USER MOD reduce.3.24.130724 H: found=0, std=0, add=447, rem=0, adj=8 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 -32:sc= -4.45! USER MOD Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= -5.62! C(o=-5.6!,f=-9.8!) USER MOD Single : A 146 ASN : amide:sc= -2.71! C(o=-2.7!,f=-5.4!) 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+ 157:sc= -0.0089 (180deg=-0.65) USER MOD Single : A 168 GLN : amide:sc= -1.8! C(o=-1.8!,f=-2.1!) USER MOD Single : A 171 ASN : amide:sc= -2.48 K(o=-2.5,f=-7.5!) USER MOD Single : A 175 SER OG : rot 103:sc=0.000969 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 MET CE :methyl -162:sc= -5.05! (180deg=-6.36!) USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 189 LYS NZ :NH3+ -166:sc= -0.352 (180deg=-0.735) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 135 0.763 0.013 -0.309 1.00 0.00 N ATOM 2 CA CYS A 135 2.056 -0.188 -0.939 1.00 0.00 C ATOM 3 C CYS A 135 1.971 -1.430 -1.828 1.00 0.00 C ATOM 4 O CYS A 135 2.839 -1.658 -2.669 1.00 0.00 O ATOM 5 CB CYS A 135 3.178 -0.303 0.095 1.00 0.00 C ATOM 6 SG CYS A 135 3.339 -2.038 0.653 1.00 0.00 S ATOM 0 HA CYS A 135 2.302 0.679 -1.551 1.00 0.00 H new ATOM 0 HB2 CYS A 135 4.119 0.037 -0.338 1.00 0.00 H new ATOM 0 HB3 CYS A 135 2.967 0.343 0.947 1.00 0.00 H new ATOM 0 HG CYS A 135 2.171 -2.608 0.640 1.00 0.00 H new ATOM 12 N TYR A 136 0.915 -2.201 -1.612 1.00 0.00 N ATOM 13 CA TYR A 136 0.704 -3.415 -2.383 1.00 0.00 C ATOM 14 C TYR A 136 -0.788 -3.735 -2.505 1.00 0.00 C ATOM 15 O TYR A 136 -1.625 -3.028 -1.946 1.00 0.00 O ATOM 16 CB TYR A 136 1.391 -4.536 -1.601 1.00 0.00 C ATOM 17 CG TYR A 136 1.328 -4.364 -0.082 1.00 0.00 C ATOM 18 CD1 TYR A 136 0.210 -3.803 0.503 1.00 0.00 C ATOM 19 CD2 TYR A 136 2.387 -4.771 0.704 1.00 0.00 C ATOM 20 CE1 TYR A 136 0.151 -3.642 1.933 1.00 0.00 C ATOM 21 CE2 TYR A 136 2.327 -4.610 2.132 1.00 0.00 C ATOM 22 CZ TYR A 136 1.212 -4.053 2.677 1.00 0.00 C ATOM 23 OH TYR A 136 1.156 -3.901 4.027 1.00 0.00 O ATOM 0 H TYR A 136 0.196 -2.009 -0.914 1.00 0.00 H new ATOM 0 HA TYR A 136 1.103 -3.303 -3.391 1.00 0.00 H new ATOM 0 HB2 TYR A 136 0.930 -5.487 -1.868 1.00 0.00 H new ATOM 0 HB3 TYR A 136 2.436 -4.591 -1.907 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -0.619 -3.485 -0.111 1.00 0.00 H new ATOM 0 HD2 TYR A 136 3.261 -5.211 0.247 1.00 0.00 H new ATOM 0 HE1 TYR A 136 -0.717 -3.204 2.404 1.00 0.00 H new ATOM 0 HE2 TYR A 136 3.149 -4.924 2.758 1.00 0.00 H new ATOM 0 HH TYR A 136 1.983 -4.239 4.429 1.00 0.00 H new ATOM 33 N VAL A 137 -1.073 -4.799 -3.240 1.00 0.00 N ATOM 34 CA VAL A 137 -2.449 -5.221 -3.442 1.00 0.00 C ATOM 35 C VAL A 137 -2.514 -6.749 -3.442 1.00 0.00 C ATOM 36 O VAL A 137 -1.525 -7.417 -3.739 1.00 0.00 O ATOM 37 CB VAL A 137 -3.003 -4.599 -4.727 1.00 0.00 C ATOM 38 CG1 VAL A 137 -2.939 -3.072 -4.668 1.00 0.00 C ATOM 39 CG2 VAL A 137 -2.266 -5.132 -5.957 1.00 0.00 C ATOM 0 H VAL A 137 -0.375 -5.382 -3.703 1.00 0.00 H new ATOM 0 HA VAL A 137 -3.081 -4.869 -2.627 1.00 0.00 H new ATOM 0 HB VAL A 137 -4.051 -4.887 -4.814 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -3.338 -2.655 -5.593 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -3.530 -2.715 -3.824 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -1.903 -2.756 -4.545 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -2.679 -4.674 -6.856 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -1.206 -4.888 -5.880 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -2.387 -6.214 -6.013 1.00 0.00 H new ATOM 49 N ARG A 138 -3.690 -7.259 -3.105 1.00 0.00 N ATOM 50 CA ARG A 138 -3.897 -8.697 -3.061 1.00 0.00 C ATOM 51 C ARG A 138 -4.772 -9.142 -4.234 1.00 0.00 C ATOM 52 O ARG A 138 -5.946 -8.781 -4.311 1.00 0.00 O ATOM 53 CB ARG A 138 -4.563 -9.118 -1.749 1.00 0.00 C ATOM 54 CG ARG A 138 -4.796 -10.630 -1.713 1.00 0.00 C ATOM 55 CD ARG A 138 -4.154 -11.254 -0.472 1.00 0.00 C ATOM 56 NE ARG A 138 -4.767 -10.690 0.752 1.00 0.00 N ATOM 57 CZ ARG A 138 -5.155 -11.424 1.804 1.00 0.00 C ATOM 58 NH1 ARG A 138 -4.996 -12.755 1.787 1.00 0.00 N ATOM 59 NH2 ARG A 138 -5.701 -10.827 2.872 1.00 0.00 N ATOM 0 H ARG A 138 -4.509 -6.702 -2.860 1.00 0.00 H new ATOM 0 HA ARG A 138 -2.920 -9.175 -3.129 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -3.936 -8.823 -0.908 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -5.514 -8.597 -1.636 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -5.866 -10.837 -1.716 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -4.380 -11.087 -2.611 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -4.285 -12.336 -0.489 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -3.081 -11.063 -0.472 1.00 0.00 H new ATOM 0 HE ARG A 138 -4.902 -9.680 0.797 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -4.580 -13.209 0.974 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -5.291 -13.314 2.587 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -5.821 -9.814 2.884 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -5.996 -11.385 3.673 1.00 0.00 H new ATOM 73 N ALA A 139 -4.168 -9.922 -5.120 1.00 0.00 N ATOM 74 CA ALA A 139 -4.877 -10.420 -6.286 1.00 0.00 C ATOM 75 C ALA A 139 -5.722 -11.631 -5.884 1.00 0.00 C ATOM 76 O ALA A 139 -5.183 -12.695 -5.582 1.00 0.00 O ATOM 77 CB ALA A 139 -3.873 -10.751 -7.392 1.00 0.00 C ATOM 0 H ALA A 139 -3.195 -10.221 -5.053 1.00 0.00 H new ATOM 0 HA ALA A 139 -5.554 -9.660 -6.677 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -4.405 -11.125 -8.267 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -3.319 -9.852 -7.661 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -3.179 -11.513 -7.037 1.00 0.00 H new ATOM 83 N LEU A 140 -7.031 -11.428 -5.893 1.00 0.00 N ATOM 84 CA LEU A 140 -7.956 -12.491 -5.533 1.00 0.00 C ATOM 85 C LEU A 140 -8.303 -13.302 -6.783 1.00 0.00 C ATOM 86 O LEU A 140 -9.351 -13.945 -6.838 1.00 0.00 O ATOM 87 CB LEU A 140 -9.177 -11.917 -4.812 1.00 0.00 C ATOM 88 CG LEU A 140 -8.893 -11.142 -3.524 1.00 0.00 C ATOM 89 CD1 LEU A 140 -9.847 -9.956 -3.375 1.00 0.00 C ATOM 90 CD2 LEU A 140 -8.936 -12.068 -2.306 1.00 0.00 C ATOM 0 H LEU A 140 -7.474 -10.544 -6.144 1.00 0.00 H new ATOM 0 HA LEU A 140 -7.492 -13.178 -4.825 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -9.704 -11.257 -5.501 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -9.854 -12.738 -4.577 1.00 0.00 H new ATOM 0 HG LEU A 140 -7.883 -10.737 -3.586 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -9.623 -9.423 -2.451 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -9.724 -9.281 -4.222 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -10.875 -10.317 -3.345 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -8.731 -11.492 -1.404 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -9.924 -12.523 -2.229 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -8.184 -12.849 -2.416 1.00 0.00 H new ATOM 102 N PHE A 141 -7.405 -13.248 -7.754 1.00 0.00 N ATOM 103 CA PHE A 141 -7.604 -13.970 -8.999 1.00 0.00 C ATOM 104 C PHE A 141 -6.291 -14.582 -9.494 1.00 0.00 C ATOM 105 O