USER MOD reduce.3.24.130724 H: found=0, std=0, add=734, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 732 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 NoAdj-H: A 38 HIS HE2 : A 38 HIS NE2 : A 101 ZNZN :(H bumps) USER MOD NoAdj-H: A 70 HIS HE2 : A 70 HIS NE2 : A 102 ZNZN :(H bumps) USER MOD Set 1.1: A 90 GLN : amide:sc= 0.579 K(o=1.1,f=-4!) USER MOD Set 1.2: A 92 ASN : amide:sc= 0.55 K(o=1.1,f=-1.4) USER MOD Set 2.1: A 44 GLN : amide:sc= 0.849 K(o=1.8,f=-2.9) USER MOD Set 2.2: A 67 LYS NZ :NH3+ 170:sc= 0.979 (180deg=0) USER MOD Set 3.1: A 40 SER OG : rot -57:sc= 0.876 USER MOD Set 3.2: A 43 CYS SG : rot 180:sc= 1.09 USER MOD Set 4.1: A 42 SER OG : rot -100:sc= 0.428 USER MOD Set 4.2: A 65 ASN : amide:sc= 0.464 K(o=0.89,f=0.032) USER MOD Set 5.1: A 12 LYS NZ :NH3+ 162:sc= 1.33 (180deg=0.714) USER MOD Set 5.2: A 85 ASN : amide:sc= 0.911 K(o=2.2,f=-1.2) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -163:sc= -0.108 (180deg=-0.42) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0447 USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.179 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 26 THR OG1 : rot -38:sc= 0.17 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.00555 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 ASN : amide:sc= -0.108 K(o=-0.11,f=-0.64) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -179:sc= 1.03 (180deg=1.03) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 HIS : no HE2:sc= 1.18 K(o=1.2,f=-3.5!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= -0.0644 X(o=-0.064,f=-0.11) USER MOD Single : A 82 ASN : amide:sc= -0.0311 X(o=-0.031,f=0) USER MOD Single : A 86 ASN : amide:sc= 0.993 K(o=0.99,f=-0.14) USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.178 15.737 0.802 1.00 0.00 N ATOM 2 CA MET A 1 -2.100 14.880 0.289 1.00 0.00 C ATOM 3 C MET A 1 -2.438 13.375 0.347 1.00 0.00 C ATOM 4 O MET A 1 -1.703 12.549 -0.201 1.00 0.00 O ATOM 5 CB MET A 1 -0.795 15.167 1.054 1.00 0.00 C ATOM 6 CG MET A 1 -0.306 16.609 0.866 1.00 0.00 C ATOM 7 SD MET A 1 1.275 16.961 1.684 1.00 0.00 S ATOM 8 CE MET A 1 1.467 18.706 1.223 1.00 0.00 C ATOM 0 H1 MET A 1 -3.027 16.715 0.481 1.00 0.00 H new ATOM 0 H2 MET A 1 -4.093 15.394 0.447 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.178 15.710 1.842 1.00 0.00 H new ATOM 0 HA MET A 1 -1.975 15.125 -0.766 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.951 14.976 2.116 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.021 14.478 0.716 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.206 16.812 -0.200 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.063 17.292 1.251 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.395 19.093 1.644 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.496 18.794 0.137 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.625 19.280 1.611 1.00 0.00 H new ATOM 18 N ALA A 2 -3.549 13.019 1.002 1.00 0.00 N ATOM 19 CA ALA A 2 -4.043 11.645 1.184 1.00 0.00 C ATOM 20 C ALA A 2 -5.578 11.513 1.003 1.00 0.00 C ATOM 21 O ALA A 2 -6.164 10.483 1.342 1.00 0.00 O ATOM 22 CB ALA A 2 -3.573 11.159 2.564 1.00 0.00 C ATOM 0 H ALA A 2 -4.157 13.711 1.440 1.00 0.00 H new ATOM 0 HA ALA A 2 -3.628 11.011 0.400 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -3.924 10.140 2.730 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -2.484 11.179 2.605 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -3.977 11.813 3.337 1.00 0.00 H new ATOM 28 N VAL A 3 -6.238 12.552 0.471 1.00 0.00 N ATOM 29 CA VAL A 3 -7.700 12.609 0.233 1.00 0.00 C ATOM 30 C VAL A 3 -8.194 11.746 -0.946 1.00 0.00 C ATOM 31 O VAL A 3 -9.403 11.613 -1.146 1.00 0.00 O ATOM 32 CB VAL A 3 -8.175 14.068 0.052 1.00 0.00 C ATOM 33 CG1 VAL A 3 -7.927 14.891 1.322 1.00 0.00 C ATOM 34 CG2 VAL A 3 -7.509 14.781 -1.134 1.00 0.00 C ATOM 0 H VAL A 3 -5.760 13.406 0.183 1.00 0.00 H new ATOM 0 HA VAL A 3 -8.146 12.178 1.130 1.00 0.00 H new ATOM 0 HB VAL A 3 -9.243 14.001 -0.153 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -8.271 15.913 1.166 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -8.473 14.448 2.155 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -6.861 14.897 1.549 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -7.887 15.801 -1.204 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -6.429 14.804 -0.985 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -7.737 14.245 -2.055 1.00 0.00 H new ATOM 44 N SER A 4 -7.281 11.169 -1.734 1.00 0.00 N ATOM 45 CA SER A 4 -7.569 10.317 -2.902 1.00 0.00 C ATOM 46 C SER A 4 -8.411 9.072 -2.569 1.00 0.00 C ATOM 47 O SER A 4 -8.383 8.564 -1.442 1.00 0.00 O ATOM 48 CB SER A 4 -6.249 9.867 -3.546 1.00 0.00 C ATOM 49 OG SER A 4 -5.408 10.979 -3.826 1.00 0.00 O ATOM 0 H SER A 4 -6.280 11.285 -1.573 1.00 0.00 H new ATOM 0 HA SER A 4 -8.159 10.926 -3.587 1.00 0.00 H new ATOM 0 HB2 SER A 4 -5.733 9.176 -2.879 1.00 0.00 H new ATOM 0 HB3 SER A 4 -6.458 9.324 -4.468 1.00 0.00 H new ATOM 0 HG SER A 4 -4.574 10.664 -4.234 1.00 0.00 H new ATOM 55 N VAL A 5 -9.133 8.550 -3.568 1.00 0.00 N ATOM 56 CA VAL A 5 -10.003 7.358 -3.468 1.00 0.00 C ATOM 57 C VAL A 5 -9.867 6.436 -4.691 1.00 0.00 C ATOM 58 O VAL A 5 -9.329 6.827 -5.730 1.00 0.00 O ATOM 59 CB VAL A 5 -11.488 7.747 -3.262 1.00 0.00 C ATOM 60 CG1 VAL A 5 -11.715 8.451 -1.919 1.00 0.00 C ATOM 61 CG2 VAL A 5 -12.046 8.637 -4.382 1.00 0.00 C ATOM 0 H VAL A 5 -9.132 8.956 -4.504 1.00 0.00 H new ATOM 0 HA VAL A 5 -9.664 6.808 -2.590 1.00 0.00 H new ATOM 0 HB VAL A 5 -12.026 6.799 -3.278 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -12.770 8.706 -1.816 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -11.421 7.787 -1.106 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -11.116 9.361 -1.879 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -13.090 8.871 -4.174 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -11.470 9.561 -4.434 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -11.975 8.111 -5.334 1.00 0.00 H new ATOM 71 N THR A 6 -10.357 5.201 -4.565 1.00 0.00 N ATOM 72 CA THR A 6 -10.348 4.160 -5.613 1.00 0.00 C ATOM 73 C THR A 6 -11.181 4.532 -6.859 1.00 0.00 C ATOM 74 O THR A 6 -12.147 5.293 -6.746 1.00 0.00 O ATOM 75 CB THR A 6 -10.852 2.824 -5.030 1.00 0.00 C ATOM 76 OG1 THR A 6 -11.931 3.019 -4.133 1.00 0.00 O ATOM 77 CG2 THR A 6 -9.750 2.121 -4.237 1.00 0.00 C ATOM 0 H THR A 6 -10.789 4.879 -3.699 1.00 0.00 H new ATOM 0 HA THR A 6 -9.314 4.066 -5.946 1.00 0.00 H new ATOM 0 HB THR A 6 -11.167 2.224 -5.884 1.00 0.00 H new ATOM 0 HG1 THR A 6 -12.227 2.152 -3.784 1.00 0.00 H new ATOM 0 HG21 THR A 6 -10.132 1.182 -3.837 1.00 0.00 H new ATOM 0 HG22 THR A 6 -8.903 1.918 -4.892 1.00 0.00 H new ATOM 0 HG23 THR A 6 -9.428 2.761 -3.415 1.00 0.00 H new ATOM 85 N PRO A 7 -10.858 3.993 -8.055 1.00 0.00 N ATOM 86 CA PRO A 7 -11.538 4.286 -9.331 1.00 0.00 C ATOM 87 C PRO A 7 -12.915 3.612 -9.529 1.00 0.00 C ATOM 88 O PRO A 7 -13.349 3.387 -10.660 1.00 0.00 O ATOM 89 CB PRO A 7 -10.527 3.853 -10.397 1.00 0.00 C ATOM 90 CG PRO A 7 -9.845 2.649 -9.756 1.00 0.00 C ATOM 91 CD PRO A 7 -9.743 3.078 -8.295 1.00 0.00 C ATOM 0 HA PRO A 7 -11.803 5.342 -9.378 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -11.017 3.588 -11.334 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -9.815 4.647 -10.624 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -10.432 1.738 -9.873 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -8.865 2.455 -10.193 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -9.799 2.215 -7.632 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -8.789 3.568 -8.100 1.00 0.00 H new ATOM 99 N ILE A 8 -13.618 3.286 -8.443 1.00 0.00 N ATOM 100 CA ILE A 8 -14.934 2.609 -8.433 1.00 0.00 C ATOM 101 C ILE A 8 -16.006 3.234 -9.348 1.00 0.00 C ATOM 102 O ILE A 8 -16.882 2.524 -9.847 1.00 0.00 O ATOM 103 CB ILE A 8 -15.467 2.425 -6.994 1.00 0.00 C ATOM 104 CG1 ILE A 8 -15.640 3.769 -6.246 1.00 0.00 C ATOM 105 CG2 ILE A 8 -14.550 1.446 -6.239 1.00 0.00 C ATOM 106 CD1 ILE A 8 -16.306 3.634 -4.871 1.00 0.00 C ATOM 0 H ILE A 8 -13.280 3.491 -7.503 1.00 0.00 H new ATOM 0 HA ILE A 8 -14.735 1.630 -8.869 1.00 0.00 H new ATOM 0 HB ILE A 8 -16.469 2.000 -7.046 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -14.661 4.232 -6.121 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -16.235 4.443 -6.862 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -14.920 1.311 -5.223 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -14.542 0.485 -6.753 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -13.537 1.848 -6.206 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -16.392 4.618 -4.410 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -17.299 3.201 -4.989 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -15.701 2.987 -4.236 1.00 0.00 H new ATOM 118 N ARG A 9 -15.936 4.550 -9.602 1.00 0.00 N ATOM 119 CA ARG A 9 -16.851 5.272 -10.507 1.00 0.00 C ATOM 120 C ARG A 9 -16.601 4.931 -11.985 1.00 0.00 C ATOM 121 O ARG A 9 -17.539 4.915 -12.779 1.00 0.00 O ATOM 122 CB ARG A 9 -16.718 6.783 -10.241 1.00 0.00 C ATOM 123 CG ARG A 9 -17.762 7.620 -10.998 1.00 0.00 C ATOM 124 CD ARG A 9 -17.664 9.102 -10.611 1.00 0.00 C ATOM 125 NE ARG A 9 -18.637 9.924 -11.359 1.00 0.00 N ATOM 126 CZ ARG A 9 -19.901 10.161 -11.045 1.00 0.00 C ATOM 127 NH1 ARG A 9 -20.463 9.660 -9.981 1.00 0.00 N ATOM 128 NH2 ARG A 9 -20.636 10.917 -11.811 1.00 0.00 N ATOM 0 H ARG A 9 -15.232 5.154 -9.179 1.00 0.00 H new ATOM 0 HA ARG A 9 -17.873 4.954 -10.301 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -16.818 6.968 -9.172 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -15.719 7.111 -10.529 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -17.612 7.510 -12.072 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -18.762 7.248 -10.776 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -17.840 9.212 -9.541 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -16.655 9.464 -10.806 1.00 0.00 H new ATOM 0 HE ARG A 9 -18.296 10.359 -12.216 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -19.926 9.061 -9.355 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -21.440 9.867 -9.775 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -20.238 11.328 -12.655 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -21.610 11.098 -11.566 1.00 0.00 H new ATOM 142 N ASP A 10 -15.353 4.633 -12.351 1.00 0.00 N ATOM 143 CA ASP A 10 -14.944 4.281 -13.717 1.00 0.00 C ATOM 144 C ASP A 10 -15.083 2.776 -14.009 1.00 0.00 C ATOM 145 O ASP A 10 -15.477 2.401 -15.113 1.00 0.00 O ATOM 146 CB ASP A 10 -13.498 4.744 -13.938 1.00 0.00 C ATOM 147 CG ASP A 10 -13.065 4.568 -15.402 1.00 0.00 C ATOM 148 OD1 ASP A 10 -13.676 5.212 -16.288 1.00 0.00 O ATOM 149 OD2 ASP A 10 -12.103 3.807 -15.663 1.00 0.00 O ATOM 0 H ASP A 10 -14.576 4.629 -11.690 1.00 0.00 H new ATOM 0 HA ASP A 10 -15.612 4.789 -14.412 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -13.403 5.792 -13.654 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -12.830 4.176 -13.290 1.00 0.00 H new ATOM 154 N THR A 11 -14.830 1.900 -13.025 1.00 0.00 N ATOM 155 CA THR A 11 -14.995 0.436 -13.180 1.00 0.00 C ATOM 156 C THR A 11 -16.453 -0.013 -13.343 1.00 0.00 C ATOM 157 O THR A 11 -16.694 -1.196 -13.573 1.00 0.00 O ATOM 158 CB THR A 11 -14.349 -0.362 -12.032 1.00 0.00 C ATOM 159 OG1 THR A 11 -14.764 0.124 -10.776 1.00 0.00 O ATOM 160 CG2 THR A 11 -12.824 -0.296 -12.078 1.00 0.00 C ATOM 0 H THR A 11 -14.506 2.180 -12.099 1.00 0.00 H new ATOM 0 HA THR A 11 -14.471 0.214 -14.110 1.00 0.00 H new ATOM 0 HB THR A 11 -14.673 -1.394 -12.164 1.00 0.00 H new ATOM 0 HG1 THR A 11 -14.340 -0.402 -10.066 1.00 0.00 H new ATOM 0 HG21 THR A 11 -12.410 -0.872 -11.251 1.00 0.00 H new ATOM 0 HG22 THR A 11 -12.470 -0.711 -13.022 1.00 0.00 H new ATOM 0 HG23 THR A 11 -12.502 0.742 -11.994 1.00 0.00 H new ATOM 168 N LYS A 12 -17.429 0.907 -13.270 1.00 0.00 N ATOM 169 CA LYS A 12 -18.881 0.692 -13.435 1.00 0.00 C ATOM 170 C LYS A 12 -19.250 -0.326 -14.527 1.00 0.00 C ATOM 171 O LYS A 12 -20.096 -1.192 -14.303 1.00 0.00 O ATOM 172 CB LYS A 12 -19.512 2.072 -13.717 1.00 0.00 C ATOM 173 CG LYS A 12 -21.034 2.034 -13.956 1.00 0.00 C ATOM 174 CD LYS A 12 -21.632 3.403 -14.317 1.00 0.00 C ATOM 175 CE LYS A 12 -21.073 3.952 -15.640 1.00 0.00 C ATOM 176 NZ LYS A 12 -21.901 5.066 -16.166 1.00 0.00 N ATOM 0 H LYS A 12 -17.213 1.886 -13.082 1.00 0.00 H new ATOM 0 HA LYS A 12 -19.273 0.249 -12.519 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -19.304 2.733 -12.875 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -19.029 2.508 -14.592 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -21.250 1.329 -14.759 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -21.525 1.657 -13.059 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -22.716 3.316 -14.391 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -21.424 4.111 -13.515 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -20.051 4.299 -15.487 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -21.031 3.151 -16.