USER MOD reduce.3.24.130724 H: found=0, std=0, add=431, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 340 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 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= -2 K(o=-2,f=-0.32) USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= -1.56! C(o=-1.6!,f=-2.5!) USER MOD Single : A 141 LYS NZ :NH3+ -108:sc= -0.346 (180deg=-2.24!) USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=-0.073) USER MOD Single : A 144 LYS NZ :NH3+ -128:sc= 0.393 (180deg=-0.516) USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot 57:sc= 0.51 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 ASN : amide:sc= -0.0104 X(o=-0.01,f=0.016) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 SER OG : rot -30:sc= -1.2 USER MOD Single : A 170 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 175 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 182 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 131 -23.305 -5.774 -1.294 1.00 0.00 N ATOM 2 CA LYS A 131 -22.706 -5.545 0.009 1.00 0.00 C ATOM 3 C LYS A 131 -22.162 -4.116 0.071 1.00 0.00 C ATOM 4 O LYS A 131 -20.954 -3.903 -0.019 1.00 0.00 O ATOM 5 CB LYS A 131 -21.657 -6.616 0.313 1.00 0.00 C ATOM 6 CG LYS A 131 -21.780 -7.109 1.756 1.00 0.00 C ATOM 7 CD LYS A 131 -21.572 -8.623 1.837 1.00 0.00 C ATOM 8 CE LYS A 131 -20.971 -9.023 3.186 1.00 0.00 C ATOM 9 NZ LYS A 131 -20.179 -10.266 3.053 1.00 0.00 N ATOM 0 HA LYS A 131 -23.456 -5.636 0.794 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -21.778 -7.454 -0.373 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -20.659 -6.210 0.147 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -21.044 -6.603 2.381 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -22.763 -6.852 2.150 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -22.525 -9.133 1.694 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -20.913 -8.947 1.031 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -20.337 -8.219 3.561 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -21.767 -9.168 3.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -19.778 -10.523 3.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -20.793 -11.035 2.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -19.408 -10.115 2.372 1.00 0.00 H new ATOM 19 N VAL A 132 -23.081 -3.174 0.227 1.00 0.00 N ATOM 20 CA VAL A 132 -22.708 -1.771 0.302 1.00 0.00 C ATOM 21 C VAL A 132 -21.857 -1.541 1.553 1.00 0.00 C ATOM 22 O VAL A 132 -20.690 -1.168 1.454 1.00 0.00 O ATOM 23 CB VAL A 132 -23.961 -0.894 0.262 1.00 0.00 C ATOM 24 CG1 VAL A 132 -23.613 0.571 0.532 1.00 0.00 C ATOM 25 CG2 VAL A 132 -24.694 -1.046 -1.072 1.00 0.00 C ATOM 0 H VAL A 132 -24.082 -3.354 0.303 1.00 0.00 H new ATOM 0 HA VAL A 132 -22.103 -1.490 -0.560 1.00 0.00 H new ATOM 0 HB VAL A 132 -24.631 -1.231 1.053 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -24.521 1.173 0.498 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -23.155 0.661 1.517 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -22.915 0.925 -0.226 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -25.581 -0.412 -1.074 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -24.033 -0.748 -1.886 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -24.991 -2.086 -1.207 1.00 0.00 H new ATOM 35 N ASN A 133 -22.476 -1.772 2.702 1.00 0.00 N ATOM 36 CA ASN A 133 -21.790 -1.594 3.971 1.00 0.00 C ATOM 37 C ASN A 133 -20.333 -2.040 3.824 1.00 0.00 C ATOM 38 O ASN A 133 -19.441 -1.473 4.453 1.00 0.00 O ATOM 39 CB ASN A 133 -22.436 -2.441 5.069 1.00 0.00 C ATOM 40 CG ASN A 133 -23.232 -3.602 4.470 1.00 0.00 C ATOM 41 OD1 ASN A 133 -24.451 -3.631 4.495 1.00 0.00 O ATOM 42 ND2 ASN A 133 -22.477 -4.555 3.931 1.00 0.00 N ATOM 0 H ASN A 133 -23.445 -2.081 2.781 1.00 0.00 H new ATOM 0 HA ASN A 133 -21.853 -0.541 4.245 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -21.665 -2.829 5.734 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -23.095 -1.818 5.674 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -22.914 -5.372 3.505 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -21.461 -4.469 3.944 1.00 0.00 H new ATOM 48 N MET A 134 -20.139 -3.053 2.991 1.00 0.00 N ATOM 49 CA MET A 134 -18.806 -3.581 2.755 1.00 0.00 C ATOM 50 C MET A 134 -17.982 -2.625 1.890 1.00 0.00 C ATOM 51 O MET A 134 -16.876 -2.241 2.264 1.00 0.00 O ATOM 52 CB MET A 134 -18.911 -4.938 2.058 1.00 0.00 C ATOM 53 CG MET A 134 -18.807 -6.083 3.067 1.00 0.00 C ATOM 54 SD MET A 134 -17.203 -6.061 3.851 1.00 0.00 S ATOM 55 CE MET A 134 -17.558 -7.028 5.309 1.00 0.00 C ATOM 0 H MET A 134 -20.882 -3.521 2.472 1.00 0.00 H new ATOM 0 HA MET A 134 -18.305 -3.694 3.716 1.00 0.00 H new ATOM 0 HB2 MET A 134 -19.859 -5.004 1.524 1.00 0.00 H new ATOM 0 HB3 MET A 134 -18.119 -5.031 1.314 1.00 0.00 H new ATOM 0 HG2 MET A 134 -19.590 -5.988 3.819 1.00 0.00 H new ATOM 0 HG3 MET A 134 -18.962 -7.037 2.564 1.00 0.00 H new ATOM 0 HE1 MET A 134 -16.657 -7.114 5.917 1.00 0.00 H new ATOM 0 HE2 MET A 134 -18.341 -6.539 5.888 1.00 0.00 H new ATOM 0 HE3 MET A 134 -17.893 -8.022 5.013 1.00 0.00 H new ATOM 63 N ASP A 135 -18.554 -2.267 0.749 1.00 0.00 N ATOM 64 CA ASP A 135 -17.887 -1.364 -0.172 1.00 0.00 C ATOM 65 C ASP A 135 -17.409 -0.126 0.591 1.00 0.00 C ATOM 66 O ASP A 135 -16.330 0.397 0.318 1.00 0.00 O ATOM 67 CB ASP A 135 -18.840 -0.899 -1.275 1.00 0.00 C ATOM 68 CG ASP A 135 -18.247 -0.904 -2.685 1.00 0.00 C ATOM 69 OD1 ASP A 135 -17.489 0.044 -2.986 1.00 0.00 O ATOM 70 OD2 ASP A 135 -18.564 -1.855 -3.431 1.00 0.00 O ATOM 0 H ASP A 135 -19.473 -2.587 0.442 1.00 0.00 H new ATOM 0 HA ASP A 135 -17.049 -1.898 -0.620 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -19.722 -1.539 -1.266 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -19.176 0.111 -1.042 1.00 0.00 H new ATOM 74 N LEU A 136 -18.235 0.305 1.532 1.00 0.00 N ATOM 75 CA LEU A 136 -17.911 1.471 2.336 1.00 0.00 C ATOM 76 C LEU A 136 -16.749 1.133 3.273 1.00 0.00 C ATOM 77 O LEU A 136 -15.782 1.886 3.365 1.00 0.00 O ATOM 78 CB LEU A 136 -19.156 1.985 3.063 1.00 0.00 C ATOM 79 CG LEU A 136 -18.915 3.050 4.134 1.00 0.00 C ATOM 80 CD1 LEU A 136 -19.832 4.256 3.924 1.00 0.00 C ATOM 81 CD2 LEU A 136 -19.060 2.459 5.538 1.00 0.00 C ATOM 0 H LEU A 136 -19.129 -0.132 1.756 1.00 0.00 H new ATOM 0 HA LEU A 136 -17.580 2.291 1.699 