USER MOD reduce.3.24.130724 H: found=0, std=0, add=633, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 627 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 79 HIS : no HD1:sc= -0.51 X(o=0.16,f=0.28) USER MOD Set 1.2: A 80 HIS : no HE2:sc= 0.675 K(o=0.16,f=-2.5!) USER MOD Set 2.1: A 26 GLN : amide:sc= 1.25 K(o=1.5,f=-3) USER MOD Set 2.2: A 50 LYS NZ :NH3+ -168:sc= 0.203 (180deg=-0.235) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 145:sc= 0.0201 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 47:sc= 0.835 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot -130:sc= 0.75 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 24 GLN : amide:sc= -0.0104 X(o=-0.01,f=-0.01) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 90:sc= 1.24 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 177:sc= 1.23 (180deg=1.2) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 77:sc= 0.299 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= 0.194 X(o=0.19,f=0) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=-0.055) USER MOD Single : A 61 GLN : amide:sc=-0.00835 K(o=-0.0084,f=-0.54) USER MOD Single : A 62 SER OG : rot -45:sc= 0.0148 USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 THR OG1 : rot -62:sc= 0.327 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ -176:sc= 1.18 (180deg=1.17) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 81 HIS : no HE2:sc= 0.64 K(o=0.64,f=-2.1!) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 83 HIS : no HD1:sc=-1.89e-05 X(o=-1.9e-05,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -21.599 5.724 6.606 1.00 10.00 N ATOM 2 CA MET A 1 -21.303 4.458 5.884 1.00 10.00 C ATOM 3 C MET A 1 -20.419 4.714 4.660 1.00 10.00 C ATOM 4 O MET A 1 -20.561 5.746 4.001 1.00 10.00 O ATOM 5 CB MET A 1 -22.583 3.681 5.502 1.00 10.00 C ATOM 6 CG MET A 1 -23.499 4.384 4.485 1.00 10.00 C ATOM 7 SD MET A 1 -24.979 3.432 4.041 1.00 10.00 S ATOM 8 CE MET A 1 -25.700 4.558 2.814 1.00 10.00 C ATOM 0 H1 MET A 1 -22.562 5.684 6.996 1.00 10.00 H new ATOM 0 H2 MET A 1 -20.917 5.849 7.381 1.00 10.00 H new ATOM 0 H3 MET A 1 -21.525 6.525 5.947 1.00 10.00 H new ATOM 0 HA MET A 1 -20.749 3.823 6.575 1.00 10.00 H new ATOM 0 HB2 MET A 1 -22.293 2.712 5.096 1.00 10.00 H new ATOM 0 HB3 MET A 1 -23.155 3.488 6.409 1.00 10.00 H new ATOM 0 HG2 MET A 1 -23.808 5.346 4.894 1.00 10.00 H new ATOM 0 HG3 MET A 1 -22.928 4.591 3.580 1.00 10.00 H new ATOM 0 HE1 MET A 1 -26.626 4.131 2.429 1.00 10.00 H new ATOM 0 HE2 MET A 1 -25.911 5.520 3.282 1.00 10.00 H new ATOM 0 HE3 MET A 1 -24.997 4.700 1.993 1.00 10.00 H new ATOM 20 N ALA A 2 -19.510 3.784 4.345 1.00 10.00 N ATOM 21 CA ALA A 2 -18.645 3.841 3.162 1.00 10.00 C ATOM 22 C ALA A 2 -18.074 2.496 2.757 1.00 10.00 C ATOM 23 O ALA A 2 -18.000 1.524 3.516 1.00 10.00 O ATOM 24 CB ALA A 2 -17.392 4.703 3.460 1.00 10.00 C ATOM 0 H ALA A 2 -19.352 2.954 4.917 1.00 10.00 H new ATOM 0 HA ALA A 2 -19.285 4.239 2.375 1.00 10.00 H new ATOM 0 HB1 ALA A 2 -16.756 4.739 2.575 1.00 10.00 H new ATOM 0 HB2 ALA A 2 -17.701 5.714 3.726 1.00 10.00 H new ATOM 0 HB3 ALA A 2 -16.836 4.263 4.288 1.00 10.00 H new ATOM 30 N THR A 3 -17.629 2.518 1.513 1.00 10.00 N ATOM 31 CA THR A 3 -16.778 1.516 0.917 1.00 10.00 C ATOM 32 C THR A 3 -15.354 1.885 1.332 1.00 10.00 C ATOM 33 O THR A 3 -15.107 2.971 1.870 1.00 10.00 O ATOM 34 CB THR A 3 -16.934 1.522 -0.597 1.00 10.00 C ATOM 35 OG1 THR A 3 -16.897 2.821 -1.143 1.00 10.00 O ATOM 36 CG2 THR A 3 -18.300 0.930 -0.925 1.00 10.00 C ATOM 0 H THR A 3 -17.864 3.271 0.866 1.00 10.00 H new ATOM 0 HA THR A 3 -17.035 0.510 1.249 1.00 10.00 H new ATOM 0 HB THR A 3 -16.107 0.952 -1.020 1.00 10.00 H new ATOM 0 HG1 THR A 3 -16.145 3.317 -0.757 1.00 10.00 H new ATOM 0 HG21 THR A 3 -18.442 0.920 -2.006 1.00 10.00 H new ATOM 0 HG22 