USER MOD reduce.3.24.130724 H: found=0, std=0, add=415, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 414 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 NoAdj-H: A 147 HIS HE2 : A 147 HIS NE2 : A 330 ZNZN :(H bumps) USER MOD NoAdj-H: A 169 HIS HE2 : A 169 HIS NE2 : A 530 ZNZN :(H bumps) USER MOD Set 1.1: A 141 ASN : amide:sc= -0.225 K(o=-0.71,f=-4!) USER MOD Set 1.2: A 157 GLN : amide:sc= -0.487! C(o=-0.71!,f=-4!) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot -23:sc= 0.456 USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 HIS : no HD1:sc=-0.00726 X(o=-0.0073,f=-0.0088) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 HIS : no HE2:sc= -3.12 K(o=-3.1,f=-5.8!) USER MOD Single : A 165 GLN : amide:sc= -0.263 X(o=-0.26,f=-0.27) USER MOD Single : A 166 SER OG : rot 180:sc= -0.0835 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 170 MET CE :methyl -161:sc= -0.0981 (180deg=-0.567) USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 177 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 179 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 180 GLN : amide:sc= -0.0367 K(o=-0.037,f=-1.6!) USER MOD Single : A 183 SER OG : rot 180:sc= 0 USER MOD Single : A 185 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 187 SER OG : rot 180:sc= 0 USER MOD Single : A 190 SER OG : rot -54:sc= 0.714 USER MOD Single : A 191 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 130 -20.472 18.021 -6.374 1.00 0.00 N ATOM 2 CA GLY A 130 -20.948 16.657 -6.522 1.00 0.00 C ATOM 3 C GLY A 130 -21.807 16.213 -5.355 1.00 0.00 C ATOM 4 O GLY A 130 -22.230 17.032 -4.539 1.00 0.00 O ATOM 0 HA2 GLY A 130 -21.523 16.574 -7.444 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -20.094 15.986 -6.617 1.00 0.00 H new ATOM 8 N SER A 131 -22.068 14.912 -5.276 1.00 0.00 N ATOM 9 CA SER A 131 -22.888 14.360 -4.204 1.00 0.00 C ATOM 10 C SER A 131 -22.133 14.382 -2.878 1.00 0.00 C ATOM 11 O SER A 131 -21.534 13.385 -2.476 1.00 0.00 O ATOM 12 CB SER A 131 -23.309 12.929 -4.540 1.00 0.00 C ATOM 13 OG SER A 131 -24.408 12.520 -3.744 1.00 0.00 O ATOM 0 H SER A 131 -21.723 14.220 -5.942 1.00 0.00 H new ATOM 0 HA SER A 131 -23.780 14.979 -4.106 1.00 0.00 H new ATOM 0 HB2 SER A 131 -23.576 12.863 -5.595 1.00 0.00 H new ATOM 0 HB3 SER A 131 -22.469 12.253 -4.381 1.00 0.00 H new ATOM 0 HG SER A 131 -24.659 11.602 -3.979 1.00 0.00 H new ATOM 19 N SER A 132 -22.168 15.527 -2.203 1.00 0.00 N ATOM 20 CA SER A 132 -21.485 15.681 -0.924 1.00 0.00 C ATOM 21 C SER A 132 -22.439 15.413 0.237 1.00 0.00 C ATOM 22 O SER A 132 -23.203 16.287 0.642 1.00 0.00 O ATOM 23 CB SER A 132 -20.899 17.089 -0.802 1.00 0.00 C ATOM 24 OG SER A 132 -19.776 17.248 -1.651 1.00 0.00 O ATOM 0 H SER A 132 -22.662 16.361 -2.521 1.00 0.00 H new ATOM 0 HA SER A 132 -20.675 14.953 -0.882 1.00 0.00 H new ATOM 0 HB2 SER A 132 -21.660 17.827 -1.058 1.00 0.00 H new ATOM 0 HB3 SER A 132 -20.607 17.277 0.231 1.00 0.00 H new ATOM 0 HG SER A 132 -19.420 18.156 -1.556 1.00 0.00 H new ATOM 30 N GLY A 133 -22.387 14.194 0.767 1.00 0.00 N ATOM 31 CA GLY A 133 -23.250 13.831 1.876 1.00 0.00 C ATOM 32 C GLY A 133 -23.694 12.383 1.815 1.00 0.00 C ATOM 33 O GLY A 133 -24.867 12.096 1.575 1.00 0.00 O ATOM 0 H GLY A 133 -21.763 13.452 0.448 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -22.724 14.007 2.814 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -24.128 14.477 1.876 1.00 0.00 H new ATOM 37 N SER A 134 -22.754 11.468 2.030 1.00 0.00 N ATOM 38 CA SER A 134 -23.053 10.041 1.993 1.00 0.00 C ATOM 39 C SER A 134 -22.004 9.245 2.763 1.00 0.00 C ATOM 40 O SER A 134 -20.870 9.092 2.309 1.00 0.00 O ATOM 41 CB SER A 134 -23.121 9.551 0.545 1.00 0.00 C ATOM 42 OG SER A 134 -23.652 8.239 0.476 1.00 0.00 O ATOM 0 H SER A 134 -21.779 11.689 2.232 1.00 0.00 H new ATOM 0 HA SER A 134 -24.022 9.885 2.468 1.00 0.00 H new ATOM 0 HB2 SER A 134 -23.740 10.229 -0.043 1.00 0.00 H new ATOM 0 HB3 SER A 134 -22.124 9.567 0.105 1.00 0.00 H new ATOM 0 HG SER A 134 -23.687 7.949 -0.459 1.00 0.00 H new ATOM 48 N SER A 135 -22.391 8.742 3.930 1.00 0.00 N ATOM 49 CA SER A 135 -21.483 7.965 4.766 1.00 0.00 C ATOM 50 C SER A 135 -20.087 8.580 4.769 1.00 0.00 C ATOM 51 O SER A 135 -19.084 7.871 4.701 1.00 0.00 O ATOM 52 CB SER A 135 -21.415 6.518 4.274 1.00 0.00 C ATOM 53 OG SER A 135 -20.611 6.413 3.112 1.00 0.00 O ATOM 0 H SER A 135 -23.327 8.858 4.319 1.00 0.00 H new ATOM 0 HA SER A 135 -21.868 7.976 5.786 1.00 0.00 H new ATOM 0 HB2 SER A 135 -21.009 5.882 5.060 1.00 0.00 H new ATOM 0 HB3 SER A 135 -22.420 6.156 4.059 1.00 0.00 H new ATOM 0 HG SER A 135 -20.571 7.283 2.662 1.00 0.00 H new ATOM 59 N GLY A 136 -20.031 9.906 4.849 1.00 0.00 N ATOM 60 CA GLY A 136 -18.754 10.595 4.859 1.00 0.00 C ATOM 61 C GLY A 136 -17.744 9.959 3.925 1.00 0.00 C ATOM 62 O GLY A 136 -16.941 9.125 4.343 1.00 0.00 O ATOM 0 H GLY A 136 -20.847 10.515 4.907 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -18.904 11.636 4.572 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -18.354 10.598 5.873 1.00 0.00 H new ATOM 66 N ASP A 137 -17.785 10.351 2.656 1.00 0.00 N ATOM 67 CA ASP A 137 -16.867 9.813 1.659 1.00 0.00 C ATOM 68 C ASP A 137 -15.694 10.761 1.433 1.00 0.00 C ATOM 69 O ASP A 137 -15.710 11.576 0.511 1.00 0.00 O ATOM 70 CB ASP A 137 -17.600 9.566 0.340 1.00 0.00 C ATOM 71 CG ASP A 137 -18.627 8.456 0.448 1.00 0.00 C ATOM 72 OD1 ASP A 137 -18.337 7.441 1.115 1.00 0.00 O ATOM 73 OD2 ASP A 137 -19.722 8.602 -0.135 1.00 0.00 O ATOM 0 H ASP A 137 -18.444 11.040 2.294 1.00 0.00 H new ATOM 0 HA ASP A 137 -16.479 8.866 2.033 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -18.094 10.485 0.025 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -16.875 9.312 -0.433 1.00 0.00 H new ATOM 78 N ARG A 138 -14.677 10.649 2.282 1.00 0.00 N ATOM 79 CA ARG A 138 -13.496 11.498 2.176 1.00 0.00 C ATOM 80 C ARG A 138 -12.224 10.694 2.429 1.00 0.00 C ATOM 81 O ARG A 138 -12.273 9.586 2.965 1.00 0.00 O ATOM 82 CB ARG A 138 -13.585 12.657 3.170 1.00 0.00 C ATOM 83 CG ARG A 138 -13.311 12.249 4.608 1.00 0.00 C ATOM 84 CD ARG A 138 -14.543 11.639 5.258 1.00 0.00 C ATOM 85 NE ARG A 138 -14.193 10.729 6.346 1.00 0.00 N ATOM 86 CZ ARG A 138 -15.060 10.312 7.262 1.00 0.00 C ATOM 87 NH1 ARG A 138 -16.320 10.721 7.222 1.00 0.00 N ATOM 88 NH2 ARG A 138 -14.666 9.484 8.221 1.00 0.00 N ATOM 0 H ARG A 138 -14.647 9.979 3.050 1.00 0.00 H new ATOM 0 HA ARG