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -19.843 2.393 2.322 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -19.657 1.136 3.529 1.00 0.00 H new ATOM 0 HG LEU A 136 -17.889 3.404 4.038 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -19.640 4.998 4.699 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -19.638 4.695 2.945 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -20.872 3.936 3.978 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -18.884 3.237 6.280 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -20.067 2.060 5.663 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -18.333 1.658 5.672 1.00 0.00 H new ATOM 92 N ARG A 137 -16.882 -0.003 3.943 1.00 0.00 N ATOM 93 CA ARG A 137 -15.856 -0.451 4.868 1.00 0.00 C ATOM 94 C ARG A 137 -14.476 -0.362 4.214 1.00 0.00 C ATOM 95 O ARG A 137 -13.630 0.421 4.643 1.00 0.00 O ATOM 96 CB ARG A 137 -16.108 -1.893 5.315 1.00 0.00 C ATOM 97 CG ARG A 137 -17.437 -2.010 6.065 1.00 0.00 C ATOM 98 CD ARG A 137 -17.208 -2.406 7.526 1.00 0.00 C ATOM 99 NE ARG A 137 -18.011 -1.538 8.417 1.00 0.00 N ATOM 100 CZ ARG A 137 -18.376 -1.873 9.661 1.00 0.00 C ATOM 101 NH1 ARG A 137 -18.012 -3.058 10.170 1.00 0.00 N ATOM 102 NH2 ARG A 137 -19.104 -1.024 10.398 1.00 0.00 N ATOM 0 H ARG A 137 -17.685 -0.626 3.863 1.00 0.00 H new ATOM 0 HA ARG A 137 -15.891 0.200 5.742 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -16.118 -2.551 4.446 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -15.293 -2.226 5.958 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -17.969 -1.059 6.021 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -18.070 -2.752 5.578 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -17.484 -3.450 7.676 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -16.150 -2.317 7.774 1.00 0.00 H new ATOM 0 HE ARG A 137 -18.304 -0.628 8.061 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -17.457 -3.705 9.610 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -18.290 -3.313 11.118 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -19.381 -0.121 10.012 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -19.382 -1.280 11.346 1.00 0.00 H new ATOM 113 N ALA A 138 -14.291 -1.175 3.184 1.00 0.00 N ATOM 114 CA ALA A 138 -13.028 -1.197 2.465 1.00 0.00 C ATOM 115 C ALA A 138 -12.737 0.198 1.910 1.00 0.00 C ATOM 116 O ALA A 138 -11.645 0.731 2.102 1.00 0.00 O ATOM 117 CB ALA A 138 -13.084 -2.262 1.367 1.00 0.00 C ATOM 0 H ALA A 138 -14.995 -1.823 2.830 1.00 0.00 H new ATOM 0 HA ALA A 138 -12.210 -1.462 3.135 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -12.137 -2.279 0.828 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -13.263 -3.239 1.816 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -13.892 -2.028 0.674 1.00 0.00 H new ATOM 123 N ASN A 139 -13.733 0.750 1.232 1.00 0.00 N ATOM 124 CA ASN A 139 -13.598 2.074 0.648 1.00 0.00 C ATOM 125 C ASN A 139 -12.790 2.965 1.596 1.00 0.00 C ATOM 126 O ASN A 139 -11.920 3.714 1.157 1.00 0.00 O ATOM 127 CB ASN A 139 -14.965 2.726 0.437 1.00 0.00 C ATOM 128 CG ASN A 139 -14.824 4.231 0.199 1.00 0.00 C ATOM 129 OD1 ASN A 139 -13.759 4.740 -0.107 1.00 0.00 O ATOM 130 ND2 ASN A 139 -15.956 4.911 0.356 1.00 0.00 N ATOM 0 H ASN A 139 -14.637 0.304 1.074 1.00 0.00 H new ATOM 0 HA ASN A 139 -13.097 1.968 -0.314 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -15.464 2.265 -0.415 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -15.595 2.550 1.309 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -15.967 5.922 0.219 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -16.813 4.422 0.613 1.00 0.00 H new ATOM 136 N LEU A 140 -13.108 2.852 2.877 1.00 0.00 N ATOM 137 CA LEU A 140 -12.423 3.638 3.889 1.00 0.00 C ATOM 138 C LEU A 140 -11.007 3.092 4.080 1.00 0.00 C ATOM 139 O LEU A 140 -10.043 3.856 4.106 1.00 0.00 O ATOM 140 CB LEU A 140 -13.245 3.681 5.180 1.00 0.00 C ATOM 141 CG LEU A 140 -13.840 5.042 5.549 1.00 0.00 C ATOM 142 CD1 LEU A 140 -12.739 6.080 5.772 1.00 0.00 C ATOM 143 CD2 LEU A 140 -14.857 5.499 4.501 1.00 0.00 C ATOM 0 H LEU A 140 -13.830 2.228 3.237 1.00 0.00 H new ATOM 0 HA LEU A 140 -12.325 4.674 3.565 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -14.059 2.962 5.093 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -12.612 3.348 6.002 1.00 0.00 H new ATOM 0 HG LEU A 140 -14.377 4.936 6.492 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -13.189 7.038 6.033 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -12.089 5.752 6.583 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -12.153 6.191 4.859 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -15.264 6.469 4.788 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -14.367 5.584 3.531 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -15.665 4.771 4.437 1.00 0.00 H new ATOM 154 N LYS A 141 -10.926 1.776 4.211 1.00 0.00 N ATOM 155 CA LYS A 141 -9.644 1.120 4.399 1.00 0.00 C ATOM 156 C LYS A 141 -9.459 0.052 3.318 1.00 0.00 C ATOM 157 O LYS A 141 -10.262 -0.873 3.211 1.00 0.00 O ATOM 158 CB LYS A 141 -9.523 0.579 5.825 1.00 0.00 C ATOM 159 CG LYS A 141 -8.396 1.282 6.585 1.00 0.00 C ATOM 160 CD LYS A 141 -7.810 0.370 7.664 1.00 0.00 C ATOM 161 CE LYS A 141 -6.284 0.471 7.699 1.00 0.00 C ATOM 162 NZ LYS A 141 -5.704 -0.685 8.417 1.00 0.00 N ATOM 0 H LYS A 141 -11.728 1.146 4.191 1.00 0.00 H new ATOM 0 HA LYS A 141 -8.830 1.835 4.284 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -10.466 0.721 6.353 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -9.333 -0.494 5.796 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -7.612 1.577 5.888 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -8.776 2.195 7.043 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -8.218 0.643 8.637 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -8.105 -0.662 7.473 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -5.893 0.508 6.682 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -5.986 1.398 8.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -5.339 -0.373 9.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -6.438 -1.408 8.