USER MOD reduce.3.24.130724 H: found=0, std=0, add=1098, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1101 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 Set 1.1: A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 71 SER OG : rot 53:sc= -0.263 USER MOD Single : A 3 THR OG1 : rot 140:sc= -0.328 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.315) USER MOD Single : A 10 CYS SG : rot 180:sc= -0.257 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.0508 K(o=-0.051,f=-0.7) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot -166:sc= -1.57 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 TYR OH : rot 180:sc=-0.00988 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -4.57! C(o=-4.6!,f=-8.4!) USER MOD Single : A 45 TYR OH : rot -71:sc= 1.09 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 HIS : no HD1:sc= -0.192 X(o=-0.19,f=-0.42) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 GLN : amide:sc= -0.203 K(o=-0.2,f=-1.3) USER MOD Single : A 52 CYS SG : rot 132:sc= 0.11 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 46:sc= 0.854 USER MOD Single : A 66 THR OG1 : rot 46:sc= 0.28 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 22:sc= 0.178 USER MOD Single : A 75 LYS NZ :NH3+ 166:sc= 0.0433 (180deg=-0.155) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0.728 K(o=0.73,f=-0.0049) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.201 K(o=-0.2,f=-0.92) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot 89:sc= 0.306 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ -177:sc= 0.00795 (180deg=0.0014) USER MOD Single : A 106 GLN : amide:sc= -0.242 K(o=-0.24,f=-1.5) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot -137:sc= -2.01! USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= -0.0445 X(o=-0.044,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= 0.0308 X(o=0.031,f=0) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= -0.0536 K(o=-0.054,f=-0.67) USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 -1.092 -17.742 -12.968 1.00 0.00 N ATOM 2 CA ALA A 2 -1.967 -16.584 -13.300 1.00 0.00 C ATOM 3 C ALA A 2 -2.458 -15.867 -12.041 1.00 0.00 C ATOM 4 O ALA A 2 -2.427 -14.638 -11.968 1.00 0.00 O ATOM 5 CB ALA A 2 -3.151 -17.041 -14.140 1.00 0.00 C ATOM 0 HA ALA A 2 -1.372 -15.875 -13.875 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -3.782 -16.184 -14.375 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -2.789 -17.490 -15.065 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -3.731 -17.776 -13.582 1.00 0.00 H new ATOM 13 N THR A 3 -2.910 -16.644 -11.056 1.00 0.00 N ATOM 14 CA THR A 3 -3.413 -16.094 -9.795 1.00 0.00 C ATOM 15 C THR A 3 -4.712 -15.319 -10.011 1.00 0.00 C ATOM 16 O THR A 3 -4.742 -14.324 -10.739 1.00 0.00 O ATOM 17 CB THR A 3 -2.370 -15.184 -9.135 1.00 0.00 C ATOM 18 OG1 THR A 3 -1.052 -15.626 -9.421 1.00 0.00 O ATOM 19 CG2 THR A 3 -2.511 -15.110 -7.630 1.00 0.00 C ATOM 0 H THR A 3 -2.938 -17.662 -11.107 1.00 0.00 H new ATOM 0 HA THR A 3 -3.614 -16.935 -9.132 1.00 0.00 H new ATOM 0 HB THR A 3 -2.550 -14.194 -9.554 1.00 0.00 H new ATOM 0 HG1 THR A 3 -0.477 -14.851 -9.593 1.00 0.00 H new ATOM 0 HG21 THR A 3 -1.744 -14.450 -7.225 1.00 0.00 H new ATOM 0 HG22 THR A 3 -3.496 -14.720 -7.376 1.00 0.00 H new ATOM 0 HG23 THR A 3 -2.395 -16.107 -7.204 1.00 0.00 H new ATOM 27 N LYS A 4 -5.783 -15.780 -9.373 1.00 0.00 N ATOM 28 CA LYS A 4 -7.085 -15.130 -9.495 1.00 0.00 C ATOM 29 C LYS A 4 -7.252 -14.034 -8.445 1.00 0.00 C ATOM 30 O LYS A 4 -6.685 -14.113 -7.354 1.00 0.00 O ATOM 31 CB LYS A 4 -8.211 -16.158 -9.354 1.00 0.00 C ATOM 32 CG LYS A 4 -8.483 -16.940 -10.629 1.00 0.00 C ATOM 33 CD LYS A 4 -7.434 -18.015 -10.857 1.00 0.00 C ATOM 34 CE LYS A 4 -7.633 -18.716 -12.192 1.00 0.00 C ATOM 35 NZ LYS A 4 -7.068 -17.929 -13.325 1.00 0.00 N ATOM 0 H LYS A 4 -5.776 -16.600 -8.767 1.00 0.00 H new ATOM 0 HA LYS A 4 -7.139 -14.674 -10.483 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -7.957 -16.856 -8.557 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -9.124 -15.646 -9.050 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -9.470 -17.399 -10.572 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.498 -16.258 -11.479 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -6.441 -17.568 -10.825 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -7.481 -18.747 -10.050 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -7.160 -19.697 -12.160 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -8.697 -18.881 -12.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -7.225 -18.442 -14.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -7.537 -17.002 -13.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -6.047 -17.793 -13.179 1.00 0.00 H new ATOM 49 N ILE A 5 -8.040 -13.017 -8.782 1.00 0.00 N ATOM 50 CA ILE A 5 -8.295 -11.906 -7.872 1.00 0.00 C ATOM 51 C ILE A 5 -9.789 -11.782 -7.581 1.00 0.00 C ATOM 52 O ILE A 5 -10.602 -11.665 -8.502 1.00 0.00 O ATOM 53 CB ILE A 5 -7.763 -10.569 -8.441 1.00 0.00 C ATOM 54 CG1 ILE A 5 -8.016 -9.426 -7.453 1.00 0.00 C ATOM 55 CG2 ILE A 5 -8.399 -10.261 -9.790 1.00 0.00 C ATOM 56 CD1 ILE A 5 -6.937 -8.364 -7.469 1.00 0.00 C ATOM 0 H ILE A 5 -8.514 -12.940 -9.682 1.00 0.00 H new ATOM 0 HA ILE A 5 -7.763 -12.118 -6.945 1.00 0.00 H new ATOM 0 HB ILE A 5 -6.687 -10.667 -8.588 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -8.975 -8.962 -7.684 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -8.095 -9.837 -6.447 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -8.009 -9.316 -10.169 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -8.164 -11.059 -10.494 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.480 -10.187 -9.674 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -7.181 -7.586 -6.745 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.979 -8.814 -7.208 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -6.873 -7.926 -8.465 1.00 0.00 H new ATOM 68 N ASP A 6 -10.147 -11.815 -6.299 1.00 0.00 N ATOM 69 CA ASP A 6 -11.545 -11.707 -5.897 1.00 0.00 C ATOM 70 C ASP A 6 -12.051 -10.281 -6.076 1.00 0.00 C ATOM 71 O ASP A 6 -11.610 -9.361 -5.384 1.00 0.00 O ATOM 72 CB ASP A 6 -11.727 -12.147 -4.443 1.00 0.00 C ATOM 73 CG ASP A 6 -13.123 -12.668 -4.171 1.00 0.00 C ATOM 74 OD1 ASP A 6 -13.999 -11.857 -3.805 1.00 0.00 O ATOM 75 OD2 ASP A 6 -13.342 -13.886 -4.330 1.00 0.00 O ATOM 0 H ASP A 6 -9.490 -11.915 -5.525 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.129 -12.368 -6.538 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.999 -12.923 -4.207 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -11.521 -11.305 -3.782 1.00 0.00 H new ATOM 80 N LYS A 7 -12.977 -10.106 -7.014 1.00 0.00 N ATOM 81 CA LYS A 7 -13.547 -8.795 -7.295 1.00 0.00 C ATOM 82 C LYS A 7 -14.484 -8.355 -6.171 1.00 0.00 C ATOM 83 O LYS A 7 -14.455 -7.199 -5.751 1.00 0.00 O ATOM 84 CB LYS A 7 -14.296 -8.821 -8.629 1.00 0.00 C ATOM 85 CG LYS A 7 -14.769 -7.453 -9.089 1.00 0.00 C ATOM 86 CD LYS A 7 -14.842 -7.368 -10.606 1.00 0.00 C ATOM 87 CE LYS A 7 -13.537 -6.860 -11.203 1.00 0.00 C ATOM 88 NZ LYS A 7 -12.629 -7.976 -11.587 1.00 0.00 N ATOM 0 H LYS A 7 -13.349 -10.859 -7.593 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.732 -8.074 -7.360 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -13.645 -9.247 -9.393 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -15.158 -9.483 -8.539 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -15.751 -7.245 -8.664 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -14.091 -6.687 -8.713 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -15.071 -8.352 -11.015 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -15.657 -6.705 -10.895 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -13.753 -6.250 -12.080 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -13.035 -6.215 -10.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -11.889 -7.618 -12.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -12.189 -8.375 -10.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -13.175 -8.716 -12.073 1.00 0.00 H new ATOM 102 N GLU A 8 -15.313 -9.284 -5.690 1.00 0.00 N ATOM 103 CA GLU A 8 -16.259 -8.991 -4.615 1.00 0.00 C ATOM 104 C GLU A 8 -15.535 -8.464 -3.376 1.00 0.00 C ATOM 105 O GLU A 8 -15.896 -7.415 -2.840 1.00 0.00 O ATOM 106 CB GLU A 8 -17.067 -10.244 -4.262 1.00 0.00 C ATOM 107 CG GLU A 8 -18.525 -9.958 -3.930 1.00 0.00 C ATOM 108 CD GLU A 8 -19.326 -11.223 -3.688 1.00 0.00 C ATOM 109 OE1 GLU A 8 -19.561 -11.973 -4.659 1.00 0.00 O ATOM 110 OE2 GLU A 8 -19.720 -11.465 -2.527 1.00 0.00 O ATOM 0 H GLU A 8 -15.347 -10.245 -6.029 1.00 0.00 H new ATOM 0 HA GLU A 8 -16.941 -8.217 -4.966 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -17.024 -10.941 -5.099 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -16.600 -10.739 -3.411 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -18.575 -9.325 -3.044 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -18.977 -9.397 -4.748 1.00 0.00 H new ATOM 117 N ALA A 9 -14.511 -9.194 -2.931 1.00 0.00 N ATOM 118 CA ALA A 9 -13.736 -8.796 -1.758 1.00 0.00 C ATOM 119 C ALA A 9 -13.061 -7.444 -1.976 1.00 0.00 C ATOM 120 O ALA A 9 -13.182 -6.542 -1.145 1.00 0.00 O ATOM 121 CB ALA A 9 -12.704 -9.862 -1.420 1.00 0.00 C ATOM 0 H ALA A 9 -14.200 -10.063 -3.366 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.422 -8.694 -0.917 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -12.134 -9.552 -0.544 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -13.210 -10.804 -1.209 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -12.028 -9.995 -2.265 1.00 0.00 H new ATOM 127 N CYS A 10 -12.355 -7.309 -3.100 1.00 0.00 N ATOM 128 CA CYS A 10 -11.663 -6.065 -3.435 1.00 0.00 C ATOM 129 C CYS A 10 -12.636 -4.884 -3.477 1.00 0.00 C ATOM 130 O CYS A 10 -12.342 -3.809 -2.952 1.00 0.00 O ATOM 131 CB CYS A 10 -10.953 -6.206 -4.784 1.00 0.00 C ATOM 132 SG CYS A 10 -9.804 -4.862 -5.159 1.00 0.00 S ATOM 0 H CYS A 10 -12.248 -8.048 -3.795 1.00 0.00 H new ATOM 0 HA CYS A 10 -10.925 -5.869 -2.657 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -10.408 -7.150 -4.798 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -11.703 -6.259 -5.573 1.00 0.00 H new ATOM 0 HG CYS A 10 -9.253 -5.073 -6.317 1.00 0.00 H new ATOM 138 N ARG A 11 -13.796 -5.096 -4.103 1.00 0.00 N ATOM 139 CA ARG A 11 -14.818 -4.053 -4.212 1.00 0.00 C ATOM 140 C ARG A 11 -15.382 -3.700 -2.838 1.00 0.00 C ATOM 141 O ARG A 11 -15.587 -2.525 -2.530 1.00 0.00 O ATOM 142 CB ARG A 11 -15.951 -4.504 -5.141 1.00 0.00 C ATOM 143 CG ARG A 11 -16.372 -3.451 -6.156 1.00 0.00 C ATOM 144 CD ARG A 11 -17.807 -3.660 -6.623 1.00 0.00 C ATOM 145 NE ARG A 11 -18.034 -5.015 -7.133 1.00 0.00 N ATOM 146 CZ ARG A 11 -19.071 -5.364 -7.898 1.00 0.00 C ATOM 147 NH1 ARG A 11 -19.987 -4.465 -8.248 1.00 0.00 N ATOM 148 NH2 ARG A 11 -19.194 -6.620 -8.313 1.00 0.00 N ATOM 0 H ARG A 11 -14.051 -5.981 -4.542 1.00 0.00 H new ATOM 0 HA ARG A 11 -14.348 -3.165 -4.634 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -15.636 -5.402 -5.673 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -16.816 -4.778 -4.537 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -16.274 -2.460 -5.714 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -15.701 -3.485 -7.015 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -18.488 -3.467 -5.794 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -18.042 -2.936 -7.404 1.00 0.00 H new ATOM 0 HE ARG A 11 -17.357 -5.737 -6.888 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -19.901 -3.499 -7.932 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -20.776 -4.742 -8.833 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -18.497 -7.316 -8.047 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -19.986 -6.889 -8.898 1.00 0.00 H new ATOM 162 N ALA A 12 -15.626 -4.724 -2.016 1.00 0.00 N ATOM 163 CA ALA A 12 -16.159 -4.524 -0.670 1.00 0.00 C ATOM 164 C ALA A 12 -15.301 -3.533 0.109 1.00 0.00 C ATOM 165 O ALA A 12 -15.818 -2.594 0.717 1.00 0.00 O ATOM 166 CB ALA A 12 -16.243 -5.851 0.072 1.00 0.00 C ATOM 0 H ALA A 12 -15.462 -5.700 -2.261 1.00 0.00 H new ATOM 0 HA ALA A 12 -17.164 -4.111 -0.759 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -16.642 -5.684 1.073 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -16.899 -6.531 -0.471 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -15.248 -6.290 0.147 1.00 0.00 H new ATOM 172 N ALA A 13 -13.985 -3.741 0.072 1.00 0.00 N ATOM 173 CA ALA A 13 -13.046 -2.861 0.760 1.00 0.00 C ATOM 174 C ALA A 13 -13.051 -1.471 0.131 1.00 0.00 C ATOM 175 O ALA A 13 -13.074 -0.463 0.837 1.00 0.00 O ATOM 176 CB ALA A 13 -11.645 -3.454 0.734 1.00 0.00 C ATOM 0 H ALA A 13 -13.546 -4.514 -0.429 1.00 0.00 H new ATOM 0 HA ALA A 13 -13.362 -2.767 1.799 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -10.957 -2.785 1.251 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -11.651 -4.424 1.231 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -11.322 -3.578 -0.299 1.00 0.00 H new ATOM 182 N TYR A 14 -13.040 -1.429 -1.204 1.00 0.00 N ATOM 183 CA TYR A 14 -13.052 -0.165 -1.940 1.00 0.00 C ATOM 184 C TYR A 14 -14.293 0.660 -1.598 1.00 0.00 C ATOM 185 O TYR A 14 -14.227 1.888 -1.505 1.00 0.00 O ATOM 186 CB TYR A 14 -13.007 -0.430 -3.449 1.00 0.00 C ATOM 187 CG TYR A 14 -12.618 0.780 -4.270 1.00 0.00 C ATOM 188 CD1 TYR A 14 -13.547 1.769 -4.570 1.00 0.00 C ATOM 189 CD2 TYR A 14 -11.322 0.931 -4.745 1.00 0.00 C ATOM 190 CE1 TYR A 14 -13.195 2.874 -5.319 1.00 0.00 C ATOM 191 CE2 TYR A 14 -10.961 2.034 -5.496 1.00 0.00 C ATOM 192 CZ TYR A 14 -11.902 3.002 -5.780 1.00 0.00 C ATOM 193 OH TYR A 14 -11.549 4.101 -6.529 1.00 0.00 O ATOM 0 H TYR A 14 -13.023 -2.259 -1.797 1.00 0.00 H new ATOM 0 HA TYR A 14 -12.169 0.402 -1.646 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -12.298 -1.234 -3.646 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -13.986 -0.780 -3.776 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -14.561 1.672 -4.211 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -10.584 0.174 -4.524 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -13.929 3.634 -5.543 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -9.949 2.137 -5.858 1.00 0.00 H new ATOM 0 HH TYR A 14 -10.602 4.039 -6.774 1.00 0.00 H new ATOM 203 N ASN A 15 -15.423 -0.023 -1.418 1.00 0.00 N ATOM 204 CA ASN A 15 -16.682 0.638 -1.089 1.00 0.00 C ATOM 205 C ASN A 15 -16.657 1.204 0.330 1.00 0.00 C ATOM 206 O ASN A 15 -17.088 2.334 0.563 1.00 0.00 O ATOM 207 CB ASN A 15 -17.847 -0.343 -1.238 1.00 0.00 C ATOM 208 CG ASN A 15 -18.333 -0.461 -2.672 1.00 0.00 C ATOM 209 OD1 ASN A 15 -18.409 0.530 -3.398 1.00 0.00 O ATOM 210 ND2 ASN A 15 -18.665 -1.681 -3.089 1.00 0.00 N ATOM 0 H ASN A 15 -15.490 -1.038 -1.495 1.00 0.00 H new ATOM 0 HA ASN A 15 -16.817 1.467 -1.783 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -17.537 -1.325 -0.881 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -18.673 -0.019 -0.604 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -18.997 -1.821 -4.043 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -18.587 -2.476 -2.454 1.00 0.00 H new ATOM 217 N LEU A 16 -16.151 0.410 1.274 1.00 0.00 N ATOM 218 CA LEU A 16 -16.074 0.831 2.672 1.00 0.00 C ATOM 219 C LEU A 16 -15.049 1.951 2.854 1.00 0.00 C ATOM 220 O LEU A 16 -15.334 2.958 3.506 1.00 0.00 O ATOM 221 CB LEU A 16 -15.720 -0.362 3.564 1.00 0.00 C ATOM 222 CG LEU A 16 -16.444 -0.404 4.914 1.00 0.00 C ATOM 223 CD1 LEU A 16 -17.100 -1.761 5.129 1.00 0.00 C ATOM 224 CD2 LEU A 16 -15.478 -0.094 6.048 1.00 0.00 C ATOM 0 H LEU A 16 -15.789 -0.527 1.096 1.00 0.00 H new ATOM 0 HA LEU A 16 -17.051 1.216 2.965 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -15.944 -1.280 3.021 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -14.645 -0.353 3.746 1.00 0.00 H new ATOM 0 HG LEU A 16 -17.224 0.357 4.908 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -17.609 -1.771 6.093 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -17.824 -1.945 4.335 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -16.338 -2.540 5.113 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -16.010 -0.128 6.999 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -14.676 -0.832 6.054 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -15.056 0.900 5.904 1.00 0.00 H new ATOM 236 N VAL A 17 -13.862 1.775 2.271 1.00 0.00 N ATOM 237 CA VAL A 17 -12.802 2.778 2.368 1.00 0.00 C ATOM 238 C VAL A 17 -13.211 4.092 1.689 1.00 0.00 C ATOM 239 O VAL A 17 -12.703 5.158 2.039 1.00 0.00 O ATOM 240 CB VAL A 17 -11.477 2.267 1.753 1.00 0.00 C ATOM 241 CG1 VAL A 17 -11.584 2.148 0.240 1.00 0.00 C ATOM 242 CG2 VAL A 17 -10.318 3.175 2.142 1.00 0.00 C ATOM 0 H VAL A 17 -13.612 0.949 1.728 1.00 0.00 H new ATOM 0 HA VAL A 17 -12.644 2.965 3.430 1.00 0.00 H new ATOM 0 HB VAL A 17 -11.283 1.272 2.154 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -10.638 1.787 -0.164 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -12.379 1.447 -0.015 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -11.812 3.125 -0.187 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -9.396 2.798 1.699 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -10.509 4.185 1.778 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -10.218 3.193 3.227 1.00 0.00 H new ATOM 252 N ARG A 18 -14.134 4.007 0.723 1.00 0.00 N ATOM 253 CA ARG A 18 -14.613 5.189 0.005 1.00 0.00 C ATOM 254 C ARG A 18 -15.118 6.252 0.981 1.00 0.00 C ATOM 255 O ARG A 18 -14.880 7.444 0.787 1.00 0.00 O ATOM 256 CB ARG A 18 -15.733 4.808 -0.970 1.00 0.00 C ATOM 257 CG ARG A 18 -15.867 5.757 -2.151 1.00 0.00 C ATOM 258 CD ARG A 18 -15.416 5.103 -3.450 1.00 0.00 C ATOM 259 NE ARG A 18 -14.114 5.604 -3.889 1.00 0.00 N ATOM 260 CZ ARG A 18 -13.937 6.753 -4.547 1.00 0.00 C ATOM 261 NH1 ARG A 18 -14.979 7.512 -4.875 1.00 0.00 N ATOM 262 NH2 ARG A 18 -12.711 7.142 -4.880 1.00 0.00 N ATOM 0 H ARG A 18 -14.562 3.131 0.423 1.00 0.00 H new ATOM 0 HA ARG A 18 -13.775 5.601 -0.558 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -15.549 3.801 -1.344 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -16.679 4.780 -0.429 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -16.905 6.077 -2.245 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -15.273 6.652 -1.968 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -15.362 4.023 -3.313 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -16.158 5.289 -4.227 1.00 0.00 H new ATOM 0 HE ARG A 18 -13.290 5.041 -3.680 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -15.923 7.218 -4.624 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -14.834 8.388 -5.377 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -11.908 6.564 -4.633 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -12.573 8.019 -5.382 1.00 0.00 H new ATOM 276 N ASP A 19 -15.810 5.806 2.032 1.00 0.00 N ATOM 277 CA ASP A 19 -16.343 6.713 3.044 1.00 0.00 C ATOM 278 C ASP A 19 -15.210 7.362 3.832 1.00 0.00 C ATOM 279 O ASP A 19 -14.474 6.683 4.553 1.00 0.00 O ATOM 280 CB ASP A 19 -17.279 5.965 4.001 1.00 0.00 C ATOM 281 CG ASP A 19 -18.188 6.902 4.771 1.00 0.00 C ATOM 282 OD1 ASP A 19 -17.727 7.486 5.775 1.00 0.00 O ATOM 283 OD2 ASP A 19 -19.361 7.051 4.372 1.00 0.00 O ATOM 0 H ASP A 19 -16.013 4.821 2.202 1.00 0.00 H new ATOM 0 HA ASP A 19 -16.910 7.492 2.534 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -17.886 5.259 3.434 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -16.685 5.381 4.704 1.00 0.00 H new ATOM 288 N ASP A 20 -15.074 8.679 3.691 1.00 0.00 N ATOM 289 CA ASP A 20 -14.029 9.422 4.389 1.00 0.00 C ATOM 290 C ASP A 20 -14.556 10.029 5.691 1.00 0.00 C ATOM 291 O ASP A 20 -14.248 11.177 6.023 1.00 0.00 O ATOM 292 CB ASP A 20 -13.460 10.518 3.478 1.00 0.00 C ATOM 293 CG ASP A 20 -12.715 9.951 2.283 1.00 0.00 C ATOM 294 OD1 ASP A 20 -11.814 9.109 2.485 1.00 0.00 O ATOM 295 OD2 ASP A 20 -13.029 10.354 1.143 1.00 0.00 O ATOM 0 H ASP A 20 -15.675 9.253 3.099 1.00 0.00 H new ATOM 0 HA ASP A 20 -13.231 8.725 4.645 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -14.273 11.153 3.127 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -12.787 11.152 4.055 1.00 0.00 H new ATOM 300 N GLY A 21 -15.349 9.251 6.428 1.00 0.00 N ATOM 301 CA GLY A 21 -15.903 9.724 7.687 1.00 0.00 C ATOM 302 C GLY A 21 -15.876 8.663 8.776 1.00 0.00 C ATOM 303 O GLY A 21 -16.753 8.636 9.640 1.00 0.00 O ATOM 0 H GLY A 21 -15.618 8.300 6.174 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -15.341 10.596 8.021 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -16.931 10.049 7.527 1.00 0.00 H new ATOM 307 N SER A 22 -14.869 7.787 8.733 1.00 0.00 N ATOM 308 CA SER A 22 -14.735 6.720 9.722 1.00 0.00 C ATOM 309 C SER A 22 -13.281 6.559 10.164 1.00 0.00 C ATOM 310 O SER A 22 -12.388 7.244 9.661 1.00 0.00 O ATOM 311 CB SER A 22 -15.257 5.399 9.148 1.00 0.00 C ATOM 312 OG SER A 22 -15.769 4.567 10.175 1.00 0.00 O ATOM 0 H SER A 22 -14.136 7.797 8.024 1.00 0.00 H new ATOM 0 HA SER A 22 -15.329 6.992 10.595 1.00 0.00 H new ATOM 0 HB2 SER A 22 -16.038 5.600 8.415 1.00 0.00 H new ATOM 0 HB3 SER A 22 -14.453 4.883 8.624 1.00 0.00 H new ATOM 0 HG SER A 22 -16.098 3.730 9.785 1.00 0.00 H new ATOM 318 N ALA A 23 -13.049 5.644 11.106 1.00 0.00 N ATOM 319 CA ALA A 23 -11.705 5.387 11.615 1.00 0.00 C ATOM 320 C ALA A 23 -10.964 4.383 10.728 1.00 0.00 C ATOM 321 O ALA A 23 -10.482 3.351 11.203 1.00 0.00 O ATOM 322 CB ALA A 23 -11.772 4.891 13.054 1.00 0.00 C ATOM 0 H ALA A 23 -13.776 5.069 11.531 1.00 0.00 H new ATOM 0 HA ALA A 23 -11.147 6.323 11.596 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -10.763 4.703 13.421 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -12.250 5.646 13.677 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -12.350 3.968 13.094 1.00 0.00 H new ATOM 328 N VAL A 24 -10.883 4.695 9.434 1.00 0.00 N ATOM 329 CA VAL A 24 -10.207 3.829 8.470 1.00 0.00 C ATOM 330 C VAL A 24 -9.455 4.657 7.427 1.00 0.00 C ATOM 331 O VAL A 24 -10.041 5.520 6.770 1.00 0.00 O ATOM 332 CB VAL A 24 -11.212 2.903 7.748 1.00 0.00 C ATOM 333 CG1 VAL A 24 -10.485 1.926 6.837 1.00 0.00 C ATOM 334 CG2 VAL A 24 -12.076 2.154 8.755 1.00 0.00 C ATOM 0 H VAL A 24 -11.279 5.544 9.029 1.00 0.00 H new ATOM 0 HA VAL A 24 -9.498 3.218 9.029 1.00 0.00 H new ATOM 0 HB VAL A 24 -11.864 3.524 7.134 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -11.211 1.284 6.339 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -9.917 2.480 6.089 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -9.805 1.313 7.429 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -12.776 1.508 8.225 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -11.440 1.548 9.400 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.631 2.870 9.362 1.00 0.00 H new ATOM 344 N ILE A 25 -8.155 4.393 7.284 1.00 0.00 N ATOM 345 CA ILE A 25 -7.326 5.122 6.319 1.00 0.00 C ATOM 346 C ILE A 25 -6.561 4.183 5.381 1.00 0.00 C ATOM 347 O ILE A 25 -6.267 4.550 4.241 1.00 0.00 O ATOM 348 CB ILE A 25 -6.319 6.056 7.026 1.00 0.00 C ATOM 349 CG1 ILE A 25 -5.415 5.264 7.978 1.00 0.00 C ATOM 350 CG2 ILE A 25 -7.051 7.158 7.778 1.00 0.00 C ATOM 351 CD1 ILE A 25 -3.939 5.487 7.733 1.00 0.00 C ATOM 0 H ILE A 25 -7.655 3.684 7.820 1.00 0.00 H new ATOM 0 HA ILE A 25 -8.018 5.719 5.725 1.00 0.00 H new ATOM 0 HB ILE A 25 -5.689 6.516 6.264 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -5.651 5.542 9.005 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -5.636 4.201 7.876 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -6.326 7.806 8.270 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -7.645 7.744 7.077 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -7.707 6.714 8.527 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -3.359 4.896 8.442 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.689 5.182 6.717 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.704 6.543 7.863 1.00 0.00 H new ATOM 363 N TRP A 26 -6.231 2.977 5.857 1.00 0.00 N ATOM 364 CA TRP A 26 -5.496 2.013 5.043 1.00 0.00 C ATOM 365 C TRP A 26 -6.127 0.621 5.106 1.00 0.00 C ATOM 366 O TRP A 26 -6.837 0.289 6.058 1.00 0.00 O ATOM 367 CB TRP A 26 -4.027 1.946 5.485 1.00 0.00 C ATOM 368 CG TRP A 26 -3.828 1.345 6.846 1.00 0.00 C ATOM 369 CD1 TRP A 26 -3.564 2.015 8.007 1.00 0.00 C ATOM 370 CD2 TRP A 26 -3.868 -0.048 7.191 1.00 0.00 C ATOM 371 NE1 TRP A 26 -3.445 1.128 9.046 1.00 0.00 N ATOM 372 CE2 TRP A 26 -3.627 -0.140 8.573 1.00 0.00 C ATOM 373 CE3 TRP A 26 -4.086 -1.224 6.467 1.00 0.00 C ATOM 374 CZ2 TRP A 26 -3.599 -1.357 9.245 1.00 0.00 C ATOM 375 CZ3 TRP A 26 -4.059 -2.433 7.138 1.00 0.00 C ATOM 376 CH2 TRP A 26 -3.818 -2.489 8.512 1.00 0.00 C ATOM 0 H TRP A 26 -6.461 2.650 6.796 1.00 0.00 H new ATOM 0 HA TRP A 26 -5.544 2.355 4.009 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -3.465 1.363 4.756 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -3.610 2.953 5.479 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -3.464 3.087 8.094 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -3.252 1.376 10.016 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -4.272 -1.189 5.404 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -3.411 -1.406 10.307 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -4.227 -3.349 6.590 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -3.804 -3.449 9.007 1.00 0.00 H new ATOM 387 N VAL A 27 -5.844 -0.191 4.085 1.00 0.00 N ATOM 388 CA VAL A 27 -6.358 -1.556 4.008 1.00 0.00 C ATOM 389 C VAL A 27 -5.275 -2.500 3.495 1.00 0.00 C ATOM 390 O VAL A 27 -4.403 -2.090 2.726 1.00 0.00 O ATOM 391 CB VAL A 27 -7.588 -1.663 3.080 1.00 0.00 C ATOM 392 CG1 VAL A 27 -8.410 -2.899 3.414 1.00 0.00 C ATOM 393 CG2 VAL A 27 -8.446 -0.407 3.160 1.00 0.00 C ATOM 0 H VAL A 27 -5.257 0.078 3.296 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.661 -1.837 5.017 1.00 0.00 H new ATOM 0 HB VAL A 27 -7.228 -1.759 2.056 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.271 -2.954 2.748 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.795 -3.790 3.287 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -8.753 -2.839 4.447 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -9.305 -0.510 2.497 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -8.793 -0.268 4.184 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -7.855 0.457 2.857 1.00 0.00 H new ATOM 403 N THR A 28 -5.329 -3.765 3.911 1.00 0.00 N ATOM 404 CA THR A 28 -4.338 -4.744 3.471 1.00 0.00 C ATOM 405 C THR A 28 -4.812 -5.452 2.205 1.00 0.00 C ATOM 406 O THR A 28 -6.003 -5.456 1.897 1.00 0.00 O ATOM 407 CB THR A 28 -4.053 -5.766 4.582 1.00 0.00 C ATOM 408 OG1 THR A 28 -3.487 -5.131 5.714 1.00 0.00 O ATOM 409 CG2 THR A 28 -3.107 -6.873 4.165 1.00 0.00 C ATOM 0 H THR A 28 -6.039 -4.132 4.544 1.00 0.00 H new ATOM 0 HA THR A 28 -3.412 -4.215 3.246 1.00 0.00 H new ATOM 0 HB THR A 28 -5.022 -6.208 4.812 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.111 -5.808 6.315 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.954 -7.555 5.001 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.535 -7.420 3.324 1.00 0.00 H new ATOM 0 HG23 THR A 28 -2.151 -6.442 3.869 1.00 0.00 H new ATOM 417 N PHE A 29 -3.874 -6.047 1.474 1.00 0.00 N ATOM 418 CA PHE A 29 -4.203 -6.762 0.247 1.00 0.00 C ATOM 419 C PHE A 29 -3.293 -7.971 0.072 1.00 0.00 C ATOM 420 O PHE A 29 -2.197 -7.870 -0.480 1.00 0.00 O ATOM 421 CB PHE A 29 -4.105 -5.833 -0.964 1.00 0.00 C ATOM 422 CG PHE A 29 -5.364 -5.050 -1.213 1.00 0.00 C ATOM 423 CD1 PHE A 29 -5.596 -3.859 -0.545 1.00 0.00 C ATOM 424 CD2 PHE A 29 -6.316 -5.506 -2.112 1.00 0.00 C ATOM 425 CE1 PHE A 29 -6.753 -3.137 -0.768 1.00 0.00 C ATOM 426 CE2 PHE A 29 -7.476 -4.789 -2.339 1.00 0.00 C ATOM 427 CZ PHE A 29 -7.694 -3.602 -1.666 1.00 0.00 C ATOM 0 H PHE A 29 -2.882 -6.048 1.710 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.232 -7.115 0.322 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -3.277 -5.140 -0.816 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -3.871 -6.424 -1.849 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -4.864 -3.490 0.158 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -6.149 -6.433 -2.641 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -6.921 -2.210 -0.241 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -8.210 -5.156 -3.041 1.00 0.00 H new ATOM 0 HZ PHE A 29 -8.599 -3.039 -1.842 1.00 0.00 H new ATOM 437 N LYS A 30 -3.767 -9.113 0.554 1.00 0.00 N ATOM 438 CA LYS A 30 -3.023 -10.366 0.468 1.00 0.00 C ATOM 439 C LYS A 30 -3.745 -11.341 -0.460 1.00 0.00 C ATOM 440 O LYS A 30 -4.806 -11.023 -0.997 1.00 0.00 O ATOM 441 CB LYS A 30 -2.852 -10.979 1.866 1.00 0.00 C ATOM 442 CG LYS A 30 -4.112 -10.916 2.721 1.00 0.00 C ATOM 443 CD LYS A 30 -3.901 -11.548 4.088 1.00 0.00 C ATOM 444 CE LYS A 30 -4.982 -12.573 4.397 1.00 0.00 C ATOM 445 NZ LYS A 30 -5.110 -12.828 5.860 1.00 0.00 N ATOM 0 H LYS A 30 -4.674 -9.198 1.014 1.00 0.00 H new ATOM 0 HA LYS A 30 -2.034 -10.163 0.058 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -2.546 -12.020 1.762 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -2.046 -10.460 2.384 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -4.415 -9.876 2.844 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.926 -11.427 2.206 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -2.922 -12.027 4.122 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -3.903 -10.772 4.854 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -5.937 -12.222 4.006 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -4.752 -13.507 3.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -5.857 -13.532 6.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -4.207 -13.188 6.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -5.355 -11.942 6.347 1.00 0.00 H new ATOM 459 N TYR A 31 -3.175 -12.527 -0.653 1.00 0.00 N ATOM 460 CA TYR A 31 -3.791 -13.523 -1.521 1.00 0.00 C ATOM 461 C TYR A 31 -3.586 -14.935 -0.982 1.00 0.00 C ATOM 462 O TYR A 31 -2.467 -15.330 -0.646 1.00 0.00 O ATOM 463 CB TYR A 31 -3.252 -13.403 -2.952 1.00 0.00 C ATOM 464 CG TYR A 31 -1.821 -13.863 -3.124 1.00 0.00 C ATOM 465 CD1 TYR A 31 -0.767 -13.142 -2.575 1.00 0.00 C ATOM 466 CD2 TYR A 31 -1.524 -15.017 -3.839 1.00 0.00 C ATOM 467 CE1 TYR A 31 0.540 -13.557 -2.737 1.00 0.00 C ATOM 468 CE2 TYR A 31 -0.221 -15.439 -4.003 1.00 0.00 C ATOM 469 CZ TYR A 31 0.809 -14.706 -3.452 1.00 0.00 C ATOM 470 OH TYR A 31 2.110 -15.121 -3.616 1.00 0.00 O ATOM 0 H TYR A 31 -2.297 -12.819 -0.225 1.00 0.00 H new ATOM 0 HA TYR A 31 -4.863 -13.329 -1.540 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -3.890 -13.985 -3.617 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -3.327 -12.363 -3.269 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -0.974 -12.243 -2.013 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -2.327 -15.593 -4.274 1.00 0.00 H new ATOM 0 HE1 TYR A 31 1.348 -12.985 -2.306 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -0.008 -16.339 -4.560 1.00 0.00 H new ATOM 0 HH TYR A 31 2.126 -15.947 -4.143 1.00 0.00 H new ATOM 480 N ASP A 32 -4.681 -15.688 -0.908 1.00 0.00 N ATOM 481 CA ASP A 32 -4.646 -17.060 -0.418 1.00 0.00 C ATOM 482 C ASP A 32 -4.247 -18.018 -1.548 1.00 0.00 C ATOM 483 O ASP A 32 -3.495 -17.633 -2.446 1.00 0.00 O ATOM 484 CB ASP A 32 -6.013 -17.433 0.170 1.00 0.00 C ATOM 485 CG ASP A 32 -5.892 -18.192 1.478 1.00 0.00 C ATOM 486 OD1 ASP A 32 -5.163 -19.205 1.515 1.00 0.00 O ATOM 487 OD2 ASP A 32 -6.525 -17.771 2.468 1.00 0.00 O ATOM 0 H ASP A 32 -5.609 -15.366 -1.184 1.00 0.00 H new ATOM 0 HA ASP A 32 -3.898 -17.144 0.370 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -6.596 -16.526 0.332 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.562 -18.040 -0.550 1.00 0.00 H new ATOM 492 N GLY A 33 -4.740 -19.260 -1.501 1.00 0.00 N ATOM 493 CA GLY A 33 -4.411 -20.236 -2.532 1.00 0.00 C ATOM 494 C GLY A 33 -4.941 -19.840 -3.900 1.00 0.00 C ATOM 495 O GLY A 33 -6.013 -20.289 -4.308 1.00 0.00 O ATOM 0 H GLY A 33 -5.360 -19.605 -0.768 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -3.329 -20.352 -2.585 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -4.822 -21.206 -2.254 1.00 0.00 H new ATOM 499 N SER A 34 -4.188 -18.987 -4.602 1.00 0.00 N ATOM 500 CA SER A 34 -4.573 -18.504 -5.931 1.00 0.00 C ATOM 501 C SER A 34 -5.838 -17.648 -5.862 1.00 0.00 C ATOM 502 O SER A 34 -6.783 -17.857 -6.625 1.00 0.00 O ATOM 503 CB SER A 34 -4.787 -19.670 -6.907 1.00 0.00 C ATOM 504 OG SER A 34 -3.724 -20.606 -6.845 1.00 0.00 O ATOM 0 H SER A 34 -3.300 -18.614 -4.267 1.00 0.00 H new ATOM 0 HA SER A 34 -3.753 -17.888 -6.300 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.727 -20.171 -6.676 1.00 0.00 H new ATOM 0 HB3 SER A 34 -4.873 -19.284 -7.923 1.00 0.00 H new ATOM 0 HG SER A 34 -3.893 -21.335 -7.477 1.00 0.00 H new ATOM 510 N THR A 35 -5.848 -16.679 -4.947 1.00 0.00 N ATOM 511 CA THR A 35 -6.997 -15.790 -4.785 1.00 0.00 C ATOM 512 C THR A 35 -6.624 -14.549 -3.972 1.00 0.00 C ATOM 513 O THR A 35 -6.319 -14.644 -2.781 