USER MOD reduce.3.24.130724 H: found=0, std=0, add=368, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 371 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 Single : A 126 ASN :FLIP amide:sc= -0.199! F(o=-0.74,f=-0.2!) USER MOD Single : A 132 MET CE :methyl -120:sc= -0.422 (180deg=-3.01!) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 TYR OH : rot 120:sc= -0.352 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 152 THR OG1 : rot -85:sc= 1.22 USER MOD Single : A 154 LYS NZ :NH3+ -166:sc= -0.0987 (180deg=-0.428) USER MOD Single : A 155 ASN : amide:sc=-0.00974 X(o=-0.0097,f=-0.0097) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 126 1.125 12.982 -12.576 1.00 0.00 N ATOM 2 CA ASN A 126 0.932 12.227 -11.310 1.00 0.00 C ATOM 3 C ASN A 126 -0.414 11.508 -11.296 1.00 0.00 C ATOM 4 O ASN A 126 -1.388 11.980 -11.882 1.00 0.00 O ATOM 5 CB ASN A 126 1.016 13.210 -10.140 1.00 0.00 C ATOM 6 CG ASN A 126 0.115 14.414 -10.330 1.00 0.00 C ATOM 7 OD1 ASN A 126 0.135 15.327 -9.366 1.00 0.00 O flip ATOM 8 ND2 ASN A 126 -0.592 14.523 -11.331 1.00 0.00 N flip ATOM 0 HA ASN A 126 1.710 11.469 -11.223 1.00 0.00 H new ATOM 0 HB2 ASN A 126 0.743 12.697 -9.218 1.00 0.00 H new ATOM 0 HB3 ASN A 126 2.047 13.546 -10.024 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -0.577 13.797 -12.048 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -1.194 15.339 -11.444 1.00 0.00 H new ATOM 17 N ARG A 127 -0.459 10.362 -10.624 1.00 0.00 N ATOM 18 CA ARG A 127 -1.685 9.577 -10.534 1.00 0.00 C ATOM 19 C ARG A 127 -2.018 9.254 -9.081 1.00 0.00 C ATOM 20 O ARG A 127 -1.396 8.386 -8.468 1.00 0.00 O ATOM 21 CB ARG A 127 -1.546 8.283 -11.338 1.00 0.00 C ATOM 22 CG ARG A 127 -2.108 8.380 -12.748 1.00 0.00 C ATOM 23 CD ARG A 127 -1.417 7.409 -13.693 1.00 0.00 C ATOM 24 NE ARG A 127 -2.367 6.730 -14.570 1.00 0.00 N ATOM 25 CZ ARG A 127 -3.270 5.848 -14.145 1.00 0.00 C ATOM 26 NH1 ARG A 127 -3.350 5.538 -12.857 1.00 0.00 N ATOM 27 NH2 ARG A 127 -4.097 5.277 -15.010 1.00 0.00 N ATOM 0 H ARG A 127 0.339 9.957 -10.134 1.00 0.00 H new ATOM 0 HA ARG A 127 -2.499 10.170 -10.951 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -0.492 8.011 -11.394 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -2.055 7.479 -10.807 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -3.178 8.172 -12.729 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -1.988 9.398 -13.119 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -0.687 7.948 -14.297 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -0.866 6.669 -13.113 1.00 0.00 H new ATOM 0 HE ARG A 127 -2.337 6.944 -15.567 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -2.718 5.976 -12.187 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -4.044 4.862 -12.537 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -4.042 5.513 -16.001 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -4.789 4.602 -14.685 1.00 0.00 H new ATOM 41 N ARG A 128 -3.004 9.959 -8.534 1.00 0.00 N ATOM 42 CA ARG A 128 -3.421 9.748 -7.149 1.00 0.00 C ATOM 43 C ARG A 128 -3.756 8.282 -6.892 1.00 0.00 C ATOM 44 O ARG A 128 -4.090 7.539 -7.815 1.00 0.00 O ATOM 45 CB ARG A 128 -4.625 10.623 -6.802 1.00 0.00 C ATOM 46 CG ARG A 128 -5.579 10.809 -7.960 1.00 0.00 C ATOM 47 CD ARG A 128 -7.031 10.770 -7.509 1.00 0.00 C ATOM 48 NE ARG A 128 -7.873 10.020 -8.436 1.00 0.00 N ATOM 49 CZ ARG A 128 -8.198 10.447 -9.655 1.00 0.00 C ATOM 50 NH1 ARG A 128 -7.753 11.617 -10.095 1.00 0.00 N ATOM 51 NH2 ARG A 128 -8.971 9.702 -10.433 1.00 0.00 N ATOM 0 H ARG A 128 -3.529 10.681 -9.027 1.00 0.00 H new ATOM 0 HA ARG A 128 -2.585 10.031 -6.510 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -5.162 10.176 -5.965 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -4.273 11.599 -6.469 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -5.376 11.762 -8.449 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -5.408 10.028 -8.701 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -7.091 10.318 -6.519 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -7.410 11.788 -7.418 1.00 0.00 H new ATOM 0 HE ARG A 128 -8.234 9.116 -8.132 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -7.159 12.194 -9.499 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -8.005 11.940 -11.029 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -9.316 8.803 -10.098 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -9.220 10.028 -11.367 1.00 0.00 H new ATOM 65 N VAL A 129 -3.668 7.873 -5.631 1.00 0.00 N ATOM 66 CA VAL A 129 -3.963 6.496 -5.251 1.00 0.00 C ATOM 67 C VAL A 129 -4.832 6.446 -4.000 1.00 0.00 C ATOM 68 O VAL A 129 -4.754 7.326 -3.142 1.00 0.00 O ATOM 69 CB VAL A 129 -2.674 5.693 -4.997 1.00 0.00 C ATOM 70 CG1 VAL A 129 -2.994 4.223 -4.772 1.00 0.00 C ATOM 71 CG2 VAL A 129 -1.701 5.864 -6.154 1.00 0.00 C ATOM 0 H VAL A 129 -3.395 8.475 -4.855 1.00 0.00 H new ATOM 0 HA VAL A 129 -4.503 6.048 -6.085 1.00 0.00 H new ATOM 0 HB VAL A 129 -2.200 6.079 -4.094 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -2.070 3.673 -4.594 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -3.649 4.122 -3.907 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -3.493 3.820 -5.654 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -0.796 