3.650 1.00 0.00 H new ATOM 0 HD23 LEU B 658 1.766 -2.138 -2.213 1.00 0.00 H new ATOM 1060 N VAL B 659 5.841 -3.033 0.777 1.00 0.00 N ATOM 1061 CA VAL B 659 6.664 -4.127 1.280 1.00 0.00 C ATOM 1062 C VAL B 659 6.015 -4.789 2.490 1.00 0.00 C ATOM 1063 O VAL B 659 6.107 -6.004 2.670 1.00 0.00 O ATOM 1064 CB VAL B 659 8.071 -3.637 1.669 1.00 0.00 C ATOM 1065 CG1 VAL B 659 8.927 -4.800 2.148 1.00 0.00 C ATOM 1066 CG2 VAL B 659 8.731 -2.927 0.497 1.00 0.00 C ATOM 0 H VAL B 659 6.274 -2.112 0.848 1.00 0.00 H new ATOM 0 HA VAL B 659 6.752 -4.855 0.474 1.00 0.00 H new ATOM 0 HB VAL B 659 7.975 -2.925 2.488 1.00 0.00 H new ATOM 0 HG11 VAL B 659 9.918 -4.435 2.419 1.00 0.00 H new ATOM 0 HG12 VAL B 659 8.460 -5.261 3.018 1.00 0.00 H new ATOM 0 HG13 VAL B 659 9.017 -5.538 1.351 1.00 0.00 H new ATOM 0 HG21 VAL B 659 9.724 -2.587 0.790 1.00 0.00 H new ATOM 0 HG22 VAL B 659 8.816 -3.615 -0.344 1.00 0.00 H new ATOM 0 HG23 VAL B 659 8.126 -2.069 0.204 1.00 0.00 H new ATOM 1076 N VAL B 660 5.359 -3.983 3.319 1.00 0.00 N ATOM 1077 CA VAL B 660 4.693 -4.492 4.512 1.00 0.00 C ATOM 1078 C VAL B 660 3.528 -5.404 4.145 1.00 0.00 C ATOM 1079 O VAL B 660 3.329 -6.451 4.760 1.00 0.00 O ATOM 1080 CB VAL B 660 4.173 -3.343 5.396 1.00 0.00 C ATOM 1081 CG1 VAL B 660 3.328 -3.888 6.538 1.00 0.00 C ATOM 1082 CG2 VAL B 660 5.332 -2.514 5.929 1.00 0.00 C ATOM 0 H VAL B 660 5.275 -2.975 3.186 1.00 0.00 H new ATOM 0 HA VAL B 660 5.435 -5.063 5.070 1.00 0.00 H new ATOM 0 HB VAL B 660 3.543 -2.695 4.786 1.00 0.00 H new ATOM 0 HG11 VAL B 660 2.969 -3.062 7.152 1.00 0.00 H new ATOM 0 HG12 VAL B 660 2.477 -4.435 6.132 1.00 0.00 H new ATOM 0 HG13 VAL B 660 3.932 -4.559 7.149 1.00 0.00 H new ATOM 0 HG21 VAL B 660 4.946 -1.707 6.551 1.00 0.00 H new ATOM 0 HG22 VAL B 660 5.990 -3.148 6.524 1.00 0.00 H new ATOM 0 HG23 VAL B 660 5.892 -2.092 5.094 1.00 0.00 H new ATOM 1092 N ALA B 661 2.761 -4.998 3.138 1.00 0.00 N ATOM 1093 CA ALA B 661 1.616 -5.781 2.687 1.00 0.00 C ATOM 1094 C ALA B 661 2.057 -7.136 2.145 1.00 0.00 C ATOM 1095 O ALA B 661 1.480 -8.170 2.484 1.00 0.00 O ATOM 1096 CB ALA B 661 0.838 -5.014 1.629 1.00 0.00 C ATOM 0 H ALA B 661 2.911 -4.133 2.620 1.00 0.00 H new ATOM 0 HA ALA B 661 0.966 -5.957 3.544 1.00 0.00 H new ATOM 0 HB1 ALA B 661 -0.014 -5.609 1.301 1.00 0.00 H new ATOM 0 HB2 ALA B 661 0.483 -4.073 2.049 1.00 0.00 H new ATOM 0 HB3 ALA B 661 1.487 -4.809 0.778 1.00 0.00 H new ATOM 1102 N LEU B 662 3.082 -7.124 1.300 