1.00 0.00 O ATOM 514 CB THR A 35 -8.164 -16.532 -4.119 1.00 0.00 C ATOM 515 OG1 THR A 35 -9.178 -15.623 -3.725 1.00 0.00 O ATOM 516 CG2 THR A 35 -7.759 -17.327 -2.895 1.00 0.00 C ATOM 0 H THR A 35 -5.075 -16.490 -4.308 1.00 0.00 H new ATOM 0 HA THR A 35 -7.310 -15.465 -5.777 1.00 0.00 H new ATOM 0 HB THR A 35 -8.526 -17.228 -4.876 1.00 0.00 H new ATOM 0 HG1 THR A 35 -9.913 -16.116 -3.304 1.00 0.00 H new ATOM 0 HG21 THR A 35 -8.635 -17.824 -2.478 1.00 0.00 H new ATOM 0 HG22 THR A 35 -7.017 -18.074 -3.176 1.00 0.00 H new ATOM 0 HG23 THR A 35 -7.333 -16.655 -2.149 1.00 0.00 H new ATOM 524 N ILE A 36 -6.652 -13.389 -4.625 1.00 0.00 N ATOM 525 CA ILE A 36 -6.318 -12.125 -3.968 1.00 0.00 C ATOM 526 C ILE A 36 -7.535 -11.531 -3.267 1.00 0.00 C ATOM 527 O ILE A 36 -8.647 -11.572 -3.795 1.00 0.00 O ATOM 528 CB ILE A 36 -5.763 -11.095 -4.971 1.00 0.00 C ATOM 529 CG1 ILE A 36 -4.662 -11.727 -5.825 1.00 0.00 C ATOM 530 CG2 ILE A 36 -5.236 -9.869 -4.237 1.00 0.00 C ATOM 531 CD1 ILE A 36 -4.090 -10.795 -6.868 1.00 0.00 C ATOM 0 H ILE A 36 -6.903 -13.297 -5.609 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.549 -12.349 -3.229 1.00 0.00 H new ATOM 0 HB ILE A 36 -6.572 -10.778 -5.630 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -3.857 -12.065 -5.172 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -5.062 -12.611 -6.321 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.848 -9.151 -4.960 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -6.045 -9.410 -3.668 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.438 -10.167 -3.557 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.316 -11.313 -7.434 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -4.882 -10.477 -7.545 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.659 -9.922 -6.378 1.00 0.00 H new ATOM 543 N VAL A 37 -7.313 -10.978 -2.074 1.00 0.00 N ATOM 544 CA VAL A 37 -8.386 -10.373 -1.290 1.00 0.00 C ATOM 545 C VAL A 37 -7.838 -9.343 -0.301 1.00 0.00 C ATOM 546 O VAL A 37 -6.681 -9.424 0.116 1.00 0.00 O ATOM 547 CB VAL A 37 -9.184 -11.445 -0.514 1.00 0.00 C ATOM 548 CG1 VAL A 37 -10.108 -12.206 -1.452 1.00 0.00 C ATOM 549 CG2 VAL A 37 -8.242 -12.403 0.207 1.00 0.00 C ATOM 0 H VAL A 37 -6.396 -10.938 -1.630 1.00 0.00 H new ATOM 0 HA VAL A 37 -9.050 -9.873 -1.995 1.00 0.00 H new ATOM 0 HB VAL A 37 -9.794 -10.941 0.235 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -10.662 -12.956 -0.888 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -10.808 -11.511 -1.916 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -9.517 -12.697 -2.226 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -8.825 -13.149 0.747 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -7.601 -12.900 -0.521 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -7.625 -11.845 0.912 1.00 0.00 H new ATOM 559 N PRO A 38 -8.668 -8.360 0.095 1.00 0.00 N ATOM 560 CA PRO A 38 -8.261 -7.318 1.046 1.00 0.00 C ATOM 561 C PRO A 38 -8.014 -7.877 2.446 1.00 0.00 C ATOM 562 O PRO A 38 -8.394 -9.012 2.747 1.00 0.00 O ATOM 563 CB PRO A 38 -9.452 -6.355 1.053 1.00 0.00 C ATOM 564 CG PRO A 38 -10.613 -7.185 0.630 1.00 0.00 C ATOM 565 CD PRO A 38 -10.067 -8.191 -0.342 1.00 0.00 C ATOM 0 HA PRO A 38 -7.321 -6.848 0.758 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -9.610 -5.929 2.044 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -9.291 -5.522 0.369 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -11.073 -7.679 1.486 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -11.384 -6.570 0.165 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -10.618 -9.131 -0.300 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -10.127 -7.832 -1.369 1.00 0.00 H new ATOM 573 N GLY A 39 -7.372 -7.077 3.297 1.00 0.00 N ATOM 574 CA GLY A 39 -7.080 -7.504 4.647 1.00 0.00 C ATOM 575 C GLY A 39 -7.298 -6.402 5.666 1.00 0.00 C ATOM 576 O GLY A 39 -8.182 -5.561 5.499 1.00 0.00 O ATOM 0 H GLY A 39 -7.050 -6.137 3.069 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -7.710 -8.357 4.899 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -6.046 -7.845 4.701 1.00 0.00 H new ATOM 580 N GLU A 40 -6.479 -6.419 6.717 1.00 0.00 N ATOM 581 CA GLU A 40 -6.546 -5.442 7.806 1.00 0.00 C ATOM 582 C GLU A 40 -7.011 -4.069 7.326 1.00 0.00 C ATOM 583 O GLU A 40 -6.530 -3.556 6.317 1.00 0.00 O ATOM 584 CB GLU A 40 -5.185 -5.320 8.496 1.00 0.00 C ATOM 585 CG GLU A 40 -4.762 -6.570 9.257 1.00 0.00 C ATOM 586 CD GLU A 40 -4.034 -7.573 8.381 1.00 0.00 C ATOM 587 OE1 GLU A 40 -2.830 -7.373 8.121 1.00 0.00 O ATOM 588 OE2 GLU A 40 -4.673 -8.557 7.951 1.00 0.00 O ATOM 0 H GLU A 40 -5.744 -7.116 6.839 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.286 -5.808 8.518 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.428 -5.090 7.746 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.214 -4.478 9.188 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.116 -6.283 10.087 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -5.644 -7.044 9.688 1.00 0.00 H new ATOM 595 N GLN A 41 -7.951 -3.488 8.063 1.00 0.00 N ATOM 596 CA GLN A 41 -8.498 -2.176 7.730 1.00 0.00 C ATOM 597 C GLN A 41 -8.624 -1.312 8.982 1.00 0.00 C ATOM 598 O GLN A 41 -9.622 -1.385 9.700 1.00 0.00 O ATOM 599 CB GLN A 41 -9.863 -2.332 7.052 1.00 0.00 C ATOM 600 CG GLN A 41 -10.142 -1.280 5.989 1.00 0.00 C ATOM 601 CD GLN A 41 -11.600 -0.861 5.941 1.00 0.00 C ATOM 602 OE1 GLN A 41 -12.335 -1.006 6.919 1.00 0.00 O ATOM 603 NE2 GLN A 41 -12.029 -0.332 4.800 1.00 0.00 N ATOM 0 H GLN A 41 -8.353 -3.908 8.901 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.815 -1.681 7.039 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.922 -3.320 6.596 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.643 -2.284 7.811 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.523 -0.403 6.181 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.849 -1.669 5.014 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.388 -0.229 4.013 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -12.999 -0.029 4.711 1.00 0.00 H new ATOM 612 N GLY A 42 -7.600 -0.502 9.243 1.00 0.00 N ATOM 613 CA GLY A 42 -7.610 0.357 10.414 1.00 0.00 C ATOM 614 C GLY A 42 -6.976 1.710 10.164 1.00 0.00 C ATOM 615 O GLY A 42 -6.323 1.923 9.142 1.00 0.00 O ATOM 0 H GLY A 42 -6.764 -0.426 8.664 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.639 0.500 10.744 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.081 -0.141 11.227 1.00 0.00 H new ATOM 619 N ALA A 43 -7.163 2.621 11.116 1.00 0.00 N ATOM 620 CA ALA A 43 -6.596 3.963 11.021 1.00 0.00 C ATOM 621 C ALA A 43 -5.172 3.992 11.580 1.00 0.00 C ATOM 622 O ALA A 43 -4.397 4.901 11.275 1.00 0.00 O ATOM 623 CB ALA A 43 -7.476 4.963 11.759 1.00 0.00 C ATOM 0 H ALA A 43 -7.704 2.453 11.964 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.555 4.243 9.968 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.041 5.959 11.679 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.472 4.966 11.317 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.546 4.680 12.809 1.00 0.00 H new ATOM 629 N GLU A 44 -4.833 2.987 12.394 1.00 0.00 N ATOM 630 CA GLU A 44 -3.503 2.892 12.993 1.00 0.00 C ATOM 631 C GLU A 44 -2.563 2.101 12.089 1.00 0.00 C ATOM 632 O GLU A 44 -2.740 0.896 11.899 1.00 0.00 O ATOM 633 CB GLU A 44 -3.578 2.220 14.365 1.00 0.00 C ATOM 634 CG GLU A 44 -4.474 2.941 15.359 1.00 0.00 C ATOM 635 CD GLU A 44 -4.678 2.146 16.634 1.00 0.00 C ATOM 636 OE1 GLU A 44 -5.433 1.153 16.600 1.00 0.00 O ATOM 637 OE2 GLU A 44 -4.079 2.516 17.666 1.00 0.00 O ATOM 0 H GLU A 44 -5.464 2.228 12.652 1.00 0.00 H new ATOM 0 HA GLU A 44 -3.115 3.904 13.112 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -3.940 1.200 14.239 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -2.573 2.152 14.780 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -4.036 3.909 15.603 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -5.442 3.136 14.897 1.00 0.00 H new ATOM 644 N TYR A 45 -1.570 2.785 11.526 1.00 0.00 N ATOM 645 CA TYR A 45 -0.609 2.140 10.634 1.00 0.00 C ATOM 646 C TYR A 45 0.264 1.129 11.377 1.00 0.00 C ATOM 647 O TYR A 45 0.806 0.209 10.762 1.00 0.00 O ATOM 648 CB TYR A 45 0.270 3.184 9.950 1.00 0.00 C ATOM 649 CG TYR A 45 1.060 2.636 8.784 1.00 0.00 C ATOM 650 CD1 TYR A 45 0.460 2.432 7.548 1.00 0.00 C ATOM 651 CD2 TYR A 45 2.407 2.332 8.917 1.00 0.00 C ATOM 652 CE1 TYR A 45 1.182 1.940 6.477 1.00 0.00 C ATOM 653 CE2 TYR A 45 3.137 1.843 7.852 1.00 0.00 C ATOM 654 CZ TYR A 45 2.520 1.648 6.632 1.00 0.00 C ATOM 655 OH TYR A 45 3.243 1.164 5.562 1.00 0.00 O ATOM 0 H TYR A 45 -1.410 3.782 11.671 1.00 0.00 H new ATOM 0 HA TYR A 45 -1.179 1.600 9.878 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -0.358 4.003 9.600 1.00 0.00 H new ATOM 0 HB3 TYR A 45 0.961 3.602 10.682 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -0.588 2.662 7.422 1.00 0.00 H new ATOM 0 HD2 TYR A 45 2.893 2.480 9.870 1.00 0.00 H new ATOM 0 HE1 TYR A 45 0.700 1.785 5.523 1.00 0.00 H new ATOM 0 HE2 TYR A 45 4.186 1.614 7.972 1.00 0.00 H new ATOM 0 HH TYR A 45 2.965 0.244 5.369 1.00 0.00 H new ATOM 665 N GLN A 46 0.396 1.295 12.697 1.00 0.00 N ATOM 666 CA GLN A 46 1.201 0.382 13.510 1.00 0.00 C ATOM 667 C GLN A 46 0.846 -1.074 13.204 1.00 0.00 C ATOM 668 O GLN A 46 1.715 -1.949 13.214 1.00 0.00 O ATOM 669 CB GLN A 46 0.994 0.670 15.000 1.00 0.00 C ATOM 670 CG GLN A 46 2.282 0.659 15.808 1.00 0.00 C ATOM 671 CD GLN A 46 2.034 0.478 17.293 1.00 0.00 C ATOM 672 OE1 GLN A 46 1.878 1.452 18.030 1.00 0.00 O ATOM 673 NE2 GLN A 46 1.995 -0.772 17.741 1.00 0.00 N ATOM 0 H GLN A 46 -0.043 2.051 13.222 1.00 0.00 H new ATOM 0 HA GLN A 46 2.250 0.542 13.261 1.00 0.00 H new ATOM 0 HB2 GLN A 46 0.514 1.643 15.110 1.00 0.00 H new ATOM 0 HB3 GLN A 46 0.310 -0.071 15.413 1.00 0.00 H new ATOM 0 HG2 GLN A 46 2.925 -0.145 15.450 1.00 0.00 H new ATOM 0 HG3 GLN A 46 2.818 1.594 15.644 1.00 0.00 H new ATOM 0 HE21 GLN A 46 2.129 -1.550 17.095 1.00 0.00 H new ATOM 0 HE22 GLN A 46 1.831 -0.954 18.731 1.00 0.00 H new ATOM 682 N HIS A 47 -0.434 -1.320 12.921 1.00 0.00 N ATOM 683 CA HIS A 47 -0.912 -2.661 12.600 1.00 0.00 C ATOM 684 C HIS A 47 -0.248 -3.191 11.330 1.00 0.00 C ATOM 685 O HIS A 47 0.084 -4.374 11.248 1.00 0.00 O ATOM 686 CB HIS A 47 -2.432 -2.649 12.423 1.00 0.00 C ATOM 687 CG HIS A 47 -3.195 -3.043 13.652 1.00 0.00 C ATOM 688 ND1 HIS A 47 -2.621 -3.155 14.903 1.00 0.00 N ATOM 689 CD2 HIS A 47 -4.504 -3.346 13.815 1.00 0.00 C ATOM 690 CE1 HIS A 47 -3.544 -3.511 15.778 1.00 0.00 C ATOM 691 NE2 HIS A 47 -4.695 -3.633 15.144 1.00 0.00 N ATOM 0 H HIS A 47 -1.159 -0.603 12.908 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.649 -3.321 13.427 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.744 -1.649 12.120 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.698 -3.326 11.611 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -5.259 -3.360 13.043 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.384 -3.675 16.833 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -5.582 -3.898 15.572 1.00 0.00 H new ATOM 700 N PHE A 48 -0.054 -2.316 10.340 1.00 0.00 N ATOM 701 CA PHE A 48 0.572 -2.719 9.087 1.00 0.00 C ATOM 702 C PHE A 48 2.060 -2.999 9.286 1.00 0.00 C ATOM 703 O PHE A 48 2.602 -3.945 8.712 1.00 0.00 O ATOM 704 CB PHE A 48 0.375 -1.647 8.015 1.00 0.00 C ATOM 705 CG PHE A 48 0.808 -2.099 6.651 1.00 0.00 C ATOM 706 CD1 PHE A 48 0.076 -3.051 5.961 1.00 0.00 C ATOM 707 CD2 PHE A 48 1.950 -1.582 6.064 1.00 0.00 C ATOM 708 CE1 PHE A 48 0.475 -3.479 4.710 1.00 0.00 C ATOM 709 CE2 PHE A 48 2.356 -2.005 4.814 1.00 0.00 C ATOM 710 CZ PHE A 48 1.617 -2.955 4.136 1.00 0.00 C ATOM 0 H PHE A 48 -0.320 -1.332 10.385 1.00 0.00 H new ATOM 0 HA PHE A 48 0.091 -3.638 8.753 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.677 -1.363 7.981 1.00 0.00 H new ATOM 0 HB3 PHE A 48 0.937 -0.755 8.292 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -0.817 -3.463 6.406 1.00 0.00 H new ATOM 0 HD2 PHE A 48 2.531 -0.839 6.590 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -0.104 -4.222 4.182 1.00 0.00 H new ATOM 0 HE2 PHE A 48 3.249 -1.594 4.367 1.00 0.00 H new ATOM 0 HZ PHE A 48 1.932 -3.288 3.158 1.00 0.00 H new ATOM 720 N ILE A 49 2.712 -2.180 10.112 1.00 0.00 N ATOM 721 CA ILE A 49 4.137 -2.344 10.397 1.00 0.00 C ATOM 722 C ILE A 49 4.402 -3.682 11.086 1.00 0.00 C ATOM 723 O ILE A 49 5.390 -4.359 10.792 1.00 0.00 O ATOM 724 CB ILE A 49 4.670 -1.206 11.299 1.00 0.00 C ATOM 725 CG1 ILE A 49 4.336 0.162 10.698 1.00 0.00 C ATOM 726 CG2 ILE A 49 6.173 -1.345 11.502 1.00 0.00 C ATOM 727 CD1 ILE A 49 4.230 1.264 11.730 1.00 0.00 C ATOM 0 H ILE A 49 2.275 -1.396 10.596 1.00 0.00 H new ATOM 0 HA ILE A 49 4.658 -2.312 9.440 1.00 0.00 H new ATOM 0 HB ILE A 49 4.181 -1.283 12.270 1.00 0.00 H new ATOM 0 HG12 ILE A 49 5.103 0.428 9.971 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.394 0.091 10.155 1.00 0.00 H new ATOM 0 HG21 ILE A 49 6.530 -0.536 12.139 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.389 -2.302 11.976 1.00 0.00 H new ATOM 0 HG23 ILE A 49 6.677 -1.296 10.537 1.00 0.00 H new ATOM 0 HD11 ILE A 49 3.991 2.205 11.234 1.00 0.00 H new ATOM 0 HD12 ILE A 49 3.443 1.020 12.443 1.00 0.00 H new ATOM 0 HD13 ILE A 49 5.179 1.362 12.257 1.00 0.00 H new ATOM 739 N GLN A 50 3.510 -4.050 12.006 1.00 0.00 N ATOM 740 CA GLN A 50 3.630 -5.302 12.752 1.00 0.00 C ATOM 741 C GLN A 50 3.508 -6.515 11.828 1.00 0.00 C ATOM 742 O GLN A 50 4.298 -7.456 11.922 1.00 0.00 O ATOM 743 CB GLN A 50 2.559 -5.363 13.845 1.00 0.00 C ATOM 744 CG GLN A 50 3.028 -6.028 15.128 1.00 0.00 C ATOM 745 CD GLN A 50 2.754 -5.179 16.356 1.00 0.00 C ATOM 746 OE1 GLN A 50 3.629 -4.457 16.831 1.00 0.00 O ATOM 747 NE2 GLN A 50 1.534 -5.261 16.877 1.00 0.00 N ATOM 0 H GLN A 50 2.691 -3.494 12.253 1.00 0.00 H new ATOM 0 HA GLN A 50 4.618 -5.329 13.212 1.00 0.00 H new ATOM 0 HB2 GLN A 50 2.227 -4.350 14.072 1.00 0.00 H new ATOM 0 HB3 GLN A 50 1.693 -5.903 13.462 1.00 0.00 H new ATOM 0 HG2 GLN A 50 2.530 -6.991 15.237 1.00 0.00 H new ATOM 0 HG3 GLN A 50 4.097 -6.228 15.060 1.00 0.00 H new ATOM 0 HE21 GLN A 50 0.838 -5.873 16.451 1.00 0.00 H new ATOM 0 HE22 GLN A 50 1.294 -4.712 17.703 1.00 0.00 H new ATOM 756 N GLN A 51 2.513 -6.489 10.940 1.00 0.00 N ATOM 757 CA GLN A 51 2.290 -7.591 10.003 1.00 0.00 C ATOM 758 C GLN A 51 3.379 -7.641 8.927 1.00 0.00 C ATOM 759 O GLN A 51 3.722 -8.719 8.436 1.00 0.00 O ATOM 760 CB GLN A 51 0.914 -7.456 9.342 1.00 0.00 C ATOM 761 CG GLN A 51 -0.179 -8.246 10.046 1.00 0.00 C ATOM 762 CD GLN A 51 -0.849 -7.458 11.156 1.00 0.00 C ATOM 763 OE1 GLN A 51 -1.944 -6.926 10.982 1.00 0.00 O ATOM 764 NE2 GLN A 51 -0.191 -7.377 12.308 1.00 0.00 N ATOM 0 H GLN A 51 1.850 -5.719 10.850 1.00 0.00 H new ATOM 0 HA GLN A 51 2.330 -8.521 10.571 1.00 0.00 H new ATOM 0 HB2 GLN A 51 0.633 -6.403 9.319 1.00 0.00 H new ATOM 0 HB3 GLN A 51 0.983 -7.790 8.307 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -0.930 -8.549 9.316 1.00 0.00 H new ATOM 0 HG3 GLN A 51 0.248 -9.159 10.461 1.00 0.00 H new ATOM 0 HE21 GLN A 51 0.715 -7.833 12.411 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -0.593 -6.859 13.089 1.00 0.00 H new ATOM 773 N CYS A 52 3.912 -6.473 8.563 1.00 0.00 N ATOM 774 CA CYS A 52 4.954 -6.383 7.544 1.00 0.00 C ATOM 775 C CYS A 52 6.298 -6.875 8.083 1.00 0.00 C ATOM 776 O CYS A 52 7.132 -6.083 8.526 1.00 0.00 O ATOM 777 CB CYS A 52 5.087 -4.944 7.043 1.00 0.00 C ATOM 778 SG CYS A 52 4.029 -4.558 5.631 1.00 0.00 S ATOM 0 H CYS A 52 3.637 -5.575 8.961 1.00 0.00 H new ATOM 0 HA CYS A 52 4.664 -7.025 6.712 1.00 0.00 H new ATOM 0 HB2 CYS A 52 4.849 -4.262 7.860 1.00 0.00 H new ATOM 0 HB3 CYS A 52 6.125 -4.761 6.767 1.00 0.00 H new ATOM 0 HG CYS A 52 3.404 -3.439 5.850 1.00 0.00 H new ATOM 784 N THR A 53 6.497 -8.189 8.038 1.00 0.00 N ATOM 785 CA THR A 53 7.736 -8.800 8.514 1.00 0.00 C ATOM 786 C THR A 53 8.668 -9.132 7.349 1.00 0.00 C ATOM 787 O THR A 53 8.363 -8.838 6.192 1.00 0.00 O ATOM 788 CB THR A 53 7.432 -10.066 9.322 1.00 0.00 C ATOM 789 OG1 THR A 53 6.831 -11.056 8.503 1.00 0.00 O ATOM 790 CG2 THR A 53 6.519 -9.827 10.508 1.00 0.00 C ATOM 0 H THR A 53 5.814 -8.854 7.675 1.00 0.00 H new ATOM 0 HA THR A 53 8.239 -8.080 9.160 1.00 0.00 H new ATOM 0 HB THR A 53 8.399 -10.400 9.698 1.00 0.00 H new ATOM 0 HG1 THR A 53 6.647 -11.856 9.038 1.00 0.00 H new ATOM 0 HG21 THR A 53 6.349 -10.768 11.032 1.00 0.00 H new ATOM 0 HG22 THR A 53 6.984 -9.113 11.187 1.00 0.00 H new ATOM 0 HG23 THR A 53 5.566 -9.428 10.159 1.00 0.00 H new ATOM 798 N ASP A 54 9.806 -9.753 7.665 1.00 