USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 936 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 153 MET CE :methyl 150:sc= -3.77 (180deg=-5.32!) USER MOD Set 1.2: A 154 MET CE :methyl 143:sc= -2.34 (180deg=-3.36!) USER MOD Set 2.1: A 5 TYR OH : rot 130:sc= 0.674 USER MOD Set 2.2: A 90 LYS NZ :NH3+ 134:sc= 0.641 (180deg=-0.574) USER MOD Set 3.1: A 80 MET CE :methyl -116:sc= -0.881 (180deg=-2.66!) USER MOD Set 3.2: A 81 MET CE :methyl -153:sc= -3.31 (180deg=-4.12!) USER MOD Single : A 1 MET CE :methyl 167:sc= -1.41 (180deg=-1.87!) USER MOD Single : A 1 MET N :NH3+ 171:sc= 1.21 (180deg=1.05) USER MOD Single : A 6 LYS NZ :NH3+ -168:sc= 0.0474 (180deg=0.032) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 THR OG1 : rot -170:sc= -0.67 USER MOD Single : A 16 GLN : amide:sc= -4.64! C(o=-4.6!,f=-12!) USER MOD Single : A 17 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.00993) USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 21 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0886) USER MOD Single : A 35 SER OG : rot 117:sc= 1.04 USER MOD Single : A 37 SER OG : rot -91:sc= 1.18 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 153:sc= 1.19 (180deg=1.17) USER MOD Single : A 45 MET CE :methyl -178:sc= -2.04! (180deg=-2.07!) USER MOD Single : A 47 MET CE :methyl 180:sc= -1.51 (180deg=-1.51) USER MOD Single : A 50 GLN : amide:sc= 0.492 K(o=0.49,f=-0.14) USER MOD Single : A 51 ASN : amide:sc= -0.13 X(o=-0.13,f=-0.14) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.0736 USER MOD Single : A 58 GLN : amide:sc= -0.312 K(o=-0.31,f=-0.89) USER MOD Single : A 60 MET CE :methyl -122:sc= -2.76 (180deg=-5.99!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 128:sc= -1.37! USER MOD Single : A 85 MET CE :methyl -109:sc= -7.87! (180deg=-11.6!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 137 LYS NZ :NH3+ -151:sc= 0.999 (180deg=-0.808!) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 THR OG1 : rot 102:sc= 1.31 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 155 GLN : amide:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 163 LYS NZ :NH3+ 169:sc= -0.0198 (180deg=-0.165) USER MOD Single : A 165 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.594 -10.492 -10.316 1.00 0.00 N ATOM 2 CA MET A 1 -3.152 -10.036 -9.023 1.00 0.00 C ATOM 3 C MET A 1 -3.633 -11.221 -8.202 1.00 0.00 C ATOM 4 O MET A 1 -4.325 -12.103 -8.714 1.00 0.00 O ATOM 5 CB MET A 1 -4.315 -9.071 -9.251 1.00 0.00 C ATOM 6 CG MET A 1 -4.826 -8.427 -7.971 1.00 0.00 C ATOM 7 SD MET A 1 -6.286 -7.405 -8.229 1.00 0.00 S ATOM 8 CE MET A 1 -6.348 -6.518 -6.674 1.00 0.00 C ATOM 0 H1 MET A 1 -2.411 -9.669 -10.925 1.00 0.00 H new ATOM 0 H2 MET A 1 -1.704 -11.003 -10.149 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.274 -11.125 -10.784 1.00 0.00 H new ATOM 0 HA MET A 1 -2.361 -9.521 -8.478 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.998 -8.289 -9.941 1.00 0.00 H new ATOM 0 HB3 MET A 1 -5.134 -9.607 -9.731 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.059 -9.207 -7.247 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.034 -7.816 -7.537 1.00 0.00 H new ATOM 0 HE1 MET A 1 -7.047 -5.686 -6.757 1.00 0.00 H new ATOM 0 HE2 MET A 1 -6.678 -7.192 -5.884 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.356 -6.135 -6.434 1.00 0.00 H new ATOM 20 N ASP A 2 -3.261 -11.239 -6.931 1.00 0.00 N ATOM 21 CA ASP A 2 -3.708 -12.278 -6.015 1.00 0.00 C ATOM 22 C ASP A 2 -5.195 -12.107 -5.744 1.00 0.00 C ATOM 23 O ASP A 2 -5.613 -11.108 -5.158 1.00 0.00 O ATOM 24 CB ASP A 2 -2.935 -12.207 -4.697 1.00 0.00 C ATOM 25 CG ASP A 2 -1.433 -12.325 -4.874 1.00 0.00 C ATOM 26 OD1 ASP A 2 -0.765 -11.279 -5.036 1.00 0.00 O ATOM 27 OD2 ASP A 2 -0.913 -13.458 -4.832 1.00 0.00 O1- ATOM 0 H ASP A 2 -2.648 -10.542 -6.509 1.00 0.00 H new ATOM 0 HA ASP A 2 -3.524 -13.250 -6.472 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -3.162 -11.263 -4.201 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -3.280 -13.004 -4.038 1.00 0.00 H new ATOM 32 N ASP A 3 -5.997 -13.073 -6.162 1.00 0.00 N ATOM 33 CA ASP A 3 -7.445 -12.938 -6.075 1.00 0.00 C ATOM 34 C ASP A 3 -7.951 -13.155 -4.659 1.00 0.00 C ATOM 35 O ASP A 3 -9.102 -12.857 -4.365 1.00 0.00 O ATOM 36 CB ASP A 3 -8.156 -13.876 -7.048 1.00 0.00 C ATOM 37 CG ASP A 3 -7.809 -15.326 -6.814 1.00 0.00 C ATOM 38 OD1 ASP A 3 -8.647 -16.054 -6.246 1.00 0.00 O ATOM 39 OD2 ASP A 3 -6.687 -15.737 -7.187 1.00 0.00 O1- ATOM 0 H ASP A 3 -5.674 -13.954 -6.562 1.00 0.00 H new ATOM 0 HA ASP A 3 -7.681 -11.912 -6.359 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -9.234 -13.744 -6.952 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -7.891 -13.603 -8.069 1.00 0.00 H new ATOM 44 N ILE A 4 -7.099 -13.673 -3.787 1.00 0.00 N ATOM 45 CA ILE A 4 -7.393 -13.672 -2.356 1.00 0.00 C ATOM 46 C ILE A 4 -7.613 -12.231 -1.904 1.00 0.00 C ATOM 47 O ILE A 4 -8.523 -11.916 -1.142 1.00 0.00 O ATOM 48 CB ILE A 4 -6.246 -14.319 -1.530 1.00 0.00 C ATOM 49 CG1 ILE A 4 -6.446 -14.102 -0.027 1.00 0.00 C ATOM 50 CG2 ILE A 4 -4.900 -13.780 -1.965 1.00 0.00 C ATOM 51 CD1 ILE A 4 -7.612 -14.870 0.549 1.00 0.00 C ATOM 0 H ILE A 4 -6.206 -14.096 -4.039 1.00 0.00 H new ATOM 0 HA ILE A 4 -8.290 -14.267 -2.184 1.00 0.00 H new ATOM 0 HB ILE A 4 -6.270 -15.392 -1.721 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -5.536 -14.394 0.497 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -6.595 -13.039 0.161 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.113 -14.247 -1.373 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -4.742 -14.004 -3.020 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -4.875 -12.701 -1.815 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -7.690 -14.666 1.617 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -8.532 -14.561 0.052 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -7.457 -15.938 0.394 1.00 0.00 H new ATOM 63 N TYR A 5 -6.775 -11.367 -2.432 1.00 0.00 N ATOM 64 CA TYR A 5 -6.809 -9.955 -2.160 1.00 0.00 C ATOM 65 C TYR A 5 -7.834 -9.261 -3.031 1.00 0.00 C ATOM 66 O TYR A 5 -8.477 -8.306 -2.605 1.00 0.00 O ATOM 67 CB TYR A 5 -5.418 -9.430 -2.423 1.00 0.00 C ATOM 68 CG TYR A 5 -4.389 -10.037 -1.507 1.00 0.00 C ATOM 69 CD1 TYR A 5 -3.104 -10.244 -1.946 1.00 0.00 C ATOM 70 CD2 TYR A 5 -4.715 -10.422 -0.211 1.00 0.00 C ATOM 71 CE1 TYR A 5 -2.162 -10.824 -1.141 1.00 0.00 C ATOM 72 CE2 TYR A 5 -3.775 -10.998 0.613 1.00 0.00 C ATOM 73 CZ TYR A 5 -2.496 -11.200 0.146 1.00 0.00 C ATOM 74 OH TYR A 5 -1.554 -11.783 0.964 1.00 0.00 O ATOM 0 H TYR A 5 -6.034 -11.638 -3.078 1.00 0.00 H new ATOM 0 HA TYR A 5 -7.103 -9.762 -1.128 1.00 0.00 H new ATOM 0 HB2 TYR A 5 -5.145 -9.636 -3.458 1.00 0.00 H new ATOM 0 HB3 TYR A 5 -5.413 -8.347 -2.302 1.00 0.00 H new ATOM 0 HD1 TYR A 5 -2.832 -9.943 -2.947 1.00 0.00 H new ATOM 0 HD2 TYR A 5 -5.720 -10.267 0.154 1.00 0.00 H new ATOM 0 HE1 TYR A 5 -1.160 -10.987 -1.510 1.00 0.00 H new ATOM 0 HE2 TYR A 5 -4.039 -11.289 1.619 1.00 0.00 H new ATOM 0 HH TYR A 5 -1.542 -11.322 1.829 1.00 0.00 H new ATOM 84 N LYS A 6 -7.993 -9.750 -4.246 1.00 0.00 N ATOM 85 CA LYS A 6 -8.997 -9.208 -5.135 1.00 0.00 C ATOM 86 C LYS A 6 -10.394 -9.496 -4.596 1.00 0.00 C ATOM 87 O LYS A 6 -11.307 -8.717 -4.815 1.00 0.00 O ATOM 88 CB LYS A 6 -8.850 -9.762 -6.532 1.00 0.00 C ATOM 89 CG LYS A 6 -9.567 -8.909 -7.555 1.00 0.00 C ATOM 90 CD LYS A 6 -10.133 -9.747 -8.677 1.00 0.00 C ATOM 91 CE LYS A 6 -11.375 -10.469 -8.201 1.00 0.00 C ATOM 92 NZ LYS A 6 -12.093 -11.163 -9.300 1.00 0.00 N1+ ATOM 0 H LYS A 6 -7.443 -10.516 -4.636 1.00 0.00 H new ATOM 0 HA LYS A 6 -8.852 -8.129 -5.185 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -7.792 -9.824 -6.788 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -9.246 -10.777 -6.564 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -10.372 -8.357 -7.070 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.876 -8.171 -7.963 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -10.374 -9.113 -9.531 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -9.389 -10.468 -9.016 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -11.097 -11.196 -7.438 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -12.048 -9.753 -7.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -13.030 -11.465 -8.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -12.205 -10.515 -10.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -11.547 -11.996 -9.600 1.00 0.00 H new ATOM 106 N ALA A 7 -10.554 -10.615 -3.887 1.00 0.00 N ATOM 107 CA ALA A 7 -11.830 -10.948 -3.254 1.00 0.00 C ATOM 108 C ALA A 7 -12.033 -10.145 -1.979 1.00 0.00 C ATOM 109 O ALA A 7 -13.163 -9.887 -1.564 1.00 0.00 O ATOM 110 CB ALA A 7 -11.936 -12.426 -2.986 1.00 0.00 C ATOM 0 H ALA A 7 -9.817 -11.304 -3.737 1.00 0.00 H new ATOM 0 HA ALA A 7 -12.626 -10.679 -3.949 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -12.895 -12.643 -2.515 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -11.862 -12.973 -3.926 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -11.128 -12.734 -2.322 1.00 0.00 H new ATOM 116 N ALA A 8 -10.935 -9.759 -1.355 1.00 0.00 N ATOM 117 CA ALA A 8 -10.991 -8.773 -0.295 1.00 0.00 C ATOM 118 C ALA A 8 -11.496 -7.459 -0.885 1.00 0.00 C ATOM 119 O ALA A 8 -12.324 -6.768 -0.298 1.00 0.00 O ATOM 120 CB ALA A 8 -9.619 -8.605 0.339 1.00 0.00 C ATOM 0 H ALA A 8 -10.001 -10.111 -1.563 1.00 0.00 H new ATOM 0 HA ALA A 8 -11.674 -9.098 0.490 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -9.674 -7.861 1.134 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -9.291 -9.558 0.755 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -8.907 -8.275 -0.417 1.00 0.00 H new ATOM 126 N VAL A 9 -10.999 -7.158 -2.078 1.00 0.00 N ATOM 127 CA VAL A 9 -11.474 -6.044 -2.895 1.00 0.00 C ATOM 128 C VAL A 9 -12.943 -6.216 -3.263 1.00 0.00 C ATOM 129 O VAL A 9 -13.680 -5.243 -3.394 1.00 0.00 O ATOM 130 CB VAL A 9 -10.621 -5.957 -4.176 1.00 0.00 C ATOM 131 CG1 VAL A 9 -11.295 -5.137 -5.265 1.00 0.00 C ATOM 132 CG2 VAL A 9 -9.258 -5.401 -3.830 1.00 0.00 C ATOM 0 H VAL A 9 -10.244 -7.687 -2.513 1.00 0.00 H new ATOM 0 HA VAL A 9 -11.378 -5.124 -2.318 1.00 0.00 H new ATOM 0 HB VAL A 9 -10.508 -6.962 -4.582 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -10.654 -5.106 -6.146 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -12.250 -5.594 -5.526 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -11.465 -4.123 -4.904 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -8.651 -5.338 -4.733 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -9.370 -4.407 -3.397 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -8.769 -6.057 -3.110 1.00 0.00 H new ATOM 142 N GLU A 10 -13.349 -7.459 -3.435 1.00 0.00 N ATOM 143 CA GLU A 10 -14.734 -7.785 -3.754 1.00 0.00 C ATOM 144 C GLU A 10 -15.665 -7.410 -2.602 1.00 0.00 C ATOM 145 O GLU A 10 -16.848 -7.132 -2.807 1.00 0.00 O ATOM 146 CB GLU A 10 -14.866 -9.262 -4.101 1.00 0.00 C ATOM 147 CG GLU A 10 -13.991 -9.645 -5.270 1.00 0.00 C ATOM 148 CD GLU A 10 -14.173 -11.078 -5.738 1.00 0.00 C ATOM 149 OE1 GLU A 10 -14.379 -11.975 -4.895 1.00 0.00 O ATOM 150 OE2 GLU A 10 -14.104 -11.314 -6.963 1.00 0.00 O1- ATOM 0 H GLU A 10 -12.736 -8.270 -3.359 1.00 0.00 H new ATOM 0 HA GLU A 10 -15.031 -7.200 -4.624 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -14.597 -9.864 -3.233 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -15.906 -9.488 -4.336 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -14.201 -8.973 -6.102 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.947 -9.494 -4.994 1.00 0.00 H new ATOM 157 N GLN A 11 -15.120 -7.410 -1.392 1.00 0.00 N ATOM 158 CA GLN A 11 -15.839 -6.914 -0.224 1.00 0.00 C ATOM 159 C GLN A 11 -15.660 -5.415 -0.109 1.00 0.00 C ATOM 160 O GLN A 11 -16.581 -4.703 0.298 1.00 0.00 O ATOM 161 CB GLN A 11 -15.358 -7.589 1.047 1.00 0.00 C ATOM 162 CG GLN A 11 -16.110 -7.114 2.248 1.00 0.00 C ATOM 163 CD GLN A 11 -15.659 -7.782 3.533 1.00 0.00 C ATOM 164 OE1 GLN A 11 -16.188 -8.822 3.923 1.00 0.00 O ATOM 165 NE2 GLN A 11 -14.680 -7.191 4.198 1.00 0.00 N ATOM 0 H GLN A 11 -14.179 -7.749 -1.193 1.00 0.00 H new ATOM 0 HA GLN A 11 -16.896 -7.148 -0.352 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -15.472 -8.669 0.950 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -14.295 -7.392 1.183 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -15.987 -6.035 2.343 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -17.174 -7.302 2.101 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -14.268 -6.329 3.840 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -14.337 -7.597 5.069 1.00 0.00 H new ATOM 174 N LEU A 12 -14.471 -4.943 -0.461 1.00 0.00 N ATOM 175 CA LEU A 12 -14.221 -3.534 -0.560 1.00 0.00 C ATOM 176 C LEU A 12 -15.195 -2.914 -1.525 1.00 0.00 C ATOM 177 O LEU A 12 -15.555 -3.497 -2.546 1.00 0.00 O ATOM 178 CB LEU A 12 -12.804 -3.266 -1.032 1.00 0.00 C ATOM 179 CG LEU A 12 -11.712 -3.685 -0.071 1.00 0.00 C ATOM 180 CD1 LEU A 12 -10.342 -3.326 -0.631 1.00 0.00 C ATOM 181 CD2 LEU A 12 -11.964 -3.039 1.270 1.00 0.00 C ATOM 0 H LEU A 12 -13.667 -5.531 -0.682 1.00 0.00 H new ATOM 0 HA LEU A 12 -14.347 -3.093 0.429 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -12.650 -3.783 -1.979 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -12.701 -2.199 -1.231 1.00 0.00 H new ATOM 0 HG LEU A 12 -11.725 -4.767 0.060 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -9.569 -3.634 0.073 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -10.192 -3.838 -1.582 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -10.283 -2.249 -0.786 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -11.182 -3.335 1.969 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -11.959 -1.955 