1.00 0.00 N ATOM 1103 CA LEU B 662 3.600 -8.354 0.709 1.00 0.00 C ATOM 1104 C LEU B 662 4.043 -9.333 1.791 1.00 0.00 C ATOM 1105 O LEU B 662 3.680 -10.508 1.765 1.00 0.00 O ATOM 1106 CB LEU B 662 4.773 -8.040 -0.222 1.00 0.00 C ATOM 1107 CG LEU B 662 4.405 -7.519 -1.612 1.00 0.00 C ATOM 1108 CD1 LEU B 662 5.606 -6.855 -2.268 1.00 0.00 C ATOM 1109 CD2 LEU B 662 3.878 -8.650 -2.483 1.00 0.00 C ATOM 0 H LEU B 662 3.571 -6.277 1.009 1.00 0.00 H new ATOM 0 HA LEU B 662 2.799 -8.817 0.132 1.00 0.00 H new ATOM 0 HB2 LEU B 662 5.409 -7.301 0.265 1.00 0.00 H new ATOM 0 HB3 LEU B 662 5.369 -8.945 -0.341 1.00 0.00 H new ATOM 0 HG LEU B 662 3.617 -6.773 -1.503 1.00 0.00 H new ATOM 0 HD11 LEU B 662 5.325 -6.490 -3.256 1.00 0.00 H new ATOM 0 HD12 LEU B 662 5.940 -6.019 -1.654 1.00 0.00 H new ATOM 0 HD13 LEU B 662 6.415 -7.580 -2.365 1.00 0.00 H new ATOM 0 HD21 LEU B 662 3.621 -8.261 -3.468 1.00 0.00 H new ATOM 0 HD22 LEU B 662 4.644 -9.418 -2.585 1.00 0.00 H new ATOM 0 HD23 LEU B 662 2.990 -9.082 -2.021 1.00 0.00 H new ATOM 1121 N GLY B 663 4.830 -8.840 2.743 1.00 0.00 N ATOM 1122 CA GLY B 663 5.307 -9.684 3.822 1.00 0.00 C ATOM 1123 C GLY B 663 4.176 -10.328 4.599 1.00 0.00 C ATOM 1124 O GLY B 663 4.171 -11.541 4.810 1.00 0.00 O ATOM 0 H GLY B 663 5.145 -7.871 2.786 1.00 0.00 H new ATOM 0 HA2 GLY B 663 5.951 -10.462 3.413 1.00 0.00 H new ATOM 0 HA3 GLY B 663 5.918 -9.089 4.501 1.00 0.00 H new ATOM 1128 N ILE B 664 3.216 -9.515 5.026 1.00 0.00 N ATOM 1129 CA ILE B 664 2.075 -10.013 5.785 1.00 0.00 C ATOM 1130 C ILE B 664 1.316 -11.078 5.000 1.00 0.00 C ATOM 1131 O ILE B 664 0.886 -12.086 5.557 1.00 0.00 O ATOM 1132 CB ILE B 664 1.106 -8.875 6.155 1.00 0.00 C ATOM 1133 CG1 ILE B 664 1.829 -7.807 6.977 1.00 0.00 C ATOM 1134 CG2 ILE B 664 -0.087 -9.425 6.924 1.00 0.00 C ATOM 1135 CD1 ILE B 664 1.178 -6.444 6.904 1.00 0.00 C ATOM 0 H ILE B 664 3.205 -8.509 4.860 1.00 0.00 H new ATOM 0 HA ILE B 664 2.471 -10.453 6.700 1.00 0.00 H new ATOM 0 HB ILE B 664 0.742 -8.415 5.237 1.00 0.00 H new ATOM 0 HG12 ILE B 664 1.868 -8.127 8.018 1.00 0.00 H new ATOM 0 HG13 ILE B 664 2.859 -7.728 6.629 1.00 0.00 H new ATOM 0 HG21 ILE B 664 -0.763 -8.609 7.179 1.00 0.00 H new ATOM 0 HG22 ILE B 664 -0.613 -10.153 6.307 1.00 0.00 H new ATOM 0 HG23 ILE B 664 0.260 -9.907 7.838 1.00 0.00 H new ATOM 0 HD11 ILE B 664 1.744 -5.737 7.511 1.00 0.00 H new ATOM 0 HD12 ILE B 664 1.163 -6.103 5.869 1.00 0.00 H new ATOM 0 HD13 ILE B 664 0.157 -6.508 7.280 1.00 0.00 H new ATOM 1147 N GLY B 665 1.157 -10.846 3.700 1.00 0.00 N ATOM 1148 CA GLY B 665 0.451 -11.794 2.859 1.00 0.00 C ATOM 1149 C GLY B 665 1.095 -13.167 2.865 1.00 0.00 C ATOM 1150 O GLY B 665 0.426 -14.173 3.102 1.00 0.00 O ATOM 0 H GLY B 665 1.505 -10.019 3.215 1.00 0.00 H new ATOM 0 HA2 GLY B 665 -0.581 -11.879 3.200 1.00 0.00 H new ATOM 0 HA3 GLY B 665 0.419 -11.415 1.837 1.00 0.00 H new ATOM 1154 N LEU B 666 2.396 -13.209 2.604 1.00 0.00 N ATOM 1155 CA LEU B 666 3.131 -14.469 2.579 1.00 0.00 C ATOM 1156 C LEU B 666 3.140 -15.121 3.958 1.00 0.00 C ATOM 1157 O LEU B 666 3.147 -16.347 4.076 1.00 0.00 O ATOM 1158 CB LEU B 666 4.566 -14.236 2.103 1.00 0.00 C ATOM 1159 CG LEU B 666 4.721 -13.509 0.767 1.00 0.00 C ATOM 1160 CD1 LEU B 666 6.170 -13.542 0.306 1.00 0.00 C ATOM 1161 CD2 LEU B 666 3.810 -14.127 -0.284 1.00 0.00 C ATOM 0 H LEU B 666 2.964 -12.385 2.407 1.00 0.00 H new ATOM 0 HA LEU B 666 2.629 -15.141 1.883 1.00 0.00 H new ATOM 0 HB2 LEU B 666 5.093 -13.665 2.868 1.00 0.00 H new ATOM 0 HB3 LEU B 666 5.064 -15.203 2.027 1.00 0.00 H new ATOM 0 HG LEU B 666 4.430 -12.468 0.905 1.00 0.00 H new ATOM 0 HD11 LEU B 666 6.261 -13.020 -0.646 1.00 0.00 H new ATOM 0 HD12 LEU B 666 6.800 -13.053 1.049 1.00 0.00 H new ATOM 0 HD13 LEU B 666 6.490 -14.577 0.184 1.00 0.00 H new ATOM 0 HD21 LEU B 666 3.933 -13.598 -1.229 1.00 0.00 H new ATOM 0 HD22 LEU B 666 4.071 -15.177 -0.420 1.00 0.00 H new ATOM 0 HD23 LEU B 666 2.773 -14.050 0.043 1.00 0.00 H new ATOM 1173 N PHE B 667 3.137 -14.294 4.998 1.00 0.00 N ATOM 1174 CA PHE B 667 3.144 -14.791 6.369 1.00 0.00 C ATOM 1175 C PHE B 667 1.793 -15.399 6.734 1.00 0.00 C ATOM 1176 O PHE B 667 1.719 -16.528 7.218 1.00 0.00 O ATOM 1177 CB PHE B 667 3.486 -13.660 7.342 1.00 0.00 C ATOM 1178 CG PHE B 667 3.212 -14.002 8.778 1.00 0.00 C ATOM 1179 CD1 PHE B 667 1.973 -13.742 9.341 1.00 0.00 C ATOM 1180 CD2 PHE B 667 4.193 -14.582 9.566 1.00 0.00 C ATOM 1181 CE1 PHE B 667 1.716 -14.055 10.663 1.00 0.00 C ATOM 1182 CE2 PHE B 667 3.943 -14.897 10.888 1.00 0.00 C ATOM 1183 CZ PHE B 667 2.703 -14.633 11.438 1.00 0.00 C ATOM 0 H PHE B 667 3.130 -13.277 4.918 1.00 0.00 H new ATOM 0 HA PHE B 667 3.905 -15.568 6.443 1.00 0.00 H new ATOM 0 HB2 PHE B 667 4.540 -13.403 7.233 1.00 0.00 H new ATOM 0 HB3 PHE B 667 2.912 -12.773 7.072 1.00 0.00 H new ATOM 0 HD1 PHE B 667 1.198 -13.289 8.740 1.00 0.00 H new ATOM 0 HD2 PHE B 667 5.164 -14.790 9.142 1.00 0.00 H new