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 -163:sc= -2.84 (180deg=-0.749) USER MOD Set 1.2: B 650 MET CE :methyl -153:sc= -2.9 (180deg=-0.857) USER MOD Single : A 636 CYS SG : rot 180:sc= 0 USER MOD Single : A 638 THR OG1 : rot 180:sc= -0.0598 USER MOD Single : A 639 ASN : amide:sc= -0.509 K(o=-0.51,f=-2) USER MOD Single : A 642 LYS NZ :NH3+ 148:sc= -0.197 (180deg=-1.32!) USER MOD Single : A 645 SER OG : rot 180:sc= 0.0622 USER MOD Single : A 648 THR OG1 : rot 86:sc= 0.211 USER MOD Single : A 668 MET CE :methyl -140:sc= -5.8! (180deg=-7.9!) USER MOD Single : A 672 HIS : no HD1:sc= -0.451 X(o=-0.45,f=-0.45) USER MOD Single : A 676 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 636 CYS SG : rot 31:sc= -0.409 USER MOD Single : B 638 THR OG1 : rot 180:sc= 0 USER MOD Single : B 639 ASN : amide:sc=-0.00742 X(o=-0.0074,f=-0.15) USER MOD Single : B 642 LYS NZ :NH3+ -158:sc= -0.0401 (180deg=-0.272) USER MOD Single : B 645 SER OG : rot -120:sc= 0.0611 USER MOD Single : B 648 THR OG1 : rot 80:sc= 0.697 USER MOD Single : B 668 MET CE :methyl -138:sc= -6.07! (180deg=-7.91!) USER MOD Single : B 672 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 676 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 634 18.959 22.198 -2.497 1.00 0.00 N ATOM 2 CA GLU A 634 19.633 23.424 -2.085 1.00 0.00 C ATOM 3 C GLU A 634 19.998 23.373 -0.604 1.00 0.00 C ATOM 4 O GLU A 634 21.072 23.819 -0.203 1.00 0.00 O ATOM 5 CB GLU A 634 18.744 24.638 -2.361 1.00 0.00 C ATOM 6 CG GLU A 634 19.445 25.968 -2.141 1.00 0.00 C ATOM 7 CD GLU A 634 18.731 27.123 -2.816 1.00 0.00 C ATOM 8 OE1 GLU A 634 18.334 26.969 -3.991 1.00 0.00 O ATOM 9 OE2 GLU A 634 18.569 28.180 -2.172 1.00 0.00 O ATOM 0 HA GLU A 634 20.551 23.516 -2.665 1.00 0.00 H new ATOM 0 HB2 GLU A 634 18.388 24.590 -3.390 1.00 0.00 H new ATOM 0 HB3 GLU A 634 17.866 24.589 -1.717 1.00 0.00 H new ATOM 0 HG2 GLU A 634 19.515 26.165 -1.071 1.00 0.00 H new ATOM 0 HG3 GLU A 634 20.465 25.904 -2.521 1.00 0.00 H new ATOM 16 N GLY A 635 19.095 22.827 0.204 1.00 0.00 N ATOM 17 CA GLY A 635 19.339 22.728 1.631 1.00 0.00 C ATOM 18 C GLY A 635 18.115 23.077 2.454 1.00 0.00 C ATOM 19 O GLY A 635 18.078 24.115 3.115 1.00 0.00 O ATOM 0 H GLY A 635 18.198 22.451 -0.104 1.00 0.00 H new ATOM 0 HA2 GLY A 635 19.658 21.714 1.872 1.00 0.00 H new ATOM 0 HA3 GLY A 635 20.158 23.394 1.903 1.00 0.00 H new ATOM 23 N CYS A 636 17.110 22.209 2.414 1.00 0.00 N ATOM 24 CA CYS A 636 15.877 22.432 3.160 1.00 0.00 C ATOM 25 C CYS A 636 15.258 23.778 2.797 1.00 0.00 C ATOM 26 O CYS A 636 15.313 24.741 3.563 1.00 0.00 O ATOM 27 CB CYS A 636 16.148 22.370 4.664 1.00 0.00 C ATOM 28 SG CYS A 636 16.871 20.809 5.220 1.00 0.00 S ATOM 0 H CYS A 636 17.125 21.344 1.873 1.00 0.00 H new ATOM 0 HA CYS A 636 15.172 21.645 2.893 1.00 0.00 H new ATOM 0 HB2 CYS A 636 16.818 23.186 4.935 1.00 0.00 H new ATOM 0 HB3 CYS A 636 15.212 22.535 5.198 1.00 0.00 H new ATOM 0 HG CYS A 636 17.065 20.854 6.505 1.00 0.00 H new ATOM 34 N PRO A 637 14.655 23.849 1.601 1.00 0.00 N ATOM 35 CA PRO A 637 14.015 25.073 1.109 1.00 0.00 C ATOM 36 C PRO A 637 12.743 25.412 1.880 1.00 0.00 C ATOM 37 O PRO A 637 12.529 26.560 2.271 1.00 0.00 O ATOM 38 CB PRO A 637 13.685 24.739 -0.348 1.00 0.00 C ATOM 39 CG PRO A 637 13.570 23.254 -0.379 1.00 0.00 C ATOM 40 CD PRO A 637 14.552 22.741 0.637 1.00 0.00 C ATOM 0 HA PRO A 637 14.658 25.945 1.225 1.00 0.00 H new ATOM 0 HB2 PRO A 637 12.756 25.215 -0.663 1.00 0.00 H new ATOM 0 HB3 PRO A 637 14.467 25.090 -1.022 1.00 0.00 H new ATOM 0 HG2 PRO A 637 12.556 22.936 -0.137 1.00 0.00 H new ATOM 0 HG3 PRO A 637 13.797 22.866 -1.372 1.00 0.00 H new ATOM 0 HD2 PRO A 637 14.198 21.826 1.112 1.00 0.00 H new ATOM 0 HD3 PRO A 637 15.516 22.512 0.184 1.00 0.00 H new ATOM 48 N THR A 638 11.901 24.406 2.095 1.00 0.00 N ATOM 49 CA THR A 638 10.651 24.598 2.818 1.00 0.00 C ATOM 50 C THR A 638 9.991 23.262 3.140 1.00 0.00 C ATOM 51 O THR A 638 9.160 22.770 2.378 1.00 0.00 O ATOM 52 CB THR A 638 9.664 25.464 2.014 1.00 0.00 C ATOM 53 OG1 THR A 638 10.032 25.469 0.630 1.00 0.00 O ATOM 54 CG2 THR A 638 9.640 26.890 2.542 1.00 0.00 C ATOM 0 H THR A 638 12.063 23.450 1.778 1.00 0.00 H new ATOM 0 HA THR A 638 10.899 25.111 3.747 1.00 0.00 H new ATOM 0 HB THR A 638 8.667 25.036 2.124 1.00 0.00 H new ATOM 0 HG1 THR A 638 9.399 26.021 0.125 1.00 0.00 H new ATOM 0 HG21 THR A 638 8.936 27.482 1.958 1.00 0.00 H new ATOM 0 HG22 THR A 638 9.331 26.886 3.587 1.00 0.00 H new ATOM 0 HG23 THR A 638 10.636 27.325 2.459 1.00 0.00 H new ATOM 62 N ASN A 639 10.367 22.679 4.273 1.00 0.00 N ATOM 63 CA ASN A 639 9.811 21.398 4.696 1.00 0.00 C ATOM 64 C ASN A 639 8.964 21.561 5.955 1.00 0.00 C ATOM 65 O ASN A 639 9.278 22.372 6.825 1.00 0.00 O ATOM 66 CB ASN A 639 10.933 20.390 4.949 1.00 0.00 C ATOM 67 CG ASN A 639 11.811 20.784 6.121 1.00 0.00 C ATOM 68 OD1 ASN A 639 11.380 20.748 7.273 1.00 0.00 O ATOM 69 ND2 ASN A 639 13.050 21.163 5.830 1.00 0.00 N ATOM 0 H ASN A 639 11.055 23.073 4.915 1.00 0.00 H new ATOM 0 HA ASN A 639 9.171 21.026 3.896 1.00 0.00 H new ATOM 0 HB2 ASN A 639 10.500 19.408 5.137 1.00 0.00 H new ATOM 0 HB3 ASN A 639 11.547 20.301 4.053 1.00 0.00 H new ATOM 0 HD21 ASN A 639 13.687 21.440 6.577 1.00 0.00 H new ATOM 0 HD22 ASN A 639 13.364 21.177 4.860 1.00 0.00 H new ATOM 76 N GLY A 640 7.890 20.783 6.044 1.00 0.00 N ATOM 77 CA GLY A 640 7.015 20.856 7.200 1.00 0.00 C ATOM 78 C GLY A 640 5.759 20.026 7.029 1.00 0.00 C ATOM 79 O GLY A 640 5.458 19.532 5.942 1.00 0.00 O ATOM 0 H GLY A 640 7.610 20.104 5.337 1.00 0.00 H new ATOM 0 HA2 GLY A 640 7.555 20.514 8.083 1.00 0.00 H new ATOM 0 HA3 GLY A 640 6.739 21.895 7.378 1.00 0.00 H new ATOM 83 N PRO A 641 5.001 19.861 8.123 1.00 0.00 N ATOM 84 CA PRO A 641 3.758 19.083 8.115 1.00 0.00 C ATOM 85 C PRO A 641 2.647 19.774 7.331 1.00 0.00 C ATOM 86 O PRO A 641 2.291 20.917 7.614 1.00 0.00 O ATOM 87 CB PRO A 641 3.387 18.992 9.598 1.00 0.00 C ATOM 88 CG PRO A 641 4.029 20.182 10.223 1.00 0.00 C ATOM 89 CD PRO A 641 5.298 20.421 9.452 1.00 0.00 C ATOM 0 HA PRO A 641 3.887 18.114 7.633 1.00 0.00 H new ATOM 0 HB2 PRO A 641 2.306 19.007 9.737 1.00 0.00 H new ATOM 0 HB3 PRO A 641 3.753 18.066 10.042 1.00 0.00 H new ATOM 0 HG2 PRO A 641 3.373 21.051 10.173 1.00 0.00 H new ATOM 0 HG3 PRO A 641 4.241 20.003 11.277 1.00 0.00 H new ATOM 0 HD2 PRO A 641 5.540 21.482 9.396 1.00 0.00 H new ATOM 0 HD3 PRO A 641 6.150 19.924 9.916 1.00 0.00 H new ATOM 97 N LYS A 642 2.103 19.071 6.343 1.00 0.00 N ATOM 98 CA LYS A 642 1.031 19.615 5.517 1.00 0.00 C ATOM 99 C LYS A 642 0.012 18.534 5.168 1.00 0.00 C ATOM 100 O LYS A 642 0.353 17.522 4.555 1.00 0.00 O ATOM 101 CB LYS A 642 1.605 20.224 4.236 1.00 0.00 C ATOM 102 CG LYS A 642 0.844 21.445 3.749 1.00 0.00 C ATOM 103 CD LYS A 642 1.686 22.286 2.805 1.00 0.00 C ATOM 104 CE LYS A 642 2.576 23.256 3.566 1.00 0.00 C ATOM 105 NZ LYS A 642 3.917 22.673 3.850 1.00 0.00 N ATOM 0 H LYS A 642 2.387 18.123 6.095 1.00 0.00 H new ATOM 0 HA LYS A 642 0.526 20.395 6.087 1.00 0.00 H new ATOM 0 HB2 LYS A 642 2.645 20.500 4.409 1.00 0.00 H new ATOM 0 HB3 LYS A 642 1.602 19.468 3.451 1.00 0.00 H new ATOM 0 HG2 LYS A 642 -0.067 21.128 3.241 1.00 0.00 H new ATOM 0 HG3 LYS A 642 0.539 22.050 4.603 1.00 0.00 H new ATOM 0 HD2 LYS A 642 2.302 21.634 2.187 1.00 0.00 H new ATOM 0 HD3 LYS A 642 1.034 22.841 2.131 1.00 0.00 H new ATOM 0 HE2 LYS A 642 2.694 24.172 2.987 1.00 0.00 H new ATOM 0 HE3 LYS A 642 2.094 23.532 4.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 4.631 23.429 3.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 3.903 22.208 4.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 4.154 21.974 3.117 1.00 0.00 H new ATOM 119 N ILE A 643 -1.238 18.757 5.559 1.00 0.00 N ATOM 120 CA ILE A 643 -2.305 17.804 5.284 1.00 0.00 C ATOM 121 C ILE A 643 -3.536 18.504 4.719 1.00 0.00 C ATOM 122 O ILE A 643 -4.580 18.598 5.366 1.00 0.00 O ATOM 123 CB ILE A 643 -2.707 17.027 6.552 1.00 0.00 C ATOM 124 CG1 ILE A 643 -1.464 16.476 7.254 1.00 0.00 C ATOM 125 CG2 ILE A 643 -3.667 15.901 6.201 1.00 0.00 C ATOM 126 CD1 ILE A 643 -1.777 15.701 8.515 1.00 0.00 C ATOM 0 H ILE A 643 -1.536 19.589 6.067 1.00 0.00 H new ATOM 0 HA ILE A 643 -1.918 17.102 4.545 1.00 0.00 H new ATOM 0 HB ILE A 643 -3.213 17.710 7.234 1.00 0.00 H new ATOM 0 HG12 ILE A 643 -0.924 15.828 6.564 1.00 0.00 H new ATOM 0 HG13 ILE A 643 -0.799 17.304 7.501 1.00 0.00 H new ATOM 0 HG21 ILE A 643 -3.942 15.361 7.107 1.00 0.00 H new ATOM 0 HG22 ILE A 643 -4.563 16.317 5.741 1.00 0.00 H new ATOM 0 HG23 ILE A 643 -3.185 15.216 5.503 1.00 0.00 H new ATOM 0 HD11 ILE A 643 -0.850 15.340 8.960 1.00 0.00 H new ATOM 0 HD12 ILE A 643 -2.290 16.351 9.224 1.00 0.00 H new ATOM 0 HD13 ILE A 643 -2.417 14.853 8.271 1.00 0.00 H new ATOM 138 N PRO A 644 -3.414 19.008 3.482 1.00 0.00 N ATOM 139 CA PRO A 644 -4.508 19.707 2.801 1.00 0.00 C ATOM 140 C PRO A 644 -5.644 18.767 2.412 1.00 0.00 C ATOM 141 O PRO A 644 -5.699 17.625 2.866 1.00 0.00 O ATOM 142 CB PRO A 644 -3.837 20.282 1.551 1.00 0.00 C ATOM 143 CG PRO A 644 -2.674 19.387 1.299 1.00 0.00 C ATOM 144 CD PRO A 644 -2.200 18.934 2.653 1.00 0.00 C ATOM 0 HA PRO A 644 -4.970 20.461 3.439 1.00 0.00 H new ATOM 0 HB2 PRO A 644 -4.521 20.290 0.703 1.00 0.00 H new ATOM 0 HB3 PRO A 644 -3.517 21.311 1.712 1.00 0.00 H new ATOM 0 HG2 PRO A 644 -2.963 18.536 0.682 1.00 0.00 H new ATOM 0 HG3 PRO A 644 -1.884 19.915 0.765 1.00 0.00 H new ATOM 0 HD2 PRO A 644 -1.797 17.922 2.620 1.00 0.00 H new ATOM 0 HD3 PRO A 644 -1.410 19.579 3.039 1.00 0.00 H new ATOM 152 N SER A 645 -6.547 19.256 1.568 1.00 0.00 N ATOM 153 CA SER A 645 -7.684 18.459 1.120 1.00 0.00 C ATOM 154 C SER A 645 -7.236 17.371 0.149 1.00 0.00 C ATOM 155 O SER A 645 -8.004 16.468 -0.185 1.00 0.00 O ATOM 156 CB SER A 645 -8.730 19.355 0.454 1.00 0.00 C ATOM 157 OG SER A 645 -8.553 20.711 0.827 1.00 0.00 O ATOM 0 H SER A 645 -6.514 20.199 1.181 1.00 0.00 H new ATOM 0 HA SER A 645 -8.128 17.981 1.993 1.00 0.00 H new ATOM 0 HB2 SER A 645 -8.657 19.260 -0.629 1.00 0.00 H new ATOM 0 HB3 SER A 645 -9.729 19.024 0.737 