THR A 3 -18.356 -0.089 -0.543 1.00 10.00 H new ATOM 0 HG23 THR A 3 -19.079 1.535 -0.462 1.00 10.00 H new ATOM 44 N PRO A 4 -14.399 0.974 1.143 1.00 10.00 N ATOM 45 CA PRO A 4 -13.057 1.105 1.694 1.00 10.00 C ATOM 46 C PRO A 4 -12.214 2.379 1.458 1.00 10.00 C ATOM 47 O PRO A 4 -11.121 2.475 2.021 1.00 10.00 O ATOM 48 CB PRO A 4 -12.345 -0.170 1.285 1.00 10.00 C ATOM 49 CG PRO A 4 -13.488 -1.186 1.303 1.00 10.00 C ATOM 50 CD PRO A 4 -14.659 -0.407 0.763 1.00 10.00 C ATOM 0 HA PRO A 4 -13.182 1.248 2.767 1.00 10.00 H new ATOM 0 HB2 PRO A 4 -11.889 -0.085 0.299 1.00 10.00 H new ATOM 0 HB3 PRO A 4 -11.550 -0.436 1.982 1.00 10.00 H new ATOM 0 HG2 PRO A 4 -13.263 -2.054 0.683 1.00 10.00 H new ATOM 0 HG3 PRO A 4 -13.681 -1.555 2.310 1.00 10.00 H new ATOM 0 HD2 PRO A 4 -14.737 -0.511 -0.319 1.00 10.00 H new ATOM 0 HD3 PRO A 4 -15.599 -0.763 1.186 1.00 10.00 H new ATOM 58 N TRP A 5 -12.678 3.379 0.692 1.00 10.00 N ATOM 59 CA TRP A 5 -12.036 4.702 0.619 1.00 10.00 C ATOM 60 C TRP A 5 -11.912 5.390 1.986 1.00 10.00 C ATOM 61 O TRP A 5 -11.017 6.212 2.164 1.00 10.00 O ATOM 62 CB TRP A 5 -12.736 5.614 -0.399 1.00 10.00 C ATOM 63 CG TRP A 5 -14.186 5.922 -0.166 1.00 10.00 C ATOM 64 CD1 TRP A 5 -15.204 5.391 -0.876 1.00 10.00 C ATOM 65 CD2 TRP A 5 -14.813 6.836 0.795 1.00 10.00 C ATOM 66 NE1 TRP A 5 -16.409 5.884 -0.418 1.00 10.00 N ATOM 67 CE2 TRP A 5 -16.230 6.780 0.612 1.00 10.00 C ATOM 68 CE3 TRP A 5 -14.339 7.713 1.798 1.00 10.00 C ATOM 69 CZ2 TRP A 5 -17.125 7.533 1.387 1.00 10.00 C ATOM 70 CZ3 TRP A 5 -15.231 8.466 2.590 1.00 10.00 C ATOM 71 CH2 TRP A 5 -16.619 8.377 2.389 1.00 10.00 C ATOM 0 H TRP A 5 -13.508 3.294 0.106 1.00 10.00 H new ATOM 0 HA TRP A 5 -11.019 4.522 0.272 1.00 10.00 H new ATOM 0 HB2 TRP A 5 -12.192 6.558 -0.435 1.00 10.00 H new ATOM 0 HB3 TRP A 5 -12.643 5.155 -1.383 1.00 10.00 H new ATOM 0 HD1 TRP A 5 -15.092 4.684 -1.684 1.00 10.00 H new ATOM 0 HE1 TRP A 5 -17.318 5.618 -0.795 1.00 10.00 H new ATOM 0 HE3 TRP A 5 -13.276 7.808 1.960 1.00 10.00 H new ATOM 0 HZ2 TRP A 5 -18.189 7.464 1.215 1.00 10.00 H new ATOM 0 HZ3 TRP A 5 -14.843 9.118 3.359 1.00 10.00 H new ATOM 0 HH2 TRP A 5 -17.294 8.955 3.003 1.00 10.00 H new ATOM 82 N SER A 6 -12.724 5.019 2.981 1.00 10.00 N ATOM 83 CA SER A 6 -12.578 5.465 4.377 1.00 10.00 C ATOM 84 C SER A 6 -11.207 5.149 5.006 1.00 10.00 C ATOM 85 O SER A 6 -10.783 5.846 5.931 1.00 10.00 O ATOM 86 CB SER A 6 -13.694 4.860 5.234 1.00 10.00 C ATOM 87 OG SER A 6 -13.651 3.440 5.179 1.00 10.00 O ATOM 0 H SER A 6 -13.515 4.390 2.840 1.00 10.00 H new ATOM 0 HA SER A 6 -12.652 6.552 4.353 1.00 10.00 H new ATOM 0 HB2 SER A 6 -13.589 5.193 6.267 1.00 10.00 H new ATOM 0 HB3 SER A 6 -14.663 5.214 4.882 1.00 10.00 H new ATOM 0 HG SER A 6 -14.369 3.069 5.733 1.00 10.00 H new ATOM 93 N GLY A 7 -10.475 4.156 4.481 1.00 10.00 N ATOM 94 CA GLY A 7 -9.115 3.789 4.906 1.00 10.00 C ATOM 95 C GLY A 7 -7.985 4.525 4.163 1.00 10.00 C ATOM 96 O GLY A 7 -6.814 4.342 4.502 1.00 10.00 O ATOM 0 H GLY A 7 -10.824 3.567 3.725 1.00 10.00 H new ATOM 0 HA2 GLY A 7 -9.018 3.986 5.974 1.00 10.00 H new ATOM 0 HA3 GLY A 7 -8.983 2.716 4.767 1.00 10.00 H new ATOM 100 N TYR A 8 -8.326 5.363 3.175 1.00 10.00 N ATOM 101 CA TYR A 8 -7.418 6.081 2.277 1.00 10.00 C ATOM 102 C TYR A 8 -7.841 7.544 2.027 1.00 10.00 C ATOM 103 O TYR A 8 -7.266 8.239 1.185 1.00 10.00 O ATOM 104 CB TYR A 8 -7.324 5.306 0.952 1.00 10.00 C ATOM 105 CG TYR A 8 -6.779 3.895 1.080 1.00 10.00 C ATOM 106 CD1 TYR A 8 -5.390 3.689 1.201 1.00 10.00 C ATOM 107 CD2 TYR A 8 -7.657 2.792 1.096 1.00 10.00 C ATOM 108 CE1 TYR A 8 -4.880 2.384 1.343 1.00 10.00 C ATOM 109 CE2 TYR A 8 -7.150 1.486 1.240 1.00 10.00 C ATOM 110 CZ TYR A 8 -5.758 1.278 1.365 1.00 10.00 C ATOM 111 OH TYR A 8 -5.256 0.021 1.507 1.00 10.00 O ATOM 0 H TYR A 8 -9.304 5.569 