USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 738 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 30 HIS HD1 : A 30 HIS ND1 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 91 HIS HD1 : A 91 HIS ND1 : A 601 ZNZN :(H bumps) USER MOD Single : A 1 GLY N :NH3+ 139:sc= 0.0136 (180deg=0) USER MOD Single : A 2 SER OG : rot -56:sc= 0.209 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 166:sc=-0.00669 (180deg=-0.132) USER MOD Single : A 23 HIS : no HE2:sc= -1.91 K(o=-1.9,f=-0.79) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc=-0.00367 X(o=-0.0037,f=-0.18) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HE2:sc= -2.24 K(o=-2.2,f=-2.7!) USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc=-0.000141 X(o=-0.00014,f=0) USER MOD Single : A 54 LYS NZ :NH3+ 164:sc=-0.00824 (180deg=-0.118) USER MOD Single : A 58 ASN : amide:sc= -0.12 K(o=-0.12,f=-1.9!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 THR OG1 : rot -29:sc= -0.011 USER MOD Single : A 62 THR OG1 : rot 64:sc= 0.546 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0134) USER MOD Single : A 74 LYS NZ :NH3+ -144:sc= -0.915 (180deg=-2.66!) USER MOD Single : A 81 GLN : amide:sc= -0.645 K(o=-0.64,f=-4.5!) USER MOD Single : A 82 ASN : amide:sc= -1.98 K(o=-2,f=-0.15) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 36:sc= 0.0817 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.855 24.080 -12.309 1.00 0.00 N ATOM 2 CA GLY A 1 -16.564 23.786 -11.715 1.00 0.00 C ATOM 3 C GLY A 1 -15.410 24.315 -12.543 1.00 0.00 C ATOM 4 O GLY A 1 -15.453 24.282 -13.773 1.00 0.00 O ATOM 0 H1 GLY A 1 -18.478 23.253 -12.212 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.283 24.895 -11.825 1.00 0.00 H new ATOM 0 H3 GLY A 1 -17.731 24.303 -13.317 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -16.520 24.221 -10.716 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -16.459 22.707 -11.598 1.00 0.00 H new ATOM 8 N SER A 2 -14.376 24.807 -11.868 1.00 0.00 N ATOM 9 CA SER A 2 -13.208 25.352 -12.550 1.00 0.00 C ATOM 10 C SER A 2 -12.228 24.242 -12.919 1.00 0.00 C ATOM 11 O SER A 2 -11.030 24.344 -12.657 1.00 0.00 O ATOM 12 CB SER A 2 -12.512 26.388 -11.665 1.00 0.00 C ATOM 13 OG SER A 2 -11.532 27.106 -12.395 1.00 0.00 O ATOM 0 H SER A 2 -14.323 24.839 -10.850 1.00 0.00 H new ATOM 0 HA SER A 2 -13.546 25.835 -13.467 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.250 27.081 -11.262 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.045 25.890 -10.815 1.00 0.00 H new ATOM 0 HG SER A 2 -10.893 26.477 -12.790 1.00 0.00 H new ATOM 19 N SER A 3 -12.748 23.181 -13.529 1.00 0.00 N ATOM 20 CA SER A 3 -11.921 22.049 -13.931 1.00 0.00 C ATOM 21 C SER A 3 -11.061 22.408 -15.139 1.00 0.00 C ATOM 22 O SER A 3 -11.535 23.025 -16.092 1.00 0.00 O ATOM 23 CB SER A 3 -12.799 20.840 -14.256 1.00 0.00 C ATOM 24 OG SER A 3 -13.133 20.121 -13.082 1.00 0.00 O ATOM 0 H SER A 3 -13.738 23.082 -13.755 1.00 0.00 H new ATOM 0 HA SER A 3 -11.262 21.797 -13.100 1.00 0.00 H new ATOM 0 HB2 SER A 3 -13.710 21.172 -14.754 1.00 0.00 H new ATOM 0 HB3 SER A 3 -12.276 20.184 -14.952 1.00 0.00 H new ATOM 0 HG SER A 3 -13.696 19.354 -13.317 1.00 0.00 H new ATOM 30 N GLY A 4 -9.792 22.015 -15.092 1.00 0.00 N ATOM 31 CA GLY A 4 -8.884 22.303 -16.187 1.00 0.00 C ATOM 32 C GLY A 4 -7.448 21.948 -15.858 1.00 0.00 C ATOM 33 O GLY A 4 -6.839 21.112 -16.525 1.00 0.00 O ATOM 0 H GLY A 4 -9.376 21.502 -14.315 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.199 21.749 -17.071 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.945 23.362 -16.437 1.00 0.00 H new ATOM 37 N SER A 5 -6.903 22.588 -14.828 1.00 0.00 N ATOM 38 CA SER A 5 -5.527 22.340 -14.415 1.00 0.00 C ATOM 39 C SER A 5 -5.252 20.843 -14.312 1.00 0.00 C ATOM 40 O SER A 5 -6.176 20.038 -14.193 1.00 0.00 O ATOM 41 CB SER A 5 -5.245 23.015 -13.072 1.00 0.00 C ATOM 42 OG SER A 5 -5.814 22.280 -12.002 1.00 0.00 O ATOM 0 H SER A 5 -7.394 23.282 -14.264 1.00 0.00 H new ATOM 0 HA SER A 5 -4.866 22.762 -15.171 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.169 23.103 -12.925 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.650 24.027 -13.078 1.00 0.00 H new ATOM 0 HG SER A 5 -5.618 22.731 -11.154 1.00 0.00 H new ATOM 48 N SER A 6 -3.975 20.477 -14.358 1.00 0.00 N ATOM 49 CA SER A 6 -3.577 19.077 -14.273 1.00 0.00 C ATOM 50 C SER A 6 -3.855 18.516 -12.882 1.00 0.00 C ATOM 51 O SER A 6 -3.173 18.855 -11.916 1.00 0.00 O ATOM 52 CB SER A 6 -2.092 18.926 -14.609 1.00 0.00 C ATOM 53 OG SER A 6 -1.783 19.543 -15.847 1.00 0.00 O ATOM 0 H SER A 6 -3.198 21.131 -14.454 1.00 0.00 H new ATOM 0 HA SER A 6 -4.165 18.513 -14.997 1.00 0.00 H new ATOM 0 HB2 SER A 6 -1.490 19.371 -13.817 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.831 17.868 -14.651 1.00 0.00 H new ATOM 0 HG SER A 6 -0.828 19.434 -16.038 1.00 0.00 H new ATOM 59 N GLY A 7 -4.863 17.654 -12.789 1.00 0.00 N ATOM 60 CA GLY A 7 -5.215 17.059 -11.513 1.00 0.00 C ATOM 61 C GLY A 7 -4.895 15.579 -11.455 1.00 0.00 C ATOM 62 O GLY A 7 -4.451 14.993 -12.443 1.00 0.00 O ATOM 0 H GLY A 7 -5.442 17.357 -13.575 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.680 17.575 -10.715 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.279 17.205 -11.329 1.00 0.00 H new ATOM 66 N CYS A 8 -5.119 14.971 -10.295 1.00 0.00 N ATOM 67 CA CYS A 8 -4.850 13.550 -10.110 1.00 0.00 C ATOM 68 C CYS A 8 -6.009 12.705 -10.629 1.00 0.00 C ATOM 69 O CYS A 8 -7.169 13.111 -10.557 1.00 0.00 O ATOM 70 CB CYS A 8 -4.603 13.245 -8.632 1.00 0.00 C ATOM 71 SG CYS A 8 -3.800 11.638 -8.329 1.00 0.00 S ATOM 0 H CYS A 8 -5.487 15.441 -9.468 1.00 0.00 H new ATOM 0 HA CYS A 8 -3.956 13.297 -10.680 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -3.983 14.035 -8.208 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -5.556 13.269 -8.103 1.00 0.00 H new ATOM 76 N VAL A 9 -5.687 11.527 -11.153 1.00 0.00 N ATOM 77 CA VAL A 9 -6.701 10.623 -11.684 1.00 0.00 C ATOM 78 C VAL A 9 -7.100 9.577 -10.649 1.00 0.00 C ATOM 79 O VAL A 9 -7.996 8.767 -10.885 1.00 0.00 O ATOM 80 CB VAL A 9 -6.206 9.909 -12.955 1.00 0.00 C ATOM 81 CG1 VAL A 9 -4.729 9.568 -12.836 1.00 0.00 C ATOM 82 CG2 VAL A 9 -7.031 8.658 -13.218 1.00 0.00 C ATOM 0 H VAL A 9 -4.732 11.176 -11.221 1.00 0.00 H new ATOM 0 HA VAL A 9 -7.569 11.233 -11.934 1.00 0.00 H new ATOM 0 HB VAL A 9 -6.331 10.584 -13.802 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -4.398 9.064 -13.744 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -4.154 10.484 -12.699 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -4.575 8.911 -11.980 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -6.668 8.166 -14.120 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -6.940 7.978 -12.371 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -8.077 8.933 -13.351 1.00 0.00 H new ATOM 92 N GLU A 10 -6.428 9.601 -9.502 1.00 0.00 N ATOM 93 CA GLU A 10 -6.713 8.653 -8.431 1.00 0.00 C ATOM 94 C GLU A 10 -7.668 9.260 -7.407 1.00 0.00 C ATOM 95 O GLU A 10 -8.734 8.709 -7.132 1.00 0.00 O ATOM 96 CB GLU A 10 -5.416 8.223 -7.742 1.00 0.00 C ATOM 97 CG GLU A 10 -5.451 6.798 -7.215 1.00 0.00 C ATOM 98 CD GLU A 10 -6.026 6.708 -5.815 1.00 0.00 C ATOM 99 OE1 GLU A 10 -7.122 7.261 -5.587 1.00 0.00 O ATOM 100 OE2 GLU A 10 -5.380 6.083 -4.948 1.00 0.00 O ATOM 0 H GLU A 10 -5.684 10.266 -9.291 1.00 0.00 H new ATOM 0 HA GLU A 10 -7.189 7.778 -8.873 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.590 8.321 -8.447 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -5.211 8.903 -6.915 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -6.045 6.180 -7.888 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.440 6.389 -7.216 1.00 0.00 H new ATOM 107 N CYS A 11 -7.277 10.399 -6.845 1.00 0.00 N ATOM 108 CA CYS A 11 -8.095 11.082 -5.850 1.00 0.00 C ATOM 109 C CYS A 11 -8.863 12.241 -6.480 1.00 0.00 C ATOM 110 O CYS A 11 -9.523 13.013 -5.785 1.00 0.00 O ATOM 111 CB CYS A 11 -7.221 11.598 -4.706 1.00 0.00 C ATOM 112 SG CYS A 11 -5.779 12.569 -5.251 1.00 0.00 S ATOM 0 H CYS A 11 -6.398 10.869 -7.062 1.00 0.00 H new ATOM 0 HA CYS A 11 -8.814 10.365 -5.454 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -7.832 12.214 -4.046 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -6.873 10.749 -4.118 1.00 0.00 H new ATOM 117 N ARG A 12 -8.771 12.355 -7.801 1.00 0.00 N ATOM 118 CA ARG A 12 -9.456 13.419 -8.526 1.00 0.00 C ATOM 119 C ARG A 12 -9.220 14.770 -7.857 1.00 0.00 C ATOM 120 O ARG A 12 -10.040 15.682 -7.968 1.00 0.00 O ATOM 121 CB ARG A 12 -10.956 13.130 -8.602 1.00 0.00 C ATOM 122 CG ARG A 12 -11.342 12.214 -9.751 1.00 0.00 C ATOM 123 CD ARG A 12 -11.191 12.910 -11.094 1.00 0.00 C ATOM 124 NE ARG A 12 -10.998 11.959 -12.185 1.00 0.00 N ATOM 125 CZ ARG A 12 -11.104 12.282 -13.469 1.00 0.00 C ATOM 126 NH1 ARG A 12 -11.399 13.525 -13.821 1.00 0.00 N ATOM 127 NH2 ARG A 12 -10.914 11.360 -14.405 1.00 0.00 N ATOM 0 H ARG A 12 -8.229 11.724 -8.391 1.00 0.00 H new ATOM 0 HA ARG A 12 -9.049 13.457 -9.537 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -11.278 12.678 -7.664 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -11.494 14.072 -8.703 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -10.718 11.321 -9.731 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -12.373 11.885 -9.625 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -12.077 13.513 -11.291 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -10.343 13.593 -11.055 1.00 0.00 H new ATOM 0 HE ARG A 12 -10.769 10.994 -11.948 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -11.545 14.237 -13.105 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -11.480 13.770 -14.808 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -10.686 10.402 -14.139 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -10.996 11.609 -15.391 1.00 0.00 H new ATOM 141 N LYS A 13 -8.095 14.892 -7.161 1.00 0.00 N ATOM 142 CA LYS A 13 -7.750 16.131 -6.474 1.00 0.00 C ATOM 143 C LYS A 13 -6.703 16.915 -7.260 1.00 0.00 C ATOM 144 O LYS A 13 -5.959 16.364 -8.071 1.00 0.00 O ATOM 145 CB LYS A 13 -7.228 15.830 -5.068 1.00 0.00 C ATOM 146 CG LYS A 13 -8.319 15.444 -4.084 1.00 0.00 C ATOM 147 CD LYS A 13 -8.941 16.668 -3.433 1.00 0.00 C ATOM 148 CE LYS A 13 -10.307 16.352 -2.844 1.00 0.00 C ATOM 149 NZ LYS A 13 -10.203 15.820 -1.457 1.00 0.00 N ATOM 0 H LYS A 13 -7.406 14.147 -7.058 1.00 0.00 H new ATOM 0 HA LYS A 13 -8.652 16.739 -6.398 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -6.499 15.021 -5.125 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -6.702 16.707 -4.689 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -9.091 14.874 -4.601 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -7.903 14.793 -3.315 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -8.282 17.038 -2.648 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -9.037 17.465 -4.171 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -10.919 17.254 -2.842 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -10.815 15.623 -3.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -11.155 15.617 -1.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -9.640 14.946 -1.