1.00 0.00 H new ATOM 0 HG SER A 645 -9.233 21.263 0.387 1.00 0.00 H new ATOM 163 N ILE A 646 -5.989 17.464 -0.299 1.00 0.00 N ATOM 164 CA ILE A 646 -5.438 16.488 -1.231 1.00 0.00 C ATOM 165 C ILE A 646 -5.311 15.116 -0.578 1.00 0.00 C ATOM 166 O ILE A 646 -5.081 14.114 -1.255 1.00 0.00 O ATOM 167 CB ILE A 646 -4.057 16.926 -1.754 1.00 0.00 C ATOM 168 CG1 ILE A 646 -4.116 18.365 -2.270 1.00 0.00 C ATOM 169 CG2 ILE A 646 -3.582 15.983 -2.849 1.00 0.00 C ATOM 170 CD1 ILE A 646 -2.770 18.908 -2.699 1.00 0.00 C ATOM 0 H ILE A 646 -5.341 18.205 -0.032 1.00 0.00 H new ATOM 0 HA ILE A 646 -6.131 16.426 -2.070 1.00 0.00 H new ATOM 0 HB ILE A 646 -3.343 16.884 -0.931 1.00 0.00 H new ATOM 0 HG12 ILE A 646 -4.804 18.412 -3.114 1.00 0.00 H new ATOM 0 HG13 ILE A 646 -4.526 19.006 -1.489 1.00 0.00 H new ATOM 0 HG21 ILE A 646 -2.605 16.306 -3.208 1.00 0.00 H new ATOM 0 HG22 ILE A 646 -3.506 14.971 -2.450 1.00 0.00 H new ATOM 0 HG23 ILE A 646 -4.294 15.995 -3.674 1.00 0.00 H new ATOM 0 HD11 ILE A 646 -2.887 19.932 -3.053 1.00 0.00 H new ATOM 0 HD12 ILE A 646 -2.085 18.893 -1.851 1.00 0.00 H new ATOM 0 HD13 ILE A 646 -2.367 18.290 -3.502 1.00 0.00 H new ATOM 182 N ALA A 647 -5.464 15.078 0.742 1.00 0.00 N ATOM 183 CA ALA A 647 -5.370 13.829 1.486 1.00 0.00 C ATOM 184 C ALA A 647 -6.277 12.761 0.884 1.00 0.00 C ATOM 185 O ALA A 647 -5.967 11.570 0.928 1.00 0.00 O ATOM 186 CB ALA A 647 -5.721 14.058 2.949 1.00 0.00 C ATOM 0 H ALA A 647 -5.654 15.898 1.318 1.00 0.00 H new ATOM 0 HA ALA A 647 -4.342 13.474 1.421 1.00 0.00 H new ATOM 0 HB1 ALA A 647 -5.647 13.116 3.493 1.00 0.00 H new ATOM 0 HB2 ALA A 647 -5.029 14.782 3.380 1.00 0.00 H new ATOM 0 HB3 ALA A 647 -6.739 14.440 3.023 1.00 0.00 H new ATOM 192 N THR A 648 -7.401 13.195 0.322 1.00 0.00 N ATOM 193 CA THR A 648 -8.354 12.276 -0.288 1.00 0.00 C ATOM 194 C THR A 648 -7.671 11.368 -1.303 1.00 0.00 C ATOM 195 O THR A 648 -7.845 10.150 -1.278 1.00 0.00 O ATOM 196 CB THR A 648 -9.499 13.035 -0.985 1.00 0.00 C ATOM 197 OG1 THR A 648 -9.990 14.074 -0.130 1.00 0.00 O ATOM 198 CG2 THR A 648 -10.635 12.090 -1.345 1.00 0.00 C ATOM 0 H THR A 648 -7.673 14.177 0.277 1.00 0.00 H new ATOM 0 HA THR A 648 -8.767 11.669 0.518 1.00 0.00 H new ATOM 0 HB THR A 648 -9.108 13.474 -1.903 1.00 0.00 H new ATOM 0 HG1 THR A 648 -9.448 14.881 -0.251 1.00 0.00 H new ATOM 0 HG21 THR A 648 -11.432 12.649 -1.836 1.00 0.00 H new ATOM 0 HG22 THR A 648 -10.266 11.317 -2.019 1.00 0.00 H new ATOM 0 HG23 THR A 648 -11.023 11.626 -0.438 1.00 0.00 H new ATOM 206 N GLY A 649 -6.890 11.969 -2.197 1.00 0.00 N ATOM 207 CA GLY A 649 -6.191 11.198 -3.209 1.00 0.00 C ATOM 208 C GLY A 649 -5.094 10.332 -2.622 1.00 0.00 C ATOM 209 O GLY A 649 -4.880 9.204 -3.066 1.00 0.00 O ATOM 0 H GLY A 649 -6.729 12.975 -2.238 1.00 0.00 H new ATOM 0 HA2 GLY A 649 -6.905 10.566 -3.738 1.00 0.00 H new ATOM 0 HA3 GLY A 649 -5.760 11.877 -3.945 1.00 0.00 H new ATOM 213 N MET A 650 -4.395 10.861 -1.623 1.00 0.00 N ATOM 214 CA MET A 650 -3.313 10.128 -0.976 1.00 0.00 C ATOM 215 C MET A 650 -3.845 8.885 -0.270 1.00 0.00 C ATOM 216 O MET A 650 -3.306 7.790 -0.430 1.00 0.00 O ATOM 217 CB MET A 650 -2.588 11.028 0.027 1.00 0.00 C ATOM 218 CG MET A 650 -1.914 12.231 -0.613 1.00 0.00 C ATOM 219 SD MET A 650 -0.691 11.764 -1.853 1.00 0.00 S ATOM 220 CE MET A 650 0.329 10.631 -0.913 1.00 0.00 C ATOM 0 H MET A 650 -4.558 11.794 -1.244 1.00 0.00 H new ATOM 0 HA MET A 650 -2.609 9.813 -1.746 1.00 0.00 H new ATOM 0 HB2 MET A 650 -3.302 11.376 0.773 1.00 0.00 H new ATOM 0 HB3 MET A 650 -1.838 10.439 0.555 1.00 0.00 H new ATOM 0 HG2 MET A 650 -2.672 12.863 -1.076 1.00 0.00 H new ATOM 0 HG3 MET A 650 -1.431 12.827 0.162 1.00 0.00 H new ATOM 0 HE1 MET A 650 1.282 10.490 -1.423 1.00 0.00 H new ATOM 0 HE2 MET A 650 0.507 11.041 0.081 1.00 0.00 H new ATOM 0 HE3 MET A 650 -0.180 9.671 -0.824 1.00 0.00 H new ATOM 230 N VAL A 651 -4.904 9.062 0.513 1.00 0.00 N ATOM 231 CA VAL A 651 -5.509 7.955 1.243 1.00 0.00 C ATOM 232 C VAL A 651 -5.977 6.859 0.291 1.00 0.00 C ATOM 233 O VAL A 651 -5.715 5.678 0.511 1.00 0.00 O ATOM 234 CB VAL A 651 -6.704 8.427 2.092 1.00 0.00 C ATOM 235 CG1 VAL A 651 -7.314 7.260 2.853 1.00 0.00 C ATOM 236 CG2 VAL A 651 -6.276 9.532 3.046 1.00 0.00 C ATOM 0 H VAL A 651 -5.361 9.962 0.658 1.00 0.00 H new ATOM 0 HA VAL A 651 -4.740 7.555 1.904 1.00 0.00 H new ATOM 0 HB VAL A 651 -7.465 8.830 1.424 1.00 0.00 H new ATOM 0 HG11 VAL A 651 -8.157 7.614 3.447 1.00 0.00 H new ATOM 0 HG12 VAL A 651 -7.659 6.505 2.146 1.00 0.00 H new ATOM 0 HG13 VAL A 651 -6.564 6.823 3.512 1.00 0.00 H new ATOM 0 HG21 VAL A 651 -7.133 9.854 3.638 1.00 0.00 H new ATOM 0 HG22 VAL A 651 -5.496 9.158 3.709 1.00 0.00 H new ATOM 0 HG23 VAL A 651 -5.892 10.377 2.475 1.00 0.00 H new ATOM 246 N GLY A 652 -6.672 7.261 -0.769 1.00 0.00 N ATOM 247 CA GLY A 652 -7.166 6.302 -1.739 1.00 0.00 C ATOM 248 C GLY A 652 -6.049 5.527 -2.409 1.00 0.00 C ATOM 249 O GLY A 652 -6.173 4.327 -2.648 1.00 0.00 O ATOM 0 H GLY A 652 -6.901 8.234 -0.973 1.00 0.00 H new ATOM 0 HA2 GLY A 652 -7.842 5.605 -1.244 1.00 0.00 H new ATOM 0 HA3 GLY A 652 -7.748 6.825 -2.498 1.00 0.00 H new ATOM 253 N ALA A 653 -4.954 6.216 -2.715 1.00 0.00 N ATOM 254 CA ALA A 653 -3.810 5.586 -3.361 1.00 0.00 C ATOM 255 C ALA A 653 -3.064 4.676 -2.391 1.00 0.00 C ATOM 256 O ALA A 653 -2.729 3.538 -2.723 1.00 0.00 O ATOM 257 CB ALA A 653 -2.872 6.643 -3.924 1.00 0.00 C ATOM 0 H ALA A 653 -4.836 7.211 -2.525 1.00 0.00 H new ATOM 0 HA ALA A 653 -4.181 4.972 -4.182 1.00 0.00 H new ATOM 0 HB1 ALA A 653 -2.022 6.157 -4.403 1.00 0.00 H new ATOM 0 HB2 ALA A 653 -3.405 7.249 -4.657 1.00 0.00 H new ATOM 0 HB3 ALA A 653 -2.516 7.281 -3.115 1.00 0.00 H new ATOM 263 N LEU A 654 -2.805 5.184 -1.191 1.00 0.00 N ATOM 264 CA LEU A 654 -2.097 4.418 -0.172 1.00 0.00 C ATOM 265 C LEU A 654 -2.813 3.101 0.114 1.00 0.00 C ATOM 266 O LEU A 654 -2.189 2.039 0.154 1.00 0.00 O ATOM 267 CB LEU A 654 -1.975 5.234 1.116 1.00 0.00 C ATOM 268 CG LEU A 654 -0.983 6.397 1.081 1.00 0.00 C ATOM 269 CD1 LEU A 654 -1.361 7.452 2.110 1.00 0.00 C ATOM 270 CD2 LEU A 654 0.434 5.897 1.324 1.00 0.00 C ATOM 0 H LEU A 654 -3.075 6.124 -0.900 1.00 0.00 H new ATOM 0 HA LEU A 654 -1.099 4.195 -0.549 1.00 0.00 H new ATOM 0 HB2 LEU A 654 -2.959 5.629 1.367 1.00 0.00 H new ATOM 0 HB3 LEU A 654 -1.687 4.561 1.923 1.00 0.00 H new ATOM 0 HG LEU A 654 -1.022 6.853 0.092 1.00 0.00 H new ATOM 0 HD11 LEU A 654 -0.644 8.272 2.071 1.00 0.00 H new ATOM 0 HD12 LEU A 654 -2.359 7.832 1.892 1.00 0.00 H new ATOM 0 HD13 LEU A 654 -1.351 7.009 3.106 1.00 0.00 H new ATOM 0 HD21 LEU A 654 1.127 6.738 1.296 1.00 0.00 H new ATOM 0 HD22 LEU A 654 0.488 5.416 2.301 1.00 0.00 H new ATOM 0 HD23 LEU A 654 0.704 5.178 0.550 1.00 0.00 H new ATOM 282 N LEU A 655 -4.124 3.176 0.309 1.00 0.00 N ATOM 283 CA LEU A 655 -4.926 1.990 0.588 1.00 0.00 C ATOM 284 C LEU A 655 -4.878 1.013 -0.582 1.00 0.00 C ATOM 285 O LEU A 655 -4.675 -0.188 -0.395 1.00 0.00 O ATOM 286 CB LEU A 655 -6.375 2.386 0.878 1.00 0.00 C ATOM 287 CG LEU A 655 -6.621 3.108 2.203 1.00 0.00 C ATOM 288 CD1 LEU A 655 -8.086 3.492 2.337 1.00 0.00 C ATOM 289 CD2 LEU A 655 -6.186 2.239 3.373 1.00 0.00 C ATOM 0 H LEU A 655 -4.655 4.046 0.279 1.00 0.00 H new ATOM 0 HA LEU A 655 -4.508 1.497 1.466 1.00 0.00 H new ATOM 0 HB2 LEU A 655 -6.725 3.026 0.068 1.00 0.00 H new ATOM 0 HB3 LEU A 655 -6.988 1.485 0.859 1.00 0.00 H new ATOM 0 HG LEU A 655 -6.025 4.021 2.214 1.00 0.00 H new ATOM 0 HD11 LEU A 655 -8.242 4.005 3.286 1.00 0.00 H new ATOM 0 HD12 LEU A 655 -8.365 4.153 1.517 1.00 0.00 H new ATOM 0 HD13 LEU A 655 -8.702 2.593 2.304 1.00 0.00 H new ATOM 0 HD21 LEU A 655 -6.369 2.769 4.308 1.00 0.00 H new ATOM 0 HD22 LEU A 655 -6.754 1.309 3.366 1.00 0.00 H new ATOM 0 HD23 LEU A 655 -5.123 2.015 3.285 1.00 0.00 H new ATOM 301 N LEU A 656 -5.065 1.534 -1.790 1.00 0.00 N ATOM 302 CA LEU A 656 -5.041 0.708 -2.992 1.00 0.00 C ATOM 303 C LEU A 656 -3.674 0.057 -3.178 1.00 0.00 C ATOM 304 O LEU A 656 -3.576 -1.097 -3.597 1.00 0.00 O ATOM 305 CB LEU A 656 -5.388 1.551 -4.220 1.00 0.00 C ATOM 306 CG LEU A 656 -6.874 1.838 -4.439 1.00 0.00 C ATOM 307 CD1 LEU A 656 -7.063 2.851 -5.557 1.00 0.00 C ATOM 308 CD2 LEU A 656 -7.626 0.552 -4.749 1.00 0.00 C ATOM 0 H LEU A 656 -5.235 2.525 -1.963 1.00 0.00 H new ATOM 0 HA LEU A 656 -5.785 -0.080 -2.877 1.00 0.00 H new ATOM 0 HB2 LEU A 656 -4.862 2.503 -4.143 1.00 0.00 H new ATOM 0 HB3 LEU A 656 -5.002 1.044 -5.105 1.00 0.00 H new ATOM 0 HG LEU A 656 -7.282 2.261 -3.521 1.00 0.00 H new ATOM 0 HD11 LEU A 656 -8.127 3.043 -5.698 1.00 0.00 H new ATOM 0 HD12 LEU A 656 -6.558 3.781 -5.295 1.00 0.00 H new ATOM 0 HD13 LEU A 656 -6.639 2.457 -6.481 1.00 0.00 H new ATOM 0 HD21 LEU A 656 -8.682 0.776 -4.902 1.00 0.00 H new ATOM 0 HD22 LEU A 656 -7.216 0.100 -5.652 1.00 0.00 H new ATOM 0 HD23 LEU A 656 -7.519 -0.142 -3.915 1.00 0.00 H new ATOM 320 N LEU A 657 -2.621 0.803 -2.861 1.00 0.00 N ATOM 321 CA LEU A 657 -1.259 0.297 -2.991 1.00 0.00 C ATOM 322 C LEU A 657 -1.055 -0.946 -2.131 1.00 0.00 C ATOM 323 O LEU A 657 -0.595 -1.981 -2.616 1.00 0.00 O ATOM 324 CB LEU A 657 -0.253 1.378 -2.592 1.00 0.00 C ATOM 325 CG LEU A 657 0.059 2.431 -3.656 1.00 0.00 C ATOM 326 CD1 LEU A 657 0.962 3.514 -3.086 1.00 0.00 C ATOM 327 CD2 LEU A 657 0.701 1.785 -4.874 1.00 0.00 C ATOM 0 H LEU A 657 -2.684 1.760 -2.512 1.00 0.00 H new ATOM 0 HA LEU A 657 -1.097 0.025 -4.034 1.00 0.00 H new ATOM 0 HB2 LEU A 657 -0.630 1.887 -1.705 1.00 0.00 H new ATOM 0 HB3 LEU A 657 0.680 0.891 -2.307 1.00 0.00 H new ATOM 0 HG LEU A 657 -0.877 2.894 -3.967 1.00 0.00 H new ATOM 0 HD11 LEU A 657 1.173 4.255 -3.857 1.00 0.00 H new ATOM 0 HD12 LEU A 657 0.464 3.997 -2.245 1.00 0.00 H new ATOM 0 HD13 LEU A 657 1.896 3.067 -2.746 1.00 0.00 H new ATOM 0 HD21 LEU A 657 0.916 2.550 -5.621 1.00 0.00 H new ATOM 0 HD22 LEU A 657 1.629 1.295 -4.579 1.00 0.00 H new ATOM 0 HD23 LEU A 657 0.019 1.047 -5.296 1.00 0.00 H new ATOM 339 N LEU A 658 -1.401 -0.838 -0.853 1.00 0.00 N ATOM 340 CA LEU A 658 -1.259 -1.955 0.075 1.00 0.00 C ATOM 341 C LEU A 658 -2.037 -3.172 -0.414 