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -21.353 5.605 -16.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -22.756 4.681 -16.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -22.175 5.694 -15.384 1.00 0.00 H new ATOM 190 N TRP A 13 -18.625 -0.222 -15.703 1.00 0.00 N ATOM 191 CA TRP A 13 -18.889 -1.095 -16.858 1.00 0.00 C ATOM 192 C TRP A 13 -18.193 -2.471 -16.800 1.00 0.00 C ATOM 193 O TRP A 13 -18.596 -3.400 -17.500 1.00 0.00 O ATOM 194 CB TRP A 13 -18.540 -0.327 -18.147 1.00 0.00 C ATOM 195 CG TRP A 13 -17.285 -0.691 -18.890 1.00 0.00 C ATOM 196 CD1 TRP A 13 -17.171 -1.736 -19.739 1.00 0.00 C ATOM 197 CD2 TRP A 13 -15.992 -0.008 -18.942 1.00 0.00 C ATOM 198 NE1 TRP A 13 -15.929 -1.733 -20.336 1.00 0.00 N ATOM 199 CE2 TRP A 13 -15.159 -0.684 -19.885 1.00 0.00 C ATOM 200 CE3 TRP A 13 -15.435 1.114 -18.293 1.00 0.00 C ATOM 201 CZ2 TRP A 13 -13.854 -0.264 -20.183 1.00 0.00 C ATOM 202 CZ3 TRP A 13 -14.120 1.539 -18.576 1.00 0.00 C ATOM 203 CH2 TRP A 13 -13.332 0.857 -19.520 1.00 0.00 C ATOM 0 H TRP A 13 -17.909 0.481 -15.886 1.00 0.00 H new ATOM 0 HA TRP A 13 -19.950 -1.343 -16.840 1.00 0.00 H new ATOM 0 HB2 TRP A 13 -19.377 -0.442 -18.836 1.00 0.00 H new ATOM 0 HB3 TRP A 13 -18.478 0.731 -17.894 1.00 0.00 H new ATOM 0 HD1 TRP A 13 -17.943 -2.469 -19.923 1.00 0.00 H new ATOM 0 HE1 TRP A 13 -15.620 -2.420 -21.024 1.00 0.00 H new ATOM 0 HE3 TRP A 13 -16.024 1.656 -17.568 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 -13.260 -0.796 -20.912 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 -13.714 2.398 -18.062 1.00 0.00 H new ATOM 0 HH2 TRP A 13 -12.329 1.195 -19.734 1.00 0.00 H new ATOM 214 N LEU A 14 -17.153 -2.600 -15.970 1.00 0.00 N ATOM 215 CA LEU A 14 -16.310 -3.789 -15.811 1.00 0.00 C ATOM 216 C LEU A 14 -16.756 -4.743 -14.692 1.00 0.00 C ATOM 217 O LEU A 14 -16.317 -5.892 -14.688 1.00 0.00 O ATOM 218 CB LEU A 14 -14.869 -3.317 -15.532 1.00 0.00 C ATOM 219 CG LEU A 14 -14.237 -2.483 -16.661 1.00 0.00 C ATOM 220 CD1 LEU A 14 -12.910 -1.898 -16.191 1.00 0.00 C ATOM 221 CD2 LEU A 14 -13.968 -3.314 -17.914 1.00 0.00 C ATOM 0 H LEU A 14 -16.861 -1.837 -15.359 1.00 0.00 H new ATOM 0 HA LEU A 14 -16.390 -4.362 -16.735 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -14.865 -2.726 -14.616 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -14.243 -4.191 -15.350 1.00 0.00 H new ATOM 0 HG LEU A 14 -14.950 -1.696 -16.909 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -12.467 -1.309 -16.994 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -13.080 -1.260 -15.324 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -12.232 -2.707 -15.918 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -13.522 -2.681 -18.681 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -13.284 -4.127 -17.671 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -14.906 -3.728 -18.285 1.00 0.00 H new ATOM 233 N THR A 15 -17.577 -4.300 -13.737 1.00 0.00 N ATOM 234 CA THR A 15 -18.056 -5.111 -12.598 1.00 0.00 C ATOM 235 C THR A 15 -19.115 -6.145 -13.034 1.00 0.00 C ATOM 236 O THR A 15 -20.318 -5.984 -12.818 1.00 0.00 O ATOM 237 CB THR A 15 -18.542 -4.229 -11.430 1.00 0.00 C ATOM 238 OG1 THR A 15 -17.712 -3.099 -11.263 1.00 0.00 O ATOM 239 CG2 THR A 15 -18.510 -4.972 -10.096 1.00 0.00 C ATOM 0 H THR A 15 -17.940 -3.347 -13.727 1.00 0.00 H new ATOM 0 HA THR A 15 -17.203 -5.678 -12.225 1.00 0.00 H new ATOM 0 HB THR A 15 -19.562 -3.944 -11.689 1.00 0.00 H new ATOM 0 HG1 THR A 15 -18.044 -2.557 -10.517 1.00 0.00 H new ATOM 0 HG21 THR A 15 -18.861 -4.311 -9.303 1.00 0.00 H new ATOM 0 HG22 THR A 15 -19.157 -5.847 -10.152 1.00 0.00 H new ATOM 0 HG23 THR A 15 -17.489 -5.288 -9.880 1.00 0.00 H new ATOM 247 N LEU A 16 -18.649 -7.210 -13.684 1.00 0.00 N ATOM 248 CA LEU A 16 -19.404 -8.338 -14.247 1.00 0.00 C ATOM 249 C LEU A 16 -19.872 -9.301 -13.138 1.00 0.00 C ATOM 250 O LEU A 16 -19.173 -9.497 -12.148 1.00 0.00 O ATOM 251 CB LEU A 16 -18.440 -9.064 -15.215 1.00 0.00 C ATOM 252 CG LEU A 16 -19.039 -9.442 -16.577 1.00 0.00 C ATOM 253 CD1 LEU A 16 -17.920 -9.963 -17.478 1.00 0.00 C ATOM 254 CD2 LEU A 16 -20.127 -10.512 -16.487 1.00 0.00 C ATOM 0 H LEU A 16 -17.648 -7.319 -13.846 1.00 0.00 H new ATOM 0 HA LEU A 16 -20.300 -7.987 -14.760 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -17.572 -8.427 -15.383 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -18.080 -9.972 -14.730 1.00 0.00 H new ATOM 0 HG LEU A 16 -19.504 -8.542 -16.981 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -18.332 -10.235 -18.450 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -17.166 -9.186 -17.608 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -17.462 -10.839 -17.020 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -20.506 -10.731 -17.485 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -19.710 -11.419 -16.051 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -20.942 -10.150 -15.861 1.00 0.00 H new ATOM 266 N GLU A 17 -21.039 -9.932 -13.271 1.00 0.00 N ATOM 267 CA GLU A 17 -21.514 -10.888 -12.257 1.00 0.00 C ATOM 268 C GLU A 17 -20.794 -12.244 -12.332 1.00 0.00 C ATOM 269 O GLU A 17 -20.361 -12.671 -13.408 1.00 0.00 O ATOM 270 CB GLU A 17 -23.025 -11.129 -12.361 1.00 0.00 C ATOM 271 CG GLU A 17 -23.847 -9.834 -12.388 1.00 0.00 C ATOM 272 CD GLU A 17 -25.230 -10.021 -11.746 1.00 0.00 C ATOM 273 OE1 GLU A 17 -25.652 -9.124 -10.975 1.00 0.00 O ATOM 274 OE2 GLU A 17 -25.880 -11.067 -11.987 1.00 0.00 O ATOM 0 H GLU A 17 -21.671 -9.804 -14.061 1.00 0.00 H new ATOM 0 HA GLU A 17 -21.283 -10.424 -11.298 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -23.233 -11.702 -13.265 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -23.347 -11.738 -11.516 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -23.305 -9.049 -11.861 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -23.967 -9.501 -13.419 1.00 0.00 H new ATOM 281 N VAL A 18 -20.717 -12.951 -11.199 1.00 0.00 N ATOM 282 CA VAL A 18 -20.174 -14.320 -11.149 1.00 0.00 C ATOM 283 C VAL A 18 -21.264 -15.338 -11.510 1.00 0.00 C ATOM 284 O VAL A 18 -22.461 -15.083 -11.305 1.00 0.00 O ATOM 285 CB VAL A 18 -19.542 -14.686 -9.786 1.00 0.00 C ATOM 286 CG1 VAL A 18 -18.515 -13.640 -9.342 1.00 0.00 C ATOM 287 CG2 VAL A 18 -20.549 -14.909 -8.649 1.00 0.00 C ATOM 0 H VAL A 18 -21.026 -12.596 -10.294 1.00 0.00 H new ATOM 0 HA VAL A 18 -19.370 -14.355 -11.884 1.00 0.00 H new ATOM 0 HB VAL A 18 -19.055 -15.643 -9.970 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -18.092 -13.931 -8.380 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -17.719 -13.574 -10.084 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -19.002 -12.670 -9.246 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -20.014 -15.161 -7.733 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -21.128 -13.999 -8.492 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -21.221 -15.726 -8.913 1.00 0.00 H new ATOM 297 N CYS A 19 -20.867 -16.508 -12.016 1.00 0.00 N ATOM 298 CA CYS A 19 -21.822 -17.573 -12.324 1.00 0.00 C ATOM 299 C CYS A 19 -22.369 -18.192 -11.028 1.00 0.00 C ATOM 300 O CYS A 19 -21.634 -18.400 -10.058 1.00 0.00 O ATOM 301 CB CYS A 19 -21.153 -18.620 -13.204 1.00 0.00 C ATOM 302 SG CYS A 19 -22.353 -19.876 -13.750 1.00 0.00 S ATOM 0 H CYS A 19 -19.895 -16.741 -12.220 1.00 0.00 H new ATOM 0 HA CYS A 19 -22.668 -17.156 -12.871 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -20.705 -18.138 -14.073 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -20.344 -19.100 -12.653 1.00 0.00 H new ATOM 307 N ARG A 20 -23.674 -18.477 -11.011 1.00 0.00 N ATOM 308 CA ARG A 20 -24.409 -19.025 -9.862 1.00 0.00 C ATOM 309 C ARG A 20 -24.006 -20.461 -9.544 1.00 0.00 C ATOM 310 O ARG A 20 -23.890 -20.820 -8.374 1.00 0.00 O ATOM 311 CB ARG A 20 -25.924 -18.944 -10.110 1.00 0.00 C ATOM 312 CG ARG A 20 -26.481 -17.508 -10.161 1.00 0.00 C ATOM 313 CD ARG A 20 -26.124 -16.735 -11.443 1.00 0.00 C ATOM 314 NE ARG A 20 -26.965 -15.534 -11.603 1.00 0.00 N ATOM 315 CZ ARG A 20 -26.573 -14.275 -11.719 1.00 0.00 C ATOM 316 NH1 ARG A 20 -27.447 -13.327 -11.866 1.00 0.00 N ATOM 317 NH2 ARG A 20 -25.335 -13.877 -11.691 1.00 0.00 N ATOM 0 H ARG A 20 -24.271 -18.328 -11.824 1.00 0.00 H new ATOM 0 HA ARG A 20 -24.148 -18.416 -8.996 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -26.154 -19.444 -11.051 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -26.439 -19.494 -9.322 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -27.566 -17.548 -10.065 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -26.105 -16.954 -9.300 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -25.074 -16.444 -11.413 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -26.249 -17.386 -12.308 1.00 0.00 H new ATOM 0 HE ARG A 20 -27.972 -15.693 -11.627 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -28.442 -13.550 -11.893 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -27.139 -12.359 -11.955 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -24.583 -14.556 -11.573 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -25.116 -12.886 -11.788 1.00 0.00 H new ATOM 331 N GLU A 21 -23.763 -21.277 -10.565 1.00 0.00 N ATOM 332 CA GLU A 21 -23.336 -22.673 -10.414 1.00 0.00 C ATOM 333 C GLU A 21 -21.862 -22.753 -9.987 1.00 0.00 C ATOM 334 O GLU A 21 -21.470 -23.607 -9.187 1.00 0.00 O ATOM 335 CB GLU A 21 -23.574 -23.435 -11.723 1.00 0.00 C ATOM 336 CG GLU A 21 -25.041 -23.423 -12.192 1.00 0.00 C ATOM 337 CD GLU A 21 -25.977 -24.143 -11.202 1.00 0.00 C ATOM 338 OE1 GLU A 21 -26.600 -23.472 -10.343 1.00 0.00 O ATOM 339 OE2 GLU A 21 -26.087 -25.390 -11.247 1.00 0.00 O ATOM 0 H GLU A 21 -23.857 -20.987 -11.538 1.00 0.00 H new ATOM 0 HA GLU A 21 -23.930 -23.139 -9.628 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -22.949 -23.001 -12.504 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -23.252 -24.468 -11.595 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -25.372 -22.392 -12.317 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -25.112 -23.901 -13.169 1.00 0.00 H new ATOM 346 N PHE A 22 -21.043 -21.810 -10.458 1.00 0.00 N ATOM 347 CA PHE A 22 -19.639 -21.685 -10.071 1.00 0.00 C ATOM 348 C PHE A 22 -19.479 -21.341 -8.581 1.00 0.00 C ATOM 349 O PHE A 22 -18.453 -21.675 -7.986 1.00 0.00 O ATOM 350 CB PHE A 22 -18.982 -20.642 -10.971 1.00 0.00 C ATOM 351 CG PHE A 22 -17.474 -20.576 -10.881 1.00 0.00 C ATOM 352 CD1 PHE A 22 -16.689 -21.499 -11.598 1.00 0.00 