2.971 1.00 10.00 H new ATOM 0 HA TYR A 8 -6.442 6.135 2.758 1.00 10.00 H new ATOM 0 HB2 TYR A 8 -8.316 5.258 0.503 1.00 10.00 H new ATOM 0 HB3 TYR A 8 -6.690 5.865 0.264 1.00 10.00 H new ATOM 0 HD1 TYR A 8 -4.716 4.533 1.185 1.00 10.00 H new ATOM 0 HD2 TYR A 8 -8.721 2.949 0.998 1.00 10.00 H new ATOM 0 HE1 TYR A 8 -3.815 2.229 1.435 1.00 10.00 H new ATOM 0 HE2 TYR A 8 -7.825 0.643 1.255 1.00 10.00 H new ATOM 0 HH TYR A 8 -5.991 -0.627 1.504 1.00 10.00 H new ATOM 121 N LEU A 9 -8.864 8.017 2.748 1.00 10.00 N ATOM 122 CA LEU A 9 -9.549 9.286 2.512 1.00 10.00 C ATOM 123 C LEU A 9 -8.603 10.489 2.455 1.00 10.00 C ATOM 124 O LEU A 9 -8.657 11.279 1.516 1.00 10.00 O ATOM 125 CB LEU A 9 -10.634 9.457 3.596 1.00 10.00 C ATOM 126 CG LEU A 9 -11.361 10.812 3.538 1.00 10.00 C ATOM 127 CD1 LEU A 9 -12.101 11.016 2.221 1.00 10.00 C ATOM 128 CD2 LEU A 9 -12.356 10.936 4.691 1.00 10.00 C ATOM 0 H LEU A 9 -9.249 7.504 3.541 1.00 10.00 H new ATOM 0 HA LEU A 9 -10.007 9.253 1.524 1.00 10.00 H new ATOM 0 HB2 LEU A 9 -11.367 8.657 3.493 1.00 10.00 H new ATOM 0 HB3 LEU A 9 -10.175 9.343 4.578 1.00 10.00 H new ATOM 0 HG LEU A 9 -10.593 11.581 3.621 1.00 10.00 H new ATOM 0 HD11 LEU A 9 -12.598 11.986 2.229 1.00 10.00 H new ATOM 0 HD12 LEU A 9 -11.391 10.979 1.395 1.00 10.00 H new ATOM 0 HD13 LEU A 9 -12.845 10.229 2.096 1.00 10.00 H new ATOM 0 HD21 LEU A 9 -12.861 11.900 4.634 1.00 10.00 H new ATOM 0 HD22 LEU A 9 -13.093 10.136 4.623 1.00 10.00 H new ATOM 0 HD23 LEU A 9 -11.825 10.860 5.640 1.00 10.00 H new ATOM 140 N ASP A 10 -7.703 10.605 3.425 1.00 10.00 N ATOM 141 CA ASP A 10 -6.758 11.720 3.551 1.00 10.00 C ATOM 142 C ASP A 10 -5.563 11.656 2.564 1.00 10.00 C ATOM 143 O ASP A 10 -4.534 12.302 2.760 1.00 10.00 O ATOM 144 CB ASP A 10 -6.309 11.846 5.018 1.00 10.00 C ATOM 145 CG ASP A 10 -5.386 10.701 5.482 1.00 10.00 C ATOM 146 OD1 ASP A 10 -5.815 9.522 5.446 1.00 10.00 O ATOM 147 OD2 ASP A 10 -4.245 10.977 5.925 1.00 10.00 O ATOM 0 H ASP A 10 -7.604 9.911 4.166 1.00 10.00 H new ATOM 0 HA ASP A 10 -7.286 12.628 3.260 1.00 10.00 H new ATOM 0 HB2 ASP A 10 -5.790 12.796 5.150 1.00 10.00 H new ATOM 0 HB3 ASP A 10 -7.191 11.873 5.658 1.00 10.00 H new ATOM 152 N ASP A 11 -5.715 10.887 1.485 1.00 10.00 N ATOM 153 CA ASP A 11 -4.837 10.829 0.312 1.00 10.00 C ATOM 154 C ASP A 11 -5.664 10.945 -0.975 1.00 10.00 C ATOM 155 O ASP A 11 -5.355 11.744 -1.861 1.00 10.00 O ATOM 156 CB ASP A 11 -4.006 9.538 0.346 1.00 10.00 C ATOM 157 CG ASP A 11 -3.038 9.462 -0.845 1.00 10.00 C ATOM 158 OD1 ASP A 11 -1.991 10.154 -0.820 1.00 10.00 O ATOM 159 OD2 ASP A 11 -3.312 8.704 -1.805 1.00 10.00 O ATOM 0 H ASP A 11 -6.504 10.247 1.400 1.00 10.00 H new ATOM 0 HA ASP A 11 -4.145 11.671 0.331 1.00 10.00 H new ATOM 0 HB2 ASP A 11 -3.443 9.491 1.278 1.00 10.00 H new ATOM 0 HB3 ASP A 11 -4.671 8.675 0.331 1.00 10.00 H new ATOM 164 N VAL A 12 -6.771 10.207 -1.032 1.00 10.00 N ATOM 165 CA VAL A 12 -7.687 10.108 -2.167 1.00 10.00 C ATOM 166 C VAL A 12 -8.556 11.344 -2.326 1.00 10.00 C ATOM 167 O VAL A 12 -8.652 11.900 -3.418 1.00 10.00 O ATOM 168 CB VAL A 12 -8.555 8.853 -1.957 1.00 10.00 C ATOM 169 CG1 VAL A 12 -9.754 8.763 -2.905 1.00 10.00 C ATOM 170 CG2 VAL A 12 -7.667 7.614 -2.117 1.00 10.00 C ATOM 0 H VAL A 12 -7.069 9.631 -0.245 1.00 10.00 H new ATOM 0 HA VAL A 12 -7.108 10.032 -3.087 1.00 10.00 H new ATOM 0 HB VAL A 12 -8.975 8.914 -0.953 1.00 10.00 H new ATOM 0 HG11 VAL A 12 -10.316 7.853 -2.696 1.00 10.00 H new ATOM 0 HG12 VAL A 12 -10.399 9.629 -2.759 1.00 10.00 H new ATOM 0 HG13 VAL A 12 -9.402 8.743 -3.936 1.00 10.00 H new ATOM 0 HG21 VAL A 12 -8.266 6.715 -1.971 1.00 10.00 H new ATOM 0 HG22 VAL A 12 -7.234 7.603 -3.117 1.00 10.00 H new ATOM 0 HG23 VAL A 12 -6.868 7.641 -1.376 1.00 10.00 H new ATOM 180 N SER A 13 -9.177 11.788 -1.237 1.00 10.00 