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -9.741 16.526 -0.848 1.00 0.00 H new ATOM 163 N PRO A 14 -6.641 18.232 -7.013 1.00 0.00 N ATOM 164 CA PRO A 14 -5.687 19.119 -7.686 1.00 0.00 C ATOM 165 C PRO A 14 -4.250 18.869 -7.242 1.00 0.00 C ATOM 166 O PRO A 14 -3.980 18.693 -6.053 1.00 0.00 O ATOM 167 CB PRO A 14 -6.143 20.517 -7.261 1.00 0.00 C ATOM 168 CG PRO A 14 -6.846 20.309 -5.964 1.00 0.00 C ATOM 169 CD PRO A 14 -7.497 18.957 -6.059 1.00 0.00 C ATOM 0 HA PRO A 14 -5.681 18.967 -8.765 1.00 0.00 H new ATOM 0 HB2 PRO A 14 -5.295 21.192 -7.148 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -6.806 20.960 -8.004 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -6.146 20.347 -5.130 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -7.588 21.089 -5.793 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -7.531 18.458 -5.090 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -8.524 19.030 -6.416 1.00 0.00 H new ATOM 177 N ILE A 15 -3.333 18.855 -8.203 1.00 0.00 N ATOM 178 CA ILE A 15 -1.923 18.628 -7.909 1.00 0.00 C ATOM 179 C ILE A 15 -1.141 19.937 -7.922 1.00 0.00 C ATOM 180 O ILE A 15 -1.407 20.823 -8.733 1.00 0.00 O ATOM 181 CB ILE A 15 -1.288 17.653 -8.918 1.00 0.00 C ATOM 182 CG1 ILE A 15 -2.048 16.325 -8.925 1.00 0.00 C ATOM 183 CG2 ILE A 15 0.180 17.428 -8.585 1.00 0.00 C ATOM 184 CD1 ILE A 15 -1.611 15.385 -10.027 1.00 0.00 C ATOM 0 H ILE A 15 -3.540 18.998 -9.191 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.875 18.189 -6.912 1.00 0.00 H new ATOM 0 HB ILE A 15 -1.352 18.091 -9.914 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -1.911 15.832 -7.962 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.114 16.526 -9.031 1.00 0.00 H new ATOM 0 HG21 ILE A 15 0.615 16.737 -9.307 1.00 0.00 H new ATOM 0 HG22 ILE A 15 0.712 18.378 -8.626 1.00 0.00 H new ATOM 0 HG23 ILE A 15 0.265 17.008 -7.583 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -2.192 14.464 -9.971 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -1.774 15.859 -10.995 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -0.552 15.154 -9.910 1.00 0.00 H new ATOM 196 N GLY A 16 -0.172 20.051 -7.018 1.00 0.00 N ATOM 197 CA GLY A 16 0.635 21.254 -6.944 1.00 0.00 C ATOM 198 C GLY A 16 1.933 21.130 -7.718 1.00 0.00 C ATOM 199 O GLY A 16 2.395 20.024 -7.995 1.00 0.00 O ATOM 0 H GLY A 16 0.068 19.331 -6.336 1.00 0.00 H new ATOM 0 HA2 GLY A 16 0.063 22.096 -7.333 1.00 0.00 H new ATOM 0 HA3 GLY A 16 0.858 21.475 -5.900 1.00 0.00 H new ATOM 203 N ALA A 17 2.521 22.269 -8.070 1.00 0.00 N ATOM 204 CA ALA A 17 3.772 22.284 -8.816 1.00 0.00 C ATOM 205 C ALA A 17 4.908 21.682 -7.996 1.00 0.00 C ATOM 206 O ALA A 17 5.660 20.838 -8.484 1.00 0.00 O ATOM 207 CB ALA A 17 4.119 23.704 -9.239 1.00 0.00 C ATOM 0 H ALA A 17 2.150 23.193 -7.850 1.00 0.00 H new ATOM 0 HA ALA A 17 3.640 21.673 -9.709 1.00 0.00 H new ATOM 0 HB1 ALA A 17 5.056 23.699 -9.795 1.00 0.00 H new ATOM 0 HB2 ALA A 17 3.324 24.100 -9.871 1.00 0.00 H new ATOM 0 HB3 ALA A 17 4.226 24.331 -8.354 1.00 0.00 H new ATOM 213 N ASP A 18 5.027 22.121 -6.748 1.00 0.00 N ATOM 214 CA ASP A 18 6.071 21.626 -5.859 1.00 0.00 C ATOM 215 C ASP A 18 5.962 20.114 -5.682 1.00 0.00 C ATOM 216 O ASP A 18 6.970 19.420 -5.556 1.00 0.00 O ATOM 217 CB ASP A 18 5.984 22.319 -4.498 1.00 0.00 C ATOM 218 CG ASP A 18 7.143 21.959 -3.590 1.00 0.00 C ATOM 219 OD1 ASP A 18 8.288 21.896 -4.085 1.00 0.00 O ATOM 220 OD2 ASP A 18 6.906 21.738 -2.383 1.00 0.00 O ATOM 0 H ASP A 18 4.413 22.819 -6.329 1.00 0.00 H new ATOM 0 HA ASP A 18 7.036 21.853 -6.312 1.00 0.00 H new ATOM 0 HB2 ASP A 18 5.963 23.399 -4.644 1.00 0.00 H new ATOM 0 HB3 ASP A 18 5.047 22.044 -4.013 1.00 0.00 H new ATOM 225 N SER A 19 4.732 19.612 -5.672 1.00 0.00 N ATOM 226 CA SER A 19 4.490 18.184 -5.505 1.00 0.00 C ATOM 227 C SER A 19 4.936 17.410 -6.741 1.00 0.00 C ATOM 228 O SER A 19 4.589 17.763 -7.869 1.00 0.00 O ATOM 229 CB SER A 19 3.007 17.924 -5.233 1.00 0.00 C ATOM 230 OG SER A 19 2.644 18.353 -3.933 1.00 0.00 O ATOM 0 H SER A 19 3.887 20.173 -5.778 1.00 0.00 H new ATOM 0 HA SER A 19 5.074 17.839 -4.651 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.401 18.446 -5.974 1.00 0.00 H new ATOM 0 HB3 SER A 19 2.795 16.860 -5.341 1.00 0.00 H new ATOM 0 HG SER A 19 1.691 18.177 -3.785 1.00 0.00 H new ATOM 236 N LYS A 20 5.707 16.350 -6.522 1.00 0.00 N ATOM 237 CA LYS A 20 6.201 15.523 -7.616 1.00 0.00 C ATOM 238 C LYS A 20 5.105 14.599 -8.137 1.00 0.00 C ATOM 239 O LYS A 20 4.780 13.592 -7.509 1.00 0.00 O ATOM 240 CB LYS A 20 7.403 14.696 -7.155 1.00 0.00 C ATOM 241 CG LYS A 20 8.590 15.539 -6.721 1.00 0.00 C ATOM 242 CD LYS A 20 9.877 14.731 -6.721 1.00 0.00 C ATOM 243 CE LYS A 20 10.999 15.470 -6.007 1.00 0.00 C ATOM 244 NZ LYS A 20 10.787 15.509 -4.533 1.00 0.00 N ATOM 0 H LYS A 20 6.003 16.043 -5.595 1.00 0.00 H new ATOM 0 HA LYS A 20 6.511 16.183 -8.426 1.00 0.00 H new ATOM 0 HB2 LYS A 20 7.098 14.058 -6.325 1.00 0.00 H new ATOM 0 HB3 LYS A 20 7.713 14.037 -7.966 1.00 0.00 H new ATOM 0 HG2 LYS A 20 8.695 16.393 -7.390 1.00 0.00 H new ATOM 0 HG3 LYS A 20 8.409 15.937 -5.723 1.00 0.00 H new ATOM 0 HD2 LYS A 20 9.705 13.771 -6.235 1.00 0.00 H new ATOM 0 HD3 LYS A 20 10.175 14.519 -7.748 1.00 0.00 H new ATOM 0 HE2 LYS A 20 11.950 14.984 -6.224 1.00 0.00 H new ATOM 0 HE3 LYS A 20 11.066 16.488 -6.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 11.667 15.802 -4.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 10.032 16.188 -4.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 10.514 14.564 -4.196 1.00 0.00 H new ATOM 258 N GLU A 21 4.540 14.948 -9.289 1.00 0.00 N ATOM 259 CA GLU A 21 3.481 14.148 -9.893 1.00 0.00 C ATOM 260 C GLU A 21 4.040 13.240 -10.984 1.00 0.00 C ATOM 261 O GLU A 21 5.179 13.405 -11.422 1.00 0.00 O ATOM 262 CB GLU A 21 2.396 15.056 -10.476 1.00 0.00 C ATOM 263 CG GLU A 21 2.817 15.768 -11.750 1.00 0.00 C ATOM 264 CD GLU A 21 3.743 16.940 -11.486 1.00 0.00 C ATOM 265 OE1 GLU A 21 3.291 17.921 -10.859 1.00 0.00 O ATOM 266 OE2 GLU A 21 4.917 16.875 -11.904 1.00 0.00 O ATOM 0 H GLU A 21 4.798 15.779 -9.822 1.00 0.00 H new ATOM 0 HA GLU A 21 3.043 13.524 -9.114 1.00 0.00 H new ATOM 0 HB2 GLU A 21 1.507 14.460 -10.680 1.00 0.00 H new ATOM 0 HB3 GLU A 21 2.117 15.800 -9.730 1.00 0.00 H new ATOM 0 HG2 GLU A 21 3.315 15.058 -12.411 1.00 0.00 H new ATOM 0 HG3 GLU A 21 1.929 16.122 -12.274 1.00 0.00 H new ATOM 273 N VAL A 22 3.231 12.280 -11.420 1.00 0.00 N ATOM 274 CA VAL A 22 3.643 11.346 -12.460 1.00 0.00 C ATOM 275 C VAL A 22 2.672 11.368 -13.636 1.00 0.00 C ATOM 276 O VAL A 22 1.555 10.859 -13.542 1.00 0.00 O ATOM 277 CB VAL A 22 3.741 9.908 -11.917 1.00 0.00 C ATOM 278 CG1 VAL A 22 4.242 8.961 -12.996 1.00 0.00 C ATOM 279 CG2 VAL A 22 4.644 9.861 -10.694 1.00 0.00 C ATOM 0 H VAL A 22 2.285 12.129 -11.068 1.00 0.00 H new ATOM 0 HA VAL A 22 4.628 11.666 -12.800 1.00 0.00 H new ATOM 0 HB VAL A 22 2.744 9.583 -11.618 1.00 0.00 H new ATOM 0 HG11 VAL A 22 4.304 7.950 -12.593 1.00 0.00 H new ATOM 0 HG12 VAL A 22 3.552 8.973 -13.840 1.00 0.00 H new ATOM 0 HG13 VAL A 22 5.229 9.280 -13.330 1.00 0.00 H new ATOM 0 HG21 VAL A 22 4.702 8.838 -10.324 1.00 0.00 H new ATOM 0 HG22 VAL A 22 5.642 10.206 -10.965 1.00 0.00 H new ATOM 0 HG23 VAL A 22 4.236 10.506 -9.916 1.00 0.00 H new ATOM 289 N HIS A 23 3.106 11.962 -14.743 1.00 0.00 N ATOM 290 CA HIS A 23 2.275 12.050 -15.939 1.00 0.00 C ATOM 291 C HIS A 23 2.518 10.857 -16.858 1.00 0.00 C ATOM 292 O HIS A 23 3.627 10.658 -17.355 1.00 0.00 O ATOM 293 CB HIS A 23 2.560 13.352 -16.688 1.00 0.00 C ATOM 294 CG HIS A 23 1.988 13.384 -18.072 1.00 0.00 C ATOM 295 ND1 HIS A 23 2.507 14.164 -19.084 1.00 0.00 N ATOM 296 CD2 HIS A 23 0.935 12.725 -18.610 1.00 0.00 C ATOM 297 CE1 HIS A 23 1.798 13.985 -20.183 1.00 0.00 C ATOM 298 NE2 HIS A 23 0.837 13.116 -19.923 1.00 0.00 N ATOM 0 H HIS A 23 4.027 12.389 -14.837 1.00 0.00 H new ATOM 0 HA HIS A 23 1.230 12.039 -15.628 1.00 0.00 H new ATOM 0 HB2 HIS A 23 2.154 14.187 -16.117 1.00 0.00 H new ATOM 0 HB3 HIS A 23 3.638 13.500 -16.746 1.00 0.00 H new ATOM 0 HD1 HIS A 23 3.313 14.783 -18.997 1.00 0.00 H new ATOM 0 HD2 HIS A 23 0.292 12.022 -18.101 1.00 0.00 H new ATOM 0 HE1 HIS A 23 1.974 14.467 -21.133 1.00 0.00 H new ATOM 307 N TYR A 24 1.474 10.065 -17.079 1.00 0.00 N ATOM 308 CA TYR A 24 1.574 8.890 -17.935 1.00 0.00 C ATOM 309 C TYR A 24 0.232 8.577 -18.590 1.00 0.00 C ATOM 310 O TYR A 24 -0.768 8.353 -17.908 1.00 0.00 O ATOM 311 CB TYR A 24 2.054 7.683 -17.127 1.00 0.00 C ATOM 312 CG TYR A 24 2.378 6.475 -17.976 1.00 0.00 C ATOM 313 CD1 TYR A 24 3.509 6.452 -18.783 1.00 0.00 C ATOM 314 CD2 TYR A 24 1.552 5.357 -17.973 1.00 0.00 C ATOM 315 CE1 TYR A 24 3.808 5.350 -19.561 1.00 0.00 C ATOM 316 CE2 TYR A 24 1.845 4.251 -18.747 1.00 0.00 C ATOM 317 CZ TYR A 24 2.973 4.252 -19.539 1.00 0.00 C ATOM 318 OH TYR A 24 3.268 3.153 -20.313 1.00 0.00 O ATOM 0 H TYR A 24 0.549 10.216 -16.677 1.00 0.00 H new ATOM 0 HA TYR A 24 2.299 9.105 -18.720 1.00 0.00 H new ATOM 0 HB2 TYR A 24 2.941 7.966 -16.559 1.00 0.00 H new ATOM 0 HB3 TYR A 24 1.285 7.412 -16.403 1.00 0.00 H new ATOM 0 HD1 TYR A 24 4.165 7.310 -18.802 1.00 0.00 H new ATOM 0 HD2 TYR A 24 0.666 5.353 -17.355 1.00 0.00 H new ATOM 0 HE1 TYR A 24 4.691 5.348 -20.183 1.00 0.00 H new ATOM 0 HE2 TYR A 24 1.193 3.390 -18.732 1.00 0.00 H new ATOM 0 HH TYR A 24 2.581 2.467 -20.182 1.00 0.00 H new ATOM 328 N LYS A 25 0.219 8.561 -19.918 1.00 0.00 N ATOM 329 CA LYS A 25 -0.998 8.274 -20.668 1.00 0.00 C ATOM 330 C LYS A 25 -2.043 9.363 -20.449 1.00 0.00 C ATOM 331 O LYS A 25 -3.178 9.080 -20.070 1.00 0.00 O ATOM 332 CB LYS A 25 -1.568 6.915 -20.255 1.00 0.00 C ATOM 333 CG LYS A 25 -0.577 5.772 -20.394 1.00 0.00 C ATOM 334 CD LYS A 25 -0.474 5.296 -21.833 1.00 0.00 C ATOM 335 CE LYS A 25 -1.661 4.427 -22.220 1.00 0.00 C ATOM 336 NZ LYS A 25 -1.469 3.787 -23.550 1.00 0.00 N ATOM 0 H LYS A 25 1.038 8.744 -20.498 1.00 0.00 H new ATOM 0 HA LYS A 25 -0.743 8.248 -21.728 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -1.903 6.970 -19.219 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -2.447 6.699 -20.863 1.00 0.00 H new ATOM 0 HG2 LYS A 25 0.404 6.095 -20.046 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -0.884 4.943 -19.757 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -0.420 6.157 -22.499 1.00 0.00 H new ATOM 0 HD3 LYS A 25 0.449 4.732 -21.965 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -1.808 3.656 -21.464 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -2.566 5.035 -22.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -2.299 3.203 -23.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -1.354 4.523 -24.