C ATOM 353 CD2 PHE A 22 -16.853 -19.586 -10.097 1.00 0.00 C ATOM 354 CE1 PHE A 22 -15.287 -21.454 -11.502 1.00 0.00 C ATOM 355 CE2 PHE A 22 -15.451 -19.534 -10.013 1.00 0.00 C ATOM 356 CZ PHE A 22 -14.668 -20.473 -10.708 1.00 0.00 C ATOM 0 H PHE A 22 -21.342 -21.102 -11.129 1.00 0.00 H new ATOM 0 HA PHE A 22 -19.141 -22.645 -10.205 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -19.260 -20.849 -12.004 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -19.389 -19.662 -10.722 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -17.164 -22.242 -12.222 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -17.453 -18.867 -9.560 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -14.686 -22.173 -12.038 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -14.974 -18.772 -9.414 1.00 0.00 H new ATOM 0 HZ PHE A 22 -13.591 -20.440 -10.632 1.00 0.00 H new ATOM 366 N GLN A 23 -20.505 -20.753 -7.940 1.00 0.00 N ATOM 367 CA GLN A 23 -20.491 -20.469 -6.491 1.00 0.00 C ATOM 368 C GLN A 23 -20.308 -21.738 -5.633 1.00 0.00 C ATOM 369 O GLN A 23 -19.841 -21.653 -4.495 1.00 0.00 O ATOM 370 CB GLN A 23 -21.762 -19.739 -6.012 1.00 0.00 C ATOM 371 CG GLN A 23 -22.019 -18.384 -6.685 1.00 0.00 C ATOM 372 CD GLN A 23 -23.201 -17.611 -6.096 1.00 0.00 C ATOM 373 OE1 GLN A 23 -23.807 -17.968 -5.092 1.00 0.00 O ATOM 374 NE2 GLN A 23 -23.583 -16.508 -6.705 1.00 0.00 N ATOM 0 H GLN A 23 -21.364 -20.462 -8.408 1.00 0.00 H new ATOM 0 HA GLN A 23 -19.629 -19.816 -6.353 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -22.623 -20.385 -6.187 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -21.692 -19.586 -4.935 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -21.121 -17.772 -6.602 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -22.197 -18.546 -7.748 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -23.093 -16.192 -7.542 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -24.369 -15.970 -6.340 1.00 0.00 H new ATOM 383 N ARG A 24 -20.645 -22.917 -6.187 1.00 0.00 N ATOM 384 CA ARG A 24 -20.491 -24.242 -5.555 1.00 0.00 C ATOM 385 C ARG A 24 -19.504 -25.137 -6.329 1.00 0.00 C ATOM 386 O ARG A 24 -19.457 -26.348 -6.107 1.00 0.00 O ATOM 387 CB ARG A 24 -21.864 -24.927 -5.378 1.00 0.00 C ATOM 388 CG ARG A 24 -22.920 -24.094 -4.621 1.00 0.00 C ATOM 389 CD ARG A 24 -23.919 -23.383 -5.548 1.00 0.00 C ATOM 390 NE ARG A 24 -24.785 -24.350 -6.253 1.00 0.00 N ATOM 391 CZ ARG A 24 -25.542 -24.110 -7.308 1.00 0.00 C ATOM 392 NH1 ARG A 24 -25.688 -22.928 -7.821 1.00 0.00 N ATOM 393 NH2 ARG A 24 -26.170 -25.063 -7.925 1.00 0.00 N ATOM 0 H ARG A 24 -21.047 -22.976 -7.122 1.00 0.00 H new ATOM 0 HA ARG A 24 -20.063 -24.088 -4.564 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -22.258 -25.175 -6.363 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -21.717 -25.868 -4.847 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -23.468 -24.747 -3.942 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -22.413 -23.350 -4.007 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -24.535 -22.699 -4.965 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -23.376 -22.781 -6.276 1.00 0.00 H new ATOM 0 HE ARG A 24 -24.800 -25.302 -5.887 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -25.206 -22.130 -7.408 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -26.285 -22.797 -8.637 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -26.085 -26.025 -7.597 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -26.748 -24.850 -8.738 1.00 0.00 H new ATOM 407 N GLY A 25 -18.720 -24.550 -7.241 1.00 0.00 N ATOM 408 CA GLY A 25 -17.729 -25.238 -8.078 1.00 0.00 C ATOM 409 C GLY A 25 -18.311 -26.355 -8.953 1.00 0.00 C ATOM 410 O GLY A 25 -17.681 -27.405 -9.097 1.00 0.00 O ATOM 0 H GLY A 25 -18.759 -23.547 -7.423 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -17.242 -24.505 -8.721 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -16.957 -25.661 -7.435 1.00 0.00 H new ATOM 414 N THR A 26 -19.519 -26.158 -9.497 1.00 0.00 N ATOM 415 CA THR A 26 -20.250 -27.180 -10.278 1.00 0.00 C ATOM 416 C THR A 26 -20.737 -26.704 -11.665 1.00 0.00 C ATOM 417 O THR A 26 -21.469 -27.425 -12.349 1.00 0.00 O ATOM 418 CB THR A 26 -21.350 -27.791 -9.385 1.00 0.00 C ATOM 419 OG1 THR A 26 -21.837 -29.014 -9.899 1.00 0.00 O ATOM 420 CG2 THR A 26 -22.530 -26.853 -9.121 1.00 0.00 C ATOM 0 H THR A 26 -20.027 -25.278 -9.410 1.00 0.00 H new ATOM 0 HA THR A 26 -19.550 -27.970 -10.552 1.00 0.00 H new ATOM 0 HB THR A 26 -20.852 -27.969 -8.432 1.00 0.00 H new ATOM 0 HG1 THR A 26 -21.886 -28.962 -10.876 1.00 0.00 H new ATOM 0 HG21 THR A 26 -23.260 -27.356 -8.486 1.00 0.00 H new ATOM 0 HG22 THR A 26 -22.174 -25.952 -8.621 1.00 0.00 H new ATOM 0 HG23 THR A 26 -22.998 -26.582 -10.067 1.00 0.00 H new ATOM 428 N CYS A 27 -20.308 -25.519 -12.128 1.00 0.00 N ATOM 429 CA CYS A 27 -20.638 -25.018 -13.469 1.00 0.00 C ATOM 430 C CYS A 27 -20.058 -25.945 -14.567 1.00 0.00 C ATOM 431 O CYS A 27 -18.905 -26.390 -14.494 1.00 0.00 O ATOM 432 CB CYS A 27 -20.162 -23.564 -13.623 1.00 0.00 C ATOM 433 SG CYS A 27 -20.818 -22.885 -15.182 1.00 0.00 S ATOM 0 H CYS A 27 -19.724 -24.884 -11.584 1.00 0.00 H new ATOM 0 HA CYS A 27 -21.721 -25.026 -13.593 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -20.503 -22.965 -12.779 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -19.073 -23.523 -13.624 1.00 0.00 H new ATOM 438 N SER A 28 -20.874 -26.260 -15.577 1.00 0.00 N ATOM 439 CA SER A 28 -20.550 -27.166 -16.694 1.00 0.00 C ATOM 440 C SER A 28 -19.689 -26.549 -17.814 1.00 0.00 C ATOM 441 O SER A 28 -19.447 -27.218 -18.825 1.00 0.00 O ATOM 442 CB SER A 28 -21.854 -27.693 -17.315 1.00 0.00 C ATOM 443 OG SER A 28 -22.676 -28.322 -16.340 1.00 0.00 O ATOM 0 H SER A 28 -21.817 -25.878 -15.646 1.00 0.00 H new ATOM 0 HA SER A 28 -19.948 -27.960 -16.253 1.00 0.00 H new ATOM 0 HB2 SER A 28 -22.399 -26.869 -17.775 1.00 0.00 H new ATOM 0 HB3 SER A 28 -21.620 -28.403 -18.108 1.00 0.00 H new ATOM 0 HG SER A 28 -23.498 -28.645 -16.764 1.00 0.00 H new ATOM 449 N ARG A 29 -19.248 -25.288 -17.691 1.00 0.00 N ATOM 450 CA ARG A 29 -18.511 -24.544 -18.729 1.00 0.00 C ATOM 451 C ARG A 29 -17.255 -23.824 -18.202 1.00 0.00 C ATOM 452 O ARG A 29 -17.274 -23.318 -17.077 1.00 0.00 O ATOM 453 CB ARG A 29 -19.448 -23.448 -19.265 1.00 0.00 C ATOM 454 CG ARG A 29 -20.693 -23.962 -20.011 1.00 0.00 C ATOM 455 CD ARG A 29 -21.678 -22.815 -20.276 1.00 0.00 C ATOM 456 NE ARG A 29 -22.200 -22.251 -19.014 1.00 0.00 N ATOM 457 CZ ARG A 29 -23.186 -22.690 -18.259 1.00 0.00 C ATOM 458 NH1 ARG A 29 -23.992 -23.650 -18.628 1.00 0.00 N ATOM 459 NH2 ARG A 29 -23.366 -22.149 -17.098 1.00 0.00 N ATOM 0 H ARG A 29 -19.397 -24.740 -16.844 1.00 0.00 H new ATOM 0 HA ARG A 29 -18.195 -25.270 -19.479 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -19.774 -22.829 -18.429 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -18.881 -22.803 -19.937 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -20.395 -24.418 -20.955 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -21.181 -24.739 -19.422 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -21.181 -22.032 -20.849 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -22.506 -23.178 -20.884 1.00 0.00 H new ATOM 0 HE ARG A 29 -21.733 -21.407 -18.682 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -23.872 -24.095 -19.538 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -24.741 -23.954 -18.006 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -22.751 -21.398 -16.784 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -24.123 -22.473 -16.496 1.00 0.00 H new ATOM 473 N PRO A 30 -16.185 -23.700 -19.010 1.00 0.00 N ATOM 474 CA PRO A 30 -15.035 -22.865 -18.663 1.00 0.00 C ATOM 475 C PRO A 30 -15.426 -21.373 -18.752 1.00 0.00 C ATOM 476 O PRO A 30 -16.455 -21.012 -19.334 1.00 0.00 O ATOM 477 CB PRO A 30 -13.960 -23.224 -19.695 1.00 0.00 C ATOM 478 CG PRO A 30 -14.776 -23.593 -20.933 1.00 0.00 C ATOM 479 CD PRO A 30 -16.008 -24.274 -20.338 1.00 0.00 C ATOM 0 HA PRO A 30 -14.680 -23.034 -17.646 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -13.291 -22.385 -19.889 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -13.340 -24.055 -19.359 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -15.044 -22.713 -21.518 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -14.226 -24.261 -21.596 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -16.887 -24.100 -20.958 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -15.867 -25.353 -20.281 1.00 0.00 H new ATOM 487 N ASP A 31 -14.586 -20.481 -18.213 1.00 0.00 N ATOM 488 CA ASP A 31 -14.800 -19.020 -18.264 1.00 0.00 C ATOM 489 C ASP A 31 -15.018 -18.497 -19.701 1.00 0.00 C ATOM 490 O ASP A 31 -15.785 -17.562 -19.928 1.00 0.00 O ATOM 491 CB ASP A 31 -13.588 -18.327 -17.627 1.00 0.00 C ATOM 492 CG ASP A 31 -13.780 -16.805 -17.501 1.00 0.00 C ATOM 493 OD1 ASP A 31 -14.615 -16.361 -16.677 1.00 0.00 O ATOM 494 OD2 ASP A 31 -13.063 -16.062 -18.211 1.00 0.00 O ATOM 0 H ASP A 31 -13.732 -20.749 -17.725 1.00 0.00 H new ATOM 0 HA ASP A 31 -15.712 -18.792 -17.712 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -13.409 -18.751 -16.639 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -12.701 -18.530 -18.226 1.00 0.00 H new ATOM 499 N THR A 32 -14.376 -19.138 -20.684 1.00 0.00 N ATOM 500 CA THR A 32 -14.472 -18.831 -22.122 1.00 0.00 C ATOM 501 C THR A 32 -15.809 -19.200 -22.780 1.00 0.00 C ATOM 502 O THR A 32 -16.031 -18.823 -23.933 1.00 0.00 O ATOM 503 CB THR A 32 -13.325 -19.500 -22.899 1.00 0.00 C ATOM 504 OG1 THR A 32 -13.244 -20.873 -22.571 1.00 0.00 O ATOM 505 CG2 THR A 32 -11.975 -18.863 -22.562 1.00 0.00 C ATOM 0 H THR A 32 -13.748 -19.919 -20.495 1.00 0.00 H new ATOM 0 HA THR A 32 -14.398 -17.745 -22.174 1.00 0.00 H new ATOM 0 HB THR A 32 -13.540 -19.367 -23.959 1.00 0.00 H new ATOM 0 HG1 THR A 32 -12.511 -21.287 -23.074 1.00 0.00 H new ATOM 0 HG21 THR A 32 -11.187 -19.359 -23.128 1.00 0.00 H new ATOM 0 HG22 THR A 32 -11.997 -17.805 -22.822 1.00 0.00 H new ATOM 0 HG23 THR A 32 -11.778 -18.970 -21.495 1.00 0.00 H new ATOM 513 N GLU A 33 -16.714 -19.906 -22.092 1.00 0.00 N ATOM 514 CA GLU A 33 -18.010 -20.364 -22.630 1.00 0.00 C ATOM 515 C GLU A 33 -19.246 -19.946 -21.819 1.00 0.00 C ATOM 516 O GLU A 33 -20.337 -19.872 -22.393 1.00 0.00 O ATOM 517 CB GLU A 33 -17.988 -21.900 -22.728 1.00 0.00 C ATOM 518 CG GLU A 33 -17.412 -22.376 -24.063 1.00 0.00 C ATOM 519 CD GLU A 33 -17.396 -23.914 -24.157 1.00 0.00 C ATOM 520 OE1 GLU A 33 -18.473 -24.523 -24.372 1.00 0.00 O ATOM 521 OE2 GLU A 33 -16.307 -24.527 -24.042 1.00 0.00 O ATOM 0 H GLU A 33 -16.566 -20.184 -21.122 1.00 0.00 H new ATOM 0 HA GLU A 33 -18.113 -19.878 -23.600 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -17.394 -22.308 -21.910 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -19.000 -22.286 -22.611 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -18.004 -21.967 -24.882 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -16.398 -21.993 -24.180 1.00 0.00 H new ATOM 528 N CYS A 34 -19.113 -19.698 -20.513 1.00 0.00 N ATOM 529 CA CYS A 34 -20.250 -19.358 -19.660 1.00 0.00 C ATOM 530 C CYS A 34 -20.867 -17.961 -19.912 1.00 0.00 C ATOM 531 O CYS A 34 -20.283 -17.077 -20.551 1.00 0.00 O ATOM 532 CB CYS A 34 -19.855 -19.606 -18.201 1.00 0.00 C ATOM 533 SG CYS A 34 -21.349 -19.899 -17.213 1.00 0.00 S ATOM 0 H CYS A 34 -18.219 -19.727 -20.022 1.00 0.00 H new ATOM 0 HA CYS A 34 -21.076 -20.017 -19.927 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -19.188 -20.465 -18.135 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -19.309 -18.747 -17.810 1.00 0.00 H new ATOM 538 N LYS A 35 -22.082 -17.785 -19.381 1.00 0.00 N ATOM 539 CA LYS A 35 -22.920 -16.572 -19.449 1.00 0.00 C ATOM 540 C LYS A 35 -22.530 -15.506 -18.412 1.00 0.00 C ATOM 541 O LYS A 35 -23.000 -14.369 -18.498 1.00 0.00 O ATOM 542 CB LYS A 35 -24.399 -16.962 -19.255 1.00 0.00 C ATOM 543 CG LYS A 35 -24.935 -18.029 -20.228 1.00 0.00 C ATOM 544 CD LYS A 35 -24.810 -17.630 -21.707 1.00 0.00 C ATOM 545 CE LYS A 35 -25.461 -18.698 -22.593 1.00 0.00 C ATOM 546 NZ LYS A 35 -25.369 -18.348 -24.034 1.00 0.00 N ATOM 0 H LYS A 35 -22.540 -18.531 -18.858 1.00 0.00 H new ATOM 0 HA LYS A 35 -22.760 -16.129 -20.432 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -24.530 -17.326 -18.236 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -25.010 -16.065 -19.355 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -24.395 -18.962 -20.065 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -25.983 -18.223 -20.000 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -25.289 -16.665 -21.874 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -23.759 -17.515 -21.974 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -24.976 -19.659 -22.420 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -26.508 -18.814 -22.