0.00 N ATOM 799 CA ASP A 54 10.791 -10.133 6.653 1.00 0.00 C ATOM 800 C ASP A 54 10.450 -11.483 6.001 1.00 0.00 C ATOM 801 O ASP A 54 11.310 -12.109 5.380 1.00 0.00 O ATOM 802 CB ASP A 54 12.182 -10.193 7.290 1.00 0.00 C ATOM 803 CG ASP A 54 13.281 -9.733 6.349 1.00 0.00 C ATOM 804 OD1 ASP A 54 13.228 -8.573 5.884 1.00 0.00 O ATOM 805 OD2 ASP A 54 14.201 -10.534 6.082 1.00 0.00 O ATOM 0 H ASP A 54 10.068 -10.004 8.618 1.00 0.00 H new ATOM 0 HA ASP A 54 10.776 -9.378 5.867 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.193 -9.572 8.186 1.00 0.00 H new ATOM 0 HB3 ASP A 54 12.387 -11.215 7.608 1.00 0.00 H new ATOM 810 N ASP A 55 9.197 -11.923 6.136 1.00 0.00 N ATOM 811 CA ASP A 55 8.756 -13.186 5.555 1.00 0.00 C ATOM 812 C ASP A 55 7.318 -13.067 5.066 1.00 0.00 C ATOM 813 O ASP A 55 6.382 -13.501 5.742 1.00 0.00 O ATOM 814 CB ASP A 55 8.874 -14.311 6.586 1.00 0.00 C ATOM 815 CG ASP A 55 8.369 -15.657 6.077 1.00 0.00 C ATOM 816 OD1 ASP A 55 8.107 -15.786 4.861 1.00 0.00 O ATOM 817 OD2 ASP A 55 8.236 -16.584 6.902 1.00 0.00 O ATOM 0 H ASP A 55 8.470 -11.419 6.645 1.00 0.00 H new ATOM 0 HA ASP A 55 9.395 -13.423 4.704 1.00 0.00 H new ATOM 0 HB2 ASP A 55 9.918 -14.412 6.884 1.00 0.00 H new ATOM 0 HB3 ASP A 55 8.313 -14.035 7.479 1.00 0.00 H new ATOM 822 N VAL A 56 7.148 -12.468 3.894 1.00 0.00 N ATOM 823 CA VAL A 56 5.814 -12.280 3.320 1.00 0.00 C ATOM 824 C VAL A 56 5.890 -11.666 1.922 1.00 0.00 C ATOM 825 O VAL A 56 6.976 -11.480 1.374 1.00 0.00 O ATOM 826 CB VAL A 56 4.918 -11.389 4.226 1.00 0.00 C ATOM 827 CG1 VAL A 56 3.975 -12.247 5.057 1.00 0.00 C ATOM 828 CG2 VAL A 56 5.758 -10.493 5.130 1.00 0.00 C ATOM 0 H VAL A 56 7.910 -12.104 3.322 1.00 0.00 H new ATOM 0 HA VAL A 56 5.364 -13.270 3.250 1.00 0.00 H new ATOM 0 HB VAL A 56 4.325 -10.747 3.576 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.357 -11.605 5.684 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.336 -12.832 4.395 1.00 0.00 H new ATOM 0 HG13 VAL A 56 4.556 -12.920 5.688 1.00 0.00 H new ATOM 0 HG21 VAL A 56 5.101 -9.883 5.750 1.00 0.00 H new ATOM 0 HG22 VAL A 56 6.390 -11.110 5.769 1.00 0.00 H new ATOM 0 HG23 VAL A 56 6.385 -9.844 4.518 1.00 0.00 H new ATOM 838 N ARG A 57 4.729 -11.361 1.347 1.00 0.00 N ATOM 839 CA ARG A 57 4.659 -10.769 0.012 1.00 0.00 C ATOM 840 C ARG A 57 3.230 -10.334 -0.311 1.00 0.00 C ATOM 841 O ARG A 57 2.510 -11.011 -1.048 1.00 0.00 O ATOM 842 CB ARG A 57 5.169 -11.757 -1.046 1.00 0.00 C ATOM 843 CG ARG A 57 4.448 -13.100 -1.041 1.00 0.00 C ATOM 844 CD ARG A 57 5.172 -14.124 -0.183 1.00 0.00 C ATOM 845 NE ARG A 57 4.253 -14.865 0.679 1.00 0.00 N ATOM 846 CZ ARG A 57 4.633 -15.556 1.757 1.00 0.00 C ATOM 847 NH1 ARG A 57 5.913 -15.599 2.116 1.00 0.00 N ATOM 848 NH2 ARG A 57 3.726 -16.202 2.481 1.00 0.00 N ATOM 0 H ARG A 57 3.821 -11.514 1.786 1.00 0.00 H new ATOM 0 HA ARG A 57 5.299 -9.887 -0.002 1.00 0.00 H new ATOM 0 HB2 ARG A 57 5.064 -11.304 -2.032 1.00 0.00 H new ATOM 0 HB3 ARG A 57 6.234 -11.927 -0.885 1.00 0.00 H new ATOM 0 HG2 ARG A 57 3.432 -12.966 -0.669 1.00 0.00 H new ATOM 0 HG3 ARG A 57 4.367 -13.473 -2.062 1.00 0.00 H new ATOM 0 HD2 ARG A 57 5.708 -14.822 -0.826 1.00 0.00 H new ATOM 0 HD3 ARG A 57 5.918 -13.620 0.431 1.00 0.00 H new ATOM 0 HE ARG A 57 3.261 -14.854 0.443 1.00 0.00 H new ATOM 0 HH11 ARG A 57 6.614 -15.102 1.567 1.00 0.00 H new ATOM 0 HH12 ARG A 57 6.194 -16.129 2.941 1.00 0.00 H new ATOM 0 HH21 ARG A 57 2.742 -16.170 2.213 1.00 0.00 H new ATOM 0 HH22 ARG A 57 4.013 -16.731 3.305 1.00 0.00 H new ATOM 862 N LEU A 58 2.820 -9.203 0.257 1.00 0.00 N ATOM 863 CA LEU A 58 1.475 -8.681 0.039 1.00 0.00 C ATOM 864 C LEU A 58 1.502 -7.195 -0.306 1.00 0.00 C ATOM 865 O LEU A 58 2.541 -6.542 -0.211 1.00 0.00 O ATOM 866 CB LEU A 58 0.608 -8.918 1.280 1.00 0.00 C ATOM 867 CG LEU A 58 1.170 -8.355 2.589 1.00 0.00 C ATOM 868 CD1 LEU A 58 0.695 -6.926 2.803 1.00 0.00 C ATOM 869 CD2 LEU A 58 0.764 -9.234 3.763 1.00 0.00 C ATOM 0 H LEU A 58 3.400 -8.631 0.871 1.00 0.00 H new ATOM 0 HA LEU A 58 1.043 -9.214 -0.808 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.374 -8.478 1.106 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.459 -9.991 1.400 1.00 0.00 H new ATOM 0 HG LEU A 58 2.258 -8.348 2.523 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.104 -6.543 3.738 1.00 0.00 H new ATOM 0 HD12 LEU A 58 1.034 -6.302 1.976 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.394 -6.908 2.849 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.171 -8.820 4.685 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.323 -9.271 3.831 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.153 -10.241 3.615 1.00 0.00 H new ATOM 881 N PHE A 59 0.347 -6.669 -0.705 1.00 0.00 N ATOM 882 CA PHE A 59 0.224 -5.260 -1.067 1.00 0.00 C ATOM 883 C PHE A 59 -0.517 -4.479 0.016 1.00 0.00 C ATOM 884 O PHE A 59 -1.006 -5.058 0.989 1.00 0.00 O ATOM 885 CB PHE A 59 -0.507 -5.121 -2.405 1.00 0.00 C ATOM 886 CG PHE A 59 0.060 -5.989 -3.493 1.00 0.00 C ATOM 887 CD1 PHE A 59 1.135 -5.558 -4.254 1.00 0.00 C ATOM 888 CD2 PHE A 59 -0.480 -7.240 -3.749 1.00 0.00 C ATOM 889 CE1 PHE A 59 1.660 -6.357 -5.251 1.00 0.00 C ATOM 890 CE2 PHE A 59 0.042 -8.044 -4.746 1.00 0.00 C ATOM 891 CZ PHE A 59 1.113 -7.601 -5.498 1.00 0.00 C ATOM 0 H PHE A 59 -0.520 -7.200 -0.786 1.00 0.00 H new ATOM 0 HA PHE A 59 1.228 -4.845 -1.162 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -1.558 -5.371 -2.263 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -0.468 -4.080 -2.725 1.00 0.00 H new ATOM 0 HD1 PHE A 59 1.567 -4.586 -4.065 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -1.317 -7.590 -3.164 1.00 0.00 H new ATOM 0 HE1 PHE A 59 2.498 -6.009 -5.837 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -0.387 -9.017 -4.936 1.00 0.00 H new ATOM 0 HZ PHE A 59 1.522 -8.226 -6.278 1.00 0.00 H new ATOM 901 N ALA A 60 -0.594 -3.161 -0.161 1.00 0.00 N ATOM 902 CA ALA A 60 -1.272 -2.296 0.798 1.00 0.00 C ATOM 903 C ALA A 60 -1.837 -1.052 0.118 1.00 0.00 C ATOM 904 O ALA A 60 -1.375 -0.657 -0.955 1.00 0.00 O ATOM 905 CB ALA A 60 -0.317 -1.899 1.915 1.00 0.00 C ATOM 0 H ALA A 60 -0.194 -2.670 -0.961 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.106 -2.854 1.224 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -0.835 -1.253 2.624 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.034 -2.794 2.429 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.534 -1.365 1.493 1.00 0.00 H new ATOM 911 N PHE A 61 -2.835 -0.439 0.751 1.00 0.00 N ATOM 912 CA PHE A 61 -3.466 0.764 0.214 1.00 0.00 C ATOM 913 C PHE A 61 -3.660 1.809 1.309 1.00 0.00 C ATOM 914 O PHE A 61 -4.332 1.552 2.308 1.00 0.00 O ATOM 915 CB PHE A 61 -4.815 0.419 -0.425 1.00 0.00 C ATOM 916 CG PHE A 61 -5.042 1.091 -1.750 1.00 0.00 C ATOM 917 CD1 PHE A 61 -5.595 2.360 -1.814 1.00 0.00 C ATOM 918 CD2 PHE A 61 -4.702 0.453 -2.931 1.00 0.00 C ATOM 919 CE1 PHE A 61 -5.805 2.979 -3.032 1.00 0.00 C ATOM 920 CE2 PHE A 61 -4.908 1.066 -4.151 1.00 0.00 C ATOM 921 CZ PHE A 61 -5.461 2.331 -4.202 1.00 0.00 C ATOM 0 H PHE A 61 -3.225 -0.757 1.638 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.808 1.180 -0.549 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.879 -0.661 -0.559 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.615 0.703 0.259 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -5.865 2.871 -0.902 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -4.270 -0.536 -2.897 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -6.237 3.968 -3.069 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -4.637 0.557 -5.064 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.624 2.812 -5.155 1.00 0.00 H new ATOM 931 N VAL A 62 -3.068 2.987 1.113 1.00 0.00 N ATOM 932 CA VAL A 62 -3.178 4.071 2.085 1.00 0.00 C ATOM 933 C VAL A 62 -3.454 5.406 1.392 1.00 0.00 C ATOM 934 O VAL A 62 -2.728 5.804 0.480 1.00 0.00 O ATOM 935 CB VAL A 62 -1.897 4.205 2.939 1.00 0.00 C ATOM 936 CG1 VAL A 62 -2.126 5.165 4.098 1.00 0.00 C ATOM 937 CG2 VAL A 62 -1.437 2.845 3.450 1.00 0.00 C ATOM 0 H VAL A 62 -2.508 3.213 0.291 1.00 0.00 H new ATOM 0 HA VAL A 62 -4.013 3.820 2.739 1.00 0.00 H new ATOM 0 HB VAL A 62 -1.108 4.611 2.306 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -1.213 5.247 4.688 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -2.396 6.147 3.709 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -2.933 4.790 4.727 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.534 2.967 4.048 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -2.222 2.403 4.064 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -1.226 2.191 2.604 1.00 0.00 H new ATOM 947 N ARG A 63 -4.506 6.096 1.838 1.00 0.00 N ATOM 948 CA ARG A 63 -4.872 7.392 1.268 1.00 0.00 C ATOM 949 C ARG A 63 -4.115 8.518 1.971 1.00 0.00 C ATOM 950 O ARG A 63 -4.260 8.714 3.180 1.00 0.00 O ATOM 951 CB ARG A 63 -6.386 7.621 1.369 1.00 0.00 C ATOM 952 CG ARG A 63 -6.922 7.591 2.796 1.00 0.00 C ATOM 953 CD ARG A 63 -7.424 8.957 3.239 1.00 0.00 C ATOM 954 NE ARG A 63 -8.531 9.436 2.409 1.00 0.00 N ATOM 955 CZ ARG A 63 -8.855 10.724 2.268 1.00 0.00 C ATOM 956 NH1 ARG A 63 -8.166 11.668 2.906 1.00 0.00 N ATOM 957 NH2 ARG A 63 -9.874 11.070 1.490 1.00 0.00 N ATOM 0 H ARG A 63 -5.117 5.779 2.590 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.595 7.392 0.214 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.628 8.584 0.921 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.899 6.858 0.783 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -7.733 6.866 2.865 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.136 7.255 3.473 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.748 8.903 4.278 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -6.604 9.674 3.197 1.00 0.00 H new ATOM 0 HE ARG A 63 -9.089 8.744 1.908 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -7.384 11.410 3.508 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -8.420 12.649 2.793 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -10.409 10.352 1.001 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -10.122 12.053 1.382 1.00 0.00 H new ATOM 971 N PHE A 64 -3.300 9.249 1.211 1.00 0.00 N ATOM 972 CA PHE A 64 -2.510 10.348 1.765 1.00 0.00 C ATOM 973 C PHE A 64 -3.071 11.706 1.357 1.00 0.00 C ATOM 974 O PHE A 64 -3.716 11.836 0.317 1.00 0.00 O ATOM 975 CB PHE A 64 -1.054 10.241 1.308 1.00 0.00 C ATOM 976 CG PHE A 64 -0.265 9.208 2.059 1.00 0.00 C ATOM 977 CD1 PHE A 64 -0.242 7.892 1.632 1.00 0.00 C ATOM 978 CD2 PHE A 64 0.454 9.556 3.191 1.00 0.00 C ATOM 979 CE1 PHE A 64 0.485 6.940 2.320 1.00 0.00 C ATOM 980 CE2 PHE A 64 1.182 8.609 3.884 1.00 0.00 C ATOM 981 CZ PHE A 64 1.197 7.298 3.448 1.00 0.00 C ATOM 0 H PHE A 64 -3.170 9.100 0.210 1.00 0.00 H new ATOM 0 HA PHE A 64 -2.560 10.269 2.851 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.032 10.001 0.245 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.572 11.212 1.426 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.798 7.606 0.752 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.445 10.580 3.535 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.497 5.916 1.976 1.00 0.00 H new ATOM 0 HE2 PHE A 64 1.739 8.893 4.765 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.764 6.555 3.988 1.00 0.00 H new ATOM 991 N THR A 65 -2.803 12.717 2.182 1.00 0.00 N ATOM 992 CA THR A 65 -3.262 14.077 1.914 1.00 0.00 C ATOM 993 C THR A 65 -2.171 15.091 2.259 1.00 0.00 C ATOM 994 O THR A 65 -1.599 15.054 3.350 1.00 0.00 O ATOM 995 CB THR A 65 -4.547 14.381 2.697 1.00 0.00 C ATOM 996 OG1 THR A 65 -4.862 15.764 2.644 1.00 0.00 O ATOM 997 CG2 THR A 65 -4.483 13.976 4.158 1.00 0.00 C ATOM 0 H THR A 65 -2.268 12.618 3.045 1.00 0.00 H new ATOM 0 HA THR A 65 -3.483 14.158 0.850 1.00 0.00 H new ATOM 0 HB THR A 65 -5.318 13.784 2.210 1.00 0.00 H new ATOM 0 HG1 THR A 65 -4.773 16.085 1.722 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.426 14.222 4.645 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.306 12.903 4.231 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.671 14.512 4.649 1.00 0.00 H new ATOM 1005 N THR A 66 -1.888 15.992 1.318 1.00 0.00 N ATOM 1006 CA THR A 66 -0.865 17.017 1.513 1.00 0.00 C ATOM 1007 C THR A 66 -1.444 18.415 1.311 1.00 0.00 C ATOM 1008 O THR A 66 -1.682 18.844 0.180 1.00 0.00 O ATOM 1009 CB THR A 66 0.312 16.793 0.556 1.00 0.00 C ATOM 1010 OG1 THR A 66 -0.139 16.633 -0.778 1.00 0.00 O ATOM 1011 CG2 THR A 66 1.147 15.581 0.906 1.00 0.00 C ATOM 0 H THR A 66 -2.354 16.032 0.412 1.00 0.00 H new ATOM 0 HA THR A 66 -0.505 16.938 2.539 1.00 0.00 H new ATOM 0 HB THR A 66 0.932 17.684 0.656 1.00 0.00 H new ATOM 0 HG1 THR A 66 -0.803 17.324 -0.984 1.00 0.00 H new ATOM 0 HG21 THR A 66 1.962 15.481 0.189 1.00 0.00 H new ATOM 0 HG22 THR A 66 1.558 15.700 1.909 1.00 0.00 H new ATOM 0 HG23 THR A 66 0.523 14.688 0.873 1.00 0.00 H new ATOM 1019 N GLY A 67 -1.665 19.121 2.419 1.00 0.00 N ATOM 1020 CA GLY A 67 -2.210 20.467 2.355 1.00 0.00 C ATOM 1021 C GLY A 67 -1.947 21.263 3.620 1.00 0.00 C ATOM 1022 O GLY A 67 -1.534 20.700 4.637 1.00 0.00 O ATOM 0 H GLY A 67 -1.475 18.783 3.362 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.776 20.991 1.503 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -3.285 20.412 2.181 1.00 0.00 H new ATOM 1026 N ASP A 68 -2.187 22.572 3.562 1.00 0.00 N ATOM 1027 CA ASP A 68 -1.976 23.441 4.718 1.00 0.00 C ATOM 1028 C ASP A 68 -2.881 24.669 4.657 1.00 0.00 C ATOM 1029 O ASP A 68 -2.444 25.760 4.286 1.00 0.00 O ATOM 1030 CB ASP A 68 -0.508 23.873 4.801 1.00 0.00 C ATOM 1031 CG ASP A 68 -0.042 24.068 6.230 1.00 0.00 C ATOM 1032 OD1 ASP A 68 -0.592 24.952 6.920 1.00 0.00 O ATOM 1033 OD2 ASP A 68 0.873 23.336 6.662 1.00 0.00 O ATOM 0 H ASP A 68 -2.527 23.053 2.729 1.00 0.00 H new ATOM 0 HA ASP A 68 -2.231 22.874 5.614 1.00 0.00 H new ATOM 0 HB2 ASP A 68 0.117 23.122 4.318 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -0.374 24.803 4.248 1.00 0.00 H new ATOM 1038 N ALA A 69 -4.146 24.477 5.041 1.00 0.00 N ATOM 1039 CA ALA A 69 -5.142 25.551 5.053 1.00 0.00 C ATOM 1040 C ALA A 69 -4.994 26.504 3.867 1.00 0.00 C ATOM 1041 O ALA A 69 -5.059 27.728 4.018 1.00 0.00 O ATOM 1042 CB ALA A 69 -5.054 26.318 6.355 1.00 0.00 C ATOM 0 H ALA A 69 -4.507 23.575 5.351 1.00 0.00 H new ATOM 0 HA ALA A 69 -6.123 25.085 4.964 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -5.797 27.116 6.358 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -5.243 25.642 7.189 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -4.058 26.749 6.457 1.00 0.00 H new ATOM 1048 N MET A 70 -4.797 25.930 2.693 1.00 0.00 N ATOM 1049 CA MET A 70 -4.641 26.706 1.467 1.00 0.00 C ATOM 1050 C MET A 70 -4.788 25.826 0.224 1.00 0.00 C ATOM 1051 O MET A 70 -5.354 26.255 -0.784 1.00 0.00 O ATOM 1052 CB MET A 70 -3.281 27.411 1.453 1.00 0.00 C ATOM 1053 CG MET A 70 -2.103 26.472 1.249 1.00 0.00 C ATOM 1054 SD MET A 70 -0.515 27.325 1.300 1.00 0.00 S ATOM 1055 CE MET A 70 0.164 26.872 -0.293 1.00 0.00 C ATOM 0 H MET A 70 -4.740 24.920 2.559 1.00 0.00 H new ATOM 0 HA MET A 70 -5.433 27.454 1.445 1.00 0.00 H new ATOM 0 HB2 MET A 70 -3.279 28.159 0.660 1.00 0.00 H new ATOM 0 HB3 MET A 70 -3.149 27.944 2.395 1.00 0.00 H new ATOM 0 HG2 MET A 70 -2.121 25.701 2.019 1.00 0.00 H new ATOM 0 HG3 MET A 70 -2.209 25.967 0.289 1.00 0.00 H new ATOM 0 HE1 MET A 70 1.148 27.325 -0.411 1.00 0.00 H new ATOM 0 HE2 MET A 70 0.254 25.787 -0.355 1.00 0.00 H new ATOM 0 HE3 MET A 70 -0.496 27.227 -1.084 1.00 0.00 H new ATOM 1065 N SER A 71 -4.276 24.595 0.302 1.00 0.00 N ATOM 1066 CA SER A 71 -4.348 23.659 -0.815 1.00 0.00 C ATOM 1067 C SER A 71 -4.344 22.216 -0.316 1.00 0.00 C ATOM 1068 O SER A 71 -3.289 21.587 -0.210 1.00 0.00 O ATOM 1069 CB SER A 71 -3.177 23.883 -1.777 1.00 0.00 C ATOM 1070 OG SER A 71 -1.956 24.036 -1.074 1.00 0.00 O ATOM 0 H SER A 71 -3.807 24.226 1.129 1.00 0.00 H new ATOM 0 HA SER A 71 -5.282 23.839 -1.347 1.00 0.00 H new ATOM 0 HB2 SER A 71 -3.101 23.040 -2.463 1.00 0.00 H new ATOM 0 HB3 SER A 71 -3.365 24.770 -2.382 1.00 0.00 H new ATOM 0 HG SER A 71 -1.830 23.277 -0.468 1.00 0.00 H new ATOM 1076 N LYS A 72 -5.530 21.696 -0.012 1.00 0.00 N ATOM 1077 CA LYS A 72 -5.666 20.327 0.472 1.00 0.00 C ATOM 1078 C LYS A 72 -5.718 19.348 -0.696 1.00 0.00 C ATOM 1079 O LYS A 72 -6.656 19.373 -1.495 1.00 0.00 O ATOM 1080 CB LYS A 72 -6.923 20.186 1.332 1.00 0.00 C ATOM 1081 CG LYS A 72 -6.756 20.722 2.744 1.00 0.00 C ATOM 1082 CD LYS A 72 -8.100 21.049 3.376 1.00 0.00 C ATOM 1083 CE LYS A 72 -8.481 22.505 3.160 1.00 0.00 C ATOM 1084 NZ LYS A 72 -9.399 23.005 4.223 1.00 0.00 N ATOM 0 H LYS A 72 -6.411 22.203 -0.093 1.00 0.00 H new ATOM 0 HA LYS A 72 -4.795 20.093 1.084 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.746 20.712 0.847 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -7.203 19.134 1.382 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -6.234 19.985 3.355 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -6.134 21.617 2.724 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -8.869 20.404 2.951 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -8.061 20.837 4.445 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -7.579 23.117 3.142 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -8.960 22.614 2.