N ATOM 181 CA SER A 13 -9.853 13.072 -1.185 1.00 10.00 C ATOM 182 C SER A 13 -8.823 14.170 -1.124 1.00 10.00 C ATOM 183 O SER A 13 -8.901 15.084 -1.929 1.00 10.00 O ATOM 184 CB SER A 13 -10.793 13.158 0.012 1.00 10.00 C ATOM 185 OG SER A 13 -11.537 14.369 -0.007 1.00 10.00 O ATOM 0 H SER A 13 -9.223 11.262 -0.364 1.00 10.00 H new ATOM 0 HA SER A 13 -10.459 13.185 -2.084 1.00 10.00 H new ATOM 0 HB2 SER A 13 -11.476 12.308 0.004 1.00 10.00 H new ATOM 0 HB3 SER A 13 -10.217 13.096 0.935 1.00 10.00 H new ATOM 0 HG SER A 13 -11.474 14.806 0.868 1.00 10.00 H new ATOM 191 N ALA A 14 -7.823 14.059 -0.241 1.00 10.00 N ATOM 192 CA ALA A 14 -6.895 15.153 0.053 1.00 10.00 C ATOM 193 C ALA A 14 -6.169 15.738 -1.182 1.00 10.00 C ATOM 194 O ALA A 14 -5.759 16.899 -1.161 1.00 10.00 O ATOM 195 CB ALA A 14 -5.898 14.726 1.125 1.00 10.00 C ATOM 0 H ALA A 14 -7.636 13.208 0.289 1.00 10.00 H new ATOM 0 HA ALA A 14 -7.512 15.971 0.426 1.00 10.00 H new ATOM 0 HB1 ALA A 14 -5.214 15.549 1.334 1.00 10.00 H new ATOM 0 HB2 ALA A 14 -6.435 14.460 2.036 1.00 10.00 H new ATOM 0 HB3 ALA A 14 -5.332 13.864 0.773 1.00 10.00 H new ATOM 201 N LYS A 15 -6.073 14.977 -2.283 1.00 10.00 N ATOM 202 CA LYS A 15 -5.625 15.435 -3.608 1.00 10.00 C ATOM 203 C LYS A 15 -6.348 16.715 -4.100 1.00 10.00 C ATOM 204 O LYS A 15 -5.790 17.502 -4.863 1.00 10.00 O ATOM 205 CB LYS A 15 -5.738 14.249 -4.595 1.00 10.00 C ATOM 206 CG LYS A 15 -7.080 14.142 -5.339 1.00 10.00 C ATOM 207 CD LYS A 15 -7.164 12.853 -6.171 1.00 10.00 C ATOM 208 CE LYS A 15 -6.170 12.846 -7.342 1.00 10.00 C ATOM 209 NZ LYS A 15 -6.273 11.594 -8.139 1.00 10.00 N ATOM 0 H LYS A 15 -6.315 13.986 -2.275 1.00 10.00 H new ATOM 0 HA LYS A 15 -4.583 15.746 -3.540 1.00 10.00 H new ATOM 0 HB2 LYS A 15 -4.938 14.332 -5.331 1.00 10.00 H new ATOM 0 HB3 LYS A 15 -5.570 13.323 -4.046 1.00 10.00 H new ATOM 0 HG2 LYS A 15 -7.898 14.165 -4.620 1.00 10.00 H new ATOM 0 HG3 LYS A 15 -7.205 15.006 -5.992 1.00 10.00 H new ATOM 0 HD2 LYS A 15 -6.969 11.995 -5.527 1.00 10.00 H new ATOM 0 HD3 LYS A 15 -8.177 12.738 -6.557 1.00 10.00 H new ATOM 0 HE2 LYS A 15 -6.359 13.705 -7.986 1.00 10.00 H new ATOM 0 HE3 LYS A 15 -5.155 12.952 -6.959 1.00 10.00 H new ATOM 0 HZ1 LYS A 15 -5.588 11.623 -8.921 1.00 10.00 H new ATOM 0 HZ2 LYS A 15 -6.068 10.777 -7.529 1.00 10.00 H new ATOM 0 HZ3 LYS A 15 -7.235 11.506 -8.524 1.00 10.00 H new ATOM 223 N PHE A 16 -7.584 16.913 -3.634 1.00 10.00 N ATOM 224 CA PHE A 16 -8.526 17.998 -3.926 1.00 10.00 C ATOM 225 C PHE A 16 -8.181 19.383 -3.359 1.00 10.00 C ATOM 226 O PHE A 16 -8.670 20.399 -3.848 1.00 10.00 O ATOM 227 CB PHE A 16 -9.912 17.579 -3.374 1.00 10.00 C ATOM 228 CG PHE A 16 -10.271 17.766 -1.890 1.00 10.00 C ATOM 229 CD1 PHE A 16 -9.321 17.709 -0.847 1.00 10.00 C ATOM 230 CD2 PHE A 16 -11.625 17.930 -1.538 1.00 10.00 C ATOM 231 CE1 PHE A 16 -9.698 17.855 0.499 1.00 10.00 C ATOM 232 CE2 PHE A 16 -12.008 18.069 -0.190 1.00 10.00 C ATOM 233 CZ PHE A 16 -11.046 18.041 0.830 1.00 10.00 C ATOM 0 H PHE A 16 -7.992 16.249 -2.975 1.00 10.00 H new ATOM 0 HA PHE A 16 -8.494 18.125 -5.008 1.00 10.00 H new ATOM 0 HB2 PHE A 16 -10.661 18.119 -3.953 1.00 10.00 H new ATOM 0 HB3 PHE A 16 -10.037 16.520 -3.600 1.00 10.00 H new ATOM 0 HD1 PHE A 16 -8.281 17.550 -1.089 1.00 10.00 H new ATOM 0 HD2 PHE A 16 -12.379 17.949 -2.311 1.00 10.00 H new ATOM 0 HE1 PHE A 16 -8.949 17.824 1.277 1.00 10.00 H new ATOM 0 HE2 PHE A 16 -13.051 18.198 0.060 1.00 10.00 H new ATOM 0 HZ PHE A 16 -11.342 18.162 1.862 1.00 10.00 H new ATOM 243 N ASP A 17 -7.317 19.414 -2.347 1.00 10.00 N ATOM 244 CA ASP A 17 -7.017 20.546 -1.459 1.00 10.00 C ATOM 245 C ASP A 17 -6.835 21.958 -2.053 1.00 10.00 C ATOM 246 O ASP A 17 -7.169 22.928 -1.375 1.00 10.00 O ATOM 247 CB ASP A 17 -5.844 20.146 -0.550 1.00 10.00 C ATOM 248 CG