5.289 -5.956 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -2.164 5.507 -7.074 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -1.445 6.918 -6.261 1.00 0.00 H new ATOM 81 N ILE A 130 -5.657 5.409 -3.900 1.00 0.00 N ATOM 82 CA ILE A 130 -6.537 5.244 -2.749 1.00 0.00 C ATOM 83 C ILE A 130 -5.774 4.660 -1.564 1.00 0.00 C ATOM 84 O ILE A 130 -6.072 3.559 -1.099 1.00 0.00 O ATOM 85 CB ILE A 130 -7.734 4.331 -3.083 1.00 0.00 C ATOM 86 CG1 ILE A 130 -8.429 4.807 -4.361 1.00 0.00 C ATOM 87 CG2 ILE A 130 -8.716 4.298 -1.921 1.00 0.00 C ATOM 88 CD1 ILE A 130 -8.871 3.678 -5.265 1.00 0.00 C ATOM 0 H ILE A 130 -5.735 4.672 -4.601 1.00 0.00 H new ATOM 0 HA ILE A 130 -6.913 6.233 -2.486 1.00 0.00 H new ATOM 0 HB ILE A 130 -7.363 3.320 -3.250 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -9.298 5.406 -4.090 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -7.751 5.459 -4.912 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -9.555 3.649 -2.172 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -8.215 3.915 -1.032 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -9.082 5.306 -1.725 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -9.355 4.089 -6.151 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -8.003 3.091 -5.566 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -9.574 3.038 -4.731 1.00 0.00 H new ATOM 100 N ALA A 131 -4.787 5.405 -1.079 1.00 0.00 N ATOM 101 CA ALA A 131 -3.979 4.963 0.051 1.00 0.00 C ATOM 102 C ALA A 131 -3.656 6.125 0.984 1.00 0.00 C ATOM 103 O ALA A 131 -3.655 7.284 0.571 1.00 0.00 O ATOM 104 CB ALA A 131 -2.697 4.310 -0.444 1.00 0.00 C ATOM 0 H ALA A 131 -4.527 6.318 -1.451 1.00 0.00 H new ATOM 0 HA ALA A 131 -4.556 4.230 0.614 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -2.102 3.984 0.409 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -2.944 3.449 -1.065 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -2.126 5.029 -1.031 1.00 0.00 H new ATOM 110 N MET A 132 -3.382 5.805 2.244 1.00 0.00 N ATOM 111 CA MET A 132 -3.056 6.822 3.238 1.00 0.00 C ATOM 112 C MET A 132 -1.699 7.457 2.939 1.00 0.00 C ATOM 113 O MET A 132 -0.885 6.886 2.212 1.00 0.00 O ATOM 114 CB MET A 132 -3.048 6.210 4.640 1.00 0.00 C ATOM 115 CG MET A 132 -4.428 6.122 5.273 1.00 0.00 C ATOM 116 SD MET A 132 -4.449 6.689 6.984 1.00 0.00 S ATOM 117 CE MET A 132 -4.922 8.403 6.767 1.00 0.00 C ATOM 0 H MET A 132 -3.379 4.850 2.602 1.00 0.00 H new ATOM 0 HA MET A 132 -3.820 7.599 3.193 1.00 0.00 H new ATOM 0 HB2 MET A 132 -2.616 5.210 4.589 1.00 0.00 H new ATOM 0 HB3 MET A 132 -2.399 6.805 5.283 1.00 0.00 H new ATOM 0 HG2 MET A 132 -5.129 6.718 4.689 1.00 0.00 H new ATOM 0 HG3 MET A 132 -4.776 5.090 5.233 1.00 0.00 H new ATOM 0 HE1 MET A 132 -4.140 9.049 7.166 1.00 0.00 H new ATOM 0 HE2 MET A 132 -5.058 8.611 5.706 1.00 0.00 H new ATOM 0 HE3 MET A 132 -5.856 8.593 7.297 1.00 0.00 H new ATOM 127 N PRO A 133 -1.437 8.650 3.499 1.00 0.00 N ATOM 128 CA PRO A 133 -0.171 9.360 3.290 1.00 0.00 C ATOM 129 C PRO A 133 1.029 8.575 3.814 1.00 0.00 C ATOM 130 O PRO A 133 2.170 8.846 3.439 1.00 0.00 O ATOM 131 CB PRO A 133 -0.346 10.662 4.083 1.00 0.00 C ATOM 132 CG PRO A 133 -1.437 10.379 5.057 1.00 0.00 C ATOM 133 CD PRO A 133 -2.350 9.399 4.379 1.00 0.00 C ATOM 0 HA PRO A 133 0.031 9.518 2.231 1.00 0.00 H new ATOM 0 HB2 PRO A 133 0.576 10.940 4.594 1.00 0.00 H new ATOM 0 HB3 PRO A 133 -0.609 11.491 3.426 1.00 0.00 H new ATOM 0 HG2 PRO A 133 -1.037 9.964 5.982 1.00 0.00 H new ATOM 0 HG3 PRO A 133 -1.971 11.292 5.322 1.00 0.00 H new ATOM 0 HD2 PRO A 133 -2.845 8.745 5.097 1.00 0.00 H new ATOM 0 HD3 PRO A 133 -3.134 9.902 3.813 1.00 0.00 H new ATOM 141 N SER A 134 0.765 7.604 4.682 1.00 0.00 N ATOM 142 CA SER A 134 1.826 6.783 5.254 1.00 0.00 C ATOM 143 C SER A 134 2.111 5.569 4.376 1.00 0.00 C ATOM 144 O SER A 134 3.267 5.198 4.169 1.00 0.00 O ATOM 145 CB SER A 134 1.443 6.327 6.664 1.00 0.00 C ATOM 146 OG SER A 134 2.401 5.424 7.188 1.00 0.00 O ATOM 0 H SER A 134 -0.173 7.367 5.004 1.00 0.00 H new ATOM 0 HA SER A 134 2.730 7.390 5.307 1.00 0.00 H new ATOM 0 HB2 SER A 134 1.360 7.194 7.319 1.00 0.00 H new ATOM 0 HB3 SER A 134 0.463 5.849 6.641 1.00 0.00 H new ATOM 0 HG SER A 134 2.133 5.150 8.090 1.00 0.00 H new ATOM 152 N VAL A 135 1.051 4.952 3.864 1.00 0.00 N ATOM 153 CA VAL A 135 1.191 3.778 3.009 1.00 0.00 C ATOM 154 C VAL A 135 2.006 4.102 1.760 1.00 0.00 C ATOM 155 O VAL A 135 2.835 3.303 1.327 1.00 0.00 O ATOM 156 CB VAL A 135 -0.185 3.216 2.598 1.00 0.00 C ATOM 157 CG1 VAL A 135 -0.031 2.037 1.649 1.00 0.00 C ATOM 158 CG2 VAL A 135 -0.978 2.811 3.831 1.00 0.00 C ATOM 0 H VAL A 135 0.087 5.244 4.026 1.00 0.00 H new ATOM 0 HA VAL A 135 1.718 3.020 3.588 1.00 0.00 H new ATOM 0 HB VAL A 135 -0.732 4.000 2.073 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -1.016 1.660 1.375 1.00 0.00 H new ATOM 0 HG12 VAL A 135 0.497 2.359 0.751 1.00 0.00 H new ATOM 0 HG13 VAL A 135 0.537 1.246 2.140 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -1.947 2.416 3.527 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -0.430 2.045 4.381 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -1.125 3.681 4.471 1.00 0.00 H new ATOM 168 N ARG A 136 1.776 5.277 