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -9.634 24.001 4.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -10.271 22.438 4.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -8.933 22.925 5.150 1.00 0.00 H new ATOM 1098 N ARG A 73 -4.702 18.492 -0.792 1.00 0.00 N ATOM 1099 CA ARG A 73 -4.629 17.508 -1.867 1.00 0.00 C ATOM 1100 C ARG A 73 -4.671 16.086 -1.317 1.00 0.00 C ATOM 1101 O ARG A 73 -4.450 15.866 -0.126 1.00 0.00 O ATOM 1102 CB ARG A 73 -3.354 17.712 -2.687 1.00 0.00 C ATOM 1103 CG ARG A 73 -3.612 17.898 -4.173 1.00 0.00 C ATOM 1104 CD ARG A 73 -2.418 17.460 -5.007 1.00 0.00 C ATOM 1105 NE ARG A 73 -2.109 18.417 -6.068 1.00 0.00 N ATOM 1106 CZ ARG A 73 -2.770 18.493 -7.226 1.00 0.00 C ATOM 1107 NH1 ARG A 73 -3.800 17.686 -7.470 1.00 0.00 N ATOM 1108 NH2 ARG A 73 -2.407 19.386 -8.140 1.00 0.00 N ATOM 0 H ARG A 73 -3.920 18.461 -0.138 1.00 0.00 H new ATOM 0 HA ARG A 73 -5.497 17.651 -2.511 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -2.823 18.584 -2.307 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -2.699 16.853 -2.545 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -4.491 17.324 -4.465 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -3.834 18.946 -4.376 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -1.548 17.342 -4.361 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -2.622 16.484 -5.447 1.00 0.00 H new ATOM 0 HE ARG A 73 -1.339 19.068 -5.914 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -4.090 17.003 -6.770 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -4.299 17.751 -8.357 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -1.624 20.013 -7.957 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -2.912 19.444 -9.025 1.00 0.00 H new ATOM 1122 N SER A 74 -4.954 15.127 -2.198 1.00 0.00 N ATOM 1123 CA SER A 74 -5.025 13.722 -1.809 1.00 0.00 C ATOM 1124 C SER A 74 -4.381 12.830 -2.870 1.00 0.00 C ATOM 1125 O SER A 74 -4.473 13.108 -4.067 1.00 0.00 O ATOM 1126 CB SER A 74 -6.480 13.305 -1.585 1.00 0.00 C ATOM 1127 OG SER A 74 -6.558 12.022 -0.984 1.00 0.00 O ATOM 0 H SER A 74 -5.138 15.299 -3.186 1.00 0.00 H new ATOM 0 HA SER A 74 -4.474 13.600 -0.876 1.00 0.00 H new ATOM 0 HB2 SER A 74 -6.978 14.038 -0.950 1.00 0.00 H new ATOM 0 HB3 SER A 74 -7.010 13.296 -2.538 1.00 0.00 H new ATOM 0 HG SER A 74 -5.714 11.822 -0.528 1.00 0.00 H new ATOM 1133 N LYS A 75 -3.731 11.757 -2.422 1.00 0.00 N ATOM 1134 CA LYS A 75 -3.070 10.820 -3.328 1.00 0.00 C ATOM 1135 C LYS A 75 -3.206 9.383 -2.828 1.00 0.00 C ATOM 1136 O LYS A 75 -3.289 9.140 -1.622 1.00 0.00 O ATOM 1137 CB LYS A 75 -1.585 11.170 -3.473 1.00 0.00 C ATOM 1138 CG LYS A 75 -1.324 12.438 -4.274 1.00 0.00 C ATOM 1139 CD LYS A 75 -0.932 13.601 -3.373 1.00 0.00 C ATOM 1140 CE LYS A 75 0.465 13.422 -2.795 1.00 0.00 C ATOM 1141 NZ LYS A 75 1.521 13.487 -3.846 1.00 0.00 N ATOM 0 H LYS A 75 -3.648 11.515 -1.435 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.557 10.901 -4.300 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.150 11.284 -2.480 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.071 10.337 -3.953 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -0.530 12.254 -4.998 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.217 12.701 -4.841 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -0.974 14.531 -3.940 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -1.653 13.690 -2.560 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.649 14.195 -2.049 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.524 12.462 -2.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 2.452 13.599 -3.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.509 12.610 -4.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.339 14.298 -4.471 1.00 0.00 H new ATOM 1155 N PHE A 76 -3.214 8.436 -3.764 1.00 0.00 N ATOM 1156 CA PHE A 76 -3.323 7.020 -3.425 1.00 0.00 C ATOM 1157 C PHE A 76 -1.973 6.337 -3.600 1.00 0.00 C ATOM 1158 O PHE A 76 -1.436 6.283 -4.709 1.00 0.00 O ATOM 1159 CB PHE A 76 -4.373 6.325 -4.299 1.00 0.00 C ATOM 1160 CG PHE A 76 -5.659 7.091 -4.437 1.00 0.00 C ATOM 1161 CD1 PHE A 76 -5.773 8.116 -5.362 1.00 0.00 C ATOM 1162 CD2 PHE A 76 -6.753 6.784 -3.644 1.00 0.00 C ATOM 1163 CE1 PHE A 76 -6.953 8.822 -5.493 1.00 0.00 C ATOM 1164 CE2 PHE A 76 -7.935 7.485 -3.770 1.00 0.00 C ATOM 1165 CZ PHE A 76 -8.036 8.506 -4.697 1.00 0.00 C ATOM 0 H PHE A 76 -3.146 8.625 -4.764 1.00 0.00 H new ATOM 0 HA PHE A 76 -3.636 6.943 -2.384 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -3.953 6.159 -5.291 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.590 5.344 -3.877 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -4.929 8.366 -5.988 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -6.680 5.987 -2.919 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -7.028 9.620 -6.217 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.780 7.236 -3.145 1.00 0.00 H new ATOM 0 HZ PHE A 76 -8.960 9.055 -4.798 1.00 0.00 H new ATOM 1175 N ALA A 77 -1.420 5.824 -2.503 1.00 0.00 N ATOM 1176 CA ALA A 77 -0.126 5.155 -2.544 1.00 0.00 C ATOM 1177 C ALA A 77 -0.259 3.666 -2.244 1.00 0.00 C ATOM 1178 O ALA A 77 -0.777 3.277 -1.196 1.00 0.00 O ATOM 1179 CB ALA A 77 0.840 5.810 -1.566 1.00 0.00 C ATOM 0 H ALA A 77 -1.848 5.860 -1.578 1.00 0.00 H new ATOM 0 HA ALA A 77 0.271 5.257 -3.554 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.802 5.299 -1.608 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.973 6.858 -1.833 1.00 0.00 H new ATOM 0 HB3 ALA A 77 0.437 5.742 -0.556 1.00 0.00 H new ATOM 1185 N LEU A 78 0.219 2.838 -3.172 1.00 0.00 N ATOM 1186 CA LEU A 78 0.166 1.388 -3.008 1.00 0.00 C ATOM 1187 C LEU A 78 1.504 0.863 -2.499 1.00 0.00 C ATOM 1188 O LEU A 78 2.478 0.781 -3.253 1.00 0.00 O ATOM 1189 CB LEU A 78 -0.199 0.709 -4.331 1.00 0.00 C ATOM 1190 CG LEU A 78 -0.524 -0.784 -4.222 1.00 0.00 C ATOM 1191 CD1 LEU A 78 -2.026 -0.996 -4.100 1.00 0.00 C ATOM 1192 CD2 LEU A 78 0.027 -1.542 -5.422 1.00 0.00 C ATOM 0 H LEU A 78 0.647 3.148 -4.045 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.605 1.154 -2.274 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.059 1.223 -4.761 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.629 0.836 -5.028 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.047 -1.174 -3.323 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.238 -2.062 -4.024 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.394 -0.488 -3.208 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.524 -0.589 -4.980 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.214 -2.601 -5.326 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.419 -1.150 -6.336 1.00 0.00 H new ATOM 0 HD23 LEU A 78 1.109 -1.419 -5.464 1.00 0.00 H new ATOM 1204 N ILE A 79 1.547 0.516 -1.214 1.00 0.00 N ATOM 1205 CA ILE A 79 2.768 0.004 -0.599 1.00 0.00 C ATOM 1206 C ILE A 79 2.894 -1.503 -0.808 1.00 0.00 C ATOM 1207 O ILE A 79 2.271 -2.295 -0.098 1.00 0.00 O ATOM 1208 CB ILE A 79 2.816 0.321 0.914 1.00 0.00 C ATOM 1209 CG1 ILE A 79 2.577 1.816 1.161 1.00 0.00 C ATOM 1210 CG2 ILE A 79 4.151 -0.113 1.510 1.00 0.00 C ATOM 1211 CD1 ILE A 79 3.621 2.715 0.529 1.00 0.00 C ATOM 0 H ILE A 79 0.751 0.580 -0.580 1.00 0.00 H new ATOM 0 HA ILE A 79 3.605 0.504 -1.086 1.00 0.00 H new ATOM 0 HB ILE A 79 2.021 -0.239 1.406 1.00 0.00 H new ATOM 0 HG12 ILE A 79 1.595 2.086 0.773 1.00 0.00 H new ATOM 0 HG13 ILE A 79 2.556 1.998 2.235 1.00 0.00 H new ATOM 0 HG21 ILE A 79 4.166 0.118 2.575 1.00 0.00 H new ATOM 0 HG22 ILE A 79 4.280 -1.186 1.370 1.00 0.00 H new ATOM 0 HG23 ILE A 79 4.962 0.418 1.012 1.00 0.00 H new ATOM 0 HD11 ILE A 79 3.384 3.756 0.747 1.00 0.00 H new ATOM 0 HD12 ILE A 79 4.603 2.473 0.935 1.00 0.00 H new ATOM 0 HD13 ILE A 79 3.627 2.563 -0.550 1.00 0.00 H new ATOM 1223 N THR A 80 3.709 -1.889 -1.789 1.00 0.00 N ATOM 1224 CA THR A 80 3.931 -3.298 -2.096 1.00 0.00 C ATOM 1225 C THR A 80 5.021 -3.871 -1.195 1.00 0.00 C ATOM 1226 O THR A 80 6.198 -3.539 -1.344 1.00 0.00 O ATOM 1227 CB THR A 80 4.317 -3.469 -3.570 1.00 0.00 C ATOM 1228 OG1 THR A 80 3.308 -2.948 -4.418 1.00 0.00 O ATOM 1229 CG2 THR A 80 4.549 -4.911 -3.968 1.00 0.00 C ATOM 0 H THR A 80 4.227 -1.243 -2.385 1.00 0.00 H new ATOM 0 HA THR A 80 3.005 -3.843 -1.913 1.00 0.00 H new ATOM 0 HB THR A 80 5.253 -2.922 -3.686 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.574 -3.066 -5.354 1.00 0.00 H new ATOM 0 HG21 THR A 80 4.818 -4.958 -5.023 1.00 0.00 H new ATOM 0 HG22 THR A 80 5.358 -5.329 -3.368 1.00 0.00 H new ATOM 0 HG23 THR A 80 3.638 -5.486 -3.800 1.00 0.00 H new ATOM 1237 N TRP A 81 4.623 -4.723 -0.255 1.00 0.00 N ATOM 1238 CA TRP A 81 5.569 -5.330 0.673 1.00 0.00 C ATOM 1239 C TRP A 81 6.021 -6.704 0.189 1.00 0.00 C ATOM 1240 O TRP A 81 5.217 -7.500 -0.302 1.00 0.00 O ATOM 1241 CB TRP A 81 4.955 -5.448 2.070 1.00 0.00 C ATOM 1242 CG TRP A 81 5.910 -6.009 3.079 1.00 0.00 C ATOM 1243 CD1 TRP A 81 5.775 -7.173 3.779 1.00 0.00 C ATOM 1244 CD2 TRP A 81 7.156 -5.435 3.487 1.00 0.00 C ATOM 1245 NE1 TRP A 81 6.860 -7.353 4.602 1.00 0.00 N ATOM 1246 CE2 TRP A 81 7.721 -6.299 4.440 1.00 0.00 C ATOM 1247 CE3 TRP A 81 7.846 -4.270 3.139 1.00 0.00 C ATOM 1248 CZ2 TRP A 81 8.946 -6.037 5.050 1.00 0.00 C ATOM 1249 CZ3 TRP A 81 9.062 -4.012 3.744 1.00 0.00 C ATOM 1250 CH2 TRP A 81 9.600 -4.891 4.690 1.00 0.00 C ATOM 0 H TRP A 81 3.653 -5.008 -0.117 1.00 0.00 H new ATOM 0 HA TRP A 81 6.442 -4.680 0.721 1.00 0.00 H new ATOM 0 HB2 TRP A 81 4.622 -4.464 2.400 1.00 0.00 H new ATOM 0 HB3 TRP A 81 4.071 -6.084 2.021 1.00 0.00 H new ATOM 0 HD1 TRP A 81 4.939 -7.852 3.698 1.00 0.00 H new ATOM 0 HE1 TRP A 81 7.002 -8.143 5.232 1.00 0.00 H new ATOM 0 HE3 TRP A 81 7.437 -3.585 2.411 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 9.364 -6.714 5.780 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 9.606 -3.117 3.482 1.00 0.00 H new ATOM 0 HH2 TRP A 81 10.552 -4.660 5.146 1.00 0.00 H new ATOM 1261 N ILE A 82 7.314 -6.977 0.342 1.00 0.00 N ATOM 1262 CA ILE A 82 7.885 -8.251 -0.066 1.00 0.00 C ATOM 1263 C ILE A 82 8.935 -8.726 0.944 1.00 0.00 C ATOM 1264 O ILE A 82 10.129 -8.447 0.795 1.00 0.00 O ATOM 1265 CB ILE A 82 8.512 -8.162 -1.480 1.00 0.00 C ATOM 1266 CG1 ILE A 82 9.227 -9.470 -1.828 1.00 0.00 C ATOM 1267 CG2 ILE A 82 9.475 -6.981 -1.576 1.00 0.00 C ATOM 1268 CD1 ILE A 82 9.167 -9.830 -3.298 1.00 0.00 C ATOM 0 H ILE A 82 7.987 -6.327 0.748 1.00 0.00 H new ATOM 0 HA ILE A 82 7.073 -8.977 -0.097 1.00 0.00 H new ATOM 0 HB ILE A 82 7.710 -8.002 -2.200 1.00 0.00 H new ATOM 0 HG12 ILE A 82 10.271 -9.394 -1.525 1.00 0.00 H new ATOM 0 HG13 ILE A 82 8.785 -10.280 -1.247 1.00 0.00 H new ATOM 0 HG21 ILE A 82 9.902 -6.940 -2.578 1.00 0.00 H new ATOM 0 HG22 ILE A 82 8.937 -6.055 -1.373 1.00 0.00 H new ATOM 0 HG23 ILE A 82 10.275 -7.103 -0.846 1.00 0.00 H new ATOM 0 HD11 ILE A 82 9.696 -10.769 -3.465 1.00 0.00 H new ATOM 0 HD12 ILE A 82 8.126 -9.940 -3.603 1.00 0.00 H new ATOM 0 HD13 ILE A 82 9.636 -9.040 -3.885 1.00 0.00 H new ATOM 1280 N GLY A 83 8.481 -9.453 1.969 1.00 0.00 N ATOM 1281 CA GLY A 83 9.393 -9.969 2.982 1.00 0.00 C ATOM 1282 C GLY A 83 10.442 -10.876 2.371 1.00 0.00 C ATOM 1283 O GLY A 83 10.097 -11.847 1.695 1.00 0.00 O ATOM 0 H GLY A 83 7.500 -9.693 2.115 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.881 -9.138 3.492 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.829 -10.519 3.736 1.00 0.00 H new ATOM 1287 N GLU A 84 11.718 -10.537 2.590 1.00 0.00 N ATOM 1288 CA GLU A 84 12.852 -11.294 2.034 1.00 0.00 C ATOM 1289 C GLU A 84 12.640 -12.801 2.034 1.00 0.00 C ATOM 1290 O GLU A 84 13.028 -13.476 1.080 1.00 0.00 O ATOM 1291 CB GLU A 84 14.125 -10.994 2.806 1.00 0.00 C ATOM 1292 CG GLU A 84 14.915 -9.818 2.258 1.00 0.00 C ATOM 1293 CD GLU A 84 14.023 -8.719 1.707 1.00 0.00 C ATOM 1294 OE1 GLU A 84 13.421 -7.982 2.518 1.00 0.00 O ATOM 1295 OE2 GLU A 84 13.920 -8.605 0.466 1.00 0.00 O ATOM 0 H GLU A 84 11.996 -9.734 3.155 1.00 0.00 H new ATOM 0 HA GLU A 84 12.935 -10.968 0.997 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.869 -10.794 3.846 1.00 0.00 H new ATOM 0 HB3 GLU A 84 14.760 -11.880 2.799 1.00 0.00 H new ATOM 0 HG2 GLU A 84 15.544 -9.408 3.048 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.581 -10.169 1.470 1.00 0.00 H new ATOM 1302 N ASN A 85 12.046 -13.335 3.096 1.00 0.00 N ATOM 1303 CA ASN A 85 11.810 -14.775 3.196 1.00 0.00 C ATOM 1304 C ASN A 85 10.675 -15.222 2.279 1.00 0.00 C ATOM 1305 O ASN A 85 9.830 -16.035 2.658 1.00 0.00 O ATOM 1306 CB ASN A 85 11.513 -15.160 4.643 1.00 0.00 C ATOM 1307 CG ASN A 85 12.767 -15.177 5.486 1.00 0.00 C ATOM 1308 OD1 ASN A 85 13.244 -16.237 5.890 1.00 0.00 O ATOM 1309 ND2 ASN A 85 13.311 -13.996 5.758 1.00 0.00 N ATOM 0 H ASN A 85 11.719 -12.796 3.898 1.00 0.00 H new ATOM 0 HA ASN A 85 12.716 -15.287 2.871 1.00 0.00 H new ATOM 0 HB2 ASN A 85 10.799 -14.455 5.068 1.00 0.00 H new ATOM 0 HB3 ASN A 85 11.044 -16.144 4.669 1.00 0.00 H new ATOM 0 HD21 ASN A 85 14.159 -13.943 6.323 1.00 0.00 H new ATOM 0 HD22 ASN A 85 12.881 -13.142 5.402 1.00 0.00 H new ATOM 1316 N VAL A 86 10.676 -14.697 1.063 1.00 0.00 N ATOM 1317 CA VAL A 86 9.660 -15.042 0.073 1.00 0.00 C ATOM 1318 C VAL A 86 10.166 -16.138 -0.863 1.00 0.00 C ATOM 1319 O VAL A 86 11.304 -16.088 -1.331 1.00 0.00 O ATOM 1320 CB VAL A 86 9.230 -13.809 -0.756 1.00 0.00 C ATOM 1321 CG1 VAL A 86 10.417 -13.209 -1.493 1.00 0.00 C ATOM 1322 CG2 VAL A 86 8.121 -14.176 -1.732 1.00 0.00 C ATOM 0 H VAL A 86 11.371 -14.027 0.735 1.00 0.00 H new ATOM 0 HA VAL A 86 8.791 -15.409 0.619 1.00 0.00 H new ATOM 0 HB VAL A 86 8.845 -13.057 -0.067 1.00 0.00 H new ATOM 0 HG11 VAL A 86 10.088 -12.344 -2.068 1.00 0.00 H new ATOM 0 HG12 VAL A 86 11.174 -12.899 -0.772 1.00 0.00 H new ATOM 0 HG13 VAL A 86 10.841 -13.953 -2.167 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.834 -13.294 -2.305 1.00 0.00 H new ATOM 0 HG22 VAL A 86 8.476 -14.950 -2.412 1.00 0.00 H new ATOM 0 HG23 VAL A 86 7.258 -14.547 -1.179 1.00 0.00 H new ATOM 1332 N SER A 87 9.316 -17.128 -1.131 1.00 0.00 N ATOM 1333 CA SER A 87 9.685 -18.235 -2.011 1.00 0.00 C ATOM 1334 C SER A 87 9.769 -17.778 -3.467 1.00 0.00 C ATOM 1335 O SER A 87 9.173 -16.767 -3.846 1.00 0.00 O ATOM 1336 CB SER A 87 8.684 -19.388 -1.877 1.00 0.00 C ATOM 1337 OG SER A 87 9.015 -20.228 -0.783 1.00 0.00 O ATOM 0 H SER A 87 8.370 -17.186 -0.753 1.00 0.00 H new ATOM 0 HA SER A 87 10.670 -18.587 -1.706 1.00 0.00 H new ATOM 0 HB2 SER A 87 7.679 -18.987 -1.741 1.00 0.00 H new ATOM 0 HB3 SER A 87 8.672 -19.972 -2.797 1.00 0.00 H new ATOM 0 HG SER A 87 8.360 -20.954 -0.718 1.00 0.00 H new ATOM 1343 N GLY A 88 10.516 -18.534 -4.277 1.00 0.00 N ATOM 1344 CA GLY A 88 10.676 -18.200 -5.685 1.00 0.00 C ATOM 1345 C GLY A 88 9.352 -18.078 -6.420 1.00 0.00 C ATOM 1346 O GLY A 88 9.165 -17.155 -7.215 1.00 0.00 O ATOM 0 H GLY A 88 11.014 -19.373 -3.980 1.00 0.00 H new ATOM 0 HA2 GLY A 88 11.221 -17.260 -5.770 1.00 0.00 H new ATOM 0 HA3 GLY A 88 11.284 -18.965 -6.168 1.00 0.00 H new ATOM 1350 N LEU A 89 8.434 -19.006 -6.154 1.00 0.00 N ATOM 1351 CA LEU A 89 7.119 -18.995 -6.796 1.00 0.00 C ATOM 1352 C LEU A 89 6.376 -17.690 -6.504 1.00 0.00 C ATOM 1353 O LEU A 89 5.764 -17.102 -7.398 1.00 0.00 O ATOM 1354 CB LEU A 89 6.283 -20.189 -6.322 1.00 0.00 C ATOM 1355 CG LEU A 89 6.387 -21.443 -7.195 1.00 0.00 C ATOM 1356 CD1 LEU A 89 6.171 -22.696 -6.361 1.00 0.00 C ATOM 1357 CD2 LEU A 89 5.382 -21.384 -8.336 1.00 0.00 C ATOM 0 H LEU A 89 8.576 -19.775 -5.499 1.00 0.00 H new ATOM 0 HA LEU A 89 7.271 -19.071 -7.873 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.587 -20.446 -5.307 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.238 -19.884 -6.274 1.00 0.00 H new ATOM 0 HG LEU A 89 7.390 -21.482 -7.620 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.249 -23.576 -7.000 