USER MOD reduce.3.24.130724 H: found=0, std=0, add=744, rem=0, adj=13 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 -156:sc= -2.92 (180deg=-0.774) USER MOD Set 1.2: B 650 MET CE :methyl -155:sc= -2.88 (180deg=-0.866) USER MOD Single : A 636 CYS SG : rot 180:sc= 0 USER MOD Single : A 638 THR OG1 : rot -47:sc= 1.07 USER MOD Single : A 639 ASN : amide:sc= -0.0146 X(o=-0.015,f=-0.18) USER MOD Single : A 642 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 645 SER OG : rot 180:sc= 0.0422 USER MOD Single : A 648 THR OG1 : rot 86:sc= 0.434 USER MOD Single : A 668 MET CE :methyl -131:sc= -5.95! (180deg=-7.95!) USER MOD Single : A 672 HIS : no HD1:sc= -1.45 X(o=-1.4,f=-1.4) USER MOD Single : A 676 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 636 CYS SG : rot 112:sc= 0.12 USER MOD Single : B 638 THR OG1 : rot -30:sc= 0.677 USER MOD Single : B 639 ASN : amide:sc= 0 X(o=0,f=-0.04) USER MOD Single : B 642 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 645 SER OG : rot 180:sc= 0.0483 USER MOD Single : B 648 THR OG1 : rot 83:sc= 0.175 USER MOD Single : B 668 MET CE :methyl -136:sc= -6.07! (180deg=-7.98!) USER MOD Single : B 672 HIS : no HD1:sc= -0.0519 X(o=-0.052,f=0) USER MOD Single : B 676 LYS NZ :NH3+ 144:sc= -0.257 (180deg=-1.85!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 634 23.400 19.278 9.578 1.00 0.00 N ATOM 2 CA GLU A 634 22.865 18.236 10.446 1.00 0.00 C ATOM 3 C GLU A 634 21.482 18.618 10.967 1.00 0.00 C ATOM 4 O GLU A 634 21.191 19.793 11.183 1.00 0.00 O ATOM 5 CB GLU A 634 23.813 17.985 11.621 1.00 0.00 C ATOM 6 CG GLU A 634 25.248 17.720 11.200 1.00 0.00 C ATOM 7 CD GLU A 634 25.428 16.354 10.567 1.00 0.00 C ATOM 8 OE1 GLU A 634 25.453 15.353 11.313 1.00 0.00 O ATOM 9 OE2 GLU A 634 25.544 16.286 9.326 1.00 0.00 O ATOM 0 HA GLU A 634 22.773 17.322 9.860 1.00 0.00 H new ATOM 0 HB2 GLU A 634 23.792 18.849 12.285 1.00 0.00 H new ATOM 0 HB3 GLU A 634 23.449 17.133 12.195 1.00 0.00 H new ATOM 0 HG2 GLU A 634 25.563 18.488 10.493 1.00 0.00 H new ATOM 0 HG3 GLU A 634 25.899 17.801 12.071 1.00 0.00 H new ATOM 16 N GLY A 635 20.633 17.614 11.165 1.00 0.00 N ATOM 17 CA GLY A 635 19.291 17.864 11.657 1.00 0.00 C ATOM 18 C GLY A 635 18.252 17.826 10.554 1.00 0.00 C ATOM 19 O GLY A 635 18.108 16.818 9.862 1.00 0.00 O ATOM 0 H GLY A 635 20.851 16.632 10.993 1.00 0.00 H new ATOM 0 HA2 GLY A 635 19.040 17.120 12.414 1.00 0.00 H new ATOM 0 HA3 GLY A 635 19.262 18.838 12.146 1.00 0.00 H new ATOM 23 N CYS A 636 17.526 18.926 10.390 1.00 0.00 N ATOM 24 CA CYS A 636 16.493 19.014 9.364 1.00 0.00 C ATOM 25 C CYS A 636 15.429 17.940 9.570 1.00 0.00 C ATOM 26 O CYS A 636 15.332 16.975 8.811 1.00 0.00 O ATOM 27 CB CYS A 636 17.113 18.875 7.973 1.00 0.00 C ATOM 28 SG CYS A 636 17.758 20.422 7.295 1.00 0.00 S ATOM 0 H CYS A 636 17.633 19.769 10.954 1.00 0.00 H new ATOM 0 HA CYS A 636 16.017 19.991 9.445 1.00 0.00 H new ATOM 0 HB2 CYS A 636 17.922 18.146 8.019 1.00 0.00 H new ATOM 0 HB3 CYS A 636 16.362 18.477 7.290 1.00 0.00 H new ATOM 0 HG CYS A 636 18.264 20.202 6.118 1.00 0.00 H new ATOM 34 N PRO A 637 14.613 18.108 10.621 1.00 0.00 N ATOM 35 CA PRO A 637 13.543 17.163 10.952 1.00 0.00 C ATOM 36 C PRO A 637 12.405 17.198 9.938 1.00 0.00 C ATOM 37 O PRO A 637 11.462 16.409 10.019 1.00 0.00 O ATOM 38 CB PRO A 637 13.055 17.644 12.320 1.00 0.00 C ATOM 39 CG PRO A 637 13.401 19.093 12.358 1.00 0.00 C ATOM 40 CD PRO A 637 14.672 19.235 11.567 1.00 0.00 C ATOM 0 HA PRO A 637 13.895 16.131 10.949 1.00 0.00 H new ATOM 0 HB2 PRO A 637 11.982 17.490 12.434 1.00 0.00 H new ATOM 0 HB3 PRO A 637 13.543 17.099 13.128 1.00 0.00 H new ATOM 0 HG2 PRO A 637 12.603 19.696 11.926 1.00 0.00 H new ATOM 0 HG3 PRO A 637 13.539 19.435 13.384 1.00 0.00 H new ATOM 0 HD2 PRO A 637 14.718 20.193 11.049 1.00 0.00 H new ATOM 0 HD3 PRO A 637 15.552 19.177 12.207 1.00 0.00 H new ATOM 48 N THR A 638 12.498 18.116 8.981 1.00 0.00 N ATOM 49 CA THR A 638 11.476 18.254 7.952 1.00 0.00 C ATOM 50 C THR A 638 10.127 18.620 8.561 1.00 0.00 C ATOM 51 O THR A 638 9.077 18.312 7.999 1.00 0.00 O ATOM 52 CB THR A 638 11.322 16.957 7.135 1.00 0.00 C ATOM 53 OG1 THR A 638 10.366 16.095 7.761 1.00 0.00 O ATOM 54 CG2 THR A 638 12.656 16.236 7.008 1.00 0.00 C ATOM 0 H THR A 638 13.272 18.775 8.898 1.00 0.00 H new ATOM 0 HA THR A 638 11.802 19.056 7.290 1.00 0.00 H new ATOM 0 HB THR A 638 10.973 17.221 6.137 1.00 0.00 H new ATOM 0 HG1 THR A 638 10.555 16.039 8.721 1.00 0.00 H new ATOM 0 HG21 THR A 638 12.522 15.323 6.427 1.00 0.00 H new ATOM 0 HG22 THR A 638 13.374 16.884 6.505 1.00 0.00 H new ATOM 0 HG23 THR A 638 13.029 15.983 8.001 1.00 0.00 H new ATOM 62 N ASN A 639 10.164 19.281 9.714 1.00 0.00 N ATOM 63 CA ASN A 639 8.943 19.689 10.400 1.00 0.00 C ATOM 64 C ASN A 639 8.031 20.476 9.465 1.00 0.00 C ATOM 65 O ASN A 639 8.500 21.189 8.578 1.00 0.00 O ATOM 66 CB ASN A 639 9.283 20.534 11.630 1.00 0.00 C ATOM 67 CG ASN A 639 9.533 21.988 11.281 1.00 0.00 C ATOM 68 OD1 ASN A 639 8.615 22.809 11.300 1.00 0.00 O ATOM 69 ND2 ASN A 639 10.780 22.314 10.961 1.00 0.00 N ATOM 0 H ASN A 639 11.025 19.545 10.192 1.00 0.00 H new ATOM 0 HA ASN A 639 8.417 18.789 10.719 1.00 0.00 H new ATOM 0 HB2 ASN A 639 8.465 20.471 12.348 1.00 0.00 H new ATOM 0 HB3 ASN A 639 10.167 20.123 12.117 1.00 0.00 H new ATOM 0 HD21 ASN A 639 11.009 23.278 10.718 1.00 0.00 H new ATOM 0 HD22 ASN A 639 11.509 21.601 10.958 1.00 0.00 H new ATOM 76 N GLY A 640 6.724 20.343 9.670 1.00 0.00 N ATOM 77 CA GLY A 640 5.767 21.048 8.838 1.00 0.00 C ATOM 78 C GLY A 640 4.637 20.153 8.370 1.00 0.00 C ATOM 79 O GLY A 640 4.540 19.804 7.193 1.00 0.00 O ATOM 0 H GLY A 640 6.311 19.759 10.398 1.00 0.00 H new ATOM 0 HA2 GLY A 640 5.354 21.888 9.396 1.00 0.00 H new ATOM 0 HA3 GLY A 640 6.280 21.463 7.971 1.00 0.00 H new ATOM 83 N PRO A 641 3.757 19.765 9.305 1.00 0.00 N ATOM 84 CA PRO A 641 2.613 18.899 9.005 1.00 0.00 C ATOM 85 C PRO A 641 1.556 19.605 8.163 1.00 0.00 C ATOM 86 O PRO A 641 1.022 20.642 8.560 1.00 0.00 O ATOM 87 CB PRO A 641 2.054 18.557 10.388 1.00 0.00 C ATOM 88 CG PRO A 641 2.479 19.689 11.259 1.00 0.00 C ATOM 89 CD PRO A 641 3.811 20.142 10.727 1.00 0.00 C ATOM 0 HA PRO A 641 2.905 18.026 8.421 1.00 0.00 H new ATOM 0 HB2 PRO A 641 0.968 18.462 10.364 1.00 0.00 H new ATOM 0 HB3 PRO A 641 2.449 17.608 10.751 1.00 0.00 H new ATOM 0 HG2 PRO A 641 1.751 20.499 11.229 1.00 0.00 H new ATOM 0 HG3 PRO A 641 2.561 19.372 12.299 1.00 0.00 H new ATOM 0 HD2 PRO A 641 3.950 21.216 10.853 1.00 0.00 H new ATOM 0 HD3 PRO A 641 4.637 19.651 11.242 1.00 0.00 H new ATOM 97 N LYS A 642 1.256 19.039 6.999 1.00 0.00 N ATOM 98 CA LYS A 642 0.261 19.613 6.102 1.00 0.00 C ATOM 99 C LYS A 642 -0.723 18.548 5.628 1.00 0.00 C ATOM 100 O LYS A 642 -0.335 17.579 4.973 1.00 0.00 O ATOM 101 CB LYS A 642 0.946 20.263 4.897 1.00 0.00 C ATOM 102 CG LYS A 642 1.390 21.693 5.148 1.00 0.00 C ATOM 103 CD LYS A 642 2.022 22.307 3.910 1.00 0.00 C ATOM 104 CE LYS A 642 1.814 23.813 3.865 1.00 0.00 C ATOM 105 NZ LYS A 642 2.816 24.535 4.697 1.00 0.00 N ATOM 0 H LYS A 642 1.689 18.182 6.655 1.00 0.00 H new ATOM 0 HA LYS A 642 -0.292 20.374 6.652 1.00 0.00 H new ATOM 0 HB2 LYS A 642 1.814 19.666 4.617 1.00 0.00 H new ATOM 0 HB3 LYS A 642 0.262 20.248 4.049 1.00 0.00 H new ATOM 0 HG2 LYS A 642 0.533 22.292 5.455 1.00 0.00 H new ATOM 0 HG3 LYS A 642 2.105 21.714 5.971 1.00 0.00 H new ATOM 0 HD2 LYS A 642 3.089 22.086 3.898 1.00 0.00 H new ATOM 0 HD3 LYS A 642 1.592 21.853 3.017 1.00 0.00 H new ATOM 0 HE2 LYS A 642 1.881 24.159 2.833 1.00 0.00 H new ATOM 0 HE3 LYS A 642 0.810 24.052 4.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 642 2.641 25.559 4.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 642 2.735 24.224 5.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 642 3.773 24.327 4.346 1.00 0.00 H new ATOM 119 N ILE A 643 -1.995 18.735 5.960 1.00 0.00 N ATOM 120 CA ILE A 643 -3.034 17.792 5.565 1.00 0.00 C ATOM 121 C ILE A 643 -4.176 18.501 4.845 1.00 0.00 C ATOM 122 O ILE A 643 -5.284 18.633 5.365 1.00 0.00 O ATOM 123 CB ILE A 643 -3.600 17.037 6.782 1.00 0.00 C ATOM 124 CG1 ILE A 643 -2.463 16.439 7.614 1.00 0.00 C ATOM 125 CG2 ILE A 643 -4.561 15.948 6.330 1.00 0.00 C ATOM 126 CD1 ILE A 643 -2.934 15.754 8.877 1.00 0.00 C ATOM 0 H ILE A 643 -2.332 19.531 6.502 1.00 0.00 H new ATOM 0 HA ILE A 643 -2.569 17.076 4.887 1.00 0.00 H new ATOM 0 HB ILE A 643 -4.148 17.743 7.405 1.00 0.00 H new ATOM 0 HG12 ILE A 643 -1.916 15.721 7.003 1.00 0.00 H new ATOM 0 HG13 ILE A 643 -1.763 17.231 7.879 1.00 0.00 H new ATOM 0 HG21 ILE A 643 -4.952 15.423 7.202 1.00 0.00 H new ATOM 0 HG22 ILE A 643 -5.385 16.397 5.776 1.00 0.00 H new ATOM 0 HG23 ILE A 643 -4.035 15.242 5.688 1.00 0.00 H new ATOM 0 HD11 ILE A 643 -2.075 15.354 9.416 1.00 0.00 H new ATOM 0 HD12 ILE A 643 -3.456 16.473 9.508 1.00 0.00 H new ATOM 0 HD13 ILE A 643 -3.611 14.940 8.619 1.00 0.00 H new ATOM 138 N PRO A 644 -3.902 18.967 3.617 1.00 0.00 N ATOM 139 CA PRO A 644 -4.894 19.668 2.797 1.00 0.00 C ATOM 140 C PRO A 644 -5.999 18.740 2.305 1.00 0.00 C ATOM 141 O PRO A 644 -6.116 17.602 2.759 1.00 0.00 O ATOM 142 CB PRO A 644 -4.072 20.194 1.618 1.00 0.00 C ATOM 143 CG PRO A 644 -2.908 19.268 1.525 1.00 0.00 C ATOM 144 CD PRO A 644 -2.602 18.845 2.935 1.00 0.00 C ATOM 0 HA PRO A 644 -5.408 20.449 3.358 1.00 0.00 H new ATOM 0 HB2 PRO A 644 -4.655 20.191 0.697 1.00 0.00 H new ATOM 0 HB3 PRO A 644 -3.748 21.221 1.788 1.00 0.00 H new ATOM 0 HG2 PRO A 644 -3.144 18.406 0.901 1.00 0.00 H new ATOM 0 HG3 PRO A 644 -2.050 19.764 1.071 1.00 0.00 H new ATOM 0 HD2 PRO A 644 -2.221 17.824 2.975 1.00 0.00 H new ATOM 0 HD3 PRO A 644 -1.847 19.485 3.392 1.00 0.00 H new ATOM 152 N SER A 645 -6.808 19.234 1.373 1.00 0.00 N ATOM 153 CA SER A 645 -7.907 18.450 0.821 1.00 0.00 C ATOM 154 C SER A 645 -7.384 17.377 -0.129 1.00 0.00 C ATOM 155 O SER A 645 -8.116 16.464 -0.515 1.00 0.00 O ATOM 156 CB SER A 645 -8.893 19.360 0.087 1.00 0.00 C ATOM 157 OG SER A 645 -8.759 20.705 0.513 1.00 0.00 O ATOM 0 H SER A 645 -6.723 20.173 0.984 1.00 0.00 H new ATOM 0 HA SER A 645 -8.422 17.960 1.647 1.00 0.00 H new ATOM 0 HB2 SER A 645 -8.721 19.297 -0.987 1.00 0.00 H new ATOM 0 HB3 SER A 645 -9.912 19.018 0.267 1.00 0.00 H new ATOM 0 HG SER A 645 -9.399 21.267 0.028 1.00 0.00 H new ATOM 163 N ILE A 646 -6.114 17.493 -0.503 1.00 0.00 N ATOM 164 CA ILE A 646 -5.493 16.534 -1.406 1.00 0.00 C ATOM 165 C ILE A 646 -5.358 15.165 -0.747 1.00 0.00 C ATOM 166 O ILE A 646 -5.092 14.167 -1.415 1.00 0.00 O ATOM 167 CB ILE A 646 -4.102 17.010 -1.864 1.00 0.00 C ATOM 168 CG1 ILE A 646 -4.216 18.338 -2.616 1.00 0.00 C ATOM 169 CG2 ILE A 646 -3.442 15.955 -2.739 1.00 0.00 C ATOM 170 CD1 ILE A 646 -3.983 19.550 -1.740 1.00 0.00 C ATOM 0 H ILE A 646 -5.495 18.243 -0.194 1.00 0.00 H new ATOM 0 HA ILE A 646 -6.145 16.453 -2.276 1.00 0.00 H new ATOM 0 HB ILE A 646 -3.479 17.164 -0.983 1.00 0.00 H new ATOM 0 HG12 ILE A 646 -3.495 18.347 -3.434 1.00 0.00 H new ATOM 0 HG13 ILE A 646 -5.207 18.409 -3.064 1.00 0.00 H new ATOM 0 HG21 ILE A 646 -2.460 16.307 -3.055 1.00 0.00 H new ATOM 0 HG22 ILE A 646 -3.332 15.030 -2.173 1.00 0.00 H new ATOM 0 HG23 ILE A 646 -4.061 15.771 -3.617 1.00 0.00 H new ATOM 0 HD11 ILE A 646 -4.079 20.456 -2.339 1.00 0.00 H new ATOM 0 HD12 ILE A 646 -4.720 19.566 -0.937 1.00 0.00 H new ATOM 0 HD13 ILE A 646 -2.982 19.503 -1.312 1.00 0.00 H new ATOM 182 N ALA A 647 -5.544 15.128 0.568 1.00 0.00 N ATOM 183 CA ALA A 647 -5.446 13.881 1.318 1.00 0.00 C ATOM 184 C ALA A 647 -6.331 12.801 0.705 1.00 0.00 C ATOM 185 O ALA A 647 -6.025 11.611 0.789 1.00 0.00 O ATOM 186 CB ALA A 647 -5.823 14.111 2.774 1.00 0.00 C ATOM 0 H ALA A 647 -5.763 15.946 1.136 1.00 0.00 H new ATOM 0 HA ALA A 647 -4.413 13.537 1.271 1.00 0.00 H new ATOM 0 HB1 ALA A 647 -5.746 13.172 3.323 1.00 0.00 H new ATOM 0 HB2 ALA A 647 -5.147 14.845 3.213 1.00 0.00 H new ATOM 0 HB3 ALA A 647 -6.847 14.481 2.831 1.00 0.00 H new ATOM 192 N THR A 648 -7.430 13.223 0.088 1.00 0.00 N ATOM 193 CA THR A 648 -8.360 12.291 -0.538 1.00 0.00 C ATOM 194 C THR A 648 -7.648 11.397 -1.547 1.00 0.00 C ATOM 195 O THR A 648 -7.813 10.178 -1.536 1.00 0.00 O ATOM 196 CB THR A 648 -9.508 13.035 -1.248 1.00 0.00 C ATOM 197 OG1 THR A 648 -9.979 14.108 -0.425 1.00 0.00 O ATOM 198 CG2 THR A 648 -10.655 12.086 -1.560 1.00 0.00 C ATOM 0 H THR A 648 -7.698 14.204 0.008 1.00 0.00 H new ATOM 0 HA THR A 648 -8.774 11.675 0.260 1.00 0.00 H new ATOM 0 HB THR A 648 -9.126 13.439 -2.186 1.00 0.00 H new ATOM 0 HG1 THR A 648 -9.433 14.906 -0.584 1.00 0.00 H new ATOM 0 HG21 THR A 648 -11.454 12.633 -2.061 1.00 0.00 H new ATOM 0 HG22 THR A 648 -10.299 11.287 -2.210 1.00 0.00 H new ATOM 0 HG23 THR A 648 -11.035 11.657 -0.633 1.00 0.00 H new ATOM 206 N GLY A 649 -6.854 12.012 -2.418 1.00 0.00 N ATOM 207 CA GLY A 649 -6.128 11.256 -3.422 1.00 0.00 C ATOM 208 C GLY A 649 -5.026 10.405 -2.822 1.00 0.00 C ATOM 209 O GLY A 649 -4.765 9.297 -3.288 1.00 0.00 O ATOM 0 H GLY A 649 -6.700 13.020 -2.446 1.00 0.00 H new ATOM 0 HA2 GLY A 649 -6.824 10.615 -3.963 1.00 0.00 H new ATOM 0 HA3 GLY A 649 -5.697 11.944 -4.149 1.00 0.00 H new ATOM 213 N MET A 650 -4.377 10.926 -1.785 1.00 0.00 N ATOM 214 CA MET A 650 -3.296 10.206 -1.121 1.00 0.00 C ATOM 215 C MET A 650 -3.822 8.951 -0.432 1.00 0.00 C ATOM 216 O MET A 650 -3.245 7.871 -0.562 1.00 0.00 O ATOM 217 CB MET A 650 -2.604 11.111 -0.100 1.00 0.00 C ATOM 218 CG MET A 650 -1.904 12.308 -0.725 1.00 0.00 C ATOM 219 SD MET A 650 -0.681 11.831 -1.961 1.00 0.00 S ATOM 220 CE MET A 650 0.245 10.591 -1.059 1.00 0.00 C ATOM 0 H MET A 650 -4.581 11.843 -1.387 1.00 0.00 H new ATOM 0 HA MET A 650 -2.572 9.906 -1.879 1.00 0.00 H new ATOM 0 HB2 MET A 650 -3.343 11.467 0.618 1.00 0.00 H new ATOM 0 HB3 MET A 650 -1.874 10.524 0.458 1.00 0.00 H new ATOM 0 HG2 MET A 650 -2.647 12.958 -1.187 1.00 0.00 H new ATOM 0 HG3 MET A 650 -1.416 12.888 0.058 1.00 0.00 H new ATOM 0 HE1 MET A 650 1.247 10.507 -1.480 1.00 0.00 H new ATOM 0 HE2 MET A 650 0.315 10.880 -0.010 1.00 0.00 H new ATOM 0 HE3 MET A 650 -0.263 9.630 -1.137 1.00 0.00 H new ATOM 230 N VAL A 651 -4.920 9.101 0.303 1.00 0.00 N ATOM 231 CA VAL A 651 -5.524 7.979 1.012 1.00 0.00 C ATOM 232 C VAL A 651 -5.962 6.888 0.042 1.00 0.00 C ATOM 233 O VAL A 651 -5.698 5.706 0.260 1.00 0.00 O ATOM 234 CB VAL A 651 -6.739 8.430 1.844 1.00 0.00 C ATOM 235 CG1 VAL A 651 -7.332 7.254 2.604 1.00 0.00 C ATOM 236 CG2 VAL A 651 -6.345 9.548 2.798 1.00 0.00 C ATOM 0 H VAL A 651 -5.409 9.988 0.423 1.00 0.00 H new ATOM 0 HA VAL A 651 -4.762 7.580 1.682 1.00 0.00 H new ATOM 0 HB VAL A 651 -7.501 8.814 1.165 1.00 0.00 H new ATOM 0 HG11 VAL A 651 -8.189 7.592 3.186 1.00 0.00 H new ATOM 0 HG12 VAL A 651 -7.652 6.488 1.897 1.00 0.00 H new ATOM 0 HG13 VAL A 651 -6.580 6.837 3.274 1.00 0.00 H new ATOM 0 HG21 VAL A 651 -7.215 9.855 3.378 1.00 0.00 H new ATOM 0 HG22 VAL A 651 -5.566 9.193 3.473 1.00 0.00 H new ATOM 0 HG23 VAL A 651 -5.971 10.398 2.228 1.00 0.00 H new ATOM 246 N GLY A 652 -6.635 7.292 -1.031 1.00 0.00 N ATOM 247 CA GLY A 652 -7.100 6.336 -2.019 1.00 0.00 C ATOM 248 C GLY A 652 -5.964 5.553 -2.647 1.00 0.00 C ATOM 249 O GLY A 652 -6.084 4.351 -2.879 1.00 0.00 O ATOM 0 H GLY A 652 -6.867 8.264 -1.234 1.00 0.00 H new ATOM 0 HA2 GLY A 652 -7.799 5.643 -1.549 1.00 0.00 H new ATOM 0 HA3 GLY A 652 -7.649 6.863 -2.799 1.00 0.00 H new ATOM 253 N ALA A 653 -4.858 6.236 -2.924 1.00 0.00 N ATOM 254 CA ALA A 653 -3.696 5.597 -3.529 1.00 0.00 C ATOM 255 C ALA A 653 -2.980 4.699 -2.525 1.00 0.00 C ATOM 256 O ALA A 653 -2.656 3.549 -2.826 1.00 0.00 O ATOM 257 CB ALA A 653 -2.741 6.647 -4.076 1.00 0.00 C ATOM 0 H ALA A 653 -4.742 7.232 -2.739 1.00 0.00 H new ATOM 0 HA ALA A 653 -4.042 4.973 -4.353 1.00 0.00 H new ATOM 0 HB1 ALA A 653 -1.878 6.155 -4.525 1.00 0.00 H new ATOM 0 HB2 ALA A 653 -3.251 7.245 -4.831 1.00 0.00 H new ATOM 0 HB3 ALA A 653 -2.408 7.294 -3.265 1.00 0.00 H new ATOM 263 N LEU A 654 -2.734 5.230 -1.333 1.00 0.00 N ATOM 264 CA LEU A 654 -2.055 4.476 -0.285 1.00 0.00 C ATOM 265 C LEU A 654 -2.787 3.171 0.009 1.00 0.00 C ATOM 266 O LEU A 654 -2.174 2.104 0.077 1.00 0.00 O ATOM 267 CB LEU A 654 -1.954 5.315 0.990 1.00 0.00 C ATOM 268 CG LEU A 654 -0.993 6.503 0.938 1.00 0.00 C ATOM 269 CD1 LEU A 654 -1.385 7.553 1.965 1.00 0.00 C ATOM 270 CD2 LEU A 654 0.439 6.041 1.165 1.00 0.00 C ATOM 0 H LEU A 654 -2.994 6.180 -1.068 1.00 0.00 H new ATOM 0 HA LEU A 654 -1.051 4.237 -0.636 1.00 0.00 H new ATOM 0 HB2 LEU A 654 -2.948 5.688 1.235 1.00 0.00 H new ATOM 0 HB3 LEU A 654 -1.648 4.662 1.807 1.00 0.00 H new ATOM 0 HG LEU A 654 -1.056 6.953 -0.053 1.00 0.00 H new ATOM 0 HD11 LEU A 654 -0.689 8.391 1.913 1.00 0.00 H new ATOM 0 HD12 LEU A 654 -2.395 7.906 1.757 1.00 0.00 H new ATOM 0 HD13 LEU A 654 -1.352 7.116 2.963 1.00 0.00 H new ATOM 0 HD21 LEU A 654 1.109 6.900 1.125 1.00 0.00 H new ATOM 0 HD22 LEU A 654 0.517 5.565 2.143 1.00 0.00 H new ATOM 0 HD23 LEU A 654 0.718 5.326 0.391 1.00 0.00 H new ATOM 282 N LEU A 655 -4.101 3.261 0.179 1.00 0.00 N ATOM 283 CA LEU A 655 -4.918 2.086 0.463 1.00 0.00 C ATOM 284 C LEU A 655 -4.855 1.088 -0.688 1.00 0.00 C ATOM 285 O LEU A 655 -4.674 -0.112 -0.475 1.00 0.00 O ATOM 286 CB LEU A 655 -6.369 2.499 0.716 1.00 0.00 C ATOM 287 CG LEU A 655 -6.641 3.224 2.035 1.00 0.00 C ATOM 288 CD1 LEU A 655 -8.108 3.609 2.140 1.00 0.00 C ATOM 289 CD2 LEU A 655 -6.230 2.355 3.215 1.00 0.00 C ATOM 0 H LEU A 655 -4.624 4.135 0.125 1.00 0.00 H new ATOM 0 HA LEU A 655 -4.522 1.606 1.358 1.00 0.00 H new ATOM 0 HB2 LEU A 655 -6.690 3.143 -0.102 1.00 0.00 H new ATOM 0 HB3 LEU A 655 -6.991 1.605 0.681 1.00 0.00 H new ATOM 0 HG LEU A 655 -6.045 4.136 2.056 1.00 0.00 H new ATOM 0 HD11 LEU A 655 -8.282 4.124 3.085 1.00 0.00 H new ATOM 0 HD12 LEU A 655 -8.371 4.269 1.313 1.00 0.00 H new ATOM 0 HD13 LEU A 655 -8.724 2.711 2.097 1.00 0.00 H new ATOM 0 HD21 LEU A 655 -6.430 2.886 4.145 1.00 0.00 H new ATOM 0 HD22 LEU A 655 -6.799 1.426 3.198 1.00 0.00 H new ATOM 0 HD23 LEU A 655 -5.166 2.130 3.148 1.00 0.00 H new ATOM 301 N LEU A 656 -5.003 1.590 -1.909 1.00 0.00 N ATOM 302 CA LEU A 656 -4.961 0.743 -3.096 1.00 0.00 C ATOM 303 C LEU A 656 -3.595 0.080 -3.243 1.00 0.00 C ATOM 304 O LEU A 656 -3.495 -1.078 -3.650 1.00 0.00 O ATOM 305 CB LEU A 656 -5.278 1.566 -4.345 1.00 0.00 C ATOM 306 CG LEU A 656 -6.759 1.846 -4.606 1.00 0.00 C ATOM 307 CD1 LEU A 656 -6.920 2.882 -5.708 1.00 0.00 C ATOM 308 CD2 LEU A 656 -7.489 0.561 -4.968 1.00 0.00 C ATOM 0 H LEU A 656 -5.153 2.580 -2.103 1.00 0.00 H new ATOM 0 HA LEU A 656 -5.713 -0.038 -2.982 1.00 0.00 H new ATOM 0 HB2 LEU A 656 -4.756 2.520 -4.269 1.00 0.00 H new ATOM 0 HB3 LEU A 656 -4.869 1.047 -5.212 1.00 0.00 H new ATOM 0 HG LEU A 656 -7.200 2.246 -3.693 1.00 0.00 H new ATOM 0 HD11 LEU A 656 -7.980 3.069 -5.880 1.00 0.00 H new ATOM 0 HD12 LEU A 656 -6.432 3.810 -5.409 1.00 0.00 H new ATOM 0 HD13 LEU A 656 -6.463 2.511 -6.626 1.00 0.00 H new ATOM 0 HD21 LEU A 656 -8.541 0.779 -5.150 1.00 0.00 H new ATOM 0 HD22 LEU A 656 -7.046 0.132 -5.867 1.00 0.00 H new ATOM 0 HD23 LEU A 656 -7.403 -0.150 -4.146 1.00 0.00 H new ATOM 320 N LEU A 657 -2.544 0.821 -2.907 1.00 0.00 N ATOM 321 CA LEU A 657 -1.183 0.305 -3.000 1.00 0.00 C ATOM 322 C LEU A 657 -1.006 -0.926 -2.117 1.00 0.00 C ATOM 323 O LEU A 657 -0.545 -1.972 -2.576 1.00 0.00 O ATOM 324 CB LEU A 657 -0.178 1.385 -2.595 1.00 0.00 C ATOM 325 CG LEU A 657 0.168 2.416 -3.669 1.00 0.00 C ATOM 326 CD1 LEU A 657 1.111 3.472 -3.112 1.00 0.00 C ATOM 327 CD2 LEU A 657 0.783 1.736 -4.883 1.00 0.00 C ATOM 0 H LEU A 657 -2.609 1.781 -2.568 1.00 0.00 H new ATOM 0 HA LEU A 657 -1.000 0.017 -4.035 1.00 0.00 H new ATOM 0 HB2 LEU A 657 -0.572 1.913 -1.727 1.00 0.00 H new ATOM 0 HB3 LEU A 657 0.743 0.896 -2.279 1.00 0.00 H new ATOM 0 HG LEU A 657 -0.752 2.909 -3.981 1.00 0.00 H new ATOM 0 HD11 LEU A 657 1.346 4.197 -3.891 1.00 0.00 H new ATOM 0 HD12 LEU A 657 0.634 3.981 -2.275 1.00 0.00 H new ATOM 0 HD13 LEU A 657 2.030 2.996 -2.771 1.00 0.00 H new ATOM 0 HD21 LEU A 657 1.023 2.485 -5.637 1.00 0.00 H new ATOM 0 HD22 LEU A 657 1.694 1.216 -4.586 1.00 0.00 H new ATOM 0 HD23 LEU A 657 0.074 1.019 -5.297 1.00 0.00 H new ATOM 339 