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -4.927 -1.088 7.856 1.00 0.00 H new ATOM 172 N GLN A 142 -8.395 0.217 2.546 1.00 0.00 N ATOM 173 CA GLN A 142 -8.095 -0.721 1.478 1.00 0.00 C ATOM 174 C GLN A 142 -6.649 -0.547 1.009 1.00 0.00 C ATOM 175 O GLN A 142 -5.951 -1.528 0.756 1.00 0.00 O ATOM 176 CB GLN A 142 -9.073 -0.558 0.312 1.00 0.00 C ATOM 177 CG GLN A 142 -9.383 0.918 0.060 1.00 0.00 C ATOM 178 CD GLN A 142 -10.080 1.110 -1.287 1.00 0.00 C ATOM 179 OE1 GLN A 142 -10.935 0.337 -1.689 1.00 0.00 O ATOM 180 NE2 GLN A 142 -9.670 2.181 -1.962 1.00 0.00 N ATOM 0 H GLN A 142 -7.731 0.985 2.639 1.00 0.00 H new ATOM 0 HA GLN A 142 -8.211 -1.732 1.867 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -8.649 -1.003 -0.588 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -9.996 -1.095 0.529 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -10.017 1.302 0.859 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -8.459 1.496 0.081 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -8.950 2.787 -1.568 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -10.075 2.396 -2.873 1.00 0.00 H new ATOM 187 N VAL A 143 -6.242 0.710 0.906 1.00 0.00 N ATOM 188 CA VAL A 143 -4.891 1.026 0.473 1.00 0.00 C ATOM 189 C VAL A 143 -4.633 2.521 0.673 1.00 0.00 C ATOM 190 O VAL A 143 -4.884 3.323 -0.226 1.00 0.00 O ATOM 191 CB VAL A 143 -4.687 0.572 -0.974 1.00 0.00 C ATOM 192 CG1 VAL A 143 -5.993 0.660 -1.766 1.00 0.00 C ATOM 193 CG2 VAL A 143 -3.580 1.382 -1.652 1.00 0.00 C ATOM 0 H VAL A 143 -6.824 1.521 1.115 1.00 0.00 H new ATOM 0 HA VAL A 143 -4.160 0.487 1.075 1.00 0.00 H new ATOM 0 HB VAL A 143 -4.376 -0.472 -0.956 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -5.820 0.332 -2.791 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -6.744 0.020 -1.302 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -6.347 1.691 -1.770 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -3.455 1.039 -2.679 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -3.850 2.438 -1.652 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -2.645 1.247 -1.108 1.00 0.00 H new ATOM 203 N LYS A 144 -4.136 2.850 1.855 1.00 0.00 N ATOM 204 CA LYS A 144 -3.841 4.235 2.184 1.00 0.00 C ATOM 205 C LYS A 144 -2.324 4.443 2.181 1.00 0.00 C ATOM 206 O LYS A 144 -1.722 4.654 3.233 1.00 0.00 O ATOM 207 CB LYS A 144 -4.513 4.627 3.501 1.00 0.00 C ATOM 208 CG LYS A 144 -5.923 4.040 3.594 1.00 0.00 C ATOM 209 CD LYS A 144 -6.936 4.933 2.872 1.00 0.00 C ATOM 210 CE LYS A 144 -7.261 4.379 1.483 1.00 0.00 C ATOM 211 NZ LYS A 144 -6.848 5.338 0.435 1.00 0.00 N ATOM 0 H LYS A 144 -3.930 2.182 2.598 1.00 0.00 H new ATOM 0 HA LYS A 144 -4.256 4.903 1.430 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -3.912 4.274 4.339 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -4.562 5.713 3.579 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -5.935 3.042 3.156 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -6.208 3.932 4.641 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -7.850 5.004 3.462 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -6.536 5.943 2.781 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -6.750 3.427 1.336 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -8.330 4.183 1.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -7.647 5.517 -0.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -6.553 6.231 0.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -6.053 4.941 -0.105 1.00 0.00 H new ATOM 221 N LYS A 145 -1.754 4.377 0.988 1.00 0.00 N ATOM 222 CA LYS A 145 -0.319 4.557 0.834 1.00 0.00 C ATOM 223 C LYS A 145 -0.026 6.018 0.491 1.00 0.00 C ATOM 224 O LYS A 145 -0.767 6.642 -0.267 1.00 0.00 O ATOM 225 CB LYS A 145 0.239 3.561 -0.186 1.00 0.00 C ATOM 226 CG LYS A 145 1.580 2.993 0.280 1.00 0.00 C ATOM 227 CD LYS A 145 2.729 3.522 -0.580 1.00 0.00 C ATOM 228 CE LYS A 145 2.541 3.128 -2.047 1.00 0.00 C ATOM 229 NZ LYS A 145 2.672 4.315 -2.922 1.00 0.00 N ATOM 0 H LYS A 145 -2.258 4.202 0.119 1.00 0.00 H new ATOM 0 HA LYS A 145 0.195 4.341 1.771 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -0.473 2.749 -0.333 1.00 0.00 H new ATOM 0 HB3 LYS A 145 0.364 4.054 -1.150 1.00 0.00 H new ATOM 0 HG2 LYS A 145 1.749 3.260 1.323 1.00 0.00 H new ATOM 0 HG3 LYS A 145 1.555 1.904 0.230 1.00 0.00 H new ATOM 0 HD2 LYS A 145 2.782 4.607 -0.495 1.00 0.00 H new ATOM 0 HD3 LYS A 145 3.676 3.127 -0.212 1.00 0.00 H new ATOM 0 HE2 LYS A 145 3.282 2.379 -2.327 1.00 0.00 H new ATOM 0 HE3 LYS A 145 1.560 2.673 -2.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 2.542 4.031 -3.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 1.949 5.017 -2.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 3.617 4.732 -2.802 1.00 0.00 H new ATOM 239 N GLU A 146 1.056 6.522 1.066 1.00 0.00 N ATOM 240 CA GLU A 146 1.456 7.899 0.830 1.00 0.00 C ATOM 241 C GLU A 146 2.977 8.035 0.936 1.00 0.00 C ATOM 242 O GLU A 146 3.497 9.144 1.047 1.00 0.00 O ATOM 243 CB GLU A 146 0.752 8.849 1.802 1.00 0.00 C ATOM 244 CG GLU A 146 -0.411 9.569 1.116 1.00 0.00 C ATOM 245 CD GLU A 146 -1.282 10.300 2.140 1.00 0.00 C ATOM 246 OE1 GLU A 146 -0.753 11.245 2.764 1.00 0.00 O ATOM 247 OE2 GLU A 146 -2.458 9.897 2.276 1.00 0.00 O ATOM 0 H GLU A 146 1.668 6.002 1.695 1.00 0.00 H new ATOM 0 HA GLU A 146 1.155 8.176 -0.180 1.00 0.00 H new ATOM 0 HB2 GLU A 146 0.382 8.289 2.661 1.00 0.00 H new ATOM 0 HB3 GLU A 146 1.465 9.581 2.182 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -0.024 10.281 0.388 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -1.016 8.848 0.566 1.00 0.00 H new ATOM 252 N ASP A 147 3.646 6.892 0.898 1.00 0.00 N ATOM 253 CA ASP A 147 5.096 6.870 0.988 1.00 0.00 C ATOM 254 C ASP A 147 5.544 5.543 1.603 1.00 0.00 C ATOM 255 O ASP A 147 4.730 4.643 1.807 1.00 0.00 O ATOM 256 CB ASP A 147 5.609 8.002 1.879 1.00 0.00 C ATOM 257 CG ASP A 147 6.085 9.250 1.133 1.00 0.00 C ATOM 258 OD1 ASP A 147 6.702 9.067 0.060 1.00 0.00 O ATOM 259 OD2 ASP A 147 5.821 10.356 1.650 1.00 0.00 O ATOM 0 H ASP A 147 3.210 5.974 0.806 1.00 0.00 H new ATOM 0 HA ASP A 147 5.499 6.992 -0.017 1.00 0.00 H new ATOM 0 HB2 ASP A 147 4.815 8.290 2.567 1.00 0.00 H new ATOM 0 HB3 ASP A 147 6.433 7.623 2.484 1.00 0.00 H new ATOM 263 N THR A 148 6.837 5.463 1.881 1.00 0.00 N ATOM 264 CA THR A 148 7.402 4.261 2.470 1.00 0.00 C ATOM 265 C THR A 148 6.813 4.019 3.860 1.00 0.00 C ATOM 266 O THR A 148 6.296 2.938 4.140 1.00 0.00 O ATOM 267 CB THR A 148 8.926 4.408 2.471 1.00 0.00 C ATOM 268 OG1 THR A 148 9.392 3.175 3.012 1.00 0.00 O ATOM 269 CG2 THR A 148 