ATOM 0 HE1 PHE B 667 0.745 -13.848 11.089 1.00 0.00 H new ATOM 0 HE2 PHE B 667 4.716 -15.349 11.491 1.00 0.00 H new ATOM 0 HZ PHE B 667 2.506 -14.878 12.471 1.00 0.00 H new ATOM 1193 N MET B 668 0.727 -14.641 6.498 1.00 0.00 N ATOM 1194 CA MET B 668 -0.622 -15.105 6.801 1.00 0.00 C ATOM 1195 C MET B 668 -0.935 -16.395 6.050 1.00 0.00 C ATOM 1196 O MET B 668 -1.692 -17.238 6.532 1.00 0.00 O ATOM 1197 CB MET B 668 -1.648 -14.029 6.439 1.00 0.00 C ATOM 1198 CG MET B 668 -1.622 -12.828 7.369 1.00 0.00 C ATOM 1199 SD MET B 668 -2.792 -11.545 6.881 1.00 0.00 S ATOM 1200 CE MET B 668 -2.246 -11.208 5.208 1.00 0.00 C ATOM 0 H MET B 668 0.771 -13.704 6.098 1.00 0.00 H new ATOM 0 HA MET B 668 -0.678 -15.305 7.871 1.00 0.00 H new ATOM 0 HB2 MET B 668 -1.465 -13.692 5.419 1.00 0.00 H new ATOM 0 HB3 MET B 668 -2.645 -14.469 6.455 1.00 0.00 H new ATOM 0 HG2 MET B 668 -1.849 -13.154 8.384 1.00 0.00 H new ATOM 0 HG3 MET B 668 -0.616 -12.409 7.387 1.00 0.00 H new ATOM 0 HE1 MET B 668 -2.272 -10.134 5.026 1.00 0.00 H new ATOM 0 HE2 MET B 668 -1.228 -11.574 5.077 1.00 0.00 H new ATOM 0 HE3 MET B 668 -2.906 -11.711 4.502 1.00 0.00 H new ATOM 1210 N ARG B 669 -0.348 -16.543 4.866 1.00 0.00 N ATOM 1211 CA ARG B 669 -0.566 -17.730 4.048 1.00 0.00 C ATOM 1212 C ARG B 669 -0.205 -18.996 4.820 1.00 0.00 C ATOM 1213 O ARG B 669 -0.718 -20.078 4.533 1.00 0.00 O ATOM 1214 CB ARG B 669 0.262 -17.650 2.764 1.00 0.00 C ATOM 1215 CG ARG B 669 -0.373 -16.790 1.683 1.00 0.00 C ATOM 1216 CD ARG B 669 -0.805 -17.627 0.489 1.00 0.00 C ATOM 1217 NE ARG B 669 0.295 -18.424 -0.048 1.00 0.00 N ATOM 1218 CZ ARG B 669 0.120 -19.500 -0.807 1.00 0.00 C ATOM 1219 NH1 ARG B 669 -1.103 -19.905 -1.118 1.00 0.00 N ATOM 1220 NH2 ARG B 669 1.171 -20.172 -1.259 1.00 0.00 N ATOM 0 H ARG B 669 0.282 -15.856 4.452 1.00 0.00 H new ATOM 0 HA ARG B 669 -1.624 -17.772 3.788 1.00 0.00 H new ATOM 0 HB2 ARG B 669 1.248 -17.251 3.002 1.00 0.00 H new ATOM 0 HB3 ARG B 669 0.411 -18.657 2.374 1.00 0.00 H new ATOM 0 HG2 ARG B 669 -1.236 -16.266 2.093 1.00 0.00 H new ATOM 0 HG3 ARG B 669 0.337 -16.029 1.358 1.00 0.00 H new ATOM 0 HD2 ARG B 669 -1.620 -18.287 0.785 1.00 0.00 H new ATOM 0 HD3 ARG B 669 -1.193 -16.972 -0.291 1.00 0.00 H new ATOM 0 HE ARG B 669 1.249 -18.139 0.172 1.00 0.00 H new ATOM 0 HH11 ARG B 669 -1.914 -19.390 -0.774 1.00 0.00 H new ATOM 0 HH12 ARG B 669 -1.234 -20.732 -1.701 1.00 0.00 H new ATOM 0 HH21 ARG B 669 2.114 -19.862 -1.024 1.00 