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.928 -22.747 -5.579 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.181 -22.664 -5.906 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.470 -22.283 -8.946 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.373 -21.319 -7.929 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.582 -20.507 -8.952 1.00 0.00 H new ATOM 1369 N GLN A 90 6.437 -17.242 -5.248 1.00 0.00 N ATOM 1370 CA GLN A 90 5.775 -16.006 -4.836 1.00 0.00 C ATOM 1371 C GLN A 90 6.420 -14.787 -5.496 1.00 0.00 C ATOM 1372 O GLN A 90 5.737 -13.809 -5.804 1.00 0.00 O ATOM 1373 CB GLN A 90 5.822 -15.859 -3.314 1.00 0.00 C ATOM 1374 CG GLN A 90 4.683 -16.566 -2.595 1.00 0.00 C ATOM 1375 CD GLN A 90 5.150 -17.786 -1.825 1.00 0.00 C ATOM 1376 OE1 GLN A 90 5.462 -17.703 -0.637 1.00 0.00 O ATOM 1377 NE2 GLN A 90 5.203 -18.930 -2.499 1.00 0.00 N ATOM 0 H GLN A 90 6.939 -17.719 -4.499 1.00 0.00 H new ATOM 0 HA GLN A 90 4.735 -16.061 -5.159 1.00 0.00 H new ATOM 0 HB2 GLN A 90 6.770 -16.253 -2.949 1.00 0.00 H new ATOM 0 HB3 GLN A 90 5.798 -14.799 -3.059 1.00 0.00 H new ATOM 0 HG2 GLN A 90 4.203 -15.869 -1.908 1.00 0.00 H new ATOM 0 HG3 GLN A 90 3.929 -16.866 -3.323 1.00 0.00 H new ATOM 0 HE21 GLN A 90 4.935 -18.955 -3.483 1.00 0.00 H new ATOM 0 HE22 GLN A 90 5.511 -19.783 -2.032 1.00 0.00 H new ATOM 1386 N ARG A 91 7.738 -14.852 -5.708 1.00 0.00 N ATOM 1387 CA ARG A 91 8.478 -13.754 -6.333 1.00 0.00 C ATOM 1388 C ARG A 91 7.801 -13.305 -7.627 1.00 0.00 C ATOM 1389 O ARG A 91 7.513 -12.120 -7.806 1.00 0.00 O ATOM 1390 CB ARG A 91 9.921 -14.179 -6.622 1.00 0.00 C ATOM 1391 CG ARG A 91 10.780 -13.067 -7.206 1.00 0.00 C ATOM 1392 CD ARG A 91 11.819 -12.583 -6.208 1.00 0.00 C ATOM 1393 NE ARG A 91 13.111 -13.241 -6.399 1.00 0.00 N ATOM 1394 CZ ARG A 91 14.264 -12.778 -5.912 1.00 0.00 C ATOM 1395 NH1 ARG A 91 14.290 -11.661 -5.189 1.00 0.00 N ATOM 1396 NH2 ARG A 91 15.392 -13.438 -6.143 1.00 0.00 N ATOM 0 H ARG A 91 8.314 -15.655 -5.455 1.00 0.00 H new ATOM 0 HA ARG A 91 8.485 -12.915 -5.637 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.378 -14.532 -5.698 1.00 0.00 H new ATOM 0 HB3 ARG A 91 9.911 -15.020 -7.315 1.00 0.00 H new ATOM 0 HG2 ARG A 91 11.278 -13.426 -8.107 1.00 0.00 H new ATOM 0 HG3 ARG A 91 10.144 -12.233 -7.504 1.00 0.00 H new ATOM 0 HD2 ARG A 91 11.943 -11.505 -6.308 1.00 0.00 H new ATOM 0 HD3 ARG A 91 11.463 -12.770 -5.195 1.00 0.00 H new ATOM 0 HE ARG A 91 13.132 -14.107 -6.938 1.00 0.00 H new ATOM 0 HH11 ARG A 91 13.425 -11.153 -5.004 1.00 0.00 H new ATOM 0 HH12 ARG A 91 15.175 -11.313 -4.820 1.00 0.00 H new ATOM 0 HH21 ARG A 91 15.377 -14.298 -6.692 1.00 0.00 H new ATOM 0 HH22 ARG A 91 16.274 -13.086 -5.772 1.00 0.00 H new ATOM 1410 N ALA A 92 7.545 -14.260 -8.519 1.00 0.00 N ATOM 1411 CA ALA A 92 6.895 -13.969 -9.794 1.00 0.00 C ATOM 1412 C ALA A 92 5.437 -13.556 -9.589 1.00 0.00 C ATOM 1413 O ALA A 92 4.922 -12.689 -10.298 1.00 0.00 O ATOM 1414 CB ALA A 92 6.980 -15.175 -10.718 1.00 0.00 C ATOM 0 H ALA A 92 7.778 -15.243 -8.381 1.00 0.00 H new ATOM 0 HA ALA A 92 7.419 -13.133 -10.257 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.491 -14.943 -11.664 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.026 -15.421 -10.900 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.483 -16.026 -10.252 1.00 0.00 H new ATOM 1420 N LYS A 93 4.780 -14.184 -8.610 1.00 0.00 N ATOM 1421 CA LYS A 93 3.382 -13.890 -8.299 1.00 0.00 C ATOM 1422 C LYS A 93 3.172 -12.396 -8.048 1.00 0.00 C ATOM 1423 O LYS A 93 2.198 -11.815 -8.528 1.00 0.00 O ATOM 1424 CB LYS A 93 2.929 -14.689 -7.073 1.00 0.00 C ATOM 1425 CG LYS A 93 1.526 -15.263 -7.201 1.00 0.00 C ATOM 1426 CD LYS A 93 1.549 -16.689 -7.734 1.00 0.00 C ATOM 1427 CE LYS A 93 1.124 -17.692 -6.670 1.00 0.00 C ATOM 1428 NZ LYS A 93 1.287 -19.100 -7.131 1.00 0.00 N ATOM 0 H LYS A 93 5.198 -14.902 -8.018 1.00 0.00 H new ATOM 0 HA LYS A 93 2.782 -14.181 -9.161 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.631 -15.505 -6.902 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.970 -14.044 -6.195 1.00 0.00 H new ATOM 0 HG2 LYS A 93 1.035 -15.246 -6.228 1.00 0.00 H new ATOM 0 HG3 LYS A 93 0.935 -14.635 -7.867 1.00 0.00 H new ATOM 0 HD2 LYS A 93 0.885 -16.767 -8.595 1.00 0.00 H new ATOM 0 HD3 LYS A 93 2.553 -16.931 -8.083 1.00 0.00 H new ATOM 0 HE2 LYS A 93 1.715 -17.535 -5.768 1.00 0.00 H new ATOM 0 HE3 LYS A 93 0.082 -17.517 -6.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 0.986 -19.749 -6.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 0.703 -19.258 -7.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 2.286 -19.276 -7.362 1.00 0.00 H new ATOM 1442 N THR A 94 4.091 -11.784 -7.296 1.00 0.00 N ATOM 1443 CA THR A 94 4.009 -10.354 -6.979 1.00 0.00 C ATOM 1444 C THR A 94 3.762 -9.523 -8.238 1.00 0.00 C ATOM 1445 O THR A 94 2.894 -8.648 -8.249 1.00 0.00 O ATOM 1446 CB THR A 94 5.291 -9.874 -6.284 1.00 0.00 C ATOM 1447 OG1 THR A 94 5.872 -10.913 -5.516 1.00 0.00 O ATOM 1448 CG2 THR A 94 5.062 -8.695 -5.361 1.00 0.00 C ATOM 0 H THR A 94 4.901 -12.256 -6.895 1.00 0.00 H new ATOM 0 HA THR A 94 3.167 -10.217 -6.301 1.00 0.00 H new ATOM 0 HB THR A 94 5.956 -9.565 -7.091 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.487 -11.430 -6.077 1.00 0.00 H new ATOM 0 HG21 THR A 94 6.006 -8.404 -4.901 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.664 -7.857 -5.933 1.00 0.00 H new ATOM 0 HG23 THR A 94 4.351 -8.974 -4.584 1.00 0.00 H new ATOM 1456 N GLY A 95 4.523 -9.805 -9.298 1.00 0.00 N ATOM 1457 CA GLY A 95 4.361 -9.077 -10.546 1.00 0.00 C ATOM 1458 C GLY A 95 2.994 -9.294 -11.168 1.00 0.00 C ATOM 1459 O GLY A 95 2.343 -8.339 -11.592 1.00 0.00 O ATOM 0 H GLY A 95 5.247 -10.524 -9.313 1.00 0.00 H new ATOM 0 HA2 GLY A 95 4.510 -8.013 -10.365 1.00 0.00 H new ATOM 0 HA3 GLY A 95 5.132 -9.391 -11.250 1.00 0.00 H new ATOM 1463 N THR A 96 2.555 -10.554 -11.212 1.00 0.00 N ATOM 1464 CA THR A 96 1.251 -10.894 -11.778 1.00 0.00 C ATOM 1465 C THR A 96 0.124 -10.239 -10.981 1.00 0.00 C ATOM 1466 O THR A 96 -0.796 -9.654 -11.556 1.00 0.00 O ATOM 1467 CB THR A 96 1.055 -12.414 -11.800 1.00 0.00 C ATOM 1468 OG1 THR A 96 2.171 -13.061 -12.387 1.00 0.00 O ATOM 1469 CG2 THR A 96 -0.180 -12.848 -12.562 1.00 0.00 C ATOM 0 H THR A 96 3.084 -11.353 -10.863 1.00 0.00 H new ATOM 0 HA THR A 96 1.221 -10.517 -12.800 1.00 0.00 H new ATOM 0 HB THR A 96 0.939 -12.702 -10.755 1.00 0.00 H new ATOM 0 HG1 THR A 96 2.024 -14.030 -12.388 1.00 0.00 H new ATOM 0 HG21 THR A 96 -0.259 -13.935 -12.538 1.00 0.00 H new ATOM 0 HG22 THR A 96 -1.065 -12.410 -12.100 1.00 0.00 H new ATOM 0 HG23 THR A 96 -0.106 -12.512 -13.596 1.00 0.00 H new ATOM 1477 N ASP A 97 0.201 -10.345 -9.654 1.00 0.00 N ATOM 1478 CA ASP A 97 -0.811 -9.768 -8.772 1.00 0.00 C ATOM 1479 C ASP A 97 -0.896 -8.251 -8.936 1.00 0.00 C ATOM 1480 O ASP A 97 -1.987 -7.679 -8.893 1.00 0.00 O ATOM 1481 CB ASP A 97 -0.520 -10.129 -7.312 1.00 0.00 C ATOM 1482 CG ASP A 97 -0.453 -11.631 -7.074 1.00 0.00 C ATOM 1483 OD1 ASP A 97 -1.101 -12.388 -7.831 1.00 0.00 O ATOM 1484 OD2 ASP A 97 0.249 -12.051 -6.130 1.00 0.00 O ATOM 0 H ASP A 97 0.956 -10.827 -9.166 1.00 0.00 H new ATOM 0 HA ASP A 97 -1.775 -10.190 -9.054 1.00 0.00 H new ATOM 0 HB2 ASP A 97 0.425 -9.677 -7.013 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -1.294 -9.700 -6.676 1.00 0.00 H new ATOM 1489 N LYS A 98 0.255 -7.605 -9.139 1.00 0.00 N ATOM 1490 CA LYS A 98 0.301 -6.153 -9.326 1.00 0.00 C ATOM 1491 C LYS A 98 -0.579 -5.733 -10.505 1.00 0.00 C ATOM 1492 O LYS A 98 -1.193 -4.664 -10.483 1.00 0.00 O ATOM 1493 CB LYS A 98 1.743 -5.688 -9.561 1.00 0.00 C ATOM 1494 CG LYS A 98 1.966 -4.207 -9.287 1.00 0.00 C ATOM 1495 CD LYS A 98 3.091 -3.639 -10.143 1.00 0.00 C ATOM 1496 CE LYS A 98 4.462 -4.071 -9.638 1.00 0.00 C ATOM 1497 NZ LYS A 98 5.568 -3.438 -10.412 1.00 0.00 N ATOM 0 H LYS A 98 1.165 -8.063 -9.178 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.079 -5.682 -8.419 1.00 0.00 H new ATOM 0 HB2 LYS A 98 2.410 -6.270 -8.925 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.020 -5.902 -10.593 1.00 0.00 H new ATOM 0 HG2 LYS A 98 1.045 -3.658 -9.485 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.203 -4.064 -8.233 1.00 0.00 H new ATOM 0 HD2 LYS A 98 2.964 -3.968 -11.174 1.00 0.00 H new ATOM 0 HD3 LYS A 98 3.031 -2.551 -10.146 1.00 0.00 H new ATOM 0 HE2 LYS A 98 4.560 -3.808 -8.585 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.548 -5.156 -9.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 6.483 -3.759 -10.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 5.491 -3.709 -11.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 5.503 -2.403 -10.328 1.00 0.00 H new ATOM 1511 N THR A 99 -0.643 -6.590 -11.527 1.00 0.00 N ATOM 1512 CA THR A 99 -1.452 -6.322 -12.715 1.00 0.00 C ATOM 1513 C THR A 99 -2.940 -6.471 -12.398 1.00 0.00 C ATOM 1514 O THR A 99 -3.757 -5.647 -12.814 1.00 0.00 O ATOM 1515 CB THR A 99 -1.058 -7.277 -13.849 1.00 0.00 C ATOM 1516 OG1 THR A 99 0.336 -7.214 -14.096 1.00 0.00 O ATOM 1517 CG2 THR A 99 -1.767 -6.992 -15.157 1.00 0.00 C ATOM 0 H THR A 99 -0.142 -7.478 -11.554 1.00 0.00 H new ATOM 0 HA THR A 99 -1.267 -5.296 -13.034 1.00 0.00 H new ATOM 0 HB THR A 99 -1.357 -8.266 -13.504 1.00 0.00 H new ATOM 0 HG1 THR A 99 0.568 -7.831 -14.821 1.00 0.00 H new ATOM 0 HG21 THR A 99 -1.439 -7.706 -15.912 1.00 0.00 H new ATOM 0 HG22 THR A 99 -2.844 -7.084 -15.015 1.00 0.00 H new ATOM 0 HG23 THR A 99 -1.529 -5.981 -15.487 1.00 0.00 H new ATOM 1525 N LEU A 100 -3.279 -7.527 -11.657 1.00 0.00 N ATOM 1526 CA LEU A 100 -4.658 -7.797 -11.273 1.00 0.00 C ATOM 1527 C LEU A 100 -5.249 -6.627 -10.488 1.00 0.00 C ATOM 1528 O LEU A 100 -6.362 -6.178 -10.773 1.00 0.00 O ATOM 1529 CB LEU A 100 -4.726 -9.075 -10.436 1.00 0.00 C ATOM 1530 CG LEU A 100 -4.229 -10.342 -11.139 1.00 0.00 C ATOM 1531 CD1 LEU A 100 -3.968 -11.447 -10.129 1.00 0.00 C ATOM 1532 CD2 LEU A 100 -5.236 -10.802 -12.183 1.00 0.00 C ATOM 0 H LEU A 100 -2.608 -8.212 -11.310 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.245 -7.928 -12.182 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -4.139 -8.928 -9.529 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.759 -9.232 -10.125 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.291 -10.109 -11.643 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.616 -12.338 -10.648 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.211 -11.118 -9.418 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -4.890 -11.678 -9.596 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -4.867 -11.703 -12.673 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -6.189 -11.016 -11.700 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -5.375 -10.016 -12.926 1.00 0.00 H new ATOM 1544 N VAL A 101 -4.496 -6.133 -9.505 1.00 0.00 N ATOM 1545 CA VAL A 101 -4.942 -5.008 -8.685 1.00 0.00 C ATOM 1546 C VAL A 101 -5.084 -3.743 -9.528 1.00 0.00 C ATOM 1547 O VAL A 101 -6.012 -2.961 -9.331 1.00 0.00 O ATOM 1548 CB VAL A 101 -3.971 -4.736 -7.516 1.00 0.00 C ATOM 1549 CG1 VAL A 101 -4.515 -3.650 -6.599 1.00 0.00 C ATOM 1550 CG2 VAL A 101 -3.701 -6.012 -6.731 1.00 0.00 C ATOM 0 H VAL A 101 -3.575 -6.494 -9.258 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.914 -5.280 -8.274 1.00 0.00 H new ATOM 0 HB VAL A 101 -3.028 -4.386 -7.937 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -3.813 -3.477 -5.784 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -4.648 -2.728 -7.165 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -5.475 -3.966 -6.190 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -3.014 -5.797 -5.912 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -4.638 -6.396 -6.328 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -3.257 -6.758 -7.390 1.00 0.00 H new ATOM 1560 N LYS A 102 -4.160 -3.555 -10.472 1.00 0.00 N ATOM 1561 CA LYS A 102 -4.181 -2.389 -11.353 1.00 0.00 C ATOM 1562 C LYS A 102 -5.440 -2.382 -12.222 1.00 0.00 C ATOM 1563 O LYS A 102 -6.025 -1.326 -12.468 1.00 0.00 O ATOM 1564 CB LYS A 102 -2.934 -2.375 -12.240 1.00 0.00 C ATOM 1565 CG LYS A 102 -2.164 -1.063 -12.195 1.00 0.00 C ATOM 1566 CD LYS A 102 -1.350 -0.854 -13.462 1.00 0.00 C ATOM 1567 CE LYS A 102 -2.229 -0.417 -14.625 1.00 0.00 C ATOM 1568 NZ LYS A 102 -2.207 1.060 -14.817 1.00 0.00 N ATOM 0 H LYS A 102 -3.387 -4.197 -10.645 1.00 0.00 H new ATOM 0 HA LYS A 102 -4.188 -1.494 -10.731 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -2.272 -3.185 -11.933 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -3.229 -2.577 -13.270 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -2.861 -0.235 -12.068 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -1.501 -1.058 -11.330 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -0.582 -0.101 -13.282 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -0.835 -1.779 -13.721 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -1.891 -0.906 -15.539 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -3.254 -0.744 -14.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -2.858 1.320 -15.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -2.505 1.529 -13.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -1.243 1.364 -15.062 1.00 0.00 H new ATOM 1582 N GLU A 103 -5.856 -3.567 -12.678 1.00 0.00 N ATOM 1583 CA GLU A 103 -7.051 -3.696 -13.511 1.00 0.00 C ATOM 1584 C GLU A 103 -8.298 -3.272 -12.738 1.00 0.00 C ATOM 1585 O GLU A 103 -9.196 -2.635 -13.291 1.00 0.00 O ATOM 1586 CB GLU A 103 -7.204 -5.142 -14.000 1.00 0.00 C ATOM 1587 CG GLU A 103 -8.102 -5.290 -15.220 1.00 0.00 C ATOM 1588 CD GLU A 103 -7.652 -4.433 -16.389 1.00 0.00 C ATOM 1589 OE1 GLU A 103 -6.522 -4.641 -16.880 1.00 0.00 O ATOM 1590 OE2 GLU A 103 -8.430 -3.552 -16.813 1.00 0.00 O ATOM 0 H GLU A 103 -5.382 -4.449 -12.484 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.938 -3.039 -14.373 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -6.218 -5.541 -14.237 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -7.607 -5.748 -13.189 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -8.120 -6.336 -15.528 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -9.123 -5.020 -14.949 1.00 0.00 H new ATOM 1597 N VAL A 104 -8.343 -3.630 -11.455 1.00 0.00 N ATOM 1598 CA VAL A 104 -9.475 -3.286 -10.598 1.00 0.00 C ATOM 1599 C VAL A 104 -9.354 -1.853 -10.077 1.00 0.00 C ATOM 1600 O VAL A 104 -10.337 -1.111 -10.053 1.00 0.00 O ATOM 1601 CB VAL A 104 -9.589 -4.257 -9.402 1.00 0.00 C ATOM 1602 CG1 VAL A 104 -10.876 -4.015 -8.625 1.00 0.00 C ATOM 1603 CG2 VAL A 104 -9.515 -5.702 -9.876 1.00 0.00 C ATOM 0 H VAL A 104 -7.607 -4.159 -10.987 1.00 0.00 H new ATOM 0 HA VAL A 104 -10.375 -3.370 -11.207 1.00 0.00 H new ATOM 0 HB VAL A 104 -8.749 -4.069 -8.733 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -10.932 -4.711 -7.788 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -10.886 -2.992 -8.248 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -11.732 -4.168 -9.282 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -9.597 -6.371 -9.019 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -10.332 -5.900 -10.570 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -8.563 -5.872 -10.379 1.00 0.00 H new ATOM 1613 N VAL A 105 -8.146 -1.471 -9.662 1.00 0.00 N ATOM 1614 CA VAL A 105 -7.898 -0.129 -9.143 1.00 0.00 C ATOM 1615 C VAL A 105 -7.072 0.694 -10.128 1.00 0.00 C ATOM 1616 O VAL A 105 -5.855 0.519 -10.236 1.00 0.00 O ATOM 1617 CB VAL A 105 -7.174 -0.171 -7.781 1.00 0.00 C ATOM 1618 CG1 VAL A 105 -7.104 1.219 -7.165 1.00 0.00 C ATOM 1619 CG2 VAL A 105 -7.867 -1.144 -6.837 1.00 0.00 C ATOM 0 H VAL A 105 -7.324 -2.074 -9.676 1.00 0.00 H new ATOM 0 HA VAL A 105 -8.871 0.342 -9.006 1.00 0.00 H new ATOM 0 HB VAL A 105 -6.155 -0.521 -7.946 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -6.590 1.166 -6.205 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -6.559 1.886 -7.833 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -8.114 1.602 -7.015 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -7.342 -1.160 -5.882 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -8.898 -0.826 -6.680 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -7.858 -2.143 -7.273 1.00 0.00 H new ATOM 1629 N GLN A 106 -7.745 1.591 -10.846 1.00 0.00 N ATOM 1630 CA GLN A 106 -7.088 2.447 -11.830 1.00 0.00 C ATOM 1631 C GLN A 106 -6.847 3.853 -11.273 1.00 0.00 C ATOM 1632 O GLN A 106 -5.897 4.530 -11.673 1.00 0.00 O ATOM 1633 CB GLN A 106 -7.933 2.523 -13.106 1.00 0.00 C ATOM 1634 CG GLN A 106 -8.162 1.169 -13.764 1.00 0.00 C ATOM 1635 