PHE A 141 -5.221 -14.265 -8.977 1.00 0.00 O ATOM 106 CB PHE A 141 -8.101 -12.955 -10.031 1.00 0.00 C ATOM 107 CG PHE A 141 -8.761 -13.588 -11.258 1.00 0.00 C ATOM 108 CD1 PHE A 141 -9.974 -14.191 -11.141 1.00 0.00 C ATOM 109 CD2 PHE A 141 -8.135 -13.546 -12.464 1.00 0.00 C ATOM 110 CE1 PHE A 141 -10.588 -14.777 -12.280 1.00 0.00 C ATOM 111 CE2 PHE A 141 -8.748 -14.133 -13.602 1.00 0.00 C ATOM 112 CZ PHE A 141 -9.962 -14.736 -13.487 1.00 0.00 C ATOM 0 H PHE A 141 -6.537 -12.715 -7.704 1.00 0.00 H new ATOM 0 HA PHE A 141 -8.318 -14.780 -8.849 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -8.815 -12.285 -9.552 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -7.260 -12.343 -10.358 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -10.470 -14.224 -10.182 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -7.172 -13.066 -12.556 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -11.552 -15.255 -12.188 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -8.250 -14.101 -14.560 1.00 0.00 H new ATOM 0 HZ PHE A 141 -10.428 -15.182 -14.353 1.00 0.00 H new ATOM 122 N ASP A 142 -6.417 -15.446 -10.490 1.00 0.00 N ATOM 123 CA ASP A 142 -5.254 -16.104 -11.062 1.00 0.00 C ATOM 124 C ASP A 142 -4.996 -15.548 -12.463 1.00 0.00 C ATOM 125 O ASP A 142 -5.869 -15.603 -13.327 1.00 0.00 O ATOM 126 CB ASP A 142 -5.480 -17.613 -11.185 1.00 0.00 C ATOM 127 CG ASP A 142 -6.942 -18.056 -11.095 1.00 0.00 C ATOM 128 OD1 ASP A 142 -7.522 -17.882 -10.002 1.00 0.00 O ATOM 129 OD2 ASP A 142 -7.446 -18.561 -12.121 1.00 0.00 O ATOM 0 H ASP A 142 -7.307 -15.706 -10.916 1.00 0.00 H new ATOM 0 HA ASP A 142 -4.405 -15.919 -10.404 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -5.072 -17.950 -12.138 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -4.915 -18.115 -10.400 1.00 0.00 H new ATOM 134 N PHE A 143 -3.791 -15.026 -12.645 1.00 0.00 N ATOM 135 CA PHE A 143 -3.407 -14.461 -13.927 1.00 0.00 C ATOM 136 C PHE A 143 -1.893 -14.543 -14.131 1.00 0.00 C ATOM 137 O PHE A 143 -1.151 -13.695 -13.639 1.00 0.00 O ATOM 138 CB PHE A 143 -3.830 -12.990 -13.912 1.00 0.00 C ATOM 139 CG PHE A 143 -4.148 -12.421 -15.296 1.00 0.00 C ATOM 140 CD1 PHE A 143 -5.149 -12.964 -16.040 1.00 0.00 C ATOM 141 CD2 PHE A 143 -3.432 -11.372 -15.782 1.00 0.00 C ATOM 142 CE1 PHE A 143 -5.445 -12.435 -17.326 1.00 0.00 C ATOM 143 CE2 PHE A 143 -3.728 -10.843 -17.065 1.00 0.00 C ATOM 144 CZ PHE A 143 -4.728 -11.385 -17.810 1.00 0.00 C ATOM 0 H PHE A 143 -3.069 -14.983 -11.926 1.00 0.00 H new ATOM 0 HA PHE A 143 -3.885 -15.013 -14.736 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -4.708 -12.881 -13.275 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -3.034 -12.398 -13.461 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -5.719 -13.796 -15.654 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -2.637 -10.941 -15.191 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -6.238 -12.866 -17.918 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -3.159 -10.010 -17.450 1.00 0.00 H new ATOM 0 HZ PHE A 143 -4.953 -10.982 -18.786 1.00 0.00 H new ATOM 154 N ASN A 144 -1.480 -15.571 -14.857 1.00 0.00 N ATOM 155 CA ASN A 144 -0.068 -15.775 -15.132 1.00 0.00 C ATOM 156 C ASN A 144 0.123 -16.039 -16.626 1.00 0.00 C ATOM 157 O ASN A 144 -0.342 -17.053 -17.146 1.00 0.00 O ATOM 158 CB ASN A 144 0.473 -16.983 -14.364 1.00 0.00 C ATOM 159 CG ASN A 144 0.036 -16.943 -12.899 1.00 0.00 C ATOM 160 OD1 ASN A 144 0.696 -16.377 -12.043 1.00 0.00 O ATOM 161 ND2 ASN A 144 -1.110 -17.573 -12.659 1.00 0.00 N ATOM 0 H ASN A 144 -2.099 -16.272 -15.264 1.00 0.00 H new ATOM 0 HA ASN A 144 0.470 -14.880 -14.820 1.00 0.00 H new ATOM 0 HB2 ASN A 144 0.117 -17.903 -14.828 1.00 0.00 H new ATOM 0 HB3 ASN A 144 1.561 -16.997 -14.422 1.00 0.00 H new ATOM 0 HD21 ASN A 144 -1.487 -17.603 -11.712 1.00 0.00 H new ATOM 0 HD22 ASN A 144 -1.612 -18.027 -13.422 1.00 0.00 H new ATOM 168 N GLY A 145 0.809 -15.111 -17.276 1.00 0.00 N ATOM 169 CA GLY A 145 1.067 -15.231 -18.701 1.00 0.00 C ATOM 170 C GLY A 145 -0.138 -14.760 -19.518 1.00 0.00 C ATOM 171 O GLY A 145 -1.133 -15.474 -19.630 1.00 0.00 O ATOM 0 H GLY A 145 1.194 -14.272 -16.842 1.00 0.00 H new ATOM 0 HA2 GLY A 145 1.944 -14.641 -18.966 1.00 0.00 H new ATOM 0 HA3 GLY A 145 1.295 -16.268 -18.947 1.00 0.00 H new ATOM 175 N ASN A 146 -0.007 -13.564 -20.070 1.00 0.00 N ATOM 176 CA ASN A 146 -1.073 -12.990 -20.874 1.00 0.00 C ATOM 177 C ASN A 146 -0.469 -12.040 -21.912 1.00 0.00 C ATOM 178 O ASN A 146 -0.694 -12.201 -23.110 1.00 0.00 O ATOM 179 CB ASN A 146 -2.045 -12.187 -20.009 1.00 0.00 C ATOM 180 CG ASN A 146 -3.467 -12.262 -20.567 1.00 0.00 C ATOM 181 OD1 ASN A 146 -4.349 -12.894 -20.009 1.00 0.00 O ATOM 182 ND2 ASN A 146 -3.641 -11.583 -21.698 1.00 0.00 N ATOM 0 H ASN A 146 0.821 -12.976 -19.977 1.00 0.00 H new ATOM 0 HA ASN A 146 -1.609 -13.808 -21.355 1.00 0.00 H new ATOM 0 HB2 ASN A 146 -2.030 -12.570 -18.989 1.00 0.00 H new ATOM 0 HB3 ASN A 146 -1.723 -11.147 -19.964 1.00 0.00 H new ATOM 0 HD21 ASN A 146 -4.555 -11.571 -22.150 1.00 0.00 H new ATOM 0 HD22 ASN A 146 -2.860 -11.075 -22.113 1.00 0.00 H new ATOM 189 N ASP A 147 0.286 -11.073 -21.413 1.00 0.00 N ATOM 190 CA ASP A 147 0.924 -10.098 -22.281 1.00 0.00 C ATOM 191 C ASP A 147 2.232 -9.630 -21.640 1.00 0.00 C ATOM 192 O ASP A 147 2.425 -9.778 -20.434 1.00 0.00 O ATOM 193 CB ASP A 147 0.031 -8.872 -22.481 1.00 0.00 C ATOM 194 CG ASP A 147 -1.152 -8.769 -21.517 1.00 0.00 C ATOM 195 OD1 ASP A 147 -2.014 -9.673 -21.578 1.00 0.00 O ATOM 196 OD2 ASP A 147 -1.169 -7.788 -20.742 1.00 0.00 O ATOM 0 H ASP A 147 0.470 -10.944 -20.418 1.00 0.00 H new ATOM 0 HA ASP A 147 1.107 -10.573 -23.245 1.00 0.00 H new ATOM 0 HB2 ASP A 147 0.642 -7.975 -22.379 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -0.351 -8.882 -23.502 1.00 0.00 H new ATOM 201 N GLU A 148 3.097 -9.073 -22.475 1.00 0.00 N ATOM 202 CA GLU A 148 4.382 -8.582 -22.005 1.00 0.00 C ATOM 203 C GLU A 148 4.216 -7.213 -21.341 1.00 0.00 C ATOM 204 O GLU A 148 5.046 -6.325 -21.526 1.00 0.00 O ATOM 205 CB GLU A 148 5.396 -8.518 -23.149 1.00 0.00 C ATOM 206 CG GLU A 148 6.207 -9.811 -23.237 1.00 0.00 C ATOM 207 CD GLU A 148 5.326 -10.981 -23.681 1.00 0.00 C ATOM 208 OE1 GLU A 148 4.523 -10.766 -24.613 1.00 0.00 O ATOM 209 OE2 GLU A 148 5.476 -12.066 -23.077 1.00 0.00 O ATOM 0 H GLU A 148 2.933 -8.951 -23.474 1.00 0.00 H new ATOM 0 HA GLU A 148 4.767 -9.280 -21.262 1.00 0.00 H new ATOM 0 HB2 GLU A 148 4.876 -8.346 -24.091 1.00 0.00 H new ATOM 0 HB3 GLU A 148 6.068 -7.673 -22.997 1.00 0.00 H new ATOM 0 HG2 GLU A 148 7.029 -9.682 -23.941 1.00 0.00 H new ATOM 0 HG3 GLU A 148 6.651 -10.033 -22.267 1.00 0.00 H new ATOM 216 N GLU A 149 3.138 -7.087 -20.581 1.00 0.00 N ATOM 217 CA GLU A 149 2.853 -5.842 -19.888 1.00 0.00 C ATOM 218 C GLU A 149 2.161 -6.123 -18.554 1.00 0.00 C ATOM 219 O GLU A 149 2.328 -5.374 -17.593 1.00 0.00 O ATOM 220 CB GLU A 149 2.007 -4.912 -20.760 1.00 0.00 C ATOM 221 CG GLU A 149 0.573 -5.430 -20.883 1.00 0.00 C ATOM 222 CD GLU A 149 -0.119 -4.843 -22.116 1.00 0.00 C ATOM 223 OE1 GLU A 149 0.561 -4.762 -23.163 1.00 0.00 O ATOM 224 OE2 GLU A 149 -1.309 -4.488 -21.984 1.00 0.00 O ATOM 0 H GLU A 149 2.452 -7.826 -20.430 1.00 0.00 H new ATOM 0 HA GLU A 149 3.797 -5.337 -19.685 1.00 0.00 H new ATOM 0 HB2 GLU A 149 2.000 -3.911 -20.330 1.00 0.00 H new ATOM 0 HB3 GLU A 149 2.454 -4.830 -21.751 1.00 0.00 H new ATOM 0 HG2 GLU A 149 0.580 -6.518 -20.949 1.00 0.00 H new ATOM 0 HG3 GLU A 149 0.010 -5.169 -19.987 1.00 0.00 H new ATOM 231 N ASP A 150 1.398 -7.207 -18.536 1.00 0.00 N ATOM 232 CA ASP A 150 0.679 -7.596 -17.335 1.00 0.00 C ATOM 233 C ASP A 150 1.602 -8.424 -16.439 1.00 0.00 C ATOM 234 O ASP A 150 2.505 -9.102 -16.930 1.00 0.00 O ATOM 235 CB ASP A 150 -0.541 -8.454 -17.677 1.00 0.00 C ATOM 236 CG ASP A 150 -0.228 -9.904 -18.049 1.00 0.00 C ATOM 237 OD1 ASP A 150 0.916 -10.142 -18.494 1.00 0.00 O ATOM 238 OD2 ASP A 150 -1.139 -10.744 -17.881 1.00 0.00 O ATOM 0 H ASP A 150 1.262 -7.828 -19.334 1.00 0.00 H new ATOM 0 HA ASP A 150 0.351 -6.688 -16.829 1.00 0.00 H new ATOM 0 HB2 ASP A 150 -1.219 -8.452 -16.823 1.00 0.00 H new ATOM 0 HB3 ASP A 150 -1.073 -7.988 -18.507 1.00 0.00 H new ATOM 243 N LEU A 151 1.347 -8.342 -15.142 1.00 0.00 N ATOM 244 CA LEU A 151 2.144 -9.075 -14.174 1.00 0.00 C ATOM 245 C LEU A 151 1.440 -10.389 -13.830 1.00 0.00 C ATOM 246 O LEU A 151 0.260 -10.393 -13.484 1.00 0.00 O ATOM 247 CB LEU A 151 2.444 -8.200 -12.955 1.00 0.00 C ATOM 248 CG LEU A 151 3.624 -8.641 -12.087 1.00 0.00 C ATOM 249 CD1 LEU A 151 4.951 -8.433 -12.821 1.00 0.00 C ATOM 250 CD2 LEU A 151 3.602 -7.933 -10.730 1.00 0.00 C ATOM 0 H LEU A 151 0.599 -7.778 -14.738 1.00 0.00 H new ATOM 0 HA LEU A 151 3.114 -9.335 -14.598 1.00 0.00 H new ATOM 0 HB2 LEU A 151 2.632 -7.183 -13.300 1.00 0.00 H new ATOM 0 HB3 LEU A 151 1.552 -8.164 -12.330 1.00 0.00 H new ATOM 0 HG LEU A 151 3.526 -9.709 -11.894 1.00 0.00 H new ATOM 0 HD11 LEU A 151 5.774 -8.754 -12.183 1.00 0.00 H new ATOM 0 HD12 LEU A 151 4.954 -9.019 -13.740 1.00 0.00 H new ATOM 0 HD13 LEU A 151 5.071 -7.377 -13.064 1.00 0.00 H new ATOM 0 HD21 LEU A 151 4.451 -8.265 -10.133 1.00 0.00 H new ATOM 0 HD22 LEU A 151 3.663 -6.855 -10.881 1.00 0.00 H new ATOM 0 HD23 LEU A 151 2.676 -8.174 -10.209 1.00 0.00 H new ATOM 262 N PRO A 152 2.214 -11.501 -13.942 1.00 0.00 N ATOM 263 CA PRO A 152 1.677 -12.820 -13.646 1.00 0.00 C ATOM 264 C PRO A 152 1.534 -13.029 -12.138 1.00 0.00 C ATOM 265 O PRO A 152 2.380 -12.584 -11.363 1.00 0.00 O ATOM 266 CB PRO A 152 2.650 -13.794 -14.291 1.00 0.00 C ATOM 267 CG PRO A 152 3.933 -13.011 -14.521 1.00 0.00 C ATOM 268 CD PRO A 152 3.615 -11.535 -14.350 1.00 0.00 C ATOM 0 HA PRO A 152 0.671 -12.962 -14.040 1.00 0.00 H new ATOM 0 HB2 PRO A 152 2.828 -14.654 -13.645 1.00 0.00 H new ATOM 0 HB3 PRO A 152 2.253 -14.178 -15.231 1.00 0.00 H new ATOM 0 HG2 PRO A 152 4.701 -13.321 -13.813 1.00 0.00 H new ATOM 0 HG3 PRO A 152 4.324 -13.204 -15.520 1.00 0.00 H new ATOM 0 HD2 PRO A 152 4.257 -11.076 -13.598 1.00 0.00 H new ATOM 0 HD3 PRO A 152 3.770 -10.987 -15.279 1.00 0.00 H new ATOM 276 N PHE A 153 0.457 -13.704 -11.766 1.00 0.00 N ATOM 277 CA PHE A 153 0.193 -13.978 -10.364 1.00 0.00 C ATOM 278 C PHE A 153 -0.874 -15.063 -10.208 1.00 0.00 C ATOM 279 O PHE A 153 -1.388 -15.580 -11.200 1.00 0.00 O ATOM 280 CB PHE A 153 -0.326 -12.678 -9.745 1.00 0.00 C ATOM 281 CG PHE A 153 -1.615 -12.155 -10.383 1.00 0.00 C ATOM 282 CD1 PHE A 153 -2.781 -12.834 -10.215 1.00 0.00 C ATOM 283 CD2 PHE A 153 -1.594 -11.012 -11.120 1.00 0.00 C ATOM 284 CE1 PHE A 153 -3.978 -12.349 -10.807 1.00 0.00 C ATOM 285 CE2 PHE A 153 -2.790 -10.527 -11.712 1.00 0.00 C ATOM 286 CZ PHE A 153 -3.956 -11.205 -11.543 1.00 0.00 C ATOM 0 H PHE A 153 -0.243 -14.069 -12.411 1.00 0.00 H new ATOM 0 HA PHE A 153 1.103 -14.328 -9.876 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -0.499 -12.838 -8.681 1.00 0.00 H new ATOM 0 HB3 PHE A 153 0.446 -11.913 -9.831 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -2.797 -13.742 -9.631 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -0.668 -10.473 -11.255 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -4.904 -12.888 -10.673 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -2.773 -9.619 -12.297 1.00 0.00 H new ATOM 0 HZ PHE A 153 -4.865 -10.835 -11.993 1.00 0.00 H new ATOM 296 N LYS A 154 -1.177 -15.376 -8.957 1.00 0.00 N ATOM 297 CA LYS A 154 -2.174 -16.391 -8.659 1.00 0.00 C ATOM 298 C LYS A 154 -3.088 -15.888 -7.540 1.00 0.00 C ATOM 299 O LYS A 154 -2.637 -15.198 -6.627 1.00 0.00 O ATOM 300 CB LYS A 154 -1.500 -17.729 -8.349 1.00 0.00 C ATOM 301 CG LYS A 154 -2.262 -18.487 -7.260 1.00 0.00 C ATOM 302 CD LYS A 154 -1.645 -19.866 -7.018 1.00 0.00 C ATOM 303 CE LYS A 154 -2.435 -20.955 -7.745 1.00 0.00 C ATOM 304 NZ LYS A 154 -2.076 -22.292 -7.221 1.00 0.00 N ATOM 0 H LYS A 154 -0.750 -14.945 -8.137 1.00 0.00 H new ATOM 0 HA LYS A 154 -2.805 -16.573 -9.529 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -1.453 -18.335 -9.254 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -0.473 -17.557 -8.027 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -2.249 -17.911 -6.334 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -3.306 -18.598 -7.552 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -0.611 -19.871 -7.362 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -1.626 -20.078 -5.949 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -3.504 -20.783 -7.619 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -2.229 -20.910 -8.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -2.621 -23.020 -7.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -1.060 -22.459 -7.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -2.295 -22.337 -6.205 1.00 0.00 H new ATOM 318 N LYS A 155 -4.357 -16.254 -7.647 1.00 0.00 N ATOM 319 CA LYS A 155 -5.338 -15.849 -6.655 1.00 0.00 C ATOM 320 C LYS A 155 -4.701 -15.893 -5.266 1.00 0.00 C ATOM 321 O LYS A 155 -4.005 -16.848 -4.928 1.00 0.00 O ATOM 322 CB LYS A 155 -6.605 -16.698 -6.778 1.00 0.00 C ATOM 323 CG LYS A 155 -7.730 -16.135 -5.905 1.00 0.00 C ATOM 324 CD LYS A 155 -8.099 -17.113 -4.788 1.00 0.00 C ATOM 325 CE LYS A 155 -6.977 -17.210 -3.752 1.00 0.00 C ATOM 326 NZ LYS A 155 -7.364 -18.125 -2.655 1.00 0.00 N ATOM 0 H LYS A 155 -4.728 -16.826 -8.405 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.653 -14.820 -6.828 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -6.928 -16.727 -7.819 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -6.389 -17.725 -6.482 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -7.418 -15.184 -5.472 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -8.607 -15.933 -6.521 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -9.019 -16.787 -4.303 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -8.294 -18.098 -5.212 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -6.064 -17.568 -4.228 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -6.759 -16.221 -3.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -6.592 -18.180 -1.