1.185 1.00 0.00 N ATOM 169 CA ARG A 136 2.510 5.685 -0.006 1.00 0.00 C ATOM 170 C ARG A 136 3.992 5.806 0.316 1.00 0.00 C ATOM 171 O ARG A 136 4.843 5.346 -0.447 1.00 0.00 O ATOM 172 CB ARG A 136 1.967 7.008 -0.549 1.00 0.00 C ATOM 173 CG ARG A 136 0.452 7.032 -0.690 1.00 0.00 C ATOM 174 CD ARG A 136 0.017 7.556 -2.052 1.00 0.00 C ATOM 175 NE ARG A 136 0.799 8.719 -2.468 1.00 0.00 N ATOM 176 CZ ARG A 136 0.741 9.253 -3.686 1.00 0.00 C ATOM 177 NH1 ARG A 136 -0.060 8.734 -4.609 1.00 0.00 N ATOM 178 NH2 ARG A 136 1.485 10.309 -3.982 1.00 0.00 N ATOM 0 H ARG A 136 1.094 5.957 1.520 1.00 0.00 H new ATOM 0 HA ARG A 136 2.378 4.925 -0.776 1.00 0.00 H new ATOM 0 HB2 ARG A 136 2.275 7.817 0.114 1.00 0.00 H new ATOM 0 HB3 ARG A 136 2.417 7.204 -1.522 1.00 0.00 H new ATOM 0 HG2 ARG A 136 0.058 6.026 -0.545 1.00 0.00 H new ATOM 0 HG3 ARG A 136 0.024 7.658 0.093 1.00 0.00 H new ATOM 0 HD2 ARG A 136 0.121 6.765 -2.795 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -1.039 7.823 -2.017 1.00 0.00 H new ATOM 0 HE ARG A 136 1.425 9.146 -1.785 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -0.635 7.922 -4.387 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -0.100 9.148 -5.540 1.00 0.00 H new ATOM 0 HH21 ARG A 136 2.102 10.712 -3.277 1.00 0.00 H new ATOM 0 HH22 ARG A 136 1.441 10.719 -4.915 1.00 0.00 H new ATOM 192 N LYS A 137 4.296 6.400 1.465 1.00 0.00 N ATOM 193 CA LYS A 137 5.676 6.545 1.902 1.00 0.00 C ATOM 194 C LYS A 137 6.287 5.160 2.098 1.00 0.00 C ATOM 195 O LYS A 137 7.469 4.940 1.836 1.00 0.00 O ATOM 196 CB LYS A 137 5.737 7.359 3.202 1.00 0.00 C ATOM 197 CG LYS A 137 6.905 7.003 4.110 1.00 0.00 C ATOM 198 CD LYS A 137 7.010 7.961 5.285 1.00 0.00 C ATOM 199 CE LYS A 137 7.380 7.232 6.567 1.00 0.00 C ATOM 200 NZ LYS A 137 6.793 7.887 7.768 1.00 0.00 N ATOM 0 H LYS A 137 3.606 6.787 2.108 1.00 0.00 H new ATOM 0 HA LYS A 137 6.247 7.081 1.144 1.00 0.00 H new ATOM 0 HB2 LYS A 137 5.797 8.418 2.951 1.00 0.00 H new ATOM 0 HB3 LYS A 137 4.807 7.214 3.752 1.00 0.00 H new ATOM 0 HG2 LYS A 137 6.783 5.985 4.479 1.00 0.00 H new ATOM 0 HG3 LYS A 137 7.832 7.025 3.537 1.00 0.00 H new ATOM 0 HD2 LYS A 137 7.759 8.723 5.069 1.00 0.00 H new ATOM 0 HD3 LYS A 137 6.060 8.478 5.420 1.00 0.00 H new ATOM 0 HE2 LYS A 137 7.033 6.200 6.511 1.00 0.00 H new ATOM 0 HE3 LYS A 137 8.465 7.199 6.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 7.069 7.359 8.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 7.143 8.864 7.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 5.756 7.896 7.687 1.00 0.00 H new ATOM 214 N TYR A 138 5.450 4.229 2.546 1.00 0.00 N ATOM 215 CA TYR A 138 5.861 2.848 2.769 1.00 0.00 C ATOM 216 C TYR A 138 6.417 2.249 1.486 1.00 0.00 C ATOM 217 O TYR A 138 7.578 1.843 1.424 1.00 0.00 O ATOM 218 CB TYR A 138 4.650 2.033 3.244 1.00 0.00 C ATOM 219 CG TYR A 138 4.966 0.664 3.819 1.00 0.00 C ATOM 220 CD1 TYR A 138 6.168 0.014 3.559 1.00 0.00 C ATOM 221 CD2 TYR A 138 4.035 0.017 4.621 1.00 0.00 C ATOM 222 CE1 TYR A 138 6.430 -1.237 4.086 1.00 0.00 C ATOM 223 CE2 TYR A 138 4.290 -1.232 5.150 1.00 0.00 C ATOM 224 CZ TYR A 138 5.489 -1.854 4.880 1.00 0.00 C ATOM 225 OH TYR A 138 5.747 -3.100 5.405 1.00 0.00 O ATOM 0 H TYR A 138 4.470 4.411 2.764 1.00 0.00 H new ATOM 0 HA TYR A 138 6.642 2.823 3.529 1.00 0.00 H new ATOM 0 HB2 TYR A 138 4.119 2.611 4.000 1.00 0.00 H new ATOM 0 HB3 TYR A 138 3.968 1.906 2.403 1.00 0.00 H new ATOM 0 HD1 TYR A 138 6.908 0.494 2.936 1.00 0.00 H new ATOM 0 HD2 TYR A 138 3.093 0.501 4.835 1.00 0.00 H new ATOM 0 HE1 TYR A 138 7.369 -1.728 3.876 1.00 0.00 H new ATOM 0 HE2 TYR A 138 3.554 -1.719 5.772 1.00 0.00 H new ATOM 0 HH TYR A 138 5.720 -3.055 6.384 1.00 0.00 H new ATOM 235 N ALA A 139 5.576 2.197 0.465 1.00 0.00 N ATOM 236 CA ALA A 139 5.972 1.643 -0.821 1.00 0.00 C ATOM 237 C ALA A 139 7.134 2.422 -1.429 1.00 0.00 C ATOM 238 O ALA A 139 7.951 1.865 -2.159 1.00 0.00 O ATOM 239 CB ALA A 139 4.783 1.625 -1.767 1.00 0.00 C ATOM 0 H ALA A 139 4.613 2.532 0.502 1.00 0.00 H new ATOM 0 HA ALA A 139 6.313 0.620 -0.661 1.00 0.00 H new ATOM 0 HB1 ALA A 139 5.088 1.209 -2.727 1.00 0.00 H new ATOM 0 HB2 ALA A 139 3.989 1.011 -1.342 1.00 0.00 H new ATOM 0 HB3 ALA A 139 4.418 2.642 -1.912 1.00 0.00 H new ATOM 245 N ARG A 140 7.206 3.713 -1.129 1.00 0.00 N ATOM 246 CA ARG A 140 8.272 4.556 -1.658 1.00 0.00 C ATOM 247 C ARG A 140 9.563 4.390 -0.857 1.00 0.00 C ATOM 248 O ARG A 140 10.647 4.719 -1.339 1.00 0.00 O ATOM 249 CB ARG A 140 7.840 6.022 -1.654 1.00 0.00 C ATOM 250 CG ARG A 140 8.886 6.967 -2.223 1.00 0.00 C ATOM 251 CD ARG A 140 9.332 7.992 -1.192 1.00 0.00 C ATOM 252 NE ARG A 140 10.306 8.932 -1.741 1.00 0.00 N ATOM 253 CZ ARG A 140 10.007 9.876 -2.631 1.00 0.00 C ATOM 254 NH1 ARG A 140 8.762 10.011 -3.072 1.00 0.00 N ATOM 255 NH2 ARG A 140 10.954 10.688 -3.079 1.00 0.00 N ATOM 0 H ARG A 140 6.542 4.198 -0.525 1.00 0.00 H new ATOM 0 HA ARG A 140 8.467 4.242 -2.683 1.00 0.00 H new ATOM 0 HB2 ARG A 140 6.920 6.122 -2.230 1.00 0.00 H new ATOM 0 HB3 ARG A 140 7.610 6.321 -0.631 1.00 0.00 H new ATOM 0 HG2 ARG A 140 9.748 6.394 -2.564 1.00 0.00 H new ATOM 0 HG3 ARG A 140 8.479 7.480 -3.095 1.00 0.00 H new ATOM 0 HD2 ARG A 140 8.464 8.541 -0.828 1.00 0.00 H new ATOM 