USER MOD reduce.3.24.130724 H: found=0, std=0, add=1118, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1119 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 108 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 59 GLN : amide:sc= 1.1 K(o=1.7,f=-0.3) USER MOD Set 2.2: A 143 GLN : amide:sc= 0.585 K(o=1.7,f=-0.3!) USER MOD Set 3.1: A 40 THR OG1 : rot -81:sc= 1.28 USER MOD Set 3.2: A 41 GLN : amide:sc= -0.155 X(o=1.1,f=0.91) USER MOD Set 4.1: A 5 THR OG1 : rot -79:sc= 0.333 USER MOD Set 4.2: A 7 ASN : amide:sc= 0.0457 K(o=0.38,f=-4.5!) USER MOD Set 4.3: A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ -170:sc= 1.15 (180deg=0.388) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -0.198 K(o=-0.2,f=0.47) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= -0.0447 X(o=-0.045,f=-0.028) USER MOD Single : A 29 ASN : amide:sc= -0.515 X(o=-0.52,f=-0.21) USER MOD Single : A 32 GLN : amide:sc= -1.7! K(o=-1.7!,f=-0.17) USER MOD Single : A 33 ASN : amide:sc= -1.17! K(o=-1.2!,f=-0.052) USER MOD Single : A 39 SER OG : rot -150:sc= -1.42 USER MOD Single : A 45 HIS : no HE2:sc= -1.99! C(o=-2!,f=-3.7!) USER MOD Single : A 46 ASN : amide:sc= -1.37! C(o=-1.4!,f=-3.9!) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc=-0.00835 X(o=-0.0084,f=-0.059) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot -9:sc= -0.354 USER MOD Single : A 78 SER OG : rot -53:sc= 0.148 USER MOD Single : A 80 SER OG : rot -118:sc= 0.697 USER MOD Single : A 81 SER OG : rot 44:sc= 0.15 USER MOD Single : A 82 TYR OH : rot 129:sc= -1.93 USER MOD Single : A 86 THR OG1 : rot 123:sc= 0.19 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0.00484 USER MOD Single : A 88 SER OG : rot -114:sc= 1.31 USER MOD Single : A 90 THR OG1 : rot -78:sc= 0.672 USER MOD Single : A 95 TYR OH : rot -139:sc= -0.91! USER MOD Single : A 96 ASN : amide:sc= -0.487 X(o=-0.49,f=0) USER MOD Single : A 97 SER OG : rot 130:sc= -0.243 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.0593 USER MOD Single : A 101 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.759) USER MOD Single : A 110 THR OG1 : rot -159:sc= 1.64 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 165:sc= 1.22 (180deg=1.06) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -3.67! C(o=-3.7!,f=-1.7!) USER MOD Single : A 134 THR OG1 : rot 180:sc= -0.193 USER MOD Single : A 135 ASN : amide:sc= -0.278 X(o=-0.28,f=-0.3) USER MOD Single : A 147 ASN : amide:sc= 0.686 K(o=0.69,f=0) USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 151 ASN : amide:sc= -0.753 X(o=-0.75,f=-0.38) USER MOD Single : A 152 ASN : amide:sc= -0.847 K(o=-0.85,f=-0.012) USER MOD Single : A 158 THR OG1 : rot -59:sc= 0.66 USER MOD ----------------------------------------------------------------- ATOM 23 N ALA A 2 13.977 4.013 -0.587 1.00 0.00 N ATOM 24 CA ALA A 2 13.050 4.733 0.260 1.00 0.00 C ATOM 25 C ALA A 2 11.779 4.913 -0.501 1.00 0.00 C ATOM 26 O ALA A 2 11.773 4.779 -1.721 1.00 0.00 O ATOM 27 CB ALA A 2 13.590 6.055 0.737 1.00 0.00 C ATOM 0 HA ALA A 2 12.879 4.150 1.165 1.00 0.00 H new ATOM 0 HB1 ALA A 2 12.848 6.545 1.367 1.00 0.00 H new ATOM 0 HB2 ALA A 2 14.501 5.890 1.311 1.00 0.00 H new ATOM 0 HB3 ALA A 2 13.812 6.688 -0.122 1.00 0.00 H new ATOM 33 N CYS A 3 10.718 5.214 0.165 1.00 0.00 N ATOM 34 CA CYS A 3 9.453 5.273 -0.499 1.00 0.00 C ATOM 35 C CYS A 3 8.689 6.523 -0.094 1.00 0.00 C ATOM 36 O CYS A 3 8.902 7.076 0.985 1.00 0.00 O ATOM 37 CB CYS A 3 8.649 4.009 -0.205 1.00 0.00 C ATOM 38 SG CYS A 3 9.458 2.428 -0.654 1.00 0.00 S ATOM 0 H CYS A 3 10.696 5.423 1.163 1.00 0.00 H new ATOM 0 HA CYS A 3 9.621 5.328 -1.575 1.00 0.00 H new ATOM 0 HB2 CYS A 3 8.418 3.988 0.860 1.00 0.00 H new ATOM 0 HB3 CYS A 3 7.699 4.073 -0.736 1.00 0.00 H new ATOM 43 N LYS A 4 7.798 6.957 -0.947 1.00 0.00 N ATOM 44 CA LYS A 4 7.057 8.167 -0.734 1.00 0.00 C ATOM 45 C LYS A 4 5.653 8.018 -1.290 1.00 0.00 C ATOM 46 O LYS A 4 5.399 7.195 -2.161 1.00 0.00 O ATOM 47 CB LYS A 4 7.808 9.374 -1.364 1.00 0.00 C ATOM 48 CG LYS A 4 7.966 9.367 -2.866 1.00 0.00 C ATOM 49 CD LYS A 4 6.835 10.075 -3.543 1.00 0.00 C ATOM 50 CE LYS A 4 7.026 10.076 -5.019 1.00 0.00 C ATOM 51 NZ LYS A 4 8.236 10.818 -5.442 1.00 0.00 N ATOM 0 H LYS A 4 7.566 6.475 -1.815 1.00 0.00 H new ATOM 0 HA LYS A 4 6.971 8.359 0.335 1.00 0.00 H new ATOM 0 HB2 LYS A 4 7.283 10.286 -1.082 1.00 0.00 H new ATOM 0 HB3 LYS A 4 8.801 9.427 -0.918 1.00 0.00 H new ATOM 0 HG2 LYS A 4 8.908 9.845 -3.135 1.00 0.00 H new ATOM 0 HG3 LYS A 4 8.017 8.338 -3.222 1.00 0.00 H new ATOM 0 HD2 LYS A 4 5.892 9.588 -3.293 1.00 0.00 H new ATOM 0 HD3 LYS A 4 6.770 11.100 -3.179 1.00 0.00 H new ATOM 0 HE2 LYS A 4 7.095 9.047 -5.372 1.00 0.00 H new ATOM 0 HE3 LYS A 4 6.150 10.518 -5.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 8.230 10.932 -6.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 8.244 11.755 -4.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 9.085 10.289 -5.157 1.00 0.00 H new ATOM 65 N THR A 5 4.765 8.788 -0.754 1.00 0.00 N ATOM 66 CA THR A 5 3.370 8.786 -1.157 1.00 0.00 C ATOM 67 C THR A 5 3.122 9.816 -2.233 1.00 0.00 C ATOM 68 O THR A 5 3.965 10.660 -2.507 1.00 0.00 O ATOM 69 CB THR A 5 2.526 9.208 0.014 1.00 0.00 C ATOM 70 OG1 THR A 5 2.984 10.496 0.409 1.00 0.00 O ATOM 71 CG2 THR A 5 2.682 8.259 1.147 1.00 0.00 C ATOM 0 H THR A 5 4.977 9.453 -0.010 1.00 0.00 H new ATOM 0 HA THR A 5 3.126 7.785 -1.514 1.00 0.00 H new ATOM 0 HB THR A 5 1.472 9.223 -0.265 1.00 0.00 H new ATOM 0 HG1 THR A 5 3.805 10.404 0.936 1.00 0.00 H new ATOM 0 HG21 THR A 5 2.062 8.585 1.982 1.00 0.00 H new ATOM 0 HG22 THR A 5 2.372 7.262 0.832 1.00 0.00 H new ATOM 0 HG23 THR A 5 3.726 8.233 1.459 1.00 0.00 H new ATOM 79 N ALA A 6 1.912 9.803 -2.719 1.00 0.00 N ATOM 80 CA ALA A 6 1.448 10.703 -3.764 1.00 0.00 C ATOM 81 C ALA A 6 0.978 12.000 -3.148 1.00 0.00 C ATOM 82 O ALA A 6 0.727 12.985 -3.837 1.00 0.00 O ATOM 83 CB ALA A 6 0.296 10.056 -4.512 1.00 0.00 C ATOM 0 H ALA A 6 1.195 9.153 -2.398 1.00 0.00 H new ATOM 0 HA ALA A 6 2.267 10.906 -4.454 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -0.053 10.729 -5.295 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.633 9.121 -4.960 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.520 9.853 -3.818 1.00 0.00 H new ATOM 89 N ASN A 7 0.851 11.983 -1.845 1.00 0.00 N ATOM 90 CA ASN A 7 0.383 13.111 -1.101 1.00 0.00 C ATOM 91 C ASN A 7 1.527 13.944 -0.567 1.00 0.00 C ATOM 92 O ASN A 7 1.366 15.142 -0.320 1.00 0.00 O ATOM 93 CB ASN A 7 -0.598 12.670 -0.019 1.00 0.00 C ATOM 94 CG ASN A 7 -0.174 11.419 0.692 1.00 0.00 C ATOM 95 OD1 ASN A 7 -0.535 10.313 0.278 1.00 0.00 O ATOM 96 ND2 ASN A 7 0.603 11.540 1.710 1.00 0.00 N ATOM 0 H ASN A 7 1.074 11.171 -1.269 1.00 0.00 H new ATOM 0 HA ASN A 7 -0.166 13.768 -1.776 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -0.710 13.473 0.709 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -1.577 12.509 -0.470 1.00 0.00 H new ATOM 0 HD21 ASN A 7 0.938 10.709 2.198 1.00 0.00 H new ATOM 0 HD22 ASN A 7 0.885 12.467 2.029 1.00 0.00 H new ATOM 103 N GLY A 8 2.665 13.318 -0.343 1.00 0.00 N ATOM 104 CA GLY A 8 3.856 14.097 -0.054 1.00 0.00 C ATOM 105 C GLY A 8 4.703 13.564 1.071 1.00 0.00 C ATOM 106 O GLY A 8 5.730 14.140 1.398 1.00 0.00 O ATOM 0 H GLY A 8 2.792 12.306 -0.354 1.00 0.00 H new ATOM 0 HA2 GLY A 8 4.466 14.149 -0.956 1.00 0.00 H new ATOM 0 HA3 GLY A 8 3.556 15.117 0.188 1.00 0.00 H new ATOM 110 N THR A 9 4.311 12.474 1.649 1.00 0.00 N ATOM 111 CA THR A 9 5.051 11.909 2.730 1.00 0.00 C ATOM 112 C THR A 9 6.121 10.977 2.183 1.00 0.00 C ATOM 113 O THR A 9 5.827 9.909 1.634 1.00 0.00 O ATOM 114 CB THR A 9 4.118 11.155 3.680 1.00 0.00 C ATOM 115 OG1 THR A 9 2.935 11.950 3.888 1.00 0.00 O ATOM 116 CG2 THR A 9 4.804 10.942 5.023 1.00 0.00 C ATOM 0 H THR A 9 3.474 11.953 1.387 1.00 0.00 H new ATOM 0 HA THR A 9 5.531 12.711 3.291 1.00 0.00 H new ATOM 0 HB THR A 9 3.863 10.188 3.247 1.00 0.00 H new ATOM 0 HG1 THR A 9 2.326 11.478 4.494 1.00 0.00 H new ATOM 0 HG21 THR A 9 4.133 10.405 5.693 1.00 0.00 H new ATOM 0 HG22 THR A 9 5.715 10.361 4.878 1.00 0.00 H new ATOM 0 HG23 THR A 9 5.056 11.908 5.460 1.00 0.00 H new ATOM 124 N ALA A 10 7.324 11.442 2.242 1.00 0.00 N ATOM 125 CA ALA A 10 8.478 10.683 1.845 1.00 0.00 C ATOM 126 C ALA A 10 9.137 10.097 3.076 1.00 0.00 C ATOM 127 O ALA A 10 9.532 10.834 3.987 1.00 0.00 O ATOM 128 CB ALA A 10 9.455 11.568 1.087 1.00 0.00 C ATOM 0 H ALA A 10 7.544 12.381 2.574 1.00 0.00 H new ATOM 0 HA ALA A 10 8.170 9.873 1.183 1.00 0.00 H new ATOM 0 HB1 ALA A 10 10.325 10.981 0.792 1.00 0.00 H new ATOM 0 HB2 ALA A 10 8.969 11.968 0.197 1.00 0.00 H new ATOM 0 HB3 ALA A 10 9.773 12.391 1.727 1.00 0.00 H new ATOM 134 N ILE A 11 9.213 8.797 3.125 1.00 0.00 N ATOM 135 CA ILE A 11 9.836 8.100 4.236 1.00 0.00 C ATOM 136 C ILE A 11 11.249 7.682 3.829 1.00 0.00 C ATOM 137 O ILE A 11 11.413 6.874 2.910 1.00 0.00 O ATOM 138 CB ILE A 11 9.068 6.808 4.631 1.00 0.00 C ATOM 139 CG1 ILE A 11 7.593 7.083 4.915 1.00 0.00 C ATOM 140 CG2 ILE A 11 9.716 6.168 5.866 1.00 0.00 C ATOM 141 CD1 ILE A 11 6.813 5.815 5.161 1.00 0.00 C ATOM 0 H ILE A 11 8.847 8.181 2.399 1.00 0.00 H new ATOM 0 HA ILE A 11 9.835 8.783 5.086 1.00 0.00 H new ATOM 0 HB ILE A 11 9.125 6.124 3.784 1.00 0.00 H new ATOM 0 HG12 ILE A 11 7.508 7.734 5.785 1.00 0.00 H new ATOM 0 HG13 ILE A 11 7.156 7.618 4.072 1.00 0.00 H new ATOM 0 HG21 ILE A 11 9.171 5.263 6.135 1.00 0.00 H new ATOM 0 HG22 ILE A 11 10.752 5.914 5.643 1.00 0.00 H new ATOM 0 HG23 ILE A 11 9.686 6.871 6.698 1.00 0.00 H new ATOM 0 HD11 ILE A 11 5.770 6.062 5.358 1.00 0.00 H new ATOM 0 HD12 ILE A 11 6.874 5.174 4.282 1.00 0.00 H new ATOM 0 HD13 ILE A 11 7.231 5.292 6.021 1.00 0.00 H new ATOM 153 N PRO A 12 12.274 8.239 4.476 1.00 0.00 N ATOM 154 CA PRO A 12 13.660 7.870 4.209 1.00 0.00 C ATOM 155 C PRO A 12 14.014 6.517 4.853 1.00 0.00 C ATOM 156 O PRO A 12 13.220 5.955 5.636 1.00 0.00 O ATOM 157 CB PRO A 12 14.447 8.999 4.882 1.00 0.00 C ATOM 158 CG PRO A 12 13.577 9.428 6.010 1.00 0.00 C ATOM 159 CD PRO A 12 12.168 9.285 5.516 1.00 0.00 C ATOM 0 HA PRO A 12 13.871 7.756 3.146 1.00 0.00 H new ATOM 0 HB2 PRO A 12 15.417 8.651 5.237 1.00 0.00 H new ATOM 0 HB3 PRO A 12 14.636 9.820 4.190 1.00 0.00 H new ATOM 0 HG2 PRO A 12 13.747 8.810 6.892 1.00 0.00 H new ATOM 0 HG3 PRO A 12 13.788 10.458 6.297 1.00 0.00 H new ATOM 0 HD2 PRO A 12 11.490 8.989 6.316 1.00 0.00 H new ATOM 0 HD3 PRO A 12 11.789 10.221 5.107 1.00 0.00 H new ATOM 167 N ILE A 13 15.196 6.007 4.534 1.00 0.00 N ATOM 168 CA ILE A 13 15.674 4.744 5.083 1.00 0.00 C ATOM 169 C ILE A 13 15.711 4.819 6.610 1.00 0.00 C ATOM 170 O ILE A 13 16.170 5.814 7.187 1.00 0.00 O ATOM 171 CB ILE A 13 17.097 4.403 4.575 1.00 0.00 C ATOM 172 CG1 ILE A 13 17.127 4.391 3.056 1.00 0.00 C ATOM 173 CG2 ILE A 13 17.532 3.038 5.109 1.00 0.00 C ATOM 174 CD1 ILE A 13 18.508 4.256 2.471 1.00 0.00 C ATOM 0 H ILE A 13 15.848 6.454 3.890 1.00 0.00 H new ATOM 0 HA ILE A 13 14.986 3.966 4.754 1.00 0.00 H new ATOM 0 HB ILE A 13 17.786 5.166 4.937 1.00 0.00 H new ATOM 0 HG12 ILE A 13 16.510 3.567 2.697 1.00 0.00 H new ATOM 0 HG13 ILE A 13 16.676 5.312 2.687 1.00 0.00 H new ATOM 0 HG21 ILE A 13 18.534 2.808 4.746 1.00 0.00 H new ATOM 0 HG22 ILE A 13 17.537 3.058 6.199 1.00 0.00 H new ATOM 0 HG23 ILE A 13 16.836 2.273 4.763 1.00 0.00 H new ATOM 0 HD11 ILE A 13 18.444 4.256 1.383 1.00 0.00 H new ATOM 0 HD12 ILE A 13 19.125 5.093 2.798 1.00 0.00 H new ATOM 0 HD13 ILE A 13 18.956 3.321 2.808 1.00 0.00 H new ATOM 186 N GLY A 14 15.212 3.801 7.253 1.00 0.00 N ATOM 187 CA GLY A 14 15.214 3.778 8.696 1.00 0.00 C ATOM 188 C GLY A 14 13.856 3.475 9.268 1.00 0.00 C ATOM 189 O GLY A 14 13.681 3.446 10.490 1.00 0.00 O ATOM 0 H GLY A 14 14.801 2.980 6.809 1.00 0.00 H new ATOM 0 HA2 GLY A 14 15.926 3.030 9.043 1.00 0.00 H new ATOM 0 HA3 GLY A 14 15.556 4.742 9.071 1.00 0.00 H new ATOM 193 N GLY A 15 12.903 3.225 8.395 1.00 0.00 N ATOM 194 CA GLY A 15 11.562 2.922 8.831 1.00 0.00 C ATOM 195 C GLY A 15 10.774 4.165 9.147 1.00 0.00 C ATOM 196 O GLY A 15 11.341 5.258 9.285 1.00 0.00 O ATOM 0 H GLY A 15 13.034 3.226 7.383 1.00 0.00 H new ATOM 0 HA2 GLY A 15 11.048 2.355 8.054 1.00 0.00 H new ATOM 0 HA3 GLY A 15 11.604 2.286 9.715 1.00 0.00 H new ATOM 200 N GLY A 16 9.492 4.017 9.250 1.00 0.00 N ATOM 201 CA GLY A 16 8.640 5.128 9.541 1.00 0.00 C ATOM 202 C GLY A 16 7.241 4.836 9.111 1.00 0.00 C ATOM 203 O GLY A 16 6.918 3.687 8.803 1.00 0.00 O ATOM 0 H GLY A 16 9.007 3.127 9.136 1.00 0.00 H new ATOM 0 HA2 GLY A 16 8.662 5.341 10.610 1.00 0.00 H new ATOM 0 HA3 GLY A 16 9.006 6.019 9.031 1.00 0.00 H new ATOM 207 N SER A 17 6.424 5.838 9.064 1.00 0.00 N ATOM 208 CA SER A 17 5.048 5.686 8.689 1.00 0.00 C ATOM 209 C SER A 17 4.608 6.866 7.830 1.00 0.00 C ATOM 210 O SER A 17 5.219 7.947 7.898 1.00 0.00 O ATOM 211 CB SER A 17 4.199 5.558 9.954 1.00 0.00 C ATOM 212 OG SER A 17 4.546 6.562 10.900 1.00 0.00 O ATOM 0 H SER A 17 6.692 6.797 9.286 1.00 0.00 H new ATOM 0 HA SER A 17 4.917 4.783 8.093 1.00 0.00 H new ATOM 0 HB2 SER A 17 3.143 5.643 9.698 1.00 0.00 H new ATOM 0 HB3 SER A 17 4.342 4.572 10.395 1.00 0.00 H new ATOM 0 HG SER A 17 3.990 6.463 11.701 1.00 0.00 H new ATOM 218 N ALA A 18 3.611 6.659 7.000 1.00 0.00 N ATOM 219 CA ALA A 18 3.102 7.684 6.157 1.00 0.00 C ATOM 220 C ALA A 18 1.631 7.527 6.052 1.00 0.00 C ATOM 221 O ALA A 18 1.074 6.447 6.343 1.00 0.00 O ATOM 222 CB ALA A 18 3.702 7.592 4.762 1.00 0.00 C ATOM 0 H ALA A 18 3.135 5.762 6.900 1.00 0.00 H new ATOM 0 HA ALA A 18 3.363 8.651 6.587 1.00 0.00 H new ATOM 0 HB1 ALA A 18 3.295 8.388 4.138 1.00 0.00 H new ATOM 0 HB2 ALA A 18 4.785 7.697 4.824 1.00 0.00 H new ATOM 0 HB3 ALA A 18 3.456 6.625 4.323 1.00 0.00 H new ATOM 228 N ASN A 19 1.008 8.577 5.686 1.00 0.00 N ATOM 229 CA ASN A 19 -0.378 8.588 5.408 1.00 0.00 C ATOM 230 C ASN A 19 -0.508 8.603 3.924 1.00 0.00 C ATOM 231 O ASN A 19 0.128 9.396 3.258 1.00 0.00 O ATOM 232 CB ASN A 19 -1.079 9.804 6.056 1.00 0.00 C ATOM 233 CG ASN A 19 -0.493 11.152 5.660 1.00 0.00 C ATOM 234 OD1 ASN A 19 -0.941 11.806 4.722 1.00 0.00 O ATOM 235 ND2 ASN A 19 0.515 11.564 6.372 1.00 0.00 N ATOM 0 H ASN A 19 1.460 9.484 5.567 1.00 0.00 H new ATOM 0 HA ASN A 19 -0.867 7.711 5.831 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -2.135 9.787 5.785 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -1.027 9.703 7.140 1.00 0.00 H new ATOM 0 HD21 ASN A 19 0.960 12.457 6.158 1.00 0.00 H new ATOM 0 HD22 ASN A 19 0.861 10.994 7.144 1.00 0.00 H new ATOM 242 N VAL A 20 -1.181 7.651 3.414 1.00 0.00 N ATOM 243 CA VAL A 20 -1.424 7.570 1.993 1.00 0.00 C ATOM 244 C VAL A 20 -2.870 7.920 1.700 1.00 0.00 C ATOM 245 O VAL A 20 -3.772 7.383 2.317 1.00 0.00 O ATOM 246 CB VAL A 20 -1.127 6.165 1.426 1.00 0.00 C ATOM 247 CG1 VAL A 20 -1.283 6.171 -0.076 1.00 0.00 C ATOM 248 CG2 VAL A 20 0.257 5.717 1.828 1.00 0.00 C ATOM 0 H VAL A 20 -1.591 6.890 3.955 1.00 0.00 H new ATOM 0 HA VAL A 20 -0.750 8.278 1.511 1.00 0.00 H new ATOM 0 HB VAL A 20 -1.842 5.455 1.841 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -1.072 5.176 -0.468 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -2.303 6.454 -0.335 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -0.587 6.888 -0.511 1.00 0.00 H new ATOM 0 HG21 VAL A 20 0.451 4.725 1.420 1.00 0.00 H new ATOM 0 HG22 VAL A 20 0.994 6.419 1.439 1.00 0.00 H new ATOM 0 HG23 VAL A 20 0.327 5.683 2.915 1.00 0.00 H new ATOM 258 N TYR A 21 -3.076 8.808 0.776 1.00 0.00 N ATOM 259 CA TYR A 21 -4.394 9.235 0.397 1.00 0.00 C ATOM 260 C TYR A 21 -4.724 8.802 -0.997 1.00 0.00 C ATOM 261 O TYR A 21 -4.036 9.161 -1.951 1.00 0.00 O ATOM 262 CB TYR A 21 -4.540 10.736 0.544 1.00 0.00 C ATOM 263 CG TYR A 21 -4.824 11.172 1.962 1.00 0.00 C ATOM 264 CD1 TYR A 21 -3.857 11.099 2.956 1.00 0.00 C ATOM 265 CD2 TYR A 21 -6.077 11.661 2.300 1.00 0.00 C ATOM 266 CE1 TYR A 21 -4.144 11.505 4.254 1.00 0.00 C ATOM 267 CE2 TYR A 21 -6.371 12.064 3.582 1.00 0.00 C ATOM 268 CZ TYR A 21 -5.408 11.987 4.556 1.00 0.00 C ATOM 269 OH TYR A 21 -5.708 12.397 5.840 1.00 0.00 O ATOM 0 H TYR A 21 -2.326 9.264 0.256 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.104 8.757 1.072 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -3.626 11.219 0.199 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -5.346 11.081 -0.103 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -2.873 10.723 2.718 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -6.840 11.727 1.539 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -3.387 11.445 5.022 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -7.355 12.439 3.821 1.00 0.00 H new ATOM 0 HH TYR A 21 -6.637 12.707 5.876 1.00 0.00 H new ATOM 279 N VAL A 22 -5.776 8.043 -1.110 1.00 0.00 N ATOM 280 