A 138 -13.457 11.899 1.163 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -12.873 13.430 2.879 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -14.579 13.100 3.110 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -12.491 11.531 4.634 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -12.990 13.120 5.180 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -15.182 12.434 5.642 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -15.121 11.101 4.507 1.00 0.00 H new ATOM 0 HE ARG A 138 -13.231 10.396 6.405 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -16.626 11.358 6.486 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -16.983 10.399 7.927 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -13.697 9.167 8.255 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -15.332 9.164 8.924 1.00 0.00 H new ATOM 102 N CYS A 139 -11.086 11.258 2.038 1.00 0.00 N ATOM 103 CA CYS A 139 -9.801 10.595 2.220 1.00 0.00 C ATOM 104 C CYS A 139 -9.744 9.879 3.567 1.00 0.00 C ATOM 105 O CYS A 139 -9.818 10.511 4.621 1.00 0.00 O ATOM 106 CB CYS A 139 -8.661 11.610 2.121 1.00 0.00 C ATOM 107 SG CYS A 139 -7.079 11.020 2.805 1.00 0.00 S ATOM 0 H CYS A 139 -11.028 12.174 1.593 1.00 0.00 H new ATOM 0 HA CYS A 139 -9.688 9.854 1.429 1.00 0.00 H new ATOM 0 HB2 CYS A 139 -8.515 11.876 1.074 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -8.953 12.521 2.643 1.00 0.00 H new ATOM 112 N TYR A 140 -9.612 8.558 3.524 1.00 0.00 N ATOM 113 CA TYR A 140 -9.548 7.756 4.739 1.00 0.00 C ATOM 114 C TYR A 140 -8.131 7.735 5.304 1.00 0.00 C ATOM 115 O TYR A 140 -7.655 6.705 5.779 1.00 0.00 O ATOM 116 CB TYR A 140 -10.018 6.328 4.459 1.00 0.00 C ATOM 117 CG TYR A 140 -9.504 5.767 3.153 1.00 0.00 C ATOM 118 CD1 TYR A 140 -8.177 5.375 3.017 1.00 0.00 C ATOM 119 CD2 TYR A 140 -10.343 5.629 2.054 1.00 0.00 C ATOM 120 CE1 TYR A 140 -7.703 4.862 1.825 1.00 0.00 C ATOM 121 CE2 TYR A 140 -9.877 5.116 0.859 1.00 0.00 C ATOM 122 CZ TYR A 140 -8.556 4.734 0.749 1.00 0.00 C ATOM 123 OH TYR A 140 -8.088 4.224 -0.440 1.00 0.00 O ATOM 0 H TYR A 140 -9.547 8.020 2.660 1.00 0.00 H new ATOM 0 HA TYR A 140 -10.208 8.210 5.478 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -9.695 5.681 5.275 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -11.108 6.308 4.449 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -7.506 5.473 3.857 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -11.378 5.928 2.135 1.00 0.00 H new ATOM 0 HE1 TYR A 140 -6.669 4.563 1.736 1.00 0.00 H new ATOM 0 HE2 TYR A 140 -10.543 5.015 0.015 1.00 0.00 H new ATOM 0 HH TYR A 140 -8.817 4.200 -1.095 1.00 0.00 H new ATOM 133 N ASN A 141 -7.462 8.882 5.248 1.00 0.00 N ATOM 134 CA ASN A 141 -6.099 8.998 5.753 1.00 0.00 C ATOM 135 C ASN A 141 -5.955 10.218 6.658 1.00 0.00 C ATOM 136 O ASN A 141 -5.633 10.094 7.840 1.00 0.00 O ATOM 137 CB ASN A 141 -5.108 9.091 4.591 1.00 0.00 C ATOM 138 CG ASN A 141 -3.695 8.728 5.005 1.00 0.00 C ATOM 139 OD1 ASN A 141 -3.188 9.215 6.016 1.00 0.00 O ATOM 140 ND2 ASN A 141 -3.052 7.868 4.224 1.00 0.00 N ATOM 0 H ASN A 141 -7.842 9.745 4.858 1.00 0.00 H new ATOM 0 HA ASN A 141 -5.879 8.106 6.339 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -5.430 8.428 3.788 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -5.117 10.104 4.190 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -2.099 7.586 4.452 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -3.511 7.489 3.396 1.00 0.00 H new ATOM 147 N CYS A 142 -6.197 11.397 6.095 1.00 0.00 N ATOM 148 CA CYS A 142 -6.095 12.640 6.849 1.00 0.00 C ATOM 149 C CYS A 142 -7.477 13.237 7.103 1.00 0.00 C ATOM 150 O CYS A 142 -7.788 13.655 8.217 1.00 0.00 O ATOM 151 CB CYS A 142 -5.224 13.648 6.096 1.00 0.00 C ATOM 152 SG CYS A 142 -6.005 14.336 4.601 1.00 0.00 S ATOM 0 H CYS A 142 -6.465 11.517 5.118 1.00 0.00 H new ATOM 0 HA CYS A 142 -5.632 12.416 7.810 1.00 0.00 H new ATOM 0 HB2 CYS A 142 -4.970 14.467 6.769 1.00 0.00 H new ATOM 0 HB3 CYS A 142 -4.289 13.165 5.814 1.00 0.00 H new ATOM 157 N GLY A 143 -8.302 13.272 6.061 1.00 0.00 N ATOM 158 CA GLY A 143 -9.640 13.818 6.192 1.00 0.00 C ATOM 159 C GLY A 143 -9.901 14.951 5.220 1.00 0.00 C ATOM 160 O GLY A 143 -10.547 15.939 5.566 1.00 0.00 O ATOM 0 H GLY A 143 -8.067 12.932 5.128 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -10.370 13.026 6.026 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -9.785 14.177 7.211 1.00 0.00 H new ATOM 164 N GLY A 144 -9.395 14.810 3.998 1.00 0.00 N ATOM 165 CA GLY A 144 -9.587 15.838 2.992 1.00 0.00 C ATOM 166 C GLY A 144 -10.790 15.571 2.111 1.00 0.00 C ATOM 167 O GLY A 144 -10.966 14.460 1.608 1.00 0.00 O ATOM 0 H GLY A 144 -8.856 14.002 3.687 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -9.707 16.804 3.483 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -8.694 15.905 2.371 1.00 0.00 H new ATOM 171 N LEU A 145 -11.623 16.589 1.924 1.00 0.00 N ATOM 172 CA LEU A 145 -12.818 16.458 1.098 1.00 0.00 C ATOM 173 C LEU A 145 -12.522 16.833 -0.351 1.00 0.00 C ATOM 174 O LEU A 145 -13.025 16.202 -1.281 1.00 0.00 O ATOM 175 CB LEU A 145 -13.940 17.341 1.646 1.00 0.00 C ATOM 176 CG LEU A 145 -14.324 17.108 3.108 1.00 0.00 C ATOM 177 CD1 LEU A 145 -15.159 18.266 3.632 1.00 0.00 C ATOM 178 CD2 LEU A 145 -15.078 15.794 3.257 1.00 0.00 C ATOM 0 H LEU A 145 -11.493 17.514 2.333 1.00 0.00 H new ATOM 0 HA LEU A 145 -13.137 15.416 1.127 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -13.644 18.384 1.531 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -14.827 17.191 1.030 1.00 0.00 H new ATOM 0 HG LEU A 145 -13.410 17.050 3.699 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -15.423 18.082 4.674 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -14.585 19.190 3.560 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -16.068 18.357 3.038 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -15.344 15.644 4.303 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -15.985 15.824 2.653 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -14.446 14.972 2.921 1.00 0.00 H new ATOM 190 N ASP A 146 -11.703 17.863 -0.535 1.00 0.00 N ATOM 191 CA ASP A 146 -11.337 18.320 -1.871 1.00 0.00 C ATOM 192 C ASP A 146 -10.570 17.238 -2.624 1.00 0.00 C ATOM 193 O ASP A 146 -10.892 16.917 -3.769 1.00 0.00 O ATOM 194 CB ASP A 146 -10.495 19.594 -1.784 1.00 0.00 C ATOM 195 CG ASP A 146 -9.280 19.425 -0.892 1.00 0.00 C ATOM 196 OD1 ASP