9.411 5.460 3.472 1.00 0.00 C ATOM 0 H THR A 148 7.509 6.211 1.709 1.00 0.00 H new ATOM 0 HA THR A 148 7.146 3.376 1.887 1.00 0.00 H new ATOM 0 HB THR A 148 9.267 4.674 1.470 1.00 0.00 H new ATOM 0 HG1 THR A 148 9.054 2.432 2.470 1.00 0.00 H new ATOM 0 HG21 THR A 148 10.498 5.525 3.433 1.00 0.00 H new ATOM 0 HG22 THR A 148 8.980 6.429 3.219 1.00 0.00 H new ATOM 0 HG23 THR A 148 9.100 5.176 4.477 1.00 0.00 H new ATOM 277 N GLU A 149 6.912 5.043 4.696 1.00 0.00 N ATOM 278 CA GLU A 149 6.395 4.955 6.051 1.00 0.00 C ATOM 279 C GLU A 149 4.866 5.024 6.042 1.00 0.00 C ATOM 280 O GLU A 149 4.213 4.509 6.948 1.00 0.00 O ATOM 281 CB GLU A 149 6.987 6.053 6.936 1.00 0.00 C ATOM 282 CG GLU A 149 8.465 5.784 7.228 1.00 0.00 C ATOM 283 CD GLU A 149 8.721 5.715 8.736 1.00 0.00 C ATOM 284 OE1 GLU A 149 8.274 4.718 9.342 1.00 0.00 O ATOM 285 OE2 GLU A 149 9.359 6.662 9.247 1.00 0.00 O ATOM 0 H GLU A 149 7.342 5.937 4.461 1.00 0.00 H new ATOM 0 HA GLU A 149 6.694 3.994 6.471 1.00 0.00 H new ATOM 0 HB2 GLU A 149 6.880 7.019 6.443 1.00 0.00 H new ATOM 0 HB3 GLU A 149 6.432 6.109 7.872 1.00 0.00 H new ATOM 0 HG2 GLU A 149 8.767 4.847 6.761 1.00 0.00 H new ATOM 0 HG3 GLU A 149 9.076 6.572 6.787 1.00 0.00 H new ATOM 290 N LYS A 150 4.341 5.664 5.007 1.00 0.00 N ATOM 291 CA LYS A 150 2.902 5.806 4.867 1.00 0.00 C ATOM 292 C LYS A 150 2.366 4.681 3.979 1.00 0.00 C ATOM 293 O LYS A 150 2.407 4.781 2.753 1.00 0.00 O ATOM 294 CB LYS A 150 2.548 7.207 4.366 1.00 0.00 C ATOM 295 CG LYS A 150 2.326 8.169 5.536 1.00 0.00 C ATOM 296 CD LYS A 150 3.661 8.650 6.110 1.00 0.00 C ATOM 297 CE LYS A 150 3.782 8.289 7.591 1.00 0.00 C ATOM 298 NZ LYS A 150 3.635 9.496 8.434 1.00 0.00 N ATOM 0 H LYS A 150 4.887 6.090 4.258 1.00 0.00 H new ATOM 0 HA LYS A 150 2.414 5.707 5.836 1.00 0.00 H new ATOM 0 HB2 LYS A 150 3.349 7.582 3.729 1.00 0.00 H new ATOM 0 HB3 LYS A 150 1.648 7.161 3.753 1.00 0.00 H new ATOM 0 HG2 LYS A 150 1.740 9.025 5.202 1.00 0.00 H new ATOM 0 HG3 LYS A 150 1.748 7.672 6.316 1.00 0.00 H new ATOM 0 HD2 LYS A 150 4.483 8.200 5.554 1.00 0.00 H new ATOM 0 HD3 LYS A 150 3.746 9.730 5.987 1.00 0.00 H new ATOM 0 HE2 LYS A 150 3.018 7.558 7.856 1.00 0.00 H new ATOM 0 HE3 LYS A 150 4.749 7.822 7.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 3.720 9.232 9.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 4.379 10.181 8.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 2.702 9.925 8.267 1.00 0.00 H new ATOM 308 N GLU A 151 1.875 3.638 4.632 1.00 0.00 N ATOM 309 CA GLU A 151 1.332 2.496 3.916 1.00 0.00 C ATOM 310 C GLU A 151 0.322 1.752 4.792 1.00 0.00 C ATOM 311 O GLU A 151 0.700 0.913 5.608 1.00 0.00 O ATOM 312 CB GLU A 151 2.448 1.559 3.451 1.00 0.00 C ATOM 313 CG GLU A 151 1.982 0.690 2.281 1.00 0.00 C ATOM 314 CD GLU A 151 1.914 -0.785 2.685 1.00 0.00 C ATOM 315 OE1 GLU A 151 1.173 -1.074 3.649 1.00 0.00 O ATOM 316 OE2 GLU A 151 2.604 -1.587 2.022 1.00 0.00 O ATOM 0 H GLU A 151 1.842 3.560 5.648 1.00 0.00 H new ATOM 0 HA GLU A 151 0.815 2.861 3.028 1.00 0.00 H new ATOM 0 HB2 GLU A 151 3.317 2.144 3.151 1.00 0.00 H new ATOM 0 HB3 GLU A 151 2.762 0.923 4.279 1.00 0.00 H new ATOM 0 HG2 GLU A 151 1.001 1.024 1.944 1.00 0.00 H new ATOM 0 HG3 GLU A 151 2.665 0.809 1.440 1.00 0.00 H new ATOM 321 N LYS A 152 -0.945 2.087 4.594 1.00 0.00 N ATOM 322 CA LYS A 152 -2.013 1.462 5.356 1.00 0.00 C ATOM 323 C LYS A 152 -2.526 0.237 4.596 1.00 0.00 C ATOM 324 O LYS A 152 -3.269 0.371 3.625 1.00 0.00 O ATOM 325 CB LYS A 152 -3.104 2.483 5.686 1.00 0.00 C ATOM 326 CG LYS A 152 -3.644 2.269 7.101 1.00 0.00 C ATOM 327 CD LYS A 152 -4.648 3.362 7.476 1.00 0.00 C ATOM 328 CE LYS A 152 -4.703 3.559 8.992 1.00 0.00 C ATOM 329 NZ LYS A 152 -5.565 4.712 9.333 1.00 0.00 N ATOM 0 H LYS A 152 -1.256 2.783 3.917 1.00 0.00 H new ATOM 0 HA LYS A 152 -1.639 1.108 6.317 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -2.702 3.492 5.595 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -3.917 2.397 4.965 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -4.123 1.292 7.167 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -2.819 2.269 7.813 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -4.368 4.299 6.994 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -5.637 3.095 7.104 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -5.087 2.657 9.468 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -3.698 3.721 9.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -5.592 4.832 10.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -5.182 5.574 8.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -6.528 4.542 8.979 1.00 0.00 H new ATOM 339 N ASP A 153 -2.108 -0.928 5.066 1.00 0.00 N ATOM 340 CA ASP A 153 -2.516 -2.176 4.444 1.00 0.00 C ATOM 341 C ASP A 153 -3.504 -2.900 5.361 1.00 0.00 C ATOM 342 O ASP A 153 -3.380 -2.840 6.583 1.00 0.00 O ATOM 343 CB ASP A 153 -1.316 -3.098 4.219 1.00 0.00 C ATOM 344 CG ASP A 153 -0.990 -4.031 5.387 1.00 0.00 C ATOM 345 OD1 ASP A 153 -1.097 -3.558 6.539 1.00 0.00 O ATOM 346 OD2 ASP A 153 -0.641 -5.197 5.102 1.00 0.00 O ATOM 0 H ASP A 153 -1.490 -1.035 5.871 1.00 0.00 H new ATOM 0 HA ASP A 153 -2.974 -1.939 3.483 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -1.503 -3.703 3.332 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -0.440 -2.485 4.008 1.00 0.00 H new ATOM 350 N LEU A 154 -4.462 -3.569 4.736 1.00 0.00 N ATOM 351 CA LEU A 154 -5.470 -4.303 5.480 1.00 0.00 C ATOM 352 C LEU A 154 -6.122 -5.340 4.563 1.00 0.00 C ATOM 353 O LEU A 154 -5.604 -5.634 3.486 1.00 0.00 O ATOM 354 CB LEU A 154 -6.468 -3.340 6.126 1.00 0.00 C ATOM 355 CG LEU A 154 -6.940 -2.177 5.250 1.00 0.00 C ATOM 356 CD1 LEU A 154 -5.808 -1.177 5.010 1.00 0.00 C ATOM 357 CD2 LEU A 154 -7.542 -2.688 3.939 1.00 0.00 C ATOM 0 H LEU A 154 -4.561 -3.618 3.722 1.00 0.00 H new ATOM 0 HA LEU A 154 -5.011 -4.849 6.304 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -7.342 -3.910 6.440 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -6.015 -2.929 7.028 1.00 0.00 H new ATOM 0 HG LEU A 154 -7.730 -1.647 5.782 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -6.170 -0.361 4.385 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -5.466 -0.778 5.965 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -4.980 -1.678 4.509 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -7.870 -1.842 3.335 