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -8.223 -17.767 -2.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -7.549 -19.072 -3.042 1.00 0.00 H new ATOM 340 N GLY A 156 -4.962 -14.846 -4.496 1.00 0.00 N ATOM 341 CA GLY A 156 -4.422 -14.753 -3.151 1.00 0.00 C ATOM 342 C GLY A 156 -2.944 -14.364 -3.179 1.00 0.00 C ATOM 343 O GLY A 156 -2.175 -14.768 -2.308 1.00 0.00 O ATOM 0 H GLY A 156 -5.541 -14.055 -4.779 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -4.985 -14.015 -2.580 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -4.540 -15.709 -2.641 1.00 0.00 H new ATOM 347 N ASP A 157 -2.590 -13.582 -4.188 1.00 0.00 N ATOM 348 CA ASP A 157 -1.216 -13.133 -4.341 1.00 0.00 C ATOM 349 C ASP A 157 -1.118 -11.659 -3.940 1.00 0.00 C ATOM 350 O ASP A 157 -2.134 -10.979 -3.808 1.00 0.00 O ATOM 351 CB ASP A 157 -0.754 -13.259 -5.795 1.00 0.00 C ATOM 352 CG ASP A 157 0.607 -12.627 -6.097 1.00 0.00 C ATOM 353 OD1 ASP A 157 0.613 -11.416 -6.408 1.00 0.00 O ATOM 354 OD2 ASP A 157 1.608 -13.370 -6.011 1.00 0.00 O ATOM 0 H ASP A 157 -3.231 -13.248 -4.908 1.00 0.00 H new ATOM 0 HA ASP A 157 -0.585 -13.756 -3.707 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -0.713 -14.316 -6.058 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -1.503 -12.799 -6.440 1.00 0.00 H new ATOM 359 N ILE A 158 0.115 -11.210 -3.756 1.00 0.00 N ATOM 360 CA ILE A 158 0.360 -9.830 -3.373 1.00 0.00 C ATOM 361 C ILE A 158 1.245 -9.162 -4.426 1.00 0.00 C ATOM 362 O ILE A 158 2.091 -9.814 -5.036 1.00 0.00 O ATOM 363 CB ILE A 158 0.931 -9.761 -1.955 1.00 0.00 C ATOM 364 CG1 ILE A 158 -0.112 -10.191 -0.922 1.00 0.00 C ATOM 365 CG2 ILE A 158 1.494 -8.370 -1.658 1.00 0.00 C ATOM 366 CD1 ILE A 158 -1.189 -9.117 -0.750 1.00 0.00 C ATOM 0 H ILE A 158 0.955 -11.778 -3.865 1.00 0.00 H new ATOM 0 HA ILE A 158 -0.575 -9.271 -3.342 1.00 0.00 H new ATOM 0 HB ILE A 158 1.760 -10.465 -1.886 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -0.574 -11.128 -1.235 1.00 0.00 H new ATOM 0 HG13 ILE A 158 0.375 -10.379 0.035 1.00 0.00 H new ATOM 0 HG21 ILE A 158 1.893 -8.348 -0.644 1.00 0.00 H new ATOM 0 HG22 ILE A 158 2.290 -8.141 -2.367 1.00 0.00 H new ATOM 0 HG23 ILE A 158 0.700 -7.629 -1.751 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -1.918 -9.448 -0.010 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -0.727 -8.189 -0.414 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -1.690 -8.949 -1.703 1.00 0.00 H new ATOM 378 N LEU A 159 1.020 -7.869 -4.608 1.00 0.00 N ATOM 379 CA LEU A 159 1.787 -7.104 -5.577 1.00 0.00 C ATOM 380 C LEU A 159 1.993 -5.682 -5.051 1.00 0.00 C ATOM 381 O LEU A 159 1.053 -5.053 -4.569 1.00 0.00 O ATOM 382 CB LEU A 159 1.119 -7.161 -6.953 1.00 0.00 C ATOM 383 CG LEU A 159 0.488 -8.500 -7.337 1.00 0.00 C ATOM 384 CD1 LEU A 159 -0.751 -8.291 -8.211 1.00 0.00 C ATOM 385 CD2 LEU A 159 1.513 -9.417 -8.008 1.00 0.00 C ATOM 0 H LEU A 159 0.317 -7.331 -4.101 1.00 0.00 H new ATOM 0 HA LEU A 159 2.777 -7.540 -5.710 1.00 0.00 H new ATOM 0 HB2 LEU A 159 0.346 -6.393 -6.992 1.00 0.00 H new ATOM 0 HB3 LEU A 159 1.863 -6.903 -7.707 1.00 0.00 H new ATOM 0 HG LEU A 159 0.159 -8.997 -6.424 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -1.181 -9.259 -8.470 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.487 -7.702 -7.664 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.469 -7.764 -9.122 1.00 0.00 H new ATOM 0 HD21 LEU A 159 1.038 -10.362 -8.271 1.00 0.00 H new ATOM 0 HD22 LEU A 159 1.893 -8.939 -8.911 1.00 0.00 H new ATOM 0 HD23 LEU A 159 2.338 -9.604 -7.321 1.00 0.00 H new ATOM 397 N ARG A 160 3.229 -5.219 -5.162 1.00 0.00 N ATOM 398 CA ARG A 160 3.570 -3.883 -4.703 1.00 0.00 C ATOM 399 C ARG A 160 3.325 -2.860 -5.815 1.00 0.00 C ATOM 400 O ARG A 160 4.100 -2.777 -6.767 1.00 0.00 O ATOM 401 CB ARG A 160 5.034 -3.808 -4.264 1.00 0.00 C ATOM 402 CG ARG A 160 5.403 -2.390 -3.822 1.00 0.00 C ATOM 403 CD ARG A 160 6.651 -1.895 -4.555 1.00 0.00 C ATOM 404 NE ARG A 160 7.326 -0.848 -3.755 1.00 0.00 N ATOM 405 CZ ARG A 160 7.907 -1.068 -2.568 1.00 0.00 C ATOM 406 NH1 ARG A 160 7.900 -2.298 -2.036 1.00 0.00 N ATOM 407 NH2 ARG A 160 8.496 -0.057 -1.912 1.00 0.00 N ATOM 0 H ARG A 160 4.006 -5.744 -5.563 1.00 0.00 H new ATOM 0 HA ARG A 160 2.934 -3.654 -3.848 1.00 0.00 H new ATOM 0 HB2 ARG A 160 5.207 -4.505 -3.444 1.00 0.00 H new ATOM 0 HB3 ARG A 160 5.680 -4.116 -5.086 1.00 0.00 H new ATOM 0 HG2 ARG A 160 4.570 -1.715 -4.019 1.00 0.00 H new ATOM 0 HG3 ARG A 160 5.578 -2.375 -2.746 1.00 0.00 H new ATOM 0 HD2 ARG A 160 7.333 -2.727 -4.731 1.00 0.00 H new ATOM 0 HD3 ARG A 160 6.375 -1.497 -5.532 1.00 0.00 H new ATOM 0 HE ARG A 160 7.350 0.100 -4.131 1.00 0.00 H new ATOM 0 HH11 ARG A 160 7.452 -3.067 -2.535 1.00 0.00 H new ATOM 0 HH12 ARG A 160 8.342 -2.465 -1.132 1.00 0.00 H new ATOM 0 HH21 ARG A 160 8.501 0.879 -2.317 1.00 0.00 H new ATOM 0 HH22 ARG A 160 8.938 -0.224 -1.008 1.00 0.00 H new ATOM 421 N ILE A 161 2.246 -2.109 -5.657 1.00 0.00 N ATOM 422 CA ILE A 161 1.889 -1.097 -6.636 1.00 0.00 C ATOM 423 C ILE A 161 2.676 0.184 -6.349 1.00 0.00 C ATOM 424 O ILE A 161 2.688 0.668 -5.219 1.00 0.00 O ATOM 425 CB ILE A 161 0.373 -0.892 -6.668 1.00 0.00 C ATOM 426 CG1 ILE A 161 0.000 0.304 -7.546 1.00 0.00 C ATOM 427 CG2 ILE A 161 -0.192 -0.764 -5.253 1.00 0.00 C ATOM 428 CD1 ILE A 161 0.106 1.613 -6.763 1.00 0.00 C ATOM 0 H ILE A 161 1.607 -2.181 -4.865 1.00 0.00 H new ATOM 0 HA ILE A 161 2.164 -1.424 -7.639 1.00 0.00 H new ATOM 0 HB ILE A 161 -0.082 -1.775 -7.117 1.00 0.00 H new ATOM 0 HG12 ILE A 161 0.658 0.341 -8.414 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -1.016 0.182 -7.921 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -1.271 -0.619 -5.304 1.00 0.00 H new ATOM 0 HG22 ILE A 161 0.026 -1.672 -4.691 1.00 0.00 H new ATOM 0 HG23 ILE A 161 0.266 0.090 -4.754 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -0.164 2.447 -7.410 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -0.571 1.582 -5.909 1.00 0.00 H new ATOM 0 HD13 ILE A 161 1.129 1.744 -6.410 1.00 0.00 H new ATOM 440 N ARG A 162 3.314 0.695 -7.391 1.00 0.00 N ATOM 441 CA ARG A 162 4.102 1.910 -7.265 1.00 0.00 C ATOM 442 C ARG A 162 3.620 2.960 -8.267 1.00 0.00 C ATOM 443 O ARG A 162 3.847 4.155 -8.076 1.00 0.00 O ATOM 444 CB ARG A 162 5.587 1.631 -7.504 1.00 0.00 C ATOM 445 CG ARG A 162 6.441 2.839 -7.116 1.00 0.00 C ATOM 446 CD ARG A 162 7.863 2.410 -6.749 1.00 0.00 C ATOM 447 NE ARG A 162 8.357 3.217 -5.611 1.00 0.00 N ATOM 448 CZ ARG A 162 8.862 4.453 -5.731 1.00 0.00 C ATOM 449 NH1 ARG A 162 8.943 5.030 -6.936 1.00 0.00 N ATOM 450 NH2 ARG A 162 9.286 5.111 -4.643 1.00 0.00 N ATOM 0 H ARG A 162 3.302 0.290 -8.327 1.00 0.00 H new ATOM 0 HA ARG A 162 3.974 2.285 -6.250 1.00 0.00 H new ATOM 0 HB2 ARG A 162 5.895 0.762 -6.923 1.00 0.00 H new ATOM 0 HB3 ARG A 162 5.751 1.388 -8.554 1.00 0.00 H new ATOM 0 HG2 ARG A 162 6.473 3.547 -7.944 1.00 0.00 H new ATOM 0 HG3 ARG A 162 5.984 3.356 -6.272 1.00 0.00 H new ATOM 0 HD2 ARG A 162 7.877 1.352 -6.488 1.00 0.00 H new ATOM 0 HD3 ARG A 162 8.523 