A 146 -9.449 19.424 0.345 1.00 0.00 O ATOM 197 OD2 ASP A 146 -8.161 19.295 -1.432 1.00 0.00 O ATOM 0 H ASP A 146 -11.280 18.397 0.224 1.00 0.00 H new ATOM 0 HA ASP A 146 -12.254 18.537 -2.419 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -10.171 19.881 -2.784 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -11.111 20.408 -1.403 1.00 0.00 H new ATOM 202 N HIS A 147 -9.552 16.680 -1.976 1.00 0.00 N ATOM 203 CA HIS A 147 -8.738 15.635 -2.585 1.00 0.00 C ATOM 204 C HIS A 147 -9.191 14.254 -2.120 1.00 0.00 C ATOM 205 O HIS A 147 -9.849 14.120 -1.087 1.00 0.00 O ATOM 206 CB HIS A 147 -7.263 15.843 -2.243 1.00 0.00 C ATOM 207 CG HIS A 147 -6.912 15.449 -0.841 1.00 0.00 C ATOM 208 ND1 HIS A 147 -6.633 16.366 0.151 1.00 0.00 N ATOM 209 CD2 HIS A 147 -6.796 14.229 -0.267 1.00 0.00 C ATOM 210 CE1 HIS A 147 -6.360 15.726 1.274 1.00 0.00 C ATOM 211 NE2 HIS A 147 -6.452 14.428 1.047 1.00 0.00 N ATOM 0 H HIS A 147 -9.272 16.935 -1.029 1.00 0.00 H new ATOM 0 HA HIS A 147 -8.864 15.695 -3.666 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -6.653 15.266 -2.938 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -7.009 16.892 -2.391 1.00 0.00 H new ATOM 0 HD1 HIS A 147 -6.637 17.379 0.036 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -6.946 13.276 -0.752 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -6.105 16.186 2.217 1.00 0.00 H new ATOM 219 N HIS A 148 -8.834 13.229 -2.888 1.00 0.00 N ATOM 220 CA HIS A 148 -9.203 11.858 -2.554 1.00 0.00 C ATOM 221 C HIS A 148 -8.039 11.128 -1.891 1.00 0.00 C ATOM 222 O HIS A 148 -6.876 11.467 -2.109 1.00 0.00 O ATOM 223 CB HIS A 148 -9.643 11.106 -3.810 1.00 0.00 C ATOM 224 CG HIS A 148 -10.956 11.574 -4.359 1.00 0.00 C ATOM 225 ND1 HIS A 148 -12.081 10.778 -4.399 1.00 0.00 N ATOM 226 CD2 HIS A 148 -11.320 12.764 -4.891 1.00 0.00 C ATOM 227 CE1 HIS A 148 -13.080 11.458 -4.934 1.00 0.00 C ATOM 228 NE2 HIS A 148 -12.644 12.666 -5.241 1.00 0.00 N ATOM 0 H HIS A 148 -8.290 13.322 -3.746 1.00 0.00 H new ATOM 0 HA HIS A 148 -10.035 11.893 -1.850 1.00 0.00 H new ATOM 0 HB2 HIS A 148 -8.877 11.218 -4.577 1.00 0.00 H new ATOM 0 HB3 HIS A 148 -9.712 10.043 -3.581 1.00 0.00 H new ATOM 0 HD2 HIS A 148 -10.687 13.630 -5.017 1.00 0.00 H new ATOM 0 HE1 HIS A 148 -14.082 11.089 -5.093 1.00 0.00 H new ATOM 0 HE2 HIS A 148 -13.200 13.406 -5.669 1.00 0.00 H new ATOM 236 N ALA A 149 -8.360 10.125 -1.081 1.00 0.00 N ATOM 237 CA ALA A 149 -7.342 9.346 -0.388 1.00 0.00 C ATOM 238 C ALA A 149 -6.156 9.057 -1.301 1.00 0.00 C ATOM 239 O ALA A 149 -5.001 9.243 -0.916 1.00 0.00 O ATOM 240 CB ALA A 149 -7.936 8.048 0.137 1.00 0.00 C ATOM 0 H ALA A 149 -9.318 9.833 -0.888 1.00 0.00 H new ATOM 0 HA ALA A 149 -6.982 9.934 0.456 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -7.164 7.477 0.652 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -8.745 8.273 0.832 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -8.325 7.463 -0.696 1.00 0.00 H new ATOM 246 N LYS A 150 -6.447 8.599 -2.514 1.00 0.00 N ATOM 247 CA LYS A 150 -5.405 8.284 -3.484 1.00 0.00 C ATOM 248 C LYS A 150 -4.571 9.520 -3.807 1.00 0.00 C ATOM 249 O LYS A 150 -3.345 9.496 -3.701 1.00 0.00 O ATOM 250 CB LYS A 150 -6.026 7.725 -4.766 1.00 0.00 C ATOM 251 CG LYS A 150 -5.000 7.286 -5.797 1.00 0.00 C ATOM 252 CD LYS A 150 -5.666 6.714 -7.038 1.00 0.00 C ATOM 253 CE LYS A 150 -6.358 7.799 -7.849 1.00 0.00 C ATOM 254 NZ LYS A 150 -7.213 7.227 -8.925 1.00 0.00 N ATOM 0 H LYS A 150 -7.397 8.438 -2.849 1.00 0.00 H new ATOM 0 HA LYS A 150 -4.751 7.530 -3.046 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -6.660 6.876 -4.512 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -6.671 8.484 -5.208 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -4.377 8.136 -6.076 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -4.340 6.537 -5.359 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -4.919 6.216 -7.657 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -6.394 5.957 -6.746 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -6.969 8.413 -7.187 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -5.609 8.456 -8.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -7.667 7.998 -9.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -6.626 6.662 -9.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -7.944 6.621 -8.502 1.00 0.00 H new ATOM 268 N GLU A 151 -5.244 10.596 -4.201 1.00 0.00 N ATOM 269 CA GLU A 151 -4.563 11.841 -4.539 1.00 0.00 C ATOM 270 C GLU A 151 -3.698 12.321 -3.376 1.00 0.00 C ATOM 271 O GLU A 151 -2.588 12.814 -3.576 1.00 0.00 O ATOM 272 CB GLU A 151 -5.581 12.921 -4.911 1.00 0.00 C ATOM 273 CG GLU A 151 -6.289 12.660 -6.230 1.00 0.00 C ATOM 274 CD GLU A 151 -5.344 12.182 -7.315 1.00 0.00 C ATOM 275 OE1 GLU A 151 -4.220 12.720 -7.402 1.00 0.00 O ATOM 276 OE2 GLU A 151 -5.728 11.270 -8.077 1.00 0.00 O ATOM 0 H GLU A 151 -6.259 10.631 -4.294 1.00 0.00 H new ATOM 0 HA GLU A 151 -3.917 11.651 -5.396 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -6.325 12.997 -4.118 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -5.073 13.884 -4.965 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -7.069 11.914 -6.078 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -6.783 13.574 -6.560 1.00 0.00 H new ATOM 283 N CYS A 152 -4.216 12.173 -2.161 1.00 0.00 N ATOM 284 CA CYS A 152 -3.494 12.591 -0.966 1.00 0.00 C ATOM 285 C CYS A 152 -1.995 12.357 -1.126 1.00 0.00 C ATOM 286 O CYS A 152 -1.569 11.469 -1.865 1.00 0.00 O ATOM 287 CB CYS A 152 -4.011 11.835 0.259 1.00 0.00 C ATOM 288 SG CYS A 152 -3.637 12.645 1.847 1.00 0.00 S ATOM 0 H CYS A 152 -5.134 11.766 -1.979 1.00 0.00 H new ATOM 0 HA CYS A 152 -3.664 13.658 -0.824 1.00 0.00 H new ATOM 0 HB2 CYS A 152 -5.091 11.716 0.170 1.00 0.00 H new ATOM 0 HB3 CYS A 152 -3.579 10.834 0.264 1.00 0.00 H new ATOM 293 N LYS A 153 -1.198 13.159 -0.428 1.00 0.00 N ATOM 294 CA LYS A 153 0.254 13.040 -0.490 1.00 0.00 C ATOM 295 C LYS A 153 0.788 12.265 0.710 1.00 0.00 C ATOM 296 O LYS A 153 1.701 11.449 0.579 1.00 0.00 O ATOM 297 CB LYS A 153 0.898 14.427 -0.543 1.00 0.00 C ATOM 298 CG LYS A 153 0.641 15.168 -1.843 1.00 0.00 C ATOM 299 CD LYS A 153 1.562 14.687 -2.951 1.00 0.00 C ATOM 300 CE LYS A 153 1.562 15.646 -4.132 1.00 0.00 C ATOM 301 NZ LYS A 153 2.175 15.034 -5.343 1.00 0.00 N ATOM 0 H LYS A 153 -1.534 13.899 0.188 1.00 0.00 H new ATOM 0 HA LYS A 153 0.510 12.492 -1.397 1.00 0.00 H new ATOM 0 HB2 LYS A 153 0.521 15.025 0.287 1.00 0.00 H new ATOM 0 HB3 LYS A 153 1.974 14.325 -0.400 1.00 0.00 H new ATOM 0 HG2 LYS A 153 -0.397 15.026 -2.144 1.00 0.00 H new ATOM 0 HG3 LYS A 153 0.785 16.237 -1.688 1.00 0.00 H new ATOM 0 HD2 LYS A 153 2.576 14.585 -2.564 1.00 0.00 H new ATOM 0 HD3 LYS A 153 1.247 13.698 -3.284 1.00 0.00 H new ATOM 0 HE2 LYS A 153 0.538 15.947 -4.356 1.00 0.00 H new ATOM 0 HE3 LYS A 153 2.109 16.550 -3.