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -6.791 -3.256 3.391 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -8.395 -3.330 4.156 1.00 0.00 H new ATOM 368 N ARG A 155 -7.247 -5.865 5.022 1.00 0.00 N ATOM 369 CA ARG A 155 -7.975 -6.863 4.256 1.00 0.00 C ATOM 370 C ARG A 155 -7.757 -6.644 2.758 1.00 0.00 C ATOM 371 O ARG A 155 -7.669 -5.507 2.299 1.00 0.00 O ATOM 372 CB ARG A 155 -9.473 -6.806 4.559 1.00 0.00 C ATOM 373 CG ARG A 155 -10.078 -5.480 4.091 1.00 0.00 C ATOM 374 CD ARG A 155 -10.653 -4.693 5.270 1.00 0.00 C ATOM 375 NE ARG A 155 -12.092 -4.424 5.046 1.00 0.00 N ATOM 376 CZ ARG A 155 -13.070 -5.299 5.315 1.00 0.00 C ATOM 377 NH1 ARG A 155 -12.772 -6.503 5.820 1.00 0.00 N ATOM 378 NH2 ARG A 155 -14.347 -4.969 5.078 1.00 0.00 N ATOM 0 H ARG A 155 -7.673 -5.619 5.915 1.00 0.00 H new ATOM 0 HA ARG A 155 -7.595 -7.843 4.543 1.00 0.00 H new ATOM 0 HB2 ARG A 155 -9.979 -7.635 4.065 1.00 0.00 H new ATOM 0 HB3 ARG A 155 -9.636 -6.926 5.630 1.00 0.00 H new ATOM 0 HG2 ARG A 155 -9.315 -4.885 3.590 1.00 0.00 H new ATOM 0 HG3 ARG A 155 -10.863 -5.672 3.360 1.00 0.00 H new ATOM 0 HD2 ARG A 155 -10.519 -5.256 6.194 1.00 0.00 H new ATOM 0 HD3 ARG A 155 -10.113 -3.754 5.389 1.00 0.00 H new ATOM 0 HE ARG A 155 -12.355 -3.516 4.663 1.00 0.00 H new ATOM 0 HH11 ARG A 155 -11.800 -6.754 6.000 1.00 0.00 H new ATOM 0 HH12 ARG A 155 -13.517 -7.169 6.025 1.00 0.00 H new ATOM 0 HH21 ARG A 155 -14.574 -4.052 4.693 1.00 0.00 H new ATOM 0 HH22 ARG A 155 -15.092 -5.635 5.283 1.00 0.00 H new ATOM 389 N ASP A 156 -7.675 -7.752 2.035 1.00 0.00 N ATOM 390 CA ASP A 156 -7.468 -7.696 0.598 1.00 0.00 C ATOM 391 C ASP A 156 -5.980 -7.492 0.310 1.00 0.00 C ATOM 392 O ASP A 156 -5.556 -7.537 -0.845 1.00 0.00 O ATOM 393 CB ASP A 156 -8.235 -6.528 -0.023 1.00 0.00 C ATOM 394 CG ASP A 156 -8.513 -6.660 -1.521 1.00 0.00 C ATOM 395 OD1 ASP A 156 -8.619 -7.818 -1.979 1.00 0.00 O ATOM 396 OD2 ASP A 156 -8.612 -5.600 -2.176 1.00 0.00 O ATOM 0 H ASP A 156 -7.748 -8.694 2.418 1.00 0.00 H new ATOM 0 HA ASP A 156 -7.826 -8.631 0.168 1.00 0.00 H new ATOM 0 HB2 ASP A 156 -9.185 -6.419 0.499 1.00 0.00 H new ATOM 0 HB3 ASP A 156 -7.671 -5.611 0.147 1.00 0.00 H new ATOM 400 N VAL A 157 -5.227 -7.271 1.377 1.00 0.00 N ATOM 401 CA VAL A 157 -3.795 -7.060 1.252 1.00 0.00 C ATOM 402 C VAL A 157 -3.235 -8.007 0.189 1.00 0.00 C ATOM 403 O VAL A 157 -2.924 -7.583 -0.923 1.00 0.00 O ATOM 404 CB VAL A 157 -3.120 -7.227 2.616 1.00 0.00 C ATOM 405 CG1 VAL A 157 -3.034 -5.888 3.352 1.00 0.00 C ATOM 406 CG2 VAL A 157 -3.848 -8.274 3.462 1.00 0.00 C ATOM 0 H VAL A 157 -5.582 -7.233 2.333 1.00 0.00 H new ATOM 0 HA VAL A 157 -3.587 -6.042 0.923 1.00 0.00 H new ATOM 0 HB VAL A 157 -2.103 -7.581 2.447 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -2.551 -6.034 4.318 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -2.452 -5.183 2.758 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -4.038 -5.492 3.505 1.00 0.00 H new ATOM 0 HG21 VAL A 157 -3.349 -8.374 4.426 1.00 0.00 H new ATOM 0 HG22 VAL A 157 -4.880 -7.961 3.619 1.00 0.00 H new ATOM 0 HG23 VAL A 157 -3.834 -9.233 2.945 1.00 0.00 H new ATOM 416 N GLY A 158 -3.124 -9.271 0.567 1.00 0.00 N ATOM 417 CA GLY A 158 -2.606 -10.282 -0.340 1.00 0.00 C ATOM 418 C GLY A 158 -1.525 -9.698 -1.251 1.00 0.00 C ATOM 419 O GLY A 158 -0.402 -9.455 -0.811 1.00 0.00 O ATOM 0 H GLY A 158 -3.384 -9.619 1.490 1.00 0.00 H new ATOM 0 HA2 GLY A 158 -2.194 -11.113 0.233 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -3.419 -10.684 -0.945 1.00 0.00 H new ATOM 423 N ASP A 159 -1.900 -9.490 -2.504 1.00 0.00 N ATOM 424 CA ASP A 159 -0.977 -8.939 -3.482 1.00 0.00 C ATOM 425 C ASP A 159 -0.873 -7.426 -3.283 1.00 0.00 C ATOM 426 O ASP A 159 0.203 -6.907 -2.986 1.00 0.00 O ATOM 427 CB ASP A 159 -1.467 -9.196 -4.909 1.00 0.00 C ATOM 428 CG ASP A 159 -2.977 -9.058 -5.108 1.00 0.00 C ATOM 429 OD1 ASP A 159 -3.698 -9.957 -4.625 1.00 0.00 O ATOM 430 OD2 ASP A 159 -3.377 -8.056 -5.740 1.00 0.00 O ATOM 0 H ASP A 159 -2.832 -9.693 -2.865 1.00 0.00 H new ATOM 0 HA ASP A 159 -0.010 -9.421 -3.341 1.00 0.00 H new ATOM 0 HB2 ASP A 159 -0.962 -8.502 -5.581 1.00 0.00 H new ATOM 0 HB3 ASP A 159 -1.167 -10.201 -5.205 1.00 0.00 H new ATOM 434 N TRP A 160 -2.006 -6.760 -3.453 1.00 0.00 N ATOM 435 CA TRP A 160 -2.056 -5.315 -3.296 1.00 0.00 C ATOM 436 C TRP A 160 -1.058 -4.924 -2.204 1.00 0.00 C ATOM 437 O TRP A 160 -0.301 -3.968 -2.362 1.00 0.00 O ATOM 438 CB TRP A 160 -3.481 -4.846 -2.999 1.00 0.00 C ATOM 439 CG TRP A 160 -3.638 -4.150 -1.646 1.00 0.00 C ATOM 440 CD1 TRP A 160 -4.300 -4.587 -0.566 1.00 0.00 C ATOM 441 CD2 TRP A 160 -3.093 -2.868 -1.270 1.00 0.00 C ATOM 442 NE1 TRP A 160 -4.222 -3.685 0.475 1.00 0.00 N ATOM 443 CE2 TRP A 160 -3.464 -2.606 0.034 1.00 0.00 C ATOM 444 CE3 TRP A 160 -2.311 -1.960 -2.005 1.00 0.00 C ATOM 445 CZ2 TRP A 160 -3.100 -1.438 0.715 1.00 0.00 C ATOM 446 CZ3 TRP A 160 -1.955 -0.798 -1.311 1.00 0.00 C ATOM 447 CH2 TRP A 160 -2.321 -0.519 0.001 1.00 0.00 C ATOM 0 H TRP A 160 -2.896 -7.194 -3.698 1.00 0.00 H new ATOM 0 HA TRP A 160 -1.772 -4.815 -4.222 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -3.799 -4.163 -3.786 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -4.150 -5.706 -3.033 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -4.828 -5.528 -0.517 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -4.643 -3.790 1.398 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -2.009 -2.145 -3.025 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -3.403 -1.256 1.735 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -1.354 -0.067 -1.831 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -2.006 0.403 0.468 1.00 0.00 H new ATOM 457 N ARG A 161 -1.088 -5.684 -1.118 1.00 0.00 N ATOM 458 CA ARG A 161 -0.197 -5.429 0.000 1.00 0.00 C ATOM 459 C ARG A 161 1.242 -5.795 -0.374 1.00 0.00 C ATOM 460 O ARG A 161 2.100 -4.921 -0.483 1.00 0.00 O ATOM 461 CB ARG A 161 -0.616 -6.232 1.233 1.00 0.00 C ATOM 462 CG ARG A 161 0.387 -6.047 2.374 1.00 0.00 C ATOM 463 CD ARG A 161 0.633 -7.367 3.107 1.00 0.00 C ATOM 464 NE ARG A 161 0.865 -7.111 4.546 1.00 0.00 N ATOM 465 CZ ARG A 161 0.864 -8.064 5.488 1.00 0.00 C ATOM 466 NH1 ARG A 161 0.643 -9.341 5.150 1.00 0.00 N ATOM 467 NH2 ARG A 161 1.084 -7.738 6.770 1.00 0.00 N ATOM 0 H ARG A 161 -1.716 -6.477 -0.990 1.00 0.00 H