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -25.820 -19.094 -24.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -25.853 -17.443 -24.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -24.369 -18.262 -24.307 1.00 0.00 H new ATOM 560 N PHE A 36 -21.668 -15.862 -17.462 1.00 0.00 N ATOM 561 CA PHE A 36 -21.149 -15.016 -16.383 1.00 0.00 C ATOM 562 C PHE A 36 -19.643 -15.284 -16.173 1.00 0.00 C ATOM 563 O PHE A 36 -19.060 -16.154 -16.829 1.00 0.00 O ATOM 564 CB PHE A 36 -21.952 -15.290 -15.104 1.00 0.00 C ATOM 565 CG PHE A 36 -23.442 -15.010 -15.177 1.00 0.00 C ATOM 566 CD1 PHE A 36 -23.906 -13.684 -15.267 1.00 0.00 C ATOM 567 CD2 PHE A 36 -24.368 -16.071 -15.124 1.00 0.00 C ATOM 568 CE1 PHE A 36 -25.286 -13.418 -15.301 1.00 0.00 C ATOM 569 CE2 PHE A 36 -25.749 -15.805 -15.161 1.00 0.00 C ATOM 570 CZ PHE A 36 -26.208 -14.479 -15.249 1.00 0.00 C ATOM 0 H PHE A 36 -21.288 -16.808 -17.420 1.00 0.00 H new ATOM 0 HA PHE A 36 -21.260 -13.964 -16.647 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -21.813 -16.336 -14.829 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -21.529 -14.690 -14.298 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -23.199 -12.868 -15.310 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -24.017 -17.090 -15.055 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -25.638 -12.399 -15.367 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -26.457 -16.620 -15.122 1.00 0.00 H new ATOM 0 HZ PHE A 36 -27.268 -14.275 -15.277 1.00 0.00 H new ATOM 580 N ALA A 37 -18.988 -14.532 -15.284 1.00 0.00 N ATOM 581 CA ALA A 37 -17.551 -14.665 -15.041 1.00 0.00 C ATOM 582 C ALA A 37 -17.201 -15.753 -14.000 1.00 0.00 C ATOM 583 O ALA A 37 -17.962 -16.003 -13.059 1.00 0.00 O ATOM 584 CB ALA A 37 -17.042 -13.297 -14.586 1.00 0.00 C ATOM 0 H ALA A 37 -19.439 -13.816 -14.714 1.00 0.00 H new ATOM 0 HA ALA A 37 -17.067 -14.988 -15.963 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -15.971 -13.353 -14.394 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -17.233 -12.560 -15.366 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -17.560 -13.001 -13.673 1.00 0.00 H new ATOM 590 N HIS A 38 -16.021 -16.369 -14.143 1.00 0.00 N ATOM 591 CA HIS A 38 -15.490 -17.416 -13.258 1.00 0.00 C ATOM 592 C HIS A 38 -14.118 -16.998 -12.659 1.00 0.00 C ATOM 593 O HIS A 38 -13.077 -17.254 -13.278 1.00 0.00 O ATOM 594 CB HIS A 38 -15.381 -18.748 -14.030 1.00 0.00 C ATOM 595 CG HIS A 38 -16.679 -19.372 -14.496 1.00 0.00 C ATOM 596 ND1 HIS A 38 -16.812 -20.318 -15.490 1.00 0.00 N ATOM 597 CD2 HIS A 38 -17.936 -19.151 -13.997 1.00 0.00 C ATOM 598 CE1 HIS A 38 -18.114 -20.640 -15.594 1.00 0.00 C ATOM 599 NE2 HIS A 38 -18.843 -19.945 -14.711 1.00 0.00 N ATOM 0 H HIS A 38 -15.385 -16.144 -14.908 1.00 0.00 H new ATOM 0 HA HIS A 38 -16.179 -17.553 -12.424 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -14.749 -18.584 -14.903 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -14.866 -19.468 -13.394 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -16.054 -20.707 -16.050 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -18.185 -18.478 -13.190 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -18.516 -21.359 -16.293 1.00 0.00 H new ATOM 607 N PRO A 39 -14.075 -16.334 -11.479 1.00 0.00 N ATOM 608 CA PRO A 39 -12.825 -15.876 -10.845 1.00 0.00 C ATOM 609 C PRO A 39 -11.846 -17.000 -10.456 1.00 0.00 C ATOM 610 O PRO A 39 -12.229 -18.161 -10.296 1.00 0.00 O ATOM 611 CB PRO A 39 -13.256 -15.086 -9.600 1.00 0.00 C ATOM 612 CG PRO A 39 -14.664 -15.585 -9.295 1.00 0.00 C ATOM 613 CD PRO A 39 -15.223 -15.944 -10.670 1.00 0.00 C ATOM 0 HA PRO A 39 -12.265 -15.278 -11.564 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -12.582 -15.267 -8.763 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -13.248 -14.013 -9.790 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -14.648 -16.449 -8.631 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -15.264 -14.818 -8.806 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -15.944 -16.758 -10.598 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -15.743 -15.095 -11.114 1.00 0.00 H new ATOM 621 N SER A 40 -10.576 -16.632 -10.246 1.00 0.00 N ATOM 622 CA SER A 40 -9.483 -17.523 -9.815 1.00 0.00 C ATOM 623 C SER A 40 -8.972 -17.179 -8.404 1.00 0.00 C ATOM 624 O SER A 40 -9.515 -16.308 -7.717 1.00 0.00 O ATOM 625 CB SER A 40 -8.325 -17.471 -10.825 1.00 0.00 C ATOM 626 OG SER A 40 -7.599 -16.260 -10.687 1.00 0.00 O ATOM 0 H SER A 40 -10.266 -15.669 -10.376 1.00 0.00 H new ATOM 0 HA SER A 40 -9.887 -18.535 -9.777 1.00 0.00 H new ATOM 0 HB2 SER A 40 -7.660 -18.320 -10.669 1.00 0.00 H new ATOM 0 HB3 SER A 40 -8.715 -17.554 -11.839 1.00 0.00 H new ATOM 0 HG SER A 40 -8.207 -15.500 -10.797 1.00 0.00 H new ATOM 632 N LYS A 41 -7.899 -17.860 -7.979 1.00 0.00 N ATOM 633 CA LYS A 41 -7.208 -17.705 -6.686 1.00 0.00 C ATOM 634 C LYS A 41 -6.785 -16.268 -6.328 1.00 0.00 C ATOM 635 O LYS A 41 -6.653 -15.971 -5.139 1.00 0.00 O ATOM 636 CB LYS A 41 -5.978 -18.631 -6.684 1.00 0.00 C ATOM 637 CG LYS A 41 -6.362 -20.120 -6.612 1.00 0.00 C ATOM 638 CD LYS A 41 -5.147 -21.049 -6.461 1.00 0.00 C ATOM 639 CE LYS A 41 -4.220 -21.007 -7.684 1.00 0.00 C ATOM 640 NZ LYS A 41 -3.081 -21.952 -7.538 1.00 0.00 N ATOM 0 H LYS A 41 -7.463 -18.576 -8.560 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.931 -17.976 -5.917 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -5.392 -18.453 -7.586 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -5.341 -18.382 -5.835 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -7.037 -20.275 -5.770 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -6.910 -20.392 -7.514 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -4.584 -20.764 -5.572 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -5.492 -22.071 -6.306 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -4.788 -21.256 -8.581 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -3.839 -19.995 -7.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -2.475 -21.898 -8.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -2.526 -21.699 -6.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -3.445 -22.921 -7.435 1.00 0.00 H new ATOM 654 N SER A 42 -6.575 -15.386 -7.314 1.00 0.00 N ATOM 655 CA SER A 42 -6.148 -13.988 -7.093 1.00 0.00 C ATOM 656 C SER A 42 -7.226 -12.931 -7.380 1.00 0.00 C ATOM 657 O SER A 42 -7.111 -11.806 -6.888 1.00 0.00 O ATOM 658 CB SER A 42 -4.892 -13.669 -7.917 1.00 0.00 C ATOM 659 OG SER A 42 -3.826 -14.560 -7.605 1.00 0.00 O ATOM 0 H SER A 42 -6.697 -15.620 -8.299 1.00 0.00 H new ATOM 0 HA SER A 42 -5.937 -13.927 -6.025 1.00 0.00 H new ATOM 0 HB2 SER A 42 -5.125 -13.736 -8.980 1.00 0.00 H new ATOM 0 HB3 SER A 42 -4.579 -12.643 -7.724 1.00 0.00 H new ATOM 0 HG SER A 42 -3.203 -14.121 -6.989 1.00 0.00 H new ATOM 665 N CYS A 43 -8.270 -13.249 -8.153 1.00 0.00 N ATOM 666 CA CYS A 43 -9.344 -12.317 -8.507 1.00 0.00 C ATOM 667 C CYS A 43 -10.150 -11.821 -7.291 1.00 0.00 C ATOM 668 O CYS A 43 -10.587 -12.621 -6.459 1.00 0.00 O ATOM 669 CB CYS A 43 -10.286 -12.976 -9.522 1.00 0.00 C ATOM 670 SG CYS A 43 -9.374 -13.506 -11.001 1.00 0.00 S ATOM 0 H CYS A 43 -8.394 -14.178 -8.557 1.00 0.00 H new ATOM 0 HA CYS A 43 -8.867 -11.439 -8.942 1.00 0.00 H new ATOM 0 HB2 CYS A 43 -10.777 -13.835 -9.065 1.00 0.00 H new ATOM 0 HB3 CYS A 43 -11.071 -12.274 -9.805 1.00 0.00 H new ATOM 0 HG CYS A 43 -10.195 -14.062 -11.841 1.00 0.00 H new ATOM 676 N GLN A 44 -10.399 -10.509 -7.212 1.00 0.00 N ATOM 677 CA GLN A 44 -11.229 -9.905 -6.161 1.00 0.00 C ATOM 678 C GLN A 44 -12.721 -10.032 -6.501 1.00 0.00 C ATOM 679 O GLN A 44 -13.120 -9.839 -7.652 1.00 0.00 O ATOM 680 CB GLN A 44 -10.834 -8.434 -5.946 1.00 0.00 C ATOM 681 CG GLN A 44 -9.548 -8.341 -5.111 1.00 0.00 C ATOM 682 CD GLN A 44 -9.141 -6.902 -4.797 1.00 0.00 C ATOM 683 OE1 GLN A 44 -8.125 -6.395 -5.256 1.00 0.00 O ATOM 684 NE2 GLN A 44 -9.894 -6.188 -3.988 1.00 0.00 N ATOM 0 H GLN A 44 -10.029 -9.832 -7.879 1.00 0.00 H new ATOM 0 HA GLN A 44 -11.054 -10.445 -5.230 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -10.686 -7.946 -6.909 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -11.642 -7.904 -5.441 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -9.688 -8.885 -4.177 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -8.737 -8.833 -5.648 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -10.744 -6.591 -3.595 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -9.627 -5.232 -3.754 1.00 0.00 H new ATOM 693 N VAL A 45 -13.539 -10.342 -5.489 1.00 0.00 N ATOM 694 CA VAL A 45 -14.992 -10.568 -5.603 1.00 0.00 C ATOM 695 C VAL A 45 -15.748 -9.771 -4.531 1.00 0.00 C ATOM 696 O VAL A 45 -15.327 -9.735 -3.374 1.00 0.00 O ATOM 697 CB VAL A 45 -15.331 -12.070 -5.423 1.00 0.00 C ATOM 698 CG1 VAL A 45 -16.782 -12.385 -5.816 1.00 0.00 C ATOM 699 CG2 VAL A 45 -14.416 -13.042 -6.183 1.00 0.00 C ATOM 0 H VAL A 45 -13.200 -10.447 -4.533 1.00 0.00 H new ATOM 0 HA VAL A 45 -15.297 -10.238 -6.596 1.00 0.00 H new ATOM 0 HB VAL A 45 -15.171 -12.231 -4.357 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -16.975 -13.448 -5.674 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -17.462 -11.806 -5.191 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -16.940 -12.124 -6.862 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -14.735 -14.067 -5.992 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -14.475 -12.837 -7.252 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -13.388 -12.913 -5.845 1.00 0.00 H new ATOM 709 N GLU A 46 -16.879 -9.163 -4.894 1.00 0.00 N ATOM 710 CA GLU A 46 -17.755 -8.395 -3.992 1.00 0.00 C ATOM 711 C GLU A 46 -19.235 -8.553 -4.388 1.00 0.00 C ATOM 712 O GLU A 46 -19.587 -8.403 -5.558 1.00 0.00 O ATOM 713 CB GLU A 46 -17.398 -6.896 -4.024 1.00 0.00 C ATOM 714 CG GLU A 46 -16.028 -6.568 -3.415 1.00 0.00 C ATOM 715 CD GLU A 46 -15.834 -5.046 -3.284 1.00 0.00 C ATOM 716 OE1 GLU A 46 -15.314 -4.409 -4.235 1.00 0.00 O ATOM 717 OE2 GLU A 46 -16.194 -4.472 -2.227 1.00 0.00 O ATOM 0 H GLU A 46 -17.226 -9.189 -5.853 1.00 0.00 H new ATOM 0 HA GLU A 46 -17.603 -8.789 -2.987 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -17.417 -6.550 -5.058 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -18.166 -6.339 -3.487 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -15.940 -7.035 -2.434 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -15.239 -6.987 -4.039 1.00 0.00 H new ATOM 724 N ASN A 47 -20.109 -8.827 -3.410 1.00 0.00 N ATOM 725 CA ASN A 47 -21.571 -8.976 -3.550 1.00 0.00 C ATOM 726 C