USER MOD reduce.3.24.130724 H: found=0, std=0, add=447, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 448 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 135 CYS SG : rot 58:sc= 1.18 USER MOD Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= -0.92! C(o=-0.92!,f=-0.96!) USER MOD Single : A 146 ASN : amide:sc= -4.05 K(o=-4,f=-7.5!) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 GLN : amide:sc= -3.06! C(o=-3.1!,f=-3.1!) USER MOD Single : A 171 ASN : amide:sc=-0.000171 X(o=-0.00017,f=-0.073) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 MET CE :methyl 155:sc= -3.63 (180deg=-5.7!) USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 189 LYS NZ :NH3+ -109:sc= -0.374 (180deg=-1.58!) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 135 1.155 0.573 -0.959 1.00 0.00 N ATOM 2 CA CYS A 135 2.232 0.300 -1.894 1.00 0.00 C ATOM 3 C CYS A 135 2.123 -1.159 -2.342 1.00 0.00 C ATOM 4 O CYS A 135 2.879 -1.607 -3.202 1.00 0.00 O ATOM 5 CB CYS A 135 3.602 0.608 -1.285 1.00 0.00 C ATOM 6 SG CYS A 135 3.866 -0.415 0.210 1.00 0.00 S ATOM 0 HA CYS A 135 2.137 0.953 -2.761 1.00 0.00 H new ATOM 0 HB2 CYS A 135 4.387 0.409 -2.015 1.00 0.00 H new ATOM 0 HB3 CYS A 135 3.666 1.665 -1.028 1.00 0.00 H new ATOM 0 HG CYS A 135 3.774 -1.673 -0.103 1.00 0.00 H new ATOM 12 N TYR A 136 1.174 -1.860 -1.738 1.00 0.00 N ATOM 13 CA TYR A 136 0.954 -3.258 -2.063 1.00 0.00 C ATOM 14 C TYR A 136 -0.525 -3.530 -2.347 1.00 0.00 C ATOM 15 O TYR A 136 -1.383 -2.714 -2.018 1.00 0.00 O ATOM 16 CB TYR A 136 1.378 -4.051 -0.825 1.00 0.00 C ATOM 17 CG TYR A 136 2.861 -4.428 -0.804 1.00 0.00 C ATOM 18 CD1 TYR A 136 3.348 -5.362 -1.696 1.00 0.00 C ATOM 19 CD2 TYR A 136 3.712 -3.833 0.106 1.00 0.00 C ATOM 20 CE1 TYR A 136 4.743 -5.717 -1.676 1.00 0.00 C ATOM 21 CE2 TYR A 136 5.107 -4.188 0.125 1.00 0.00 C ATOM 22 CZ TYR A 136 5.554 -5.112 -0.767 1.00 0.00 C ATOM 23 OH TYR A 136 6.872 -5.446 -0.748 1.00 0.00 O ATOM 0 H TYR A 136 0.549 -1.485 -1.025 1.00 0.00 H new ATOM 0 HA TYR A 136 1.519 -3.538 -2.952 1.00 0.00 H new ATOM 0 HB2 TYR A 136 1.150 -3.464 0.065 1.00 0.00 H new ATOM 0 HB3 TYR A 136 0.782 -4.962 -0.768 1.00 0.00 H new ATOM 0 HD1 TYR A 136 2.683 -5.826 -2.409 1.00 0.00 H new ATOM 0 HD2 TYR A 136 3.331 -3.101 0.803 1.00 0.00 H new ATOM 0 HE1 TYR A 136 5.137 -6.447 -2.367 1.00 0.00 H new ATOM 0 HE2 TYR A 136 5.783 -3.731 0.832 1.00 0.00 H new ATOM 0 HH TYR A 136 7.329 -4.934 -0.048 1.00 0.00 H new ATOM 33 N VAL A 137 -0.776 -4.681 -2.954 1.00 0.00 N ATOM 34 CA VAL A 137 -2.136 -5.071 -3.286 1.00 0.00 C ATOM 35 C VAL A 137 -2.260 -6.593 -3.200 1.00 0.00 C ATOM 36 O VAL A 137 -1.255 -7.301 -3.161 1.00 0.00 O ATOM 37 CB VAL A 137 -2.519 -4.516 -4.659 1.00 0.00 C ATOM 38 CG1 VAL A 137 -1.326 -3.826 -5.324 1.00 0.00 C ATOM 39 CG2 VAL A 137 -3.086 -5.617 -5.557 1.00 0.00 C ATOM 0 H VAL A 137 -0.061 -5.356 -3.224 1.00 0.00 H new ATOM 0 HA VAL A 137 -2.841 -4.647 -2.571 1.00 0.00 H new ATOM 0 HB VAL A 137 -3.299 -3.769 -4.512 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -1.626 -3.441 -6.299 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -0.986 -3.002 -4.697 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -0.515 -4.543 -5.451 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -3.350 -5.195 -6.527 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -2.337 -6.398 -5.692 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -3.975 -6.044 -5.092 1.00 0.00 H new ATOM 49 N ARG A 138 -3.503 -7.052 -3.174 1.00 0.00 N ATOM 50 CA ARG A 138 -3.773 -8.478 -3.094 1.00 0.00 C ATOM 51 C ARG A 138 -4.690 -8.910 -4.239 1.00 0.00 C ATOM 52 O ARG A 138 -5.821 -8.437 -4.345 1.00 0.00 O ATOM 53 CB ARG A 138 -4.428 -8.841 -1.759 1.00 0.00 C ATOM 54 CG ARG A 138 -3.897 -10.176 -1.233 1.00 0.00 C ATOM 55 CD ARG A 138 -4.541 -10.531 0.108 1.00 0.00 C ATOM 56 NE ARG A 138 -3.698 -10.039 1.221 1.00 0.00 N ATOM 57 CZ ARG A 138 -3.648 -10.607 2.434 1.00 0.00 C ATOM 58 NH1 ARG A 138 -4.393 -11.689 2.698 1.00 0.00 N ATOM 59 NH2 ARG A 138 -2.854 -10.093 3.382 1.00 0.00 N ATOM 0 H ARG A 138 -4.334 -6.462 -3.207 1.00 0.00 H new ATOM 0 HA ARG A 138 -2.820 -9.001 -3.171 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -4.234 -8.055 -1.029 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -5.509 -8.900 -1.884 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -4.101 -10.964 -1.958 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -2.815 -10.121 -1.118 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -5.535 -10.089 0.171 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -4.666 -11.611 0.186 1.00 0.00 H new ATOM 0 HE ARG A 138 -3.119 -9.216 1.054 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -4.998 -12.080 1.976 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -4.355 -12.121 3.621 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -2.287 -9.269 3.181 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -2.816 -10.525 4.305 1.00 0.00 H new ATOM 73 N ALA A 139 -4.170 -9.804 -5.067 1.00 0.00 N ATOM 74 CA ALA A 139 -4.929 -10.305 -6.201 1.00 0.00 C ATOM 75 C ALA A 139 -5.830 -11.452 -5.739 1.00 0.00 C ATOM 76 O ALA A 139 -5.340 -12.513 -5.353 1.00 0.00 O ATOM 77 CB ALA A 139 -3.967 -10.729 -7.312 1.00 0.00 C ATOM 0 H ALA A 139 -3.232 -10.195 -4.975 1.00 0.00 H new ATOM 0 HA ALA A 139 -5.572 -9.525 -6.608 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -4.536 -11.105 -8.162 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -3.371 -9.871 -7.624 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -3.307 -11.514 -6.942 1.00 0.00 H new ATOM 83 N LEU A 140 -7.129 -11.200 -5.793 1.00 0.00 N ATOM 84 CA LEU A 140 -8.103 -12.200 -5.385 1.00 0.00 C ATOM 85 C LEU A 140 -8.431 -13.102 -6.575 1.00 0.00 C ATOM 86 O LEU A 140 -9.467 -13.763 -6.591 1.00 0.00 O ATOM 87 CB LEU A 140 -9.330 -11.529 -4.766 1.00 0.00 C ATOM 88 CG LEU A 140 -9.097 -10.789 -3.447 1.00 0.00 C ATOM 89 CD1 LEU A 140 -9.750 -9.405 -3.472 1.00 0.00 C ATOM 90 CD2 LEU A 140 -9.572 -11.626 -2.256 1.00 0.00 C ATOM 0 H LEU A 140 -7.531 -10.319 -6.113 1.00 0.00 H new ATOM 0 HA LEU A 140 -7.689 -12.839 -4.605 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -9.736 -10.822 -5.489 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -10.092 -12.291 -4.602 1.00 0.00 H new ATOM 0 HG LEU A 140 -8.024 -10.637 -3.326 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -9.569 -8.900 -2.523 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -9.323 -8.816 -4.283 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -10.824 -9.512 -3.628 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -9.395 -11.077 -1.331 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -10.638 -11.831 -2.357 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -9.022 -12.567 -2.230 1.00 0.00 H new ATOM 102 N PHE A 141 -7.526 -13.101 -7.545 1.00 0.00 N ATOM 103 CA PHE A 141 -7.706 -13.912 -8.737 1.00 0.00 C ATOM 104 C PHE A 141 -6.372 -14.490 -9.212 1.00 0.00 C ATOM 105 O PHE A 141 -5.310 -14.065 -8.761 1.00 0.00 O ATOM 106 CB PHE A 