0 HD3 ARG A 140 9.767 7.478 -0.335 1.00 0.00 H new ATOM 0 HE ARG A 140 11.273 8.861 -1.424 1.00 0.00 H new ATOM 0 HH11 ARG A 140 8.029 9.390 -2.729 1.00 0.00 H new ATOM 0 HH12 ARG A 140 8.538 10.736 -3.754 1.00 0.00 H new ATOM 0 HH21 ARG A 140 11.912 10.590 -2.742 1.00 0.00 H new ATOM 0 HH22 ARG A 140 10.725 11.411 -3.761 1.00 0.00 H new ATOM 269 N GLU A 141 9.444 3.881 0.366 1.00 0.00 N ATOM 270 CA GLU A 141 10.607 3.679 1.222 1.00 0.00 C ATOM 271 C GLU A 141 11.162 2.265 1.072 1.00 0.00 C ATOM 272 O GLU A 141 12.330 2.014 1.369 1.00 0.00 O ATOM 273 CB GLU A 141 10.240 3.941 2.684 1.00 0.00 C ATOM 274 CG GLU A 141 10.343 5.404 3.083 1.00 0.00 C ATOM 275 CD GLU A 141 11.115 5.606 4.372 1.00 0.00 C ATOM 276 OE1 GLU A 141 11.240 4.635 5.148 1.00 0.00 O ATOM 277 OE2 GLU A 141 11.594 6.736 4.607 1.00 0.00 O ATOM 0 H GLU A 141 8.557 3.602 0.785 1.00 0.00 H new ATOM 0 HA GLU A 141 11.378 4.385 0.913 1.00 0.00 H new ATOM 0 HB2 GLU A 141 9.222 3.595 2.862 1.00 0.00 H new ATOM 0 HB3 GLU A 141 10.894 3.351 3.326 1.00 0.00 H new ATOM 0 HG2 GLU A 141 10.829 5.961 2.282 1.00 0.00 H new ATOM 0 HG3 GLU A 141 9.341 5.817 3.196 1.00 0.00 H new ATOM 284 N LYS A 142 10.320 1.344 0.615 1.00 0.00 N ATOM 285 CA LYS A 142 10.733 -0.043 0.433 1.00 0.00 C ATOM 286 C LYS A 142 11.004 -0.354 -1.038 1.00 0.00 C ATOM 287 O LYS A 142 11.714 -1.308 -1.357 1.00 0.00 O ATOM 288 CB LYS A 142 9.664 -0.990 0.983 1.00 0.00 C ATOM 289 CG LYS A 142 9.965 -1.495 2.385 1.00 0.00 C ATOM 290 CD LYS A 142 10.296 -2.979 2.387 1.00 0.00 C ATOM 291 CE LYS A 142 10.014 -3.612 3.741 1.00 0.00 C ATOM 292 NZ LYS A 142 11.252 -3.759 4.555 1.00 0.00 N ATOM 0 H LYS A 142 9.349 1.532 0.364 1.00 0.00 H new ATOM 0 HA LYS A 142 11.661 -0.191 0.985 1.00 0.00 H new ATOM 0 HB2 LYS A 142 8.703 -0.476 0.989 1.00 0.00 H new ATOM 0 HB3 LYS A 142 9.565 -1.843 0.312 1.00 0.00 H new ATOM 0 HG2 LYS A 142 10.802 -0.935 2.802 1.00 0.00 H new ATOM 0 HG3 LYS A 142 9.106 -1.313 3.030 1.00 0.00 H new ATOM 0 HD2 LYS A 142 9.710 -3.484 1.619 1.00 0.00 H new ATOM 0 HD3 LYS A 142 11.346 -3.119 2.131 1.00 0.00 H new ATOM 0 HE2 LYS A 142 9.293 -3.001 4.284 1.00 0.00 H new ATOM 0 HE3 LYS A 142 9.557 -4.591 3.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 11.016 -4.194 5.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 11.931 -4.363 4.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 11.675 -2.823 4.716 1.00 0.00 H new ATOM 306 N GLY A 143 10.436 0.450 -1.934 1.00 0.00 N ATOM 307 CA GLY A 143 10.638 0.229 -3.355 1.00 0.00 C ATOM 308 C GLY A 143 9.420 -0.370 -4.037 1.00 0.00 C ATOM 309 O GLY A 143 9.467 -0.706 -5.220 1.00 0.00 O ATOM 0 H GLY A 143 9.842 1.247 -1.702 1.00 0.00 H new ATOM 0 HA2 GLY A 143 10.887 1.176 -3.833 1.00 0.00 H new ATOM 0 HA3 GLY A 143 11.491 -0.434 -3.497 1.00 0.00 H new ATOM 313 N VAL A 144 8.325 -0.498 -3.292 1.00 0.00 N ATOM 314 CA VAL A 144 7.091 -1.052 -3.831 1.00 0.00 C ATOM 315 C VAL A 144 6.190 0.057 -4.364 1.00 0.00 C ATOM 316 O VAL A 144 6.333 1.220 -3.987 1.00 0.00 O ATOM 317 CB VAL A 144 6.326 -1.855 -2.762 1.00 0.00 C ATOM 318 CG1 VAL A 144 5.066 -2.475 -3.348 1.00 0.00 C ATOM 319 CG2 VAL A 144 7.222 -2.923 -2.155 1.00 0.00 C ATOM 0 H VAL A 144 8.270 -0.224 -2.311 1.00 0.00 H new ATOM 0 HA VAL A 144 7.365 -1.721 -4.647 1.00 0.00 H new ATOM 0 HB VAL A 144 6.026 -1.169 -1.970 1.00 0.00 H new ATOM 0 HG11 VAL A 144 4.543 -3.037 -2.574 1.00 0.00 H new ATOM 0 HG12 VAL A 144 4.415 -1.687 -3.727 1.00 0.00 H new ATOM 0 HG13 VAL A 144 5.336 -3.146 -4.164 1.00 0.00 H new ATOM 0 HG21 VAL A 144 6.665 -3.480 -1.402 1.00 0.00 H new ATOM 0 HG22 VAL A 144 7.557 -3.605 -2.937 1.00 0.00 H new ATOM 0 HG23 VAL A 144 8.088 -2.451 -1.690 1.00 0.00 H new ATOM 329 N ASP A 145 5.262 -0.310 -5.239 1.00 0.00 N ATOM 330 CA ASP A 145 4.337 0.657 -5.819 1.00 0.00 C ATOM 331 C ASP A 145 2.928 0.454 -5.272 1.00 0.00 C ATOM 332 O ASP A 145 2.254 -0.521 -5.606 1.00 0.00 O ATOM 333 CB ASP A 145 4.333 0.540 -7.346 1.00 0.00 C ATOM 334 CG ASP A 145 3.380 1.519 -8.004 1.00 0.00 C ATOM 335 OD1 ASP A 145 2.733 2.302 -7.277 1.00 0.00 O ATOM 336 OD2 ASP A 145 3.280 1.503 -9.249 1.00 0.00 O ATOM 0 H ASP A 145 5.130 -1.268 -5.562 1.00 0.00 H new ATOM 0 HA ASP A 145 4.672 1.657 -5.543 1.00 0.00 H new ATOM 0 HB2 ASP A 145 5.341 0.712 -7.722 1.00 0.00 H new ATOM 0 HB3 ASP A 145 4.056 -0.476 -7.628 1.00 0.00 H new ATOM 341 N ILE A 146 2.490 1.384 -4.428 1.00 0.00 N ATOM 342 CA ILE A 146 1.166 1.323 -3.828 1.00 0.00 C ATOM 343 C ILE A 146 0.086 1.104 -4.879 1.00 0.00 C ATOM 344 O ILE A 146 -0.850 0.332 -4.674 1.00 0.00 O ATOM 345 CB ILE A 146 0.862 2.617 -3.058 1.00 0.00 C ATOM 346 CG1 ILE A 146 1.155 3.843 -3.939 1.00 0.00 C ATOM 347 CG2 ILE A 146 1.666 2.651 -1.767 1.00 0.00 C ATOM 348 CD1 ILE A 146 1.777 5.011 -3.200 1.00 0.00 C ATOM 0 H ILE A 146 3.040 2.195 -4.144 1.00 0.00 H new ATOM 0 HA ILE A 146 1.163 0.477 -3.141 1.00 0.00 H new ATOM 0 HB ILE A 146 -0.196 2.643 -2.798 1.00 0.00 H new ATOM 0 HG12 ILE A 146 1.822 3.543 -4.747 1.00 0.00 H new ATOM 0 HG13 ILE A 146 0.225 4.174 -4.400 1.00 0.00 H new ATOM 0 HG21 ILE A 146 1.446 3.571 -1.226 1.00 0.00 H new ATOM 0 HG22 ILE A 146 1.399 1.794 -1.149 1.00 0.00 H new ATOM 0 HG23 ILE A 146 2.730 2.613 -2.000 1.00 0.00 