CA VAL A 22 -6.217 7.516 -2.371 1.00 0.00 C ATOM 281 C VAL A 22 -7.707 7.691 -2.544 1.00 0.00 C ATOM 282 O VAL A 22 -8.495 7.414 -1.633 1.00 0.00 O ATOM 283 CB VAL A 22 -5.803 6.034 -2.523 1.00 0.00 C ATOM 284 CG1 VAL A 22 -6.136 5.249 -1.289 1.00 0.00 C ATOM 285 CG2 VAL A 22 -6.413 5.377 -3.763 1.00 0.00 C ATOM 0 H VAL A 22 -6.359 7.769 -0.320 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.727 8.082 -3.163 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.721 6.027 -2.658 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -5.833 4.211 -1.426 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -5.607 5.672 -0.435 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -7.210 5.293 -1.109 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -6.089 4.338 -3.821 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -7.500 5.415 -3.697 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -6.084 5.909 -4.656 1.00 0.00 H new ATOM 295 N ASN A 23 -8.094 8.219 -3.662 1.00 0.00 N ATOM 296 CA ASN A 23 -9.496 8.390 -3.949 1.00 0.00 C ATOM 297 C ASN A 23 -10.026 7.203 -4.690 1.00 0.00 C ATOM 298 O ASN A 23 -9.420 6.723 -5.651 1.00 0.00 O ATOM 299 CB ASN A 23 -9.819 9.700 -4.692 1.00 0.00 C ATOM 300 CG ASN A 23 -9.069 9.875 -5.982 1.00 0.00 C ATOM 301 OD1 ASN A 23 -9.518 9.459 -7.042 1.00 0.00 O ATOM 302 ND2 ASN A 23 -7.929 10.495 -5.896 1.00 0.00 N ATOM 0 H ASN A 23 -7.464 8.542 -4.396 1.00 0.00 H new ATOM 0 HA ASN A 23 -10.002 8.466 -2.986 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -10.889 9.733 -4.899 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -9.595 10.542 -4.037 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -7.369 10.652 -6.734 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -7.595 10.824 -4.990 1.00 0.00 H new ATOM 309 N LEU A 24 -11.114 6.714 -4.206 1.00 0.00 N ATOM 310 CA LEU A 24 -11.788 5.585 -4.776 1.00 0.00 C ATOM 311 C LEU A 24 -13.047 6.048 -5.412 1.00 0.00 C ATOM 312 O LEU A 24 -13.507 7.151 -5.118 1.00 0.00 O ATOM 313 CB LEU A 24 -12.131 4.525 -3.739 1.00 0.00 C ATOM 314 CG LEU A 24 -10.994 3.708 -3.139 1.00 0.00 C ATOM 315 CD1 LEU A 24 -10.201 4.484 -2.100 1.00 0.00 C ATOM 316 CD2 LEU A 24 -11.558 2.437 -2.583 1.00 0.00 C ATOM 0 H LEU A 24 -11.577 7.094 -3.381 1.00 0.00 H new ATOM 0 HA LEU A 24 -11.113 5.134 -5.504 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -12.654 5.018 -2.920 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -12.836 3.830 -4.195 1.00 0.00 H new ATOM 0 HG LEU A 24 -10.278 3.472 -3.926 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -9.404 3.854 -1.706 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -9.768 5.371 -2.561 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -10.862 4.784 -1.287 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -10.755 1.841 -2.150 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -12.292 2.671 -1.812 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -12.038 1.872 -3.382 1.00 0.00 H new ATOM 328 N ALA A 25 -13.582 5.220 -6.282 1.00 0.00 N ATOM 329 CA ALA A 25 -14.824 5.505 -6.986 1.00 0.00 C ATOM 330 C ALA A 25 -15.938 5.738 -5.976 1.00 0.00 C ATOM 331 O ALA A 25 -16.223 4.874 -5.180 1.00 0.00 O ATOM 332 CB ALA A 25 -15.183 4.340 -7.891 1.00 0.00 C ATOM 0 H ALA A 25 -13.168 4.321 -6.527 1.00 0.00 H new ATOM 0 HA ALA A 25 -14.696 6.400 -7.595 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -16.113 4.559 -8.415 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -14.385 4.184 -8.617 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -15.308 3.439 -7.291 1.00 0.00 H new ATOM 338 N PRO A 26 -16.574 6.912 -5.999 1.00 0.00 N ATOM 339 CA PRO A 26 -17.614 7.273 -5.032 1.00 0.00 C ATOM 340 C PRO A 26 -18.957 6.587 -5.294 1.00 0.00 C ATOM 341 O PRO A 26 -19.921 6.791 -4.554 1.00 0.00 O ATOM 342 CB PRO A 26 -17.740 8.781 -5.204 1.00 0.00 C ATOM 343 CG PRO A 26 -17.338 9.029 -6.614 1.00 0.00 C ATOM 344 CD PRO A 26 -16.306 7.998 -6.949 1.00 0.00 C ATOM 0 HA PRO A 26 -17.347 6.957 -4.024 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -18.759 9.118 -5.017 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -17.094 9.315 -4.507 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -18.196 8.950 -7.282 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -16.934 10.035 -6.731 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -16.400 7.659 -7.981 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -15.296 8.391 -6.833 1.00 0.00 H new ATOM 352 N VAL A 27 -19.007 5.800 -6.334 1.00 0.00 N ATOM 353 CA VAL A 27 -20.183 5.049 -6.708 1.00 0.00 C ATOM 354 C VAL A 27 -19.776 3.599 -6.882 1.00 0.00 C ATOM 355 O VAL A 27 -19.048 3.261 -7.829 1.00 0.00 O ATOM 356 CB VAL A 27 -20.787 5.538 -8.050 1.00 0.00 C ATOM 357 CG1 VAL A 27 -21.957 4.658 -8.447 1.00 0.00 C ATOM 358 CG2 VAL A 27 -21.226 6.987 -7.961 1.00 0.00 C ATOM 0 H VAL A 27 -18.216 5.657 -6.961 1.00 0.00 H new ATOM 0 HA VAL A 27 -20.933 5.180 -5.928 1.00 0.00 H new ATOM 0 HB VAL A 27 -20.013 5.469 -8.814 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -22.374 5.010 -9.391 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -21.616 3.629 -8.563 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -22.724 4.701 -7.673 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -21.645 7.300 -8.917 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -21.982 7.091 -7.182 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -20.367 7.613 -7.719 1.00 0.00 H new ATOM 368 N VAL A 28 -20.207 2.751 -5.976 1.00 0.00 N ATOM 369 CA VAL A 28 -19.843 1.344 -6.002 1.00 0.00 C ATOM 370 C VAL A 28 -21.014 0.543 -5.494 1.00 0.00 C ATOM 371 O VAL A 28 -21.376 0.642 -4.366 1.00 0.00 O ATOM 372 CB VAL A 28 -18.643 1.024 -5.077 1.00 0.00 C ATOM 373 CG1 VAL A 28 -18.085 -0.335 -5.386 1.00 0.00 C ATOM 374 CG2 VAL A 28 -17.567 2.057 -5.167 1.00 0.00 C ATOM 0 H VAL A 28 -20.818 3.011 -5.201 1.00 0.00 H new ATOM 0 HA VAL A 28 -19.571 1.096 -7.028 1.00 0.00 H new ATOM 0 HB VAL A 28 -19.019 1.033 -4.054 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -17.243 -0.541 -4.726 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -18.858 -1.089 -5.235 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -17.749 -0.363 -6.422 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -16.748 1.788 -4.500 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -17.199 2.110 -6.191 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -17.969 3.027 -4.875 1.00 0.00 H new ATOM 384 N ASN A 29 -21.599 -0.200 -6.335 1.00 0.00 N ATOM 385 CA ASN A 29 -22.750 -1.034 -5.999 1.00 0.00 C ATOM 386 C ASN A 29 -22.336 -2.470 -5.795 1.00 0.00 C ATOM 387 O ASN A 29 -21.311 -2.887 -6.307 1.00 0.00 O ATOM 388 CB ASN A 29 -23.820 -0.925 -7.098 1.00 0.00 C ATOM 389 CG ASN A 29 -23.231 -0.716 -8.481 1.00 0.00 C ATOM 390 OD1 ASN A 29 -22.955 -1.662 -9.215 1.00 0.00 O ATOM 391 ND2 ASN A 29 -23.017 0.534 -8.834 1.00 0.00 N ATOM 0 H ASN A 29 -21.311 -0.273 -7.311 1.00 0.00 H new ATOM 0 HA ASN A 29 -23.175 -0.675 -5.062 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -24.425 -1.832 -7.100 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -24.489 -0.097 -6.865 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -22.609 0.744 -9.745 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -23.260 1.293 -8.197 1.00 0.00 H new ATOM 398 N VAL A 30 -23.099 -3.192 -4.961 1.00 0.00 N ATOM 399 CA VAL A 30 -22.900 -4.627 -4.708 1.00 0.00 C ATOM 400 C VAL A 30 -22.637 -5.399 -6.007 1.00 0.00 C ATOM 401 O VAL A 30 -23.472 -5.431 -6.905 1.00 0.00 O ATOM 402 CB VAL A 30 -24.134 -5.227 -3.954 1.00 0.00 C ATOM 403 CG1 VAL A 30 -24.111 -6.751 -3.958 1.00 0.00 C ATOM 404 CG2 VAL A 30 -24.153 -4.723 -2.513 1.00 0.00 C ATOM 0 H VAL A 30 -23.879 -2.793 -4.438 1.00 0.00 H new ATOM 0 HA VAL A 30 -22.017 -4.732 -4.077 1.00 0.00 H new ATOM 0 HB VAL A 30 -25.033 -4.901 -4.477 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -24.983 -7.129 -3.425 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -24.129 -7.112 -4.986 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -23.204 -7.102 -3.465 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -25.013 -5.143 -1.992 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -23.237 -5.030 -2.008 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -24.222 -3.635 -2.509 1.00 0.00 H new ATOM 414 N GLY A 31 -21.449 -5.972 -6.096 1.00 0.00 N ATOM 415 CA GLY A 31 -21.069 -6.730 -7.276 1.00 0.00 C ATOM 416 C GLY A 31 -20.046 -6.012 -8.138 1.00 0.00 C ATOM 417 O GLY A 31 -19.546 -6.563 -9.114 1.00 0.00 O ATOM 0 H GLY A 31 -20.734 -5.928 -5.370 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -20.664 -7.694 -6.967 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -21.959 -6.935 -7.872 1.00 0.00 H new ATOM 421 N GLN A 32 -19.736 -4.786 -7.773 1.00 0.00 N ATOM 422 CA GLN A 32 -18.736 -3.962 -8.459 1.00 0.00 C ATOM 423 C GLN A 32 -17.340 -4.486 -8.248 1.00 0.00 C ATOM 424 O GLN A 32 -17.147 -5.546 -7.659 1.00 0.00 O ATOM 425 CB GLN A 32 -18.844 -2.528 -7.973 1.00 0.00 C ATOM 426 CG GLN A 32 -19.589 -1.632 -8.936 1.00 0.00 C ATOM 427 CD GLN A 32 -18.668 -0.918 -9.877 1.00 0.00 C ATOM 428 OE1 GLN A 32 -18.991 -0.698 -11.025 1.00 0.00 O ATOM 429 NE2 GLN A 32 -17.587 -0.422 -9.355 1.00 0.00 N ATOM 0 H GLN A 32 -20.173 -4.317 -6.980 1.00 0.00 H new ATOM 0 HA GLN A 32 -18.936 -4.002 -9.530 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -19.350 -2.515 -7.008 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -17.843 -2.128 -7.814 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -20.299 -2.229 -9.509 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -20.169 -0.900 -8.373 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -17.347 -0.629 -8.385 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -16.978 0.175 -9.915 1.00 0.00 H new ATOM 438 N ASN A 33 -16.379 -3.794 -8.785 1.00 0.00 N ATOM 439 CA ASN A 33 -14.989 -4.156 -8.594 1.00 0.00 C ATOM 440 C ASN A 33 -14.282 -2.956 -8.087 1.00 0.00 C ATOM 441 O ASN A 33 -13.764 -2.153 -8.868 1.00 0.00 O ATOM 442 CB ASN A 33 -14.342 -4.593 -9.890 1.00 0.00 C ATOM 443 CG ASN A 33 -12.981 -5.272 -9.678 1.00 0.00 C ATOM 444 OD1 ASN A 33 -12.075 -5.144 -10.507 1.00 0.00 O ATOM 445 ND2 ASN A 33 -12.821 -6.014 -8.604 1.00 0.00 N ATOM 0 H ASN A 33 -16.525 -2.968 -9.365 1.00 0.00 H new ATOM 0 HA ASN A 33 -14.930 -4.990 -7.895 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -15.009 -5.281 -10.409 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -14.213 -3.725 -10.537 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -11.936 -6.496 -8.444 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -13.581 -6.107 -7.931 1.00 0.00 H new ATOM 452 N LEU A 34 -14.305 -2.771 -6.813 1.00 0.00 N ATOM 453 CA LEU A 34 -13.659 -1.641 -6.270 1.00 0.00 C ATOM 454 C LEU A 34 -12.293 -2.019 -5.823 1.00 0.00 C ATOM 455 O LEU A 34 -12.080 -3.077 -5.254 1.00 0.00 O ATOM 456 CB LEU A 34 -14.415 -1.028 -5.142 1.00 0.00 C ATOM 457 CG LEU A 34 -13.895 0.341 -4.728 1.00 0.00 C ATOM 458 CD1 LEU A 34 -14.067 1.363 -5.840 1.00 0.00 C ATOM 459 CD2 LEU A 34 -14.513 0.800 -3.438 1.00 0.00 C ATOM 0 H LEU A 34 -14.761 -3.384 -6.138 1.00 0.00 H new ATOM 0 HA LEU A 34 -13.605 -0.888 -7.056 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.464 -0.938 -5.426 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.374 -1.697 -4.283 1.00 0.00 H new ATOM 0 HG LEU A 34 -12.824 0.244 -4.549 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -13.685 2.329 -5.509 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -13.515 1.037 -6.722 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -15.124 1.457 -6.088 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -14.118 1.781 -3.174 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -15.595 0.864 -3.555 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -14.275 0.088 -2.647 1.00 0.00 H new ATOM 471 N VAL A 35 -11.380 -1.201 -6.155 1.00 0.00 N ATOM 472 CA VAL A 35 -10.045 -1.406 -5.871 1.00 0.00 C ATOM 473 C VAL A 35 -9.345 -0.129 -5.492 1.00 0.00 C ATOM 474 O VAL A 35 -9.598 0.944 -6.056 1.00 0.00 O ATOM 475 CB VAL A 35 -9.398 -2.153 -7.042 1.00 0.00 C ATOM 476 CG1 VAL A 35 -9.817 -1.574 -8.372 1.00 0.00 C ATOM 477 CG2 VAL A 35 -7.908 -2.258 -6.922 1.00 0.00 C ATOM 0 H VAL A 35 -11.564 -0.332 -6.656 1.00 0.00 H new ATOM 0 HA VAL A 35 -9.947 -2.034 -4.986 1.00 0.00 H new ATOM 0 HB VAL A 35 -9.774 -3.175 -6.995 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -9.338 -2.130 -9.178 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -10.900 -1.646 -8.475 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -9.516 -0.528 -8.424 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -7.511 -2.797 -7.782 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -7.474 -1.259 -6.889 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.654 -2.795 -6.008 1.00 0.00 H new ATOM 487 N VAL A 36 -8.532 -0.255 -4.489 1.00 0.00 N ATOM 488 CA VAL A 36 -7.708 0.783 -4.001 1.00 0.00 C ATOM 489 C VAL A 36 -6.400 0.681 -4.749 1.00 0.00 C ATOM 490 O VAL A 36 -5.514 -0.065 -4.334 1.00 0.00 O ATOM 491 CB VAL A 36 -7.400 0.559 -2.501 1.00 0.00 C ATOM 492 CG1 VAL A 36 -6.541 1.657 -1.988 1.00 0.00 C ATOM 493 CG2 VAL A 36 -8.650 0.448 -1.666 1.00 0.00 C ATOM 0 H VAL A 36 -8.428 -1.128 -3.972 1.00 0.00 H new ATOM 0 HA VAL A 36 -8.198 1.748 -4.132 1.00 0.00 H new ATOM 0 HB VAL A 36 -6.872 -0.391 -2.419 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -6.330 1.490 -0.932 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -5.605 1.678 -2.546 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -7.057 2.609 -2.109 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -8.378 0.292 -0.622 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -9.230 1.366 -1.756 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -9.247 -0.394 -2.015 1.00 0.00 H new ATOM 503 N ASP A 37 -6.295 1.346 -5.857 1.00 0.00 N ATOM 504 CA ASP A 37 -5.064 1.291 -6.624 1.00 0.00 C ATOM 505 C ASP A 37 -4.016 2.145 -5.962 1.00 0.00 C ATOM 506 O ASP A 37 -4.084 3.363 -6.003 1.00 0.00 O ATOM 507 CB ASP A 37 -5.253 1.747 -8.066 1.00 0.00 C ATOM 508 CG ASP A 37 -3.997 1.526 -8.897 1.00 0.00 C ATOM 509 OD1 ASP A 37 -3.034 2.316 -8.800 1.00 0.00 O ATOM 510 OD2 ASP A 37 -3.958 0.546 -9.666 1.00 0.00 O ATOM 0 H ASP A 37 -7.030 1.930 -6.257 1.00 0.00 H new ATOM 0 HA ASP A 37 -4.746 0.249 -6.649 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -6.085 1.203 -8.513 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -5.518 2.804 -8.081 1.00 0.00 H new ATOM 515 N LEU A 38 -3.062 1.497 -5.345 1.00 0.00 N ATOM 516 CA LEU A 38 -1.988 2.171 -4.644 1.00 0.00 C ATOM 517 C LEU A 38 -0.788 2.315 -5.523 1.00 0.00 C ATOM 518 O LEU A 38 0.187 2.972 -5.162 1.00 0.00 O ATOM 519 CB LEU A 38 -1.612 1.416 -3.387 1.00 0.00 C ATOM 520 CG LEU A 38 -2.696 1.325 -2.340 1.00 0.00 C ATOM 521 CD1 LEU A 38 -2.212 0.541 -1.167 1.00 0.00 C ATOM 522 CD2 LEU A 38 -3.109 2.703 -1.906 1.00 0.00 C ATOM 0 H LEU A 38 -3.004 0.479 -5.312 1.00 0.00 H new ATOM 0 HA LEU A 38 -2.343 3.164 -4.367 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.313 0.405 -3.666 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.740 1.895 -2.942 1.00 0.00 H new ATOM 0 HG LEU A 38 -3.559 0.817 -2.769 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.002 0.482 -0.418 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.940 -0.465 -1.488 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.340 1.032 -0.736 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.891 2.627 -1.151 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.249 3.225 -1.487 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.487 3.257 -2.765 1.00 0.00 H new ATOM 534 N SER A 39 -0.902 1.804 -6.723 1.00 0.00 N ATOM 535 CA SER A 39 0.182 1.814 -7.676 1.00 0.00 C ATOM 536 C SER A 39 0.308 3.217 -8.295 1.00 0.00 C ATOM 537 O SER A 39 1.142 3.477 -9.142 1.00 0.00 O ATOM 538 CB SER A 39 -0.094 0.758 -8.739 1.00 0.00 C ATOM 539 OG SER A 39 -0.387 -0.503 -8.124 1.00 0.00 O ATOM 0 H SER A 39 -1.755 1.366 -7.070 1.00 0.00 H new ATOM 0 HA SER A 39 1.127 1.579 -7.187 1.00 0.00 H new ATOM 0 HB2 SER A 39 -0.932 1.070 -9.362 1.00 0.00 H new ATOM 0 HB3 SER A 39 0.771 0.658 -9.395 1.00 0.00 H new ATOM 0 HG SER A 39 -0.101 -1.230 -8.716 1.00 0.00 H new ATOM 545 N THR A 40 -0.545 4.090 -7.848 1.00 0.00 N ATOM 546 CA THR A 40 -0.589 5.448 -8.264 1.00 0.00 C ATOM 547 C THR A 40 -0.581 6.369 -7.051 1.00 0.00 C ATOM 548 O THR A 40 -0.684 7.587 -7.176 1.00 0.00 O ATOM 549 CB THR A 40 -1.856 5.676 -9.108 1.00 0.00 C ATOM 550 OG1 THR A 40 -2.972 4.955 -8.523 1.00 0.00 O ATOM 551 CG2 THR A 40 -1.638 5.213 -10.529 1.00 0.00 C ATOM 0 H THR A 40 -1.256 3.859 -7.154 1.00 0.00 H new ATOM 0 HA THR A 40 0.290 5.675 -8.868 1.00 0.00 H new ATOM 0 HB THR A 40 -2.079 6.743 -9.120 1.00 0.00 H new ATOM 0 HG1 THR A 40 -2.931 4.014 -8.793 1.00 0.00 H new ATOM 0 HG21 THR A 40 -2.545 5.382 -11.110 1.00 0.00 H new ATOM 0 HG22 THR A 40 -0.814 5.772 -10.971 1.00 0.00 H new ATOM 0 HG23 THR A 40 -1.398 4.150 -10.532 1.00 0.00 H new ATOM 559 N GLN A 41 -0.424 5.778 -5.868 1.00 0.00 N ATOM 560 CA GLN A 41 -0.521 6.540 -4.624 1.00 0.00 C ATOM 561 C GLN A 41 0.740 6.404 -3.817 1.00 0.00 C ATOM 562 O GLN A 41 1.039 7.235 -2.964 1.00 0.00 O ATOM 563 CB GLN A 41 -1.657 6.011 -3.766 1.00 0.00 C ATOM 564 CG GLN A 41 -2.916 5.710 -4.523 1.00 0.00 C ATOM 565 CD GLN A 41 -3.526 6.887 -5.231 1.00 0.00 C ATOM 566 OE1 GLN A 41 -3.404 8.043 -4.815 1.00 0.00 O ATOM 567 NE2 GLN A 41 -4.187 6.598 -6.306 1.00 0.00 N ATOM 0 H GLN A 41 -0.231 4.784 -5.744 1.00 0.00 H new ATOM 0 HA GLN A 41 -0.692 7.582 -4.896 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -1.324 5.103 -3.263 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -1.880 6.742 -2.989 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -2.704 4.933 -5.257 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -3.651 5.301 -3.829 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -4.262 5.628 -6.613 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -4.633 7.340 -6.846 1.00 0.00 H new ATOM 576 N ILE A 42 1.451 5.335 -4.044 1.00 0.00 N ATOM 577 CA ILE A 42 2.639 5.061 -3.293 1.00 0.00 C ATOM 578 C ILE A 42 3.743 4.736 -4.278 1.00 0.00 C ATOM 579 O ILE A 42 3.488 4.096 -5.305 1.00 0.00 O ATOM 580 CB ILE A 42 2.436 3.874 -2.305 1.00 0.00 C ATOM 581 CG1 ILE A 42 1.113 4.036 -1.543 1.00 0.00 C ATOM 582 CG2 ILE A 42 3.571 3.869 -1.304 1.00 0.00 C ATOM 583 CD1 ILE A 42 0.783 2.906 -0.589 1.00 0.00 C ATOM 0 H ILE A 42 1.224 4.635 -4.750 1.00 0.00 H new ATOM 0 HA ILE A 42 2.896 5.934 -2.692 1.00 0.00 H new ATOM 0 HB ILE A 42 2.416 2.942 -2.870 1.00 0.00 H new ATOM 0 HG12 ILE A 42 1.147 4.969 -0.980 1.00 0.00 H new ATOM 0 HG13 ILE A 42 0.303 4.129 -2.266 1.00 0.00 H new ATOM 0 HG21 ILE A 42 3.438 3.041 -0.607 1.00 0.00 H new ATOM 0 HG22 ILE A 42 4.519 3.753 -1.829 1.00 0.00 H new ATOM 0 HG23 ILE A 42 3.575 4.810 -0.753 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -0.169 3.110 -0.098 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.712 1.971 -1.144 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.568 2.823 0.162 1.00 0.00 H new ATOM 595 N PHE A 43 4.930 5.216 -4.013 1.00 0.00 N ATOM 596 CA PHE A 43 6.059 5.041 -4.908 1.00 0.00 C ATOM 597 C PHE A 43 7.288 4.716 -4.100 1.00 0.00 C ATOM 598 O PHE A 43 7.419 5.169 -2.968 1.00 0.00 O ATOM 599 CB PHE A 43 6.327 6.343 -5.693 1.00 0.00 C ATOM 600 CG PHE A 43 5.132 6.882 -6.428 1.00 0.00 C ATOM 601 CD1 PHE A 43 4.249 7.740 -5.791 1.00 0.00 C ATOM 602 CD2 PHE A 43 4.881 6.519 -7.735 1.00 0.00 C ATOM 603 CE1 PHE A 43 3.144 8.220 -6.439 1.00 0.00 C ATOM 604 CE2 PHE A 43 3.771 6.995 -8.397 1.00 0.00 C ATOM 605 CZ PHE A 43 2.896 7.848 -7.748 1.00 0.00 C ATOM 0 H PHE A 43 5.148 5.743 -3.167 1.00 0.00 H new ATOM 0 HA PHE A 43 5.831 4.234 -5.604 1.00 0.00 H new ATOM 0 HB2 PHE A 43 6.685 7.104 -4.999 1.00 0.00 H new ATOM 0 HB3 PHE A 43 7.128 6.162 -6.410 1.00 0.00 H new ATOM 0 HD1 PHE A 43 4.436 8.034 -4.769 1.00 0.00 H new ATOM 0 HD2 PHE A 43 5.563 5.854 -8.245 1.00 0.00 H new ATOM 0 HE1 PHE A 43 2.466 8.889 -5.929 1.00 0.00 H new ATOM 0 HE2 PHE A 43 3.584 6.703 -9.420 1.00 0.00 H new ATOM 0 HZ PHE A 43 2.023 8.222 -8.262 1.00 0.00 H new ATOM 615 N CYS A 44 8.173 3.973 -4.671 1.00 0.00 N ATOM 616 CA CYS A 44 9.420 3.634 -4.050 1.00 0.00 C ATOM 617 C CYS A 44 10.563 4.000 -4.955 1.00 0.00 C ATOM 618 O CYS A 44 10.529 3.730 -6.155 1.00 0.00 O ATOM 619 CB CYS A 44 9.469 2.159 -3.658 1.00 0.00 C ATOM 620 SG CYS A 44 8.397 1.737 -2.248 1.00 0.00 S ATOM 0 H CYS A 44 8.053 3.573 -5.602 1.00 0.00 H new ATOM 0 HA CYS A 44 9.511 4.209 -3.129 1.00 0.00 H new ATOM 0 HB2 CYS A 44 9.178 1.555 -4.517 1.00 0.00 H new ATOM 0 HB3 CYS A 44 10.497 1.892 -3.414 1.00 0.00 H new ATOM 625 N HIS A 45 11.560 4.625 -4.399 1.00 0.00 N ATOM 626 CA HIS A 45 12.689 5.068 -5.153 1.00 0.00 C ATOM 627 C HIS A 45 13.942 4.415 -4.650 1.00 0.00 C ATOM 628 O HIS A 45 14.068 4.056 -3.468 1.00 0.00 O ATOM 629 CB HIS A 45 12.834 6.617 -5.163 1.00 0.00 C ATOM 630 CG HIS A 45 12.991 7.277 -3.823 1.00 0.00 C ATOM 631 ND1 HIS A 45 11.991 7.982 -3.202 1.00 0.00 N ATOM 632 CD2 HIS A 45 14.062 7.341 -2.995 1.00 0.00 C ATOM 633 CE1 HIS A 45 12.466 8.437 -2.041 1.00 0.00 C ATOM 634 NE2 HIS A 45 13.725 8.076 -1.869 1.00 0.00 N ATOM 0 H HIS A 45 11.610 4.841 -3.403 1.00 0.00 H new ATOM 0 HA HIS A 45 12.522 4.766 -6.187 1.00 0.00 H new ATOM 0 HB2 HIS A 45 13.697 6.876 -5.776 1.00 0.00 H new ATOM 0 HB3 HIS A 45 11.957 7.040 -5.653 1.00 0.00 H new ATOM 0 HD1 HIS A 45 11.049 8.132 -3.564 1.00 0.00 H new ATOM 0 HD2 HIS A 45 15.026 6.891 -3.183 1.00 0.00 H new ATOM 0 HE1 HIS A 45 11.896 9.023 -1.335 1.00 0.00 H new ATOM 642 N ASN A 46 14.843 4.259 -5.534 1.00 0.00 N ATOM 643 CA ASN A 46 16.092 3.644 -5.265 1.00 0.00 C ATOM 644 C ASN A 46 17.097 4.741 -5.066 1.00 0.00 C ATOM 645 O ASN A 46 17.545 5.353 -6.039 1.00 0.00 O ATOM 646 CB ASN A 46 16.521 2.851 -6.471 1.00 0.00 C ATOM 647 CG ASN A 46 15.458 1.921 -7.025 1.00 0.00 C ATOM 648 OD1 ASN A 46 14.600 2.335 -7.817 1.00 0.00 O ATOM 649 ND2 ASN A 46 15.546 0.681 -6.695 1.00 0.00 N ATOM 0 H ASN A 46 14.735 4.564 -6.501 1.00 0.00 H new ATOM 0 HA ASN A 46 16.017 2.995 -4.392 1.00 0.00 H new ATOM 0 HB2 ASN A 46 16.824 3.544 -7.256 1.00 0.00 H new ATOM 0 HB3 ASN A 46 17.400 2.262 -6.209 1.00 0.00 H new ATOM 0 HD21 ASN A 46 14.896 0.001 -7.089 1.00 0.00 H new ATOM 0 HD22 ASN A 46 16.266 0.378 -6.039 1.00 0.00 H new ATOM 656 N ASP A 47 17.437 5.027 -3.843 1.00 0.00 N ATOM 657 CA ASP A 47 18.381 6.074 -3.554 1.00 0.00 C ATOM 658 C ASP A 47 19.804 5.575 -3.597 1.00 0.00 C ATOM 659 O ASP A 47 20.739 6.363 -3.716 1.00 0.00 O ATOM 660 CB ASP A 47 18.046 6.819 -2.245 1.00 0.00 C ATOM 661 CG ASP A 47 17.753 5.925 -1.047 1.00 0.00 C ATOM 662 OD1 ASP A 47 17.788 4.670 -1.183 1.00 0.00 O ATOM 663 OD2 ASP A 47 17.429 6.475 0.030 1.00 0.00 O ATOM 0 H ASP A 47 17.072 4.546 -3.021 1.00 0.00 H new ATOM 0 HA ASP A 47 18.291 6.814 -4.350 1.00 0.00 H new ATOM 0 HB2 ASP A 47 18.881 7.473 -1.994 1.00 0.00 H new ATOM 0 HB3 ASP A 47 17.181 7.459 -2.421 1.00 0.00 H new ATOM 668 N TYR A 48 19.970 4.268 -3.522 1.00 0.00 N ATOM 669 CA TYR A 48 21.302 3.644 -3.658 1.00 0.00 C ATOM 670 C TYR A 48 21.178 2.383 -4.518 1.00 0.00 C ATOM 671 O TYR A 48 21.520 1.285 -4.070 1.00 0.00 O ATOM 672 CB TYR A 48 21.897 3.271 -2.285 1.00 0.00 C ATOM 673 CG TYR A 48 22.001 4.414 -1.307 1.00 0.00 C ATOM 674 CD1 TYR A 48 20.935 4.730 -0.497 1.00 0.00 C ATOM 675 CD2 TYR A 48 23.146 5.187 -1.218 1.00 0.00 C ATOM 676 CE1 TYR A 48 20.988 5.781 0.376 1.00 0.00 C ATOM 677 CE2 TYR A 48 23.216 6.244 -0.334 1.00 0.00 C ATOM 678 CZ TYR A 48 22.131 6.538 0.460 1.00 0.00 C ATOM 679 OH TYR A 48 22.184 7.610 1.330 1.00 0.00 O ATOM 0 H TYR A 48 19.209 3.606 -3.368 1.00 0.00 H new ATOM 0 HA TYR A 48 21.971 4.364 -4.129 1.00 0.00 H new ATOM 0 HB2 TYR A 48 21.284 2.486 -1.841 1.00 0.00 H new ATOM 0 HB3 TYR A 48 22.891 2.851 -2.438 1.00 0.00 H new ATOM 0 HD1 TYR A 48 20.036 4.134 -0.552 1.00 0.00 H new ATOM 0 HD2 TYR A 48 23.994 4.960 -1.847 1.00 0.00 H new ATOM 0 HE1 TYR A 48 20.135 6.015 0.996 1.00 0.00 H new ATOM 0 HE2 TYR A 48 24.116 6.837 -0.266 1.00 0.00 H new ATOM 0 HH TYR A 48 23.063 8.039 1.268 1.00 0.00 H new ATOM 689 N PRO A 49 20.772 2.535 -5.796 1.00 0.00 N ATOM 690 CA PRO A 49 20.425 1.394 -6.680 1.00 0.00 C ATOM 691 C PRO A 49 21.619 0.534 -7.103 1.00 0.00 C ATOM 692 O PRO A 49 21.463 -0.472 -7.800 1.00 0.00 O ATOM 693 CB PRO A 49 19.828 2.083 -7.907 1.00 0.00 C ATOM 694 CG PRO A 49 20.500 3.411 -7.943 1.00 0.00 C ATOM 695 CD PRO A 49 20.644 3.826 -6.518 1.00 0.00 C ATOM 0 HA PRO A 49 19.764 0.696 -6.167 1.00 0.00 H new ATOM 0 HB2 PRO A 49 20.021 1.514 -8.817 1.00 0.00 H new ATOM 0 HB3 PRO A 49 18.746 2.186 -7.819 1.00 0.00 H new ATOM 0 HG2 PRO A 49 21.472 3.345 -8.432 1.00 0.00 H new ATOM 0 HG3 PRO A 49 19.909 4.135 -8.504 1.00 0.00 H new ATOM 0 HD2 PRO A 49 21.520 4.458 -6.370 1.00 0.00 H new ATOM 0 HD3 PRO A 49 19.779 4.394 -6.175 1.00 0.00 H new ATOM 703 N GLU A 50 22.794 0.922 -6.709 1.00 0.00 N ATOM 704 CA GLU A 50 23.975 0.193 -7.096 1.00 0.00 C ATOM 705 C GLU A 50 24.641 -0.407 -5.881 1.00 0.00 C ATOM 706 O GLU A 50 25.447 -1.335 -5.985 1.00 0.00 O ATOM 707 CB GLU A 50 24.935 1.121 -7.816 1.00 0.00 C ATOM 708 CG GLU A 50 25.465 2.239 -6.943 1.00 0.00 C ATOM 709 CD GLU A 50 26.284 3.220 -7.715 1.00 0.00 C ATOM 710 OE1 GLU A 50 27.373 2.858 -8.177 1.00 0.00 O ATOM 711 OE2 GLU A 50 25.869 4.381 -7.852 1.00 0.00 O ATOM 0 H GLU A 50 22.966 1.737 -6.121 1.00 0.00 H new ATOM 0 HA GLU A 50 23.689 -0.616 -7.768 1.00 0.00 H new ATOM 0 HB2 GLU A 50 25.774 0.539 -8.196 1.00 0.00 H new ATOM 0 HB3 GLU A 50 24.430 1.554 -8.680 1.00 0.00 H new ATOM 0 HG2 GLU A 50 24.629 2.757 -6.473 1.00 0.00 H new ATOM 0 HG3 GLU A 50 26.070 1.815 -6.141 1.00 0.00 H new ATOM 718 N THR A 51 24.282 0.102 -4.738 1.00 0.00 N ATOM 719 CA THR A 51 24.903 -0.273 -3.513 1.00 0.00 C ATOM 720 C THR A 51 23.996 -1.236 -2.781 1.00 0.00 C ATOM 721 O THR A 51 24.438 -2.134 -2.066 1.00 0.00 O ATOM 722 CB THR A 51 25.087 0.989 -2.683 1.00 0.00 C ATOM 723 OG1 THR A 51 25.422 2.067 -3.570 1.00 0.00 O ATOM 724 CG2 THR A 51 26.206 0.828 -1.691 1.00 0.00 C ATOM 0 H THR A 51 23.542 0.796 -4.635 1.00 0.00 H new ATOM 0 HA THR A 51 25.866 -0.752 -3.691 1.00 0.00 H new ATOM 0 HB THR A 51 24.163 1.189 -2.140 1.00 0.00 H new ATOM 0 HG1 THR A 51 25.543 2.891 -3.053 1.00 0.00 H new ATOM 0 HG21 THR A 51 26.314 1.745 -1.112 1.00 0.00 H new ATOM 0 HG22 THR A 51 25.980 -0.000 -1.019 1.00 0.00 H new ATOM 0 HG23 THR A 51 27.136 0.622 -2.221 1.00 0.00 H new ATOM 732 N ILE A 52 22.745 -1.054 -3.006 1.00 0.00 N ATOM 733 CA ILE A 52 21.719 -1.818 -2.415 1.00 0.00 C ATOM 734 C ILE A 52 20.872 -2.430 -3.503 1.00 0.00 C ATOM 735 O ILE A 52 20.615 -1.794 -4.521 1.00 0.00 O ATOM 736 CB ILE A 52 20.825 -0.923 -1.456 1.00 0.00 C ATOM 737 CG1 ILE A 52 21.485 -0.677 -0.099 1.00 0.00 C ATOM 738 CG2 ILE A 52 19.424 -1.443 -1.276 1.00 0.00 C ATOM 739 CD1 ILE A 52 22.405 0.492 -0.040 1.00 0.00 C ATOM 0 H ILE A 52 22.398 -0.333 -3.638 1.00 0.00 H new ATOM 0 HA ILE A 52 22.166 -2.607 -1.810 1.00 0.00 H new ATOM 0 HB ILE A 52 20.743 0.034 -1.971 1.00 0.00 H new ATOM 0 HG12 ILE A 52 20.702 -0.540 0.647 1.00 0.00 H new ATOM 0 HG13 ILE A 52 22.042 -1.571 0.183 1.00 0.00 H new ATOM 0 HG21 ILE A 52 18.873 -0.780 -0.609 1.00 0.00 H new ATOM 0 HG22 ILE A 52 18.923 -1.482 -2.243 1.00 0.00 H new ATOM 0 HG23 ILE A 52 19.460 -2.444 -0.845 1.00 0.00 H new ATOM 0 HD11 ILE A 52 22.820 0.578 0.964 1.00 0.00 H new ATOM 0 HD12 ILE A 52 23.215 0.354 -0.756 1.00 0.00 H new ATOM 0 HD13 ILE A 52 21.855 1.401 -0.285 1.00 0.00 H new ATOM 751 N THR A 53 20.523 -3.686 -3.335 1.00 0.00 N ATOM 752 CA THR A 53 19.534 -4.261 -4.175 1.00 0.00 C ATOM 753 C THR A 53 18.237 -3.842 -3.499 1.00 0.00 C ATOM 754 O THR A 53 18.047 -4.056 -2.286 1.00 0.00 O ATOM 755 CB THR A 53 19.663 -5.839 -4.319 1.00 0.00 C ATOM 756 OG1 THR A 53 18.963 -6.299 -5.488 1.00 0.00 O ATOM 757 CG2 THR A 53 19.087 -6.589 -3.121 1.00 0.00 C ATOM 0 H THR A 53 20.912 -4.311 -2.629 1.00 0.00 H new ATOM 0 HA THR A 53 19.615 -3.920 -5.207 1.00 0.00 H new ATOM 0 HB THR A 53 20.731 -6.044 -4.390 1.00 0.00 H new ATOM 0 HG1 THR A 53 19.054 -7.272 -5.562 1.00 0.00 H new ATOM 0 HG21 THR A 53 19.202 -7.662 -3.274 1.00 0.00 H new ATOM 0 HG22 THR A 53 19.618 -6.292 -2.216 1.00 0.00 H new ATOM 0 HG23 THR A 53 18.029 -6.349 -3.016 1.00 0.00 H new ATOM 765 N ASP A 54 17.416 -3.179 -4.189 1.00 0.00 N ATOM 766 CA ASP A 54 16.276 -2.634 -3.540 1.00 0.00 C ATOM 767 C ASP A 54 15.174 -3.636 -3.572 1.00 0.00 C ATOM 768 O ASP A 54 14.561 -3.895 -4.602 1.00 0.00 O ATOM 769 CB ASP A 54 15.855 -1.268 -4.111 1.00 0.00 C ATOM 770 CG ASP A 54 16.947 -0.179 -3.999 1.00 0.00 C ATOM 771 OD1 ASP A 54 17.155 0.407 -2.907 1.00 0.00 O ATOM 772 OD2 ASP A 54 17.580 0.114 -5.024 1.00 0.00 O ATOM 0 H ASP A 54 17.493 -2.993 -5.189 1.00 0.00 H new ATOM 0 HA ASP A 54 16.534 -2.428 -2.501 1.00 0.00 H new ATOM 0 HB2 ASP A 54 15.585 -1.391 -5.160 1.00 0.00 H new ATOM 0 HB3 ASP A 54 14.961 -0.927 -3.589 1.00 0.00 H new ATOM 777 N TYR A 55 14.922 -4.184 -2.437 1.00 0.00 N ATOM 778 CA TYR A 55 13.988 -5.238 -2.271 1.00 0.00 C ATOM 779 C TYR A 55 12.937 -4.831 -1.267 1.00 0.00 C ATOM 780 O TYR A 55 13.244 -4.321 -0.174 1.00 0.00 O ATOM 781 CB TYR A 55 14.753 -6.511 -1.864 1.00 0.00 C ATOM 782 CG TYR A 55 13.911 -7.677 -1.390 1.00 0.00 C ATOM 783 CD1 TYR A 55 12.866 -8.156 -2.147 1.00 0.00 C ATOM 784 CD2 TYR A 55 14.179 -8.301 -0.176 1.00 0.00 C ATOM 785 CE1 TYR A 55 12.106 -9.211 -1.722 1.00 0.00 C ATOM 786 CE2 TYR A 55 13.423 -9.374 0.256 1.00 0.00 C ATOM 787 CZ TYR A 55 12.385 -9.823 -0.524 1.00 0.00 C ATOM 788 OH TYR A 55 11.632 -10.905 -0.125 1.00 0.00 O ATOM 0 H TYR A 55 15.376 -3.901 -1.569 1.00 0.00 H new ATOM 0 HA TYR A 55 13.462 -5.451 -3.202 1.00 0.00 H new ATOM 0 HB2 TYR A 55 15.346 -6.841 -2.717 1.00 0.00 H new ATOM 0 HB3 TYR A 55 15.454 -6.250 -1.071 1.00 0.00 H new ATOM 0 HD1 TYR A 55 12.642 -7.690 -3.095 1.00 0.00 H new ATOM 0 HD2 TYR A 55 14.991 -7.941 0.439 1.00 0.00 H new ATOM 0 HE1 TYR A 55 11.285 -9.563 -2.329 1.00 0.00 H new ATOM 0 HE2 TYR A 55 13.646 -9.855 1.197 1.00 0.00 H new ATOM 0 HH TYR A 55 11.954 -11.226 0.743 1.00 0.00 H new ATOM 798 N VAL A 56 11.714 -5.038 -1.633 1.00 0.00 N ATOM 799 CA VAL A 56 10.623 -4.623 -0.831 1.00 0.00 C ATOM 800 C VAL A 56 9.578 -5.713 -0.790 1.00 0.00 C ATOM 801 O VAL A 56 9.397 -6.437 -1.764 1.00 0.00 O ATOM 802 CB VAL A 56 10.007 -3.312 -1.383 1.00 0.00 C ATOM 803 CG1 VAL A 56 9.414 -3.492 -2.762 1.00 0.00 C ATOM 804 CG2 VAL A 56 8.999 -2.767 -0.428 1.00 0.00 C ATOM 0 H VAL A 56 11.448 -5.502 -2.502 1.00 0.00 H new ATOM 0 HA VAL A 56 10.983 -4.432 0.180 1.00 0.00 H new ATOM 0 HB VAL A 56 10.816 -2.589 -1.485 1.00 0.00 H new ATOM 0 HG11 VAL A 56 8.995 -2.546 -3.104 1.00 0.00 H new ATOM 0 HG12 VAL A 56 10.192 -3.816 -3.453 1.00 0.00 H new ATOM 0 HG13 VAL A 56 8.626 -4.244 -2.724 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.576 -1.847 -0.831 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.204 -3.498 -0.282 1.00 0.00 H new ATOM 0 HG23 VAL A 56 9.479 -2.558 0.528 1.00 0.00 H new ATOM 814 N THR A 57 8.935 -5.848 0.333 1.00 0.00 N ATOM 815 CA THR A 57 7.890 -6.810 0.506 1.00 0.00 C ATOM 816 C THR A 57 6.893 -6.295 1.516 1.00 0.00 C ATOM 817 O THR A 57 7.273 -5.951 2.628 1.00 0.00 O ATOM 818 CB THR A 57 8.458 -8.171 0.983 1.00 0.00 C ATOM 819 OG1 THR A 57 9.604 -7.940 1.843 1.00 0.00 O ATOM 820 CG2 THR A 57 8.830 -9.080 -0.189 1.00 0.00 C ATOM 0 H THR A 57 9.125 -5.286 1.163 1.00 0.00 H new ATOM 0 HA THR A 57 7.400 -6.962 -0.456 1.00 0.00 H new ATOM 0 HB THR A 57 7.680 -8.688 1.545 1.00 0.00 H new ATOM 0 HG1 THR A 57 9.963 -8.800 2.147 1.00 0.00 H new ATOM 0 HG21 THR A 57 9.224 -10.022 0.192 1.00 0.00 H new ATOM 0 HG22 THR A 57 7.944 -9.275 -0.794 1.00 0.00 H new ATOM 0 HG23 THR A 57 9.588 -8.592 -0.802 1.00 0.00 H new ATOM 828 N LEU A 58 5.663 -6.113 1.093 1.00 0.00 N ATOM 829 CA LEU A 58 4.564 -5.831 1.998 1.00 0.00 C ATOM 830 C LEU A 58 4.523 -6.917 3.072 1.00 0.00 C ATOM 831 O LEU A 58 4.257 -8.085 2.773 1.00 0.00 O ATOM 832 CB LEU A 58 3.233 -5.809 1.220 1.00 0.00 C ATOM 833 CG LEU A 58 1.936 -5.707 2.042 1.00 0.00 C ATOM 834 CD1 LEU A 58 1.922 -4.459 2.854 1.00 0.00 C ATOM 835 CD2 LEU A 58 0.719 -5.755 1.139 1.00 0.00 C ATOM 0 H LEU A 58 5.392 -6.156 0.111 1.00 0.00 H new ATOM 0 HA LEU A 58 4.709 -4.856 2.463 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.261 -4.967 0.528 1.00 0.00 H new ATOM 0 HB3 LEU A 58 3.180 -6.716 0.617 1.00 0.00 H new ATOM 0 HG LEU A 58 1.901 -6.562 2.717 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.996 -4.408 3.427 1.00 0.00 H new ATOM 0 HD12 LEU A 58 2.772 -4.460 3.537 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.988 -3.594 2.194 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.185 -5.681 1.743 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.755 -4.923 0.436 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.712 -6.695 0.588 1.00 0.00 H new ATOM 847 N GLN A 59 4.854 -6.503 4.281 1.00 0.00 N ATOM 848 CA GLN A 59 4.895 -7.321 5.474 1.00 0.00 C ATOM 849 C GLN A 59 3.542 -7.912 5.756 1.00 0.00 C ATOM 850 O GLN A 59 3.413 -9.093 5.988 1.00 0.00 O ATOM 851 CB GLN A 59 5.282 -6.438 6.669 1.00 0.00 C ATOM 852 CG GLN A 59 5.149 -7.113 8.023 1.00 0.00 C ATOM 