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -0.620 3.187 -23.527 1.00 0.00 H new ATOM 350 N ASN A 26 -1.651 10.610 -20.691 1.00 0.00 N ATOM 351 CA ASN A 26 -2.554 11.742 -20.521 1.00 0.00 C ATOM 352 C ASN A 26 -3.185 11.730 -19.132 1.00 0.00 C ATOM 353 O ASN A 26 -4.319 12.175 -18.950 1.00 0.00 O ATOM 354 CB ASN A 26 -3.648 11.714 -21.590 1.00 0.00 C ATOM 355 CG ASN A 26 -3.201 12.352 -22.891 1.00 0.00 C ATOM 356 OD1 ASN A 26 -2.724 13.487 -22.907 1.00 0.00 O ATOM 357 ND2 ASN A 26 -3.354 11.623 -23.991 1.00 0.00 N ATOM 0 H ASN A 26 -0.714 10.862 -21.005 1.00 0.00 H new ATOM 0 HA ASN A 26 -1.973 12.658 -20.629 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -3.943 10.682 -21.777 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -4.530 12.235 -21.217 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -3.071 12.000 -24.896 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -3.754 10.687 -23.931 1.00 0.00 H new ATOM 364 N ARG A 27 -2.443 11.218 -18.155 1.00 0.00 N ATOM 365 CA ARG A 27 -2.930 11.147 -16.783 1.00 0.00 C ATOM 366 C ARG A 27 -1.912 11.740 -15.814 1.00 0.00 C ATOM 367 O ARG A 27 -0.855 12.221 -16.224 1.00 0.00 O ATOM 368 CB ARG A 27 -3.230 9.697 -16.400 1.00 0.00 C ATOM 369 CG ARG A 27 -4.435 9.114 -17.119 1.00 0.00 C ATOM 370 CD ARG A 27 -5.736 9.506 -16.436 1.00 0.00 C ATOM 371 NE ARG A 27 -6.297 10.734 -16.992 1.00 0.00 N ATOM 372 CZ ARG A 27 -7.070 10.766 -18.071 1.00 0.00 C ATOM 373 NH1 ARG A 27 -7.372 9.643 -18.708 1.00 0.00 N ATOM 374 NH2 ARG A 27 -7.543 11.923 -18.517 1.00 0.00 N ATOM 0 H ARG A 27 -1.503 10.846 -18.289 1.00 0.00 H new ATOM 0 HA ARG A 27 -3.849 11.730 -16.720 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -2.356 9.084 -16.619 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -3.397 9.641 -15.324 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -4.446 9.461 -18.152 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -4.352 8.028 -17.149 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -6.459 8.697 -16.541 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -5.559 9.639 -15.369 1.00 0.00 H new ATOM 0 HE ARG A 27 -6.083 11.616 -16.526 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -7.010 8.751 -18.369 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -7.966 9.671 -19.537 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -7.313 12.790 -18.031 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -8.137 11.946 -19.346 1.00 0.00 H new ATOM 388 N PHE A 28 -2.237 11.703 -14.526 1.00 0.00 N ATOM 389 CA PHE A 28 -1.352 12.238 -13.498 1.00 0.00 C ATOM 390 C PHE A 28 -1.697 11.661 -12.128 1.00 0.00 C ATOM 391 O PHE A 28 -2.843 11.731 -11.685 1.00 0.00 O ATOM 392 CB PHE A 28 -1.445 13.765 -13.459 1.00 0.00 C ATOM 393 CG PHE A 28 -1.367 14.405 -14.815 1.00 0.00 C ATOM 394 CD1 PHE A 28 -2.510 14.590 -15.575 1.00 0.00 C ATOM 395 CD2 PHE A 28 -0.150 14.823 -15.329 1.00 0.00 C ATOM 396 CE1 PHE A 28 -2.441 15.178 -16.824 1.00 0.00 C ATOM 397 CE2 PHE A 28 -0.074 15.413 -16.577 1.00 0.00 C ATOM 398 CZ PHE A 28 -1.222 15.591 -17.325 1.00 0.00 C ATOM 0 H PHE A 28 -3.107 11.308 -14.169 1.00 0.00 H new ATOM 0 HA PHE A 28 -0.331 11.949 -13.747 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -2.383 14.052 -12.984 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -0.640 14.154 -12.836 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -3.466 14.271 -15.187 1.00 0.00 H new ATOM 0 HD2 PHE A 28 0.750 14.686 -14.748 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -3.339 15.314 -17.408 1.00 0.00 H new ATOM 0 HE2 PHE A 28 0.881 15.734 -16.966 1.00 0.00 H new ATOM 0 HZ PHE A 28 -1.166 16.052 -18.300 1.00 0.00 H new ATOM 408 N TRP A 29 -0.698 11.091 -11.465 1.00 0.00 N ATOM 409 CA TRP A 29 -0.895 10.500 -10.146 1.00 0.00 C ATOM 410 C TRP A 29 0.035 11.138 -9.119 1.00 0.00 C ATOM 411 O TRP A 29 1.189 11.444 -9.419 1.00 0.00 O ATOM 412 CB TRP A 29 -0.658 8.990 -10.199 1.00 0.00 C ATOM 413 CG TRP A 29 -1.656 8.262 -11.047 1.00 0.00 C ATOM 414 CD1 TRP A 29 -2.800 7.650 -10.623 1.00 0.00 C ATOM 415 CD2 TRP A 29 -1.596 8.068 -12.465 1.00 0.00 C ATOM 416 NE1 TRP A 29 -3.456 7.087 -11.691 1.00 0.00 N ATOM 417 CE2 TRP A 29 -2.739 7.330 -12.832 1.00 0.00 C ATOM 418 CE3 TRP A 29 -0.691 8.447 -13.459 1.00 0.00 C ATOM 419 CZ2 TRP A 29 -2.996 6.965 -14.151 1.00 0.00 C ATOM 420 CZ3 TRP A 29 -0.947 8.083 -14.767 1.00 0.00 C ATOM 421 CH2 TRP A 29 -2.093 7.349 -15.104 1.00 0.00 C ATOM 0 H TRP A 29 0.257 11.025 -11.818 1.00 0.00 H new ATOM 0 HA TRP A 29 -1.925 10.688 -9.842 1.00 0.00 H new ATOM 0 HB2 TRP A 29 0.343 8.800 -10.585 1.00 0.00 H new ATOM 0 HB3 TRP A 29 -0.691 8.588 -9.186 1.00 0.00 H new ATOM 0 HD1 TRP A 29 -3.140 7.614 -9.598 1.00 0.00 H new ATOM 0 HE1 TRP A 29 -4.335 6.572 -11.642 1.00 0.00 H new ATOM 0 HE3 TRP A 29 0.193 9.015 -13.210 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 -3.878 6.398 -14.412 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 -0.252 8.369 -15.543 1.00 0.00 H new ATOM 0 HH2 TRP A 29 -2.266 7.082 -16.136 1.00 0.00 H new ATOM 432 N HIS A 30 -0.474 11.335 -7.907 1.00 0.00 N ATOM 433 CA HIS A 30 0.313 11.936 -6.836 1.00 0.00 C ATOM 434 C HIS A 30 1.504 11.053 -6.477 1.00 0.00 C ATOM 435 O HIS A 30 1.547 9.876 -6.834 1.00 0.00 O ATOM 436 CB HIS A 30 -0.559 12.163 -5.600 1.00 0.00 C ATOM 437 CG HIS A 30 -1.371 13.420 -5.664 1.00 0.00 C ATOM 438 ND1 HIS A 30 -2.746 13.423 -5.777 1.00 0.00 N ATOM 439 CD2 HIS A 30 -0.996 14.720 -5.627 1.00 0.00 C ATOM 440 CE1 HIS A 30 -3.180 14.670 -5.809 1.00 0.00 C ATOM 441 NE2 HIS A 30 -2.138 15.476 -5.719 1.00 0.00 N ATOM 0 H HIS A 30 -1.427 11.087 -7.642 1.00 0.00 H new ATOM 0 HA HIS A 30 0.688 12.897 -7.189 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -1.230 11.313 -5.477 1.00 0.00 H new ATOM 0 HB3 HIS A 30 0.079 12.196 -4.717 1.00 0.00 H new ATOM 0 HD2 HIS A 30 0.014 15.093 -5.541 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -4.212 14.978 -5.894 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -2.176 16.495 -5.718 1.00 0.00 H new ATOM 449 N ASP A 31 2.470 11.630 -5.770 1.00 0.00 N ATOM 450 CA ASP A 31 3.662 10.896 -5.362 1.00 0.00 C ATOM 451 C ASP A 31 3.302 9.763 -4.407 1.00 0.00 C ATOM 452 O ASP A 31 4.129 8.899 -4.112 1.00 0.00 O ATOM 453 CB ASP A 31 4.666 11.840 -4.698 1.00 0.00 C ATOM 454 CG ASP A 31 4.028 12.703 -3.627 1.00 0.00 C ATOM 455 OD1 ASP A 31 3.311 13.661 -3.986 1.00 0.00 O ATOM 456 OD2 ASP A 31 4.245 12.421 -2.430 1.00 0.00 O ATOM 0 H ASP A 31 2.451 12.604 -5.468 1.00 0.00 H new ATOM 0 HA ASP A 31 4.116 10.465 -6.254 1.00 0.00 H new ATOM 0 HB2 ASP A 31 5.473 11.255 -4.256 1.00 0.00 H new ATOM 0 HB3 ASP A 31 5.115 12.481 -5.457 1.00 0.00 H new ATOM 461 N THR A 32 2.063 9.772 -3.925 1.00 0.00 N ATOM 462 CA THR A 32 1.595 8.746 -3.002 1.00 0.00 C ATOM 463 C THR A 32 0.495 7.899 -3.633 1.00 0.00 C ATOM 464 O THR A 32 0.148 6.834 -3.122 1.00 0.00 O ATOM 465 CB THR A 32 1.063 9.367 -1.696 1.00 0.00 C ATOM 466 OG1 THR A 32 0.097 10.381 -1.993 1.00 0.00 O ATOM 467 CG2 THR A 32 2.199 9.965 -0.880 1.00 0.00 C ATOM 0 H THR A 32 1.366 10.479 -4.159 1.00 0.00 H new ATOM 0 HA THR A 32 2.452 8.112 -2.773 1.00 0.00 H new ATOM 0 HB THR A 32 0.592 8.578 -1.110 1.00 0.00 H new ATOM 0 HG1 THR A 32 -0.237 10.769 -1.158 1.00 0.00 H new ATOM 0 HG21 THR A 32 1.800 10.398 0.037 1.00 0.00 H new ATOM 0 HG22 THR A 32 2.918 9.184 -0.630 1.00 0.00 H new ATOM 0 HG23 THR A 32 2.695 10.742 -1.462 1.00 0.00 H new ATOM 475 N CYS A 33 -0.049 8.379 -4.747 1.00 0.00 N ATOM 476 CA CYS A 33 -1.109 7.665 -5.448 1.00 0.00 C ATOM 477 C CYS A 33 -0.527 6.710 -6.486 1.00 0.00 C ATOM 478 O CYS A 33 -0.973 5.570 -6.615 1.00 0.00 O ATOM 479 CB CYS A 33 -2.057 8.657 -6.126 1.00 0.00 C ATOM 480 SG CYS A 33 -3.165 9.532 -4.975 1.00 0.00 S ATOM 0 H CYS A 33 0.227 9.259 -5.183 1.00 0.00 H new ATOM 0 HA CYS A 33 -1.667 7.081 -4.716 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -1.466 9.391 -6.674 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -2.661 8.123 -6.859 1.00 0.00 H new ATOM 485 N PHE A 34 0.471 7.184 -7.224 1.00 0.00 N ATOM 486 CA PHE A 34 1.114 6.373 -8.252 1.00 0.00 C ATOM 487 C PHE A 34 1.768 5.137 -7.639 1.00 0.00 C ATOM 488 O PHE A 34 2.877 5.207 -7.109 1.00 0.00 O ATOM 489 CB PHE A 34 2.161 7.198 -9.002 1.00 0.00 C ATOM 490 CG PHE A 34 2.727 6.498 -10.205 1.00 0.00 C ATOM 491 CD1 PHE A 34 1.889 5.952 -11.163 1.00 0.00 C ATOM 492 CD2 PHE A 34 4.097 6.387 -10.376 1.00 0.00 C ATOM 493 CE1 PHE A 34 2.406 5.307 -12.271 1.00 0.00 C ATOM 494 CE2 PHE A 34 4.621 5.744 -11.482 1.00 0.00 C ATOM 495 CZ PHE A 34 3.774 5.202 -12.430 1.00 0.00 C ATOM 0 H PHE A 34 0.852 8.125 -7.130 1.00 0.00 H new ATOM 0 HA PHE A 34 0.347 6.047 -8.955 1.00 0.00 H new ATOM 0 HB2 PHE A 34 1.712 8.140 -9.317 1.00 0.00 H new ATOM 0 HB3 PHE A 34 2.974 7.445 -8.320 1.00 0.00 H new ATOM 0 HD1 PHE A 34 0.819 6.031 -11.043 1.00 0.00 H new ATOM 0 HD2 PHE A 34 4.763 6.807 -9.637 1.00 0.00 H new ATOM 0 HE1 PHE A 34 1.741 4.886 -13.011 1.00 0.00 H new ATOM 0 HE2 PHE A 34 5.691 5.665 -11.605 1.00 0.00 H new ATOM 0 HZ PHE A 34 4.181 4.697 -13.294 1.00 0.00 H new ATOM 505 N ARG A 35 1.072 4.008 -7.716 1.00 0.00 N ATOM 506 CA ARG A 35 1.583 2.757 -7.168 1.00 0.00 C ATOM 507 C ARG A 35 0.920 1.558 -7.840 1.00 0.00 C ATOM 508 O ARG A 35 0.040 1.715 -8.687 1.00 0.00 O ATOM 509 CB ARG A 35 1.347 2.703 -5.657 1.00 0.00 C ATOM 510 CG ARG A 35 -0.114 2.533 -5.275 1.00 0.00 C ATOM 511 CD ARG A 35 -0.263 2.105 -3.823 1.00 0.00 C ATOM 512 NE ARG A 35 0.546 2.924 -2.925 1.00 0.00 N ATOM 513 CZ ARG A 35 0.146 4.091 -2.433 1.00 0.00 C ATOM 514 NH1 ARG A 35 -1.047 4.574 -2.751 1.00 0.00 N ATOM 515 NH2 ARG A 35 0.940 4.778 -1.622 1.00 0.00 N ATOM 0 H ARG A 35 0.153 3.933 -8.152 1.00 0.00 H new ATOM 0 HA ARG A 35 2.655 2.715 -7.363 1.00 0.00 H new ATOM 0 HB2 ARG A 35 1.922 1.878 -5.237 1.00 0.00 H new ATOM 0 HB3 ARG A 35 1.728 3.619 -5.205 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -0.645 3.471 -5.435 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -0.577 1.790 -5.924 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -1.311 2.173 -3.531 1.00 0.00 H new ATOM 0 HD3 ARG A 35 0.029 1.060 -3.722 1.00 0.00 H new ATOM 0 HE ARG A 35 1.470 2.581 -2.661 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -1.660 4.049 -3.375 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -1.352 5.470 -2.372 1.00 0.00 H new ATOM 0 HH21 ARG A 35 1.859 4.410 -1.376 1.00 0.00 H new ATOM 0 HH22 ARG A 35 0.632 5.674 -1.245 1.00 0.00 H new ATOM 529 N CYS A 36 1.348 0.360 -7.457 1.00 0.00 N ATOM 530 CA CYS A 36 0.798 -0.866 -8.022 1.00 0.00 C ATOM 531 C CYS A 36 -0.618 -1.113 -7.512 1.00 0.00 C ATOM 532 O CYS A 36 -1.046 -0.515 -6.525 1.00 0.00 O ATOM 533 CB CYS A 36 1.692 -2.058 -7.674 1.00 0.00 C ATOM 534 SG CYS A 36 1.405 -3.530 -8.710 1.00 0.00 S ATOM 0 H CYS A 36 2.075 0.212 -6.757 1.00 0.00 H new ATOM 0 HA CYS A 36 0.760 -0.752 -9.105 1.00 0.00 H new ATOM 0 HB2 CYS A 36 2.735 -1.757 -7.770 1.00 0.00 H new ATOM 0 HB3 CYS A 36 1.533 -2.325 -6.629 1.00 0.00 H new ATOM 539 N ALA A 37 -1.341 -1.998 -8.191 1.00 0.00 N ATOM 540 CA ALA A 37 -2.708 -2.325 -7.806 1.00 0.00 C ATOM 541 C ALA A 37 -2.789 -3.727 -7.211 1.00 0.00 C ATOM 542 O ALA A 37 -3.839 -4.145 -6.721 1.00 0.00 O ATOM 543 CB ALA A 37 -3.637 -2.203 -9.004 1.00 0.00 C ATOM 0 H ALA A 37 -1.002 -2.501 -9.011 1.00 0.00 H new ATOM 0 HA ALA A 37 -3.025 -1.615 -7.042 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -4.655 -2.450 -8.702 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -3.609 -1.182 -9.384 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -3.314 -2.890 -9.786 1.00 0.00 H new ATOM 549 N LYS A 38 -1.676 -4.450 -7.257 1.00 0.00 N ATOM 550 CA LYS A 38 -1.620 -5.805 -6.722 1.00 0.00 C ATOM 551 C LYS A 38 -0.821 -5.845 -5.423 1.00 0.00 C ATOM 552 O LYS A 38 -1.223 -6.489 -4.454 1.00 0.00 O ATOM 553 CB LYS A 38 -0.996 -6.755 -7.746 1.00 0.00 C ATOM 554 CG LYS A 38 -2.016 -7.450 -8.632 1.00 0.00 C ATOM 555 CD LYS A 38 -1.343 -8.272 -9.718 1.00 0.00 C ATOM 556 CE LYS A 38 -0.807 -9.586 -9.170 1.00 0.00 C ATOM 557 NZ LYS A 38 -0.145 -10.399 -10.228 1.00 0.00 N ATOM 0 H LYS A 38 -0.799 -4.120 -7.660 1.00 0.00 H new ATOM 0 HA LYS A 38 -2.640 -6.127 -6.511 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -0.304 -6.195 -8.374 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -0.410 -7.509 -7.220 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -2.647 -8.097 -8.023 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.669 -6.706 -9.089 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -2.056 -8.474 -10.518 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -0.526 -7.699 -10.156 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -0.095 -9.383 -8.370 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -1.625 -10.157 -8.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 0.207 -11.286 -9.