ASN A 47 -22.060 -9.787 -4.779 1.00 0.00 C ATOM 727 O ASN A 47 -23.070 -9.448 -5.403 1.00 0.00 O ATOM 728 CB ASN A 47 -22.195 -7.568 -3.471 1.00 0.00 C ATOM 729 CG ASN A 47 -23.690 -7.578 -3.171 1.00 0.00 C ATOM 730 OD1 ASN A 47 -24.211 -8.427 -2.459 1.00 0.00 O ATOM 731 ND2 ASN A 47 -24.432 -6.623 -3.687 1.00 0.00 N ATOM 0 H ASN A 47 -19.802 -8.959 -2.446 1.00 0.00 H new ATOM 0 HA ASN A 47 -21.916 -9.602 -2.727 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -21.682 -6.995 -2.698 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -22.026 -7.051 -4.416 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -25.433 -6.594 -3.493 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -24.007 -5.911 -4.281 1.00 0.00 H new ATOM 738 N GLY A 48 -21.341 -10.850 -5.157 1.00 0.00 N ATOM 739 CA GLY A 48 -21.697 -11.693 -6.310 1.00 0.00 C ATOM 740 C GLY A 48 -21.202 -11.172 -7.668 1.00 0.00 C ATOM 741 O GLY A 48 -21.700 -11.596 -8.714 1.00 0.00 O ATOM 0 H GLY A 48 -20.495 -11.152 -4.674 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -21.291 -12.692 -6.150 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -22.782 -11.792 -6.348 1.00 0.00 H new ATOM 745 N ARG A 49 -20.233 -10.248 -7.674 1.00 0.00 N ATOM 746 CA ARG A 49 -19.645 -9.631 -8.873 1.00 0.00 C ATOM 747 C ARG A 49 -18.120 -9.536 -8.772 1.00 0.00 C ATOM 748 O ARG A 49 -17.539 -9.616 -7.690 1.00 0.00 O ATOM 749 CB ARG A 49 -20.282 -8.251 -9.146 1.00 0.00 C ATOM 750 CG ARG A 49 -21.820 -8.269 -9.170 1.00 0.00 C ATOM 751 CD ARG A 49 -22.396 -6.952 -9.697 1.00 0.00 C ATOM 752 NE ARG A 49 -23.846 -7.076 -9.943 1.00 0.00 N ATOM 753 CZ ARG A 49 -24.753 -6.121 -9.992 1.00 0.00 C ATOM 754 NH1 ARG A 49 -24.482 -4.868 -9.754 1.00 0.00 N ATOM 755 NH2 ARG A 49 -25.972 -6.445 -10.300 1.00 0.00 N ATOM 0 H ARG A 49 -19.820 -9.895 -6.811 1.00 0.00 H new ATOM 0 HA ARG A 49 -19.866 -10.278 -9.722 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -19.948 -7.550 -8.381 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -19.918 -7.876 -10.103 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -22.164 -9.092 -9.796 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -22.197 -8.454 -8.164 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -22.212 -6.155 -8.977 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -21.889 -6.671 -10.620 1.00 0.00 H new ATOM 0 HE ARG A 49 -24.191 -8.024 -10.095 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -23.530 -4.588 -9.516 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -25.222 -4.168 -9.805 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -26.207 -7.418 -10.496 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -26.695 -5.727 -10.345 1.00 0.00 H new ATOM 769 N VAL A 50 -17.482 -9.384 -9.926 1.00 0.00 N ATOM 770 CA VAL A 50 -16.031 -9.336 -10.149 1.00 0.00 C ATOM 771 C VAL A 50 -15.684 -8.251 -11.173 1.00 0.00 C ATOM 772 O VAL A 50 -16.378 -8.091 -12.174 1.00 0.00 O ATOM 773 CB VAL A 50 -15.525 -10.694 -10.677 1.00 0.00 C ATOM 774 CG1 VAL A 50 -15.413 -11.706 -9.543 1.00 0.00 C ATOM 775 CG2 VAL A 50 -16.377 -11.336 -11.784 1.00 0.00 C ATOM 0 H VAL A 50 -17.999 -9.283 -10.800 1.00 0.00 H new ATOM 0 HA VAL A 50 -15.551 -9.109 -9.197 1.00 0.00 H new ATOM 0 HB VAL A 50 -14.557 -10.453 -11.116 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -15.054 -12.657 -9.938 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -14.713 -11.337 -8.794 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -16.392 -11.849 -9.085 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -15.932 -12.285 -12.081 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -17.387 -11.509 -11.412 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -16.418 -10.669 -12.645 1.00 0.00 H new ATOM 785 N ILE A 51 -14.608 -7.496 -10.953 1.00 0.00 N ATOM 786 CA ILE A 51 -14.188 -6.422 -11.872 1.00 0.00 C ATOM 787 C ILE A 51 -13.282 -7.004 -12.971 1.00 0.00 C ATOM 788 O ILE A 51 -12.316 -7.714 -12.682 1.00 0.00 O ATOM 789 CB ILE A 51 -13.520 -5.269 -11.085 1.00 0.00 C ATOM 790 CG1 ILE A 51 -14.544 -4.685 -10.087 1.00 0.00 C ATOM 791 CG2 ILE A 51 -13.008 -4.170 -12.035 1.00 0.00 C ATOM 792 CD1 ILE A 51 -14.067 -3.507 -9.232 1.00 0.00 C ATOM 0 H ILE A 51 -14.002 -7.605 -10.140 1.00 0.00 H new ATOM 0 HA ILE A 51 -15.060 -5.994 -12.367 1.00 0.00 H new ATOM 0 HB ILE A 51 -12.659 -5.661 -10.544 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -15.423 -4.367 -10.647 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -14.864 -5.485 -9.419 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -12.544 -3.374 -11.453 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -12.274 -4.594 -12.720 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -13.843 -3.763 -12.605 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -14.873 -3.186 -8.573 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -13.210 -3.815 -8.634 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -13.778 -2.680 -9.881 1.00 0.00 H new ATOM 804 N ALA A 52 -13.595 -6.714 -14.235 1.00 0.00 N ATOM 805 CA ALA A 52 -12.818 -7.153 -15.397 1.00 0.00 C ATOM 806 C ALA A 52 -11.513 -6.342 -15.552 1.00 0.00 C ATOM 807 O ALA A 52 -11.442 -5.174 -15.162 1.00 0.00 O ATOM 808 CB ALA A 52 -13.707 -7.088 -16.646 1.00 0.00 C ATOM 0 H ALA A 52 -14.412 -6.156 -14.485 1.00 0.00 H new ATOM 0 HA ALA A 52 -12.503 -8.186 -15.253 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -13.136 -7.413 -17.516 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -14.570 -7.741 -16.513 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -14.047 -6.064 -16.797 1.00 0.00 H new ATOM 814 N CYS A 53 -10.472 -6.969 -16.109 1.00 0.00 N ATOM 815 CA CYS A 53 -9.145 -6.385 -16.280 1.00 0.00 C ATOM 816 C CYS A 53 -9.115 -5.250 -17.320 1.00 0.00 C ATOM 817 O CYS A 53 -9.064 -5.465 -18.539 1.00 0.00 O ATOM 818 CB CYS A 53 -8.123 -7.496 -16.564 1.00 0.00 C ATOM 819 SG CYS A 53 -6.421 -6.851 -16.433 1.00 0.00 S ATOM 0 H CYS A 53 -10.535 -7.924 -16.462 1.00 0.00 H new ATOM 0 HA CYS A 53 -8.863 -5.900 -15.346 1.00 0.00 H new ATOM 0 HB2 CYS A 53 -8.263 -8.315 -15.859 1.00 0.00 H new ATOM 0 HB3 CYS A 53 -8.288 -7.903 -17.562 1.00 0.00 H new ATOM 824 N PHE A 54 -9.139 -4.015 -16.811 1.00 0.00 N ATOM 825 CA PHE A 54 -9.013 -2.800 -17.615 1.00 0.00 C ATOM 826 C PHE A 54 -7.652 -2.772 -18.325 1.00 0.00 C ATOM 827 O PHE A 54 -7.573 -2.382 -19.487 1.00 0.00 O ATOM 828 CB PHE A 54 -9.195 -1.551 -16.738 1.00 0.00 C ATOM 829 CG PHE A 54 -8.337 -1.500 -15.487 1.00 0.00 C ATOM 830 CD1 PHE A 54 -8.821 -2.032 -14.276 1.00 0.00 C ATOM 831 CD2 PHE A 54 -7.042 -0.950 -15.542 1.00 0.00 C ATOM 832 CE1 PHE A 54 -8.004 -2.031 -13.131 1.00 0.00 C ATOM 833 CE2 PHE A 54 -6.222 -0.962 -14.401 1.00 0.00 C ATOM 834 CZ PHE A 54 -6.702 -1.502 -13.195 1.00 0.00 C ATOM 0 H PHE A 54 -9.248 -3.830 -15.814 1.00 0.00 H new ATOM 0 HA PHE A 54 -9.797 -2.800 -18.372 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -8.979 -0.670 -17.342 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -10.242 -1.486 -16.442 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -9.819 -2.441 -14.227 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -6.678 -0.518 -16.463 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -8.377 -2.437 -12.202 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -5.222 -0.556 -14.451 1.00 0.00 H new ATOM 0 HZ PHE A 54 -6.072 -1.511 -12.318 1.00 0.00 H new ATOM 844 N ASP A 55 -6.584 -3.231 -17.662 1.00 0.00 N ATOM 845 CA ASP A 55 -5.251 -3.314 -18.257 1.00 0.00 C ATOM 846 C ASP A 55 -5.253 -4.274 -19.457 1.00 0.00 C ATOM 847 O ASP A 55 -4.702 -3.931 -20.502 1.00 0.00 O ATOM 848 CB ASP A 55 -4.203 -3.750 -17.224 1.00 0.00 C ATOM 849 CG ASP A 55 -3.909 -2.720 -16.134 1.00 0.00 C ATOM 850 OD1 ASP A 55 -3.746 -1.522 -16.469 1.00 0.00 O ATOM 851 OD2 ASP A 55 -3.761 -3.128 -14.959 1.00 0.00 O ATOM 0 H ASP A 55 -6.623 -3.555 -16.696 1.00 0.00 H new ATOM 0 HA ASP A 55 -4.982 -2.317 -18.607 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -4.541 -4.672 -16.751 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -3.274 -3.982 -17.745 1.00 0.00 H new ATOM 856 N SER A 56 -5.883 -5.450 -19.362 1.00 0.00 N ATOM 857 CA SER A 56 -5.973 -6.396 -20.484 1.00 0.00 C ATOM 858 C SER A 56 -6.775 -5.806 -21.656 1.00 0.00 C ATOM 859 O SER A 56 -6.349 -5.908 -22.810 1.00 0.00 O ATOM 860 CB SER A 56 -6.551 -7.731 -20.005 1.00 0.00 C ATOM 861 OG SER A 56 -6.617 -8.664 -21.073 1.00 0.00 O ATOM 0 H SER A 56 -6.343 -5.773 -18.511 1.00 0.00 H new ATOM 0 HA SER A 56 -4.967 -6.583 -20.861 1.00 0.00 H new ATOM 0 HB2 SER A 56 -5.933 -8.133 -19.203 1.00 0.00 H new ATOM 0 HB3 SER A 56 -7.547 -7.574 -19.591 1.00 0.00 H new ATOM 0 HG SER A 56 -6.987 -9.510 -20.746 1.00 0.00 H new ATOM 867 N LEU A 57 -7.894 -5.116 -21.380 1.00 0.00 N ATOM 868 CA LEU A 57 -8.708 -4.435 -22.400 1.00 0.00 C ATOM 869 C LEU A 57 -7.949 -3.295 -23.110 1.00 0.00 C ATOM 870 O LEU A 57 -8.074 -3.142 -24.328 1.00 0.00 O ATOM 871 CB LEU A 57 -9.998 -3.895 -21.751 1.00 0.00 C ATOM 872 CG LEU A 57 -11.087 -4.963 -21.546 1.00 0.00 C ATOM 873 CD1 LEU A 57 -12.169 -4.429 -20.611 1.00 0.00 C ATOM 874 CD2 LEU A 57 -11.761 -5.359 -22.864 1.00 0.00 C ATOM 0 H LEU A 57 -8.262 -5.014 -20.434 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.952 -5.170 -23.167 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -9.750 -3.453 -20.786 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -10.399 -3.096 -22.374 1.00 0.00 H new ATOM 0 HG LEU A 57 -10.595 -5.838 -21.122 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -12.936 -5.190 -20.470 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -11.726 -4.178 -19.647 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -12.618 -3.537 -21.047 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -12.522 -6.115 -22.671 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -12.227 -4.481 -23.313 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -11.014 -5.763 -23.548 1.00 0.00 H new ATOM 886 N LYS A 58 -7.161 -2.501 -22.372 1.00 0.00 N ATOM 887 CA LYS A 58 -6.363 -1.374 -22.901 1.00 0.00 C ATOM 888 C LYS A 58 -5.009 -1.798 -23.504 1.00 0.00 C ATOM 889 O LYS A 58 -4.342 -0.973 -24.130 1.00 0.00 O ATOM 890 CB LYS A 58 -6.161 -0.321 -21.791 1.00 0.00 C ATOM 891 CG LYS A 58 -7.462 0.347 -21.295 1.00 0.00 C ATOM 892 CD LYS A 58 -8.213 1.220 -22.314 1.00 0.00 C ATOM 893 CE LYS A 58 -7.380 2.424 -22.777 1.00 0.00 C ATOM 894 NZ LYS A 58 -8.168 3.333 -23.651 1.00 0.00 N ATOM 0 H LYS A 58 -7.055 -2.623 -21.365 1.00 0.00 H new ATOM 0 HA LYS A 58 -6.929 -0.946 -23.728 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.666 -0.796 -20.944 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -5.489 0.453 -22.161 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -8.138 -0.436 -20.951 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -7.221 0.963 -20.429 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -8.483 0.614 -23.179 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -9.143 1.574 -21.870 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -7.022 2.975 -21.907 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -6.500 2.072 -23.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -7.568 4.125 -23.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -8.503 2.809 -24.