0.00 H new ATOM 0 HH22 ARG B 669 1.036 -20.998 -1.842 1.00 0.00 H new ATOM 1234 N ARG B 670 0.681 -18.853 5.801 1.00 0.00 N ATOM 1235 CA ARG B 670 1.111 -19.984 6.613 1.00 0.00 C ATOM 1236 C ARG B 670 1.552 -21.149 5.732 1.00 0.00 C ATOM 1237 O ARG B 670 1.179 -22.298 5.971 1.00 0.00 O ATOM 1238 CB ARG B 670 -0.019 -20.433 7.541 1.00 0.00 C ATOM 1239 CG ARG B 670 -0.267 -19.483 8.702 1.00 0.00 C ATOM 1240 CD ARG B 670 0.597 -19.834 9.903 1.00 0.00 C ATOM 1241 NE ARG B 670 1.922 -19.224 9.822 1.00 0.00 N ATOM 1242 CZ ARG B 670 2.880 -19.425 10.719 1.00 0.00 C ATOM 1243 NH1 ARG B 670 2.663 -20.218 11.759 1.00 0.00 N ATOM 1244 NH2 ARG B 670 4.059 -18.834 10.576 1.00 0.00 N ATOM 0 H ARG B 670 1.115 -17.965 6.052 1.00 0.00 H new ATOM 0 HA ARG B 670 1.961 -19.663 7.215 1.00 0.00 H new ATOM 0 HB2 ARG B 670 -0.937 -20.532 6.961 1.00 0.00 H new ATOM 0 HB3 ARG B 670 0.217 -21.421 7.935 1.00 0.00 H new ATOM 0 HG2 ARG B 670 -0.057 -18.460 8.388 1.00 0.00 H new ATOM 0 HG3 ARG B 670 -1.319 -19.520 8.986 1.00 0.00 H new ATOM 0 HD2 ARG B 670 0.101 -19.503 10.815 1.00 0.00 H new ATOM 0 HD3 ARG B 670 0.700 -20.917 9.971 1.00 0.00 H new ATOM 0 HE ARG B 670 2.122 -18.610 9.033 1.00 0.00 H new ATOM 0 HH11 ARG B 670 1.758 -20.675 11.872 1.00 0.00 H new ATOM 0 HH12 ARG B 670 3.401 -20.371 12.447 1.00 0.00 H new ATOM 0 HH21 ARG B 670 4.230 -18.224 9.776 1.00 0.00 H new ATOM 0 HH22 ARG B 670 4.794 -18.989 11.266 1.00 0.00 H new ATOM 1258 N ARG B 671 2.349 -20.845 4.712 1.00 0.00 N ATOM 1259 CA ARG B 671 2.839 -21.866 3.794 1.00 0.00 C ATOM 1260 C ARG B 671 4.269 -21.562 3.356 1.00 0.00 C ATOM 1261 O ARG B 671 4.583 -20.438 2.961 1.00 0.00 O ATOM 1262 CB ARG B 671 1.928 -21.960 2.569 1.00 0.00 C ATOM 1263 CG ARG B 671 0.638 -22.723 2.826 1.00 0.00 C ATOM 1264 CD ARG B 671 0.010 -23.208 1.529 1.00 0.00 C ATOM 1265 NE ARG B 671 0.713 -24.365 0.980 1.00 0.00 N ATOM 1266 CZ ARG B 671 0.586 -25.597 1.458 1.00 0.00 C ATOM 1267 NH1 ARG B 671 -0.213 -25.833 2.490 1.00 0.00 N ATOM 1268 NH2 ARG B 671 1.259 -26.598 0.904 1.00 0.00 N ATOM 0 H ARG B 671 2.669 -19.900 4.501 1.00 0.00 H new ATOM 0 HA ARG B 671 2.833 -22.822 4.317 1.00 0.00 H new ATOM 0 HB2 ARG B 671 1.683 -20.953 2.231 1.00 0.00 H new ATOM 0 HB3 ARG B 671 2.472 -22.445 1.759 1.00 0.00 H new ATOM 0 HG2 ARG B 671 0.841 -23.575 3.474 1.00 0.00 H new ATOM 0 HG3 ARG B 671 -0.066 -22.081 3.355 1.00 0.00 H new ATOM 0 HD2 ARG B 671 -1.033 -23.468 1.707 1.00 0.00 H new ATOM 0 