N LEU A 658 -1.379 -0.797 -0.848 1.00 0.00 N ATOM 340 CA LEU A 658 -1.264 -1.900 0.099 1.00 0.00 C ATOM 341 C LEU A 658 -2.052 -3.114 -0.380 1.00 0.00 C ATOM 342 O LEU A 658 -1.587 -4.249 -0.279 1.00 0.00 O ATOM 343 CB LEU A 658 -1.763 -1.466 1.479 1.00 0.00 C ATOM 344 CG LEU A 658 -0.773 -0.669 2.331 1.00 0.00 C ATOM 345 CD1 LEU A 658 -1.504 0.087 3.429 1.00 0.00 C ATOM 346 CD2 LEU A 658 0.282 -1.591 2.925 1.00 0.00 C ATOM 0 H LEU A 658 -1.764 0.061 -0.452 1.00 0.00 H new ATOM 0 HA LEU A 658 -0.212 -2.178 0.169 1.00 0.00 H new ATOM 0 HB2 LEU A 658 -2.663 -0.865 1.346 1.00 0.00 H new ATOM 0 HB3 LEU A 658 -2.055 -2.357 2.035 1.00 0.00 H new ATOM 0 HG LEU A 658 -0.272 0.057 1.690 1.00 0.00 H new ATOM 0 HD11 LEU A 658 -0.785 0.648 4.025 1.00 0.00 H new ATOM 0 HD12 LEU A 658 -2.220 0.776 2.982 1.00 0.00 H new ATOM 0 HD13 LEU A 658 -2.032 -0.620 4.069 1.00 0.00 H new ATOM 0 HD21 LEU A 658 0.978 -1.007 3.528 1.00 0.00 H new ATOM 0 HD22 LEU A 658 -0.201 -2.340 3.552 1.00 0.00 H new ATOM 0 HD23 LEU A 658 0.826 -2.087 2.121 1.00 0.00 H new ATOM 358 N VAL A 659 -3.248 -2.867 -0.905 1.00 0.00 N ATOM 359 CA VAL A 659 -4.100 -3.940 -1.404 1.00 0.00 C ATOM 360 C VAL A 659 -3.458 -4.643 -2.595 1.00 0.00 C ATOM 361 O VAL A 659 -3.588 -5.857 -2.757 1.00 0.00 O ATOM 362 CB VAL A 659 -5.485 -3.409 -1.822 1.00 0.00 C ATOM 363 CG1 VAL A 659 -6.362 -4.544 -2.328 1.00 0.00 C ATOM 364 CG2 VAL A 659 -6.150 -2.687 -0.660 1.00 0.00 C ATOM 0 H VAL A 659 -3.649 -1.933 -0.996 1.00 0.00 H new ATOM 0 HA VAL A 659 -4.223 -4.652 -0.588 1.00 0.00 H new ATOM 0 HB VAL A 659 -5.352 -2.696 -2.635 1.00 0.00 H new ATOM 0 HG11 VAL A 659 -7.336 -4.150 -2.618 1.00 0.00 H new ATOM 0 HG12 VAL A 659 -5.888 -5.013 -3.191 1.00 0.00 H new ATOM 0 HG13 VAL A 659 -6.491 -5.284 -1.538 1.00 0.00 H new ATOM 0 HG21 VAL A 659 -7.127 -2.318 -0.972 1.00 0.00 H new ATOM 0 HG22 VAL A 659 -6.272 -3.377 0.175 1.00 0.00 H new ATOM 0 HG23 VAL A 659 -5.528 -1.848 -0.349 1.00 0.00 H new ATOM 374 N VAL A 660 -2.763 -3.873 -3.426 1.00 0.00 N ATOM 375 CA VAL A 660 -2.098 -4.422 -4.601 1.00 0.00 C ATOM 376 C VAL A 660 -0.969 -5.366 -4.203 1.00 0.00 C ATOM 377 O VAL A 660 -0.813 -6.442 -4.781 1.00 0.00 O ATOM 378 CB VAL A 660 -1.528 -3.306 -5.496 1.00 0.00 C ATOM 379 CG1 VAL A 660 -0.681 -3.897 -6.613 1.00 0.00 C ATOM 380 CG2 VAL A 660 -2.652 -2.452 -6.064 1.00 0.00 C ATOM 0 H VAL A 660 -2.646 -2.867 -3.307 1.00 0.00 H new ATOM 0 HA VAL A 660 -2.851 -4.977 -5.160 1.00 0.00 H new ATOM 0 HB VAL A 660 -0.889 -2.667 -4.887 1.00 0.00 H new ATOM 0 HG11 VAL A 660 -0.287 -3.093 -7.235 1.00 0.00 H new ATOM 0 HG12 VAL A 660 0.146 -4.462 -6.183 1.00 0.00 H new ATOM 0 HG13 VAL A 660 -1.295 -4.560 -7.223 1.00 0.00 H new ATOM 0 HG21 VAL A 660 -2.231 -1.668 -6.694 1.00 0.00 H new ATOM 0 HG22 VAL A 660 -3.319 -3.077 -6.659 1.00 0.00 H new ATOM 0 HG23 VAL A 660 -3.213 -1.998 -5.247 1.00 0.00 H new ATOM 390 N ALA A 661 -0.184 -4.956 -3.212 1.00 0.00 N ATOM 391 CA ALA A 661 0.930 -5.766 -2.735 1.00 0.00 C ATOM 392 C ALA A 661 0.440 -7.097 -2.174 1.00 0.00 C ATOM 393 O ALA A 661 0.994 -8.153 -2.479 1.00 0.00 O ATOM 394 CB ALA A 661 1.721 -5.006 -1.681 1.00 0.00 C ATOM 0 H ALA A 661 -0.299 -4.068 -2.724 1.00 0.00 H new ATOM 0 HA ALA A 661 1.583 -5.977 -3.582 1.00 0.00 H new ATOM 0 HB1 ALA A 661 2.550 -5.623 -1.333 1.00 0.00 H new ATOM 0 HB2 ALA A 661 2.111 -4.084 -2.113 1.00 0.00 H new ATOM 0 HB3 ALA A 661 1.070 -4.766 -0.840 1.00 0.00 H new ATOM 400 N LEU A 662 -0.602 -7.039 -1.351 1.00 0.00 N ATOM 401 CA LEU A 662 -1.167 -8.240 -0.746 1.00 0.00 C ATOM 402 C LEU A 662 -1.640 -9.218 -1.817 1.00 0.00 C ATOM 403 O LEU A 662 -1.297 -10.399 -1.789 1.00 0.00 O ATOM 404 CB LEU A 662 -2.331 -7.872 0.175 1.00 0.00 C ATOM 405 CG LEU A 662 -1.951 -7.366 1.567 1.00 0.00 C ATOM 406 CD1 LEU A 662 -3.149 -6.719 2.246 1.00 0.00 C ATOM 407 CD2 LEU A 662 -1.404 -8.503 2.417 1.00 0.00 C ATOM 0 H LEU A 662 -1.072 -6.173 -1.088 1.00 0.00 H new ATOM 0 HA LEU A 662 -0.386 -8.723 -0.158 1.00 0.00 H new ATOM 0 HB2 LEU A 662 -2.930 -7.106 -0.317 1.00 0.00 H new ATOM 0 HB3 LEU A 662 -2.968 -8.749 0.290 1.00 0.00 H new ATOM 0 HG LEU A 662 -1.171 -6.613 1.458 1.00 0.00 H new ATOM 0 HD11 LEU A 662 -2.859 -6.365 3.235 1.00 0.00 H new ATOM 0 HD12 LEU A 662 -3.496 -5.877 1.647 1.00 0.00 H new ATOM 0 HD13 LEU A 662 -3.951 -7.451 2.343 1.00 0.00 H new ATOM 0 HD21 LEU A 662 -1.139 -8.124 3.404 1.00 0.00 H new ATOM 0 HD22 LEU A 662 -2.162 -9.279 2.518 1.00 0.00 H new ATOM 0 HD23 LEU A 662 -0.518 -8.921 1.939 1.00 0.00 H new ATOM 419 N GLY A 663 -2.430 -8.716 -2.762 1.00 0.00 N ATOM 420 CA GLY A 663 -2.936 -9.559 -3.830 1.00 0.00 C ATOM 421 C GLY A 663 -1.827 -10.259 -4.591 1.00 0.00 C ATOM 422 O GLY A 663 -1.880 -11.471 -4.802 1.00 0.00 O ATOM 0 H GLY A 663 -2.728 -7.742 -2.807 1.00 0.00 H new ATOM 0 HA2 GLY A 663 -3.612 -10.305 -3.411 1.00 0.00 H new ATOM 0 HA3 GLY A 663 -3.520 -8.952 -4.522 1.00 0.00 H new ATOM 426 N ILE A 664 -0.822 -9.495 -5.005 1.00 0.00 N ATOM 427 CA ILE A 664 0.303 -10.050 -5.747 1.00 0.00 C ATOM 428 C ILE A 664 0.986 -11.163 -4.959 1.00 0.00 C ATOM 429 O ILE A 664 1.294 -12.223 -5.502 1.00 0.00 O ATOM 430 CB ILE A 664 1.343 -8.966 -6.087 1.00 0.00 C ATOM 431 CG1 ILE A 664 0.700 -7.858 -6.924 1.00 0.00 C ATOM 432 CG2 ILE A 664 2.524 -9.578 -6.826 1.00 0.00 C ATOM 433 CD1 ILE A 664 1.391 -6.519 -6.786 1.00 0.00 C ATOM 0 H ILE A 664 -0.764 -8.490 -4.839 1.00 0.00 H new ATOM 0 HA ILE A 664 -0.101 -10.458 -6.673 1.00 0.00 H new ATOM 0 HB ILE A 664 1.708 -8.529 -5.158 1.00 0.00 H new ATOM 0 HG12 ILE A 664 0.707 -8.155 -7.973 1.00 0.00 H new ATOM 0 HG13 ILE A 664 -0.344 -7.751 -6.630 1.00 0.00 H new ATOM 0 HG21 ILE A 664 3.250 -8.799 -7.059 1.00 0.00 H new ATOM 0 HG22 ILE A 664 2.993 -10.335 -6.198 1.00 0.00 H new ATOM 0 HG23 ILE A 664 2.176 -10.038 -7.751 1.00 0.00 H new ATOM 0 HD11 ILE A 664 0.882 -5.781 -7.407 1.00 0.00 H new ATOM 0 HD12 ILE A 664 1.361 -6.200 -5.744 1.00 0.00 H new ATOM 0 HD13 ILE A 664 2.428 -6.610 -7.108 1.00 0.00 H new ATOM 445 N GLY A 665 1.217 -10.915 -3.673 1.00 0.00 N ATOM 446 CA GLY A 665 1.860 -11.907 -2.831 1.00 0.00 C ATOM 447 C GLY A 665 1.124 -13.232 -2.829 1.00 0.00 C ATOM 448 O GLY A 665 1.726 -14.285 -3.038 1.00 0.00 O ATOM 0 H GLY A 665 0.971 -10.046 -3.200 1.00 0.00 H new ATOM 0 HA2 GLY A 665 2.882 -12.063 -3.175 1.00 0.00 H new ATOM 0 HA3 GLY A 665 1.922 -11.528 -1.811 1.00 0.00 H new ATOM 452 N LEU A 666 -0.182 -13.181 -2.592 1.00 0.00 N ATOM 453 CA LEU A 666 -1.002 -14.387 -2.562 1.00 0.00 C ATOM 454 C LEU A 666 -1.130 -14.992 -3.956 1.00 0.00 C ATOM 455 O LEU A 666 -1.186 -16.213 -4.112 1.00 0.00 O ATOM 456 CB LEU A 666 -2.390 -14.070 -2.002 1.00 0.00 C ATOM 457 CG LEU A 666 -2.421 -13.310 -0.676 1.00 0.00 C ATOM 458 CD1 LEU A 666 -3.838 -13.247 -0.129 1.00 0.00 C ATOM 459 CD2 LEU A 666 -1.486 -13.960 0.334 1.00 0.00 C ATOM 0 H LEU A 666 -0.696 -12.317 -2.418 1.00 0.00 H new ATOM 0 HA LEU A 666 -0.513 -15.114 -1.914 1.00 0.00 H new ATOM 0 HB2 LEU A 666 -2.935 -13.487 -2.745 1.00 0.00 H new ATOM 0 HB3 LEU A 666 -2.931 -15.008 -1.873 1.00 0.00 H new ATOM 0 HG LEU A 666 -2.078 -12.291 -0.856 1.00 0.00 H new ATOM 0 HD11 LEU A 666 -3.840 -12.702 0.815 1.00 0.00 H new ATOM 0 HD12 LEU A 666 -4.482 -12.735 -0.844 1.00 0.00 H new ATOM 0 HD13 LEU A 666 -4.210 -14.258 0.035 1.00 0.00 H new ATOM 0 HD21 LEU A 666 -1.521 -13.405 1.272 1.00 0.00 H new ATOM 0 HD22 LEU A 666 -1.799 -14.989 0.509 1.00 0.00 H new ATOM 0 HD23 LEU A 666 -0.468 -13.951 -0.055 1.00 0.00 H new ATOM 471 N PHE A 667 -1.174 -14.132 -4.968 1.00 0.00 N ATOM 472 CA PHE A 667 -1.294 -14.582 -6.350 1.00 0.00 C ATOM 473 C PHE A 667 -0.052 -15.359 -6.779 1.00 0.00 C ATOM 474 O PHE A 667 -0.152 -16.470 -7.299 1.00 0.00 O ATOM 475 CB PHE A 667 -1.508 -13.387 -7.281 1.00 0.00 C ATOM 476 CG PHE A 667 -1.339 -13.722 -8.735 1.00 0.00 C ATOM 477 CD1 PHE A 667 -0.097 -13.624 -9.343 1.00 0.00 C ATOM 478 CD2 PHE A 667 -2.421 -14.137 -9.495 1.00 0.00 C ATOM 479 CE1 PHE A 667 0.061 -13.931 -10.681 1.00 0.00 C ATOM 480 CE2 PHE A 667 -2.268 -14.446 -10.834 1.00 0.00 C ATOM 481 CZ PHE A 667 -1.026 -14.344 -11.427 1.00 0.00 C ATOM 0 H PHE A 667 -1.128 -13.119 -4.857 1.00 0.00 H new ATOM 0 HA PHE A 667 -2.157 -15.245 -6.416 1.00 0.00 H new ATOM 0 HB2 PHE A 667 -2.510 -12.988 -7.122 1.00 0.00 H new ATOM 0 HB3 PHE A 667 -0.805 -12.598 -7.014 1.00 0.00 H new ATOM 0 HD1 PHE A 667 0.757 -13.304 -8.764 1.00 0.00 H new ATOM 0 HD2 PHE A 667 -3.395 -14.220 -9.036 1.00 0.00 H new ATOM 0 HE1 PHE A 667 1.034 -13.848 -11.143 1.00 0.00 H new ATOM 0 HE2 PHE A 667 -3.120 -14.767 -11.415 1.00 0.00 H new ATOM 0 HZ PHE A 667 -0.904 -14.587 -12.472 1.00 0.00 H new ATOM 491 N MET A 668 1.116 -14.766 -6.556 1.00 0.00 N ATOM 492 CA MET A 668 2.377 -15.402 -6.918 1.00 0.00 C ATOM 493 C MET A 668 2.562 -16.713 -6.161 1.00 0.00 C ATOM 494 O MET A 668 3.072 -17.690 -6.708 1.00 0.00 O ATOM 495 CB MET A 668 3.549 -14.462 -6.628 1.00 0.00 C ATOM 496 CG MET A 668 3.540 -13.201 -7.477 1.00 0.00 C ATOM 497 SD MET A 668 4.845 -12.045 -7.016 1.00 0.00 S ATOM 498 CE MET A 668 4.474 -11.788 -5.283 1.00 0.00 C ATOM 0 H MET A 668 1.215 -13.846 -6.126 1.00 0.00 H new ATOM 0 HA MET A 668 2.351 -15.620 -7.986 1.00 0.00 H new ATOM 0 HB2 MET A 668 3.527 -14.182 -5.575 1.00 0.00 H new ATOM 0 HB3 MET A 668 4.484 -14.997 -6.796 1.00 0.00 H new ATOM 0 HG2 MET A 668 3.655 -13.473 -8.526 1.00 0.00 H new ATOM 0 HG3 MET A 668 2.572 -12.709 -7.379 1.00 0.00 H new ATOM 0 HE1 MET A 668 4.461 -10.719 -5.068 1.00 0.00 H new ATOM 0 HE2 MET A 668 3.498 -12.216 -5.052 1.00 0.00 H new ATOM 0 HE3 MET A 668 5.236 -12.272 -4.672 1.00 0.00 H new ATOM 508 N ARG A 669 2.145 -16.726 -4.899 1.00 0.00 N ATOM 509 CA ARG A 669 2.266 -17.917 -4.066 1.00 0.00 C ATOM 510 C ARG A 669 1.563 -19.106 -4.713 1.00 0.00 C ATOM 511 O ARG A 669 2.028 -20.242 -4.616 1.00 0.00 O ATOM 512 CB ARG A 669 1.679 -17.656 -2.678 1.00 0.00 C ATOM 513 CG ARG A 669 2.619 -16.903 -1.751 1.00 0.00 C ATOM 514 CD ARG A 669 2.861 -17.671 -0.460 1.00 0.00 C ATOM 515 NE ARG A 669 4.240 -17.542 0.002 1.00 0.00 N ATOM 516 CZ ARG