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -8.984 3.701 -23.122 1.00 0.00 H new ATOM 908 N GLY A 59 -4.599 -3.059 -23.337 1.00 0.00 N ATOM 909 CA GLY A 59 -3.338 -3.607 -23.862 1.00 0.00 C ATOM 910 C GLY A 59 -2.105 -3.277 -23.005 1.00 0.00 C ATOM 911 O GLY A 59 -1.036 -2.984 -23.548 1.00 0.00 O ATOM 0 H GLY A 59 -5.147 -3.747 -22.820 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -3.431 -4.690 -23.944 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -3.180 -3.224 -24.870 1.00 0.00 H new ATOM 915 N ARG A 60 -2.260 -3.289 -21.674 1.00 0.00 N ATOM 916 CA ARG A 60 -1.241 -2.936 -20.665 1.00 0.00 C ATOM 917 C ARG A 60 -0.900 -4.060 -19.670 1.00 0.00 C ATOM 918 O ARG A 60 0.161 -3.996 -19.044 1.00 0.00 O ATOM 919 CB ARG A 60 -1.734 -1.659 -19.944 1.00 0.00 C ATOM 920 CG ARG A 60 -0.667 -0.984 -19.064 1.00 0.00 C ATOM 921 CD ARG A 60 -1.068 0.440 -18.658 1.00 0.00 C ATOM 922 NE ARG A 60 -2.249 0.439 -17.778 1.00 0.00 N ATOM 923 CZ ARG A 60 -2.947 1.469 -17.349 1.00 0.00 C ATOM 924 NH1 ARG A 60 -3.957 1.235 -16.570 1.00 0.00 N ATOM 925 NH2 ARG A 60 -2.669 2.702 -17.670 1.00 0.00 N ATOM 0 H ARG A 60 -3.145 -3.559 -21.245 1.00 0.00 H new ATOM 0 HA ARG A 60 -0.296 -2.763 -21.180 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -2.080 -0.944 -20.690 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -2.593 -1.913 -19.324 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -0.505 -1.583 -18.168 1.00 0.00 H new ATOM 0 HG3 ARG A 60 0.280 -0.953 -19.603 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -0.234 0.922 -18.148 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -1.279 1.028 -19.551 1.00 0.00 H new ATOM 0 HE ARG A 60 -2.566 -0.477 -17.461 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -4.188 0.277 -16.309 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -4.520 2.009 -16.219 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -1.878 2.904 -18.281 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -3.243 3.465 -17.310 1.00 0.00 H new ATOM 939 N CYS A 61 -1.759 -5.074 -19.507 1.00 0.00 N ATOM 940 CA CYS A 61 -1.538 -6.164 -18.546 1.00 0.00 C ATOM 941 C CYS A 61 -0.372 -7.102 -18.933 1.00 0.00 C ATOM 942 O CYS A 61 -0.083 -7.330 -20.114 1.00 0.00 O ATOM 943 CB CYS A 61 -2.853 -6.934 -18.322 1.00 0.00 C ATOM 944 SG CYS A 61 -2.823 -7.815 -16.725 1.00 0.00 S ATOM 0 H CYS A 61 -2.626 -5.163 -20.037 1.00 0.00 H new ATOM 0 HA CYS A 61 -1.228 -5.711 -17.604 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -3.694 -6.241 -18.344 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -3.005 -7.646 -19.133 1.00 0.00 H new ATOM 949 N SER A 62 0.286 -7.645 -17.908 1.00 0.00 N ATOM 950 CA SER A 62 1.426 -8.577 -17.985 1.00 0.00 C ATOM 951 C SER A 62 1.591 -9.451 -16.723 1.00 0.00 C ATOM 952 O SER A 62 2.588 -10.171 -16.583 1.00 0.00 O ATOM 953 CB SER A 62 2.720 -7.784 -18.243 1.00 0.00 C ATOM 954 OG SER A 62 2.986 -6.870 -17.185 1.00 0.00 O ATOM 0 H SER A 62 0.027 -7.438 -16.943 1.00 0.00 H new ATOM 0 HA SER A 62 1.221 -9.260 -18.810 1.00 0.00 H new ATOM 0 HB2 SER A 62 3.557 -8.474 -18.349 1.00 0.00 H new ATOM 0 HB3 SER A 62 2.634 -7.240 -19.184 1.00 0.00 H new ATOM 0 HG SER A 62 3.814 -6.382 -17.375 1.00 0.00 H new ATOM 960 N ARG A 63 0.629 -9.394 -15.789 1.00 0.00 N ATOM 961 CA ARG A 63 0.624 -10.118 -14.504 1.00 0.00 C ATOM 962 C ARG A 63 0.455 -11.638 -14.642 1.00 0.00 C ATOM 963 O ARG A 63 -0.049 -12.149 -15.643 1.00 0.00 O ATOM 964 CB ARG A 63 -0.516 -9.547 -13.633 1.00 0.00 C ATOM 965 CG ARG A 63 -0.259 -8.107 -13.159 1.00 0.00 C ATOM 966 CD ARG A 63 -1.430 -7.578 -12.317 1.00 0.00 C ATOM 967 NE ARG A 63 -2.613 -7.271 -13.145 1.00 0.00 N ATOM 968 CZ ARG A 63 -3.019 -6.106 -13.611 1.00 0.00 C ATOM 969 NH1 ARG A 63 -2.422 -4.972 -13.371 1.00 0.00 N ATOM 970 NH2 ARG A 63 -4.074 -6.033 -14.345 1.00 0.00 N ATOM 0 H ARG A 63 -0.204 -8.818 -15.912 1.00 0.00 H new ATOM 0 HA ARG A 63 1.601 -9.969 -14.045 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -1.446 -9.574 -14.201 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -0.655 -10.189 -12.763 1.00 0.00 H new ATOM 0 HG2 ARG A 63 0.658 -8.074 -12.571 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -0.108 -7.459 -14.023 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -1.698 -8.318 -11.563 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -1.117 -6.680 -11.785 1.00 0.00 H new ATOM 0 HE ARG A 63 -3.197 -8.070 -13.391 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -1.585 -4.950 -12.789 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -2.792 -4.107 -13.765 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -4.599 -6.878 -14.568 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -4.384 -5.130 -14.703 1.00 0.00 H new ATOM 984 N GLU A 64 0.830 -12.352 -13.577 1.00 0.00 N ATOM 985 CA GLU A 64 0.693 -13.817 -13.422 1.00 0.00 C ATOM 986 C GLU A 64 -0.233 -14.193 -12.240 1.00 0.00 C ATOM 987 O GLU A 64 -0.513 -15.369 -11.995 1.00 0.00 O ATOM 988 CB GLU A 64 2.083 -14.461 -13.268 1.00 0.00 C ATOM 989 CG GLU A 64 2.970 -14.271 -14.507 1.00 0.00 C ATOM 990 CD GLU A 64 4.308 -15.017 -14.347 1.00 0.00 C ATOM 991 OE1 GLU A 64 5.270 -14.439 -13.782 1.00 0.00 O ATOM 992 OE2 GLU A 64 4.414 -16.188 -14.790 1.00 0.00 O ATOM 0 H GLU A 64 1.256 -11.914 -12.761 1.00 0.00 H new ATOM 0 HA GLU A 64 0.221 -14.208 -14.324 1.00 0.00 H new ATOM 0 HB2 GLU A 64 2.583 -14.031 -12.400 1.00 0.00 H new ATOM 0 HB3 GLU A 64 1.964 -15.527 -13.072 1.00 0.00 H new ATOM 0 HG2 GLU A 64 2.449 -14.637 -15.392 1.00 0.00 H new ATOM 0 HG3 GLU A 64 3.158 -13.209 -14.665 1.00 0.00 H new ATOM 999 N ASN A 65 -0.733 -13.179 -11.526 1.00 0.00 N ATOM 1000 CA ASN A 65 -1.641 -13.233 -10.375 1.00 0.00 C ATOM 1001 C ASN A 65 -2.634 -12.049 -10.445 1.00 0.00 C ATOM 1002 O ASN A 65 -2.936 -11.399 -9.441 1.00 0.00 O ATOM 1003 CB ASN A 65 -0.792 -13.228 -9.088 1.00 0.00 C ATOM 1004 CG ASN A 65 -0.210 -14.594 -8.775 1.00 0.00 C ATOM 1005 OD1 ASN A 65 0.975 -14.854 -8.946 1.00 0.00 O ATOM 1006 ND2 ASN A 65 -1.024 -15.505 -8.290 1.00 0.00 N ATOM 0 H ASN A 65 -0.492 -12.216 -11.759 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.238 -14.145 -10.381 1.00 0.00 H new ATOM 0 HB2 ASN A 65 0.018 -12.506 -9.193 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -1.407 -12.898 -8.251 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -0.670 -16.432 -8.055 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -2.010 -15.285 -8.149 1.00 0.00 H new ATOM 1013 N CYS A 66 -3.098 -11.733 -11.660 1.00 0.00 N ATOM 1014 CA CYS A 66 -4.006 -10.627 -11.942 1.00 0.00 C ATOM 1015 C CYS A 66 -5.276 -10.703 -11.070 1.00 0.00 C ATOM 1016 O CYS A 66 -5.956 -11.734 -11.002 1.00 0.00 O ATOM 1017 CB CYS A 66 -4.293 -10.631 -13.450 1.00 0.00 C ATOM 1018 SG CYS A 66 -4.951 -9.024 -13.962 1.00 0.00 S ATOM 0 H CYS A 66 -2.841 -12.259 -12.496 1.00 0.00 H new ATOM 0 HA CYS A 66 -3.549 -9.673 -11.679 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -3.379 -10.851 -14.002 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -5.007 -11.418 -13.690 1.00 0.00 H new ATOM 1023 N LYS A 67 -5.572 -9.604 -10.364 1.00 0.00 N ATOM 1024 CA LYS A 67 -6.711 -9.496 -9.434 1.00 0.00 C ATOM 1025 C LYS A 67 -8.051 -9.222 -10.120 1.00 0.00 C ATOM 1026 O LYS A 67 -9.071 -9.081 -9.441 1.00 0.00 O ATOM 1027 CB LYS A 67 -6.472 -8.405 -8.382 1.00 0.00 C ATOM 1028 CG LYS A 67 -5.050 -8.372 -7.803 1.00 0.00 C ATOM 1029 CD LYS A 67 -4.977 -7.471 -6.563 1.00 0.00 C ATOM 1030 CE LYS A 67 -5.251 -5.997 -6.902 1.00 0.00 C ATOM 1031 NZ LYS A 67 -5.573 -5.210 -5.686 1.00 0.00 N ATOM 0 H LYS A 67 -5.019 -8.749 -10.422 1.00 0.00 H new ATOM 0 HA LYS A 67 -6.774 -10.476 -8.962 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -6.690 -7.435 -8.828 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -7.179 -8.546 -7.565 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -4.738 -9.383 -7.540 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -4.354 -8.010 -8.560 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -5.701 -7.813 -5.824 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -3.991 -7.561 -6.108 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -4.378 -5.568 -7.394 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -6.079 -5.933 -7.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -5.586 -4.197 -5.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -6.507 -5.493 -5.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -4.853 -5.387 -4.957 1.00 0.00 H new ATOM 1045 N TYR A 68 -8.045 -9.130 -11.444 1.00 0.00 N ATOM 1046 CA TYR A 68 -9.194 -8.776 -12.264 1.00 0.00 C ATOM 1047 C TYR A 68 -9.459 -9.835 -13.344 1.00 0.00 C ATOM 1048 O TYR A 68 -8.573 -10.595 -13.743 1.00 0.00 O ATOM 1049 CB TYR A 68 -8.924 -7.383 -12.844 1.00 0.00 C ATOM 1050 CG TYR A 68 -8.635 -6.321 -11.793 1.00 0.00 C ATOM 1051 CD1 TYR A 68 -9.701 -5.688 -11.125 1.00 0.00 C ATOM 1052 CD2 TYR A 68 -7.304 -6.004 -11.446 1.00 0.00 C ATOM 1053 CE1 TYR A 68 -9.445 -4.740 -10.114 1.00 0.00 C ATOM 1054 CE2 TYR A 68 -7.043 -5.055 -10.438 1.00 0.00 C ATOM 1055 CZ TYR A 68 -8.111 -4.424 -9.767 1.00 0.00 C ATOM 1056 OH TYR A 68 -7.847 -3.526 -8.778 1.00 0.00 O ATOM 0 H TYR A 68 -7.206 -9.307 -11.996 1.00 0.00 H new ATOM 0 HA TYR A 68 -10.106 -8.748 -11.668 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -8.077 -7.443 -13.528 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -9.787 -7.072 -13.432 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -10.720 -5.930 -11.389 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -6.484 -6.490 -11.954 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -10.266 -4.256 -9.605 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -6.024 -4.810 -10.179 1.00 0.00 H new ATOM 0 HH TYR A 68 -6.877 -3.431 -8.673 1.00 0.00 H new ATOM 1066 N LEU A 69 -10.712 -9.926 -13.790 1.00 0.00 N ATOM 1067 CA LEU A 69 -11.150 -10.933 -14.758 1.00 0.00 C ATOM 1068 C LEU A 69 -10.715 -10.592 -16.188 1.00 0.00 C ATOM 1069 O LEU A 69 -11.229 -9.644 -16.784 1.00 0.00 O ATOM 1070 CB LEU A 69 -12.683 -11.094 -14.678 1.00 0.00 C ATOM 1071 CG LEU A 69 -13.179 -12.157 -13.687 1.00 0.00 C ATOM 1072 CD1 LEU A 69 -12.944 -13.576 -14.204 1.00 0.00 C ATOM 1073 CD2 LEU A 69 -12.538 -12.036 -12.306 1.00 0.00 C ATOM 0 H LEU A 69 -11.457 -9.299 -13.488 1.00 0.00 H new ATOM 0 HA LEU A 69 -10.670 -11.877 -14.501 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -13.119 -10.133 -14.404 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -13.058 -11.343 -15.671 1.00 0.00 H new ATOM 0 HG LEU A 69 -14.249 -11.970 -13.592 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -13.310 -14.295 -13.471 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -13.477 -13.713 -15.145 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.877 -13.733 -14.365 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -12.931 -12.816 -11.653 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -11.457 -12.148 -12.395 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -12.768 -11.058 -11.883 1.00 0.00 H new ATOM 1085 N HIS A 70 -9.817 -11.391 -16.768 1.00 0.00 N ATOM 1086 CA HIS A 70 -9.461 -11.244 -18.184 1.00 0.00 C ATOM 1087 C HIS A 70 -10.732 -11.564 -19.002 1.00 0.00 C ATOM 1088 O HIS A 70 -11.364 -12.597 -18.754 1.00 0.00 O ATOM 1089 CB HIS A 70 -8.265 -12.137 -18.542 1.00 0.00 C ATOM 1090 CG HIS A 70 -6.935 -11.508 -18.189 1.00 0.00 C ATOM 1091 ND1 HIS A 70 -5.753 -11.667 -18.881 1.00 0.00 N ATOM 1092 CD2 HIS A 70 -6.706 -10.559 -17.226 1.00 0.00 C ATOM 1093 CE1 HIS A 70 -4.851 -10.810 -18.366 1.00 0.00 C ATOM 1094 NE2 HIS A 70 -5.394 -10.103 -17.363 1.00 0.00 N ATOM 0 H HIS A 70 -9.325 -12.142 -16.284 1.00 0.00 H new ATOM 0 HA HIS A 70 -9.135 -10.230 -18.415 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -8.360 -13.090 -18.021 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -8.287 -12.354 -19.610 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -5.590 -12.319 -19.648 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -7.419 -10.222 -16.488 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -3.833 -10.706 -18.712 1.00 0.00 H new ATOM 1102 N PRO A 71 -11.167 -10.682 -19.919 1.00 