HD3 ARG B 671 0.017 -22.399 0.798 1.00 0.00 H new ATOM 0 HE ARG B 671 1.336 -24.218 0.186 1.00 0.00 H new ATOM 0 HH11 ARG B 671 -0.732 -25.067 2.919 1.00 0.00 H new ATOM 0 HH12 ARG B 671 -0.308 -26.781 2.855 1.00 0.00 H new ATOM 0 HH21 ARG B 671 1.875 -26.421 0.110 1.00 0.00 H new ATOM 0 HH22 ARG B 671 1.161 -27.544 1.272 1.00 0.00 H new ATOM 1282 N HIS B 672 5.132 -22.570 3.429 1.00 0.00 N ATOM 1283 CA HIS B 672 6.528 -22.410 3.040 1.00 0.00 C ATOM 1284 C HIS B 672 6.849 -23.252 1.808 1.00 0.00 C ATOM 1285 O HIS B 672 7.589 -22.819 0.924 1.00 0.00 O ATOM 1286 CB HIS B 672 7.450 -22.804 4.195 1.00 0.00 C ATOM 1287 CG HIS B 672 8.895 -22.513 3.934 1.00 0.00 C ATOM 1288 ND1 HIS B 672 9.919 -23.323 4.378 1.00 0.00 N ATOM 1289 CD2 HIS B 672 9.487 -21.493 3.268 1.00 0.00 C ATOM 1290 CE1 HIS B 672 11.077 -22.814 3.999 1.00 0.00 C ATOM 1291 NE2 HIS B 672 10.843 -21.703 3.323 1.00 0.00 N ATOM 0 H HIS B 672 4.889 -23.506 3.754 1.00 0.00 H new ATOM 0 HA HIS B 672 6.693 -21.361 2.795 1.00 0.00 H new ATOM 0 HB2 HIS B 672 7.138 -22.274 5.095 1.00 0.00 H new ATOM 0 HB3 HIS B 672 7.333 -23.869 4.395 1.00 0.00 H new ATOM 0 HD2 HIS B 672 8.986 -20.668 2.784 1.00 0.00 H new ATOM 0 HE1 HIS B 672 12.050 -23.234 4.206 1.00 0.00 H new ATOM 0 HE2 HIS B 672 11.554 -21.100 2.909 1.00 0.00 H new ATOM 1299 N ILE B 673 6.288 -24.455 1.757 1.00 0.00 N ATOM 1300 CA ILE B 673 6.514 -25.356 0.634 1.00 0.00 C ATOM 1301 C ILE B 673 5.231 -25.577 -0.160 1.00 0.00 C ATOM 1302 O ILE B 673 4.292 -26.212 0.319 1.00 0.00 O ATOM 1303 CB ILE B 673 7.053 -26.720 1.106 1.00 0.00 C ATOM 1304 CG1 ILE B 673 6.288 -27.194 2.344 1.00 0.00 C ATOM 1305 CG2 ILE B 673 8.542 -26.627 1.400 1.00 0.00 C ATOM 1306 CD1 ILE B 673 6.896 -26.723 3.646 1.00 0.00 C ATOM 0 H ILE B 673 5.674 -24.828 2.480 1.00 0.00 H new ATOM 0 HA ILE B 673 7.258 -24.882 -0.006 1.00 0.00 H new ATOM 0 HB ILE B 673 6.905 -27.449 0.309 1.00 0.00 H new ATOM 0 HG12 ILE B 673 5.259 -26.839 2.283 1.00 0.00 H new ATOM 0 HG13 ILE B 673 6.250 -28.283 2.343 1.00 0.00 H new ATOM 0 HG21 ILE B 673 8.909 -27.598 1.732 1.00 0.00 H new ATOM 0 HG22 ILE B 673 9.073 -26.328 0.496 1.00 0.00 H new ATOM 0 HG23 ILE B 673 8.713 -25.888 2.182 1.00 0.00 H new ATOM 0 HD11 ILE B 673 6.302 -27.096 4.481 1.00 0.00 H new ATOM 0 HD12 ILE B 673 7.915 -27.100 3.729 1.00 0.00 H new ATOM 0 HD13 ILE B 673 6.909 -25.633 3.668 1.00 0.00 H new ATOM 1318 N VAL B 674 5.199 -25.049 -1.380 1.00 0.00 N ATOM 1319 CA