A 669 4.645 -17.900 1.216 1.00 0.00 C ATOM 517 NH1 ARG A 669 3.780 -18.406 2.084 1.00 0.00 N ATOM 518 NH2 ARG A 669 5.917 -17.752 1.563 1.00 0.00 N ATOM 0 H ARG A 669 1.720 -15.925 -4.431 1.00 0.00 H new ATOM 0 HA ARG A 669 3.325 -18.154 -3.966 1.00 0.00 H new ATOM 0 HB2 ARG A 669 0.755 -17.088 -2.785 1.00 0.00 H new ATOM 0 HB3 ARG A 669 1.416 -18.609 -2.219 1.00 0.00 H new ATOM 0 HG2 ARG A 669 3.569 -16.730 -2.256 1.00 0.00 H new ATOM 0 HG3 ARG A 669 2.198 -15.924 -1.520 1.00 0.00 H new ATOM 0 HD2 ARG A 669 2.184 -17.305 0.312 1.00 0.00 H new ATOM 0 HD3 ARG A 669 2.628 -18.724 -0.615 1.00 0.00 H new ATOM 0 HE ARG A 669 4.930 -17.156 -0.642 1.00 0.00 H new ATOM 0 HH11 ARG A 669 2.801 -18.521 1.821 1.00 0.00 H new ATOM 0 HH12 ARG A 669 4.093 -18.680 3.015 1.00 0.00 H new ATOM 0 HH21 ARG A 669 6.585 -17.363 0.898 1.00 0.00 H new ATOM 0 HH22 ARG A 669 6.227 -18.027 2.495 1.00 0.00 H new ATOM 532 N ARG A 670 0.440 -18.837 -5.372 1.00 0.00 N ATOM 533 CA ARG A 670 -0.328 -19.885 -6.033 1.00 0.00 C ATOM 534 C ARG A 670 -0.368 -19.660 -7.541 1.00 0.00 C ATOM 535 O ARG A 670 -1.214 -18.922 -8.046 1.00 0.00 O ATOM 536 CB ARG A 670 -1.751 -19.932 -5.475 1.00 0.00 C ATOM 537 CG ARG A 670 -2.679 -20.853 -6.250 1.00 0.00 C ATOM 538 CD ARG A 670 -4.110 -20.757 -5.745 1.00 0.00 C ATOM 539 NE ARG A 670 -4.174 -20.724 -4.286 1.00 0.00 N ATOM 540 CZ ARG A 670 -4.138 -21.812 -3.524 1.00 0.00 C ATOM 541 NH1 ARG A 670 -4.039 -23.011 -4.079 1.00 0.00 N ATOM 542 NH2 ARG A 670 -4.201 -21.700 -2.203 1.00 0.00 N ATOM 0 H ARG A 670 0.042 -17.902 -5.462 1.00 0.00 H new ATOM 0 HA ARG A 670 0.163 -20.839 -5.839 1.00 0.00 H new ATOM 0 HB2 ARG A 670 -1.714 -20.258 -4.436 1.00 0.00 H new ATOM 0 HB3 ARG A 670 -2.167 -18.924 -5.478 1.00 0.00 H new ATOM 0 HG2 ARG A 670 -2.648 -20.595 -7.309 1.00 0.00 H new ATOM 0 HG3 ARG A 670 -2.329 -21.882 -6.162 1.00 0.00 H new ATOM 0 HD2 ARG A 670 -4.578 -19.859 -6.149 1.00 0.00 H new ATOM 0 HD3 ARG A 670 -4.683 -21.608 -6.114 1.00 0.00 H new ATOM 0 HE ARG A 670 -4.250 -19.816 -3.827 1.00 0.00 H new ATOM 0 HH11 ARG A 670 -3.990 -23.101 -5.094 1.00 0.00 H new ATOM 0 HH12 ARG A 670 -4.012 -23.844 -3.491 1.00 0.00 H new ATOM 0 HH21 ARG A 670 -4.277 -20.779 -1.772 1.00 0.00 H new ATOM 0 HH22 ARG A 670 -4.173 -22.535 -1.618 1.00 0.00 H new ATOM 556 N ARG A 671 0.552 -20.301 -8.255 1.00 0.00 N ATOM 557 CA ARG A 671 0.623 -20.170 -9.705 1.00 0.00 C ATOM 558 C ARG A 671 0.911 -21.518 -10.359 1.00 0.00 C ATOM 559 O ARG A 671 1.779 -22.266 -9.908 1.00 0.00 O ATOM 560 CB ARG A 671 1.704 -19.160 -10.095 1.00 0.00 C ATOM 561 CG ARG A 671 1.216 -17.720 -10.107 1.00 0.00 C ATOM 562 CD ARG A 671 2.314 -16.764 -10.545 1.00 0.00 C ATOM 563 NE ARG A 671 2.930 -17.177 -11.803 1.00 0.00 N ATOM 564 CZ ARG A 671 2.374 -16.980 -12.994 1.00 0.00 C ATOM 565 NH1 ARG A 671 1.196 -16.379 -13.087 1.00 0.00 N ATOM 566 NH2 ARG A 671 2.996 -17.385 -14.093 1.00 0.00 N ATOM 0 H ARG A 671 1.259 -20.916 -7.852 1.00 0.00 H new ATOM 0 HA ARG A 671 -0.343 -19.812 -10.060 1.00 0.00 H new ATOM 0 HB2 ARG A 671 2.538 -19.246 -9.399 1.00 0.00 H new ATOM 0 HB3 ARG A 671 2.086 -19.413 -11.084 1.00 0.00 H new ATOM 0 HG2 ARG A 671 0.363 -17.629 -10.780 1.00 0.00 H new ATOM 0 HG3 ARG A 671 0.868 -17.444 -9.112 1.00 0.00 H new ATOM 0 HD2 ARG A 671 1.899 -15.762 -10.656 1.00 0.00 H new ATOM 0 HD3 ARG A 671 3.077 -16.709 -9.769 1.00 0.00 H new ATOM 0 HE ARG A 671 3.837 -17.642 -11.766 1.00 0.00 H new ATOM 0 HH11 ARG A 671 0.715 -16.067 -12.244 1.00 0.00 H new ATOM 0 HH12 ARG A 671 0.771 -16.229 -14.002 1.00 0.00 H new ATOM 0 HH21 ARG A 671 3.902 -17.848 -14.025 1.00 0.00 H new ATOM 0 HH22 ARG A 671 2.568 -17.233 -15.006 1.00 0.00 H new ATOM 580 N HIS A 672 0.177 -21.821 -11.425 1.00 0.00 N ATOM 581 CA HIS A 672 0.354 -23.079 -12.142 1.00 0.00 C ATOM 582 C HIS A 672 1.447 -22.953 -13.198 1.00 0.00 C ATOM 583 O HIS A 672 1.795 -21.849 -13.617 1.00 0.00 O ATOM 584 CB HIS A 672 -0.960 -23.505 -12.800 1.00 0.00 C ATOM 585 CG HIS A 672 -2.065 -23.756 -11.821 1.00 0.00 C ATOM 586 ND1 HIS A 672 -3.340 -24.117 -12.203 1.00 0.00 N ATOM 587 CD2 HIS A 672 -2.081 -23.698 -10.469 1.00 0.00 C ATOM 588 CE1 HIS A 672 -4.093 -24.268 -11.127 1.00 0.00 C ATOM 589 NE2 HIS A 672 -3.353 -24.020 -10.062 1.00 0.00 N ATOM 0 H HIS A 672 -0.545 -21.213 -11.811 1.00 0.00 H new ATOM 0 HA HIS A 672 0.655 -23.840 -11.422 1.00 0.00 H new ATOM 0 HB2 HIS A 672 -1.274 -22.731 -13.500 1.00 0.00 H new ATOM 0 HB3 HIS A 672 -0.789 -24.410 -13.382 1.00 0.00 H new ATOM 0 HD2 HIS A 672 -1.249 -23.446 -9.829 1.00 0.00 H new ATOM 0 HE1 HIS A 672 -5.136 -24.547 -11.120 1.00 0.00 H new ATOM 0 HE2 HIS A 672 -3.674 -24.061 -9.095 1.00 0.00 H new ATOM 597 N ILE A 673 1.986 -24.091 -13.624 1.00 0.00 N ATOM 598 CA ILE A 673 3.040 -24.107 -14.630 1.00 0.00 C ATOM 599 C ILE A 673 2.895 -25.309 -15.559 1.00 0.00 C ATOM 600 O ILE A 673 2.347 -26.342 -15.174 1.00 0.00 O ATOM 601 CB ILE A 673 4.437 -24.139 -13.983 1.00 0.00 C ATOM 602 CG1 ILE A 673 4.384 -24.871 -12.640 1.00 0.00 C ATOM 603 CG2 ILE A 673 4.969 -22.725 -13.801 1.00 0.00 C ATOM 604 CD1 ILE A 673 3.898 -26.299 -12.749 1.00 0.00 C ATOM 0 H ILE A 673 1.710 -25.013 -13.288 1.00 0.00 H new ATOM 0 HA ILE A 673 2.938 -23.189 -15.208 1.00 0.00 H new ATOM 0 HB ILE A 673 5.115 -24.679 -14.644 1.00 0.00 H new ATOM 0 HG12 ILE A 673 5.379 -24.867 -12.194 1.00 0.00 H new ATOM 0 HG13 ILE A 673 3.729 -24.323 -11.963 1.00 0.00 H new ATOM 0 HG21 ILE A 673 5.957 -22.764 -13.343 1.00 0.00 H new ATOM 0 HG22 ILE A 673 5.039 -22.235 -14.772 1.00 0.00 H new ATOM 0 HG23 ILE A 673 4.293 -22.162 -13.158 1.00 0.00 H new ATOM 0 HD11 ILE A 673 3.886 -26.756 -11.759 1.00 0.00 H new ATOM 0 HD12 ILE A 673 2.891 -26.310 -13.166 1.00 0.00 H new ATOM 0 HD13 ILE A 673 4.566 -26.862 -13.401 1.00 0.00 H new ATOM 616 N VAL A 674 3.392 -25.167 -16.783 1.00 0.00 N ATOM 617 CA VAL A 674 3.321 -26.241 -17.766 1.00 0.00 C ATOM 618 C VAL A 674 4.645 -26.992 -17.857 1.00 0.00 C ATOM 619 O VAL A 674 5.711 -26.420 -17.629 1.00 0.00 O ATOM 620 CB VAL A 674 2.952 -25.702 -19.161 1.00 0.00 C ATOM 621 CG1 VAL A 674 2.698 -26.849 -20.127 1.00 0.00 C ATOM 622 CG2 VAL A 674 1.739 -24.787 -19.075 1.00 0.00 C ATOM 0 H VAL A 674 3.848 -24.318 -17.118 1.00 0.00 H new ATOM 0 HA VAL A 674 2.541 -26.925 -17.431 1.00 0.00 H new ATOM 0 HB VAL A 674 3.792 -25.119 -19.540 1.00 0.00 H new ATOM 0 HG11 VAL A 674 2.439 -26.449 -21.107 1.00 0.00 H new ATOM 0 HG12 VAL A 674 3.597 -27.460 -20.211 1.00 0.00 H new ATOM 0 HG13 VAL A 674 1.876 -27.462 -19.756 1.00 0.00 H new ATOM 0 HG21 VAL A 674 1.492 -24.415 -20.070 1.00 0.00 H new ATOM 0 HG22 VAL A 674 0.891 -25.343 -18.675 1.00 0.00 H new ATOM 0 HG23 VAL A 674 1.963 -23.946 -18.419 1.00 0.00 H new ATOM 632 N ARG A 675 4.569 -28.276 -18.192 1.00 0.00 N ATOM 633 CA ARG A 675 5.761 -29.105 -18.312 1.00 0.00 C ATOM 634 C ARG A 675 6.792 -28.447 -19.225 1.00 0.00 C ATOM 635 O ARG A 675 6.493 -27.473 -19.917 1.00 0.00 O ATOM 636 CB ARG A 675 5.394 -30.488 -18.854 1.00 0.00 C ATOM 637 CG ARG A 675 4.724 -31.386 -17.828 1.00 0.00 C ATOM 638 CD ARG A 675 4.035 -32.570 -18.488 1.00 0.00 C ATOM 639 NE ARG A 675 4.669 -33.838 -18.139 1.00 0.00 N ATOM 640 CZ ARG A 675 5.763 -34.301 -18.734 1.00 0.00 C ATOM 641 NH1 ARG A 675 6.341 -33.604 -19.702 1.00 0.00 N ATOM 642 NH2 ARG A 675 6.281 -35.464 -18.360 1.00 0.00 N ATOM 0 H ARG A 675 3.694 -28.764 -18.385 1.00 0.00 H new ATOM 0 HA ARG A 675 6.197 -29.215 -17.319 1.00 0.00 H new ATOM 0 HB2 ARG A 675 4.729 -30.369 -19.709 1.00 0.00 H new ATOM 0 HB3 ARG A 675 6.297 -30.978 -19.218 1.00 0.00 H new ATOM 0 HG2 ARG A 675 5.468 -31.747 -17.118 1.00 0.00 H new ATOM 0 HG3 ARG A 675 3.994 -30.809 -17.260 1.00 0.00 H new ATOM 0 HD2 ARG A 675 2.988 -32.594 -18.187 1.00 0.00 H new ATOM 0 HD3 ARG A 675 4.053 -32.442 -19.570 1.00 0.00 H new ATOM 0 HE ARG A 675 4.249 -34.399 -17.398 1.00 0.00 H new ATOM 0 HH11 ARG A 675 5.946 -32.709 -19.992 1.00 0.00 H new ATOM 0 HH12 ARG A 675 7.181 -33.962 -20.157 1.00 0.00 H new ATOM 0 HH21 ARG A 675 5.839 -36.003 -17.615 1.00 0.00 H new ATOM 0 HH22 ARG A 675 7.121 -35.819 -18.817 1.00 0.00 H new ATOM 656 N LYS A 676 8.007 -28.984 -19.221 1.00 0.00 N ATOM 657 CA LYS A 676 9.083 -28.450 -20.048 1.00 0.00 C ATOM 658 C LYS A 676 9.474 -29.443 -21.139 1.00 0.00 C ATOM 659 O LYS A 676 8.935 -30.547 -21.208 1.00 0.00 O ATOM 660 CB LYS A 676 10.302 -28.119 -19.184 1.00 0.00 C ATOM 661 CG LYS A 676 10.053 -27.006 -18.181 1.00 0.00 C ATOM 662 CD LYS A 676 11.255 -26.789 -17.278 1.00 0.00 C ATOM 663 CE LYS A 676 12.486 -26.386 -18.076 1.00 0.00 C ATOM 664 NZ LYS A 676 13.435 -25.578 -17.260 1.00 0.00 N ATOM 0 H LYS A 676 8.272 -29.789 -18.654 1.00 0.00 H new ATOM 0 HA LYS A 676 8.724 -27.537 -20.523 1.00 0.00 H new ATOM 0 HB2 LYS A 676 10.612 -29.016 -18.649 1.00 0.00 H new ATOM 0 HB3 LYS A 676 11.130 -27.833 -19.833 1.00 0.00 H new ATOM 0 HG2 LYS A 676 9.824 -26.082 -18.711 1.00 0.00 H new ATOM 0 HG3 LYS A 676 9.181 -27.250 -17.575 1.00 0.00 H new ATOM 0 HD2 LYS A 676 11.026 -26.015 -16.545 1.00 0.00 H new ATOM 0 HD3 LYS A 676 11.464 -27.703 -16.722 1.00 0.00 H new ATOM 0 HE2 LYS A 676 12.991 -27.280 -18.441 1.00 0.00 H new ATOM 0 HE3 LYS A 676 12.180 -25.813 -18.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 676 14.261 -25.323 -17.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 676 12.961 -24.712 -16.