1.00 0.00 C ATOM 342 O LEU A 658 -1.544 -4.299 -0.362 1.00 0.00 O ATOM 343 CB LEU A 658 -1.744 -1.551 1.468 1.00 0.00 C ATOM 344 CG LEU A 658 -0.758 -0.747 2.316 1.00 0.00 C ATOM 345 CD1 LEU A 658 -1.486 -0.020 3.436 1.00 0.00 C ATOM 346 CD2 LEU A 658 0.323 -1.656 2.881 1.00 0.00 C ATOM 0 H LEU A 658 -1.782 0.011 -0.436 1.00 0.00 H new ATOM 0 HA LEU A 658 -0.203 -2.220 0.127 1.00 0.00 H new ATOM 0 HB2 LEU A 658 -2.657 -0.967 1.357 1.00 0.00 H new ATOM 0 HB3 LEU A 658 -2.009 -2.456 2.015 1.00 0.00 H new ATOM 0 HG LEU A 658 -0.282 -0.003 1.678 1.00 0.00 H new ATOM 0 HD11 LEU A 658 -0.768 0.547 4.029 1.00 0.00 H new ATOM 0 HD12 LEU A 658 -2.222 0.661 3.009 1.00 0.00 H new ATOM 0 HD13 LEU A 658 -1.990 -0.746 4.074 1.00 0.00 H new ATOM 0 HD21 LEU A 658 1.016 -1.067 3.482 1.00 0.00 H new ATOM 0 HD22 LEU A 658 -0.136 -2.423 3.504 1.00 0.00 H new ATOM 0 HD23 LEU A 658 0.865 -2.130 2.062 1.00 0.00 H new ATOM 358 N VAL A 659 -3.255 -2.937 -0.891 1.00 0.00 N ATOM 359 CA VAL A 659 -4.101 -4.013 -1.393 1.00 0.00 C ATOM 360 C VAL A 659 -3.473 -4.683 -2.610 1.00 0.00 C ATOM 361 O VAL A 659 -3.592 -5.894 -2.797 1.00 0.00 O ATOM 362 CB VAL A 659 -5.502 -3.497 -1.770 1.00 0.00 C ATOM 363 CG1 VAL A 659 -6.392 -4.646 -2.218 1.00 0.00 C ATOM 364 CG2 VAL A 659 -6.128 -2.753 -0.600 1.00 0.00 C ATOM 0 H VAL A 659 -3.678 -2.010 -0.940 1.00 0.00 H new ATOM 0 HA VAL A 659 -4.196 -4.742 -0.589 1.00 0.00 H new ATOM 0 HB VAL A 659 -5.401 -2.801 -2.603 1.00 0.00 H new ATOM 0 HG11 VAL A 659 -7.378 -4.262 -2.480 1.00 0.00 H new ATOM 0 HG12 VAL A 659 -5.949 -5.132 -3.087 1.00 0.00 H new ATOM 0 HG13 VAL A 659 -6.488 -5.369 -1.408 1.00 0.00 H new ATOM 0 HG21 VAL A 659 -7.118 -2.395 -0.884 1.00 0.00 H new ATOM 0 HG22 VAL A 659 -6.216 -3.425 0.253 1.00 0.00 H new ATOM 0 HG23 VAL A 659 -5.499 -1.905 -0.330 1.00 0.00 H new ATOM 374 N VAL A 660 -2.804 -3.886 -3.437 1.00 0.00 N ATOM 375 CA VAL A 660 -2.155 -4.402 -4.637 1.00 0.00 C ATOM 376 C VAL A 660 -1.002 -5.334 -4.281 1.00 0.00 C ATOM 377 O VAL A 660 -0.836 -6.391 -4.888 1.00 0.00 O ATOM 378 CB VAL A 660 -1.623 -3.259 -5.522 1.00 0.00 C ATOM 379 CG1 VAL A 660 -0.792 -3.815 -6.669 1.00 0.00 C ATOM 380 CG2 VAL A 660 -2.772 -2.413 -6.047 1.00 0.00 C ATOM 0 H VAL A 660 -2.697 -2.881 -3.298 1.00 0.00 H new ATOM 0 HA VAL A 660 -2.910 -4.959 -5.191 1.00 0.00 H new ATOM 0 HB VAL A 660 -0.981 -2.621 -4.915 1.00 0.00 H new ATOM 0 HG11 VAL A 660 -0.424 -2.993 -7.284 1.00 0.00 H new ATOM 0 HG12 VAL A 660 0.053 -4.375 -6.268 1.00 0.00 H new ATOM 0 HG13 VAL A 660 -1.409 -4.476 -7.278 1.00 0.00 H new ATOM 0 HG21 VAL A 660 -2.378 -1.610 -6.670 1.00 0.00 H new ATOM 0 HG22 VAL A 660 -3.442 -3.036 -6.639 1.00 0.00 H new ATOM 0 HG23 VAL A 660 -3.321 -1.985 -5.209 1.00 0.00 H new ATOM 390 N ALA A 661 -0.209 -4.934 -3.293 1.00 0.00 N ATOM 391 CA ALA A 661 0.928 -5.734 -2.855 1.00 0.00 C ATOM 392 C ALA A 661 0.472 -7.087 -2.317 1.00 0.00 C ATOM 393 O ALA A 661 1.046 -8.124 -2.649 1.00 0.00 O ATOM 394 CB ALA A 661 1.724 -4.985 -1.797 1.00 0.00 C ATOM 0 H ALA A 661 -0.333 -4.061 -2.781 1.00 0.00 H new ATOM 0 HA ALA A 661 1.569 -5.912 -3.718 1.00 0.00 H new ATOM 0 HB1 ALA A 661 2.570 -5.594 -1.479 1.00 0.00 H new ATOM 0 HB2 ALA A 661 2.089 -4.046 -2.213 1.00 0.00 H new ATOM 0 HB3 ALA A 661 1.084 -4.777 -0.939 1.00 0.00 H new ATOM 400 N LEU A 662 -0.563 -7.068 -1.484 1.00 0.00 N ATOM 401 CA LEU A 662 -1.097 -8.294 -0.900 1.00 0.00 C ATOM 402 C LEU A 662 -1.538 -9.269 -1.987 1.00 0.00 C ATOM 403 O LEU A 662 -1.155 -10.438 -1.979 1.00 0.00 O ATOM 404 CB LEU A 662 -2.275 -7.972 0.022 1.00 0.00 C ATOM 405 CG LEU A 662 -1.915 -7.468 1.420 1.00 0.00 C ATOM 406 CD1 LEU A 662 -3.106 -6.769 2.058 1.00 0.00 C ATOM 407 CD2 LEU A 662 -1.437 -8.617 2.295 1.00 0.00 C ATOM 0 H LEU A 662 -1.049 -6.218 -1.198 1.00 0.00 H new ATOM 0 HA LEU A 662 -0.305 -8.764 -0.317 1.00 0.00 H new ATOM 0 HB2 LEU A 662 -2.896 -7.220 -0.465 1.00 0.00 H new ATOM 0 HB3 LEU A 662 -2.884 -8.870 0.127 1.00 0.00 H new ATOM 0 HG LEU A 662 -1.103 -6.747 1.327 1.00 0.00 H new ATOM 0 HD11 LEU A 662 -2.831 -6.417 3.052 1.00 0.00 H new ATOM 0 HD12 LEU A 662 -3.403 -5.920 1.442 1.00 0.00 H new ATOM 0 HD13 LEU A 662 -3.938 -7.468 2.138 1.00 0.00 H new ATOM 0 HD21 LEU A 662 -1.185 -8.239 3.286 1.00 0.00 H new ATOM 0 HD22 LEU A 662 -2.228 -9.362 2.381 1.00 0.00 H new ATOM 0 HD23 LEU A 662 -0.555 -9.074 1.846 1.00 0.00 H new ATOM 419 N GLY A 663 -2.345 -8.778 -2.923 1.00 0.00 N ATOM 420 CA GLY A 663 -2.823 -9.619 -4.005 1.00 0.00 C ATOM 421 C GLY A 663 -1.692 -10.258 -4.786 1.00 0.00 C ATOM 422 O GLY A 663 -1.698 -11.466 -5.023 1.00 0.00 O ATOM 0 H GLY A 663 -2.676 -7.814 -2.951 1.00 0.00 H new ATOM 0 HA2 GLY A 663 -3.465 -10.400 -3.598 1.00 0.00 H new ATOM 0 HA3 GLY A 663 -3.436 -9.023 -4.681 1.00 0.00 H new ATOM 426 N ILE A 664 -0.721 -9.445 -5.188 1.00 0.00 N ATOM 427 CA ILE A 664 0.421 -9.939 -5.948 1.00 0.00 C ATOM 428 C ILE A 664 1.163 -11.028 -5.180 1.00 0.00 C ATOM 429 O ILE A 664 1.530 -12.058 -5.743 1.00 0.00 O ATOM 430 CB ILE A 664 1.406 -8.804 -6.285 1.00 0.00 C ATOM 431 CG1 ILE A 664 0.711 -7.730 -7.125 1.00 0.00 C ATOM 432 CG2 ILE A 664 2.619 -9.355 -7.019 1.00 0.00 C ATOM 433 CD1 ILE A 664 1.397 -6.382 -7.070 1.00 0.00 C ATOM 0 H ILE A 664 -0.702 -8.443 -5.001 1.00 0.00 H new ATOM 0 HA ILE A 664 0.027 -10.355 -6.875 1.00 0.00 H new ATOM 0 HB ILE A 664 1.745 -8.349 -5.354 1.00 0.00 H new ATOM 0 HG12 ILE A 664 0.666 -8.064 -8.162 1.00 0.00 H new ATOM 0 HG13 ILE A 664 -0.317 -7.620 -6.781 1.00 0.00 H new ATOM 0 HG21 ILE A 664 3.305 -8.540 -7.250 1.00 0.00 H new ATOM 0 HG22 ILE A 664 3.124 -10.087 -6.389 1.00 0.00 H new ATOM 0 HG23 ILE A 664 2.298 -9.833 -7.945 1.00 0.00 H new ATOM 0 HD11 ILE A 664 0.850 -5.670 -7.688 1.00 0.00 H new ATOM 0 HD12 ILE A 664 1.419 -6.027 -6.040 1.00 0.00 H new ATOM 0 HD13 ILE A 664 2.417 -6.477 -7.442 1.00 0.00 H new ATOM 445 N GLY A 665 1.378 -10.793 -3.889 1.00 0.00 N ATOM 446 CA GLY A 665 2.073 -11.764 -3.065 1.00 0.00 C ATOM 447 C GLY A 665 1.406 -13.125 -3.085 1.00 0.00 C ATOM 448 O GLY A 665 2.066 -14.145 -3.290 1.00 0.00 O ATOM 0 H GLY A 665 1.083 -9.948 -3.400 1.00 0.00 H new ATOM 0 HA2 GLY A 665 3.101 -11.862 -3.413 1.00 0.00 H new ATOM 0 HA3 GLY A 665 2.117 -11.400 -2.039 1.00 0.00 H new ATOM 452 N LEU A 666 0.096 -13.143 -2.869 1.00 0.00 N ATOM 453 CA LEU A 666 -0.661 -14.390 -2.861 1.00 0.00 C ATOM 454 C LEU A 666 -0.771 -14.969 -4.268 1.00 0.00 C ATOM 455 O LEU A 666 -0.782 -16.187 -4.450 1.00 0.00 O ATOM 456 CB LEU A 666 -2.058 -14.158 -2.283 1.00 0.00 C ATOM 457 CG LEU A 666 -2.117 -13.422 -0.944 1.00 0.00 C ATOM 458 CD1 LEU A 666 -3.534 -13.430 -0.392 1.00 0.00 C ATOM 459 CD2 LEU A 666 -1.151 -14.049 0.052 1.00 0.00 C ATOM 0 H LEU A 666 -0.465 -12.308 -2.697 1.00 0.00 H new ATOM 0 HA LEU A 666 -0.129 -15.105 -2.234 1.00 0.00 H new ATOM 0 HB2 LEU A 666 -2.641 -13.594 -3.011 1.00 0.00 H new ATOM 0 HB3 LEU A 666 -2.546 -15.126 -2.165 1.00 0.00 H new ATOM 0 HG LEU A 666 -1.819 -12.386 -1.107 1.00 0.00 H new ATOM 0 HD11 LEU A 666 -3.556 -12.902 0.561 1.00 0.00 H new ATOM 0 HD12 LEU A 666 -4.202 -12.935 -1.097 1.00 0.00 H new ATOM 0 HD13 LEU A 666 -3.861 -14.459 -0.244 1.00 0.00 H new ATOM 0 HD21 LEU A 666 -1.206 -13.513 0.999 1.00 0.00 H new ATOM 0 HD22 LEU A 666 -1.419 -15.094 0.210 1.00 0.00 H new ATOM 0 HD23 LEU A 666 -0.135 -13.990 -0.340 1.00 0.00 H new ATOM 471 N PHE A 667 -0.850 -14.089 -5.260 1.00 0.00 N ATOM 472 CA PHE A 667 -0.957 -14.513 -6.652 1.00 0.00 C ATOM 473 C PHE A 667 0.317 -15.220 -7.104 1.00 0.00 C ATOM 474 O PHE A 667 0.268 -16.324 -7.645 1.00 0.00 O ATOM 475 CB PHE A 667 -1.233 -13.308 -7.554 1.00 0.00 C ATOM 476 CG PHE A 667 -1.045 -13.598 -9.015 1.00 0.00 C ATOM 477 CD1 PHE A 667 0.191 -13.424 -9.616 1.00 0.00 C ATOM 478 CD2 PHE A 667 -2.104 -14.047 -9.788 1.00 0.00 C ATOM 479 CE1 PHE A 667 0.367 -13.689 -10.961 1.00 0.00 C ATOM 480 CE2 PHE A 667 -1.935 -14.314 -11.134 1.00 0.00 C ATOM 481 CZ PHE A 667 -0.697 -14.136 -11.721 1.00 0.00 C ATOM 0 H PHE A 667 -0.842 -13.078 -5.127 1.00 0.00 H new ATOM 0 HA PHE A 667 -1.788 -15.214 -6.730 1.00 0.00 H new ATOM 0 HB2 PHE A 667 -2.255 -12.966 -7.388 1.00 0.00 H new ATOM 0 HB3 PHE A 667 -0.573 -12.490 -7.266 1.00 0.00 H new ATOM 0 HD1 PHE A 667 1.027 -13.077 -9.027 1.00 0.00 H new ATOM 0 HD2 PHE A 667 -3.073 -14.190 -9.333 1.00 0.00 H new ATOM 0 HE1 PHE A 667 1.335 -13.547 -11.418 1.00 0.00 H new ATOM 0 HE2 PHE A 667 -2.769 -14.661 -11.726 1.00 0.00 H new ATOM 0 HZ PHE A 667 -0.561 -14.346 -12.772 1.00 0.00 H new ATOM 491 N MET A 668 1.457 -14.574 -6.879 1.00 0.00 N ATOM 492 CA MET A 668 2.745 -15.141 -7.264 1.00 0.00 C ATOM 493 C MET A 668 2.978 -16.479 -6.570 1.00 0.00 C ATOM 494 O MET A 668 3.302 -17.476 -7.216 1.00 0.00 O ATOM 495 CB MET A 668 3.876 -14.171 -6.919 1.00 0.00 C ATOM 496 CG MET A 668 3.849 -12.891 -7.739 1.00 0.00 C ATOM 497 SD MET A 668 5.112 -11.710 -7.225 1.00 0.00 S ATOM 498 CE MET A 668 4.693 -11.499 -5.496 1.00 0.00 C ATOM 0 H MET A 668 1.515 -13.659 -6.433 1.00 0.00 H new ATOM 0 HA MET A 668 2.734 -15.307 -8.341 1.00 0.00 H new ATOM 0 HB2 MET A 668 3.815 -13.916 -5.861 1.00 0.00 H new ATOM 0 HB3 MET A 668 4.832 -14.671 -7.072 1.00 0.00 H new ATOM 0 HG2 MET A 668 3.992 -13.135 -8.792 1.00 0.00 H new ATOM 0 HG3 MET A 668 2.866 -12.428 -7.650 1.00 0.00 H new ATOM 0 HE1 MET A 668 4.802 -10.450 -5.221 1.00 0.00 H new ATOM 0 HE2 MET A 668 3.662 -11.812 -5.331 1.00 0.00 H new ATOM 0 HE3 MET A 668 5.360 -12.106 -4.883 1.00 0.00 H new ATOM 508 N ARG A 669 2.812 -16.494 -5.251 1.00 0.00 N ATOM 509 CA ARG A 669 3.007 -17.710 -4.470 1.00 0.00 C ATOM 510 C ARG A 669 1.996 -18.780 -4.870 1.00 0.00 C ATOM 511 O ARG A 669 2.295 -19.974 -4.838 1.00 0.00 O ATOM 512 CB ARG A 669 2.881 -17.407 -2.976 1.00 0.00 C ATOM 513 CG ARG A 669 4.140 -16.810 -2.368 1.00 0.00 C ATOM 514 CD ARG A 669 4.508 -17.499 -1.063 1.00 0.00 C ATOM 515 NE ARG A 669 3.366 -17.605 -0.159 1.00 0.00 N ATOM 516 CZ ARG A 669 3.352 -18.381 0.919 1.00 0.00 C ATOM 517 NH1 ARG A 669 4.413 -19.116 1.225 1.00 0.00 N ATOM 518 NH2 ARG A 669 2.275 -18.424 1.693 1.00 0.00 