141 -8.265 -12.992 -9.823 1.00 0.00 C ATOM 107 CG PHE A 141 -8.980 -13.730 -10.957 1.00 0.00 C ATOM 108 CD1 PHE A 141 -10.242 -14.203 -10.771 1.00 0.00 C ATOM 109 CD2 PHE A 141 -8.353 -13.914 -12.150 1.00 0.00 C ATOM 110 CE1 PHE A 141 -10.905 -14.888 -11.823 1.00 0.00 C ATOM 111 CE2 PHE A 141 -9.018 -14.599 -13.202 1.00 0.00 C ATOM 112 CZ PHE A 141 -10.279 -15.072 -13.016 1.00 0.00 C ATOM 0 H PHE A 141 -6.667 -12.551 -7.529 1.00 0.00 H new ATOM 0 HA PHE A 141 -8.377 -14.744 -8.524 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -8.961 -12.288 -9.366 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -7.448 -12.405 -10.243 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -10.739 -14.057 -9.823 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -7.351 -13.540 -12.297 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -11.907 -15.263 -11.676 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -8.522 -14.744 -14.150 1.00 0.00 H new ATOM 0 HZ PHE A 141 -10.783 -15.594 -13.816 1.00 0.00 H new ATOM 122 N ASP A 142 -6.471 -15.453 -10.117 1.00 0.00 N ATOM 123 CA ASP A 142 -5.285 -16.095 -10.659 1.00 0.00 C ATOM 124 C ASP A 142 -5.063 -15.618 -12.096 1.00 0.00 C ATOM 125 O ASP A 142 -6.006 -15.211 -12.771 1.00 0.00 O ATOM 126 CB ASP A 142 -5.445 -17.616 -10.686 1.00 0.00 C ATOM 127 CG ASP A 142 -4.674 -18.328 -11.799 1.00 0.00 C ATOM 128 OD1 ASP A 142 -5.119 -18.211 -12.962 1.00 0.00 O ATOM 129 OD2 ASP A 142 -3.658 -18.973 -11.463 1.00 0.00 O ATOM 0 H ASP A 142 -7.354 -15.804 -10.488 1.00 0.00 H new ATOM 0 HA ASP A 142 -4.440 -15.832 -10.023 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -5.121 -18.017 -9.726 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -6.504 -17.853 -10.789 1.00 0.00 H new ATOM 134 N PHE A 143 -3.810 -15.683 -12.520 1.00 0.00 N ATOM 135 CA PHE A 143 -3.451 -15.262 -13.864 1.00 0.00 C ATOM 136 C PHE A 143 -1.958 -15.467 -14.123 1.00 0.00 C ATOM 137 O PHE A 143 -1.131 -14.677 -13.670 1.00 0.00 O ATOM 138 CB PHE A 143 -3.775 -13.770 -13.968 1.00 0.00 C ATOM 139 CG PHE A 143 -3.986 -13.277 -15.400 1.00 0.00 C ATOM 140 CD1 PHE A 143 -2.916 -12.914 -16.158 1.00 0.00 C ATOM 141 CD2 PHE A 143 -5.242 -13.201 -15.915 1.00 0.00 C ATOM 142 CE1 PHE A 143 -3.113 -12.455 -17.488 1.00 0.00 C ATOM 143 CE2 PHE A 143 -5.437 -12.742 -17.245 1.00 0.00 C ATOM 144 CZ PHE A 143 -4.368 -12.380 -18.004 1.00 0.00 C ATOM 0 H PHE A 143 -3.030 -16.021 -11.957 1.00 0.00 H new ATOM 0 HA PHE A 143 -4.003 -15.850 -14.597 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -4.674 -13.563 -13.387 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -2.964 -13.200 -13.514 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -1.918 -12.975 -15.749 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -6.091 -13.489 -15.313 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -2.264 -12.165 -18.090 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -6.435 -12.680 -17.654 1.00 0.00 H new ATOM 0 HZ PHE A 143 -4.516 -12.033 -19.016 1.00 0.00 H new ATOM 154 N ASN A 144 -1.656 -16.532 -14.852 1.00 0.00 N ATOM 155 CA ASN A 144 -0.277 -16.850 -15.177 1.00 0.00 C ATOM 156 C ASN A 144 -0.169 -17.165 -16.671 1.00 0.00 C ATOM 157 O ASN A 144 -0.733 -18.149 -17.144 1.00 0.00 O ATOM 158 CB ASN A 144 0.203 -18.078 -14.399 1.00 0.00 C ATOM 159 CG ASN A 144 -0.546 -19.336 -14.844 1.00 0.00 C ATOM 160 OD1 ASN A 144 -1.724 -19.513 -14.582 1.00 0.00 O ATOM 161 ND2 ASN A 144 0.201 -20.196 -15.531 1.00 0.00 N ATOM 0 H ASN A 144 -2.344 -17.185 -15.227 1.00 0.00 H new ATOM 0 HA ASN A 144 0.339 -15.991 -14.911 1.00 0.00 H new ATOM 0 HB2 ASN A 144 1.274 -18.214 -14.552 1.00 0.00 H new ATOM 0 HB3 ASN A 144 0.052 -17.919 -13.331 1.00 0.00 H new ATOM 0 HD21 ASN A 144 -0.207 -21.066 -15.873 1.00 0.00 H new ATOM 0 HD22 ASN A 144 1.182 -19.986 -15.715 1.00 0.00 H new ATOM 168 N GLY A 145 0.561 -16.309 -17.371 1.00 0.00 N ATOM 169 CA GLY A 145 0.750 -16.483 -18.801 1.00 0.00 C ATOM 170 C GLY A 145 0.425 -15.194 -19.558 1.00 0.00 C ATOM 171 O GLY A 145 -0.655 -15.061 -20.131 1.00 0.00 O ATOM 0 H GLY A 145 1.028 -15.494 -16.975 1.00 0.00 H new ATOM 0 HA2 GLY A 145 1.780 -16.777 -19.002 1.00 0.00 H new ATOM 0 HA3 GLY A 145 0.112 -17.291 -19.160 1.00 0.00 H new ATOM 175 N ASN A 146 1.381 -14.276 -19.537 1.00 0.00 N ATOM 176 CA ASN A 146 1.210 -13.002 -20.215 1.00 0.00 C ATOM 177 C ASN A 146 2.384 -12.084 -19.869 1.00 0.00 C ATOM 178 O ASN A 146 3.248 -11.833 -20.706 1.00 0.00 O ATOM 179 CB ASN A 146 -0.079 -12.310 -19.769 1.00 0.00 C ATOM 180 CG ASN A 146 -1.167 -12.434 -20.838 1.00 0.00 C ATOM 181 OD1 ASN A 146 -1.035 -11.956 -21.952 1.00 0.00 O ATOM 182 ND2 ASN A 146 -2.246 -13.100 -20.437 1.00 0.00 N ATOM 0 H ASN A 146 2.276 -14.389 -19.061 1.00 0.00 H new ATOM 0 HA ASN A 146 1.164 -13.194 -21.287 1.00 0.00 H new ATOM 0 HB2 ASN A 146 -0.429 -12.752 -18.836 1.00 0.00 H new ATOM 0 HB3 ASN A 146 0.120 -11.257 -19.568 1.00 0.00 H new ATOM 0 HD21 ASN A 146 -3.028 -13.236 -21.077 1.00 0.00 H new ATOM 0 HD22 ASN A 146 -2.291 -13.475 -19.489 1.00 0.00 H new ATOM 189 N ASP A 147 2.376 -11.607 -18.632 1.00 0.00 N ATOM 190 CA ASP A 147 3.430 -10.722 -18.165 1.00 0.00 C ATOM 191 C ASP A 147 3.412 -9.434 -18.991 1.00 0.00 C ATOM 192 O ASP A 147 2.857 -8.424 -18.562 1.00 0.00 O ATOM 193 CB ASP A 147 4.806 -11.370 -18.328 1.00 0.00 C ATOM 194 CG ASP A 147 5.459 -11.838 -17.026 1.00 0.00 C ATOM 195 OD1 ASP A 147 4.694 -12.175 -16.096 1.00 0.00 O ATOM 196 OD2 ASP A 147 6.708 -11.848 -16.989 1.00 0.00 O ATOM 0 H ASP A 147 1.657 -11.817 -17.940 1.00 0.00 H new ATOM 0 HA ASP A 147 3.253 -10.514 -17.110 1.00 0.00 H new ATOM 0 HB2 ASP A 147 4.711 -12.225 -18.997 1.00 0.00 H new ATOM 0 HB3 ASP A 147 5.471 -10.657 -18.815 1.00 0.00 H new ATOM 201 N GLU A 148 4.026 -9.513 -20.162 1.00 0.00 N ATOM 202 CA GLU A 148 4.089 -8.366 -21.053 1.00 0.00 C ATOM 203 C GLU A 148 2.696 -7.756 -21.230 1.00 0.00 C ATOM 204 O GLU A 148 2.569 -6.573 -21.542 1.00 0.00 O ATOM 205 CB GLU A 148 4.693 -8.754 -22.404 1.00 0.00 C ATOM 206 CG GLU A 148 3.795 -9.749 -23.143 1.00 0.00 C ATOM 207 CD GLU A 148 4.377 -11.162 -23.080 1.00 0.00 C ATOM 208 OE1 GLU A 148 5.622 -11.263 -23.034 1.00 0.00 O ATOM 209 OE2 GLU A 148 3.562 -12.111 -23.080 1.00 0.00 O ATOM 0 H GLU A 148 4.484 -10.353 -20.515 1.00 0.00 H new ATOM 0 HA GLU A 148 4.739 -7.616 -20.604 1.00 0.00 H new ATOM 0 HB2 GLU A 148 4.831 -7.861 -23.014 1.00 0.00 H new ATOM 0 HB3 GLU A 148 5.679 -9.192 -22.253 1.00 0.00 H new ATOM 0 HG2 GLU A 148 2.798 -9.742 -22.702 1.00 0.00 H new ATOM 0 HG3 GLU A 148 3.685 -9.443 -24.183 1.00 0.00 H new ATOM 216 N GLU A 149 1.689 -8.591 -21.024 1.00 0.00 N ATOM 217 CA GLU A 149 0.311 -8.148 -21.157 1.00 0.00 C ATOM 218 C GLU A 149 -0.235 -7.699 -19.801 1.00 0.00 C ATOM 219 O GLU A 149 -1.167 -6.897 -19.737 1.00 0.00 O ATOM 220 CB GLU A 149 -0.563 -9.249 -21.763 1.00 0.00 C ATOM 221 CG GLU A 149 -1.424 -8.700 -22.901 1.00 0.00 C ATOM 222 CD GLU A 149 -2.583 -9.648 -23.217 1.00 0.00 C ATOM 223 OE1 GLU A 149 -2.354 -10.577 -24.021 1.00 0.00 O ATOM 