853 CD GLN A 59 6.259 -8.049 8.333 1.00 0.00 C ATOM 854 OE1 GLN A 59 6.226 -9.233 7.998 1.00 0.00 O ATOM 855 NE2 GLN A 59 7.231 -7.534 8.982 1.00 0.00 N ATOM 0 H GLN A 59 5.115 -5.534 4.464 1.00 0.00 H new ATOM 0 HA GLN A 59 5.619 -8.121 5.322 1.00 0.00 H new ATOM 0 HB2 GLN A 59 6.313 -6.109 6.542 1.00 0.00 H new ATOM 0 HB3 GLN A 59 4.658 -5.544 6.660 1.00 0.00 H new ATOM 0 HG2 GLN A 59 5.103 -6.348 8.798 1.00 0.00 H new ATOM 0 HG3 GLN A 59 4.206 -7.658 8.057 1.00 0.00 H new ATOM 0 HE21 GLN A 59 7.209 -6.546 9.235 1.00 0.00 H new ATOM 0 HE22 GLN A 59 8.030 -8.111 9.247 1.00 0.00 H new ATOM 864 N ARG A 60 2.556 -7.059 5.769 1.00 0.00 N ATOM 865 CA ARG A 60 1.213 -7.419 6.093 1.00 0.00 C ATOM 866 C ARG A 60 0.316 -6.268 5.775 1.00 0.00 C ATOM 867 O ARG A 60 0.773 -5.116 5.693 1.00 0.00 O ATOM 868 CB ARG A 60 1.080 -7.766 7.573 1.00 0.00 C ATOM 869 CG ARG A 60 1.564 -6.680 8.505 1.00 0.00 C ATOM 870 CD ARG A 60 1.052 -6.911 9.882 1.00 0.00 C ATOM 871 NE ARG A 60 1.548 -8.141 10.497 1.00 0.00 N ATOM 872 CZ ARG A 60 1.147 -8.600 11.682 1.00 0.00 C ATOM 873 NH1 ARG A 60 0.316 -7.870 12.438 1.00 0.00 N ATOM 874 NH2 ARG A 60 1.611 -9.759 12.127 1.00 0.00 N ATOM 0 H ARG A 60 2.672 -6.070 5.548 1.00 0.00 H new ATOM 0 HA ARG A 60 0.934 -8.296 5.509 1.00 0.00 H new ATOM 0 HB2 ARG A 60 0.034 -7.980 7.793 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.641 -8.679 7.773 1.00 0.00 H new ATOM 0 HG2 ARG A 60 2.654 -6.659 8.514 1.00 0.00 H new ATOM 0 HG3 ARG A 60 1.230 -5.707 8.144 1.00 0.00 H new ATOM 0 HD2 ARG A 60 1.330 -6.064 10.510 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -0.037 -6.943 9.854 1.00 0.00 H new ATOM 0 HE ARG A 60 2.246 -8.682 9.986 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -0.010 -6.962 12.107 1.00 0.00 H new ATOM 0 HH12 ARG A 60 0.010 -8.222 13.345 1.00 0.00 H new ATOM 0 HH21 ARG A 60 2.271 -10.294 11.563 1.00 0.00 H new ATOM 0 HH22 ARG A 60 1.308 -10.116 13.033 1.00 0.00 H new ATOM 888 N GLY A 61 -0.927 -6.559 5.603 1.00 0.00 N ATOM 889 CA GLY A 61 -1.877 -5.566 5.313 1.00 0.00 C ATOM 890 C GLY A 61 -3.071 -5.777 6.153 1.00 0.00 C ATOM 891 O GLY A 61 -3.402 -6.909 6.456 1.00 0.00 O ATOM 0 H GLY A 61 -1.306 -7.504 5.662 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -1.456 -4.578 5.500 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.149 -5.603 4.258 1.00 0.00 H new ATOM 895 N SER A 62 -3.688 -4.721 6.539 1.00 0.00 N ATOM 896 CA SER A 62 -4.830 -4.730 7.402 1.00 0.00 C ATOM 897 C SER A 62 -5.913 -3.826 6.837 1.00 0.00 C ATOM 898 O SER A 62 -5.606 -2.855 6.144 1.00 0.00 O ATOM 899 CB SER A 62 -4.377 -4.238 8.757 1.00 0.00 C ATOM 900 OG SER A 62 -3.471 -5.150 9.369 1.00 0.00 O ATOM 0 H SER A 62 -3.406 -3.783 6.255 1.00 0.00 H new ATOM 0 HA SER A 62 -5.247 -5.734 7.486 1.00 0.00 H new ATOM 0 HB2 SER A 62 -3.898 -3.265 8.650 1.00 0.00 H new ATOM 0 HB3 SER A 62 -5.244 -4.097 9.402 1.00 0.00 H new ATOM 0 HG SER A 62 -3.196 -4.801 10.243 1.00 0.00 H new ATOM 906 N ALA A 63 -7.152 -4.151 7.126 1.00 0.00 N ATOM 907 CA ALA A 63 -8.306 -3.415 6.643 1.00 0.00 C ATOM 908 C ALA A 63 -9.012 -2.801 7.819 1.00 0.00 C ATOM 909 O ALA A 63 -8.841 -3.283 8.936 1.00 0.00 O ATOM 910 CB ALA A 63 -9.248 -4.358 5.926 1.00 0.00 C ATOM 0 H ALA A 63 -7.394 -4.948 7.714 1.00 0.00 H new ATOM 0 HA ALA A 63 -7.985 -2.636 5.951 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -10.113 -3.803 5.565 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -8.732 -4.816 5.082 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -9.578 -5.136 6.615 1.00 0.00 H new ATOM 916 N TYR A 64 -9.797 -1.743 7.582 1.00 0.00 N ATOM 917 CA TYR A 64 -10.522 -1.014 8.610 1.00 0.00 C ATOM 918 C TYR A 64 -11.734 -0.328 7.974 1.00 0.00 C ATOM 919 O TYR A 64 -11.967 -0.481 6.770 1.00 0.00 O ATOM 920 CB TYR A 64 -9.642 0.047 9.329 1.00 0.00 C ATOM 921 CG TYR A 64 -8.454 -0.520 10.062 1.00 0.00 C ATOM 922 CD1 TYR A 64 -8.556 -0.939 11.375 1.00 0.00 C ATOM 923 CD2 TYR A 64 -7.239 -0.677 9.418 1.00 0.00 C ATOM 924 CE1 TYR A 64 -7.477 -1.490 12.023 1.00 0.00 C ATOM 925 CE2 TYR A 64 -6.168 -1.228 10.042 1.00 0.00 C ATOM 926 CZ TYR A 64 -6.281 -1.637 11.353 1.00 0.00 C ATOM 927 OH TYR A 64 -5.194 -2.202 11.996 1.00 0.00 O ATOM 0 H TYR A 64 -9.944 -1.367 6.645 1.00 0.00 H new ATOM 0 HA TYR A 64 -10.835 -1.734 9.366 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -9.288 0.767 8.591 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -10.263 0.595 10.038 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -9.495 -0.832 11.898 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -7.141 -0.353 8.393 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -7.565 -1.806 13.052 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -5.233 -1.345 9.515 1.00 0.00 H new ATOM 0 HH TYR A 64 -4.431 -2.233 11.382 1.00 0.00 H new ATOM 937 N GLY A 65 -12.496 0.388 8.787 1.00 0.00 N ATOM 938 CA GLY A 65 -13.662 1.134 8.340 1.00 0.00 C ATOM 939 C GLY A 65 -14.669 0.287 7.592 1.00 0.00 C ATOM 940 O GLY A 65 -14.916 -0.871 7.933 1.00 0.00 O ATOM 0 H GLY A 65 -12.319 0.468 9.788 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -14.149 1.585 9.205 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -13.336 1.951 7.696 1.00 0.00 H new ATOM 944 N GLY A 66 -15.229 0.846 6.549 1.00 0.00 N ATOM 945 CA GLY A 66 -16.173 0.122 5.744 1.00 0.00 C ATOM 946 C GLY A 66 -15.503 -0.924 4.892 1.00 0.00 C ATOM 947 O GLY A 66 -16.133 -1.832 4.425 1.00 0.00 O ATOM 0 H GLY A 66 -15.046 1.800 6.239 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -16.910 -0.355 6.390 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -16.714 0.819 5.104 1.00 0.00 H new ATOM 951 N VAL A 67 -14.219 -0.815 4.765 1.00 0.00 N ATOM 952 CA VAL A 67 -13.414 -1.693 3.928 1.00 0.00 C ATOM 953 C VAL A 67 -13.386 -3.114 4.465 1.00 0.00 C ATOM 954 O VAL A 67 -13.456 -4.074 3.706 1.00 0.00 O ATOM 955 CB VAL A 67 -11.995 -1.143 3.827 1.00 0.00 C ATOM 956 CG1 VAL A 67 -11.058 -2.054 3.079 1.00 0.00 C ATOM 957 CG2 VAL A 67 -12.019 0.210 3.193 1.00 0.00 C ATOM 0 H VAL A 67 -13.673 -0.100 5.246 1.00 0.00 H new ATOM 0 HA VAL A 67 -13.869 -1.726 2.938 1.00 0.00 H new ATOM 0 HB VAL A 67 -11.609 -1.071 4.844 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -10.066 -1.605 3.043 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -11.002 -3.016 3.588 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -11.427 -2.201 2.064 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -11.003 0.597 3.124 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -12.448 0.136 2.194 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -12.624 0.885 3.799 1.00 0.00 H new ATOM 967 N LEU A 68 -13.294 -3.259 5.758 1.00 0.00 N ATOM 968 CA LEU A 68 -13.301 -4.586 6.311 1.00 0.00 C ATOM 969 C LEU A 68 -14.722 -5.087 6.594 1.00 0.00 C ATOM 970 O LEU A 68 -14.948 -6.278 6.803 1.00 0.00 O ATOM 971 CB LEU A 68 -12.381 -4.742 7.553 1.00 0.00 C ATOM 972 CG LEU A 68 -12.456 -3.727 8.703 1.00 0.00 C ATOM 973 CD1 LEU A 68 -13.829 -3.448 9.195 1.00 0.00 C ATOM 974 CD2 LEU A 68 -11.581 -4.184 9.842 1.00 0.00 C ATOM 0 H LEU A 68 -13.215 -2.499 6.433 1.00 0.00 H new ATOM 0 HA LEU A 68 -12.876 -5.226 5.538 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -12.576 -5.727 7.978 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -11.352 -4.748 7.194 1.00 0.00 H new ATOM 0 HG LEU A 68 -12.097 -2.783 8.292 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -13.784 -2.721 10.006 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -14.433 -3.047 8.381 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -14.279 -4.371 9.560 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -11.637 -3.461 10.656 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -11.923 -5.157 10.196 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -10.550 -4.265 9.499 1.00 0.00 H new ATOM 986 N SER A 69 -15.660 -4.171 6.623 1.00 0.00 N ATOM 987 CA SER A 69 -17.017 -4.503 6.985 1.00 0.00 C ATOM 988 C SER A 69 -17.922 -4.641 5.755 1.00 0.00 C ATOM 989 O SER A 69 -18.475 -5.706 5.484 1.00 0.00 O ATOM 990 CB SER A 69 -17.562 -3.431 7.936 1.00 0.00 C ATOM 991 OG SER A 69 -18.822 -3.783 8.457 1.00 0.00 O ATOM 0 H SER A 69 -15.508 -3.187 6.400 1.00 0.00 H new ATOM 0 HA SER A 69 -17.011 -5.472 7.485 1.00 0.00 H new ATOM 0 HB2 SER A 69 -16.859 -3.281 8.756 1.00 0.00 H new ATOM 0 HB3 SER A 69 -17.641 -2.482 7.406 1.00 0.00 H new ATOM 0 HG SER A 69 -19.136 -3.077 9.060 1.00 0.00 H new ATOM 997 N ASN A 70 -18.010 -3.580 5.002 1.00 0.00 N ATOM 998 CA ASN A 70 -18.943 -3.459 3.896 1.00 0.00 C ATOM 999 C ASN A 70 -18.295 -3.944 2.623 1.00 0.00 C ATOM 1000 O ASN A 70 -18.979 -4.277 1.650 1.00 0.00 O ATOM 1001 CB ASN A 70 -19.345 -1.984 3.698 1.00 0.00 C ATOM 1002 CG ASN A 70 -19.816 -1.268 4.963 1.00 0.00 C ATOM 1003 OD1 ASN A 70 -20.394 -1.865 5.874 1.00 0.00 O ATOM 1004 ND2 ASN A 70 -19.510 0.005 5.051 1.00 0.00 N ATOM 0 H ASN A 70 -17.427 -2.754 5.136 1.00 0.00 H new ATOM 0 HA ASN A 70 -19.824 -4.058 4.125 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -18.492 -1.443 3.288 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -20.140 -1.936 2.954 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -19.751 0.530 5.891 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -19.032 0.469 4.279 1.00 0.00 H new ATOM 1011 N PHE A 71 -16.985 -3.942 2.591 1.00 0.00 N ATOM 1012 CA PHE A 71 -16.302 -4.410 1.435 1.00 0.00 C ATOM 1013 C PHE A 71 -15.594 -5.716 1.727 1.00 0.00 C ATOM 1014 O PHE A 71 -15.342 -6.053 2.889 1.00 0.00 O ATOM 1015 CB PHE A 71 -15.312 -3.371 0.920 1.00 0.00 C ATOM 1016 CG PHE A 71 -15.921 -2.050 0.527 1.00 0.00 C ATOM 1017 CD1 PHE A 71 -16.398 -1.854 -0.746 1.00 0.00 C ATOM 1018 CD2 PHE A 71 -16.019 -1.013 1.433 1.00 0.00 C ATOM 1019 CE1 PHE A 71 -16.962 -0.655 -1.117 1.00 0.00 C ATOM 1020 CE2 PHE A 71 -16.578 0.180 1.072 1.00 0.00 C ATOM 1021 CZ PHE A 71 -17.053 0.363 -0.207 1.00 0.00 C ATOM 0 H PHE A 71 -16.384 -3.622 3.351 1.00 0.00 H new ATOM 0 HA PHE A 71 -17.044 -4.583 0.656 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -14.562 -3.193 1.690 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -14.791 -3.785 0.057 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -16.329 -2.654 -1.468 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -15.649 -1.146 2.439 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -17.331 -0.518 -2.123 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -16.647 0.982 1.792 1.00 0.00 H new ATOM 0 HZ PHE A 71 -17.496 1.306 -0.491 1.00 0.00 H new ATOM 1031 N SER A 72 -15.338 -6.463 0.684 1.00 0.00 N ATOM 1032 CA SER A 72 -14.616 -7.681 0.751 1.00 0.00 C ATOM 1033 C SER A 72 -14.226 -8.073 -0.671 1.00 0.00 C ATOM 1034 O SER A 72 -15.051 -8.021 -1.594 1.00 0.00 O ATOM 1035 CB SER A 72 -15.470 -8.776 1.379 1.00 0.00 C ATOM 1036 OG SER A 72 -14.669 -9.868 1.824 1.00 0.00 O ATOM 0 H SER A 72 -15.641 -6.222 -0.259 1.00 0.00 H new ATOM 0 HA SER A 72 -13.728 -7.554 1.370 1.00 0.00 H new ATOM 0 HB2 SER A 72 -16.029 -8.366 2.220 1.00 0.00 H new ATOM 0 HB3 SER A 72 -16.201 -9.131 0.653 1.00 0.00 H new ATOM 0 HG SER A 72 -15.244 -10.554 2.224 1.00 0.00 H new ATOM 1042 N GLY A 73 -12.991 -8.386 -0.849 1.00 0.00 N ATOM 1043 CA GLY A 73 -12.496 -8.819 -2.113 1.00 0.00 C ATOM 1044 C GLY A 73 -11.184 -9.547 -1.956 1.00 0.00 C ATOM 1045 O GLY A 73 -11.173 -10.702 -1.571 1.00 0.00 O ATOM 0 H GLY A 73 -12.285 -8.349 -0.113 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -13.226 -9.474 -2.589 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -12.363 -7.959 -2.770 1.00 0.00 H new ATOM 1049 N THR A 74 -10.088 -8.848 -2.215 1.00 0.00 N ATOM 1050 CA THR A 74 -8.716 -9.384 -2.170 1.00 0.00 C ATOM 1051 C THR A 74 -7.703 -8.237 -2.253 1.00 0.00 C ATOM 1052 O THR A 74 -8.086 -7.080 -2.312 1.00 0.00 O ATOM 1053 CB THR A 74 -8.457 -10.377 -3.337 1.00 0.00 C ATOM 1054 OG1 THR A 74 -9.261 -10.032 -4.487 1.00 0.00 O ATOM 1055 CG2 THR A 74 -8.682 -11.823 -2.928 1.00 0.00 C ATOM 0 H THR A 74 -10.120 -7.861 -2.471 1.00 0.00 H new ATOM 0 HA THR A 74 -8.599 -9.918 -1.227 1.00 0.00 H new ATOM 0 HB THR A 74 -7.405 -10.288 -3.608 1.00 0.00 H new ATOM 0 HG1 THR A 74 -9.084 -10.667 -5.212 1.00 0.00 H new ATOM 0 HG21 THR A 74 -8.488 -12.476 -3.779 1.00 0.00 H new ATOM 0 HG22 THR A 74 -8.006 -12.080 -2.112 1.00 0.00 H new ATOM 0 HG23 THR A 74 -9.713 -11.952 -2.599 1.00 0.00 H new ATOM 1063 N VAL A 75 -6.438 -8.561 -2.225 1.00 0.00 N ATOM 1064 CA VAL A 75 -5.368 -7.592 -2.330 1.00 0.00 C ATOM 1065 C VAL A 75 -4.346 -8.069 -3.361 1.00 0.00 C ATOM 1066 O VAL A 75 -4.151 -9.279 -3.547 1.00 0.00 O ATOM 1067 CB VAL A 75 -4.703 -7.338 -0.934 1.00 0.00 C ATOM 1068 CG1 VAL A 75 -4.352 -8.641 -0.262 1.00 0.00 C ATOM 1069 CG2 VAL A 75 -3.461 -6.458 -1.031 1.00 0.00 C ATOM 0 H VAL A 75 -6.111 -9.522 -2.127 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.779 -6.640 -2.665 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.440 -6.806 -0.332 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -3.892 -8.439 0.705 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -5.257 -9.231 -0.117 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -3.653 -9.196 -0.888 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -3.039 -6.313 -0.036 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -2.723 -6.940 -1.672 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -3.732 -5.491 -1.454 1.00 0.00 H new ATOM 1079 N LYS A 76 -3.746 -7.135 -4.047 1.00 0.00 N ATOM 1080 CA LYS A 76 -2.774 -7.421 -5.056 1.00 0.00 C ATOM 1081 C LYS A 76 -1.477 -6.686 -4.760 1.00 0.00 C ATOM 1082 O LYS A 76 -1.491 -5.595 -4.185 1.00 0.00 O ATOM 1083 CB LYS A 76 -3.334 -7.000 -6.396 1.00 0.00 C ATOM 1084 CG LYS A 76 -2.459 -7.291 -7.585 1.00 0.00 C ATOM 1085 CD LYS A 76 -3.218 -7.010 -8.837 1.00 0.00 C ATOM 1086 CE LYS A 76 -2.425 -7.349 -10.065 1.00 0.00 C ATOM 1087 NZ LYS A 76 -3.166 -7.041 -11.306 1.00 0.00 N ATOM 0 H LYS A 76 -3.924 -6.139 -3.915 1.00 0.00 H new ATOM 0 HA LYS A 76 -2.556 -8.489 -5.072 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -4.293 -7.498 -6.542 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -3.532 -5.929 -6.367 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -1.559 -6.678 -7.547 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -2.137 -8.332 -7.568 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -4.145 -7.583 -8.835 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -3.495 -5.956 -8.864 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -1.487 -6.794 -10.056 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -2.168 -8.408 -10.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -2.582 -7.290 -12.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -4.049 -7.590 -11.