N ATOM 0 H ARG A 669 2.543 -15.678 -4.701 1.00 0.00 H new ATOM 0 HA ARG A 669 4.009 -18.087 -4.674 1.00 0.00 H new ATOM 0 HB2 ARG A 669 2.051 -16.717 -2.822 1.00 0.00 H new ATOM 0 HB3 ARG A 669 2.633 -18.327 -2.447 1.00 0.00 H new ATOM 0 HG2 ARG A 669 4.965 -16.901 -3.074 1.00 0.00 H new ATOM 0 HG3 ARG A 669 3.990 -15.745 -2.189 1.00 0.00 H new ATOM 0 HD2 ARG A 669 4.895 -18.495 -1.276 1.00 0.00 H new ATOM 0 HD3 ARG A 669 5.308 -16.944 -0.573 1.00 0.00 H new ATOM 0 HE ARG A 669 2.534 -17.053 -0.367 1.00 0.00 H new ATOM 0 HH11 ARG A 669 5.242 -19.086 0.632 1.00 0.00 H new ATOM 0 HH12 ARG A 669 4.400 -19.711 2.053 1.00 0.00 H new ATOM 0 HH21 ARG A 669 1.457 -17.861 1.460 1.00 0.00 H new ATOM 0 HH22 ARG A 669 2.265 -19.020 2.521 1.00 0.00 H new ATOM 532 N ARG A 670 0.797 -18.345 -5.246 1.00 0.00 N ATOM 533 CA ARG A 670 -0.258 -19.265 -5.650 1.00 0.00 C ATOM 534 C ARG A 670 -0.575 -20.253 -4.531 1.00 0.00 C ATOM 535 O ARG A 670 -0.573 -21.466 -4.742 1.00 0.00 O ATOM 536 CB ARG A 670 0.153 -20.023 -6.913 1.00 0.00 C ATOM 537 CG ARG A 670 0.100 -19.177 -8.175 1.00 0.00 C ATOM 538 CD ARG A 670 0.217 -20.034 -9.426 1.00 0.00 C ATOM 539 NE ARG A 670 1.459 -20.803 -9.448 1.00 0.00 N ATOM 540 CZ ARG A 670 1.794 -21.628 -10.434 1.00 0.00 C ATOM 541 NH1 ARG A 670 0.986 -21.790 -11.472 1.00 0.00 N ATOM 542 NH2 ARG A 670 2.942 -22.293 -10.383 1.00 0.00 N ATOM 0 H ARG A 670 0.533 -17.360 -5.279 1.00 0.00 H new ATOM 0 HA ARG A 670 -1.154 -18.681 -5.861 1.00 0.00 H new ATOM 0 HB2 ARG A 670 1.166 -20.405 -6.784 1.00 0.00 H new ATOM 0 HB3 ARG A 670 -0.500 -20.887 -7.037 1.00 0.00 H new ATOM 0 HG2 ARG A 670 -0.836 -18.619 -8.201 1.00 0.00 H new ATOM 0 HG3 ARG A 670 0.907 -18.445 -8.158 1.00 0.00 H new ATOM 0 HD2 ARG A 670 -0.632 -20.715 -9.480 1.00 0.00 H new ATOM 0 HD3 ARG A 670 0.170 -19.396 -10.308 1.00 0.00 H new ATOM 0 HE ARG A 670 2.104 -20.701 -8.664 1.00 0.00 H new ATOM 0 HH11 ARG A 670 0.104 -21.280 -11.516 1.00 0.00 H new ATOM 0 HH12 ARG A 670 1.247 -22.424 -12.227 1.00 0.00 H new ATOM 0 HH21 ARG A 670 3.567 -22.171 -9.586 1.00 0.00 H new ATOM 0 HH22 ARG A 670 3.199 -22.926 -11.140 1.00 0.00 H new ATOM 556 N ARG A 671 -0.847 -19.726 -3.342 1.00 0.00 N ATOM 557 CA ARG A 671 -1.164 -20.562 -2.190 1.00 0.00 C ATOM 558 C ARG A 671 -2.670 -20.611 -1.953 1.00 0.00 C ATOM 559 O ARG A 671 -3.288 -19.603 -1.607 1.00 0.00 O ATOM 560 CB ARG A 671 -0.457 -20.034 -0.940 1.00 0.00 C ATOM 561 CG ARG A 671 -0.757 -20.838 0.314 1.00 0.00 C ATOM 562 CD ARG A 671 0.302 -21.901 0.562 1.00 0.00 C ATOM 563 NE ARG A 671 -0.104 -22.846 1.599 1.00 0.00 N ATOM 564 CZ ARG A 671 0.720 -23.732 2.148 1.00 0.00 C ATOM 565 NH1 ARG A 671 1.986 -23.793 1.762 1.00 0.00 N ATOM 566 NH2 ARG A 671 0.276 -24.559 3.086 1.00 0.00 N ATOM 0 H ARG A 671 -0.854 -18.724 -3.151 1.00 0.00 H new ATOM 0 HA ARG A 671 -0.813 -21.573 -2.398 1.00 0.00 H new ATOM 0 HB2 ARG A 671 0.619 -20.035 -1.114 1.00 0.00 H new ATOM 0 HB3 ARG A 671 -0.752 -18.998 -0.776 1.00 0.00 H new ATOM 0 HG2 ARG A 671 -0.810 -20.169 1.173 1.00 0.00 H new ATOM 0 HG3 ARG A 671 -1.734 -21.312 0.219 1.00 0.00 H new ATOM 0 HD2 ARG A 671 0.497 -22.441 -0.364 1.00 0.00 H new ATOM 0 HD3 ARG A 671 1.236 -21.421 0.854 1.00 0.00 H new ATOM 0 HE ARG A 671 -1.072 -22.825 1.919 1.00 0.00 H new ATOM 0 HH11 ARG A 671 2.331 -23.159 1.041 1.00 0.00 H new ATOM 0 HH12 ARG A 671 2.616 -24.474 2.185 1.00 0.00 H new ATOM 0 HH21 ARG A 671 -0.698 -24.515 3.386 1.00 0.00 H new ATOM 0 HH22 ARG A 671 0.909 -25.239 3.507 1.00 0.00 H new ATOM 580 N HIS A 672 -3.256 -21.790 -2.140 1.00 0.00 N ATOM 581 CA HIS A 672 -4.690 -21.971 -1.946 1.00 0.00 C ATOM 582 C HIS A 672 -5.002 -23.395 -1.496 1.00 0.00 C ATOM 583 O HIS A 672 -4.108 -24.236 -1.403 1.00 0.00 O ATOM 584 CB HIS A 672 -5.445 -21.655 -3.238 1.00 0.00 C ATOM 585 CG HIS A 672 -5.393 -20.208 -3.624 1.00 0.00 C ATOM 586 ND1 HIS A 672 -4.580 -19.726 -4.628 1.00 0.00 N ATOM 587 CD2 HIS A 672 -6.061 -19.137 -3.135 1.00 0.00 C ATOM 588 CE1 HIS A 672 -4.749 -18.420 -4.738 1.00 0.00 C ATOM 589 NE2 HIS A 672 -5.643 -18.038 -3.844 1.00 0.00 N ATOM 0 H HIS A 672 -2.759 -22.634 -2.426 1.00 0.00 H new ATOM 0 HA HIS A 672 -5.016 -21.283 -1.166 1.00 0.00 H new ATOM 0 HB2 HIS A 672 -5.029 -22.254 -4.048 1.00 0.00 H new ATOM 0 HB3 HIS A 672 -6.487 -21.955 -3.123 1.00 0.00 H new ATOM 0 HD2 HIS A 672 -6.788 -19.145 -2.336 1.00 0.00 H new ATOM 0 HE1 HIS A 672 -4.242 -17.774 -5.440 1.00 0.00 H new ATOM 0 HE2 HIS A 672 -5.970 -17.082 -3.703 1.00 0.00 H new ATOM 597 N ILE A 673 -6.275 -23.657 -1.218 1.00 0.00 N ATOM 598 CA ILE A 673 -6.703 -24.979 -0.779 1.00 0.00 C ATOM 599 C ILE A 673 -7.190 -25.818 -1.955 1.00 0.00 C ATOM 600 O ILE A 673 -8.293 -25.615 -2.462 1.00 0.00 O ATOM 601 CB ILE A 673 -7.827 -24.886 0.271 1.00 0.00 C ATOM 602 CG1 ILE A 673 -7.357 -24.079 1.483 1.00 0.00 C ATOM 603 CG2 ILE A 673 -8.272 -26.277 0.694 1.00 0.00 C ATOM 604 CD1 ILE A 673 -8.456 -23.792 2.481 1.00 0.00 C ATOM 0 H ILE A 673 -7.027 -22.972 -1.289 1.00 0.00 H new ATOM 0 HA ILE A 673 -5.834 -25.459 -0.329 1.00 0.00 H new ATOM 0 HB ILE A 673 -8.679 -24.373 -0.175 1.00 0.00 H new ATOM 0 HG12 ILE A 673 -6.556 -24.623 1.983 1.00 0.00 H new ATOM 0 HG13 ILE A 673 -6.934 -23.135 1.139 1.00 0.00 H new ATOM 0 HG21 ILE A 673 -9.066 -26.195 1.436 1.00 0.00 H new ATOM 0 HG22 ILE A 673 -8.642 -26.821 -0.175 1.00 0.00 H new ATOM 0 HG23 ILE A 673 -7.427 -26.814 1.125 1.00 0.00 H new ATOM 0 HD11 ILE A 673 -8.051 -23.217 3.313 1.00 0.00 H new ATOM 0 HD12 ILE A 673 -9.247 -23.220 1.996 1.00 0.00 H new ATOM 0 HD13 ILE A 673 -8.863 -24.732 2.854 1.00 0.00 H new ATOM 616 N VAL A 674 -6.360 -26.764 -2.384 1.00 0.00 N ATOM 617 CA VAL A 674 -6.706 -27.637 -3.498 1.00 0.00 C ATOM 618 C VAL A 674 -7.097 -29.027 -3.007 1.00 0.00 C ATOM 619 O VAL A 674 -7.953 -29.687 -3.596 1.00 0.00 O ATOM 620 CB VAL A 674 -5.539 -27.766 -4.494 1.00 0.00 C ATOM 621 CG1 VAL A 674 -5.957 -28.588 -5.704 1.00 0.00 C ATOM 622 CG2 VAL A 674 -5.047 -26.391 -4.919 1.00 0.00 C ATOM 0 H VAL A 674 -5.443 -26.945 -1.976 1.00 0.00 H new ATOM 0 HA VAL A 674 -7.557 -27.181 -4.004 1.00 0.00 H new ATOM 0 HB VAL A 674 -4.718 -28.284 -3.999 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -5.119 -28.668 -6.397 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -6.257 -29.585 -5.381 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -6.795 -28.101 -6.203 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -4.222 -26.501 -5.623 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -5.861 -25.845 -5.396 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -4.705 -25.840 -4.043 1.00 0.00 H new ATOM 632 N ARG A 675 -6.463 -29.465 -1.924 1.00 0.00 N ATOM 633 CA ARG A 675 -6.743 -30.777 -1.354 1.00 0.00 C ATOM 634 C ARG A 675 -8.208 -30.889 -0.940 1.00 0.00 C ATOM 635 O ARG A 675 -8.735 -30.022 -0.243 1.00 0.00 O ATOM 636 CB ARG A 675 -5.840 -31.035 -0.146 1.00 0.00 C ATOM 637 CG ARG A 675 -6.074 -32.386 0.511 1.00 0.00 C ATOM 638 CD ARG A 675 -5.271 -32.526 1.795 1.00 0.00 C ATOM 639 NE ARG A 675 -5.874 -31.787 2.901 1.00 0.00 N ATOM 640 CZ ARG A 675 -6.983 -32.171 3.523 1.00 0.00 C ATOM 641 NH1 ARG A 675 -7.607 -33.280 3.150 1.00 0.00 N ATOM 642 NH2 ARG A 675 -7.470 -31.445 4.522 1.00 0.00 N ATOM 0 H ARG A 675 -5.752 -28.931 -1.424 1.00 0.00 H new ATOM 0 HA ARG A 675 -6.541 -31.528 -2.118 1.00 0.00 H new ATOM 0 HB2 ARG A 675 -4.799 -30.969 -0.461 1.00 0.00 H new ATOM 0 HB3 ARG A 675 -6.001 -30.249 0.592 1.00 0.00 H new ATOM 0 HG2 ARG A 675 -7.135 -32.507 0.729 1.00 0.00 H new ATOM 0 HG3 ARG A 675 -5.798 -33.181 -0.181 1.00 0.00 H new ATOM 0 HD2 ARG A 675 -5.195 -33.580 2.062 1.00 0.00 H new ATOM 0 HD3 ARG A 675 -4.256 -32.165 1.629 1.00 0.00 H new ATOM 0 HE ARG A 675 -5.419 -30.929 3.213 1.00 0.00 H new ATOM 0 HH11 ARG A 675 -7.236 -33.841 2.383 1.00 0.00 H new ATOM 0 HH12 ARG A 675 -8.458 -33.572 3.630 1.00 0.00 H new ATOM 0 HH21 ARG A 675 -6.993 -30.592 4.812 1.00 0.00 H new ATOM 0 HH22 ARG A 675 -8.322 -31.740 4.999 1.00 0.00 H new ATOM 656 N LYS A 676 -8.860 -31.961 -1.375 1.00 0.00 N ATOM 657 CA LYS A 676 -10.263 -32.188 -1.051 1.00 0.00 C ATOM 658 C LYS A 676 -10.492 -33.628 -0.603 1.00 0.00 C ATOM 659 O LYS A 676 -10.023 -34.569 -1.243 1.00 0.00 O ATOM 660 CB LYS A 676 -11.145 -31.873 -2.261 1.00 0.00 C ATOM 661 CG LYS A 676 -12.592 -31.581 -1.900 1.00 0.00 C ATOM 662 CD LYS A 676 -13.429 -32.849 -1.882 1.00 0.00 C ATOM 663 CE LYS A 676 -13.740 -33.330 -3.291 1.00 0.00 C ATOM 664 NZ LYS A 676 -14.980 -32.705 -3.830 1.00 0.00 N ATOM 0 H LYS A 676 -8.439 -32.688 -1.954 1.00 0.00 H new ATOM 0 HA LYS A 676 -10.532 -31.523 -0.230 1.00 0.00 H new ATOM 0 HB2 LYS A 676 -10.730 -31.014 -2.788 1.00 0.00 H new ATOM 0 HB3 LYS A 676 -11.115 -32.716 -2.951 1.00 0.00 H new ATOM 0 HG2 LYS A 676 -12.634 -31.102 -0.922 1.00 0.00 H new ATOM 0 HG3 LYS A 676 -13.012 -30.877 -2.618 1.00 0.00 H new ATOM 0 HD2 LYS A 676 -12.897 -33.630 -1.339 1.00 0.00 H new ATOM 0 HD3 LYS A 676 -14.360 -32.665 -1.345 1.00 0.00 H new ATOM 0 HE2 LYS A 676 -12.901 -33.098 -3.947 1.00 0.00 H new ATOM 0 HE3 LYS A 676 -13.852 -34.414 -3.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 676 -15.157 -33.059 -4.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 676 -15.785 -32.948 -3.