USER MOD reduce.3.24.130724 H: found=0, std=0, add=815, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 809 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 65 ASN : amide:sc= -1.61 K(o=-4.9,f=-7.4!) USER MOD Set 1.2: A 88 MET CE :methyl -118:sc= -3.27 (180deg=-4.26!) USER MOD Single : A 1 GLY N :NH3+ 148:sc= 0.0157 (180deg=0) USER MOD Single : A 2 SER OG : rot 42:sc= 0.223 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.877 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 23 MET CE :methyl -161:sc= -0.719 (180deg=-1.59!) USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 30 HIS : no HE2:sc= -23.4! C(o=-23!,f=-26!) USER MOD Single : A 31 THR OG1 : rot -100:sc= -1.1! USER MOD Single : A 32 HIS : no HD1:sc= -0.192 X(o=-0.19,f=-0.012) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -2.4 K(o=-2.4,f=-9.5!) USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.891 USER MOD Single : A 47 SER OG : rot 131:sc= 0.158 USER MOD Single : A 56 SER OG : rot 52:sc= 0.981 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 37:sc= 0.204 USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 HIS : no HE2:sc= 0.506 K(o=0.51,f=-2.1!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 170:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 HIS : no HD1:sc= -0.081 X(o=-0.081,f=-0.00088) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 20.597 16.531 -10.329 1.00 0.00 N ATOM 2 CA GLY A 1 21.104 15.295 -10.902 1.00 0.00 C ATOM 3 C GLY A 1 20.009 14.229 -10.963 1.00 0.00 C ATOM 4 O GLY A 1 19.197 14.114 -10.046 1.00 0.00 O ATOM 0 H1 GLY A 1 21.359 17.011 -9.808 1.00 0.00 H new ATOM 0 H2 GLY A 1 20.254 17.151 -11.090 1.00 0.00 H new ATOM 0 H3 GLY A 1 19.815 16.317 -9.678 1.00 0.00 H new ATOM 0 HA2 GLY A 1 21.487 15.485 -11.904 1.00 0.00 H new ATOM 0 HA3 GLY A 1 21.940 14.929 -10.305 1.00 0.00 H new ATOM 8 N SER A 2 20.020 13.477 -12.054 1.00 0.00 N ATOM 9 CA SER A 2 19.038 12.424 -12.247 1.00 0.00 C ATOM 10 C SER A 2 19.520 11.449 -13.323 1.00 0.00 C ATOM 11 O SER A 2 20.242 11.838 -14.240 1.00 0.00 O ATOM 12 CB SER A 2 17.676 13.005 -12.630 1.00 0.00 C ATOM 13 OG SER A 2 16.797 13.089 -11.511 1.00 0.00 O ATOM 0 H SER A 2 20.694 13.576 -12.813 1.00 0.00 H new ATOM 0 HA SER A 2 18.923 11.888 -11.305 1.00 0.00 H new ATOM 0 HB2 SER A 2 17.813 13.998 -13.059 1.00 0.00 H new ATOM 0 HB3 SER A 2 17.221 12.384 -13.402 1.00 0.00 H new ATOM 0 HG SER A 2 17.292 13.414 -10.730 1.00 0.00 H new ATOM 19 N SER A 3 19.102 10.200 -13.175 1.00 0.00 N ATOM 20 CA SER A 3 19.483 9.167 -14.123 1.00 0.00 C ATOM 21 C SER A 3 18.392 8.096 -14.195 1.00 0.00 C ATOM 22 O SER A 3 17.658 7.887 -13.231 1.00 0.00 O ATOM 23 CB SER A 3 20.823 8.535 -13.741 1.00 0.00 C ATOM 24 OG SER A 3 21.257 7.580 -14.705 1.00 0.00 O ATOM 0 H SER A 3 18.504 9.881 -12.413 1.00 0.00 H new ATOM 0 HA SER A 3 19.597 9.628 -15.104 1.00 0.00 H new ATOM 0 HB2 SER A 3 21.576 9.316 -13.640 1.00 0.00 H new ATOM 0 HB3 SER A 3 20.732 8.052 -12.768 1.00 0.00 H new ATOM 0 HG SER A 3 22.116 7.201 -14.426 1.00 0.00 H new ATOM 30 N GLY A 4 18.322 7.445 -15.347 1.00 0.00 N ATOM 31 CA GLY A 4 17.334 6.401 -15.558 1.00 0.00 C ATOM 32 C GLY A 4 15.916 6.975 -15.535 1.00 0.00 C ATOM 33 O GLY A 4 15.623 7.885 -14.761 1.00 0.00 O ATOM 0 H GLY A 4 18.934 7.621 -16.144 1.00 0.00 H new ATOM 0 HA2 GLY A 4 17.516 5.911 -16.514 1.00 0.00 H new ATOM 0 HA3 GLY A 4 17.434 5.639 -14.785 1.00 0.00 H new ATOM 37 N SER A 5 15.073 6.420 -16.394 1.00 0.00 N ATOM 38 CA SER A 5 13.693 6.866 -16.483 1.00 0.00 C ATOM 39 C SER A 5 12.780 5.681 -16.805 1.00 0.00 C ATOM 40 O SER A 5 12.540 5.378 -17.973 1.00 0.00 O ATOM 41 CB SER A 5 13.535 7.961 -17.540 1.00 0.00 C ATOM 42 OG SER A 5 12.434 8.820 -17.257 1.00 0.00 O ATOM 0 H SER A 5 15.319 5.665 -17.034 1.00 0.00 H new ATOM 0 HA SER A 5 13.406 7.286 -15.519 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.451 8.550 -17.592 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.395 7.503 -18.519 1.00 0.00 H new ATOM 0 HG SER A 5 12.367 9.506 -17.953 1.00 0.00 H new ATOM 48 N SER A 6 12.297 5.043 -15.750 1.00 0.00 N ATOM 49 CA SER A 6 11.416 3.898 -15.906 1.00 0.00 C ATOM 50 C SER A 6 10.367 3.889 -14.792 1.00 0.00 C ATOM 51 O SER A 6 10.508 4.597 -13.796 1.00 0.00 O ATOM 52 CB SER A 6 12.208 2.589 -15.899 1.00 0.00 C ATOM 53 OG SER A 6 12.765 2.308 -14.618 1.00 0.00 O ATOM 0 H SER A 6 12.499 5.297 -14.783 1.00 0.00 H new ATOM 0 HA SER A 6 10.913 3.982 -16.869 1.00 0.00 H new ATOM 0 HB2 SER A 6 11.555 1.769 -16.198 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.008 2.645 -16.637 1.00 0.00 H new ATOM 0 HG SER A 6 13.261 1.464 -14.655 1.00 0.00 H new ATOM 59 N GLY A 7 9.338 3.081 -14.999 1.00 0.00 N ATOM 60 CA GLY A 7 8.265 2.971 -14.024 1.00 0.00 C ATOM 61 C GLY A 7 7.362 1.776 -14.336 1.00 0.00 C ATOM 62 O GLY A 7 6.916 1.610 -15.471 1.00 0.00 O ATOM 0 H GLY A 7 9.224 2.496 -15.827 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.686 2.862 -13.025 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.675 3.887 -14.023 1.00 0.00 H new ATOM 66 N TYR A 8 7.119 0.975 -13.309 1.00 0.00 N ATOM 67 CA TYR A 8 6.277 -0.200 -13.460 1.00 0.00 C ATOM 68 C TYR A 8 5.354 -0.371 -12.251 1.00 0.00 C ATOM 69 O TYR A 8 5.745 -0.082 -11.121 1.00 0.00 O ATOM 70 CB TYR A 8 7.229 -1.395 -13.532 1.00 0.00 C ATOM 71 CG TYR A 8 8.177 -1.509 -12.337 1.00 0.00 C ATOM 72 CD1 TYR A 8 7.687 -1.876 -11.100 1.00 0.00 C ATOM 73 CD2 TYR A 8 9.522 -1.244 -12.495 1.00 0.00 C ATOM 74 CE1 TYR A 8 8.579 -1.983 -9.975 1.00 0.00 C ATOM 75 CE2 TYR A 8 10.414 -1.351 -11.370 1.00 0.00 C ATOM 76 CZ TYR A 8 9.899 -1.715 -10.165 1.00 0.00 C ATOM 77 OH TYR A 8 10.742 -1.817 -9.103 1.00 0.00 O ATOM 0 H TYR A 8 7.490 1.116 -12.369 1.00 0.00 H new ATOM 0 HA TYR A 8 5.650 -0.111 -14.347 1.00 0.00 H new ATOM 0 HB2 TYR A 8 6.642 -2.310 -13.605 1.00 0.00 H new ATOM 0 HB3 TYR A 8 7.819 -1.321 -14.445 1.00 0.00 H new ATOM 0 HD1 TYR A 8 6.634 -2.083 -10.976 1.00 0.00 H new ATOM 0 HD2 TYR A 8 9.906 -0.956 -13.463 1.00 0.00 H new ATOM 0 HE1 TYR A 8 8.208 -2.270 -9.002 1.00 0.00 H new ATOM 0 HE2 TYR A 8 11.469 -1.147 -11.481 1.00 0.00 H new ATOM 0 HH TYR A 8 11.654 -1.598 -9.387 1.00 0.00 H new ATOM 87 N VAL A 9 4.146 -0.839 -12.531 1.00 0.00 N ATOM 88 CA VAL A 9 3.165 -1.052 -11.481 1.00 0.00 C ATOM 89 C VAL A 9 3.144 -2.534 -11.101 1.00 0.00 C ATOM 90 O VAL A 9 3.657 -3.375 -11.838 1.00 0.00 O ATOM 91 CB VAL A 9 1.798 -0.531 -11.929 1.00 0.00 C ATOM 92 CG1 VAL A 9 0.785 -0.594 -10.784 1.00 0.00 C ATOM 93 CG2 VAL A 9 1.908 0.889 -12.487 1.00 0.00 C ATOM 0 H VAL A 9 3.825 -1.076 -13.470 1.00 0.00 H new ATOM 0 HA VAL A 9 3.435 -0.491 -10.587 1.00 0.00 H new ATOM 0 HB VAL A 9 1.439 -1.178 -12.729 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -0.178 -0.218 -11.129 1.00 0.00 H new ATOM 0 HG12 VAL A 9 0.674 -1.627 -10.453 1.00 0.00 H new ATOM 0 HG13 VAL A 9 1.137 0.018 -9.953 1.00 0.00 H new ATOM 0 HG21 VAL A 9 0.922 1.235 -12.798 1.00 0.00 H new ATOM 0 HG22 VAL A 9 2.299 1.553 -11.717 1.00 0.00 H new ATOM 0 HG23 VAL A 9 2.581 0.892 -13.345 1.00 0.00 H new ATOM 103 N PHE A 10 2.547 -2.808 -9.950 1.00 0.00 N ATOM 104 CA PHE A 10 2.453 -4.174 -9.463 1.00 0.00 C ATOM 105 C PHE A 10 1.185 -4.374 -8.631 1.00 0.00 C ATOM 106 O PHE A 10 0.787 -3.487 -7.877 1.00 0.00 O ATOM 107 CB PHE A 10 3.675 -4.417 -8.575 1.00 0.00 C ATOM 108 CG PHE A 10 3.619 -3.693 -7.228 1.00 0.00 C ATOM 109 CD1 PHE A 10 4.034 -2.402 -7.132 1.00 0.00 C ATOM 110 CD2 PHE A 10 3.155 -4.342 -6.126 1.00 0.00 C ATOM 111 CE1 PHE A 10 3.983 -1.730 -5.882 1.00 0.00 C ATOM 112 CE2 PHE A 10 3.103 -3.670 -4.876 1.00 0.00 C ATOM 113 CZ PHE A 10 3.518 -2.378 -4.781 1.00 0.00 C ATOM 0 H PHE A 10 2.124 -2.108 -9.341 1.00 0.00 H new ATOM 0 HA PHE A 10 2.416 -4.867 -10.304 1.00 0.00 H new ATOM 0 HB2 PHE A 10 3.775 -5.488 -8.397 1.00 0.00 H new ATOM 0 HB3 PHE A 10 4.570 -4.098 -9.110 1.00 0.00 H new ATOM 0 HD1 PHE A 10 4.403 -1.887 -8.007 1.00 0.00 H new ATOM 0 HD2 PHE A 10 2.826 -5.368 -6.202 1.00 0.00 H new ATOM 0 HE1 PHE A 10 4.313 -0.705 -5.806 1.00 0.00 H new ATOM 0 HE2 PHE A 10 2.734 -4.185 -4.001 1.00 0.00 H new ATOM 0 HZ PHE A 10 3.478 -1.867 -3.830 1.00 0.00 H new ATOM 123 N THR A 11 0.586 -5.544 -8.795 1.00 0.00 N ATOM 124 CA THR A 11 -0.629 -5.871 -8.069 1.00 0.00 C ATOM 125 C THR A 11 -0.290 -6.561 -6.746 1.00 0.00 C ATOM 126 O THR A 11 0.754 -7.199 -6.624 1.00 0.00 O ATOM 127 CB THR A 11 -1.515 -6.717 -8.985 1.00 0.00 C ATOM 128 OG1 THR A 11 -1.882 -5.824 -10.034 1.00 0.00 O ATOM 129 CG2 THR A 11 -2.847 -7.090 -8.331 1.00 0.00 C ATOM 0 H THR A 11 0.920 -6.278 -9.420 1.00 0.00 H new ATOM 0 HA THR A 11 -1.182 -4.971 -7.799 1.00 0.00 H new ATOM 0 HB THR A 11 -0.982 -7.625 -9.267 1.00 0.00 H new ATOM 0 HG1 THR A 11 -2.457 -6.291 -10.675 1.00 0.00 H new ATOM 0 HG21 THR A 11 -3.437 -7.690 -9.024 1.00 0.00 H new ATOM 0 HG22 THR A 11 -2.659 -7.664 -7.424 1.00 0.00 H new ATOM 0 HG23 THR A 11 -3.395 -6.182 -8.079 1.00 0.00 H new ATOM 137 N VAL A 12 -1.193 -6.409 -5.788 1.00 0.00 N ATOM 138 CA VAL A 12 -1.002 -7.009 -4.478 1.00 0.00 C ATOM 139 C VAL A 12 -2.320 -7.630 -4.010 1.00 0.00 C ATOM 140 O VAL A 12 -3.315 -6.927 -3.840 1.00 0.00 O ATOM 141 CB VAL A 12 -0.451 -5.969 -3.501 1.00 0.00 C ATOM 142 CG1 VAL A 12 0.566 -6.599 -2.546 1.00 0.00 C ATOM 143 CG2 VAL A 12 0.161 -4.783 -4.250 1.00 0.00 C ATOM 0 H VAL A 12 -2.058 -5.879 -5.893 1.00 0.00 H new ATOM 0 HA VAL A 12 -0.264 -7.810 -4.528 1.00 0.00 H new ATOM 0 HB VAL A 12 -1.283 -5.595 -2.905 1.00 0.00 H new ATOM 0 HG11 VAL A 12 0.942 -5.838 -1.862 1.00 0.00 H new ATOM 0 HG12 VAL A 12 0.086 -7.394 -1.976 1.00 0.00 H new ATOM 0 HG13 VAL A 12 1.395 -7.014 -3.119 1.00 0.00 H new ATOM 0 HG21 VAL A 12 0.545 -4.058 -3.532 1.00 0.00 H new ATOM 0 HG22 VAL A 12 0.976 -5.134 -4.883 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -0.602 -4.311 -4.869 1.00 0.00 H new ATOM 153 N GLU A 13 -2.284 -8.940 -3.815 1.00 0.00 N ATOM 154 CA GLU A 13 -3.463 -9.663 -3.370 1.00 0.00 C ATOM 155 C GLU A 13 -3.286 -10.127 -1.923 1.00 0.00 C ATOM 156 O GLU A 13 -2.578 -11.098 -1.661 1.00 0.00 O ATOM 157 CB GLU A 13 -3.762 -10.846 -4.293 1.00 0.00 C ATOM 158 CG GLU A 13 -4.516 -10.389 -5.543 1.00 0.00 C ATOM 159 CD GLU A 13 -5.174 -11.576 -6.251 1.00 0.00 C ATOM 160 OE1 GLU A 13 -4.486 -12.183 -7.100 1.00 0.00 O ATOM 161 OE2 GLU A 13 -6.350 -11.849 -5.926 1.00 0.00 O ATOM 0 H GLU A 13 -1.457 -9.519 -3.957 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.317 -8.987 -3.412 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -2.830 -11.330 -4.583 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -4.354 -11.589 -3.758 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -5.276 -9.659 -5.267 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -3.828 -9.890 -6.225 1.00 0.00 H new ATOM 168 N LEU A 14 -3.942 -9.412 -1.021 1.00 0.00 N ATOM 169 CA LEU A 14 -3.866 -9.738 0.393 1.00 0.00 C ATOM 170 C LEU A 14 -5.180 -10.387 0.833 1.00 0.00 C ATOM 171 O LEU A 14 -6.204 -10.234 0.171 1.00 0.00 O ATOM 172 CB LEU A 14 -3.487 -8.501 1.209 1.00 0.00 C ATOM 173 CG LEU A 14 -2.052 -7.998 1.038 1.00 0.00 C ATOM 174 CD1 LEU A 14 -1.048 -9.142 1.194 1.00 0.00 C ATOM 175 CD2 LEU A 14 -1.883 -7.265 -0.294 1.00 0.00 C ATOM 0 H LEU A 14 -4.529 -8.608 -1.242 1.00 0.00 H new ATOM 0 HA LEU A 14 -3.074 -10.465 0.575 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -4.168 -7.693 0.944 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -3.650 -8.722 2.264 1.00 0.00 H new ATOM 0 HG LEU A 14 -1.846 -7.278 1.830 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.036 -8.758 1.068 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -1.148 -9.581 2.187 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -1.244 -9.903 0.439 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.854 -6.918 -0.390 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -2.115 -7.944 -1.115 