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -0.830 -10.615 -10.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 0.652 -9.864 -10.629 1.00 0.00 H new ATOM 571 N CYS A 39 0.313 -5.152 -5.410 1.00 0.00 N ATOM 572 CA CYS A 39 1.168 -5.107 -4.230 1.00 0.00 C ATOM 573 C CYS A 39 1.135 -3.724 -3.586 1.00 0.00 C ATOM 574 O CYS A 39 1.748 -3.498 -2.542 1.00 0.00 O ATOM 575 CB CYS A 39 2.606 -5.474 -4.603 1.00 0.00 C ATOM 576 SG CYS A 39 3.395 -4.308 -5.759 1.00 0.00 S ATOM 0 H CYS A 39 0.661 -4.614 -6.204 1.00 0.00 H new ATOM 0 HA CYS A 39 0.790 -5.832 -3.510 1.00 0.00 H new ATOM 0 HB2 CYS A 39 3.204 -5.527 -3.693 1.00 0.00 H new ATOM 0 HB3 CYS A 39 2.612 -6.469 -5.047 1.00 0.00 H new ATOM 581 N LEU A 40 0.416 -2.801 -4.216 1.00 0.00 N ATOM 582 CA LEU A 40 0.302 -1.440 -3.706 1.00 0.00 C ATOM 583 C LEU A 40 1.678 -0.846 -3.427 1.00 0.00 C ATOM 584 O LEU A 40 1.954 -0.384 -2.319 1.00 0.00 O ATOM 585 CB LEU A 40 -0.542 -1.422 -2.430 1.00 0.00 C ATOM 586 CG LEU A 40 -1.995 -1.875 -2.579 1.00 0.00 C ATOM 587 CD1 LEU A 40 -2.767 -0.910 -3.466 1.00 0.00 C ATOM 588 CD2 LEU A 40 -2.058 -3.287 -3.144 1.00 0.00 C ATOM 0 H LEU A 40 -0.097 -2.971 -5.081 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.188 -0.833 -4.467 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.058 -2.059 -1.689 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.538 -0.408 -2.030 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.457 -1.878 -1.592 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -3.799 -1.249 -3.560 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -2.751 0.085 -3.021 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.305 -0.874 -4.453 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.099 -3.593 -3.243 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -1.578 -3.309 -4.123 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.541 -3.971 -2.471 1.00 0.00 H new ATOM 600 N HIS A 41 2.539 -0.858 -4.440 1.00 0.00 N ATOM 601 CA HIS A 41 3.887 -0.318 -4.304 1.00 0.00 C ATOM 602 C HIS A 41 4.100 0.856 -5.255 1.00 0.00 C ATOM 603 O HIS A 41 3.756 0.800 -6.436 1.00 0.00 O ATOM 604 CB HIS A 41 4.926 -1.406 -4.579 1.00 0.00 C ATOM 605 CG HIS A 41 6.337 -0.904 -4.565 1.00 0.00 C ATOM 606 ND1 HIS A 41 7.037 -0.660 -3.403 1.00 0.00 N ATOM 607 CD2 HIS A 41 7.179 -0.603 -5.581 1.00 0.00 C ATOM 608 CE1 HIS A 41 8.249 -0.228 -3.704 1.00 0.00 C ATOM 609 NE2 HIS A 41 8.361 -0.185 -5.019 1.00 0.00 N ATOM 0 H HIS A 41 2.327 -1.236 -5.364 1.00 0.00 H new ATOM 0 HA HIS A 41 4.007 0.038 -3.281 1.00 0.00 H new ATOM 0 HB2 HIS A 41 4.822 -2.193 -3.832 1.00 0.00 H new ATOM 0 HB3 HIS A 41 4.719 -1.857 -5.549 1.00 0.00 H new ATOM 0 HD1 HIS A 41 6.676 -0.792 -2.458 1.00 0.00 H new ATOM 0 HD2 HIS A 41 6.962 -0.677 -6.636 1.00 0.00 H new ATOM 0 HE1 HIS A 41 9.017 0.044 -2.995 1.00 0.00 H new ATOM 618 N PRO A 42 4.678 1.947 -4.730 1.00 0.00 N ATOM 619 CA PRO A 42 4.949 3.155 -5.515 1.00 0.00 C ATOM 620 C PRO A 42 6.055 2.942 -6.543 1.00 0.00 C ATOM 621 O PRO A 42 7.153 2.497 -6.205 1.00 0.00 O ATOM 622 CB PRO A 42 5.388 4.172 -4.459 1.00 0.00 C ATOM 623 CG PRO A 42 5.925 3.349 -3.339 1.00 0.00 C ATOM 624 CD PRO A 42 5.114 2.083 -3.330 1.00 0.00 C ATOM 0 HA PRO A 42 4.080 3.469 -6.094 1.00 0.00 H new ATOM 0 HB2 PRO A 42 6.147 4.848 -4.852 1.00 0.00 H new ATOM 0 HB3 PRO A 42 4.551 4.788 -4.131 1.00 0.00 H new ATOM 0 HG2 PRO A 42 6.983 3.133 -3.486 1.00 0.00 H new ATOM 0 HG3 PRO A 42 5.836 3.876 -2.389 1.00 0.00 H new ATOM 0 HD2 PRO A 42 5.708 1.227 -3.009 1.00 0.00 H new ATOM 0 HD3 PRO A 42 4.265 2.154 -2.650 1.00 0.00 H new ATOM 632 N LEU A 43 5.760 3.264 -7.797 1.00 0.00 N ATOM 633 CA LEU A 43 6.731 3.109 -8.875 1.00 0.00 C ATOM 634 C LEU A 43 7.278 4.464 -9.315 1.00 0.00 C ATOM 635 O LEU A 43 7.592 4.667 -10.487 1.00 0.00 O ATOM 636 CB LEU A 43 6.090 2.395 -10.066 1.00 0.00 C ATOM 637 CG LEU A 43 5.511 1.008 -9.785 1.00 0.00 C ATOM 638 CD1 LEU A 43 6.360 0.273 -8.759 1.00 0.00 C ATOM 639 CD2 LEU A 43 4.070 1.118 -9.307 1.00 0.00 C ATOM 0 H LEU A 43 4.857 3.634 -8.093 1.00 0.00 H new ATOM 0 HA LEU A 43 7.559 2.508 -8.501 1.00 0.00 H new ATOM 0 HB2 LEU A 43 5.293 3.027 -10.457 1.00 0.00 H new ATOM 0 HB3 LEU A 43 6.838 2.302 -10.854 1.00 0.00 H new ATOM 0 HG LEU A 43 5.522 0.436 -10.713 1.00 0.00 H new ATOM 0 HD11 LEU A 43 5.933 -0.712 -8.572 1.00 0.00 H new ATOM 0 HD12 LEU A 43 7.375 0.162 -9.140 1.00 0.00 H new ATOM 0 HD13 LEU A 43 6.381 0.842 -7.830 1.00 0.00 H new ATOM 0 HD21 LEU A 43 3.674 0.121 -9.112 1.00 0.00 H new ATOM 0 HD22 LEU A 43 4.034 1.708 -8.391 1.00 0.00 H new ATOM 0 HD23 LEU A 43 3.468 1.603 -10.075 1.00 0.00 H new ATOM 651 N ALA A 44 7.390 5.387 -8.365 1.00 0.00 N ATOM 652 CA ALA A 44 7.903 6.720 -8.653 1.00 0.00 C ATOM 653 C ALA A 44 9.300 6.652 -9.262 1.00 0.00 C ATOM 654 O ALA A 44 9.585 7.310 -10.261 1.00 0.00 O ATOM 655 CB ALA A 44 7.918 7.565 -7.388 1.00 0.00 C ATOM 0 H ALA A 44 7.132 5.236 -7.390 1.00 0.00 H new ATOM 0 HA ALA A 44 7.240 7.187 -9.381 1.00 0.00 H new ATOM 0 HB1 ALA A 44 8.304 8.558 -7.618 1.00 0.00 H new ATOM 0 HB2 ALA A 44 6.905 7.651 -6.996 1.00 0.00 H new ATOM 0 HB3 ALA A 44 8.557 7.092 -6.642 1.00 0.00 H new ATOM 661 N ASN A 45 10.168 5.852 -8.651 1.00 0.00 N ATOM 662 CA ASN A 45 11.536 5.698 -9.132 1.00 0.00 C ATOM 663 C ASN A 45 11.775 4.284 -9.651 1.00 0.00 C ATOM 664 O ASN A 45 12.870 3.957 -10.108 1.00 0.00 O ATOM 665 CB ASN A 45 12.531 6.019 -8.015 1.00 0.00 C ATOM 666 CG ASN A 45 12.280 7.377 -7.390 1.00 0.00 C ATOM 667 OD1 ASN A 45 11.693 7.478 -6.312 1.00 0.00 O ATOM 668 ND2 ASN A 45 12.726 8.430 -8.065 1.00 0.00 N ATOM 0 H ASN A 45 9.948 5.300 -7.822 1.00 0.00 H new ATOM 0 HA ASN A 45 11.686 6.397 -9.955 1.00 0.00 H new ATOM 0 HB2 ASN A 45 12.469 5.250 -7.245 1.00 0.00 H new ATOM 0 HB3 ASN A 45 13.544 5.988 -8.415 1.00 0.00 H new ATOM 0 HD21 ASN A 45 12.587 9.370 -7.694 1.00 0.00 H new ATOM 0 HD22 ASN A 45 13.207 8.299 -8.955 1.00 0.00 H new ATOM 675 N GLU A 46 10.742 3.450 -9.578 1.00 0.00 N ATOM 676 CA GLU A 46 10.840 2.071 -10.040 1.00 0.00 C ATOM 677 C GLU A 46 10.137 1.895 -11.383 1.00 0.00 C ATOM 678 O GLU A 46 9.485 2.814 -11.881 1.00 0.00 O ATOM 679 CB GLU A 46 10.234 1.119 -9.007 1.00 0.00 C ATOM 680 CG GLU A 46 10.984 1.096 -7.686 1.00 0.00 C ATOM 681 CD GLU A 46 10.921 2.424 -6.956 1.00 0.00 C ATOM 682 OE1 GLU A 46 9.798 2.911 -6.706 1.00 0.00 O ATOM 683 OE2 GLU A 46 11.994 2.976 -6.636 1.00 0.00 O ATOM 0 H GLU A 46 9.828 3.706 -9.203 1.00 0.00 H new ATOM 0 HA GLU A 46 11.896 1.833 -10.168 1.00 0.00 H new ATOM 0 HB2 GLU A 46 9.199 1.408 -8.823 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.215 0.111 -9.422 1.00 0.00 H new ATOM 0 HG2 GLU A 46 10.567 0.316 -7.049 1.00 0.00 H new ATOM 0 HG3 GLU A 46 12.026 0.835 -7.869 1.00 0.00 H new ATOM 690 N THR A 47 10.275 0.709 -11.966 1.00 0.00 N ATOM 691 CA THR A 47 9.656 0.412 -13.252 1.00 0.00 C ATOM 692 C THR A 47 8.189 0.036 -13.082 1.00 0.00 C ATOM 693 O THR A 47 7.800 -0.543 -12.067 1.00 0.00 O ATOM 694 CB THR A 47 10.387 -0.733 -13.977 1.00 0.00 C ATOM 695 OG1 THR A 47 11.803 -0.588 -13.820 1.00 0.00 O ATOM 696 CG2 THR A 47 10.035 -0.749 -15.457 1.00 0.00 C ATOM 0 H THR A 47 10.810 -0.062 -11.568 1.00 0.00 H new ATOM 0 HA THR A 47 9.729 1.318 -13.854 1.00 0.00 H new ATOM 0 HB THR A 47 10.067 -1.676 -13.534 1.00 0.00 H new ATOM 0 HG1 THR A 47 12.260 -1.321 -14.283 1.00 0.00 H new ATOM 0 HG21 THR A 47 10.563 -1.566 -15.948 1.00 0.00 H new ATOM 0 HG22 THR A 47 8.960 -0.890 -15.574 1.00 0.00 H new ATOM 0 HG23 THR A 47 10.329 0.197 -15.911 1.00 0.00 H new ATOM 704 N PHE A 48 7.378 0.368 -14.081 1.00 0.00 N ATOM 705 CA PHE A 48 5.952 0.064 -14.042 1.00 0.00 C ATOM 706 C PHE A 48 5.457 -0.403 -15.407 1.00 0.00 C ATOM 707 O PHE A 48 6.049 -0.081 -16.438 1.00 0.00 O ATOM 708 CB PHE A 48 5.160 1.294 -13.593 1.00 0.00 C ATOM 709 CG PHE A 48 5.203 2.427 -14.579 1.00 0.00 C ATOM 710 CD1 PHE A 48 4.284 2.498 -15.613 1.00 0.00 C ATOM 711 CD2 PHE A 48 6.162 3.421 -14.470 1.00 0.00 C ATOM 712 CE1 PHE A 48 4.322 3.539 -16.521 1.00 0.00 C ATOM 713 CE2 PHE A 48 6.205 4.465 -15.375 1.00 0.00 C ATOM 714 CZ PHE A 48 5.283 4.524 -16.402 1.00 0.00 C ATOM 0 H PHE A 48 7.684 0.848 -14.928 1.00 0.00 H new ATOM 0 HA PHE A 48 5.797 -0.742 -13.325 1.00 0.00 H new ATOM 0 HB2 PHE A 48 4.122 1.007 -13.426 1.00 0.00 H new ATOM 0 HB3 PHE A 48 5.552 1.640 -12.637 1.00 0.00 H new ATOM 0 HD1 PHE A 48 3.530 1.731 -15.711 1.00 0.00 H new ATOM 0 HD2 PHE A 48 6.885 3.380 -13.668 1.00 0.00 H new ATOM 0 HE1 PHE A 48 3.601 3.582 -17.323 1.00 0.00 H new ATOM 0 HE2 PHE A 48 6.958 5.233 -15.279 1.00 0.00 H new ATOM 0 HZ PHE A 48 5.314 5.339 -17.110 1.00 0.00 H new ATOM 724 N VAL A 49 4.369 -1.166 -15.406 1.00 0.00 N ATOM 725 CA VAL A 49 3.793 -1.678 -16.644 1.00 0.00 C ATOM 726 C VAL A 49 2.293 -1.415 -16.702 1.00 0.00 C ATOM 727 O VAL A 49 1.594 -1.522 -15.695 1.00 0.00 O ATOM 728 CB VAL A 49 4.044 -3.190 -16.796 1.00 0.00 C ATOM 729 CG1 VAL A 49 3.409 -3.711 -18.076 1.00 0.00 C ATOM 730 CG2 VAL A 49 5.536 -3.487 -16.772 1.00 0.00 C ATOM 0 H VAL A 49 3.868 -1.443 -14.562 1.00 0.00 H new ATOM 0 HA VAL A 49 4.283 -1.151 -17.463 1.00 0.00 H new ATOM 0 HB VAL A 49 3.581 -3.704 -15.954 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.597 -4.781 -18.166 1.00 0.00 H new ATOM 0 HG12 VAL A 49 2.334 -3.532 -18.048 1.00 0.00 H new ATOM 0 HG13 VAL A 49 3.840 -3.194 -18.933 1.00 0.00 H new ATOM 0 HG21 VAL A 49 5.695 -4.560 -16.881 1.00 0.00 H new ATOM 0 HG22 VAL A 49 6.025 -2.963 -17.593 1.00 0.00 H new ATOM 0 HG23 VAL A 49 5.959 -3.151 -15.825 1.00 0.00 H new ATOM 740 N ALA A 50 1.804 -1.071 -17.889 1.00 0.00 N ATOM 741 CA ALA A 50 0.385 -0.795 -18.080 1.00 0.00 C ATOM 742 C ALA A 50 -0.273 -1.871 -18.936 1.00 0.00 C ATOM 743 O ALA A 50 -0.027 -1.959 -20.139 1.00 0.00 O ATOM 744 CB ALA A 50 0.195 0.576 -18.713 1.00 0.00 C ATOM 0 H ALA A 50 2.369 -0.977 -18.733 1.00 0.00 H new ATOM 0 HA ALA A 50 -0.096 -0.801 -17.102 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -0.869 0.769 -18.850 1.00 0.00 H new ATOM 0 HB2 ALA A 50 0.622 1.339 -18.062 1.00 0.00 H new ATOM 0 HB3 ALA A 50 0.696 0.603 -19.681 1.00 0.00 H new ATOM 750 N LYS A 51 -1.111 -2.689 -18.308 1.00 0.00 N ATOM 751 CA LYS A 51 -1.806 -3.761 -19.012 1.00 0.00 C ATOM 752 C LYS A 51 -3.247 -3.885 -18.527 1.00 0.00 C ATOM 753 O LYS A 51 -3.510 -3.873 -17.324 1.00 0.00 O ATOM 754 CB LYS A 51 -1.073 -5.089 -18.813 1.00 0.00 C ATOM 755 CG LYS A 51 -0.016 -5.364 -19.867 1.00 0.00 C ATOM 756 CD LYS A 51 0.814 -6.589 -19.519 1.00 0.00 C ATOM 757 CE LYS A 51 2.137 -6.598 -20.269 1.00 0.00 C ATOM 758 NZ LYS A 51 3.116 -7.537 -19.656 1.00 0.00 N ATOM 0 H LYS A 51 -1.326 -2.630 -17.313 1.00 0.00 H new ATOM 0 HA LYS A 51 -1.819 -3.516 -20.074 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -0.603 -5.091 -17.830 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -1.801 -5.901 -18.820 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -0.496 -5.511 -20.835 1.00 0.00 H new ATOM 0 HG3 LYS A 51 0.637 -4.497 -19.964 1.00 0.00 H new ATOM 0 HD2 LYS A 51 1.003 -6.609 -18.446 1.00 0.00 H new ATOM 0 HD3 LYS A 51 0.252 -7.491 -19.760 1.00 0.00 H new ATOM 0 HE2 LYS A 51 1.964 -6.881 -21.307 1.00 0.00 H new ATOM 0 HE3 LYS A 51 2.556 -5.592 -20.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 4.004 -7.514 -20.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 3.301 -7.253 -18.