224 OE2 GLU A 149 -3.673 -9.420 -22.648 1.00 0.00 O ATOM 0 H GLU A 149 1.799 -9.572 -20.766 1.00 0.00 H new ATOM 0 HA GLU A 149 0.288 -7.296 -21.836 1.00 0.00 H new ATOM 0 HB2 GLU A 149 0.068 -10.055 -22.136 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -1.203 -9.676 -20.991 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -1.815 -7.720 -22.626 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -0.811 -8.560 -23.791 1.00 0.00 H new ATOM 231 N ASP A 150 0.367 -8.234 -18.749 1.00 0.00 N ATOM 232 CA ASP A 150 -0.048 -7.899 -17.397 1.00 0.00 C ATOM 233 C ASP A 150 0.650 -8.834 -16.408 1.00 0.00 C ATOM 234 O ASP A 150 0.848 -10.013 -16.697 1.00 0.00 O ATOM 235 CB ASP A 150 -1.558 -8.070 -17.226 1.00 0.00 C ATOM 236 CG ASP A 150 -2.094 -9.462 -17.569 1.00 0.00 C ATOM 237 OD1 ASP A 150 -1.812 -10.388 -16.778 1.00 0.00 O ATOM 238 OD2 ASP A 150 -2.774 -9.568 -18.613 1.00 0.00 O ATOM 0 H ASP A 150 1.140 -8.898 -18.806 1.00 0.00 H new ATOM 0 HA ASP A 150 0.220 -6.859 -17.210 1.00 0.00 H new ATOM 0 HB2 ASP A 150 -1.820 -7.841 -16.193 1.00 0.00 H new ATOM 0 HB3 ASP A 150 -2.065 -7.337 -17.854 1.00 0.00 H new ATOM 243 N LEU A 151 1.002 -8.273 -15.260 1.00 0.00 N ATOM 244 CA LEU A 151 1.672 -9.042 -14.225 1.00 0.00 C ATOM 245 C LEU A 151 0.762 -10.188 -13.777 1.00 0.00 C ATOM 246 O LEU A 151 -0.378 -9.960 -13.379 1.00 0.00 O ATOM 247 CB LEU A 151 2.118 -8.128 -13.083 1.00 0.00 C ATOM 248 CG LEU A 151 3.167 -8.706 -12.131 1.00 0.00 C ATOM 249 CD1 LEU A 151 4.553 -8.710 -12.780 1.00 0.00 C ATOM 250 CD2 LEU A 151 3.162 -7.965 -10.793 1.00 0.00 C ATOM 0 H LEU A 151 0.836 -7.295 -15.024 1.00 0.00 H new ATOM 0 HA LEU A 151 2.584 -9.493 -14.616 1.00 0.00 H new ATOM 0 HB2 LEU A 151 2.515 -7.209 -13.514 1.00 0.00 H new ATOM 0 HB3 LEU A 151 1.239 -7.853 -12.500 1.00 0.00 H new ATOM 0 HG LEU A 151 2.905 -9.744 -11.924 1.00 0.00 H new ATOM 0 HD11 LEU A 151 5.280 -9.126 -12.082 1.00 0.00 H new ATOM 0 HD12 LEU A 151 4.529 -9.318 -13.685 1.00 0.00 H new ATOM 0 HD13 LEU A 151 4.838 -7.689 -13.036 1.00 0.00 H new ATOM 0 HD21 LEU A 151 3.917 -8.396 -10.135 1.00 0.00 H new ATOM 0 HD22 LEU A 151 3.385 -6.911 -10.960 1.00 0.00 H new ATOM 0 HD23 LEU A 151 2.180 -8.059 -10.329 1.00 0.00 H new ATOM 262 N PRO A 152 1.316 -11.427 -13.862 1.00 0.00 N ATOM 263 CA PRO A 152 0.568 -12.609 -13.469 1.00 0.00 C ATOM 264 C PRO A 152 0.472 -12.717 -11.946 1.00 0.00 C ATOM 265 O PRO A 152 1.145 -11.983 -11.224 1.00 0.00 O ATOM 266 CB PRO A 152 1.313 -13.774 -14.101 1.00 0.00 C ATOM 267 CG PRO A 152 2.701 -13.251 -14.432 1.00 0.00 C ATOM 268 CD PRO A 152 2.664 -11.735 -14.330 1.00 0.00 C ATOM 0 HA PRO A 152 -0.467 -12.583 -13.809 1.00 0.00 H new ATOM 0 HB2 PRO A 152 1.368 -14.620 -13.416 1.00 0.00 H new ATOM 0 HB3 PRO A 152 0.803 -14.123 -14.999 1.00 0.00 H new ATOM 0 HG2 PRO A 152 3.438 -13.662 -13.743 1.00 0.00 H new ATOM 0 HG3 PRO A 152 2.996 -13.559 -15.435 1.00 0.00 H new ATOM 0 HD2 PRO A 152 3.418 -11.367 -13.635 1.00 0.00 H new ATOM 0 HD3 PRO A 152 2.864 -11.268 -15.294 1.00 0.00 H new ATOM 276 N PHE A 153 -0.371 -13.638 -11.503 1.00 0.00 N ATOM 277 CA PHE A 153 -0.564 -13.852 -10.078 1.00 0.00 C ATOM 278 C PHE A 153 -1.485 -15.047 -9.823 1.00 0.00 C ATOM 279 O PHE A 153 -2.055 -15.606 -10.758 1.00 0.00 O ATOM 280 CB PHE A 153 -1.222 -12.588 -9.521 1.00 0.00 C ATOM 281 CG PHE A 153 -2.230 -11.940 -10.473 1.00 0.00 C ATOM 282 CD1 PHE A 153 -3.432 -12.536 -10.699 1.00 0.00 C ATOM 283 CD2 PHE A 153 -1.925 -10.769 -11.093 1.00 0.00 C ATOM 284 CE1 PHE A 153 -4.367 -11.935 -11.582 1.00 0.00 C ATOM 285 CE2 PHE A 153 -2.860 -10.168 -11.976 1.00 0.00 C ATOM 286 CZ PHE A 153 -4.062 -10.764 -12.202 1.00 0.00 C ATOM 0 H PHE A 153 -0.928 -14.244 -12.105 1.00 0.00 H new ATOM 0 HA PHE A 153 0.394 -14.057 -9.599 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -1.727 -12.835 -8.587 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -0.445 -11.862 -9.281 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -3.675 -13.466 -10.207 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -0.971 -10.296 -10.914 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -5.321 -12.408 -11.761 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -2.617 -9.238 -12.468 1.00 0.00 H new ATOM 0 HZ PHE A 153 -4.774 -10.307 -12.874 1.00 0.00 H new ATOM 296 N LYS A 154 -1.602 -15.402 -8.552 1.00 0.00 N ATOM 297 CA LYS A 154 -2.443 -16.520 -8.162 1.00 0.00 C ATOM 298 C LYS A 154 -3.479 -16.042 -7.142 1.00 0.00 C ATOM 299 O LYS A 154 -3.125 -15.436 -6.132 1.00 0.00 O ATOM 300 CB LYS A 154 -1.587 -17.688 -7.667 1.00 0.00 C ATOM 301 CG LYS A 154 -1.886 -18.006 -6.201 1.00 0.00 C ATOM 302 CD LYS A 154 -0.974 -19.119 -5.683 1.00 0.00 C ATOM 303 CE LYS A 154 -0.095 -18.620 -4.535 1.00 0.00 C ATOM 304 NZ LYS A 154 -0.820 -18.714 -3.249 1.00 0.00 N ATOM 0 H LYS A 154 -1.128 -14.935 -7.779 1.00 0.00 H new ATOM 0 HA LYS A 154 -2.993 -16.900 -9.022 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -1.778 -18.569 -8.280 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -0.531 -17.443 -7.781 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -1.751 -17.109 -5.596 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -2.928 -18.307 -6.096 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -1.578 -19.960 -5.343 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -0.345 -19.485 -6.494 1.00 0.00 H new ATOM 0 HE2 LYS A 154 0.820 -19.210 -4.487 1.00 0.00 H new ATOM 0 HE3 LYS A 154 0.201 -17.587 -4.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -0.209 -18.371 -2.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -1.681 -18.132 -3.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -1.080 -19.705 -3.069 1.00 0.00 H new ATOM 318 N LYS A 155 -4.735 -16.333 -7.441 1.00 0.00 N ATOM 319 CA LYS A 155 -5.824 -15.940 -6.563 1.00 0.00 C ATOM 320 C LYS A 155 -5.339 -15.967 -5.113 1.00 0.00 C ATOM 321 O LYS A 155 -5.138 -17.038 -4.541 1.00 0.00 O ATOM 322 CB LYS A 155 -7.057 -16.811 -6.816 1.00 0.00 C ATOM 323 CG LYS A 155 -8.301 -16.204 -6.163 1.00 0.00 C ATOM 324 CD LYS A 155 -9.002 -17.224 -5.265 1.00 0.00 C ATOM 325 CE LYS A 155 -8.326 -17.306 -3.895 1.00 0.00 C ATOM 326 NZ LYS A 155 -8.453 -18.670 -3.335 1.00 0.00 N ATOM 0 H LYS A 155 -5.024 -16.837 -8.280 1.00 0.00 H new ATOM 0 HA LYS A 155 -6.135 -14.917 -6.776 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -7.219 -16.915 -7.889 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -6.886 -17.812 -6.421 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -8.018 -15.331 -5.575 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -8.990 -15.860 -6.935 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -10.049 -16.946 -5.142 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -8.986 -18.204 -5.741 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -7.273 -17.041 -3.986 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -8.779 -16.584 -3.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -7.989 -18.708 -2.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -9.460 -18.910 -3.