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -2.559 -6.410 -0.327 1.00 0.00 H new ATOM 187 N GLU A 15 -5.106 -11.098 1.949 1.00 0.00 N ATOM 188 CA GLU A 15 -6.277 -11.771 2.486 1.00 0.00 C ATOM 189 C GLU A 15 -6.691 -11.136 3.815 1.00 0.00 C ATOM 190 O GLU A 15 -5.975 -11.248 4.809 1.00 0.00 O ATOM 191 CB GLU A 15 -6.021 -13.270 2.650 1.00 0.00 C ATOM 192 CG GLU A 15 -7.093 -13.917 3.530 1.00 0.00 C ATOM 193 CD GLU A 15 -7.072 -15.440 3.390 1.00 0.00 C ATOM 194 OE1 GLU A 15 -7.713 -15.932 2.436 1.00 0.00 O ATOM 195 OE2 GLU A 15 -6.414 -16.079 4.240 1.00 0.00 O ATOM 0 H GLU A 15 -4.254 -11.223 2.496 1.00 0.00 H new ATOM 0 HA GLU A 15 -7.097 -11.652 1.778 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -6.011 -13.750 1.671 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -5.038 -13.428 3.093 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -6.928 -13.642 4.572 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -8.076 -13.536 3.251 1.00 0.00 H new ATOM 202 N ARG A 16 -7.844 -10.485 3.790 1.00 0.00 N ATOM 203 CA ARG A 16 -8.362 -9.832 4.980 1.00 0.00 C ATOM 204 C ARG A 16 -8.086 -10.689 6.217 1.00 0.00 C ATOM 205 O ARG A 16 -8.625 -11.787 6.350 1.00 0.00 O ATOM 206 CB ARG A 16 -9.867 -9.587 4.864 1.00 0.00 C ATOM 207 CG ARG A 16 -10.287 -8.359 5.673 1.00 0.00 C ATOM 208 CD ARG A 16 -11.788 -8.096 5.533 1.00 0.00 C ATOM 209 NE ARG A 16 -12.408 -7.976 6.871 1.00 0.00 N ATOM 210 CZ ARG A 16 -12.457 -6.837 7.577 1.00 0.00 C ATOM 211 NH1 ARG A 16 -11.924 -5.715 7.075 1.00 0.00 N ATOM 212 NH2 ARG A 16 -13.040 -6.821 8.783 1.00 0.00 N ATOM 0 H ARG A 16 -8.435 -10.396 2.963 1.00 0.00 H new ATOM 0 HA ARG A 16 -7.856 -8.871 5.078 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -10.136 -9.447 3.817 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -10.410 -10.463 5.218 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -10.037 -8.508 6.723 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -9.728 -7.487 5.333 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -11.954 -7.182 4.963 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -12.257 -8.908 4.977 1.00 0.00 H new ATOM 0 HE ARG A 16 -12.824 -8.812 7.282 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -11.481 -5.727 6.156 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -11.961 -4.848 7.612 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -13.447 -7.675 9.164 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -13.077 -5.955 9.320 1.00 0.00 H new ATOM 226 N GLY A 17 -7.246 -10.156 7.092 1.00 0.00 N ATOM 227 CA GLY A 17 -6.891 -10.858 8.314 1.00 0.00 C ATOM 228 C GLY A 17 -7.901 -10.567 9.426 1.00 0.00 C ATOM 229 O GLY A 17 -8.986 -10.049 9.165 1.00 0.00 O ATOM 0 H GLY A 17 -6.801 -9.245 6.979 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -6.853 -11.931 8.124 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -5.894 -10.556 8.635 1.00 0.00 H new ATOM 233 N PRO A 18 -7.499 -10.923 10.675 1.00 0.00 N ATOM 234 CA PRO A 18 -8.356 -10.706 11.828 1.00 0.00 C ATOM 235 C PRO A 18 -8.383 -9.227 12.220 1.00 0.00 C ATOM 236 O PRO A 18 -9.242 -8.801 12.991 1.00 0.00 O ATOM 237 CB PRO A 18 -7.785 -11.599 12.917 1.00 0.00 C ATOM 238 CG PRO A 18 -6.365 -11.927 12.485 1.00 0.00 C ATOM 239 CD PRO A 18 -6.222 -11.539 11.022 1.00 0.00 C ATOM 0 HA PRO A 18 -9.398 -10.958 11.631 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -7.792 -11.092 13.882 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -8.379 -12.506 13.029 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -5.645 -11.383 13.096 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -6.160 -12.989 12.620 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -5.395 -10.845 10.876 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -6.021 -12.411 10.399 1.00 0.00 H new ATOM 247 N SER A 19 -7.433 -8.485 11.672 1.00 0.00 N ATOM 248 CA SER A 19 -7.337 -7.063 11.955 1.00 0.00 C ATOM 249 C SER A 19 -7.644 -6.256 10.692 1.00 0.00 C ATOM 250 O SER A 19 -7.982 -5.076 10.771 1.00 0.00 O ATOM 251 CB SER A 19 -5.951 -6.700 12.492 1.00 0.00 C ATOM 252 OG SER A 19 -5.612 -5.343 12.223 1.00 0.00 O ATOM 0 H SER A 19 -6.722 -8.842 11.033 1.00 0.00 H new ATOM 0 HA SER A 19 -8.070 -6.818 12.723 1.00 0.00 H new ATOM 0 HB2 SER A 19 -5.922 -6.874 13.568 1.00 0.00 H new ATOM 0 HB3 SER A 19 -5.205 -7.356 12.043 1.00 0.00 H new ATOM 0 HG SER A 19 -4.721 -5.151 12.583 1.00 0.00 H new ATOM 258 N GLY A 20 -7.516 -6.925 9.555 1.00 0.00 N ATOM 259 CA GLY A 20 -7.776 -6.285 8.277 1.00 0.00 C ATOM 260 C GLY A 20 -6.697 -6.646 7.254 1.00 0.00 C ATOM 261 O GLY A 20 -6.652 -7.774 6.765 1.00 0.00 O ATOM 0 H GLY A 20 -7.236 -7.904 9.493 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -8.753 -6.592 7.904 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -7.811 -5.203 8.408 1.00 0.00 H new ATOM 265 N LEU A 21 -5.854 -5.667 6.960 1.00 0.00 N ATOM 266 CA LEU A 21 -4.779 -5.867 6.004 1.00 0.00 C ATOM 267 C LEU A 21 -3.524 -5.142 6.495 1.00 0.00 C ATOM 268 O LEU A 21 -2.580 -4.942 5.732 1.00 0.00 O ATOM 269 CB LEU A 21 -5.223 -5.447 4.601 1.00 0.00 C ATOM 270 CG LEU A 21 -6.594 -5.955 4.152 1.00 0.00 C ATOM 271 CD1 LEU A 21 -7.537 -4.790 3.842 1.00 0.00 C ATOM 272 CD2 LEU A 21 -6.462 -6.915 2.967 1.00 0.00 C ATOM 0 H LEU A 21 -5.894 -4.733 7.367 1.00 0.00 H new ATOM 0 HA LEU A 21 -4.528 -6.925 5.930 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -5.228 -4.358 4.554 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.477 -5.794 3.886 1.00 0.00 H new ATOM 0 HG LEU A 21 -7.036 -6.517 4.975 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -8.504 -5.179 3.525 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -7.667 -4.179 4.735 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -7.112 -4.181 3.044 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -7.451 -7.261 2.667 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -5.990 -6.399 2.131 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.851 -7.770 3.257 1.00 0.00 H new ATOM 284 N GLY A 22 -3.555 -4.767 7.765 1.00 0.00 N ATOM 285 CA GLY A 22 -2.432 -4.069 8.367 1.00 0.00 C ATOM 286 C GLY A 22 -1.811 -3.077 7.381 1.00 0.00 C ATOM 287 O GLY A 22 -0.614 -3.136 7.106 1.00 0.00 O ATOM 0 H GLY A 22 -4.340 -4.933 8.394 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -2.764 -3.540 9.260 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -1.679 -4.790 8.686 1.00 0.00 H new ATOM 291 N MET A 23 -2.654 -2.188 6.875 1.00 0.00 N ATOM 292 CA MET A 23 -2.204 -1.185 5.926 1.00 0.00 C ATOM 293 C MET A 23 -2.843 0.174 6.220 1.00 0.00 C ATOM 294 O MET A 23 -4.065 0.309 6.190 1.00 0.00 O ATOM 295 CB MET A 23 -2.569 -1.624 4.506 1.00 0.00 C ATOM 296 CG MET A 23 -1.313 -1.922 3.684 1.00 0.00 C ATOM 297 SD MET A 23 -1.706 -1.906 1.943 1.00 0.00 S ATOM 298 CE MET A 23 -3.289 -2.730 1.975 1.00 0.00 C ATOM 0 H MET A 23 -3.647 -2.142 7.105 1.00 0.00 H new ATOM 0 HA MET A 23 -1.123 -1.085 6.018 1.00 0.00 H new ATOM 0 HB2 MET A 23 -3.200 -2.512 4.547 1.00 0.00 H new ATOM 0 HB3 MET A 23 -3.150 -0.842 4.018 1.00 0.00 H new ATOM 0 HG2 MET A 23 -0.543 -1.180 3.898 1.00 0.00 H new ATOM 0 HG3 MET A 23 -0.907 -2.894 3.965 1.00 0.00 H new ATOM 0 HE1 MET A 23 -3.524 -3.105 0.979 1.00 0.00 H new ATOM 0 HE2 MET A 23 -3.252 -3.563 2.677 1.00 0.00 H new ATOM 0 HE3 MET A 23 -4.060 -2.026 2.288 1.00 0.00 H new ATOM 308 N GLY A 24 -1.987 1.147 6.497 1.00 0.00 N ATOM 309 CA GLY A 24 -2.452 2.490 6.796 1.00 0.00 C ATOM 310 C GLY A 24 -2.360 3.390 5.562 1.00 0.00 C ATOM 311 O GLY A 24 -1.375 4.105 5.382 1.00 0.00 O ATOM 0 H GLY A 24 -0.974 1.031 6.521 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -3.483 2.452 7.147 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -1.856 2.913 7.604 1.00 0.00 H new ATOM 315 N LEU A 25 -3.399 3.325 4.743 1.00 0.00 N ATOM 316 CA LEU A 25 -3.448 4.125 3.531 1.00 0.00 C ATOM 317 C LEU A 25 -4.013 5.508 3.860 1.00 0.00 C ATOM 318 O LEU A 25 -5.137 5.624 4.346 1.00 0.00 O ATOM 319 CB LEU A 25 -4.221 3.390 2.434 1.00 0.00 C ATOM 320 CG LEU A 25 -3.886 1.908 2.255 1.00 0.00 C ATOM 321 CD1 LEU A 25 -2.404 1.644 2.531 1.00 0.00 C ATOM 322 CD2 LEU A 25 -4.794 1.031 3.120 1.00 0.00 C ATOM 0 H LEU A 25 -4.214 2.731 4.895 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.444 4.276 3.134 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -5.286 3.478 2.647 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.042 3.899 1.487 1.00 0.00 H new ATOM 0 HG LEU A 25 -4.074 1.639 1.216 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -2.192 0.583 2.397 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -1.796 2.226 1.839 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -2.167 1.935 3.554 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.534 -0.017 2.973 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -4.662 1.294 4.169 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.834 1.191 2.834 1.00 0.00 H new ATOM 334 N ILE A 26 -3.207 6.523 3.582 1.00 0.00 N ATOM 335 CA ILE A 26 -3.613 7.894 3.843 1.00 0.00 C ATOM 336 C ILE A 26 -3.500 8.708 2.553 1.00 0.00 C ATOM 337 O ILE A 26 -2.791 8.317 1.627 1.00 0.00 O ATOM 338 CB ILE A 26 -2.814 8.476 5.010 1.00 0.00 C ATOM 339 CG1 ILE A 26 -3.394 9.820 5.455 1.00 0.00 C ATOM 340 CG2 ILE A 26 -1.328 8.581 4.660 1.00 0.00 C ATOM 341 CD1 ILE A 26 -3.246 10.008 6.967 1.00 0.00 C ATOM 0 H ILE A 26 -2.275 6.423 3.179 1.00 0.00 H new ATOM 0 HA ILE A 26 -4.657 7.930 4.153 1.00 0.00 H new ATOM 0 HB ILE A 26 -2.898 7.793 5.855 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -2.885 10.630 4.933 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -4.447 9.875 5.180 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -0.783 8.998 5.507 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.938 7.590 4.430 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -1.203 9.230 3.793 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -3.666 10.971 7.257 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -3.776 9.210 7.487 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -2.190 9.977 7.236 1.00 0.00 H new ATOM 353 N ASP A 27 -4.209 9.827 2.533 1.00 0.00 N ATOM 354 CA ASP A 27 -4.198 10.700 1.372 1.00 0.00 C ATOM 355 C ASP A 27 -2.916 11.536 1.381 1.00 0.00 C ATOM 356 O ASP A 27 -2.301 11.725 2.429 1.00 0.00 O ATOM 357 CB ASP A 27 -5.389 11.660 1.392 1.00 0.00 C ATOM 358 CG ASP A 27 -6.217 11.691 0.106 1.00 0.00 C ATOM 359 OD1 ASP A 27 -6.896 10.676 -0.156 1.00 0.00 O ATOM 360 OD2 ASP A 27 -6.151 12.730 -0.586 1.00 0.00 O ATOM 0 H ASP A 27 -4.795 10.149 3.303 1.00 0.00 H new ATOM 0 HA ASP A 27 -4.254 10.076 0.480 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -6.043 11.387 2.220 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -5.022 12.666 1.594 1.00 0.00 H new ATOM 365 N GLY A 28 -2.552 12.015 0.201 1.00 0.00 N ATOM 366 CA GLY A 28 -1.355 12.827 0.060 1.00 0.00 C ATOM 367 C GLY A 28 -1.644 14.293 0.390 1.00 0.00 C ATOM 368 O GLY A 28 -0.934 15.187 -0.067 1.00 0.00 O ATOM 0 H GLY A 28 -3.065 11.857 -0.666 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -0.575 12.449 0.721 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -0.976 12.748 -0.959 1.00 0.00 H new ATOM 372 N MET A 29 -2.688 14.493 1.181 1.00 0.00 N ATOM 373 CA MET A 29 -3.080 15.835 1.578 1.00 0.00 C ATOM 374 C MET A 29 -2.443 16.219 2.914 1.00 0.00 C ATOM 375 O MET A 29 -1.813 17.270 3.027 1.00 0.00 O ATOM 376 CB MET A 29 -4.603 15.907 1.698 1.00 0.00 C ATOM 377 CG MET A 29 -5.268 15.794 0.325 1.00 0.00 C ATOM 378 SD MET A 29 -5.915 17.382 -0.172 1.00 0.00 S ATOM 379 CE MET A 29 -4.828 17.746 -1.540 1.00 0.00 C ATOM 0 H MET A 29 -3.274 13.748 1.558 1.00 0.00 H new ATOM 0 HA MET A 29 -2.733 16.535 0.818 1.00 0.00 H new ATOM 0 HB2 MET A 29 -4.958 15.105 2.345 1.00 0.00 H new ATOM 0 HB3 MET A 29 -4.890 16.847 2.169 1.00 0.00 H new ATOM 0 HG2 MET A 29 -4.545 15.440 -0.410 1.00 0.00 H new ATOM 0 HG3 MET A 29 -6.072 15.059 0.361 1.00 0.00 H new ATOM 0 HE1 MET A 29 -5.095 18.711 -1.970 1.00 0.00 H new ATOM 0 HE2 MET A 29 -3.797 17.779 -1.187 1.00 0.00 H new ATOM 0 HE3 MET A 29 -4.927 16.970 -2.300 1.00 0.00 H new ATOM 389 N HIS A 30 -2.628 15.347 3.894 1.00 0.00 N ATOM 390 CA HIS A 30 -2.079 15.582 5.219 1.00 0.00 C ATOM 391 C HIS A 30 -0.562 15.386 5.188 1.00 0.00 C ATOM 392 O HIS A 30 0.168 16.044 5.929 1.00 0.00 O ATOM 393 CB HIS A 30 -2.770 14.697 6.258 1.00 0.00 C ATOM 394 CG HIS A 30 -2.082 13.373 6.492 1.00 0.00 C ATOM 395 ND1 HIS A 30 -1.778 12.899 7.757 1.00 0.00 N ATOM 396 CD2 HIS A 30 -1.644 12.428 5.611 1.00 0.00 C ATOM 397 CE1 HIS A 30 -1.183 11.722 7.630 1.00 0.00 C ATOM 398 NE2 HIS A 30 -1.100 11.432 6.300 1.00 0.00 N ATOM 0 H HIS A 30 -3.150 14.476 3.797 1.00 0.00 H new ATOM 0 HA HIS A 30 -2.271 16.612 5.519 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -2.825 15.238 7.203 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -3.795 14.511 5.937 1.00 0.00 H new ATOM 0 HD1 HIS A 30 -1.978 13.375 8.637 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -1.726 12.481 4.535 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -0.826 11.101 8.438 1.00 0.00 H new ATOM 406 N THR A 31 -0.132 14.479 4.324 1.00 0.00 N ATOM 407 CA THR A 31 1.285 14.188 4.187 1.00 0.00 C ATOM 408 C THR A 31 1.968 15.255 3.328 1.00 0.00 C ATOM 409 O THR A 31 1.350 15.822 2.429 1.00 0.00 O ATOM 410 CB THR A 31 1.425 12.773 3.622 1.00 0.00 C ATOM 411 OG1 THR A 31 0.444 12.713 2.590 1.00 0.00 O ATOM 412 CG2 THR A 31 0.985 11.699 4.618 1.00 0.00 C ATOM 0 H THR A 31 -0.740 13.936 3.711 1.00 0.00 H new ATOM 0 HA THR A 31 1.790 14.220 5.152 1.00 0.00 H new ATOM 0 HB THR A 31 2.462 12.598 3.334 1.00 0.00 H new ATOM 0 HG1 THR A 31 -0.349 12.241 2.920 1.00 0.00 H new ATOM 0 HG21 THR A 31 1.104 10.714 4.167 1.00 0.00 H new ATOM 0 HG22 THR A 31 1.598 11.763 5.517 1.00 0.00 H new ATOM 0 HG23 THR A 31 -0.062 11.853 4.881 1.00 0.00 H new ATOM 420 N HIS A 32 3.233 15.496 3.637 1.00 0.00 N ATOM 421 CA HIS A 32 4.007 16.485 2.905 1.00 0.00 C ATOM 422 C HIS A 32 3.688 16.384 1.413 1.00 0.00 C ATOM 423 O HIS A 32 3.761 17.377 0.690 1.00 0.00 O ATOM 424 CB HIS A 32 5.500 16.337 3.204 1.00 0.00 C ATOM 425 CG HIS A 32 6.037 17.363 4.173 1.00 0.00 C ATOM 426 ND1 HIS A 32 6.861 17.032 5.235 1.00 0.00 N ATOM 427 CD2 HIS A 32 5.861 18.714 4.229 1.00 0.00 C ATOM 428 CE1 HIS A 32 7.160 18.142 5.894 1.00 0.00 C ATOM 429 NE2 HIS A 32 6.539 19.183 5.269 1.00 0.00 N ATOM 0 H HIS A 32 3.742 15.024 4.384 1.00 0.00 H new ATOM 0 HA HIS A 32 3.728 17.486 3.234 1.00 0.00 H new ATOM 0 HB2 HIS A 32 5.682 15.341 3.607 1.00 0.00 H new ATOM 0 HB3 HIS A 32 6.056 16.409 2.269 1.00 0.00 H new ATOM 0 HD2 HIS A 32 5.270 19.303 3.543 1.00 0.00 H new ATOM 0 HE1 HIS A 32 7.786 18.210 6.772 1.00 0.00 H new ATOM 0 HE2 HIS A 32 6.588 20.161 5.554 1.00 0.00 H new ATOM 437 N LEU A 33 3.341 15.176 0.995 1.00 0.00 N ATOM 438 CA LEU A 33 3.010 14.932 -0.399 1.00 0.00 C ATOM 439 C LEU A 33 2.221 16.122 -0.947 1.00 0.00 C ATOM 440 O LEU A 33 2.365 16.482 -2.115 1.00 0.00 O ATOM 441 CB LEU A 33 2.288 13.592 -0.552 1.00 0.00 C ATOM 442 CG LEU A 33 2.611 12.796 -1.818 1.00 0.00 C ATOM 443 CD1 LEU A 33 3.989 12.140 -1.717 1.00 0.00 C ATOM 444 CD2 LEU A 33 1.511 11.777 -2.121 1.00 0.00 C ATOM 0 H LEU A 33 3.282 14.355 1.597 1.00 0.00 H new ATOM 0 HA LEU A 33 3.918 14.848 -0.997 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.526 12.973 0.313 1.00 0.00 H new ATOM 0 HB3 LEU A 33 1.214 13.776 -0.527 1.00 0.00 H new ATOM 0 HG LEU A 33 2.646 13.490 -2.658 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.193 11.581 -2.630 1.00 0.00 H new ATOM 0 HD12 LEU A 33 4.750 12.910 -1.585 1.00 0.00 H new ATOM 0 HD13 LEU A 33 4.007 11.462 -0.864 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.766 11.225 -3.026 1.00 0.00 H new ATOM 0 HD22 LEU A 33 1.418 11.082 -1.286 1.00 0.00 H new ATOM 0 HD23 LEU A 33 0.564 12.297 -2.267 1.00 0.00 H new ATOM 456 N GLY A 34 1.404 16.700 -0.079 1.00 0.00 N ATOM 457 CA GLY A 34 0.592 17.843 -0.461 1.00 0.00 C ATOM 458 C GLY A 34 -0.078 17.609 -1.817 1.00 0.00 C ATOM 459 O GLY A 34 -0.423 18.562 -2.515 1.00 0.00 O ATOM 0 H GLY A 34 1.287 16.398 0.888 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -0.169 18.024 0.298 1.00 0.00 H new ATOM 0 HA3 GLY A 34 1.214 18.737 -0.508 1.00 0.00 H new ATOM 463 N ALA A 35 -0.243 16.337 -2.149 1.00 0.00 N ATOM 464 CA ALA A 35 -0.866 15.967 -3.408 1.00 0.00 C ATOM 465 C ALA A 35 -2.013 14.991 -3.138 1.00 0.00 C ATOM 466 O ALA A 35 -1.986 14.254 -2.153 1.00 0.00 O ATOM 467 CB ALA A 35 0.190 15.379 -4.347 1.00 0.00 C ATOM 0 H ALA A 35 0.044 15.550 -1.568 1.00 0.00 H new ATOM 0 HA ALA A 35 -1.288 16.844 -3.899 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -0.277 15.101 -5.292 1.00 0.00 H new ATOM 0 HB2 ALA A 35 0.967 16.121 -4.531 1.00 0.00 H new ATOM 0 HB3 ALA A 35 0.633 14.495 -3.888 1.00 0.00 H new ATOM 473 N PRO A 36 -3.018 15.018 -4.053 1.00 0.00 N ATOM 474 CA PRO A 36 -4.173 14.145 -3.922 1.00 0.00 C ATOM 475 C PRO A 36 -3.818 12.707 -4.304 1.00 0.00 C ATOM 476 O PRO A 36 -3.159 12.474 -5.317 1.00 0.00 O ATOM 477 CB PRO A 36 -5.231 14.756 -4.826 1.00 0.00 C ATOM 478 CG PRO A 36 -4.486 15.675 -5.780 1.00 0.00 C ATOM 479 CD PRO A 36 -3.083 15.878 -5.231 1.00 0.00 C ATOM 0 HA PRO A 36 -4.536 14.076 -2.896 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -5.772 13.983 -5.372 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -5.968 15.311 -4.245 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -4.446 15.238 -6.778 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -5.002 16.631 -5.871 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -2.327 15.601 -5.965 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -2.907 16.922 -4.970 1.00 0.00 H new ATOM 487 N GLY A 37 -4.270 11.779 -3.473 1.00 0.00 N ATOM 488 CA GLY A 37 -4.009 10.370 -3.711 1.00 0.00 C ATOM 489 C GLY A 37 -3.705 9.640 -2.401 1.00 0.00 C ATOM 490 O GLY A 37 -3.264 10.256 -1.431 1.00 0.00 O ATOM 0 H GLY A 37 -4.815 11.976 -2.634 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -4.873 9.913 -4.194 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -3.167 10.263 -4.395 1.00 0.00 H new ATOM 494 N LEU A 38 -3.951 8.339 -2.415 1.00 0.00 N ATOM 495 CA LEU A 38 -3.709 7.518 -1.240 1.00 0.00 C ATOM 496 C LEU A 38 -2.310 6.906 -1.331 1.00 0.00 C ATOM 497 O LEU A 38 -1.768 6.746 -2.423 1.00 0.00 O ATOM 498 CB LEU A 38 -4.824 6.484 -1.070 1.00 0.00 C ATOM 499 CG LEU A 38 -6.239 7.043 -0.914 1.00 0.00 C ATOM 500 CD1 LEU A 38 -7.077 6.771 -2.165 1.00 0.00 C ATOM 501 CD2 LEU A 38 -6.907 6.501 0.352 1.00 0.00 C ATOM 0 H LEU A 38 -4.316 7.832 -3.222 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.732 8.128 -0.337 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.811 5.819 -1.934 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -4.597 5.875 -0.195 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.168 8.125 -0.803 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -8.079 7.179 -2.028 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.608 7.244 -3.027 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -7.143 5.696 -2.332 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -7.912 6.914 0.439 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -6.965 5.414 0.296 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -6.320 6.788 1.224 1.00 0.00 H new ATOM 513 N TYR A 39 -1.765 6.580 -0.168 1.00 0.00 N ATOM 514 CA TYR A 39 -0.440 5.988 -0.102 1.00 0.00 C ATOM 515 C TYR A 39 -0.235 5.247 1.221 1.00 0.00 C ATOM 516 O TYR A 39 -0.781 5.643 2.249 1.00 0.00 O ATOM 517 CB TYR A 39 0.547 7.155 -0.178 1.00 0.00 C ATOM 518 CG TYR A 39 0.347 8.061 -1.394 1.00 0.00 C ATOM 519 CD1 TYR A 39 -0.521 9.132 -1.322 1.00 0.00 C ATOM 520 CD2 TYR A 39 1.034 7.808 -2.564 1.00 0.00 C ATOM 521 CE1 TYR A 39 -0.709 9.985 -2.466 1.00 0.00 C ATOM 522 CE2 TYR A 39 0.846 8.661 -3.708 1.00 0.00 C ATOM 523 CZ TYR A 39 -0.016 9.707 -3.603 1.00 0.00 C ATOM 524 OH TYR A 39 -0.194 10.513 -4.684 1.00 0.00 O ATOM 0 H TYR A 39 -2.217 6.715 0.736 1.00 0.00 H new ATOM 0 HA TYR A 39 -0.300 5.269 -0.909 1.00 0.00 H new ATOM 0 HB2 TYR A 39 0.455 7.754 0.728 1.00 0.00 H new ATOM 0 HB3 TYR A 39 1.562 6.758 -0.196 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -1.059 9.330 -0.407 1.00 0.00 H new ATOM 0 HD2 TYR A 39 1.713 6.970 -2.621 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -1.385 10.826 -2.423 1.00 0.00 H new ATOM 0 HE2 TYR A 39 1.378 8.474 -4.629 1.00 0.00 H new ATOM 0 HH TYR A 39 0.365 10.196 -5.424 1.00 0.00 H new ATOM 534 N ILE A 40 0.554 4.185 1.151 1.00 0.00 N ATOM 535 CA ILE A 40 0.837 3.385 2.331 1.00 0.00 C ATOM 536 C ILE A 40 1.608 4.234 3.344 1.00 0.00 C ATOM 537 O ILE A 40 2.724 4.672 3.070 1.00 0.00 O ATOM 538 CB ILE A 40 1.555 2.091 1.941 1.00 0.00 C ATOM 539 CG1 ILE A 40 0.682 1.237 1.019 1.00 0.00 C ATOM 540 CG2 ILE A 40 2.005 1.318 3.182 1.00 0.00 C ATOM 541 CD1 ILE A 40 1.271 -0.165 0.849 1.00 0.00 C ATOM 0 H ILE A 40 1.006 3.860 0.296 1.00 0.00 H new ATOM 0 HA ILE A 40 -0.090 3.076 2.813 1.00 0.00 H new ATOM 0 HB ILE A 40 2.453 2.354 1.382 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -0.325 1.165 1.430 1.00 0.00 H new ATOM 0 HG13 ILE A 40 0.595 1.719 0.045 1.00 0.00 H new ATOM 0 HG21 ILE A 40 2.512 0.403 2.877 1.00 0.00 H new ATOM 0 HG22 ILE A 40 2.688 1.934 3.766 1.00 0.00 H new ATOM 0 HG23 ILE A 40 1.135 1.066 3.789 1.00 0.00 H new ATOM 0 HD11 ILE A 40 0.631 -0.751 0.189 1.00 0.00 H new ATOM 0 HD12 ILE A 40 2.268 -0.091 0.415 1.00 0.00 H new ATOM 0 HD13 ILE A 40 1.334 -0.654 1.821 1.00 0.00 H new ATOM 553 N GLN A 41 0.982 4.440 4.493 1.00 0.00 N ATOM 554 CA GLN A 41 1.595 5.229 5.548 1.00 0.00 C ATOM 555 C GLN A 41 2.171 4.312 6.630 1.00 0.00 C ATOM 556 O GLN A 41 3.210 4.613 7.215 1.00 0.00 O ATOM 557 CB GLN A 41 0.593 6.219 6.145 1.00 0.00 C ATOM 558 CG GLN A 41 1.202 6.965 7.334 1.00 0.00 C ATOM 559 CD GLN A 41 1.289 8.466 7.053 1.00 0.00 C ATOM 560 OE1 GLN A 41 1.447 8.905 5.925 1.00 0.00 O ATOM 561 NE2 GLN A 41 1.178 9.228 8.138 1.00 0.00 N ATOM 0 H GLN A 41 0.056 4.074 4.717 1.00 0.00 H new ATOM 0 HA GLN A 41 2.412 5.806 5.115 1.00 0.00 H new ATOM 0 HB2 GLN A 41 0.284 6.934 5.382 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -0.303 5.687 6.465 1.00 0.00 H new ATOM 0 HG2 GLN A 41 0.597 6.793 8.224 1.00 0.00 H new ATOM 0 HG3 GLN A 41 2.197 6.572 7.543 1.00 0.00 H new ATOM 0 HE21 GLN A 41 1.047 8.797 9.053 1.00 0.00 H new ATOM 0 HE22 GLN A 41 1.224 10.244 8.055 1.00 0.00 H new ATOM 570 N THR A 42 1.470 3.212 6.862 1.00 0.00 N ATOM 571 CA THR A 42 1.898 2.249 7.863 1.00 0.00 C ATOM 572 C THR A 42 1.554 0.827 7.417 1.00 0.00 C ATOM 573 O THR A 42 0.694 0.633 6.559 1.00 0.00 O ATOM 574 CB THR A 42 1.260 2.639 9.198 1.00 0.00 C ATOM 575 OG1 THR A 42 0.007 3.209 8.830 1.00 0.00 O ATOM 576 CG2 THR A 42 2.001 3.784 9.890 1.00 0.00 C ATOM 0 H THR A 42 0.609 2.966 6.374 1.00 0.00 H new ATOM 0 HA THR A 42 2.981 2.263 7.988 1.00 0.00 H new ATOM 0 HB THR A 42 1.239 1.771 9.857 1.00 0.00 H new ATOM 0 HG1 THR A 42 -0.475 3.488 9.636 1.00 0.00 H new ATOM 0 HG21 THR A 42 1.507 4.020 10.832 1.00 0.00 H new ATOM 0 HG22 THR A 42 3.031 3.485 10.086 1.00 0.00 H new ATOM 0 HG23 THR A 42 1.994 4.663 9.246 1.00 0.00 H new ATOM 584 N LEU A 43 2.244 -0.131 8.019 1.00 0.00 N ATOM 585 CA LEU A 43 2.022 -1.530 7.694 1.00 0.00 C ATOM 586 C LEU A 43 2.209 -2.378 8.954 1.00 0.00 C ATOM 587 O LEU A 43 3.302 -2.426 9.516 1.00 0.00 O ATOM 588 CB LEU A 43 2.914 -1.957 6.527 1.00 0.00 C ATOM 589 CG LEU A 43 2.397 -1.617 5.127 1.00 0.00 C ATOM 590 CD1 LEU A 43 3.555 -1.421 4.147 1.00 0.00 C ATOM 591 CD2 LEU A 43 1.404 -2.674 4.638 1.00 0.00 C ATOM 0 H LEU A 43 2.957 0.034 8.730 1.00 0.00 H new ATOM 0 HA LEU A 43 0.998 -1.684 7.355 1.00 0.00 H new ATOM 0 HB2 LEU A 43 3.892 -1.492 6.654 1.00 0.00 H new ATOM 0 HB3 LEU A 43 