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -3.389 -6.026 -11.334 1.00 0.00 H new ATOM 1101 N TYR A 77 -0.379 -7.298 -5.142 1.00 0.00 N ATOM 1102 CA TYR A 77 0.951 -6.761 -4.936 1.00 0.00 C ATOM 1103 C TYR A 77 1.845 -7.218 -6.078 1.00 0.00 C ATOM 1104 O TYR A 77 2.145 -8.391 -6.171 1.00 0.00 O ATOM 1105 CB TYR A 77 1.521 -7.298 -3.626 1.00 0.00 C ATOM 1106 CG TYR A 77 2.892 -6.757 -3.239 1.00 0.00 C ATOM 1107 CD1 TYR A 77 4.058 -7.379 -3.657 1.00 0.00 C ATOM 1108 CD2 TYR A 77 3.008 -5.645 -2.431 1.00 0.00 C ATOM 1109 CE1 TYR A 77 5.297 -6.891 -3.274 1.00 0.00 C ATOM 1110 CE2 TYR A 77 4.235 -5.153 -2.055 1.00 0.00 C ATOM 1111 CZ TYR A 77 5.373 -5.775 -2.475 1.00 0.00 C ATOM 1112 OH TYR A 77 6.594 -5.283 -2.087 1.00 0.00 O ATOM 0 H TYR A 77 -0.384 -8.202 -5.615 1.00 0.00 H new ATOM 0 HA TYR A 77 0.905 -5.673 -4.899 1.00 0.00 H new ATOM 0 HB2 TYR A 77 0.819 -7.070 -2.824 1.00 0.00 H new ATOM 0 HB3 TYR A 77 1.584 -8.384 -3.695 1.00 0.00 H new ATOM 0 HD1 TYR A 77 4.000 -8.254 -4.288 1.00 0.00 H new ATOM 0 HD2 TYR A 77 2.113 -5.149 -2.086 1.00 0.00 H new ATOM 0 HE1 TYR A 77 6.199 -7.385 -3.602 1.00 0.00 H new ATOM 0 HE2 TYR A 77 4.297 -4.276 -1.428 1.00 0.00 H new ATOM 0 HH TYR A 77 7.297 -5.917 -2.340 1.00 0.00 H new ATOM 1122 N SER A 78 2.212 -6.308 -6.953 1.00 0.00 N ATOM 1123 CA SER A 78 3.110 -6.567 -8.091 1.00 0.00 C ATOM 1124 C SER A 78 2.635 -7.776 -8.924 1.00 0.00 C ATOM 1125 O SER A 78 3.425 -8.644 -9.311 1.00 0.00 O ATOM 1126 CB SER A 78 4.558 -6.764 -7.591 1.00 0.00 C ATOM 1127 OG SER A 78 5.501 -6.756 -8.656 1.00 0.00 O ATOM 0 H SER A 78 1.895 -5.340 -6.905 1.00 0.00 H new ATOM 0 HA SER A 78 3.087 -5.698 -8.749 1.00 0.00 H new ATOM 0 HB2 SER A 78 4.806 -5.974 -6.882 1.00 0.00 H new ATOM 0 HB3 SER A 78 4.629 -7.709 -7.052 1.00 0.00 H new ATOM 0 HG SER A 78 5.236 -7.413 -9.333 1.00 0.00 H new ATOM 1133 N GLY A 79 1.348 -7.838 -9.161 1.00 0.00 N ATOM 1134 CA GLY A 79 0.807 -8.918 -9.948 1.00 0.00 C ATOM 1135 C GLY A 79 0.432 -10.133 -9.126 1.00 0.00 C ATOM 1136 O GLY A 79 0.119 -11.177 -9.680 1.00 0.00 O ATOM 0 H GLY A 79 0.662 -7.162 -8.825 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.075 -8.563 -10.481 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.538 -9.210 -10.702 1.00 0.00 H new ATOM 1140 N SER A 80 0.476 -10.016 -7.818 1.00 0.00 N ATOM 1141 CA SER A 80 0.077 -11.112 -6.954 1.00 0.00 C ATOM 1142 C SER A 80 -1.455 -11.130 -6.844 1.00 0.00 C ATOM 1143 O SER A 80 -2.136 -10.304 -7.452 1.00 0.00 O ATOM 1144 CB SER A 80 0.734 -10.967 -5.561 1.00 0.00 C ATOM 1145 OG SER A 80 0.500 -12.096 -4.737 1.00 0.00 O ATOM 0 H SER A 80 0.783 -9.176 -7.327 1.00 0.00 H new ATOM 0 HA SER A 80 0.413 -12.057 -7.380 1.00 0.00 H new ATOM 0 HB2 SER A 80 1.808 -10.824 -5.681 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.346 -10.075 -5.070 1.00 0.00 H new ATOM 0 HG SER A 80 -0.011 -11.824 -3.946 1.00 0.00 H new ATOM 1151 N SER A 81 -1.970 -12.047 -6.101 1.00 0.00 N ATOM 1152 CA SER A 81 -3.375 -12.195 -5.896 1.00 0.00 C ATOM 1153 C SER A 81 -3.590 -12.994 -4.596 1.00 0.00 C ATOM 1154 O SER A 81 -3.308 -14.202 -4.541 1.00 0.00 O ATOM 1155 CB SER A 81 -3.986 -12.905 -7.111 1.00 0.00 C ATOM 1156 OG SER A 81 -3.228 -14.063 -7.478 1.00 0.00 O ATOM 0 H SER A 81 -1.410 -12.738 -5.602 1.00 0.00 H new ATOM 0 HA SER A 81 -3.867 -11.228 -5.795 1.00 0.00 H new ATOM 0 HB2 SER A 81 -5.012 -13.197 -6.885 1.00 0.00 H new ATOM 0 HB3 SER A 81 -4.029 -12.215 -7.954 1.00 0.00 H new ATOM 0 HG SER A 81 -2.990 -14.567 -6.672 1.00 0.00 H new ATOM 1162 N TYR A 82 -4.018 -12.335 -3.550 1.00 0.00 N ATOM 1163 CA TYR A 82 -4.143 -12.962 -2.240 1.00 0.00 C ATOM 1164 C TYR A 82 -5.266 -12.264 -1.437 1.00 0.00 C ATOM 1165 O TYR A 82 -5.653 -11.148 -1.784 1.00 0.00 O ATOM 1166 CB TYR A 82 -2.737 -12.944 -1.517 1.00 0.00 C ATOM 1167 CG TYR A 82 -2.062 -11.582 -1.414 1.00 0.00 C ATOM 1168 CD1 TYR A 82 -1.603 -10.918 -2.550 1.00 0.00 C ATOM 1169 CD2 TYR A 82 -1.890 -10.965 -0.193 1.00 0.00 C ATOM 1170 CE1 TYR A 82 -1.018 -9.682 -2.472 1.00 0.00 C ATOM 1171 CE2 TYR A 82 -1.290 -9.726 -0.103 1.00 0.00 C ATOM 1172 CZ TYR A 82 -0.868 -9.088 -1.244 1.00 0.00 C ATOM 1173 OH TYR A 82 -0.322 -7.839 -1.153 1.00 0.00 O ATOM 0 H TYR A 82 -4.291 -11.352 -3.572 1.00 0.00 H new ATOM 0 HA TYR A 82 -4.435 -14.008 -2.331 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -2.862 -13.344 -0.511 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -2.068 -13.621 -2.048 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -1.711 -11.390 -3.516 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -2.230 -11.459 0.706 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -0.679 -9.181 -3.366 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -1.153 -9.259 0.861 1.00 0.00 H new ATOM 0 HH TYR A 82 -0.906 -7.265 -0.615 1.00 0.00 H new ATOM 1183 N PRO A 83 -5.849 -12.934 -0.407 1.00 0.00 N ATOM 1184 CA PRO A 83 -6.972 -12.383 0.382 1.00 0.00 C ATOM 1185 C PRO A 83 -6.567 -11.176 1.217 1.00 0.00 C ATOM 1186 O PRO A 83 -5.425 -11.070 1.652 1.00 0.00 O ATOM 1187 CB PRO A 83 -7.384 -13.550 1.291 1.00 0.00 C ATOM 1188 CG PRO A 83 -6.164 -14.392 1.401 1.00 0.00 C ATOM 1189 CD PRO A 83 -5.456 -14.269 0.079 1.00 0.00 C ATOM 0 HA PRO A 83 -7.775 -12.023 -0.261 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -7.709 -13.195 2.269 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -8.215 -14.111 0.863 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -5.527 -14.052 2.218 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -6.423 -15.430 1.610 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -4.375 -14.350 0.195 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -5.762 -15.053 -0.613 1.00 0.00 H new ATOM 1197 N PHE A 84 -7.498 -10.275 1.425 1.00 0.00 N ATOM 1198 CA PHE A 84 -7.251 -9.076 2.188 1.00 0.00 C ATOM 1199 C PHE A 84 -8.207 -8.985 3.374 1.00 0.00 C ATOM 1200 O PHE A 84 -9.407 -9.170 3.216 1.00 0.00 O ATOM 1201 CB PHE A 84 -7.390 -7.839 1.317 1.00 0.00 C ATOM 1202 CG PHE A 84 -6.940 -6.588 2.004 1.00 0.00 C ATOM 1203 CD1 PHE A 84 -5.598 -6.351 2.218 1.00 0.00 C ATOM 1204 CD2 PHE A 84 -7.850 -5.665 2.439 1.00 0.00 C ATOM 1205 CE1 PHE A 84 -5.174 -5.214 2.854 1.00 0.00 C ATOM 1206 CE2 PHE A 84 -7.435 -4.517 3.075 1.00 0.00 C ATOM 1207 CZ PHE A 84 -6.095 -4.293 3.284 1.00 0.00 C ATOM 0 H PHE A 84 -8.450 -10.354 1.069 1.00 0.00 H new ATOM 0 HA PHE A 84 -6.228 -9.125 2.562 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -6.808 -7.976 0.405 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -8.432 -7.728 1.017 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -4.870 -7.073 1.879 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -8.904 -5.838 2.282 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -4.120 -5.044 3.016 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -8.162 -3.792 3.410 1.00 0.00 H new ATOM 0 HZ PHE A 84 -5.768 -3.394 3.786 1.00 0.00 H new ATOM 1217 N PRO A 85 -7.687 -8.704 4.578 1.00 0.00 N ATOM 1218 CA PRO A 85 -6.252 -8.511 4.801 1.00 0.00 C ATOM 1219 C PRO A 85 -5.516 -9.856 4.672 1.00 0.00 C ATOM 1220 O PRO A 85 -6.115 -10.923 4.883 1.00 0.00 O ATOM 1221 CB PRO A 85 -6.213 -7.956 6.224 1.00 0.00 C ATOM 1222 CG PRO A 85 -7.400 -8.535 6.885 1.00 0.00 C ATOM 1223 CD PRO A 85 -8.461 -8.569 5.827 1.00 0.00 C ATOM 0 HA PRO A 85 -5.763 -7.850 4.086 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -5.295 -8.244 6.736 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -6.251 -6.867 6.225 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -7.191 -9.535 7.265 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -7.712 -7.929 7.736 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -9.145 -9.406 5.969 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -9.063 -7.661 5.831 1.00 0.00 H new ATOM 1231 N THR A 86 -4.264 -9.796 4.245 1.00 0.00 N ATOM 1232 CA THR A 86 -3.454 -11.000 3.963 1.00 0.00 C ATOM 1233 C THR A 86 -3.291 -11.916 5.214 1.00 0.00 C ATOM 1234 O THR A 86 -3.744 -11.600 6.318 1.00 0.00 O ATOM 1235 CB THR A 86 -2.044 -10.549 3.418 1.00 0.00 C ATOM 1236 OG1 THR A 86 -1.185 -11.670 3.093 1.00 0.00 O ATOM 1237 CG2 THR A 86 -1.336 -9.656 4.419 1.00 0.00 C ATOM 0 H THR A 86 -3.770 -8.919 4.080 1.00 0.00 H new ATOM 0 HA THR A 86 -3.976 -11.594 3.213 1.00 0.00 H new ATOM 0 HB THR A 86 -2.239 -9.996 2.499 1.00 0.00 H new ATOM 0 HG1 THR A 86 -0.904 -11.606 2.156 1.00 0.00 H new ATOM 0 HG21 THR A 86 -0.366 -9.359 4.019 1.00 0.00 H new ATOM 0 HG22 THR A 86 -1.940 -8.768 4.605 1.00 0.00 H new ATOM 0 HG23 THR A 86 -1.192 -10.199 5.353 1.00 0.00 H new ATOM 1245 N THR A 87 -2.548 -12.979 5.037 1.00 0.00 N ATOM 1246 CA THR A 87 -2.395 -13.999 6.028 1.00 0.00 C ATOM 1247 C THR A 87 -0.968 -14.045 6.506 1.00 0.00 C ATOM 1248 O THR A 87 -0.661 -14.635 7.542 1.00 0.00 O ATOM 1249 CB THR A 87 -2.800 -15.356 5.422 1.00 0.00 C ATOM 1250 OG1 THR A 87 -2.175 -15.503 4.124 1.00 0.00 O ATOM 1251 CG2 THR A 87 -4.311 -15.459 5.270 1.00 0.00 C ATOM 0 H THR A 87 -2.024 -13.158 4.180 1.00 0.00 H new ATOM 0 HA THR A 87 -3.036 -13.779 6.881 1.00 0.00 H new ATOM 0 HB THR A 87 -2.468 -16.148 6.093 1.00 0.00 H new ATOM 0 HG1 THR A 87 -2.428 -16.366 3.735 1.00 0.00 H new ATOM 0 HG21 THR A 87 -4.568 -16.427 4.840 1.00 0.00 H new ATOM 0 HG22 THR A 87 -4.783 -15.359 6.248 1.00 0.00 H new ATOM 0 HG23 THR A 87 -4.666 -14.665 4.613 1.00 0.00 H new ATOM 1259 N SER A 88 -0.104 -13.418 5.743 1.00 0.00 N ATOM 1260 CA SER A 88 1.273 -13.332 6.056 1.00 0.00 C ATOM 1261 C SER A 88 1.835 -12.129 5.302 1.00 0.00 C ATOM 1262 O SER A 88 1.432 -11.004 5.595 1.00 0.00 O ATOM 1263 CB SER A 88 1.998 -14.648 5.719 1.00 0.00 C ATOM 1264 OG SER A 88 3.310 -14.691 6.283 1.00 0.00 O ATOM 0 H SER A 88 -0.360 -12.950 4.874 1.00 0.00 H new ATOM 0 HA SER A 88 1.427 -13.186 7.125 1.00 0.00 H new ATOM 0 HB2 SER A 88 1.415 -15.490 6.092 1.00 0.00 H new ATOM 0 HB3 SER A 88 2.064 -14.760 4.637 1.00 0.00 H new ATOM 0 HG SER A 88 3.975 -14.694 5.564 1.00 0.00 H new ATOM 1270 N GLU A 89 2.655 -12.351 4.284 1.00 0.00 N ATOM 1271 CA GLU A 89 3.208 -11.267 3.522 1.00 0.00 C ATOM 1272 C GLU A 89 3.087 -11.511 2.028 1.00 0.00 C ATOM 1273 O GLU A 89 2.297 -12.360 1.585 1.00 0.00 O ATOM 1274 CB GLU A 89 4.651 -10.939 3.901 1.00 0.00 C ATOM 1275 CG GLU A 89 5.670 -11.972 3.593 1.00 0.00 C ATOM 1276 CD GLU A 89 5.804 -13.014 4.650 1.00 0.00 C ATOM 1277 OE1 GLU A 89 6.616 -12.830 5.585 1.00 0.00 O ATOM 1278 OE2 GLU A 89 5.116 -14.042 4.571 1.00 0.00 O ATOM 0 H GLU A 89 2.946 -13.279 3.975 1.00 0.00 H new ATOM 0 HA GLU A 89 2.609 -10.393 3.778 1.00 0.00 H new ATOM 0 HB2 GLU A 89 4.936 -10.018 3.393 1.00 0.00 H new ATOM 0 HB3 GLU A 89 4.684 -10.736 4.971 1.00 0.00 H new ATOM 0 HG2 GLU A 89 5.412 -12.454 2.650 1.00 0.00 H new ATOM 0 HG3 GLU A 89 6.635 -11.486 3.449 1.00 0.00 H new ATOM 1285 N THR A 90 3.831 -10.762 1.271 1.00 0.00 N ATOM 1286 CA THR A 90 3.814 -10.816 -0.156 1.00 0.00 C ATOM 1287 C THR A 90 4.985 -11.631 -0.725 1.00 0.00 C ATOM 1288 O THR A 90 5.941 -11.954 0.003 1.00 0.00 O ATOM 1289 CB THR A 90 3.861 -9.384 -0.681 1.00 0.00 C ATOM 1290 OG1 THR A 90 4.848 -8.643 0.056 1.00 0.00 O ATOM 1291 CG2 THR A 90 2.526 -8.744 -0.494 1.00 0.00 C ATOM 0 H THR A 90 4.487 -10.075 1.644 1.00 0.00 H new ATOM 0 HA THR A 90 2.903 -11.320 -0.478 1.00 0.00 H new ATOM 0 HB THR A 90 4.119 -9.390 -1.740 1.00 0.00 H new ATOM 0 HG1 THR A 90 4.480 -8.385 0.927 1.00 0.00 H new ATOM 0 HG21 THR A 90 2.557 -7.721 -0.868 1.00 0.00 H new ATOM 0 HG22 THR A 90 1.772 -9.308 -1.043 1.00 0.00 H new ATOM 0 HG23 THR A 90 2.272 -8.735 0.566 1.00 0.00 H new ATOM 1299 N PRO A 91 4.897 -12.020 -2.025 1.00 0.00 N ATOM 1300 CA PRO A 91 5.990 -12.701 -2.745 1.00 0.00 C ATOM 1301 C PRO A 91 7.203 -11.777 -2.915 1.00 0.00 C ATOM 1302 O PRO A 91 7.122 -10.565 -2.678 1.00 0.00 O ATOM 1303 CB PRO A 91 5.369 -12.983 -4.125 1.00 0.00 C ATOM 1304 CG PRO A 91 4.302 -11.964 -4.260 1.00 0.00 C ATOM 1305 CD PRO A 91 3.711 -11.857 -2.897 1.00 0.00 C ATOM 0 HA PRO A 91 6.346 -13.588 -2.222 1.00 0.00 H new ATOM 0 HB2 PRO A 91 6.109 -12.892 -4.920 1.00 0.00 H new ATOM 0 HB3 PRO A 91 4.964 -13.993 -4.180 1.00 0.00 H new ATOM 0 HG2 PRO A 91 4.706 -11.008 -4.593 1.00 0.00 H new ATOM 0 HG3 PRO A 91 3.555 -12.267 -4.994 1.00 0.00 H new ATOM 0 HD2 PRO A 91 3.220 -10.896 -2.741 1.00 0.00 H new ATOM 0 HD3 PRO A 91 2.964 -12.630 -2.716 1.00 0.00 H new ATOM 1313 N ARG A 92 8.312 -12.351 -3.336 1.00 0.00 N ATOM 1314 CA ARG A 92 9.535 -11.613 -3.516 1.00 0.00 C ATOM 1315 C ARG A 92 9.392 -10.680 -4.715 1.00 0.00 C ATOM 1316 O ARG A 92 9.035 -11.115 -5.812 1.00 0.00 O ATOM 1317 CB ARG A 92 10.712 -12.601 -3.694 1.00 0.00 C ATOM 1318 CG ARG A 92 12.114 -11.988 -3.598 1.00 0.00 C ATOM 1319 CD ARG A 92 12.511 -11.168 -4.825 1.00 0.00 C ATOM 1320 NE ARG A 92 12.709 -12.004 -6.009 1.00 0.00 N ATOM 1321 CZ ARG A 92 12.342 -11.696 -7.266 1.00 0.00 C ATOM 1322 NH1 ARG A 92 11.419 -10.774 -7.493 1.00 0.00 N ATOM 1323 NH2 ARG A 92 12.827 -12.382 -8.277 1.00 0.00 N ATOM 0 H ARG A 92 8.385 -13.343 -3.562 1.00 0.00 H new ATOM 0 HA ARG A 92 9.741 -11.002 -2.638 1.00 0.00 H new ATOM 0 HB2 ARG A 92 10.624 -13.382 -2.939 1.00 0.00 H new ATOM 0 HB3 ARG A 92 10.613 -13.085 -4.666 1.00 0.00 H new ATOM 0 HG2 ARG A 92 12.163 -11.351 -2.715 1.00 0.00 H new ATOM 0 HG3 ARG A 92 12.841 -12.787 -3.455 1.00 0.00 H new ATOM 0 HD2 ARG A 92 11.738 -10.428 -5.031 1.00 0.00 H new ATOM 0 HD3 ARG A 92 13.429 -10.620 -4.612 1.00 0.00 H new ATOM 0 HE ARG A 92 13.168 -12.904 -5.868 1.00 0.00 H new ATOM 0 HH11 ARG A 92 10.979 -10.290 -6.711 1.00 0.00 H new ATOM 0 HH12 ARG A 92 11.148 -10.548 -8.450 1.00 0.00 H new ATOM 0 HH21 ARG A 92 13.481 -13.147 -8.108 1.00 0.00 H new ATOM 0 HH22 ARG A 92 12.550 -12.150 -9.231 1.00 0.00 H new ATOM 1337 N VAL A 93 9.706 -9.414 -4.501 1.00 0.00 N ATOM 1338 CA VAL A 93 9.607 -8.368 -5.494 1.00 0.00 C ATOM 1339 C VAL A 93 10.781 -7.427 -5.306 1.00 0.00 C ATOM 1340 O VAL A 93 10.985 -6.883 -4.224 1.00 0.00 O ATOM 1341 CB VAL A 93 8.264 -7.575 -5.384 1.00 0.00 C ATOM 1342 CG1 VAL A 93 8.259 -6.356 -6.306 1.00 0.00 C ATOM 1343 CG2 VAL A 93 7.086 -8.477 -5.723 1.00 0.00 C ATOM 0 H VAL A 93 10.048 -9.079 -3.600 1.00 0.00 H new ATOM 0 HA VAL A 93 9.625 -8.822 -6.485 1.00 0.00 H new ATOM 0 HB VAL A 93 8.170 -7.228 -4.355 1.00 0.00 H new ATOM 0 HG11 VAL A 93 7.311 -5.827 -6.205 1.00 0.00 H new ATOM 0 HG12 VAL A 93 9.077 -5.690 -6.033 1.00 0.00 H new ATOM 0 HG13 VAL A 93 8.385 -6.681 -7.339 1.00 0.00 H new ATOM 0 HG21 VAL A 93 6.159 -7.910 -5.642 1.00 0.00 H new ATOM 0 HG22 VAL A 93 7.195 -8.851 -6.741 1.00 0.00 H new ATOM 0 HG23 VAL A 93 7.060 -9.317 -5.029 1.00 0.00 H new ATOM 1353 N VAL A 94 11.567 -7.286 -6.313 1.00 0.00 N ATOM 1354 CA VAL A 94 12.732 -6.462 -6.245 1.00 0.00 C ATOM 1355 C VAL A 94 12.661 -5.330 -7.284 1.00 0.00 C ATOM 1356 O VAL A 94 12.157 -5.518 -8.393 1.00 0.00 O ATOM 1357 CB VAL A 94 14.014 -7.346 -6.391 1.00 0.00 C ATOM 1358 CG1 VAL A 94 13.916 -8.242 -7.606 1.00 0.00 C ATOM 1359 CG2 VAL A 94 15.290 -6.518 -6.424 1.00 0.00 C ATOM 0 H VAL A 94 11.424 -7.740 -7.215 1.00 0.00 H new ATOM 0 HA VAL A 94 12.782 -5.977 -5.270 1.00 0.00 H new ATOM 0 HB VAL A 94 14.070 -7.974 -5.502 1.00 0.00 H new ATOM 0 HG11 VAL A 94 14.819 -8.847 -7.686 1.00 0.00 H new ATOM 0 HG12 VAL A 94 13.049 -8.896 -7.507 1.00 0.00 H new ATOM 0 HG13 VAL A 94 13.809 -7.630 -8.502 1.00 0.00 H new ATOM 0 HG21 VAL A 94 16.150 -7.179 -6.526 1.00 0.00 H new ATOM 0 HG22 VAL A 94 15.257 -5.832 -7.270 1.00 0.00 H new ATOM 0 HG23 VAL A 94 15.378 -5.949 -5.499 1.00 0.00 H new ATOM 1369 N TYR A 95 13.101 -4.157 -6.887 1.00 0.00 N ATOM 1370 CA TYR A 95 13.148 -2.997 -7.746 1.00 0.00 C ATOM 1371 C TYR A 95 14.517 -2.900 -8.366 1.00 0.00 C ATOM 1372 O TYR A 95 15.505 -2.663 -7.675 1.00 0.00 O ATOM 1373 CB TYR A 95 12.862 -1.699 -6.965 1.00 0.00 C ATOM 1374 CG TYR A 95 11.402 -1.371 -6.702 1.00 0.00 C ATOM 1375 CD1 TYR A 95 10.571 -2.213 -5.978 1.00 0.00 C ATOM 1376 CD2 TYR A 95 10.867 -0.174 -7.160 1.00 0.00 C ATOM 1377 CE1 TYR A 95 9.262 -1.871 -5.724 1.00 0.00 C ATOM 1378 CE2 TYR A 95 9.559 0.167 -6.911 1.00 0.00 C ATOM 1379 CZ TYR A 95 8.763 -0.681 -6.196 1.00 0.00 C ATOM 1380 OH TYR A 95 7.469 -0.336 -5.938 1.00 0.00 O ATOM 0 H TYR A 95 13.442 -3.980 -5.942 1.00 0.00 H new ATOM 0 HA TYR A 95 12.381 -3.112 -8.512 1.00 0.00 H new ATOM 0 HB2 TYR A 95 13.376 -1.758 -6.006 1.00 0.00 H new ATOM 0 HB3 TYR A 95 13.305 -0.867 -7.513 1.00 0.00 H new ATOM 0 HD1 TYR A 95 10.957 -3.151 -5.608 1.00 0.00 H new ATOM 0 HD2 TYR A 95 11.492 0.503 -7.724 1.00 0.00 H new ATOM 0 HE1 TYR A 95 8.629 -2.536 -5.155 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.163 1.102 -7.279 1.00 0.00 H new ATOM 0 HH TYR A 95 7.070 0.061 -6.740 1.00 0.00 H new ATOM 1390 N ASN A 96 14.585 -3.095 -9.650 1.00 0.00 N ATOM 1391 CA ASN A 96 15.853 -3.006 -10.371 1.00 0.00 C ATOM 1392 C ASN A 96 15.975 -1.627 -11.001 1.00 0.00 C ATOM 1393 O ASN A 96 16.895 -1.348 -11.780 1.00 0.00 O ATOM 1394 CB ASN A 96 15.949 -4.090 -11.462 1.00 0.00 C ATOM 1395 CG ASN A 96 15.868 -5.524 -10.938 1.00 0.00 C ATOM 1396 OD1 ASN A 96 15.363 -6.407 -11.626 1.00 0.00 O ATOM 1397 ND2 ASN A 96 16.365 -5.777 -9.746 1.00 0.00 N ATOM 0 H ASN A 96 13.781 -3.319 -10.236 1.00 0.00 H new ATOM 0 HA ASN A 96 16.668 -3.166 -9.665 1.00 0.00 H new ATOM 0 HB2 ASN A 96 15.147 -3.934 -12.183 1.00 0.00 H new ATOM 0 HB3 ASN A 96 16.889 -3.965 -11.999 1.00 0.00 H new ATOM 0 HD21 ASN A 96 16.336 -6.726 -9.372 1.00 0.00 H new ATOM 0 HD22 ASN A 96 16.779 -5.024 -9.196 1.00 0.00 H new ATOM 1404 N SER A 97 15.050 -0.773 -10.635 1.00 0.00 N ATOM 1405 CA SER A 97 14.936 0.562 -11.126 1.00 0.00 C ATOM 1406 C SER A 97 15.991 1.459 -10.459 1.00 0.00 C ATOM 1407 O SER A 97 16.841 0.981 -9.703 1.00 0.00 O ATOM 1408 CB SER A 97 13.536 1.027 -10.755 1.00 0.00 C ATOM 1409 OG SER A 97 12.582 0.015 -11.079 1.00 0.00 O ATOM 0 H SER A 97 14.327 -1.009 -9.955 1.00 0.00 H new ATOM 0 HA SER A 97 15.098 0.611 -12.203 1.00 0.00 H new ATOM 0 HB2 SER A 97 13.490 1.254 -9.690 1.00 0.00 H new ATOM 0 HB3 SER A 97 13.297 1.947 -11.288 1.00 0.00 H new ATOM 0 HG SER A 97 12.006 -0.151 -10.304 1.00 0.00 H new ATOM 1415 N ARG A 98 15.953 2.734 -10.753 1.00 0.00 N ATOM 1416 CA ARG A 98 16.869 3.675 -10.146 1.00 0.00 C ATOM 1417 C ARG A 98 16.177 5.006 -9.888 1.00 0.00 C ATOM 1418 O ARG A 98 16.817 6.071 -9.890 1.00 0.00 O ATOM 1419 CB ARG A 98 18.076 3.878 -11.047 1.00 0.00 C ATOM 1420 CG ARG A 98 17.702 4.290 -12.449 1.00 0.00 C ATOM 1421 CD ARG A 98 18.909 4.581 -13.282 1.00 0.00 C ATOM 1422 NE ARG A 98 19.811 3.436 -13.380 1.00 0.00 N ATOM 1423 CZ ARG A 98 21.016 3.474 -13.949 1.00 0.00 C ATOM 1424 NH1 ARG A 98 21.427 4.580 -14.572 1.00 0.00 N ATOM 1425 