2.535 -7.608 1.00 0.00 H new ATOM 0 HE ARG A 162 8.310 2.808 -4.678 1.00 0.00 H new ATOM 0 HH11 ARG A 162 8.620 4.529 -7.764 1.00 0.00 H new ATOM 0 HH12 ARG A 162 9.327 5.970 -7.026 1.00 0.00 H new ATOM 0 HH21 ARG A 162 9.224 4.671 -3.725 1.00 0.00 H new ATOM 0 HH22 ARG A 162 9.670 6.051 -4.733 1.00 0.00 H new ATOM 464 N ASP A 163 2.964 2.479 -9.312 1.00 0.00 N ATOM 465 CA ASP A 163 2.449 3.363 -10.345 1.00 0.00 C ATOM 466 C ASP A 163 1.049 2.900 -10.753 1.00 0.00 C ATOM 467 O ASP A 163 0.689 1.741 -10.547 1.00 0.00 O ATOM 468 CB ASP A 163 3.338 3.334 -11.588 1.00 0.00 C ATOM 469 CG ASP A 163 4.502 2.343 -11.529 1.00 0.00 C ATOM 470 OD1 ASP A 163 5.010 2.130 -10.407 1.00 0.00 O ATOM 471 OD2 ASP A 163 4.859 1.820 -12.607 1.00 0.00 O ATOM 0 H ASP A 163 2.777 1.488 -9.466 1.00 0.00 H new ATOM 0 HA ASP A 163 2.426 4.376 -9.943 1.00 0.00 H new ATOM 0 HB2 ASP A 163 2.720 3.093 -12.453 1.00 0.00 H new ATOM 0 HB3 ASP A 163 3.740 4.334 -11.752 1.00 0.00 H new ATOM 476 N LYS A 164 0.297 3.828 -11.326 1.00 0.00 N ATOM 477 CA LYS A 164 -1.056 3.530 -11.766 1.00 0.00 C ATOM 478 C LYS A 164 -1.448 4.496 -12.885 1.00 0.00 C ATOM 479 O LYS A 164 -2.208 5.435 -12.661 1.00 0.00 O ATOM 480 CB LYS A 164 -2.020 3.541 -10.578 1.00 0.00 C ATOM 481 CG LYS A 164 -2.038 4.913 -9.900 1.00 0.00 C ATOM 482 CD LYS A 164 -1.333 4.863 -8.543 1.00 0.00 C ATOM 483 CE LYS A 164 -0.351 6.027 -8.392 1.00 0.00 C ATOM 484 NZ LYS A 164 0.936 5.550 -7.839 1.00 0.00 N ATOM 0 H LYS A 164 0.599 4.787 -11.496 1.00 0.00 H new ATOM 0 HA LYS A 164 -1.109 2.523 -12.181 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -3.024 3.286 -10.917 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -1.724 2.779 -9.857 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -1.549 5.646 -10.541 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -3.068 5.243 -9.767 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -2.073 4.901 -7.743 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -0.800 3.918 -8.440 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -0.185 6.499 -9.361 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -0.776 6.787 -7.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 1.692 6.216 -8.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 0.867 5.487 -6.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 1.155 4.611 -8.229 1.00 0.00 H new ATOM 498 N PRO A 165 -0.897 4.222 -14.099 1.00 0.00 N ATOM 499 CA PRO A 165 -1.182 5.056 -15.255 1.00 0.00 C ATOM 500 C PRO A 165 -2.587 4.785 -15.793 1.00 0.00 C ATOM 501 O PRO A 165 -3.017 5.414 -16.759 1.00 0.00 O ATOM 502 CB PRO A 165 -0.087 4.726 -16.257 1.00 0.00 C ATOM 503 CG PRO A 165 0.493 3.392 -15.815 1.00 0.00 C ATOM 504 CD PRO A 165 0.008 3.117 -14.402 1.00 0.00 C ATOM 0 HA PRO A 165 -1.179 6.120 -15.018 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -0.489 4.661 -17.268 1.00 0.00 H new ATOM 0 HB3 PRO A 165 0.679 5.501 -16.268 1.00 0.00 H new ATOM 0 HG2 PRO A 165 0.176 2.596 -16.489 1.00 0.00 H new ATOM 0 HG3 PRO A 165 1.582 3.421 -15.846 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -0.504 2.157 -14.339 1.00 0.00 H new ATOM 0 HD3 PRO A 165 0.839 3.082 -13.698 1.00 0.00 H new ATOM 512 N GLU A 166 -3.265 3.849 -15.145 1.00 0.00 N ATOM 513 CA GLU A 166 -4.613 3.487 -15.547 1.00 0.00 C ATOM 514 C GLU A 166 -5.559 3.544 -14.345 1.00 0.00 C ATOM 515 O GLU A 166 -5.116 3.716 -13.211 1.00 0.00 O ATOM 516 CB GLU A 166 -4.638 2.104 -16.199 1.00 0.00 C ATOM 517 CG GLU A 166 -3.447 1.921 -17.141 1.00 0.00 C ATOM 518 CD GLU A 166 -3.902 1.399 -18.506 1.00 0.00 C ATOM 519 OE1 GLU A 166 -4.654 2.140 -19.175 1.00 0.00 O ATOM 520 OE2 GLU A 166 -3.487 0.270 -18.849 1.00 0.00 O ATOM 0 H GLU A 166 -2.905 3.330 -14.344 1.00 0.00 H new ATOM 0 HA GLU A 166 -4.956 4.208 -16.289 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -4.618 1.334 -15.428 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -5.568 1.976 -16.753 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -2.928 2.871 -17.266 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -2.734 1.224 -16.700 1.00 0.00 H new ATOM 527 N GLU A 167 -6.843 3.395 -14.635 1.00 0.00 N ATOM 528 CA GLU A 167 -7.855 3.428 -13.593 1.00 0.00 C ATOM 529 C GLU A 167 -8.281 2.006 -13.223 1.00 0.00 C ATOM 530 O GLU A 167 -9.306 1.811 -12.572 1.00 0.00 O ATOM 531 CB GLU A 167 -9.059 4.268 -14.023 1.00 0.00 C ATOM 532 CG GLU A 167 -8.750 5.763 -13.921 1.00 0.00 C ATOM 533 CD GLU A 167 -9.681 6.447 -12.919 1.00 0.00 C ATOM 534 OE1 GLU A 167 -9.594 6.088 -11.725 1.00 0.00 O ATOM 535 OE2 GLU A 167 -10.459 7.316 -13.370 1.00 0.00 O ATOM 0 H GLU A 167 -7.206 3.251 -15.577 1.00 0.00 H new ATOM 0 HA GLU A 167 -7.424 3.899 -12.709 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -9.333 4.019 -15.048 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -9.917 4.027 -13.396 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -7.713 5.904 -13.615 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -8.859 6.228 -14.901 1.00 0.00 H new ATOM 542 N GLN A 168 -7.473 1.048 -13.654 1.00 0.00 N ATOM 543 CA GLN A 168 -7.754 -0.349 -13.377 1.00 0.00 C ATOM 544 C GLN A 168 -6.462 -1.167 -13.412 1.00 0.00 C ATOM 545 O GLN A 168 -6.218 -1.989 -12.529 1.00 0.00 O ATOM 546 CB GLN A 168 -8.783 -0.908 -14.362 1.00 0.00 C ATOM 547 CG GLN A 168 -10.202 -0.496 -13.965 1.00 0.00 C ATOM 548 CD GLN A 168 -11.193 -1.636 -14.212 1.00 0.00 C ATOM 549 OE1 GLN A 168 -11.025 -2.459 -15.097 1.00 0.00 O ATOM 550 NE2 GLN A 168 -12.233 -1.638 -13.382 1.00 0.00 N ATOM 0 H GLN A 168 -6.623 1.213 -14.193 1.00 0.00 H new ATOM 0 HA GLN A 168 -8.181 -0.422 -12.377 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -8.563 -0.547 -15.367 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -8.711 -1.995 -14.391 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -10.222 -0.214 -12.912 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -10.503 0.382 -14.536 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -12.313 -0.919 -12.663 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -12.950 -2.358 -13.465 1.00 0.00 H new ATOM 559 N TRP A 169 -5.667 -0.917 -14.442 1.00 0.00 N ATOM 560 CA TRP A 169 -4.406 -1.619 -14.604 1.00 0.00 C ATOM 561 C TRP A 169 -3.291 -0.718 -14.071 1.00 0.00 C ATOM 562 O TRP A 169 -2.887 0.235 -14.735 1.00 0.00 O ATOM 563 CB TRP A 169 -4.193 -2.036 -16.061 1.00 0.00 C ATOM 564 CG TRP A 169 -5.080 -3.199 -16.511 1.00 0.00 C ATOM 565 CD1 TRP A 169 -6.282 -3.139 -17.101 1.00 0.00 C ATOM 566 CD2 TRP A 169 -4.783 -4.606 -16.386 1.00 0.00 C ATOM 567 NE1 TRP A 169 -6.780 -4.399 -17.362 1.00 0.00 N ATOM 568 CE2 TRP A 169 -5.839 -5.319 -16.913 1.00 0.00 C ATOM 569 CE3 TRP A 169 -3.659 -5.253 -15.842 1.00 0.00 C ATOM 570 CZ2 TRP A 169 -5.876 -6.718 -16.950 1.00 0.00 C ATOM 571 CZ3 TRP A 169 -3.711 -6.651 -15.888 1.00 0.00 C ATOM 572 CH2 TRP A 169 -4.767 -7.385 -16.415 1.00 0.00 C ATOM 0 H TRP A 169 -5.873 -0.237 -15.174 1.00 0.00 H new ATOM 0 HA TRP A 169 -4.406 -2.547 -14.033 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -4.382 -1.178 -16.705 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -3.148 -2.314 -16.200 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -6.796 -2.220 -17.342 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -7.674 -4.616 -17.803 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -2.822 -4.714 -15.422 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -6.715 -7.254 -17.369 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -2.871 -7.198 -15.486 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -4.732 -8.464 -16.412 1.00 0.00 H new ATOM 583 N TRP A 170 -2.824 -1.052 -12.876 1.00 0.00 N ATOM 584 CA TRP A 170 -1.763 -0.284 -12.246 1.00 0.00 C ATOM 585 C TRP A 170 -0.485 -1.124 -12.285 1.00 0.00 C ATOM 586 O TRP A 170 -0.546 -2.351 -12.344 1.00 0.00 O ATOM 587 CB TRP A 170 -2.158 0.138 -10.830 1.00 0.00 C ATOM 588 CG TRP A 170 -3.440 0.971 -10.763 1.00 0.00 C ATOM 589 CD1 TRP A 170 -4.193 1.409 -11.781 1.00 0.00 C ATOM 590 CD2 TRP A 170 -4.093 1.451 -9.569 1.00 0.00 C ATOM 591 NE1 TRP A 170 -5.279 2.133 -11.333 1.00 0.00 N ATOM 592 CE2 TRP A 170 -5.216 2.159 -9.945 1.00 0.00 C ATOM 593 CE3 TRP A 170 -3.746 1.291 -8.215 1.00 0.00 C ATOM 594 CZ2 TRP A 170 -6.083 2.764 -9.027 1.00 0.00 C ATOM 595 CZ3 TRP A 170 -4.622 1.903 -7.311 1.00 0.00 C ATOM 596 CH2 TRP A 170 -5.757 2.619 -7.673 1.00 0.00 C ATOM 0 H TRP A 170 -3.161 -1.844 -12.328 1.00 0.00 H new ATOM 0 HA TRP A 170 -1.586 0.645 -12.787 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -2.285 -0.755 -10.218 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -1.341 0.711 -10.392 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -3.977 1.219 -12.822 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -5.996 2.569 -11.913 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -2.873 0.740 -7.898 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -6.956 3.313 -9.346 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -4.400 1.812 -6.258 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.385 3.061 -6.913 1.00 0.00 H new ATOM 607 N ASN A 171 0.643 -0.429 -12.250 1.00 0.00 N ATOM 608 CA ASN A 171 1.933 -1.097 -12.280 1.00 0.00 C ATOM 609 C ASN A 171 2.357 -1.442 -10.851 1.00 0.00 C ATOM 610 O ASN A 171 2.575 -0.551 -10.031 1.00 0.00 O ATOM 611 CB ASN A 171 3.007 -0.191 -12.885 1.00 0.00 C ATOM 612 CG ASN A 171 3.754 -0.904 -14.015 1.00 0.00 C ATOM 613 OD1 ASN A 171 3.376 -1.972 -14.465 1.00 0.00 O ATOM 614 ND2 ASN A 171 4.833 -0.255 -14.443 1.00 0.00 N ATOM 0 H ASN A 171 0.690 0.589 -12.201 1.00 0.00 H new ATOM 0 HA ASN A 171 1.834 -1.996 -12.888 1.00 0.00 H new ATOM 0 HB2 ASN A 171 2.546 0.720 -13.267 1.00 0.00 H new ATOM 0 HB3 ASN A 171 3.713 0.109 -12.111 1.00 0.00 H new ATOM 0 HD21 ASN A 171 5.401 -0.649 -15.193 1.00 0.00 H new ATOM 0 HD22 ASN A 171 5.093 0.637 -14.021 1.00 0.00 H new ATOM 621 N ALA A 172 2.463 -2.739 -10.597 1.00 0.00 N ATOM 622 CA ALA A 172 2.856 -3.213 -9.281 1.00 0.00 C ATOM 623 C ALA A 172 3.859 -4.359 -9.437 1.00 0.00 C ATOM 624 O ALA A 172 3.941 -4.978 -10.496 1.00 0.00 O ATOM 625 CB ALA A 172 1.613 -3.630 -8.495 1.00 0.00 C ATOM 0 H ALA A 172 2.284 -3.475 -11.280 1.00 0.00 H new ATOM 0 HA ALA A 172 3.345 -2.419 -8.717 1.00 0.00 H new ATOM 0 HB1 ALA A 172 1.909 -3.985 -7.508 1.00 0.00 H new ATOM 0 HB2 ALA A 172 0.946 -2.774 -8.388 1.00 0.00 H new ATOM 0 HB3 ALA A 172 1.096 -4.428 -9.028 1.00 0.00 H new ATOM 631 N GLU A 173 4.597 -4.606 -8.364 1.00 0.00 N ATOM 632 CA GLU A 173 5.591 -5.666 -8.368 1.00 0.00 C ATOM 633 C GLU A 173 4.960 -6.986 -7.923 1.00 0.00 C ATOM 634 O GLU A 173 3.944 -6.990 -7.229 1.00 0.00 O ATOM 635 CB GLU A 173 6.784 -5.303 -7.483 1.00 0.00 C ATOM 636 CG GLU A 173 7.873 -4.596 -8.293 1.00 0.00 C ATOM 637 CD GLU A 173 7.770 -3.077 -8.141 1.00 0.00 C ATOM 638 OE1 GLU A 173 6.622 -2.589 -8.073 1.00 0.00 O ATOM 639 OE2 GLU A 173 8.844 -2.437 -8.095 1.00 0.00 O ATOM 0 H GLU A 173 4.526 -4.091 -7.487 1.00 0.00 H new ATOM 0 HA GLU A 173 5.960 -5.787 -9.386 1.00 0.00 H new ATOM 0 HB2 GLU A 173 6.454 -4.657 -6.669 1.00 0.00 H new ATOM 0 HB3 GLU A 173 7.192 -6.206 -7.028 1.00 0.00 H new ATOM 0 HG2 GLU A 173 8.855 -4.933 -7.960 1.00 0.00 H new ATOM 0 HG3 GLU A 173 7.783 -4.867 -9.345 1.00 0.00 H new ATOM 646 N ASP A 174 5.588 -8.076 -8.340 1.00 0.00 N ATOM 647 CA ASP A 174 5.101 -9.400 -7.992 1.00 0.00 C ATOM 648 C ASP A 174 5.760 -9.856 -6.688 1.00 0.00 C ATOM 649 O ASP A 174 6.295 -9.038 -5.941 1.00 0.00 O ATOM 650 CB ASP A 174 5.450 -10.419 -9.079 1.00 0.00 C ATOM 651 CG ASP A 174 4.254 -11.166 -9.673 1.00 0.00 C ATOM 652 OD1 ASP A 174 3.186 -11.133 -9.025 1.00 0.00 O ATOM 653 OD2 ASP A 174 4.436 -11.752 -10.762 1.00 0.00 O ATOM 0 H ASP A 174 6.430 -8.069 -8.916 1.00 0.00 H new ATOM 0 HA ASP A 174 4.018 -9.343 -7.885 1.00 0.00 H new ATOM 0 HB2 ASP A 174 5.974 -9.904 -9.884 1.00 0.00 H new ATOM 0 HB3 ASP A 174 6.145 -11.149 -8.663 1.00 0.00 H new ATOM 658 N SER A 175 5.699 -11.159 -6.455 1.00 0.00 N ATOM 659 CA SER A 175 6.283 -11.732 -5.255 1.00 0.00 C ATOM 660 C SER A 175 7.792 -11.908 -5.440 1.00 0.00 C ATOM 661 O SER A 175 8.453 -12.535 -4.614 1.00 0.00 O ATOM 662 CB SER A 175 5.632 -13.073 -4.912 1.00 0.00 C ATOM 663 OG SER A 175 4.407 -12.906 -4.203 1.00 0.00 O ATOM 0 H SER A 175 5.254 -11.834 -7.077 1.00 0.00 H new ATOM 0 HA SER A 175 6.102 -11.047 -4.426 1.00 0.00 H new ATOM 0 HB2 SER A 175 5.447 -13.631 -5.830 1.00 0.00 H new ATOM 0 HB3 SER A 175 6.321 -13.667 -4.311 1.00 0.00 H new ATOM 0 HG SER A 175 3.654 -13.059 -4.811 1.00 0.00 H new ATOM 669 N GLU A 176 8.292 -11.342 -6.528 1.00 0.00 N ATOM 670 CA GLU A 176 9.711 -11.427 -6.832 1.00 0.00 C ATOM 671 C GLU A 176 10.260 -10.047 -7.197 1.00 0.00 C ATOM 672 O GLU A 176 11.465 -9.884 -7.381 1.00 0.00 O ATOM 673 CB GLU A 176 9.972 -12.435 -7.954 1.00 0.00 C ATOM 674 CG GLU A 176 9.669 -13.862 -7.490 1.00 0.00 C ATOM 675 CD GLU A 176 10.785 -14.393 -6.587 1.00 0.00 C ATOM 676 OE1 GLU A 176 11.898 -14.595 -7.119 1.00 0.00 O ATOM 677 OE2 GLU A 176 10.499 -14.584 -5.385 1.00 0.00 O ATOM 0 H GLU A 176 7.740 -10.822 -7.211 1.00 0.00 H new ATOM 0 HA GLU A 176 10.232 -11.780 -5.942 1.00 0.00 H new ATOM 0 HB2 GLU A 176 9.354 -12.191 -8.818 1.00 0.00 H new ATOM 0 HB3 GLU A 176 11.011 -12.366 -8.275 1.00 0.00 H new ATOM 0 HG2 GLU A 176 8.721 -13.880 -6.952 1.00 0.00 H new ATOM 0 HG3 GLU A 176 9.556 -14.514 -8.356 1.00 0.00 H new ATOM 684 N GLY A 177 9.349 -9.089 -7.290 1.00 0.00 N ATOM 685 CA GLY A 177 9.728 -7.728 -7.630 1.00 0.00 C ATOM 686 C GLY A 177 9.380 -7.409 -9.085 1.00 0.00 C ATOM 687 O GLY A 177 9.450 -6.255 -9.506 1.00 0.00 O ATOM 0 H GLY A 177 8.350 -9.228 -7.136 1.00 0.00 H new ATOM 0 HA2 GLY A 177 9.217 -7.028 -6.968 1.00 0.00 H new ATOM 0 HA3 GLY A 177 10.798 -7.594 -7.471 1.00 0.00 H new ATOM 691 N LYS A 178 9.015 -8.453 -9.815 1.00 0.00 N ATOM 692 CA LYS A 178 8.656 -8.298 -11.215 1.00 0.00 C ATOM 693 C LYS A 178 7.566 -7.232 -11.343 1.00 0.00 C ATOM 694 O LYS A 178 6.448 -7.422 -10.866 1.00 0.00 O ATOM 695 CB LYS A 178 8.270 -9.648 -11.821 1.00 0.00 C ATOM 696 CG LYS A 178 9.499 -10.544 -11.992 1.00 0.00 C ATOM 697 CD LYS A 178 9.580 -11.097 -13.416 1.00 0.00 C ATOM 698 CE LYS A 178 11.021 -11.080 -13.930 1.00 0.00 C ATOM 699 NZ LYS A 178 11.301 -12.292 -14.732 1.00 0.00 N ATOM 0 H LYS A 178 8.960 -9.409 -9.464 1.00 0.00 H new ATOM 0 HA LYS A 178 9.513 -7.949 -11.792 1.00 0.00 H new ATOM 0 HB2 LYS A 178 7.541 -10.143 -11.180 1.00 0.00 H new ATOM 0 HB3 LYS A 178 7.791 -9.493 -12.788 1.00 0.00 H new ATOM 0 HG2 LYS A 178 10.402 -9.976 -11.767 1.00 0.00 H new ATOM 0 HG3 LYS A 178 9.455 -11.368 -11.280 1.00 0.00 H new ATOM 0 HD2 LYS A 178 9.195 -12.117 -13.436 1.00 0.00 H new ATOM 0 HD3 LYS A 178 8.947 -10.504 -14.077 1.00 0.00 H new ATOM 0 HE2 LYS A 178 11.186 -10.190 -14.537 1.00 0.00 H new ATOM 0 HE3 LYS A 178 11.712 -11.026 -13.