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 2.727 -8.502 -19.670 1.00 0.00 H new ATOM 772 N ASP A 52 -4.175 -4.006 -19.469 1.00 0.00 N ATOM 773 CA ASP A 52 -5.589 -4.136 -19.137 1.00 0.00 C ATOM 774 C ASP A 52 -6.079 -2.918 -18.359 1.00 0.00 C ATOM 775 O ASP A 52 -6.808 -3.049 -17.377 1.00 0.00 O ATOM 776 CB ASP A 52 -5.829 -5.407 -18.321 1.00 0.00 C ATOM 777 CG ASP A 52 -7.212 -5.987 -18.546 1.00 0.00 C ATOM 778 OD1 ASP A 52 -8.119 -5.224 -18.939 1.00 0.00 O ATOM 779 OD2 ASP A 52 -7.387 -7.204 -18.330 1.00 0.00 O ATOM 0 H ASP A 52 -3.974 -4.017 -20.469 1.00 0.00 H new ATOM 0 HA ASP A 52 -6.151 -4.200 -20.069 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -5.078 -6.152 -18.585 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -5.699 -5.185 -17.262 1.00 0.00 H new ATOM 784 N ASN A 53 -5.672 -1.734 -18.806 1.00 0.00 N ATOM 785 CA ASN A 53 -6.067 -0.493 -18.151 1.00 0.00 C ATOM 786 C ASN A 53 -5.832 -0.573 -16.646 1.00 0.00 C ATOM 787 O ASN A 53 -6.598 -0.022 -15.855 1.00 0.00 O ATOM 788 CB ASN A 53 -7.540 -0.190 -18.432 1.00 0.00 C ATOM 789 CG ASN A 53 -7.738 0.561 -19.734 1.00 0.00 C ATOM 790 OD1 ASN A 53 -8.243 0.009 -20.712 1.00 0.00 O ATOM 791 ND2 ASN A 53 -7.339 1.828 -19.753 1.00 0.00 N ATOM 0 H ASN A 53 -5.069 -1.608 -19.619 1.00 0.00 H new ATOM 0 HA ASN A 53 -5.453 0.312 -18.555 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -8.100 -1.124 -18.466 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -7.950 0.398 -17.611 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -7.446 2.384 -20.602 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -6.926 2.245 -18.919 1.00 0.00 H new ATOM 798 N LYS A 54 -4.765 -1.263 -16.255 1.00 0.00 N ATOM 799 CA LYS A 54 -4.426 -1.415 -14.845 1.00 0.00 C ATOM 800 C LYS A 54 -2.918 -1.317 -14.635 1.00 0.00 C ATOM 801 O LYS A 54 -2.143 -1.999 -15.306 1.00 0.00 O ATOM 802 CB LYS A 54 -4.938 -2.756 -14.318 1.00 0.00 C ATOM 803 CG LYS A 54 -6.351 -2.692 -13.763 1.00 0.00 C ATOM 804 CD LYS A 54 -6.354 -2.342 -12.284 1.00 0.00 C ATOM 805 CE LYS A 54 -7.633 -2.804 -11.604 1.00 0.00 C ATOM 806 NZ LYS A 54 -7.665 -4.283 -11.428 1.00 0.00 N ATOM 0 H LYS A 54 -4.120 -1.726 -16.896 1.00 0.00 H new ATOM 0 HA LYS A 54 -4.906 -0.607 -14.292 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -4.906 -3.490 -15.124 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -4.266 -3.111 -13.537 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -6.926 -1.949 -14.315 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -6.845 -3.652 -13.912 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -5.495 -2.804 -11.798 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -6.246 -1.264 -12.164 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -7.722 -2.321 -10.631 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -8.493 -2.490 -12.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -8.400 -4.534 -10.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -7.878 -4.737 -12.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -6.740 -4.612 -11.085 1.00 0.00 H new ATOM 820 N ILE A 55 -2.510 -0.465 -13.700 1.00 0.00 N ATOM 821 CA ILE A 55 -1.095 -0.281 -13.401 1.00 0.00 C ATOM 822 C ILE A 55 -0.557 -1.433 -12.559 1.00 0.00 C ATOM 823 O ILE A 55 -1.184 -1.851 -11.585 1.00 0.00 O ATOM 824 CB ILE A 55 -0.845 1.044 -12.657 1.00 0.00 C ATOM 825 CG1 ILE A 55 -1.502 2.206 -13.405 1.00 0.00 C ATOM 826 CG2 ILE A 55 0.648 1.288 -12.496 1.00 0.00 C ATOM 827 CD1 ILE A 55 -0.818 2.549 -14.709 1.00 0.00 C ATOM 0 H ILE A 55 -3.139 0.108 -13.137 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.571 -0.257 -14.356 1.00 0.00 H new ATOM 0 HB ILE A 55 -1.291 0.976 -11.665 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -2.544 1.956 -13.605 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -1.504 3.086 -12.762 1.00 0.00 H new ATOM 0 HG21 ILE A 55 0.808 2.228 -11.968 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.091 0.472 -11.925 1.00 0.00 H new ATOM 0 HG23 ILE A 55 1.116 1.339 -13.479 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -1.337 3.381 -15.184 1.00 0.00 H new ATOM 0 HD12 ILE A 55 0.217 2.831 -14.514 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -0.840 1.683 -15.370 1.00 0.00 H new ATOM 839 N LEU A 56 0.610 -1.941 -12.940 1.00 0.00 N ATOM 840 CA LEU A 56 1.236 -3.045 -12.219 1.00 0.00 C ATOM 841 C LEU A 56 2.756 -2.921 -12.247 1.00 0.00 C ATOM 842 O LEU A 56 3.319 -2.248 -13.111 1.00 0.00 O ATOM 843 CB LEU A 56 0.810 -4.383 -12.826 1.00 0.00 C ATOM 844 CG LEU A 56 -0.678 -4.719 -12.734 1.00 0.00 C ATOM 845 CD1 LEU A 56 -0.997 -5.960 -13.552 1.00 0.00 C ATOM 846 CD2 LEU A 56 -1.092 -4.913 -11.282 1.00 0.00 C ATOM 0 H LEU A 56 1.142 -1.607 -13.744 1.00 0.00 H new ATOM 0 HA LEU A 56 0.906 -3.003 -11.181 1.00 0.00 H new ATOM 0 HB2 LEU A 56 1.099 -4.391 -13.877 1.00 0.00 H new ATOM 0 HB3 LEU A 56 1.372 -5.177 -12.335 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.246 -3.884 -13.144 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -2.061 -6.183 -13.474 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.739 -5.784 -14.596 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.420 -6.804 -13.173 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.155 -5.152 -11.235 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.517 -5.730 -10.846 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -0.901 -3.997 -10.724 1.00 0.00 H new ATOM 858 N CYS A 57 3.415 -3.576 -11.298 1.00 0.00 N ATOM 859 CA CYS A 57 4.870 -3.542 -11.213 1.00 0.00 C ATOM 860 C CYS A 57 5.475 -4.853 -11.708 1.00 0.00 C ATOM 861 O CYS A 57 4.764 -5.833 -11.926 1.00 0.00 O ATOM 862 CB CYS A 57 5.312 -3.276 -9.773 1.00 0.00 C ATOM 863 SG CYS A 57 5.208 -4.731 -8.682 1.00 0.00 S ATOM 0 H CYS A 57 2.964 -4.138 -10.576 1.00 0.00 H new ATOM 0 HA CYS A 57 5.227 -2.733 -11.851 1.00 0.00 H new ATOM 0 HB2 CYS A 57 6.340 -2.914 -9.781 1.00 0.00 H new ATOM 0 HB3 CYS A 57 4.696 -2.479 -9.357 1.00 0.00 H new ATOM 868 N ASN A 58 6.792 -4.861 -11.883 1.00 0.00 N ATOM 869 CA ASN A 58 7.493 -6.051 -12.353 1.00 0.00 C ATOM 870 C ASN A 58 7.198 -7.247 -11.452 1.00 0.00 C ATOM 871 O ASN A 58 6.743 -8.292 -11.918 1.00 0.00 O ATOM 872 CB ASN A 58 9.001 -5.794 -12.401 1.00 0.00 C ATOM 873 CG ASN A 58 9.416 -5.022 -13.638 1.00 0.00 C ATOM 874 OD1 ASN A 58 8.688 -4.978 -14.630 1.00 0.00 O ATOM 875 ND2 ASN A 58 10.592 -4.408 -13.585 1.00 0.00 N ATOM 0 H ASN A 58 7.395 -4.058 -11.707 1.00 0.00 H new ATOM 0 HA ASN A 58 7.138 -6.279 -13.358 1.00 0.00 H new ATOM 0 HB2 ASN A 58 9.301 -5.239 -11.512 1.00 0.00 H new ATOM 0 HB3 ASN A 58 9.530 -6.747 -12.376 1.00 0.00 H new ATOM 0 HD21 ASN A 58 10.925 -3.873 -14.387 1.00 0.00 H new ATOM 0 HD22 ASN A 58 11.163 -4.471 -12.742 1.00 0.00 H new ATOM 882 N LYS A 59 7.460 -7.086 -10.160 1.00 0.00 N ATOM 883 CA LYS A 59 7.221 -8.150 -9.192 1.00 0.00 C ATOM 884 C LYS A 59 5.891 -8.845 -9.464 1.00 0.00 C ATOM 885 O LYS A 59 5.775 -10.063 -9.325 1.00 0.00 O ATOM 886 CB LYS A 59 7.232 -7.586 -7.770 1.00 0.00 C ATOM 887 CG LYS A 59 8.617 -7.199 -7.279 1.00 0.00 C ATOM 888 CD LYS A 59 8.993 -5.795 -7.722 1.00 0.00 C ATOM 889 CE LYS A 59 9.983 -5.155 -6.761 1.00 0.00 C ATOM 890 NZ LYS A 59 11.333 -5.773 -6.862 1.00 0.00 N ATOM 0 H LYS A 59 7.838 -6.228 -9.758 1.00 0.00 H new ATOM 0 HA LYS A 59 8.021 -8.884 -9.292 1.00 0.00 H new ATOM 0 HB2 LYS A 59 6.584 -6.710 -7.731 1.00 0.00 H new ATOM 0 HB3 LYS A 59 6.809 -8.327 -7.091 1.00 0.00 H new ATOM 0 HG2 LYS A 59 8.648 -7.259 -6.191 1.00 0.00 H new ATOM 0 HG3 LYS A 59 9.351 -7.910 -7.659 1.00 0.00 H new ATOM 0 HD2 LYS A 59 9.426 -5.831 -8.722 1.00 0.00 H new ATOM 0 HD3 LYS A 59 8.096 -5.180 -7.785 1.00 0.00 H new ATOM 0 HE2 LYS A 59 10.055 -4.088 -6.972 1.00 0.00 H new ATOM 0 HE3 LYS A 59 9.614 -5.254 -5.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 11.978 -5.309 -6.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 11.269 -6.786 -6.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 11.697 -5.656 -7.829 1.00 0.00 H new ATOM 904 N CYS A 60 4.890 -8.064 -9.855 1.00 0.00 N ATOM 905 CA CYS A 60 3.568 -8.604 -10.148 1.00 0.00 C ATOM 906 C CYS A 60 3.514 -9.172 -11.563 1.00 0.00 C ATOM 907 O CYS A 60 3.255 -10.360 -11.759 1.00 0.00 O ATOM 908 CB CYS A 60 2.502 -7.519 -9.981 1.00 0.00 C ATOM 909 SG CYS A 60 2.082 -7.150 -8.248 1.00 0.00 S ATOM 0 H CYS A 60 4.969 -7.054 -9.976 1.00 0.00 H new ATOM 0 HA CYS A 60 3.368 -9.411 -9.443 1.00 0.00 H new ATOM 0 HB2 CYS A 60 2.851 -6.605 -10.462 1.00 0.00 H new ATOM 0 HB3 CYS A 60 1.598 -7.829 -10.505 1.00 0.00 H new ATOM 914 N THR A 61 3.761 -8.315 -12.549 1.00 0.00 N ATOM 915 CA THR A 61 3.740 -8.730 -13.946 1.00 0.00 C ATOM 916 C THR A 61 4.351 -10.116 -14.117 1.00 0.00 C ATOM 917 O THR A 61 3.903 -10.905 -14.950 1.00 0.00 O ATOM 918 CB THR A 61 4.500 -7.732 -14.840 1.00 0.00 C ATOM 919 OG1 THR A 61 5.892 -7.736 -14.504 1.00 0.00 O ATOM 920 CG2 THR A 61 3.939 -6.327 -14.682 1.00 0.00 C ATOM 0 H THR A 61 3.978 -7.329 -12.405 1.00 0.00 H new ATOM 0 HA THR A 61 2.694 -8.757 -14.252 1.00 0.00 H new ATOM 0 HB THR A 61 4.376 -8.040 -15.878 1.00 0.00 H new ATOM 0 HG1 THR A 61 5.999 -7.966 -13.557 1.00 0.00 H new ATOM 0 HG21 THR A 61 4.492 -5.640 -15.323 1.00 0.00 H new ATOM 0 HG22 THR A 61 2.887 -6.321 -14.966 1.00 0.00 H new ATOM 0 HG23 THR A 61 4.036 -6.011 -13.643 1.00 0.00 H new ATOM 928 N THR A 62 5.376 -10.408 -13.323 1.00 0.00 N ATOM 929 CA THR A 62 6.049 -11.699 -13.387 1.00 0.00 C ATOM 930 C THR A 62 5.055 -12.825 -13.647 1.00 0.00 C ATOM 931 O THR A 62 5.254 -13.648 -14.541 1.00 0.00 O ATOM 932 CB THR A 62 6.817 -11.998 -12.085 1.00 0.00 C ATOM 933 OG1 THR A 62 7.851 -11.026 -11.893 1.00 0.00 O ATOM 934 CG2 THR A 62 7.424 -13.392 -12.123 1.00 0.00 C ATOM 0 H THR A 62 5.758 -9.767 -12.628 1.00 0.00 H new ATOM 0 HA THR A 62 6.757 -11.645 -14.214 1.00 0.00 H new ATOM 0 HB THR A 62 6.114 -11.949 -11.254 1.00 0.00 H new ATOM 0 HG1 THR A 62 7.449 -10.139 -11.779 1.00 0.00 H new ATOM 0 HG21 THR A 62 7.961 -13.580 -11.193 1.00 0.00 H new ATOM 0 HG22 THR A 62 6.631 -14.131 -12.240 1.00 0.00 H new ATOM 0 HG23 THR A 62 8.115 -13.465 -12.963 1.00 0.00 H new ATOM 942 N ARG A 63 3.984 -12.855 -12.861 1.00 0.00 N ATOM 943 CA ARG A 63 2.958 -13.881 -13.006 1.00 0.00 C ATOM 944 C ARG A 63 1.614 -13.259 -13.373 1.00 0.00 C ATOM 945 O ARG A 63 1.457 -12.039 -13.344 1.00 0.00 O ATOM 946 CB ARG A 63 2.823 -14.685 -11.712 1.00 0.00 C ATOM 947 CG ARG A 63 2.223 -13.892 -10.562 1.00 0.00 C ATOM 948 CD ARG A 63 1.889 -14.789 -9.381 1.00 0.00 C ATOM 949 NE ARG A 63 1.509 -14.020 -8.199 1.00 0.00 N ATOM 950 CZ ARG A 63 1.577 -14.495 -6.960 1.00 0.00 C ATOM 951 NH1 ARG A 63 2.008 -15.730 -6.743 1.00 0.00 N ATOM 952 NH2 ARG A 63 1.214 -13.733 -5.936 1.00 0.00 N ATOM 0 H ARG A 63 3.804 -12.181 -12.117 1.00 0.00 H new ATOM 0 HA ARG A 63 3.261 -14.550 -13.811 1.00 0.00 H new ATOM 0 HB2 ARG A 63 2.202 -15.561 -11.901 1.00 0.00 H new ATOM 0 HB3 ARG A 63 3.807 -15.050 -11.416 1.00 0.00 H new ATOM 0 HG2 ARG A 63 2.924 -13.119 -10.247 1.00 0.00 H new ATOM 0 HG3 ARG A 63 1.320 -13.384 -10.901 1.00 0.00 H new ATOM 0 HD2 ARG A 63 1.074 -15.460 -9.654 1.00 0.00 H new ATOM 0 HD3 ARG A 63 2.751 -15.414 -9.145 1.00 0.00 H new ATOM 0 HE ARG A 63 1.173 -13.066 -8.332 1.00 0.00 H new ATOM 0 HH11 ARG A 63 2.288 -16.318 -7.528 1.00 0.00 H new ATOM 0 HH12 ARG A 63 2.059 -16.092 -5.791 1.00 0.00 H new ATOM 0 HH21 ARG A 63 0.883 -12.782 -6.100 1.00 0.00 H new ATOM 0 HH22 ARG A 63 1.266 -14.098 -4.985 1.00 0.00 H new ATOM 966 N GLU A 64 0.650 -14.106 -13.719 1.00 0.00 N ATOM 967 CA GLU A 64 -0.680 -13.638 -14.092 1.00 0.00 C ATOM 968 C GLU A 64 -1.734 -14.699 -13.794 1.00 0.00 C ATOM 969 O GLU A 64 -1.407 -15.834 -13.444 1.00 0.00 O ATOM 970 CB GLU A 64 -0.716 -13.270 -15.577 1.00 0.00 C ATOM 971 CG GLU A 64 -0.085 -14.317 -16.479 1.00 0.00 C ATOM 972 CD GLU A 64 -0.811 -15.647 -16.426 1.00 0.00 C ATOM 973 OE1 GLU A 64 -1.766 -15.833 -17.208 1.00 0.00 O ATOM 974 OE2 GLU A 64 -0.424 -16.502 -15.601 1.00 0.00 O ATOM 0 H GLU A 64 0.765 -15.119 -13.749 1.00 0.00 H new ATOM 0 HA GLU A 64 -0.905 -12.752 -13.499 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -1.752 -13.118 -15.880 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -0.200 -12.321 -15.720 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -0.080 -13.951 -17.506 1.00 0.00 H new ATOM 0 HG3 GLU A 64 0.955 -14.463 -16.187 1.00 0.00 H new ATOM 981 N ASP A 65 -3.000 -14.323 -13.934 1.00 0.00 N ATOM 982 CA ASP A 65 -4.104 -15.242 -13.680 1.00 0.00 C ATOM 983 C ASP A 65 -5.061 -15.282 -14.867 1.00 0.00 C ATOM 984 O ASP A 65 -6.260 -15.507 -14.703 1.00 0.00 O ATOM 985 CB ASP A 65 -4.858 -14.830 -12.415 1.00 0.00 C ATOM 986 CG ASP A 65 -4.938 -13.324 -12.253 1.00 0.00 C ATOM 987 OD1 ASP A 65 -5.878 -12.717 -12.808 1.00 0.00 O ATOM 988 OD2 ASP A 65 -4.062 -12.754 -11.571 1.00 0.00 O ATOM 0 H ASP A 65 -3.288 -13.388 -14.222 1.00 0.00 H new ATOM 0 HA ASP A 65 -3.689 -16.240 -13.537 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -5.866 -15.243 -12.446 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -4.363 -15.260 -11.544 1.00 0.00 H new ATOM 993 N SER A 66 -4.523 -15.062 -16.063 1.00 0.00 N ATOM 994 CA SER A 66 -5.330 -15.069 -17.277 1.00 0.00 C ATOM 995 C SER A 66 -5.488 -16.487 -17.817 1.00 0.00 C ATOM 996 O SER A 66 -4.731 -17.396 -17.476 1.00 0.00 O ATOM 997 CB SER A 66 -4.694 -14.173 -18.342 1.00 0.00 C ATOM 998 OG SER A 66 -5.166 -12.841 -18.237 1.00 0.00 O ATOM 0 H SER A 66 -3.532 -14.877 -16.217 1.00 0.00 H new ATOM 0 HA SER A 66 -6.318 -14.682 -17.029 1.00 0.00 H new ATOM 0 HB2 SER A 66 -3.610 -14.187 -18.233 1.00 0.00 H new ATOM 0 HB3 SER A 66 -4.920 -14.565 -19.334 1.00 0.00 H new ATOM 0 HG SER A 66 -4.743 -12.289 -18.927 1.00 0.00 H new ATOM 1004 N PRO A 67 -6.496 -16.682 -18.680 1.00 0.00 N ATOM 1005 CA PRO A 67 -6.778 -17.986 -19.286 1.00 0.00 C ATOM 1006 C PRO A 67 -5.709 -18.402 -20.290 1.00 0.00 C ATOM 1007 O PRO A 67 -4.819 -17.620 -20.625 1.00 0.00 O ATOM 1008 CB PRO A 67 -8.118 -17.767 -19.993 1.00 0.00 C ATOM 1009 CG PRO A 67 -8.166 -16.304 -20.269 1.00 0.00 C ATOM 1010 CD PRO A 67 -7.438 -15.644 -19.131 1.00 0.00 C ATOM 0 HA PRO A 67 -6.797 -18.784 -18.544 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -8.179 -18.346 -20.915 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -8.953 -18.079 -19.365 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -7.692 -16.071 -21.223 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -9.196 -15.952 -20.330 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -6.918 -14.743 -19.456 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -8.121 -15.348 -18.335 1.00 0.00 H new ATOM 1018 N LYS A 68 -5.801 -19.639 -20.768 1.00 0.00 N ATOM 1019 CA LYS A 68 -4.842 -20.159 -21.735 1.00 0.00 C ATOM 1020 C LYS A 68 -5.558 -20.773 -22.934 1.00 0.00 C ATOM 1021 O LYS A 68 -6.763 -21.023 -22.890 1.00 0.00 O ATOM 1022 CB LYS A 68 -3.939 -21.205 -21.077 1.00 0.00 C ATOM 1023 CG LYS A 68 -4.698 -22.386 -20.499 1.00 0.00 C ATOM 1024 CD LYS A 68 -3.964 -22.995 -19.316 1.00 0.00 C ATOM 1025 CE LYS A 68 -2.832 -23.904 -19.770 1.00 0.00 C ATOM 1026 NZ LYS A 68 -2.413 -24.848 -18.696 1.00 0.00 N ATOM 0 H LYS A 68 -6.531 -20.300 -20.501 1.00 0.00 H new ATOM 0 HA LYS A 68 -4.230 -19.328 -22.085 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -3.223 -21.569 -21.813 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -3.365 -20.729 -20.282 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -5.691 -22.063 -20.186 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -4.838 -23.143 -21.271 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -3.564 -22.200 -18.687 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -4.665 -23.563 -18.705 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -3.149 -24.469 -20.646 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -1.979 -23.297 -20.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -1.640 -25.450 -19.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -2.086 -24.309 -17.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -3.220 -25.445 -18.424 1.00 0.00 H new ATOM 1040 N CYS A 69 -4.809 -21.015 -24.005 1.00 0.00 N ATOM 1041 CA CYS A 69 -5.371 -21.600 -25.216 1.00 0.00 C ATOM 1042 C CYS A 69 -4.931 -23.053 -25.373 1.00 0.00 C ATOM 1043 O CYS A 69 -4.023 -23.516 -24.682 1.00 0.00 O ATOM 1044 CB CYS A 69 -4.946 -20.791 -26.443 1.00 0.00 C ATOM 1045 SG CYS A 69 -5.888 -21.181 -27.953 1.00 0.00 S ATOM 0 H CYS A 69 -3.810 -20.815 -24.058 1.00 0.00 H new ATOM 0 HA CYS A 69 -6.457 -21.575 -25.131 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -5.058 -19.730 -26.222 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -3.887 -20.967 -26.632 1.00 0.00 H new ATOM 1050 N LYS A 70 -5.580 -23.766 -26.287 1.00 0.00 N ATOM 1051 CA LYS A 70 -5.256 -25.166 -26.537 1.00 0.00 C ATOM 1052 C LYS A 70 -4.723 -25.355 -27.954 1.00 0.00 C ATOM 1053 O LYS A 70 -3.982 -26.299 -28.227 1.00 0.00 O ATOM 1054 CB LYS A 70 -6.492 -26.043 -26.324 1.00 0.00 C ATOM 1055 CG LYS A 70 -6.164 -27.505 -26.074 1.00 0.00 C ATOM 1056 CD LYS A 70 -5.826 -27.758 -24.614 1.00 0.00 C ATOM 1057 CE LYS A 70 -5.409 -29.202 -24.381 1.00 0.00 C ATOM 1058 NZ LYS A 70 -6.555 -30.141 -24.531 1.00 0.00 N ATOM 0 H LYS A 70 -6.334 -23.398 -26.867 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.480 -25.466 -25.832 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -7.060 -25.657 -25.478 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -7.136 -25.968 -27.200 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -7.013 -28.124 -26.365 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.323 -27.803 -26.700 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.021 -27.091 -24.305 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.691 -27.523 -23.993 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.624 -29.472 -25.087 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -4.987 -29.301 -23.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -6.241 -31.109 -24.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -7.315 -29.869 -23.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -6.910 -30.102 -25.508 1.00 0.00 H new ATOM 1072 N GLY A 71 -5.104 -24.451 -28.851 1.00 0.00 N ATOM 1073 CA GLY A 71 -4.654 -24.537 -30.228 1.00 0.00 C ATOM 1074 C GLY A 71 -3.202 -24.132 -30.389 1.00 0.00 C ATOM 1075 O GLY A 71 -2.446 -24.778 -31.115 1.00 0.00 O ATOM 0 H GLY A 71 -5.716 -23.661 -28.649 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -4.785 -25.558 -30.587 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -5.278 -23.897 -30.852 1.00 0.00 H new ATOM 1079 N CYS A 72 -2.811 -23.057 -29.713 1.00 0.00 N ATOM 1080 CA CYS A 72 -1.441 -22.564 -29.786 1.00 0.00 C ATOM 1081 C CYS A 72 -0.788 -22.565 -28.407 1.00 0.00 C ATOM 1082 O CYS A 72 0.404 -22.291 -28.272 1.00 0.00 O ATOM 1083 CB CYS A 72 -1.415 -21.151 -30.373 1.00 0.00 C ATOM 1084 SG CYS A 72 -2.420 -19.944 -29.449 1.00 0.00 S ATOM 0 H CYS A 72 -3.424 -22.510 -29.108 1.00 0.00 H new ATOM 0 HA CYS A 72 -0.876 -23.231 -30.437 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -0.383 -20.801 -30.404 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -1.769 -21.190 -31.403 1.00 0.00 H new ATOM 1089 N PHE A 73 -1.578 -22.877 -27.385 1.00 0.00 N ATOM 1090 CA PHE A 73 -1.079 -22.914 -26.015 1.00 0.00 C ATOM 1091 C PHE A 73 -0.410 -21.593 -25.645 1.00 0.00 C ATOM 1092 O PHE A 73 0.742 -21.568 -25.210 1.00 0.00 O ATOM 1093 CB PHE A 73 -0.088 -24.067 -25.842 1.00 0.00 C ATOM 1094 CG PHE A 73 -0.732 -25.350 -25.404 1.00 0.00 C ATOM 1095 CD1 PHE A 73 -0.896 -25.635 -24.058 1.00 0.00 C ATOM 1096 CD2 PHE A 73 -1.174 -26.273 -26.338 1.00 0.00 C ATOM 1097 CE1 PHE A 73 -1.489 -26.815 -23.651 1.00 0.00 C ATOM 1098 CE2 PHE A 73 -1.769 -27.455 -25.938 1.00 0.00 C ATOM 1099 CZ PHE A 73 -1.925 -27.727 -24.592 1.00 0.00 C ATOM 0 H PHE A 73 -2.567 -23.108 -27.480 1.00 0.00 H new ATOM 0 HA PHE A 73 -1.928 -23.071 -25.349 1.00 0.00 H new ATOM 0 HB2 PHE A 73 0.431 -24.234 -26.786 1.00 0.00 H new ATOM 0 HB3 PHE A 73 0.667 -23.780 -25.110 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -0.556 -24.926 -23.318 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -1.052 -26.067 -27.391 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -1.611 -27.024 -22.598 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -2.111 -28.165 -26.676 1.00 0.00 H new ATOM 0 HZ PHE A 73 -2.387 -28.651 -24.277 1.00 0.00 H new ATOM 1109 N LYS A 74 -1.140 -20.497 -25.821 1.00 0.00 N ATOM 1110 CA LYS A 74 -0.620 -19.172 -25.505 1.00 0.00 C ATOM 1111 C LYS A 74 -1.574 -18.418 -24.586 1.00 0.00 C ATOM 1112 O LYS A 74 -2.789 -18.610 -24.644 1.00 0.00 O ATOM 1113 CB LYS A 74 -0.392 -18.372 -26.790 1.00 0.00 C ATOM 1114 CG LYS A 74 0.748 -18.900 -27.642 1.00 0.00 C ATOM 1115 CD LYS A 74 1.373 -17.799 -28.482 1.00 0.00 C ATOM 1116 CE LYS A 74 2.290 -16.915 -27.650 1.00 0.00 C ATOM 1117 NZ LYS A 74 1.557 -15.767 -27.048 1.00 0.00 N ATOM 0 H LYS A 74 -2.094 -20.500 -26.181 1.00 0.00 H new ATOM 0 HA LYS A 74 0.331 -19.296 -24.988 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -1.309 -18.379 -27.380 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -0.189 -17.333 -26.530 1.00 0.00 H new ATOM 0 HG2 LYS A 74 1.508 -19.344 -26.999 1.00 0.00 H new ATOM 0 HG3 LYS A 74 0.379 -19.692 -28.294 1.00 0.00 H new ATOM 0 HD2 LYS A 74 1.939 -18.242 -29.302 1.00 0.00 H new ATOM 0 HD3 LYS A 74 0.587 -17.191 -28.929 1.00 0.00 H new ATOM 0 HE2 LYS A 74 2.747 -17.509 -26.859 1.00 0.00 H new ATOM 0 HE3 LYS A 74 3.100 -16.541 -28.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 2.174 -14.930 -27.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 0.708 -15.563 -27.