CD GLN A 106 -9.585 0.663 -13.603 1.00 0.00 C ATOM 1636 OE1 GLN A 106 -10.294 1.054 -12.675 1.00 0.00 O ATOM 1637 NE2 GLN A 106 -10.010 -0.213 -14.507 1.00 0.00 N ATOM 0 H GLN A 106 -8.750 1.744 -10.763 1.00 0.00 H new ATOM 0 HA GLN A 106 -6.118 2.009 -12.065 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -8.898 2.970 -12.867 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -7.442 3.186 -13.818 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -7.927 1.243 -14.826 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -7.473 0.442 -13.335 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -9.390 -0.510 -15.260 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -10.957 -0.588 -14.448 1.00 0.00 H new ATOM 1646 N ASN A 107 -7.708 4.288 -10.348 1.00 0.00 N ATOM 1647 CA ASN A 107 -7.582 5.612 -9.742 1.00 0.00 C ATOM 1648 C ASN A 107 -6.530 5.609 -8.632 1.00 0.00 C ATOM 1649 O ASN A 107 -6.862 5.567 -7.446 1.00 0.00 O ATOM 1650 CB ASN A 107 -8.931 6.078 -9.182 1.00 0.00 C ATOM 1651 CG ASN A 107 -9.847 6.638 -10.255 1.00 0.00 C ATOM 1652 OD1 ASN A 107 -10.010 7.851 -10.375 1.00 0.00 O ATOM 1653 ND2 ASN A 107 -10.454 5.754 -11.040 1.00 0.00 N ATOM 0 H ASN A 107 -8.498 3.742 -10.005 1.00 0.00 H new ATOM 0 HA ASN A 107 -7.262 6.306 -10.519 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -9.424 5.240 -8.689 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.761 6.840 -8.421 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -11.083 6.073 -11.776 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -10.291 4.756 -10.906 1.00 0.00 H new ATOM 1660 N PHE A 108 -5.260 5.660 -9.027 1.00 0.00 N ATOM 1661 CA PHE A 108 -4.155 5.671 -8.071 1.00 0.00 C ATOM 1662 C PHE A 108 -3.134 6.745 -8.442 1.00 0.00 C ATOM 1663 O PHE A 108 -3.097 7.207 -9.585 1.00 0.00 O ATOM 1664 CB PHE A 108 -3.484 4.294 -8.008 1.00 0.00 C ATOM 1665 CG PHE A 108 -2.914 3.830 -9.321 1.00 0.00 C ATOM 1666 CD1 PHE A 108 -1.711 4.337 -9.787 1.00 0.00 C ATOM 1667 CD2 PHE A 108 -3.579 2.885 -10.086 1.00 0.00 C ATOM 1668 CE1 PHE A 108 -1.184 3.910 -10.990 1.00 0.00 C ATOM 1669 CE2 PHE A 108 -3.057 2.455 -11.291 1.00 0.00 C ATOM 1670 CZ PHE A 108 -1.857 2.969 -11.744 1.00 0.00 C ATOM 0 H PHE A 108 -4.970 5.694 -10.004 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.558 5.904 -7.085 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -2.685 4.324 -7.267 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -4.213 3.562 -7.661 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -1.180 5.074 -9.203 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -4.517 2.480 -9.736 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -0.245 4.312 -11.341 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -3.586 1.719 -11.878 1.00 0.00 H new ATOM 0 HZ PHE A 108 -1.446 2.636 -12.686 1.00 0.00 H new ATOM 1680 N ALA A 109 -2.307 7.141 -7.476 1.00 0.00 N ATOM 1681 CA ALA A 109 -1.291 8.162 -7.714 1.00 0.00 C ATOM 1682 C ALA A 109 0.071 7.538 -7.993 1.00 0.00 C ATOM 1683 O ALA A 109 0.638 7.729 -9.070 1.00 0.00 O ATOM 1684 CB ALA A 109 -1.202 9.113 -6.529 1.00 0.00 C ATOM 0 H ALA A 109 -2.321 6.772 -6.525 1.00 0.00 H new ATOM 0 HA ALA A 109 -1.590 8.726 -8.598 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -0.440 9.867 -6.724 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.165 9.601 -6.381 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -0.937 8.553 -5.632 1.00 0.00 H new ATOM 1690 N LYS A 110 0.597 6.804 -7.015 1.00 0.00 N ATOM 1691 CA LYS A 110 1.900 6.165 -7.157 1.00 0.00 C ATOM 1692 C LYS A 110 1.952 4.837 -6.404 1.00 0.00 C ATOM 1693 O LYS A 110 1.285 4.665 -5.382 1.00 0.00 O ATOM 1694 CB LYS A 110 2.998 7.101 -6.647 1.00 0.00 C ATOM 1695 CG LYS A 110 4.260 7.075 -7.492 1.00 0.00 C ATOM 1696 CD LYS A 110 5.508 7.122 -6.626 1.00 0.00 C ATOM 1697 CE LYS A 110 6.549 8.073 -7.193 1.00 0.00 C ATOM 1698 NZ LYS A 110 7.937 7.584 -6.959 1.00 0.00 N ATOM 0 H LYS A 110 0.141 6.638 -6.118 1.00 0.00 H new ATOM 0 HA LYS A 110 2.063 5.958 -8.215 1.00 0.00 H new ATOM 0 HB2 LYS A 110 2.611 8.120 -6.618 1.00 0.00 H new ATOM 0 HB3 LYS A 110 3.251 6.827 -5.623 1.00 0.00 H new ATOM 0 HG2 LYS A 110 4.273 6.172 -8.102 1.00 0.00 H new ATOM 0 HG3 LYS A 110 4.259 7.923 -8.177 1.00 0.00 H new ATOM 0 HD2 LYS A 110 5.240 7.436 -5.617 1.00 0.00 H new ATOM 0 HD3 LYS A 110 5.934 6.122 -6.546 1.00 0.00 H new ATOM 0 HE2 LYS A 110 6.383 8.196 -8.263 1.00 0.00 H new ATOM 0 HE3 LYS A 110 6.429 9.056 -6.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 8.616 8.261 -7.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 8.105 7.491 -5.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 8.060 6.658 -7.416 1.00 0.00 H new ATOM 1712 N GLU A 111 2.751 3.906 -6.918 1.00 0.00 N ATOM 1713 CA GLU A 111 2.898 2.591 -6.302 1.00 0.00 C ATOM 1714 C GLU A 111 4.326 2.076 -6.456 1.00 0.00 C ATOM 1715 O GLU A 111 4.877 2.072 -7.559 1.00 0.00 O ATOM 1716 CB GLU A 111 1.915 1.599 -6.930 1.00 0.00 C ATOM 1717 CG GLU A 111 2.004 1.524 -8.448 1.00 0.00 C ATOM 1718 CD GLU A 111 2.175 0.104 -8.954 1.00 0.00 C ATOM 1719 OE1 GLU A 111 3.330 -0.368 -9.023 1.00 0.00 O ATOM 1720 OE2 GLU A 111 1.154 -0.537 -9.280 1.00 0.00 O ATOM 0 H GLU A 111 3.308 4.039 -7.762 1.00 0.00 H new ATOM 0 HA GLU A 111 2.678 2.687 -5.239 1.00 0.00 H new ATOM 0 HB2 GLU A 111 2.099 0.608 -6.515 1.00 0.00 H new ATOM 0 HB3 GLU A 111 0.900 1.880 -6.648 1.00 0.00 H new ATOM 0 HG2 GLU A 111 1.102 1.954 -8.883 1.00 0.00 H new ATOM 0 HG3 GLU A 111 2.843 2.131 -8.789 1.00 0.00 H new ATOM 1727 N PHE A 112 4.922 1.642 -5.347 1.00 0.00 N ATOM 1728 CA PHE A 112 6.286 1.120 -5.368 1.00 0.00 C ATOM 1729 C PHE A 112 6.452 -0.033 -4.384 1.00 0.00 C ATOM 1730 O PHE A 112 5.641 -0.210 -3.470 1.00 0.00 O ATOM 1731 CB PHE A 112 7.304 2.227 -5.062 1.00 0.00 C ATOM 1732 CG PHE A 112 6.905 3.146 -3.938 1.00 0.00 C ATOM 1733 CD1 PHE A 112 7.189 2.816 -2.623 1.00 0.00 C ATOM 1734 CD2 PHE A 112 6.259 4.343 -4.201 1.00 0.00 C ATOM 1735 CE1 PHE A 112 6.832 3.663 -1.590 1.00 0.00 C ATOM 1736 CE2 PHE A 112 5.902 5.195 -3.173 1.00 0.00 C ATOM 1737 CZ PHE A 112 6.189 4.854 -1.866 1.00 0.00 C ATOM 0 H PHE A 112 4.483 1.642 -4.426 1.00 0.00 H new ATOM 0 HA PHE A 112 6.475 0.743 -6.373 1.00 0.00 H new ATOM 0 HB2 PHE A 112 8.261 1.766 -4.816 1.00 0.00 H new ATOM 0 HB3 PHE A 112 7.459 2.821 -5.963 1.00 0.00 H new ATOM 0 HD1 PHE A 112 7.695 1.887 -2.402 1.00 0.00 H new ATOM 0 HD2 PHE A 112 6.032 4.614 -5.222 1.00 0.00 H new ATOM 0 HE1 PHE A 112 7.056 3.394 -0.568 1.00 0.00 H new ATOM 0 HE2 PHE A 112 5.400 6.126 -3.391 1.00 0.00 H new ATOM 0 HZ PHE A 112 5.911 5.518 -1.061 1.00 0.00 H new ATOM 1747 N VAL A 113 7.510 -0.816 -4.581 1.00 0.00 N ATOM 1748 CA VAL A 113 7.795 -1.959 -3.720 1.00 0.00 C ATOM 1749 C VAL A 113 8.892 -1.624 -2.708 1.00 0.00 C ATOM 1750 O VAL A 113 9.858 -0.932 -3.032 1.00 0.00 O ATOM 1751 CB VAL A 113 8.208 -3.196 -4.553 1.00 0.00 C ATOM 1752 CG1 VAL A 113 9.518 -2.948 -5.293 1.00 0.00 C ATOM 1753 CG2 VAL A 113 8.309 -4.437 -3.674 1.00 0.00 C ATOM 0 H VAL A 113 8.186 -0.678 -5.332 1.00 0.00 H new ATOM 0 HA VAL A 113 6.879 -2.195 -3.178 1.00 0.00 H new ATOM 0 HB VAL A 113 7.430 -3.370 -5.297 1.00 0.00 H new ATOM 0 HG11 VAL A 113 9.783 -3.834 -5.870 1.00 0.00 H new ATOM 0 HG12 VAL A 113 9.401 -2.099 -5.966 1.00 0.00 H new ATOM 0 HG13 VAL A 113 10.308 -2.734 -4.573 1.00 0.00 H new ATOM 0 HG21 VAL A 113 8.601 -5.292 -4.284 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.056 -4.273 -2.898 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.342 -4.635 -3.211 1.00 0.00 H new ATOM 1763 N ILE A 114 8.729 -2.112 -1.479 1.00 0.00 N ATOM 1764 CA ILE A 114 9.699 -1.862 -0.415 1.00 0.00 C ATOM 1765 C ILE A 114 10.032 -3.148 0.338 1.00 0.00 C ATOM 1766 O ILE A 114 9.187 -4.034 0.475 1.00 0.00 O ATOM 1767 CB ILE A 114 9.178 -0.807 0.590 1.00 0.00 C ATOM 1768 CG1 ILE A 114 8.542 0.376 -0.146 1.00 0.00 C ATOM 1769 CG2 ILE A 114 10.306 -0.324 1.493 1.00 0.00 C ATOM 1770 CD1 ILE A 114 7.827 1.348 0.768 1.00 0.00 C ATOM 0 H ILE A 114 7.933 -2.683 -1.196 1.00 0.00 H new ATOM 0 HA ILE A 114 10.601 -1.480 -0.893 1.00 0.00 H new ATOM 0 HB ILE A 114 8.415 -1.277 1.210 1.00 0.00 H new ATOM 0 HG12 ILE A 114 9.317 0.910 -0.695 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.834 -0.004 -0.883 1.00 0.00 H new ATOM 0 HG21 ILE A 114 9.920 0.417 2.193 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.715 -1.168 2.048 1.00 0.00 H new ATOM 0 HG23 ILE A 114 11.092 0.125 0.885 1.00 0.00 H new ATOM 0 HD11 ILE A 114 7.402 2.159 0.176 1.00 0.00 H new ATOM 0 HD12 ILE A 114 7.029 0.829 1.298 1.00 0.00 H new ATOM 0 HD13 ILE A 114 8.535 1.757 1.489 1.00 0.00 H new ATOM 1782 N SER A 115 11.269 -3.239 0.829 1.00 0.00 N ATOM 1783 CA SER A 115 11.718 -4.414 1.577 1.00 0.00 C ATOM 1784 C SER A 115 12.406 -4.009 2.887 1.00 0.00 C ATOM 1785 O SER A 115 13.243 -4.744 3.413 1.00 0.00 O ATOM 1786 CB SER A 115 12.664 -5.263 0.720 1.00 0.00 C ATOM 1787 OG SER A 115 11.948 -6.237 -0.018 1.00 0.00 O ATOM 0 H SER A 115 11.978 -2.513 0.722 1.00 0.00 H new ATOM 0 HA SER A 115 10.839 -5.008 1.827 1.00 0.00 H new ATOM 0 HB2 SER A 115 13.217 -4.619 0.037 1.00 0.00 H new ATOM 0 HB3 SER A 115 13.397 -5.754 1.360 1.00 0.00 H new ATOM 0 HG SER A 115 12.429 -7.090 0.014 1.00 0.00 H new ATOM 1793 N ASP A 116 12.037 -2.838 3.413 1.00 0.00 N ATOM 1794 CA ASP A 116 12.605 -2.336 4.661 1.00 0.00 C ATOM 1795 C ASP A 116 11.505 -1.806 5.577 1.00 0.00 C ATOM 1796 O ASP A 116 10.579 -1.132 5.123 1.00 0.00 O ATOM 1797 CB ASP A 116 13.629 -1.231 4.384 1.00 0.00 C ATOM 1798 CG ASP A 116 14.231 -0.661 5.655 1.00 0.00 C ATOM 1799 OD1 ASP A 116 14.686 -1.453 6.510 1.00 0.00 O ATOM 1800 OD2 ASP A 116 14.243 0.577 5.797 1.00 0.00 O ATOM 0 H ASP A 116 11.345 -2.220 2.990 1.00 0.00 H new ATOM 0 HA ASP A 116 13.109 -3.164 5.159 1.00 0.00 H new ATOM 0 HB2 ASP A 116 14.426 -1.629 3.756 1.00 0.00 H new ATOM 0 HB3 ASP A 116 13.150 -0.429 3.822 1.00 0.00 H new ATOM 1805 N ARG A 117 11.616 -2.115 6.867 1.00 0.00 N ATOM 1806 CA ARG A 117 10.633 -1.667 7.849 1.00 0.00 C ATOM 1807 C ARG A 117 10.695 -0.151 8.034 1.00 0.00 C ATOM 1808 O ARG A 117 9.663 0.502 8.205 1.00 0.00 O ATOM 1809 CB ARG A 117 10.862 -2.370 9.189 1.00 0.00 C ATOM 1810 CG ARG A 117 9.578 -2.666 9.946 1.00 0.00 C ATOM 1811 CD ARG A 117 9.482 -4.133 10.336 1.00 0.00 C ATOM 1812 NE ARG A 117 9.981 -4.376 11.689 1.00 0.00 N ATOM 1813 CZ ARG A 117 9.947 -5.565 12.295 1.00 0.00 C ATOM 1814 NH1 ARG A 117 9.447 -6.627 11.670 1.00 0.00 N ATOM 1815 NH2 ARG A 117 10.419 -5.691 13.530 1.00 0.00 N ATOM 0 H ARG A 117 12.376 -2.673 7.256 1.00 0.00 H new ATOM 0 HA ARG A 117 9.642 -1.926 7.477 1.00 0.00 H new ATOM 0 HB2 ARG A 117 11.395 -3.305 9.013 1.00 0.00 H new ATOM 0 HB3 ARG A 117 11.506 -1.748 9.811 1.00 0.00 H new ATOM 0 HG2 ARG A 117 9.533 -2.047 10.842 1.00 0.00 H new ATOM 0 HG3 ARG A 117 8.721 -2.396 9.329 1.00 0.00 H new ATOM 0 HD2 ARG A 117 8.444 -4.458 10.269 1.00 0.00 H new ATOM 0 HD3 ARG A 117 10.051 -4.734 9.627 1.00 0.00 H new ATOM 0 HE ARG A 117 10.379 -3.589 12.201 1.00 0.00 H new ATOM 0 HH11 ARG A 117 9.086 -6.537 10.720 1.00 0.00 H new ATOM 0 HH12 ARG A 117 9.425 -7.532 12.140 1.00 0.00 H new ATOM 0 HH21 ARG A 117 10.806 -4.880 14.013 1.00 0.00 H new ATOM 0 HH22 ARG A 117 10.394 -6.598 13.995 1.00 0.00 H new ATOM 1829 N LYS A 118 11.907 0.405 7.988 1.00 0.00 N ATOM 1830 CA LYS A 118 12.101 1.845 8.141 1.00 0.00 C ATOM 1831 C LYS A 118 11.376 2.604 7.030 1.00 0.00 C ATOM 1832 O LYS A 118 10.714 3.611 7.287 1.00 0.00 O ATOM 1833 CB LYS A 118 13.593 2.183 8.125 1.00 0.00 C ATOM 1834 CG LYS A 118 13.985 3.288 9.091 1.00 0.00 C ATOM 1835 CD LYS A 118 13.902 2.824 10.537 1.00 0.00 C ATOM 1836 CE LYS A 118 13.128 3.814 11.396 1.00 0.00 C ATOM 1837 NZ LYS A 118 12.356 3.138 12.476 1.00 0.00 N ATOM 0 H LYS A 118 12.769 -0.122 7.846 1.00 0.00 H new ATOM 0 HA LYS A 118 11.682 2.150 9.100 1.00 0.00 H new ATOM 0 HB2 LYS A 118 14.161 1.285 8.366 1.00 0.00 H new ATOM 0 HB3 LYS A 118 13.878 2.479 7.115 1.00 0.00 H new ATOM 0 HG2 LYS A 118 15.000 3.620 8.873 1.00 0.00 H new ATOM 0 HG3 LYS A 118 13.331 4.148 8.946 1.00 0.00 H new ATOM 0 HD2 LYS A 118 13.419 1.848 10.580 1.00 0.00 H new ATOM 0 HD3 LYS A 118 14.908 2.700 10.939 1.00 0.00 H new ATOM 0 HE2 LYS A 118 13.822 4.528 11.840 1.00 0.00 H new ATOM 0 HE3 LYS A 118 12.445 4.383 10.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 11.845 3.850 13.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 11.675 2.476 12.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 13.009 2.615 13.094 1.00 0.00 H new ATOM 1851 N GLU A 119 11.492 2.100 5.802 1.00 0.00 N ATOM 1852 CA GLU A 119 10.835 2.715 4.652 1.00 0.00 C ATOM 1853 C GLU A 119 9.319 2.531 4.736 1.00 0.00 C ATOM 1854 O GLU A 119 8.555 3.385 4.279 1.00 0.00 O ATOM 1855 CB GLU A 119 11.361 2.109 3.349 1.00 0.00 C ATOM 1856 CG GLU A 119 12.759 2.576 2.978 1.00 0.00 C ATOM 1857 CD GLU A 119 13.024 2.490 1.487 1.00 0.00 C ATOM 1858 OE1 GLU A 119 12.271 3.119 0.712 1.00 0.00 O ATOM 1859 OE2 GLU A 119 13.982 1.794 1.093 1.00 0.00 O ATOM 0 H GLU A 119 12.036 1.266 5.579 1.00 0.00 H new ATOM 0 HA GLU A 119 11.060 3.782 4.662 1.00 0.00 H new ATOM 0 HB2 GLU A 119 11.362 1.023 3.439 1.00 0.00 H new ATOM 0 HB3 GLU A 119 10.676 2.361 2.539 1.00 0.00 H new ATOM 0 HG2 GLU A 119 12.894 3.606 3.309 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.494 1.971 3.510 1.00 0.00 H new ATOM 1866 N LEU A 120 8.893 1.416 5.332 1.00 0.00 N ATOM 1867 CA LEU A 120 7.471 1.115 5.492 1.00 0.00 C ATOM 1868 C LEU A 120 6.784 2.167 6.360 1.00 0.00 C ATOM 1869 O LEU A 120 5.603 2.463 6.169 1.00 0.00 O ATOM 1870 CB LEU A 120 7.287 -0.268 6.123 1.00 0.00 C ATOM 1871 CG LEU A 120 7.350 -1.445 5.150 1.00 0.00 C ATOM 1872 CD1 LEU A 120 7.173 -2.757 5.899 1.00 0.00 C ATOM 1873 CD2 LEU A 120 6.293 -1.302 4.063 1.00 0.00 C ATOM 0 H LEU A 120 9.516 0.704 5.713 1.00 0.00 H new ATOM 0 HA LEU A 120 7.014 1.125 4.503 1.00 0.00 H new ATOM 0 HB2 LEU A 120 8.054 -0.406 6.885 1.00 0.00 H new ATOM 0 HB3 LEU A 120 6.324 -0.291 6.633 1.00 0.00 H new ATOM 0 HG LEU A 120 8.330 -1.447 4.672 1.00 0.00 H new ATOM 0 HD11 LEU A 120 7.220 -3.587 5.194 1.00 0.00 H new ATOM 0 HD12 LEU A 120 7.966 -2.864 6.639 1.00 0.00 H new ATOM 0 HD13 LEU A 120 6.206 -2.762 6.401 1.00 0.00 H new ATOM 0 HD21 LEU A 120 6.355 -2.150 3.381 1.00 0.00 H new ATOM 0 HD22 LEU A 120 5.303 -1.275 4.519 1.00 0.00 H new ATOM 0 HD23 LEU A 120 6.463 -0.378 3.510 1.00 0.00 H new ATOM 1885 N GLU A 121 7.534 2.721 7.313 1.00 0.00 N ATOM 1886 CA GLU A 121 7.021 3.741 8.220 1.00 0.00 C ATOM 1887 C GLU A 121 6.242 4.813 7.458 1.00 0.00 C ATOM 1888 O GLU A 121 6.738 5.380 6.482 1.00 0.00 O ATOM 1889 CB GLU A 121 8.185 4.372 8.989 1.00 0.00 C ATOM 1890 CG GLU A 121 7.757 5.223 10.174 1.00 0.00 C ATOM 1891 CD GLU A 121 8.924 5.951 10.814 1.00 0.00 C ATOM 1892 OE1 GLU A 121 9.388 6.954 10.234 1.00 0.00 O ATOM 1893 OE2 GLU A 121 9.376 5.513 11.893 1.00 0.00 O ATOM 0 H GLU A 121 8.510 2.475 7.475 1.00 0.00 H new ATOM 0 HA GLU A 121 6.335 3.270 8.924 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.844 3.580 9.344 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.767 4.988 8.304 1.00 0.00 H new ATOM 0 HG2 GLU A 121 7.014 5.950 9.846 1.00 0.00 H new ATOM 0 HG3 GLU A 121 7.275 4.589 10.918 1.00 0.00 H new ATOM 1900 N GLU A 122 5.014 5.072 7.907 1.00 0.00 N ATOM 1901 CA GLU A 122 4.145 6.066 7.273 1.00 0.00 C ATOM 1902 C GLU A 122 4.867 7.397 7.068 1.00 0.00 C ATOM 1903 O GLU A 122 4.732 8.026 6.017 1.00 0.00 O ATOM 1904 CB GLU A 122 2.886 6.280 8.117 1.00 0.00 C ATOM 1905 CG GLU A 122 1.868 7.210 7.476 1.00 0.00 C ATOM 1906 CD GLU A 122 0.695 7.505 8.392 1.00 0.00 C ATOM 1907 OE1 GLU A 122 0.926 8.029 9.502 1.00 0.00 O ATOM 1908 OE2 GLU A 122 -0.453 7.211 7.999 1.00 0.00 O ATOM 0 H GLU A 122 4.596 4.605 8.712 1.00 0.00 H new ATOM 0 HA GLU A 122 3.864 5.683 6.292 1.00 0.00 H new ATOM 0 HB2 GLU A 122 2.416 5.314 8.302 1.00 0.00 H new ATOM 0 HB3 GLU A 122 3.175 6.685 9.087 1.00 0.00 H new ATOM 0 HG2 GLU A 122 2.356 8.146 7.203 1.00 0.00 H new ATOM 0 HG3 GLU A 122 1.501 6.761 6.553 1.00 0.00 H new ATOM 1915 N ASN A 123 5.640 7.812 8.073 1.00 0.00 N ATOM 1916 CA ASN A 123 6.392 9.061 7.999 1.00 0.00 C ATOM 1917 C ASN A 123 7.299 9.060 6.773 1.00 0.00 C ATOM 1918 O ASN A 123 7.398 10.059 6.056 1.00 0.00 O ATOM 1919 CB ASN A 123 7.229 9.252 9.267 1.00 0.00 C ATOM 1920 CG ASN A 123 6.458 9.929 10.385 1.00 0.00 C ATOM 1921 OD1 ASN A 123 6.226 9.335 11.438 1.00 0.00 O ATOM 1922 ND2 ASN A 123 6.058 11.178 10.167 1.00 0.00 N ATOM 0 