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -8.000 -19.352 -3.976 1.00 0.00 H new ATOM 340 N GLY A 156 -5.164 -14.776 -4.558 1.00 0.00 N ATOM 341 CA GLY A 156 -4.706 -14.651 -3.185 1.00 0.00 C ATOM 342 C GLY A 156 -3.207 -14.350 -3.133 1.00 0.00 C ATOM 343 O GLY A 156 -2.494 -14.877 -2.279 1.00 0.00 O ATOM 0 H GLY A 156 -5.331 -13.890 -5.034 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -5.258 -13.855 -2.685 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -4.915 -15.573 -2.643 1.00 0.00 H new ATOM 347 N ASP A 157 -2.771 -13.507 -4.057 1.00 0.00 N ATOM 348 CA ASP A 157 -1.369 -13.130 -4.127 1.00 0.00 C ATOM 349 C ASP A 157 -1.222 -11.656 -3.748 1.00 0.00 C ATOM 350 O ASP A 157 -2.217 -10.950 -3.589 1.00 0.00 O ATOM 351 CB ASP A 157 -0.821 -13.312 -5.543 1.00 0.00 C ATOM 352 CG ASP A 157 0.692 -13.129 -5.679 1.00 0.00 C ATOM 353 OD1 ASP A 157 1.410 -14.110 -5.386 1.00 0.00 O ATOM 354 OD2 ASP A 157 1.096 -12.013 -6.072 1.00 0.00 O ATOM 0 H ASP A 157 -3.364 -13.074 -4.764 1.00 0.00 H new ATOM 0 HA ASP A 157 -0.813 -13.768 -3.440 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -1.084 -14.310 -5.893 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -1.319 -12.602 -6.203 1.00 0.00 H new ATOM 359 N ILE A 158 0.027 -11.234 -3.614 1.00 0.00 N ATOM 360 CA ILE A 158 0.317 -9.855 -3.257 1.00 0.00 C ATOM 361 C ILE A 158 1.226 -9.238 -4.321 1.00 0.00 C ATOM 362 O ILE A 158 2.029 -9.936 -4.939 1.00 0.00 O ATOM 363 CB ILE A 158 0.890 -9.780 -1.840 1.00 0.00 C ATOM 364 CG1 ILE A 158 -0.222 -9.870 -0.793 1.00 0.00 C ATOM 365 CG2 ILE A 158 1.743 -8.522 -1.661 1.00 0.00 C ATOM 366 CD1 ILE A 158 -1.018 -8.565 -0.723 1.00 0.00 C ATOM 0 H ILE A 158 0.850 -11.822 -3.746 1.00 0.00 H new ATOM 0 HA ILE A 158 -0.599 -9.264 -3.239 1.00 0.00 H new ATOM 0 HB ILE A 158 1.544 -10.639 -1.690 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -0.891 -10.695 -1.038 1.00 0.00 H new ATOM 0 HG13 ILE A 158 0.210 -10.089 0.183 1.00 0.00 H new ATOM 0 HG21 ILE A 158 2.139 -8.492 -0.646 1.00 0.00 H new ATOM 0 HG22 ILE A 158 2.569 -8.538 -2.372 1.00 0.00 H new ATOM 0 HG23 ILE A 158 1.130 -7.638 -1.838 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -1.802 -8.657 0.029 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -0.351 -7.746 -0.454 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -1.469 -8.361 -1.694 1.00 0.00 H new ATOM 378 N LEU A 159 1.069 -7.935 -4.504 1.00 0.00 N ATOM 379 CA LEU A 159 1.866 -7.215 -5.483 1.00 0.00 C ATOM 380 C LEU A 159 2.146 -5.802 -4.967 1.00 0.00 C ATOM 381 O LEU A 159 1.272 -5.167 -4.380 1.00 0.00 O ATOM 382 CB LEU A 159 1.185 -7.245 -6.853 1.00 0.00 C ATOM 383 CG LEU A 159 0.581 -8.587 -7.272 1.00 0.00 C ATOM 384 CD1 LEU A 159 -0.588 -8.384 -8.238 1.00 0.00 C ATOM 385 CD2 LEU A 159 1.651 -9.513 -7.855 1.00 0.00 C ATOM 0 H LEU A 159 0.402 -7.359 -3.991 1.00 0.00 H new ATOM 0 HA LEU A 159 2.832 -7.702 -5.621 1.00 0.00 H new ATOM 0 HB2 LEU A 159 0.394 -6.495 -6.860 1.00 0.00 H new ATOM 0 HB3 LEU A 159 1.914 -6.946 -7.606 1.00 0.00 H new ATOM 0 HG LEU A 159 0.183 -9.075 -6.382 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -0.999 -9.353 -8.520 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.362 -7.789 -7.753 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.237 -7.865 -9.130 1.00 0.00 H new ATOM 0 HD21 LEU A 159 1.195 -10.460 -8.144 1.00 0.00 H new ATOM 0 HD22 LEU A 159 2.100 -9.044 -8.730 1.00 0.00 H new ATOM 0 HD23 LEU A 159 2.421 -9.696 -7.106 1.00 0.00 H new ATOM 397 N ARG A 160 3.369 -5.352 -5.205 1.00 0.00 N ATOM 398 CA ARG A 160 3.776 -4.026 -4.772 1.00 0.00 C ATOM 399 C ARG A 160 3.450 -2.992 -5.851 1.00 0.00 C ATOM 400 O ARG A 160 4.166 -2.879 -6.844 1.00 0.00 O ATOM 401 CB ARG A 160 5.274 -3.981 -4.468 1.00 0.00 C ATOM 402 CG ARG A 160 5.755 -2.540 -4.288 1.00 0.00 C ATOM 403 CD ARG A 160 6.397 -2.344 -2.913 1.00 0.00 C ATOM 404 NE ARG A 160 6.485 -0.901 -2.596 1.00 0.00 N ATOM 405 CZ ARG A 160 7.358 -0.375 -1.726 1.00 0.00 C ATOM 406 NH1 ARG A 160 8.223 -1.169 -1.081 1.00 0.00 N ATOM 407 NH2 ARG A 160 7.365 0.947 -1.502 1.00 0.00 N ATOM 0 H ARG A 160 4.092 -5.882 -5.692 1.00 0.00 H new ATOM 0 HA ARG A 160 3.225 -3.791 -3.861 1.00 0.00 H new ATOM 0 HB2 ARG A 160 5.482 -4.553 -3.564 1.00 0.00 H new ATOM 0 HB3 ARG A 160 5.827 -4.454 -5.279 1.00 0.00 H new ATOM 0 HG2 ARG A 160 6.475 -2.293 -5.068 1.00 0.00 H new ATOM 0 HG3 ARG A 160 4.915 -1.855 -4.402 1.00 0.00 H new ATOM 0 HD2 ARG A 160 5.809 -2.857 -2.152 1.00 0.00 H new ATOM 0 HD3 ARG A 160 7.392 -2.789 -2.900 1.00 0.00 H new ATOM 0 HE ARG A 160 5.841 -0.267 -3.069 1.00 0.00 H new ATOM 0 HH11 ARG A 160 8.217 -2.175 -1.252 1.00 0.00 H new ATOM 0 HH12 ARG A 160 8.887 -0.768 -0.419 1.00 0.00 H new ATOM 0 HH21 ARG A 160 6.706 1.551 -1.994 1.00 0.00 H new ATOM 0 HH22 ARG A 160 8.029 1.349 -0.840 1.00 0.00 H new ATOM 421 N ILE A 161 2.368 -2.263 -5.618 1.00 0.00 N ATOM 422 CA ILE A 161 1.937 -1.242 -6.558 1.00 0.00 C ATOM 423 C ILE A 161 2.723 0.046 -6.301 1.00 0.00 C ATOM 424 O ILE A 161 2.721 0.565 -5.186 1.00 0.00 O ATOM 425 CB ILE A 161 0.420 -1.059 -6.494 1.00 0.00 C ATOM 426 CG1 ILE A 161 -0.147 -0.697 -7.868 1.00 0.00 C ATOM 427 CG2 ILE A 161 0.035 -0.034 -5.426 1.00 0.00 C ATOM 428 CD1 ILE A 161 -0.937 -1.865 -8.462 1.00 0.00 C ATOM 0 H ILE A 161 1.777 -2.359 -4.792 1.00 0.00 H new ATOM 0 HA ILE A 161 2.154 -1.551 -7.581 1.00 0.00 H new ATOM 0 HB ILE A 161 -0.026 -2.010 -6.202 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -0.794 0.176 -7.780 1.00 0.00 H new ATOM 0 HG13 ILE A 161 0.666 -0.425 -8.540 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -1.049 0.077 -5.402 1.00 0.00 H new ATOM 0 HG22 ILE A 161 0.387 -0.374 -4.452 1.00 0.00 H new ATOM 0 HG23 ILE A 161 0.493 0.927 -5.662 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -1.329 -1.580 -9.439 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -0.282 -2.729 -8.572 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -1.764 -2.119 -7.799 1.00 0.00 H new ATOM 440 N ARG A 162 3.375 0.523 -7.350 1.00 0.00 N ATOM 441 CA ARG A 162 4.163 1.739 -7.252 1.00 0.00 C ATOM 442 C ARG A 162 3.616 2.805 -8.203 1.00 0.00 C ATOM 443 O ARG A 162 3.803 4.000 -7.976 1.00 0.00 O ATOM 444 CB ARG A 162 5.632 1.473 -7.586 1.00 0.00 C ATOM 445 CG ARG A 162 5.778 0.901 -8.998 1.00 0.00 C ATOM 446 CD ARG A 162 6.458 1.906 -9.929 1.00 0.00 C ATOM 447 NE ARG A 162 7.440 1.213 -10.792 1.00 0.00 N ATOM 448 CZ ARG A 162 7.858 1.676 -11.978 1.00 0.00 C ATOM 449 NH1 ARG A 162 7.381 2.836 -12.450 1.00 0.00 N ATOM 450 NH2 ARG A 162 8.751 0.979 -12.693 1.00 0.00 N ATOM 0 H ARG A 162 3.374 0.089 -8.273 1.00 0.00 H new ATOM 0 HA ARG A 162 4.095 2.095 -6.224 1.00 0.00 H new ATOM 0 HB2 ARG A 162 6.201 2.399 -7.504 1.00 0.00 H new ATOM 0 HB3 ARG A 162 6.053 0.776 -6.862 1.00 0.00 H new ATOM 0 HG2 ARG A 162 6.361 -0.019 -8.963 1.00 0.00 H new ATOM 0 HG3 ARG A 162 4.796 0.641 -9.392 1.00 0.00 H new ATOM 0 HD2 ARG A 162 5.711 2.407 -10.544 1.00 0.00 H new ATOM 0 HD3 ARG A 162 6.957 2.677 -9.343 1.00 0.00 