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 2.156 15.719 -6.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 3.160 14.770 -5.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 1.638 14.185 -5.613 1.00 0.00 H new ATOM 315 N LEU A 154 0.212 12.524 1.879 1.00 0.00 N ATOM 316 CA LEU A 154 0.630 11.849 3.104 1.00 0.00 C ATOM 317 C LEU A 154 0.966 10.386 2.832 1.00 0.00 C ATOM 318 O LEU A 154 0.490 9.783 1.869 1.00 0.00 O ATOM 319 CB LEU A 154 -0.471 11.943 4.162 1.00 0.00 C ATOM 320 CG LEU A 154 -0.679 13.320 4.793 1.00 0.00 C ATOM 321 CD1 LEU A 154 -1.881 13.303 5.725 1.00 0.00 C ATOM 322 CD2 LEU A 154 0.571 13.758 5.541 1.00 0.00 C ATOM 0 H LEU A 154 -0.545 13.196 2.005 1.00 0.00 H new ATOM 0 HA LEU A 154 1.526 12.345 3.476 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -1.411 11.627 3.709 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -0.246 11.232 4.956 1.00 0.00 H new ATOM 0 HG LEU A 154 -0.872 14.038 3.996 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -2.014 14.291 6.165 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -2.774 13.033 5.162 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -1.717 12.572 6.517 1.00 0.00 H new ATOM 0 HD21 LEU A 154 0.405 14.740 5.984 1.00 0.00 H new ATOM 0 HD22 LEU A 154 0.795 13.038 6.328 1.00 0.00 H new ATOM 0 HD23 LEU A 154 1.410 13.810 4.848 1.00 0.00 H new ATOM 334 N PRO A 155 1.804 9.800 3.700 1.00 0.00 N ATOM 335 CA PRO A 155 2.220 8.400 3.576 1.00 0.00 C ATOM 336 C PRO A 155 1.082 7.429 3.868 1.00 0.00 C ATOM 337 O PRO A 155 0.354 7.566 4.851 1.00 0.00 O ATOM 338 CB PRO A 155 3.323 8.264 4.628 1.00 0.00 C ATOM 339 CG PRO A 155 3.018 9.318 5.636 1.00 0.00 C ATOM 340 CD PRO A 155 2.409 10.459 4.869 1.00 0.00 C ATOM 0 HA PRO A 155 2.545 8.159 2.564 1.00 0.00 H new ATOM 0 HB2 PRO A 155 3.319 7.272 5.079 1.00 0.00 H new ATOM 0 HB3 PRO A 155 4.310 8.410 4.188 1.00 0.00 H new ATOM 0 HG2 PRO A 155 2.329 8.945 6.394 1.00 0.00 H new ATOM 0 HG3 PRO A 155 3.922 9.635 6.155 1.00 0.00 H new ATOM 0 HD2 PRO A 155 1.664 10.989 5.462 1.00 0.00 H new ATOM 0 HD3 PRO A 155 3.161 11.191 4.573 1.00 0.00 H new ATOM 348 N PRO A 156 0.923 6.422 2.995 1.00 0.00 N ATOM 349 CA PRO A 156 -0.125 5.407 3.140 1.00 0.00 C ATOM 350 C PRO A 156 0.130 4.475 4.319 1.00 0.00 C ATOM 351 O PRO A 156 1.248 3.999 4.515 1.00 0.00 O ATOM 352 CB PRO A 156 -0.053 4.633 1.821 1.00 0.00 C ATOM 353 CG PRO A 156 1.346 4.824 1.346 1.00 0.00 C ATOM 354 CD PRO A 156 1.755 6.197 1.801 1.00 0.00 C ATOM 0 HA PRO A 156 -1.100 5.853 3.336 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -0.280 3.577 1.969 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -0.773 5.016 1.097 1.00 0.00 H new ATOM 0 HG2 PRO A 156 2.006 4.063 1.761 1.00 0.00 H new ATOM 0 HG3 PRO A 156 1.405 4.739 0.261 1.00 0.00 H new ATOM 0 HD2 PRO A 156 2.818 6.242 2.038 1.00 0.00 H new ATOM 0 HD3 PRO A 156 1.567 6.947 1.033 1.00 0.00 H new ATOM 362 N GLN A 157 -0.914 4.218 5.101 1.00 0.00 N ATOM 363 CA GLN A 157 -0.802 3.343 6.261 1.00 0.00 C ATOM 364 C GLN A 157 -0.061 2.058 5.905 1.00 0.00 C ATOM 365 O GLN A 157 -0.019 1.638 4.748 1.00 0.00 O ATOM 366 CB GLN A 157 -2.190 3.009 6.811 1.00 0.00 C ATOM 367 CG GLN A 157 -2.848 4.165 7.545 1.00 0.00 C ATOM 368 CD GLN A 157 -2.955 5.414 6.692 1.00 0.00 C ATOM 369 OE1 GLN A 157 -3.361 5.353 5.531 1.00 0.00 O ATOM 370 NE2 GLN A 157 -2.590 6.555 7.263 1.00 0.00 N ATOM 0 H GLN A 157 -1.846 4.604 4.952 1.00 0.00 H new ATOM 0 HA GLN A 157 -0.232 3.869 7.027 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -2.833 2.700 5.987 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -2.108 2.159 7.488 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -3.844 3.864 7.869 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -2.276 4.392 8.444 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -2.259 6.560 8.228 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -2.640 7.427 6.737 1.00 0.00 H new ATOM 379 N PRO A 158 0.539 1.419 6.920 1.00 0.00 N ATOM 380 CA PRO A 158 1.290 0.173 6.737 1.00 0.00 C ATOM 381 C PRO A 158 0.383 -1.006 6.402 1.00 0.00 C ATOM 382 O PRO A 158 0.821 -2.157 6.395 1.00 0.00 O ATOM 383 CB PRO A 158 1.961 -0.038 8.097 1.00 0.00 C ATOM 384 CG PRO A 158 1.088 0.681 9.066 1.00 0.00 C ATOM 385 CD PRO A 158 0.531 1.863 8.324 1.00 0.00 C ATOM 0 HA PRO A 158 1.991 0.237 5.905 1.00 0.00 H new ATOM 0 HB2 PRO A 158 2.035 -1.098 8.342 1.00 0.00 H new ATOM 0 HB3 PRO A 158 2.975 0.363 8.105 1.00 0.00 H new ATOM 0 HG2 PRO A 158 0.288 0.034 9.425 1.00 0.00 H new ATOM 0 HG3 PRO A 158 1.656 1.001 9.940 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -0.475 2.111 8.661 1.00 0.00 H new ATOM 0 HD3 PRO A 158 1.144 2.753 8.468 1.00 0.00 H new ATOM 393 N LYS A 159 -0.883 -0.713 6.124 1.00 0.00 N ATOM 394 CA LYS A 159 -1.852 -1.748 5.785 1.00 0.00 C ATOM 395 C LYS A 159 -1.437 -2.488 4.517 1.00 0.00 C ATOM 396 O LYS A 159 -0.542 -2.049 3.794 1.00 0.00 O ATOM 397 CB LYS A 159 -3.241 -1.134 5.599 1.00 0.00 C ATOM 398 CG LYS A 159 -3.838 -0.579 6.881 1.00 0.00 C ATOM 399 CD LYS A 159 -5.278 -0.138 6.680 1.00 0.00 C ATOM 400 CE LYS A 159 -6.235 -1.318 6.737 1.00 0.00 C ATOM 401 NZ LYS A 159 -6.634 -1.641 8.135 1.00 0.00 N ATOM 0 H LYS A 159 -1.262 0.234 6.127 1.00 0.00 H new ATOM 0 HA LYS A 159 -1.885 -2.463 6.607 1.00 0.00 H new ATOM 0 HB2 LYS A 159 -3.180 -0.334 4.861 1.00 0.00 H new ATOM 0 HB3 LYS A 159 -3.912 -1.891 5.194 1.00 0.00 H new ATOM 0 HG2 LYS A 159 -3.795 -1.338 7.662 1.00 0.00 H new ATOM 0 HG3 LYS A 159 -3.242 0.267 7.225 1.00 0.00 H new ATOM 0 HD2 LYS A 159 -5.548 0.588 7.447 1.00 0.00 H new ATOM 0 HD3 LYS A 159 -5.375 0.364 5.717 1.00 0.00 H new ATOM 0 HE2 LYS A 159 -7.124 -1.093 6.148 1.00 0.00 H new ATOM 0 HE3 LYS A 159 -5.764 -2.190 6.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 -7.287 -2.451 8.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 -5.788 -1.880 8.