3.063 -3.035 6.585 1.00 0.00 H new ATOM 0 HG LEU A 43 1.859 -0.671 5.182 1.00 0.00 H new ATOM 0 HD11 LEU A 43 3.160 -1.180 3.160 1.00 0.00 H new ATOM 0 HD12 LEU A 43 4.190 -0.605 4.492 1.00 0.00 H new ATOM 0 HD13 LEU A 43 4.142 -2.338 4.089 1.00 0.00 H new ATOM 0 HD21 LEU A 43 1.052 -2.409 3.641 1.00 0.00 H new ATOM 0 HD22 LEU A 43 1.896 -3.646 4.602 1.00 0.00 H new ATOM 0 HD23 LEU A 43 0.556 -2.721 5.322 1.00 0.00 H new ATOM 603 N LEU A 44 1.127 -3.024 9.360 1.00 0.00 N ATOM 604 CA LEU A 44 1.158 -3.868 10.543 1.00 0.00 C ATOM 605 C LEU A 44 2.088 -5.056 10.292 1.00 0.00 C ATOM 606 O LEU A 44 2.257 -5.487 9.152 1.00 0.00 O ATOM 607 CB LEU A 44 -0.260 -4.272 10.951 1.00 0.00 C ATOM 608 CG LEU A 44 -0.688 -3.879 12.367 1.00 0.00 C ATOM 609 CD1 LEU A 44 -1.952 -3.018 12.338 1.00 0.00 C ATOM 610 CD2 LEU A 44 -0.856 -5.116 13.251 1.00 0.00 C ATOM 0 H LEU A 44 0.222 -2.980 8.891 1.00 0.00 H new ATOM 0 HA LEU A 44 1.564 -3.319 11.392 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -0.961 -3.827 10.244 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.351 -5.354 10.852 1.00 0.00 H new ATOM 0 HG LEU A 44 0.103 -3.273 12.808 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -2.235 -2.752 13.357 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.761 -2.110 11.766 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -2.762 -3.577 11.871 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -1.160 -4.809 14.252 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -1.618 -5.768 12.824 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.091 -5.653 13.308 1.00 0.00 H new ATOM 622 N PRO A 45 2.683 -5.566 11.404 1.00 0.00 N ATOM 623 CA PRO A 45 3.591 -6.696 11.315 1.00 0.00 C ATOM 624 C PRO A 45 2.824 -8.000 11.086 1.00 0.00 C ATOM 625 O PRO A 45 3.115 -8.739 10.147 1.00 0.00 O ATOM 626 CB PRO A 45 4.364 -6.684 12.624 1.00 0.00 C ATOM 627 CG PRO A 45 3.543 -5.837 13.584 1.00 0.00 C ATOM 628 CD PRO A 45 2.507 -5.081 12.769 1.00 0.00 C ATOM 0 HA PRO A 45 4.270 -6.623 10.466 1.00 0.00 H new ATOM 0 HB2 PRO A 45 4.495 -7.695 13.009 1.00 0.00 H new ATOM 0 HB3 PRO A 45 5.360 -6.264 12.486 1.00 0.00 H new ATOM 0 HG2 PRO A 45 3.057 -6.467 14.329 1.00 0.00 H new ATOM 0 HG3 PRO A 45 4.185 -5.142 14.124 1.00 0.00 H new ATOM 0 HD2 PRO A 45 1.498 -5.277 13.132 1.00 0.00 H new ATOM 0 HD3 PRO A 45 2.664 -4.004 12.830 1.00 0.00 H new ATOM 636 N GLY A 46 1.858 -8.242 11.961 1.00 0.00 N ATOM 637 CA GLY A 46 1.047 -9.444 11.866 1.00 0.00 C ATOM 638 C GLY A 46 -0.124 -9.240 10.902 1.00 0.00 C ATOM 639 O GLY A 46 -1.274 -9.497 11.254 1.00 0.00 O ATOM 0 H GLY A 46 1.619 -7.626 12.738 1.00 0.00 H new ATOM 0 HA2 GLY A 46 1.663 -10.276 11.525 1.00 0.00 H new ATOM 0 HA3 GLY A 46 0.668 -9.711 12.853 1.00 0.00 H new ATOM 643 N SER A 47 0.210 -8.779 9.706 1.00 0.00 N ATOM 644 CA SER A 47 -0.800 -8.538 8.689 1.00 0.00 C ATOM 645 C SER A 47 -0.386 -9.201 7.373 1.00 0.00 C ATOM 646 O SER A 47 0.736 -9.688 7.245 1.00 0.00 O ATOM 647 CB SER A 47 -1.024 -7.039 8.480 1.00 0.00 C ATOM 648 OG SER A 47 -0.337 -6.551 7.331 1.00 0.00 O ATOM 0 H SER A 47 1.165 -8.566 9.418 1.00 0.00 H new ATOM 0 HA SER A 47 -1.739 -8.975 9.029 1.00 0.00 H new ATOM 0 HB2 SER A 47 -2.091 -6.843 8.374 1.00 0.00 H new ATOM 0 HB3 SER A 47 -0.686 -6.496 9.362 1.00 0.00 H new ATOM 0 HG SER A 47 -0.953 -6.025 6.780 1.00 0.00 H new ATOM 654 N PRO A 48 -1.340 -9.199 6.404 1.00 0.00 N ATOM 655 CA PRO A 48 -1.086 -9.794 5.103 1.00 0.00 C ATOM 656 C PRO A 48 -0.176 -8.899 4.259 1.00 0.00 C ATOM 657 O PRO A 48 0.836 -9.357 3.732 1.00 0.00 O ATOM 658 CB PRO A 48 -2.461 -9.993 4.486 1.00 0.00 C ATOM 659 CG PRO A 48 -3.401 -9.082 5.260 1.00 0.00 C ATOM 660 CD PRO A 48 -2.680 -8.631 6.520 1.00 0.00 C ATOM 0 HA PRO A 48 -0.554 -10.743 5.171 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -2.454 -9.738 3.426 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -2.776 -11.034 4.561 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -3.684 -8.222 4.654 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -4.320 -9.609 5.514 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -2.645 -7.544 6.588 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -3.186 -8.990 7.416 1.00 0.00 H new ATOM 668 N ALA A 49 -0.570 -7.638 4.156 1.00 0.00 N ATOM 669 CA ALA A 49 0.197 -6.674 3.385 1.00 0.00 C ATOM 670 C ALA A 49 1.683 -6.833 3.712 1.00 0.00 C ATOM 671 O ALA A 49 2.502 -7.032 2.816 1.00 0.00 O ATOM 672 CB ALA A 49 -0.316 -5.263 3.676 1.00 0.00 C ATOM 0 H ALA A 49 -1.411 -7.261 4.594 1.00 0.00 H new ATOM 0 HA ALA A 49 0.073 -6.852 2.317 1.00 0.00 H new ATOM 0 HB1 ALA A 49 0.259 -4.540 3.098 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.368 -5.194 3.399 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.206 -5.048 4.739 1.00 0.00 H new ATOM 678 N ALA A 50 1.987 -6.740 4.999 1.00 0.00 N ATOM 679 CA ALA A 50 3.360 -6.871 5.455 1.00 0.00 C ATOM 680 C ALA A 50 3.924 -8.212 4.983 1.00 0.00 C ATOM 681 O ALA A 50 5.054 -8.279 4.501 1.00 0.00 O ATOM 682 CB ALA A 50 3.409 -6.721 6.977 1.00 0.00 C ATOM 0 H ALA A 50 1.305 -6.575 5.740 1.00 0.00 H new ATOM 0 HA ALA A 50 3.982 -6.084 5.030 1.00 0.00 H new ATOM 0 HB1 ALA A 50 4.439 -6.819 7.319 1.00 0.00 H new ATOM 0 HB2 ALA A 50 3.025 -5.740 7.259 1.00 0.00 H new ATOM 0 HB3 ALA A 50 2.798 -7.496 7.439 1.00 0.00 H new ATOM 688 N ALA A 51 3.111 -9.247 5.136 1.00 0.00 N ATOM 689 CA ALA A 51 3.515 -10.582 4.731 1.00 0.00 C ATOM 690 C ALA A 51 4.011 -10.544 3.285 1.00 0.00 C ATOM 691 O ALA A 51 4.904 -11.303 2.910 1.00 0.00 O ATOM 692 CB ALA A 51 2.344 -11.549 4.921 1.00 0.00 C ATOM 0 H ALA A 51 2.174 -9.188 5.535 1.00 0.00 H new ATOM 0 HA ALA A 51 4.337 -10.939 5.351 1.00 0.00 H new ATOM 0 HB1 ALA A 51 2.647 -12.551 4.617 1.00 0.00 H new ATOM 0 HB2 ALA A 51 2.049 -11.562 5.970 1.00 0.00 H new ATOM 0 HB3 ALA A 51 1.501 -11.224 4.311 1.00 0.00 H new ATOM 698 N ASP A 52 3.410 -9.652 2.510 1.00 0.00 N ATOM 699 CA ASP A 52 3.780 -9.505 1.113 1.00 0.00 C ATOM 700 C ASP A 52 5.204 -8.953 1.022 1.00 0.00 C ATOM 701 O ASP A 52 6.017 -9.448 0.242 1.00 0.00 O ATOM 702 CB ASP A 52 2.847 -8.527 0.396 1.00 0.00 C ATOM 703 CG ASP A 52 2.389 -8.970 -0.994 1.00 0.00 C ATOM 704 OD1 ASP A 52 1.698 -10.010 -1.059 1.00 0.00 O ATOM 705 OD2 ASP A 52 2.740 -8.260 -1.961 1.00 0.00 O ATOM 0 H ASP A 52 2.670 -9.024 2.824 1.00 0.00 H new ATOM 0 HA ASP A 52 3.708 -10.485 0.640 1.00 0.00 H new ATOM 0 HB2 ASP A 52 1.966 -8.367 1.018 1.00 0.00 H new ATOM 0 HB3 ASP A 52 3.353 -7.566 0.306 1.00 0.00 H new ATOM 710 N GLY A 53 5.463 -7.936 1.830 1.00 0.00 N ATOM 711 CA GLY A 53 6.775 -7.312 1.851 1.00 0.00 C ATOM 712 C GLY A 53 6.861 -6.183 0.822 1.00 0.00 C ATOM 713 O GLY A 53 7.301 -5.079 1.142 1.00 0.00 O ATOM 0 H GLY A 53 4.786 -7.528 2.475 1.00 0.00 H new ATOM 0 HA2 GLY A 53 6.978 -6.918 2.847 1.00 0.00 H new ATOM 0 HA3 GLY A 53 7.541 -8.059 1.641 1.00 0.00 H new ATOM 717 N ARG A 54 6.435 -6.498 -0.392 1.00 0.00 N ATOM 718 CA ARG A 54 6.458 -5.524 -1.470 1.00 0.00 C ATOM 719 C ARG A 54 5.907 -4.181 -0.984 1.00 0.00 C ATOM 720 O ARG A 54 6.578 -3.156 -1.091 1.00 0.00 O ATOM 721 CB ARG A 54 5.632 -6.004 -2.665 1.00 0.00 C ATOM 722 CG ARG A 54 6.273 -5.571 -3.984 1.00 0.00 C ATOM 723 CD ARG A 54 6.533 -4.063 -3.999 1.00 0.00 C ATOM 724 NE ARG A 54 7.269 -3.688 -5.227 1.00 0.00 N ATOM 725 CZ ARG A 54 8.593 -3.824 -5.380 1.00 0.00 C ATOM 726 NH1 ARG A 54 9.334 -4.328 -4.384 1.00 0.00 N ATOM 727 NH2 ARG A 54 9.176 -3.458 -6.529 1.00 0.00 N ATOM 0 H ARG A 54 6.072 -7.415 -0.653 1.00 0.00 H new ATOM 0 HA ARG A 54 7.494 -5.403 -1.785 1.00 0.00 H new ATOM 0 HB2 ARG A 54 5.545 -7.090 -2.638 1.00 0.00 H new ATOM 0 HB3 ARG A 54 4.621 -5.601 -2.598 1.00 0.00 H new ATOM 0 HG2 ARG A 54 7.211 -6.107 -4.130 1.00 0.00 H new ATOM 0 HG3 ARG A 54 5.620 -5.839 -4.815 1.00 0.00 H new ATOM 0 HD2 ARG A 54 5.588 -3.522 -3.952 1.00 0.00 H new ATOM 0 HD3 ARG A 54 7.108 -3.776 -3.119 1.00 0.00 H new ATOM 0 HE ARG A 54 6.735 -3.302 -6.005 1.00 0.00 H new ATOM 0 HH11 ARG A 54 8.890 -4.608 -3.509 1.00 0.00 H new ATOM 0 HH12 ARG A 54 10.342 -4.432 -4.500 1.00 0.00 H new ATOM 0 HH21 ARG A 54 8.612 -3.076 -7.288 1.00 0.00 H new ATOM 0 HH22 ARG A 54 10.184 -3.562 -6.645 1.00 0.00 H new ATOM 741 N LEU A 55 4.691 -4.232 -0.461 1.00 0.00 N ATOM 742 CA LEU A 55 4.043 -3.033 0.042 1.00 0.00 C ATOM 743 C LEU A 55 5.010 -2.280 0.958 1.00 0.00 C ATOM 744 O LEU A 55 5.399 -2.790 2.008 1.00 0.00 O ATOM 745 CB LEU A 55 2.711 -3.383 0.709 1.00 0.00 C ATOM 746 CG LEU A 55 1.682 -4.089 -0.177 1.00 0.00 C ATOM 747 CD1 LEU A 55 0.808 -5.037 0.646 1.00 0.00 C ATOM 748 CD2 LEU A 55 0.847 -3.076 -0.962 1.00 0.00 C ATOM 0 H LEU A 55 4.138 -5.084 -0.375 1.00 0.00 H new ATOM 0 HA LEU A 55 3.795 -2.362 -0.780 1.00 0.00 H new ATOM 0 HB2 LEU A 55 2.915 -4.018 1.571 1.00 0.00 H new ATOM 0 HB3 LEU A 55 2.265 -2.464 1.088 1.00 0.00 H new ATOM 0 HG LEU A 55 2.219 -4.697 -0.905 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.086 -5.526 -0.008 1.00 0.00 H new ATOM 0 HD12 LEU A 55 1.436 -5.791 1.121 1.00 0.00 H new ATOM 0 HD13 LEU A 55 0.279 -4.471 1.412 1.00 0.00 H new ATOM 0 HD21 LEU A 55 0.124 -3.604 -1.583 1.00 0.00 H new ATOM 0 HD22 LEU A 55 0.320 -2.423 -0.267 1.00 0.00 H new ATOM 0 HD23 LEU A 55 1.502 -2.478 -1.596 1.00 0.00 H new ATOM 760 N SER A 56 5.370 -1.080 0.527 1.00 0.00 N ATOM 761 CA SER A 56 6.285 -0.253 1.296 1.00 0.00 C ATOM 762 C SER A 56 5.622 1.084 1.635 1.00 0.00 C ATOM 763 O SER A 56 4.655 1.484 0.987 1.00 0.00 O ATOM 764 CB SER A 56 7.590 -0.019 0.533 1.00 0.00 C ATOM 765 OG SER A 56 8.218 -1.244 0.162 1.00 0.00 O ATOM 0 H SER A 56 5.045 -0.661 -0.344 1.00 0.00 H new ATOM 0 HA SER A 56 6.525 -0.778 2.221 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.387 0.570 -0.362 1.00 0.00 H new ATOM 0 HB3 SER A 56 8.272 0.565 1.151 1.00 0.00 H new ATOM 0 HG SER A 56 7.572 -1.815 -0.304 1.00 0.00 H new ATOM 771 N LEU A 57 6.168 1.738 2.649 1.00 0.00 N ATOM 772 CA LEU A 57 5.641 3.022 3.082 1.00 0.00 C ATOM 773 C LEU A 57 5.965 4.082 2.028 1.00 0.00 C ATOM 774 O LEU A 57 7.125 4.265 1.662 1.00 0.00 O ATOM 775 CB LEU A 57 6.156 3.368 4.481 1.00 0.00 C ATOM 776 CG LEU A 57 5.784 2.386 5.594 1.00 0.00 C ATOM 777 CD1 LEU A 57 5.775 3.081 6.957 1.00 0.00 C ATOM 778 CD2 LEU A 57 4.452 1.696 5.294 1.00 0.00 C ATOM 0 H LEU A 57 6.970 1.404 3.184 1.00 0.00 H new ATOM 0 HA LEU A 57 4.555 2.979 3.169 1.00 0.00 H new ATOM 0 HB2 LEU A 57 7.243 3.443 4.438 1.00 0.00 H new ATOM 0 HB3 LEU A 57 5.778 4.354 4.752 1.00 0.00 H new ATOM 0 HG LEU A 57 6.547 1.609 5.633 1.00 0.00 H new ATOM 0 HD11 LEU A 57 5.508 2.361 7.731 1.00 0.00 H new ATOM 0 HD12 LEU A 57 6.765 3.487 7.165 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.046 3.891 6.948 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.211 1.004 6.101 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.665 2.445 5.212 1.00 0.00 H new ATOM 0 HD23 LEU A 57 4.530 1.147 4.356 1.00 0.00 H new ATOM 790 N GLY A 58 4.919 4.754 1.570 1.00 0.00 N ATOM 791 CA GLY A 58 5.077 5.791 0.565 1.00 0.00 C ATOM 792 C GLY A 58 4.494 5.347 -0.778 1.00 0.00 C ATOM 793 O GLY A 58 4.427 6.135 -1.720 1.00 0.00 O ATOM 0 H GLY A 58 3.958 4.600 1.877 1.00 0.00 H new ATOM 0 HA2 GLY A 58 4.581 6.703 0.897 1.00 0.00 H new ATOM 0 HA3 GLY A 58 6.134 6.029 0.446 1.00 0.00 H new ATOM 797 N ASP A 59 4.088 4.087 -0.823 1.00 0.00 N ATOM 798 CA ASP A 59 3.514 3.528 -2.035 1.00 0.00 C ATOM 799 C ASP A 59 2.223 4.276 -2.375 1.00 0.00 C ATOM 800 O ASP A 59 1.707 5.034 -1.554 1.00 0.00 O ATOM 801 CB ASP A 59 3.168 2.049 -1.851 1.00 0.00 C ATOM 802 CG ASP A 59 4.278 1.072 -2.243 1.00 0.00 C ATOM 803 OD1 ASP A 59 5.266 1.547 -2.844 1.00 0.00 O ATOM 804 OD2 ASP A 59 4.114 -0.128 -1.933 1.00 0.00 O ATOM 0 H ASP A 59 4.145 3.437 -0.039 1.00 0.00 H new ATOM 0 HA ASP A 59 4.249 3.629 -2.833 1.00 0.00 H new ATOM 0 HB2 ASP A 59 2.908 1.879 -0.806 1.00 0.00 H new ATOM 0 HB3 ASP A 59 2.280 1.823 -2.442 1.00 0.00 H new ATOM 809 N ARG A 60 1.739 4.038 -3.585 1.00 0.00 N ATOM 810 CA ARG A 60 0.519 4.680 -4.042 1.00 0.00 C ATOM 811 C ARG A 60 -0.431 3.645 -4.648 1.00 0.00 C ATOM 812 O ARG A 60 -0.060 2.924 -5.573 1.00 0.00 O ATOM 813 CB ARG A 60 0.821 5.757 -5.086 1.00 0.00 C ATOM 814 CG ARG A 60 -0.457 6.484 -5.510 1.00 0.00 C ATOM 815 CD ARG A 60 -0.302 7.100 -6.902 1.00 0.00 C ATOM 816 NE ARG A 60 -1.531 7.837 -7.269 1.00 0.00 N ATOM 817 CZ ARG A 60 -1.639 8.629 -8.344 1.00 0.00 C ATOM 818 NH1 ARG A 60 -0.592 8.793 -9.164 1.00 0.00 N ATOM 819 NH2 ARG A 60 -2.794 9.259 -8.599 1.00 0.00 N ATOM 0 H ARG A 60 2.170 3.409 -4.263 1.00 0.00 H new ATOM 0 HA ARG A 60 0.048 5.149 -3.178 1.00 0.00 H new ATOM 0 HB2 ARG A 60 1.533 6.474 -4.678 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.291 5.302 -5.958 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -1.294 5.786 -5.509 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -0.692 7.265 -4.787 1.00 0.00 H new ATOM 0 HD2 ARG A 60 0.554 7.774 -6.917 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -0.105 6.318 -7.635 1.00 0.00 H new ATOM 0 HE ARG A 60 -2.347 7.736 -6.666 1.00 0.00 H new ATOM 0 HH11 ARG A 60 0.288 8.315 -8.970 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -0.675 9.396 -9.982 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -3.591 9.136 -7.975 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -2.876 9.862 -9.418 1.00 0.00 H new ATOM 833 N ILE A 61 -1.637 3.604 -4.102 1.00 0.00 N ATOM 834 CA ILE A 61 -2.642 2.668 -4.576 1.00 0.00 C ATOM 835 C ILE A 61 -3.308 3.235 -5.832 1.00 0.00 C ATOM 836 O ILE A 61 -3.462 4.449 -5.963 1.00 0.00 O ATOM 837 CB ILE A 61 -3.629 2.328 -3.457 1.00 0.00 C ATOM 838 CG1 ILE A 61 -2.895 2.057 -2.143 1.00 0.00 C ATOM 839 CG2 ILE A 61 -4.534 1.162 -3.860 1.00 0.00 C ATOM 840 CD1 ILE A 61 -2.316 0.641 -2.120 1.00 0.00 C ATOM 0 H ILE A 61 -1.941 4.204 -3.335 1.00 0.00 H new ATOM 0 HA ILE A 61 -2.179 1.723 -4.859 1.00 0.00 H new ATOM 0 HB ILE A 61 -4.272 3.193 -3.294 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -2.093 2.784 -2.014 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -3.581 2.187 -1.306 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -5.226 0.941 -3.047 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -5.098 1.431 -4.753 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -3.924 0.283 -4.067 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -1.799 0.474 -1.175 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.123 -0.084 -2.225 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -1.612 0.522 -2.944 1.00 0.00 H new ATOM 852 N LEU A 62 -3.685 2.331 -6.723 1.00 0.00 N ATOM 853 CA LEU A 62 -4.330 2.726 -7.964 1.00 0.00 C ATOM 854 C LEU A 62 -5.712 2.075 -8.044 1.00 0.00 C ATOM 855 O LEU A 62 -6.689 2.727 -8.410 1.00 0.00 O ATOM 856 CB LEU A 62 -3.431 2.409 -9.160 1.00 0.00 C ATOM 857 CG LEU A 62 -1.977 2.874 -9.049 1.00 0.00 C ATOM 858 CD1 LEU A 62 -1.167 2.437 -10.271 1.00 0.00 C ATOM 859 CD2 LEU A 62 -1.901 4.385 -8.821 1.00 0.00 C ATOM 0 H LEU A 62 -3.556 1.325 -6.611 1.00 0.00 H new ATOM 0 HA LEU A 62 -4.483 3.805 -7.987 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -3.436 1.330 -9.317 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.870 2.862 -10.049 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.530 2.394 -8.178 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.138 2.780 -10.167 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -1.181 1.350 -10.347 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -1.604 2.869 -11.171 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.857 4.690 -8.746 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -2.371 4.903 -9.657 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.421 4.640 -7.898 1.00 0.00 H new ATOM 871 N GLU A 63 -5.751 0.797 -7.696 1.00 0.00 N ATOM 872 CA GLU A 63 -6.997 0.051 -7.724 1.00 0.00 C ATOM 873 C GLU A 63 -7.163 -0.754 -6.433 1.00 0.00 C ATOM 874 O GLU A 63 -6.194 -0.982 -5.711 1.00 0.00 O ATOM 875 CB GLU A 63 -7.063 -0.861 -8.951 1.00 0.00 C ATOM 876 CG GLU A 63 -7.197 -0.041 -10.236 1.00 0.00 C ATOM 877 CD GLU A 63 -7.106 -0.940 -11.471 1.00 0.00 C ATOM 878 OE1 GLU A 63 -7.254 -2.168 -11.291 1.00 0.00 O ATOM 879 OE2 GLU A 63 -6.890 -0.379 -12.567 1.00 0.00 O ATOM 0 H GLU A 63 -4.939 0.259 -7.393 1.00 0.00 H new ATOM 0 HA GLU A 63 -7.821 0.761 -7.795 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -6.165 -1.477 -9.000 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -7.910 -1.540 -8.859 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -8.150 0.488 -10.236 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -6.412 0.715 -10.273 1.00 0.00 H new ATOM 886 N VAL A 64 -8.399 -1.161 -6.182 1.00 0.00 N ATOM 887 CA VAL A 64 -8.705 -1.936 -4.992 1.00 0.00 C ATOM 888 C VAL A 64 -9.756 -2.994 -5.332 1.00 0.00 C ATOM 889 O VAL A 64 -10.911 -2.664 -5.597 1.00 0.00 O ATOM 890 CB VAL A 64 -9.140 -1.004 -3.859 1.00 0.00 C ATOM 891 CG1 VAL A 64 -10.103 -1.713 -2.905 1.00 0.00 C ATOM 892 CG2 VAL A 64 -7.928 -0.453 -3.105 1.00 0.00 C ATOM 0 H VAL A 64 -9.200 -0.968 -6.783 1.00 0.00 H new ATOM 0 HA VAL A 64 -7.817 -2.462 -4.641 1.00 0.00 H new ATOM 0 HB VAL A 64 -9.669 -0.161 -4.304 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -10.397 -1.028 -2.109 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.989 -2.033 -3.454 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -9.611 -2.584 -2.472 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -8.266 0.206 -2.305 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -7.359 -1.279 -2.678 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -7.295 0.107 -3.793 1.00 0.00 H new ATOM 902 N ASN A 65 -9.317 -4.244 -5.315 1.00 0.00 N ATOM 903 CA ASN A 65 -10.206 -5.353 -5.618 1.00 0.00 C ATOM 904 C ASN A 65 -10.672 -5.244 -7.071 1.00 0.00 C ATOM 905 O ASN A 65 -11.624 -5.911 -7.473 1.00 0.00 O ATOM 906 CB ASN A 65 -11.445 -5.328 -4.721 1.00 0.00 C ATOM 907 CG ASN A 65 -11.317 -6.340 -3.581 1.00 0.00 C ATOM 908 OD1 ASN A 65 -10.584 -7.312 -3.658 1.00 0.00 O ATOM 909 ND2 ASN A 65 -12.069 -6.058 -2.521 1.00 0.00 N ATOM 0 H ASN A 65 -8.358 -4.513 -5.096 1.00 0.00 H new ATOM 0 HA ASN A 65 -9.658 -6.280 -5.449 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -11.581 -4.328 -4.310 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -12.332 -5.553 -5.314 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -12.054 -6.672 -1.707 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -12.661 -5.227 -2.522 1.00 0.00 H new ATOM 916 N GLY A 66 -9.980 -4.397 -7.820 1.00 0.00 N ATOM 917 CA GLY A 66 -10.311 -4.192 -9.219 1.00 0.00 C ATOM 918 C GLY A 66 -11.294 -3.031 -9.386 1.00 0.00 C ATOM 919 O GLY A 66 -12.178 -3.080 -10.239 1.00 0.00 O ATOM 0 H GLY A 66 -9.191 -3.845 -7.483 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -9.402 -3.988 -9.785 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -10.745 -5.103 -9.631 1.00 0.00 H new ATOM 923 N SER A 67 -11.105 -2.015 -8.557 1.00 0.00 N ATOM 924 CA SER A 67 -11.963 -0.843 -8.602 1.00 0.00 C ATOM 925 C SER A 67 -11.115 0.421 -8.757 1.00 0.00 C ATOM 926 O SER A 67 -10.359 0.779 -7.856 1.00 0.00 O ATOM 927 CB SER A 67 -12.832 -0.749 -7.347 1.00 0.00 C ATOM 928 OG SER A 67 -14.157 -0.316 -7.645 1.00 0.00 O ATOM 0 H SER A 67 -10.370 -1.979 -7.850 1.00 0.00 H new ATOM 0 HA SER A 67 -12.625 -0.936 -9.463 1.00 0.00 H new ATOM 0 HB2 SER A 67 -12.870 -1.723 -6.859 1.00 0.00 H new ATOM 0 HB3 SER A 67 -12.375 -0.056 -6.641 1.00 0.00 H new ATOM 0 HG SER A 67 -14.680 -0.271 -6.818 1.00 0.00 H new ATOM 934 N SER A 68 -11.271 1.062 -9.906 1.00 0.00 N ATOM 935 CA SER A 68 -10.529 2.279 -10.190 1.00 0.00 C ATOM 936 C SER A 68 -10.565 3.209 -8.976 1.00 0.00 C ATOM 937 O SER A 68 -11.634 3.654 -8.562 1.00 0.00 O ATOM 938 CB SER A 68 -11.091 2.991 -11.422 1.00 0.00 C ATOM 939 OG SER A 68 -12.493 3.224 -11.311 1.00 0.00 O ATOM 0 H SER A 68 -11.900 0.762 -10.651 1.00 0.00 H new ATOM 0 HA SER A 68 -9.494 2.008 -10.401 1.00 0.00 H new ATOM 0 HB2 SER A 68 -10.575 3.942 -11.558 1.00 0.00 H new ATOM 0 HB3 SER A 68 -10.892 2.391 -12.310 1.00 0.00 H new ATOM 0 HG SER A 68 -12.715 3.444 -10.382 1.00 0.00 H new ATOM 945 N LEU A 69 -9.383 3.476 -8.441 1.00 0.00 N ATOM 946 CA LEU A 69 -9.265 4.346 -7.283 1.00 0.00 C ATOM 947 C LEU A 69 -8.533 5.628 -7.685 1.00 0.00 C ATOM 948 O LEU A 69 -7.463 5.927 -7.157 1.00 0.00 O ATOM 949 CB LEU A 69 -8.608 3.602 -6.118 1.00 0.00 C ATOM 950 CG LEU A 69 -8.053 4.476 -4.991 1.00 0.00 C ATOM 951 CD1 LEU A 69 -8.985 5.654 -4.702 1.00 0.00 C ATOM 952 CD2 LEU A 69 -7.775 3.643 -3.738 1.00 0.00 C ATOM 0 H LEU A 69 -8.498 3.105 -8.788 1.00 0.00 H new ATOM 0 HA LEU A 69 -10.252 4.641 -6.927 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -9.340 2.916 -5.692 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.794 2.994 -6.514 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.100 4.892 -5.318 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.568 6.259 -3.897 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -9.089 6.265 -5.599 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -9.964 5.279 -4.403 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -7.381 4.288 -2.952 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.700 3.179 -3.397 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -7.045 2.868 -3.971 1.00 0.00 H new ATOM 964 N LEU A 70 -9.139 6.350 -8.615 1.00 0.00 N ATOM 965 CA LEU A 70 -8.559 7.593 -9.094 1.00 0.00 C ATOM 966 C LEU A 70 -9.280 8.773 -8.440 1.00 0.00 C ATOM 967 O LEU A 70 -8.817 9.307 -7.434 1.00 0.00 O ATOM 968 CB LEU A 70 -8.571 7.636 -10.624 1.00 0.00 C ATOM 969 CG LEU A 70 -7.526 6.767 -11.327 1.00 0.00 C ATOM 970 CD1 LEU A 70 -7.792 6.700 -12.833 1.00 0.00 C ATOM 971 CD2 LEU A 70 -6.109 7.254 -11.017 1.00 0.00 C ATOM 0 H LEU A 70 -10.026 6.098 -9.050 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.510 7.660 -8.805 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -9.559 7.332 -10.969 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -8.428 8.669 -10.940 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.610 5.752 -10.939 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.035 6.076 -13.309 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -8.779 6.272 -13.010 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -7.752 7.704 -13.255 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.386 6.619 -11.529 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -5.995 8.283 -11.359 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.935 7.208 -9.942 1.00 0.00 H new ATOM 983 N GLY A 71 -10.401 9.145 -9.039 1.00 0.00 N ATOM 984 CA GLY A 71 -11.191 10.253 -8.528 1.00 0.00 C ATOM 985 C GLY A 71 -12.171 9.777 -7.453 1.00 0.00 C ATOM 986 O GLY A 71 -13.323 10.207 -7.424 1.00 0.00 O ATOM 0 H GLY A 71 -10.782 8.699 -9.874 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -10.531 11.014 -8.112 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -11.741 10.720 -9.345 1.00 0.00 H new ATOM 990 N LEU A 72 -11.677 8.896 -6.595 1.00 0.00 N ATOM 991 CA LEU A 72 -12.494 8.357 -5.522 1.00 0.00 C ATOM 992 C LEU A 72 -12.100 9.024 -4.202 1.00 0.00 C ATOM 993 O LEU A 72 -10.918 9.092 -3.866 1.00 0.00 O ATOM 994 CB LEU A 72 -12.400 6.830 -5.491 1.00 0.00 C ATOM 995 CG LEU A 72 -13.374 6.080 -6.401 1.00 0.00 C ATOM 996 CD1 LEU A 72 -13.212 4.566 -6.248 1.00 0.00 C ATOM 997 CD2 LEU A 72 -14.815 6.530 -6.151 1.00 0.00 C ATOM 0 H LEU A 72 -10.721 8.542 -6.622 1.00 0.00 H new ATOM 0 HA LEU A 72 -13.546 8.585 -5.694 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -11.385 6.543 -5.764 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -12.561 6.497 -4.466 1.00 0.00 H new ATOM 0 HG LEU A 72 -13.134 6.327 -7.435 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -13.916 4.056 -6.906 