H new ATOM 0 HE ARG A 162 7.823 0.327 -10.463 1.00 0.00 H new ATOM 0 HH11 ARG A 162 6.700 3.366 -11.907 1.00 0.00 H new ATOM 0 HH12 ARG A 162 7.699 3.189 -13.353 1.00 0.00 H new ATOM 0 HH21 ARG A 162 9.113 0.095 -12.335 1.00 0.00 H new ATOM 0 HH22 ARG A 162 9.069 1.332 -13.596 1.00 0.00 H new ATOM 464 N ASP A 163 2.951 2.334 -9.248 1.00 0.00 N ATOM 465 CA ASP A 163 2.375 3.233 -10.235 1.00 0.00 C ATOM 466 C ASP A 163 0.925 2.825 -10.503 1.00 0.00 C ATOM 467 O ASP A 163 0.542 1.682 -10.261 1.00 0.00 O ATOM 468 CB ASP A 163 3.139 3.160 -11.558 1.00 0.00 C ATOM 469 CG ASP A 163 4.047 4.357 -11.848 1.00 0.00 C ATOM 470 OD1 ASP A 163 4.348 5.088 -10.880 1.00 0.00 O ATOM 471 OD2 ASP A 163 4.420 4.513 -13.030 1.00 0.00 O ATOM 0 H ASP A 163 2.798 1.343 -9.433 1.00 0.00 H new ATOM 0 HA ASP A 163 2.432 4.248 -9.842 1.00 0.00 H new ATOM 0 HB2 ASP A 163 3.745 2.254 -11.560 1.00 0.00 H new ATOM 0 HB3 ASP A 163 2.419 3.064 -12.371 1.00 0.00 H new ATOM 476 N LYS A 164 0.157 3.785 -11.000 1.00 0.00 N ATOM 477 CA LYS A 164 -1.243 3.541 -11.303 1.00 0.00 C ATOM 478 C LYS A 164 -1.773 4.671 -12.187 1.00 0.00 C ATOM 479 O LYS A 164 -2.644 5.434 -11.769 1.00 0.00 O ATOM 480 CB LYS A 164 -2.043 3.339 -10.016 1.00 0.00 C ATOM 481 CG LYS A 164 -1.957 4.575 -9.117 1.00 0.00 C ATOM 482 CD LYS A 164 -3.246 4.761 -8.315 1.00 0.00 C ATOM 483 CE LYS A 164 -3.532 6.245 -8.074 1.00 0.00 C ATOM 484 NZ LYS A 164 -3.673 6.517 -6.626 1.00 0.00 N ATOM 0 H LYS A 164 0.478 4.732 -11.200 1.00 0.00 H new ATOM 0 HA LYS A 164 -1.355 2.615 -11.868 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -3.085 3.134 -10.260 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -1.664 2.468 -9.481 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -1.112 4.475 -8.436 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -1.773 5.460 -9.726 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -4.080 4.308 -8.851 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -3.162 4.243 -7.360 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -2.724 6.849 -8.486 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -4.444 6.535 -8.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -3.867 7.528 -6.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -4.459 5.955 -6.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -2.792 6.259 -6.137 1.00 0.00 H new ATOM 498 N PRO A 165 -1.212 4.747 -13.423 1.00 0.00 N ATOM 499 CA PRO A 165 -1.619 5.772 -14.369 1.00 0.00 C ATOM 500 C PRO A 165 -2.987 5.449 -14.972 1.00 0.00 C ATOM 501 O PRO A 165 -3.447 6.138 -15.882 1.00 0.00 O ATOM 502 CB PRO A 165 -0.508 5.815 -15.405 1.00 0.00 C ATOM 503 CG PRO A 165 0.246 4.502 -15.263 1.00 0.00 C ATOM 504 CD PRO A 165 -0.178 3.862 -13.952 1.00 0.00 C ATOM 0 HA PRO A 165 -1.747 6.748 -13.902 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -0.915 5.925 -16.410 1.00 0.00 H new ATOM 0 HB3 PRO A 165 0.153 6.665 -15.234 1.00 0.00 H new ATOM 0 HG2 PRO A 165 0.023 3.841 -16.100 1.00 0.00 H new ATOM 0 HG3 PRO A 165 1.322 4.676 -15.272 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -0.562 2.854 -14.110 1.00 0.00 H new ATOM 0 HD3 PRO A 165 0.662 3.778 -13.263 1.00 0.00 H new ATOM 512 N GLU A 166 -3.600 4.401 -14.442 1.00 0.00 N ATOM 513 CA GLU A 166 -4.906 3.978 -14.917 1.00 0.00 C ATOM 514 C GLU A 166 -5.855 3.760 -13.736 1.00 0.00 C ATOM 515 O GLU A 166 -5.432 3.784 -12.582 1.00 0.00 O ATOM 516 CB GLU A 166 -4.797 2.715 -15.771 1.00 0.00 C ATOM 517 CG GLU A 166 -3.647 2.830 -16.775 1.00 0.00 C ATOM 518 CD GLU A 166 -4.040 3.713 -17.960 1.00 0.00 C ATOM 519 OE1 GLU A 166 -4.847 4.641 -17.734 1.00 0.00 O ATOM 520 OE2 GLU A 166 -3.525 3.441 -19.066 1.00 0.00 O ATOM 0 H GLU A 166 -3.216 3.832 -13.688 1.00 0.00 H new ATOM 0 HA GLU A 166 -5.315 4.768 -15.547 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -4.638 1.849 -15.128 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -5.734 2.549 -16.303 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -2.769 3.247 -16.282 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -3.371 1.838 -17.132 1.00 0.00 H new ATOM 527 N GLU A 167 -7.122 3.553 -14.066 1.00 0.00 N ATOM 528 CA GLU A 167 -8.134 3.332 -13.048 1.00 0.00 C ATOM 529 C GLU A 167 -8.659 1.897 -13.125 1.00 0.00 C ATOM 530 O GLU A 167 -9.869 1.674 -13.120 1.00 0.00 O ATOM 531 CB GLU A 167 -9.275 4.341 -13.180 1.00 0.00 C ATOM 532 CG GLU A 167 -8.785 5.763 -12.901 1.00 0.00 C ATOM 533 CD GLU A 167 -9.700 6.473 -11.901 1.00 0.00 C ATOM 534 OE1 GLU A 167 -9.917 5.889 -10.818 1.00 0.00 O ATOM 535 OE2 GLU A 167 -10.160 7.584 -12.242 1.00 0.00 O ATOM 0 H GLU A 167 -7.470 3.534 -15.025 1.00 0.00 H new ATOM 0 HA GLU A 167 -7.676 3.479 -12.070 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -9.697 4.288 -14.184 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -10.074 4.085 -12.484 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -7.768 5.731 -12.509 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -8.750 6.329 -13.832 1.00 0.00 H new ATOM 542 N GLN A 168 -7.724 0.961 -13.195 1.00 0.00 N ATOM 543 CA GLN A 168 -8.078 -0.446 -13.274 1.00 0.00 C ATOM 544 C GLN A 168 -6.826 -1.296 -13.503 1.00 0.00 C ATOM 545 O GLN A 168 -6.752 -2.434 -13.043 1.00 0.00 O ATOM 546 CB GLN A 168 -9.115 -0.690 -14.372 1.00 0.00 C ATOM 547 CG GLN A 168 -10.531 -0.724 -13.791 1.00 0.00 C ATOM 548 CD GLN A 168 -11.286 -1.970 -14.259 1.00 0.00 C ATOM 549 OE1 GLN A 168 -11.045 -2.509 -15.327 1.00 0.00 O ATOM 550 NE2 GLN A 168 -12.209 -2.396 -13.403 1.00 0.00 N ATOM 0 H GLN A 168 -6.722 1.149 -13.199 1.00 0.00 H new ATOM 0 HA GLN A 168 -8.526 -0.742 -12.325 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -9.045 0.096 -15.124 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -8.902 -1.633 -14.876 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -10.482 -0.712 -12.702 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -11.074 0.171 -14.095 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -12.360 -1.898 -12.526 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -12.767 -3.221 -13.623 1.00 0.00 H new ATOM 559 N TRP A 169 -5.875 -0.711 -14.215 1.00 0.00 N ATOM 560 CA TRP A 169 -4.630 -1.400 -14.511 1.00 0.00 C ATOM 561 C TRP A 169 -3.478 -0.539 -13.990 1.00 0.00 C ATOM 562 O TRP A 169 -3.115 0.460 -14.610 1.00 0.00 O ATOM 563 CB TRP A 169 -4.517 -1.711 -16.005 1.00 0.00 C ATOM 564 CG TRP A 169 -5.313 -2.939 -16.447 1.00 0.00 C ATOM 565 CD1 TRP A 169 -6.469 -2.974 -17.125 1.00 0.00 C ATOM 566 CD2 TRP A 169 -4.964 -4.320 -16.213 1.00 0.00 C ATOM 567 NE1 TRP A 169 -6.888 -4.271 -17.344 1.00 0.00 N ATOM 568 CE2 TRP A 169 -5.943 -5.115 -16.773 1.00 0.00 C ATOM 569 CE3 TRP A 169 -3.857 -4.878 -15.551 1.00 0.00 C ATOM 570 CZ2 TRP A 169 -5.915 -6.514 -16.726 1.00 0.00 C ATOM 571 CZ3 TRP A 169 -3.842 -6.278 -15.514 1.00 0.00 C ATOM 572 CH2 TRP A 169 -4.821 -7.093 -16.072 1.00 0.00 C ATOM 0 H TRP A 169 -5.941 0.233 -14.596 1.00 0.00 H new ATOM 0 HA TRP A 169 -4.596 -2.367 -14.010 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -4.859 -0.846 -16.573 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -3.467 -1.862 -16.256 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -7.005 -2.098 -17.458 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -7.735 -4.557 -17.835 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -3.079 -4.275 -15.106 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -6.695 -7.114 -17.170 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -3.012 -6.758 -15.017 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -4.738 -8.167 -16.001 1.00 0.00 H new ATOM 583 N TRP A 170 -2.933 -0.958 -12.858 1.00 0.00 N ATOM 584 CA TRP A 170 -1.829 -0.238 -12.246 1.00 0.00 C ATOM 585 C TRP A 170 -0.563 -1.081 -12.415 1.00 0.00 C ATOM 586 O TRP A 170 -0.636 -2.242 -12.817 1.00 0.00 O ATOM 587 CB TRP A 170 -2.133 0.096 -10.785 1.00 0.00 C ATOM 588 CG TRP A 170 -3.479 0.795 -10.574 1.00 0.00 C ATOM 589 CD1 TRP A 170 -4.255 1.386 -11.493 1.00 0.00 C ATOM 590 CD2 TRP A 170 -4.179 0.951 -9.322 1.00 0.00 C ATOM 591 NE1 TRP A 170 -5.399 1.910 -10.927 1.00 0.00 N ATOM 592 CE2 TRP A 170 -5.352 1.637 -9.565 1.00 0.00 C ATOM 593 CE3 TRP A 170 -3.833 0.527 -8.027 1.00 0.00 C ATOM 594 CZ2 TRP A 170 -6.273 1.959 -8.562 1.00 0.00 C ATOM 595 CZ3 TRP A 170 -4.765 0.856 -7.036 1.00 0.00 C ATOM 596 CH2 TRP A 170 -5.950 1.547 -7.264 1.00 0.00 C ATOM 0 H TRP A 170 -3.235 -1.788 -12.348 1.00 0.00 H new ATOM 0 HA TRP A 170 -1.677 0.723 -12.738 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -2.118 -0.825 -10.202 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -1.339 0.733 -10.396 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -4.015 1.445 -12.544 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -6.143 2.406 -11.418 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -2.921 -0.010 -7.814 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -7.184 2.497 -8.778 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -4.549 0.552 -6.023 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.618 1.765 -6.444 1.00 0.00 H new ATOM 607 N ASN A 171 0.567 -0.466 -12.099 1.00 0.00 N ATOM 608 CA ASN A 171 1.846 -1.145 -12.212 1.00 0.00 C ATOM 609 C ASN A 171 2.341 -1.524 -10.814 1.00 0.00 C ATOM 610 O ASN A 171 2.615 -0.652 -9.991 1.00 0.00 O ATOM 611 CB ASN A 171 2.897 -0.239 -12.855 1.00 0.00 C ATOM 612 CG ASN A 171 3.656 -0.978 -13.959 1.00 0.00 C ATOM 613 OD1 ASN A 171 4.436 -1.883 -13.712 1.00 0.00 O ATOM 614 ND2 ASN A 171 3.385 -0.543 -15.186 1.00 0.00 N ATOM 0 H ASN A 171 0.623 0.496 -11.764 1.00 0.00 H new ATOM 0 HA ASN A 171 1.704 -2.029 -12.833 1.00 0.00 H new ATOM 0 HB2 ASN A 171 2.415 0.646 -13.270 1.00 0.00 H new ATOM 0 HB3 ASN A 171 3.598 0.107 -12.095 1.00 0.00 H new ATOM 0 HD21 ASN A 171 3.841 -0.972 -15.991 1.00 0.00 H new ATOM 0 HD22 ASN A 171 2.721 0.219 -15.322 1.00 0.00 H new ATOM 621 N ALA A 172 2.441 -2.826 -10.589 1.00 0.00 N ATOM 622 CA ALA A 172 2.898 -3.331 -9.306 1.00 0.00 C ATOM 623 C ALA A 172 3.938 -4.429 -9.536 1.00 0.00 C ATOM 624 O ALA A 172 4.103 -4.907 -10.656 1.00 0.00 O ATOM 625 CB ALA A 172 1.698 -3.825 -8.495 1.00 0.00 C ATOM 0 H ALA A 172 2.213 -3.546 -11.274 1.00 0.00 H new ATOM 0 HA ALA A 172 3.377 -2.539 -8.730 1.00 0.00 H new ATOM 0 HB1 ALA A 172 2.041 -4.204 -7.532 1.00 0.00 H new ATOM 0 HB2 ALA A 172 1.003 -3.001 -8.334 1.00 0.00 H new ATOM 0 HB3 ALA A 172 1.194 -4.623 -9.040 1.00 0.00 H new ATOM 631 N GLU A 173 4.612 -4.796 -8.456 1.00 0.00 N ATOM 632 CA GLU A 173 5.632 -5.828 -8.526 1.00 0.00 C ATOM 633 C GLU A 173 5.074 -7.161 -8.022 1.00 0.00 C ATOM 634 O GLU A 173 4.088 -7.186 -7.287 1.00 0.00 O ATOM 635 CB GLU A 173 6.879 -5.423 -7.738 1.00 0.00 C ATOM 636 CG GLU A 173 7.818 -4.572 -8.595 1.00 0.00 C ATOM 637 CD GLU A 173 7.446 -3.089 -8.509 1.00 0.00 C ATOM 638 OE1 GLU A 173 6.228 -2.808 -8.523 1.00 0.00 O ATOM 639 OE2 GLU A 173 8.388 -2.271 -8.431 1.00 0.00 O ATOM 0 H GLU A 173 4.472 -4.397 -7.528 1.00 0.00 H new ATOM 0 HA GLU A 173 5.926 -5.950 -9.569 1.00 0.00 H new ATOM 0 HB2 GLU A 173 6.586 -4.864 -6.849 1.00 0.00 H new ATOM 0 HB3 GLU A 173 7.403 -6.316 -7.395 1.00 0.00 H new ATOM 0 HG2 GLU A 173 8.847 -4.712 -8.263 1.00 0.00 H new ATOM 0 HG3 GLU A 173 7.770 -4.903 -9.632 1.00 0.00 H new ATOM 646 N ASP A 174 5.730 -8.235 -8.437 1.00 0.00 N ATOM 647 CA ASP A 174 5.311 -9.568 -8.037 1.00 0.00 C ATOM 648 C ASP A 174 6.108 -10.000 -6.804 1.00 0.00 C ATOM 649 O ASP A 174 6.683 -9.163 -6.109 1.00 0.00 O ATOM 650 CB ASP A 174 5.573 -10.585 -9.149 1.00 0.00 C ATOM 651 CG ASP A 174 7.051 -10.851 -9.447 1.00 0.00 C ATOM 652 OD1 ASP A 174 7.883 -10.077 -8.924 1.00 0.00 O ATOM 653 OD2 ASP A 174 7.315 -11.820 -10.190 1.00 0.00 O ATOM 0 H ASP A 174 6.548 -8.209 -9.046 1.00 0.00 H new ATOM 0 HA ASP A 174 4.243 -9.535 -7.823 1.00 0.00 H new ATOM 0 HB2 ASP A 174 5.097 -11.528 -8.878 1.00 0.00 H new ATOM 0 HB3 ASP A 174 5.091 -10.235 -10.062 1.00 0.00 H new ATOM 658 N SER A 175 6.116 -11.303 -6.570 1.00 0.00 N ATOM 659 CA SER A 175 6.832 -11.855 -5.433 1.00 0.00 C ATOM 660 C SER A 175 8.317 -12.000 -5.771 1.00 0.00 C ATOM 661 O SER A 175 9.056 -12.678 -5.059 1.00 0.00 O ATOM 662 CB SER A 175 6.248 -13.206 -5.017 1.00 0.00 C ATOM 663 OG SER A 175 6.234 -13.369 -3.601 1.00 0.00 O ATOM 0 H SER A 175 5.638 -11.993 -7.149 1.00 0.00 H new ATOM 0 HA SER A 175 6.722 -11.169 -4.593 1.00 0.00 H new ATOM 0 HB2 SER A 175 5.232 -13.296 -5.402 1.00 0.00 H new ATOM 0 HB3 SER A 175 6.832 -14.008 -5.468 1.00 0.00 H new ATOM 0 HG SER A 175 5.853 -14.243 -3.376 1.00 0.00 H new ATOM 669 N GLU A 176 8.710 -11.353 -6.858 1.00 0.00 N ATOM 670 CA GLU A 176 10.093 -11.402 -7.299 1.00 0.00 C ATOM 671 C GLU A 176 10.589 -9.997 -7.648 1.00 0.00 C ATOM 672 O GLU A 176 11.767 -9.807 -7.949 1.00 0.00 O ATOM 673 CB GLU A 176 10.258 -12.352 -8.487 1.00 0.00 C ATOM 674 CG GLU A 176 10.035 -13.805 -8.063 1.00 0.00 C ATOM 675 CD GLU A 176 10.024 -14.735 -9.277 1.00 0.00 C ATOM 676 OE1 GLU A 176 9.593 -14.262 -10.351 1.00 0.00 O ATOM 677 OE2 GLU A 176 10.448 -15.898 -9.104 1.00 0.00 O ATOM 0 H GLU A 176 8.094 -10.792 -7.447 1.00 0.00 H new ATOM 0 HA GLU A 176 10.700 -11.788 -6.481 1.00 0.00 H new ATOM 0 HB2 GLU A 176 9.549 -12.086 -9.271 1.00 0.00 H new ATOM 0 HB3 GLU A 176 11.257 -12.242 -8.909 1.00 0.00 H new ATOM 0 HG2 GLU A 176 10.822 -14.111 -7.373 1.00 0.00 H new ATOM 0 HG3 GLU A 176 9.090 -13.890 -7.527 1.00 0.00 H new ATOM 684 N GLY A 177 9.666 -9.048 -7.595 1.00 0.00 N ATOM 685 CA GLY A 177 9.995 -7.666 -7.900 1.00 0.00 C ATOM 686 C GLY A 177 9.577 -7.307 -9.328 1.00 0.00 C ATOM 687 O GLY A 177 9.558 -6.133 -9.696 1.00 0.00 O ATOM 0 H GLY A 177 8.690 -9.209 -7.345 1.00 0.00 H new ATOM 0 HA2 GLY A 177 9.494 -7.004 -7.193 1.00 0.00 H new ATOM 0 HA3 GLY A 177 11.067 -7.508 -7.780 1.00 0.00 H new ATOM 691 N LYS A 178 9.255 -8.339 -10.094 1.00 0.00 N ATOM 692 CA LYS A 178 8.839 -8.148 -11.473 1.00 0.00 C ATOM 693 C LYS A 178 7.681 -7.150 -11.518 1.00 0.00 C ATOM 694 O LYS A 178 6.586 -7.441 -11.038 1.00 0.00 O ATOM 695 CB LYS A 178 8.518 -9.493 -12.128 1.00 0.00 C ATOM 696 CG LYS A 178 9.781 -10.343 -12.280 1.00 0.00 C ATOM 697 CD LYS A 178 9.994 -10.754 -13.738 1.00 0.00 C ATOM 698 CE LYS A 178 11.483 -10.890 -14.059 1.00 0.00 C ATOM 699 NZ LYS A 178 11.888 -9.886 -15.069 1.00 0.00 N ATOM 0 H LYS A 178 9.274 -9.311 -9.785 1.00 0.00 H new ATOM 0 HA LYS A 178 9.652 -7.721 -12.060 1.00 0.00 H new ATOM 0 HB2 LYS A 178 7.785 -10.029 -11.526 1.00 0.00 H new ATOM 0 HB3 LYS A 178 8.067 -9.327 -13.106 1.00 0.00 H new ATOM 0 HG2 LYS A 178 10.646 -9.782 -11.927 1.00 0.00 H new ATOM 0 HG3 LYS A 178 9.702 -11.233 -11.656 1.00 0.00 H new ATOM 0 HD2 LYS A 178 9.489 -11.701 -13.930 1.00 0.00 H new ATOM 0 HD3 LYS A 178 9.543 -10.013 -14.398 1.00 0.00 H new ATOM 0 HE2 LYS A 178 12.071 -10.758 -13.150 1.00 0.00 H new ATOM 0 HE3 LYS A 178 11.691 -11.893 -14.