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 -7.106 -0.818 8.560 1.00 0.00 H new ATOM 415 N LYS A 160 -2.095 -3.611 4.251 1.00 0.00 N ATOM 416 CA LYS A 160 -1.797 -4.411 3.069 1.00 0.00 C ATOM 417 C LYS A 160 -2.404 -3.781 1.819 1.00 0.00 C ATOM 418 O LYS A 160 -3.235 -2.877 1.908 1.00 0.00 O ATOM 419 CB LYS A 160 -2.328 -5.835 3.244 1.00 0.00 C ATOM 420 CG LYS A 160 -3.843 -5.914 3.331 1.00 0.00 C ATOM 421 CD LYS A 160 -4.314 -7.335 3.586 1.00 0.00 C ATOM 422 CE LYS A 160 -5.668 -7.358 4.279 1.00 0.00 C ATOM 423 NZ LYS A 160 -6.295 -8.708 4.227 1.00 0.00 N ATOM 0 H LYS A 160 -2.839 -3.988 4.838 1.00 0.00 H new ATOM 0 HA LYS A 160 -0.714 -4.446 2.948 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -1.988 -6.446 2.407 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -1.898 -6.266 4.148 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -4.197 -5.264 4.131 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -4.281 -5.546 2.403 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -4.379 -7.873 2.640 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -3.581 -7.858 4.200 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -5.549 -7.053 5.319 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -6.330 -6.632 3.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -7.216 -8.682 4.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -6.432 -8.989 3.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -5.676 -9.397 4.700 1.00 0.00 H new ATOM 437 N CYS A 161 -1.986 -4.266 0.655 1.00 0.00 N ATOM 438 CA CYS A 161 -2.489 -3.752 -0.613 1.00 0.00 C ATOM 439 C CYS A 161 -4.011 -3.652 -0.594 1.00 0.00 C ATOM 440 O CYS A 161 -4.707 -4.649 -0.401 1.00 0.00 O ATOM 441 CB CYS A 161 -2.040 -4.652 -1.766 1.00 0.00 C ATOM 442 SG CYS A 161 -2.790 -4.233 -3.372 1.00 0.00 S ATOM 0 H CYS A 161 -1.300 -5.015 0.564 1.00 0.00 H new ATOM 0 HA CYS A 161 -2.079 -2.753 -0.760 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -0.955 -4.593 -1.857 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -2.284 -5.686 -1.522 1.00 0.00 H new ATOM 447 N HIS A 162 -4.522 -2.442 -0.797 1.00 0.00 N ATOM 448 CA HIS A 162 -5.962 -2.211 -0.805 1.00 0.00 C ATOM 449 C HIS A 162 -6.544 -2.451 -2.194 1.00 0.00 C ATOM 450 O HIS A 162 -7.533 -1.829 -2.580 1.00 0.00 O ATOM 451 CB HIS A 162 -6.274 -0.786 -0.348 1.00 0.00 C ATOM 452 CG HIS A 162 -6.032 0.248 -1.405 1.00 0.00 C ATOM 453 ND1 HIS A 162 -6.997 0.643 -2.306 1.00 0.00 N ATOM 454 CD2 HIS A 162 -4.926 0.971 -1.699 1.00 0.00 C ATOM 455 CE1 HIS A 162 -6.495 1.563 -3.111 1.00 0.00 C ATOM 456 NE2 HIS A 162 -5.240 1.780 -2.763 1.00 0.00 N ATOM 0 H HIS A 162 -3.960 -1.606 -0.958 1.00 0.00 H new ATOM 0 HA HIS A 162 -6.421 -2.916 -0.112 1.00 0.00 H new ATOM 0 HB2 HIS A 162 -7.316 -0.734 -0.032 1.00 0.00 H new ATOM 0 HB3 HIS A 162 -5.665 -0.551 0.525 1.00 0.00 H new ATOM 0 HD1 HIS A 162 -7.950 0.282 -2.345 1.00 0.00 H new ATOM 0 HD2 HIS A 162 -3.974 0.921 -1.191 1.00 0.00 H new ATOM 0 HE1 HIS A 162 -7.022 2.054 -3.916 1.00 0.00 H new ATOM 464 N PHE A 163 -5.922 -3.357 -2.942 1.00 0.00 N ATOM 465 CA PHE A 163 -6.377 -3.678 -4.290 1.00 0.00 C ATOM 466 C PHE A 163 -6.667 -5.170 -4.425 1.00 0.00 C ATOM 467 O PHE A 163 -7.738 -5.567 -4.886 1.00 0.00 O ATOM 468 CB PHE A 163 -5.327 -3.256 -5.320 1.00 0.00 C ATOM 469 CG PHE A 163 -5.874 -3.115 -6.711 1.00 0.00 C ATOM 470 CD1 PHE A 163 -6.397 -1.908 -7.146 1.00 0.00 C ATOM 471 CD2 PHE A 163 -5.867 -4.191 -7.585 1.00 0.00 C ATOM 472 CE1 PHE A 163 -6.901 -1.775 -8.426 1.00 0.00 C ATOM 473 CE2 PHE A 163 -6.369 -4.064 -8.866 1.00 0.00 C ATOM 474 CZ PHE A 163 -6.888 -2.855 -9.287 1.00 0.00 C ATOM 0 H PHE A 163 -5.102 -3.882 -2.638 1.00 0.00 H new ATOM 0 HA PHE A 163 -7.299 -3.128 -4.476 1.00 0.00 H new ATOM 0 HB2 PHE A 163 -4.889 -2.306 -5.012 1.00 0.00 H new ATOM 0 HB3 PHE A 163 -4.522 -3.990 -5.328 1.00 0.00 H new ATOM 0 HD1 PHE A 163 -6.411 -1.061 -6.477 1.00 0.00 H new ATOM 0 HD2 PHE A 163 -5.465 -5.139 -7.261 1.00 0.00 H new ATOM 0 HE1 PHE A 163 -7.304 -0.828 -8.753 1.00 0.00 H new ATOM 0 HE2 PHE A 163 -6.356 -4.910 -9.538 1.00 0.00 H new ATOM 0 HZ PHE A 163 -7.283 -2.754 -10.287 1.00 0.00 H new ATOM 484 N CYS A 164 -5.705 -5.993 -4.021 1.00 0.00 N ATOM 485 CA CYS A 164 -5.854 -7.441 -4.097 1.00 0.00 C ATOM 486 C CYS A 164 -5.450 -8.099 -2.781 1.00 0.00 C ATOM 487 O CYS A 164 -5.071 -9.270 -2.752 1.00 0.00 O ATOM 488 CB CYS A 164 -5.008 -8.003 -5.241 1.00 0.00 C ATOM 489 SG CYS A 164 -3.211 -7.888 -4.964 1.00 0.00 S ATOM 0 H CYS A 164 -4.813 -5.681 -3.637 1.00 0.00 H new ATOM 0 HA CYS A 164 -6.904 -7.663 -4.287 1.00 0.00 H new ATOM 0 HB2 CYS A 164 -5.275 -9.048 -5.396 1.00 0.00 H new ATOM 0 HB3 CYS A 164 -5.258 -7.471 -6.159 1.00 0.00 H new ATOM 494 N GLN A 165 -5.534 -7.338 -1.694 1.00 0.00 N ATOM 495 CA GLN A 165 -5.177 -7.847 -0.376 1.00 0.00 C ATOM 496 C GLN A 165 -3.882 -8.650 -0.435 1.00 0.00 C ATOM 497 O GLN A 165 -3.738 -9.666 0.246 1.00 0.00 O ATOM 498 CB GLN A 165 -6.305 -8.717 0.181 1.00 0.00 C ATOM 499 CG GLN A 165 -7.523 -7.923 0.625 1.00 0.00 C ATOM 500 CD GLN A 165 -8.391 -7.486 -0.539 1.00 0.00 C ATOM 501 OE1 GLN A 165 -8.932 -8.315 -1.271 1.00 0.00 O ATOM 502 NE2 GLN A 165 -8.528 -6.177 -0.717 1.00 0.00 N ATOM 0 H GLN A 165 -5.846 -6.367 -1.701 1.00 0.00 H new ATOM 0 HA GLN A 165 -5.025 -6.994 0.286 1.00 0.00 H new ATOM 0 HB2 GLN A 165 -6.608 -9.436 -0.580 1.00 0.00 H new ATOM 0 HB3 GLN A 165 -5.927 -9.290 1.028 1.00 0.00 H new ATOM 0 HG2 GLN A 165 -8.117 -8.529 1.309 1.00 0.00 H new ATOM 0 HG3 GLN A 165 -7.196 -7.044 1.180 1.00 0.00 H new ATOM 0 HE21 GLN A 165 -8.062 -5.525 -0.086 1.00 0.00 H new ATOM 0 HE22 GLN A 165 -9.100 -5.824 -1.484 1.00 0.00 H new ATOM 511 N SER A 166 -2.942 -8.189 -1.254 1.00 0.00 N ATOM 512 CA SER A 166 -1.660 -8.867 -1.405 1.00 0.00 C ATOM 513 C SER A 166 -0.631 -8.308 -0.427 1.00 0.00 C ATOM 514 O SER A 166 0.174 -7.446 -0.782 1.00 0.00 O ATOM 515 CB SER A 166 -1.149 -8.722 -2.840 1.00 0.00 C ATOM 516 OG SER A 166 0.230 -9.041 -2.924 1.00 0.00 O ATOM 0 H SER A 166 -3.044 -7.349 -1.823 1.00 0.00 H new ATOM 0 HA SER A 166 -1.807 -9.924 -1.184 1.00 0.00 H new ATOM 0 HB2 SER A 166 -1.718 -9.377 -3.500 1.00 0.00 H new ATOM 0 HB3 SER A 166 -1.311 -7.701 -3.186 1.00 0.00 H new ATOM 0 HG SER A 166 0.533 -8.942 -3.851 1.00 0.00 H new ATOM 522 N ILE A 167 -0.663 -8.804 0.805 1.00 0.00 N ATOM 523 CA ILE A 167 0.267 -8.355 1.834 1.00 0.00 C ATOM 524 C ILE A 167 1.700 -8.347 1.313 1.00 0.00 C ATOM 525 O ILE A 167 2.571 -7.683 1.875 1.00 