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 676 13.747 -26.134 -16.438 1.00 0.00 H new ATOM 678 N ARG A 677 10.415 -29.042 -21.987 1.00 0.00 N ATOM 679 CA ARG A 677 10.878 -29.896 -23.074 1.00 0.00 C ATOM 680 C ARG A 677 11.440 -31.207 -22.533 1.00 0.00 C ATOM 681 O ARG A 677 12.318 -31.177 -21.673 1.00 0.00 O ATOM 682 CB ARG A 677 11.944 -29.174 -23.900 1.00 0.00 C ATOM 683 CG ARG A 677 11.372 -28.326 -25.025 1.00 0.00 C ATOM 684 CD ARG A 677 12.444 -27.461 -25.670 1.00 0.00 C ATOM 685 NE ARG A 677 12.933 -26.427 -24.762 1.00 0.00 N ATOM 686 CZ ARG A 677 13.800 -25.487 -25.118 1.00 0.00 C ATOM 687 NH1 ARG A 677 14.272 -25.450 -26.357 1.00 0.00 N ATOM 688 NH2 ARG A 677 14.198 -24.580 -24.234 1.00 0.00 N ATOM 0 H ARG A 677 10.872 -28.131 -21.942 1.00 0.00 H new ATOM 0 HA ARG A 677 10.025 -30.122 -23.713 1.00 0.00 H new ATOM 0 HB2 ARG A 677 12.533 -28.537 -23.240 1.00 0.00 H new ATOM 0 HB3 ARG A 677 12.625 -29.912 -24.323 1.00 0.00 H new ATOM 0 HG2 ARG A 677 10.923 -28.973 -25.778 1.00 0.00 H new ATOM 0 HG3 ARG A 677 10.576 -27.691 -24.635 1.00 0.00 H new ATOM 0 HD2 ARG A 677 13.277 -28.090 -25.985 1.00 0.00 H new ATOM 0 HD3 ARG A 677 12.041 -26.993 -26.568 1.00 0.00 H new ATOM 0 HE ARG A 677 12.589 -26.427 -23.802 1.00 0.00 H new ATOM 0 HH11 ARG A 677 13.969 -26.145 -27.039 1.00 0.00 H new ATOM 0 HH12 ARG A 677 14.938 -24.726 -26.628 1.00 0.00 H new ATOM 0 HH21 ARG A 677 13.838 -24.605 -23.280 1.00 0.00 H new ATOM 0 HH22 ARG A 677 14.864 -23.858 -24.509 1.00 0.00 H new TER 702 ARG A 677 ATOM 703 N GLU B 634 -3.398 29.383 0.625 1.00 0.00 N ATOM 704 CA GLU B 634 -4.068 30.294 1.545 1.00 0.00 C ATOM 705 C GLU B 634 -4.503 31.569 0.828 1.00 0.00 C ATOM 706 O GLU B 634 -4.653 32.622 1.446 1.00 0.00 O ATOM 707 CB GLU B 634 -3.146 30.644 2.715 1.00 0.00 C ATOM 708 CG GLU B 634 -1.839 31.290 2.287 1.00 0.00 C ATOM 709 CD GLU B 634 -0.766 30.271 1.955 1.00 0.00 C ATOM 710 OE1 GLU B 634 -0.589 29.318 2.743 1.00 0.00 O ATOM 711 OE2 GLU B 634 -0.103 30.426 0.908 1.00 0.00 O ATOM 0 HA GLU B 634 -4.956 29.792 1.929 1.00 0.00 H new ATOM 0 HB2 GLU B 634 -3.671 31.319 3.391 1.00 0.00 H new ATOM 0 HB3 GLU B 634 -2.926 29.737 3.278 1.00 0.00 H new ATOM 0 HG2 GLU B 634 -2.018 31.921 1.416 1.00 0.00 H new ATOM 0 HG3 GLU B 634 -1.482 31.942 3.084 1.00 0.00 H new ATOM 718 N GLY B 635 -4.704 31.465 -0.483 1.00 0.00 N ATOM 719 CA GLY B 635 -5.119 32.615 -1.263 1.00 0.00 C ATOM 720 C GLY B 635 -4.754 32.484 -2.729 1.00 0.00 C ATOM 721 O GLY B 635 -4.166 33.395 -3.313 1.00 0.00 O ATOM 0 H GLY B 635 -4.587 30.604 -1.018 1.00 0.00 H new ATOM 0 HA2 GLY B 635 -6.198 32.743 -1.170 1.00 0.00 H new ATOM 0 HA3 GLY B 635 -4.655 33.513 -0.855 1.00 0.00 H new ATOM 725 N CYS B 636 -5.100 31.348 -3.323 1.00 0.00 N ATOM 726 CA CYS B 636 -4.803 31.099 -4.730 1.00 0.00 C ATOM 727 C CYS B 636 -5.663 29.964 -5.275 1.00 0.00 C ATOM 728 O CYS B 636 -6.151 29.111 -4.533 1.00 0.00 O ATOM 729 CB CYS B 636 -3.321 30.764 -4.907 1.00 0.00 C ATOM 730 SG CYS B 636 -2.686 29.570 -3.708 1.00 0.00 S ATOM 0 H CYS B 636 -5.586 30.584 -2.853 1.00 0.00 H new ATOM 0 HA CYS B 636 -5.033 32.005 -5.291 1.00 0.00 H new ATOM 0 HB2 CYS B 636 -3.166 30.371 -5.912 1.00 0.00 H new ATOM 0 HB3 CYS B 636 -2.740 31.683 -4.831 1.00 0.00 H new ATOM 0 HG CYS B 636 -2.393 28.459 -4.316 1.00 0.00 H new ATOM 736 N PRO B 637 -5.855 29.952 -6.602 1.00 0.00 N ATOM 737 CA PRO B 637 -6.658 28.927 -7.276 1.00 0.00 C ATOM 738 C PRO B 637 -5.982 27.560 -7.263 1.00 0.00 C ATOM 739 O PRO B 637 -5.398 27.134 -8.260 1.00 0.00 O ATOM 740 CB PRO B 637 -6.773 29.452 -8.709 1.00 0.00 C ATOM 741 CG PRO B 637 -5.577 30.321 -8.891 1.00 0.00 C ATOM 742 CD PRO B 637 -5.303 30.937 -7.547 1.00 0.00 C ATOM 0 HA PRO B 637 -7.619 28.774 -6.785 1.00 0.00 H new ATOM 0 HB2 PRO B 637 -6.782 28.635 -9.430 1.00 0.00 H new ATOM 0 HB3 PRO B 637 -7.696 30.014 -8.852 1.00 0.00 H new ATOM 0 HG2 PRO B 637 -4.722 29.740 -9.235 1.00 0.00 H new ATOM 0 HG3 PRO B 637 -5.764 31.089 -9.641 1.00 0.00 H new ATOM 0 HD2 PRO B 637 -4.236 31.094 -7.387 1.00 0.00 H new ATOM 0 HD3 PRO B 637 -5.787 31.908 -7.444 1.00 0.00 H new ATOM 750 N THR B 638 -6.067 26.874 -6.127 1.00 0.00 N ATOM 751 CA THR B 638 -5.463 25.555 -5.984 1.00 0.00 C ATOM 752 C THR B 638 -4.010 25.563 -6.443 1.00 0.00 C ATOM 753 O THR B 638 -3.546 24.620 -7.083 1.00 0.00 O ATOM 754 CB THR B 638 -6.238 24.493 -6.786 1.00 0.00 C ATOM 755 OG1 THR B 638 -5.926 24.607 -8.179 1.00 0.00 O ATOM 756 CG2 THR B 638 -7.737 24.648 -6.583 1.00 0.00 C ATOM 0 H THR B 638 -6.548 27.210 -5.293 1.00 0.00 H new ATOM 0 HA THR B 638 -5.504 25.301 -4.925 1.00 0.00 H new ATOM 0 HB THR B 638 -5.939 23.509 -6.426 1.00 0.00 H new ATOM 0 HG1 THR B 638 -5.711 25.539 -8.391 1.00 0.00 H new ATOM 0 HG21 THR B 638 -8.263 23.887 -7.159 1.00 0.00 H new ATOM 0 HG22 THR B 638 -7.975 24.531 -5.526 1.00 0.00 H new ATOM 0 HG23 THR B 638 -8.049 25.637 -6.918 1.00 0.00 H new ATOM 764 N ASN B 639 -3.295 26.633 -6.112 1.00 0.00 N ATOM 765 CA ASN B 639 -1.893 26.763 -6.491 1.00 0.00 C ATOM 766 C ASN B 639 -0.978 26.443 -5.312 1.00 0.00 C ATOM 767 O ASN B 639 -1.385 26.535 -4.155 1.00 0.00 O ATOM 768 CB ASN B 639 -1.609 28.177 -7.001 1.00 0.00 C ATOM 769 CG ASN B 639 -0.502 28.208 -8.037 1.00 0.00 C ATOM 770 OD1 ASN B 639 0.680 28.251 -7.696 1.00 0.00 O ATOM 771 ND2 ASN B 639 -0.881 28.185 -9.309 1.00 0.00 N ATOM 0 H ASN B 639 -3.663 27.423 -5.582 1.00 0.00 H new ATOM 0 HA ASN B 639 -1.692 26.049 -7.289 1.00 0.00 H new ATOM 0 HB2 ASN B 639 -2.519 28.594 -7.433 1.00 0.00 H new ATOM 0 HB3 ASN B 639 -1.334 28.815 -6.161 1.00 0.00 H new ATOM 0 HD21 ASN B 639 -0.181 28.203 -10.050 1.00 0.00 H new ATOM 0 HD22 ASN B 639 -1.873 28.149 -9.545 1.00 0.00 H new ATOM 778 N GLY B 640 0.260 26.067 -5.616 1.00 0.00 N ATOM 779 CA GLY B 640 1.213 25.739 -4.571 1.00 0.00 C ATOM 780 C GLY B 640 2.130 24.597 -4.960 1.00 0.00 C ATOM 781 O GLY B 640 2.084 24.090 -6.082 1.00 0.00 O ATOM 0 H GLY B 640 0.620 25.984 -6.567 1.00 0.00 H new ATOM 0 HA2 GLY B 640 1.812 26.620 -4.341 1.00 0.00 H new ATOM 0 HA3 GLY B 640 0.673 25.474 -3.662 1.00 0.00 H new ATOM 785 N PRO B 641 2.988 24.175 -4.020 1.00 0.00 N ATOM 786 CA PRO B 641 3.937 23.081 -4.247 1.00 0.00 C ATOM 787 C PRO B 641 3.245 21.728 -4.362 1.00 0.00 C ATOM 788 O PRO B 641 2.576 21.280 -3.430 1.00 0.00 O ATOM 789 CB PRO B 641 4.830 23.122 -3.004 1.00 0.00 C ATOM 790 CG PRO B 641 3.983 23.748 -1.950 1.00 0.00 C ATOM 791 CD PRO B 641 3.098 24.733 -2.661 1.00 0.00 C ATOM 0 HA PRO B 641 4.482 23.202 -5.184 1.00 0.00 H new ATOM 0 HB2 PRO B 641 5.149 22.121 -2.713 1.00 0.00 H new ATOM 0 HB3 PRO B 641 5.733 23.705 -3.184 1.00 0.00 H new ATOM 0 HG2 PRO B 641 3.390 22.997 -1.428 1.00 0.00 H new ATOM 0 HG3 PRO B 641 4.598 24.246 -1.200 1.00 0.00 H new ATOM 0 HD2 PRO B 641 2.123 24.816 -2.181 1.00 0.00 H new ATOM 0 HD3 PRO B 641 3.535 25.732 -2.671 1.00 0.00 H new ATOM 799 N LYS B 642 3.410 21.079 -5.510 1.00 0.00 N ATOM 800 CA LYS B 642 2.803 19.775 -5.747 1.00 0.00 C ATOM 801 C LYS B 642 3.754 18.651 -5.348 1.00 0.00 C ATOM 802 O LYS B 642 3.348 17.677 -4.715 1.00 0.00 O ATOM 803 CB LYS B 642 2.414 19.630 -7.220 1.00 0.00 C ATOM 804 CG LYS B 642 1.051 20.213 -7.549 1.00 0.00 C ATOM 805 CD LYS B 642 1.161 21.645 -8.044 1.00 0.00 C ATOM 806 CE LYS B 642 1.678 21.703 -9.473 1.00 0.00 C ATOM 807 NZ LYS B 642 0.571 21.644 -10.467 1.00 0.00 N ATOM 0 H LYS B 642 3.960 21.436 -6.292 1.00 0.00 H new ATOM 0 HA LYS B 642 1.906 19.703 -5.132 1.00 0.00 H new ATOM 0 HB2 LYS B 642 3.168 20.120 -7.836 1.00 0.00 H new ATOM 0 HB3 LYS B 642 2.422 18.573 -7.487 1.00 0.00 H new ATOM 0 HG2 LYS B 642 0.566 19.601 -8.309 1.00 0.00 H new ATOM 0 HG3 LYS B 642 0.417 20.181 -6.663 1.00 0.00 H new ATOM 0 HD2 LYS B 642 0.184 22.126 -7.990 1.00 0.00 H new ATOM 0 HD3 LYS B 642 1.829 22.206 -7.391 1.00 0.00 H new ATOM 0 HE2 LYS B 642 2.246 22.622 -9.616 1.00 0.00 H new ATOM 0 HE3 LYS B 642 2.365 20.874 -9.645 1.00 0.00 H new ATOM 0 HZ1 LYS B 642 0.965 21.686 -11.428 1.00 0.00 H new ATOM 0 HZ2 LYS B 642 0.044 20.755 -10.347 1.00 0.00 H new ATOM 0 HZ3 LYS B 642 -0.071 22.449 -10.320 1.00 0.00 H new ATOM 821 N ILE B 643 5.021 18.795 -5.722 1.00 0.00 N ATOM 822 CA ILE B 643 6.030 17.793 -5.401 1.00 0.00 C ATOM 823 C ILE B 643 7.241 18.428 -4.727 1.00 0.00 C ATOM 824 O ILE B 643 8.336 18.486 -5.287 1.00 0.00 O ATOM 825 CB ILE B 643 6.495 17.039 -6.661 1.00 0.00 C ATOM 826 CG1 ILE B 643 5.288 16.560 -7.470 1.00 0.00 C ATOM 827 CG2 ILE B 643 7.382 15.864 -6.277 1.00 0.00 C ATOM 828 CD1 ILE B 643 5.664 15.809 -8.729 1.00 0.00 C ATOM 0 H ILE B 643 5.373 19.595 -6.247 1.00 0.00 H new ATOM 0 HA ILE B 643 5.565 17.086 -4.715 1.00 0.00 H new ATOM 0 HB ILE B 643 7.076 17.721 -7.281 1.00 0.00 H new ATOM 0 HG12 ILE B 643 4.673 15.916 -6.842 1.00 0.00 H new ATOM 0 HG13 ILE B 643 4.676 17.421 -7.739 1.00 0.00 H new ATOM 0 HG21 ILE B 643 7.703 15.341 -7.178 1.00 0.00 H new ATOM 0 HG22 ILE B 643 8.257 16.229 -5.738 1.00 0.00 H new ATOM 0 HG23 ILE B 643 6.823 15.179 -5.639 1.00 0.00 H new ATOM 0 HD11 ILE B 643 4.759 15.500 -9.252 1.00 0.00 H new ATOM 0 HD12 ILE B 643 6.254 16.457 -9.377 1.00 0.00 H new ATOM 0 HD13 ILE B 643 6.250 14.928 -8.466 1.00 0.00 H new ATOM 840 N PRO B 644 7.043 18.916 -3.493 1.00 0.00 N ATOM 841 CA PRO B 644 8.108 19.554 -2.714 1.00 0.00 C ATOM 842 C PRO B 644 9.168 18.558 -2.256 1.00 0.00 C ATOM 843 O PRO B 644 9.202 17.417 -2.717 1.00 0.00 O ATOM 844 CB PRO B 644 7.365 20.136 -1.508 1.00 0.00 C ATOM 845 CG PRO B 644 6.148 19.289 -1.368 1.00 0.00 C ATOM 846 CD PRO B 644 5.764 18.881 -2.764 1.00 0.00 C ATOM 0 HA PRO B 644 8.650 20.298 -3.298 1.00 0.00 H new ATOM 0 HB2 PRO B 644 7.979 20.098 -0.608 1.00 0.00 H new ATOM 0 HB3 PRO B 644 7.103 21.181 -1.671 1.00 0.00 H new ATOM 0 HG2 PRO B 644 6.350 18.416 -0.748 1.00 0.00 H new ATOM 0 HG3 PRO B 644 5.341 19.842 -0.887 1.00 0.00 H new ATOM 0 HD2 PRO B 644 5.317 17.887 -2.784 1.00 0.00 H new ATOM 0 HD3 PRO B 644 5.036 19.567 -3.197 1.00 0.00 H new ATOM 854 N SER B 645 10.032 18.997 -1.346 1.00 0.00 N ATOM 855 CA SER B 645 11.096 18.144 -0.829 1.00 0.00 C ATOM 856 C SER B 645 10.534 17.093 0.124 1.00 0.00 C ATOM 857 O SER B 645 11.237 16.164 0.525 1.00 0.00 O ATOM 858 CB SER B 645 12.151 18.988 -0.111 1.00 0.00 C ATOM 859 OG SER B 645 12.081 20.344 -0.515 1.00 0.00 O ATOM 0 H SER B 645 10.016 19.938 -0.952 1.00 0.00 H new ATOM 0 HA SER B 645 11.562 17.633 -1.672 1.00 0.00 H new ATOM 0 HB2 SER B 645 12.005 18.919 0.967 1.00 0.00 H new ATOM 0 HB3 SER B 645 13.144 18.593 -0.324 1.00 0.00 H new ATOM 0 HG SER B 645 12.764 20.862 -0.041 1.00 0.00 H new ATOM 865 N ILE B 646 9.264 17.247 0.482 1.00 0.00 N ATOM 866 CA ILE B 646 8.607 16.311 1.386 1.00 0.00 C ATOM 867 C ILE B 646 8.442 14.941 0.736 1.00 0.00 C ATOM 868 O ILE B 646 8.115 13.961 1.404 1.00 0.00 