NH2 ARG A 98 21.800 2.405 -13.910 1.00 0.00 N ATOM 0 H ARG A 98 15.295 3.149 -11.412 1.00 0.00 H new ATOM 0 HA ARG A 98 17.202 3.270 -9.190 1.00 0.00 H new ATOM 0 HB2 ARG A 98 18.724 4.639 -10.611 1.00 0.00 H new ATOM 0 HB3 ARG A 98 18.652 2.954 -11.087 1.00 0.00 H new ATOM 0 HG2 ARG A 98 17.119 3.497 -12.918 1.00 0.00 H new ATOM 0 HG3 ARG A 98 17.065 5.174 -12.411 1.00 0.00 H new ATOM 0 HD2 ARG A 98 18.593 4.877 -14.282 1.00 0.00 H new ATOM 0 HD3 ARG A 98 19.446 5.427 -12.854 1.00 0.00 H new ATOM 0 HE ARG A 98 19.498 2.548 -12.987 1.00 0.00 H new ATOM 0 HH11 ARG A 98 20.819 5.398 -14.613 1.00 0.00 H new ATOM 0 HH12 ARG A 98 22.349 4.608 -15.007 1.00 0.00 H new ATOM 0 HH21 ARG A 98 21.481 1.555 -13.445 1.00 0.00 H new ATOM 0 HH22 ARG A 98 22.722 2.433 -14.345 1.00 0.00 H new ATOM 1439 N THR A 99 14.887 4.956 -9.635 1.00 0.00 N ATOM 1440 CA THR A 99 14.114 6.174 -9.469 1.00 0.00 C ATOM 1441 C THR A 99 12.786 5.833 -8.793 1.00 0.00 C ATOM 1442 O THR A 99 12.565 4.667 -8.449 1.00 0.00 O ATOM 1443 CB THR A 99 13.863 6.863 -10.856 1.00 0.00 C ATOM 1444 OG1 THR A 99 13.324 8.177 -10.684 1.00 0.00 O ATOM 1445 CG2 THR A 99 12.891 6.063 -11.692 1.00 0.00 C ATOM 0 H THR A 99 14.352 4.093 -9.540 1.00 0.00 H new ATOM 0 HA THR A 99 14.671 6.873 -8.845 1.00 0.00 H new ATOM 0 HB THR A 99 14.827 6.919 -11.362 1.00 0.00 H new ATOM 0 HG1 THR A 99 13.177 8.588 -11.562 1.00 0.00 H new ATOM 0 HG21 THR A 99 12.735 6.563 -12.648 1.00 0.00 H new ATOM 0 HG22 THR A 99 13.296 5.066 -11.866 1.00 0.00 H new ATOM 0 HG23 THR A 99 11.940 5.982 -11.166 1.00 0.00 H new ATOM 1453 N ASP A 100 11.931 6.841 -8.601 1.00 0.00 N ATOM 1454 CA ASP A 100 10.609 6.655 -8.006 1.00 0.00 C ATOM 1455 C ASP A 100 9.737 5.849 -8.940 1.00 0.00 C ATOM 1456 O ASP A 100 9.199 6.368 -9.932 1.00 0.00 O ATOM 1457 CB ASP A 100 9.893 7.999 -7.709 1.00 0.00 C ATOM 1458 CG ASP A 100 10.575 8.886 -6.688 1.00 0.00 C ATOM 1459 OD1 ASP A 100 11.487 9.640 -7.066 1.00 0.00 O ATOM 1460 OD2 ASP A 100 10.153 8.915 -5.499 1.00 0.00 O ATOM 0 H ASP A 100 12.137 7.807 -8.854 1.00 0.00 H new ATOM 0 HA ASP A 100 10.761 6.134 -7.061 1.00 0.00 H new ATOM 0 HB2 ASP A 100 9.798 8.554 -8.642 1.00 0.00 H new ATOM 0 HB3 ASP A 100 8.883 7.784 -7.361 1.00 0.00 H new ATOM 1465 N LYS A 101 9.641 4.602 -8.654 1.00 0.00 N ATOM 1466 CA LYS A 101 8.800 3.692 -9.354 1.00 0.00 C ATOM 1467 C LYS A 101 7.615 3.419 -8.464 1.00 0.00 C ATOM 1468 O LYS A 101 7.763 3.347 -7.252 1.00 0.00 O ATOM 1469 CB LYS A 101 9.581 2.405 -9.647 1.00 0.00 C ATOM 1470 CG LYS A 101 9.903 2.173 -11.118 1.00 0.00 C ATOM 1471 CD LYS A 101 10.578 3.374 -11.766 1.00 0.00 C ATOM 1472 CE LYS A 101 10.911 3.080 -13.215 1.00 0.00 C ATOM 1473 NZ LYS A 101 11.341 4.271 -13.980 1.00 0.00 N ATOM 0 H LYS A 101 10.166 4.166 -7.896 1.00 0.00 H new ATOM 0 HA LYS A 101 8.464 4.099 -10.308 1.00 0.00 H new ATOM 0 HB2 LYS A 101 10.514 2.427 -9.085 1.00 0.00 H new ATOM 0 HB3 LYS A 101 9.006 1.556 -9.277 1.00 0.00 H new ATOM 0 HG2 LYS A 101 10.552 1.302 -11.211 1.00 0.00 H new ATOM 0 HG3 LYS A 101 8.983 1.944 -11.656 1.00 0.00 H new ATOM 0 HD2 LYS A 101 9.922 4.243 -11.707 1.00 0.00 H new ATOM 0 HD3 LYS A 101 11.488 3.624 -11.221 1.00 0.00 H new ATOM 0 HE2 LYS A 101 11.702 2.331 -13.252 1.00 0.00 H new ATOM 0 HE3 LYS A 101 10.036 2.645 -13.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 11.211 4.096 -14.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 10.770 5.092 -13.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 12.345 4.463 -13.788 1.00 0.00 H new ATOM 1487 N PRO A 102 6.424 3.307 -9.038 1.00 0.00 N ATOM 1488 CA PRO A 102 5.202 3.093 -8.269 1.00 0.00 C ATOM 1489 C PRO A 102 5.242 1.799 -7.475 1.00 0.00 C ATOM 1490 O PRO A 102 5.849 0.807 -7.915 1.00 0.00 O ATOM 1491 CB PRO A 102 4.110 3.025 -9.335 1.00 0.00 C ATOM 1492 CG PRO A 102 4.815 2.719 -10.603 1.00 0.00 C ATOM 1493 CD PRO A 102 6.160 3.356 -10.485 1.00 0.00 C ATOM 0 HA PRO A 102 5.046 3.881 -7.532 1.00 0.00 H new ATOM 0 HB2 PRO A 102 3.377 2.254 -9.097 1.00 0.00 H new ATOM 0 HB3 PRO A 102 3.569 3.969 -9.404 1.00 0.00 H new ATOM 0 HG2 PRO A 102 4.904 1.643 -10.751 1.00 0.00 H new ATOM 0 HG3 PRO A 102 4.269 3.115 -11.459 1.00 0.00 H new ATOM 0 HD2 PRO A 102 6.915 2.812 -11.052 1.00 0.00 H new ATOM 0 HD3 PRO A 102 6.156 4.379 -10.860 1.00 0.00 H new ATOM 1501 N TRP A 103 4.611 1.809 -6.328 1.00 0.00 N ATOM 1502 CA TRP A 103 4.558 0.649 -5.473 1.00 0.00 C ATOM 1503 C TRP A 103 3.310 -0.091 -5.880 1.00 0.00 C ATOM 1504 O TRP A 103 2.194 0.359 -5.596 1.00 0.00 O ATOM 1505 CB TRP A 103 4.518 1.080 -3.988 1.00 0.00 C ATOM 1506 CG TRP A 103 4.754 -0.034 -2.999 1.00 0.00 C ATOM 1507 CD1 TRP A 103 5.815 -0.888 -2.983 1.00 0.00 C ATOM 1508 CD2 TRP A 103 3.949 -0.382 -1.851 1.00 0.00 C ATOM 1509 NE1 TRP A 103 5.703 -1.758 -1.929 1.00 0.00 N ATOM 1510 CE2 TRP A 103 4.581 -1.469 -1.220 1.00 0.00 C ATOM 1511 CE3 TRP A 103 2.761 0.107 -1.302 1.00 0.00 C ATOM 1512 CZ2 TRP A 103 4.070 -2.072 -0.075 1.00 0.00 C ATOM 1513 CZ3 TRP A 103 2.252 -0.500 -0.156 1.00 0.00 C ATOM 1514 CH2 TRP A 103 2.912 -1.576 0.438 1.00 0.00 C ATOM 0 H TRP A 103 4.119 2.623 -5.960 1.00 0.00 H new ATOM 0 HA TRP A 103 5.437 0.013 -5.577 1.00 0.00 H new ATOM 0 HB2 TRP A 103 5.269 1.854 -3.829 1.00 0.00 H new ATOM 0 HB3 TRP A 103 3.547 1.531 -3.781 1.00 0.00 H new ATOM 0 HD1 TRP A 103 6.626 -0.881 -3.696 1.00 0.00 H new ATOM 0 HE1 TRP A 103 6.361 -2.507 -1.711 1.00 0.00 H new ATOM 0 HE3 TRP A 103 2.247 0.940 -1.758 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 4.575 -2.905 0.390 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 1.334 -0.133 0.278 1.00 0.00 H new ATOM 0 HH2 TRP A 103 2.494 -2.026 1.326 1.00 0.00 H new ATOM 1525 N PRO A 104 3.459 -1.200 -6.611 1.00 0.00 N ATOM 1526 CA PRO A 104 2.325 -1.868 -7.207 1.00 0.00 C ATOM 1527 C PRO A 104 1.504 -2.655 -6.201 1.00 0.00 C ATOM 1528 O PRO A 104 1.722 -3.847 -5.983 1.00 0.00 O ATOM 1529 CB PRO A 104 2.962 -2.787 -8.254 1.00 0.00 C ATOM 1530 CG PRO A 104 4.339 -3.072 -7.740 1.00 0.00 C ATOM 1531 CD PRO A 104 4.738 -1.905 -6.878 1.00 0.00 C ATOM 0 HA PRO A 104 1.612 -1.160 -7.630 1.00 0.00 H new ATOM 0 HB2 PRO A 104 2.388 -3.706 -8.373 1.00 0.00 H new ATOM 0 HB3 PRO A 104 2.998 -2.305 -9.231 1.00 0.00 H new ATOM 0 HG2 PRO A 104 4.352 -3.998 -7.165 1.00 0.00 H new ATOM 0 HG3 PRO A 104 5.040 -3.199 -8.565 1.00 0.00 H new ATOM 0 HD2 PRO A 104 5.212 -2.235 -5.954 1.00 0.00 H new ATOM 0 HD3 PRO A 104 5.451 -1.258 -7.388 1.00 0.00 H new ATOM 1539 N VAL A 105 0.557 -1.983 -5.599 1.00 0.00 N ATOM 1540 CA VAL A 105 -0.343 -2.586 -4.662 1.00 0.00 C ATOM 1541 C VAL A 105 -1.722 -2.086 -4.973 1.00 0.00 C ATOM 1542 O VAL A 105 -1.876 -0.992 -5.542 1.00 0.00 O ATOM 1543 CB VAL A 105 0.033 -2.239 -3.180 1.00 0.00 C ATOM 1544 CG1 VAL A 105 -0.933 -2.867 -2.178 1.00 0.00 C ATOM 1545 CG2 VAL A 105 1.425 -2.703 -2.880 1.00 0.00 C ATOM 0 H VAL A 105 0.391 -0.988 -5.751 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.286 -3.671 -4.755 1.00 0.00 H new ATOM 0 HB VAL A 105 -0.033 -1.156 -3.078 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -0.632 -2.599 -1.165 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -1.942 -2.500 -2.366 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -0.916 -3.951 -2.286 1.00 0.00 H new ATOM 0 HG21 VAL A 105 1.676 -2.457 -1.848 1.00 0.00 H new ATOM 0 HG22 VAL A 105 1.487 -3.782 -3.021 1.00 0.00 H new ATOM 0 HG23 VAL A 105 2.126 -2.208 -3.552 1.00 0.00 H new ATOM 1555 N ALA A 106 -2.698 -2.888 -4.683 1.00 0.00 N ATOM 1556 CA ALA A 106 -4.062 -2.529 -4.857 1.00 0.00 C ATOM 1557 C ALA A 106 -4.919 -3.357 -3.962 1.00 0.00 C ATOM 1558 O ALA A 106 -4.721 -4.567 -3.848 1.00 0.00 O ATOM 1559 CB ALA A 106 -4.479 -2.701 -6.282 1.00 0.00 C ATOM 0 H ALA A 106 -2.562 -3.828 -4.312 1.00 0.00 H new ATOM 0 HA ALA A 106 -4.182 -1.478 -4.595 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -5.527 -2.420 -6.391 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -3.865 -2.066 -6.920 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.350 -3.743 -6.576 1.00 0.00 H new ATOM 1565 N LEU A 107 -5.834 -2.722 -3.304 1.00 0.00 N ATOM 1566 CA LEU A 107 -6.730 -3.416 -2.418 1.00 0.00 C ATOM 1567 C LEU A 107 -8.081 -3.552 -3.111 1.00 0.00 C ATOM 1568 O LEU A 107 -8.843 -2.598 -3.166 1.00 0.00 O ATOM 1569 CB LEU A 107 -6.920 -2.650 -1.093 1.00 0.00 C ATOM 1570 CG LEU A 107 -5.674 -2.126 -0.356 1.00 0.00 C ATOM 1571 CD1 LEU A 107 -6.070 -1.551 0.977 1.00 0.00 C ATOM 1572 CD2 LEU A 107 -4.663 -3.211 -0.161 1.00 0.00 C ATOM 0 H LEU A 107 -5.986 -1.715 -3.360 1.00 0.00 H new ATOM 0 HA LEU A 107 -6.306 -4.393 -2.186 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -7.568 -1.797 -1.295 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -7.459 -3.304 -0.407 1.00 0.00 H new ATOM 0 HG LEU A 107 -5.222 -1.346 -0.969 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -5.183 -1.182 1.492 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -6.769 -0.729 0.825 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.545 -2.325 1.580 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -3.795 -2.810 0.362 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.102 -4.016 0.429 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -4.354 -3.599 -1.132 1.00 0.00 H new ATOM 1584 N TYR A 108 -8.351 -4.696 -3.670 1.00 0.00 N ATOM 1585 CA TYR A 108 -9.626 -4.953 -4.346 1.00 0.00 C ATOM 1586 C TYR A 108 -10.724 -5.244 -3.315 1.00 0.00 C ATOM 1587 O TYR A 108 -11.014 -6.393 -3.028 1.00 0.00 O ATOM 1588 CB TYR A 108 -9.509 -6.160 -5.309 1.00 0.00 C ATOM 1589 CG TYR A 108 -8.611 -5.949 -6.511 1.00 0.00 C ATOM 1590 CD1 TYR A 108 -7.233 -6.025 -6.400 1.00 0.00 C ATOM 1591 CD2 TYR A 108 -9.153 -5.680 -7.769 1.00 0.00 C ATOM 1592 CE1 TYR A 108 -6.419 -5.835 -7.496 1.00 0.00 C ATOM 1593 CE2 TYR A 108 -8.339 -5.491 -8.873 1.00 0.00 C ATOM 1594 CZ TYR A 108 -6.971 -5.570 -8.727 1.00 0.00 C ATOM 1595 OH TYR A 108 -6.146 -5.384 -9.816 1.00 0.00 O ATOM 0 H TYR A 108 -7.707 -5.487 -3.680 1.00 0.00 H new ATOM 0 HA TYR A 108 -9.884 -4.063 -4.920 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -9.139 -7.017 -4.746 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -10.507 -6.418 -5.663 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -6.789 -6.237 -5.439 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -10.225 -5.618 -7.883 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -5.346 -5.894 -7.388 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -8.772 -5.283 -9.840 1.00 0.00 H new ATOM 0 HH TYR A 108 -6.690 -5.207 -10.612 1.00 0.00 H new ATOM 1605 N LEU A 109 -11.289 -4.216 -2.740 1.00 0.00 N ATOM 1606 CA LEU A 109 -12.381 -4.371 -1.800 1.00 0.00 C ATOM 1607 C LEU A 109 -13.676 -3.939 -2.419 1.00 0.00 C ATOM 1608 O LEU A 109 -13.864 -2.782 -2.739 1.00 0.00 O ATOM 1609 CB LEU A 109 -12.149 -3.642 -0.474 1.00 0.00 C ATOM 1610 CG LEU A 109 -11.192 -4.284 0.519 1.00 0.00 C ATOM 1611 CD1 LEU A 109 -11.458 -5.754 0.695 1.00 0.00 C ATOM 1612 CD2 LEU A 109 -9.777 -4.010 0.178 1.00 0.00 C ATOM 0 H LEU A 109 -11.011 -3.249 -2.905 1.00 0.00 H new ATOM 0 HA LEU A 109 -12.431 -5.433 -1.562 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -11.779 -2.642 -0.700 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -13.114 -3.522 0.018 1.00 0.00 H new ATOM 0 HG LEU A 109 -11.381 -3.817 1.486 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -10.750 -6.168 1.413 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -12.474 -5.898 1.062 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -11.343 -6.262 -0.263 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -9.127 -4.486 0.912 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -9.558 -4.408 -0.813 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -9.603 -2.934 0.184 1.00 0.00 H new ATOM 1624 N THR A 110 -14.569 -4.862 -2.543 1.00 0.00 N ATOM 1625 CA THR A 110 -15.799 -4.652 -3.206 1.00 0.00 C ATOM 1626 C THR A 110 -16.963 -4.899 -2.253 1.00 0.00 C ATOM 1627 O THR A 110 -16.867 -5.721 -1.354 1.00 0.00 O ATOM 1628 CB THR A 110 -15.826 -5.577 -4.430 1.00 0.00 C ATOM 1629 OG1 THR A 110 -15.845 -4.780 -5.594 1.00 0.00 O ATOM 1630 CG2 THR A 110 -16.981 -6.587 -4.416 1.00 0.00 C ATOM 0 H THR A 110 -14.455 -5.806 -2.174 1.00 0.00 H new ATOM 0 HA THR A 110 -15.900 -3.620 -3.541 1.00 0.00 H new ATOM 0 HB THR A 110 -14.925 -6.190 -4.408 1.00 0.00 H new ATOM 0 HG1 THR A 110 -16.187 -5.307 -6.346 1.00 0.00 H new ATOM 0 HG21 THR A 110 -16.934 -7.206 -5.312 1.00 0.00 H new ATOM 0 HG22 THR A 110 -16.899 -7.221 -3.533 1.00 0.00 H new ATOM 0 HG23 THR A 110 -17.931 -6.053 -4.393 1.00 0.00 H new ATOM 1638 N PRO A 111 -18.059 -4.152 -2.428 1.00 0.00 N ATOM 1639 CA PRO A 111 -19.225 -4.237 -1.568 1.00 0.00 C ATOM 1640 C PRO A 111 -19.853 -5.616 -1.585 1.00 0.00 C ATOM 1641 O PRO A 111 -20.222 -6.149 -2.653 1.00 0.00 O ATOM 1642 CB PRO A 111 -20.195 -3.218 -2.172 1.00 0.00 C ATOM 1643 CG PRO A 111 -19.719 -3.003 -3.549 1.00 0.00 C ATOM 1644 CD PRO A 111 -18.244 -3.167 -3.498 1.00 0.00 C ATOM 0 HA PRO A 111 -18.970 -4.043 -0.526 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -21.218 -3.594 -2.163 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -20.193 -2.287 -1.604 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -20.169 -3.721 -4.235 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -19.990 -2.009 -3.906 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -17.844 -3.523 -4.448 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -17.741 -2.227 -3.273 1.00 0.00 H new ATOM 1652 N VAL A 112 -19.889 -6.209 -0.409 1.00 0.00 N ATOM 1653 CA VAL A 112 -20.559 -7.470 -0.171 1.00 0.00 C ATOM 1654 C VAL A 112 -22.077 -7.339 -0.289 1.00 0.00 C ATOM 1655 O VAL A 112 -22.565 -7.055 -1.340 1.00 0.00 O ATOM 1656 CB VAL A 112 -20.153 -8.104 1.171 1.00 0.00 C ATOM 1657 CG1 VAL A 112 -18.806 -8.752 1.016 1.00 0.00 C ATOM 1658 CG2 VAL A 112 -20.085 -7.047 2.277 1.00 0.00 C ATOM 0 H VAL A 112 -19.445 -5.820 0.423 1.00 0.00 H new ATOM 0 HA VAL A 112 -20.227 -8.149 -0.957 1.00 0.00 H new ATOM 0 HB VAL A 112 -20.901 -8.846 1.451 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -18.509 -9.205 1.962 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -18.859 -9.522 0.246 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -18.072 -8.000 0.727 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -19.796 -7.520 3.215 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -19.348 -6.289 2.011 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -21.062 -6.578 2.393 1.00 0.00 H new ATOM 1668 N SER A 113 -22.808 -7.598 0.746 1.00 0.00 N ATOM 1669 CA SER A 113 -24.222 -7.403 0.701 1.00 0.00 C ATOM 1670 C SER A 113 -24.548 -6.274 1.637 1.00 0.00 C ATOM 1671 O SER A 113 -25.415 -5.442 1.380 1.00 0.00 O ATOM 1672 CB SER A 113 -24.970 -8.700 1.044 1.00 0.00 C ATOM 1673 OG SER A 113 -26.360 -8.592 0.775 1.00 0.00 O ATOM 0 H SER A 113 -22.449 -7.946 1.635 1.00 0.00 H new ATOM 0 HA SER A 113 -24.550 -7.140 -0.305 1.00 0.00 H new ATOM 0 HB2 SER A 113 -24.551 -9.525 0.468 1.00 0.00 H new ATOM 0 HB3 SER A 113 -24.821 -8.939 2.097 1.00 0.00 H new ATOM 0 HG SER A 113 -26.804 -9.435 1.003 1.00 0.00 H new ATOM 1679 N SER A 114 -23.766 -6.211 2.684 1.00 0.00 N ATOM 1680 CA SER A 114 -23.871 -5.284 3.727 1.00 0.00 C ATOM 1681 C SER A 114 -23.259 -3.917 3.372 1.00 0.00 C ATOM 1682 O SER A 114 -22.673 -3.240 4.218 1.00 0.00 O ATOM 1683 CB SER A 114 -23.110 -5.884 4.837 1.00 0.00 C ATOM 1684 OG SER A 114 -23.598 -7.170 5.163 1.00 0.00 O ATOM 0 H SER A 114 -22.992 -6.862 2.818 1.00 0.00 H new ATOM 0 HA SER A 114 -24.918 -5.092 3.963 1.00 0.00 H new ATOM 0 HB2 SER A 114 -22.057 -5.952 4.563 1.00 0.00 H new ATOM 0 HB3 SER A 114 -23.171 -5.238 5.713 1.00 0.00 H new ATOM 0 HG SER A 114 -23.072 -7.542 5.901 1.00 0.00 H new ATOM 1690 N ALA A 115 -23.371 -3.540 2.153 1.00 0.00 N ATOM 1691 CA ALA A 115 -22.856 -2.291 1.711 1.00 0.00 C ATOM 1692 C ALA A 115 -23.979 -1.409 1.196 1.00 0.00 C ATOM 1693 O ALA A 115 -24.802 -1.872 0.397 1.00 0.00 O ATOM 1694 CB ALA A 115 -21.836 -2.548 0.648 1.00 0.00 C ATOM 0 H ALA A 115 -23.826 -4.091 1.425 1.00 0.00 H new ATOM 0 HA ALA A 115 -22.385 -1.764 2.541 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -21.430 -1.600 0.297 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -21.031 -3.159 1.056 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -22.303 -3.073 -0.185 1.00 0.00 H new ATOM 1700 N GLY A 116 -24.040 -0.172 1.662 1.00 0.00 N ATOM 1701 CA GLY A 116 -25.074 0.740 1.212 1.00 0.00 C ATOM 1702 C GLY A 116 -24.835 2.170 1.673 1.00 0.00 C ATOM 1703 O GLY A 116 -24.642 2.432 2.869 1.00 0.00 O ATOM 0 H GLY A 116 -23.391 0.219 2.345 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -25.125 