0.00 O ATOM 526 CB ILE A 167 0.193 -9.248 3.087 1.00 0.00 C ATOM 527 CG1 ILE A 167 0.550 -10.693 2.733 1.00 0.00 C ATOM 528 CG2 ILE A 167 -1.195 -9.176 3.707 1.00 0.00 C ATOM 529 CD1 ILE A 167 0.785 -11.571 3.942 1.00 0.00 C ATOM 0 H ILE A 167 -1.323 -9.517 1.115 1.00 0.00 H new ATOM 0 HA ILE A 167 -0.025 -7.340 2.103 1.00 0.00 H new ATOM 0 HB ILE A 167 0.916 -8.884 3.817 1.00 0.00 H new ATOM 0 HG12 ILE A 167 -0.254 -11.121 2.134 1.00 0.00 H new ATOM 0 HG13 ILE A 167 1.446 -10.696 2.112 1.00 0.00 H new ATOM 0 HG21 ILE A 167 -1.232 -9.812 4.591 1.00 0.00 H new ATOM 0 HG22 ILE A 167 -1.414 -8.147 3.991 1.00 0.00 H new ATOM 0 HG23 ILE A 167 -1.935 -9.518 2.983 1.00 0.00 H new ATOM 0 HD11 ILE A 167 1.033 -12.581 3.616 1.00 0.00 H new ATOM 0 HD12 ILE A 167 1.609 -11.167 4.531 1.00 0.00 H new ATOM 0 HD13 ILE A 167 -0.118 -11.599 4.552 1.00 0.00 H new ATOM 541 N SER A 168 1.937 -9.087 0.235 1.00 0.00 N ATOM 542 CA SER A 168 3.265 -9.166 -0.361 1.00 0.00 C ATOM 543 C SER A 168 3.716 -7.799 -0.867 1.00 0.00 C ATOM 544 O SER A 168 4.599 -7.169 -0.284 1.00 0.00 O ATOM 545 CB SER A 168 3.272 -10.176 -1.511 1.00 0.00 C ATOM 546 OG SER A 168 4.481 -10.103 -2.246 1.00 0.00 O ATOM 0 H SER A 168 1.226 -9.641 -0.244 1.00 0.00 H new ATOM 0 HA SER A 168 3.962 -9.497 0.409 1.00 0.00 H new ATOM 0 HB2 SER A 168 3.144 -11.183 -1.115 1.00 0.00 H new ATOM 0 HB3 SER A 168 2.428 -9.984 -2.173 1.00 0.00 H new ATOM 0 HG SER A 168 4.462 -10.759 -2.974 1.00 0.00 H new ATOM 552 N HIS A 169 3.103 -7.347 -1.956 1.00 0.00 N ATOM 553 CA HIS A 169 3.441 -6.054 -2.542 1.00 0.00 C ATOM 554 C HIS A 169 2.453 -4.981 -2.094 1.00 0.00 C ATOM 555 O HIS A 169 1.487 -5.268 -1.388 1.00 0.00 O ATOM 556 CB HIS A 169 3.451 -6.149 -4.068 1.00 0.00 C ATOM 557 CG HIS A 169 2.091 -6.340 -4.665 1.00 0.00 C ATOM 558 ND1 HIS A 169 1.811 -7.310 -5.604 1.00 0.00 N ATOM 559 CD2 HIS A 169 0.929 -5.680 -4.451 1.00 0.00 C ATOM 560 CE1 HIS A 169 0.536 -7.237 -5.943 1.00 0.00 C ATOM 561 NE2 HIS A 169 -0.022 -6.256 -5.257 1.00 0.00 N ATOM 0 H HIS A 169 2.370 -7.856 -2.451 1.00 0.00 H new ATOM 0 HA HIS A 169 4.436 -5.775 -2.197 1.00 0.00 H new ATOM 0 HB2 HIS A 169 3.894 -5.241 -4.477 1.00 0.00 H new ATOM 0 HB3 HIS A 169 4.090 -6.979 -4.368 1.00 0.00 H new ATOM 0 HD1 HIS A 169 2.483 -7.979 -5.979 1.00 0.00 H new ATOM 0 HD2 HIS A 169 0.778 -4.854 -3.772 1.00 0.00 H new ATOM 0 HE1 HIS A 169 0.035 -7.872 -6.659 1.00 0.00 H new ATOM 569 N MET A 170 2.704 -3.743 -2.508 1.00 0.00 N ATOM 570 CA MET A 170 1.837 -2.627 -2.149 1.00 0.00 C ATOM 571 C MET A 170 1.079 -2.113 -3.369 1.00 0.00 C ATOM 572 O MET A 170 1.579 -2.172 -4.492 1.00 0.00 O ATOM 573 CB MET A 170 2.657 -1.494 -1.528 1.00 0.00 C ATOM 574 CG MET A 170 3.045 -1.747 -0.081 1.00 0.00 C ATOM 575 SD MET A 170 1.633 -1.680 1.039 1.00 0.00 S ATOM 576 CE MET A 170 1.228 0.063 0.969 1.00 0.00 C ATOM 0 H MET A 170 3.500 -3.488 -3.092 1.00 0.00 H new ATOM 0 HA MET A 170 1.112 -2.984 -1.417 1.00 0.00 H new ATOM 0 HB2 MET A 170 3.562 -1.346 -2.118 1.00 0.00 H new ATOM 0 HB3 MET A 170 2.084 -0.568 -1.585 1.00 0.00 H new ATOM 0 HG2 MET A 170 3.520 -2.725 -0.002 1.00 0.00 H new ATOM 0 HG3 MET A 170 3.784 -1.007 0.228 1.00 0.00 H new ATOM 0 HE1 MET A 170 0.620 0.330 1.833 1.00 0.00 H new ATOM 0 HE2 MET A 170 2.146 0.650 0.976 1.00 0.00 H new ATOM 0 HE3 MET A 170 0.671 0.271 0.055 1.00 0.00 H new ATOM 586 N VAL A 171 -0.129 -1.608 -3.140 1.00 0.00 N ATOM 587 CA VAL A 171 -0.955 -1.083 -4.221 1.00 0.00 C ATOM 588 C VAL A 171 -0.148 -0.164 -5.132 1.00 0.00 C ATOM 589 O VAL A 171 -0.408 -0.080 -6.332 1.00 0.00 O ATOM 590 CB VAL A 171 -2.169 -0.309 -3.674 1.00 0.00 C ATOM 591 CG1 VAL A 171 -1.730 1.019 -3.075 1.00 0.00 C ATOM 592 CG2 VAL A 171 -3.201 -0.093 -4.771 1.00 0.00 C ATOM 0 H VAL A 171 -0.557 -1.551 -2.216 1.00 0.00 H new ATOM 0 HA VAL A 171 -1.308 -1.940 -4.795 1.00 0.00 H new ATOM 0 HB VAL A 171 -2.630 -0.902 -2.884 1.00 0.00 H new ATOM 0 HG11 VAL A 171 -2.601 1.552 -2.694 1.00 0.00 H new ATOM 0 HG12 VAL A 171 -1.030 0.837 -2.259 1.00 0.00 H new ATOM 0 HG13 VAL A 171 -1.244 1.621 -3.842 1.00 0.00 H new ATOM 0 HG21 VAL A 171 -4.052 0.455 -4.367 1.00 0.00 H new ATOM 0 HG22 VAL A 171 -2.754 0.479 -5.584 1.00 0.00 H new ATOM 0 HG23 VAL A 171 -3.538 -1.058 -5.149 1.00 0.00 H new ATOM 602 N ALA A 172 0.831 0.522 -4.554 1.00 0.00 N ATOM 603 CA ALA A 172 1.678 1.433 -5.314 1.00 0.00 C ATOM 604 C ALA A 172 2.379 0.707 -6.457 1.00 0.00 C ATOM 605 O ALA A 172 2.567 1.265 -7.538 1.00 0.00 O ATOM 606 CB ALA A 172 2.700 2.091 -4.399 1.00 0.00 C ATOM 0 H ALA A 172 1.058 0.465 -3.561 1.00 0.00 H new ATOM 0 HA ALA A 172 1.042 2.206 -5.745 1.00 0.00 H new ATOM 0 HB1 ALA A 172 3.326 2.769 -4.980 1.00 0.00 H new ATOM 0 HB2 ALA A 172 2.183 2.652 -3.620 1.00 0.00 H new ATOM 0 HB3 ALA A 172 3.324 1.324 -3.940 1.00 0.00 H new ATOM 612 N SER A 173 2.763 -0.542 -6.211 1.00 0.00 N ATOM 613 CA SER A 173 3.448 -1.343 -7.219 1.00 0.00 C ATOM 614 C SER A 173 2.477 -2.304 -7.899 1.00 0.00 C ATOM 615 O SER A 173 2.660 -2.671 -9.060 1.00 0.00 O ATOM 616 CB SER A 173 4.598 -2.127 -6.583 1.00 0.00 C ATOM 617 OG SER A 173 5.645 -1.261 -6.183 1.00 0.00 O ATOM 0 H SER A 173 2.611 -1.021 -5.323 1.00 0.00 H new ATOM 0 HA SER A 173 3.852 -0.667 -7.973 1.00 0.00 H new ATOM 0 HB2 SER A 173 4.231 -2.682 -5.720 1.00 0.00 H new ATOM 0 HB3 SER A 173 4.980 -2.860 -7.294 1.00 0.00 H new ATOM 0 HG SER A 173 6.367 -1.786 -5.778 1.00 0.00 H new ATOM 623 N CYS A 174 1.444 -2.709 -7.168 1.00 0.00 N ATOM 624 CA CYS A 174 0.444 -3.627 -7.698 1.00 0.00 C ATOM 625 C CYS A 174 0.211 -3.377 -9.185 1.00 0.00 C ATOM 626 O CYS A 174 -0.144 -2.277 -9.607 1.00 0.00 O ATOM 627 CB CYS A 174 -0.872 -3.479 -6.932 1.00 0.00 C ATOM 628 SG CYS A 174 -2.076 -4.806 -7.258 1.00 0.00 S ATOM 0 H CYS A 174 1.278 -2.415 -6.205 1.00 0.00 H new ATOM 0 HA CYS A 174 0.817 -4.643 -7.572 1.00 0.00 H new ATOM 0 HB2 CYS A 174 -0.657 -3.453 -5.864 1.00 0.00 H new ATOM 0 HB3 CYS A 174 -1.324 -2.521 -7.190 1.00 0.00 H new ATOM 633 N PRO A 175 0.415 -4.423 -10.000 1.00 0.00 N ATOM 634 CA PRO A 175 0.232 -4.343 -11.452 1.00 0.00 C ATOM 635 C PRO A 175 -1.235 -4.198 -11.844 1.00 0.00 C ATOM 636 O PRO A 175 -1.596 -3.309 -12.616 1.00 0.00 O ATOM 637 CB PRO A 175 0.790 -5.677 -11.954 1.00 0.00 C ATOM 638 CG PRO A 175 0.649 -6.606 -10.798 1.00 0.00 C ATOM 639 CD PRO A 175 0.839 -5.765 -9.566 1.00 0.00 C ATOM 0 HA PRO A 175 0.728 -3.471 -11.878 1.00 0.00 H new