new ATOM 0 HA ARG A 161 -0.256 -4.366 0.235 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -1.606 -5.914 1.559 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -0.689 -7.289 0.976 1.00 0.00 H new ATOM 0 HG2 ARG A 161 1.328 -5.666 1.977 1.00 0.00 H new ATOM 0 HG3 ARG A 161 0.012 -5.302 3.075 1.00 0.00 H new ATOM 0 HD2 ARG A 161 -0.224 -8.028 2.980 1.00 0.00 H new ATOM 0 HD3 ARG A 161 1.495 -7.877 2.676 1.00 0.00 H new ATOM 0 HE ARG A 161 1.036 -6.149 4.839 1.00 0.00 H new ATOM 0 HH11 ARG A 161 0.475 -9.589 4.175 1.00 0.00 H new ATOM 0 HH12 ARG A 161 0.642 -10.066 5.868 1.00 0.00 H new ATOM 0 HH21 ARG A 161 1.252 -6.765 7.027 1.00 0.00 H new ATOM 0 HH22 ARG A 161 1.083 -8.463 7.488 1.00 0.00 H new ATOM 478 N LYS A 162 1.459 -7.089 -0.562 1.00 0.00 N ATOM 479 CA LYS A 162 2.778 -7.581 -0.922 1.00 0.00 C ATOM 480 C LYS A 162 3.490 -6.535 -1.782 1.00 0.00 C ATOM 481 O LYS A 162 4.695 -6.326 -1.641 1.00 0.00 O ATOM 482 CB LYS A 162 2.675 -8.955 -1.584 1.00 0.00 C ATOM 483 CG LYS A 162 3.666 -9.083 -2.742 1.00 0.00 C ATOM 484 CD LYS A 162 5.093 -9.274 -2.224 1.00 0.00 C ATOM 485 CE LYS A 162 5.422 -10.760 -2.066 1.00 0.00 C ATOM 486 NZ LYS A 162 6.160 -11.257 -3.248 1.00 0.00 N ATOM 0 H LYS A 162 0.744 -7.811 -0.472 1.00 0.00 H new ATOM 0 HA LYS A 162 3.386 -7.728 -0.030 1.00 0.00 H new ATOM 0 HB2 LYS A 162 2.870 -9.733 -0.846 1.00 0.00 H new ATOM 0 HB3 LYS A 162 1.660 -9.111 -1.951 1.00 0.00 H new ATOM 0 HG2 LYS A 162 3.388 -9.928 -3.372 1.00 0.00 H new ATOM 0 HG3 LYS A 162 3.618 -8.191 -3.366 1.00 0.00 H new ATOM 0 HD2 LYS A 162 5.799 -8.812 -2.914 1.00 0.00 H new ATOM 0 HD3 LYS A 162 5.207 -8.768 -1.265 1.00 0.00 H new ATOM 0 HE2 LYS A 162 6.019 -10.913 -1.167 1.00 0.00 H new ATOM 0 HE3 LYS A 162 4.502 -11.330 -1.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 6.375 -12.267 -3.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 5.577 -11.129 -4.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 7.047 -10.725 -3.352 1.00 0.00 H new ATOM 496 N ASN A 163 2.717 -5.907 -2.655 1.00 0.00 N ATOM 497 CA ASN A 163 3.260 -4.889 -3.538 1.00 0.00 C ATOM 498 C ASN A 163 3.727 -3.694 -2.705 1.00 0.00 C ATOM 499 O ASN A 163 4.927 -3.507 -2.501 1.00 0.00 O ATOM 500 CB ASN A 163 2.199 -4.393 -4.523 1.00 0.00 C ATOM 501 CG ASN A 163 2.132 -5.295 -5.757 1.00 0.00 C ATOM 502 OD1 ASN A 163 1.884 -6.486 -5.675 1.00 0.00 O ATOM 503 ND2 ASN A 163 2.366 -4.661 -6.903 1.00 0.00 N ATOM 0 H ASN A 163 1.719 -6.083 -2.770 1.00 0.00 H new ATOM 0 HA ASN A 163 4.089 -5.329 -4.092 1.00 0.00 H new ATOM 0 HB2 ASN A 163 1.226 -4.368 -4.033 1.00 0.00 H new ATOM 0 HB3 ASN A 163 2.429 -3.372 -4.827 1.00 0.00 H new ATOM 0 HD21 ASN A 163 2.344 -5.175 -7.784 1.00 0.00 H new ATOM 0 HD22 ASN A 163 2.568 -3.661 -6.901 1.00 0.00 H new ATOM 509 N ILE A 164 2.757 -2.916 -2.247 1.00 0.00 N ATOM 510 CA ILE A 164 3.055 -1.745 -1.441 1.00 0.00 C ATOM 511 C ILE A 164 4.007 -2.138 -0.310 1.00 0.00 C ATOM 512 O ILE A 164 5.051 -1.511 -0.127 1.00 0.00 O ATOM 513 CB ILE A 164 1.762 -1.086 -0.956 1.00 0.00 C ATOM 514 CG1 ILE A 164 0.708 -2.139 -0.609 1.00 0.00 C ATOM 515 CG2 ILE A 164 1.246 -0.072 -1.978 1.00 0.00 C ATOM 516 CD1 ILE A 164 0.129 -1.896 0.786 1.00 0.00 C ATOM 0 H ILE A 164 1.764 -3.074 -2.419 1.00 0.00 H new ATOM 0 HA ILE A 164 3.566 -0.990 -2.039 1.00 0.00 H new ATOM 0 HB ILE A 164 1.981 -0.536 -0.041 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -0.093 -2.115 -1.348 1.00 0.00 H new ATOM 0 HG13 ILE A 164 1.153 -3.133 -0.654 1.00 0.00 H new ATOM 0 HG21 ILE A 164 0.326 0.381 -1.608 1.00 0.00 H new ATOM 0 HG22 ILE A 164 1.996 0.703 -2.132 1.00 0.00 H new ATOM 0 HG23 ILE A 164 1.047 -0.577 -2.923 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -0.618 -2.658 1.008 1.00 0.00 H new ATOM 0 HD12 ILE A 164 0.928 -1.945 1.525 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -0.337 -0.911 0.820 1.00 0.00 H new ATOM 527 N GLU A 165 3.615 -3.173 0.418 1.00 0.00 N ATOM 528 CA GLU A 165 4.421 -3.656 1.526 1.00 0.00 C ATOM 529 C GLU A 165 5.901 -3.679 1.136 1.00 0.00 C ATOM 530 O GLU A 165 6.749 -3.177 1.872 1.00 0.00 O ATOM 531 CB GLU A 165 3.953 -5.039 1.982 1.00 0.00 C ATOM 532 CG GLU A 165 3.537 -5.019 3.454 1.00 0.00 C ATOM 533 CD GLU A 165 2.595 -3.848 3.742 1.00 0.00 C ATOM 534 OE1 GLU A 165 1.564 -3.763 3.042 1.00 0.00 O ATOM 535 OE2 GLU A 165 2.929 -3.064 4.658 1.00 0.00 O ATOM 0 H GLU A 165 2.750 -3.690 0.262 1.00 0.00 H new ATOM 0 HA GLU A 165 4.297 -2.972 2.365 1.00 0.00 H new ATOM 0 HB2 GLU A 165 3.113 -5.364 1.367 1.00 0.00 H new ATOM 0 HB3 GLU A 165 4.754 -5.764 1.836 1.00 0.00 H new ATOM 0 HG2 GLU A 165 3.045 -5.957 3.709 1.00 0.00 H new ATOM 0 HG3 GLU A 165 4.423 -4.942 4.085 1.00 0.00 H new ATOM 540 N GLU A 166 6.165 -4.268 -0.021 1.00 0.00 N ATOM 541 CA GLU A 166 7.527 -4.364 -0.518 1.00 0.00 C ATOM 542 C GLU A 166 8.034 -2.986 -0.947 1.00 0.00 C ATOM 543 O GLU A 166 8.822 -2.361 -0.237 1.00 0.00 O ATOM 544 CB GLU A 166 7.621 -5.366 -1.670 1.00 0.00 C ATOM 545 CG GLU A 166 9.059 -5.479 -2.182 1.00 0.00 C ATOM 546 CD GLU A 166 9.320 -6.863 -2.781 1.00 0.00 C ATOM 547 OE1 GLU A 166 8.601 -7.210 -3.743 1.00 0.00 O ATOM 548 OE2 GLU A 166 10.232 -7.543 -2.263 1.00 0.00 O ATOM 0 H GLU A 166 5.459 -4.684 -0.629 1.00 0.00 H new ATOM 0 HA GLU A 166 8.163 -4.728 0.289 1.00 0.00 H new ATOM 0 HB2 GLU A 166 7.272 -6.343 -1.336 1.00 0.00 H new ATOM 0 HB3 GLU A 166 6.965 -5.054 -2.483 1.00 0.00 H new ATOM 0 HG2 GLU A 166 9.242 -4.712 -2.935 1.00 0.00 H new ATOM 0 HG3 GLU A 166 9.756 -5.295 -1.364 1.00 0.00 H new ATOM 553 N LYS A 167 7.561 -2.551 -2.106 1.00 0.00 N ATOM 554 CA LYS A 167 7.956 -1.258 -2.638 1.00 0.00 C ATOM 555 C LYS A 167 8.066 -0.252 -1.491 1.00 0.00 C ATOM 556 O LYS A 167 8.882 0.667 -1.542 1.00 0.00 O ATOM 557 CB LYS A 167 7.000 -0.822 -3.749 1.00 0.00 C ATOM 558 CG LYS A 167 5.591 -0.585 -3.200 1.00 0.00 C ATOM 559 CD LYS A 167 4.994 0.707 -3.761 1.00 0.00 C ATOM 560 CE LYS A 167 5.808 1.925 -3.320 1.00 0.00 C ATOM 561 NZ LYS A 167 5.968 2.875 -4.443 1.00 0.00 N ATOM 0 H LYS A 167 6.908 -3.071 -2.691 1.00 0.00 H new ATOM 0 HA LYS A 167 8.940 -1.321 -3.103 1.00 0.00 H new ATOM 0 HB2 LYS A 167 7.371 0.091 -4.215 1.00 0.00 H new ATOM 0 HB3 LYS A 167 6.968 -1.586 -4.526 1.00 0.00 H new ATOM 0 HG2 LYS A 167 4.950 -1.428 -3.458 1.00 0.00 H new ATOM 0 HG3 LYS A 167 5.625 -0.532 -2.112 1.00 0.00 H new ATOM 0 HD2 LYS A 167 4.969 0.657 -4.850 1.00 0.00 H new ATOM 0 HD3 LYS A 167 3.963 0.812 -3.423 1.00 0.00 H new ATOM 0 HE2 LYS A 167 5.311 2.419 -2.486 1.00 0.00 H new ATOM 0 HE3 LYS A 167 6.787 1.606 -2.