0.717 0.123 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -26.040 0.399 1.583 1.00 0.00 H new ATOM 1707 N GLY A 117 -24.874 3.084 0.724 1.00 0.00 N ATOM 1708 CA GLY A 117 -24.591 4.489 0.947 1.00 0.00 C ATOM 1709 C GLY A 117 -23.159 4.709 1.330 1.00 0.00 C ATOM 1710 O GLY A 117 -22.306 3.950 0.894 1.00 0.00 O ATOM 0 H GLY A 117 -25.108 2.867 -0.245 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -24.817 5.054 0.043 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -25.242 4.871 1.734 1.00 0.00 H new ATOM 1714 N VAL A 118 -22.885 5.743 2.110 1.00 0.00 N ATOM 1715 CA VAL A 118 -21.517 6.064 2.509 1.00 0.00 C ATOM 1716 C VAL A 118 -20.855 4.893 3.212 1.00 0.00 C ATOM 1717 O VAL A 118 -21.170 4.558 4.352 1.00 0.00 O ATOM 1718 CB VAL A 118 -21.435 7.336 3.372 1.00 0.00 C ATOM 1719 CG1 VAL A 118 -20.007 7.562 3.839 1.00 0.00 C ATOM 1720 CG2 VAL A 118 -21.903 8.534 2.563 1.00 0.00 C ATOM 0 H VAL A 118 -23.592 6.378 2.482 1.00 0.00 H new ATOM 0 HA VAL A 118 -20.969 6.266 1.589 1.00 0.00 H new ATOM 0 HB VAL A 118 -22.077 7.213 4.244 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -19.962 8.465 4.448 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -19.678 6.708 4.431 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -19.355 7.676 2.973 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -21.844 9.433 3.177 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -21.267 8.651 1.685 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -22.934 8.378 2.246 1.00 0.00 H new ATOM 1730 N ALA A 119 -19.980 4.262 2.491 1.00 0.00 N ATOM 1731 CA ALA A 119 -19.285 3.106 2.967 1.00 0.00 C ATOM 1732 C ALA A 119 -17.846 3.445 3.320 1.00 0.00 C ATOM 1733 O ALA A 119 -17.198 2.725 4.079 1.00 0.00 O ATOM 1734 CB ALA A 119 -19.335 2.032 1.907 1.00 0.00 C ATOM 0 H ALA A 119 -19.725 4.539 1.543 1.00 0.00 H new ATOM 0 HA ALA A 119 -19.769 2.744 3.874 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -18.807 1.146 2.261 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -20.374 1.776 1.697 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -18.860 2.397 0.996 1.00 0.00 H new ATOM 1740 N ILE A 120 -17.345 4.533 2.750 1.00 0.00 N ATOM 1741 CA ILE A 120 -15.981 4.987 2.989 1.00 0.00 C ATOM 1742 C ILE A 120 -16.016 6.493 3.206 1.00 0.00 C ATOM 1743 O ILE A 120 -16.771 7.187 2.529 1.00 0.00 O ATOM 1744 CB ILE A 120 -15.053 4.691 1.760 1.00 0.00 C ATOM 1745 CG1 ILE A 120 -15.032 3.202 1.411 1.00 0.00 C ATOM 1746 CG2 ILE A 120 -13.646 5.184 2.008 1.00 0.00 C ATOM 1747 CD1 ILE A 120 -14.179 2.858 0.202 1.00 0.00 C ATOM 0 H ILE A 120 -17.872 5.126 2.109 1.00 0.00 H new ATOM 0 HA ILE A 120 -15.585 4.460 3.857 1.00 0.00 H new ATOM 0 HB ILE A 120 -15.470 5.232 0.911 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -14.664 2.644 2.272 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -16.053 2.869 1.228 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -13.025 4.965 1.139 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -13.663 6.260 2.180 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -13.234 4.683 2.884 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -14.218 1.784 0.023 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -14.558 3.386 -0.673 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -13.147 3.157 0.387 1.00 0.00 H new ATOM 1759 N LYS A 121 -15.226 6.989 4.136 1.00 0.00 N ATOM 1760 CA LYS A 121 -15.143 8.408 4.404 1.00 0.00 C ATOM 1761 C LYS A 121 -13.764 8.943 4.097 1.00 0.00 C ATOM 1762 O LYS A 121 -12.761 8.299 4.400 1.00 0.00 O ATOM 1763 CB LYS A 121 -15.498 8.697 5.849 1.00 0.00 C ATOM 1764 CG LYS A 121 -16.988 8.688 6.165 1.00 0.00 C ATOM 1765 CD LYS A 121 -17.684 10.025 5.855 1.00 0.00 C ATOM 1766 CE LYS A 121 -17.886 10.260 4.378 1.00 0.00 C ATOM 1767 NZ LYS A 121 -18.719 11.434 4.085 1.00 0.00 N ATOM 0 H LYS A 121 -14.623 6.418 4.728 1.00 0.00 H new ATOM 0 HA LYS A 121 -15.859 8.911 3.753 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -15.004 7.960 6.482 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -15.092 9.672 6.118 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -17.469 7.895 5.593 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -17.127 8.450 7.219 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -18.652 10.048 6.356 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -17.091 10.841 6.269 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -16.914 10.385 3.901 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -18.347 9.377 3.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -18.615 11.692 3.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -19.715 11.211 4.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -18.417 12.231 4.681 1.00 0.00 H new ATOM 1781 N ALA A 122 -13.726 10.121 3.509 1.00 0.00 N ATOM 1782 CA ALA A 122 -12.485 10.772 3.163 1.00 0.00 C ATOM 1783 C ALA A 122 -11.795 11.228 4.424 1.00 0.00 C ATOM 1784 O ALA A 122 -12.442 11.749 5.327 1.00 0.00 O ATOM 1785 CB ALA A 122 -12.751 11.955 2.253 1.00 0.00 C ATOM 0 H ALA A 122 -14.559 10.653 3.258 1.00 0.00 H new ATOM 0 HA ALA A 122 -11.842 10.069 2.634 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -11.807 12.438 1.999 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -13.239 11.610 1.341 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -13.398 12.669 2.763 1.00 0.00 H new ATOM 1791 N GLY A 123 -10.514 10.981 4.509 1.00 0.00 N ATOM 1792 CA GLY A 123 -9.752 11.357 5.677 1.00 0.00 C ATOM 1793 C GLY A 123 -9.790 10.291 6.749 1.00 0.00 C ATOM 1794 O GLY A 123 -9.077 10.372 7.748 1.00 0.00 O ATOM 0 H GLY A 123 -9.971 10.518 3.780 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -8.717 11.544 5.389 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -10.145 12.290 6.080 1.00 0.00 H new ATOM 1798 N SER A 124 -10.608 9.297 6.541 1.00 0.00 N ATOM 1799 CA SER A 124 -10.735 8.226 7.468 1.00 0.00 C ATOM 1800 C SER A 124 -9.842 7.088 7.006 1.00 0.00 C ATOM 1801 O SER A 124 -9.652 6.869 5.784 1.00 0.00 O ATOM 1802 CB SER A 124 -12.207 7.788 7.570 1.00 0.00 C ATOM 1803 OG SER A 124 -12.390 6.757 8.545 1.00 0.00 O ATOM 0 H SER A 124 -11.204 9.214 5.718 1.00 0.00 H new ATOM 0 HA SER A 124 -10.423 8.540 8.464 1.00 0.00 H new ATOM 0 HB2 SER A 124 -12.824 8.648 7.830 1.00 0.00 H new ATOM 0 HB3 SER A 124 -12.548 7.433 6.598 1.00 0.00 H new ATOM 0 HG SER A 124 -13.337 6.506 8.582 1.00 0.00 H new ATOM 1809 N LEU A 125 -9.260 6.416 7.971 1.00 0.00 N ATOM 1810 CA LEU A 125 -8.354 5.326 7.743 1.00 0.00 C ATOM 1811 C LEU A 125 -9.148 4.148 7.198 1.00 0.00 C ATOM 1812 O LEU A 125 -10.184 3.768 7.767 1.00 0.00 O ATOM 1813 CB LEU A 125 -7.649 4.996 9.094 1.00 0.00 C ATOM 1814 CG LEU A 125 -6.467 4.005 9.119 1.00 0.00 C ATOM 1815 CD1 LEU A 125 -6.897 2.599 8.825 1.00 0.00 C ATOM 1816 CD2 LEU A 125 -5.378 4.440 8.168 1.00 0.00 C ATOM 0 H LEU A 125 -9.410 6.621 8.959 1.00 0.00 H new ATOM 0 HA LEU A 125 -7.585 5.575 7.011 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -7.293 5.937 9.514 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -8.410 4.612 9.773 1.00 0.00 H new ATOM 0 HG LEU A 125 -6.068 4.014 10.133 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -6.030 1.940 8.854 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -7.623 2.277 9.572 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -7.351 2.557 7.835 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -4.556 3.725 8.204 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -5.776 4.484 7.154 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -5.014 5.426 8.458 1.00 0.00 H new ATOM 1828 N ILE A 126 -8.700 3.605 6.098 1.00 0.00 N ATOM 1829 CA ILE A 126 -9.376 2.485 5.493 1.00 0.00 C ATOM 1830 C ILE A 126 -8.553 1.210 5.559 1.00 0.00 C ATOM 1831 O ILE A 126 -9.107 0.111 5.573 1.00 0.00 O ATOM 1832 CB ILE A 126 -9.788 2.760 4.031 1.00 0.00 C ATOM 1833 CG1 ILE A 126 -8.592 3.203 3.178 1.00 0.00 C ATOM 1834 CG2 ILE A 126 -10.925 3.767 3.975 1.00 0.00 C ATOM 1835 CD1 ILE A 126 -8.862 3.263 1.692 1.00 0.00 C ATOM 0 H ILE A 126 -7.867 3.920 5.600 1.00 0.00 H new ATOM 0 HA ILE A 126 -10.282 2.344 6.082 1.00 0.00 H new ATOM 0 HB ILE A 126 -10.149 1.825 3.602 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -8.268 4.188 3.514 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -7.763 2.518 3.355 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -11.201 3.947 2.936 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -11.786 3.374 4.516 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -10.605 4.703 4.433 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -7.960 3.585 1.171 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -9.154 2.275 1.335 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -9.667 3.972 1.497 1.00 0.00 H new ATOM 1847 N ALA A 127 -7.241 1.348 5.608 1.00 0.00 N ATOM 1848 CA ALA A 127 -6.361 0.201 5.636 1.00 0.00 C ATOM 1849 C ALA A 127 -4.999 0.610 6.129 1.00 0.00 C ATOM 1850 O ALA A 127 -4.702 1.789 6.218 1.00 0.00 O ATOM 1851 CB ALA A 127 -6.237 -0.398 4.247 1.00 0.00 C ATOM 0 H ALA A 127 -6.762 2.248 5.629 1.00 0.00 H new ATOM 0 HA ALA A 127 -6.781 -0.544 6.311 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -5.572 -1.261 4.281 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -7.220 -0.711 3.897 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -5.829 0.348 3.564 1.00 0.00 H new ATOM 1857 N VAL A 128 -4.187 -0.356 6.431 1.00 0.00 N ATOM 1858 CA VAL A 128 -2.829 -0.152 6.904 1.00 0.00 C ATOM 1859 C VAL A 128 -1.976 -1.218 6.291 1.00 0.00 C ATOM 1860 O VAL A 128 -2.222 -2.406 6.493 1.00 0.00 O ATOM 1861 CB VAL A 128 -2.713 -0.246 8.461 1.00 0.00 C ATOM 1862 CG1 VAL A 128 -1.257 -0.249 8.913 1.00 0.00 C ATOM 1863 CG2 VAL A 128 -3.435 0.901 9.119 1.00 0.00 C ATOM 0 H VAL A 128 -4.446 -1.340 6.357 1.00 0.00 H new ATOM 0 HA VAL A 128 -2.510 0.850 6.618 1.00 0.00 H new ATOM 0 HB VAL A 128 -3.174 -1.187 8.762 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -1.214 -0.315 10.000 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -0.742 -1.105 8.476 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -0.773 0.671 8.586 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -3.342 0.816 10.202 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -2.997 1.843 8.790 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -4.489 0.874 8.842 1.00 0.00 H new ATOM 1873 N LEU A 129 -1.049 -0.821 5.503 1.00 0.00 N ATOM 1874 CA LEU A 129 -0.155 -1.744 4.887 1.00 0.00 C ATOM 1875 C LEU A 129 1.233 -1.450 5.359 1.00 0.00 C ATOM 1876 O LEU A 129 1.603 -0.301 5.487 1.00 0.00 O ATOM 1877 CB LEU A 129 -0.232 -1.577 3.392 1.00 0.00 C ATOM 1878 CG LEU A 129 -1.623 -1.705 2.800 1.00 0.00 C ATOM 1879 CD1 LEU A 129 -1.576 -1.429 1.351 1.00 0.00 C ATOM 1880 CD2 LEU A 129 -2.193 -3.078 3.041 1.00 0.00 C ATOM 0 H LEU A 129 -0.883 0.156 5.262 1.00 0.00 H new ATOM 0 HA LEU A 129 -0.423 -2.768 5.149 1.00 0.00 H new ATOM 0 HB2 LEU A 129 0.168 -0.597 3.131 1.00 0.00 H new ATOM 0 HB3 LEU A 129 0.414 -2.320 2.925 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.271 -0.978 3.290 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.577 -1.522 0.930 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -1.205 -0.417 1.185 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -0.911 -2.143 0.866 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -3.190 -3.140 2.605 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.548 -3.826 2.579 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -2.253 -3.264 4.113 1.00 0.00 H new ATOM 1892 N ILE A 130 1.989 -2.454 5.664 1.00 0.00 N ATOM 1893 CA ILE A 130 3.335 -2.208 6.077 1.00 0.00 C ATOM 1894 C ILE A 130 4.290 -2.858 5.121 1.00 0.00 C ATOM 1895 O ILE A 130 4.230 -4.034 4.887 1.00 0.00 O ATOM 1896 CB ILE A 130 3.664 -2.664 7.528 1.00 0.00 C ATOM 1897 CG1 ILE A 130 2.665 -2.112 8.534 1.00 0.00 C ATOM 1898 CG2 ILE A 130 5.057 -2.236 7.907 1.00 0.00 C ATOM 1899 CD1 ILE A 130 1.548 -3.072 8.827 1.00 0.00 C ATOM 0 H ILE A 130 1.707 -3.434 5.637 1.00 0.00 H new ATOM 0 HA ILE A 130 3.448 -1.124 6.070 1.00 0.00 H new ATOM 0 HB ILE A 130 3.598 -3.752 7.551 1.00 0.00 H new ATOM 0 HG12 ILE A 130 3.185 -1.871 9.461 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.247 -1.181 8.152 1.00 0.00 H new ATOM 0 HG21 ILE A 130 5.274 -2.562 8.924 1.00 0.00 H new ATOM 0 HG22 ILE A 130 5.775 -2.686 7.221 1.00 0.00 H new ATOM 0 HG23 ILE A 130 5.132 -1.150 7.850 1.00 0.00 H new ATOM 0 HD11 ILE A 130 0.865 -2.626 9.551 1.00 0.00 H new ATOM 0 HD12 ILE A 130 1.007 -3.293 7.907 1.00 0.00 H new ATOM 0 HD13 ILE A 130 1.959 -3.995 9.237 1.00 0.00 H new ATOM 1911 N LEU A 131 5.126 -2.077 4.580 1.00 0.00 N ATOM 1912 CA LEU A 131 6.162 -2.479 3.676 1.00 0.00 C ATOM 1913 C LEU A 131 7.347 -2.824 4.464 1.00 0.00 C ATOM 1914 O LEU A 131 7.633 -2.153 5.409 1.00 0.00 O ATOM 1915 CB LEU A 131 6.437 -1.261 2.828 1.00 0.00 C ATOM 1916 CG LEU A 131 7.733 -1.140 2.050 1.00 0.00 C ATOM 1917 CD1 LEU A 131 7.552 -0.096 0.968 1.00 0.00 C ATOM 1918 CD2 LEU A 131 8.917 -0.706 2.922 1.00 0.00 C ATOM 0 H LEU A 131 5.122 -1.072 4.754 1.00 0.00 H new ATOM 0 HA LEU A 131 5.891 -3.339 3.063 1.00 0.00 H new ATOM 0 HB2 LEU A 131 5.622 -1.179 2.109 1.00 0.00 H new ATOM 0 HB3 LEU A 131 6.373 -0.392 3.483 1.00 0.00 H new ATOM 0 HG LEU A 131 7.956 -2.127 1.644 1.00 0.00 H new ATOM 0 HD11 LEU A 131 8.477 0.003 0.399 1.00 0.00 H new ATOM 0 HD12 LEU A 131 6.746 -0.400 0.300 1.00 0.00 H new ATOM 0 HD13 LEU A 131 7.303 0.862 1.425 1.00 0.00 H new ATOM 0 HD21 LEU A 131 9.815 -0.637 2.308 1.00 0.00 H new ATOM 0 HD22 LEU A 131 8.705 0.267 3.365 1.00 0.00 H new ATOM 0 HD23 LEU A 131 9.074 -1.439 3.714 1.00 0.00 H new ATOM 1930 N ARG A 132 8.044 -3.827 4.083 1.00 0.00 N ATOM 1931 CA ARG A 132 9.258 -4.132 4.730 1.00 0.00 C ATOM 1932 C ARG A 132 10.384 -4.133 3.729 1.00 0.00 C ATOM 1933 O ARG A 132 10.268 -4.721 2.633 1.00 0.00 O ATOM 1934 CB ARG A 132 9.172 -5.434 5.500 1.00 0.00 C ATOM 1935 CG ARG A 132 10.427 -5.727 6.274 1.00 0.00 C ATOM 1936 CD ARG A 132 10.206 -6.798 7.289 1.00 0.00 C ATOM 1937 NE ARG A 132 9.871 -8.108 6.701 1.00 0.00 N ATOM 1938 CZ ARG A 132 10.169 -9.290 7.263 1.00 0.00 C ATOM 1939 NH1 ARG A 132 10.830 -9.334 8.418 1.00 0.00 N ATOM 1940 NH2 ARG A 132 9.798 -10.418 6.667 1.00 0.00 N ATOM 0 H ARG A 132 7.790 -4.454 3.320 1.00 0.00 H new ATOM 0 HA ARG A 132 9.464 -3.358 5.470 1.00 0.00 H new ATOM 0 HB2 ARG A 132 8.327 -5.391 6.187 1.00 0.00 H new ATOM 0 HB3 ARG A 132 8.978 -6.251 4.806 1.00 0.00 H new ATOM 0 HG2 ARG A 132 11.216 -6.032 5.587 1.00 0.00 H new ATOM 0 HG3 ARG A 132 10.770 -4.819 6.770 1.00 0.00 H new ATOM 0 HD2 ARG A 132 11.104 -6.901 7.898 1.00 0.00 H new ATOM 0 HD3 ARG A 132 9.401 -6.493 7.958 1.00 0.00 H new ATOM 0 HE ARG A 132 9.380 -8.117 5.807 1.00 0.00 H new ATOM 0 HH11 ARG A 132 11.111 -8.468 8.878 1.00 0.00 H new ATOM 0 HH12 ARG A 132 11.055 -10.234 8.843 1.00 0.00 H new ATOM 0 HH21 ARG A 132 9.288 -10.385 5.784 1.00 0.00 H new ATOM 0 HH22 ARG A 132 10.023 -11.317 7.092 1.00 0.00 H new ATOM 1954 N GLN A 133 11.432 -3.445 4.079 1.00 0.00 N ATOM 1955 CA GLN A 133 12.593 -3.312 3.272 1.00 0.00 C ATOM 1956 C GLN A 133 13.608 -4.304 3.764 1.00 0.00 C ATOM 1957 O GLN A 133 13.650 -4.612 4.951 1.00 0.00 O ATOM 1958 CB GLN A 133 13.190 -1.911 3.432 1.00 0.00 C ATOM 1959 CG GLN A 133 12.301 -0.722 3.085 1.00 0.00 C ATOM 1960 CD GLN A 133 12.122 -0.411 1.581 1.00 0.00 C ATOM 1961 OE1 GLN A 133 11.929 0.729 1.216 1.00 0.00 O ATOM 1962 NE2 GLN A 133 12.202 -1.385 0.706 1.00 0.00 N ATOM 0 H GLN A 133 11.496 -2.947 4.967 1.00 0.00 H new ATOM 0 HA GLN A 133 12.334 -3.480 2.227 1.00 0.00 H new ATOM 0 HB2 GLN A 133 13.512 -1.799 4.467 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.085 -1.854 2.812 1.00 0.00 H new ATOM 0 HG2 GLN A 133 11.315 -0.895 3.517 1.00 0.00 H new ATOM 0 HG3 GLN A 133 12.711 0.164 3.570 1.00 0.00 H new ATOM 0 HE21 GLN A 133 12.365 -2.341 1.021 1.00 0.00 H new ATOM 0 HE22 GLN A 133 12.102 -1.186 -0.289 1.00 0.00 H new ATOM 1971 N THR A 134 14.341 -4.860 2.873 1.00 0.00 N ATOM 1972 CA THR A 134 15.443 -5.728 3.200 1.00 0.00 C ATOM 1973 C THR A 134 16.416 -5.667 2.008 1.00 0.00 C ATOM 1974 O THR A 134 15.961 -5.624 0.870 1.00 0.00 O ATOM 1975 CB THR A 134 14.961 -7.205 3.401 1.00 0.00 C ATOM 1976 OG1 THR A 134 13.785 -7.242 4.258 1.00 0.00 O ATOM 1977 CG2 THR A 134 16.058 -8.020 4.065 1.00 0.00 C ATOM 0 H THR A 134 14.201 -4.731 1.871 1.00 0.00 H new ATOM 0 HA THR A 134 15.913 -5.408 4.130 1.00 0.00 H new ATOM 0 HB THR A 134 14.719 -7.620 2.423 1.00 0.00 H new ATOM 0 HG1 THR A 134 13.494 -8.171 4.374 1.00 0.00 H new ATOM 0 HG21 THR A 134 15.717 -9.046 4.202 1.00 0.00 H new ATOM 0 HG22 THR A 134 16.947 -8.015 3.435 1.00 0.00 