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 1.277 -16.006 -26.075 1.00 0.00 H new ATOM 1131 N ALA A 75 -1.018 -17.558 -23.739 1.00 0.00 N ATOM 1132 CA ALA A 75 -1.820 -16.772 -22.810 1.00 0.00 C ATOM 1133 C ALA A 75 -2.819 -15.894 -23.555 1.00 0.00 C ATOM 1134 O ALA A 75 -2.435 -14.947 -24.243 1.00 0.00 O ATOM 1135 CB ALA A 75 -0.922 -15.921 -21.925 1.00 0.00 C ATOM 0 H ALA A 75 -0.014 -17.388 -23.677 1.00 0.00 H new ATOM 0 HA ALA A 75 -2.382 -17.462 -22.180 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -1.535 -15.340 -21.236 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -0.253 -16.567 -21.357 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -0.334 -15.245 -22.546 1.00 0.00 H new ATOM 1141 N ILE A 76 -4.101 -16.213 -23.414 1.00 0.00 N ATOM 1142 CA ILE A 76 -5.155 -15.451 -24.074 1.00 0.00 C ATOM 1143 C ILE A 76 -5.354 -14.095 -23.405 1.00 0.00 C ATOM 1144 O ILE A 76 -5.438 -14.001 -22.181 1.00 0.00 O ATOM 1145 CB ILE A 76 -6.491 -16.216 -24.066 1.00 0.00 C ATOM 1146 CG1 ILE A 76 -6.314 -17.604 -24.685 1.00 0.00 C ATOM 1147 CG2 ILE A 76 -7.556 -15.429 -24.815 1.00 0.00 C ATOM 1148 CD1 ILE A 76 -7.555 -18.465 -24.605 1.00 0.00 C ATOM 0 H ILE A 76 -4.435 -16.994 -22.849 1.00 0.00 H new ATOM 0 HA ILE A 76 -4.838 -15.301 -25.106 1.00 0.00 H new ATOM 0 HB ILE A 76 -6.816 -16.339 -23.033 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -6.026 -17.492 -25.730 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -5.494 -18.116 -24.181 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -8.495 -15.983 -24.801 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -7.698 -14.461 -24.335 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.239 -15.279 -25.847 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -7.356 -19.434 -25.063 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -7.832 -18.608 -23.561 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -8.373 -17.975 -25.134 1.00 0.00 H new ATOM 1160 N VAL A 77 -5.430 -13.046 -24.218 1.00 0.00 N ATOM 1161 CA VAL A 77 -5.623 -11.695 -23.707 1.00 0.00 C ATOM 1162 C VAL A 77 -7.104 -11.380 -23.531 1.00 0.00 C ATOM 1163 O VAL A 77 -7.927 -11.722 -24.379 1.00 0.00 O ATOM 1164 CB VAL A 77 -4.993 -10.645 -24.642 1.00 0.00 C ATOM 1165 CG1 VAL A 77 -4.939 -9.287 -23.961 1.00 0.00 C ATOM 1166 CG2 VAL A 77 -3.605 -11.087 -25.080 1.00 0.00 C ATOM 0 H VAL A 77 -5.361 -13.107 -25.234 1.00 0.00 H new ATOM 0 HA VAL A 77 -5.128 -11.650 -22.737 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.618 -10.554 -25.531 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.491 -8.559 -24.637 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.949 -8.969 -23.703 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -4.338 -9.358 -23.054 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -3.175 -10.334 -25.740 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -2.968 -11.208 -24.204 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -3.676 -12.036 -25.611 1.00 0.00 H new ATOM 1176 N ALA A 78 -7.436 -10.724 -22.424 1.00 0.00 N ATOM 1177 CA ALA A 78 -8.818 -10.359 -22.137 1.00 0.00 C ATOM 1178 C ALA A 78 -9.454 -9.643 -23.324 1.00 0.00 C ATOM 1179 O ALA A 78 -10.617 -9.876 -23.651 1.00 0.00 O ATOM 1180 CB ALA A 78 -8.887 -9.487 -20.893 1.00 0.00 C ATOM 0 H ALA A 78 -6.767 -10.434 -21.711 1.00 0.00 H new ATOM 0 HA ALA A 78 -9.379 -11.275 -21.955 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.925 -9.222 -20.691 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.480 -10.034 -20.042 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -8.306 -8.579 -21.052 1.00 0.00 H new ATOM 1186 N GLY A 79 -8.683 -8.770 -23.965 1.00 0.00 N ATOM 1187 CA GLY A 79 -9.190 -8.033 -25.108 1.00 0.00 C ATOM 1188 C GLY A 79 -8.879 -8.718 -26.424 1.00 0.00 C ATOM 1189 O GLY A 79 -8.349 -8.096 -27.345 1.00 0.00 O ATOM 0 H GLY A 79 -7.717 -8.560 -23.713 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -10.269 -7.914 -25.010 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.758 -7.032 -25.112 1.00 0.00 H new ATOM 1193 N ASP A 80 -9.207 -10.002 -26.512 1.00 0.00 N ATOM 1194 CA ASP A 80 -8.959 -10.772 -27.725 1.00 0.00 C ATOM 1195 C ASP A 80 -10.103 -11.745 -27.995 1.00 0.00 C ATOM 1196 O ASP A 80 -10.612 -12.388 -27.077 1.00 0.00 O ATOM 1197 CB ASP A 80 -7.640 -11.537 -27.608 1.00 0.00 C ATOM 1198 CG ASP A 80 -6.944 -11.699 -28.945 1.00 0.00 C ATOM 1199 OD1 ASP A 80 -6.139 -10.815 -29.307 1.00 0.00 O ATOM 1200 OD2 ASP A 80 -7.204 -12.710 -29.630 1.00 0.00 O ATOM 0 H ASP A 80 -9.645 -10.531 -25.758 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.894 -10.075 -28.561 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -6.979 -11.012 -26.919 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -7.831 -12.521 -27.179 1.00 0.00 H new ATOM 1205 N GLN A 81 -10.502 -11.845 -29.258 1.00 0.00 N ATOM 1206 CA GLN A 81 -11.588 -12.738 -29.647 1.00 0.00 C ATOM 1207 C GLN A 81 -11.197 -14.196 -29.431 1.00 0.00 C ATOM 1208 O GLN A 81 -10.303 -14.715 -30.099 1.00 0.00 O ATOM 1209 CB GLN A 81 -11.963 -12.510 -31.113 1.00 0.00 C ATOM 1210 CG GLN A 81 -12.657 -11.181 -31.363 1.00 0.00 C ATOM 1211 CD GLN A 81 -14.103 -11.182 -30.908 1.00 0.00 C ATOM 1212 OE1 GLN A 81 -14.454 -11.828 -29.920 1.00 0.00 O ATOM 1213 NE2 GLN A 81 -14.951 -10.457 -31.627 1.00 0.00 N ATOM 0 H GLN A 81 -10.091 -11.320 -30.029 1.00 0.00 H new ATOM 0 HA GLN A 81 -12.451 -12.515 -29.019 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -11.061 -12.560 -31.722 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -12.615 -13.319 -31.443 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -12.117 -10.390 -30.842 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -12.615 -10.948 -32.427 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -14.617 -9.937 -32.438 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -15.937 -10.420 -31.368 1.00 0.00 H new ATOM 1222 N ASN A 82 -11.873 -14.852 -28.493 1.00 0.00 N ATOM 1223 CA ASN A 82 -11.595 -16.251 -28.189 1.00 0.00 C ATOM 1224 C ASN A 82 -12.858 -17.098 -28.321 1.00 0.00 C ATOM 1225 O ASN A 82 -13.936 -16.582 -28.615 1.00 0.00 O ATOM 1226 CB ASN A 82 -11.025 -16.383 -26.775 1.00 0.00 C ATOM 1227 CG ASN A 82 -11.532 -15.299 -25.843 1.00 0.00 C ATOM 1228 OD1 ASN A 82 -12.735 -15.177 -25.612 1.00 0.00 O ATOM 1229 ND2 ASN A 82 -10.614 -14.506 -25.304 1.00 0.00 N ATOM 0 H ASN A 82 -12.616 -14.438 -27.931 1.00 0.00 H new ATOM 0 HA ASN A 82 -10.859 -16.614 -28.906 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -11.289 -17.360 -26.370 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -9.937 -16.340 -26.820 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -10.895 -13.758 -24.670 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -9.628 -14.644 -25.524 1.00 0.00 H new ATOM 1236 N VAL A 83 -12.715 -18.401 -28.102 1.00 0.00 N ATOM 1237 CA VAL A 83 -13.844 -19.320 -28.195 1.00 0.00 C ATOM 1238 C VAL A 83 -13.811 -20.347 -27.069 1.00 0.00 C ATOM 1239 O VAL A 83 -13.004 -21.276 -27.087 1.00 0.00 O ATOM 1240 CB VAL A 83 -13.857 -20.057 -29.548 1.00 0.00 C ATOM 1241 CG1 VAL A 83 -15.111 -20.908 -29.679 1.00 0.00 C ATOM 1242 CG2 VAL A 83 -13.754 -19.064 -30.696 1.00 0.00 C ATOM 0 H VAL A 83 -11.829 -18.844 -27.859 1.00 0.00 H new ATOM 0 HA VAL A 83 -14.749 -18.719 -28.108 1.00 0.00 H new ATOM 0 HB VAL A 83 -12.992 -20.718 -29.591 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -15.104 -21.421 -30.641 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -15.137 -21.644 -28.875 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -15.992 -20.270 -29.615 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -13.765 -19.602 -31.644 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -14.599 -18.376 -30.659 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -12.824 -18.502 -30.608 1.00 0.00 H new ATOM 1252 N GLU A 84 -14.694 -20.173 -26.091 1.00 0.00 N ATOM 1253 CA GLU A 84 -14.765 -21.086 -24.956 1.00 0.00 C ATOM 1254 C GLU A 84 -15.812 -22.170 -25.194 1.00 0.00 C ATOM 1255 O GLU A 84 -16.960 -21.877 -25.528 1.00 0.00 O ATOM 1256 CB GLU A 84 -15.093 -20.317 -23.674 1.00 0.00 C ATOM 1257 CG GLU A 84 -14.599 -21.000 -22.411 1.00 0.00 C ATOM 1258 CD GLU A 84 -15.352 -20.553 -21.173 1.00 0.00 C ATOM 1259 OE1 GLU A 84 -14.965 -19.522 -20.584 1.00 0.00 O ATOM 1260 OE2 GLU A 84 -16.327 -21.234 -20.793 1.00 0.00 O ATOM 0 H GLU A 84 -15.369 -19.409 -26.062 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.792 -21.564 -24.846 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -14.653 -19.322 -23.735 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -16.173 -20.184 -23.606 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -14.700 -22.080 -22.523 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -13.537 -20.791 -22.281 1.00 0.00 H new ATOM 1267 N TYR A 85 -15.406 -23.423 -25.021 1.00 0.00 N ATOM 1268 CA TYR A 85 -16.308 -24.552 -25.220 1.00 0.00 C ATOM 1269 C TYR A 85 -16.507 -25.326 -23.921 1.00 0.00 C ATOM 1270 O TYR A 85 -16.062 -26.467 -23.789 1.00 0.00 O ATOM 1271 CB TYR A 85 -15.761 -25.483 -26.303 1.00 0.00 C ATOM 1272 CG TYR A 85 -16.477 -26.813 -26.377 1.00 0.00 C ATOM 1273 CD1 TYR A 85 -17.864 -26.874 -26.443 1.00 0.00 C ATOM 1274 CD2 TYR A 85 -15.768 -28.007 -26.381 1.00 0.00 C ATOM 1275 CE1 TYR A 85 -18.523 -28.086 -26.509 1.00 0.00 C ATOM 1276 CE2 TYR A 85 -16.419 -29.224 -26.449 1.00 0.00 C ATOM 1277 CZ TYR A 85 -17.796 -29.258 -26.513 1.00 0.00 C ATOM 1278 OH TYR A 85 -18.448 -30.468 -26.579 1.00 0.00 O ATOM 0 H TYR A 85 -14.459 -23.683 -24.744 1.00 0.00 H new ATOM 0 HA TYR A 85 -17.274 -24.161 -25.540 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -15.836 -24.985 -27.270 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -14.702 -25.660 -26.117 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -18.436 -25.958 -26.443 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.689 -27.984 -26.330 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -19.602 -28.116 -26.557 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -15.852 -30.143 -26.452 1.00 0.00 H new ATOM 0 HH TYR A 85 -17.790 -31.195 -26.573 1.00 0.00 H new ATOM 1288 N LYS A 86 -17.178 -24.697 -22.962 1.00 0.00 N ATOM 1289 CA LYS A 86 -17.439 -25.325 -21.673 1.00 0.00 C ATOM 1290 C LYS A 86 -16.139 -25.761 -21.006 1.00 0.00 C ATOM 1291 O LYS A 86 -15.975 -26.926 -20.645 1.00 0.00 O ATOM 1292 CB LYS A 86 -18.365 -26.531 -21.847 1.00 0.00 C ATOM 1293 CG LYS A 86 -19.686 -26.192 -22.516 1.00 0.00 C ATOM 1294 CD LYS A 86 -20.680 -27.335 -22.397 1.00 0.00 C ATOM 1295 CE LYS A 86 -20.537 -28.320 -23.547 1.00 0.00 C ATOM 1296 NZ LYS A 86 -21.447 -29.489 -23.393 1.00 0.00 N ATOM 0 H LYS A 86 -17.551 -23.752 -23.054 1.00 0.00 H new ATOM 0 HA LYS A 86 -17.926 -24.590 -21.032 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -17.852 -27.290 -22.438 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -18.564 -26.969 -20.869 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -20.106 -25.295 -22.061 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -19.515 -25.966 -23.568 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -20.527 -27.854 -21.451 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -21.694 -26.936 -22.382 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -20.753 -27.814 -24.488 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -19.505 -28.668 -23.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -21.319 -30.137 -24.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -21.225 -29.988 -22.