1.158 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -12.933 -3.360 1.652 1.00 0.00 H new ATOM 193 N THR A 13 -15.636 -1.744 -1.188 1.00 0.00 N ATOM 194 CA THR A 13 -16.616 -1.077 -1.983 1.00 0.00 C ATOM 195 C THR A 13 -15.944 -0.042 -2.846 1.00 0.00 C ATOM 196 O THR A 13 -14.786 0.277 -2.609 1.00 0.00 O ATOM 197 CB THR A 13 -17.681 -0.449 -1.069 1.00 0.00 C ATOM 198 OG1 THR A 13 -17.220 0.815 -0.573 1.00 0.00 O ATOM 199 CG2 THR A 13 -17.946 -1.368 0.123 1.00 0.00 C ATOM 0 H THR A 13 -15.331 -1.229 -0.363 1.00 0.00 H new ATOM 0 HA THR A 13 -17.115 -1.790 -2.639 1.00 0.00 H new ATOM 0 HB THR A 13 -18.595 -0.310 -1.647 1.00 0.00 H new ATOM 0 HG1 THR A 13 -17.828 1.133 0.127 1.00 0.00 H new ATOM 0 HG21 THR A 13 -18.701 -0.919 0.768 1.00 0.00 H new ATOM 0 HG22 THR A 13 -18.302 -2.334 -0.235 1.00 0.00 H new ATOM 0 HG23 THR A 13 -17.024 -1.507 0.687 1.00 0.00 H new ATOM 207 N GLU A 14 -16.631 0.461 -3.857 1.00 0.00 N ATOM 208 CA GLU A 14 -16.046 1.486 -4.704 1.00 0.00 C ATOM 209 C GLU A 14 -15.636 2.681 -3.863 1.00 0.00 C ATOM 210 O GLU A 14 -14.722 3.404 -4.222 1.00 0.00 O ATOM 211 CB GLU A 14 -17.003 1.915 -5.814 1.00 0.00 C ATOM 212 CG GLU A 14 -17.358 0.791 -6.759 1.00 0.00 C ATOM 213 CD GLU A 14 -18.090 1.271 -7.991 1.00 0.00 C ATOM 214 OE1 GLU A 14 -19.325 1.433 -7.937 1.00 0.00 O ATOM 215 OE2 GLU A 14 -17.429 1.479 -9.029 1.00 0.00 O1- ATOM 0 H GLU A 14 -17.579 0.182 -4.109 1.00 0.00 H new ATOM 0 HA GLU A 14 -15.162 1.064 -5.182 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -17.916 2.307 -5.366 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -16.551 2.729 -6.381 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -16.447 0.275 -7.061 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -17.977 0.063 -6.234 1.00 0.00 H new ATOM 222 N GLU A 15 -16.299 2.859 -2.728 1.00 0.00 N ATOM 223 CA GLU A 15 -15.917 3.887 -1.774 1.00 0.00 C ATOM 224 C GLU A 15 -14.635 3.492 -1.049 1.00 0.00 C ATOM 225 O GLU A 15 -13.693 4.273 -0.991 1.00 0.00 O ATOM 226 CB GLU A 15 -17.039 4.114 -0.765 1.00 0.00 C ATOM 227 CG GLU A 15 -18.325 4.610 -1.398 1.00 0.00 C ATOM 228 CD GLU A 15 -19.448 4.747 -0.397 1.00 0.00 C ATOM 229 OE1 GLU A 15 -19.531 5.796 0.272 1.00 0.00 O ATOM 230 OE2 GLU A 15 -20.262 3.809 -0.279 1.00 0.00 O1- ATOM 0 H GLU A 15 -17.106 2.302 -2.447 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.739 4.814 -2.319 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -17.238 3.181 -0.238 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -16.707 4.837 -0.020 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -18.144 5.575 -1.871 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -18.627 3.921 -2.186 1.00 0.00 H new ATOM 237 N GLN A 16 -14.609 2.281 -0.488 1.00 0.00 N ATOM 238 CA GLN A 16 -13.407 1.747 0.138 1.00 0.00 C ATOM 239 C GLN A 16 -12.227 1.783 -0.824 1.00 0.00 C ATOM 240 O GLN A 16 -11.186 2.375 -0.548 1.00 0.00 O ATOM 241 CB GLN A 16 -13.645 0.322 0.583 1.00 0.00 C ATOM 242 CG GLN A 16 -14.771 0.213 1.571 1.00 0.00 C ATOM 243 CD GLN A 16 -14.798 -1.120 2.285 1.00 0.00 C ATOM 244 OE1 GLN A 16 -15.419 -2.071 1.823 1.00 0.00 O ATOM 245 NE2 GLN A 16 -14.122 -1.197 3.420 1.00 0.00 N ATOM 0 H GLN A 16 -15.412 1.653 -0.457 1.00 0.00 H new ATOM 0 HA GLN A 16 -13.173 2.369 1.002 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -13.867 -0.296 -0.287 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -12.733 -0.074 1.030 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -14.681 1.012 2.307 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -15.718 0.362 1.053 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -13.618 -0.382 3.770 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -14.105 -2.071 3.945 1.00 0.00 H new ATOM 254 N LYS A 17 -12.416 1.119 -1.951 1.00 0.00 N ATOM 255 CA LYS A 17 -11.473 1.111 -3.049 1.00 0.00 C ATOM 256 C LYS A 17 -11.052 2.527 -3.453 1.00 0.00 C ATOM 257 O LYS A 17 -9.866 2.794 -3.646 1.00 0.00 O ATOM 258 CB LYS A 17 -12.119 0.370 -4.210 1.00 0.00 C ATOM 259 CG LYS A 17 -12.290 -1.105 -3.917 1.00 0.00 C ATOM 260 CD LYS A 17 -12.913 -1.837 -5.088 1.00 0.00 C ATOM 261 CE LYS A 17 -12.009 -1.740 -6.298 1.00 0.00 C ATOM 262 NZ LYS A 17 -12.459 -2.609 -7.419 1.00 0.00 N1+ ATOM 0 H LYS A 17 -13.249 0.559 -2.129 1.00 0.00 H new ATOM 0 HA LYS A 17 -10.558 0.605 -2.742 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -13.092 0.812 -4.426 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -11.508 0.493 -5.104 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -11.320 -1.546 -3.686 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -12.916 -1.231 -3.034 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -13.076 -2.883 -4.829 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -13.889 -1.409 -5.317 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -11.972 -0.705 -6.638 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -10.994 -2.018 -6.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -11.762 -2.571 -8.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -12.551 -3.589 -7.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -13.380 -2.275 -7.769 1.00 0.00 H new ATOM 276 N ASN A 18 -12.023 3.425 -3.569 1.00 0.00 N ATOM 277 CA ASN A 18 -11.746 4.832 -3.864 1.00 0.00 C ATOM 278 C ASN A 18 -10.883 5.440 -2.792 1.00 0.00 C ATOM 279 O ASN A 18 -9.948 6.179 -3.079 1.00 0.00 O ATOM 280 CB ASN A 18 -13.039 5.626 -3.941 1.00 0.00 C ATOM 281 CG ASN A 18 -12.829 7.131 -3.994 1.00 0.00 C ATOM 282 OD1 ASN A 18 -12.834 7.810 -2.968 1.00 0.00 O ATOM 283 ND2 ASN A 18 -12.659 7.665 -5.192 1.00 0.00 N ATOM 0 H ASN A 18 -13.014 3.206 -3.463 1.00 0.00 H new ATOM 0 HA ASN A 18 -11.228 4.870 -4.822 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -13.595 5.314 -4.825 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -13.656 5.384 -3.075 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -12.526 8.672 -5.287 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -12.661 7.070 -6.020 1.00 0.00 H new ATOM 290 N GLU A 19 -11.218 5.129 -1.556 1.00 0.00 N ATOM 291 CA GLU A 19 -10.514 5.669 -0.425 1.00 0.00 C ATOM 292 C GLU A 19 -9.033 5.315 -0.514 1.00 0.00 C ATOM 293 O GLU A 19 -8.158 6.138 -0.232 1.00 0.00 O ATOM 294 CB GLU A 19 -11.119 5.138 0.863 1.00 0.00 C ATOM 295 CG GLU A 19 -10.640 5.844 2.115 1.00 0.00 C ATOM 296 CD GLU A 19 -11.468 5.477 3.327 1.00 0.00 C ATOM 297 OE1 GLU A 19 -12.363 6.265 3.705 1.00 0.00 O ATOM 298 OE2 GLU A 19 -11.256 4.383 3.886 1.00 0.00 O1- ATOM 0 H GLU A 19 -11.982 4.498 -1.315 1.00 0.00 H new ATOM 0 HA GLU A 19 -10.608 6.755 -0.428 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -12.204 5.225 0.804 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -10.888 4.076 0.948 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -9.596 5.588 2.298 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -10.681 6.922 1.961 1.00 0.00 H new ATOM 305 N PHE A 20 -8.770 4.086 -0.939 1.00 0.00 N ATOM 306 CA PHE A 20 -7.409 3.621 -1.147 1.00 0.00 C ATOM 307 C PHE A 20 -6.782 4.299 -2.360 1.00 0.00 C ATOM 308 O PHE A 20 -5.613 4.655 -2.339 1.00 0.00 O ATOM 309 CB PHE A 20 -7.389 2.096 -1.300 1.00 0.00 C ATOM 310 CG PHE A 20 -7.795 1.391 -0.040 1.00 0.00 C ATOM 311 CD1 PHE A 20 -8.848 0.496 -0.041 1.00 0.00 C ATOM 312 CD2 PHE A 20 -7.128 1.637 1.153 1.00 0.00 C ATOM 313 CE1 PHE A 20 -9.234 -0.142 1.113 1.00 0.00 C ATOM 314 CE2 PHE A 20 -7.509 0.998 2.314 1.00 0.00 C ATOM 315 CZ PHE A 20 -8.566 0.107 2.297 1.00 0.00 C ATOM 0 H PHE A 20 -9.487 3.391 -1.147 1.00 0.00 H new ATOM 0 HA PHE A 20 -6.814 3.888 -0.274 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -8.060 1.806 -2.108 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -6.387 1.775 -1.586 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -9.375 0.295 -0.962 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -6.304 2.335 1.172 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -10.060 -0.838 1.095 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -6.982 1.193 3.236 1.00 0.00 H new ATOM 0 HZ PHE A 20 -8.869 -0.393 3.205 1.00 0.00 H new ATOM 325 N LYS A 21 -7.574 4.494 -3.404 1.00 0.00 N ATOM 326 CA LYS A 21 -7.106 5.156 -4.623 1.00 0.00 C ATOM 327 C LYS A 21 -6.701 6.578 -4.304 1.00 0.00 C ATOM 328 O LYS A 21 -5.631 7.050 -4.674 1.00 0.00 O ATOM 329 CB LYS A 21 -8.225 5.219 -5.641 1.00 0.00 C ATOM 330 CG LYS A 21 -7.763 5.311 -7.098 1.00 0.00 C ATOM 331 CD LYS A 21 -6.312 5.754 -7.258 1.00 0.00 C ATOM 332 CE LYS A 21 -6.069 6.387 -8.621 1.00 0.00 C ATOM 333 NZ LYS A 21 -6.484 5.495 -9.736 1.00 0.00 N1+ ATOM 0 H LYS A 21 -8.551 4.203 -3.435 1.00 0.00 H new ATOM 0 HA LYS A 21 -6.262 4.591 -5.019 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -8.850 4.333 -5.528 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -8.852 6.082 -5.418 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -7.890 4.338 -7.572 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -8.407 6.011 -7.630 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -6.060 6.468 -6.474 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -5.652 4.896 -7.132 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -6.617 7.327 -8.686 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -5.011 6.627 -8.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -6.134 5.879 -10.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -6.087 4.545 -9.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -7.522 5.435 -9.765 1.00 0.00 H new ATOM 347 N ALA A 22 -7.612 7.260 -3.657 1.00 0.00 N ATOM 348 CA ALA A 22 -7.377 8.623 -3.217 1.00 0.00 C ATOM 349 C ALA A 22 -6.066 8.722 -2.459 1.00 0.00 C ATOM 350 O ALA A 22 -5.241 9.574 -2.768 1.00 0.00 O ATOM 351 CB ALA A 22 -8.524 9.117 -2.362 1.00 0.00 C ATOM 0 H ALA A 22 -8.534 6.894 -3.419 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.312 9.258 -4.100 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -8.326 10.141 -2.044 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -9.447 9.089 -2.941 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -8.626 8.478 -1.485 1.00 0.00 H new ATOM 357 N ALA A 23 -5.861 7.833 -1.490 1.00 0.00 N ATOM 358 CA ALA A 23 -4.611 7.816 -0.739 1.00 0.00 C ATOM 359 C ALA A 23 -3.447 7.401 -1.621 1.00 0.00 C ATOM 360 O ALA A 23 -2.327 7.862 -1.420 1.00 0.00 O ATOM 361 CB ALA A 23 -4.700 6.895 0.464 1.00 0.00 C ATOM 0 H ALA A 23 -6.537 7.123 -1.209 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.437 8.832 -0.384 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -3.752 6.906 1.001 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -5.496 7.237 1.126 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -4.916 5.880 0.130 1.00 0.00 H new ATOM 367 N PHE A 24 -3.715 6.519 -2.580 1.00 0.00 N ATOM 368 CA PHE A 24 -2.729 6.165 -3.591 1.00 0.00 C ATOM 369 C PHE A 24 -2.140 7.430 -4.174 1.00 0.00 C ATOM 370 O PHE A 24 -0.929 7.638 -4.165 1.00 0.00 O ATOM 371 CB PHE A 24 -3.359 5.361 -4.736 1.00 0.00 C ATOM 372 CG PHE A 24 -2.424 5.135 -5.894 1.00 0.00 C ATOM 373 CD1 PHE A 24 -2.744 5.629 -7.147 1.00 0.00 C ATOM 374 CD2 PHE A 24 -1.228 4.449 -5.736 1.00 0.00 C ATOM 375 CE1 PHE A 24 -1.895 5.446 -8.215 1.00 0.00 C ATOM 376 CE2 PHE A 24 -0.379 4.265 -6.801 1.00 0.00 C ATOM 377 CZ PHE A 24 -0.714 4.760 -8.042 1.00 0.00 C ATOM 0 H PHE A 24 -4.609 6.037 -2.676 1.00 0.00 H new ATOM 0 HA PHE A 24 -1.963 5.556 -3.111 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.690 4.396 -4.353 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -4.246 5.884 -5.092 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -3.671 6.165 -7.288 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -0.962 4.056 -4.766 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -2.155 5.840 -9.187 1.00 0.00 H new ATOM 0 HE2 PHE A 24 0.551 3.732 -6.665 1.00 0.00 H new ATOM 0 HZ PHE A 24 -0.050 4.610 -8.880 1.00 0.00 H new ATOM 387 N ASP A 25 -3.042 8.258 -4.664 1.00 0.00 N ATOM 388 CA ASP A 25 -2.703 9.535 -5.277 1.00 0.00 C ATOM 389 C ASP A 25 -1.801 10.376 -4.379 1.00 0.00 C ATOM 390 O ASP A 25 -0.898 11.065 -4.852 1.00 0.00 O ATOM 391 CB ASP A 25 -3.965 10.323 -5.559 1.00 0.00 C ATOM 392 CG ASP A 25 -3.716 11.454 -6.529 1.00 0.00 C ATOM 393 OD1 ASP A 25 -3.298 11.183 -7.676 1.00 0.00 O ATOM 394 OD2 ASP A 25 -3.950 12.622 -6.157 1.00 0.00 O1- ATOM 0 H ASP A 25 -4.043 8.064 -4.649 1.00 0.00 H new ATOM 0 HA ASP A 25 -2.169 9.316 -6.202 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -4.726 9.657 -5.965 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -4.359 10.725 -4.625 1.00 0.00 H new ATOM 399 N ILE A 26 -2.051 10.297 -3.084 1.00 0.00 N ATOM 400 CA ILE A 26 -1.346 11.115 -2.108 1.00 0.00 C ATOM 401 C ILE A 26 0.013 10.507 -1.808 1.00 0.00 C ATOM 402 O ILE A 26 1.024 11.207 -1.703 1.00 0.00 O ATOM 403 CB ILE A 26 -2.133 11.223 -0.797 1.00 0.00 C ATOM 404 CG1 ILE A 26 -3.624 11.218 -1.093 1.00 0.00 C ATOM 405 CG2 ILE A 26 -1.745 12.493 -0.055 1.00 0.00 C ATOM 406 CD1 ILE A 26 -4.506 11.256 0.131 1.00 0.00 C ATOM 0 H ILE A 26 -2.744 9.668 -2.679 1.00 0.00 H new ATOM 0 HA ILE A 26 -1.231 12.111 -2.535 1.00 0.00 H new ATOM 0 HB ILE A 26 -1.894 10.368 -0.165 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -3.859 12.077 -1.722 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -3.864 10.325 -1.670 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -2.311 12.559 0.874 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.679 12.472 0.170 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -1.967 13.360 -0.677 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -5.552 11.250 -0.174 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -4.304 10.384 0.752 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -4.300 12.162 0.700 1.00 0.00 H new ATOM 418 N PHE A 27 