ATOM 0 HB2 PRO A 175 0.236 -6.037 -12.821 1.00 0.00 H new ATOM 0 HB3 PRO A 175 1.832 -5.580 -12.259 1.00 0.00 H new ATOM 0 HG2 PRO A 175 -0.331 -7.083 -10.798 1.00 0.00 H new ATOM 0 HG3 PRO A 175 1.391 -7.403 -10.845 1.00 0.00 H new ATOM 0 HD2 PRO A 175 0.235 -6.128 -8.735 1.00 0.00 H new ATOM 0 HD3 PRO A 175 1.877 -5.770 -9.232 1.00 0.00 H new ATOM 647 N LEU A 176 -2.075 -5.076 -11.308 1.00 0.00 N ATOM 648 CA LEU A 176 -3.504 -5.046 -11.602 1.00 0.00 C ATOM 649 C LEU A 176 -4.038 -3.618 -11.560 1.00 0.00 C ATOM 650 O LEU A 176 -4.851 -3.223 -12.396 1.00 0.00 O ATOM 651 CB LEU A 176 -4.269 -5.918 -10.605 1.00 0.00 C ATOM 652 CG LEU A 176 -3.791 -7.365 -10.475 1.00 0.00 C ATOM 653 CD1 LEU A 176 -4.306 -7.983 -9.184 1.00 0.00 C ATOM 654 CD2 LEU A 176 -4.239 -8.184 -11.677 1.00 0.00 C ATOM 0 H LEU A 176 -1.792 -5.818 -10.668 1.00 0.00 H new ATOM 0 HA LEU A 176 -3.651 -5.441 -12.607 1.00 0.00 H new ATOM 0 HB2 LEU A 176 -4.212 -5.448 -9.623 1.00 0.00 H new ATOM 0 HB3 LEU A 176 -5.320 -5.928 -10.893 1.00 0.00 H new ATOM 0 HG LEU A 176 -2.701 -7.367 -10.445 1.00 0.00 H new ATOM 0 HD11 LEU A 176 -3.956 -9.013 -9.109 1.00 0.00 H new ATOM 0 HD12 LEU A 176 -3.936 -7.411 -8.334 1.00 0.00 H new ATOM 0 HD13 LEU A 176 -5.396 -7.969 -9.184 1.00 0.00 H new ATOM 0 HD21 LEU A 176 -3.890 -9.211 -11.568 1.00 0.00 H new ATOM 0 HD22 LEU A 176 -5.327 -8.175 -11.738 1.00 0.00 H new ATOM 0 HD23 LEU A 176 -3.821 -7.754 -12.587 1.00 0.00 H new ATOM 666 N LYS A 177 -3.574 -2.846 -10.583 1.00 0.00 N ATOM 667 CA LYS A 177 -4.001 -1.460 -10.433 1.00 0.00 C ATOM 668 C LYS A 177 -3.519 -0.613 -11.606 1.00 0.00 C ATOM 669 O LYS A 177 -4.265 0.209 -12.138 1.00 0.00 O ATOM 670 CB LYS A 177 -3.471 -0.881 -9.120 1.00 0.00 C ATOM 671 CG LYS A 177 -3.680 0.617 -8.987 1.00 0.00 C ATOM 672 CD LYS A 177 -2.636 1.249 -8.082 1.00 0.00 C ATOM 673 CE LYS A 177 -2.719 2.767 -8.109 1.00 0.00 C ATOM 674 NZ LYS A 177 -1.993 3.383 -6.964 1.00 0.00 N ATOM 0 H LYS A 177 -2.901 -3.157 -9.882 1.00 0.00 H new ATOM 0 HA LYS A 177 -5.091 -1.441 -10.417 1.00 0.00 H new ATOM 0 HB2 LYS A 177 -3.963 -1.383 -8.287 1.00 0.00 H new ATOM 0 HB3 LYS A 177 -2.406 -1.099 -9.040 1.00 0.00 H new ATOM 0 HG2 LYS A 177 -3.636 1.080 -9.973 1.00 0.00 H new ATOM 0 HG3 LYS A 177 -4.675 0.812 -8.587 1.00 0.00 H new ATOM 0 HD2 LYS A 177 -2.776 0.894 -7.061 1.00 0.00 H new ATOM 0 HD3 LYS A 177 -1.641 0.933 -8.396 1.00 0.00 H new ATOM 0 HE2 LYS A 177 -2.301 3.137 -9.045 1.00 0.00 H new ATOM 0 HE3 LYS A 177 -3.765 3.074 -8.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 177 -2.073 4.418 -7.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 177 -2.408 3.050 -6.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 177 -0.990 3.111 -7.002 1.00 0.00 H new ATOM 688 N ALA A 178 -2.268 -0.819 -12.005 1.00 0.00 N ATOM 689 CA ALA A 178 -1.689 -0.076 -13.117 1.00 0.00 C ATOM 690 C ALA A 178 -2.367 -0.440 -14.433 1.00 0.00 C ATOM 691 O ALA A 178 -2.916 0.423 -15.118 1.00 0.00 O ATOM 692 CB ALA A 178 -0.192 -0.336 -13.203 1.00 0.00 C ATOM 0 H ALA A 178 -1.636 -1.494 -11.574 1.00 0.00 H new ATOM 0 HA ALA A 178 -1.853 0.986 -12.936 1.00 0.00 H new ATOM 0 HB1 ALA A 178 0.227 0.225 -14.038 1.00 0.00 H new ATOM 0 HB2 ALA A 178 0.286 -0.019 -12.276 1.00 0.00 H new ATOM 0 HB3 ALA A 178 -0.016 -1.401 -13.357 1.00 0.00 H new ATOM 698 N GLN A 179 -2.324 -1.722 -14.781 1.00 0.00 N ATOM 699 CA GLN A 179 -2.933 -2.199 -16.017 1.00 0.00 C ATOM 700 C GLN A 179 -4.397 -1.779 -16.099 1.00 0.00 C ATOM 701 O GLN A 179 -5.234 -2.261 -15.337 1.00 0.00 O ATOM 702 CB GLN A 179 -2.821 -3.722 -16.111 1.00 0.00 C ATOM 703 CG GLN A 179 -1.440 -4.206 -16.522 1.00 0.00 C ATOM 704 CD GLN A 179 -1.272 -4.283 -18.026 1.00 0.00 C ATOM 705 OE1 GLN A 179 -1.507 -5.326 -18.636 1.00 0.00 O ATOM 706 NE2 GLN A 179 -0.862 -3.175 -18.634 1.00 0.00 N ATOM 0 H GLN A 179 -1.874 -2.449 -14.225 1.00 0.00 H new ATOM 0 HA GLN A 179 -2.397 -1.750 -16.854 1.00 0.00 H new ATOM 0 HB2 GLN A 179 -3.077 -4.157 -15.145 1.00 0.00 H new ATOM 0 HB3 GLN A 179 -3.554 -4.088 -16.830 1.00 0.00 H new ATOM 0 HG2 GLN A 179 -0.687 -3.535 -16.110 1.00 0.00 H new ATOM 0 HG3 GLN A 179 -1.261 -5.190 -16.089 1.00 0.00 H new ATOM 0 HE21 GLN A 179 -0.679 -2.332 -18.089 1.00 0.00 H new ATOM 0 HE22 GLN A 179 -0.731 -3.167 -19.645 1.00 0.00 H new ATOM 715 N GLN A 180 -4.697 -0.877 -17.028 1.00 0.00 N ATOM 716 CA GLN A 180 -6.060 -0.392 -17.209 1.00 0.00 C ATOM 717 C GLN A 180 -6.814 -1.249 -18.220 1.00 0.00 C ATOM 718 O GLN A 180 -8.033 -1.396 -18.138 1.00 0.00 O ATOM 719 CB GLN A 180 -6.048 1.068 -17.667 1.00 0.00 C ATOM 720 CG GLN A 180 -5.245 1.299 -18.937 1.00 0.00 C ATOM 721 CD GLN A 180 -5.566 2.626 -19.597 1.00 0.00 C ATOM 722 OE1 GLN A 180 -6.629 3.204 -19.369 1.00 0.00 O ATOM 723 NE2 GLN A 180 -4.647 3.116 -20.421 1.00 0.00 N ATOM 0 H GLN A 180 -4.015 -0.468 -17.667 1.00 0.00 H new ATOM 0 HA GLN A 180 -6.573 -0.460 -16.250 1.00 0.00 H new ATOM 0 HB2 GLN A 180 -7.074 1.398 -17.830 1.00 0.00 H new ATOM 0 HB3 GLN A 180 -5.638 1.687 -16.869 1.00 0.00 H new ATOM 0 HG2 GLN A 180 -4.181 1.263 -18.702 1.00 0.00 H new ATOM 0 HG3 GLN A 180 -5.444 0.490 -19.640 1.00 0.00 H new ATOM 0 HE21 GLN A 180 -3.780 2.603 -20.581 1.00 0.00 H new ATOM 0 HE22 GLN A 180 -4.808 4.005 -20.894 1.00 0.00 H new ATOM 732 N GLY A 181 -6.080 -1.812 -19.175 1.00 0.00 N ATOM 733 CA GLY A 181 -6.696 -2.647 -20.190 1.00 0.00 C ATOM 734 C GLY A 181 -6.802 -1.948 -21.531 1.00 0.00 C ATOM 735 O GLY A 181 -7.827 -1.355 -21.867 1.00 0.00 O ATOM 0 H GLY A 181 -5.070 -1.705 -19.264 1.00 0.00 H new ATOM 0 HA2 GLY A 181 -6.114 -3.562 -20.306 1.00 0.00 H new ATOM 0 HA3 GLY A 181 -7.691 -2.942 -19.858 1.00 0.00 H new ATOM 739 N PRO A 182 -5.720 -2.010 -22.322 1.00 0.00 N ATOM 740 CA PRO A 182 -5.670 -1.382 -23.645 1.00 0.00 C ATOM 741 C PRO A 182 -6.570 -2.086 -24.655 1.00 0.00 C ATOM 742 O PRO A 182 -7.189 -1.443 -25.503 1.00 0.00 O ATOM 743 CB PRO A 182 -4.201 -1.523 -24.050 1.00 0.00 C ATOM 744 CG PRO A 182 -3.709 -2.704 -23.286 1.00 0.00 C ATOM 745 CD PRO A 182 -4.463 -2.699 -21.985 1.00 0.00 C ATOM 0 HA PRO A 182 -6.022 -0.351 -23.620 1.00 0.00 H new ATOM 0 HB2 PRO A 182 -4.100 -1.676 -25.124 1.00 0.00 H new ATOM 0 HB3 PRO A 182 -3.634 -0.626 -23.801 1.00 0.00 H new ATOM 0 HG2 PRO A 182 -3.888 -3.627 -23.837 1.00 0.00 H new ATOM 0 HG3 PRO A 182 -2.635 -2.638 -23.115 1.00 0.00 H new ATOM 0 HD2 PRO A 182 -4.644 -3.711 -21.622 1.00 0.00 H new