O ATOM 869 CB ILE B 646 7.224 16.828 1.825 1.00 0.00 C ATOM 870 CG1 ILE B 646 7.331 18.268 2.332 1.00 0.00 C ATOM 871 CG2 ILE B 646 6.637 15.925 2.898 1.00 0.00 C ATOM 872 CD1 ILE B 646 5.994 18.891 2.666 1.00 0.00 C ATOM 0 H ILE B 646 8.669 18.011 0.160 1.00 0.00 H new ATOM 0 HA ILE B 646 9.247 16.219 2.263 1.00 0.00 H new ATOM 0 HB ILE B 646 6.557 16.815 0.963 1.00 0.00 H new ATOM 0 HG12 ILE B 646 7.963 18.286 3.220 1.00 0.00 H new ATOM 0 HG13 ILE B 646 7.827 18.875 1.575 1.00 0.00 H new ATOM 0 HG21 ILE B 646 5.660 16.304 3.198 1.00 0.00 H new ATOM 0 HG22 ILE B 646 6.529 14.914 2.504 1.00 0.00 H new ATOM 0 HG23 ILE B 646 7.300 15.909 3.763 1.00 0.00 H new ATOM 0 HD11 ILE B 646 6.146 19.911 3.019 1.00 0.00 H new ATOM 0 HD12 ILE B 646 5.366 18.905 1.775 1.00 0.00 H new ATOM 0 HD13 ILE B 646 5.505 18.307 3.445 1.00 0.00 H new ATOM 884 N ALA B 647 8.674 14.882 -0.572 1.00 0.00 N ATOM 885 CA ALA B 647 8.555 13.632 -1.312 1.00 0.00 C ATOM 886 C ALA B 647 9.390 12.531 -0.668 1.00 0.00 C ATOM 887 O ALA B 647 9.065 11.347 -0.775 1.00 0.00 O ATOM 888 CB ALA B 647 8.973 13.835 -2.761 1.00 0.00 C ATOM 0 H ALA B 647 8.945 15.685 -1.140 1.00 0.00 H new ATOM 0 HA ALA B 647 7.511 13.321 -1.286 1.00 0.00 H new ATOM 0 HB1 ALA B 647 8.879 12.893 -3.302 1.00 0.00 H new ATOM 0 HB2 ALA B 647 8.331 14.585 -3.223 1.00 0.00 H new ATOM 0 HB3 ALA B 647 10.009 14.173 -2.797 1.00 0.00 H new ATOM 894 N THR B 648 10.468 12.927 0.001 1.00 0.00 N ATOM 895 CA THR B 648 11.351 11.973 0.661 1.00 0.00 C ATOM 896 C THR B 648 10.581 11.101 1.646 1.00 0.00 C ATOM 897 O THR B 648 10.705 9.877 1.636 1.00 0.00 O ATOM 898 CB THR B 648 12.492 12.688 1.409 1.00 0.00 C ATOM 899 OG1 THR B 648 13.120 13.644 0.547 1.00 0.00 O ATOM 900 CG2 THR B 648 13.525 11.688 1.904 1.00 0.00 C ATOM 0 H THR B 648 10.751 13.902 0.100 1.00 0.00 H new ATOM 0 HA THR B 648 11.777 11.344 -0.121 1.00 0.00 H new ATOM 0 HB THR B 648 12.066 13.202 2.271 1.00 0.00 H new ATOM 0 HG1 THR B 648 12.604 14.477 0.552 1.00 0.00 H new ATOM 0 HG21 THR B 648 14.321 12.217 2.429 1.00 0.00 H new ATOM 0 HG22 THR B 648 13.050 10.980 2.583 1.00 0.00 H new ATOM 0 HG23 THR B 648 13.946 11.149 1.055 1.00 0.00 H new ATOM 908 N GLY B 649 9.783 11.740 2.497 1.00 0.00 N ATOM 909 CA GLY B 649 9.003 11.006 3.477 1.00 0.00 C ATOM 910 C GLY B 649 7.887 10.200 2.843 1.00 0.00 C ATOM 911 O GLY B 649 7.571 9.101 3.298 1.00 0.00 O ATOM 0 H GLY B 649 9.663 12.753 2.525 1.00 0.00 H new ATOM 0 HA2 GLY B 649 9.660 10.337 4.033 1.00 0.00 H new ATOM 0 HA3 GLY B 649 8.578 11.706 4.197 1.00 0.00 H new ATOM 915 N MET B 650 7.287 10.748 1.791 1.00 0.00 N ATOM 916 CA MET B 650 6.199 10.071 1.095 1.00 0.00 C ATOM 917 C MET B 650 6.697 8.804 0.408 1.00 0.00 C ATOM 918 O MET B 650 6.102 7.735 0.547 1.00 0.00 O ATOM 919 CB MET B 650 5.564 11.008 0.065 1.00 0.00 C ATOM 920 CG MET B 650 4.912 12.235 0.680 1.00 0.00 C ATOM 921 SD MET B 650 3.651 11.815 1.898 1.00 0.00 S ATOM 922 CE MET B 650 2.684 10.614 0.985 1.00 0.00 C ATOM 0 H MET B 650 7.536 11.658 1.402 1.00 0.00 H new ATOM 0 HA MET B 650 5.448 9.790 1.833 1.00 0.00 H new ATOM 0 HB2 MET B 650 6.329 11.329 -0.642 1.00 0.00 H new ATOM 0 HB3 MET B 650 4.816 10.456 -0.504 1.00 0.00 H new ATOM 0 HG2 MET B 650 5.678 12.850 1.153 1.00 0.00 H new ATOM 0 HG3 MET B 650 4.463 12.837 -0.110 1.00 0.00 H new ATOM 0 HE1 MET B 650 1.668 10.588 1.380 1.00 0.00 H new ATOM 0 HE2 MET B 650 2.657 10.894 -0.068 1.00 0.00 H new ATOM 0 HE3 MET B 650 3.138 9.628 1.087 1.00 0.00 H new ATOM 932 N VAL B 651 7.793 8.930 -0.334 1.00 0.00 N ATOM 933 CA VAL B 651 8.372 7.794 -1.042 1.00 0.00 C ATOM 934 C VAL B 651 8.764 6.685 -0.073 1.00 0.00 C ATOM 935 O VAL B 651 8.476 5.512 -0.306 1.00 0.00 O ATOM 936 CB VAL B 651 9.611 8.213 -1.855 1.00 0.00 C ATOM 937 CG1 VAL B 651 10.201 7.015 -2.583 1.00 0.00 C ATOM 938 CG2 VAL B 651 9.256 9.321 -2.835 1.00 0.00 C ATOM 0 H VAL B 651 8.298 9.807 -0.460 1.00 0.00 H new ATOM 0 HA VAL B 651 7.608 7.422 -1.724 1.00 0.00 H new ATOM 0 HB VAL B 651 10.364 8.597 -1.166 1.00 0.00 H new ATOM 0 HG11 VAL B 651 11.076 7.330 -3.152 1.00 0.00 H new ATOM 0 HG12 VAL B 651 10.494 6.256 -1.857 1.00 0.00 H new ATOM 0 HG13 VAL B 651 9.457 6.599 -3.262 1.00 0.00 H new ATOM 0 HG21 VAL B 651 10.143 9.604 -3.401 1.00 0.00 H new ATOM 0 HG22 VAL B 651 8.486 8.967 -3.521 1.00 0.00 H new ATOM 0 HG23 VAL B 651 8.884 10.186 -2.287 1.00 0.00 H new ATOM 948 N GLY B 652 9.425 7.065 1.018 1.00 0.00 N ATOM 949 CA GLY B 652 9.846 6.090 2.007 1.00 0.00 C ATOM 950 C GLY B 652 8.679 5.328 2.604 1.00 0.00 C ATOM 951 O GLY B 652 8.760 4.118 2.810 1.00 0.00 O ATOM 0 H GLY B 652 9.676 8.030 1.234 1.00 0.00 H new ATOM 0 HA2 GLY B 652 10.538 5.385 1.546 1.00 0.00 H new ATOM 0 HA3 GLY B 652 10.390 6.597 2.804 1.00 0.00 H new ATOM 955 N ALA B 653 7.592 6.039 2.884 1.00 0.00 N ATOM 956 CA ALA B 653 6.404 5.423 3.461 1.00 0.00 C ATOM 957 C ALA B 653 5.675 4.566 2.432 1.00 0.00 C ATOM 958 O ALA B 653 5.253 3.447 2.727 1.00 0.00 O ATOM 959 CB ALA B 653 5.472 6.490 4.017 1.00 0.00 C ATOM 0 H ALA B 653 7.510 7.042 2.720 1.00 0.00 H new ATOM 0 HA ALA B 653 6.722 4.774 4.277 1.00 0.00 H new ATOM 0 HB1 ALA B 653 4.589 6.015 4.445 1.00 0.00 H new ATOM 0 HB2 ALA B 653 5.989 7.058 4.791 1.00 0.00 H new ATOM 0 HB3 ALA B 653 5.169 7.163 3.215 1.00 0.00 H new ATOM 965 N LEU B 654 5.530 5.097 1.223 1.00 0.00 N ATOM 966 CA LEU B 654 4.851 4.381 0.149 1.00 0.00 C ATOM 967 C LEU B 654 5.555 3.062 -0.156 1.00 0.00 C ATOM 968 O LEU B 654 4.915 2.014 -0.260 1.00 0.00 O ATOM 969 CB LEU B 654 4.795 5.245 -1.112 1.00 0.00 C ATOM 970 CG LEU B 654 3.850 6.447 -1.060 1.00 0.00 C ATOM 971 CD1 LEU B 654 4.287 7.512 -2.054 1.00 0.00 C ATOM 972 CD2 LEU B 654 2.418 6.012 -1.335 1.00 0.00 C ATOM 0 H LEU B 654 5.874 6.021 0.962 1.00 0.00 H new ATOM 0 HA LEU B 654 3.835 4.163 0.478 1.00 0.00 H new ATOM 0 HB2 LEU B 654 5.801 5.608 -1.325 1.00 0.00 H new ATOM 0 HB3 LEU B 654 4.500 4.612 -1.949 1.00 0.00 H new ATOM 0 HG LEU B 654 3.892 6.875 -0.059 1.00 0.00 H new ATOM 0 HD11 LEU B 654 3.603 8.359 -2.003 1.00 0.00 H new ATOM 0 HD12 LEU B 654 5.296 7.845 -1.811 1.00 0.00 H new ATOM 0 HD13 LEU B 654 4.275 7.096 -3.061 1.00 0.00 H new ATOM 0 HD21 LEU B 654 1.760 6.880 -1.294 1.00 0.00 H new ATOM 0 HD22 LEU B 654 2.359 5.558 -2.324 1.00 0.00 H new ATOM 0 HD23 LEU B 654 2.108 5.286 -0.584 1.00 0.00 H new ATOM 984 N LEU B 655 6.874 3.121 -0.297 1.00 0.00 N ATOM 985 CA LEU B 655 7.666 1.931 -0.587 1.00 0.00 C ATOM 986 C LEU B 655 7.577 0.924 0.555 1.00 0.00 C ATOM 987 O LEU B 655 7.352 -0.266 0.332 1.00 0.00 O ATOM 988 CB LEU B 655 9.127 2.314 -0.831 1.00 0.00 C ATOM 989 CG LEU B 655 9.416 3.063 -2.132 1.00 0.00 C ATOM 990 CD1 LEU B 655 10.891 3.424 -2.224 1.00 0.00 C ATOM 991 CD2 LEU B 655 8.993 2.230 -3.333 1.00 0.00 C ATOM 0 H LEU B 655 7.418 3.980 -0.215 1.00 0.00 H new ATOM 0 HA LEU B 655 7.262 1.467 -1.487 1.00 0.00 H new ATOM 0 HB2 LEU B 655 9.464 2.930 0.002 1.00 0.00 H new ATOM 0 HB3 LEU B 655 9.727 1.404 -0.818 1.00 0.00 H new ATOM 0 HG LEU B 655 8.836 3.986 -2.133 1.00 0.00 H new ATOM 0 HD11 LEU B 655 11.078 3.957 -3.157 1.00 0.00 H new ATOM 0 HD12 LEU B 655 11.163 4.060 -1.382 1.00 0.00 H new ATOM 0 HD13 LEU B 655 11.491 2.514 -2.200 1.00 0.00 H new ATOM 0 HD21 LEU B 655 9.206 2.779 -4.250 1.00 0.00 H new ATOM 0 HD22 LEU B 655 9.545 1.290 -3.336 1.00 0.00 H new ATOM 0 HD23 LEU B 655 7.924 2.023 -3.274 1.00 0.00 H new ATOM 1003 N LEU B 656 7.751 1.410 1.779 1.00 0.00 N ATOM 1004 CA LEU B 656 7.687 0.553 2.958 1.00 0.00 C ATOM 1005 C LEU B 656 6.302 -0.068 3.106 1.00 0.00 C ATOM 1006 O LEU B 656 6.168 -1.225 3.506 1.00 0.00 O ATOM 1007 CB LEU B 656 8.036 1.354 4.214 1.00 0.00 C ATOM 1008 CG LEU B 656 9.526 1.595 4.464 1.00 0.00 C ATOM 1009 CD1 LEU B 656 9.722 2.613 5.577 1.00 0.00 C ATOM 1010 CD2 LEU B 656 10.227 0.288 4.804 1.00 0.00 C ATOM 0 H LEU B 656 7.937 2.392 1.981 1.00 0.00 H new ATOM 0 HA LEU B 656 8.413 -0.250 2.833 1.00 0.00 H new ATOM 0 HB2 LEU B 656 7.537 2.321 4.154 1.00 0.00 H new ATOM 0 HB3 LEU B 656 7.622 0.835 5.078 1.00 0.00 H new ATOM 0 HG LEU B 656 9.969 1.995 3.552 1.00 0.00 H new ATOM 0 HD11 LEU B 656 10.788 2.772 5.741 1.00 0.00 H new ATOM 0 HD12 LEU B 656 9.254 3.556 5.294 1.00 0.00 H new ATOM 0 HD13 LEU B 656 9.265 2.242 6.494 1.00 0.00 H new ATOM 0 HD21 LEU B 656 11.286 0.478 4.979 1.00 0.00 H new ATOM 0 HD22 LEU B 656 9.782 -0.141 5.702 1.00 0.00 H new ATOM 0 HD23 LEU B 656 10.116 -0.411 3.975 1.00 0.00 H new ATOM 1022 N LEU B 657 5.274 0.708 2.779 1.00 0.00 N ATOM 1023 CA LEU B 657 3.898 0.233 2.873 1.00 0.00 C ATOM 1024 C LEU B 657 3.681 -0.989 1.987 1.00 0.00 C ATOM 1025 O LEU B 657 3.192 -2.023 2.445 1.00 0.00 O ATOM 1026 CB LEU B 657 2.926 1.345 2.473 1.00 0.00 C ATOM 1027 CG LEU B 657 2.618 2.386 3.550 1.00 0.00 C ATOM 1028 CD1 LEU B 657 2.067 3.657 2.922 1.00 0.00 C ATOM 1029 CD2 LEU B 657 1.637 1.825 4.570 1.00 0.00 C ATOM 0 H LEU B 657 5.367 1.668 2.447 1.00 0.00 H new ATOM 0 HA LEU B 657 3.709 -0.053 3.908 1.00 0.00 H new ATOM 0 HB2 LEU B 657 3.333 1.861 1.603 1.00 0.00 H new ATOM 0 HB3 LEU B 657 1.988 0.886 2.161 1.00 0.00 H new ATOM 0 HG LEU B 657 3.546 2.632 4.065 1.00 0.00 H new ATOM 0 HD11 LEU B 657 1.854 4.386 3.704 1.00 0.00 H new ATOM 0 HD12 LEU B 657 2.802 4.070 2.231 1.00 0.00 H new ATOM 0 HD13 LEU B 657 1.150 3.427 2.380 1.00 0.00 H new ATOM 0 HD21 LEU B 657 1.430 2.580 5.329 1.00 0.00 H new ATOM 0 HD22 LEU B 657 0.709 1.550 4.069 1.00 0.00 H new ATOM 0 HD23 LEU B 657 2.069 0.944 5.044 1.00 0.00 H new ATOM 1041 N LEU B 658 4.051 -0.866 0.717 1.00 0.00 N ATOM 1042 CA LEU B 658 3.900 -1.962 -0.233 1.00 0.00 C ATOM 1043 C LEU B 658 4.653 -3.201 0.240 1.00 0.00 C ATOM 1044 O LEU B 658 4.147 -4.320 0.149 1.00 0.00 O ATOM 1045 CB LEU B 658 4.407 -1.540 -1.614 1.00 0.00 C ATOM 1046 CG LEU B 658 3.441 -0.707 -2.457 1.00 0.00 C ATOM 1047 CD1 LEU B 658 4.190 0.023 -3.561 1.00 0.00 C ATOM 1048 CD2 LEU B 658 2.349 -1.589 -3.044 1.00 0.00 C ATOM 0 H LEU B 658 4.458 -0.018 0.322 1.00 0.00 H new ATOM 0 HA LEU B 658 2.840 -2.207 -0.301 1.00 0.00 H new ATOM 0 HB2 LEU B 658 5.327 -0.971 -1.483 