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -12.194 4.280 -6.514 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -13.410 4.281 -5.215 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -15.487 5.981 -6.811 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -15.083 6.332 -5.113 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -14.902 7.598 -6.351 1.00 0.00 H new ATOM 1009 N GLY A 73 -13.111 9.500 -3.491 1.00 0.00 N ATOM 1010 CA GLY A 73 -12.885 10.159 -2.216 1.00 0.00 C ATOM 1011 C GLY A 73 -12.323 9.179 -1.184 1.00 0.00 C ATOM 1012 O GLY A 73 -12.605 7.983 -1.240 1.00 0.00 O ATOM 0 H GLY A 73 -14.089 9.442 -3.774 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -12.191 10.989 -2.350 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -13.821 10.581 -1.850 1.00 0.00 H new ATOM 1016 N TYR A 74 -11.538 9.722 -0.265 1.00 0.00 N ATOM 1017 CA TYR A 74 -10.934 8.911 0.778 1.00 0.00 C ATOM 1018 C TYR A 74 -11.992 8.080 1.507 1.00 0.00 C ATOM 1019 O TYR A 74 -11.669 7.075 2.140 1.00 0.00 O ATOM 1020 CB TYR A 74 -10.305 9.895 1.766 1.00 0.00 C ATOM 1021 CG TYR A 74 -9.664 9.228 2.985 1.00 0.00 C ATOM 1022 CD1 TYR A 74 -10.445 8.863 4.063 1.00 0.00 C ATOM 1023 CD2 TYR A 74 -8.304 8.991 3.006 1.00 0.00 C ATOM 1024 CE1 TYR A 74 -9.841 8.236 5.210 1.00 0.00 C ATOM 1025 CE2 TYR A 74 -7.701 8.363 4.153 1.00 0.00 C ATOM 1026 CZ TYR A 74 -8.499 8.017 5.198 1.00 0.00 C ATOM 1027 OH TYR A 74 -7.929 7.424 6.282 1.00 0.00 O ATOM 0 H TYR A 74 -11.306 10.714 -0.221 1.00 0.00 H new ATOM 0 HA TYR A 74 -10.204 8.221 0.354 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -9.548 10.482 1.246 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -11.071 10.592 2.107 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -11.509 9.048 4.046 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -7.693 9.276 2.163 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -10.440 7.946 6.060 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -6.639 8.171 4.183 1.00 0.00 H new ATOM 0 HH TYR A 74 -6.965 7.329 6.134 1.00 0.00 H new ATOM 1037 N LEU A 75 -13.233 8.529 1.394 1.00 0.00 N ATOM 1038 CA LEU A 75 -14.340 7.840 2.035 1.00 0.00 C ATOM 1039 C LEU A 75 -14.848 6.731 1.111 1.00 0.00 C ATOM 1040 O LEU A 75 -15.434 5.753 1.572 1.00 0.00 O ATOM 1041 CB LEU A 75 -15.422 8.837 2.453 1.00 0.00 C ATOM 1042 CG LEU A 75 -15.205 9.539 3.795 1.00 0.00 C ATOM 1043 CD1 LEU A 75 -16.446 10.334 4.205 1.00 0.00 C ATOM 1044 CD2 LEU A 75 -14.781 8.541 4.874 1.00 0.00 C ATOM 0 H LEU A 75 -13.497 9.362 0.868 1.00 0.00 H new ATOM 0 HA LEU A 75 -14.009 7.361 2.956 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -15.506 9.598 1.677 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -16.377 8.312 2.490 1.00 0.00 H new ATOM 0 HG LEU A 75 -14.389 10.253 3.679 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -16.265 10.823 5.162 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -16.662 11.088 3.448 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -17.297 9.659 4.298 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -14.633 9.066 5.818 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -15.557 7.786 4.997 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -13.849 8.059 4.578 1.00 0.00 H new ATOM 1056 N ARG A 76 -14.607 6.922 -0.178 1.00 0.00 N ATOM 1057 CA ARG A 76 -15.033 5.951 -1.171 1.00 0.00 C ATOM 1058 C ARG A 76 -13.994 4.836 -1.303 1.00 0.00 C ATOM 1059 O ARG A 76 -14.348 3.667 -1.451 1.00 0.00 O ATOM 1060 CB ARG A 76 -15.237 6.612 -2.536 1.00 0.00 C ATOM 1061 CG ARG A 76 -16.716 6.924 -2.778 1.00 0.00 C ATOM 1062 CD ARG A 76 -17.311 5.978 -3.823 1.00 0.00 C ATOM 1063 NE ARG A 76 -18.111 6.745 -4.804 1.00 0.00 N ATOM 1064 CZ ARG A 76 -18.984 6.193 -5.657 1.00 0.00 C ATOM 1065 NH1 ARG A 76 -19.174 4.867 -5.657 1.00 0.00 N ATOM 1066 NH2 ARG A 76 -19.666 6.968 -6.512 1.00 0.00 N ATOM 0 H ARG A 76 -14.122 7.735 -0.557 1.00 0.00 H new ATOM 0 HA ARG A 76 -15.982 5.531 -0.838 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -14.654 7.531 -2.590 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -14.867 5.954 -3.322 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -17.269 6.833 -1.843 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -16.824 7.956 -3.113 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -16.513 5.439 -4.334 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -17.938 5.232 -3.335 1.00 0.00 H new ATOM 0 HE ARG A 76 -17.990 7.757 -4.832 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -18.654 4.277 -5.007 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -19.839 4.447 -6.307 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -19.520 7.978 -6.513 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -20.331 6.548 -7.162 1.00 0.00 H new ATOM 1080 N ALA A 77 -12.732 5.236 -1.245 1.00 0.00 N ATOM 1081 CA ALA A 77 -11.639 4.285 -1.356 1.00 0.00 C ATOM 1082 C ALA A 77 -11.577 3.436 -0.085 1.00 0.00 C ATOM 1083 O ALA A 77 -11.415 2.219 -0.155 1.00 0.00 O ATOM 1084 CB ALA A 77 -10.333 5.037 -1.620 1.00 0.00 C ATOM 0 H ALA A 77 -12.442 6.206 -1.123 1.00 0.00 H new ATOM 0 HA ALA A 77 -11.801 3.609 -2.196 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -9.513 4.324 -1.703 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -10.419 5.601 -2.549 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -10.135 5.723 -0.796 1.00 0.00 H new ATOM 1090 N VAL A 78 -11.709 4.112 1.047 1.00 0.00 N ATOM 1091 CA VAL A 78 -11.669 3.435 2.332 1.00 0.00 C ATOM 1092 C VAL A 78 -12.784 2.388 2.387 1.00 0.00 C ATOM 1093 O VAL A 78 -12.547 1.243 2.767 1.00 0.00 O ATOM 1094 CB VAL A 78 -11.754 4.459 3.466 1.00 0.00 C ATOM 1095 CG1 VAL A 78 -13.146 5.089 3.532 1.00 0.00 C ATOM 1096 CG2 VAL A 78 -11.375 3.825 4.806 1.00 0.00 C ATOM 0 H VAL A 78 -11.844 5.122 1.101 1.00 0.00 H new ATOM 0 HA VAL A 78 -10.723 2.909 2.457 1.00 0.00 H new ATOM 0 HB VAL A 78 -11.037 5.252 3.256 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -13.180 5.813 4.346 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -13.363 5.592 2.590 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -13.889 4.311 3.707 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -11.444 4.574 5.595 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -12.057 3.003 5.025 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -10.354 3.446 4.753 1.00 0.00 H new ATOM 1106 N ASP A 79 -13.976 2.819 2.001 1.00 0.00 N ATOM 1107 CA ASP A 79 -15.128 1.934 2.001 1.00 0.00 C ATOM 1108 C ASP A 79 -14.817 0.699 1.153 1.00 0.00 C ATOM 1109 O ASP A 79 -15.102 -0.426 1.560 1.00 0.00 O ATOM 1110 CB ASP A 79 -16.354 2.625 1.400 1.00 0.00 C ATOM 1111 CG ASP A 79 -17.696 2.191 1.993 1.00 0.00 C ATOM 1112 OD1 ASP A 79 -18.173 1.109 1.586 1.00 0.00 O ATOM 1113 OD2 ASP A 79 -18.215 2.951 2.839 1.00 0.00 O ATOM 0 H ASP A 79 -14.169 3.770 1.686 1.00 0.00 H new ATOM 0 HA ASP A 79 -15.341 1.657 3.034 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -16.247 3.702 1.532 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -16.370 2.435 0.327 1.00 0.00 H new ATOM 1118 N LEU A 80 -14.237 0.952 -0.011 1.00 0.00 N ATOM 1119 CA LEU A 80 -13.884 -0.126 -0.920 1.00 0.00 C ATOM 1120 C LEU A 80 -13.114 -1.202 -0.154 1.00 0.00 C ATOM 1121 O LEU A 80 -13.548 -2.351 -0.085 1.00 0.00 O ATOM 1122 CB LEU A 80 -13.132 0.423 -2.134 1.00 0.00 C ATOM 1123 CG LEU A 80 -13.998 0.989 -3.261 1.00 0.00 C ATOM 1124 CD1 LEU A 80 -13.152 1.787 -4.255 1.00 0.00 C ATOM 1125 CD2 LEU A 80 -14.797 -0.120 -3.949 1.00 0.00 C ATOM 0 H LEU A 80 -14.003 1.887 -0.346 1.00 0.00 H new ATOM 0 HA LEU A 80 -14.782 -0.599 -1.317 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -12.456 1.207 -1.793 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -12.513 -0.375 -2.544 1.00 0.00 H new ATOM 0 HG LEU A 80 -14.718 1.680 -2.823 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -13.792 2.178 -5.046 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -12.667 2.615 -3.738 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -12.393 1.137 -4.691 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -15.404 0.310 -4.746 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -14.111 -0.854 -4.371 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -15.446 -0.606 -3.221 1.00 0.00 H new ATOM 1137 N ILE A 81 -11.983 -0.793 0.402 1.00 0.00 N ATOM 1138 CA ILE A 81 -11.148 -1.708 1.161 1.00 0.00 C ATOM 1139 C ILE A 81 -11.912 -2.183 2.399 1.00 0.00 C ATOM 1140 O ILE A 81 -11.973 -3.380 2.674 1.00 0.00 O ATOM 1141 CB ILE A 81 -9.798 -1.062 1.481 1.00 0.00 C ATOM 1142 CG1 ILE A 81 -8.927 -0.961 0.228 1.00 0.00 C ATOM 1143 CG2 ILE A 81 -9.089 -1.807 2.614 1.00 0.00 C ATOM 1144 CD1 ILE A 81 -8.914 0.468 -0.317 1.00 0.00 C ATOM 0 H ILE A 81 -11.625 0.160 0.342 1.00 0.00 H new ATOM 0 HA ILE A 81 -10.919 -2.594 0.569 1.00 0.00 H new ATOM 0 HB ILE A 81 -9.980 -0.045 1.828 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -7.909 -1.274 0.462 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -9.302 -1.642 -0.536 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -8.132 -1.328 2.822 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -9.709 -1.782 3.510 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -8.920 -2.842 2.319 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -8.287 0.512 -1.208 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -9.930 0.769 -0.573 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -8.515 1.143 0.441 1.00 0.00 H new ATOM 1156 N ARG A 82 -12.476 -1.219 3.112 1.00 0.00 N ATOM 1157 CA ARG A 82 -13.233 -1.523 4.314 1.00 0.00 C ATOM 1158 C ARG A 82 -14.236 -2.646 4.040 1.00 0.00 C ATOM 1159 O ARG A 82 -14.239 -3.662 4.732 1.00 0.00 O ATOM 1160 CB ARG A 82 -13.985 -0.289 4.818 1.00 0.00 C ATOM 1161 CG ARG A 82 -15.317 -0.683 5.460 1.00 0.00 C ATOM 1162 CD ARG A 82 -15.977 0.520 6.135 1.00 0.00 C ATOM 1163 NE ARG A 82 -16.610 0.103 7.406 1.00 0.00 N ATOM 1164 CZ ARG A 82 -16.946 0.948 8.391 1.00 0.00 C ATOM 1165 NH1 ARG A 82 -16.711 2.260 8.257 1.00 0.00 N ATOM 1166 NH2 ARG A 82 -17.517 0.480 9.510 1.00 0.00 N ATOM 0 H ARG A 82 -12.424 -0.227 2.880 1.00 0.00 H new ATOM 0 HA ARG A 82 -12.526 -1.842 5.080 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -13.371 0.244 5.544 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -14.165 0.395 3.989 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -15.985 -1.090 4.700 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -15.152 -1.471 6.194 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -15.233 1.293 6.326 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -16.725 0.954 5.472 1.00 0.00 H new ATOM 0 HE ARG A 82 -16.803 -0.889 7.541 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -16.276 2.616 7.406 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -16.967 2.903 9.006 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -17.696 -0.519 9.612 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -17.773 1.123 10.259 1.00 0.00 H new ATOM 1180 N HIS A 83 -15.062 -2.424 3.028 1.00 0.00 N ATOM 1181 CA HIS A 83 -16.067 -3.404 2.653 1.00 0.00 C ATOM 1182 C HIS A 83 -15.491 -4.353 1.601 1.00 0.00 C ATOM 1183 O HIS A 83 -16.204 -4.796 0.702 1.00 0.00 O ATOM 1184 CB HIS A 83 -17.352 -2.715 2.191 1.00 0.00 C ATOM 1185 CG HIS A 83 -18.246 -2.261 3.320 1.00 0.00 C ATOM 1186 ND1 HIS A 83 -18.965 -1.079 3.277 1.00 0.00 N ATOM 1187 CD2 HIS A 83 -18.530 -2.842 4.521 1.00 0.00 C ATOM 1188 CE1 HIS A 83 -19.647 -0.964 4.407 1.00 0.00 C ATOM 1189 NE2 HIS A 83 -19.375 -2.057 5.177 1.00 0.00 N ATOM 0 H HIS A 83 -15.056 -1.579 2.456 1.00 0.00 H new ATOM 0 HA HIS A 83 -16.338 -4.003 3.522 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -17.089 -1.852 1.580 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -17.910 -3.400 1.552 1.00 0.00 H new ATOM 0 HD1 HIS A 83 -18.969 -0.410 2.507 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -18.134 -3.782 4.877 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -20.303 -0.148 4.672 1.00 0.00 H new ATOM 1197 N GLY A 84 -14.205 -4.638 1.747 1.00 0.00 N ATOM 1198 CA GLY A 84 -13.525 -5.526 0.820 1.00 0.00 C ATOM 1199 C GLY A 84 -14.108 -6.939 0.887 1.00 0.00 C ATOM 1200 O GLY A 84 -15.316 -7.109 1.043 1.00 0.00 O ATOM 0 H GLY A 84 -13.616 -4.269 2.494 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -13.617 -5.138 -0.195 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -12.461 -5.556 1.054 1.00 0.00 H new ATOM 1204 N GLY A 85 -13.223 -7.917 0.764 1.00 0.00 N ATOM 1205 CA GLY A 85 -13.634 -9.310 0.808 1.00 0.00 C ATOM 1206 C GLY A 85 -12.465 -10.215 1.201 1.00 0.00 C ATOM 1207 O GLY A 85 -11.351 -9.740 1.411 1.00 0.00 O ATOM 0 H GLY A 85 -12.222 -7.772 0.634 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -14.448 -9.430 1.523 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -14.019 -9.610 -0.167 1.00 0.00 H new ATOM 1211 N LYS A 86 -12.760 -11.504 1.288 1.00 0.00 N ATOM 1212 CA LYS A 86 -11.747 -12.480 1.651 1.00 0.00 C ATOM 1213 C LYS A 86 -10.480 -12.224 0.832 1.00 0.00 C ATOM 1214 O LYS A 86 -9.369 -12.360 1.342 1.00 0.00 O ATOM 1215 CB LYS A 86 -12.296 -13.901 1.506 1.00 0.00 C ATOM 1216 CG LYS A 86 -11.209 -14.940 1.791 1.00 0.00 C ATOM 1217 CD LYS A 86 -11.136 -15.262 3.284 1.00 0.00 C ATOM 1218 CE LYS A 86 -11.131 -16.774 3.520 1.00 0.00 C ATOM 1219 NZ LYS A 86 -11.925 -17.115 4.721 1.00 0.00 N ATOM 0 H LYS A 86 -13.686 -11.895 1.113 1.00 0.00 H new ATOM 0 HA LYS A 86 -11.475 -12.373 2.701 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -13.130 -14.044 2.193 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -12.685 -14.043 0.498 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -11.415 -15.851 1.229 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -10.244 -14.565 1.449 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -10.235 -14.821 3.711 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -11.986 -14.813 3.798 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -11.541 -17.285 2.649 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -10.106 -17.125 3.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -11.911 -18.145 4.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -11.517 -16.643 5.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -12.907 -16.798 4.590 1.00 0.00 H new ATOM 1233 N LYS A 87 -10.690 -11.857 -0.423 1.00 0.00 N ATOM 1234 CA LYS A 87 -9.579 -11.580 -1.318 1.00 0.00 C ATOM 1235 C LYS A 87 -9.552 -10.086 -1.643 1.00 0.00 C ATOM 1236 O LYS A 87 -10.460 -9.572 -2.294 1.00 0.00 O ATOM 1237 CB LYS A 87 -9.650 -12.478 -2.555 1.00 0.00 C ATOM 1238 CG LYS A 87 -8.716 -13.681 -2.414 1.00 0.00 C ATOM 1239 CD LYS A 87 -8.961 -14.699 -3.530 1.00 0.00 C ATOM 1240 CE LYS A 87 -9.514 -16.009 -2.965 1.00 0.00 C ATOM 1241 NZ LYS A 87 -9.291 -17.119 -3.918 1.00 0.00 N ATOM 0 H LYS A 87 -11.613 -11.745 -0.842 1.00 0.00 H new ATOM 0 HA LYS A 87 -8.632 -11.818 -0.834 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -10.674 -12.823 -2.700 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -9.379 -11.904 -3.441 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -7.679 -13.346 -2.443 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -8.871 -14.154 -1.444 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -9.662 -14.287 -4.256 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -8.029 -14.893 -4.062 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -9.030 -16.235 -2.015 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -10.580 -15.904 -2.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -9.672 -18.001 -3.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -9.773 -16.908 -4.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -8.271 -17.229 -4.090 1.00 0.00 H new ATOM 1255 N MET A 88 -8.500 -9.430 -1.174 1.00 0.00 N ATOM 1256 CA MET A 88 -8.343 -8.004 -1.407 1.00 0.00 C ATOM 1257 C MET A 88 -7.156 -7.727 -2.332 1.00 0.00 C ATOM 1258 O MET A 88 -6.021 -8.084 -2.015 1.00 0.00 O ATOM 1259 CB MET A 88 -8.127 -7.289 -0.071 1.00 0.00 C ATOM 1260 CG MET A 88 -9.417 -7.263 0.751 1.00 0.00 C ATOM 1261 SD MET A 88 -9.868 -5.578 1.127 1.00 0.00 S ATOM 1262 CE MET A 88 -9.952 -4.903 -0.523 1.00 0.00 C ATOM 0 H MET A 88 -7.749 -9.859 -0.634 1.00 0.00 H new ATOM 0 HA MET A 88 -9.248 -7.631 -1.887 1.00 0.00 H new ATOM 0 HB2 MET A 88 -7.342 -7.793 0.493 1.00 0.00 H new ATOM 0 HB3 MET A 88 -7.785 -6.270 -0.251 1.00 0.00 H new ATOM 0 HG2 MET A 88 -10.221 -7.748 0.197 1.00 0.00 H new ATOM 0 HG3 MET A 88 -9.281 -7.826 1.674 1.00 0.00 H new ATOM 0 HE1 MET A 88 -9.211 -4.111 -0.630 1.00 0.00 H new ATOM 0 HE2 MET A 88 -9.749 -5.690 -1.249 1.00 0.00 H new ATOM 0 HE3 MET A 88 -10.947 -4.495 -0.699 1.00 0.00 H new ATOM 1272 N ARG A 89 -7.457 -7.095 -3.456 1.00 0.00 N ATOM 1273 CA ARG A 89 -6.429 -6.766 -4.429 1.00 0.00 C ATOM 1274 C ARG A 89 -6.175 -5.257 -4.444 1.00 0.00 C ATOM 1275 O ARG A 89 -7.091 -4.468 -4.216 1.00 0.00 O ATOM 1276 CB ARG A 89 -6.832 -7.222 -5.832 1.00 0.00 C ATOM 1277 CG ARG A 89 -5.683 -7.028 -6.823 1.00 0.00 C ATOM 1278 CD ARG A 89 -5.977 -5.874 -7.784 1.00 0.00 C ATOM 1279 NE ARG A 89 -5.938 -6.357 -9.182 1.00 0.00 N ATOM 1280 CZ ARG A 89 -6.943 -7.013 -9.779 1.00 0.00 C ATOM 1281 NH1 ARG A 89 -8.071 -7.268 -9.102 1.00 0.00 N ATOM 1282 NH2 ARG A 89 -6.819 -7.414 -11.051 1.00 0.00 N ATOM 0 H ARG A 89 -8.399 -6.802 -3.715 1.00 0.00 H new ATOM 0 HA ARG A 89 -5.518 -7.288 -4.137 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -7.122 -8.272 -5.807 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -7.703 -6.658 -6.165 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -4.759 -6.827 -6.280 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -5.527 -7.946 -7.389 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -6.956 -5.448 -7.565 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -5.245 -5.079 -7.645 1.00 0.00 H new ATOM 0 HE ARG A 89 -5.093 -6.180 -9.726 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -8.164 -6.963 -8.133 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -8.836 -7.767 -9.556 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -5.960 -7.220 -11.565 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -7.584 -7.913 -11.505 1.00 0.00 H new ATOM 1296 N PHE A 90 -4.928 -4.902 -4.714 1.00 0.00 N ATOM 1297 CA PHE A 90 -4.542 -3.502 -4.761 1.00 0.00 C ATOM 1298 C PHE A 90 -3.494 -3.258 -5.849 1.00 0.00 C ATOM 1299 O PHE A 90 -2.473 -3.942 -5.896 1.00 0.00 O ATOM 1300 CB PHE A 90 -3.936 -3.158 -3.399 1.00 0.00 C ATOM 1301 CG PHE A 90 -4.796 -3.586 -2.209 1.00 0.00 C ATOM 1302 CD1 PHE A 90 -5.993 -2.981 -1.983 1.00 0.00 C ATOM 1303 CD2 PHE A 90 -4.365 -4.571 -1.377 1.00 0.00 C ATOM 1304 CE1 PHE A 90 -6.792 -3.378 -0.878 1.00 0.00 C ATOM 1305 CE2 PHE A 90 -5.164 -4.968 -0.272 1.00 0.00 C ATOM 1306 CZ PHE A 90 -6.360 -4.363 -0.046 1.00 0.00 C ATOM 0 H PHE A 90 -4.171 -5.560 -4.903 1.00 0.00 H new ATOM 0 HA PHE A 90 -5.411 -2.884 -4.987 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -2.959 -3.633 -3.317 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -3.772 -2.082 -3.347 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -6.336 -2.199 -2.644 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -3.415 -5.052 -1.556 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -7.743 -2.898 -0.699 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -4.821 -5.751 0.389 1.00 0.00 H new ATOM 0 HZ PHE A 90 -6.967 -4.665 0.795 1.00 0.00 H new ATOM 1316 N LEU A 91 -3.784 -2.282 -6.697 1.00 0.00 N ATOM 1317 CA LEU A 91 -2.879 -1.940 -7.781 1.00 0.00 C ATOM 1318 C LEU A 91 -2.029 -0.736 -7.370 1.00 0.00 C ATOM 1319 O LEU A 91 -2.402 0.408 -7.627 1.00 0.00 O ATOM 1320 CB LEU A 91 -3.657 -1.728 -9.082 1.00 0.00 C ATOM 1321 CG LEU A 91 -2.817 -1.625 -10.356 1.00 0.00 C ATOM 1322 CD1 LEU A 91 -1.943 -2.867 -10.540 1.00 0.00 C ATOM 1323 CD2 LEU A 91 -3.703 -1.362 -11.576 1.00 0.00 C ATOM 0 H LEU A 91 -4.633 -1.718 -6.655 1.00 0.00 H new ATOM 0 HA LEU A 91 -2.192 -2.763 -7.978 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -4.360 -2.552 -9.200 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -4.247 -0.817 -8.985 1.00 0.00 H new ATOM 0 HG LEU A 91 -2.146 -0.772 -10.254 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -1.356 -2.767 -11.453 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -1.272 -2.969 -9.687 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -2.577 -3.751 -10.611 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -3.082 -1.293 -12.469 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -4.415 -2.179 -11.692 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -4.244 -0.426 -11.438 1.00 0.00 H new ATOM 1335 N VAL A 92 -0.903 -1.034 -6.739 1.00 0.00 N ATOM 1336 CA VAL A 92 0.002 0.009 -6.290 1.00 0.00 C ATOM 1337 C VAL A 92 1.191 0.095 -7.250 1.00 0.00 C ATOM 1338 O VAL A 92 1.511 -0.875 -7.935 1.00 0.00 O ATOM 1339 CB VAL A 92 0.422 -0.249 -4.841 1.00 0.00 C ATOM 1340 CG1 VAL A 92 0.425 -1.748 -4.531 1.00 0.00 C ATOM 1341 CG2 VAL A 92 1.787 0.375 -4.546 1.00 0.00 C ATOM 0 H VAL A 92 -0.597 -1.984 -6.528 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.497 0.978 -6.302 1.00 0.00 H new ATOM 0 HB VAL A 92 -0.311 0.227 -4.189 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.727 -1.905 -3.495 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -0.576 -2.153 -4.683 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.126 -2.255 -5.194 1.00 0.00 H new ATOM 0 HG21 VAL A 92 2.061 0.177 -3.510 1.00 0.00 H new ATOM 0 HG22 VAL A 92 2.536 -0.058 -5.209 1.00 0.00 H new ATOM 0 HG23 VAL A 92 1.738 1.452 -4.709 1.00 0.00 H new ATOM 1351 N ALA A 93 1.811 1.266 -7.269 1.00 0.00 N ATOM 1352 CA ALA A 93 2.957 1.491 -8.133 1.00 0.00 C ATOM 1353 C ALA A 93 4.211 1.671 -7.275 1.00 0.00 C ATOM 1354 O ALA A 93 4.118 2.036 -6.104 1.00 0.00 O ATOM 1355 CB ALA A 93 2.688 2.699 -9.033 1.00 0.00 C ATOM 0 H ALA A 93 1.541 2.068 -6.700 1.00 0.00 H new ATOM 0 HA ALA A 93 3.123 0.631 -8.782 1.00 0.00 H new ATOM 0 HB1 ALA A 93 3.548 2.868 -9.681 1.00 0.00 H new ATOM 0 HB2 ALA A 93 1.805 2.509 -9.643 1.00 0.00 H new ATOM 0 HB3 ALA A 93 2.519 3.582 -8.416 1.00 0.00 H new ATOM 1361 N LYS A 94 5.354 1.408 -7.891 1.00 0.00 N ATOM 1362 CA LYS A 94 6.624 1.537 -7.198 1.00 0.00 C ATOM 1363 C LYS A 94 7.010 3.015 -7.120 1.00 0.00 C ATOM 1364 O LYS A 94 7.574 3.564 -8.066 1.00 0.00 O ATOM 1365 CB LYS A 94 7.687 0.658 -7.860 1.00 0.00 C ATOM 1366 CG LYS A 94 8.250 -0.363 -6.869 1.00 0.00 C ATOM 1367 CD LYS A 94 9.195 0.306 -5.869 1.00 0.00 C ATOM 1368 CE LYS A 94 10.578 0.525 -6.485 1.00 0.00 C ATOM 1369 NZ LYS A 94 11.603 -0.244 -5.745 1.00 0.00 N ATOM 0 H LYS A 94 5.427 1.106 -8.863 1.00 0.00 H new ATOM 0 HA LYS A 94 6.537 1.176 -6.173 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.254 0.139 -8.715 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.494 1.283 -8.242 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.432 -0.846 -6.335 1.00 0.00 H new ATOM 0 HG3 LYS A 94 8.782 -1.145 -7.410 1.00 0.00 H new ATOM 0 HD2 LYS A 94 8.778 1.262 -5.553 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.284 -0.314 -4.977 1.00 0.00 H new ATOM 0 HE2 LYS A 94 10.569 0.218 -7.531 1.00 0.00 H new ATOM 0 HE3 LYS A 94 10.827 1.586 -6.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 12.536 -0.084 -6.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 11.622 0.068 -4.