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 12.902 -9.991 -15.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 11.340 -10.030 -15.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 11.708 -8.930 -14.700 1.00 0.00 H new ATOM 713 N ARG A 179 7.960 -5.992 -12.099 1.00 0.00 N ATOM 714 CA ARG A 179 6.954 -4.950 -12.214 1.00 0.00 C ATOM 715 C ARG A 179 6.151 -5.126 -13.503 1.00 0.00 C ATOM 716 O ARG A 179 6.724 -5.245 -14.585 1.00 0.00 O ATOM 717 CB ARG A 179 7.597 -3.561 -12.207 1.00 0.00 C ATOM 718 CG ARG A 179 8.877 -3.553 -11.368 1.00 0.00 C ATOM 719 CD ARG A 179 10.063 -3.036 -12.182 1.00 0.00 C ATOM 720 NE ARG A 179 10.946 -2.214 -11.325 1.00 0.00 N ATOM 721 CZ ARG A 179 12.278 -2.146 -11.463 1.00 0.00 C ATOM 722 NH1 ARG A 179 12.887 -2.850 -12.426 1.00 0.00 N ATOM 723 NH2 ARG A 179 12.998 -1.375 -10.638 1.00 0.00 N ATOM 0 H ARG A 179 8.869 -5.753 -12.495 1.00 0.00 H new ATOM 0 HA ARG A 179 6.289 -5.035 -11.354 1.00 0.00 H new ATOM 0 HB2 ARG A 179 7.826 -3.257 -13.229 1.00 0.00 H new ATOM 0 HB3 ARG A 179 6.892 -2.832 -11.808 1.00 0.00 H new ATOM 0 HG2 ARG A 179 8.735 -2.926 -10.488 1.00 0.00 H new ATOM 0 HG3 ARG A 179 9.088 -4.561 -11.011 1.00 0.00 H new ATOM 0 HD2 ARG A 179 10.623 -3.874 -12.597 1.00 0.00 H new ATOM 0 HD3 ARG A 179 9.706 -2.443 -13.024 1.00 0.00 H new ATOM 0 HE ARG A 179 10.514 -1.664 -10.582 1.00 0.00 H new ATOM 0 HH11 ARG A 179 12.338 -3.437 -13.054 1.00 0.00 H new ATOM 0 HH12 ARG A 179 13.900 -2.799 -12.532 1.00 0.00 H new ATOM 0 HH21 ARG A 179 12.533 -0.840 -9.905 1.00 0.00 H new ATOM 0 HH22 ARG A 179 14.011 -1.323 -10.743 1.00 0.00 H new ATOM 737 N GLY A 180 4.835 -5.139 -13.346 1.00 0.00 N ATOM 738 CA GLY A 180 3.946 -5.298 -14.485 1.00 0.00 C ATOM 739 C GLY A 180 2.591 -4.640 -14.220 1.00 0.00 C ATOM 740 O GLY A 180 2.440 -3.889 -13.258 1.00 0.00 O ATOM 0 H GLY A 180 4.363 -5.042 -12.447 1.00 0.00 H new ATOM 0 HA2 GLY A 180 4.402 -4.856 -15.371 1.00 0.00 H new ATOM 0 HA3 GLY A 180 3.804 -6.358 -14.695 1.00 0.00 H new ATOM 744 N MET A 181 1.640 -4.947 -15.089 1.00 0.00 N ATOM 745 CA MET A 181 0.302 -4.396 -14.961 1.00 0.00 C ATOM 746 C MET A 181 -0.630 -5.376 -14.246 1.00 0.00 C ATOM 747 O MET A 181 -0.856 -6.485 -14.727 1.00 0.00 O ATOM 748 CB MET A 181 -0.256 -4.081 -16.350 1.00 0.00 C ATOM 749 CG MET A 181 0.458 -2.878 -16.969 1.00 0.00 C ATOM 750 SD MET A 181 -0.676 -1.508 -17.125 1.00 0.00 S ATOM 751 CE MET A 181 -0.528 -0.796 -15.495 1.00 0.00 C ATOM 0 H MET A 181 1.770 -5.571 -15.885 1.00 0.00 H new ATOM 0 HA MET A 181 0.361 -3.483 -14.368 1.00 0.00 H new ATOM 0 HB2 MET A 181 -0.140 -4.950 -16.998 1.00 0.00 H new ATOM 0 HB3 MET A 181 -1.324 -3.877 -16.279 1.00 0.00 H new ATOM 0 HG2 MET A 181 1.306 -2.590 -16.348 1.00 0.00 H new ATOM 0 HG3 MET A 181 0.855 -3.145 -17.948 1.00 0.00 H new ATOM 0 HE1 MET A 181 -0.788 0.262 -15.535 1.00 0.00 H new ATOM 0 HE2 MET A 181 -1.203 -1.310 -14.811 1.00 0.00 H new ATOM 0 HE3 MET A 181 0.498 -0.905 -15.142 1.00 0.00 H new ATOM 761 N ILE A 182 -1.145 -4.932 -13.109 1.00 0.00 N ATOM 762 CA ILE A 182 -2.046 -5.756 -12.323 1.00 0.00 C ATOM 763 C ILE A 182 -3.443 -5.134 -12.337 1.00 0.00 C ATOM 764 O ILE A 182 -3.583 -3.912 -12.281 1.00 0.00 O ATOM 765 CB ILE A 182 -1.484 -5.974 -10.916 1.00 0.00 C ATOM 766 CG1 ILE A 182 -1.377 -4.650 -10.158 1.00 0.00 C ATOM 767 CG2 ILE A 182 -0.146 -6.715 -10.969 1.00 0.00 C ATOM 768 CD1 ILE A 182 -1.648 -4.849 -8.666 1.00 0.00 C ATOM 0 H ILE A 182 -0.955 -4.011 -12.713 1.00 0.00 H new ATOM 0 HA ILE A 182 -2.135 -6.749 -12.763 1.00 0.00 H new ATOM 0 HB ILE A 182 -2.180 -6.606 -10.364 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -0.382 -4.227 -10.297 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -2.089 -3.934 -10.568 1.00 0.00 H new ATOM 0 HG21 ILE A 182 0.232 -6.857 -9.956 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -0.286 -7.686 -11.443 1.00 0.00 H new ATOM 0 HG23 ILE A 182 0.571 -6.130 -11.545 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -1.566 -3.892 -8.150 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -2.652 -5.250 -8.529 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -0.919 -5.547 -8.254 1.00 0.00 H new ATOM 780 N PRO A 183 -4.469 -6.024 -12.415 1.00 0.00 N ATOM 781 CA PRO A 183 -5.850 -5.573 -12.437 1.00 0.00 C ATOM 782 C PRO A 183 -6.303 -5.121 -11.047 1.00 0.00 C ATOM 783 O PRO A 183 -6.173 -5.864 -10.076 1.00 0.00 O ATOM 784 CB PRO A 183 -6.642 -6.760 -12.962 1.00 0.00 C ATOM 785 CG PRO A 183 -5.746 -7.974 -12.775 1.00 0.00 C ATOM 786 CD PRO A 183 -4.341 -7.476 -12.483 1.00 0.00 C ATOM 0 HA PRO A 183 -5.997 -4.699 -13.072 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -7.578 -6.877 -12.416 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -6.901 -6.623 -14.012 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -6.109 -8.594 -11.955 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -5.752 -8.595 -13.671 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -3.963 -7.884 -11.546 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -3.644 -7.776 -13.266 1.00 0.00 H new ATOM 794 N VAL A 184 -6.823 -3.904 -10.996 1.00 0.00 N ATOM 795 CA VAL A 184 -7.294 -3.343 -9.742 1.00 0.00 C ATOM 796 C VAL A 184 -8.588 -4.047 -9.329 1.00 0.00 C ATOM 797 O VAL A 184 -8.874 -4.181 -8.140 1.00 0.00 O ATOM 798 CB VAL A 184 -7.454 -1.827 -9.873 1.00 0.00 C ATOM 799 CG1 VAL A 184 -7.888 -1.205 -8.545 1.00 0.00 C ATOM 800 CG2 VAL A 184 -6.165 -1.183 -10.386 1.00 0.00 C ATOM 0 H VAL A 184 -6.929 -3.290 -11.804 1.00 0.00 H new ATOM 0 HA VAL A 184 -6.564 -3.511 -8.950 1.00 0.00 H new ATOM 0 HB VAL A 184 -8.239 -1.634 -10.605 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -7.994 -0.127 -8.666 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -8.843 -1.632 -8.238 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -7.136 -1.412 -7.783 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -6.305 -0.105 -10.470 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -5.353 -1.390 -9.689 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -5.917 -1.594 -11.365 1.00 0.00 H new ATOM 810 N PRO A 185 -9.357 -4.489 -10.360 1.00 0.00 N ATOM 811 CA PRO A 185 -10.614 -5.176 -10.116 1.00 0.00 C ATOM 812 C PRO A 185 -10.372 -6.608 -9.636 1.00 0.00 