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 676 -14.865 -31.672 -3.857 1.00 0.00 H new ATOM 678 N ARG A 677 -11.218 -33.792 0.499 1.00 0.00 N ATOM 679 CA ARG A 677 -11.510 -35.118 1.031 1.00 0.00 C ATOM 680 C ARG A 677 -12.323 -35.938 0.034 1.00 0.00 C ATOM 681 O ARG A 677 -12.376 -37.160 0.161 1.00 0.00 O ATOM 682 CB ARG A 677 -12.270 -35.003 2.353 1.00 0.00 C ATOM 683 CG ARG A 677 -12.152 -36.238 3.232 1.00 0.00 C ATOM 684 CD ARG A 677 -10.931 -36.165 4.136 1.00 0.00 C ATOM 685 NE ARG A 677 -10.687 -37.426 4.829 1.00 0.00 N ATOM 686 CZ ARG A 677 -9.606 -37.664 5.564 1.00 0.00 C ATOM 687 NH1 ARG A 677 -8.675 -36.729 5.701 1.00 0.00 N ATOM 688 NH2 ARG A 677 -9.455 -38.837 6.164 1.00 0.00 N ATOM 0 H ARG A 677 -11.614 -33.024 1.040 1.00 0.00 H new ATOM 0 HA ARG A 677 -10.563 -35.628 1.207 1.00 0.00 H new ATOM 0 HB2 ARG A 677 -11.897 -34.139 2.903 1.00 0.00 H new ATOM 0 HB3 ARG A 677 -13.323 -34.817 2.142 1.00 0.00 H new ATOM 0 HG2 ARG A 677 -13.051 -36.340 3.840 1.00 0.00 H new ATOM 0 HG3 ARG A 677 -12.089 -37.127 2.605 1.00 0.00 H new ATOM 0 HD2 ARG A 677 -10.056 -35.903 3.542 1.00 0.00 H new ATOM 0 HD3 ARG A 677 -11.069 -35.370 4.868 1.00 0.00 H new ATOM 0 HE ARG A 677 -11.385 -38.165 4.744 1.00 0.00 H new ATOM 0 HH11 ARG A 677 -8.788 -35.825 5.242 1.00 0.00 H new ATOM 0 HH12 ARG A 677 -7.846 -36.914 6.266 1.00 0.00 H new ATOM 0 HH21 ARG A 677 -10.169 -39.558 6.062 1.00 0.00 H new ATOM 0 HH22 ARG A 677 -8.625 -39.018 6.728 1.00 0.00 H new TER 702 ARG A 677 ATOM 703 N GLU B 634 -15.303 27.219 -15.033 1.00 0.00 N ATOM 704 CA GLU B 634 -14.978 26.453 -13.835 1.00 0.00 C ATOM 705 C GLU B 634 -13.467 26.306 -13.677 1.00 0.00 C ATOM 706 O GLU B 634 -12.956 26.199 -12.563 1.00 0.00 O ATOM 707 CB GLU B 634 -15.632 25.072 -13.893 1.00 0.00 C ATOM 708 CG GLU B 634 -15.627 24.340 -12.561 1.00 0.00 C ATOM 709 CD GLU B 634 -16.826 24.685 -11.700 1.00 0.00 C ATOM 710 OE1 GLU B 634 -17.938 24.210 -12.012 1.00 0.00 O ATOM 711 OE2 GLU B 634 -16.652 25.432 -10.714 1.00 0.00 O ATOM 0 HA GLU B 634 -15.366 26.995 -12.972 1.00 0.00 H new ATOM 0 HB2 GLU B 634 -16.661 25.181 -14.234 1.00 0.00 H new ATOM 0 HB3 GLU B 634 -15.113 24.464 -14.634 1.00 0.00 H new ATOM 0 HG2 GLU B 634 -15.612 23.265 -12.742 1.00 0.00 H new ATOM 0 HG3 GLU B 634 -14.713 24.585 -12.020 1.00 0.00 H new ATOM 718 N GLY B 635 -12.758 26.302 -14.802 1.00 0.00 N ATOM 719 CA GLY B 635 -11.313 26.167 -14.768 1.00 0.00 C ATOM 720 C GLY B 635 -10.847 24.800 -15.229 1.00 0.00 C ATOM 721 O GLY B 635 -11.133 24.386 -16.353 1.00 0.00 O ATOM 0 H GLY B 635 -13.158 26.390 -15.736 1.00 0.00 H new ATOM 0 HA2 GLY B 635 -10.865 26.933 -15.401 1.00 0.00 H new ATOM 0 HA3 GLY B 635 -10.958 26.345 -13.753 1.00 0.00 H new ATOM 725 N CYS B 636 -10.128 24.098 -14.360 1.00 0.00 N ATOM 726 CA CYS B 636 -9.619 22.771 -14.686 1.00 0.00 C ATOM 727 C CYS B 636 -10.049 21.751 -13.636 1.00 0.00 C ATOM 728 O CYS B 636 -10.346 22.091 -12.490 1.00 0.00 O ATOM 729 CB CYS B 636 -8.094 22.798 -14.792 1.00 0.00 C ATOM 730 SG CYS B 636 -7.275 23.671 -13.437 1.00 0.00 S ATOM 0 H CYS B 636 -9.885 24.425 -13.425 1.00 0.00 H new ATOM 0 HA CYS B 636 -10.038 22.475 -15.648 1.00 0.00 H new ATOM 0 HB2 CYS B 636 -7.725 21.773 -14.825 1.00 0.00 H new ATOM 0 HB3 CYS B 636 -7.814 23.268 -15.735 1.00 0.00 H new ATOM 0 HG CYS B 636 -7.983 23.552 -12.353 1.00 0.00 H new ATOM 736 N PRO B 637 -10.086 20.471 -14.034 1.00 0.00 N ATOM 737 CA PRO B 637 -10.480 19.376 -13.142 1.00 0.00 C ATOM 738 C PRO B 637 -9.443 19.111 -12.056 1.00 0.00 C ATOM 739 O PRO B 637 -8.688 18.140 -12.128 1.00 0.00 O ATOM 740 CB PRO B 637 -10.588 18.174 -14.084 1.00 0.00 C ATOM 741 CG PRO B 637 -9.682 18.500 -15.221 1.00 0.00 C ATOM 742 CD PRO B 637 -9.745 19.994 -15.384 1.00 0.00 C ATOM 0 HA PRO B 637 -11.402 19.599 -12.605 1.00 0.00 H new ATOM 0 HB2 PRO B 637 -10.283 17.253 -13.587 1.00 0.00 H new ATOM 0 HB3 PRO B 637 -11.613 18.029 -14.424 1.00 0.00 H new ATOM 0 HG2 PRO B 637 -8.663 18.172 -15.015 1.00 0.00 H new ATOM 0 HG3 PRO B 637 -10.001 17.994 -16.132 1.00 0.00 H new ATOM 0 HD2 PRO B 637 -8.793 20.401 -15.725 1.00 0.00 H new ATOM 0 HD3 PRO B 637 -10.498 20.287 -16.116 1.00 0.00 H new ATOM 750 N THR B 638 -9.412 19.979 -11.050 1.00 0.00 N ATOM 751 CA THR B 638 -8.467 19.839 -9.949 1.00 0.00 C ATOM 752 C THR B 638 -7.044 19.655 -10.466 1.00 0.00 C ATOM 753 O THR B 638 -6.273 18.868 -9.919 1.00 0.00 O ATOM 754 CB THR B 638 -8.831 18.646 -9.045 1.00 0.00 C ATOM 755 OG1 THR B 638 -10.254 18.511 -8.961 1.00 0.00 O ATOM 756 CG2 THR B 638 -8.251 18.828 -7.650 1.00 0.00 C ATOM 0 H THR B 638 -10.031 20.787 -10.975 1.00 0.00 H new ATOM 0 HA THR B 638 -8.523 20.758 -9.365 1.00 0.00 H new ATOM 0 HB THR B 638 -8.406 17.743 -9.484 1.00 0.00 H new ATOM 0 HG1 THR B 638 -10.477 17.749 -8.386 1.00 0.00 H new ATOM 0 HG21 THR B 638 -8.521 17.974 -7.029 1.00 0.00 H new ATOM 0 HG22 THR B 638 -7.165 18.901 -7.714 1.00 0.00 H new ATOM 0 HG23 THR B 638 -8.651 19.740 -7.206 1.00 0.00 H new ATOM 764 N ASN B 639 -6.704 20.386 -11.522 1.00 0.00 N ATOM 765 CA ASN B 639 -5.373 20.303 -12.112 1.00 0.00 C ATOM 766 C ASN B 639 -4.394 21.214 -11.377 1.00 0.00 C ATOM 767 O ASN B 639 -4.558 22.433 -11.360 1.00 0.00 O ATOM 768 CB ASN B 639 -5.425 20.681 -13.593 1.00 0.00 C ATOM 769 CG ASN B 639 -4.371 19.960 -14.412 1.00 0.00 C ATOM 770 OD1 ASN B 639 -4.278 18.732 -14.380 1.00 0.00 O ATOM 771 ND2 ASN B 639 -3.571 20.721 -15.149 1.00 0.00 N ATOM 0 H ASN B 639 -7.331 21.042 -11.987 1.00 0.00 H new ATOM 0 HA ASN B 639 -5.025 19.274 -12.018 1.00 0.00 H new ATOM 0 HB2 ASN B 639 -6.413 20.447 -13.990 1.00 0.00 H new ATOM 0 HB3 ASN B 639 -5.287 21.757 -13.695 1.00 0.00 H new ATOM 0 HD21 ASN B 639 -2.843 20.292 -15.720 1.00 0.00 H new ATOM 0 HD22 ASN B 639 -3.685 21.735 -15.144 1.00 0.00 H new ATOM 778 N GLY B 640 -3.375 20.613 -10.771 1.00 0.00 N ATOM 779 CA GLY B 640 -2.384 21.384 -10.043 1.00 0.00 C ATOM 780 C GLY B 640 -1.755 20.598 -8.910 1.00 0.00 C ATOM 781 O GLY B 640 -1.961 20.892 -7.733 1.00 0.00 O ATOM 0 H GLY B 640 -3.218 19.605 -10.771 1.00 0.00 H new ATOM 0 HA2 GLY B 640 -1.604 21.710 -10.731 1.00 0.00 H new ATOM 0 HA3 GLY B 640 -2.851 22.283 -9.642 1.00 0.00 H new ATOM 785 N PRO B 641 -0.968 19.571 -9.263 1.00 0.00 N ATOM 786 CA PRO B 641 -0.291 18.718 -8.282 1.00 0.00 C ATOM 787 C PRO B 641 0.828 19.452 -7.550 1.00 0.00 C ATOM 788 O PRO B 641 1.291 20.502 -7.996 1.00 0.00 O ATOM 789 CB PRO B 641 0.281 17.583 -9.133 1.00 0.00 C ATOM 790 CG PRO B 641 0.442 18.172 -10.492 1.00 0.00 C ATOM 791 CD PRO B 641 -0.677 19.164 -10.648 1.00 0.00 C ATOM 0 HA PRO B 641 -0.969 18.381 -7.498 1.00 0.00 H new ATOM 0 HB2 PRO B 641 1.235 17.234 -8.737 1.00 0.00 H new ATOM 0 HB3 PRO B 641 -0.390 16.724 -9.151 1.00 0.00 H new ATOM 0 HG2 PRO B 641 1.412 18.659 -10.594 1.00 0.00 H new ATOM 0 HG3 PRO B 641 0.390 17.401 -11.260 1.00 0.00 H new ATOM 0 HD2 PRO B 641 -0.378 20.014 -11.262 1.00 0.00 H new ATOM 0 HD3 PRO B 641 -1.548 18.716 -11.126 1.00 0.00 H new ATOM 799 N LYS B 642 1.259 18.893 -6.425 1.00 0.00 N ATOM 800 CA LYS B 642 2.326 19.492 -5.631 1.00 0.00 C ATOM 801 C LYS B 642 3.294 18.426 -5.128 1.00 0.00 C ATOM 802 O LYS B 642 2.939 17.598 -4.289 1.00 0.00 O ATOM 803 CB LYS B 642 1.737 20.262 -4.447 1.00 0.00 C ATOM 804 CG LYS B 642 1.412 21.711 -4.764 1.00 0.00 C ATOM 805 CD LYS B 642 2.661 22.577 -4.760 1.00 0.00 C ATOM 806 CE LYS B 642 2.906 23.194 -3.392 1.00 0.00 C ATOM 807 NZ LYS B 642 1.889 24.230 -3.060 1.00 0.00 N ATOM 0 H LYS B 642 0.886 18.025 -6.042 1.00 0.00 H new ATOM 0 HA LYS B 642 2.876 20.184 -6.269 1.00 0.00 H new ATOM 0 HB2 LYS B 642 0.829 19.760 -4.113 1.00 0.00 H new ATOM 0 HB3 LYS B 642 2.442 20.230 -3.617 1.00 0.00 H new ATOM 0 HG2 LYS B 642 0.929 21.771 -5.740 1.00 0.00 H new ATOM 0 HG3 LYS B 642 0.701 22.094 -4.032 1.00 0.00 H new ATOM 0 HD2 LYS B 642 3.523 21.976 -5.049 1.00 0.00 H new ATOM 0 HD3 LYS B 642 2.560 23.367 -5.504 1.00 0.00 H new ATOM 0 HE2 LYS B 642 2.889 22.412 -2.633 1.00 0.00 H new ATOM 0 HE3 LYS B 642 3.900 23.640 -3.368 1.00 0.00 H new ATOM 0 HZ1 LYS B 642 2.271 24.872 -2.337 1.00 0.00 H new ATOM 0 HZ2 LYS B 642 1.654 24.772 -3.916 1.00 0.00 H new ATOM 0 HZ3 LYS B 642 1.031 23.770 -2.695 1.00 0.00 H new ATOM 821 N ILE B 643 4.518 18.455 -5.645 1.00 0.00 N ATOM 822 CA ILE B 643 5.537 17.492 -5.245 1.00 0.00 C ATOM 823 C ILE B 643 6.769 18.197 -4.687 1.00 0.00 C ATOM 824 O ILE B 643 7.825 18.248 -5.318 1.00 0.00 O ATOM 825 CB ILE B 643 5.962 16.599 -6.425 1.00 0.00 C ATOM 826 CG1 ILE B 643 5.828 17.362 -7.745 1.00 0.00 C ATOM 827 CG2 ILE B 643 5.125 15.328 -6.455 1.00 0.00 C ATOM 828 CD1 ILE B 643 6.640 16.765 -8.873 1.00 0.00 C ATOM 0 H ILE B 643 4.828 19.134 -6.341 1.00 0.00 H new ATOM 0 HA ILE B 643 5.094 16.868 -4.469 1.00 0.00 H new ATOM 0 HB ILE B 643 7.007 16.320 -6.293 1.00 0.00 H new ATOM 0 HG12 ILE B 643 4.778 17.385 -8.037 1.00 0.00 H new ATOM 0 HG13 ILE B 643 6.139 18.395 -7.591 1.00 0.00 H new ATOM 0 HG21 ILE B 643 5.437 14.707 -7.295 1.00 0.00 H new ATOM 0 HG22 ILE B 643 5.265 14.778 -5.525 1.00 0.00 H new ATOM 0 HG23 ILE B 643 4.072 15.588 -6.567 1.00 0.00 H new ATOM 0 HD11 ILE B 643 6.497 17.357 -9.777 1.00 0.00 H new ATOM 0 HD12 ILE B 643 7.696 16.766 -8.602 1.00 0.00 H new ATOM 0 HD13 ILE B 643 6.313 15.741 -9.054 1.00 0.00 H new ATOM 840 N PRO B 644 6.634 18.752 -3.473 1.00 0.00 N ATOM 841 CA PRO B 644 7.727 19.462 -2.802 1.00 0.00 C ATOM 842 C PRO B 644 8.841 18.521 -2.355 1.00 0.00 C ATOM 843 O PRO B 644 8.883 17.359 -2.757 1.00 0.00 O ATOM 844 CB PRO B 644 7.044 20.097 -1.588 1.00 0.00 C ATOM 845 CG PRO B 644 5.862 19.230 -1.321 1.00 0.00 C ATOM 846 CD PRO B 644 5.405 18.730 -2.664 1.00 0.00 C ATOM 0 HA PRO B 644 8.211 20.182 -3.461 1.00 0.00 H new ATOM 0 HB2 PRO B 644 7.714 20.129 -0.729 1.00 0.00 H new ATOM 0 HB3 PRO B 644 6.743 21.124 -1.795 1.00 0.00 H new ATOM 0 HG2 PRO B 644 6.126 18.401 -0.665 1.00 0.00 H new ATOM 0 HG3 PRO B 644 5.071 19.791 -0.823 1.00 0.00 H new ATOM 0 HD2 PRO B 644 4.986 17.726 -2.597 1.00 0.00 H new ATOM 0 HD3 PRO B 644 4.632 19.370 -3.089 1.00 0.00 H new ATOM 854 N SER B 645 9.741 19.032 -1.521 1.00 0.00 N ATOM 855 CA SER B 645 10.858 18.238 -1.022 1.00 0.00 C ATOM 856 C SER B 645 10.369 17.149 -0.072 1.00 0.00 C ATOM 857 O SER B 645 11.106 16.219 0.256 1.00 0.00 O ATOM 858 CB SER B 645 11.871 19.135 -0.310 1.00 0.00 C ATOM 859 OG SER B 645 11.711 20.490 -0.693 1.00 0.00 O ATOM 0 H SER B 645 9.719 19.992 -1.177 1.00 0.00 H new ATOM 0 HA SER B 645 11.342 17.761 -1.874 1.00 0.00 H new ATOM 0 HB2 SER B 645 11.748 19.042 0.769 1.00 0.00 H new ATOM 0 HB3 SER B 645 12.883 18.804 -0.545 1.00 0.00 H new ATOM 0 HG SER B 645 12.541 20.815 -1.101 1.00 0.00 H new ATOM 865 N ILE B 646 9.121 17.273 0.367 1.00 0.00 N ATOM 866 CA ILE B 646 8.532 16.301 1.279 1.00 0.00 C ATOM 867 C ILE B 646 8.361 14.945 0.602 1.00 0.00 C ATOM 868 O ILE B 646 8.117 13.936 1.262 1.00 0.00 O ATOM 