H new ATOM 0 HD11 ILE A 146 1.950 5.832 -3.896 1.00 0.00 H new ATOM 0 HD12 ILE A 146 1.103 5.342 -2.410 1.00 0.00 H new ATOM 0 HD13 ILE A 146 2.726 4.701 -2.762 1.00 0.00 H new ATOM 360 N ARG A 147 0.225 1.793 -6.003 1.00 0.00 N ATOM 361 CA ARG A 147 -0.735 1.688 -7.100 1.00 0.00 C ATOM 362 C ARG A 147 -1.021 0.231 -7.471 1.00 0.00 C ATOM 363 O ARG A 147 -2.065 -0.071 -8.049 1.00 0.00 O ATOM 364 CB ARG A 147 -0.217 2.443 -8.325 1.00 0.00 C ATOM 365 CG ARG A 147 -0.181 3.951 -8.139 1.00 0.00 C ATOM 366 CD ARG A 147 1.012 4.572 -8.849 1.00 0.00 C ATOM 367 NE ARG A 147 1.683 5.572 -8.020 1.00 0.00 N ATOM 368 CZ ARG A 147 2.497 6.509 -8.502 1.00 0.00 C ATOM 369 NH1 ARG A 147 2.744 6.579 -9.804 1.00 0.00 N ATOM 370 NH2 ARG A 147 3.065 7.378 -7.679 1.00 0.00 N ATOM 0 H ARG A 147 0.997 2.435 -6.182 1.00 0.00 H new ATOM 0 HA ARG A 147 -1.670 2.135 -6.762 1.00 0.00 H new ATOM 0 HB2 ARG A 147 0.787 2.090 -8.561 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -0.848 2.206 -9.181 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -1.102 4.388 -8.524 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -0.136 4.187 -7.076 1.00 0.00 H new ATOM 0 HD2 ARG A 147 1.721 3.789 -9.118 1.00 0.00 H new ATOM 0 HD3 ARG A 147 0.680 5.035 -9.778 1.00 0.00 H new ATOM 0 HE ARG A 147 1.518 5.551 -7.014 1.00 0.00 H new ATOM 0 HH11 ARG A 147 2.309 5.913 -10.442 1.00 0.00 H new ATOM 0 HH12 ARG A 147 3.369 7.299 -10.167 1.00 0.00 H new ATOM 0 HH21 ARG A 147 2.879 7.329 -6.677 1.00 0.00 H new ATOM 0 HH22 ARG A 147 3.689 8.096 -8.047 1.00 0.00 H new ATOM 384 N LEU A 148 -0.093 -0.669 -7.148 1.00 0.00 N ATOM 385 CA LEU A 148 -0.270 -2.086 -7.468 1.00 0.00 C ATOM 386 C LEU A 148 -0.252 -2.957 -6.215 1.00 0.00 C ATOM 387 O LEU A 148 0.073 -4.143 -6.283 1.00 0.00 O ATOM 388 CB LEU A 148 0.811 -2.564 -8.444 1.00 0.00 C ATOM 389 CG LEU A 148 2.204 -1.969 -8.230 1.00 0.00 C ATOM 390 CD1 LEU A 148 3.015 -2.832 -7.277 1.00 0.00 C ATOM 391 CD2 LEU A 148 2.927 -1.821 -9.561 1.00 0.00 C ATOM 0 H LEU A 148 0.780 -0.446 -6.670 1.00 0.00 H new ATOM 0 HA LEU A 148 -1.248 -2.186 -7.938 1.00 0.00 H new ATOM 0 HB2 LEU A 148 0.884 -3.649 -8.374 1.00 0.00 H new ATOM 0 HB3 LEU A 148 0.488 -2.331 -9.459 1.00 0.00 H new ATOM 0 HG LEU A 148 2.091 -0.981 -7.784 1.00 0.00 H new ATOM 0 HD11 LEU A 148 4.002 -2.392 -7.138 1.00 0.00 H new ATOM 0 HD12 LEU A 148 2.505 -2.890 -6.315 1.00 0.00 H new ATOM 0 HD13 LEU A 148 3.120 -3.834 -7.693 1.00 0.00 H new ATOM 0 HD21 LEU A 148 3.917 -1.396 -9.392 1.00 0.00 H new ATOM 0 HD22 LEU A 148 3.027 -2.799 -10.031 1.00 0.00 H new ATOM 0 HD23 LEU A 148 2.356 -1.161 -10.214 1.00 0.00 H new ATOM 403 N VAL A 149 -0.610 -2.377 -5.073 1.00 0.00 N ATOM 404 CA VAL A 149 -0.636 -3.129 -3.825 1.00 0.00 C ATOM 405 C VAL A 149 -2.024 -3.714 -3.571 1.00 0.00 C ATOM 406 O VAL A 149 -3.032 -3.169 -4.020 1.00 0.00 O ATOM 407 CB VAL A 149 -0.210 -2.255 -2.624 1.00 0.00 C ATOM 408 CG1 VAL A 149 -0.446 -2.983 -1.308 1.00 0.00 C ATOM 409 CG2 VAL A 149 1.252 -1.858 -2.757 1.00 0.00 C ATOM 0 H VAL A 149 -0.883 -1.398 -4.987 1.00 0.00 H new ATOM 0 HA VAL A 149 0.081 -3.944 -3.927 1.00 0.00 H new ATOM 0 HB VAL A 149 -0.822 -1.353 -2.624 1.00 0.00 H new ATOM 0 HG11 VAL A 149 -0.138 -2.346 -0.479 1.00 0.00 H new ATOM 0 HG12 VAL A 149 -1.505 -3.221 -1.209 1.00 0.00 H new ATOM 0 HG13 VAL A 149 0.136 -3.905 -1.293 1.00 0.00 H new ATOM 0 HG21 VAL A 149 1.541 -1.242 -1.905 1.00 0.00 H new ATOM 0 HG22 VAL A 149 1.871 -2.754 -2.784 1.00 0.00 H new ATOM 0 HG23 VAL A 149 1.393 -1.292 -3.678 1.00 0.00 H new ATOM 419 N GLN A 150 -2.064 -4.832 -2.852 1.00 0.00 N ATOM 420 CA GLN A 150 -3.322 -5.499 -2.545 1.00 0.00 C ATOM 421 C GLN A 150 -4.095 -4.747 -1.466 1.00 0.00 C ATOM 422 O GLN A 150 -4.082 -5.132 -0.297 1.00 0.00 O ATOM 423 CB GLN A 150 -3.062 -6.937 -2.092 1.00 0.00 C ATOM 424 CG GLN A 150 -4.145 -7.914 -2.517 1.00 0.00 C ATOM 425 CD GLN A 150 -3.581 -9.191 -3.108 1.00 0.00 C ATOM 426 OE1 GLN A 150 -3.628 -9.402 -4.320 1.00 0.00 O ATOM 427 NE2 GLN A 150 -3.043 -10.052 -2.252 1.00 0.00 N ATOM 0 H GLN A 150 -1.238 -5.294 -2.472 1.00 0.00 H new ATOM 0 HA GLN A 150 -3.925 -5.512 -3.453 1.00 0.00 H new ATOM 0 HB2 GLN A 150 -2.106 -7.269 -2.496 1.00 0.00 H new ATOM 0 HB3 GLN A 150 -2.973 -6.956 -1.006 1.00 0.00 H new ATOM 0 HG2 GLN A 150 -4.765 -8.160 -1.655 1.00 0.00 H new ATOM 0 HG3 GLN A 150 -4.794 -7.435 -3.250 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -3.025 -9.836 -1.255 1.00 0.00 H new ATOM 0 HE22 GLN A 150 -2.647 -10.929 -2.591 1.00 0.00 H new ATOM 436 N GLY A 151 -4.772 -3.677 -1.868 1.00 0.00 N ATOM 437 CA GLY A 151 -5.546 -2.893 -0.924 1.00 0.00 C ATOM 438 C GLY A 151 -6.788 -3.623 -0.450 1.00 0.00 C ATOM 439 O GLY A 151 -7.618 -4.040 -1.259 1.00 0.00 O ATOM 0 H GLY A 151 -4.799 -3.339 -2.830 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -4.923 -2.645 -0.065 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -5.836 -1.951 -1.390 1.00 0.00 H new ATOM 443 N THR A 152 -6.915 -3.782 0.863 1.00 0.00 N ATOM 444 CA THR A 152 -8.063 -4.471 1.442 1.00 0.00 C ATOM 445 C THR A 152 -9.103 -3.477 1.952 1.00 0.00 C ATOM 446 O THR A 152 -10.288 -3.797 2.043 1.00 0.00 O ATOM 447 CB THR A 152 -7.612 -5.382 2.585 1.00 0.00 C ATOM 