0.017 9.186 -1.692 1.00 0.00 N ATOM 419 CA PHE A 27 1.229 8.413 -1.453 1.00 0.00 C ATOM 420 C PHE A 27 2.239 8.707 -2.553 1.00 0.00 C ATOM 421 O PHE A 27 3.448 8.697 -2.333 1.00 0.00 O ATOM 422 CB PHE A 27 0.874 6.924 -1.449 1.00 0.00 C ATOM 423 CG PHE A 27 1.693 6.063 -0.533 1.00 0.00 C ATOM 424 CD1 PHE A 27 1.271 5.808 0.762 1.00 0.00 C ATOM 425 CD2 PHE A 27 2.860 5.476 -0.973 1.00 0.00 C ATOM 426 CE1 PHE A 27 1.997 4.976 1.596 1.00 0.00 C ATOM 427 CE2 PHE A 27 3.589 4.650 -0.143 1.00 0.00 C ATOM 428 CZ PHE A 27 3.159 4.398 1.140 1.00 0.00 C ATOM 0 H PHE A 27 -0.826 8.616 -1.762 1.00 0.00 H new ATOM 0 HA PHE A 27 1.664 8.684 -0.491 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -0.175 6.820 -1.174 1.00 0.00 H new ATOM 0 HB3 PHE A 27 0.976 6.542 -2.465 1.00 0.00 H new ATOM 0 HD1 PHE A 27 0.363 6.265 1.126 1.00 0.00 H new ATOM 0 HD2 PHE A 27 3.207 5.665 -1.978 1.00 0.00 H new ATOM 0 HE1 PHE A 27 1.653 4.781 2.601 1.00 0.00 H new ATOM 0 HE2 PHE A 27 4.502 4.199 -0.502 1.00 0.00 H new ATOM 0 HZ PHE A 27 3.732 3.749 1.786 1.00 0.00 H new ATOM 438 N VAL A 28 1.710 9.001 -3.733 1.00 0.00 N ATOM 439 CA VAL A 28 2.520 9.244 -4.902 1.00 0.00 C ATOM 440 C VAL A 28 2.532 10.722 -5.292 1.00 0.00 C ATOM 441 O VAL A 28 2.890 11.070 -6.417 1.00 0.00 O ATOM 442 CB VAL A 28 2.004 8.414 -6.088 1.00 0.00 C ATOM 443 CG1 VAL A 28 2.023 6.939 -5.735 1.00 0.00 C ATOM 444 CG2 VAL A 28 0.599 8.853 -6.481 1.00 0.00 C ATOM 0 H VAL A 28 0.706 9.076 -3.899 1.00 0.00 H new ATOM 0 HA VAL A 28 3.539 8.948 -4.654 1.00 0.00 H new ATOM 0 HB VAL A 28 2.661 8.579 -6.942 1.00 0.00 H new ATOM 0 HG11 VAL A 28 1.656 6.358 -6.581 1.00 0.00 H new ATOM 0 HG12 VAL A 28 3.043 6.634 -5.501 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.384 6.764 -4.870 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.252 8.253 -7.322 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.075 8.716 -5.635 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.613 9.905 -6.767 1.00 0.00 H new ATOM 454 N LEU A 29 2.124 11.601 -4.389 1.00 0.00 N ATOM 455 CA LEU A 29 2.241 13.025 -4.656 1.00 0.00 C ATOM 456 C LEU A 29 3.701 13.421 -4.563 1.00 0.00 C ATOM 457 O LEU A 29 4.352 13.210 -3.535 1.00 0.00 O ATOM 458 CB LEU A 29 1.377 13.859 -3.706 1.00 0.00 C ATOM 459 CG LEU A 29 -0.120 13.884 -4.029 1.00 0.00 C ATOM 460 CD1 LEU A 29 -0.876 14.706 -2.996 1.00 0.00 C ATOM 461 CD2 LEU A 29 -0.366 14.436 -5.428 1.00 0.00 C ATOM 0 H LEU A 29 1.718 11.361 -3.485 1.00 0.00 H new ATOM 0 HA LEU A 29 1.871 13.227 -5.661 1.00 0.00 H new ATOM 0 HB2 LEU A 29 1.506 13.476 -2.694 1.00 0.00 H new ATOM 0 HB3 LEU A 29 1.749 14.884 -3.709 1.00 0.00 H new ATOM 0 HG LEU A 29 -0.489 12.859 -3.997 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.938 14.712 -3.242 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -0.735 14.267 -2.008 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.497 15.728 -2.997 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -1.436 14.443 -5.633 1.00 0.00 H new ATOM 0 HD22 LEU A 29 0.023 15.452 -5.492 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.140 13.808 -6.161 1.00 0.00 H new ATOM 473 N GLY A 30 4.216 13.957 -5.652 1.00 0.00 N ATOM 474 CA GLY A 30 5.634 14.212 -5.755 1.00 0.00 C ATOM 475 C GLY A 30 6.344 13.086 -6.481 1.00 0.00 C ATOM 476 O GLY A 30 7.569 13.069 -6.574 1.00 0.00 O ATOM 0 H GLY A 30 3.674 14.223 -6.474 1.00 0.00 H new ATOM 0 HA2 GLY A 30 5.800 15.150 -6.284 1.00 0.00 H new ATOM 0 HA3 GLY A 30 6.058 14.329 -4.758 1.00 0.00 H new ATOM 480 N ALA A 31 5.562 12.140 -6.994 1.00 0.00 N ATOM 481 CA ALA A 31 6.108 11.008 -7.730 1.00 0.00 C ATOM 482 C ALA A 31 6.176 11.315 -9.209 1.00 0.00 C ATOM 483 O ALA A 31 5.358 12.061 -9.746 1.00 0.00 O ATOM 484 CB ALA A 31 5.267 9.762 -7.507 1.00 0.00 C ATOM 0 H ALA A 31 4.545 12.137 -6.912 1.00 0.00 H new ATOM 0 HA ALA A 31 7.116 10.825 -7.358 1.00 0.00 H new ATOM 0 HB1 ALA A 31 5.694 8.930 -8.067 1.00 0.00 H new ATOM 0 HB2 ALA A 31 5.254 9.517 -6.445 1.00 0.00 H new ATOM 0 HB3 ALA A 31 4.248 9.945 -7.849 1.00 0.00 H new ATOM 490 N GLU A 32 7.157 10.717 -9.857 1.00 0.00 N ATOM 491 CA GLU A 32 7.383 10.934 -11.268 1.00 0.00 C ATOM 492 C GLU A 32 6.410 10.121 -12.114 1.00 0.00 C ATOM 493 O GLU A 32 5.822 10.636 -13.063 1.00 0.00 O ATOM 494 CB GLU A 32 8.821 10.556 -11.617 1.00 0.00 C ATOM 495 CG GLU A 32 9.100 10.537 -13.106 1.00 0.00 C ATOM 496 CD GLU A 32 10.492 10.048 -13.416 1.00 0.00 C ATOM 497 OE1 GLU A 32 10.702 8.819 -13.446 1.00 0.00 O ATOM 498 OE2 GLU A 32 11.385 10.892 -13.632 1.00 0.00 O1- ATOM 0 H GLU A 32 7.815 10.071 -9.421 1.00 0.00 H new ATOM 0 HA GLU A 32 7.217 11.989 -11.486 1.00 0.00 H new ATOM 0 HB2 GLU A 32 9.500 11.262 -11.138 1.00 0.00 H new ATOM 0 HB3 GLU A 32 9.040 9.572 -11.202 1.00 0.00 H new ATOM 0 HG2 GLU A 32 8.372 9.896 -13.603 1.00 0.00 H new ATOM 0 HG3 GLU A 32 8.970 11.540 -13.512 1.00 0.00 H new ATOM 505 N ASP A 33 6.237 8.854 -11.763 1.00 0.00 N ATOM 506 CA ASP A 33 5.401 7.958 -12.548 1.00 0.00 C ATOM 507 C ASP A 33 3.983 7.900 -11.997 1.00 0.00 C ATOM 508 O ASP A 33 3.047 7.502 -12.691 1.00 0.00 O ATOM 509 CB ASP A 33 6.010 6.560 -12.568 1.00 0.00 C ATOM 510 CG ASP A 33 5.227 5.584 -13.423 1.00 0.00 C ATOM 511 OD1 ASP A 33 4.415 4.816 -12.866 1.00 0.00 O ATOM 512 OD2 ASP A 33 5.429 5.579 -14.654 1.00 0.00 O1- ATOM 0 H ASP A 33 6.663 8.425 -10.942 1.00 0.00 H new ATOM 0 HA ASP A 33 5.352 8.346 -13.565 1.00 0.00 H new ATOM 0 HB2 ASP A 33 7.033 6.621 -12.940 1.00 0.00 H new ATOM 0 HB3 ASP A 33 6.064 6.179 -11.548 1.00 0.00 H new ATOM 517 N GLY A 34 3.820 8.321 -10.752 1.00 0.00 N ATOM 518 CA GLY A 34 2.507 8.322 -10.138 1.00 0.00 C ATOM 519 C GLY A 34 2.176 6.989 -9.503 1.00 0.00 C ATOM 520 O GLY A 34 1.078 6.794 -8.996 1.00 0.00 O ATOM 0 H GLY A 34 4.573 8.662 -10.155 1.00 0.00 H new ATOM 0 HA2 GLY A 34 2.462 9.105 -9.381 1.00 0.00 H new ATOM 0 HA3 GLY A 34 1.755 8.562 -10.890 1.00 0.00 H new ATOM 524 N SER A 35 3.136 6.084 -9.547 1.00 0.00 N ATOM 525 CA SER A 35 3.033 4.786 -8.887 1.00 0.00 C ATOM 526 C SER A 35 4.035 4.782 -7.742 1.00 0.00 C ATOM 527 O SER A 35 5.084 5.424 -7.839 1.00 0.00 O ATOM 528 CB SER A 35 3.361 3.664 -9.871 1.00 0.00 C ATOM 529 OG SER A 35 2.708 3.859 -11.117 1.00 0.00 O ATOM 0 H SER A 35 4.016 6.225 -10.043 1.00 0.00 H new ATOM 0 HA SER A 35 2.020 4.623 -8.518 1.00 0.00 H new ATOM 0 HB2 SER A 35 4.439 3.618 -10.027 1.00 0.00 H new ATOM 0 HB3 SER A 35 3.059 2.706 -9.447 1.00 0.00 H new ATOM 0 HG SER A 35 3.378 3.985 -11.821 1.00 0.00 H new ATOM 535 N ILE A 36 3.726 4.085 -6.666 1.00 0.00 N ATOM 536 CA ILE A 36 4.578 4.097 -5.487 1.00 0.00 C ATOM 537 C ILE A 36 5.895 3.405 -5.761 1.00 0.00 C ATOM 538 O ILE A 36 5.946 2.185 -5.848 1.00 0.00 O ATOM 539 CB ILE A 36 3.913 3.369 -4.304 1.00 0.00 C ATOM 540 CG1 ILE A 36 2.517 3.907 -4.034 1.00 0.00 C ATOM 541 CG2 ILE A 36 4.760 3.502 -3.052 1.00 0.00 C ATOM 542 CD1 ILE A 36 1.805 3.152 -2.941 1.00 0.00 C ATOM 0 H ILE A 36 2.893 3.503 -6.581 1.00 0.00 H new ATOM 0 HA ILE A 36 4.742 5.145 -5.237 1.00 0.00 H new ATOM 0 HB ILE A 36 3.830 2.316 -4.574 1.00 0.00 H new ATOM 0 HG12 ILE A 36 2.584 4.959 -3.759 1.00 0.00 H new ATOM 0 HG13 ILE A 36 1.928 3.854 -4.950 1.00 0.00 H new ATOM 0 HG21 ILE A 36 4.274 2.981 -2.227 1.00 0.00 H new ATOM 0 HG22 ILE A 36 5.742 3.064 -3.229 1.00 0.00 H new ATOM 0 HG23 ILE A 36 4.873 4.556 -2.799 1.00 0.00 H new ATOM 0 HD11 ILE A 36 0.813 3.579 -2.791 1.00 0.00 H new ATOM 0 HD12 ILE A 36 1.710 2.104 -3.225 1.00 0.00 H new ATOM 0 HD13 ILE A 36 2.376 3.227 -2.016 1.00 0.00 H new ATOM 554 N SER A 37 6.961 4.169 -5.875 1.00 0.00 N ATOM 555 CA SER A 37 8.272 3.574 -5.920 1.00 0.00 C ATOM 556 C SER A 37 8.806 3.485 -4.508 1.00 0.00 C ATOM 557 O SER A 37 8.100 3.818 -3.551 1.00 0.00 O ATOM 558 CB SER A 37 9.235 4.369 -6.805 1.00 0.00 C ATOM 559 OG SER A 37 9.571 5.617 -6.227 1.00 0.00 O ATOM 0 H SER A 37 6.944 5.187 -5.937 1.00 0.00 H new ATOM 0 HA SER A 37 8.190 2.580 -6.360 1.00 0.00 H new ATOM 0 HB2 SER A 37 10.143 3.788 -6.968 1.00 0.00 H new ATOM 0 HB3 SER A 37 8.781 4.532 -7.782 1.00 0.00 H new ATOM 0 HG SER A 37 8.941 6.301 -6.537 1.00 0.00 H new ATOM 565 N THR A 38 10.032 3.051 -4.364 1.00 0.00 N ATOM 566 CA THR A 38 10.619 2.924 -3.054 1.00 0.00 C ATOM 567 C THR A 38 10.741 4.296 -2.398 1.00 0.00 C ATOM 568 O THR A 38 10.519 4.446 -1.198 1.00 0.00 O ATOM 569 CB THR A 38 11.986 2.247 -3.155 1.00 0.00 C ATOM 570 OG1 THR A 38 12.900 3.080 -3.875 1.00 0.00 O ATOM 571 CG2 THR A 38 11.831 0.920 -3.871 1.00 0.00 C ATOM 0 H THR A 38 10.642 2.780 -5.135 1.00 0.00 H new ATOM 0 HA THR A 38 9.973 2.303 -2.433 1.00 0.00 H new ATOM 0 HB THR A 38 12.380 2.082 -2.152 1.00 0.00 H new ATOM 0 HG1 THR A 38 13.772 2.636 -3.931 1.00 0.00 H new ATOM 0 HG21 THR A 38 12.803 0.432 -3.947 1.00 0.00 H new ATOM 0 HG22 THR A 38 11.147 0.282 -3.311 1.00 0.00 H new ATOM 0 HG23 THR A 38 11.432 1.091 -4.871 1.00 0.00 H new ATOM 579 N LYS A 39 11.041 5.296 -3.217 1.00 0.00 N ATOM 580 CA LYS A 39 11.141 6.674 -2.759 1.00 0.00 C ATOM 581 C LYS A 39 9.820 7.121 -2.157 1.00 0.00 C ATOM 582 O LYS A 39 9.759 7.557 -1.011 1.00 0.00 O ATOM 583 CB LYS A 39 11.492 7.586 -3.925 1.00 0.00 C ATOM 584 CG LYS A 39 11.875 8.985 -3.490 1.00 0.00 C ATOM 585 CD LYS A 39 12.338 9.813 -4.665 1.00 0.00 C ATOM 586 CE LYS A 39 12.784 11.195 -4.228 1.00 0.00 C ATOM 587 NZ LYS A 39 13.368 11.966 -5.354 1.00 0.00 N1+ ATOM 0 H LYS A 39 11.221 5.175 -4.214 1.00 0.00 H new ATOM 0 HA LYS A 39 11.923 6.733 -2.002 1.00 0.00 H new ATOM 0 HB2 LYS A 39 12.317 7.148 -4.486 1.00 0.00 H new ATOM 0 HB3 LYS A 39 10.641 7.643 -4.603 1.00 0.00 H new ATOM 0 HG2 LYS A 39 11.021 9.468 -3.015 1.00 0.00 H new ATOM 0 HG3 LYS A 39 12.667 8.933 -2.743 1.00 0.00 H new ATOM 0 HD2 LYS A 39 13.161 9.305 -5.167 1.00 0.00 H new ATOM 0 HD3 LYS A 39 11.529 9.903 -5.390 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.933 11.739 -3.817 1.00 0.00 H new ATOM 0 HE3 LYS A 39 13.520 11.104 -3.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 13.661 12.905 -5.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 14.195 11.459 -5.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 12.658 12.075 -6.106 1.00 0.00 H new ATOM 601 N GLU A 40 8.774 6.999 -2.965 1.00 0.00 N ATOM 602 CA GLU A 40 7.412 7.269 -2.558 1.00 0.00 C ATOM 603 C GLU A 40 7.050 6.585 -1.256 1.00 0.00 C ATOM 604 O GLU A 40 6.525 7.215 -0.334 1.00 0.00 O ATOM 605 CB GLU A 40 6.486 6.770 -3.664 1.00 0.00 C ATOM 606 CG GLU A 40 6.245 7.808 -4.739 1.00 0.00 C ATOM 607 CD GLU A 40 7.463 8.065 -5.596 1.00 0.00 C ATOM 608 OE1 GLU A 40 7.699 7.294 -6.550 1.00 0.00 O ATOM 609 OE2 GLU A 40 8.186 9.043 -5.327 1.00 0.00 O1- ATOM 0 H GLU A 40 8.856 6.704 -3.938 1.00 0.00 H new ATOM 0 HA GLU A 40 7.306 8.342 -2.395 1.00 0.00 H new ATOM 0 HB2 GLU A 40 6.917 5.877 -4.117 1.00 0.00 H new ATOM 0 HB3 GLU A 40 5.531 6.477 -3.228 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.423 7.480 -5.375 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.933 8.742 -4.271 1.00 0.00 H new ATOM 616 N LEU A 41 7.335 5.300 -1.173 1.00 0.00 N ATOM 617 CA LEU A 41 6.924 4.533 -0.021 1.00 0.00 C ATOM 618 C LEU A 41 7.750 4.935 1.194 1.00 0.00 C ATOM 619 O LEU A 41 7.230 4.992 2.308 1.00 0.00 O ATOM 620 CB LEU A 41 6.997 3.031 -0.327 1.00 0.00 C ATOM 621 CG LEU A 41 6.102 2.140 0.540 1.00 0.00 C ATOM 622 CD1 LEU A 41 5.551 0.986 -0.273 1.00 0.00 C ATOM 623 CD2 LEU A 41 6.852 1.604 1.747 1.00 0.00 C ATOM 0 H LEU A 41 7.844 4.773 -1.883 1.00 0.00 H new ATOM 0 HA LEU A 41 5.883 4.752 0.217 1.00 0.00 H new ATOM 0 HB2 LEU A 41 6.730 2.877 -1.373 1.00 0.00 H new ATOM 0 HB3 LEU A 41 8.030 2.703 -0.210 1.00 0.00 H new ATOM 0 HG LEU A 41 5.276 2.756 0.896 1.00 0.00 H new ATOM 0 HD11 LEU A 41 4.918 0.364 0.360 1.00 0.00 H new ATOM 0 HD12 LEU A 41 4.963 1.375 -1.104 1.00 0.00 H new ATOM 0 HD13 LEU A 41 6.375 0.388 -0.660 1.00 0.00 H new ATOM 0 HD21 LEU A 41 6.187 0.976 2.340 1.00 0.00 H new ATOM 0 HD22 LEU A 41 7.705 1.014 1.413 1.00 0.00 H new ATOM 0 HD23 LEU A 41 7.203 2.437 2.356 1.00 0.00 H new ATOM 635 N GLY A 42 9.018 5.270 0.969 1.00 0.00 N ATOM 636 CA GLY A 42 9.834 5.806 2.038 1.00 0.00 C ATOM 637 C GLY A 42 9.297 7.129 2.506 1.00 0.00 C ATOM 638 O GLY A 42 9.123 7.322 3.696 1.00 0.00 O ATOM 0 H GLY A 42 9.490 5.179 0.070 1.00 0.00 H new ATOM 0 HA2 GLY A 42 9.858 5.103 2.871 1.00 0.00 H new ATOM 0 HA3 GLY A 42 10.861 5.927 1.693 1.00 0.00 H new ATOM 642 N LYS A 43 8.984 8.006 1.552 1.00 0.00 N ATOM 643 CA LYS A 43 8.474 9.352 1.831 1.00 0.00 C ATOM 644 C LYS A 43 7.371 9.315 2.884 1.00 0.00 C ATOM 645 O LYS A 43 7.386 10.078 3.853 1.00 0.00 O ATOM 646 CB LYS A 43 7.929 9.965 0.533 1.00 0.00 C ATOM 647 CG LYS A 43 7.012 11.155 0.753 1.00 0.00 C ATOM 648 CD LYS A 43 6.028 11.329 -0.398 1.00 0.00 C ATOM 649 CE LYS A 43 4.937 12.320 -0.028 1.00 0.00 C ATOM 650 NZ LYS A 43 3.834 12.338 -1.022 1.00 0.00 N1+ ATOM 0 H LYS A 43 9.077 7.803 0.557 1.00 0.00 H new ATOM 0 HA LYS A 43 9.292 9.960 2.218 1.00 0.00 H new ATOM 0 HB2 LYS A 43 8.767 10.275 -0.091 1.00 0.00 H new ATOM 0 HB3 LYS A 43 7.387 9.198 -0.020 1.00 0.00 H new ATOM 0 HG2 LYS A 43 6.462 11.023 1.685 1.00 0.00 H new ATOM 0 HG3 LYS A 43 7.610 12.060 0.861 1.00 0.00 H new ATOM 0 HD2 LYS A 43 6.557 11.677 -1.285 1.00 0.00 H new ATOM 0 HD3 LYS A 43 5.582 10.367 -0.650 1.00 0.00 H new ATOM 0 HE2 LYS A 43 4.535 12.066 0.953 1.00 0.00 H new ATOM 0 HE3 LYS A 43 5.367 13.318 0.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 2.952 12.635 -0.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 4.065 13.006 -1.