0.00 N ATOM 1103 CA PRO A 71 -12.460 -10.820 -20.587 1.00 0.00 C ATOM 1104 C PRO A 71 -12.509 -11.953 -21.637 1.00 0.00 C ATOM 1105 O PRO A 71 -11.743 -11.923 -22.605 1.00 0.00 O ATOM 1106 CB PRO A 71 -12.714 -9.438 -21.186 1.00 0.00 C ATOM 1107 CG PRO A 71 -11.313 -8.932 -21.514 1.00 0.00 C ATOM 1108 CD PRO A 71 -10.520 -9.436 -20.311 1.00 0.00 C ATOM 0 HA PRO A 71 -13.240 -11.122 -19.888 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -13.339 -9.495 -22.077 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -13.223 -8.782 -20.480 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -10.938 -9.340 -22.453 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -11.279 -7.846 -21.602 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -9.474 -9.600 -20.570 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -10.537 -8.711 -19.497 1.00 0.00 H new ATOM 1116 N PRO A 72 -13.404 -12.951 -21.488 1.00 0.00 N ATOM 1117 CA PRO A 72 -13.550 -14.046 -22.447 1.00 0.00 C ATOM 1118 C PRO A 72 -14.321 -13.608 -23.711 1.00 0.00 C ATOM 1119 O PRO A 72 -15.161 -12.706 -23.626 1.00 0.00 O ATOM 1120 CB PRO A 72 -14.329 -15.124 -21.692 1.00 0.00 C ATOM 1121 CG PRO A 72 -15.204 -14.329 -20.730 1.00 0.00 C ATOM 1122 CD PRO A 72 -14.343 -13.117 -20.386 1.00 0.00 C ATOM 0 HA PRO A 72 -12.580 -14.395 -22.800 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -14.928 -15.733 -22.369 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -13.662 -15.802 -21.160 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -16.145 -14.034 -21.194 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -15.454 -14.909 -19.842 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -14.959 -12.226 -20.263 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -13.814 -13.271 -19.445 1.00 0.00 H new ATOM 1130 N PRO A 73 -14.103 -14.247 -24.880 1.00 0.00 N ATOM 1131 CA PRO A 73 -14.789 -13.921 -26.140 1.00 0.00 C ATOM 1132 C PRO A 73 -16.313 -13.737 -26.043 1.00 0.00 C ATOM 1133 O PRO A 73 -16.861 -12.806 -26.635 1.00 0.00 O ATOM 1134 CB PRO A 73 -14.426 -15.056 -27.104 1.00 0.00 C ATOM 1135 CG PRO A 73 -13.055 -15.509 -26.611 1.00 0.00 C ATOM 1136 CD PRO A 73 -13.151 -15.330 -25.097 1.00 0.00 C ATOM 0 HA PRO A 73 -14.454 -12.940 -26.478 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -15.155 -15.865 -27.065 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -14.388 -14.710 -28.137 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -12.852 -16.545 -26.882 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -12.254 -14.905 -27.038 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -13.488 -16.248 -24.616 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -12.178 -15.086 -24.670 1.00 0.00 H new ATOM 1144 N HIS A 74 -17.002 -14.593 -25.275 1.00 0.00 N ATOM 1145 CA HIS A 74 -18.463 -14.535 -25.080 1.00 0.00 C ATOM 1146 C HIS A 74 -18.961 -13.373 -24.201 1.00 0.00 C ATOM 1147 O HIS A 74 -20.157 -13.081 -24.225 1.00 0.00 O ATOM 1148 CB HIS A 74 -18.969 -15.901 -24.576 1.00 0.00 C ATOM 1149 CG HIS A 74 -18.906 -16.969 -25.643 1.00 0.00 C ATOM 1150 ND1 HIS A 74 -17.957 -17.970 -25.764 1.00 0.00 N ATOM 1151 CD2 HIS A 74 -19.778 -17.100 -26.689 1.00 0.00 C ATOM 1152 CE1 HIS A 74 -18.249 -18.697 -26.862 1.00 0.00 C ATOM 1153 NE2 HIS A 74 -19.355 -18.184 -27.440 1.00 0.00 N ATOM 0 H HIS A 74 -16.557 -15.356 -24.764 1.00 0.00 H new ATOM 0 HA HIS A 74 -18.895 -14.317 -26.057 1.00 0.00 H new ATOM 0 HB2 HIS A 74 -18.372 -16.212 -23.719 1.00 0.00 H new ATOM 0 HB3 HIS A 74 -19.997 -15.799 -24.229 1.00 0.00 H new ATOM 0 HD1 HIS A 74 -17.173 -18.130 -25.132 1.00 0.00 H new ATOM 0 HD2 HIS A 74 -20.635 -16.475 -26.891 1.00 0.00 H new ATOM 0 HE1 HIS A 74 -17.690 -19.549 -27.219 1.00 0.00 H new ATOM 1162 N LEU A 75 -18.078 -12.686 -23.464 1.00 0.00 N ATOM 1163 CA LEU A 75 -18.419 -11.524 -22.624 1.00 0.00 C ATOM 1164 C LEU A 75 -17.782 -10.217 -23.122 1.00 0.00 C ATOM 1165 O LEU A 75 -18.274 -9.148 -22.768 1.00 0.00 O ATOM 1166 CB LEU A 75 -18.082 -11.797 -21.146 1.00 0.00 C ATOM 1167 CG LEU A 75 -18.815 -13.003 -20.520 1.00 0.00 C ATOM 1168 CD1 LEU A 75 -18.371 -13.234 -19.074 1.00 0.00 C ATOM 1169 CD2 LEU A 75 -20.331 -12.794 -20.515 1.00 0.00 C ATOM 0 H LEU A 75 -17.087 -12.925 -23.433 1.00 0.00 H new ATOM 0 HA LEU A 75 -19.496 -11.380 -22.706 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -17.008 -11.959 -21.058 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -18.319 -10.906 -20.565 1.00 0.00 H new ATOM 0 HG LEU A 75 -18.560 -13.868 -21.132 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -18.905 -14.090 -18.662 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -17.299 -13.429 -19.049 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -18.592 -12.348 -18.479 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -20.816 -13.661 -20.068 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -20.574 -11.903 -19.935 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -20.684 -12.668 -21.538 1.00 0.00 H new ATOM 1181 N LYS A 76 -16.753 -10.259 -23.984 1.00 0.00 N ATOM 1182 CA LYS A 76 -16.155 -9.053 -24.594 1.00 0.00 C ATOM 1183 C LYS A 76 -17.205 -8.196 -25.312 1.00 0.00 C ATOM 1184 O LYS A 76 -17.169 -6.974 -25.187 1.00 0.00 O ATOM 1185 CB LYS A 76 -15.005 -9.435 -25.543 1.00 0.00 C ATOM 1186 CG LYS A 76 -13.719 -9.723 -24.754 1.00 0.00 C ATOM 1187 CD LYS A 76 -12.577 -10.278 -25.616 1.00 0.00 C ATOM 1188 CE LYS A 76 -12.118 -9.282 -26.691 1.00 0.00 C ATOM 1189 NZ LYS A 76 -10.966 -9.809 -27.471 1.00 0.00 N ATOM 0 H LYS A 76 -16.310 -11.129 -24.280 1.00 0.00 H new ATOM 0 HA LYS A 76 -15.744 -8.446 -23.787 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -15.284 -10.313 -26.125 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -14.829 -8.626 -26.252 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -13.385 -8.804 -24.273 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -13.942 -10.436 -23.960 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -11.732 -10.532 -24.976 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -12.903 -11.201 -26.095 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -12.947 -9.067 -27.366 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -11.838 -8.340 -26.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -10.683 -9.110 -28.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -10.167 -9.991 -26.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -11.241 -10.695 -27.941 1.00 0.00 H new ATOM 1203 N THR A 77 -18.170 -8.821 -25.999 1.00 0.00 N ATOM 1204 CA THR A 77 -19.280 -8.120 -26.677 1.00 0.00 C ATOM 1205 C THR A 77 -20.168 -7.368 -25.683 1.00 0.00 C ATOM 1206 O THR A 77 -20.605 -6.250 -25.952 1.00 0.00 O ATOM 1207 CB THR A 77 -20.175 -9.098 -27.459 1.00 0.00 C ATOM 1208 OG1 THR A 77 -19.390 -10.044 -28.157 1.00 0.00 O ATOM 1209 CG2 THR A 77 -21.047 -8.374 -28.483 1.00 0.00 C ATOM 0 H THR A 77 -18.207 -9.835 -26.104 1.00 0.00 H new ATOM 0 HA THR A 77 -18.811 -7.414 -27.362 1.00 0.00 H new ATOM 0 HB THR A 77 -20.810 -9.592 -26.723 1.00 0.00 H new ATOM 0 HG1 THR A 77 -19.976 -10.658 -28.647 1.00 0.00 H new ATOM 0 HG21 THR A 77 -21.664 -9.100 -29.014 1.00 0.00 H new ATOM 0 HG22 THR A 77 -21.689 -7.657 -27.972 1.00 0.00 H new ATOM 0 HG23 THR A 77 -20.411 -7.848 -29.195 1.00 0.00 H new ATOM 1217 N GLN A 78 -20.414 -7.958 -24.508 1.00 0.00 N ATOM 1218 CA GLN A 78 -21.203 -7.332 -23.448 1.00 0.00 C ATOM 1219 C GLN A 78 -20.420 -6.158 -22.844 1.00 0.00 C ATOM 1220 O GLN A 78 -20.942 -5.048 -22.765 1.00 0.00 O ATOM 1221 CB GLN A 78 -21.573 -8.376 -22.375 1.00 0.00 C ATOM 1222 CG GLN A 78 -22.440 -9.535 -22.902 1.00 0.00 C ATOM 1223 CD GLN A 78 -23.773 -9.089 -23.507 1.00 0.00 C ATOM 1224 OE1 GLN A 78 -24.432 -8.164 -23.049 1.00 0.00 O ATOM 1225 NE2 GLN A 78 -24.228 -9.725 -24.568 1.00 0.00 N ATOM 0 H GLN A 78 -20.069 -8.887 -24.267 1.00 0.00 H new ATOM 0 HA GLN A 78 -22.131 -6.942 -23.866 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -20.657 -8.785 -21.950 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -22.105 -7.877 -21.565 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -21.876 -10.084 -23.656 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -22.637 -10.228 -22.085 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -23.696 -10.498 -24.966 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -25.113 -9.444 -24.991 1.00 0.00 H new ATOM 1234 N LEU A 79 -19.150 -6.378 -22.477 1.00 0.00 N ATOM 1235 CA LEU A 79 -18.268 -5.353 -21.911 1.00 0.00 C ATOM 1236 C LEU A 79 -18.080 -4.144 -22.837 1.00 0.00 C ATOM 1237 O LEU A 79 -18.213 -3.014 -22.372 1.00 0.00 O ATOM 1238 CB LEU A 79 -16.911 -5.975 -21.537 1.00 0.00 C ATOM 1239 CG LEU A 79 -16.984 -6.985 -20.380 1.00 0.00 C ATOM 1240 CD1 LEU A 79 -15.640 -7.691 -20.240 1.00 0.00 C ATOM 1241 CD2 LEU A 79 -17.314 -6.309 -19.047 1.00 0.00 C ATOM 0 H LEU A 79 -18.701 -7.289 -22.567 1.00 0.00 H new ATOM 0 HA LEU A 79 -18.753 -4.973 -21.012 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -16.497 -6.472 -22.414 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -16.219 -5.177 -21.266 1.00 0.00 H new ATOM 0 HG LEU A 79 -17.779 -7.693 -20.614 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -15.689 -8.408 -19.420 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -15.406 -8.215 -21.167 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -14.863 -6.956 -20.033 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -17.355 -7.060 -18.258 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -16.543 -5.576 -18.810 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -18.279 -5.808 -19.122 1.00 0.00 H new ATOM 1253 N GLU A 80 -17.804 -4.332 -24.133 1.00 0.00 N ATOM 1254 CA GLU A 80 -17.645 -3.189 -25.052 1.00 0.00 C ATOM 1255 C GLU A 80 -18.937 -2.360 -25.189 1.00 0.00 C ATOM 1256 O GLU A 80 -18.873 -1.138 -25.328 1.00 0.00 O ATOM 1257 CB GLU A 80 -17.071 -3.612 -26.417 1.00 0.00 C ATOM 1258 CG GLU A 80 -18.043 -4.355 -27.340 1.00 0.00 C ATOM 1259 CD GLU A 80 -17.377 -4.698 -28.685 1.00 0.00 C ATOM 1260 OE1 GLU A 80 -16.825 -5.815 -28.834 1.00 0.00 O ATOM 1261 OE2 GLU A 80 -17.407 -3.851 -29.611 1.00 0.00 O ATOM 0 H GLU A 80 -17.687 -5.247 -24.568 1.00 0.00 H new ATOM 0 HA GLU A 80 -16.906 -2.529 -24.598 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -16.716 -2.721 -26.934 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -16.203 -4.248 -26.245 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -18.382 -5.270 -26.855 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -18.926 -3.740 -27.514 1.00 0.00 H new ATOM 1268 N ILE A 81 -20.110 -3.004 -25.090 1.00 0.00 N ATOM 1269 CA ILE A 81 -21.418 -2.332 -25.111 1.00 0.00 C ATOM 1270 C ILE A 81 -21.673 -1.623 -23.774 1.00 0.00 C ATOM 1271 O ILE A 81 -22.098 -0.470 -23.778 1.00 0.00 O ATOM 1272 CB ILE A 81 -22.536 -3.325 -25.507 1.00 0.00 C ATOM 1273 CG1 ILE A 81 -22.374 -3.626 -27.014 1.00 0.00 C ATOM 1274 CG2 ILE A 81 -23.943 -2.767 -25.207 1.00 0.00 C ATOM 1275 CD1 ILE A 81 -23.360 -4.658 -27.562 1.00 0.00 C ATOM 0 H ILE A 81 -20.178 -4.017 -24.992 1.00 0.00 H new ATOM 0 HA ILE A 81 -21.419 -1.557 -25.877 1.00 0.00 H new ATOM 0 HB ILE A 81 -22.441 -4.236 -24.916 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -22.492 -2.697 -27.572 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -21.359 -3.980 -27.194 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -24.695 -3.499 -25.502 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -24.034 -2.563 -24.140 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -24.096 -1.844 -25.767 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -23.176 -4.808 -28.626 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -23.229 -5.602 -27.034 