1.00 0.00 H new ATOM 0 HB3 LEU B 658 4.665 -2.438 -2.175 1.00 0.00 H new ATOM 0 HG LEU B 658 2.972 0.036 -1.811 1.00 0.00 H new ATOM 0 HD11 LEU B 658 3.487 0.611 -4.151 1.00 0.00 H new ATOM 0 HD12 LEU B 658 4.935 0.685 -3.119 1.00 0.00 H new ATOM 0 HD13 LEU B 658 4.686 -0.703 -4.205 1.00 0.00 H new ATOM 0 HD21 LEU B 658 1.671 -0.979 -3.641 1.00 0.00 H new ATOM 0 HD22 LEU B 658 2.800 -2.355 -3.675 1.00 0.00 H new ATOM 0 HD23 LEU B 658 1.793 -2.066 -2.237 1.00 0.00 H new ATOM 1060 N VAL B 659 5.864 -2.994 0.748 1.00 0.00 N ATOM 1061 CA VAL B 659 6.685 -4.094 1.239 1.00 0.00 C ATOM 1062 C VAL B 659 6.027 -4.783 2.429 1.00 0.00 C ATOM 1063 O VAL B 659 6.122 -6.000 2.586 1.00 0.00 O ATOM 1064 CB VAL B 659 8.086 -3.606 1.653 1.00 0.00 C ATOM 1065 CG1 VAL B 659 8.939 -4.772 2.128 1.00 0.00 C ATOM 1066 CG2 VAL B 659 8.759 -2.877 0.499 1.00 0.00 C ATOM 0 H VAL B 659 6.298 -2.075 0.830 1.00 0.00 H new ATOM 0 HA VAL B 659 6.783 -4.806 0.420 1.00 0.00 H new ATOM 0 HB VAL B 659 7.978 -2.906 2.481 1.00 0.00 H new ATOM 0 HG11 VAL B 659 9.925 -4.408 2.416 1.00 0.00 H new ATOM 0 HG12 VAL B 659 8.462 -5.246 2.986 1.00 0.00 H new ATOM 0 HG13 VAL B 659 9.042 -5.499 1.323 1.00 0.00 H new ATOM 0 HG21 VAL B 659 9.748 -2.539 0.809 1.00 0.00 H new ATOM 0 HG22 VAL B 659 8.856 -3.553 -0.351 1.00 0.00 H new ATOM 0 HG23 VAL B 659 8.155 -2.016 0.211 1.00 0.00 H new ATOM 1076 N VAL B 660 5.358 -3.996 3.266 1.00 0.00 N ATOM 1077 CA VAL B 660 4.681 -4.530 4.441 1.00 0.00 C ATOM 1078 C VAL B 660 3.526 -5.442 4.044 1.00 0.00 C ATOM 1079 O VAL B 660 3.347 -6.518 4.614 1.00 0.00 O ATOM 1080 CB VAL B 660 4.143 -3.401 5.341 1.00 0.00 C ATOM 1081 CG1 VAL B 660 3.284 -3.972 6.458 1.00 0.00 C ATOM 1082 CG2 VAL B 660 5.291 -2.579 5.907 1.00 0.00 C ATOM 0 H VAL B 660 5.271 -2.986 3.152 1.00 0.00 H new ATOM 0 HA VAL B 660 5.421 -5.107 4.997 1.00 0.00 H new ATOM 0 HB VAL B 660 3.519 -2.743 4.736 1.00 0.00 H new ATOM 0 HG11 VAL B 660 2.913 -3.160 7.083 1.00 0.00 H new ATOM 0 HG12 VAL B 660 2.441 -4.513 6.028 1.00 0.00 H new ATOM 0 HG13 VAL B 660 3.881 -4.653 7.064 1.00 0.00 H new ATOM 0 HG21 VAL B 660 4.893 -1.786 6.540 1.00 0.00 H new ATOM 0 HG22 VAL B 660 5.943 -3.223 6.498 1.00 0.00 H new ATOM 0 HG23 VAL B 660 5.861 -2.138 5.089 1.00 0.00 H new ATOM 1092 N ALA B 661 2.745 -5.005 3.061 1.00 0.00 N ATOM 1093 CA ALA B 661 1.609 -5.784 2.585 1.00 0.00 C ATOM 1094 C ALA B 661 2.061 -7.124 2.016 1.00 0.00 C ATOM 1095 O ALA B 661 1.475 -8.166 2.313 1.00 0.00 O ATOM 1096 CB ALA B 661 0.833 -4.998 1.538 1.00 0.00 C ATOM 0 H ALA B 661 2.879 -4.116 2.579 1.00 0.00 H new ATOM 0 HA ALA B 661 0.955 -5.983 3.434 1.00 0.00 H new ATOM 0 HB1 ALA B 661 -0.013 -5.591 1.191 1.00 0.00 H new ATOM 0 HB2 ALA B 661 0.469 -4.069 1.976 1.00 0.00 H new ATOM 0 HB3 ALA B 661 1.486 -4.770 0.696 1.00 0.00 H new ATOM 1102 N LEU B 662 3.106 -7.091 1.197 1.00 0.00 N ATOM 1103 CA LEU B 662 3.637 -8.305 0.585 1.00 0.00 C ATOM 1104 C LEU B 662 4.086 -9.300 1.650 1.00 0.00 C ATOM 1105 O LEU B 662 3.712 -10.472 1.616 1.00 0.00 O ATOM 1106 CB LEU B 662 4.809 -7.964 -0.337 1.00 0.00 C ATOM 1107 CG LEU B 662 4.440 -7.439 -1.725 1.00 0.00 C ATOM 1108 CD1 LEU B 662 5.654 -6.820 -2.401 1.00 0.00 C ATOM 1109 CD2 LEU B 662 3.863 -8.556 -2.582 1.00 0.00 C ATOM 0 H LEU B 662 3.603 -6.238 0.941 1.00 0.00 H new ATOM 0 HA LEU B 662 2.842 -8.764 -0.003 1.00 0.00 H new ATOM 0 HB2 LEU B 662 5.430 -7.218 0.159 1.00 0.00 H new ATOM 0 HB3 LEU B 662 5.421 -8.858 -0.459 1.00 0.00 H new ATOM 0 HG LEU B 662 3.680 -6.667 -1.610 1.00 0.00 H new ATOM 0 HD11 LEU B 662 5.373 -6.452 -3.388 1.00 0.00 H new ATOM 0 HD12 LEU B 662 6.024 -5.992 -1.797 1.00 0.00 H new ATOM 0 HD13 LEU B 662 6.436 -7.572 -2.504 1.00 0.00 H new ATOM 0 HD21 LEU B 662 3.606 -8.164 -3.566 1.00 0.00 H new ATOM 0 HD22 LEU B 662 4.601 -9.351 -2.689 1.00 0.00 H new ATOM 0 HD23 LEU B 662 2.968 -8.955 -2.105 1.00 0.00 H new ATOM 1121 N GLY B 663 4.889 -8.824 2.597 1.00 0.00 N ATOM 1122 CA GLY B 663 5.374 -9.684 3.660 1.00 0.00 C ATOM 1123 C GLY B 663 4.248 -10.355 4.422 1.00 0.00 C ATOM 1124 O GLY B 663 4.269 -11.568 4.632 1.00 0.00 O ATOM 0 H GLY B 663 5.212 -7.858 2.647 1.00 0.00 H new ATOM 0 HA2 GLY B 663 6.027 -10.447 3.236 1.00 0.00 H new ATOM 0 HA3 GLY B 663 5.977 -9.096 4.352 1.00 0.00 H new ATOM 1128 N ILE B 664 3.264 -9.565 4.837 1.00 0.00 N ATOM 1129 CA ILE B 664 2.126 -10.091 5.580 1.00 0.00 C ATOM 1130 C ILE B 664 1.406 -11.177 4.788 1.00 0.00 C ATOM 1131 O ILE B 664 1.050 -12.223 5.329 1.00 0.00 O ATOM 1132 CB ILE B 664 1.122 -8.978 5.934 1.00 0.00 C ATOM 1133 CG1 ILE B 664 1.802 -7.895 6.774 1.00 0.00 C ATOM 1134 CG2 ILE B 664 -0.073 -9.558 6.675 1.00 0.00 C ATOM 1135 CD1 ILE B 664 1.143 -6.538 6.660 1.00 0.00 C ATOM 0 H ILE B 664 3.232 -8.559 4.671 1.00 0.00 H new ATOM 0 HA ILE B 664 2.521 -10.519 6.501 1.00 0.00 H new ATOM 0 HB ILE B 664 0.766 -8.524 5.009 1.00 0.00 H new ATOM 0 HG12 ILE B 664 1.801 -8.204 7.819 1.00 0.00 H new ATOM 0 HG13 ILE B 664 2.845 -7.810 6.468 1.00 0.00 H new ATOM 0 HG21 ILE B 664 -0.773 -8.759 6.918 1.00 0.00 H new ATOM 0 HG22 ILE B 664 -0.569 -10.296 6.044 1.00 0.00 H new ATOM 0 HG23 ILE B 664 0.266 -10.036 7.594 1.00 0.00 H new ATOM 0 HD11 ILE B 664 1.678 -5.820 7.282 1.00 0.00 H new ATOM 0 HD12 ILE B 664 1.168 -6.208 5.622 1.00 0.00 H new ATOM 0 HD13 ILE B 664 0.108 -6.607 6.994 1.00 0.00 H new ATOM 1147 N GLY B 665 1.195 -10.921 3.500 1.00 0.00 N ATOM 1148 CA GLY B 665 0.520 -11.886 2.653 1.00 0.00 C ATOM 1149 C GLY B 665 1.214 -13.234 2.643 1.00 0.00 C ATOM 1150 O GLY B 665 0.579 -14.269 2.851 1.00 0.00 O ATOM 0 H GLY B 665 1.480 -10.062 3.029 1.00 0.00 H new ATOM 0 HA2 GLY B 665 -0.507 -12.012 2.997 1.00 0.00 H new ATOM 0 HA3 GLY B 665 0.470 -11.499 1.635 1.00 0.00 H new ATOM 1154 N LEU B 666 2.520 -13.224 2.400 1.00 0.00 N ATOM 1155 CA LEU B 666 3.300 -14.456 2.362 1.00 0.00 C ATOM 1156 C LEU B 666 3.399 -15.080 3.750 1.00 0.00 C ATOM 1157 O LEU B 666 3.421 -16.303 3.892 1.00 0.00 O ATOM 1158 CB LEU B 666 4.701 -14.178 1.815 1.00 0.00 C ATOM 1159 CG LEU B 666 4.766 -13.412 0.493 1.00 0.00 C ATOM 1160 CD1 LEU B 666 6.190 -13.383 -0.039 1.00 0.00 C ATOM 1161 CD2 LEU B 666 3.825 -14.033 -0.530 1.00 0.00 C ATOM 0 H LEU B 666 3.061 -12.377 2.226 1.00 0.00 H new ATOM 0 HA LEU B 666 2.792 -15.159 1.703 1.00 0.00 H new ATOM 0 HB2 LEU B 666 5.257 -13.616 2.565 1.00 0.00 H new ATOM 0 HB3 LEU B 666 5.214 -15.131 1.685 1.00 0.00 H new ATOM 0 HG LEU B 666 4.448 -12.385 0.675 1.00 0.00 H new ATOM 0 HD11 LEU B 666 6.216 -12.834 -0.980 1.00 0.00 H new ATOM 0 HD12 LEU B 666 6.839 -12.892 0.686 1.00 0.00 H new ATOM 0 HD13 LEU B 666 6.537 -14.403 -0.205 1.00 0.00 H new ATOM 0 HD21 LEU B 666 3.884 -13.475 -1.465 1.00 0.00 H new ATOM 0 HD22 LEU B 666 4.113 -15.069 -0.707 1.00 0.00 H new ATOM 0 HD23 LEU B 666 2.803 -14.000 -0.152 1.00 0.00 H new ATOM 1173 N PHE B 667 3.457 -14.233 4.772 1.00 0.00 N ATOM 1174 CA PHE B 667 3.552 -14.702 6.150 1.00 0.00 C ATOM 1175 C PHE B 667 2.275 -15.425 6.568 1.00 0.00 C ATOM 1176 O PHE B 667 2.322 -16.545 7.077 1.00 0.00 O ATOM 1177 CB PHE B 667 3.818 -13.527 7.094 1.00 0.00 C ATOM 1178 CG PHE B 667 3.624 -13.867 8.544 1.00 0.00 C ATOM 1179 CD1 PHE B 667 2.385 -13.719 9.144 1.00 0.00 C ATOM 1180 CD2 PHE B 667 4.682 -14.335 9.306 1.00 0.00 C ATOM 1181 CE1 PHE B 667 2.203 -14.032 10.478 1.00 0.00 C ATOM 1182 CE2 PHE B 667 4.507 -14.649 10.641 1.00 0.00 C ATOM 1183 CZ PHE B 667 3.266 -14.496 11.228 1.00 0.00 C ATOM 0 H PHE B 667 3.440 -13.218 4.672 1.00 0.00 H new ATOM 0 HA PHE B 667 4.383 -15.404 6.212 1.00 0.00 H new ATOM 0 HB2 PHE B 667 4.839 -13.176 6.945 1.00 0.00 H new ATOM 0 HB3 PHE B 667 3.155 -12.703 6.831 1.00 0.00 H new ATOM 0 HD1 PHE B 667 1.551 -13.355 8.563 1.00 0.00 H new ATOM 0 HD2 PHE B 667 5.654 -14.456 8.852 1.00 0.00 H new ATOM 0 HE1 PHE B 667 1.231 -13.914 10.933 1.00 0.00 H new ATOM 0 HE2 PHE B 667 5.340 -15.014 11.224 1.00 0.00 H new ATOM 0 HZ PHE B 667 3.127 -14.739 12.271 1.00 0.00 H new ATOM 1193 N MET B 668 1.136 -14.777 6.348 1.00 0.00 N ATOM 1194 CA MET B 668 -0.154 -15.358 6.701 1.00 0.00 C ATOM 1195 C MET B 668 -0.391 -16.659 5.939 1.00 0.00 C ATOM 1196 O MET B 668 -0.964 -17.607 6.475 1.00 0.00 O ATOM 1197 CB MET B 668 -1.282 -14.368 6.406 1.00 0.00 C ATOM 1198 CG MET B 668 -1.244 -13.126 7.281 1.00 0.00 C ATOM 1199 SD MET B 668 -2.508 -11.921 6.832 1.00 0.00 S ATOM 1200 CE MET B 668 -2.119 -11.650 5.105 1.00 0.00 C ATOM 0 H MET B 668 1.080 -13.850 5.927 1.00 0.00 H new ATOM 0 HA MET B 668 -0.145 -15.579 7.768 1.00 0.00 H new ATOM 0 HB2 MET B 668 -1.226 -14.067 5.360 1.00 0.00 H new ATOM 0 HB3 MET B 668 -2.240 -14.870 6.543 1.00 0.00 H new ATOM 0 HG2 MET B 668 -1.378 -13.416 8.323 1.00 0.00 H new ATOM 0 HG3 MET B 668 -0.261 -12.662 7.203 1.00 0.00 H new ATOM 0 HE1 MET B 668 -2.157 -10.583 4.887 1.00 0.00 H new ATOM 0 HE2 MET B 668 -1.119 -12.028 4.894 1.00 0.00 H new ATOM 0 HE3 MET B 668 -2.844 -12.174 4.482 1.00 0.00 H new ATOM 1210 N ARG B 669 0.054 -16.695 4.687 1.00 0.00 N ATOM 1211 CA ARG B 669 -0.112 -17.878 3.852 1.00 0.00 C ATOM 1212 C ARG B 669 0.530 -19.099 4.505 1.00 0.00 C ATOM 1213 O ARG B 669 -0.069 -20.173 4.559 1.00 0.00 O ATOM 1214 CB ARG B 669 0.503 -17.644 2.471 1.00 0.00 C ATOM 1215 CG ARG B 669 -0.391 -16.849 1.534 1.00 0.00 C ATOM 1216 CD ARG B 669 -0.636 -17.594 0.231 1.00 0.00 C ATOM 1217 NE ARG B 669 -1.973 -17.342 -0.301 1.00 0.00 N ATOM 1218 CZ ARG B 669 -2.376 -17.752 -1.498 1.00 0.00 C ATOM 1219 NH1 ARG B 669 -1.551 -18.432 -2.283 1.00 0.00 N ATOM 1220 NH2 ARG B 669 -3.608 -17.483 -1.913 1.00 0.00 N ATOM 0 H ARG B 669 0.532 -15.919 4.229 1.00 0.00 H new ATOM 0 HA ARG B 669 -1.180 -18.066 3.740 1.00 0.00 H new ATOM 0 HB2 ARG B 669 1.451 -17.118 2.589 1.00 0.00 H new ATOM 0 HB3 ARG B 669 0.728 -18.608 2.014 1.00 0.00 H new ATOM 0 HG2 ARG B 669 -1.344 -16.647 2.023 1.00 0.00 H new ATOM 0 HG3 ARG B 669 0.070 -15.884 1.322 1.00 0.00 H new ATOM 0 HD2 ARG B 669 0.110 -17.292 -0.505 1.00 0.00 H new ATOM 0 HD3 ARG B 669 -0.507 -18.664 0.395 1.00 0.00 H new ATOM 0 HE ARG B 669 -2.633 -16.823 0.278 1.00 0.00 H new ATOM 0 HH11 ARG