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 3.711 11.386 -1.421 1.00 0.00 H new ATOM 664 N VAL A 44 6.429 8.410 2.694 1.00 0.00 N ATOM 665 CA VAL A 44 5.328 8.250 3.628 1.00 0.00 C ATOM 666 C VAL A 44 5.786 7.559 4.903 1.00 0.00 C ATOM 667 O VAL A 44 5.349 7.927 5.979 1.00 0.00 O ATOM 668 CB VAL A 44 4.169 7.468 2.986 1.00 0.00 C ATOM 669 CG1 VAL A 44 3.060 7.206 4.007 1.00 0.00 C ATOM 670 CG2 VAL A 44 3.648 8.237 1.774 1.00 0.00 C ATOM 0 H VAL A 44 6.404 7.772 1.899 1.00 0.00 H new ATOM 0 HA VAL A 44 4.971 9.247 3.887 1.00 0.00 H new ATOM 0 HB VAL A 44 4.530 6.496 2.650 1.00 0.00 H new ATOM 0 HG11 VAL A 44 2.251 6.652 3.531 1.00 0.00 H new ATOM 0 HG12 VAL A 44 3.460 6.623 4.837 1.00 0.00 H new ATOM 0 HG13 VAL A 44 2.678 8.156 4.381 1.00 0.00 H new ATOM 0 HG21 VAL A 44 2.827 7.684 1.318 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.294 9.218 2.090 1.00 0.00 H new ATOM 0 HG23 VAL A 44 4.451 8.358 1.047 1.00 0.00 H new ATOM 680 N MET A 45 6.668 6.573 4.784 1.00 0.00 N ATOM 681 CA MET A 45 7.257 5.930 5.959 1.00 0.00 C ATOM 682 C MET A 45 7.906 6.980 6.860 1.00 0.00 C ATOM 683 O MET A 45 7.656 7.005 8.058 1.00 0.00 O ATOM 684 CB MET A 45 8.313 4.900 5.539 1.00 0.00 C ATOM 685 CG MET A 45 7.772 3.652 4.858 1.00 0.00 C ATOM 686 SD MET A 45 6.861 2.581 5.976 1.00 0.00 S ATOM 687 CE MET A 45 5.213 3.150 5.627 1.00 0.00 C ATOM 0 H MET A 45 6.992 6.201 3.891 1.00 0.00 H new ATOM 0 HA MET A 45 6.462 5.421 6.504 1.00 0.00 H new ATOM 0 HB2 MET A 45 9.020 5.384 4.865 1.00 0.00 H new ATOM 0 HB3 MET A 45 8.873 4.597 6.424 1.00 0.00 H new ATOM 0 HG2 MET A 45 7.121 3.947 4.035 1.00 0.00 H new ATOM 0 HG3 MET A 45 8.601 3.093 4.424 1.00 0.00 H new ATOM 0 HE1 MET A 45 4.503 2.619 6.261 1.00 0.00 H new ATOM 0 HE2 MET A 45 5.148 4.220 5.826 1.00 0.00 H new ATOM 0 HE3 MET A 45 4.977 2.961 4.580 1.00 0.00 H new ATOM 697 N ARG A 46 8.733 7.842 6.268 1.00 0.00 N ATOM 698 CA ARG A 46 9.334 8.973 6.966 1.00 0.00 C ATOM 699 C ARG A 46 8.266 9.764 7.706 1.00 0.00 C ATOM 700 O ARG A 46 8.303 9.915 8.929 1.00 0.00 O ATOM 701 CB ARG A 46 10.003 9.879 5.952 1.00 0.00 C ATOM 702 CG ARG A 46 10.786 9.115 4.910 1.00 0.00 C ATOM 703 CD ARG A 46 11.466 10.041 3.936 1.00 0.00 C ATOM 704 NE ARG A 46 12.090 9.303 2.843 1.00 0.00 N ATOM 705 CZ ARG A 46 12.066 9.684 1.570 1.00 0.00 C ATOM 706 NH1 ARG A 46 11.442 10.803 1.212 1.00 0.00 N1+ ATOM 707 NH2 ARG A 46 12.662 8.935 0.652 1.00 0.00 N ATOM 0 H ARG A 46 9.004 7.773 5.287 1.00 0.00 H new ATOM 0 HA ARG A 46 10.065 8.601 7.684 1.00 0.00 H new ATOM 0 HB2 ARG A 46 9.244 10.485 5.457 1.00 0.00 H new ATOM 0 HB3 ARG A 46 10.672 10.566 6.471 1.00 0.00 H new ATOM 0 HG2 ARG A 46 11.533 8.491 5.401 1.00 0.00 H new ATOM 0 HG3 ARG A 46 10.116 8.446 4.370 1.00 0.00 H new ATOM 0 HD2 ARG A 46 10.738 10.745 3.532 1.00 0.00 H new ATOM 0 HD3 ARG A 46 12.222 10.628 4.458 1.00 0.00 H new ATOM 0 HE ARG A 46 12.577 8.437 3.071 1.00 0.00 H new ATOM 0 HH11 ARG A 46 10.977 11.376 1.917 1.00 0.00 H new ATOM 0 HH12 ARG A 46 11.428 11.088 0.233 1.00 0.00 H new ATOM 0 HH21 ARG A 46 13.134 8.073 0.925 1.00 0.00 H new ATOM 0 HH22 ARG A 46 12.648 9.221 -0.327 1.00 0.00 H new ATOM 721 N MET A 47 7.316 10.249 6.925 1.00 0.00 N ATOM 722 CA MET A 47 6.127 10.937 7.422 1.00 0.00 C ATOM 723 C MET A 47 5.380 10.124 8.493 1.00 0.00 C ATOM 724 O MET A 47 4.676 10.680 9.335 1.00 0.00 O ATOM 725 CB MET A 47 5.220 11.261 6.226 1.00 0.00 C ATOM 726 CG MET A 47 3.745 11.222 6.535 1.00 0.00 C ATOM 727 SD MET A 47 2.733 12.124 5.341 1.00 0.00 S ATOM 728 CE MET A 47 3.074 11.223 3.836 1.00 0.00 C ATOM 0 H MET A 47 7.346 10.177 5.908 1.00 0.00 H new ATOM 0 HA MET A 47 6.434 11.859 7.916 1.00 0.00 H new ATOM 0 HB2 MET A 47 5.474 12.252 5.851 1.00 0.00 H new ATOM 0 HB3 MET A 47 5.430 10.553 5.424 1.00 0.00 H new ATOM 0 HG2 MET A 47 3.416 10.183 6.566 1.00 0.00 H new ATOM 0 HG3 MET A 47 3.579 11.639 7.528 1.00 0.00 H new ATOM 0 HE1 MET A 47 2.517 11.668 3.012 1.00 0.00 H new ATOM 0 HE2 MET A 47 4.141 11.268 3.619 1.00 0.00 H new ATOM 0 HE3 MET A 47 2.773 10.183 3.958 1.00 0.00 H new ATOM 738 N LEU A 48 5.567 8.819 8.474 1.00 0.00 N ATOM 739 CA LEU A 48 4.867 7.915 9.347 1.00 0.00 C ATOM 740 C LEU A 48 5.688 7.532 10.577 1.00 0.00 C ATOM 741 O LEU A 48 5.231 6.763 11.424 1.00 0.00 O ATOM 742 CB LEU A 48 4.515 6.705 8.531 1.00 0.00 C ATOM 743 CG LEU A 48 3.056 6.638 8.103 1.00 0.00 C ATOM 744 CD1 LEU A 48 2.810 5.377 7.312 1.00 0.00 C ATOM 745 CD2 LEU A 48 2.120 6.718 9.308 1.00 0.00 C ATOM 0 H LEU A 48 6.220 8.357 7.841 1.00 0.00 H new ATOM 0 HA LEU A 48 3.973 8.400 9.738 1.00 0.00 H new ATOM 0 HB2 LEU A 48 5.143 6.687 7.641 1.00 0.00 H new ATOM 0 HB3 LEU A 48 4.753 5.811 9.107 1.00 0.00 H new ATOM 0 HG LEU A 48 2.843 7.498 7.468 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.764 5.336 7.009 1.00 0.00 H new ATOM 0 HD12 LEU A 48 3.445 5.374 6.426 1.00 0.00 H new ATOM 0 HD13 LEU A 48 3.044 4.509 7.929 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.085 6.668 8.969 1.00 0.00 H new ATOM 0 HD22 LEU A 48 2.322 5.885 9.982 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.284 7.658 9.834 1.00 0.00 H new ATOM 757 N GLY A 49 6.895 8.073 10.673 1.00 0.00 N ATOM 758 CA GLY A 49 7.737 7.809 11.822 1.00 0.00 C ATOM 759 C GLY A 49 8.884 6.860 11.515 1.00 0.00 C ATOM 760 O GLY A 49 9.712 6.579 12.379 1.00 0.00 O ATOM 0 H GLY A 49 7.306 8.691 9.974 1.00 0.00 H new ATOM 0 HA2 GLY A 49 8.142 8.751 12.192 1.00 0.00 H new ATOM 0 HA3 GLY A 49 7.128 7.387 12.622 1.00 0.00 H new ATOM 764 N GLN A 50 8.934 6.368 10.288 1.00 0.00 N ATOM 765 CA GLN A 50 9.977 5.456 9.869 1.00 0.00 C ATOM 766 C GLN A 50 11.061 6.187 9.087 1.00 0.00 C ATOM 767 O GLN A 50 10.982 7.398 8.884 1.00 0.00 O ATOM 768 CB GLN A 50 9.407 4.395 8.944 1.00 0.00 C ATOM 769 CG GLN A 50 8.505 3.352 9.567 1.00 0.00 C ATOM 770 CD GLN A 50 7.105 3.848 9.878 1.00 0.00 C ATOM 771 OE1 GLN A 50 6.836 4.349 10.968 1.00 0.00 O ATOM 772 NE2 GLN A 50 6.198 3.687 8.930 1.00 0.00 N ATOM 0 H GLN A 50 8.255 6.590 9.560 1.00 0.00 H new ATOM 0 HA GLN A 50 10.394 5.010 10.772 1.00 0.00 H new ATOM 0 HB2 GLN A 50 8.848 4.898 8.155 1.00 0.00 H new ATOM 0 HB3 GLN A 50 10.240 3.880 8.466 1.00 0.00 H new ATOM 0 HG2 GLN A 50 8.435 2.499 8.893 1.00 0.00 H new ATOM 0 HG3 GLN A 50 8.965 2.993 10.488 1.00 0.00 H new ATOM 0 HE21 GLN A 50 6.461 3.267 8.039 1.00 0.00 H new ATOM 0 HE22 GLN A 50 5.235 3.983 9.090 1.00 0.00 H new ATOM 781 N ASN A 51 12.072 5.439 8.643 1.00 0.00 N ATOM 782 CA ASN A 51 13.025 5.929 7.644 1.00 0.00 C ATOM 783 C ASN A 51 13.744 4.766 6.944 1.00 0.00 C ATOM 784 O ASN A 51 14.970 4.670 6.951 1.00 0.00 O ATOM 785 CB ASN A 51 14.020 6.910 8.269 1.00 0.00 C ATOM 786 CG ASN A 51 14.802 6.339 9.441 1.00 0.00 C ATOM 787 OD1 ASN A 51 15.867 5.744 9.270 1.00 0.00 O ATOM 788 ND2 ASN A 51 14.291 6.540 10.646 1.00 0.00 N ATOM 0 H ASN A 51 12.253 4.487 8.961 1.00 0.00 H new ATOM 0 HA ASN A 51 12.464 6.470 6.882 1.00 0.00 H new ATOM 0 HB2 ASN A 51 14.722 7.236 7.502 1.00 0.00 H new ATOM 0 HB3 ASN A 51 13.479 7.795 8.604 1.00 0.00 H new ATOM 0 HD21 ASN A 51 14.782 6.198 11.472 1.00 0.00 H new ATOM 0 HD22 ASN A 51 13.406 7.037 10.748 1.00 0.00 H new ATOM 795 N PRO A 52 12.964 3.880 6.314 1.00 0.00 N ATOM 796 CA PRO A 52 13.472 2.677 5.625 1.00 0.00 C ATOM 797 C PRO A 52 14.379 2.993 4.440 1.00 0.00 C ATOM 798 O PRO A 52 14.328 4.089 3.872 1.00 0.00 O ATOM 799 CB PRO A 52 12.193 2.015 5.134 1.00 0.00 C ATOM 800 CG PRO A 52 11.218 3.116 5.039 1.00 0.00 C ATOM 801 CD PRO A 52 11.504 3.968 6.210 1.00 0.00 C ATOM 0 HA PRO A 52 14.087 2.065 6.285 1.00 0.00 H new ATOM 0 HB2 PRO A 52 12.342 1.533 4.168 1.00 0.00 H new ATOM 0 HB3 PRO A 52 11.854 1.244 5.826 1.00 0.00 H new ATOM 0 HG2 PRO A 52 11.335 3.670 4.108 1.00 0.00 H new ATOM 0 HG3 PRO A 52 10.194 2.742 5.061 1.00 0.00 H new ATOM 0 HD2 PRO A 52 11.169 4.994 6.058 1.00 0.00 H new ATOM 0 HD3 PRO A 52 11.010 3.601 7.110 1.00 0.00 H new ATOM 809 N THR A 53 15.211 2.030 4.075 1.00 0.00 N ATOM 810 CA THR A 53 16.050 2.159 2.901 1.00 0.00 C ATOM 811 C THR A 53 15.324 1.724 1.658 1.00 0.00 C ATOM 812 O THR A 53 14.363 0.962 1.733 1.00 0.00 O ATOM 813 CB THR A 53 17.327 1.333 3.018 1.00 0.00 C ATOM 814 OG1 THR A 53 17.093 0.174 3.824 1.00 0.00 O ATOM 815 CG2 THR A 53 18.440 2.178 3.586 1.00 0.00 C ATOM 0 H THR A 53 15.321 1.150 4.578 1.00 0.00 H new ATOM 0 HA THR A 53 16.308 3.216 2.832 1.00 0.00 H new ATOM 0 HB THR A 53 17.629 0.998 2.026 1.00 0.00 H new ATOM 0 HG1 THR A 53 17.918 -0.350 3.891 1.00 0.00 H new ATOM 0 HG21 THR A 53 19.347 1.579 3.666 1.00 0.00 H new ATOM 0 HG22 THR A 53 18.623 3.028 2.929 1.00 0.00 H new ATOM 0 HG23 THR A 53 18.155 2.538 4.575 1.00 0.00 H new ATOM 823 N PRO A 54 15.757 2.218 0.501 1.00 0.00 N ATOM 824 CA PRO A 54 15.229 1.788 -0.780 1.00 0.00 C ATOM 825 C PRO A 54 15.116 0.269 -0.901 1.00 0.00 C ATOM 826 O PRO A 54 14.185 -0.249 -1.505 1.00 0.00 O ATOM 827 CB PRO A 54 16.243 2.334 -1.760 1.00 0.00 C ATOM 828 CG PRO A 54 16.699 3.579 -1.124 1.00 0.00 C ATOM 829 CD PRO A 54 16.746 3.297 0.345 1.00 0.00 C ATOM 0 HA PRO A 54 14.212 2.144 -0.945 1.00 0.00 H new ATOM 0 HB2 PRO A 54 17.067 1.637 -1.915 1.00 0.00 H new ATOM 0 HB3 PRO A 54 15.797 2.522 -2.736 1.00 0.00 H new ATOM 0 HG2 PRO A 54 17.681 3.871 -1.497 1.00 0.00 H new ATOM 0 HG3 PRO A 54 16.017 4.401 -1.342 1.00 0.00 H new ATOM 0 HD2 PRO A 54 17.740 2.984 0.665 1.00 0.00 H new ATOM 0 HD3 PRO A 54 16.483 4.175 0.934 1.00 0.00 H new ATOM 837 N GLU A 55 16.072 -0.429 -0.302 1.00 0.00 N ATOM 838 CA GLU A 55 16.083 -1.883 -0.280 1.00 0.00 C ATOM 839 C GLU A 55 14.867 -2.418 0.475 1.00 0.00 C ATOM 840 O GLU A 55 14.123 -3.261 -0.031 1.00 0.00 O ATOM 841 CB GLU A 55 17.355 -2.362 0.402 1.00 0.00 C ATOM 842 CG GLU A 55 17.678 -3.801 0.167 1.00 0.00 C ATOM 843 CD GLU A 55 18.830 -4.287 1.018 1.00 0.00 C ATOM 844 OE1 GLU A 55 19.939 -3.731 0.899 1.00 0.00 O ATOM 845 OE2 GLU A 55 18.637 -5.233 1.808 1.00 0.00 O1- ATOM 0 H GLU A 55 16.861 -0.001 0.182 1.00 0.00 H new ATOM 0 HA GLU A 55 16.046 -2.253 -1.305 1.00 0.00 H new ATOM 0 HB2 GLU A 55 18.190 -1.754 0.055 1.00 0.00 H new ATOM 0 HB3 GLU A 55 17.263 -2.194 1.475 1.00 0.00 H new ATOM 0 HG2 GLU A 55 16.796 -4.406 0.377 1.00 0.00 H new ATOM 0 HG3 GLU A 55 17.922 -3.947 -0.885 1.00 0.00 H new ATOM 852 N GLU A 56 14.672 -1.895 1.680 1.00 0.00 N ATOM 853 CA GLU A 56 13.577 -2.278 2.545 1.00 0.00 C ATOM 854 C GLU A 56 12.245 -1.884 1.930 1.00 0.00 C ATOM 855 O GLU A 56 11.237 -2.564 2.094 1.00 0.00 O ATOM 856 CB GLU A 56 13.785 -1.602 3.868 1.00 0.00 C ATOM 857 CG GLU A 56 13.290 -2.427 5.017 1.00 0.00 C ATOM 858 CD GLU A 56 13.524 -1.770 6.359 1.00 0.00 C ATOM 859 OE1 GLU A 56 14.108 -2.430 7.237 1.00 0.00 O ATOM 860 OE2 GLU A 56 13.159 -0.591 6.537 1.00 0.00 O1- ATOM 0 H GLU A 56 15.282 -1.184 2.083 1.00 0.00 H new ATOM 0 HA GLU A 56 13.556 -3.360 2.679 1.00 0.00 H new ATOM 0 HB2 GLU A 56 14.847 -1.395 4.004 1.00 0.00 H new ATOM 0 HB3 GLU A 56 13.271 -0.641 3.866 1.00 0.00 H new ATOM 0 HG2 GLU A 56 12.223 -2.613 4.891 1.00 0.00 H new ATOM 0 HG3 GLU A 56 13.787 -3.397 5.002 1.00 0.00 H new ATOM 867 N LEU A 57 12.260 -0.793 1.202 1.00 0.00 N ATOM 868 CA LEU A 57 11.090 -0.307 0.517 1.00 0.00 C ATOM 869 C LEU A 57 10.790 -1.118 -0.734 1.00 0.00 C ATOM 870 O LEU A 57 9.632 -1.388 -1.026 1.00 0.00 O ATOM 871 CB LEU A 57 11.342 1.154 0.200 1.00 0.00 C ATOM 872 CG LEU A 57 11.504 1.995 1.455 1.00 0.00 C ATOM 873 CD1 LEU A 57 12.067 3.369 1.156 1.00 0.00 C ATOM 874 CD2 LEU A 57 10.167 2.096 2.168 1.00 0.00 C ATOM 0 H LEU A 57 13.090 -0.215 1.069 1.00 0.00 H new ATOM 0 HA LEU A 57 10.206 -0.412 1.146 1.00 0.00 H new ATOM 0 HB2 LEU A 57 12.240 1.241 -0.412 1.00 0.00 H new ATOM 0 HB3 LEU A 57 10.514 1.544 -0.392 1.00 0.00 H new ATOM 0 HG LEU A 57 12.226 1.502 2.105 1.00 0.00 H new ATOM 0 HD11 LEU A 57 12.164 3.932 2.084 1.00 0.00 H new ATOM 0 HD12 LEU A 57 13.047 3.267 0.689 1.00 0.00 H new ATOM 0 HD13 LEU A 57 11.396 3.898 0.479 1.00 0.00 H new ATOM 0 HD21 LEU A 57 10.280 2.699 3.069 1.00 0.00 H new ATOM 0 HD22 LEU A 57 9.437 2.564 1.508 1.00 0.00 H new ATOM 0 HD23 LEU A 57 9.823 1.098 2.440 1.00 0.00 H new ATOM 886 N GLN A 58 11.832 -1.532 -1.449 1.00 0.00 N ATOM 887 CA GLN A 58 11.667 -2.291 -2.686 1.00 0.00 C ATOM 888 C GLN A 58 10.912 -3.587 -2.428 1.00 0.00 C ATOM 889 O GLN A 58 10.120 -4.017 -3.249 1.00 0.00 O ATOM 890 CB GLN A 58 13.020 -2.615 -3.317 1.00 0.00 C ATOM 891 CG GLN A 58 13.027 -2.528 -4.841 1.00 0.00 C ATOM 892 CD GLN A 58 11.971 -3.388 -5.514 1.00 0.00 C ATOM 893 OE1 GLN A 58 10.861 -2.929 -5.793 1.00 0.00 O ATOM 894 NE2 GLN A 58 12.301 -4.641 -5.779 1.00 0.00 N ATOM 0 H GLN A 58 12.803 -1.354 -1.192 1.00 0.00 H new ATOM 0 HA GLN A 58 11.094 -1.670 -3.374 1.00 0.00 H new ATOM 0 HB2 GLN A 58 13.769 -1.930 -2.920 1.00 0.00 H new ATOM 0 HB3 GLN A 58 13.318 -3.620 -3.019 1.00 0.00 H new ATOM 0 HG2 GLN A 58 12.877 -1.489 -5.136 1.00 0.00 H new ATOM 0 HG3 GLN A 58 14.010 -2.825 -5.207 1.00 0.00 H new ATOM 0 HE21 GLN A 58 13.229 -4.987 -5.534 1.00 0.00 H new ATOM 0 HE22 GLN A 58 11.628 -5.262 -6.228 1.00 0.00 H new ATOM 903 N GLU A 59 11.150 -4.205 -1.287 1.00 0.00 N ATOM 904 CA GLU A 59 10.503 -5.470 -0.985 1.00 0.00 C ATOM 905 C GLU A 59 9.050 -5.268 -0.540 1.00 0.00 C ATOM 906 O GLU A 59 8.212 -6.152 -0.733 1.00 0.00 O ATOM 907 CB GLU A 59 11.308 -6.262 0.037 1.00 0.00 C ATOM 908 CG GLU A 59 11.739 -5.464 1.253 1.00 0.00 C ATOM 909 CD GLU A 59 12.695 -6.233 2.132 1.00 0.00 C ATOM 910 OE1 GLU A 59 13.918 -6.044 1.989 1.00 0.00 O ATOM 911 OE2 GLU A 59 12.231 -7.039 2.963 1.00 0.00 O1- ATOM 0 H GLU A 59 11.778 -3.859 -0.562 1.00 0.00 H new ATOM 0 HA GLU A 59 10.471 -6.058 -1.902 1.00 0.00 H new ATOM 0 HB2 GLU A 59 10.713 -7.113 0.369 1.00 0.00 H new ATOM 0 HB3 GLU A 59 12.196 -6.664 -0.451 1.00 0.00 H new ATOM 0 HG2 GLU A 59 12.213 -4.538 0.928 1.00 0.00 H new ATOM 0 HG3 GLU A 59 10.859 -5.186 1.833 1.00 0.00 H new ATOM 918 N MET A 60 8.750 -4.103 0.040 1.00 0.00 N ATOM 919 CA MET A 60 7.362 -3.719 0.305 1.00 0.00 C ATOM 920 C MET A 60 6.683 -3.386 -1.016 1.00 0.00 C ATOM 921 O