VAL B 674 4.032 -25.190 -2.244 1.00 0.00 C ATOM 1320 C VAL B 674 3.962 -26.588 -2.847 1.00 0.00 C ATOM 1321 O VAL B 674 4.988 -27.217 -3.104 1.00 0.00 O ATOM 1322 CB VAL B 674 4.048 -24.152 -3.381 1.00 0.00 C ATOM 1323 CG1 VAL B 674 5.195 -24.428 -4.341 1.00 0.00 C ATOM 1324 CG2 VAL B 674 2.716 -24.148 -4.116 1.00 0.00 C ATOM 0 H VAL B 674 5.967 -24.520 -1.792 1.00 0.00 H new ATOM 0 HA VAL B 674 3.153 -25.022 -1.621 1.00 0.00 H new ATOM 0 HB VAL B 674 4.201 -23.164 -2.946 1.00 0.00 H new ATOM 0 HG11 VAL B 674 5.190 -23.684 -5.138 1.00 0.00 H new ATOM 0 HG12 VAL B 674 6.141 -24.376 -3.802 1.00 0.00 H new ATOM 0 HG13 VAL B 674 5.077 -25.422 -4.772 1.00 0.00 H new ATOM 0 HG21 VAL B 674 2.744 -23.409 -4.916 1.00 0.00 H new ATOM 0 HG22 VAL B 674 2.531 -25.135 -4.540 1.00 0.00 H new ATOM 0 HG23 VAL B 674 1.916 -23.897 -3.419 1.00 0.00 H new ATOM 1334 N ARG B 675 2.743 -27.069 -3.071 1.00 0.00 N ATOM 1335 CA ARG B 675 2.538 -28.394 -3.644 1.00 0.00 C ATOM 1336 C ARG B 675 3.345 -28.562 -4.929 1.00 0.00 C ATOM 1337 O ARG B 675 3.050 -27.935 -5.946 1.00 0.00 O ATOM 1338 CB ARG B 675 1.053 -28.625 -3.929 1.00 0.00 C ATOM 1339 CG ARG B 675 0.652 -30.091 -3.917 1.00 0.00 C ATOM 1340 CD ARG B 675 0.335 -30.571 -2.509 1.00 0.00 C ATOM 1341 NE ARG B 675 1.539 -30.955 -1.777 1.00 0.00 N ATOM 1342 CZ ARG B 675 1.564 -31.177 -0.468 1.00 0.00 C ATOM 1343 NH1 ARG B 675 0.456 -31.055 0.250 1.00 0.00 N ATOM 1344 NH2 ARG B 675 2.699 -31.523 0.126 1.00 0.00 N ATOM 0 H ARG B 675 1.883 -26.561 -2.864 1.00 0.00 H new ATOM 0 HA ARG B 675 2.882 -29.133 -2.920 1.00 0.00 H new ATOM 0 HB2 ARG B 675 0.462 -28.089 -3.187 1.00 0.00 H new ATOM 0 HB3 ARG B 675 0.807 -28.198 -4.901 1.00 0.00 H new ATOM 0 HG2 ARG B 675 -0.219 -30.236 -4.557 1.00 0.00 H new ATOM 0 HG3 ARG B 675 1.459 -30.693 -4.335 1.00 0.00 H new ATOM 0 HD2 ARG B 675 -0.183 -29.781 -1.965 1.00 0.00 H new ATOM 0 HD3 ARG B 675 -0.345 -31.422 -2.561 1.00 0.00 H new ATOM 0 HE ARG B 675 2.409 -31.058 -2.300 1.00 0.00 H new ATOM 0 HH11 ARG B 675 -0.419 -30.790 -0.203 1.00 0.00 H new ATOM 0 HH12 ARG B 675 0.478 -31.226 1.255 1.00 0.00 H new ATOM 0 HH21 ARG B 675 3.553 -31.619 -0.423 1.00 0.00 H new ATOM 0 HH22 ARG B 675 2.717 -31.693 1.132 1.00 0.00 H new ATOM 1358 N LYS B 676 4.365 -29.411 -4.873 1.00 0.00 N ATOM 1359 CA LYS B 676 5.215 -29.663 -6.031 1.00 0.00 C ATOM 1360 C LYS B 676 6.070 -30.908 -5.817 1.00 0.00 C ATOM 1361 O LYS B 676 6.059 -31.503 -4.739 1.00 0.00 