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 11.373 -1.257 -5.785 1.00 0.00 H new ATOM 1383 N SER A 95 6.692 3.618 -5.984 1.00 0.00 N ATOM 1384 CA SER A 95 6.999 5.022 -5.770 1.00 0.00 C ATOM 1385 C SER A 95 8.479 5.187 -5.419 1.00 0.00 C ATOM 1386 O SER A 95 9.173 4.204 -5.164 1.00 0.00 O ATOM 1387 CB SER A 95 6.122 5.615 -4.665 1.00 0.00 C ATOM 1388 OG SER A 95 4.970 6.269 -5.191 1.00 0.00 O ATOM 0 H SER A 95 6.225 3.160 -5.202 1.00 0.00 H new ATOM 0 HA SER A 95 6.789 5.562 -6.693 1.00 0.00 H new ATOM 0 HB2 SER A 95 5.810 4.822 -3.985 1.00 0.00 H new ATOM 0 HB3 SER A 95 6.707 6.325 -4.080 1.00 0.00 H new ATOM 0 HG SER A 95 4.357 6.492 -4.459 1.00 0.00 H new ATOM 1394 N ASP A 96 8.918 6.437 -5.418 1.00 0.00 N ATOM 1395 CA ASP A 96 10.303 6.743 -5.102 1.00 0.00 C ATOM 1396 C ASP A 96 10.447 6.932 -3.591 1.00 0.00 C ATOM 1397 O ASP A 96 9.472 6.816 -2.851 1.00 0.00 O ATOM 1398 CB ASP A 96 10.750 8.037 -5.785 1.00 0.00 C ATOM 1399 CG ASP A 96 9.690 9.139 -5.840 1.00 0.00 C ATOM 1400 OD1 ASP A 96 8.690 8.930 -6.560 1.00 0.00 O ATOM 1401 OD2 ASP A 96 9.903 10.166 -5.160 1.00 0.00 O ATOM 0 H ASP A 96 8.339 7.250 -5.631 1.00 0.00 H new ATOM 0 HA ASP A 96 10.920 5.917 -5.455 1.00 0.00 H new ATOM 0 HB2 ASP A 96 11.626 8.422 -5.263 1.00 0.00 H new ATOM 0 HB3 ASP A 96 11.063 7.804 -6.803 1.00 0.00 H new ATOM 1406 N VAL A 97 11.673 7.218 -3.177 1.00 0.00 N ATOM 1407 CA VAL A 97 11.958 7.424 -1.767 1.00 0.00 C ATOM 1408 C VAL A 97 11.415 8.787 -1.335 1.00 0.00 C ATOM 1409 O VAL A 97 10.763 8.899 -0.299 1.00 0.00 O ATOM 1410 CB VAL A 97 13.458 7.269 -1.509 1.00 0.00 C ATOM 1411 CG1 VAL A 97 13.828 7.770 -0.112 1.00 0.00 C ATOM 1412 CG2 VAL A 97 13.901 5.818 -1.706 1.00 0.00 C ATOM 0 H VAL A 97 12.480 7.312 -3.793 1.00 0.00 H new ATOM 0 HA VAL A 97 11.457 6.668 -1.162 1.00 0.00 H new ATOM 0 HB VAL A 97 13.989 7.883 -2.237 1.00 0.00 H new ATOM 0 HG11 VAL A 97 14.900 7.649 0.046 1.00 0.00 H new ATOM 0 HG12 VAL A 97 13.565 8.824 -0.022 1.00 0.00 H new ATOM 0 HG13 VAL A 97 13.283 7.195 0.637 1.00 0.00 H new ATOM 0 HG21 VAL A 97 14.971 5.735 -1.517 1.00 0.00 H new ATOM 0 HG22 VAL A 97 13.359 5.175 -1.013 1.00 0.00 H new ATOM 0 HG23 VAL A 97 13.689 5.509 -2.729 1.00 0.00 H new ATOM 1422 N GLU A 98 11.704 9.790 -2.152 1.00 0.00 N ATOM 1423 CA GLU A 98 11.253 11.141 -1.867 1.00 0.00 C ATOM 1424 C GLU A 98 9.786 11.131 -1.434 1.00 0.00 C ATOM 1425 O GLU A 98 9.426 11.748 -0.433 1.00 0.00 O ATOM 1426 CB GLU A 98 11.462 12.055 -3.076 1.00 0.00 C ATOM 1427 CG GLU A 98 12.932 12.455 -3.214 1.00 0.00 C ATOM 1428 CD GLU A 98 13.252 12.882 -4.648 1.00 0.00 C ATOM 1429 OE1 GLU A 98 13.587 11.981 -5.447 1.00 0.00 O ATOM 1430 OE2 GLU A 98 13.154 14.099 -4.913 1.00 0.00 O ATOM 0 H GLU A 98 12.245 9.693 -3.011 1.00 0.00 H new ATOM 0 HA GLU A 98 11.851 11.537 -1.046 1.00 0.00 H new ATOM 0 HB2 GLU A 98 11.133 11.546 -3.982 1.00 0.00 H new ATOM 0 HB3 GLU A 98 10.847 12.949 -2.971 1.00 0.00 H new ATOM 0 HG2 GLU A 98 13.156 13.273 -2.529 1.00 0.00 H new ATOM 0 HG3 GLU A 98 13.569 11.617 -2.930 1.00 0.00 H new ATOM 1437 N THR A 99 8.978 10.423 -2.210 1.00 0.00 N ATOM 1438 CA THR A 99 7.558 10.324 -1.919 1.00 0.00 C ATOM 1439 C THR A 99 7.339 9.887 -0.470 1.00 0.00 C ATOM 1440 O THR A 99 6.621 10.546 0.280 1.00 0.00 O ATOM 1441 CB THR A 99 6.931 9.373 -2.942 1.00 0.00 C ATOM 1442 OG1 THR A 99 6.616 10.213 -4.049 1.00 0.00 O ATOM 1443 CG2 THR A 99 5.574 8.834 -2.485 1.00 0.00 C ATOM 0 H THR A 99 9.280 9.913 -3.040 1.00 0.00 H new ATOM 0 HA THR A 99 7.067 11.293 -2.010 1.00 0.00 H new ATOM 0 HB THR A 99 7.609 8.540 -3.126 1.00 0.00 H new ATOM 0 HG1 THR A 99 6.206 9.677 -4.760 1.00 0.00 H new ATOM 0 HG21 THR A 99 5.173 8.165 -3.246 1.00 0.00 H new ATOM 0 HG22 THR A 99 5.696 8.288 -1.550 1.00 0.00 H new ATOM 0 HG23 THR A 99 4.885 9.665 -2.333 1.00 0.00 H new ATOM 1451 N ALA A 100 7.973 8.777 -0.118 1.00 0.00 N ATOM 1452 CA ALA A 100 7.857 8.244 1.229 1.00 0.00 C ATOM 1453 C ALA A 100 8.212 9.338 2.238 1.00 0.00 C ATOM 1454 O ALA A 100 7.434 9.627 3.145 1.00 0.00 O ATOM 1455 CB ALA A 100 8.750 7.010 1.368 1.00 0.00 C ATOM 0 H ALA A 100 8.568 8.233 -0.742 1.00 0.00 H new ATOM 0 HA ALA A 100 6.833 7.930 1.431 1.00 0.00 H new ATOM 0 HB1 ALA A 100 8.663 6.610 2.378 1.00 0.00 H new ATOM 0 HB2 ALA A 100 8.438 6.252 0.650 1.00 0.00 H new ATOM 0 HB3 ALA A 100 9.786 7.287 1.175 1.00 0.00 H new ATOM 1461 N LYS A 101 9.389 9.916 2.046 1.00 0.00 N ATOM 1462 CA LYS A 101 9.857 10.971 2.928 1.00 0.00 C ATOM 1463 C LYS A 101 8.688 11.895 3.277 1.00 0.00 C ATOM 1464 O LYS A 101 8.387 12.105 4.451 1.00 0.00 O ATOM 1465 CB LYS A 101 11.051 11.699 2.306 1.00 0.00 C ATOM 1466 CG LYS A 101 12.216 10.736 2.067 1.00 0.00 C ATOM 1467 CD LYS A 101 13.559 11.433 2.295 1.00 0.00 C ATOM 1468 CE LYS A 101 14.552 11.084 1.184 1.00 0.00 C ATOM 1469 NZ LYS A 101 15.610 12.115 1.092 1.00 0.00 N ATOM 0 H LYS A 101 10.032 9.673 1.292 1.00 0.00 H new ATOM 0 HA LYS A 101 10.222 10.550 3.865 1.00 0.00 H new ATOM 0 HB2 LYS A 101 10.752 12.155 1.362 1.00 0.00 H new ATOM 0 HB3 LYS A 101 11.371 12.507 2.963 1.00 0.00 H new ATOM 0 HG2 LYS A 101 12.128 9.880 2.736 1.00 0.00 H new ATOM 0 HG3 LYS A 101 12.171 10.350 1.049 1.00 0.00 H new ATOM 0 HD2 LYS A 101 13.412 12.512 2.330 1.00 0.00 H new ATOM 0 HD3 LYS A 101 13.968 11.135 3.260 1.00 0.00 H new ATOM 0 HE2 LYS A 101 15.001 10.111 1.382 1.00 0.00 H new ATOM 0 HE3 LYS A 101 14.028 11.006 0.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 16.275 11.863 0.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 15.178 13.038 0.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 16.121 12.170 1.996 1.00 0.00 H new ATOM 1483 N LYS A 102 8.061 12.422 2.235 1.00 0.00 N ATOM 1484 CA LYS A 102 6.932 13.318 2.417 1.00 0.00 C ATOM 1485 C LYS A 102 5.882 12.636 3.296 1.00 0.00 C ATOM 1486 O LYS A 102 5.315 13.262 4.191 1.00 0.00 O ATOM 1487 CB LYS A 102 6.392 13.781 1.062 1.00 0.00 C ATOM 1488 CG LYS A 102 7.430 14.624 0.318 1.00 0.00 C ATOM 1489 CD LYS A 102 7.464 14.265 -1.169 1.00 0.00 C ATOM 1490 CE LYS A 102 8.692 14.870 -1.851 1.00 0.00 C ATOM 1491 NZ LYS A 102 8.310 15.517 -3.127 1.00 0.00 N ATOM 0 H LYS A 102 8.314 12.246 1.263 1.00 0.00 H new ATOM 0 HA LYS A 102 7.244 14.224 2.937 1.00 0.00 H new ATOM 0 HB2 LYS A 102 6.122 12.914 0.459 1.00 0.00 H new ATOM 0 HB3 LYS A 102 5.482 14.363 1.209 1.00 0.00 H new ATOM 0 HG2 LYS A 102 7.196 15.682 0.435 1.00 0.00 H new ATOM 0 HG3 LYS A 102 8.415 14.465 0.757 1.00 0.00 H new ATOM 0 HD2 LYS A 102 7.476 13.181 -1.285 1.00 0.00 H new ATOM 0 HD3 LYS A 102 6.558 14.627 -1.655 1.00 0.00 H new ATOM 0 HE2 LYS A 102 9.159 15.601 -1.191 1.00 0.00 H new ATOM 0 HE3 LYS A 102 9.432 14.092 -2.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 9.155 15.923 -3.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 7.885 14.810 -3.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 7.621 16.273 -2.940 1.00 0.00 H new ATOM 1505 N ILE A 103 5.654 11.363 3.012 1.00 0.00 N ATOM 1506 CA ILE A 103 4.682 10.589 3.766 1.00 0.00 C ATOM 1507 C ILE A 103 5.156 10.455 5.214 1.00 0.00 C ATOM 1508 O ILE A 103 4.356 10.543 6.144 1.00 0.00 O ATOM 1509 CB ILE A 103 4.415 9.248 3.079 1.00 0.00 C ATOM 1510 CG1 ILE A 103 4.002 9.452 1.620 1.00 0.00 C ATOM 1511 CG2 ILE A 103 3.385 8.429 3.858 1.00 0.00 C ATOM 1512 CD1 ILE A 103 2.480 9.410 1.471 1.00 0.00 C ATOM 0 H ILE A 103 6.126 10.847 2.269 1.00 0.00 H new ATOM 0 HA ILE A 103 3.722 11.104 3.791 1.00 0.00 H new ATOM 0 HB ILE A 103 5.343 8.676 3.073 1.00 0.00 H new ATOM 0 HG12 ILE A 103 4.380 10.410 1.262 1.00 0.00 H new ATOM 0 HG13 ILE A 103 4.453 8.678 0.999 1.00 0.00 H new ATOM 0 HG21 ILE A 103 3.213 7.481 3.348 1.00 0.00 H new ATOM 0 HG22 ILE A 103 3.758 8.238 4.864 1.00 0.00 H new ATOM 0 HG23 ILE A 103 2.449 8.984 3.917 1.00 0.00 H new ATOM 0 HD11 ILE A 103 2.213 9.558 0.425 1.00 0.00 H new ATOM 0 HD12 ILE A 103 2.108 8.442 1.808 1.00 0.00 H new ATOM 0 HD13 ILE A 103 2.033 10.200 2.074 1.00 0.00 H new ATOM 1524 N HIS A 104 6.456 10.245 5.360 1.00 0.00 N ATOM 1525 CA HIS A 104 7.047 10.098 6.680 1.00 0.00 C ATOM 1526 C HIS A 104 6.748 11.343 7.517 1.00 0.00 C ATOM 1527 O HIS A 104 6.825 12.464 7.018 1.00 0.00 O ATOM 1528 CB HIS A 104 8.544 9.798 6.575 1.00 0.00 C ATOM 1529 CG HIS A 104 8.867 8.331 6.420 1.00 0.00 C ATOM 1530 ND1 HIS A 104 10.146 7.825 6.577 1.00 0.00 N ATOM 1531 CD2 HIS A 104 8.066 7.269 6.122 1.00 0.00 C ATOM 1532 CE1 HIS A 104 10.104 6.516 6.379 1.00 0.00 C ATOM 1533 NE2 HIS A 104 8.814 6.173 6.096 1.00 0.00 N ATOM 0 H HIS A 104 7.117 10.173 4.586 1.00 0.00 H new ATOM 0 HA HIS A 104 6.600 9.244 7.190 1.00 0.00 H new ATOM 0 HB2 HIS A 104 8.954 10.342 5.724 1.00 0.00 H new ATOM 0 HB3 HIS A 104 9.044 10.177 7.466 1.00 0.00 H new ATOM 0 HD2 HIS A 104 7.003 7.312 5.938 1.00 0.00 H new ATOM 0 HE1 HIS A 104 10.944 5.839 6.432 1.00 0.00 H new ATOM 0 HE2 HIS A 104 8.480 5.230 5.897 1.00 0.00 H new ATOM 1541 N SER A 105 6.414 11.103 8.777 1.00 0.00 N ATOM 1542 CA SER A 105 6.104 12.191 9.689 1.00 0.00 C ATOM 1543 C SER A 105 7.385 12.694 10.358 1.00 0.00 C ATOM 1544 O SER A 105 7.824 13.814 10.103 1.00 0.00 O ATOM 1545 CB SER A 105 5.090 11.752 10.746 1.00 0.00 C ATOM 1546 OG SER A 105 3.981 12.643 10.825 1.00 0.00 O ATOM 0 H SER A 105 6.351 10.171 9.187 1.00 0.00 H new ATOM 0 HA SER A 105 5.659 13.003 9.114 1.00 0.00 H new ATOM 0 HB2 SER A 105 4.733 10.749 10.511 1.00 0.00 H new ATOM 0 HB3 SER A 105 5.580 11.697 11.718 1.00 0.00 H new ATOM 0 HG SER A 105 3.356 12.327 11.510 1.00 0.00 H new ATOM 1552 N GLY A 106 7.947 11.842 11.202 1.00 0.00 N ATOM 1553 CA GLY A 106 9.169 12.186 11.910 1.00 0.00 C ATOM 1554 C GLY A 106 10.135 11.000 11.944 1.00 0.00 C ATOM 1555 O GLY A 106 10.148 10.233 12.905 1.00 0.00 O ATOM 0 H GLY A 106 7.579 10.914 11.412 1.00 0.00 H new ATOM 0 HA2 GLY A 106 9.648 13.036 11.424 1.00 0.00 H new ATOM 0 HA3 GLY A 106 8.930 12.494 12.928 1.00 0.00 H new ATOM 1559 N PRO A 107 10.942 10.885 10.855 1.00 0.00 N ATOM 1560 CA PRO A 107 11.910 9.807 10.751 1.00 0.00 C ATOM 1561 C PRO A 107 13.114 10.061 11.660 1.00 0.00 C ATOM 1562 O PRO A 107 13.588 9.150 12.338 1.00 0.00 O ATOM 1563 CB PRO A 107 12.279 9.750 9.278 1.00 0.00 C ATOM 1564 CG PRO A 107 11.863 11.089 8.692 1.00 0.00 C ATOM 1565 CD PRO A 107 10.954 11.776 9.699 1.00 0.00 C ATOM 0 HA PRO A 107 11.510 8.849 11.085 1.00 0.00 H new ATOM 0 HB2 PRO A 107 13.348 9.583 9.149 1.00 0.00 H new ATOM 0 HB3 PRO A 107 11.766 8.929 8.778 1.00 0.00 H new ATOM 0 HG2 PRO A 107 12.739 11.704 8.486 1.00 0.00 H new ATOM 0 HG3 PRO A 107 11.344 10.946 7.744 1.00 0.00 H new ATOM 0 HD2 PRO A 107 11.332 12.764 9.964 1.00 0.00 H new ATOM 0 HD3 PRO A 107 9.951 11.916 9.296 1.00 0.00 H new ATOM 1573 N SER A 108 13.575 11.303 11.644 1.00 0.00 N ATOM 1574 CA SER A 108 14.715 11.688 12.458 1.00 0.00 C ATOM 1575 C SER A 108 14.809 13.213 12.539 1.00 0.00 C ATOM 1576 O SER A 108 14.796 13.783 13.629 1.00 0.00 O ATOM 1577 CB SER A 108 16.014 11.106 11.898 1.00 0.00 C ATOM 1578 OG SER A 108 16.721 10.344 12.873 1.00 0.00 O ATOM 0 H SER A 108 13.180 12.056 11.080 1.00 0.00 H new ATOM 0 HA SER A 108 14.570 11.285 13.460 1.00 0.00 H new ATOM 0 HB2 SER A 108 15.788 10.475 11.039 1.00 0.00 H new ATOM 0 HB3 SER A 108 16.650 11.916 11.540 1.00 0.00 H new ATOM 0 HG SER A 108 17.543 9.988 12.477 1.00 0.00 H new ATOM 1584 N SER A 109 14.901 13.831 11.371 1.00 0.00 N ATOM 1585 CA SER A 109 14.996 15.279 11.295 1.00 0.00 C ATOM 1586 C SER A 109 13.628 15.909 11.563 1.00 0.00 C ATOM 1587 O SER A 109 12.598 15.343 11.199 1.00 0.00 O ATOM 1588 CB SER A 109 15.528 15.726 9.932 1.00 0.00 C ATOM 1589 OG SER A 109 16.818 15.185 9.659 1.00 0.00 O ATOM 0 H SER A 109 14.912 13.355 10.469 1.00 0.00 H new ATOM 0 HA SER A 109 15.699 15.615 12.057 1.00 0.00 H new ATOM 0 HB2 SER A 109 14.832 15.416 9.152 1.00 0.00 H new ATOM 0 HB3 SER A 109 15.577 16.814 9.901 1.00 0.00 H new ATOM 0 HG SER A 109 17.122 15.492 8.779 1.00 0.00 H new ATOM 1595 N GLY A 110 13.661 17.071 12.198 1.00 0.00 N ATOM 1596 CA GLY A 110 12.436 17.784 12.519 1.00 0.00 C ATOM 1597 C GLY A 110 12.154 18.881 11.490 1.00 0.00 C ATOM 1598 O GLY A 110 11.178 18.802 10.746 1.00 0.00 O ATOM 0 H GLY A 110 14.517 17.537 12.499 1.00 0.00 H new ATOM 0 HA2 GLY A 110 11.601 17.084 12.548 1.00 0.00 H new ATOM 0 HA3 GLY A 110 12.517 18.225 13.513 1.00 0.00 H new TER 1602 GLY A 110