MET A 60 5.534 -3.750 -1.250 1.00 0.00 O ATOM 922 CB MET A 60 7.288 -2.540 1.271 1.00 0.00 C ATOM 923 CG MET A 60 5.871 -2.155 1.671 1.00 0.00 C ATOM 924 SD MET A 60 4.862 -3.555 2.223 1.00 0.00 S ATOM 925 CE MET A 60 3.318 -2.738 2.626 1.00 0.00 C ATOM 0 H MET A 60 9.443 -3.415 0.333 1.00 0.00 H new ATOM 0 HA MET A 60 6.844 -4.552 0.780 1.00 0.00 H new ATOM 0 HB2 MET A 60 7.855 -2.784 2.170 1.00 0.00 H new ATOM 0 HB3 MET A 60 7.772 -1.677 0.813 1.00 0.00 H new ATOM 0 HG2 MET A 60 5.917 -1.415 2.470 1.00 0.00 H new ATOM 0 HG3 MET A 60 5.381 -1.678 0.822 1.00 0.00 H new ATOM 0 HE1 MET A 60 3.067 -2.929 3.669 1.00 0.00 H new ATOM 0 HE2 MET A 60 3.422 -1.665 2.468 1.00 0.00 H new ATOM 0 HE3 MET A 60 2.525 -3.123 1.986 1.00 0.00 H new ATOM 935 N ILE A 61 7.426 -2.712 -1.885 1.00 0.00 N ATOM 936 CA ILE A 61 6.982 -2.460 -3.247 1.00 0.00 C ATOM 937 C ILE A 61 6.706 -3.780 -3.967 1.00 0.00 C ATOM 938 O ILE A 61 5.612 -4.015 -4.477 1.00 0.00 O ATOM 939 CB ILE A 61 8.041 -1.676 -4.046 1.00 0.00 C ATOM 940 CG1 ILE A 61 8.317 -0.316 -3.401 1.00 0.00 C ATOM 941 CG2 ILE A 61 7.611 -1.513 -5.492 1.00 0.00 C ATOM 942 CD1 ILE A 61 7.117 0.598 -3.279 1.00 0.00 C ATOM 0 H ILE A 61 8.345 -2.328 -1.667 1.00 0.00 H new ATOM 0 HA ILE A 61 6.070 -1.867 -3.187 1.00 0.00 H new ATOM 0 HB ILE A 61 8.969 -2.248 -4.031 1.00 0.00 H new ATOM 0 HG12 ILE A 61 8.729 -0.482 -2.406 1.00 0.00 H new ATOM 0 HG13 ILE A 61 9.084 0.195 -3.983 1.00 0.00 H new ATOM 0 HG21 ILE A 61 8.373 -0.957 -6.038 1.00 0.00 H new ATOM 0 HG22 ILE A 61 7.484 -2.495 -5.947 1.00 0.00 H new ATOM 0 HG23 ILE A 61 6.667 -0.970 -5.532 1.00 0.00 H new ATOM 0 HD11 ILE A 61 7.419 1.534 -2.810 1.00 0.00 H new ATOM 0 HD12 ILE A 61 6.713 0.803 -4.271 1.00 0.00 H new ATOM 0 HD13 ILE A 61 6.353 0.116 -2.669 1.00 0.00 H new ATOM 954 N ASP A 62 7.707 -4.653 -3.962 1.00 0.00 N ATOM 955 CA ASP A 62 7.680 -5.891 -4.734 1.00 0.00 C ATOM 956 C ASP A 62 6.561 -6.821 -4.295 1.00 0.00 C ATOM 957 O ASP A 62 6.038 -7.575 -5.116 1.00 0.00 O ATOM 958 CB ASP A 62 9.013 -6.630 -4.637 1.00 0.00 C ATOM 959 CG ASP A 62 9.135 -7.707 -5.691 1.00 0.00 C ATOM 960 OD1 ASP A 62 8.867 -8.886 -5.378 1.00 0.00 O ATOM 961 OD2 ASP A 62 9.490 -7.374 -6.843 1.00 0.00 O1- ATOM 0 H ASP A 62 8.562 -4.522 -3.422 1.00 0.00 H new ATOM 0 HA ASP A 62 7.498 -5.601 -5.769 1.00 0.00 H new ATOM 0 HB2 ASP A 62 9.832 -5.919 -4.747 1.00 0.00 H new ATOM 0 HB3 ASP A 62 9.110 -7.077 -3.648 1.00 0.00 H new ATOM 966 N GLU A 63 6.183 -6.773 -3.015 1.00 0.00 N ATOM 967 CA GLU A 63 5.086 -7.604 -2.533 1.00 0.00 C ATOM 968 C GLU A 63 3.856 -7.330 -3.354 1.00 0.00 C ATOM 969 O GLU A 63 3.086 -8.229 -3.691 1.00 0.00 O ATOM 970 CB GLU A 63 4.739 -7.327 -1.083 1.00 0.00 C ATOM 971 CG GLU A 63 4.488 -8.598 -0.304 1.00 0.00 C ATOM 972 CD GLU A 63 3.765 -8.373 1.001 1.00 0.00 C ATOM 973 OE1 GLU A 63 2.620 -7.873 0.986 1.00 0.00 O ATOM 974 OE2 GLU A 63 4.314 -8.741 2.045 1.00 0.00 O1- ATOM 0 H GLU A 63 6.614 -6.178 -2.308 1.00 0.00 H new ATOM 0 HA GLU A 63 5.412 -8.640 -2.621 1.00 0.00 H new ATOM 0 HB2 GLU A 63 5.552 -6.771 -0.616 1.00 0.00 H new ATOM 0 HB3 GLU A 63 3.853 -6.694 -1.038 1.00 0.00 H new ATOM 0 HG2 GLU A 63 3.905 -9.283 -0.920 1.00 0.00 H new ATOM 0 HG3 GLU A 63 5.442 -9.085 -0.102 1.00 0.00 H new ATOM 981 N VAL A 64 3.698 -6.075 -3.699 1.00 0.00 N ATOM 982 CA VAL A 64 2.505 -5.648 -4.350 1.00 0.00 C ATOM 983 C VAL A 64 2.701 -5.511 -5.842 1.00 0.00 C ATOM 984 O VAL A 64 1.782 -5.776 -6.619 1.00 0.00 O ATOM 985 CB VAL A 64 1.990 -4.328 -3.785 1.00 0.00 C ATOM 986 CG1 VAL A 64 0.540 -4.480 -3.579 1.00 0.00 C ATOM 987 CG2 VAL A 64 2.669 -3.913 -2.483 1.00 0.00 C ATOM 0 H VAL A 64 4.386 -5.340 -3.536 1.00 0.00 H new ATOM 0 HA VAL A 64 1.762 -6.423 -4.161 1.00 0.00 H new ATOM 0 HB VAL A 64 2.221 -3.534 -4.495 1.00 0.00 H new ATOM 0 HG11 VAL A 64 0.131 -3.554 -3.174 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.059 -4.704 -4.531 1.00 0.00 H new ATOM 0 HG13 VAL A 64 0.355 -5.295 -2.879 1.00 0.00 H new ATOM 0 HG21 VAL A 64 2.252 -2.966 -2.141 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.501 -4.678 -1.725 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.740 -3.798 -2.652 1.00 0.00 H new ATOM 997 N ASP A 65 3.899 -5.120 -6.238 1.00 0.00 N ATOM 998 CA ASP A 65 4.207 -4.913 -7.640 1.00 0.00 C ATOM 999 C ASP A 65 3.965 -6.192 -8.428 1.00 0.00 C ATOM 1000 O ASP A 65 4.672 -7.187 -8.257 1.00 0.00 O ATOM 1001 CB ASP A 65 5.653 -4.465 -7.806 1.00 0.00 C ATOM 1002 CG ASP A 65 5.906 -3.864 -9.168 1.00 0.00 C ATOM 1003 OD1 ASP A 65 6.684 -2.902 -9.259 1.00 0.00 O ATOM 1004 OD2 ASP A 65 5.317 -4.346 -10.160 1.00 0.00 O1- ATOM 0 H ASP A 65 4.677 -4.939 -5.604 1.00 0.00 H new ATOM 0 HA ASP A 65 3.552 -4.132 -8.025 1.00 0.00 H new ATOM 0 HB2 ASP A 65 5.896 -3.733 -7.036 1.00 0.00 H new ATOM 0 HB3 ASP A 65 6.316 -5.317 -7.657 1.00 0.00 H new ATOM 1009 N GLU A 66 2.953 -6.161 -9.280 1.00 0.00 N ATOM 1010 CA GLU A 66 2.568 -7.324 -10.053 1.00 0.00 C ATOM 1011 C GLU A 66 3.604 -7.641 -11.120 1.00 0.00 C ATOM 1012 O GLU A 66 3.824 -8.806 -11.455 1.00 0.00 O ATOM 1013 CB GLU A 66 1.215 -7.089 -10.710 1.00 0.00 C ATOM 1014 CG GLU A 66 0.587 -8.344 -11.256 1.00 0.00 C ATOM 1015 CD GLU A 66 -0.748 -8.099 -11.926 1.00 0.00 C ATOM 1016 OE1 GLU A 66 -0.778 -7.922 -13.160 1.00 0.00 O ATOM 1017 OE2 GLU A 66 -1.782 -8.096 -11.224 1.00 0.00 O1- ATOM 0 H GLU A 66 2.381 -5.334 -9.452 1.00 0.00 H new ATOM 0 HA GLU A 66 2.502 -8.173 -9.373 1.00 0.00 H new ATOM 0 HB2 GLU A 66 0.539 -6.641 -9.982 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.333 -6.369 -11.520 1.00 0.00 H new ATOM 0 HG2 GLU A 66 1.268 -8.801 -11.974 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.453 -9.059 -10.444 1.00 0.00 H new ATOM 1024 N ASP A 67 4.253 -6.608 -11.633 1.00 0.00 N ATOM 1025 CA ASP A 67 5.166 -6.784 -12.757 1.00 0.00 C ATOM 1026 C ASP A 67 6.627 -6.651 -12.328 1.00 0.00 C ATOM 1027 O ASP A 67 7.539 -6.895 -13.114 1.00 0.00 O ATOM 1028 CB ASP A 67 4.842 -5.773 -13.857 1.00 0.00 C ATOM 1029 CG ASP A 67 5.560 -6.081 -15.156 1.00 0.00 C ATOM 1030 OD1 ASP A 67 5.328 -7.170 -15.717 1.00 0.00 O ATOM 1031 OD2 ASP A 67 6.337 -5.228 -15.630 1.00 0.00 O1- ATOM 0 H ASP A 67 4.168 -5.649 -11.296 1.00 0.00 H new ATOM 0 HA ASP A 67 5.029 -7.794 -13.143 1.00 0.00 H new ATOM 0 HB2 ASP A 67 3.766 -5.764 -14.033 1.00 0.00 H new ATOM 0 HB3 ASP A 67 5.118 -4.774 -13.521 1.00 0.00 H new ATOM 1036 N GLY A 68 6.844 -6.277 -11.076 1.00 0.00 N ATOM 1037 CA GLY A 68 8.193 -6.217 -10.542 1.00 0.00 C ATOM 1038 C GLY A 68 8.967 -5.015 -11.045 1.00 0.00 C ATOM 1039 O GLY A 68 10.195 -5.043 -11.111 1.00 0.00 O ATOM 0 H GLY A 68 6.111 -6.013 -10.418 1.00 0.00 H new ATOM 0 HA2 GLY A 68 8.148 -6.185 -9.453 1.00 0.00 H new ATOM 0 HA3 GLY A 68 8.728 -7.128 -10.812 1.00 0.00 H new ATOM 1043 N SER A 69 8.247 -3.964 -11.408 1.00 0.00 N ATOM 1044 CA SER A 69 8.854 -2.778 -11.997 1.00 0.00 C ATOM 1045 C SER A 69 9.569 -1.936 -10.951 1.00 0.00 C ATOM 1046 O SER A 69 10.514 -1.208 -11.255 1.00 0.00 O ATOM 1047 CB SER A 69 7.780 -1.941 -12.684 1.00 0.00 C ATOM 1048 OG SER A 69 7.019 -2.735 -13.577 1.00 0.00 O ATOM 0 H SER A 69 7.234 -3.908 -11.304 1.00 0.00 H new ATOM 0 HA SER A 69 9.594 -3.106 -12.727 1.00 0.00 H new ATOM 0 HB2 SER A 69 7.124 -1.497 -11.935 1.00 0.00 H new ATOM 0 HB3 SER A 69 8.245 -1.119 -13.227 1.00 0.00 H new ATOM 0 HG SER A 69 6.335 -2.180 -14.006 1.00 0.00 H new ATOM 1054 N GLY A 70 9.108 -2.043 -9.723 1.00 0.00 N ATOM 1055 CA GLY A 70 9.654 -1.246 -8.650 1.00 0.00 C ATOM 1056 C GLY A 70 8.716 -0.126 -8.268 1.00 0.00 C ATOM 1057 O GLY A 70 9.130 0.864 -7.659 1.00 0.00 O ATOM 0 H GLY A 70 8.357 -2.674 -9.445 1.00 0.00 H new ATOM 0 HA2 GLY A 70 9.841 -1.879 -7.782 1.00 0.00 H new ATOM 0 HA3 GLY A 70 10.615 -0.831 -8.955 1.00 0.00 H new ATOM 1061 N THR A 71 7.447 -0.283 -8.633 1.00 0.00 N ATOM 1062 CA THR A 71 6.437 0.723 -8.361 1.00 0.00 C ATOM 1063 C THR A 71 5.065 0.088 -8.175 1.00 0.00 C ATOM 1064 O THR A 71 4.626 -0.732 -8.978 1.00 0.00 O ATOM 1065 CB THR A 71 6.363 1.763 -9.493 1.00 0.00 C ATOM 1066 OG1 THR A 71 6.700 1.150 -10.748 1.00 0.00 O ATOM 1067 CG2 THR A 71 7.276 2.953 -9.217 1.00 0.00 C ATOM 0 H THR A 71 7.096 -1.107 -9.122 1.00 0.00 H new ATOM 0 HA THR A 71 6.729 1.224 -7.438 1.00 0.00 H new ATOM 0 HB THR A 71 5.340 2.137 -9.543 1.00 0.00 H new ATOM 0 HG1 THR A 71 6.649 1.818 -11.463 1.00 0.00 H new ATOM 0 HG21 THR A 71 7.199 3.668 -10.036 1.00 0.00 H new ATOM 0 HG22 THR A 71 6.976 3.434 -8.286 1.00 0.00 H new ATOM 0 HG23 THR A 71 8.307 2.609 -9.131 1.00 0.00 H new ATOM 1075 N VAL A 72 4.397 0.485 -7.110 1.00 0.00 N ATOM 1076 CA VAL A 72 3.068 0.001 -6.802 1.00 0.00 C ATOM 1077 C VAL A 72 2.015 1.028 -7.194 1.00 0.00 C ATOM 1078 O VAL A 72 1.942 2.112 -6.619 1.00 0.00 O ATOM 1079 CB VAL A 72 2.953 -0.341 -5.304 1.00 0.00 C ATOM 1080 CG1 VAL A 72 1.496 -0.434 -4.853 1.00 0.00 C ATOM 1081 CG2 VAL A 72 3.664 -1.649 -5.041 1.00 0.00 C ATOM 0 H VAL A 72 4.763 1.154 -6.433 1.00 0.00 H new ATOM 0 HA VAL A 72 2.893 -0.906 -7.380 1.00 0.00 H new ATOM 0 HB VAL A 72 3.418 0.461 -4.731 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.459 -0.677 -3.791 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.000 0.522 -5.024 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.988 -1.213 -5.421 1.00 0.00 H new ATOM 0 HG21 VAL A 72 3.587 -1.898 -3.983 1.00 0.00 H new ATOM 0 HG22 VAL A 72 3.204 -2.439 -5.634 1.00 0.00 H new ATOM 0 HG23 VAL A 72 4.714 -1.554 -5.316 1.00 0.00 H new ATOM 1091 N ASP A 73 1.214 0.688 -8.183 1.00 0.00 N ATOM 1092 CA ASP A 73 0.153 1.572 -8.649 1.00 0.00 C ATOM 1093 C ASP A 73 -1.179 1.120 -8.040 1.00 0.00 C ATOM 1094 O ASP A 73 -1.212 0.098 -7.367 1.00 0.00 O ATOM 1095 CB ASP A 73 0.155 1.614 -10.183 1.00 0.00 C ATOM 1096 CG ASP A 73 -1.134 2.111 -10.812 1.00 0.00 C ATOM 1097 OD1 ASP A 73 -1.819 1.311 -11.484 1.00 0.00 O ATOM 1098 OD2 ASP A 73 -1.465 3.300 -10.641 1.00 0.00 O1- ATOM 0 H ASP A 73 1.274 -0.198 -8.685 1.00 0.00 H new ATOM 0 HA ASP A 73 0.317 2.597 -8.317 1.00 0.00 H new ATOM 0 HB2 ASP A 73 0.973 2.254 -10.513 1.00 0.00 H new ATOM 0 HB3 ASP A 73 0.363 0.612 -10.559 1.00 0.00 H new ATOM 1103 N PHE A 74 -2.253 1.881 -8.257 1.00 0.00 N ATOM 1104 CA PHE A 74 -3.512 1.714 -7.515 1.00 0.00 C ATOM 1105 C PHE A 74 -3.946 0.259 -7.320 1.00 0.00 C ATOM 1106 O PHE A 74 -4.182 -0.161 -6.190 1.00 0.00 O ATOM 1107 CB PHE A 74 -4.643 2.486 -8.184 1.00 0.00 C ATOM 1108 CG PHE A 74 -5.982 2.227 -7.551 1.00 0.00 C ATOM 1109 CD1 PHE A 74 -7.077 1.924 -8.341 1.00 0.00 C ATOM 1110 CD2 PHE A 74 -6.146 2.275 -6.167 1.00 0.00 C ATOM 1111 CE1 PHE A 74 -8.310 1.684 -7.776 1.00 0.00 C ATOM 1112 CE2 PHE A 74 -7.381 2.031 -5.602 1.00 0.00 C ATOM 1113 CZ PHE A 74 -8.462 1.737 -6.405 1.00 0.00 C ATOM 0 H PHE A 74 -2.279 2.630 -8.949 1.00 0.00 H new ATOM 0 HA PHE A 74 -3.306 2.116 -6.523 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -4.425 3.553 -8.138 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -4.687 2.215 -9.239 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -6.963 1.875 -9.414 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -5.302 2.504 -5.534 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -9.157 1.455 -8.405 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -7.501 2.070 -4.529 1.00 0.00 H new ATOM 0 HZ PHE A 74 -9.428 1.548 -5.961 1.00 0.00 H new ATOM 1123 N ASP A 75 -4.081 -0.502 -8.395 1.00 0.00 N ATOM 1124 CA ASP A 75 -4.574 -1.877 -8.280 1.00 0.00 C ATOM 1125 C ASP A 75 -3.626 -2.723 -7.433 1.00 0.00 C ATOM 1126 O ASP A 75 -4.069 -3.523 -6.606 1.00 0.00 O ATOM 1127 CB ASP A 75 -4.747 -2.496 -9.652 1.00 0.00 C ATOM 1128 CG ASP A 75 -5.466 -3.829 -9.618 1.00 0.00 C ATOM 1129 OD1 ASP A 75 -6.677 -3.848 -9.304 1.00 0.00 O ATOM 1130 OD2 ASP A 75 -4.841 -4.857 -9.951 1.00 0.00 O1- ATOM 0 H ASP A 75 -3.862 -0.203 -9.345 1.00 0.00 H new ATOM 0 HA ASP A 75 -5.545 -1.849 -7.785 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.303 -1.807 -10.287 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -3.767 -2.631 -10.109 1.00 0.00 H new ATOM 1135 N GLU A 76 -2.318 -2.541 -7.631 1.00 0.00 N ATOM 1136 CA GLU A 76 -1.335 -3.131 -6.730 1.00 0.00 C ATOM 1137 C GLU A 76 -1.606 -2.661 -5.318 1.00 0.00 C ATOM 1138 O GLU A 76 -1.866 -3.449 -4.419 1.00 0.00 O ATOM 1139 CB GLU A 76 0.075 -2.733 -7.096 1.00 0.00 C ATOM 1140 CG GLU A 76 0.577 -3.348 -8.372 1.00 0.00 C ATOM 1141 CD GLU A 76 0.428 -2.416 -9.553 1.00 0.00 C ATOM 1142 OE1 GLU A 76 1.307 -1.554 -9.746 1.00 0.00 O ATOM 1143 OE2 GLU A 76 -0.574 -2.530 -10.287 1.00 0.00 O1- ATOM 0 H GLU A 76 -1.922 -1.997 -8.398 1.00 0.00 H new ATOM 0 HA GLU A 76 -1.424 -4.214 -6.811 1.00 0.00 H new ATOM 0 HB2 GLU A 76 0.123 -1.648 -7.186 1.00 0.00 H new ATOM 0 HB3 GLU A 76 0.743 -3.015 -6.282 1.00 0.00 H new ATOM 0 HG2 GLU A 76 1.626 -3.618 -8.255 1.00 0.00 H new ATOM 0 HG3 GLU A 76 0.030 -4.270 -8.568 1.00 0.00 H new ATOM 1150 N PHE A 77 -1.617 -1.348 -5.177 1.00 0.00 N ATOM 1151 CA PHE A 77 -1.792 -0.666 -3.906 1.00 0.00 C ATOM 1152 C PHE A 77 -2.965 -1.239 -3.124 1.00 0.00 C ATOM 1153 O PHE A 77 -2.921 -1.346 -1.901 1.00 0.00 O ATOM 1154 CB PHE A 77 -2.005 0.821 -4.205 1.00 0.00 C ATOM 1155 CG PHE A 77 -2.299 1.692 -3.022 1.00 0.00 C ATOM 1156 CD1 PHE A 77 -3.562 1.733 -2.462 1.00 0.00 C ATOM 1157 CD2 PHE A 77 -1.307 2.485 -2.485 1.00 0.00 C ATOM 1158 CE1 PHE A 77 -3.820 2.554 -1.380 1.00 0.00 C ATOM 1159 CE2 PHE A 77 -1.557 3.306 -1.409 1.00 0.00 C ATOM 1160 CZ PHE A 77 -2.817 3.341 -0.858 1.00 0.00 C ATOM 0 H PHE A 77 -1.501 -0.709 -5.964 1.00 0.00 H new ATOM 0 HA PHE A 77 -0.908 -0.806 -3.283 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -1.112 1.203 -4.700 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -2.828 0.915 -4.914 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -4.351 