H new ATOM 0 HG23 THR A 134 16.298 -7.585 5.035 1.00 0.00 H new ATOM 1985 N ASN A 135 17.712 -5.599 2.238 1.00 0.00 N ATOM 1986 CA ASN A 135 18.649 -5.626 1.129 1.00 0.00 C ATOM 1987 C ASN A 135 19.836 -6.550 1.389 1.00 0.00 C ATOM 1988 O ASN A 135 19.911 -7.195 2.429 1.00 0.00 O ATOM 1989 CB ASN A 135 19.119 -4.239 0.624 1.00 0.00 C ATOM 1990 CG ASN A 135 20.088 -3.473 1.519 1.00 0.00 C ATOM 1991 OD1 ASN A 135 21.269 -3.740 1.492 1.00 0.00 O ATOM 1992 ND2 ASN A 135 19.646 -2.415 2.125 1.00 0.00 N ATOM 0 H ASN A 135 18.136 -5.526 3.163 1.00 0.00 H new ATOM 0 HA ASN A 135 18.062 -6.042 0.310 1.00 0.00 H new ATOM 0 HB2 ASN A 135 19.590 -4.374 -0.350 1.00 0.00 H new ATOM 0 HB3 ASN A 135 18.237 -3.618 0.468 1.00 0.00 H new ATOM 0 HD21 ASN A 135 20.298 -1.786 2.593 1.00 0.00 H new ATOM 0 HD22 ASN A 135 18.646 -2.212 2.133 1.00 0.00 H new ATOM 2083 N PHE A 142 14.105 -2.388 7.720 1.00 0.00 N ATOM 2084 CA PHE A 142 13.179 -1.526 8.377 1.00 0.00 C ATOM 2085 C PHE A 142 11.872 -1.631 7.655 1.00 0.00 C ATOM 2086 O PHE A 142 11.847 -1.996 6.469 1.00 0.00 O ATOM 2087 CB PHE A 142 13.662 -0.085 8.308 1.00 0.00 C ATOM 2088 CG PHE A 142 14.997 0.160 8.941 1.00 0.00 C ATOM 2089 CD1 PHE A 142 15.125 0.207 10.316 1.00 0.00 C ATOM 2090 CD2 PHE A 142 16.118 0.375 8.158 1.00 0.00 C ATOM 2091 CE1 PHE A 142 16.344 0.462 10.898 1.00 0.00 C ATOM 2092 CE2 PHE A 142 17.343 0.627 8.734 1.00 0.00 C ATOM 2093 CZ PHE A 142 17.456 0.672 10.105 1.00 0.00 C ATOM 0 HA PHE A 142 13.080 -1.814 9.423 1.00 0.00 H new ATOM 0 HB2 PHE A 142 13.710 0.218 7.262 1.00 0.00 H new ATOM 0 HB3 PHE A 142 12.923 0.555 8.791 1.00 0.00 H new ATOM 0 HD1 PHE A 142 14.259 0.042 10.940 1.00 0.00 H new ATOM 0 HD2 PHE A 142 16.031 0.345 7.082 1.00 0.00 H new ATOM 0 HE1 PHE A 142 16.432 0.498 11.974 1.00 0.00 H new ATOM 0 HE2 PHE A 142 18.211 0.789 8.113 1.00 0.00 H new ATOM 0 HZ PHE A 142 18.414 0.872 10.561 1.00 0.00 H new ATOM 2103 N GLN A 143 10.798 -1.329 8.304 1.00 0.00 N ATOM 2104 CA GLN A 143 9.558 -1.393 7.626 1.00 0.00 C ATOM 2105 C GLN A 143 8.806 -0.077 7.699 1.00 0.00 C ATOM 2106 O GLN A 143 8.861 0.641 8.707 1.00 0.00 O ATOM 2107 CB GLN A 143 8.736 -2.606 8.044 1.00 0.00 C ATOM 2108 CG GLN A 143 8.221 -2.613 9.471 1.00 0.00 C ATOM 2109 CD GLN A 143 7.573 -3.943 9.813 1.00 0.00 C ATOM 2110 OE1 GLN A 143 7.963 -4.972 9.290 1.00 0.00 O ATOM 2111 NE2 GLN A 143 6.566 -3.934 10.649 1.00 0.00 N ATOM 0 H GLN A 143 10.757 -1.042 9.282 1.00 0.00 H new ATOM 0 HA GLN A 143 9.767 -1.547 6.567 1.00 0.00 H new ATOM 0 HB2 GLN A 143 7.882 -2.688 7.372 1.00 0.00 H new ATOM 0 HB3 GLN A 143 9.344 -3.498 7.896 1.00 0.00 H new ATOM 0 HG2 GLN A 143 9.044 -2.419 10.159 1.00 0.00 H new ATOM 0 HG3 GLN A 143 7.498 -1.808 9.604 1.00 0.00 H new ATOM 0 HE21 GLN A 143 6.262 -3.057 11.071 1.00 0.00 H new ATOM 0 HE22 GLN A 143 6.086 -4.804 10.878 1.00 0.00 H new ATOM 2120 N PHE A 144 8.150 0.251 6.617 1.00 0.00 N ATOM 2121 CA PHE A 144 7.456 1.510 6.461 1.00 0.00 C ATOM 2122 C PHE A 144 5.970 1.249 6.551 1.00 0.00 C ATOM 2123 O PHE A 144 5.454 0.362 5.871 1.00 0.00 O ATOM 2124 CB PHE A 144 7.764 2.160 5.086 1.00 0.00 C ATOM 2125 CG PHE A 144 9.228 2.495 4.772 1.00 0.00 C ATOM 2126 CD1 PHE A 144 10.266 2.111 5.601 1.00 0.00 C ATOM 2127 CD2 PHE A 144 9.540 3.202 3.624 1.00 0.00 C ATOM 2128 CE1 PHE A 144 11.575 2.420 5.299 1.00 0.00 C ATOM 2129 CE2 PHE A 144 10.849 3.516 3.314 1.00 0.00 C ATOM 2130 CZ PHE A 144 11.868 3.125 4.153 1.00 0.00 C ATOM 0 H PHE A 144 8.080 -0.358 5.802 1.00 0.00 H new ATOM 0 HA PHE A 144 7.788 2.191 7.245 1.00 0.00 H new ATOM 0 HB2 PHE A 144 7.398 1.490 4.308 1.00 0.00 H new ATOM 0 HB3 PHE A 144 7.185 3.081 5.012 1.00 0.00 H new ATOM 0 HD1 PHE A 144 10.047 1.558 6.503 1.00 0.00 H new ATOM 0 HD2 PHE A 144 8.747 3.513 2.960 1.00 0.00 H new ATOM 0 HE1 PHE A 144 12.370 2.109 5.961 1.00 0.00 H new ATOM 0 HE2 PHE A 144 11.073 4.068 2.413 1.00 0.00 H new ATOM 0 HZ PHE A 144 12.892 3.370 3.914 1.00 0.00 H new ATOM 2140 N VAL A 145 5.301 1.992 7.373 1.00 0.00 N ATOM 2141 CA VAL A 145 3.874 1.828 7.568 1.00 0.00 C ATOM 2142 C VAL A 145 3.123 2.779 6.673 1.00 0.00 C ATOM 2143 O VAL A 145 3.386 3.974 6.664 1.00 0.00 O ATOM 2144 CB VAL A 145 3.468 2.108 9.023 1.00 0.00 C ATOM 2145 CG1 VAL A 145 1.980 1.870 9.239 1.00 0.00 C ATOM 2146 CG2 VAL A 145 4.307 1.299 9.990 1.00 0.00 C ATOM 0 H VAL A 145 5.718 2.734 7.935 1.00 0.00 H new ATOM 0 HA VAL A 145 3.627 0.795 7.324 1.00 0.00 H new ATOM 0 HB VAL A 145 3.660 3.162 9.224 1.00 0.00 H new ATOM 0 HG11 VAL A 145 1.726 2.077 10.278 1.00 0.00 H new ATOM 0 HG12 VAL A 145 1.408 2.530 8.587 1.00 0.00 H new ATOM 0 HG13 VAL A 145 1.740 0.833 9.006 1.00 0.00 H new ATOM 0 HG21 VAL A 145 3.997 1.518 11.012 1.00 0.00 H new ATOM 0 HG22 VAL A 145 4.171 0.236 9.789 1.00 0.00 H new ATOM 0 HG23 VAL A 145 5.358 1.560 9.866 1.00 0.00 H new ATOM 2156 N TRP A 146 2.198 2.262 5.958 1.00 0.00 N ATOM 2157 CA TRP A 146 1.413 3.041 5.047 1.00 0.00 C ATOM 2158 C TRP A 146 -0.022 2.980 5.463 1.00 0.00 C ATOM 2159 O TRP A 146 -0.705 1.965 5.278 1.00 0.00 O ATOM 2160 CB TRP A 146 1.575 2.536 3.616 1.00 0.00 C ATOM 2161 CG TRP A 146 2.998 2.440 3.210 1.00 0.00 C ATOM 2162 CD1 TRP A 146 3.781 1.338 3.297 1.00 0.00 C ATOM 2163 CD2 TRP A 146 3.841 3.487 2.694 1.00 0.00 C ATOM 2164 NE1 TRP A 146 5.032 1.634 2.861 1.00 0.00 N ATOM 2165 CE2 TRP A 146 5.096 2.926 2.485 1.00 0.00 C ATOM 2166 CE3 TRP A 146 3.658 4.835 2.381 1.00 0.00 C ATOM 2167 CZ2 TRP A 146 6.163 3.637 1.991 1.00 0.00 C ATOM 2168 CZ3 TRP A 146 4.738 5.552 1.882 1.00 0.00 C ATOM 2169 CH2 TRP A 146 5.977 4.947 1.691 1.00 0.00 C ATOM 0 H TRP A 146 1.952 1.272 5.981 1.00 0.00 H new ATOM 0 HA TRP A 146 1.758 4.075 5.074 1.00 0.00 H new ATOM 0 HB2 TRP A 146 1.106 1.556 3.524 1.00 0.00 H new ATOM 0 HB3 TRP A 146 1.050 3.206 2.935 1.00 0.00 H new ATOM 0 HD1 TRP A 146 3.459 0.372 3.658 1.00 0.00 H new ATOM 0 HE1 TRP A 146 5.809 0.975 2.824 1.00 0.00 H new ATOM 0 HE3 TRP A 146 2.698 5.310 2.524 1.00 0.00 H new ATOM 0 HZ2 TRP A 146 7.124 3.166 1.845 1.00 0.00 H new ATOM 0 HZ3 TRP A 146 4.614 6.597 1.638 1.00 0.00 H new ATOM 0 HH2 TRP A 146 6.800 5.527 1.300 1.00 0.00 H new ATOM 2180 N ASN A 147 -0.460 4.029 6.065 1.00 0.00 N ATOM 2181 CA ASN A 147 -1.813 4.151 6.493 1.00 0.00 C ATOM 2182 C ASN A 147 -2.603 4.581 5.301 1.00 0.00 C ATOM 2183 O ASN A 147 -2.417 5.686 4.809 1.00 0.00 O ATOM 2184 CB ASN A 147 -1.946 5.217 7.581 1.00 0.00 C ATOM 2185 CG ASN A 147 -1.165 4.948 8.844 1.00 0.00 C ATOM 2186 OD1 ASN A 147 -1.663 4.319 9.780 1.00 0.00 O ATOM 2187 ND2 ASN A 147 0.047 5.436 8.902 1.00 0.00 N ATOM 0 H ASN A 147 0.119 4.841 6.278 1.00 0.00 H new ATOM 0 HA ASN A 147 -2.165 3.203 6.901 1.00 0.00 H new ATOM 0 HB2 ASN A 147 -1.624 6.174 7.171 1.00 0.00 H new ATOM 0 HB3 ASN A 147 -3.000 5.320 7.840 1.00 0.00 H new ATOM 0 HD21 ASN A 147 0.612 5.301 9.741 1.00 0.00 H new ATOM 0 HD22 ASN A 147 0.428 5.952 8.109 1.00 0.00 H new ATOM 2194 N ILE A 148 -3.429 3.721 4.803 1.00 0.00 N ATOM 2195 CA ILE A 148 -4.198 4.028 3.637 1.00 0.00 C ATOM 2196 C ILE A 148 -5.466 4.764 4.068 1.00 0.00 C ATOM 2197 O ILE A 148 -6.244 4.259 4.895 1.00 0.00 O ATOM 2198 CB ILE A 148 -4.583 2.744 2.834 1.00 0.00 C ATOM 2199 CG1 ILE A 148 -3.366 1.821 2.590 1.00 0.00 C ATOM 2200 CG2 ILE A 148 -5.218 3.110 1.508 1.00 0.00 C ATOM 2201 CD1 ILE A 148 -2.156 2.510 1.976 1.00 0.00 C ATOM 0 H ILE A 148 -3.591 2.791 5.188 1.00 0.00 H new ATOM 0 HA ILE A 148 -3.592 4.652 2.980 1.00 0.00 H new ATOM 0 HB ILE A 148 -5.303 2.197 3.443 1.00 0.00 H new ATOM 0 HG12 ILE A 148 -3.070 1.375 3.539 1.00 0.00 H new ATOM 0 HG13 ILE A 148 -3.672 1.004 1.936 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -5.478 2.201 0.966 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -6.119 3.697 1.686 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -4.514 3.696 0.917 1.00 0.00 H new ATOM 0 HD11 ILE A 148 -1.353 1.785 1.842 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -2.429 2.932 1.009 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -1.817 3.308 2.637 1.00 0.00 H new ATOM 2213 N TYR A 149 -5.634 5.951 3.566 1.00 0.00 N ATOM 2214 CA TYR A 149 -6.784 6.775 3.835 1.00 0.00 C ATOM 2215 C TYR A 149 -7.525 7.034 2.565 1.00 0.00 C ATOM 2216 O TYR A 149 -6.934 7.072 1.473 1.00 0.00 O ATOM 2217 CB TYR A 149 -6.370 8.133 4.393 1.00 0.00 C ATOM 2218 CG TYR A 149 -5.772 8.108 5.756 1.00 0.00 C ATOM 2219 CD1 TYR A 149 -6.572 8.230 6.865 1.00 0.00 C ATOM 2220 CD2 TYR A 149 -4.416 7.980 5.935 1.00 0.00 C ATOM 2221 CE1 TYR A 149 -6.043 8.221 8.132 1.00 0.00 C ATOM 2222 CE2 TYR A 149 -3.868 7.971 7.195 1.00 0.00 C ATOM 2223 CZ TYR A 149 -4.689 8.092 8.291 1.00 0.00 C ATOM 2224 OH TYR A 149 -4.152 8.073 9.551 1.00 0.00 O ATOM 0 H TYR A 149 -4.958 6.389 2.940 1.00 0.00 H new ATOM 0 HA TYR A 149 -7.403 6.245 4.559 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -5.652 8.585 3.708 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -7.246 8.782 4.411 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -7.639 8.335 6.738 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -3.772 7.885 5.073 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -6.688 8.315 8.994 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -2.800 7.870 7.323 1.00 0.00 H new ATOM 0 HH TYR A 149 -3.179 7.974 9.490 1.00 0.00 H new ATOM 2234 N ALA A 150 -8.796 7.229 2.697 1.00 0.00 N ATOM 2235 CA ALA A 150 -9.606 7.575 1.592 1.00 0.00 C ATOM 2236 C ALA A 150 -9.442 9.050 1.327 1.00 0.00 C ATOM 2237 O ALA A 150 -9.526 9.861 2.241 1.00 0.00 O ATOM 2238 CB ALA A 150 -11.037 7.272 1.890 1.00 0.00 C ATOM 0 H ALA A 150 -9.297 7.151 3.582 1.00 0.00 H new ATOM 0 HA ALA A 150 -9.306 6.999 0.717 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -11.652 7.542 1.032 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -11.148 6.207 2.095 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -11.357 7.845 2.761 1.00 0.00 H new ATOM 2244 N ASN A 151 -9.197 9.396 0.103 1.00 0.00 N ATOM 2245 CA ASN A 151 -9.004 10.797 -0.273 1.00 0.00 C ATOM 2246 C ASN A 151 -10.351 11.361 -0.697 1.00 0.00 C ATOM 2247 O ASN A 151 -10.512 12.552 -0.948 1.00 0.00 O ATOM 2248 CB ASN A 151 -8.050 10.866 -1.453 1.00 0.00 C ATOM 2249 CG ASN A 151 -7.280 12.163 -1.574 1.00 0.00 C ATOM 2250 OD1 ASN A 151 -7.685 13.221 -1.097 1.00 0.00 O ATOM 2251 ND2 ASN A 151 -6.178 12.082 -2.242 1.00 0.00 N ATOM 0 H ASN A 151 -9.122 8.737 -0.672 1.00 0.00 H new ATOM 0 HA ASN A 151 -8.596 11.364 0.564 1.00 0.00 H new ATOM 0 HB2 ASN A 151 -7.339 10.044 -1.375 1.00 0.00 H new ATOM 0 HB3 ASN A 151 -8.618 10.710 -2.370 1.00 0.00 H new ATOM 0 HD21 ASN A 151 -5.609 12.915 -2.390 1.00 0.00 H new ATOM 0 HD22 ASN A 151 -5.877 11.185 -2.622 1.00 0.00 H new ATOM 2258 N ASN A 152 -11.313 10.473 -0.761 1.00 0.00 N ATOM 2259 CA ASN A 152 -12.660 10.760 -1.201 1.00 0.00 C ATOM 2260 C ASN A 152 -13.606 9.746 -0.600 1.00 0.00 C ATOM 2261 O ASN A 152 -13.249 8.574 -0.456 1.00 0.00 O ATOM 2262 CB ASN A 152 -12.715 10.739 -2.734 1.00 0.00 C ATOM 2263 CG ASN A 152 -14.096 10.523 -3.305 1.00 0.00 C ATOM 2264 OD1 ASN A 152 -14.861 11.461 -3.506 1.00 0.00 O ATOM 2265 ND2 ASN A 152 -14.400 9.295 -3.602 1.00 0.00 N ATOM 0 H ASN A 152 -11.177 9.497 -0.500 1.00 0.00 H new ATOM 0 HA ASN A 152 -12.963 11.752 -0.867 1.00 0.00 H new ATOM 0 HB2 ASN A 152 -12.322 11.683 -3.113 1.00 0.00 H new ATOM 0 HB3 ASN A 152 -12.057 9.950 -3.098 1.00 0.00 H new ATOM 0 HD21 ASN A 152 -15.306 9.081 -4.020 1.00 0.00 H new ATOM 0 HD22 ASN A 152 -13.733 8.546 -3.418 1.00 0.00 H new ATOM 2272 N ASP A 153 -14.776 10.205 -0.234 1.00 0.00 N ATOM 2273 CA ASP A 153 -15.781 9.378 0.396 1.00 0.00 C ATOM 2274 C ASP A 153 -16.654 8.663 -0.626 1.00 0.00 C ATOM 2275 O ASP A 153 -17.097 9.249 -1.625 1.00 0.00 O ATOM 2276 CB ASP A 153 -16.603 10.184 1.404 1.00 0.00 C ATOM 2277 CG ASP A 153 -17.431 11.324 0.861 1.00 0.00 C ATOM 2278 OD1 ASP A 153 -16.917 12.138 0.072 1.00 0.00 O ATOM 2279 OD2 ASP A 153 -18.580 11.484 1.312 1.00 0.00 O ATOM 0 H ASP A 153 -15.064 11.175 -0.366 1.00 0.00 H new ATOM 0 HA ASP A 153 -15.265 8.596 0.953 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -17.272 9.497 1.922 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -15.920 10.588 2.152 1.00 0.00 H new ATOM 2284 N VAL A 154 -16.893 7.398 -0.363 1.00 0.00 N ATOM 2285 CA VAL A 154 -17.555 6.495 -1.291 1.00 0.00 C ATOM 2286 C VAL A 154 -18.943 6.107 -0.814 1.00 0.00 C ATOM 2287 O VAL A 154 -19.153 5.870 0.386 1.00 0.00 O ATOM 2288 CB VAL A 154 -16.687 5.220 -1.506 1.00 0.00 C ATOM 2289 CG1 VAL A 154 -17.399 4.159 -2.321 1.00 0.00 C ATOM 2290 CG2 VAL A 154 -15.342 5.578 -2.128 1.00 0.00 C ATOM 0 H VAL A 154 -16.630 6.955 0.517 1.00 0.00 H new ATOM 0 HA VAL A 154 -17.669 7.022 -2.238 1.00 0.00 H new ATOM 0 HB VAL A 154 -16.510 4.789 -0.521 1.00 0.00 H new ATOM 0 HG11 VAL A 154 -16.748 3.293 -2.440 1.00 0.00 H new ATOM 0 HG12 VAL A 154 -18.313 3.858 -1.808 1.00 0.00 H new ATOM 0 HG13 VAL A 154 -17.650 4.561 -3.302 1.00 0.00 H new ATOM 0 HG21 VAL A 154 -14.753 4.671 -2.269 1.00 0.00 H new ATOM 0 HG22 VAL A 154 -15.504 6.059 -3.093 1.00 0.00 H new ATOM 0 HG23 VAL A 154 -14.806 6.260 -1.468 1.00 0.00 H new ATOM 2300 N VAL A 155 -19.872 6.028 -1.758 1.00 0.00 N ATOM 2301 CA VAL A 155 -21.242 5.684 -1.488 1.00 0.00 C ATOM 2302 C VAL A 155 -21.604 4.453 -2.331 1.00 0.00 C ATOM 2303 O VAL A 155 -21.211 4.333 -3.503 1.00 0.00 O ATOM 2304 CB VAL A 155 -22.186 6.847 -1.879 1.00 0.00 C ATOM 2305 CG1 VAL A 155 -23.603 6.680 -1.395 1.00 0.00 C ATOM 2306 CG2 VAL A 155 -21.612 8.200 -1.541 1.00 0.00 C ATOM 0 H VAL A 155 -19.681 6.206 -2.744 1.00 0.00 H new ATOM 0 HA VAL A 155 -21.357 5.481 -0.423 1.00 0.00 H new ATOM 0 HB VAL A 155 -22.254 6.799 -2.966 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -24.199 7.537 -1.710 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -24.027 5.769 -1.817 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -23.610 6.614 -0.307 1.00 0.00 H new ATOM 0 HG21 VAL A 155 -22.316 8.978 -1.837 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -21.433 8.262 -0.468 1.00 0.00 H new ATOM 0 HG23 VAL A 155 -20.672 8.340 -2.074 1.00 0.00 H new ATOM 2316 N VAL A 156 -22.293 3.549 -1.729 1.00 0.00 N ATOM 2317 CA VAL A 156 -22.731 2.340 -2.352 1.00 0.00 C ATOM 2318 C VAL A 156 -24.216 2.436 -2.699 1.00 0.00 C ATOM 2319 O VAL A 156 -25.065 2.339 -1.829 1.00 0.00 O ATOM 2320 CB VAL A 156 -22.474 1.126 -1.404 1.00 0.00 C ATOM 2321 CG1 VAL A 156 -23.068 -0.159 -1.953 1.00 0.00 C ATOM 2322 CG2 VAL A 156 -20.984 0.955 -1.149 1.00 0.00 C ATOM 0 H VAL A 156 -22.580 3.630 -0.754 1.00 0.00 H new ATOM 0 HA VAL A 156 -22.166 2.192 -3.272 1.00 0.00 H new ATOM 0 HB VAL A 156 -22.974 1.340 -0.459 1.00 0.00 H new ATOM 0 HG11 VAL A 156 -22.866 -0.978 -1.262 1.00 0.00 H new ATOM 0 HG12 VAL A 156 -24.145 -0.041 -2.070 1.00 0.00 H new ATOM 0 HG13 VAL A 156 -22.620 -0.382 -2.921 1.00 0.00 H new ATOM 0 HG21 VAL A 156 -20.824 0.104 -0.486 1.00 0.00 H new ATOM 0 HG22 VAL A 156 -20.471 0.780 -2.095 1.00 0.00 H new ATOM 0 HG23 VAL A 156 -20.589 1.858 -0.683 1.00 0.00 H new ATOM 2332 N PRO A 157 -24.550 2.658 -3.972 1.00 0.00 N ATOM 2333 CA PRO A 157 -25.945 2.708 -4.409 1.00 0.00 C ATOM 2334 C PRO A 157 -26.598 1.329 -4.343 1.00 0.00 C ATOM 2335 O PRO A 157 -27.818 1.228 -4.272 1.00 0.00 O ATOM 2336 CB PRO A 157 -25.860 3.179 -5.850 1.00 0.00 C ATOM 2337 CG PRO A 157 -24.487 2.808 -6.281 1.00 0.00 C ATOM 2338 CD PRO A 157 -23.623 2.929 -5.075 1.00 0.00 C ATOM 0 HA PRO A 157 -26.550 3.359 -3.778 1.00 0.00 H new ATOM 0 HB2 PRO A 157 -26.615 2.697 -6.471 1.00 0.00 H new ATOM 0 HB3 PRO A 157 -26.024 4.254 -5.927 1.00 0.00 H new ATOM 0 HG2 PRO A 157 -24.464 1.792 -6.675 1.00 0.00 H new ATOM 0 HG3 PRO A 157 -24.138 3.466 -7.077 1.00 0.00 H new ATOM 0 HD2 PRO A 157 -22.801 2.214 -5.095 1.00 0.00 H new ATOM 0 HD3 PRO A 157 -23.180 3.922 -4.995 1.00 0.00 H new ATOM 2346 N THR A 158 -25.749 0.280 -4.363 1.00 0.00 N ATOM 2347 CA THR A 158 -26.154 -1.124 -4.242 1.00 0.00 C ATOM 2348 C THR A 158 -27.394 -1.473 -5.083 1.00 0.00 C ATOM 2349 O THR A 158 -27.307 -1.389 -6.321 1.00 0.00 O ATOM 2350 CB THR A 158 -26.282 -1.594 -2.734 1.00 0.00 C ATOM 2351 OG1 THR A 158 -26.817 -2.907 -2.668 1.00 0.00 O ATOM 2352 CG2 THR A 158 -27.138 -0.657 -1.884 1.00 0.00 C ATOM 2353 OXT THR A 158 -28.441 -1.876 -4.524 1.00 0.00 O ATOM 0 H THR A 158 -24.741 0.396 -4.466 1.00 0.00 H new ATOM 0 HA THR A 158 -25.338 -1.704 -4.673 1.00 0.00 H new ATOM 0 HB THR A 158 -25.273 -1.576 -2.323 1.00 0.00 H new ATOM 0 HG1 THR A 158 -27.696 -2.924 -3.101 1.00 0.00 H new ATOM 0 HG21 THR A 158 -27.186 -1.034 -0.863 1.00 0.00 H new ATOM 0 HG22 THR A 158 -26.695 0.339 -1.882 1.00 0.00 H new ATOM 0 HG23 THR A 158 -28.144 -0.606 -2.300 1.00 0.00 H new