ATOM 0 HD3 PRO A 182 -3.913 -2.173 -21.204 1.00 0.00 H new ATOM 753 N SER A 183 -6.639 -3.410 -24.558 1.00 0.00 N ATOM 754 CA SER A 183 -7.461 -4.202 -25.465 1.00 0.00 C ATOM 755 C SER A 183 -8.131 -5.355 -24.725 1.00 0.00 C ATOM 756 O SER A 183 -7.461 -6.255 -24.220 1.00 0.00 O ATOM 757 CB SER A 183 -6.611 -4.744 -26.616 1.00 0.00 C ATOM 758 OG SER A 183 -6.567 -3.826 -27.694 1.00 0.00 O ATOM 0 H SER A 183 -6.135 -3.957 -23.860 1.00 0.00 H new ATOM 0 HA SER A 183 -8.238 -3.554 -25.871 1.00 0.00 H new ATOM 0 HB2 SER A 183 -5.599 -4.943 -26.263 1.00 0.00 H new ATOM 0 HB3 SER A 183 -7.021 -5.694 -26.959 1.00 0.00 H new ATOM 0 HG SER A 183 -6.016 -4.195 -28.416 1.00 0.00 H new ATOM 764 N ALA A 184 -9.458 -5.320 -24.665 1.00 0.00 N ATOM 765 CA ALA A 184 -10.220 -6.363 -23.989 1.00 0.00 C ATOM 766 C ALA A 184 -11.010 -7.202 -24.988 1.00 0.00 C ATOM 767 O ALA A 184 -11.895 -6.694 -25.675 1.00 0.00 O ATOM 768 CB ALA A 184 -11.155 -5.749 -22.958 1.00 0.00 C ATOM 0 H ALA A 184 -10.028 -4.581 -25.076 1.00 0.00 H new ATOM 0 HA ALA A 184 -9.515 -7.020 -23.480 1.00 0.00 H new ATOM 0 HB1 ALA A 184 -11.718 -6.539 -22.461 1.00 0.00 H new ATOM 0 HB2 ALA A 184 -10.572 -5.199 -22.219 1.00 0.00 H new ATOM 0 HB3 ALA A 184 -11.847 -5.068 -23.454 1.00 0.00 H new ATOM 774 N GLN A 185 -10.682 -8.488 -25.063 1.00 0.00 N ATOM 775 CA GLN A 185 -11.360 -9.396 -25.980 1.00 0.00 C ATOM 776 C GLN A 185 -11.311 -10.830 -25.462 1.00 0.00 C ATOM 777 O GLN A 185 -10.260 -11.468 -25.472 1.00 0.00 O ATOM 778 CB GLN A 185 -10.723 -9.322 -27.369 1.00 0.00 C ATOM 779 CG GLN A 185 -11.634 -9.812 -28.483 1.00 0.00 C ATOM 780 CD GLN A 185 -10.927 -9.894 -29.822 1.00 0.00 C ATOM 781 OE1 GLN A 185 -9.821 -10.426 -29.921 1.00 0.00 O ATOM 782 NE2 GLN A 185 -11.563 -9.367 -30.861 1.00 0.00 N ATOM 0 H GLN A 185 -9.952 -8.924 -24.500 1.00 0.00 H new ATOM 0 HA GLN A 185 -12.404 -9.089 -26.049 1.00 0.00 H new ATOM 0 HB2 GLN A 185 -10.436 -8.291 -27.573 1.00 0.00 H new ATOM 0 HB3 GLN A 185 -9.808 -9.914 -27.372 1.00 0.00 H new ATOM 0 HG2 GLN A 185 -12.024 -10.796 -28.222 1.00 0.00 H new ATOM 0 HG3 GLN A 185 -12.490 -9.142 -28.569 1.00 0.00 H new ATOM 0 HE21 GLN A 185 -12.479 -8.936 -30.733 1.00 0.00 H new ATOM 0 HE22 GLN A 185 -11.136 -9.393 -31.787 1.00 0.00 H new ATOM 791 N GLY A 186 -12.457 -11.329 -25.009 1.00 0.00 N ATOM 792 CA GLY A 186 -12.523 -12.684 -24.493 1.00 0.00 C ATOM 793 C GLY A 186 -11.869 -13.690 -25.419 1.00 0.00 C ATOM 794 O GLY A 186 -11.667 -13.415 -26.601 1.00 0.00 O ATOM 0 H GLY A 186 -13.340 -10.820 -24.990 1.00 0.00 H new ATOM 0 HA2 GLY A 186 -12.037 -12.722 -23.518 1.00 0.00 H new ATOM 0 HA3 GLY A 186 -13.566 -12.961 -24.340 1.00 0.00 H new ATOM 798 N SER A 187 -11.537 -14.859 -24.880 1.00 0.00 N ATOM 799 CA SER A 187 -10.897 -15.908 -25.665 1.00 0.00 C ATOM 800 C SER A 187 -11.659 -16.157 -26.963 1.00 0.00 C ATOM 801 O SER A 187 -11.103 -16.045 -28.054 1.00 0.00 O ATOM 802 CB SER A 187 -10.813 -17.202 -24.853 1.00 0.00 C ATOM 803 OG SER A 187 -9.918 -18.123 -25.453 1.00 0.00 O ATOM 0 H SER A 187 -11.701 -15.103 -23.903 1.00 0.00 H new ATOM 0 HA SER A 187 -9.889 -15.577 -25.914 1.00 0.00 H new ATOM 0 HB2 SER A 187 -10.483 -16.978 -23.839 1.00 0.00 H new ATOM 0 HB3 SER A 187 -11.803 -17.651 -24.774 1.00 0.00 H new ATOM 0 HG SER A 187 -9.881 -18.941 -24.914 1.00 0.00 H new ATOM 809 N GLY A 188 -12.939 -16.496 -26.835 1.00 0.00 N ATOM 810 CA GLY A 188 -13.758 -16.756 -28.004 1.00 0.00 C ATOM 811 C GLY A 188 -14.405 -18.126 -27.966 1.00 0.00 C ATOM 812 O GLY A 188 -15.489 -18.309 -27.412 1.00 0.00 O ATOM 0 H GLY A 188 -13.423 -16.595 -25.942 1.00 0.00 H new ATOM 0 HA2 GLY A 188 -14.533 -15.993 -28.077 1.00 0.00 H new ATOM 0 HA3 GLY A 188 -13.143 -16.673 -28.900 1.00 0.00 H new ATOM 816 N PRO A 189 -13.733 -19.119 -28.567 1.00 0.00 N ATOM 817 CA PRO A 189 -14.231 -20.497 -28.614 1.00 0.00 C ATOM 818 C PRO A 189 -14.199 -21.172 -27.247 1.00 0.00 C ATOM 819 O PRO A 189 -14.532 -22.350 -27.118 1.00 0.00 O ATOM 820 CB PRO A 189 -13.264 -21.191 -29.576 1.00 0.00 C ATOM 821 CG PRO A 189 -12.008 -20.394 -29.491 1.00 0.00 C ATOM 822 CD PRO A 189 -12.435 -18.973 -29.247 1.00 0.00 C ATOM 0 HA PRO A 189 -15.273 -20.543 -28.929 1.00 0.00 H new ATOM 0 HB2 PRO A 189 -13.095 -22.228 -29.287 1.00 0.00 H new ATOM 0 HB3 PRO A 189 -13.657 -21.203 -30.593 1.00 0.00 H new ATOM 0 HG2 PRO A 189 -11.371 -20.754 -28.683 1.00 0.00 H new ATOM 0 HG3 PRO A 189 -11.431 -20.475 -30.412 1.00 0.00 H new ATOM 0 HD2 PRO A 189 -11.715 -18.438 -28.628 1.00 0.00 H new ATOM 0 HD3 PRO A 189 -12.530 -18.416 -30.179 1.00 0.00 H new ATOM 830 N SER A 190 -13.797 -20.417 -26.229 1.00 0.00 N ATOM 831 CA SER A 190 -13.719 -20.944 -24.872 1.00 0.00 C ATOM 832 C SER A 190 -12.687 -22.064 -24.782 1.00 0.00 C ATOM 833 O SER A 190 -12.891 -23.057 -24.084 1.00 0.00 O ATOM 834 CB SER A 190 -15.087 -21.459 -24.422 1.00 0.00 C ATOM 835 OG SER A 190 -15.058 -21.865 -23.065 1.00 0.00 O ATOM 0 H SER A 190 -13.521 -19.439 -26.319 1.00 0.00 H new ATOM 0 HA SER A 190 -13.409 -20.134 -24.212 1.00 0.00 H new ATOM 0 HB2 SER A 190 -15.835 -20.677 -24.555 1.00 0.00 H new ATOM 0 HB3 SER A 190 -15.388 -22.298 -25.050 1.00 0.00 H new ATOM 0 HG SER A 190 -14.338 -22.517 -22.934 1.00 0.00 H new ATOM 841 N SER A 191 -11.577 -21.896 -25.494 1.00 0.00 N ATOM 842 CA SER A 191 -10.514 -22.894 -25.500 1.00 0.00 C ATOM 843 C SER A 191 -9.830 -22.966 -24.137 1.00 0.00 C ATOM 844 O SER A 191 -9.775 -21.980 -23.405 1.00 0.00 O ATOM 845 CB SER A 191 -9.484 -22.567 -26.583 1.00 0.00 C ATOM 846 OG SER A 191 -8.723 -23.712 -26.925 1.00 0.00 O ATOM 0 H SER A 191 -11.391 -21.078 -26.074 1.00 0.00 H new ATOM 0 HA SER A 191 -10.961 -23.864 -25.716 1.00 0.00 H new ATOM 0 HB2 SER A 191 -9.992 -22.186 -27.469 1.00 0.00 H new ATOM 0 HB3 SER A 191 -8.820 -21.777 -26.231 1.00 0.00 H new ATOM 0 HG SER A 191 -8.073 -23.477 -27.620 1.00 0.00 H new ATOM 852 N GLY A 192 -9.310 -24.144 -23.805 1.00 0.00 N ATOM 853 CA GLY A 192 -8.637 -24.325 -22.532 1.00 0.00 C ATOM 854 C GLY A 192 -7.163 -24.641 -22.695 1.00 0.00 C ATOM 855 O GLY A 192 -6.696 -24.750 -23.828 1.00 0.00 O ATOM 0 H GLY A 192 -9.343 -24.976 -24.395 1.00 0.00 H new ATOM 0 HA2 GLY A 192 -8.747 -23.420 -21.934 1.00 0.00 H new ATOM 0 HA3 GLY A 192 -9.120 -25.132 -21.981 1.00 0.00 H new TER 859 GLY A 192 HETATM 860 ZN ZN A 330 -5.767 12.961 2.748 1.00 0.00 ZN HETATM 861 ZN ZN A 530 -2.319 -5.737 -5.094 1.00 0.00 ZN