448 OG1 THR A 152 -6.460 -4.857 3.220 1.00 0.00 O ATOM 449 CG2 THR A 152 -7.286 -6.791 2.135 1.00 0.00 C ATOM 0 H THR A 152 -6.238 -3.443 1.546 1.00 0.00 H new ATOM 0 HA THR A 152 -8.521 -5.075 0.659 1.00 0.00 H new ATOM 0 HB THR A 152 -8.457 -5.423 3.272 1.00 0.00 H new ATOM 0 HG1 THR A 152 -5.659 -5.146 2.735 1.00 0.00 H new ATOM 0 HG21 THR A 152 -6.973 -7.384 2.994 1.00 0.00 H new ATOM 0 HG22 THR A 152 -8.170 -7.243 1.685 1.00 0.00 H new ATOM 0 HG23 THR A 152 -6.480 -6.761 1.402 1.00 0.00 H new ATOM 457 N GLY A 153 -8.653 -2.270 2.286 1.00 0.00 N ATOM 458 CA GLY A 153 -9.561 -1.251 2.785 1.00 0.00 C ATOM 459 C GLY A 153 -10.750 -1.027 1.870 1.00 0.00 C ATOM 460 O GLY A 153 -10.774 -1.519 0.742 1.00 0.00 O ATOM 0 H GLY A 153 -7.677 -1.980 2.220 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -9.918 -1.541 3.773 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -9.018 -0.313 2.904 1.00 0.00 H new ATOM 464 N LYS A 154 -11.738 -0.284 2.359 1.00 0.00 N ATOM 465 CA LYS A 154 -12.937 0.003 1.579 1.00 0.00 C ATOM 466 C LYS A 154 -12.583 0.703 0.270 1.00 0.00 C ATOM 467 O LYS A 154 -11.677 1.536 0.226 1.00 0.00 O ATOM 468 CB LYS A 154 -13.902 0.869 2.390 1.00 0.00 C ATOM 469 CG LYS A 154 -15.364 0.506 2.189 1.00 0.00 C ATOM 470 CD LYS A 154 -16.280 1.670 2.531 1.00 0.00 C ATOM 471 CE LYS A 154 -16.132 2.084 3.986 1.00 0.00 C ATOM 472 NZ LYS A 154 -16.163 0.912 4.903 1.00 0.00 N ATOM 0 H LYS A 154 -11.732 0.130 3.291 1.00 0.00 H new ATOM 0 HA LYS A 154 -13.421 -0.945 1.342 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -13.656 0.778 3.448 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -13.755 1.914 2.117 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -15.526 0.206 1.154 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -15.616 -0.352 2.813 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -16.050 2.517 1.885 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -17.315 1.390 2.334 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -15.193 2.622 4.116 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -16.934 2.773 4.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -16.298 1.240 5.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -16.948 0.284 4.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -15.265 0.393 4.833 1.00 0.00 H new ATOM 486 N ASN A 155 -13.304 0.360 -0.793 1.00 0.00 N ATOM 487 CA ASN A 155 -13.065 0.955 -2.103 1.00 0.00 C ATOM 488 C ASN A 155 -11.641 0.682 -2.573 1.00 0.00 C ATOM 489 O ASN A 155 -11.048 1.488 -3.290 1.00 0.00 O ATOM 490 CB ASN A 155 -13.319 2.462 -2.054 1.00 0.00 C ATOM 491 CG ASN A 155 -13.686 3.031 -3.412 1.00 0.00 C ATOM 492 OD1 ASN A 155 -12.868 3.673 -4.070 1.00 0.00 O ATOM 493 ND2 ASN A 155 -14.922 2.797 -3.837 1.00 0.00 N ATOM 0 H ASN A 155 -14.058 -0.327 -0.773 1.00 0.00 H new ATOM 0 HA ASN A 155 -13.755 0.500 -2.813 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -14.122 2.670 -1.347 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -12.428 2.966 -1.681 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -15.226 3.155 -4.742 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -15.567 2.259 -3.258 1.00 0.00 H new ATOM 500 N GLY A 156 -11.097 -0.460 -2.165 1.00 0.00 N ATOM 501 CA GLY A 156 -9.745 -0.819 -2.554 1.00 0.00 C ATOM 502 C GLY A 156 -8.706 0.111 -1.959 1.00 0.00 C ATOM 503 O GLY A 156 -7.900 0.696 -2.684 1.00 0.00 O ATOM 0 H GLY A 156 -11.568 -1.143 -1.572 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -9.538 -1.841 -2.237 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -9.666 -0.800 -3.641 1.00 0.00 H new ATOM 507 N ARG A 157 -8.724 0.250 -0.638 1.00 0.00 N ATOM 508 CA ARG A 157 -7.774 1.115 0.053 1.00 0.00 C ATOM 509 C ARG A 157 -6.530 0.337 0.466 1.00 0.00 C ATOM 510 O ARG A 157 -6.626 -0.745 1.046 1.00 0.00 O ATOM 511 CB ARG A 157 -8.431 1.747 1.283 1.00 0.00 C ATOM 512 CG ARG A 157 -8.176 3.240 1.409 1.00 0.00 C ATOM 513 CD ARG A 157 -7.671 3.609 2.795 1.00 0.00 C ATOM 514 NE ARG A 157 -8.644 3.287 3.837 1.00 0.00 N ATOM 515 CZ ARG A 157 -9.707 4.038 4.114 1.00 0.00 C ATOM 516 NH1 ARG A 157 -9.937 5.154 3.434 1.00 0.00 N ATOM 517 NH2 ARG A 157 -10.543 3.673 5.077 1.00 0.00 N ATOM 0 H ARG A 157 -9.386 -0.225 -0.024 1.00 0.00 H new ATOM 0 HA ARG A 157 -7.472 1.905 -0.634 1.00 0.00 H new ATOM 0 HB2 ARG A 157 -9.506 1.573 1.240 1.00 0.00 H new ATOM 0 HB3 ARG A 157 -8.063 1.247 2.179 1.00 0.00 H new ATOM 0 HG2 ARG A 157 -7.445 3.549 0.661 1.00 0.00 H new ATOM 0 HG3 ARG A 157 -9.096 3.785 1.200 1.00 0.00 H new ATOM 0 HD2 ARG A 157 -6.739 3.080 2.994 1.00 0.00 H new ATOM 0 HD3 ARG A 157 -7.446 4.675 2.827 1.00 0.00 H new ATOM 0 HE ARG A 157 -8.500 2.438 4.383 1.00 0.00 H new ATOM 0 HH11 ARG A 157 -9.297 5.441 2.694 1.00 0.00 H new ATOM 0 HH12 ARG A 157 -10.754 5.725 3.652 1.00 0.00 H new ATOM 0 HH21 ARG A 157 -10.371 2.817 5.605 1.00 0.00 H new ATOM 0 HH22 ARG A 157 -11.358 4.248 5.290 1.00 0.00 H new ATOM 531 N VAL A 158 -5.362 0.894 0.165 1.00 0.00 N ATOM 532 CA VAL A 158 -4.098 0.251 0.506 1.00 0.00 C ATOM 533 C VAL A 158 -3.600 0.711 1.872 1.00 0.00 C ATOM 534 O VAL A 158 -3.431 1.906 2.112 1.00 0.00 O ATOM 535 CB VAL A 158 -3.013 0.544 -0.548 1.00 0.00 C ATOM 536 CG1 VAL A 158 -1.795 -0.336 -0.316 1.00 0.00 C ATOM 537 CG2 VAL A 158 -3.564 0.346 -1.952 1.00 0.00 C ATOM 0 H VAL A 158 -5.264 1.789 -0.314 1.00 0.00 H new ATOM 0 HA VAL A 158 -4.287 -0.822 0.531 1.00 0.00 H new ATOM 0 HB VAL A 158 -2.706 1.585 -0.448 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -1.038 -0.116 -1.069 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -1.388 -0.139 0.676 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -2.085 -1.384 -0.388 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -2.783 0.558 -2.682 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -3.901 -0.684 -2.069 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -4.404 1.022 -2.112 1.00 0.00 H new ATOM 547 N LEU A 159 -3.368 -0.246 2.764 1.00 0.00 N ATOM 548 CA LEU A 159 -2.890 0.060 4.108 1.00 0.00 C ATOM 549 C LEU A 159 -1.528 -0.576 4.364 1.00 0.00 C ATOM 550 O LEU A 159 -1.026 -1.351 3.548 1.00 0.00 O ATOM 551 CB LEU A 159 -3.897 -0.428 5.152 1.00 0.00 C ATOM 552 CG LEU A 159 -5.309 0.151 5.010 1.00 0.00 C ATOM 553 CD1 LEU A 159 -6.311 -0.947 4.688 1.00 0.00 C ATOM 554 CD2 LEU A 159 -5.715 0.890 6.278 1.00 0.00 C ATOM 0 H LEU A 159 -3.503 -1.240 2.581 1.00 0.00 H new ATOM 0 HA LEU A 159 -2.784 1.142 4.189 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -3.959 -1.515 5.095 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -3.518 -0.182 6.144 1.00 0.00 H new ATOM 0 HG LEU A 159 -5.304 0.862 4.184 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -7.307 -0.514 4.592 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -6.033 -1.430 3.751 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -6.312 -1.685 5.490 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -6.720 1.294 6.158 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -5.700 0.200 7.122 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -5.016 1.706 6.463 1.00 0.00 H new ATOM 566 N LYS A 160 -0.932 -0.245 5.506 1.00 0.00 N ATOM 567 CA LYS A 160 0.373 -0.787 5.871 1.00 0.00 C ATOM 568 C LYS A 160 0.384 -2.306 5.730 1.00 0.00 C ATOM 569 O LYS A 160 1.322 -2.886 5.180 1.00 0.00 O ATOM 570 CB LYS A 160 0.730 -0.393 7.304 1.00 0.00 C ATOM 571 CG LYS A 160 2.222 -0.230 7.538 1.00 0.00 C ATOM 572 CD LYS A 160 2.510 0.401 8.891 1.00 0.00 C ATOM 573 CE LYS A 160 3.969 0.236 9.283 1.00 0.00 C ATOM 574 NZ LYS A 160 4.512 1.464 9.928 1.00 0.00 N ATOM 0 H LYS A 160 -1.331 0.395 6.193 1.00 0.00 H new ATOM 0 HA LYS A 160 1.117 -0.369 5.193 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.228 0.543 7.550 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.345 -1.150 7.987 1.00 0.00 H new ATOM 0 HG2 LYS A 160 2.709 -1.203 7.479 1.00 0.00 H new ATOM 0 HG3 LYS A 160 2.649 0.389 6.749 1.00 0.00 H new ATOM 0 HD2 LYS A 160 2.258 1.461 8.860 1.00 0.00 H new ATOM 0 HD3 LYS A 160 1.874 -0.056 9.650 1.00 0.00 H new ATOM 0 HE2 LYS A 160 4.068 -0.607 9.966 1.00 0.00 H new ATOM 0 HE3 LYS A 160 4.559 -0.000 8.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 5.509 1.311 10.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 4.441 2.264 9.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 3.966 1.675 10.787 1.00 0.00 H new ATOM 588 N GLU A 161 -0.672 -2.943 6.227 1.00 0.00 N ATOM 589 CA GLU A 161 -0.795 -4.393 6.153 1.00 0.00 C ATOM 590 C GLU A 161 -0.780 -4.858 4.702 1.00 0.00 C ATOM 591 O GLU A 161 -0.234 -5.914 4.383 1.00 0.00 O ATOM 592 CB GLU A 161 -2.084 -4.854 6.837 1.00 0.00 C ATOM 593 CG GLU A 161 -2.246 -4.321 8.252 1.00 0.00 C ATOM 594 CD GLU A 161 -3.271 -5.100 9.053 1.00 0.00 C ATOM 595 OE1 GLU A 161 -2.984 -6.261 9.413 1.00 0.00 O ATOM 596 OE2 GLU A 161 -4.359 -4.549 9.321 1.00 0.00 O ATOM 0 H GLU A 161 -1.455 -2.477 6.685 1.00 0.00 H new ATOM 0 HA GLU A 161 0.056 -4.835 6.670 1.00 0.00 H new ATOM 0 HB2 GLU A 161 -2.937 -4.536 6.238 1.00 0.00 H new ATOM 0 HB3 GLU A 161 -2.102 -5.944 6.864 1.00 0.00 H new ATOM 0 HG2 GLU A 161 -1.284 -4.360 8.764 1.00 0.00 H new ATOM 0 HG3 GLU A 161 -2.543 -3.273 8.210 1.00 0.00 H new ATOM 603 N ASP A 162 -1.374 -4.055 3.825 1.00 0.00 N ATOM 604 CA ASP A 162 -1.422 -4.377 2.410 1.00 0.00 C ATOM 605 C ASP A 162 -0.021 -4.335 1.812 1.00 0.00 C ATOM 606 O ASP A 162 0.324 -5.149 0.956 1.00 0.00 O ATOM 607 CB ASP A 162 -2.341 -3.402 1.678 1.00 0.00 C ATOM 608 CG ASP A 162 -3.802 -3.619 2.020 1.00 0.00 C ATOM 609 OD1 ASP A 162 -4.208 -4.791 2.170 1.00 0.00 O ATOM 610 OD2 ASP A 162 -4.539 -2.618 2.140 1.00 0.00 O ATOM 0 H ASP A 162 -1.828 -3.176 4.073 1.00 0.00 H new ATOM 0 HA ASP A 162 -1.820 -5.385 2.293 1.00 0.00 H new ATOM 0 HB2 ASP A 162 -2.059 -2.380 1.932 1.00 0.00 H new ATOM 0 HB3 ASP A 162 -2.202 -3.513 0.603 1.00 0.00 H new ATOM 615 N ILE A 163 0.789 -3.390 2.281 1.00 0.00 N ATOM 616 CA ILE A 163 2.158 -3.257 1.802 1.00 0.00 C ATOM 617 C ILE A 163 2.965 -4.498 2.165 1.00 0.00 C ATOM 618 O ILE A 163 3.648 -5.079 1.320 1.00 0.00 O ATOM 619 CB ILE A 163 2.845 -2.017 2.402 1.00 0.00 C ATOM 620 CG1 ILE A 163 2.020 -0.757 2.122 1.00 0.00 C ATOM 621 CG2 ILE A 163 4.264 -1.871 1.858 1.00 0.00 C ATOM 622 CD1 ILE A 163 2.190 -0.215 0.720 1.00 0.00 C ATOM 0 H ILE A 163 0.521 -2.708 2.990 1.00 0.00 H new ATOM 0 HA ILE A 163 2.117 -3.144 0.719 1.00 0.00 H new ATOM 0 HB ILE A 163 2.909 -2.148 3.482 1.00 