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 167 6.523 3.696 -4.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 167 6.462 2.405 -5.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 167 5.032 3.193 -4.765 1.00 0.00 H new ATOM 571 N SER A 168 7.231 -0.458 -0.482 1.00 0.00 N ATOM 572 CA SER A 168 7.225 0.419 0.676 1.00 0.00 C ATOM 573 C SER A 168 8.359 0.037 1.629 1.00 0.00 C ATOM 574 O SER A 168 9.218 0.861 1.939 1.00 0.00 O ATOM 575 CB SER A 168 5.880 0.363 1.401 1.00 0.00 C ATOM 576 OG SER A 168 5.800 1.322 2.452 1.00 0.00 O ATOM 0 H SER A 168 6.554 -1.220 -0.443 1.00 0.00 H new ATOM 0 HA SER A 168 7.379 1.442 0.331 1.00 0.00 H new ATOM 0 HB2 SER A 168 5.076 0.540 0.687 1.00 0.00 H new ATOM 0 HB3 SER A 168 5.730 -0.636 1.810 1.00 0.00 H new ATOM 0 HG SER A 168 6.695 1.482 2.818 1.00 0.00 H new ATOM 581 N GLY A 169 8.325 -1.213 2.066 1.00 0.00 N ATOM 582 CA GLY A 169 9.340 -1.715 2.978 1.00 0.00 C ATOM 583 C GLY A 169 10.742 -1.502 2.407 1.00 0.00 C ATOM 584 O GLY A 169 11.538 -0.751 2.969 1.00 0.00 O ATOM 0 H GLY A 169 7.611 -1.893 1.806 1.00 0.00 H new ATOM 0 HA2 GLY A 169 9.254 -1.208 3.939 1.00 0.00 H new ATOM 0 HA3 GLY A 169 9.176 -2.777 3.162 1.00 0.00 H new ATOM 588 N MET A 170 11.004 -2.177 1.298 1.00 0.00 N ATOM 589 CA MET A 170 12.297 -2.072 0.645 1.00 0.00 C ATOM 590 C MET A 170 12.797 -0.626 0.648 1.00 0.00 C ATOM 591 O MET A 170 14.003 -0.383 0.624 1.00 0.00 O ATOM 592 CB MET A 170 12.184 -2.570 -0.798 1.00 0.00 C ATOM 593 CG MET A 170 13.486 -2.330 -1.565 1.00 0.00 C ATOM 594 SD MET A 170 13.819 -3.710 -2.647 1.00 0.00 S ATOM 595 CE MET A 170 13.899 -2.861 -4.216 1.00 0.00 C ATOM 0 H MET A 170 10.342 -2.799 0.835 1.00 0.00 H new ATOM 0 HA MET A 170 13.011 -2.685 1.195 1.00 0.00 H new ATOM 0 HB2 MET A 170 11.947 -3.634 -0.802 1.00 0.00 H new ATOM 0 HB3 MET A 170 11.363 -2.058 -1.300 1.00 0.00 H new ATOM 0 HG2 MET A 170 13.411 -1.411 -2.146 1.00 0.00 H new ATOM 0 HG3 MET A 170 14.311 -2.198 -0.865 1.00 0.00 H new ATOM 0 HE1 MET A 170 14.102 -3.581 -5.009 1.00 0.00 H new ATOM 0 HE2 MET A 170 12.948 -2.365 -4.410 1.00 0.00 H new ATOM 0 HE3 MET A 170 14.696 -2.118 -4.188 1.00 0.00 H new ATOM 603 N GLU A 171 11.846 0.295 0.677 1.00 0.00 N ATOM 604 CA GLU A 171 12.174 1.711 0.684 1.00 0.00 C ATOM 605 C GLU A 171 12.640 2.140 2.076 1.00 0.00 C ATOM 606 O GLU A 171 13.719 2.713 2.225 1.00 0.00 O ATOM 607 CB GLU A 171 10.984 2.552 0.220 1.00 0.00 C ATOM 608 CG GLU A 171 11.353 3.397 -1.000 1.00 0.00 C ATOM 609 CD GLU A 171 10.172 3.509 -1.968 1.00 0.00 C ATOM 610 OE1 GLU A 171 9.060 3.795 -1.475 1.00 0.00 O ATOM 611 OE2 GLU A 171 10.410 3.305 -3.178 1.00 0.00 O ATOM 0 H GLU A 171 10.847 0.089 0.696 1.00 0.00 H new ATOM 0 HA GLU A 171 12.990 1.879 -0.019 1.00 0.00 H new ATOM 0 HB2 GLU A 171 10.146 1.899 -0.025 1.00 0.00 H new ATOM 0 HB3 GLU A 171 10.655 3.202 1.031 1.00 0.00 H new ATOM 0 HG2 GLU A 171 11.660 4.392 -0.678 1.00 0.00 H new ATOM 0 HG3 GLU A 171 12.206 2.951 -1.511 1.00 0.00 H new ATOM 616 N GLY A 172 11.803 1.850 3.061 1.00 0.00 N ATOM 617 CA GLY A 172 12.116 2.199 4.437 1.00 0.00 C ATOM 618 C GLY A 172 13.474 1.629 4.853 1.00 0.00 C ATOM 619 O GLY A 172 14.147 2.187 5.718 1.00 0.00 O ATOM 0 H GLY A 172 10.908 1.377 2.934 1.00 0.00 H new ATOM 0 HA2 GLY A 172 12.123 3.283 4.548 1.00 0.00 H new ATOM 0 HA3 GLY A 172 11.339 1.816 5.099 1.00 0.00 H new ATOM 623 N ARG A 173 13.835 0.525 4.217 1.00 0.00 N ATOM 624 CA ARG A 173 15.101 -0.127 4.510 1.00 0.00 C ATOM 625 C ARG A 173 16.242 0.569 3.764 1.00 0.00 C ATOM 626 O ARG A 173 17.158 1.104 4.387 1.00 0.00 O ATOM 627 CB ARG A 173 15.066 -1.604 4.109 1.00 0.00 C ATOM 628 CG ARG A 173 14.260 -2.426 5.116 1.00 0.00 C ATOM 629 CD ARG A 173 14.921 -3.782 5.373 1.00 0.00 C ATOM 630 NE ARG A 173 13.957 -4.873 5.113 1.00 0.00 N ATOM 631 CZ ARG A 173 13.569 -5.257 3.890 1.00 0.00 C ATOM 632 NH1 ARG A 173 14.060 -4.641 2.806 1.00 0.00 N ATOM 633 NH2 ARG A 173 12.688 -6.257 3.749 1.00 0.00 N ATOM 0 H ARG A 173 13.274 0.065 3.500 1.00 0.00 H new ATOM 0 HA ARG A 173 15.269 -0.057 5.585 1.00 0.00 H new ATOM 0 HB2 ARG A 173 14.626 -1.705 3.117 1.00 0.00 H new ATOM 0 HB3 ARG A 173 16.083 -1.992 4.048 1.00 0.00 H new ATOM 0 HG2 ARG A 173 14.174 -1.876 6.053 1.00 0.00 H new ATOM 0 HG3 ARG A 173 13.248 -2.576 4.741 1.00 0.00 H new ATOM 0 HD2 ARG A 173 15.795 -3.897 4.731 1.00 0.00 H new ATOM 0 HD3 ARG A 173 15.273 -3.835 6.403 1.00 0.00 H new ATOM 0 HE ARG A 173 13.563 -5.364 5.916 1.00 0.00 H new ATOM 0 HH11 ARG A 173 14.730 -3.879 2.912 1.00 0.00 H new ATOM 0 HH12 ARG A 173 13.764 -4.934 1.875 1.00 0.00 H new ATOM 0 HH21 ARG A 173 12.313 -6.726 4.573 1.00 0.00 H new ATOM 0 HH22 ARG A 173 12.393 -6.549 2.817 1.00 0.00 H new ATOM 644 N LYS A 174 16.147 0.540 2.443 1.00 0.00 N ATOM 645 CA LYS A 174 17.160 1.162 1.608 1.00 0.00 C ATOM 646 C LYS A 174 17.595 2.487 2.239 1.00 0.00 C ATOM 647 O LYS A 174 18.784 2.797 2.282 1.00 0.00 O ATOM 648 CB LYS A 174 16.655 1.304 0.170 1.00 0.00 C ATOM 649 CG LYS A 174 16.558 -0.062 -0.514 1.00 0.00 C ATOM 650 CD LYS A 174 17.923 -0.507 -1.045 1.00 0.00 C ATOM 651 CE LYS A 174 18.323 0.308 -2.277 1.00 0.00 C ATOM 652 NZ LYS A 174 19.672 -0.085 -2.742 1.00 0.00 N ATOM 0 H LYS A 174 15.385 0.096 1.931 1.00 0.00 H new ATOM 0 HA LYS A 174 18.046 0.530 1.551 1.00 0.00 H new ATOM 0 HB2 LYS A 174 15.677 1.785 0.170 1.00 0.00 H new ATOM 0 HB3 LYS A 174 17.328 1.950 -0.394 1.00 0.00 H new ATOM 0 HG2 LYS A 174 16.180 -0.801 0.193 1.00 0.00 H new ATOM 0 HG3 LYS A 174 15.843 -0.012 -1.335 1.00 0.00 H new ATOM 0 HD2 LYS A 174 18.676 -0.389 -0.266 1.00 0.00 H new ATOM 0 HD3 LYS A 174 17.891 -1.566 -1.300 1.00 0.00 H new ATOM 0 HE2 LYS A 174 17.597 0.152 -3.075 1.00 0.00 H new ATOM 0 HE3 LYS A 174 18.310 1.371 -2.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 19.928 0.477 -3.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 20.364 0.086 -1.