1.120 -2.872 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -0.317 2.461 -2.916 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -4.808 2.578 -0.944 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -0.768 3.919 -0.999 1.00 0.00 H new ATOM 0 HZ PHE A 77 -3.020 3.986 -0.016 1.00 0.00 H new ATOM 1170 N LEU A 78 -3.993 -1.627 -3.847 1.00 0.00 N ATOM 1171 CA LEU A 78 -5.215 -2.136 -3.268 1.00 0.00 C ATOM 1172 C LEU A 78 -5.033 -3.565 -2.759 1.00 0.00 C ATOM 1173 O LEU A 78 -5.509 -3.911 -1.674 1.00 0.00 O ATOM 1174 CB LEU A 78 -6.287 -2.035 -4.336 1.00 0.00 C ATOM 1175 CG LEU A 78 -7.723 -2.137 -3.865 1.00 0.00 C ATOM 1176 CD1 LEU A 78 -7.896 -1.533 -2.483 1.00 0.00 C ATOM 1177 CD2 LEU A 78 -8.585 -1.388 -4.836 1.00 0.00 C ATOM 0 H LEU A 78 -4.003 -1.597 -4.867 1.00 0.00 H new ATOM 0 HA LEU A 78 -5.507 -1.552 -2.395 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -6.165 -1.083 -4.853 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -6.112 -2.822 -5.070 1.00 0.00 H new ATOM 0 HG LEU A 78 -8.005 -3.188 -3.812 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -8.938 -1.622 -2.175 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -7.261 -2.062 -1.773 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -7.614 -0.480 -2.508 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -9.626 -1.446 -4.519 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -8.274 -0.344 -4.869 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -8.483 -1.828 -5.828 1.00 0.00 H new ATOM 1189 N VAL A 79 -4.353 -4.393 -3.547 1.00 0.00 N ATOM 1190 CA VAL A 79 -3.876 -5.679 -3.063 1.00 0.00 C ATOM 1191 C VAL A 79 -3.017 -5.463 -1.815 1.00 0.00 C ATOM 1192 O VAL A 79 -3.195 -6.143 -0.819 1.00 0.00 O ATOM 1193 CB VAL A 79 -3.087 -6.451 -4.166 1.00 0.00 C ATOM 1194 CG1 VAL A 79 -1.685 -6.822 -3.726 1.00 0.00 C ATOM 1195 CG2 VAL A 79 -3.814 -7.712 -4.547 1.00 0.00 C ATOM 0 H VAL A 79 -4.122 -4.195 -4.520 1.00 0.00 H new ATOM 0 HA VAL A 79 -4.736 -6.296 -2.802 1.00 0.00 H new ATOM 0 HB VAL A 79 -3.014 -5.776 -5.019 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.181 -7.357 -4.531 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -1.127 -5.917 -3.487 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -1.737 -7.460 -2.843 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -3.250 -8.238 -5.317 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -3.916 -8.352 -3.671 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -4.803 -7.460 -4.930 1.00 0.00 H new ATOM 1205 N MET A 80 -2.123 -4.478 -1.862 1.00 0.00 N ATOM 1206 CA MET A 80 -1.274 -4.146 -0.716 1.00 0.00 C ATOM 1207 C MET A 80 -2.116 -3.771 0.486 1.00 0.00 C ATOM 1208 O MET A 80 -1.848 -4.198 1.609 1.00 0.00 O ATOM 1209 CB MET A 80 -0.336 -2.986 -1.055 1.00 0.00 C ATOM 1210 CG MET A 80 0.560 -2.557 0.074 1.00 0.00 C ATOM 1211 SD MET A 80 1.671 -1.221 -0.394 1.00 0.00 S ATOM 1212 CE MET A 80 0.507 0.056 -0.872 1.00 0.00 C ATOM 0 H MET A 80 -1.966 -3.893 -2.683 1.00 0.00 H new ATOM 0 HA MET A 80 -0.682 -5.029 -0.477 1.00 0.00 H new ATOM 0 HB2 MET A 80 0.284 -3.273 -1.905 1.00 0.00 H new ATOM 0 HB3 MET A 80 -0.935 -2.132 -1.371 1.00 0.00 H new ATOM 0 HG2 MET A 80 -0.052 -2.237 0.917 1.00 0.00 H new ATOM 0 HG3 MET A 80 1.147 -3.411 0.412 1.00 0.00 H new ATOM 0 HE1 MET A 80 0.625 0.278 -1.933 1.00 0.00 H new ATOM 0 HE2 MET A 80 -0.510 -0.290 -0.685 1.00 0.00 H new ATOM 0 HE3 MET A 80 0.697 0.958 -0.290 1.00 0.00 H new ATOM 1222 N MET A 81 -3.126 -2.968 0.234 1.00 0.00 N ATOM 1223 CA MET A 81 -4.026 -2.525 1.247 1.00 0.00 C ATOM 1224 C MET A 81 -4.703 -3.683 1.954 1.00 0.00 C ATOM 1225 O MET A 81 -4.613 -3.790 3.174 1.00 0.00 O ATOM 1226 CB MET A 81 -5.027 -1.590 0.612 1.00 0.00 C ATOM 1227 CG MET A 81 -4.466 -0.202 0.392 1.00 0.00 C ATOM 1228 SD MET A 81 -3.740 0.497 1.890 1.00 0.00 S ATOM 1229 CE MET A 81 -2.026 -0.023 1.737 1.00 0.00 C ATOM 0 H MET A 81 -3.338 -2.606 -0.696 1.00 0.00 H new ATOM 0 HA MET A 81 -3.470 -1.996 2.020 1.00 0.00 H new ATOM 0 HB2 MET A 81 -5.350 -2.003 -0.343 1.00 0.00 H new ATOM 0 HB3 MET A 81 -5.911 -1.525 1.246 1.00 0.00 H new ATOM 0 HG2 MET A 81 -3.709 -0.240 -0.391 1.00 0.00 H new ATOM 0 HG3 MET A 81 -5.260 0.455 0.036 1.00 0.00 H new ATOM 0 HE1 MET A 81 -1.581 -0.105 2.729 1.00 0.00 H new ATOM 0 HE2 MET A 81 -1.983 -0.991 1.238 1.00 0.00 H new ATOM 0 HE3 MET A 81 -1.474 0.712 1.151 1.00 0.00 H new ATOM 1239 N VAL A 82 -5.356 -4.561 1.201 1.00 0.00 N ATOM 1240 CA VAL A 82 -5.964 -5.748 1.796 1.00 0.00 C ATOM 1241 C VAL A 82 -4.900 -6.656 2.421 1.00 0.00 C ATOM 1242 O VAL A 82 -5.187 -7.367 3.366 1.00 0.00 O ATOM 1243 CB VAL A 82 -6.754 -6.594 0.781 1.00 0.00 C ATOM 1244 CG1 VAL A 82 -7.827 -5.815 0.055 1.00 0.00 C ATOM 1245 CG2 VAL A 82 -5.823 -7.193 -0.214 1.00 0.00 C ATOM 0 H VAL A 82 -5.478 -4.477 0.192 1.00 0.00 H new ATOM 0 HA VAL A 82 -6.651 -5.369 2.553 1.00 0.00 H new ATOM 0 HB VAL A 82 -7.257 -7.372 1.356 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.344 -6.472 -0.644 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -8.541 -5.420 0.777 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -7.371 -4.990 -0.492 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -6.389 -7.790 -0.929 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -5.295 -6.399 -0.742 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -5.102 -7.829 0.299 1.00 0.00 H new ATOM 1255 N ARG A 83 -3.675 -6.643 1.888 1.00 0.00 N ATOM 1256 CA ARG A 83 -2.606 -7.491 2.421 1.00 0.00 C ATOM 1257 C ARG A 83 -2.357 -7.177 3.893 1.00 0.00 C ATOM 1258 O ARG A 83 -2.169 -8.079 4.710 1.00 0.00 O ATOM 1259 CB ARG A 83 -1.308 -7.331 1.617 1.00 0.00 C ATOM 1260 CG ARG A 83 -1.366 -7.953 0.230 1.00 0.00 C ATOM 1261 CD ARG A 83 -0.069 -7.764 -0.545 1.00 0.00 C ATOM 1262 NE ARG A 83 0.022 -8.664 -1.703 1.00 0.00 N ATOM 1263 CZ ARG A 83 0.837 -9.718 -1.768 1.00 0.00 C ATOM 1264 NH1 ARG A 83 1.631 -10.002 -0.749 1.00 0.00 N1+ ATOM 1265 NH2 ARG A 83 0.855 -10.499 -2.842 1.00 0.00 N ATOM 0 H ARG A 83 -3.401 -6.061 1.096 1.00 0.00 H new ATOM 0 HA ARG A 83 -2.931 -8.527 2.331 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -1.080 -6.270 1.520 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -0.488 -7.784 2.174 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -1.580 -9.018 0.321 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.189 -7.509 -0.330 1.00 0.00 H new ATOM 0 HD2 ARG A 83 0.002 -6.730 -0.884 1.00 0.00 H new ATOM 0 HD3 ARG A 83 0.778 -7.941 0.118 1.00 0.00 H new ATOM 0 HE ARG A 83 -0.575 -8.471 -2.507 1.00 0.00 H new ATOM 0 HH11 ARG A 83 1.620 -9.415 0.085 1.00 0.00 H new ATOM 0 HH12 ARG A 83 2.255 -10.808 -0.798 1.00 0.00 H new ATOM 0 HH21 ARG A 83 0.241 -10.296 -3.631 1.00 0.00 H new ATOM 0 HH22 ARG A 83 1.483 -11.302 -2.878 1.00 0.00 H new ATOM 1279 N SER A 84 -2.352 -5.894 4.213 1.00 0.00 N ATOM 1280 CA SER A 84 -2.248 -5.450 5.590 1.00 0.00 C ATOM 1281 C SER A 84 -3.614 -5.567 6.277 1.00 0.00 C ATOM 1282 O SER A 84 -3.728 -6.044 7.405 1.00 0.00 O ATOM 1283 CB SER A 84 -1.727 -4.007 5.626 1.00 0.00 C ATOM 1284 OG SER A 84 -1.502 -3.579 6.957 1.00 0.00 O ATOM 0 H SER A 84 -2.419 -5.138 3.532 1.00 0.00 H new ATOM 0 HA SER A 84 -1.543 -6.081 6.131 1.00 0.00 H new ATOM 0 HB2 SER A 84 -0.800 -3.938 5.057 1.00 0.00 H new ATOM 0 HB3 SER A 84 -2.447 -3.345 5.145 1.00 0.00 H new ATOM 0 HG SER A 84 -0.591 -3.228 7.038 1.00 0.00 H new ATOM 1290 N MET A 85 -4.636 -5.131 5.556 1.00 0.00 N ATOM 1291 CA MET A 85 -6.023 -5.182 5.979 1.00 0.00 C ATOM 1292 C MET A 85 -6.469 -6.553 6.481 1.00 0.00 C ATOM 1293 O MET A 85 -7.225 -6.644 7.448 1.00 0.00 O ATOM 1294 CB MET A 85 -6.876 -4.796 4.803 1.00 0.00 C ATOM 1295 CG MET A 85 -7.841 -3.707 5.117 1.00 0.00 C ATOM 1296 SD MET A 85 -9.453 -3.966 4.365 1.00 0.00 S ATOM 1297 CE MET A 85 -9.014 -3.885 2.637 1.00 0.00 C ATOM 0 H MET A 85 -4.516 -4.719 4.631 1.00 0.00 H new ATOM 0 HA MET A 85 -6.132 -4.498 6.820 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.232 -4.478 3.983 1.00 0.00 H new ATOM 0 HB3 MET A 85 -7.425 -5.672 4.456 1.00 0.00 H new ATOM 0 HG2 MET A 85 -7.957 -3.632 6.198 1.00 0.00 H new ATOM 0 HG3 MET A 85 -7.433 -2.756 4.773 1.00 0.00 H new ATOM 0 HE1 MET A 85 -9.401 -2.961 2.206 1.00 0.00 H new ATOM 0 HE2 MET A 85 -7.929 -3.906 2.536 1.00 0.00 H new ATOM 0 HE3 MET A 85 -9.444 -4.738 2.112 1.00 0.00 H new ATOM 1307 N LYS A 86 -6.029 -7.606 5.807 1.00 0.00 N ATOM 1308 CA LYS A 86 -6.446 -8.969 6.127 1.00 0.00 C ATOM 1309 C LYS A 86 -6.199 -9.304 7.588 1.00 0.00 C ATOM 1310 O LYS A 86 -7.134 -9.579 8.341 1.00 0.00 O ATOM 1311 CB LYS A 86 -5.705 -9.970 5.235 1.00 0.00 C ATOM 1312 CG LYS A 86 -6.259 -10.096 3.815 1.00 0.00 C ATOM 1313 CD LYS A 86 -7.458 -11.038 3.709 1.00 0.00 C ATOM 1314 CE LYS A 86 -8.710 -10.479 4.370 1.00 0.00 C ATOM 1315 NZ LYS A 86 -9.910 -11.306 4.081 1.00 0.00 N1+ ATOM 0 H LYS A 86 -5.376 -7.543 5.026 1.00 0.00 H new ATOM 0 HA LYS A 86 -7.518 -9.037 5.942 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -4.657 -9.676 5.176 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.735 -10.951 5.710 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -6.551 -9.108 3.458 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -5.468 -10.452 3.155 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -7.666 -11.236 2.658 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -7.205 -11.993 4.170 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -8.558 -10.426 5.448 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -8.880 -9.460 4.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -10.740 -10.890 4.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -10.072 -11.336 3.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -9.760 -12.272 4.436 1.00 0.00 H new ATOM 1329 N ASP A 87 -4.942 -9.260 7.986 1.00 0.00 N ATOM 1330 CA ASP A 87 -4.550 -9.652 9.328 1.00 0.00 C ATOM 1331 C ASP A 87 -3.076 -9.352 9.518 1.00 0.00 C ATOM 1332 O ASP A 87 -2.306 -9.361 8.556 1.00 0.00 O ATOM 1333 CB ASP A 87 -4.817 -11.148 9.537 1.00 0.00 C ATOM 1334 CG ASP A 87 -4.584 -11.596 10.965 1.00 0.00 C ATOM 1335 OD1 ASP A 87 -3.531 -12.205 11.236 1.00 0.00 O ATOM 1336 OD2 ASP A 87 -5.454 -11.344 11.825 1.00 0.00 O1- ATOM 0 H ASP A 87 -4.169 -8.954 7.395 1.00 0.00 H new ATOM 0 HA ASP A 87 -5.133 -9.092 10.059 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.846 -11.371 9.255 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -4.173 -11.723 8.872 1.00 0.00 H new ATOM 1341 N ASP A 88 -2.680 -9.081 10.751 1.00 0.00 N ATOM 1342 CA ASP A 88 -1.296 -8.742 11.047 1.00 0.00 C ATOM 1343 C ASP A 88 -0.399 -9.963 10.868 1.00 0.00 C ATOM 1344 O ASP A 88 0.818 -9.843 10.778 1.00 0.00 O ATOM 1345 CB ASP A 88 -1.171 -8.189 12.462 1.00 0.00 C ATOM 1346 CG ASP A 88 0.142 -7.466 12.704 1.00 0.00 C ATOM 1347 OD1 ASP A 88 0.260 -6.291 12.299 1.00 0.00 O ATOM 1348 OD2 ASP A 88 1.051 -8.048 13.327 1.00 0.00 O1- ATOM 0 H ASP A 88 -3.297 -9.089 11.564 1.00 0.00 H new ATOM 0 HA ASP A 88 -0.973 -7.971 10.348 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -1.997 -7.504 12.652 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -1.265 -9.008 13.175 1.00 0.00 H new ATOM 1353 N SER A 89 -1.009 -11.144 10.810 1.00 0.00 N ATOM 1354 CA SER A 89 -0.271 -12.365 10.533 1.00 0.00 C ATOM 1355 C SER A 89 -0.430 -12.791 9.077 1.00 0.00 C ATOM 1356 O SER A 89 0.261 -13.701 8.621 1.00 0.00 O ATOM 1357 CB SER A 89 -0.720 -13.491 11.446 1.00 0.00 C ATOM 1358 OG SER A 89 -0.504 -13.163 12.806 1.00 0.00 O ATOM 0 H SER A 89 -2.010 -11.277 10.951 1.00 0.00 H new ATOM 0 HA SER A 89 0.782 -12.155 10.721 1.00 0.00 H new ATOM 0 HB2 SER A 89 -1.778 -13.696 11.282 1.00 0.00 H new ATOM 0 HB3 SER A 89 -0.176 -14.403 11.198 1.00 0.00 H new ATOM 0 HG SER A 89 -0.803 -13.904 13.373 1.00 0.00 H new ATOM 1364 N LYS A 90 -1.344 -12.139 8.350 1.00 0.00 N ATOM 1365 CA LYS A 90 -1.517 -12.421 6.925 1.00 0.00 C ATOM 1366 C LYS A 90 -0.197 -12.191 6.217 1.00 0.00 C ATOM 1367 O LYS A 90 0.221 -12.968 5.358 1.00 0.00 O ATOM 1368 CB LYS A 90 -2.591 -11.532 6.302 1.00 0.00 C ATOM 1369 CG LYS A 90 -2.848 -11.877 4.847 1.00 0.00 C ATOM 1370 CD LYS A 90 -3.591 -13.195 4.711 1.00 0.00 C ATOM 1371 CE LYS A 90 -3.540 -13.731 3.292 1.00 0.00 C ATOM 1372 NZ LYS A 90 -2.145 -13.989 2.837 1.00 0.00 N1+ ATOM 0 H LYS A 90 -1.967 -11.422 8.721 1.00 0.00 H new ATOM 0 HA LYS A 90 -1.837 -13.457 6.814 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -3.518 -11.634 6.867 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.285 -10.489 6.378 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.428 -11.081 4.380 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -1.900 -11.936 4.313 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -3.157 -13.928 5.391 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -4.630 -13.058 5.010 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -4.116 -14.655 3.234 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -4.014 -13.017 2.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -2.097 -14.920 2.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -1.858 -13.252 2.