869 CB ILE B 646 7.164 16.776 1.803 1.00 0.00 C ATOM 870 CG1 ILE B 646 7.293 18.157 2.450 1.00 0.00 C ATOM 871 CG2 ILE B 646 6.598 15.771 2.795 1.00 0.00 C ATOM 872 CD1 ILE B 646 6.416 19.209 1.807 1.00 0.00 C ATOM 0 H ILE B 646 8.498 18.037 0.106 1.00 0.00 H new ATOM 0 HA ILE B 646 9.219 16.201 2.119 1.00 0.00 H new ATOM 0 HB ILE B 646 6.476 16.852 0.961 1.00 0.00 H new ATOM 0 HG12 ILE B 646 7.038 18.079 3.507 1.00 0.00 H new ATOM 0 HG13 ILE B 646 8.333 18.479 2.396 1.00 0.00 H new ATOM 0 HG21 ILE B 646 5.631 16.121 3.156 1.00 0.00 H new ATOM 0 HG22 ILE B 646 6.474 14.806 2.304 1.00 0.00 H new ATOM 0 HG23 ILE B 646 7.283 15.665 3.636 1.00 0.00 H new ATOM 0 HD11 ILE B 646 6.559 20.162 2.316 1.00 0.00 H new ATOM 0 HD12 ILE B 646 6.686 19.315 0.756 1.00 0.00 H new ATOM 0 HD13 ILE B 646 5.371 18.909 1.885 1.00 0.00 H new ATOM 884 N ALA B 647 8.494 14.930 -0.720 1.00 0.00 N ATOM 885 CA ALA B 647 8.359 13.698 -1.488 1.00 0.00 C ATOM 886 C ALA B 647 9.242 12.595 -0.915 1.00 0.00 C ATOM 887 O ALA B 647 8.898 11.414 -0.976 1.00 0.00 O ATOM 888 CB ALA B 647 8.701 13.946 -2.949 1.00 0.00 C ATOM 0 H ALA B 647 8.695 15.757 -1.282 1.00 0.00 H new ATOM 0 HA ALA B 647 7.322 13.369 -1.421 1.00 0.00 H new ATOM 0 HB1 ALA B 647 8.596 13.017 -3.510 1.00 0.00 H new ATOM 0 HB2 ALA B 647 8.025 14.696 -3.359 1.00 0.00 H new ATOM 0 HB3 ALA B 647 9.728 14.302 -3.027 1.00 0.00 H new ATOM 894 N THR B 648 10.384 12.987 -0.359 1.00 0.00 N ATOM 895 CA THR B 648 11.319 12.031 0.223 1.00 0.00 C ATOM 896 C THR B 648 10.624 11.132 1.239 1.00 0.00 C ATOM 897 O THR B 648 10.766 9.910 1.201 1.00 0.00 O ATOM 898 CB THR B 648 12.499 12.745 0.908 1.00 0.00 C ATOM 899 OG1 THR B 648 12.807 13.958 0.214 1.00 0.00 O ATOM 900 CG2 THR B 648 13.727 11.848 0.944 1.00 0.00 C ATOM 0 H THR B 648 10.684 13.960 -0.299 1.00 0.00 H new ATOM 0 HA THR B 648 11.700 11.422 -0.597 1.00 0.00 H new ATOM 0 HB THR B 648 12.209 12.978 1.933 1.00 0.00 H new ATOM 0 HG1 THR B 648 12.177 14.658 0.484 1.00 0.00 H new ATOM 0 HG21 THR B 648 14.547 12.374 1.432 1.00 0.00 H new ATOM 0 HG22 THR B 648 13.497 10.939 1.499 1.00 0.00 H new ATOM 0 HG23 THR B 648 14.018 11.588 -0.074 1.00 0.00 H new ATOM 908 N GLY B 649 9.870 11.744 2.147 1.00 0.00 N ATOM 909 CA GLY B 649 9.163 10.983 3.160 1.00 0.00 C ATOM 910 C GLY B 649 8.037 10.150 2.580 1.00 0.00 C ATOM 911 O GLY B 649 7.798 9.026 3.020 1.00 0.00 O ATOM 0 H GLY B 649 9.736 12.754 2.199 1.00 0.00 H new ATOM 0 HA2 GLY B 649 9.866 10.329 3.675 1.00 0.00 H new ATOM 0 HA3 GLY B 649 8.758 11.666 3.906 1.00 0.00 H new ATOM 915 N MET B 650 7.343 10.703 1.591 1.00 0.00 N ATOM 916 CA MET B 650 6.236 10.004 0.950 1.00 0.00 C ATOM 917 C MET B 650 6.729 8.756 0.224 1.00 0.00 C ATOM 918 O MET B 650 6.143 7.680 0.349 1.00 0.00 O ATOM 919 CB MET B 650 5.519 10.931 -0.033 1.00 0.00 C ATOM 920 CG MET B 650 4.860 12.129 0.631 1.00 0.00 C ATOM 921 SD MET B 650 3.698 11.654 1.925 1.00 0.00 S ATOM 922 CE MET B 650 2.773 10.366 1.093 1.00 0.00 C ATOM 0 H MET B 650 7.528 11.633 1.216 1.00 0.00 H new ATOM 0 HA MET B 650 5.534 9.698 1.726 1.00 0.00 H new ATOM 0 HB2 MET B 650 6.236 11.285 -0.774 1.00 0.00 H new ATOM 0 HB3 MET B 650 4.761 10.361 -0.570 1.00 0.00 H new ATOM 0 HG2 MET B 650 5.630 12.772 1.058 1.00 0.00 H new ATOM 0 HG3 MET B 650 4.337 12.716 -0.124 1.00 0.00 H new ATOM 0 HE1 MET B 650 1.772 10.304 1.519 1.00 0.00 H new ATOM 0 HE2 MET B 650 2.701 10.598 0.030 1.00 0.00 H new ATOM 0 HE3 MET B 650 3.282 9.411 1.222 1.00 0.00 H new ATOM 932 N VAL B 651 7.808 8.907 -0.537 1.00 0.00 N ATOM 933 CA VAL B 651 8.380 7.792 -1.283 1.00 0.00 C ATOM 934 C VAL B 651 8.819 6.672 -0.346 1.00 0.00 C ATOM 935 O VAL B 651 8.519 5.502 -0.578 1.00 0.00 O ATOM 936 CB VAL B 651 9.587 8.243 -2.127 1.00 0.00 C ATOM 937 CG1 VAL B 651 10.163 7.068 -2.904 1.00 0.00 C ATOM 938 CG2 VAL B 651 9.187 9.370 -3.067 1.00 0.00 C ATOM 0 H VAL B 651 8.304 9.791 -0.653 1.00 0.00 H new ATOM 0 HA VAL B 651 7.599 7.421 -1.947 1.00 0.00 H new ATOM 0 HB VAL B 651 10.360 8.618 -1.456 1.00 0.00 H new ATOM 0 HG11 VAL B 651 11.015 7.405 -3.495 1.00 0.00 H new ATOM 0 HG12 VAL B 651 10.487 6.295 -2.207 1.00 0.00 H new ATOM 0 HG13 VAL B 651 9.400 6.661 -3.567 1.00 0.00 H new ATOM 0 HG21 VAL B 651 10.051 9.677 -3.656 1.00 0.00 H new ATOM 0 HG22 VAL B 651 8.398 9.024 -3.734 1.00 0.00 H new ATOM 0 HG23 VAL B 651 8.825 10.218 -2.485 1.00 0.00 H new ATOM 948 N GLY B 652 9.532 7.040 0.714 1.00 0.00 N ATOM 949 CA GLY B 652 10.001 6.054 1.671 1.00 0.00 C ATOM 950 C GLY B 652 8.863 5.304 2.335 1.00 0.00 C ATOM 951 O GLY B 652 8.951 4.095 2.552 1.00 0.00 O ATOM 0 H GLY B 652 9.793 8.003 0.927 1.00 0.00 H new ATOM 0 HA2 GLY B 652 10.654 5.343 1.165 1.00 0.00 H new ATOM 0 HA3 GLY B 652 10.600 6.550 2.435 1.00 0.00 H new ATOM 955 N ALA B 653 7.793 6.021 2.659 1.00 0.00 N ATOM 956 CA ALA B 653 6.633 5.415 3.302 1.00 0.00 C ATOM 957 C ALA B 653 5.853 4.547 2.321 1.00 0.00 C ATOM 958 O ALA B 653 5.475 3.419 2.640 1.00 0.00 O ATOM 959 CB ALA B 653 5.732 6.492 3.888 1.00 0.00 C ATOM 0 H ALA B 653 7.705 7.023 2.487 1.00 0.00 H new ATOM 0 HA ALA B 653 6.989 4.775 4.110 1.00 0.00 H new ATOM 0 HB1 ALA B 653 4.870 6.025 4.365 1.00 0.00 H new ATOM 0 HB2 ALA B 653 6.288 7.069 4.627 1.00 0.00 H new ATOM 0 HB3 ALA B 653 5.392 7.155 3.092 1.00 0.00 H new ATOM 965 N LEU B 654 5.615 5.078 1.127 1.00 0.00 N ATOM 966 CA LEU B 654 4.879 4.351 0.099 1.00 0.00 C ATOM 967 C LEU B 654 5.550 3.017 -0.211 1.00 0.00 C ATOM 968 O LEU B 654 4.892 1.978 -0.270 1.00 0.00 O ATOM 969 CB LEU B 654 4.777 5.192 -1.174 1.00 0.00 C ATOM 970 CG LEU B 654 3.833 6.394 -1.112 1.00 0.00 C ATOM 971 CD1 LEU B 654 4.240 7.446 -2.133 1.00 0.00 C ATOM 972 CD2 LEU B 654 2.395 5.954 -1.341 1.00 0.00 C ATOM 0 H LEU B 654 5.921 6.010 0.847 1.00 0.00 H new ATOM 0 HA LEU B 654 3.876 4.152 0.477 1.00 0.00 H new ATOM 0 HB2 LEU B 654 5.774 5.551 -1.429 1.00 0.00 H new ATOM 0 HB3 LEU B 654 4.454 4.544 -1.989 1.00 0.00 H new ATOM 0 HG LEU B 654 3.903 6.836 -0.118 1.00 0.00 H new ATOM 0 HD11 LEU B 654 3.557 8.293 -2.074 1.00 0.00 H new ATOM 0 HD12 LEU B 654 5.255 7.783 -1.923 1.00 0.00 H new ATOM 0 HD13 LEU B 654 4.200 7.016 -3.134 1.00 0.00 H new ATOM 0 HD21 LEU B 654 1.737 6.822 -1.293 1.00 0.00 H new ATOM 0 HD22 LEU B 654 2.309 5.487 -2.322 1.00 0.00 H new ATOM 0 HD23 LEU B 654 2.107 5.238 -0.572 1.00 0.00 H new ATOM 984 N LEU B 655 6.863 3.054 -0.407 1.00 0.00 N ATOM 985 CA LEU B 655 7.626 1.847 -0.708 1.00 0.00 C ATOM 986 C LEU B 655 7.558 0.856 0.450 1.00 0.00 C ATOM 987 O LEU B 655 7.326 -0.337 0.248 1.00 0.00 O ATOM 988 CB LEU B 655 9.083 2.202 -1.007 1.00 0.00 C ATOM 989 CG LEU B 655 9.343 2.909 -2.337 1.00 0.00 C ATOM 990 CD1 LEU B 655 10.818 3.252 -2.480 1.00 0.00 C ATOM 991 CD2 LEU B 655 8.880 2.044 -3.500 1.00 0.00 C ATOM 0 H LEU B 655 7.422 3.906 -0.363 1.00 0.00 H new ATOM 0 HA LEU B 655 7.185 1.379 -1.588 1.00 0.00 H new ATOM 0 HB2 LEU B 655 9.453 2.837 -0.202 1.00 0.00 H new ATOM 0 HB3 LEU B 655 9.671 1.285 -0.985 1.00 0.00 H new ATOM 0 HG LEU B 655 8.772 3.837 -2.351 1.00 0.00 H new ATOM 0 HD11 LEU B 655 10.984 3.755 -3.433 1.00 0.00 H new ATOM 0 HD12 LEU B 655 11.119 3.910 -1.665 1.00 0.00 H new ATOM 0 HD13 LEU B 655 11.409 2.337 -2.445 1.00 0.00 H new ATOM 0 HD21 LEU B 655 9.073 2.563 -4.439 1.00 0.00 H new ATOM 0 HD22 LEU B 655 9.423 1.099 -3.490 1.00 0.00 H new ATOM 0 HD23 LEU B 655 7.812 1.849 -3.406 1.00 0.00 H new ATOM 1003 N LEU B 656 7.760 1.358 1.663 1.00 0.00 N ATOM 1004 CA LEU B 656 7.720 0.518 2.855 1.00 0.00 C ATOM 1005 C LEU B 656 6.337 -0.098 3.040 1.00 0.00 C ATOM 1006 O LEU B 656 6.210 -1.259 3.433 1.00 0.00 O ATOM 1007 CB LEU B 656 8.096 1.335 4.092 1.00 0.00 C ATOM 1008 CG LEU B 656 9.591 1.569 4.312 1.00 0.00 C ATOM 1009 CD1 LEU B 656 9.816 2.552 5.451 1.00 0.00 C ATOM 1010 CD2 LEU B 656 10.301 0.252 4.595 1.00 0.00 C ATOM 0 H LEU B 656 7.953 2.342 1.847 1.00 0.00 H new ATOM 0 HA LEU B 656 8.443 -0.288 2.726 1.00 0.00 H new ATOM 0 HB2 LEU B 656 7.603 2.305 4.026 1.00 0.00 H new ATOM 0 HB3 LEU B 656 7.694 0.832 4.971 1.00 0.00 H new ATOM 0 HG LEU B 656 10.010 1.997 3.401 1.00 0.00 H new ATOM 0 HD11 LEU B 656 10.886 2.706 5.593 1.00 0.00 H new ATOM 0 HD12 LEU B 656 9.341 3.503 5.210 1.00 0.00 H new ATOM 0 HD13 LEU B 656 9.382 2.152 6.368 1.00 0.00 H new ATOM 0 HD21 LEU B 656 11.364 0.437 4.749 1.00 0.00 H new ATOM 0 HD22 LEU B 656 9.879 -0.204 5.490 1.00 0.00 H new ATOM 0 HD23 LEU B 656 10.169 -0.422 3.748 1.00 0.00 H new ATOM 1022 N LEU B 657 5.303 0.684 2.753 1.00 0.00 N ATOM 1023 CA LEU B 657 3.928 0.215 2.885 1.00 0.00 C ATOM 1024 C LEU B 657 3.683 -1.009 2.009 1.00 0.00 C ATOM 1025 O LEU B 657 3.197 -2.037 2.482 1.00 0.00 O ATOM 1026 CB LEU B 657 2.949 1.329 2.509 1.00 0.00 C ATOM 1027 CG LEU B 657 2.669 2.371 3.593 1.00 0.00 C ATOM 1028 CD1 LEU B 657 1.734 3.449 3.068 1.00 0.00 C ATOM 1029 CD2 LEU B 657 2.081 1.708 4.830 1.00 0.00 C ATOM 0 H LEU B 657 5.390 1.647 2.427 1.00 0.00 H new ATOM 0 HA LEU B 657 3.766 -0.067 3.925 1.00 0.00 H new ATOM 0 HB2 LEU B 657 3.336 1.844 1.630 1.00 0.00 H new ATOM 0 HB3 LEU B 657 2.003 0.872 2.220 1.00 0.00 H new ATOM 0 HG LEU B 657 3.612 2.841 3.871 1.00 0.00 H new ATOM 0 HD11 LEU B 657 1.546 4.182 3.853 1.00 0.00 H new ATOM 0 HD12 LEU B 657 2.193 3.944 2.212 1.00 0.00 H new ATOM 0 HD13 LEU B 657 0.791 2.995 2.762 1.00 0.00 H new ATOM 0 HD21 LEU B 657 1.888 2.464 5.591 1.00 0.00 H new ATOM 0 HD22 LEU B 657 1.147 1.211 4.567 1.00 0.00 H new ATOM 0 HD23 LEU B 657 2.786 0.973 5.219 1.00 0.00 H new ATOM 1041 N LEU B 658 4.025 -0.893 0.731 1.00 0.00 N ATOM 1042 CA LEU B 658 3.846 -1.992 -0.212 1.00 0.00 C ATOM 1043 C LEU B 658 4.588 -3.239 0.257 1.00 0.00 C ATOM 1044 O LEU B 658 4.063 -4.350 0.187 1.00 0.00 O ATOM 1045 CB LEU B 658 4.339 -1.583 -1.601 1.00 0.00 C ATOM 1046 CG LEU B 658 3.373 -0.741 -2.435 1.00 0.00 C ATOM 1047 CD1 LEU B 658 4.120 -0.005 -3.537 1.00 0.00 C ATOM 1048 CD2 LEU B 658 2.275 -1.615 -3.025 1.00 0.00 C ATOM 0 H LEU B 658 4.428 -0.049 0.323 1.00 0.00 H new ATOM 0 HA LEU B 658 2.782 -2.224 -0.264 1.00 0.00 H new ATOM 0 HB2 LEU B 658 5.268 -1.025 -1.485 1.00 