ASP A 17 -5.531 21.191 0.536 1.00 10.00 C ATOM 249 OD1 ASP A 17 -6.281 21.265 1.539 1.00 10.00 O ATOM 250 OD2 ASP A 17 -4.509 21.908 0.410 1.00 10.00 O ATOM 0 H ASP A 17 -6.766 18.591 -2.104 1.00 10.00 H new ATOM 0 HA ASP A 17 -7.947 20.704 -0.913 1.00 10.00 H new ATOM 0 HB2 ASP A 17 -6.072 19.193 -0.072 1.00 10.00 H new ATOM 0 HB3 ASP A 17 -4.956 19.991 -1.162 1.00 10.00 H new ATOM 255 N THR A 18 -6.378 22.110 -3.299 1.00 10.00 N ATOM 256 CA THR A 18 -6.190 23.421 -3.944 1.00 10.00 C ATOM 257 C THR A 18 -7.308 23.813 -4.928 1.00 10.00 C ATOM 258 O THR A 18 -7.507 25.003 -5.178 1.00 10.00 O ATOM 259 CB THR A 18 -4.799 23.520 -4.589 1.00 10.00 C ATOM 260 OG1 THR A 18 -4.412 24.867 -4.772 1.00 10.00 O ATOM 261 CG2 THR A 18 -4.735 22.816 -5.939 1.00 10.00 C ATOM 0 H THR A 18 -6.125 21.323 -3.897 1.00 10.00 H new ATOM 0 HA THR A 18 -6.257 24.157 -3.143 1.00 10.00 H new ATOM 0 HB THR A 18 -4.116 23.025 -3.899 1.00 10.00 H new ATOM 0 HG1 THR A 18 -3.523 24.899 -5.183 1.00 10.00 H new ATOM 0 HG21 THR A 18 -3.732 22.915 -6.354 1.00 10.00 H new ATOM 0 HG22 THR A 18 -4.972 21.760 -5.810 1.00 10.00 H new ATOM 0 HG23 THR A 18 -5.455 23.269 -6.620 1.00 10.00 H new ATOM 269 N GLY A 19 -8.070 22.849 -5.462 1.00 10.00 N ATOM 270 CA GLY A 19 -9.253 23.117 -6.296 1.00 10.00 C ATOM 271 C GLY A 19 -10.509 23.233 -5.442 1.00 10.00 C ATOM 272 O GLY A 19 -11.312 24.142 -5.651 1.00 10.00 O ATOM 0 H GLY A 19 -7.883 21.855 -5.328 1.00 10.00 H new ATOM 0 HA2 GLY A 19 -9.105 24.039 -6.858 1.00 10.00 H new ATOM 0 HA3 GLY A 19 -9.377 22.316 -7.025 1.00 10.00 H new ATOM 276 N VAL A 20 -10.629 22.383 -4.416 1.00 10.00 N ATOM 277 CA VAL A 20 -11.645 22.506 -3.370 1.00 10.00 C ATOM 278 C VAL A 20 -11.584 23.866 -2.734 1.00 10.00 C ATOM 279 O VAL A 20 -12.620 24.445 -2.454 1.00 10.00 O ATOM 280 CB VAL A 20 -11.505 21.414 -2.288 1.00 10.00 C ATOM 281 CG1 VAL A 20 -10.667 21.759 -1.050 1.00 10.00 C ATOM 282 CG2 VAL A 20 -12.911 21.033 -1.813 1.00 10.00 C ATOM 0 H VAL A 20 -10.013 21.580 -4.289 1.00 10.00 H new ATOM 0 HA VAL A 20 -12.614 22.373 -3.851 1.00 10.00 H new ATOM 0 HB VAL A 20 -10.960 20.608 -2.779 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -10.651 20.906 -0.372 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -9.648 21.999 -1.355 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -11.105 22.618 -0.542 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -12.839 20.261 -1.047 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -13.405 21.911 -1.398 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -13.490 20.655 -2.656 1.00 10.00 H new ATOM 292 N ASP A 21 -10.380 24.398 -2.560 1.00 10.00 N ATOM 293 CA ASP A 21 -10.147 25.685 -1.946 1.00 10.00 C ATOM 294 C ASP A 21 -10.664 26.863 -2.771 1.00 10.00 C ATOM 295 O ASP A 21 -11.012 27.879 -2.184 1.00 10.00 O ATOM 296 CB ASP A 21 -8.679 25.771 -1.553 1.00 10.00 C ATOM 297 CG ASP A 21 -8.218 27.182 -1.147 1.00 10.00 C ATOM 298 OD1 ASP A 21 -8.443 27.576 0.022 1.00 10.00 O ATOM 299 OD2 ASP A 21 -7.598 27.882 -1.983 1.00 10.00 O ATOM 0 H ASP A 21 -9.522 23.929 -2.852 1.00 10.00 H new ATOM 0 HA ASP A 21 -10.744 25.767 -1.038 1.00 10.00 H new ATOM 0 HB2 ASP A 21 -8.496 25.088 -0.724 1.00 10.00 H new ATOM 0 HB3 ASP A 21 -8.070 25.428 -2.389 1.00 10.00 H new ATOM 304 N ASN A 22 -10.839 26.732 -4.088 1.00 10.00 N ATOM 305 CA ASN A 22 -11.543 27.738 -4.875 1.00 10.00 C ATOM 306 C ASN A 22 -13.048 27.754 -4.579 1.00 10.00 C ATOM 307 O ASN A 22 -13.719 28.772 -4.772 1.00 10.00 O ATOM 308 CB ASN A 22 -11.384 27.433 -6.368 1.00 10.00 C ATOM 309 CG ASN A 22 -9.961 27.574 -6.884 1.00 10.00 C ATOM 310 OD1 ASN A 22 -9.215 28.473 -6.517 1.00 10.00 O ATOM 311 ND2 ASN A 22 -9.541 26.698 -7.770 1.00 10.00 N ATOM 0 H ASN A 22 -10.501 25.936 -4.629 1.00 10.00 H new ATOM 0 HA ASN A 22 -11.110 