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 19.673 -1.095 -2.990 1.00 0.00 H new ATOM 662 N LYS A 175 16.607 3.231 2.715 1.00 0.00 N ATOM 663 CA LYS A 175 16.872 4.514 3.342 1.00 0.00 C ATOM 664 C LYS A 175 17.441 4.284 4.743 1.00 0.00 C ATOM 665 O LYS A 175 18.341 5.001 5.178 1.00 0.00 O ATOM 666 CB LYS A 175 15.617 5.389 3.325 1.00 0.00 C ATOM 667 CG LYS A 175 14.491 4.748 4.139 1.00 0.00 C ATOM 668 CD LYS A 175 14.219 5.542 5.419 1.00 0.00 C ATOM 669 CE LYS A 175 14.211 4.625 6.642 1.00 0.00 C ATOM 670 NZ LYS A 175 14.245 5.423 7.889 1.00 0.00 N ATOM 0 H LYS A 175 15.622 2.969 2.679 1.00 0.00 H new ATOM 0 HA LYS A 175 17.624 5.065 2.778 1.00 0.00 H new ATOM 0 HB2 LYS A 175 15.850 6.373 3.732 1.00 0.00 H new ATOM 0 HB3 LYS A 175 15.288 5.539 2.297 1.00 0.00 H new ATOM 0 HG2 LYS A 175 13.584 4.700 3.537 1.00 0.00 H new ATOM 0 HG3 LYS A 175 14.759 3.723 4.393 1.00 0.00 H new ATOM 0 HD2 LYS A 175 14.981 6.312 5.542 1.00 0.00 H new ATOM 0 HD3 LYS A 175 13.260 6.053 5.337 1.00 0.00 H new ATOM 0 HE2 LYS A 175 13.319 3.999 6.628 1.00 0.00 H new ATOM 0 HE3 LYS A 175 15.071 3.956 6.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 175 14.239 4.785 8.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 175 15.109 6.002 7.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 175 13.411 6.043 7.927 1.00 0.00 H new ATOM 680 N MET A 176 16.894 3.279 5.411 1.00 0.00 N ATOM 681 CA MET A 176 17.337 2.944 6.755 1.00 0.00 C ATOM 682 C MET A 176 18.852 2.740 6.798 1.00 0.00 C ATOM 683 O MET A 176 19.540 3.331 7.630 1.00 0.00 O ATOM 684 CB MET A 176 16.635 1.668 7.221 1.00 0.00 C ATOM 685 CG MET A 176 17.176 1.208 8.577 1.00 0.00 C ATOM 686 SD MET A 176 16.442 2.176 9.886 1.00 0.00 S ATOM 687 CE MET A 176 15.825 0.868 10.930 1.00 0.00 C ATOM 0 H MET A 176 16.148 2.686 5.047 1.00 0.00 H new ATOM 0 HA MET A 176 17.083 3.771 7.418 1.00 0.00 H new ATOM 0 HB2 MET A 176 15.562 1.845 7.295 1.00 0.00 H new ATOM 0 HB3 MET A 176 16.778 0.880 6.482 1.00 0.00 H new ATOM 0 HG2 MET A 176 16.955 0.151 8.727 1.00 0.00 H new ATOM 0 HG3 MET A 176 18.261 1.313 8.600 1.00 0.00 H new ATOM 0 HE1 MET A 176 15.333 1.300 11.802 1.00 0.00 H new ATOM 0 HE2 MET A 176 15.110 0.264 10.372 1.00 0.00 H new ATOM 0 HE3 MET A 176 16.655 0.240 11.255 1.00 0.00 H new ATOM 695 N PHE A 177 19.330 1.900 5.891 1.00 0.00 N ATOM 696 CA PHE A 177 20.752 1.609 5.815 1.00 0.00 C ATOM 697 C PHE A 177 21.432 2.477 4.754 1.00 0.00 C ATOM 698 O PHE A 177 22.300 3.288 5.075 1.00 0.00 O ATOM 699 CB PHE A 177 20.886 0.138 5.417 1.00 0.00 C ATOM 700 CG PHE A 177 19.994 -0.809 6.222 1.00 0.00 C ATOM 701 CD1 PHE A 177 18.713 -1.037 5.825 1.00 0.00 C ATOM 702 CD2 PHE A 177 20.481 -1.424 7.333 1.00 0.00 C ATOM 703 CE1 PHE A 177 17.884 -1.915 6.572 1.00 0.00 C ATOM 704 CE2 PHE A 177 19.653 -2.302 8.079 1.00 0.00 C ATOM 705 CZ PHE A 177 18.371 -2.529 7.683 1.00 0.00 C ATOM 0 H PHE A 177 18.758 1.412 5.202 1.00 0.00 H new ATOM 0 HA PHE A 177 21.227 1.816 6.774 1.00 0.00 H new ATOM 0 HB2 PHE A 177 20.645 0.035 4.359 1.00 0.00 H new ATOM 0 HB3 PHE A 177 21.925 -0.167 5.539 1.00 0.00 H new ATOM 0 HD1 PHE A 177 18.327 -0.550 4.942 1.00 0.00 H new ATOM 0 HD2 PHE A 177 21.498 -1.244 7.647 1.00 0.00 H new ATOM 0 HE1 PHE A 177 16.867 -2.095 6.258 1.00 0.00 H new ATOM 0 HE2 PHE A 177 20.040 -2.790 8.961 1.00 0.00 H new ATOM 0 HZ PHE A 177 17.740 -3.197 8.251 1.00 0.00 H new ATOM 714 N GLU A 178 21.014 2.277 3.514 1.00 0.00 N ATOM 715 CA GLU A 178 21.572 3.030 2.404 1.00 0.00 C ATOM 716 C GLU A 178 22.986 2.539 2.088 1.00 0.00 C ATOM 717 O GLU A 178 23.617 3.017 1.146 1.00 0.00 O ATOM 718 CB GLU A 178 21.566 4.530 2.703 1.00 0.00 C ATOM 719 CG GLU A 178 20.611 5.272 1.766 1.00 0.00 C ATOM 720 CD GLU A 178 20.918 6.771 1.744 1.00 0.00 C ATOM 721 OE1 GLU A 178 20.357 7.478 2.609 1.00 0.00 O ATOM 722 OE2 GLU A 178 21.708 7.176 0.864 1.00 0.00 O ATOM 0 H GLU A 178 20.294 1.603 3.253 1.00 0.00 H new ATOM 0 HA GLU A 178 20.947 2.865 1.526 1.00 0.00 H new ATOM 0 HB2 GLU A 178 21.268 4.697 3.738 1.00 0.00 H new ATOM 0 HB3 GLU A 178 22.574 4.930 2.593 1.00 0.00 H new ATOM 0 HG2 GLU A 178 20.695 4.865 0.758 1.00 0.00 H new ATOM 0 HG3 GLU A 178 19.582 5.113 2.089 1.00 0.00 H new ATOM 727 N ALA A 179 23.443 1.591 2.892 1.00 0.00 N ATOM 728 CA ALA A 179 24.771 1.030 2.709 1.00 0.00 C ATOM 729 C ALA A 179 25.721 2.127 2.225 1.00 0.00 C ATOM 730 O ALA A 179 26.433 1.946 1.238 1.00 0.00 O ATOM 731 CB ALA A 179 24.698 -0.149 1.737 1.00 0.00 C ATOM 0 H ALA A 179 22.917 1.197 3.672 1.00 0.00 H new ATOM 0 HA ALA A 179 25.160 0.650 3.653 1.00 0.00 H new ATOM 0 HB1 ALA A 179 25.694 -0.570 1.600 1.00 0.00 H new ATOM 0 HB2 ALA A 179 24.034 -0.913 2.141 1.00 0.00 H new ATOM 0 HB3 ALA A 179 24.314 0.195 0.777 1.00 0.00 H new ATOM 737 N GLY A 180 25.701 3.241 2.941 1.00 0.00 N ATOM 738 CA GLY A 180 26.553 4.367 2.597 1.00 0.00 C ATOM 739 C GLY A 180 26.548 4.616 1.087 1.00 0.00 C ATOM 740 O GLY A 180 27.519 4.302 0.400 1.00 0.00 O ATOM 0 H GLY A 180 25.108 3.388 3.758 1.00 0.00 H new ATOM 0 HA2 GLY A 180 26.209 5.261 3.118 1.00 0.00 H new ATOM 0 HA3 GLY A 180 27.571 4.174 2.934 1.00 0.00 H new ATOM 744 N GLU A 181 25.444 5.177 0.616 1.00 0.00 N ATOM 745 CA GLU A 181 25.301 5.472 -0.800 1.00 0.00 C ATOM 746 C GLU A 181 24.481 6.750 -0.996 1.00 0.00 C ATOM 747 O GLU A 181 23.273 6.687 -1.220 1.00 0.00 O ATOM 748 CB GLU A 181 24.668 4.295 -1.543 1.00 0.00 C ATOM 749 CG GLU A 181 25.441 3.976 -2.825 1.00 0.00 C ATOM 750 CD GLU A 181 24.546 4.133 -4.058 1.00 0.00 C ATOM 751 OE1 GLU A 181 23.502 3.447 -4.091 1.00 0.00 O ATOM 752 OE2 GLU A 181 24.928 4.933 -4.938 1.00 0.00 O ATOM 0 H GLU A 181 24.641 5.435 1.189 1.00 0.00 H new ATOM 0 HA GLU A 181 26.294 5.633 -1.220 1.00 0.00 H new ATOM 0 HB2 GLU A 181 24.652 3.418 -0.896 1.00 0.00 H new ATOM 0 HB3 GLU A 181 23.632 4.529 -1.788 1.00 0.00 H new ATOM 0 HG2 GLU A 181 26.302 4.639 -2.909 1.00 0.00 H new ATOM 0 HG3 GLU A 181 25.826 2.957 -2.778 1.00 0.00 H new ATOM 757 N SER A 182 25.171 7.877 -0.904 1.00 0.00 N ATOM 758 CA SER A 182 24.521 9.167 -1.068 1.00 0.00 C ATOM 759 C SER A 182 23.819 9.230 -2.426 1.00 0.00 C ATOM 760 O SER A 182 23.985 8.338 -3.257 1.00 0.00 O ATOM 761 CB SER A 182 25.528 10.310 -0.938 1.00 0.00 C ATOM 762 OG SER A 182 25.149 11.243 0.071 1.00 0.00 O ATOM 0 H SER A 182 26.173 7.924 -0.718 1.00 0.00 H new ATOM 0 HA SER A 182 23.779 9.280 -0.277 1.00 0.00 H new ATOM 0 HB2 SER A 182 26.511 9.902 -0.704 1.00 0.00 H new ATOM 0 HB3 SER A 182 25.616 10.826 -1.894 1.00 0.00 H new ATOM 0 HG SER A 182 25.818 11.957 0.124 1.00 0.00 H new TER 767 SER A 182