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 12.283 -12.264 -15.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 11.163 -13.138 -14.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 10.654 -12.327 -15.545 1.00 0.00 H new ATOM 713 N ARG A 179 7.929 -6.134 -11.989 1.00 0.00 N ATOM 714 CA ARG A 179 6.997 -5.038 -12.186 1.00 0.00 C ATOM 715 C ARG A 179 6.194 -5.249 -13.472 1.00 0.00 C ATOM 716 O ARG A 179 6.769 -5.449 -14.540 1.00 0.00 O ATOM 717 CB ARG A 179 7.730 -3.697 -12.264 1.00 0.00 C ATOM 718 CG ARG A 179 7.833 -3.047 -10.883 1.00 0.00 C ATOM 719 CD ARG A 179 8.018 -1.534 -11.003 1.00 0.00 C ATOM 720 NE ARG A 179 9.457 -1.207 -11.123 1.00 0.00 N ATOM 721 CZ ARG A 179 10.126 -1.179 -12.283 1.00 0.00 C ATOM 722 NH1 ARG A 179 9.492 -1.456 -13.430 1.00 0.00 N ATOM 723 NH2 ARG A 179 11.431 -0.873 -12.297 1.00 0.00 N ATOM 0 H ARG A 179 8.857 -5.980 -12.383 1.00 0.00 H new ATOM 0 HA ARG A 179 6.322 -5.020 -11.331 1.00 0.00 H new ATOM 0 HB2 ARG A 179 8.729 -3.848 -12.674 1.00 0.00 H new ATOM 0 HB3 ARG A 179 7.203 -3.029 -12.946 1.00 0.00 H new ATOM 0 HG2 ARG A 179 6.933 -3.263 -10.307 1.00 0.00 H new ATOM 0 HG3 ARG A 179 8.672 -3.477 -10.336 1.00 0.00 H new ATOM 0 HD2 ARG A 179 7.478 -1.161 -11.874 1.00 0.00 H new ATOM 0 HD3 ARG A 179 7.596 -1.037 -10.130 1.00 0.00 H new ATOM 0 HE ARG A 179 9.971 -0.990 -10.269 1.00 0.00 H new ATOM 0 HH11 ARG A 179 8.499 -1.688 -13.421 1.00 0.00 H new ATOM 0 HH12 ARG A 179 10.002 -1.434 -14.313 1.00 0.00 H new ATOM 0 HH21 ARG A 179 11.915 -0.661 -11.424 1.00 0.00 H new ATOM 0 HH22 ARG A 179 11.940 -0.852 -13.180 1.00 0.00 H new ATOM 737 N GLY A 180 4.878 -5.195 -13.326 1.00 0.00 N ATOM 738 CA GLY A 180 3.992 -5.377 -14.461 1.00 0.00 C ATOM 739 C GLY A 180 2.640 -4.704 -14.216 1.00 0.00 C ATOM 740 O GLY A 180 2.469 -3.991 -13.228 1.00 0.00 O ATOM 0 H GLY A 180 4.405 -5.028 -12.438 1.00 0.00 H new ATOM 0 HA2 GLY A 180 4.453 -4.960 -15.357 1.00 0.00 H new ATOM 0 HA3 GLY A 180 3.844 -6.441 -14.644 1.00 0.00 H new ATOM 744 N MET A 181 1.715 -4.952 -15.132 1.00 0.00 N ATOM 745 CA MET A 181 0.384 -4.378 -15.026 1.00 0.00 C ATOM 746 C MET A 181 -0.609 -5.396 -14.462 1.00 0.00 C ATOM 747 O MET A 181 -0.847 -6.440 -15.069 1.00 0.00 O ATOM 748 CB MET A 181 -0.084 -3.921 -16.409 1.00 0.00 C ATOM 749 CG MET A 181 0.851 -2.851 -16.978 1.00 0.00 C ATOM 750 SD MET A 181 0.969 -1.477 -15.844 1.00 0.00 S ATOM 751 CE MET A 181 -0.760 -1.069 -15.672 1.00 0.00 C ATOM 0 H MET A 181 1.861 -5.543 -15.951 1.00 0.00 H new ATOM 0 HA MET A 181 0.428 -3.527 -14.346 1.00 0.00 H new ATOM 0 HB2 MET A 181 -0.120 -4.775 -17.085 1.00 0.00 H new ATOM 0 HB3 MET A 181 -1.097 -3.525 -16.342 1.00 0.00 H new ATOM 0 HG2 MET A 181 1.840 -3.276 -17.152 1.00 0.00 H new ATOM 0 HG3 MET A 181 0.478 -2.506 -17.942 1.00 0.00 H new ATOM 0 HE1 MET A 181 -0.858 -0.061 -15.269 1.00 0.00 H new ATOM 0 HE2 MET A 181 -1.244 -1.118 -16.647 1.00 0.00 H new ATOM 0 HE3 MET A 181 -1.236 -1.778 -14.995 1.00 0.00 H new ATOM 761 N ILE A 182 -1.162 -5.057 -13.307 1.00 0.00 N ATOM 762 CA ILE A 182 -2.124 -5.928 -12.654 1.00 0.00 C ATOM 763 C ILE A 182 -3.469 -5.206 -12.545 1.00 0.00 C ATOM 764 O ILE A 182 -3.513 -3.979 -12.468 1.00 0.00 O ATOM 765 CB ILE A 182 -1.579 -6.418 -11.311 1.00 0.00 C ATOM 766 CG1 ILE A 182 -1.002 -5.257 -10.498 1.00 0.00 C ATOM 767 CG2 ILE A 182 -0.560 -7.541 -11.509 1.00 0.00 C ATOM 768 CD1 ILE A 182 -1.503 -5.297 -9.053 1.00 0.00 C ATOM 0 H ILE A 182 -0.962 -4.191 -12.807 1.00 0.00 H new ATOM 0 HA ILE A 182 -2.291 -6.825 -13.251 1.00 0.00 H new ATOM 0 HB ILE A 182 -2.407 -6.833 -10.737 1.00 0.00 H new ATOM 0 HG12 ILE A 182 0.087 -5.305 -10.511 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -1.284 -4.310 -10.958 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -0.189 -7.871 -10.539 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -1.036 -8.379 -12.019 1.00 0.00 H new ATOM 0 HG23 ILE A 182 0.272 -7.175 -12.111 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -1.078 -4.461 -8.497 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -2.591 -5.224 -9.043 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -1.198 -6.234 -8.588 1.00 0.00 H new ATOM 780 N PRO A 183 -4.559 -6.019 -12.543 1.00 0.00 N ATOM 781 CA PRO A 183 -5.901 -5.471 -12.445 1.00 0.00 C ATOM 782 C PRO A 183 -6.200 -5.005 -11.018 1.00 0.00 C ATOM 783 O PRO A 183 -5.972 -5.742 -10.061 1.00 0.00 O ATOM 784 CB PRO A 183 -6.818 -6.589 -12.910 1.00 0.00 C ATOM 785 CG PRO A 183 -6.002 -7.867 -12.809 1.00 0.00 C ATOM 786 CD PRO A 183 -4.543 -7.476 -12.632 1.00 0.00 C ATOM 0 HA PRO A 183 -6.038 -4.581 -13.060 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -7.711 -6.646 -12.288 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -7.153 -6.419 -13.933 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -6.340 -8.470 -11.967 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -6.129 -8.473 -13.706 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -4.119 -7.923 -11.733 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -3.937 -7.815 -13.472 1.00 0.00 H new ATOM 794 N VAL A 184 -6.709 -3.785 -10.922 1.00 0.00 N ATOM 795 CA VAL A 184 -7.042 -3.213 -9.628 1.00 0.00 C ATOM 796 C VAL A 184 -8.352 -3.825 -9.128 1.00 0.00 C ATOM 797 O VAL A 184 -8.557 -3.962 -7.923 1.00 0.00 O ATOM 798 CB VAL A 184 -7.094 -1.688 -9.728 1.00 0.00 C ATOM 799 CG1 VAL A 184 -7.951 -1.095 -8.609 1.00 0.00 C ATOM 800 CG2 VAL A 184 -5.686 -1.089 -9.718 1.00 0.00 C ATOM 0 H VAL A 184 -6.899 -3.177 -11.719 1.00 0.00 H new ATOM 0 HA VAL A 184 -6.271 -3.450 -8.895 1.00 0.00 H new ATOM 0 HB VAL A 184 -7.560 -1.430 -10.679 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -7.972 -0.009 -8.703 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -8.966 -1.485 -8.683 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -7.527 -1.368 -7.643 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -5.752 -0.003 -9.790 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -5.181 -1.361 -8.791 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -5.120 -1.475 -10.566 1.00 0.00 H new ATOM 810 N PRO A 185 -9.227 -4.186 -10.104 1.00 0.00 N ATOM 811 CA PRO A 185 -10.512 -4.780 -9.775 1.00 0.00 C ATOM 812 C PRO A 185 -10.347 -6.237 -9.337 1.00 