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -1.504 -13.975 3.656 1.00 0.00 H new ATOM 1386 N GLY A 136 0.459 -11.121 6.614 1.00 0.00 N ATOM 1387 CA GLY A 136 1.775 -10.823 6.126 1.00 0.00 C ATOM 1388 C GLY A 136 2.562 -10.039 7.146 1.00 0.00 C ATOM 1389 O GLY A 136 2.194 -8.913 7.479 1.00 0.00 O ATOM 0 H GLY A 136 0.092 -10.441 7.280 1.00 0.00 H new ATOM 0 HA2 GLY A 136 2.298 -11.750 5.891 1.00 0.00 H new ATOM 0 HA3 GLY A 136 1.703 -10.253 5.200 1.00 0.00 H new ATOM 1393 N LYS A 137 3.631 -10.633 7.660 1.00 0.00 N ATOM 1394 CA LYS A 137 4.498 -9.948 8.605 1.00 0.00 C ATOM 1395 C LYS A 137 5.911 -10.510 8.528 1.00 0.00 C ATOM 1396 O LYS A 137 6.782 -9.935 7.878 1.00 0.00 O ATOM 1397 CB LYS A 137 3.961 -10.077 10.030 1.00 0.00 C ATOM 1398 CG LYS A 137 4.065 -8.791 10.825 1.00 0.00 C ATOM 1399 CD LYS A 137 3.086 -7.752 10.308 1.00 0.00 C ATOM 1400 CE LYS A 137 3.259 -6.423 11.010 1.00 0.00 C ATOM 1401 NZ LYS A 137 3.212 -6.569 12.488 1.00 0.00 N1+ ATOM 0 H LYS A 137 3.917 -11.587 7.438 1.00 0.00 H new ATOM 0 HA LYS A 137 4.520 -8.891 8.340 1.00 0.00 H new ATOM 0 HB2 LYS A 137 2.917 -10.389 9.991 1.00 0.00 H new ATOM 0 HB3 LYS A 137 4.510 -10.863 10.549 1.00 0.00 H new ATOM 0 HG2 LYS A 137 3.865 -8.993 11.877 1.00 0.00 H new ATOM 0 HG3 LYS A 137 5.081 -8.402 10.762 1.00 0.00 H new ATOM 0 HD2 LYS A 137 3.229 -7.619 9.236 1.00 0.00 H new ATOM 0 HD3 LYS A 137 2.066 -8.109 10.451 1.00 0.00 H new ATOM 0 HE2 LYS A 137 4.211 -5.979 10.719 1.00 0.00 H new ATOM 0 HE3 LYS A 137 2.476 -5.737 10.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 2.847 -5.692 12.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 2.587 -7.362 12.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 4.169 -6.755 12.849 1.00 0.00 H new ATOM 1415 N PHE A 138 6.122 -11.646 9.176 1.00 0.00 N ATOM 1416 CA PHE A 138 7.414 -12.309 9.152 1.00 0.00 C ATOM 1417 C PHE A 138 7.347 -13.508 8.217 1.00 0.00 C ATOM 1418 O PHE A 138 8.263 -13.748 7.428 1.00 0.00 O ATOM 1419 CB PHE A 138 7.813 -12.750 10.563 1.00 0.00 C ATOM 1420 CG PHE A 138 9.208 -13.303 10.657 1.00 0.00 C ATOM 1421 CD1 PHE A 138 9.439 -14.666 10.543 1.00 0.00 C ATOM 1422 CD2 PHE A 138 10.287 -12.461 10.861 1.00 0.00 C ATOM 1423 CE1 PHE A 138 10.720 -15.175 10.627 1.00 0.00 C ATOM 1424 CE2 PHE A 138 11.571 -12.964 10.947 1.00 0.00 C ATOM 1425 CZ PHE A 138 11.787 -14.323 10.830 1.00 0.00 C ATOM 0 H PHE A 138 5.411 -12.128 9.726 1.00 0.00 H new ATOM 0 HA PHE A 138 8.170 -11.613 8.788 1.00 0.00 H new ATOM 0 HB2 PHE A 138 7.724 -11.899 11.238 1.00 0.00 H new ATOM 0 HB3 PHE A 138 7.109 -13.506 10.909 1.00 0.00 H new ATOM 0 HD1 PHE A 138 8.607 -15.337 10.387 1.00 0.00 H new ATOM 0 HD2 PHE A 138 10.123 -11.398 10.954 1.00 0.00 H new ATOM 0 HE1 PHE A 138 10.887 -16.238 10.534 1.00 0.00 H new ATOM 0 HE2 PHE A 138 12.404 -12.296 11.105 1.00 0.00 H new ATOM 0 HZ PHE A 138 12.790 -14.719 10.897 1.00 0.00 H new ATOM 1435 N LYS A 139 6.254 -14.258 8.315 1.00 0.00 N ATOM 1436 CA LYS A 139 5.987 -15.342 7.382 1.00 0.00 C ATOM 1437 C LYS A 139 5.702 -14.764 6.012 1.00 0.00 C ATOM 1438 O LYS A 139 5.157 -13.663 5.913 1.00 0.00 O ATOM 1439 CB LYS A 139 4.818 -16.190 7.857 1.00 0.00 C ATOM 1440 CG LYS A 139 5.107 -16.936 9.145 1.00 0.00 C ATOM 1441 CD LYS A 139 3.925 -17.782 9.580 1.00 0.00 C ATOM 1442 CE LYS A 139 4.261 -18.605 10.813 1.00 0.00 C ATOM 1443 NZ LYS A 139 3.111 -19.426 11.265 1.00 0.00 N1+ ATOM 0 H LYS A 139 5.540 -14.133 9.032 1.00 0.00 H new ATOM 0 HA LYS A 139 6.864 -15.987 7.327 1.00 0.00 H new ATOM 0 HB2 LYS A 139 3.948 -15.549 8.003 1.00 0.00 H new ATOM 0 HB3 LYS A 139 4.558 -16.908 7.079 1.00 0.00 H new ATOM 0 HG2 LYS A 139 5.980 -17.574 9.008 1.00 0.00 H new ATOM 0 HG3 LYS A 139 5.353 -16.223 9.932 1.00 0.00 H new ATOM 0 HD2 LYS A 139 3.072 -17.138 9.791 1.00 0.00 H new ATOM 0 HD3 LYS A 139 3.630 -18.445 8.767 1.00 0.00 H new ATOM 0 HE2 LYS A 139 5.107 -19.256 10.594 1.00 0.00 H new ATOM 0 HE3 LYS A 139 4.570 -17.940 11.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 3.384 -19.971 12.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 2.311 -18.804 11.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 2.831 -20.079 10.506 1.00 0.00 H new ATOM 1457 N ARG A 140 6.064 -15.513 4.971 1.00 0.00 N ATOM 1458 CA ARG A 140 6.075 -15.001 3.603 1.00 0.00 C ATOM 1459 C ARG A 140 7.176 -13.966 3.438 1.00 0.00 C ATOM 1460 O ARG A 140 7.729 -13.452 4.414 1.00 0.00 O ATOM 1461 CB ARG A 140 4.730 -14.376 3.203 1.00 0.00 C ATOM 1462 CG ARG A 140 3.684 -15.373 2.721 1.00 0.00 C ATOM 1463 CD ARG A 140 3.209 -16.304 3.825 1.00 0.00 C ATOM 1464 NE ARG A 140 2.423 -15.607 4.846 1.00 0.00 N ATOM 1465 CZ ARG A 140 1.569 -16.218 5.673 1.00 0.00 C ATOM 1466 NH1 ARG A 140 1.414 -17.535 5.620 1.00 0.00 N1+ ATOM 1467 NH2 ARG A 140 0.864 -15.513 6.547 1.00 0.00 N ATOM 0 H ARG A 140 6.356 -16.487 5.052 1.00 0.00 H new ATOM 0 HA ARG A 140 6.258 -15.852 2.948 1.00 0.00 H new ATOM 0 HB2 ARG A 140 4.328 -13.833 4.059 1.00 0.00 H new ATOM 0 HB3 ARG A 140 4.905 -13.644 2.415 1.00 0.00 H new ATOM 0 HG2 ARG A 140 2.830 -14.830 2.316 1.00 0.00 H new ATOM 0 HG3 ARG A 140 4.100 -15.965 1.906 1.00 0.00 H new ATOM 0 HD2 ARG A 140 2.607 -17.102 3.389 1.00 0.00 H new ATOM 0 HD3 ARG A 140 4.072 -16.776 4.295 1.00 0.00 H new ATOM 0 HE ARG A 140 2.534 -14.597 4.931 1.00 0.00 H new ATOM 0 HH11 ARG A 140 1.948 -18.085 4.946 1.00 0.00 H new ATOM 0 HH12 ARG A 140 0.761 -17.998 6.253 1.00 0.00 H new ATOM 0 HH21 ARG A 140 0.972 -14.500 6.590 1.00 0.00 H new ATOM 0 HH22 ARG A 140 0.214 -15.984 7.176 1.00 0.00 H new ATOM 1481 N PRO A 141 7.534 -13.696 2.187 1.00 0.00 N ATOM 1482 CA PRO A 141 8.442 -12.605 1.810 1.00 0.00 C ATOM 1483 C PRO A 141 7.837 -11.233 2.136 1.00 0.00 C ATOM 1484 O PRO A 141 7.683 -10.382 1.257 1.00 0.00 O ATOM 1485 CB PRO A 141 8.600 -12.785 0.290 1.00 0.00 C ATOM 1486 CG PRO A 141 8.160 -14.184 0.016 1.00 0.00 C ATOM 1487 CD PRO A 141 7.097 -14.476 1.029 1.00 0.00 C ATOM 0 HA PRO A 141 9.388 -12.641 2.350 1.00 0.00 H new ATOM 0 HB2 PRO A 141 7.991 -12.066 -0.257 1.00 0.00 H new ATOM 0 HB3 PRO A 141 9.633 -12.629 -0.020 1.00 0.00 H new ATOM 0 HG2 PRO A 141 7.773 -14.282 -0.998 1.00 0.00 H new ATOM 0 HG3 PRO A 141 8.992 -14.882 0.108 1.00 0.00 H new ATOM 0 HD2 PRO A 141 6.111 -14.168 0.682 1.00 0.00 H new ATOM 0 HD3 PRO A 141 7.036 -15.540 1.257 1.00 0.00 H new ATOM 1495 N THR A 142 7.497 -11.043 3.407 1.00 0.00 N ATOM 1496 CA THR A 142 6.825 -9.839 3.865 1.00 0.00 C ATOM 1497 C THR A 142 7.829 -8.853 4.470 1.00 0.00 C ATOM 1498 O THR A 142 9.032 -8.956 4.226 1.00 0.00 O ATOM 1499 CB THR A 142 5.732 -10.183 4.897 1.00 0.00 C ATOM 1500 OG1 THR A 142 5.132 -11.440 4.559 1.00 0.00 O ATOM 1501 CG2 THR A 142 4.644 -9.113 4.922 1.00 0.00 C ATOM 0 H THR A 142 7.681 -11.721 4.146 1.00 0.00 H new ATOM 0 HA THR A 142 6.354 -9.369 3.002 1.00 0.00 H new ATOM 0 HB THR A 142 6.200 -10.235 5.880 1.00 0.00 H new ATOM 0 HG1 THR A 142 5.493 -12.142 5.140 1.00 0.00 H new ATOM 0 HG21 THR A 142 3.887 -9.381 5.658 1.00 0.00 H new ATOM 0 HG22 THR A 142 5.085 -8.152 5.188 1.00 0.00 H new ATOM 0 HG23 THR A 142 4.183 -9.040 3.937 1.00 0.00 H new ATOM 1509 N LEU A 143 7.339 -7.931 5.288 1.00 0.00 N ATOM 1510 CA LEU A 143 8.068 -6.719 5.583 1.00 0.00 C ATOM 1511 C LEU A 143 8.271 -6.508 7.070 1.00 0.00 C ATOM 1512 O LEU A 143 7.315 -6.442 7.840 1.00 0.00 O ATOM 1513 CB LEU A 143 7.327 -5.513 5.004 1.00 0.00 C ATOM 1514 CG LEU A 143 7.353 -5.393 3.481 1.00 0.00 C ATOM 1515 CD1 LEU A 143 8.771 -5.543 2.967 1.00 0.00 C ATOM 1516 CD2 LEU A 143 6.442 -6.422 2.834 1.00 0.00 C ATOM 0 H LEU A 143 6.436 -8.006 5.757 1.00 0.00 H new ATOM 0 HA LEU A 143 9.052 -6.821 5.125 1.00 0.00 H new ATOM 0 HB2 LEU A 143 6.288 -5.557 5.330 1.00 0.00 H new ATOM 0 HB3 LEU A 143 7.757 -4.606 5.430 1.00 0.00 H new ATOM 0 HG LEU A 143 6.984 -4.403 3.213 1.00 0.00 H new ATOM 0 HD11 LEU A 143 8.775 -5.456 1.881 1.00 0.00 H new ATOM 0 HD12 LEU A 143 9.398 -4.762 3.396 1.00 0.00 H new ATOM 0 HD13 LEU A 143 9.161 -6.520 3.254 1.00 0.00 H new ATOM 0 HD21 LEU A 143 6.481 -6.312 1.750 1.00 0.00 H new ATOM 0 HD22 LEU A 143 6.771 -7.424 3.110 1.00 0.00 H new ATOM 0 HD23 LEU A 143 5.419 -6.269 3.177 1.00 0.00 H new ATOM 1528 N ARG A 144 9.526 -6.399 7.459 1.00 0.00 N ATOM 1529 CA ARG A 144 9.873 -5.933 8.784 1.00 0.00 C ATOM 1530 C ARG A 144 10.039 -4.419 8.734 1.00 0.00 C ATOM 1531 O ARG A 144 10.750 -3.909 7.866 1.00 0.00 O ATOM 1532 CB ARG A 144 11.166 -6.608 9.266 1.00 0.00 C ATOM 1533 CG ARG A 144 11.835 -5.902 10.437 1.00 0.00 C ATOM 1534 CD ARG A 144 10.949 -5.884 11.670 1.00 0.00 C ATOM 1535 NE ARG A 144 11.520 -5.063 12.734 1.00 0.00 N ATOM 1536 CZ ARG A 144 10.915 -4.810 13.891 1.00 0.00 C ATOM 1537 NH1 ARG A 144 9.714 -5.313 14.145 1.00 0.00 N1+ ATOM 1538 NH2 ARG A 144 11.516 -4.045 14.793 1.00 0.00 N ATOM 0 H ARG A 144 10.327 -6.629 6.870 1.00 0.00 H new ATOM 0 HA ARG A 144 9.083 -6.191 9.489 1.00 0.00 H new ATOM 0 HB2 ARG A 144 10.942 -7.635 9.555 1.00 0.00 H new ATOM 0 HB3 ARG A 144 11.870 -6.657 8.435 1.00 0.00 H new ATOM 0 HG2 ARG A 144 12.775 -6.401 10.673 1.00 0.00 H new ATOM 0 HG3 ARG A 144 12.080 -4.879 10.152 1.00 0.00 H new ATOM 0 HD2 ARG A 144 9.964 -5.501 11.404 1.00 0.00 H new ATOM 0 HD3 ARG A 144 10.809 -6.902 12.032 1.00 0.00 H new ATOM 0 HE ARG A 144 12.443 -4.657 12.580 1.00 0.00 H new ATOM 0 HH11 ARG A 144 9.249 -5.898 13.451 1.00 0.00 H new ATOM 0 HH12 ARG A 144 9.256 -5.115 15.035 1.00 0.00 H new ATOM 0 HH21 ARG A 144 12.438 -3.654 14.597 1.00 0.00 H new ATOM 0 HH22 ARG A 144 11.056 -3.848 15.682 1.00 0.00 H new ATOM 1552 N ARG A 145 9.344 -3.716 9.632 1.00 0.00 N ATOM 1553 CA ARG A 145 9.421 -2.251 9.740 1.00 0.00 C ATOM 1554 C ARG A 145 8.634 -1.559 8.625 1.00 0.00 C ATOM 1555 O ARG A 145 7.802 -0.693 8.890 1.00 0.00 O ATOM 1556 CB ARG A 145 10.874 -1.769 9.733 1.00 0.00 C ATOM 1557 CG ARG A 145 11.196 -0.744 10.808 1.00 0.00 C ATOM 1558 CD ARG A 145 10.339 0.502 10.681 1.00 0.00 C ATOM 1559 NE ARG A 145 10.777 1.565 11.587 1.00 0.00 N ATOM 1560 CZ ARG A 145 9.986 2.188 12.464 1.00 0.00 C ATOM 1561 NH1 ARG A 145 8.722 1.813 12.619 1.00 0.00 N1+ ATOM 1562 NH2 ARG A 145 10.473 3.177 13.205 1.00 0.00 N ATOM 0 H ARG A 145 8.710 -4.144 10.307 1.00 0.00 H new ATOM 0 HA ARG A 145 8.969 -1.980 10.694 1.00 0.00 H new ATOM 0 HB2 ARG A 145 11.531 -2.630 9.859 1.00 0.00 H new ATOM 0 HB3 ARG A 145 11.097 -1.338 8.757 1.00 0.00 H new ATOM 0 HG2 ARG A 145 11.044 -1.190 11.791 1.00 0.00 H new ATOM 0 HG3 ARG A 145 12.248 -0.468 10.742 1.00 0.00 H new ATOM 0 HD2 ARG A 145 10.376 0.864 9.653 1.00 0.00 H new ATOM 0 HD3 ARG A 145 9.300 0.250 10.893 1.00 0.00 H new ATOM 0 HE ARG A 145 11.756 1.850 11.545 1.00 0.00 H new ATOM 0 HH11 ARG A 145 8.347 1.043 12.066 1.00 0.00 H new ATOM 0 HH12 ARG A 145 8.126 2.295 13.292 1.00 0.00 H new ATOM 0 HH21 ARG A 145 11.448 3.458 13.103 1.00 0.00 H new ATOM 0 HH22 ARG A 145 9.872 3.655 13.876 1.00 0.00 H new ATOM 1576 N VAL A 146 8.887 -1.947 7.382 1.00 0.00 N ATOM 1577 CA VAL A 146 8.223 -1.322 6.241 1.00 0.00 C ATOM 1578 C VAL A 146 6.913 -1.996 5.920 1.00 0.00 C ATOM 1579 O VAL A 146 6.451 -1.974 4.781 1.00 0.00 O ATOM 1580 CB VAL A 146 9.089 -1.312 4.974 1.00 0.00 C ATOM 1581 CG1 VAL A 146 10.015 -0.145 4.987 1.00 0.00 C ATOM 1582 CG2 VAL A 146 9.905 -2.558 4.837 1.00 0.00 C ATOM 0 H VAL A 146 9.544 -2.688 7.137 1.00 0.00 H new ATOM 0 HA VAL A 146 8.045 -0.291 6.546 1.00 0.00 H new ATOM 0 HB VAL A 146 8.403 -1.248 4.129 1.00 0.00 H new ATOM 0 HG11 VAL A 146 10.622 -0.152 4.082 1.00 0.00 H new ATOM 0 HG12 VAL A 146 9.437 0.778 5.029 1.00 0.00 H new ATOM 0 HG13 VAL A 146 10.665 -0.206 5.860 1.00 0.00 H new ATOM 0 HG21 VAL A 146 10.501 -2.504 3.926 1.00 0.00 H new ATOM 0 HG22 VAL A 146 10.566 -2.656 5.698 1.00 0.00 H new ATOM 0 HG23 VAL A 146 9.243 -3.423 4.787 1.00 0.00 H new ATOM 1592 N ARG A 147 6.305 -2.585 6.920 1.00 0.00 N ATOM 1593 CA ARG A 147 5.027 -3.206 6.723 1.00 0.00 C ATOM 1594 C ARG A 147 3.931 -2.182 6.938 1.00 0.00 C ATOM 1595 O ARG A 147 3.533 -1.906 8.070 1.00 0.00 O ATOM 1596 CB ARG A 147 4.829 -4.387 7.664 1.00 0.00 C ATOM 1597 CG ARG A 147 3.528 -5.123 7.414 1.00 0.00 C ATOM 1598 CD ARG A 147 3.518 -5.762 6.040 1.00 0.00 C ATOM 1599 NE ARG A 147 2.269 -6.460 5.780 1.00 0.00 N ATOM 1600 CZ ARG A 147 1.919 -6.932 4.590 1.00 0.00 C ATOM 1601 NH1 ARG A 147 2.658 -6.658 3.517 1.00 0.00 N1+ ATOM 1602 NH2 ARG A 147 0.812 -7.647 4.471 1.00 0.00 N ATOM 0 H ARG A 147 6.674 -2.645 7.869 1.00 0.00 H new ATOM 0 HA ARG A 147 4.984 -3.585 5.702 1.00 0.00 H new ATOM 0 HB2 ARG A 147 5.662 -5.081 7.550 1.00 0.00 H new ATOM 0 HB3 ARG A 147 4.849 -4.032 8.695 1.00 0.00 H new ATOM 0 HG2 ARG A 147 3.388 -5.890 8.176 1.00 0.00 H new ATOM 0 HG3 ARG A 147 2.692 -4.430 7.502 1.00 0.00 H new ATOM 0 HD2 ARG A 147 3.671 -4.995 5.281 1.00 0.00 H new ATOM 0 HD3 ARG A 147 4.350 -6.462 5.958 1.00 0.00 H new ATOM 0 HE ARG A 147 1.624 -6.595 6.558 1.00 0.00 H new ATOM 0 HH11 ARG A 147 3.496 -6.084 3.608 1.00 0.00 H new ATOM 0 HH12 ARG A 147 2.386 -7.022 2.604 1.00 0.00 H new ATOM 0 HH21 ARG A 147 0.234 -7.832 5.291 1.00 0.00 H new ATOM 0 HH22 ARG A 147 0.537 -8.013 3.560 1.00 0.00 H new ATOM 1616 N ILE A 148 3.483 -1.597 5.844 1.00 0.00 N ATOM 1617 CA ILE A 148 2.390 -0.647 5.874 1.00 0.00 C ATOM 1618 C ILE A 148 1.168 -1.240 6.552 1.00 0.00 C ATOM 1619 O ILE A 148 0.616 -2.232 6.085 1.00 0.00 O ATOM 1620 CB ILE A 148 1.994 -0.202 4.463 1.00 0.00 C ATOM 1621 CG1 ILE A 148 3.089 0.673 3.859 1.00 0.00 C ATOM 1622 CG2 ILE A 148 0.658 0.525 4.479 1.00 0.00 C ATOM 1623 CD1 ILE A 148 2.719 1.230 2.511 1.00 0.00 C ATOM 0 H ILE A 148 3.865 -1.766 4.914 1.00 0.00 H new ATOM 0 HA ILE A 148 2.743 0.216 6.439 1.00 0.00 H new ATOM 0 HB ILE A 148 1.880 -1.088 3.839 1.00 0.00 H new ATOM 0 HG12 ILE A 148 3.305 1.497 4.540 1.00 0.00 H new ATOM 0 HG13 ILE A 148 4.004 0.088 3.766 1.00 0.00 H new ATOM 0 HG21 ILE A 148 0.398 0.831 3.466 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -0.114 -0.140 4.866 1.00 0.00 H new ATOM 0 HG23 ILE A 148 0.731 1.406 5.117 1.00 0.00 H new ATOM 0 HD11 ILE A 148 3.537 1.843 2.134 1.00 0.00 H new ATOM 0 HD12 ILE A 148 2.530 0.410 1.818 1.00 0.00 H new ATOM 0 HD13 ILE A 148 1.821 1.841 2.604 1.00 0.00 H new ATOM 1635 N SER A 149 0.778 -0.656 7.666 1.00 0.00 N ATOM 1636 CA SER A 149 -0.507 -0.954 8.257 1.00 0.00 C ATOM 1637 C SER A 149 -1.565 -0.145 7.520 1.00 0.00 C ATOM 1638 O SER A 149 -1.351 1.041 7.252 1.00 0.00 O ATOM 1639 CB SER A 149 -0.494 -0.619 