28.702 -4.609 1.00 10.00 H new ATOM 0 HB2 ASN A 22 -11.729 26.417 -6.559 1.00 10.00 H new ATOM 0 HB3 ASN A 22 -12.032 28.101 -6.935 1.00 10.00 H new ATOM 0 HD21 ASN A 22 -8.597 26.769 -8.149 1.00 10.00 H new ATOM 0 HD22 ASN A 22 -10.159 25.948 -8.078 1.00 10.00 H new ATOM 318 N LEU A 23 -13.591 26.614 -4.155 1.00 10.00 N ATOM 319 CA LEU A 23 -14.932 26.509 -3.629 1.00 10.00 C ATOM 320 C LEU A 23 -15.010 26.905 -2.149 1.00 10.00 C ATOM 321 O LEU A 23 -15.863 27.698 -1.772 1.00 10.00 O ATOM 322 CB LEU A 23 -15.534 25.145 -3.990 1.00 10.00 C ATOM 323 CG LEU A 23 -16.896 25.332 -4.692 1.00 10.00 C ATOM 324 CD1 LEU A 23 -17.859 26.106 -3.811 1.00 10.00 C ATOM 325 CD2 LEU A 23 -17.026 26.005 -6.056 1.00 10.00 C ATOM 0 H LEU A 23 -13.092 25.724 -4.172 1.00 10.00 H new ATOM 0 HA LEU A 23 -15.573 27.247 -4.112 1.00 10.00 H new ATOM 0 HB2 LEU A 23 -14.852 24.600 -4.643 1.00 10.00 H new ATOM 0 HB3 LEU A 23 -15.661 24.545 -3.089 1.00 10.00 H new ATOM 0 HG LEU A 23 -17.103 24.277 -4.872 1.00 10.00 H new ATOM 0 HD11 LEU A 23 -18.811 26.224 -4.329 1.00 10.00 H new ATOM 0 HD12 LEU A 23 -18.017 25.562 -2.880 1.00 10.00 H new ATOM 0 HD13 LEU A 23 -17.441 27.088 -3.591 1.00 10.00 H new ATOM 0 HD21 LEU A 23 -18.075 26.026 -6.353 1.00 10.00 H new ATOM 0 HD22 LEU A 23 -16.645 27.025 -5.996 1.00 10.00 H new ATOM 0 HD23 LEU A 23 -16.451 25.446 -6.794 1.00 10.00 H new ATOM 337 N GLN A 24 -14.064 26.446 -1.331 1.00 10.00 N ATOM 338 CA GLN A 24 -13.907 26.767 0.083 1.00 10.00 C ATOM 339 C GLN A 24 -13.759 28.267 0.309 1.00 10.00 C ATOM 340 O GLN A 24 -14.427 28.805 1.176 1.00 10.00 O ATOM 341 CB GLN A 24 -12.663 26.068 0.643 1.00 10.00 C ATOM 342 CG GLN A 24 -12.658 25.906 2.157 1.00 10.00 C ATOM 343 CD GLN A 24 -13.651 24.859 2.659 1.00 10.00 C ATOM 344 OE1 GLN A 24 -13.583 23.683 2.328 1.00 10.00 O ATOM 345 NE2 GLN A 24 -14.608 25.239 3.480 1.00 10.00 N ATOM 0 H GLN A 24 -13.345 25.802 -1.659 1.00 10.00 H new ATOM 0 HA GLN A 24 -14.805 26.421 0.594 1.00 10.00 H new ATOM 0 HB2 GLN A 24 -12.578 25.083 0.185 1.00 10.00 H new ATOM 0 HB3 GLN A 24 -11.780 26.634 0.348 1.00 10.00 H new ATOM 0 HG2 GLN A 24 -11.655 25.630 2.482 1.00 10.00 H new ATOM 0 HG3 GLN A 24 -12.889 26.866 2.618 1.00 10.00 H new ATOM 0 HE21 GLN A 24 -14.677 26.216 3.765 1.00 10.00 H new ATOM 0 HE22 GLN A 24 -15.280 24.556 3.831 1.00 10.00 H new ATOM 354 N THR A 25 -12.917 28.954 -0.466 1.00 10.00 N ATOM 355 CA THR A 25 -12.733 30.405 -0.407 1.00 10.00 C ATOM 356 C THR A 25 -14.067 31.103 -0.624 1.00 10.00 C ATOM 357 O THR A 25 -14.503 31.912 0.185 1.00 10.00 O ATOM 358 CB THR A 25 -11.631 30.854 -1.384 1.00 10.00 C ATOM 359 OG1 THR A 25 -11.184 32.148 -1.045 1.00 10.00 O ATOM 360 CG2 THR A 25 -11.986 30.839 -2.867 1.00 10.00 C ATOM 0 H THR A 25 -12.330 28.505 -1.169 1.00 10.00 H new ATOM 0 HA THR A 25 -12.385 30.697 0.584 1.00 10.00 H new ATOM 0 HB THR A 25 -10.855 30.098 -1.264 1.00 10.00 H new ATOM 0 HG1 THR A 25 -10.482 32.426 -1.670 1.00 10.00 H new ATOM 0 HG21 THR A 25 -11.129 31.176 -3.450 1.00 10.00 H new ATOM 0 HG22 THR A 25 -12.253 29.826 -3.167 1.00 10.00 H new ATOM 0 HG23 THR A 25 -12.830 31.505 -3.046 1.00 10.00 H new ATOM 368 N GLN A 26 -14.803 30.644 -1.631 1.00 10.00 N ATOM 369 CA GLN A 26 -16.164 31.062 -1.935 1.00 10.00 C ATOM 370 C GLN A 26 -17.170 30.828 -0.798 1.00 10.00 C ATOM 371 O GLN A 26 -17.863 31.768 -0.403 1.00 10.00 O ATOM 372 CB GLN A 26 -16.599 30.366 -3.238 1.00 10.00 C ATOM 373 CG GLN A 26 -16.725 31.361 -4.395 1.00 10.00 C ATOM 374 CD GLN A 26 -16.981 30.662 -5.727 1.00 10.00 C ATOM 375 OE1 GLN A 26 -18.044 30.791 -6.321 1.00 10.00 O ATOM 376 NE2 GLN A 26 -16.054 29.876 -6.232 1.00 10.00 N ATOM 0 H GLN A 26 -14.452 29.942 -2.283 1.00 10.00 H new ATOM 0 HA GLN A 26 -16.161 32.145 -2.060 1.00 10.00 H new ATOM 0 HB2 GLN A 26 -15.874 29.595 -3.498 1.00 10.00 H new ATOM 0 HB3 GLN A 26 -17.555 29.866 -3.082 1.00 10.00 H new ATOM 0 HG2 GLN A 26 -17.539 32.056 -4.188 1.00 10.00 H new ATOM 0 HG3 GLN A 26 -15.812 31.952 -4.466 1.00 10.00 H new ATOM 0 HE21 GLN A 26 -15.164 29.760 -5.747 1.00 10.00 H new ATOM 0 HE22 GLN A 26 -16.225 29.383 -7.108 1.00 10.00 H new ATOM 385 N VAL A 27 -17.258 29.616 -0.235 1.00 10.00 N ATOM 386 CA VAL A 27 -18.156 29.343 0.893 1.00 10.00 C ATOM 387 C VAL A 27 -17.747 30.139 2.121 1.00 10.00 C ATOM 388 O VAL A 27 -18.583 30.643 2.857 1.00 10.00 O ATOM 389 CB VAL A 27 -18.300 27.859 1.289 1.00 10.00 C ATOM 390 CG1 VAL A 27 -18.241 26.899 0.101 1.00 10.00 C ATOM 391 CG2 VAL A 27 -17.351 27.293 2.349 1.00 10.00 C ATOM 0 H VAL A 27 -16.717 28.808 -0.543 1.00 10.00 H new ATOM 0 HA VAL A 27 -19.133 29.656 0.526 1.00 10.00 H new ATOM 0 HB VAL A 27 -19.291 27.906 1.740 1.00 10.00 H new ATOM 0 HG11 VAL A 27 -18.349 25.874 0.456 1.00 10.00 H new ATOM 0 HG12 VAL A 27 -19.049 27.130 -0.594 1.00 10.00 H new ATOM 0 HG13 VAL A 27 -17.283 27.008 -0.408 1.00 10.00 H new ATOM 0 HG21 VAL A 27 -17.579 26.240 2.516 1.00 10.00 H new ATOM 0 HG22 VAL A 27 -16.321 27.391 2.005 1.00 10.00 H new ATOM 0 HG23 VAL A 27 -17.477 27.844 3.281 1.00 10.00 H new ATOM 401 N THR A 28 -16.445 30.282 2.335 1.00 10.00 N ATOM 402 CA THR A 28 -15.896 31.044 3.439 1.00 10.00 C ATOM 403 C THR A 28 -16.162 32.522 3.273 1.00 10.00 C ATOM 404 O THR A 28 -16.245 33.236 4.258 1.00 10.00 O ATOM 405 CB THR A 28 -14.392 30.886 3.585 1.00 10.00 C ATOM 406 OG1 THR A 28 -14.010 29.530 3.681 1.00 10.00 O ATOM 407 CG2 THR A 28 -13.923 31.557 4.860 1.00 10.00 C ATOM 0 H THR A 28 -15.734 29.864 1.735 1.00 10.00 H new ATOM 0 HA THR A 28 -16.393 30.646 4.324 1.00 10.00 H new ATOM 0 HB THR A 28 -13.945 31.337 2.699 1.00 10.00 H new ATOM 0 HG1 THR A 28 -13.833 29.176 2.785 1.00 10.00 H new ATOM 0 HG21 THR A 28 -12.844 31.439 4.957 1.00 10.00 H new ATOM 0 HG22 THR A 28 -14.171 32.618 4.825 1.00 10.00 H new ATOM 0 HG23 THR A 28 -14.417 31.097 5.716 1.00 10.00 H new ATOM 415 N GLU A 29 -16.306 33.025 2.056 1.00 10.00 N ATOM 416 CA GLU A 29 -16.680 34.404 1.860 1.00 10.00 C ATOM 417 C GLU A 29 -18.198 34.607 2.048 1.00 10.00 C ATOM 418 O GLU A 29 -18.623 35.666 2.498 1.00 10.00 O ATOM 419 CB GLU A 29 -16.140 34.935 0.551 1.00 10.00 C ATOM 420 CG GLU A 29 -14.622 35.142 0.629 1.00 10.00 C ATOM 421 CD GLU A 29 -14.078 35.839 -0.634 1.00 10.00 C ATOM 422 OE1 GLU A 29 -14.128 35.247 -1.740 1.00 10.00 O ATOM 423 OE2 GLU A 29 -13.601 36.996 -0.531 1.00 10.00 O ATOM 0 H GLU A 29 -16.168 32.495 1.196 1.00 10.00 H new ATOM 0 HA GLU A 29 -16.211 35.009 2.636 1.00 10.00 H new ATOM 0 HB2 GLU A 29 -16.375 34.238 -0.253 1.00 10.00 H new ATOM 0 HB3 GLU A 29 -16.628 35.879 0.308 1.00 10.00 H new ATOM 0 HG2 GLU A 29 -14.381 35.740 1.508 1.00 10.00 H new ATOM 0 HG3 GLU A 29 -14.129 34.178 0.754 1.00 10.00 H new ATOM 430 N ALA A 30 -19.034 33.597 1.771 1.00 10.00 N ATOM 431 CA ALA A 30 -20.444 33.606 2.165 1.00 10.00 C ATOM 432 C ALA A 30 -20.539 33.609 3.697 1.00 10.00 C ATOM 433 O ALA A 30 -21.327 34.332 4.303 1.00 10.00 O ATOM 434 CB ALA A 30 -21.148 32.368 1.601 1.00 10.00 C ATOM 0 H ALA A 30 -18.751 32.755 1.269 1.00 10.00 H new ATOM 0 HA ALA A 30 -20.929 34.498 1.769 1.00 10.00 H new ATOM 0 HB1 ALA A 30 -22.197 32.379 1.897 1.00 10.00 H new ATOM 0 HB2 ALA A 30 -21.078 32.373 0.513 1.00 10.00 H new ATOM 0 HB3 ALA A 30 -20.671 31.469 1.991 1.00 10.00 H new ATOM 440 N LEU A 31 -19.659 32.837 4.325 1.00 10.00 N ATOM 441 CA LEU A 31 -19.414 32.831 5.746 1.00 10.00 C ATOM 442 C LEU A 31 -18.762 34.124 6.253 1.00 10.00 C ATOM 443 O LEU A 31 -19.026 34.508 7.375 1.00 10.00 O ATOM 444 CB LEU A 31 -18.528 31.634 6.052 1.00 10.00 C ATOM 445 CG LEU A 31 -18.360 31.394 7.548 1.00 10.00 C ATOM 446 