C ATOM 813 O PRO A 185 -11.204 -7.181 -8.934 1.00 0.00 O ATOM 814 CB PRO A 185 -11.361 -5.110 -11.438 1.00 0.00 C ATOM 815 CG PRO A 185 -10.312 -4.803 -12.495 1.00 0.00 C ATOM 816 CD PRO A 185 -9.051 -4.348 -11.780 1.00 0.00 C ATOM 0 HA PRO A 185 -11.199 -4.714 -9.320 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -11.864 -6.053 -11.650 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -12.129 -4.337 -11.414 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -10.110 -5.687 -13.101 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -10.668 -4.027 -13.172 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -8.194 -4.959 -12.063 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -8.804 -3.316 -12.031 1.00 0.00 H new ATOM 824 N TYR A 186 -9.229 -7.147 -10.035 1.00 0.00 N ATOM 825 CA TYR A 186 -8.867 -8.502 -9.655 1.00 0.00 C ATOM 826 C TYR A 186 -7.906 -8.499 -8.464 1.00 0.00 C ATOM 827 O TYR A 186 -7.450 -9.554 -8.027 1.00 0.00 O ATOM 828 CB TYR A 186 -8.156 -9.104 -10.867 1.00 0.00 C ATOM 829 CG TYR A 186 -9.104 -9.630 -11.947 1.00 0.00 C ATOM 830 CD1 TYR A 186 -10.046 -8.791 -12.507 1.00 0.00 C ATOM 831 CD2 TYR A 186 -9.018 -10.944 -12.360 1.00 0.00 C ATOM 832 CE1 TYR A 186 -10.939 -9.285 -13.522 1.00 0.00 C ATOM 833 CE2 TYR A 186 -9.911 -11.439 -13.376 1.00 0.00 C ATOM 834 CZ TYR A 186 -10.827 -10.586 -13.907 1.00 0.00 C ATOM 835 OH TYR A 186 -11.670 -11.053 -14.867 1.00 0.00 O ATOM 0 H TYR A 186 -8.541 -6.670 -10.618 1.00 0.00 H new ATOM 0 HA TYR A 186 -9.752 -9.069 -9.366 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -7.505 -8.348 -11.306 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -7.516 -9.920 -10.532 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -10.113 -7.763 -12.183 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -8.281 -11.601 -11.922 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -11.681 -8.639 -13.968 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -9.854 -12.465 -13.709 1.00 0.00 H new ATOM 0 HH TYR A 186 -11.475 -11.997 -15.042 1.00 0.00 H new ATOM 845 N VAL A 187 -7.625 -7.300 -7.973 1.00 0.00 N ATOM 846 CA VAL A 187 -6.727 -7.145 -6.842 1.00 0.00 C ATOM 847 C VAL A 187 -7.271 -6.064 -5.907 1.00 0.00 C ATOM 848 O VAL A 187 -8.088 -5.240 -6.315 1.00 0.00 O ATOM 849 CB VAL A 187 -5.309 -6.850 -7.337 1.00 0.00 C ATOM 850 CG1 VAL A 187 -4.970 -7.695 -8.566 1.00 0.00 C ATOM 851 CG2 VAL A 187 -5.131 -5.359 -7.629 1.00 0.00 C ATOM 0 H VAL A 187 -8.004 -6.427 -8.339 1.00 0.00 H new ATOM 0 HA VAL A 187 -6.671 -8.071 -6.269 1.00 0.00 H new ATOM 0 HB VAL A 187 -4.613 -7.121 -6.543 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -3.957 -7.466 -8.897 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -5.038 -8.752 -8.310 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -5.673 -7.470 -9.368 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -4.115 -5.176 -7.979 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -5.841 -5.051 -8.397 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -5.310 -4.786 -6.719 1.00 0.00 H new ATOM 861 N GLU A 188 -6.797 -6.103 -4.671 1.00 0.00 N ATOM 862 CA GLU A 188 -7.227 -5.136 -3.674 1.00 0.00 C ATOM 863 C GLU A 188 -6.073 -4.199 -3.313 1.00 0.00 C ATOM 864 O GLU A 188 -4.910 -4.597 -3.353 1.00 0.00 O ATOM 865 CB GLU A 188 -7.774 -5.839 -2.430 1.00 0.00 C ATOM 866 CG GLU A 188 -8.741 -4.929 -1.668 1.00 0.00 C ATOM 867 CD GLU A 188 -8.211 -4.617 -0.268 1.00 0.00 C ATOM 868 OE1 GLU A 188 -7.519 -5.497 0.287 1.00 0.00 O ATOM 869 OE2 GLU A 188 -8.511 -3.504 0.217 1.00 0.00 O ATOM 0 H GLU A 188 -6.120 -6.788 -4.337 1.00 0.00 H new ATOM 0 HA GLU A 188 -8.035 -4.539 -4.098 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -8.285 -6.757 -2.721 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -6.949 -6.127 -1.778 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -8.885 -4.001 -2.221 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -9.716 -5.410 -1.593 1.00 0.00 H new ATOM 876 N LYS A 189 -6.436 -2.973 -2.967 1.00 0.00 N ATOM 877 CA LYS A 189 -5.445 -1.975 -2.598 1.00 0.00 C ATOM 878 C LYS A 189 -5.153 -2.083 -1.100 1.00 0.00 C ATOM 879 O LYS A 189 -5.983 -1.707 -0.273 1.00 0.00 O ATOM 880 CB LYS A 189 -5.898 -0.582 -3.037 1.00 0.00 C ATOM 881 CG LYS A 189 -7.172 -0.161 -2.301 1.00 0.00 C ATOM 882 CD LYS A 189 -8.278 0.214 -3.288 1.00 0.00 C ATOM 883 CE LYS A 189 -8.434 1.733 -3.385 1.00 0.00 C ATOM 884 NZ LYS A 189 -8.248 2.185 -4.782 1.00 0.00 N ATOM 0 H LYS A 189 -7.402 -2.647 -2.934 1.00 0.00 H new ATOM 0 HA LYS A 189 -4.506 -2.159 -3.121 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -5.105 0.140 -2.841 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -6.076 -0.576 -4.112 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -7.512 -0.975 -1.661 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -6.957 0.687 -1.651 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -8.047 -0.195 -4.272 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -9.220 -0.232 -2.971 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -9.422 2.026 -3.030 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -7.705 2.221 -2.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -7.346 2.696 -4.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -8.238 1.360 -5.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -9.029 2.817 -5.049 1.00 0.00 H new ATOM 898 N TYR A 190 -3.971 -2.598 -0.795 1.00 0.00 N ATOM 899 CA TYR A 190 -3.559 -2.759 0.588 1.00 0.00 C ATOM 900 C TYR A 190 -2.572 -1.664 0.999 1.00 0.00 C ATOM 901 O TYR A 190 -2.436 -1.356 2.182 1.00 0.00 O ATOM 902 CB TYR A 190 -2.857 -4.116 0.664 1.00 0.00 C ATOM 903 CG TYR A 190 -2.604 -4.607 2.091 1.00 0.00 C ATOM 904 CD1 TYR A 190 -3.668 -4.889 2.923 1.00 0.00 C ATOM 905 CD2 TYR A 190 -1.311 -4.769 2.546 1.00 0.00 C ATOM 906 CE1 TYR A 190 -3.430 -5.352 4.265 1.00 0.00 C ATOM 907 CE2 TYR A 190 -1.073 -5.232 3.889 1.00 0.00 C ATOM 908 CZ TYR A 190 -2.144 -5.501 4.682 1.00 0.00 C ATOM 909 OH TYR A 190 -1.919 -5.937 5.951 1.00 0.00 O ATOM 0 H TYR A 190 -3.285 -2.909 -1.483 1.00 0.00 H new ATOM 0 HA TYR A 190 -4.420 -2.695 1.254 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -3.461 -4.856 0.138 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -1.904 -4.050 0.139 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -4.680 -4.762 2.567 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -0.478 -4.549 1.895 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -4.254 -5.576 4.926 1.00 0.00 H new ATOM 0 HE2 TYR A 190 -0.066 -5.363 4.258 1.00 0.00 H new ATOM 0 HH TYR A 190 -0.954 -5.997 6.110 1.00 0.00 H new ATOM 919 N GLY A 191 -1.909 -1.104 -0.002 1.00 0.00 N ATOM 920 CA GLY A 191 -0.938 -0.050 0.239 1.00 0.00 C ATOM 921 C GLY A 191 -0.352 0.467 -1.076 1.00 0.00 C ATOM 922 O GLY A 191 -0.791 0.070 -2.155 1.00 0.00 O ATOM 0 H GLY A 191 -2.025 -1.360 -0.982 1.00 0.00 H new ATOM 0 HA2 GLY A 191 -1.413 0.770 0.777 1.00 0.00 H new ATOM 0 HA3 GLY A 191 -0.137 -0.427 0.875 1.00 0.00 H new TER 926 GLY A 191