0.00 H new ATOM 0 HG12 ILE A 163 0.966 -0.979 2.290 1.00 0.00 H new ATOM 0 HG13 ILE A 163 2.301 0.016 2.837 1.00 0.00 H new ATOM 0 HG21 ILE A 163 4.732 -0.989 2.294 1.00 0.00 H new ATOM 0 HG22 ILE A 163 4.846 -2.756 2.117 1.00 0.00 H new ATOM 0 HG23 ILE A 163 4.229 -1.764 0.774 1.00 0.00 H new ATOM 0 HD11 ILE A 163 1.575 0.677 0.598 1.00 0.00 H new ATOM 0 HD12 ILE A 163 3.236 0.040 0.553 1.00 0.00 H new ATOM 0 HD13 ILE A 163 1.881 -0.971 -0.002 1.00 0.00 H new ATOM 634 N ASP A 164 2.873 -4.903 3.429 1.00 0.00 N ATOM 635 CA ASP A 164 3.588 -6.080 3.908 1.00 0.00 C ATOM 636 C ASP A 164 3.180 -7.315 3.114 1.00 0.00 C ATOM 637 O ASP A 164 4.019 -8.137 2.748 1.00 0.00 O ATOM 638 CB ASP A 164 3.312 -6.301 5.397 1.00 0.00 C ATOM 639 CG ASP A 164 3.951 -5.237 6.268 1.00 0.00 C ATOM 640 OD1 ASP A 164 3.364 -4.142 6.394 1.00 0.00 O ATOM 641 OD2 ASP A 164 5.037 -5.499 6.826 1.00 0.00 O ATOM 0 H ASP A 164 2.311 -4.433 4.139 1.00 0.00 H new ATOM 0 HA ASP A 164 4.656 -5.912 3.768 1.00 0.00 H new ATOM 0 HB2 ASP A 164 2.235 -6.307 5.567 1.00 0.00 H new ATOM 0 HB3 ASP A 164 3.687 -7.281 5.692 1.00 0.00 H new ATOM 646 N ALA A 165 1.883 -7.436 2.845 1.00 0.00 N ATOM 647 CA ALA A 165 1.363 -8.567 2.088 1.00 0.00 C ATOM 648 C ALA A 165 1.953 -8.591 0.683 1.00 0.00 C ATOM 649 O ALA A 165 2.325 -9.648 0.173 1.00 0.00 O ATOM 650 CB ALA A 165 -0.156 -8.508 2.025 1.00 0.00 C ATOM 0 H ALA A 165 1.174 -6.764 3.140 1.00 0.00 H new ATOM 0 HA ALA A 165 1.655 -9.485 2.598 1.00 0.00 H new ATOM 0 HB1 ALA A 165 -0.530 -9.359 1.456 1.00 0.00 H new ATOM 0 HB2 ALA A 165 -0.564 -8.539 3.035 1.00 0.00 H new ATOM 0 HB3 ALA A 165 -0.464 -7.583 1.538 1.00 0.00 H new ATOM 656 N PHE A 166 2.043 -7.417 0.066 1.00 0.00 N ATOM 657 CA PHE A 166 2.595 -7.299 -1.279 1.00 0.00 C ATOM 658 C PHE A 166 4.031 -7.809 -1.313 1.00 0.00 C ATOM 659 O PHE A 166 4.406 -8.585 -2.193 1.00 0.00 O ATOM 660 CB PHE A 166 2.544 -5.841 -1.745 1.00 0.00 C ATOM 661 CG PHE A 166 3.151 -5.616 -3.103 1.00 0.00 C ATOM 662 CD1 PHE A 166 4.527 -5.618 -3.268 1.00 0.00 C ATOM 663 CD2 PHE A 166 2.346 -5.399 -4.210 1.00 0.00 C ATOM 664 CE1 PHE A 166 5.088 -5.408 -4.514 1.00 0.00 C ATOM 665 CE2 PHE A 166 2.902 -5.188 -5.459 1.00 0.00 C ATOM 666 CZ PHE A 166 4.275 -5.192 -5.610 1.00 0.00 C ATOM 0 H PHE A 166 1.741 -6.533 0.476 1.00 0.00 H new ATOM 0 HA PHE A 166 1.994 -7.907 -1.954 1.00 0.00 H new ATOM 0 HB2 PHE A 166 1.505 -5.511 -1.762 1.00 0.00 H new ATOM 0 HB3 PHE A 166 3.064 -5.218 -1.017 1.00 0.00 H new ATOM 0 HD1 PHE A 166 5.167 -5.785 -2.415 1.00 0.00 H new ATOM 0 HD2 PHE A 166 1.272 -5.395 -4.096 1.00 0.00 H new ATOM 0 HE1 PHE A 166 6.162 -5.413 -4.631 1.00 0.00 H new ATOM 0 HE2 PHE A 166 2.264 -5.021 -6.314 1.00 0.00 H new ATOM 0 HZ PHE A 166 4.712 -5.027 -6.583 1.00 0.00 H new ATOM 676 N LEU A 167 4.831 -7.370 -0.347 1.00 0.00 N ATOM 677 CA LEU A 167 6.227 -7.782 -0.261 1.00 0.00 C ATOM 678 C LEU A 167 6.340 -9.204 0.275 1.00 0.00 C ATOM 679 O LEU A 167 6.634 -10.140 -0.469 1.00 0.00 O ATOM 680 CB LEU A 167 7.010 -6.822 0.636 1.00 0.00 C ATOM 681 CG LEU A 167 7.203 -5.416 0.065 1.00 0.00 C ATOM 682 CD1 LEU A 167 7.431 -4.413 1.185 1.00 0.00 C ATOM 683 CD2 LEU A 167 8.365 -5.395 -0.918 1.00 0.00 C ATOM 0 H LEU A 167 4.536 -6.728 0.388 1.00 0.00 H new ATOM 0 HA LEU A 167 6.651 -7.756 -1.265 1.00 0.00 H new ATOM 0 HB2 LEU A 167 6.495 -6.742 1.593 1.00 0.00 H new ATOM 0 HB3 LEU A 167 7.990 -7.254 0.837 1.00 0.00 H new ATOM 0 HG LEU A 167 6.296 -5.133 -0.470 1.00 0.00 H new ATOM 0 HD11 LEU A 167 7.566 -3.418 0.761 1.00 0.00 H new ATOM 0 HD12 LEU A 167 6.568 -4.409 1.851 1.00 0.00 H new ATOM 0 HD13 LEU A 167 8.322 -4.692 1.747 1.00 0.00 H new ATOM 0 HD21 LEU A 167 8.488 -4.387 -1.314 1.00 0.00 H new ATOM 0 HD22 LEU A 167 9.279 -5.698 -0.407 1.00 0.00 H new ATOM 0 HD23 LEU A 167 8.161 -6.085 -1.737 1.00 0.00 H new ATOM 695 N ALA A 168 6.102 -9.356 1.570 1.00 0.00 N ATOM 696 CA ALA A 168 6.175 -10.661 2.216 1.00 0.00 C ATOM 697 C ALA A 168 4.878 -11.440 2.025 1.00 0.00 C ATOM 698 O ALA A 168 3.814 -11.012 2.470 1.00 0.00 O ATOM 699 CB ALA A 168 6.481 -10.499 3.697 1.00 0.00 C ATOM 0 H ALA A 168 5.856 -8.590 2.197 1.00 0.00 H new ATOM 0 HA ALA A 168 6.981 -11.227 1.749 1.00 0.00 H new ATOM 0 HB1 ALA A 168 6.533 -11.481 4.167 1.00 0.00 H new ATOM 0 HB2 ALA A 168 7.436 -9.988 3.817 1.00 0.00 H new ATOM 0 HB3 ALA A 168 5.693 -9.912 4.169 1.00 0.00 H new ATOM 705 N GLY A 169 4.975 -12.587 1.358 1.00 0.00 N ATOM 706 CA GLY A 169 3.802 -13.406 1.119 1.00 0.00 C ATOM 707 C GLY A 169 3.719 -14.592 2.060 1.00 0.00 C ATOM 708 O GLY A 169 2.656 -14.885 2.607 1.00 0.00 O ATOM 0 H GLY A 169 5.845 -12.963 0.980 1.00 0.00 H new ATOM 0 HA2 GLY A 169 2.907 -12.794 1.231 1.00 0.00 H new ATOM 0 HA3 GLY A 169 3.816 -13.764 0.089 1.00 0.00 H new ATOM 712 N GLY A 170 4.843 -15.276 2.249 1.00 0.00 N ATOM 713 CA GLY A 170 4.872 -16.428 3.131 1.00 0.00 C ATOM 714 C GLY A 170 5.456 -16.102 4.491 1.00 0.00 C ATOM 715 O GLY A 170 4.752 -16.301 5.503 1.00 0.00 O ATOM 0 H GLY A 170 5.735 -15.053 1.807 1.00 0.00 H new ATOM 0 HA2 GLY A 170 3.859 -16.811 3.256 1.00 0.00 H new ATOM 0 HA3 GLY A 170 5.458 -17.222 2.668 1.00 0.00 H new ATOM 719 N ALA A 171 6.619 -15.648 4.544 1.00 0.00 N TER 720 ALA A 171