0.00 C ATOM 813 O PRO A 185 -11.204 -6.783 -8.643 1.00 0.00 O ATOM 814 CB PRO A 185 -11.349 -4.631 -11.034 1.00 0.00 C ATOM 815 CG PRO A 185 -10.362 -4.383 -12.164 1.00 0.00 C ATOM 816 CD PRO A 185 -9.018 -4.040 -11.541 1.00 0.00 C ATOM 0 HA PRO A 185 -10.997 -4.291 -8.930 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -11.938 -5.529 -11.220 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -12.051 -3.803 -10.940 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -10.275 -5.267 -12.796 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -10.707 -3.568 -12.800 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -8.234 -4.709 -11.897 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -8.711 -3.026 -11.795 1.00 0.00 H new ATOM 824 N TYR A 186 -9.237 -6.826 -9.759 1.00 0.00 N ATOM 825 CA TYR A 186 -8.948 -8.209 -9.418 1.00 0.00 C ATOM 826 C TYR A 186 -8.003 -8.292 -8.217 1.00 0.00 C ATOM 827 O TYR A 186 -7.714 -9.382 -7.725 1.00 0.00 O ATOM 828 CB TYR A 186 -8.251 -8.808 -10.642 1.00 0.00 C ATOM 829 CG TYR A 186 -9.202 -9.159 -11.789 1.00 0.00 C ATOM 830 CD1 TYR A 186 -9.934 -8.165 -12.406 1.00 0.00 C ATOM 831 CD2 TYR A 186 -9.326 -10.469 -12.205 1.00 0.00 C ATOM 832 CE1 TYR A 186 -10.829 -8.496 -13.485 1.00 0.00 C ATOM 833 CE2 TYR A 186 -10.220 -10.799 -13.285 1.00 0.00 C ATOM 834 CZ TYR A 186 -10.927 -9.796 -13.872 1.00 0.00 C ATOM 835 OH TYR A 186 -11.771 -10.108 -14.891 1.00 0.00 O ATOM 0 H TYR A 186 -8.528 -6.371 -10.334 1.00 0.00 H new ATOM 0 HA TYR A 186 -9.864 -8.739 -9.157 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -7.505 -8.101 -11.005 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -7.716 -9.708 -10.339 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -9.836 -7.140 -12.080 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -8.753 -11.246 -11.721 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -11.409 -7.729 -13.976 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -10.327 -11.820 -13.621 1.00 0.00 H new ATOM 0 HH TYR A 186 -11.737 -11.073 -15.060 1.00 0.00 H new ATOM 845 N VAL A 187 -7.548 -7.126 -7.781 1.00 0.00 N ATOM 846 CA VAL A 187 -6.643 -7.053 -6.647 1.00 0.00 C ATOM 847 C VAL A 187 -7.202 -6.072 -5.615 1.00 0.00 C ATOM 848 O VAL A 187 -7.911 -5.130 -5.969 1.00 0.00 O ATOM 849 CB VAL A 187 -5.237 -6.684 -7.123 1.00 0.00 C ATOM 850 CG1 VAL A 187 -4.824 -7.537 -8.326 1.00 0.00 C ATOM 851 CG2 VAL A 187 -5.143 -5.193 -7.451 1.00 0.00 C ATOM 0 H VAL A 187 -7.789 -6.225 -8.193 1.00 0.00 H new ATOM 0 HA VAL A 187 -6.562 -8.025 -6.160 1.00 0.00 H new ATOM 0 HB VAL A 187 -4.542 -6.893 -6.309 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -3.821 -7.255 -8.645 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -4.833 -8.590 -8.045 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -5.524 -7.374 -9.145 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -4.133 -4.957 -7.787 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -5.854 -4.948 -8.240 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -5.375 -4.609 -6.560 1.00 0.00 H new ATOM 861 N GLU A 188 -6.862 -6.324 -4.360 1.00 0.00 N ATOM 862 CA GLU A 188 -7.321 -5.474 -3.275 1.00 0.00 C ATOM 863 C GLU A 188 -6.202 -4.527 -2.833 1.00 0.00 C ATOM 864 O GLU A 188 -5.031 -4.901 -2.837 1.00 0.00 O ATOM 865 CB GLU A 188 -7.828 -6.311 -2.099 1.00 0.00 C ATOM 866 CG GLU A 188 -9.349 -6.212 -1.971 1.00 0.00 C ATOM 867 CD GLU A 188 -9.838 -6.899 -0.694 1.00 0.00 C ATOM 868 OE1 GLU A 188 -9.524 -8.099 -0.540 1.00 0.00 O ATOM 869 OE2 GLU A 188 -10.514 -6.209 0.099 1.00 0.00 O ATOM 0 H GLU A 188 -6.274 -7.105 -4.070 1.00 0.00 H new ATOM 0 HA GLU A 188 -8.156 -4.874 -3.637 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -7.538 -7.353 -2.238 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -7.359 -5.970 -1.176 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -9.649 -5.164 -1.962 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -9.821 -6.672 -2.839 1.00 0.00 H new ATOM 876 N LYS A 189 -6.604 -3.320 -2.462 1.00 0.00 N ATOM 877 CA LYS A 189 -5.650 -2.318 -2.018 1.00 0.00 C ATOM 878 C LYS A 189 -5.410 -2.480 -0.516 1.00 0.00 C ATOM 879 O LYS A 189 -6.286 -2.176 0.293 1.00 0.00 O ATOM 880 CB LYS A 189 -6.119 -0.918 -2.418 1.00 0.00 C ATOM 881 CG LYS A 189 -5.081 -0.224 -3.302 1.00 0.00 C ATOM 882 CD LYS A 189 -4.343 0.869 -2.527 1.00 0.00 C ATOM 883 CE LYS A 189 -2.911 0.440 -2.202 1.00 0.00 C ATOM 884 NZ LYS A 189 -1.979 0.914 -3.249 1.00 0.00 N ATOM 0 H LYS A 189 -7.577 -3.014 -2.460 1.00 0.00 H new ATOM 0 HA LYS A 189 -4.689 -2.461 -2.512 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -7.068 -0.987 -2.950 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -6.298 -0.321 -1.524 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -4.365 -0.958 -3.673 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -5.572 0.211 -4.172 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -4.327 1.788 -3.113 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -4.879 1.090 -1.604 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -2.615 0.843 -1.233 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -2.859 -0.646 -2.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -1.066 0.425 -3.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -2.379 0.711 -4.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -1.836 1.939 -3.148 1.00 0.00 H new ATOM 898 N TYR A 190 -4.218 -2.957 -0.188 1.00 0.00 N ATOM 899 CA TYR A 190 -3.851 -3.163 1.203 1.00 0.00 C ATOM 900 C TYR A 190 -2.971 -2.020 1.713 1.00 0.00 C ATOM 901 O TYR A 190 -2.942 -1.739 2.910 1.00 0.00 O ATOM 902 CB TYR A 190 -3.048 -4.464 1.240 1.00 0.00 C ATOM 903 CG TYR A 190 -3.040 -5.153 2.606 1.00 0.00 C ATOM 904 CD1 TYR A 190 -4.194 -5.199 3.361 1.00 0.00 C ATOM 905 CD2 TYR A 190 -1.879 -5.728 3.083 1.00 0.00 C ATOM 906 CE1 TYR A 190 -4.186 -5.848 4.648 1.00 0.00 C ATOM 907 CE2 TYR A 190 -1.872 -6.375 4.369 1.00 0.00 C ATOM 908 CZ TYR A 190 -3.026 -6.404 5.088 1.00 0.00 C ATOM 909 OH TYR A 190 -3.020 -7.016 6.302 1.00 0.00 O ATOM 0 H TYR A 190 -3.494 -3.207 -0.862 1.00 0.00 H new ATOM 0 HA TYR A 190 -4.740 -3.203 1.832 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -3.457 -5.152 0.500 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -2.020 -4.253 0.945 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -5.102 -4.749 2.988 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -0.976 -5.692 2.491 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -5.082 -5.892 5.250 1.00 0.00 H new ATOM 0 HE2 TYR A 190 -0.970 -6.827 4.754 1.00 0.00 H new ATOM 0 HH TYR A 190 -2.124 -7.368 6.486 1.00 0.00 H new ATOM 919 N GLY A 191 -2.274 -1.390 0.779 1.00 0.00 N ATOM 920 CA GLY A 191 -1.395 -0.284 1.118 1.00 0.00 C ATOM 921 C GLY A 191 0.068 -0.644 0.851 1.00 0.00 C ATOM 922 O GLY A 191 0.742 -1.198 1.717 1.00 0.00 O ATOM 0 H GLY A 191 -2.300 -1.625 -0.213 1.00 0.00 H new ATOM 0 HA2 GLY A 191 -1.669 0.595 0.535 1.00 0.00 H new ATOM 0 HA3 GLY A 191 -1.523 -0.022 2.168 1.00 0.00 H new TER 926 GLY A 191