0.00 H new ATOM 0 HB3 LEU B 658 4.578 -2.487 -2.161 1.00 0.00 H new ATOM 0 HG LEU B 658 2.910 -0.002 -1.782 1.00 0.00 H new ATOM 0 HD11 LEU B 658 3.416 0.589 -4.120 1.00 0.00 H new ATOM 0 HD12 LEU B 658 4.868 0.652 -3.093 1.00 0.00 H new ATOM 0 HD13 LEU B 658 4.612 -0.727 -4.188 1.00 0.00 H new ATOM 0 HD21 LEU B 658 1.597 -0.999 -3.615 1.00 0.00 H new ATOM 0 HD22 LEU B 658 2.721 -2.378 -3.663 1.00 0.00 H new ATOM 0 HD23 LEU B 658 1.720 -2.095 -2.219 1.00 0.00 H new ATOM 1060 N VAL B 659 5.812 -3.047 0.737 1.00 0.00 N ATOM 1061 CA VAL B 659 6.626 -4.156 1.222 1.00 0.00 C ATOM 1062 C VAL B 659 5.987 -4.817 2.438 1.00 0.00 C ATOM 1063 O VAL B 659 6.063 -6.033 2.609 1.00 0.00 O ATOM 1064 CB VAL B 659 8.047 -3.690 1.591 1.00 0.00 C ATOM 1065 CG1 VAL B 659 8.902 -4.872 2.020 1.00 0.00 C ATOM 1066 CG2 VAL B 659 8.687 -2.954 0.424 1.00 0.00 C ATOM 0 H VAL B 659 6.262 -2.134 0.801 1.00 0.00 H new ATOM 0 HA VAL B 659 6.689 -4.881 0.410 1.00 0.00 H new ATOM 0 HB VAL B 659 7.977 -2.999 2.431 1.00 0.00 H new ATOM 0 HG11 VAL B 659 9.902 -4.523 2.277 1.00 0.00 H new ATOM 0 HG12 VAL B 659 8.451 -5.351 2.889 1.00 0.00 H new ATOM 0 HG13 VAL B 659 8.967 -5.590 1.202 1.00 0.00 H new ATOM 0 HG21 VAL B 659 9.690 -2.632 0.703 1.00 0.00 H new ATOM 0 HG22 VAL B 659 8.746 -3.619 -0.438 1.00 0.00 H new ATOM 0 HG23 VAL B 659 8.084 -2.082 0.169 1.00 0.00 H new ATOM 1076 N VAL B 660 5.356 -4.006 3.281 1.00 0.00 N ATOM 1077 CA VAL B 660 4.701 -4.512 4.482 1.00 0.00 C ATOM 1078 C VAL B 660 3.535 -5.427 4.128 1.00 0.00 C ATOM 1079 O VAL B 660 3.373 -6.498 4.712 1.00 0.00 O ATOM 1080 CB VAL B 660 4.187 -3.361 5.367 1.00 0.00 C ATOM 1081 CG1 VAL B 660 3.350 -3.904 6.516 1.00 0.00 C ATOM 1082 CG2 VAL B 660 5.349 -2.530 5.890 1.00 0.00 C ATOM 0 H VAL B 660 5.284 -2.996 3.155 1.00 0.00 H new ATOM 0 HA VAL B 660 5.449 -5.080 5.036 1.00 0.00 H new ATOM 0 HB VAL B 660 3.553 -2.715 4.760 1.00 0.00 H new ATOM 0 HG11 VAL B 660 2.995 -3.077 7.131 1.00 0.00 H new ATOM 0 HG12 VAL B 660 2.496 -4.452 6.117 1.00 0.00 H new ATOM 0 HG13 VAL B 660 3.958 -4.573 7.125 1.00 0.00 H new ATOM 0 HG21 VAL B 660 4.967 -1.722 6.513 1.00 0.00 H new ATOM 0 HG22 VAL B 660 6.011 -3.162 6.482 1.00 0.00 H new ATOM 0 HG23 VAL B 660 5.903 -2.110 5.050 1.00 0.00 H new ATOM 1092 N ALA B 661 2.724 -4.998 3.166 1.00 0.00 N ATOM 1093 CA ALA B 661 1.573 -5.779 2.732 1.00 0.00 C ATOM 1094 C ALA B 661 2.007 -7.126 2.162 1.00 0.00 C ATOM 1095 O ALA B 661 1.418 -8.162 2.473 1.00 0.00 O ATOM 1096 CB ALA B 661 0.766 -5.003 1.701 1.00 0.00 C ATOM 0 H ALA B 661 2.843 -4.113 2.673 1.00 0.00 H new ATOM 0 HA ALA B 661 0.944 -5.967 3.602 1.00 0.00 H new ATOM 0 HB1 ALA B 661 -0.091 -5.599 1.386 1.00 0.00 H new ATOM 0 HB2 ALA B 661 0.416 -4.069 2.141 1.00 0.00 H new ATOM 0 HB3 ALA B 661 1.394 -4.785 0.837 1.00 0.00 H new ATOM 1102 N LEU B 662 3.040 -7.104 1.327 1.00 0.00 N ATOM 1103 CA LEU B 662 3.553 -8.323 0.713 1.00 0.00 C ATOM 1104 C LEU B 662 3.980 -9.330 1.776 1.00 0.00 C ATOM 1105 O LEU B 662 3.574 -10.491 1.745 1.00 0.00 O ATOM 1106 CB LEU B 662 4.735 -7.999 -0.202 1.00 0.00 C ATOM 1107 CG LEU B 662 4.382 -7.462 -1.590 1.00 0.00 C ATOM 1108 CD1 LEU B 662 5.577 -6.754 -2.209 1.00 0.00 C ATOM 1109 CD2 LEU B 662 3.901 -8.590 -2.492 1.00 0.00 C ATOM 0 H LEU B 662 3.539 -6.255 1.060 1.00 0.00 H new ATOM 0 HA LEU B 662 2.753 -8.765 0.120 1.00 0.00 H new ATOM 0 HB2 LEU B 662 5.367 -7.266 0.300 1.00 0.00 H new ATOM 0 HB3 LEU B 662 5.332 -8.903 -0.325 1.00 0.00 H new ATOM 0 HG LEU B 662 3.573 -6.739 -1.484 1.00 0.00 H new ATOM 0 HD11 LEU B 662 5.306 -6.379 -3.196 1.00 0.00 H new ATOM 0 HD12 LEU B 662 5.875 -5.920 -1.573 1.00 0.00 H new ATOM 0 HD13 LEU B 662 6.407 -7.455 -2.302 1.00 0.00 H new ATOM 0 HD21 LEU B 662 3.654 -8.190 -3.475 1.00 0.00 H new ATOM 0 HD22 LEU B 662 4.688 -9.337 -2.592 1.00 0.00 H new ATOM 0 HD23 LEU B 662 3.015 -9.052 -2.056 1.00 0.00 H new ATOM 1121 N GLY B 663 4.802 -8.876 2.718 1.00 0.00 N ATOM 1122 CA GLY B 663 5.269 -9.750 3.779 1.00 0.00 C ATOM 1123 C GLY B 663 4.130 -10.352 4.577 1.00 0.00 C ATOM 1124 O GLY B 663 4.082 -11.565 4.785 1.00 0.00 O ATOM 0 H GLY B 663 5.153 -7.919 2.765 1.00 0.00 H new ATOM 0 HA2 GLY B 663 5.870 -10.551 3.348 1.00 0.00 H new ATOM 0 HA3 GLY B 663 5.920 -9.188 4.448 1.00 0.00 H new ATOM 1128 N ILE B 664 3.212 -9.504 5.028 1.00 0.00 N ATOM 1129 CA ILE B 664 2.068 -9.960 5.808 1.00 0.00 C ATOM 1130 C ILE B 664 1.271 -11.016 5.050 1.00 0.00 C ATOM 1131 O ILE B 664 0.878 -12.036 5.614 1.00 0.00 O ATOM 1132 CB ILE B 664 1.134 -8.791 6.174 1.00 0.00 C ATOM 1133 CG1 ILE B 664 1.880 -7.760 7.022 1.00 0.00 C ATOM 1134 CG2 ILE B 664 -0.093 -9.305 6.912 1.00 0.00 C ATOM 1135 CD1 ILE B 664 1.220 -6.398 7.037 1.00 0.00 C ATOM 0 H ILE B 664 3.238 -8.497 4.867 1.00 0.00 H new ATOM 0 HA ILE B 664 2.465 -10.397 6.724 1.00 0.00 H new ATOM 0 HB ILE B 664 0.804 -8.307 5.255 1.00 0.00 H new ATOM 0 HG12 ILE B 664 1.956 -8.129 8.045 1.00 0.00 H new ATOM 0 HG13 ILE B 664 2.897 -7.658 6.644 1.00 0.00 H new ATOM 0 HG21 ILE B 664 -0.743 -8.467 7.164 1.00 0.00 H new ATOM 0 HG22 ILE B 664 -0.634 -10.006 6.275 1.00 0.00 H new ATOM 0 HG23 ILE B 664 0.218 -9.811 7.826 1.00 0.00 H new ATOM 0 HD11 ILE B 664 1.803 -5.718 7.658 1.00 0.00 H new ATOM 0 HD12 ILE B 664 1.168 -6.008 6.021 1.00 0.00 H new ATOM 0 HD13 ILE B 664 0.213 -6.486 7.444 1.00 0.00 H new ATOM 1147 N GLY B 665 1.037 -10.764 3.766 1.00 0.00 N ATOM 1148 CA GLY B 665 0.289 -11.703 2.950 1.00 0.00 C ATOM 1149 C GLY B 665 0.914 -13.084 2.935 1.00 0.00 C ATOM 1150 O GLY B 665 0.231 -14.085 3.156 1.00 0.00 O ATOM 0 H GLY B 665 1.352 -9.927 3.276 1.00 0.00 H new ATOM 0 HA2 GLY B 665 -0.732 -11.774 3.326 1.00 0.00 H new ATOM 0 HA3 GLY B 665 0.227 -11.324 1.930 1.00 0.00 H new ATOM 1154 N LEU B 666 2.215 -13.140 2.674 1.00 0.00 N ATOM 1155 CA LEU B 666 2.932 -14.410 2.629 1.00 0.00 C ATOM 1156 C LEU B 666 3.056 -15.014 4.024 1.00 0.00 C ATOM 1157 O LEU B 666 3.037 -16.234 4.187 1.00 0.00 O ATOM 1158 CB LEU B 666 4.322 -14.212 2.022 1.00 0.00 C ATOM 1159 CG LEU B 666 4.369 -13.492 0.674 1.00 0.00 C ATOM 1160 CD1 LEU B 666 5.770 -13.552 0.085 1.00 0.00 C ATOM 1161 CD2 LEU B 666 3.357 -14.096 -0.289 1.00 0.00 C ATOM 0 H LEU B 666 2.795 -12.321 2.490 1.00 0.00 H new ATOM 0 HA LEU B 666 2.364 -15.098 2.004 1.00 0.00 H new ATOM 0 HB2 LEU B 666 4.930 -13.652 2.732 1.00 0.00 H new ATOM 0 HB3 LEU B 666 4.788 -15.190 1.905 1.00 0.00 H new ATOM 0 HG LEU B 666 4.109 -12.446 0.834 1.00 0.00 H new ATOM 0 HD11 LEU B 666 5.784 -13.034 -0.874 1.00 0.00 H new ATOM 0 HD12 LEU B 666 6.472 -13.072 0.767 1.00 0.00 H new ATOM 0 HD13 LEU B 666 6.059 -14.593 -0.060 1.00 0.00 H new ATOM 0 HD21 LEU B 666 3.404 -13.571 -1.243 1.00 0.00 H new ATOM 0 HD22 LEU B 666 3.586 -15.150 -0.443 1.00 0.00 H new ATOM 0 HD23 LEU B 666 2.355 -14.000 0.129 1.00 0.00 H new ATOM 1173 N PHE B 667 3.180 -14.152 5.028 1.00 0.00 N ATOM 1174 CA PHE B 667 3.306 -14.601 6.410 1.00 0.00 C ATOM 1175 C PHE B 667 2.017 -15.265 6.885 1.00 0.00 C ATOM 1176 O PHE B 667 2.035 -16.381 7.403 1.00 0.00 O ATOM 1177 CB PHE B 667 3.652 -13.423 7.322 1.00 0.00 C ATOM 1178 CG PHE B 667 3.489 -13.728 8.783 1.00 0.00 C ATOM 1179 CD1 PHE B 667 2.276 -13.514 9.418 1.00 0.00 C ATOM 1180 CD2 PHE B 667 4.549 -14.228 9.523 1.00 0.00 C ATOM 1181 CE1 PHE B 667 2.122 -13.794 10.763 1.00 0.00 C ATOM 1182 CE2 PHE B 667 4.401 -14.510 10.868 1.00 0.00 C ATOM 1183 CZ PHE B 667 3.187 -14.292 11.489 1.00 0.00 C ATOM 0 H PHE B 667 3.196 -13.139 4.911 1.00 0.00 H new ATOM 0 HA PHE B 667 4.111 -15.335 6.456 1.00 0.00 H new ATOM 0 HB2 PHE B 667 4.682 -13.120 7.135 1.00 0.00 H new ATOM 0 HB3 PHE B 667 3.018 -12.575 7.063 1.00 0.00 H new ATOM 0 HD1 PHE B 667 1.441 -13.124 8.855 1.00 0.00 H new ATOM 0 HD2 PHE B 667 5.501 -14.399 9.043 1.00 0.00 H new ATOM 0 HE1 PHE B 667 1.171 -13.624 11.245 1.00 0.00 H new ATOM 0 HE2 PHE B 667 5.234 -14.901 11.433 1.00 0.00 H new ATOM 0 HZ PHE B 667 3.070 -14.510 12.540 1.00 0.00 H new ATOM 1193 N MET B 668 0.899 -14.570 6.704 1.00 0.00 N ATOM 1194 CA MET B 668 -0.400 -15.092 7.114 1.00 0.00 C ATOM 1195 C MET B 668 -0.710 -16.402 6.397 1.00 0.00 C ATOM 1196 O MET B 668 -1.191 -17.356 7.008 1.00 0.00 O ATOM 1197 CB MET B 668 -1.499 -14.067 6.826 1.00 0.00 C ATOM 1198 CG MET B 668 -1.386 -12.804 7.663 1.00 0.00 C ATOM 1199 SD MET B 668 -2.615 -11.562 7.217 1.00 0.00 S ATOM 1200 CE MET B 668 -2.274 -11.362 5.470 1.00 0.00 C ATOM 0 H MET B 668 0.866 -13.645 6.276 1.00 0.00 H new ATOM 0 HA MET B 668 -0.365 -15.285 8.186 1.00 0.00 H new ATOM 0 HB2 MET B 668 -1.466 -13.798 5.770 1.00 0.00 H new ATOM 0 HB3 MET B 668 -2.470 -14.527 7.007 1.00 0.00 H new ATOM 0 HG2 MET B 668 -1.499 -13.060 8.716 1.00 0.00 H new ATOM 0 HG3 MET B 668 -0.388 -12.382 7.543 1.00 0.00 H new ATOM 0 HE1 MET B 668 -2.311 -10.304 5.211 1.00 0.00 H new ATOM 0 HE2 MET B 668 -1.283 -11.756 5.245 1.00 0.00 H new ATOM 0 HE3 MET B 668 -3.020 -11.904 4.889 1.00 0.00 H new ATOM 1210 N ARG B 669 -0.432 -16.441 5.098 1.00 0.00 N ATOM 1211 CA ARG B 669 -0.683 -17.634 4.298 1.00 0.00 C ATOM 1212 C ARG B 669 0.331 -18.727 4.620 1.00 0.00 C ATOM 1213 O ARG B 669 0.062 -19.913 4.429 1.00 0.00 O ATOM 1214 CB ARG B 669 -0.628 -17.295 2.807 1.00 0.00 C ATOM 1215 CG ARG B 669 -1.897 -16.645 2.283 1.00 0.00 C ATOM 1216 CD ARG B 669 -2.399 -17.336 1.025 1.00 0.00 C ATOM 1217 NE ARG B 669 -3.695 -17.976 1.231 1.00 0.00 N ATOM 1218 CZ ARG B 669 -4.829 -17.303 1.395 1.00 0.00 C ATOM 1219 NH1 ARG B 669 -4.825 -15.977 1.377 1.00 0.00 N ATOM 1220 NH2 ARG B 669 -5.969 -17.957 1.578 1.00 0.00 N ATOM 0 H ARG B 669 -0.033 -15.660 4.577 1.00 0.00 H new ATOM 0 HA ARG B 669 -1.679 -18.003 4.543 1.00 0.00 H new ATOM 0 HB2 ARG B 669 0.214 -16.627 2.626 1.00 0.00 H new ATOM 0 HB3 ARG B 669 -0.438 -18.208 2.242 1.00 0.00 H new ATOM 0 HG2 ARG B 669 -2.669 -16.680 3.052 1.00 0.00 H new ATOM 0 HG3 ARG B 669 -1.707 -15.593 2.070 1.00 0.00 H new ATOM 0 HD2 ARG B 669 -2.479 -16.607 0.219 1.00 0.00 H new ATOM 0 HD3 ARG B 669 -1.672 -18.084 0.708 1.00 0.00 H new ATOM 0 HE ARG B 669 -3.732 -18.995 1.250 1.00 0.00 H new ATOM 0 HH11 ARG B 669 -3.950 -15.471 1.237 1.00 0.00 H new ATOM 0 HH12 ARG B 669 -5.697 -15.463 1.503 1.00 0.00 H new ATOM 0 HH21 ARG B 669 -5.975 -18.977 1.593 1.00 0.00 H new ATOM 0 HH22 ARG B 669 -6.839 -17.440 1.704 1.00 0.00 H new ATOM 1234 N ARG B 670 1.498 -18.320 5.109 1.00 0.00 N ATOM 1235 CA ARG B 670 2.553 -19.265 5.456 1.00 0.00 C ATOM 1236 C ARG B 670 2.151 -20.111 6.660 1.00 0.00 C ATOM 1237 O ARG B 670 2.432 -21.308 6.711 1.00 0.00 O ATOM 1238 CB ARG B 670 3.856 -18.520 5.755 1.00 0.00 C ATOM 1239 CG ARG B 670 4.926 -19.395 6.386 1.00 0.00 C ATOM 1240 CD ARG B 670 6.323 -18.926 6.009 1.00 0.00 C ATOM 1241 NE ARG B 670 6.638 -19.214 4.612 1.00 0.00 N ATOM 1242 CZ ARG B 670 7.874 -19.235 4.127 1.00 0.00 C ATOM 1243 NH1 ARG B 670 8.906 -18.987 4.921 1.00 0.00 N ATOM 1244 NH2 ARG B 670 8.080 -19.506 2.844 1.00 0.00 N ATOM 0 H ARG B 670 1.737 -17.342 5.274 1.00 0.00 H new ATOM 0 HA ARG B 670 2.708 -19.927 4.604 1.00 0.00 H new ATOM 0 HB2 ARG B 670 4.244 -18.097 4.828 1.00 0.00 H new ATOM 0 HB3 ARG B 670 3.642 -17.684 6.421 1.00 0.00 H new ATOM 0 HG2 ARG B 670 4.816 -19.381 7.470 1.00 0.00 H new ATOM 0 HG3 ARG B 670 4.789 -20.428 6.065 1.00 0.00 H new ATOM 0 HD2 ARG B 670 6.405 -17.854 6.186 1.00 0.00 H new ATOM 0 HD3 ARG B 670 7.055 -19.412 6.654 1.00 0.00 H new ATOM 0 HE ARG B 670 5.866 -19.410 3.974 1.00 0.00 H new ATOM 0 HH11 ARG B 670 8.752 -18.779 5.908 1.00 0.00 H new ATOM 0 HH12 ARG B 670 9.854 -19.004 4.545 1.00 0.00 H new ATOM 0 HH21 ARG B 670 7.289 -19.698 2.230 1.00 0.00 H new ATOM 0 HH22 ARG B 670 9.030 -19.522 2.472 1.00 0.00 H new ATOM 1258 N ARG B 671 1.492 -19.480 7.627 1.00 0.00 N ATOM 1259 CA ARG B 671 1.052 -20.174 8.831 1.00 0.00 C ATOM 1260 C ARG B 671 -0.234 -20.953 8.571 1.00 0.00 C ATOM 1261 O ARG B 671 -0.218 -22.178 8.451 1.00 0.00 O ATOM 1262 CB ARG B 671 0.836 -19.177 9.970 1.00 0.00 C ATOM 1263 CG ARG B 671 2.126 -18.578 10.508 1.00 0.00 C ATOM 1264 CD ARG B 671 2.918 -19.594 11.316 1.00 0.00 C ATOM 1265 NE ARG B 671 4.293 -19.160 11.543 1.00 0.00 N ATOM 1266 CZ ARG B 671 5.124 -19.762 12.388 1.00 0.00 C ATOM 1267 NH1 ARG B 671 4.720 -20.817 13.081 1.00 0.00 N ATOM 1268 NH2 ARG B 671 6.361 -19.308 12.540 1.00 0.00 N ATOM 0 H ARG B 671 1.251 -18.489 7.600 1.00 0.00 H new ATOM 0 HA ARG B 671 1.831 -20.880 9.118 1.00 0.00 H new ATOM 0 HB2 ARG B 671 0.190 -18.372 9.619 1.00 0.00 H new ATOM 0 HB3 ARG B 671 0.310 -19.676 10.784 1.00 0.00 H new ATOM 0 HG2 ARG B 671 2.734 -18.217 9.679 1.00 0.00 H new ATOM 0 HG3 ARG B 671 1.895 -17.715 11.133 1.00 0.00 H new ATOM 0 HD2 ARG B 671 2.426 -19.757 12.275 1.00 0.00 H new ATOM 0 HD3 ARG B 671 2.921 -20.550 10.793 1.00 0.00 H new ATOM 0 HE ARG B 671 4.635 -18.351 11.025 1.00 0.00 H new ATOM 0 HH11 ARG B 671 3.769 -21.169 12.967 1.00 0.00 H new ATOM 0 HH12 ARG B 671 5.360 -21.277 13.729 1.00 0.00 H new ATOM 0 HH21 ARG B 671 6.675 -18.496 12.008 1.00 0.00 H new ATOM 0 HH22 ARG B 671 6.998 -19.771 13.189 1.00 0.00 H new ATOM 1282 N HIS B 672 -1.348 -20.233 8.485 1.00 0.00 N ATOM 1283 CA HIS B 672 -2.644 -20.855 8.239 1.00 0.00 C ATOM 1284 C HIS B 672 -3.345 -20.201 7.053 1.00 0.00 C ATOM 1285 O HIS B 672 -3.202 -19.000 6.820 1.00 0.00 O ATOM 1286 CB HIS B 672 -3.525 -20.757 9.485 1.00 0.00 C ATOM 1287 CG HIS B 672 -3.136 -21.711 10.571 1.00 0.00 C ATOM 1288 ND1 HIS B 672 -2.545 -21.308 11.751 1.00 0.00 N ATOM 1289 CD2 HIS B 672 -3.257 -23.056 10.653 1.00 0.00 C ATOM 1290 CE1 HIS B 672 -2.318 -22.365 12.510 1.00 0.00 C ATOM 1291 NE2 HIS B 672 -2.742 -23.439 11.868 1.00 0.00 N ATOM 0 H HIS B 672 -1.379 -19.218 8.582 1.00 0.00 H new ATOM 0 HA HIS B 672 -2.476 -21.906 8.004 1.00 0.00 H new ATOM 0 HB2 HIS B 672 -3.479 -19.739 9.873 1.00 0.00 H new ATOM 0 HB3 HIS B 672 -4.561 -20.944 9.203 1.00 0.00 H new ATOM 0 HD2 HIS B 672 -3.680 -23.708 9.903 1.00 0.00 H new ATOM 0 HE1 HIS B 672 -1.863 -22.353 13.489 1.00 0.00 H new ATOM 0 HE2 HIS B 672 -2.695 -24.396 12.217 1.00 0.00 H new ATOM 1299 N ILE B 673 -4.101 -20.998 6.305 1.00 0.00 N ATOM 1300 CA ILE B 673 -4.823 -20.496 5.143 1.00 0.00 C ATOM 1301 C ILE B 673 -6.330 -20.542 5.371 1.00 0.00 C ATOM 1302 O ILE B 673 -6.919 -21.617 5.489 1.00 0.00 O ATOM 1303 CB ILE B 673 -4.482 -21.302 3.876 1.00 0.00 C ATOM 1304 CG1 ILE B 673 -4.469 -22.800 4.186 1.00 0.00 C ATOM 1305 CG2 ILE B 673 -3.139 -20.861 3.314 1.00 0.00 C ATOM 1306 CD1 ILE B 673 -4.148 -23.663 2.986 1.00 0.00 C ATOM 0 H ILE B 673 -4.229 -21.994 6.483 1.00 0.00 H new ATOM 0 HA ILE B 673 -4.510 -19.462 5.000 1.00 0.00 H new ATOM 0 HB ILE B 673 -5.249 -21.112 3.125 1.00 0.00 H new ATOM 0 HG12 ILE B 673 -3.736 -22.994 4.969 1.00 0.00 H new ATOM 0 HG13 ILE B 673 -5.443 -23.089 4.581 1.00 0.00 H new ATOM 0 HG21 ILE B 673 -2.912 -21.440 2.419 1.00 0.00 H new ATOM 0 HG22 ILE B 673 -3.181 -19.802 3.061 1.00 0.00 H new ATOM 0 HG23 ILE B 673 -2.361 -21.025 4.060 1.00 0.00 H new ATOM 0 HD11 ILE B 673 -4.156 -24.713 3.280 1.00 0.00 H new ATOM 0 HD12 ILE B 673 -4.894 -23.498 2.209 1.00 0.00 H new ATOM 0 HD13 ILE B 673 -3.162 -23.401 2.603 1.00 0.00 H new ATOM 1318 N VAL B 674 -6.951 -19.368 5.429 1.00 0.00 N ATOM 1319 CA VAL B 674 -8.391 -19.274 5.640 1.00 0.00 C ATOM 1320 C VAL B 674 -9.104 -18.826 4.369 1.00 0.00 C ATOM 1321 O VAL B 674 -8.612 -17.964 3.640 1.00 0.00 O ATOM 1322 CB VAL B 674 -8.729 -18.294 6.778 1.00 0.00 C ATOM 1323 CG1 VAL B 674 -8.328 -16.876 6.399 1.00 0.00 C ATOM 1324 CG2 VAL B 674 -10.209 -18.365 7.120 1.00 0.00 C ATOM 0 H VAL B 674 -6.479 -18.469 5.333 1.00 0.00 H new ATOM 0 HA VAL B 674 -8.736 -20.271 5.915 1.00 0.00 H new ATOM 0 HB VAL B 674 -8.161 -18.582 7.663 1.00 0.00 H new ATOM 0 HG11 VAL B 674 -8.575 -16.198 7.216 1.00 0.00 H new ATOM 0 HG12 VAL B 674 -7.255 -16.840 6.209 1.00 0.00 H new ATOM 0 HG13 VAL B 674 -8.866 -16.573 5.501 1.00 0.00 H new ATOM 0 HG21 VAL B 674 -10.430 -17.666 7.926 1.00 0.00 H new ATOM 0 HG22 VAL B 674 -10.798 -18.104 6.241 1.00 0.00 H new ATOM 0 HG23 VAL B 674 -10.461 -19.377 7.438 1.00 0.00 H new ATOM 1334 N ARG B 675 -10.266 -19.416 4.109 1.00 0.00 N ATOM 1335 CA ARG B 675 -11.047 -19.077 2.925 1.00 0.00 C ATOM 1336 C ARG B 675 -12.541 -19.098 3.235 1.00 0.00 C ATOM 1337 O ARG B 675 -12.956 -19.520 4.315 1.00 0.00 O ATOM 1338 CB ARG B 675 -10.737 -20.053 1.788 1.00 0.00 C ATOM 1339 CG ARG B 675 -9.591 -19.604 0.896 1.00 0.00 C ATOM 1340 CD ARG B 675 -10.082 -18.718 -0.238 1.00 0.00 C ATOM 1341 NE ARG B 675 -9.018 -17.870 -0.769 1.00 0.00 N ATOM 1342 CZ ARG B 675 -9.241 -16.766 -1.473 1.00 0.00 C ATOM 1343 NH1 ARG B 675 -10.483 -16.377 -1.728 1.00 0.00 N ATOM 1344 NH2 ARG B 675 -8.220 -16.047 -1.923 1.00 0.00 N ATOM 0 H ARG B 675 -10.688 -20.131 4.702 1.00 0.00 H new ATOM 0 HA ARG B 675 -10.772 -18.069 2.615 1.00 0.00 H new ATOM 0 HB2 ARG B 675 -10.496 -21.027 2.213 1.00 0.00 H new ATOM 0 HB3 ARG B 675 -11.631 -20.184 1.178 1.00 0.00 H new ATOM 0 HG2 ARG B 675 -8.856 -19.062 1.491 1.00 0.00 H new ATOM 0 HG3 ARG B 675 -9.085 -20.477 0.484 1.00 0.00 H new ATOM 0 HD2 ARG B 675 -10.482 -19.341 -1.038 1.00 0.00 H new ATOM 0 HD3 ARG B 675 -10.900 -18.093 0.119 1.00 0.00 H new ATOM 0 HE ARG B 675 -8.051 -18.140 -0.589 1.00 0.00 H new ATOM 0 HH11 ARG B 675 -11.270 -16.926 -1.383 1.00 0.00 H new ATOM 0 HH12 ARG B 675 -10.651 -15.529 -2.269 1.00 0.00 H new ATOM 0 HH21 ARG B 675 -7.263 -16.342 -1.728 1.00 0.00 H new ATOM 0 HH22 ARG B 675 -8.392 -15.199 -2.464 1.00 0.00 H new ATOM 1358 N LYS B 676 -13.344 -18.638 2.282 1.00 0.00 N ATOM 1359 CA LYS B 676 -14.792 -18.604 2.451 1.00 0.00 C ATOM 1360 C LYS B 676 -15.500 -19.032 1.170 1.00 0.00 C ATOM 1361 O LYS B 676 -15.131 -18.608 0.075 1.00 0.00 O ATOM 1362 CB LYS B 676 -15.246 -17.199 2.853 1.00 0.00 C ATOM 1363 CG LYS B 676 -16.607 -17.169 3.527 1.00 0.00 C ATOM 1364 CD LYS B 676 -17.020 -15.751 3.886 1.00 0.00 C ATOM 1365 CE LYS B 676 -17.581 -15.012 2.681 1.00 0.00 C ATOM 1366 NZ LYS B 676 -18.351 -13.802 3.081 1.00 0.00 N ATOM 0 H LYS B 676 -13.016 -18.283 1.384 1.00 0.00 H new ATOM 0 HA LYS B 676 -15.057 -19.305 3.242 1.00 0.00 H new ATOM 0 HB2 LYS B 676 -14.507 -16.766 3.527 1.00 0.00 H new ATOM 0 HB3 LYS B 676 -15.276 -16.568 1.965 1.00 0.00 H new ATOM 0 HG2 LYS B 676 -17.352 -17.609 2.864 1.00 0.00 H new ATOM 0 HG3 LYS B 676 -16.581 -17.781 4.429 1.00 0.00 H new ATOM 0 HD2 LYS B 676 -17.768 -15.778 4.678 1.00 0.00 H new ATOM 0 HD3 LYS B 676 -16.160 -15.209 4.279 1.00 0.00 H new ATOM 0 HE2 LYS B 676 -16.764 -14.721 2.021 1.00 0.00 H new ATOM 0 HE3 LYS B 676 -18.226 -15.682 2.113 1.00 0.00 H new ATOM 0 HZ1 LYS B 676 -18.717 -13.327 2.231 1.00 0.00 H new ATOM 0 HZ2 LYS B 676 -19.146 -14.082 3.690 1.00 0.00 H new ATOM 0 HZ3 LYS B 676 -17.729 -13.151 3.601 1.00 0.00 H new ATOM 1380 N ARG B 677 -16.518 -19.873 1.315 1.00 0.00 N ATOM 1381 CA ARG B 677 -17.278 -20.358 0.168 1.00 0.00 C ATOM 1382 C ARG B 677 -18.711 -19.835 0.205 1.00 0.00 C ATOM 1383 O ARG B 677 -19.545 -20.225 -0.612 1.00 0.00 O ATOM 1384 CB ARG B 677 -17.282 -21.887 0.142 1.00 0.00 C ATOM 1385 CG ARG B 677 -17.560 -22.519 1.496 1.00 0.00 C ATOM 1386 CD ARG B 677 -16.274 -22.773 2.267 1.00 0.00 C ATOM 1387 NE ARG B 677 -16.395 -23.912 3.173 1.00 0.00 N ATOM 1388 CZ ARG B 677 -16.366 -25.177 2.770 1.00 0.00 C ATOM 1389 NH1 ARG B 677 -16.220 -25.464 1.484 1.00 0.00 N ATOM 1390 NH2 ARG B 677 -16.482 -26.159 3.655 1.00 0.00 N ATOM 0 H ARG B 677 -16.836 -20.233 2.215 1.00 0.00 H new ATOM 0 HA ARG B 677 -16.798 -19.987 -0.738 1.00 0.00 H new ATOM 0 HB2 ARG B 677 -18.034 -22.228 -0.570 1.00 0.00 H new ATOM 0 HB3 ARG B 677 -16.316 -22.238 -0.222 1.00 0.00 H new ATOM 0 HG2 ARG B 677 -18.211 -21.866 2.077 1.00 0.00 H new ATOM 0 HG3 ARG B 677 -18.094 -23.459 1.357 1.00 0.00 H new ATOM 0 HD2 ARG B 677 -15.460 -22.953 1.565 1.00 0.00 H new ATOM 0 HD3 ARG B 677 -16.011 -21.882 2.838 1.00 0.00 H new ATOM 0 HE ARG B 677 -16.508 -23.726 4.169 1.00 0.00 H new ATOM 0 HH11 ARG B 677 -16.130 -24.712 0.801 1.00 0.00 H new ATOM 0 HH12 ARG B 677 -16.198 -26.437 1.178 1.00 0.00 H new ATOM 0 HH21 ARG B 677 -16.594 -25.942 4.645 1.00 0.00 H new ATOM 0 HH22 ARG B 677 -16.460 -27.130 3.345 1.00 0.00 H new TER 1404 ARG B 677