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -24.379 -4.300 -27.418 1.00 0.00 H new ATOM 1287 N ASN A 82 -21.361 -2.245 -22.630 1.00 0.00 N ATOM 1288 CA ASN A 82 -21.471 -1.588 -21.321 1.00 0.00 C ATOM 1289 C ASN A 82 -20.552 -0.350 -21.261 1.00 0.00 C ATOM 1290 O ASN A 82 -20.935 0.676 -20.699 1.00 0.00 O ATOM 1291 CB ASN A 82 -21.161 -2.584 -20.183 1.00 0.00 C ATOM 1292 CG ASN A 82 -22.205 -3.675 -19.983 1.00 0.00 C ATOM 1293 OD1 ASN A 82 -21.906 -4.859 -19.933 1.00 0.00 O ATOM 1294 ND2 ASN A 82 -23.461 -3.322 -19.809 1.00 0.00 N ATOM 0 H ASN A 82 -21.028 -3.208 -22.585 1.00 0.00 H new ATOM 0 HA ASN A 82 -22.497 -1.246 -21.185 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -20.199 -3.055 -20.384 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -21.055 -2.028 -19.252 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -24.171 -4.033 -19.635 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -23.724 -2.337 -19.848 1.00 0.00 H new ATOM 1301 N GLY A 83 -19.370 -0.415 -21.888 1.00 0.00 N ATOM 1302 CA GLY A 83 -18.407 0.688 -21.994 1.00 0.00 C ATOM 1303 C GLY A 83 -18.987 1.951 -22.645 1.00 0.00 C ATOM 1304 O GLY A 83 -18.562 3.057 -22.313 1.00 0.00 O ATOM 0 H GLY A 83 -19.048 -1.265 -22.350 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -18.043 0.938 -20.998 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -17.547 0.353 -22.573 1.00 0.00 H new ATOM 1308 N ARG A 84 -20.006 1.819 -23.512 1.00 0.00 N ATOM 1309 CA ARG A 84 -20.721 2.948 -24.145 1.00 0.00 C ATOM 1310 C ARG A 84 -21.390 3.865 -23.107 1.00 0.00 C ATOM 1311 O ARG A 84 -21.516 5.065 -23.344 1.00 0.00 O ATOM 1312 CB ARG A 84 -21.736 2.429 -25.187 1.00 0.00 C ATOM 1313 CG ARG A 84 -21.057 1.644 -26.321 1.00 0.00 C ATOM 1314 CD ARG A 84 -22.087 1.070 -27.299 1.00 0.00 C ATOM 1315 NE ARG A 84 -21.436 0.224 -28.319 1.00 0.00 N ATOM 1316 CZ ARG A 84 -22.028 -0.412 -29.315 1.00 0.00 C ATOM 1317 NH1 ARG A 84 -23.315 -0.349 -29.510 1.00 0.00 N ATOM 1318 NH2 ARG A 84 -21.330 -1.137 -30.140 1.00 0.00 N ATOM 0 H ARG A 84 -20.365 0.909 -23.800 1.00 0.00 H new ATOM 0 HA ARG A 84 -19.983 3.559 -24.665 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -22.467 1.789 -24.692 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -22.284 3.272 -25.609 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -20.369 2.298 -26.857 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -20.463 0.834 -25.899 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -22.825 0.483 -26.752 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -22.624 1.884 -27.786 1.00 0.00 H new ATOM 0 HE ARG A 84 -20.424 0.119 -28.248 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -23.899 0.204 -28.883 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -23.738 -0.853 -30.289 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -20.320 -1.217 -30.020 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -21.793 -1.625 -30.907 1.00 0.00 H new ATOM 1332 N ASN A 85 -21.748 3.328 -21.934 1.00 0.00 N ATOM 1333 CA ASN A 85 -22.316 4.067 -20.796 1.00 0.00 C ATOM 1334 C ASN A 85 -21.240 4.807 -19.954 1.00 0.00 C ATOM 1335 O ASN A 85 -21.567 5.492 -18.983 1.00 0.00 O ATOM 1336 CB ASN A 85 -23.140 3.070 -19.954 1.00 0.00 C ATOM 1337 CG ASN A 85 -24.079 3.747 -18.968 1.00 0.00 C ATOM 1338 OD1 ASN A 85 -23.845 3.788 -17.768 1.00 0.00 O ATOM 1339 ND2 ASN A 85 -25.177 4.298 -19.434 1.00 0.00 N ATOM 0 H ASN A 85 -21.647 2.331 -21.743 1.00 0.00 H new ATOM 0 HA ASN A 85 -22.961 4.863 -21.168 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -23.722 2.435 -20.622 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -22.459 2.418 -19.407 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -25.828 4.756 -18.796 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -25.378 4.268 -20.433 1.00 0.00 H new ATOM 1346 N ASN A 86 -19.955 4.677 -20.308 1.00 0.00 N ATOM 1347 CA ASN A 86 -18.803 5.298 -19.637 1.00 0.00 C ATOM 1348 C ASN A 86 -17.849 6.013 -20.627 1.00 0.00 C ATOM 1349 O ASN A 86 -16.769 6.462 -20.245 1.00 0.00 O ATOM 1350 CB ASN A 86 -18.093 4.202 -18.817 1.00 0.00 C ATOM 1351 CG ASN A 86 -17.083 4.774 -17.828 1.00 0.00 C ATOM 1352 OD1 ASN A 86 -17.426 5.538 -16.937 1.00 0.00 O ATOM 1353 ND2 ASN A 86 -15.827 4.414 -17.946 1.00 0.00 N ATOM 0 H ASN A 86 -19.676 4.109 -21.108 1.00 0.00 H new ATOM 0 HA ASN A 86 -19.148 6.090 -18.973 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -18.837 3.619 -18.275 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -17.584 3.517 -19.496 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -15.130 4.772 -17.292 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -15.547 3.776 -18.691 1.00 0.00 H new ATOM 1360 N LEU A 87 -18.235 6.144 -21.903 1.00 0.00 N ATOM 1361 CA LEU A 87 -17.460 6.769 -22.991 1.00 0.00 C ATOM 1362 C LEU A 87 -17.446 8.320 -22.926 1.00 0.00 C ATOM 1363 O LEU A 87 -17.514 9.012 -23.943 1.00 0.00 O ATOM 1364 CB LEU A 87 -17.991 6.188 -24.322 1.00 0.00 C ATOM 1365 CG LEU A 87 -17.074 6.340 -25.555 1.00 0.00 C ATOM 1366 CD1 LEU A 87 -15.697 5.699 -25.355 1.00 0.00 C ATOM 1367 CD2 LEU A 87 -17.738 5.658 -26.754 1.00 0.00 C ATOM 0 H LEU A 87 -19.140 5.801 -22.224 1.00 0.00 H new ATOM 0 HA LEU A 87 -16.403 6.524 -22.891 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -18.192 5.127 -24.175 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -18.945 6.665 -24.546 1.00 0.00 H new ATOM 0 HG LEU A 87 -16.931 7.408 -25.717 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -15.097 5.838 -26.254 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -15.196 6.169 -24.509 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -15.817 4.633 -25.159 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -17.098 5.760 -27.631 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -17.888 4.601 -26.534 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -18.702 6.127 -26.952 1.00 0.00 H new ATOM 1379 N ILE A 88 -17.376 8.879 -21.714 1.00 0.00 N ATOM 1380 CA ILE A 88 -17.355 10.328 -21.424 1.00 0.00 C ATOM 1381 C ILE A 88 -15.985 10.998 -21.676 1.00 0.00 C ATOM 1382 O ILE A 88 -15.856 12.215 -21.536 1.00 0.00 O ATOM 1383 CB ILE A 88 -17.861 10.599 -19.986 1.00 0.00 C ATOM 1384 CG1 ILE A 88 -17.008 9.890 -18.907 1.00 0.00 C ATOM 1385 CG2 ILE A 88 -19.345 10.200 -19.876 1.00 0.00 C ATOM 1386 CD1 ILE A 88 -17.312 10.355 -17.478 1.00 0.00 C ATOM 0 H ILE A 88 -17.330 8.314 -20.866 1.00 0.00 H new ATOM 0 HA ILE A 88 -18.037 10.793 -22.136 1.00 0.00 H new ATOM 0 HB ILE A 88 -17.759 11.667 -19.794 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -17.175 8.815 -18.973 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -15.953 10.063 -19.119 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -19.699 10.392 -18.863 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -19.933 10.786 -20.583 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -19.455 9.140 -20.104 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -16.676 9.815 -16.777 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -17.118 11.424 -17.394 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -18.358 10.157 -17.246 1.00 0.00 H new ATOM 1398 N GLN A 89 -14.967 10.219 -22.062 1.00 0.00 N ATOM 1399 CA GLN A 89 -13.598 10.657 -22.378 1.00 0.00 C ATOM 1400 C GLN A 89 -13.060 9.930 -23.628 1.00 0.00 C ATOM 1401 O GLN A 89 -13.625 8.926 -24.072 1.00 0.00 O ATOM 1402 CB GLN A 89 -12.672 10.406 -21.169 1.00 0.00 C ATOM 1403 CG GLN A 89 -12.965 11.334 -19.976 1.00 0.00 C ATOM 1404 CD GLN A 89 -11.998 11.152 -18.802 1.00 0.00 C ATOM 1405 OE1 GLN A 89 -11.176 10.246 -18.742 1.00 0.00 O ATOM 1406 NE2 GLN A 89 -12.057 12.017 -17.810 1.00 0.00 N ATOM 0 H GLN A 89 -15.080 9.211 -22.169 1.00 0.00 H new ATOM 0 HA GLN A 89 -13.619 11.725 -22.593 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -12.777 9.369 -20.849 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -11.636 10.540 -21.479 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -12.922 12.370 -20.313 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -13.982 11.154 -19.628 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -12.734 12.780 -17.838 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -11.426 11.924 -17.014 1.00 0.00 H new ATOM 1415 N GLN A 90 -11.965 10.444 -24.200 1.00 0.00 N ATOM 1416 CA GLN A 90 -11.307 9.903 -25.401 1.00 0.00 C ATOM 1417 C GLN A 90 -10.917 8.412 -25.285 1.00 0.00 C ATOM 1418 O GLN A 90 -10.461 7.948 -24.237 1.00 0.00 O ATOM 1419 CB GLN A 90 -10.099 10.789 -25.778 1.00 0.00 C ATOM 1420 CG GLN A 90 -8.999 10.891 -24.702 1.00 0.00 C ATOM 1421 CD GLN A 90 -7.856 11.816 -25.126 1.00 0.00 C ATOM 1422 OE1 GLN A 90 -6.801 11.388 -25.576 1.00 0.00 O ATOM 1423 NE2 GLN A 90 -8.010 13.118 -25.002 1.00 0.00 N ATOM 0 H GLN A 90 -11.497 11.272 -23.831 1.00 0.00 H new ATOM 0 HA GLN A 90 -12.040 9.933 -26.208 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -9.654 10.399 -26.694 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -10.461 11.793 -26.002 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -9.435 11.258 -23.773 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -8.602 9.897 -24.496 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -8.881 13.495 -24.629 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -7.258 13.749 -25.279 1.00 0.00 H new ATOM 1432 N LYS A 91 -11.063 7.663 -26.391 1.00 0.00 N ATOM 1433 CA LYS A 91 -10.733 6.222 -26.506 1.00 0.00 C ATOM 1434 C LYS A 91 -9.228 5.894 -26.573 1.00 0.00 C ATOM 1435 O LYS A 91 -8.855 4.723 -26.626 1.00 0.00 O ATOM 1436 CB LYS A 91 -11.539 5.597 -27.668 1.00 0.00 C ATOM 1437 CG LYS A 91 -11.400 6.234 -29.069 1.00 0.00 C ATOM 1438 CD LYS A 91 -10.028 6.117 -29.760 1.00 0.00 C ATOM 1439 CE LYS A 91 -9.519 4.676 -29.942 1.00 0.00 C ATOM 1440 NZ LYS A 91 -10.344 3.901 -30.907 1.00 0.00 N ATOM 0 H LYS A 91 -11.426 8.052 -27.262 1.00 0.00 H new ATOM 0 HA LYS A 91 -11.037 5.758 -25.568 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -11.253 4.548 -27.748 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -12.594 5.619 -27.394 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -12.147 5.782 -29.722 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -11.648 7.292 -28.986 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -10.088 6.593 -30.739 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -9.295 6.676 -29.178 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -8.486 4.700 -30.288 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -9.520 4.168 -28.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -9.962 2.938 -30.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -11.325 3.854 -30.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -10.323 4.369 -31.836 1.00 0.00 H new ATOM 1454 N ASN A 92 -8.375 6.921 -26.581 1.00 0.00 N ATOM 1455 CA ASN A 92 -6.908 6.878 -26.656 1.00 0.00 C ATOM 1456 C ASN A 92 -6.245 5.836 -25.728 1.00 0.00 C ATOM 1457 O ASN A 92 -6.682 5.610 -24.589 1.00 0.00 O ATOM 1458 CB ASN A 92 -6.417 8.311 -26.375 1.00 0.00 C ATOM 1459 CG ASN A 92 -4.921 8.530 -26.530 1.00 0.00 C ATOM 1460 OD1 ASN A 92 -4.148 7.640 -26.860 1.00 0.00 O ATOM 1461 ND2 ASN A 92 -4.476 9.741 -26.291 1.00 0.00 N ATOM 0 H ASN A 92 -8.716 7.881 -26.531 1.00 0.00 H new ATOM 0 HA ASN A 92 -6.610 6.539 -27.648 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -6.938 8.994 -27.046 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -6.703 8.582 -25.359 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -3.481 9.945 -26.380 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -5.125 10.478 -26.016 1.00 0.00 H new TER 1468 ASN A 92 HETATM 1469 ZN ZN A 101 -20.750 -20.627 -15.163 1.00 0.00 ZN HETATM 1470 ZN ZN A 102 -4.900 -8.505 -16.156 1.00 0.00 ZN