9.745 1.00 0.00 C ATOM 1640 OG SER A 149 0.575 -1.280 10.408 1.00 0.00 O ATOM 0 H SER A 149 1.334 0.028 8.180 1.00 0.00 H new ATOM 0 HA SER A 149 -0.732 -2.017 8.165 1.00 0.00 H new ATOM 0 HB2 SER A 149 -0.398 0.459 9.878 1.00 0.00 H new ATOM 0 HB3 SER A 149 -1.442 -0.912 10.195 1.00 0.00 H new ATOM 0 HG SER A 149 0.563 -1.048 11.360 1.00 0.00 H new ATOM 1646 N ALA A 150 -2.676 -0.794 7.175 1.00 0.00 N ATOM 1647 CA ALA A 150 -3.713 -0.189 6.336 1.00 0.00 C ATOM 1648 C ALA A 150 -4.036 1.238 6.756 1.00 0.00 C ATOM 1649 O ALA A 150 -3.776 2.180 6.011 1.00 0.00 O ATOM 1650 CB ALA A 150 -4.971 -1.048 6.373 1.00 0.00 C ATOM 0 H ALA A 150 -2.883 -1.749 7.467 1.00 0.00 H new ATOM 0 HA ALA A 150 -3.328 -0.143 5.317 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -5.740 -0.594 5.748 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -4.741 -2.046 5.999 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -5.333 -1.119 7.399 1.00 0.00 H new ATOM 1656 N ASP A 151 -4.549 1.402 7.966 1.00 0.00 N ATOM 1657 CA ASP A 151 -4.993 2.713 8.423 1.00 0.00 C ATOM 1658 C ASP A 151 -3.808 3.607 8.780 1.00 0.00 C ATOM 1659 O ASP A 151 -3.928 4.832 8.787 1.00 0.00 O ATOM 1660 CB ASP A 151 -5.944 2.617 9.614 1.00 0.00 C ATOM 1661 CG ASP A 151 -7.069 1.623 9.397 1.00 0.00 C ATOM 1662 OD1 ASP A 151 -6.887 0.434 9.733 1.00 0.00 O ATOM 1663 OD2 ASP A 151 -8.140 2.027 8.899 1.00 0.00 O1- ATOM 0 H ASP A 151 -4.668 0.651 8.646 1.00 0.00 H new ATOM 0 HA ASP A 151 -5.537 3.160 7.591 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -5.379 2.330 10.501 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -6.369 3.601 9.812 1.00 0.00 H new ATOM 1668 N ALA A 152 -2.669 2.995 9.082 1.00 0.00 N ATOM 1669 CA ALA A 152 -1.471 3.746 9.445 1.00 0.00 C ATOM 1670 C ALA A 152 -1.056 4.690 8.329 1.00 0.00 C ATOM 1671 O ALA A 152 -0.750 5.850 8.571 1.00 0.00 O ATOM 1672 CB ALA A 152 -0.329 2.807 9.785 1.00 0.00 C ATOM 0 H ALA A 152 -2.549 1.982 9.083 1.00 0.00 H new ATOM 0 HA ALA A 152 -1.709 4.341 10.327 1.00 0.00 H new ATOM 0 HB1 ALA A 152 0.553 3.389 10.052 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -0.615 2.175 10.626 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -0.103 2.181 8.921 1.00 0.00 H new ATOM 1678 N MET A 153 -1.038 4.203 7.103 1.00 0.00 N ATOM 1679 CA MET A 153 -0.732 5.075 5.981 1.00 0.00 C ATOM 1680 C MET A 153 -1.962 5.887 5.596 1.00 0.00 C ATOM 1681 O MET A 153 -1.848 6.982 5.053 1.00 0.00 O ATOM 1682 CB MET A 153 -0.229 4.290 4.774 1.00 0.00 C ATOM 1683 CG MET A 153 -1.244 3.308 4.219 1.00 0.00 C ATOM 1684 SD MET A 153 -1.051 3.071 2.447 1.00 0.00 S ATOM 1685 CE MET A 153 -1.663 4.645 1.862 1.00 0.00 C ATOM 0 H MET A 153 -1.227 3.231 6.859 1.00 0.00 H new ATOM 0 HA MET A 153 0.065 5.748 6.296 1.00 0.00 H new ATOM 0 HB2 MET A 153 0.053 4.991 3.988 1.00 0.00 H new ATOM 0 HB3 MET A 153 0.673 3.747 5.055 1.00 0.00 H new ATOM 0 HG2 MET A 153 -1.137 2.350 4.727 1.00 0.00 H new ATOM 0 HG3 MET A 153 -2.251 3.669 4.429 1.00 0.00 H new ATOM 0 HE1 MET A 153 -1.163 4.906 0.929 1.00 0.00 H new ATOM 0 HE2 MET A 153 -2.737 4.577 1.691 1.00 0.00 H new ATOM 0 HE3 MET A 153 -1.462 5.414 2.608 1.00 0.00 H new ATOM 1695 N MET A 154 -3.135 5.337 5.893 1.00 0.00 N ATOM 1696 CA MET A 154 -4.401 6.021 5.644 1.00 0.00 C ATOM 1697 C MET A 154 -4.372 7.408 6.243 1.00 0.00 C ATOM 1698 O MET A 154 -4.535 8.404 5.543 1.00 0.00 O ATOM 1699 CB MET A 154 -5.560 5.219 6.250 1.00 0.00 C ATOM 1700 CG MET A 154 -5.987 3.987 5.459 1.00 0.00 C ATOM 1701 SD MET A 154 -6.643 4.363 3.827 1.00 0.00 S ATOM 1702 CE MET A 154 -5.138 4.311 2.870 1.00 0.00 C ATOM 0 H MET A 154 -3.236 4.412 6.310 1.00 0.00 H new ATOM 0 HA MET A 154 -4.547 6.103 4.567 1.00 0.00 H new ATOM 0 HB2 MET A 154 -5.276 4.905 7.254 1.00 0.00 H new ATOM 0 HB3 MET A 154 -6.421 5.879 6.354 1.00 0.00 H new ATOM 0 HG2 MET A 154 -5.131 3.321 5.352 1.00 0.00 H new ATOM 0 HG3 MET A 154 -6.743 3.445 6.028 1.00 0.00 H new ATOM 0 HE1 MET A 154 -5.343 3.875 1.892 1.00 0.00 H new ATOM 0 HE2 MET A 154 -4.752 5.323 2.743 1.00 0.00 H new ATOM 0 HE3 MET A 154 -4.397 3.703 3.390 1.00 0.00 H new ATOM 1712 N GLN A 155 -4.122 7.465 7.532 1.00 0.00 N ATOM 1713 CA GLN A 155 -4.074 8.727 8.240 1.00 0.00 C ATOM 1714 C GLN A 155 -3.017 9.661 7.661 1.00 0.00 C ATOM 1715 O GLN A 155 -3.273 10.834 7.414 1.00 0.00 O ATOM 1716 CB GLN A 155 -3.762 8.499 9.707 1.00 0.00 C ATOM 1717 CG GLN A 155 -2.557 7.634 9.914 1.00 0.00 C ATOM 1718 CD GLN A 155 -2.166 7.485 11.362 1.00 0.00 C ATOM 1719 OE1 GLN A 155 -3.014 7.299 12.233 1.00 0.00 O ATOM 1720 NE2 GLN A 155 -0.879 7.633 11.629 1.00 0.00 N ATOM 0 H GLN A 155 -3.948 6.647 8.116 1.00 0.00 H new ATOM 0 HA GLN A 155 -5.054 9.191 8.129 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -3.602 9.461 10.194 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -4.623 8.037 10.190 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -2.752 6.647 9.495 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -1.718 8.055 9.361 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -0.215 7.785 10.870 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -0.551 7.595 12.594 1.00 0.00 H new ATOM 1729 N ALA A 156 -1.827 9.112 7.473 1.00 0.00 N ATOM 1730 CA ALA A 156 -0.670 9.861 6.992 1.00 0.00 C ATOM 1731 C ALA A 156 -0.959 10.609 5.699 1.00 0.00 C ATOM 1732 O ALA A 156 -0.558 11.760 5.540 1.00 0.00 O ATOM 1733 CB ALA A 156 0.507 8.919 6.797 1.00 0.00 C ATOM 0 H ALA A 156 -1.633 8.127 7.651 1.00 0.00 H new ATOM 0 HA ALA A 156 -0.427 10.608 7.748 1.00 0.00 H new ATOM 0 HB1 ALA A 156 1.368 9.482 6.438 1.00 0.00 H new ATOM 0 HB2 ALA A 156 0.754 8.444 7.746 1.00 0.00 H new ATOM 0 HB3 ALA A 156 0.244 8.154 6.067 1.00 0.00 H new ATOM 1739 N LEU A 157 -1.653 9.964 4.775 1.00 0.00 N ATOM 1740 CA LEU A 157 -1.935 10.583 3.490 1.00 0.00 C ATOM 1741 C LEU A 157 -3.261 11.333 3.502 1.00 0.00 C ATOM 1742 O LEU A 157 -3.357 12.454 3.010 1.00 0.00 O ATOM 1743 CB LEU A 157 -1.941 9.553 2.371 1.00 0.00 C ATOM 1744 CG LEU A 157 -0.559 9.085 1.926 1.00 0.00 C ATOM 1745 CD1 LEU A 157 0.362 10.264 1.663 1.00 0.00 C ATOM 1746 CD2 LEU A 157 0.043 8.176 2.964 1.00 0.00 C ATOM 0 H LEU A 157 -2.028 9.022 4.888 1.00 0.00 H new ATOM 0 HA LEU A 157 -1.135 11.301 3.307 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -2.515 8.686 2.697 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -2.461 9.975 1.511 1.00 0.00 H new ATOM 0 HG LEU A 157 -0.675 8.532 0.994 1.00 0.00 H new ATOM 0 HD11 LEU A 157 1.339 9.899 1.348 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -0.063 10.889 0.878 1.00 0.00 H new ATOM 0 HD13 LEU A 157 0.471 10.851 2.575 1.00 0.00 H new ATOM 0 HD21 LEU A 157 1.029 7.849 2.634 1.00 0.00 H new ATOM 0 HD22 LEU A 157 0.136 8.713 3.908 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -0.600 7.307 3.103 1.00 0.00 H new ATOM 1758 N LEU A 158 -4.275 10.709 4.078 1.00 0.00 N ATOM 1759 CA LEU A 158 -5.637 11.218 3.998 1.00 0.00 C ATOM 1760 C LEU A 158 -5.928 12.243 5.077 1.00 0.00 C ATOM 1761 O LEU A 158 -6.494 13.299 4.808 1.00 0.00 O ATOM 1762 CB LEU A 158 -6.608 10.059 4.141 1.00 0.00 C ATOM 1763 CG LEU A 158 -6.413 8.933 3.125 1.00 0.00 C ATOM 1764 CD1 LEU A 158 -7.042 7.657 3.643 1.00 0.00 C ATOM 1765 CD2 LEU A 158 -6.990 9.312 1.766 1.00 0.00 C ATOM 0 H LEU A 158 -4.181 9.844 4.610 1.00 0.00 H new ATOM 0 HA LEU A 158 -5.754 11.708 3.032 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -6.513 9.645 5.145 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -7.625 10.441 4.049 1.00 0.00 H new ATOM 0 HG LEU A 158 -5.344 8.768 2.992 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -6.899 6.859 2.914 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -6.572 7.376 4.585 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -8.108 7.816 3.803 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -6.837 8.492 1.064 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -8.057 9.509 1.866 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -6.489 10.206 1.395 1.00 0.00 H new ATOM 1777 N GLY A 159 -5.569 11.901 6.306 1.00 0.00 N ATOM 1778 CA GLY A 159 -5.768 12.796 7.431 1.00 0.00 C ATOM 1779 C GLY A 159 -7.217 13.038 7.773 1.00 0.00 C ATOM 1780 O GLY A 159 -7.519 13.786 8.705 1.00 0.00 O ATOM 0 H GLY A 159 -5.138 11.008 6.547 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -5.263 12.383 8.304 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -5.293 13.752 7.210 1.00 0.00 H new ATOM 1784 N ALA A 160 -8.112 12.365 7.064 1.00 0.00 N ATOM 1785 CA ALA A 160 -9.530 12.670 7.144 1.00 0.00 C ATOM 1786 C ALA A 160 -10.317 11.793 6.198 1.00 0.00 C ATOM 1787 O ALA A 160 -11.315 11.171 6.570 1.00 0.00 O ATOM 1788 CB ALA A 160 -9.736 14.120 6.777 1.00 0.00 C ATOM 0 H ALA A 160 -7.879 11.604 6.427 1.00 0.00 H new ATOM 0 HA ALA A 160 -9.880 12.483 8.159 1.00 0.00 H new ATOM 0 HB1 ALA A 160 -10.797 14.362 6.833 1.00 0.00 H new ATOM 0 HB2 ALA A 160 -9.182 14.753 7.470 1.00 0.00 H new ATOM 0 HB3 ALA A 160 -9.378 14.293 5.762 1.00 0.00 H new ATOM 1794 N ARG A 161 -9.831 11.727 4.971 1.00 0.00 N ATOM 1795 CA ARG A 161 -10.436 10.921 3.925 1.00 0.00 C ATOM 1796 C ARG A 161 -10.112 9.438 4.161 1.00 0.00 C ATOM 1797 O ARG A 161 -9.949 8.663 3.237 1.00 0.00 O ATOM 1798 CB ARG A 161 -9.933 11.435 2.577 1.00 0.00 C ATOM 1799 CG ARG A 161 -10.945 11.346 1.432 1.00 0.00 C ATOM 1800 CD ARG A 161 -11.030 9.959 0.812 1.00 0.00 C ATOM 1801 NE ARG A 161 -11.894 9.033 1.544 1.00 0.00 N ATOM 1802 CZ ARG A 161 -12.996 8.474 1.045 1.00 0.00 C ATOM 1803 NH1 ARG A 161 -13.441 8.824 -0.156 1.00 0.00 N1+ ATOM 1804 NH2 ARG A 161 -13.647 7.553 1.741 1.00 0.00 N ATOM 0 H ARG A 161 -8.999 12.235 4.670 1.00 0.00 H new ATOM 0 HA ARG A 161 -11.523 11.005 3.935 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -9.628 12.475 2.693 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -9.043 10.871 2.299 1.00 0.00 H new ATOM 0 HG2 ARG A 161 -11.929 11.632 1.803 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -10.674 12.066 0.660 1.00 0.00 H new ATOM 0 HD2 ARG A 161 -11.397 10.051 -0.210 1.00 0.00 H new ATOM 0 HD3 ARG A 161 -10.027 9.536 0.754 1.00 0.00 H new ATOM 0 HE ARG A 161 -11.635 8.799 2.502 1.00 0.00 H new ATOM 0 HH11 ARG A 161 -12.939 9.524 -0.702 1.00 0.00 H new ATOM 0 HH12 ARG A 161 -14.285 8.393 -0.533 1.00 0.00 H new ATOM 0 HH21 ARG A 161 -13.305 7.271 2.660 1.00 0.00 H new ATOM 0 HH22 ARG A 161 -14.490 7.126 1.358 1.00 0.00 H new ATOM 1818 N ALA A 162 -9.995 9.075 5.431 1.00 0.00 N ATOM 1819 CA ALA A 162 -9.876 7.686 5.841 1.00 0.00 C ATOM 1820 C ALA A 162 -11.109 7.295 6.638 1.00 0.00 C ATOM 1821 O ALA A 162 -11.315 6.133 6.980 1.00 0.00 O ATOM 1822 CB ALA A 162 -8.628 7.475 6.680 1.00 0.00 C ATOM 0 H ALA A 162 -9.980 9.738 6.206 1.00 0.00 H new ATOM 0 HA ALA A 162 -9.796 7.060 4.952 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -8.561 6.428 6.975 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -7.748 7.745 6.097 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -8.679 8.100 7.571 1.00 0.00 H new ATOM 1828 N LYS A 163 -11.918 8.301 6.948 1.00 0.00 N ATOM 1829 CA LYS A 163 -13.151 8.102 7.689 1.00 0.00 C ATOM 1830 C LYS A 163 -14.287 8.777 6.936 1.00 0.00 C ATOM 1831 O LYS A 163 -15.337 8.184 6.693 1.00 0.00 O ATOM 1832 CB LYS A 163 -13.065 8.695 9.109 1.00 0.00 C ATOM 1833 CG LYS A 163 -11.835 8.277 9.915 1.00 0.00 C ATOM 1834 CD LYS A 163 -10.601 9.097 9.552 1.00 0.00 C ATOM 1835 CE LYS A 163 -10.788 10.575 9.848 1.00 0.00 C ATOM 1836 NZ LYS A 163 -11.113 10.832 11.277 1.00 0.00 N1+ ATOM 0 H LYS A 163 -11.736 9.272 6.693 1.00 0.00 H new ATOM 0 HA LYS A 163 -13.326 7.030 7.782 1.00 0.00 H new ATOM 0 HB2 LYS A 163 -13.078 9.782 9.033 1.00 0.00 H new ATOM 0 HB3 LYS A 163 -13.958 8.404 9.662 1.00 0.00 H new ATOM 0 HG2 LYS A 163 -12.044 8.390 10.979 1.00 0.00 H new ATOM 0 HG3 LYS A 163 -11.631 7.220 9.741 1.00 0.00 H new ATOM 0 HD2 LYS A 163 -9.741 8.723 10.108 1.00 0.00 H new ATOM 0 HD3 LYS A 163 -10.378 8.965 8.493 1.00 0.00 H new ATOM 0 HE2 LYS A 163 -9.878 11.114 9.583 1.00 0.00 H new ATOM 0 HE3 LYS A 163 -11.587 10.970 9.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 -11.048 11.852 11.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 -12.079 10.503 11.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 -10.440 10.321 11.883 1.00 0.00 H new ATOM 1850 N GLY A 164 -14.046 10.025 6.557 1.00 0.00 N ATOM 1851 CA GLY A 164 -15.030 10.792 5.826 1.00 0.00 C ATOM 1852 C GLY A 164 -15.015 12.246 6.236 1.00 0.00 C ATOM 1853 O GLY A 164 -14.098 12.986 5.882 1.00 0.00 O ATOM 0 H GLY A 164 -13.176 10.522 6.746 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -14.834 10.712 4.757 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -16.021 10.374 6.000 1.00 0.00 H new ATOM 1857 N HIS A 165 -16.022 12.653 6.987 1.00 0.00 N ATOM 1858 CA HIS A 165 -16.099 14.010 7.506 1.00 0.00 C ATOM 1859 C HIS A 165 -16.677 13.990 8.908 1.00 0.00 C ATOM 1860 O HIS A 165 -15.898 14.095 9.875 1.00 0.00 O ATOM 1861 CB HIS A 165 -16.948 14.908 6.598 1.00 0.00 C ATOM 1862 CG HIS A 165 -16.268 15.287 5.319 1.00 0.00 C ATOM 1863 ND1 HIS A 165 -16.578 14.722 4.100 1.00 0.00 N ATOM 1864 CD2 HIS A 165 -15.289 16.191 5.072 1.00 0.00 C ATOM 1865 CE1 HIS A 165 -15.821 15.263 3.163 1.00 0.00 C ATOM 1866 NE2 HIS A 165 -15.031 16.154 3.725 1.00 0.00 N ATOM 1867 OXT HIS A 165 -17.907 13.819 9.042 1.00 0.00 O ATOM 0 H HIS A 165 -16.806 12.058 7.254 1.00 0.00 H new ATOM 0 HA HIS A 165 -15.090 14.422 7.534 1.00 0.00 H new ATOM 0 HB2 HIS A 165 -17.881 14.395 6.365 1.00 0.00 H new ATOM 0 HB3 HIS A 165 -17.210 15.815 7.142 1.00 0.00 H new ATOM 0 HD2 HIS A 165 -14.802 16.823 5.800 1.00 0.00 H new ATOM 0 HE1 HIS A 165 -15.846 15.016 2.112 1.00 0.00 H new ATOM 0 HE2 HIS A 165 -14.339 16.724 3.238 1.00 0.00 H new TER 1876 HIS A 165