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -22.433 -29.160 -23.367 1.00 0.00 H new ATOM 1310 N GLY A 87 -15.215 -24.818 -20.846 1.00 0.00 N ATOM 1311 CA GLY A 87 -13.942 -25.125 -20.222 1.00 0.00 C ATOM 1312 C GLY A 87 -12.763 -24.634 -21.039 1.00 0.00 C ATOM 1313 O GLY A 87 -12.219 -23.560 -20.777 1.00 0.00 O ATOM 0 H GLY A 87 -15.326 -23.847 -21.138 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -13.908 -24.672 -19.231 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -13.860 -26.203 -20.082 1.00 0.00 H new ATOM 1317 N THR A 88 -12.363 -25.422 -22.032 1.00 0.00 N ATOM 1318 CA THR A 88 -11.240 -25.063 -22.888 1.00 0.00 C ATOM 1319 C THR A 88 -11.649 -24.026 -23.928 1.00 0.00 C ATOM 1320 O THR A 88 -12.605 -24.228 -24.677 1.00 0.00 O ATOM 1321 CB THR A 88 -10.666 -26.298 -23.609 1.00 0.00 C ATOM 1322 OG1 THR A 88 -11.727 -27.054 -24.204 1.00 0.00 O ATOM 1323 CG2 THR A 88 -9.890 -27.178 -22.641 1.00 0.00 C ATOM 0 H THR A 88 -12.801 -26.314 -22.263 1.00 0.00 H new ATOM 0 HA THR A 88 -10.472 -24.640 -22.240 1.00 0.00 H new ATOM 0 HB THR A 88 -9.985 -25.954 -24.387 1.00 0.00 H new ATOM 0 HG1 THR A 88 -12.421 -26.443 -24.530 1.00 0.00 H new ATOM 0 HG21 THR A 88 -9.495 -28.043 -23.173 1.00 0.00 H new ATOM 0 HG22 THR A 88 -9.066 -26.608 -22.212 1.00 0.00 H new ATOM 0 HG23 THR A 88 -10.553 -27.514 -21.844 1.00 0.00 H new ATOM 1331 N VAL A 89 -10.920 -22.916 -23.968 1.00 0.00 N ATOM 1332 CA VAL A 89 -11.207 -21.847 -24.918 1.00 0.00 C ATOM 1333 C VAL A 89 -10.073 -21.689 -25.925 1.00 0.00 C ATOM 1334 O VAL A 89 -8.899 -21.677 -25.556 1.00 0.00 O ATOM 1335 CB VAL A 89 -11.433 -20.504 -24.200 1.00 0.00 C ATOM 1336 CG1 VAL A 89 -10.647 -20.455 -22.898 1.00 0.00 C ATOM 1337 CG2 VAL A 89 -11.050 -19.344 -25.107 1.00 0.00 C ATOM 0 H VAL A 89 -10.126 -22.733 -23.354 1.00 0.00 H new ATOM 0 HA VAL A 89 -12.120 -22.127 -25.444 1.00 0.00 H new ATOM 0 HB VAL A 89 -12.493 -20.414 -23.961 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -10.819 -19.498 -22.405 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -10.974 -21.264 -22.245 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -9.584 -20.567 -23.110 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -11.216 -18.403 -24.583 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -9.998 -19.427 -25.379 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -11.661 -19.370 -26.009 1.00 0.00 H new ATOM 1347 N TRP A 90 -10.433 -21.565 -27.197 1.00 0.00 N ATOM 1348 CA TRP A 90 -9.446 -21.406 -28.259 1.00 0.00 C ATOM 1349 C TRP A 90 -9.603 -20.057 -28.952 1.00 0.00 C ATOM 1350 O TRP A 90 -10.715 -19.548 -29.095 1.00 0.00 O ATOM 1351 CB TRP A 90 -9.578 -22.537 -29.281 1.00 0.00 C ATOM 1352 CG TRP A 90 -9.739 -23.889 -28.653 1.00 0.00 C ATOM 1353 CD1 TRP A 90 -10.705 -24.272 -27.768 1.00 0.00 C ATOM 1354 CD2 TRP A 90 -8.906 -25.035 -28.863 1.00 0.00 C ATOM 1355 NE1 TRP A 90 -10.524 -25.587 -27.414 1.00 0.00 N ATOM 1356 CE2 TRP A 90 -9.428 -26.078 -28.073 1.00 0.00 C ATOM 1357 CE3 TRP A 90 -7.773 -25.282 -29.642 1.00 0.00 C ATOM 1358 CZ2 TRP A 90 -8.853 -27.345 -28.040 1.00 0.00 C ATOM 1359 CZ3 TRP A 90 -7.203 -26.540 -29.608 1.00 0.00 C ATOM 1360 CH2 TRP A 90 -7.743 -27.559 -28.813 1.00 0.00 C ATOM 0 H TRP A 90 -11.401 -21.571 -27.518 1.00 0.00 H new ATOM 0 HA TRP A 90 -8.455 -21.448 -27.808 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -10.436 -22.338 -29.924 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -8.695 -22.544 -29.921 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -11.496 -23.635 -27.400 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -11.110 -26.112 -26.766 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -7.350 -24.503 -30.260 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -9.267 -28.131 -27.427 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -6.326 -26.741 -30.205 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -7.275 -28.532 -28.810 1.00 0.00 H new ATOM 1371 N HIS A 91 -8.484 -19.482 -29.380 1.00 0.00 N ATOM 1372 CA HIS A 91 -8.499 -18.191 -30.059 1.00 0.00 C ATOM 1373 C HIS A 91 -9.479 -18.204 -31.228 1.00 0.00 C ATOM 1374 O HIS A 91 -9.607 -19.205 -31.934 1.00 0.00 O ATOM 1375 CB HIS A 91 -7.098 -17.837 -30.557 1.00 0.00 C ATOM 1376 CG HIS A 91 -6.164 -17.411 -29.466 1.00 0.00 C ATOM 1377 ND1 HIS A 91 -5.115 -18.191 -29.026 1.00 0.00 N ATOM 1378 CD2 HIS A 91 -6.125 -16.279 -28.725 1.00 0.00 C ATOM 1379 CE1 HIS A 91 -4.472 -17.557 -28.062 1.00 0.00 C ATOM 1380 NE2 HIS A 91 -5.065 -16.394 -27.860 1.00 0.00 N ATOM 0 H HIS A 91 -7.555 -19.889 -29.269 1.00 0.00 H new ATOM 0 HA HIS A 91 -8.824 -17.435 -29.344 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -6.675 -18.701 -31.070 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -7.174 -17.036 -31.292 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -6.802 -15.441 -28.800 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -3.608 -17.927 -27.529 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -4.782 -15.695 -27.173 1.00 0.00 H new ATOM 1388 N LYS A 92 -10.170 -17.087 -31.427 1.00 0.00 N ATOM 1389 CA LYS A 92 -11.139 -16.968 -32.510 1.00 0.00 C ATOM 1390 C LYS A 92 -10.625 -17.647 -33.776 1.00 0.00 C ATOM 1391 O LYS A 92 -11.403 -18.202 -34.553 1.00 0.00 O ATOM 1392 CB LYS A 92 -11.438 -15.494 -32.795 1.00 0.00 C ATOM 1393 CG LYS A 92 -12.649 -15.281 -33.687 1.00 0.00 C ATOM 1394 CD LYS A 92 -13.940 -15.633 -32.968 1.00 0.00 C ATOM 1395 CE LYS A 92 -15.130 -14.897 -33.565 1.00 0.00 C ATOM 1396 NZ LYS A 92 -15.486 -15.420 -34.913 1.00 0.00 N ATOM 0 H LYS A 92 -10.077 -16.250 -30.852 1.00 0.00 H new ATOM 0 HA LYS A 92 -12.058 -17.465 -32.199 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -11.597 -14.975 -31.850 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -10.566 -15.039 -33.265 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -12.684 -14.241 -34.012 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -12.553 -15.892 -34.584 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -14.109 -16.708 -33.027 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -13.849 -15.382 -31.911 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -15.988 -14.994 -32.900 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -14.901 -13.834 -33.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -16.301 -14.893 -35.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -14.676 -15.305 -35.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -15.730 -16.428 -34.841 1.00 0.00 H new ATOM 1410 N ASP A 93 -9.313 -17.601 -33.976 1.00 0.00 N ATOM 1411 CA ASP A 93 -8.696 -18.214 -35.146 1.00 0.00 C ATOM 1412 C ASP A 93 -8.490 -19.710 -34.931 1.00 0.00 C ATOM 1413 O ASP A 93 -8.807 -20.523 -35.800 1.00 0.00 O ATOM 1414 CB ASP A 93 -7.357 -17.542 -35.454 1.00 0.00 C ATOM 1415 CG ASP A 93 -6.950 -17.702 -36.906 1.00 0.00 C ATOM 1416 OD1 ASP A 93 -6.332 -18.735 -37.238 1.00 0.00 O ATOM 1417 OD2 ASP A 93 -7.248 -16.793 -37.709 1.00 0.00 O ATOM 0 H ASP A 93 -8.656 -17.145 -33.343 1.00 0.00 H new ATOM 0 HA ASP A 93 -9.367 -18.076 -35.994 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -7.422 -16.481 -35.213 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -6.584 -17.968 -34.814 1.00 0.00 H new ATOM 1422 N CYS A 94 -7.958 -20.068 -33.767 1.00 0.00 N ATOM 1423 CA CYS A 94 -7.708 -21.466 -33.437 1.00 0.00 C ATOM 1424 C CYS A 94 -8.995 -22.282 -33.518 1.00 0.00 C ATOM 1425 O CYS A 94 -8.997 -23.410 -34.011 1.00 0.00 O ATOM 1426 CB CYS A 94 -7.106 -21.581 -32.035 1.00 0.00 C ATOM 1427 SG CYS A 94 -5.399 -20.957 -31.906 1.00 0.00 S ATOM 0 H CYS A 94 -7.692 -19.408 -33.036 1.00 0.00 H new ATOM 0 HA CYS A 94 -6.999 -21.864 -34.163 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -7.736 -21.033 -31.335 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -7.123 -22.627 -31.728 1.00 0.00 H new ATOM 1432 N PHE A 95 -10.087 -21.703 -33.031 1.00 0.00 N ATOM 1433 CA PHE A 95 -11.381 -22.377 -33.048 1.00 0.00 C ATOM 1434 C PHE A 95 -12.036 -22.263 -34.421 1.00 0.00 C ATOM 1435 O PHE A 95 -12.025 -21.198 -35.040 1.00 0.00 O ATOM 1436 CB PHE A 95 -12.302 -21.784 -31.980 1.00 0.00 C ATOM 1437 CG PHE A 95 -13.325 -22.755 -31.464 1.00 0.00 C ATOM 1438 CD1 PHE A 95 -14.553 -22.887 -32.090 1.00 0.00 C ATOM 1439 CD2 PHE A 95 -13.057 -23.537 -30.351 1.00 0.00 C ATOM 1440 CE1 PHE A 95 -15.496 -23.780 -31.618 1.00 0.00 C ATOM 1441 CE2 PHE A 95 -13.996 -24.432 -29.874 1.00 0.00 C ATOM 1442 CZ PHE A 95 -15.217 -24.553 -30.508 1.00 0.00 C ATOM 0 H PHE A 95 -10.103 -20.770 -32.620 1.00 0.00 H new ATOM 0 HA PHE A 95 -11.216 -23.432 -32.831 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -11.697 -21.429 -31.146 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -12.814 -20.916 -32.395 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -14.777 -22.285 -32.958 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -12.104 -23.446 -29.851 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -16.450 -23.873 -32.116 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -13.775 -25.036 -29.006 1.00 0.00 H new ATOM 0 HZ PHE A 95 -15.953 -25.251 -30.136 1.00 0.00 H new ATOM 1452 N SER A 96 -12.606 -23.367 -34.892 1.00 0.00 N ATOM 1453 CA SER A 96 -13.262 -23.393 -36.194 1.00 0.00 C ATOM 1454 C SER A 96 -14.318 -24.493 -36.248 1.00 0.00 C ATOM 1455 O SER A 96 -14.012 -25.672 -36.072 1.00 0.00 O ATOM 1456 CB SER A 96 -12.231 -23.605 -37.305 1.00 0.00 C ATOM 1457 OG SER A 96 -12.800 -23.368 -38.581 1.00 0.00 O ATOM 0 H SER A 96 -12.627 -24.256 -34.391 1.00 0.00 H new ATOM 0 HA SER A 96 -13.755 -22.432 -36.344 1.00 0.00 H new ATOM 0 HB2 SER A 96 -11.384 -22.937 -37.151 1.00 0.00 H new ATOM 0 HB3 SER A 96 -11.846 -24.624 -37.259 1.00 0.00 H new ATOM 0 HG SER A 96 -12.121 -23.508 -39.273 1.00 0.00 H new ATOM 1463 N GLY A 97 -15.564 -24.098 -36.493 1.00 0.00 N ATOM 1464 CA GLY A 97 -16.647 -25.061 -36.566 1.00 0.00 C ATOM 1465 C GLY A 97 -17.434 -24.951 -37.857 1.00 0.00 C ATOM 1466 O GLY A 97 -16.931 -25.239 -38.943 1.00 0.00 O ATOM 0 H GLY A 97 -15.842 -23.128 -36.642 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -16.240 -26.068 -36.477 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -17.319 -24.913 -35.721 1.00 0.00 H new ATOM 1470 N PRO A 98 -18.702 -24.527 -37.747 1.00 0.00 N ATOM 1471 CA PRO A 98 -19.588 -24.372 -38.905 1.00 0.00 C ATOM 1472 C PRO A 98 -19.173 -23.209 -39.800 1.00 0.00 C ATOM 1473 O PRO A 98 -19.791 -22.960 -40.835 1.00 0.00 O ATOM 1474 CB PRO A 98 -20.954 -24.099 -38.271 1.00 0.00 C ATOM 1475 CG PRO A 98 -20.643 -23.512 -36.938 1.00 0.00 C ATOM 1476 CD PRO A 98 -19.368 -24.167 -36.484 1.00 0.00 C ATOM 0 HA PRO A 98 -19.571 -25.249 -39.553 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -21.542 -23.411 -38.879 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -21.536 -25.016 -38.174 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -20.523 -22.431 -37.006 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -21.451 -23.699 -36.231 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -18.758 -23.489 -35.887 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -19.564 -25.045 -35.868 1.00 0.00 H new ATOM 1484 N SER A 99 -18.124 -22.501 -39.395 1.00 0.00 N ATOM 1485 CA SER A 99 -17.629 -21.362 -40.159 1.00 0.00 C ATOM 1486 C SER A 99 -16.820 -21.828 -41.365 1.00 0.00 C ATOM 1487 O SER A 99 -16.202 -22.892 -41.338 1.00 0.00 O ATOM 1488 CB SER A 99 -16.770 -20.460 -39.271 1.00 0.00 C ATOM 1489 OG SER A 99 -17.574 -19.698 -38.388 1.00 0.00 O ATOM 0 H SER A 99 -17.600 -22.696 -38.542 1.00 0.00 H new ATOM 0 HA SER A 99 -18.488 -20.795 -40.517 1.00 0.00 H new ATOM 0 HB2 SER A 99 -16.071 -21.069 -38.697 1.00 0.00 H new ATOM 0 HB3 SER A 99 -16.175 -19.792 -39.894 1.00 0.00 H new ATOM 0 HG SER A 99 -17.001 -19.131 -37.830 1.00 0.00 H new ATOM 1495 N SER A 100 -16.829 -21.023 -42.423 1.00 0.00 N ATOM 1496 CA SER A 100 -16.100 -21.353 -43.641 1.00 0.00 C ATOM 1497 C SER A 100 -14.648 -20.895 -43.546 1.00 0.00 C ATOM 1498 O SER A 100 -14.295 -20.085 -42.690 1.00 0.00 O ATOM 1499 CB SER A 100 -16.772 -20.706 -44.854 1.00 0.00 C ATOM 1500 OG SER A 100 -16.359 -21.329 -46.058 1.00 0.00 O ATOM 0 H SER A 100 -17.334 -20.137 -42.461 1.00 0.00 H new ATOM 0 HA SER A 100 -16.114 -22.436 -43.761 1.00 0.00 H new ATOM 0 HB2 SER A 100 -17.855 -20.779 -44.756 1.00 0.00 H new ATOM 0 HB3 SER A 100 -16.526 -19.645 -44.887 1.00 0.00 H new ATOM 0 HG SER A 100 -16.804 -20.899 -46.818 1.00 0.00 H new ATOM 1506 N GLY A 101 -13.808 -21.422 -44.432 1.00 0.00 N ATOM 1507 CA GLY A 101 -12.403 -21.057 -44.432 1.00 0.00 C ATOM 1508 C GLY A 101 -11.987 -20.352 -45.707 1.00 0.00 C ATOM 1509 O GLY A 101 -12.856 -19.943 -46.476 1.00 0.00 O ATOM 0 H GLY A 101 -14.076 -22.095 -45.150 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -12.199 -20.409 -43.579 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -11.798 -21.954 -44.303 1.00 0.00 H new TER 1513 GLY A 101 HETATM 1514 ZN ZN A 201 -3.948 11.428 -6.024 1.00 0.00 ZN HETATM 1515 ZN ZN A 401 3.022 -5.035 -7.939 1.00 0.00 ZN HETATM 1516 ZN ZN A 601 -4.703 -20.358 -29.776 1.00 0.00 ZN