O ATOM 1362 CB LYS B 676 6.113 -28.454 -6.303 1.00 0.00 C ATOM 1363 CG LYS B 676 7.149 -28.210 -5.218 1.00 0.00 C ATOM 1364 CD LYS B 676 7.749 -26.818 -5.324 1.00 0.00 C ATOM 1365 CE LYS B 676 8.921 -26.789 -6.293 1.00 0.00 C ATOM 1366 NZ LYS B 676 10.030 -27.679 -5.850 1.00 0.00 N ATOM 0 H LYS B 676 4.624 -29.937 -4.038 1.00 0.00 H new ATOM 0 HA LYS B 676 4.571 -29.830 -6.894 1.00 0.00 H new ATOM 0 HB2 LYS B 676 6.623 -28.598 -7.255 1.00 0.00 H new ATOM 0 HB3 LYS B 676 5.490 -27.565 -6.406 1.00 0.00 H new ATOM 0 HG2 LYS B 676 6.688 -28.335 -4.238 1.00 0.00 H new ATOM 0 HG3 LYS B 676 7.941 -28.955 -5.295 1.00 0.00 H new ATOM 0 HD2 LYS B 676 6.984 -26.115 -5.655 1.00 0.00 H new ATOM 0 HD3 LYS B 676 8.081 -26.488 -4.340 1.00 0.00 H new ATOM 0 HE2 LYS B 676 8.582 -27.096 -7.282 1.00 0.00 H new ATOM 0 HE3 LYS B 676 9.290 -25.768 -6.386 1.00 0.00 H new ATOM 0 HZ1 LYS B 676 10.921 -27.143 -5.838 1.00 0.00 H new ATOM 0 HZ2 LYS B 676 9.828 -28.036 -4.894 1.00 0.00 H new ATOM 0 HZ3 LYS B 676 10.116 -28.480 -6.508 1.00 0.00 H new ATOM 1380 N ARG B 677 6.812 -31.295 -6.850 1.00 0.00 N ATOM 1381 CA ARG B 677 7.673 -32.469 -6.775 1.00 0.00 C ATOM 1382 C ARG B 677 8.837 -32.229 -5.817 1.00 0.00 C ATOM 1383 O ARG B 677 9.095 -33.036 -4.924 1.00 0.00 O ATOM 1384 CB ARG B 677 8.206 -32.827 -8.163 1.00 0.00 C ATOM 1385 CG ARG B 677 9.187 -31.808 -8.720 1.00 0.00 C ATOM 1386 CD ARG B 677 9.849 -32.310 -9.993 1.00 0.00 C ATOM 1387 NE ARG B 677 10.964 -33.211 -9.712 1.00 0.00 N ATOM 1388 CZ ARG B 677 12.164 -32.795 -9.324 1.00 0.00 C ATOM 1389 NH1 ARG B 677 12.404 -31.500 -9.172 1.00 0.00 N ATOM 1390 NH2 ARG B 677 13.128 -33.676 -9.088 1.00 0.00 N ATOM 0 H ARG B 677 6.834 -30.813 -7.748 1.00 0.00 H new ATOM 0 HA ARG B 677 7.079 -33.301 -6.397 1.00 0.00 H new ATOM 0 HB2 ARG B 677 8.694 -33.800 -8.116 1.00 0.00 H new ATOM 0 HB3 ARG B 677 7.366 -32.925 -8.851 1.00 0.00 H new ATOM 0 HG2 ARG B 677 8.665 -30.873 -8.924 1.00 0.00 H new ATOM 0 HG3 ARG B 677 9.950 -31.590 -7.973 1.00 0.00 H new ATOM 0 HD2 ARG B 677 9.111 -32.827 -10.606 1.00 0.00 H new ATOM 0 HD3 ARG B 677 10.207 -31.461 -10.575 1.00 0.00 H new ATOM 0 HE ARG B 677 10.813 -34.214 -9.820 1.00 0.00 H new ATOM 0 HH11 ARG B 677 11.666 -30.820 -9.353 1.00 0.00 H new ATOM 0 HH12 ARG B 677 13.327 -31.184 -8.874 1.00 0.00 H new ATOM 0 HH21 ARG B 677 12.947 -34.673 -9.205 1.00 0.00 H new ATOM 0 HH22 ARG B 677 14.050 -33.356 -8.790 1.00 0.00 H new TER 1404 ARG B 677