H ASN A 123 5.760 7.300 8.947 1.00 0.00 H new ATOM 0 HA ASN A 123 5.685 9.887 7.915 1.00 0.00 H new ATOM 0 HB2 ASN A 123 7.583 8.281 9.613 1.00 0.00 H new ATOM 0 HB3 ASN A 123 8.111 9.846 9.028 1.00 0.00 H new ATOM 0 HD21 ASN A 123 5.538 11.680 10.887 1.00 0.00 H new ATOM 0 HD22 ASN A 123 6.271 11.634 9.280 1.00 0.00 H new ATOM 1929 N PHE A 124 7.950 7.921 6.535 1.00 0.00 N ATOM 1930 CA PHE A 124 8.843 7.767 5.394 1.00 0.00 C ATOM 1931 C PHE A 124 8.070 7.873 4.080 1.00 0.00 C ATOM 1932 O PHE A 124 8.469 8.608 3.175 1.00 0.00 O ATOM 1933 CB PHE A 124 9.567 6.422 5.471 1.00 0.00 C ATOM 1934 CG PHE A 124 10.687 6.289 4.478 1.00 0.00 C ATOM 1935 CD1 PHE A 124 10.419 6.046 3.140 1.00 0.00 C ATOM 1936 CD2 PHE A 124 12.006 6.416 4.881 1.00 0.00 C ATOM 1937 CE1 PHE A 124 11.445 5.930 2.223 1.00 0.00 C ATOM 1938 CE2 PHE A 124 13.037 6.302 3.968 1.00 0.00 C ATOM 1939 CZ PHE A 124 12.757 6.059 2.638 1.00 0.00 C ATOM 0 H PHE A 124 7.873 7.090 7.122 1.00 0.00 H new ATOM 0 HA PHE A 124 9.579 8.570 5.424 1.00 0.00 H new ATOM 0 HB2 PHE A 124 9.966 6.289 6.477 1.00 0.00 H new ATOM 0 HB3 PHE A 124 8.847 5.620 5.305 1.00 0.00 H new ATOM 0 HD1 PHE A 124 9.395 5.946 2.811 1.00 0.00 H new ATOM 0 HD2 PHE A 124 12.231 6.606 5.920 1.00 0.00 H new ATOM 0 HE1 PHE A 124 11.223 5.739 1.184 1.00 0.00 H new ATOM 0 HE2 PHE A 124 14.061 6.403 4.295 1.00 0.00 H new ATOM 0 HZ PHE A 124 13.562 5.970 1.923 1.00 0.00 H new ATOM 1949 N ILE A 125 6.963 7.134 3.986 1.00 0.00 N ATOM 1950 CA ILE A 125 6.126 7.142 2.786 1.00 0.00 C ATOM 1951 C ILE A 125 5.608 8.548 2.488 1.00 0.00 C ATOM 1952 O ILE A 125 5.651 9.003 1.343 1.00 0.00 O ATOM 1953 CB ILE A 125 4.919 6.184 2.929 1.00 0.00 C ATOM 1954 CG1 ILE A 125 5.391 4.773 3.291 1.00 0.00 C ATOM 1955 CG2 ILE A 125 4.104 6.158 1.644 1.00 0.00 C ATOM 1956 CD1 ILE A 125 4.315 3.920 3.928 1.00 0.00 C ATOM 0 H ILE A 125 6.625 6.521 4.728 1.00 0.00 H new ATOM 0 HA ILE A 125 6.754 6.802 1.962 1.00 0.00 H new ATOM 0 HB ILE A 125 4.283 6.552 3.735 1.00 0.00 H new ATOM 0 HG12 ILE A 125 5.751 4.277 2.390 1.00 0.00 H new ATOM 0 HG13 ILE A 125 6.237 4.846 3.974 1.00 0.00 H new ATOM 0 HG21 ILE A 125 3.259 5.479 1.763 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.736 7.161 1.426 1.00 0.00 H new ATOM 0 HG23 ILE A 125 4.732 5.815 0.822 1.00 0.00 H new ATOM 0 HD11 ILE A 125 4.720 2.935 4.158 1.00 0.00 H new ATOM 0 HD12 ILE A 125 3.971 4.394 4.847 1.00 0.00 H new ATOM 0 HD13 ILE A 125 3.477 3.816 3.238 1.00 0.00 H new ATOM 1968 N LYS A 126 5.122 9.230 3.526 1.00 0.00 N ATOM 1969 CA LYS A 126 4.596 10.585 3.387 1.00 0.00 C ATOM 1970 C LYS A 126 5.629 11.506 2.738 1.00 0.00 C ATOM 1971 O LYS A 126 5.298 12.289 1.846 1.00 0.00 O ATOM 1972 CB LYS A 126 4.186 11.128 4.757 1.00 0.00 C ATOM 1973 CG LYS A 126 3.579 12.522 4.713 1.00 0.00 C ATOM 1974 CD LYS A 126 2.402 12.648 5.668 1.00 0.00 C ATOM 1975 CE LYS A 126 1.122 13.021 4.935 1.00 0.00 C ATOM 1976 NZ LYS A 126 -0.094 12.708 5.739 1.00 0.00 N ATOM 0 H LYS A 126 5.083 8.862 4.476 1.00 0.00 H new ATOM 0 HA LYS A 126 3.719 10.551 2.740 1.00 0.00 H new ATOM 0 HB2 LYS A 126 3.467 10.444 5.207 1.00 0.00 H new ATOM 0 HB3 LYS A 126 5.061 11.144 5.407 1.00 0.00 H new ATOM 0 HG2 LYS A 126 4.339 13.259 4.971 1.00 0.00 H new ATOM 0 HG3 LYS A 126 3.251 12.745 3.698 1.00 0.00 H new ATOM 0 HD2 LYS A 126 2.258 11.705 6.195 1.00 0.00 H new ATOM 0 HD3 LYS A 126 2.624 13.404 6.422 1.00 0.00 H new ATOM 0 HE2 LYS A 126 1.136 14.085 4.699 1.00 0.00 H new ATOM 0 HE3 LYS A 126 1.078 12.485 3.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -0.943 12.978 5.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -0.122 11.689 5.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -0.066 13.239 6.633 1.00 0.00 H new ATOM 1990 N SER A 127 6.880 11.398 3.187 1.00 0.00 N ATOM 1991 CA SER A 127 7.963 12.214 2.645 1.00 0.00 C ATOM 1992 C SER A 127 8.184 11.906 1.164 1.00 0.00 C ATOM 1993 O SER A 127 8.358 12.816 0.354 1.00 0.00 O ATOM 1994 CB SER A 127 9.253 11.978 3.432 1.00 0.00 C ATOM 1995 OG SER A 127 10.289 12.839 2.992 1.00 0.00 O ATOM 0 H SER A 127 7.167 10.754 3.924 1.00 0.00 H new ATOM 0 HA SER A 127 7.681 13.262 2.740 1.00 0.00 H new ATOM 0 HB2 SER A 127 9.069 12.140 4.494 1.00 0.00 H new ATOM 0 HB3 SER A 127 9.567 10.940 3.318 1.00 0.00 H new ATOM 0 HG SER A 127 11.101 12.667 3.513 1.00 0.00 H new ATOM 2001 N GLU A 128 8.164 10.616 0.820 1.00 0.00 N ATOM 2002 CA GLU A 128 8.353 10.178 -0.563 1.00 0.00 C ATOM 2003 C GLU A 128 7.325 10.833 -1.488 1.00 0.00 C ATOM 2004 O GLU A 128 7.684 11.428 -2.506 1.00 0.00 O ATOM 2005 CB GLU A 128 8.242 8.650 -0.651 1.00 0.00 C ATOM 2006 CG GLU A 128 8.560 8.085 -2.028 1.00 0.00 C ATOM 2007 CD GLU A 128 9.862 7.307 -2.055 1.00 0.00 C ATOM 2008 OE1 GLU A 128 10.935 7.946 -2.080 1.00 0.00 O ATOM 2009 OE2 GLU A 128 9.807 6.059 -2.053 1.00 0.00 O ATOM 0 H GLU A 128 8.018 9.855 1.483 1.00 0.00 H new ATOM 0 HA GLU A 128 9.348 10.484 -0.886 1.00 0.00 H new ATOM 0 HB2 GLU A 128 8.918 8.204 0.078 1.00 0.00 H new ATOM 0 HB3 GLU A 128 7.231 8.353 -0.372 1.00 0.00 H new ATOM 0 HG2 GLU A 128 7.746 7.434 -2.346 1.00 0.00 H new ATOM 0 HG3 GLU A 128 8.615 8.902 -2.748 1.00 0.00 H new ATOM 2016 N LEU A 129 6.047 10.717 -1.123 1.00 0.00 N ATOM 2017 CA LEU A 129 4.958 11.294 -1.915 1.00 0.00 C ATOM 2018 C LEU A 129 5.083 12.816 -2.026 1.00 0.00 C ATOM 2019 O LEU A 129 4.684 13.402 -3.035 1.00 0.00 O ATOM 2020 CB LEU A 129 3.602 10.926 -1.306 1.00 0.00 C ATOM 2021 CG LEU A 129 2.794 9.896 -2.100 1.00 0.00 C ATOM 2022 CD1 LEU A 129 3.461 8.529 -2.041 1.00 0.00 C ATOM 2023 CD2 LEU A 129 1.368 9.815 -1.575 1.00 0.00 C ATOM 0 H LEU A 129 5.740 10.228 -0.282 1.00 0.00 H new ATOM 0 HA LEU A 129 5.028 10.877 -2.919 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.765 10.540 -0.300 1.00 0.00 H new ATOM 0 HB3 LEU A 129 3.007 11.834 -1.206 1.00 0.00 H new ATOM 0 HG LEU A 129 2.761 10.217 -3.141 1.00 0.00 H new ATOM 0 HD11 LEU A 129 2.871 7.811 -2.611 1.00 0.00 H new ATOM 0 HD12 LEU A 129 4.463 8.594 -2.466 1.00 0.00 H new ATOM 0 HD13 LEU A 129 3.527 8.201 -1.004 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.809 9.078 -2.152 1.00 0.00 H new ATOM 0 HD22 LEU A 129 1.383 9.520 -0.526 1.00 0.00 H new ATOM 0 HD23 LEU A 129 0.889 10.789 -1.671 1.00 0.00 H new ATOM 2035 N LYS A 130 5.630 13.454 -0.988 1.00 0.00 N ATOM 2036 CA LYS A 130 5.801 14.902 -0.977 1.00 0.00 C ATOM 2037 C LYS A 130 7.193 15.310 -1.475 1.00 0.00 C ATOM 2038 O LYS A 130 7.643 16.431 -1.227 1.00 0.00 O ATOM 2039 CB LYS A 130 5.571 15.436 0.438 1.00 0.00 C ATOM 2040 CG LYS A 130 4.729 16.698 0.483 1.00 0.00 C ATOM 2041 CD LYS A 130 5.516 17.906 0.004 1.00 0.00 C ATOM 2042 CE LYS A 130 4.838 19.208 0.396 1.00 0.00 C ATOM 2043 NZ LYS A 130 3.825 19.638 -0.610 1.00 0.00 N ATOM 0 H LYS A 130 5.961 12.986 -0.145 1.00 0.00 H new ATOM 0 HA LYS A 130 5.067 15.335 -1.657 1.00 0.00 H new ATOM 0 HB2 LYS A 130 5.085 14.664 1.034 1.00 0.00 H new ATOM 0 HB3 LYS A 130 6.536 15.637 0.903 1.00 0.00 H new ATOM 0 HG2 LYS A 130 3.843 16.569 -0.139 1.00 0.00 H new ATOM 0 HG3 LYS A 130 4.381 16.869 1.502 1.00 0.00 H new ATOM 0 HD2 LYS A 130 6.521 17.877 0.426 1.00 0.00 H new ATOM 0 HD3 LYS A 130 5.624 17.864 -1.080 1.00 0.00 H new ATOM 0 HE2 LYS A 130 4.356 19.087 1.366 1.00 0.00 H new ATOM 0 HE3 LYS A 130 5.590 19.989 0.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 3.387 20.530 -0.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 4.288 19.779 -1.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 3.092 18.906 -0.699 1.00 0.00 H new ATOM 2057 N LYS A 131 7.873 14.402 -2.179 1.00 0.00 N ATOM 2058 CA LYS A 131 9.207 14.681 -2.705 1.00 0.00 C ATOM 2059 C LYS A 131 9.183 14.784 -4.227 1.00 0.00 C ATOM 2060 O LYS A 131 9.714 15.737 -4.800 1.00 0.00 O ATOM 2061 CB LYS A 131 10.189 13.587 -2.274 1.00 0.00 C ATOM 2062 CG LYS A 131 11.077 13.992 -1.110 1.00 0.00 C ATOM 2063 CD LYS A 131 12.370 13.191 -1.088 1.00 0.00 C ATOM 2064 CE LYS A 131 13.334 13.652 -2.173 1.00 0.00 C ATOM 2065 NZ LYS A 131 14.747 13.665 -1.696 1.00 0.00 N ATOM 0 H LYS A 131 7.521 13.470 -2.397 1.00 0.00 H new ATOM 0 HA LYS A 131 9.536 15.637 -2.298 1.00 0.00 H new ATOM 0 HB2 LYS A 131 9.628 12.694 -1.998 1.00 0.00 H new ATOM 0 HB3 LYS A 131 10.817 13.319 -3.123 1.00 0.00 H new ATOM 0 HG2 LYS A 131 11.308 15.055 -1.180 1.00 0.00 H new ATOM 0 HG3 LYS A 131 10.540 13.844 -0.173 1.00 0.00 H new ATOM 0 HD2 LYS A 131 12.845 13.292 -0.112 1.00 0.00 H new ATOM 0 HD3 LYS A 131 12.146 12.133 -1.225 1.00 0.00 H new ATOM 0 HE2 LYS A 131 13.249 12.993 -3.037 1.00 0.00 H new ATOM 0 HE3 LYS A 131 13.054 14.652 -2.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 15.370 13.985 -2.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 14.834 14.313 -0.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 15.023 12.706 -1.403 1.00 0.00 H new ATOM 2079 N ALA A 132 8.560 13.798 -4.873 1.00 0.00 N ATOM 2080 CA ALA A 132 8.459 13.773 -6.328 1.00 0.00 C ATOM 2081 C ALA A 132 7.347 14.701 -6.802 1.00 0.00 C ATOM 2082 O ALA A 132 6.282 14.250 -7.229 1.00 0.00 O ATOM 2083 CB ALA A 132 8.224 12.351 -6.823 1.00 0.00 C ATOM 0 H ALA A 132 8.117 13.005 -4.408 1.00 0.00 H new ATOM 0 HA ALA A 132 9.401 14.128 -6.746 1.00 0.00 H new ATOM 0 HB1 ALA A 132 8.151 12.352 -7.911 1.00 0.00 H new ATOM 0 HB2 ALA A 132 9.055 11.717 -6.515 1.00 0.00 H new ATOM 0 HB3 ALA A 132 7.297 11.966 -6.398 1.00 0.00 H new ATOM 2089 N GLY A 133 7.603 16.003 -6.713 1.00 0.00 N ATOM 2090 CA GLY A 133 6.622 16.987 -7.123 1.00 0.00 C ATOM 2091 C GLY A 133 5.990 17.701 -5.943 1.00 0.00 C ATOM 2092 O GLY A 133 4.766 17.812 -5.861 1.00 0.00 O ATOM 0 H GLY A 133 8.477 16.394 -6.362 1.00 0.00 H new ATOM 0 HA2 GLY A 133 7.097 17.720 -7.775 1.00 0.00 H new ATOM 0 HA3 GLY A 133 5.843 16.498 -7.708 1.00 0.00 H new ATOM 2096 N GLY A 134 6.830 18.182 -5.027 1.00 0.00 N ATOM 2097 CA GLY A 134 6.334 18.887 -3.857 1.00 0.00 C ATOM 2098 C GLY A 134 7.405 19.721 -3.176 1.00 0.00 C ATOM 2099 O GLY A 134 7.590 19.629 -1.963 1.00 0.00 O ATOM 0 H GLY A 134 7.845 18.095 -5.075 1.00 0.00 H new ATOM 0 HA2 GLY A 134 5.508 19.534 -4.151 1.00 0.00 H new ATOM 0 HA3 GLY A 134 5.935 18.165 -3.145 1.00 0.00 H new ATOM 2103 N ALA A 135 8.110 20.537 -3.961 1.00 0.00 N ATOM 2104 CA ALA A 135 9.173 21.393 -3.427 1.00 0.00 C ATOM 2105 C ALA A 135 9.570 22.496 -4.416 1.00 0.00 C ATOM 2106 O ALA A 135 10.681 23.026 -4.353 1.00 0.00 O ATOM 2107 CB ALA A 135 10.387 20.547 -3.063 1.00 0.00 C ATOM 0 H ALA A 135 7.965 20.624 -4.967 1.00 0.00 H new ATOM 0 HA ALA A 135 8.789 21.881 -2.531 1.00 0.00 H new ATOM 0 HB1 ALA A 135 11.173 21.190 -2.667 1.00 0.00 H new ATOM 0 HB2 ALA A 135 10.105 19.812 -2.309 1.00 0.00 H new ATOM 0 HB3 ALA A 135 10.752 20.033 -3.952 1.00 0.00 H new ATOM 2113 N ASN A 136 8.653 22.834 -5.321 1.00 0.00 N ATOM 2114 CA ASN A 136 8.896 23.872 -6.326 1.00 0.00 C ATOM 2115 C ASN A 136 7.627 24.149 -7.136 1.00 0.00 C ATOM 2116 O ASN A 136 7.694 24.473 -8.324 1.00 0.00 O ATOM 2117 CB ASN A 136 10.037 23.458 -7.265 1.00 0.00 C ATOM 2118 CG ASN A 136 9.929 22.011 -7.711 1.00 0.00 C ATOM 2119 OD1 ASN A 136 10.608 21.134 -7.177 1.00 0.00 O ATOM 2120 ND2 ASN A 136 9.071 21.753 -8.691 1.00 0.00 N ATOM 0 H ASN A 136 7.730 22.403 -5.380 1.00 0.00 H new ATOM 0 HA ASN A 136 9.184 24.785 -5.805 1.00 0.00 H new ATOM 0 HB2 ASN A 136 10.035 24.106 -8.142 1.00 0.00 H new ATOM 0 HB3 ASN A 136 10.991 23.609 -6.760 1.00 0.00 H new ATOM 0 HD21 ASN A 136 8.955 20.798 -9.029 1.00 0.00 H new ATOM 0 HD22 ASN A 136 8.528 22.510 -9.106 1.00 0.00 H new ATOM 2127 N TYR A 137 6.473 24.020 -6.483 1.00 0.00 N ATOM 2128 CA TYR A 137 5.193 24.255 -7.131 1.00 0.00 C ATOM 2129 C TYR A 137 5.017 25.741 -7.449 1.00 0.00 C ATOM 2130 O TYR A 137 4.592 26.099 -8.549 1.00 0.00 O ATOM 2131 CB TYR A 137 4.062 23.747 -6.231 1.00 0.00 C ATOM 2132 CG TYR A 137 2.687 24.197 -6.657 1.00 0.00 C ATOM 2133 CD1 TYR A 137 2.180 25.414 -6.234 1.00 0.00 C ATOM 2134 CD2 TYR A 137 1.902 23.404 -7.479 1.00 0.00 C ATOM 2135 CE1 TYR A 137 0.922 25.834 -6.620 1.00 0.00 C ATOM 2136 CE2 TYR A 137 0.643 23.813 -7.871 1.00 0.00 C ATOM 2137 CZ TYR A 137 0.157 25.029 -7.439 1.00 0.00 C ATOM 2138 OH TYR A 137 -1.094 25.442 -7.829 1.00 0.00 O ATOM 0 H TYR A 137 6.403 23.753 -5.501 1.00 0.00 H new ATOM 0 HA TYR A 137 5.162 23.709 -8.074 1.00 0.00 H new ATOM 0 HB2 TYR A 137 4.087 22.657 -6.214 1.00 0.00 H new ATOM 0 HB3 TYR A 137 4.244 24.086 -5.211 1.00 0.00 H new ATOM 0 HD1 TYR A 137 2.777 26.045 -5.592 1.00 0.00 H new ATOM 0 HD2 TYR A 137 2.281 22.451 -7.818 1.00 0.00 H new ATOM 0 HE1 TYR A 137 0.540 26.786 -6.283 1.00 0.00 H new ATOM 0 HE2 TYR A 137 0.043 23.185 -8.512 1.00 0.00 H new ATOM 0 HH TYR A 137 -1.499 24.760 -8.405 1.00 0.00 H new ATOM 2148 N ASP A 138 5.356 26.599 -6.483 1.00 0.00 N ATOM 2149 CA ASP A 138 5.247 28.044 -6.660 1.00 0.00 C ATOM 2150 C ASP A 138 6.629 28.698 -6.696 1.00 0.00 C ATOM 2151 O ASP A 138 7.587 28.179 -6.119 1.00 0.00 O ATOM 2152 CB ASP A 138 4.416 28.664 -5.533 1.00 0.00 C ATOM 2153 CG ASP A 138 4.313 30.175 -5.656 1.00 0.00 C ATOM 2154 OD1 ASP A 138 3.525 30.649 -6.499 1.00 0.00 O ATOM 2155 OD2 ASP A 138 5.029 30.883 -4.917 1.00 0.00 O ATOM 0 H ASP A 138 5.709 26.314 -5.569 1.00 0.00 H new ATOM 0 HA ASP A 138 4.749 28.224 -7.613 1.00 0.00 H new ATOM 0 HB2 ASP A 138 3.415 28.232 -5.543 1.00 0.00 H new ATOM 0 HB3 ASP A 138 4.864 28.410 -4.572 1.00 0.00 H new ATOM 2160 N ALA A 139 6.717 29.843 -7.371 1.00 0.00 N ATOM 2161 CA ALA A 139 7.973 30.586 -7.479 1.00 0.00 C ATOM 2162 C ALA A 139 7.755 31.962 -8.114 1.00 0.00 C ATOM 2163 O ALA A 139 8.610 32.459 -8.849 1.00 0.00 O ATOM 2164 CB ALA A 139 8.993 29.782 -8.277 1.00 0.00 C ATOM 0 H ALA A 139 5.931 30.278 -7.853 1.00 0.00 H new ATOM 0 HA ALA A 139 8.359 30.745 -6.472 1.00 0.00 H new ATOM 0 HB1 ALA A 139 9.923 30.345 -8.350 1.00 0.00 H new ATOM 0 HB2 ALA A 139 9.182 28.833 -7.775 1.00 0.00 H new ATOM 0 HB3 ALA A 139 8.604 29.592 -9.277 1.00 0.00 H new ATOM 2170 N GLN A 140 6.605 32.577 -7.824 1.00 0.00 N ATOM 2171 CA GLN A 140 6.278 33.898 -8.363 1.00 0.00 C ATOM 2172 C GLN A 140 5.749 34.836 -7.277 1.00 0.00 C ATOM 2173 O GLN A 140 5.173 35.885 -7.573 1.00 0.00 O ATOM 2174 CB GLN A 140 5.238 33.765 -9.476 1.00 0.00 C ATOM 2175 CG GLN A 140 5.824 33.752 -10.879 1.00 0.00 C ATOM 2176 CD GLN A 140 5.198 32.688 -11.763 1.00 0.00 C ATOM 2177 OE1 GLN A 140 4.038 32.317 -11.581 1.00 0.00 O ATOM 2178 NE2 GLN A 140 5.962 32.191 -12.730 1.00 0.00 N ATOM 0 H GLN A 140 5.886 32.181 -7.219 1.00 0.00 H new ATOM 0 HA GLN A 140 7.196 34.328 -8.764 1.00 0.00 H new ATOM 0 HB2 GLN A 140 4.673 32.846 -9.322 1.00 0.00 H new ATOM 0 HB3 GLN A 140 4.531 34.591 -9.397 1.00 0.00 H new ATOM 0 HG2 GLN A 140 5.681 34.730 -11.338 1.00 0.00 H new ATOM 0 HG3 GLN A 140 6.899 33.582 -10.818 1.00 0.00 H new ATOM 0 HE21 GLN A 140 6.918 32.526 -12.847 1.00 0.00 H new ATOM 0 HE22 GLN A 140 5.592 31.475 -13.355 1.00 0.00 H new ATOM 2187 N THR A 141 5.949 34.453 -6.023 1.00 0.00 N ATOM 2188 CA THR A 141 5.495 35.254 -4.886 1.00 0.00 C ATOM 2189 C THR A 141 6.266 34.906 -3.611 1.00 0.00 C ATOM 2190 O THR A 141 6.630 35.796 -2.840 1.00 0.00 O ATOM 2191 CB THR A 141 3.987 35.069 -4.660 1.00 0.00 C ATOM 2192 OG1 THR A 141 3.583 35.648 -3.429 1.00 0.00 O ATOM 2193 CG2 THR A 141 3.545 33.619 -4.644 1.00 0.00 C ATOM 0 H THR A 141 6.425 33.589 -5.763 1.00 0.00 H new ATOM 0 HA THR A 141 5.691 36.300 -5.123 1.00 0.00 H new ATOM 0 HB THR A 141 3.516 35.566 -5.508 1.00 0.00 H new ATOM 0 HG1 THR A 141 2.619 35.519 -3.308 1.00 0.00 H new ATOM 0 HG21 THR A 141 2.469 33.569 -4.480 1.00 0.00 H new ATOM 0 HG22 THR A 141 3.789 33.154 -5.599 1.00 0.00 H new ATOM 0 HG23 THR A 141 4.060 33.091 -3.841 1.00 0.00 H new ATOM 2201 N GLU A 142 6.508 33.612 -3.393 1.00 0.00 N ATOM 2202 CA GLU A 142 7.234 33.152 -2.211 1.00 0.00 C ATOM 2203 C GLU A 142 8.600 33.833 -2.103 1.00 0.00 C ATOM 2204 O GLU A 142 8.987 34.201 -0.974 1.00 0.00 O ATOM 2205 CB GLU A 142 7.406 31.631 -2.251 1.00 0.00 C ATOM 2206 CG GLU A 142 8.018 31.116 -3.548 1.00 0.00 C ATOM 2207 CD GLU A 142 8.772 29.816 -3.363 1.00 0.00 C ATOM 2208 OE1 GLU A 142 8.132 28.805 -3.006 1.00 0.00 O ATOM 2209 OE2 GLU A 142 10.002 29.805 -3.578 1.00 0.00 O ATOM 0 H GLU A 142 6.211 32.865 -4.021 1.00 0.00 H new ATOM 0 HA GLU A 142 6.649 33.421 -1.331 1.00 0.00 H new ATOM 0 HB2 GLU A 142 8.035 31.324 -1.416 1.00 0.00 H new ATOM 0 HB3 GLU A 142 6.433 31.161 -2.107 1.00 0.00 H new ATOM 0 HG2 GLU A 142 7.228 30.971 -4.285 1.00 0.00 H new ATOM 0 HG3 GLU A 142 8.695 31.870 -3.950 1.00 0.00 H new TER 2216 GLU A 142