B 669 -0.604 -18.641 -1.968 1.00 0.00 H new ATOM 0 HH12 ARG B 669 -1.864 -18.745 -3.202 1.00 0.00 H new ATOM 0 HH21 ARG B 669 -4.246 -16.961 -1.312 1.00 0.00 H new ATOM 0 HH22 ARG B 669 -3.917 -17.798 -2.833 1.00 0.00 H new ATOM 1234 N ARG B 670 1.752 -18.926 4.999 1.00 0.00 N ATOM 1235 CA ARG B 670 2.475 -20.013 5.647 1.00 0.00 C ATOM 1236 C ARG B 670 2.414 -21.284 4.805 1.00 0.00 C ATOM 1237 O ARG B 670 2.355 -22.392 5.339 1.00 0.00 O ATOM 1238 CB ARG B 670 1.897 -20.281 7.038 1.00 0.00 C ATOM 1239 CG ARG B 670 2.952 -20.382 8.127 1.00 0.00 C ATOM 1240 CD ARG B 670 2.904 -19.184 9.063 1.00 0.00 C ATOM 1241 NE ARG B 670 1.671 -19.150 9.844 1.00 0.00 N ATOM 1242 CZ ARG B 670 1.468 -19.888 10.930 1.00 0.00 C ATOM 1243 NH1 ARG B 670 2.413 -20.713 11.361 1.00 0.00 N ATOM 1244 NH2 ARG B 670 0.319 -19.801 11.588 1.00 0.00 N ATOM 0 H ARG B 670 2.262 -18.043 4.963 1.00 0.00 H new ATOM 0 HA ARG B 670 3.518 -19.713 5.747 1.00 0.00 H new ATOM 0 HB2 ARG B 670 1.200 -19.483 7.292 1.00 0.00 H new ATOM 0 HB3 ARG B 670 1.324 -21.208 7.012 1.00 0.00 H new ATOM 0 HG2 ARG B 670 2.800 -21.298 8.698 1.00 0.00 H new ATOM 0 HG3 ARG B 670 3.940 -20.450 7.672 1.00 0.00 H new ATOM 0 HD2 ARG B 670 3.760 -19.216 9.737 1.00 0.00 H new ATOM 0 HD3 ARG B 670 2.991 -18.266 8.482 1.00 0.00 H new ATOM 0 HE ARG B 670 0.924 -18.525 9.539 1.00 0.00 H new ATOM 0 HH11 ARG B 670 3.298 -20.782 10.858 1.00 0.00 H new ATOM 0 HH12 ARG B 670 2.255 -21.279 12.195 1.00 0.00 H new ATOM 0 HH21 ARG B 670 -0.410 -19.167 11.260 1.00 0.00 H new ATOM 0 HH22 ARG B 670 0.164 -20.368 12.422 1.00 0.00 H new ATOM 1258 N ARG B 671 2.428 -21.116 3.487 1.00 0.00 N ATOM 1259 CA ARG B 671 2.372 -22.249 2.572 1.00 0.00 C ATOM 1260 C ARG B 671 3.056 -21.914 1.249 1.00 0.00 C ATOM 1261 O ARG B 671 2.938 -20.798 0.743 1.00 0.00 O ATOM 1262 CB ARG B 671 0.919 -22.657 2.318 1.00 0.00 C ATOM 1263 CG ARG B 671 0.420 -23.745 3.255 1.00 0.00 C ATOM 1264 CD ARG B 671 -0.924 -24.296 2.802 1.00 0.00 C ATOM 1265 NE ARG B 671 -1.982 -23.293 2.885 1.00 0.00 N ATOM 1266 CZ ARG B 671 -3.180 -23.442 2.330 1.00 0.00 C ATOM 1267 NH1 ARG B 671 -3.470 -24.547 1.657 1.00 0.00 N ATOM 1268 NH2 ARG B 671 -4.091 -22.485 2.449 1.00 0.00 N ATOM 0 H ARG B 671 2.478 -20.206 3.029 1.00 0.00 H new ATOM 0 HA ARG B 671 2.901 -23.083 3.034 1.00 0.00 H new ATOM 0 HB2 ARG B 671 0.281 -21.780 2.421 1.00 0.00 H new ATOM 0 HB3 ARG B 671 0.822 -23.003 1.289 1.00 0.00 H new ATOM 0 HG2 ARG B 671 1.150 -24.553 3.298 1.00 0.00 H new ATOM 0 HG3 ARG B 671 0.329 -23.344 4.264 1.00 0.00 H new ATOM 0 HD2 ARG B 671 -0.842 -24.653 1.775 1.00 0.00 H new ATOM 0 HD3 ARG B 671 -1.190 -25.155 3.418 1.00 0.00 H new ATOM 0 HE ARG B 671 -1.791 -22.432 3.397 1.00 0.00 H new ATOM 0 HH11 ARG B 671 -2.773 -25.286 1.564 1.00 0.00 H new ATOM 0 HH12 ARG B 671 -4.391 -24.659 1.232 1.00 0.00 H new ATOM 0 HH21 ARG B 671 -3.872 -21.634 2.967 1.00 0.00 H new ATOM 0 HH22 ARG B 671 -5.010 -22.600 2.023 1.00 0.00 H new ATOM 1282 N HIS B 672 3.770 -22.888 0.695 1.00 0.00 N ATOM 1283 CA HIS B 672 4.473 -22.697 -0.569 1.00 0.00 C ATOM 1284 C HIS B 672 4.735 -24.035 -1.253 1.00 0.00 C ATOM 1285 O HIS B 672 5.765 -24.669 -1.024 1.00 0.00 O ATOM 1286 CB HIS B 672 5.794 -21.963 -0.336 1.00 0.00 C ATOM 1287 CG HIS B 672 6.392 -21.394 -1.586 1.00 0.00 C ATOM 1288 ND1 HIS B 672 7.684 -20.918 -1.653 1.00 0.00 N ATOM 1289 CD2 HIS B 672 5.867 -21.229 -2.823 1.00 0.00 C ATOM 1290 CE1 HIS B 672 7.928 -20.483 -2.876 1.00 0.00 C ATOM 1291 NE2 HIS B 672 6.841 -20.660 -3.606 1.00 0.00 N ATOM 0 H HIS B 672 3.877 -23.818 1.101 1.00 0.00 H new ATOM 0 HA HIS B 672 3.841 -22.094 -1.220 1.00 0.00 H new ATOM 0 HB2 HIS B 672 5.631 -21.156 0.379 1.00 0.00 H new ATOM 0 HB3 HIS B 672 6.507 -22.651 0.118 1.00 0.00 H new ATOM 0 HD2 HIS B 672 4.868 -21.495 -3.136 1.00 0.00 H new ATOM 0 HE1 HIS B 672 8.858 -20.055 -3.221 1.00 0.00 H new ATOM 0 HE2 HIS B 672 6.742 -20.414 -4.591 1.00 0.00 H new ATOM 1299 N ILE B 673 3.796 -24.457 -2.093 1.00 0.00 N ATOM 1300 CA ILE B 673 3.926 -25.720 -2.811 1.00 0.00 C ATOM 1301 C ILE B 673 4.010 -25.490 -4.316 1.00 0.00 C ATOM 1302 O ILE B 673 3.084 -24.956 -4.926 1.00 0.00 O ATOM 1303 CB ILE B 673 2.744 -26.661 -2.512 1.00 0.00 C ATOM 1304 CG1 ILE B 673 2.790 -27.881 -3.435 1.00 0.00 C ATOM 1305 CG2 ILE B 673 1.424 -25.921 -2.667 1.00 0.00 C ATOM 1306 CD1 ILE B 673 2.570 -29.193 -2.714 1.00 0.00 C ATOM 0 H ILE B 673 2.938 -23.944 -2.293 1.00 0.00 H new ATOM 0 HA ILE B 673 4.848 -26.187 -2.465 1.00 0.00 H new ATOM 0 HB ILE B 673 2.825 -27.005 -1.481 1.00 0.00 H new ATOM 0 HG12 ILE B 673 2.031 -27.770 -4.209 1.00 0.00 H new ATOM 0 HG13 ILE B 673 3.757 -27.910 -3.938 1.00 0.00 H new ATOM 0 HG21 ILE B 673 0.599 -26.600 -2.452 1.00 0.00 H new ATOM 0 HG22 ILE B 673 1.394 -25.082 -1.972 1.00 0.00 H new ATOM 0 HG23 ILE B 673 1.332 -25.550 -3.688 1.00 0.00 H new ATOM 0 HD11 ILE B 673 2.616 -30.014 -3.430 1.00 0.00 H new ATOM 0 HD12 ILE B 673 3.344 -29.327 -1.958 1.00 0.00 H new ATOM 0 HD13 ILE B 673 1.592 -29.185 -2.234 1.00 0.00 H new ATOM 1318 N VAL B 674 5.127 -25.899 -4.910 1.00 0.00 N ATOM 1319 CA VAL B 674 5.331 -25.741 -6.345 1.00 0.00 C ATOM 1320 C VAL B 674 5.186 -27.074 -7.071 1.00 0.00 C ATOM 1321 O VAL B 674 6.010 -27.974 -6.908 1.00 0.00 O ATOM 1322 CB VAL B 674 6.720 -25.151 -6.652 1.00 0.00 C ATOM 1323 CG1 VAL B 674 7.807 -25.945 -5.944 1.00 0.00 C ATOM 1324 CG2 VAL B 674 6.965 -25.118 -8.153 1.00 0.00 C ATOM 0 H VAL B 674 5.904 -26.342 -4.420 1.00 0.00 H new ATOM 0 HA VAL B 674 4.565 -25.052 -6.700 1.00 0.00 H new ATOM 0 HB VAL B 674 6.750 -24.127 -6.279 1.00 0.00 H new ATOM 0 HG11 VAL B 674 8.781 -25.513 -6.173 1.00 0.00 H new ATOM 0 HG12 VAL B 674 7.639 -25.911 -4.867 1.00 0.00 H new ATOM 0 HG13 VAL B 674 7.781 -26.981 -6.283 1.00 0.00 H new ATOM 0 HG21 VAL B 674 7.951 -24.698 -8.352 1.00 0.00 H new ATOM 0 HG22 VAL B 674 6.915 -26.131 -8.552 1.00 0.00 H new ATOM 0 HG23 VAL B 674 6.205 -24.501 -8.632 1.00 0.00 H new ATOM 1334 N ARG B 675 4.133 -27.193 -7.873 1.00 0.00 N ATOM 1335 CA ARG B 675 3.879 -28.417 -8.624 1.00 0.00 C ATOM 1336 C ARG B 675 2.947 -28.149 -9.801 1.00 0.00 C ATOM 1337 O ARG B 675 2.459 -27.033 -9.979 1.00 0.00 O ATOM 1338 CB ARG B 675 3.272 -29.484 -7.711 1.00 0.00 C ATOM 1339 CG ARG B 675 4.308 -30.315 -6.972 1.00 0.00 C ATOM 1340 CD ARG B 675 3.717 -31.623 -6.469 1.00 0.00 C ATOM 1341 NE ARG B 675 2.509 -31.409 -5.676 1.00 0.00 N ATOM 1342 CZ ARG B 675 1.929 -32.358 -4.950 1.00 0.00 C ATOM 1343 NH1 ARG B 675 2.444 -33.579 -4.916 1.00 0.00 N ATOM 1344 NH2 ARG B 675 0.832 -32.087 -4.256 1.00 0.00 N ATOM 0 H ARG B 675 3.442 -26.457 -8.020 1.00 0.00 H new ATOM 0 HA ARG B 675 4.831 -28.780 -9.012 1.00 0.00 H new ATOM 0 HB2 ARG B 675 2.621 -29.000 -6.983 1.00 0.00 H new ATOM 0 HB3 ARG B 675 2.645 -30.147 -8.308 1.00 0.00 H new ATOM 0 HG2 ARG B 675 5.148 -30.525 -7.635 1.00 0.00 H new ATOM 0 HG3 ARG B 675 4.701 -29.744 -6.130 1.00 0.00 H new ATOM 0 HD2 ARG B 675 3.484 -32.266 -7.318 1.00 0.00 H new ATOM 0 HD3 ARG B 675 4.458 -32.148 -5.866 1.00 0.00 H new ATOM 0 HE ARG B 675 2.088 -30.480 -5.680 1.00 0.00 H new ATOM 0 HH11 ARG B 675 3.288 -33.792 -5.448 1.00 0.00 H new ATOM 0 HH12 ARG B 675 1.997 -34.306 -4.358 1.00 0.00 H new ATOM 0 HH21 ARG B 675 0.433 -31.149 -4.279 1.00 0.00 H new ATOM 0 HH22 ARG B 675 0.388 -32.817 -3.699 1.00 0.00 H new ATOM 1358 N LYS B 676 2.705 -29.179 -10.604 1.00 0.00 N ATOM 1359 CA LYS B 676 1.831 -29.057 -11.765 1.00 0.00 C ATOM 1360 C LYS B 676 0.401 -28.741 -11.338 1.00 0.00 C ATOM 1361 O LYS B 676 -0.008 -29.059 -10.222 1.00 0.00 O ATOM 1362 CB LYS B 676 1.856 -30.348 -12.587 1.00 0.00 C ATOM 1363 CG LYS B 676 2.932 -30.365 -13.659 1.00 0.00 C ATOM 1364 CD LYS B 676 2.621 -29.384 -14.776 1.00 0.00 C ATOM 1365 CE LYS B 676 1.721 -30.008 -15.832 1.00 0.00 C ATOM 1366 NZ LYS B 676 0.279 -29.847 -15.496 1.00 0.00 N ATOM 0 H LYS B 676 3.102 -30.109 -10.472 1.00 0.00 H new ATOM 0 HA LYS B 676 2.198 -28.235 -12.380 1.00 0.00 H new ATOM 0 HB2 LYS B 676 2.010 -31.193 -11.916 1.00 0.00 H new ATOM 0 HB3 LYS B 676 0.883 -30.488 -13.058 1.00 0.00 H new ATOM 0 HG2 LYS B 676 3.895 -30.117 -13.213 1.00 0.00 H new ATOM 0 HG3 LYS B 676 3.021 -31.370 -14.071 1.00 0.00 H new ATOM 0 HD2 LYS B 676 2.137 -28.500 -14.361 1.00 0.00 H new ATOM 0 HD3 LYS B 676 3.550 -29.052 -15.239 1.00 0.00 H new ATOM 0 HE2 LYS B 676 1.922 -29.547 -16.799 1.00 0.00 H new ATOM 0 HE3 LYS B 676 1.955 -31.068 -15.929 1.00 0.00 H new ATOM 0 HZ1 LYS B 676 -0.266 -29.694 -16.369 1.00 0.00 H new ATOM 0 HZ2 LYS B 676 -0.064 -30.705 -15.019 1.00 0.00 H new ATOM 0 HZ3 LYS B 676 0.159 -29.029 -14.865 1.00 0.00 H new ATOM 1380 N ARG B 677 -0.355 -28.116 -12.235 1.00 0.00 N ATOM 1381 CA ARG B 677 -1.739 -27.758 -11.951 1.00 0.00 C ATOM 1382 C ARG B 677 -1.820 -26.789 -10.775 1.00 0.00 C ATOM 1383 O ARG B 677 -2.774 -26.819 -9.998 1.00 0.00 O ATOM 1384 CB ARG B 677 -2.561 -29.012 -11.650 1.00 0.00 C ATOM 1385 CG ARG B 677 -2.359 -30.130 -12.660 1.00 0.00 C ATOM 1386 CD ARG B 677 -2.907 -29.751 -14.027 1.00 0.00 C ATOM 1387 NE ARG B 677 -2.573 -30.744 -15.044 1.00 0.00 N ATOM 1388 CZ ARG B 677 -2.784 -30.564 -16.344 1.00 0.00 C ATOM 1389 NH1 ARG B 677 -3.324 -29.435 -16.781 1.00 0.00 N ATOM 1390 NH2 ARG B 677 -2.453 -31.514 -17.209 1.00 0.00 N ATOM 0 H ARG B 677 -0.032 -27.847 -13.164 1.00 0.00 H new ATOM 0 HA ARG B 677 -2.149 -27.266 -12.833 1.00 0.00 H new ATOM 0 HB2 ARG B 677 -2.298 -29.379 -10.658 1.00 0.00 H new ATOM 0 HB3 ARG B 677 -3.618 -28.746 -11.622 1.00 0.00 H new ATOM 0 HG2 ARG B 677 -1.297 -30.359 -12.743 1.00 0.00 H new ATOM 0 HG3 ARG B 677 -2.853 -31.035 -12.307 1.00 0.00 H new ATOM 0 HD2 ARG B 677 -3.990 -29.644 -13.967 1.00 0.00 H new ATOM 0 HD3 ARG B 677 -2.507 -28.781 -14.322 1.00 0.00 H new ATOM 0 HE ARG B 677 -2.155 -31.624 -14.740 1.00 0.00 H new ATOM 0 HH11 ARG B 677 -3.579 -28.702 -16.119 1.00 0.00 H new ATOM 0 HH12 ARG B 677 -3.485 -29.299 -17.779 1.00 0.00 H new ATOM 0 HH21 ARG B 677 -2.036 -32.384 -16.877 1.00 0.00 H new ATOM 0 HH22 ARG B 677 -2.615 -31.375 -18.206 1.00 0.00 H new TER 1404 ARG B 677