CD1 LEU A 31 -19.552 30.621 8.089 1.00 10.00 C ATOM 447 CD2 LEU A 31 -17.048 30.657 7.731 1.00 10.00 C ATOM 0 H LEU A 31 -19.073 32.169 3.824 1.00 10.00 H new ATOM 0 HA LEU A 31 -20.371 32.763 6.264 1.00 10.00 H new ATOM 0 HB2 LEU A 31 -18.955 30.744 5.591 1.00 10.00 H new ATOM 0 HB3 LEU A 31 -17.548 31.788 5.600 1.00 10.00 H new ATOM 0 HG LEU A 31 -18.328 32.327 8.111 1.00 10.00 H new ATOM 0 HD11 LEU A 31 -19.423 30.454 9.158 1.00 10.00 H new ATOM 0 HD12 LEU A 31 -20.464 31.193 7.918 1.00 10.00 H new ATOM 0 HD13 LEU A 31 -19.625 29.661 7.579 1.00 10.00 H new ATOM 0 HD21 LEU A 31 -16.885 30.463 8.791 1.00 10.00 H new ATOM 0 HD22 LEU A 31 -17.083 29.711 7.190 1.00 10.00 H new ATOM 0 HD23 LEU A 31 -16.231 31.266 7.344 1.00 10.00 H new ATOM 459 N ASP A 32 -17.958 34.846 5.476 1.00 10.00 N ATOM 460 CA ASP A 32 -17.449 36.166 5.848 1.00 10.00 C ATOM 461 C ASP A 32 -18.633 37.115 6.091 1.00 10.00 C ATOM 462 O ASP A 32 -18.596 37.946 7.000 1.00 10.00 O ATOM 463 CB ASP A 32 -16.439 36.677 4.805 1.00 10.00 C ATOM 464 CG ASP A 32 -16.001 38.124 5.080 1.00 10.00 C ATOM 465 OD1 ASP A 32 -15.167 38.342 5.993 1.00 10.00 O ATOM 466 OD2 ASP A 32 -16.471 39.042 4.366 1.00 10.00 O ATOM 0 H ASP A 32 -17.638 34.529 4.561 1.00 10.00 H new ATOM 0 HA ASP A 32 -16.891 36.109 6.782 1.00 10.00 H new ATOM 0 HB2 ASP A 32 -15.563 36.029 4.802 1.00 10.00 H new ATOM 0 HB3 ASP A 32 -16.883 36.616 3.812 1.00 10.00 H new ATOM 471 N LYS A 33 -19.737 36.902 5.358 1.00 10.00 N ATOM 472 CA LYS A 33 -21.018 37.538 5.591 1.00 10.00 C ATOM 473 C LYS A 33 -21.722 36.937 6.813 1.00 10.00 C ATOM 474 O LYS A 33 -22.287 37.656 7.632 1.00 10.00 O ATOM 475 CB LYS A 33 -21.918 37.498 4.355 1.00 10.00 C ATOM 476 CG LYS A 33 -21.326 37.526 2.943 1.00 10.00 C ATOM 477 CD LYS A 33 -20.121 38.443 2.716 1.00 10.00 C ATOM 478 CE LYS A 33 -19.801 38.503 1.224 1.00 10.00 C ATOM 479 NZ LYS A 33 -18.630 39.380 0.961 1.00 10.00 N ATOM 0 H LYS A 33 -19.750 36.260 4.565 1.00 10.00 H new ATOM 0 HA LYS A 33 -20.817 38.588 5.802 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -22.521 36.593 4.430 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -22.601 38.344 4.431 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -21.034 36.510 2.677 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -22.114 37.823 2.251 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -20.335 39.443 3.093 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -19.258 38.072 3.269 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -19.598 37.499 0.852 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -20.668 38.875 0.678 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -18.435 39.402 -0.060 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -18.836 40.343 1.295 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -17.799 39.009 1.464 1.00 10.00 H new ATOM 493 N LEU A 34 -21.729 35.608 6.940 1.00 10.00 N ATOM 494 CA LEU A 34 -22.453 34.895 8.002 1.00 10.00 C ATOM 495 C LEU A 34 -21.775 35.068 9.372 1.00 10.00 C ATOM 496 O LEU A 34 -22.365 34.867 10.419 1.00 10.00 O ATOM 497 CB LEU A 34 -22.673 33.437 7.590 1.00 10.00 C ATOM 498 CG LEU A 34 -24.098 32.904 7.840 1.00 10.00 C ATOM 499 CD1 LEU A 34 -24.270 31.623 7.087 1.00 10.00 C ATOM 500 CD2 LEU A 34 -24.552 32.515 9.229 1.00 10.00 C ATOM 0 H LEU A 34 -21.228 34.988 6.304 1.00 10.00 H new ATOM 0 HA LEU A 34 -23.441 35.339 8.128 1.00 10.00 H new ATOM 0 HB2 LEU A 34 -22.443 33.335 6.530 1.00 10.00 H new ATOM 0 HB3 LEU A 34 -21.965 32.810 8.132 1.00 10.00 H new ATOM 0 HG LEU A 34 -24.679 33.780 7.551 1.00 10.00 H new ATOM 0 HD11 LEU A 34 -25.274 31.234 7.255 1.00 10.00 H new ATOM 0 HD12 LEU A 34 -24.124 31.805 6.022 1.00 10.00 H new ATOM 0 HD13 LEU A 34 -23.537 30.895 7.435 1.00 10.00 H new ATOM 0 HD21 LEU A 34 -25.584 32.166 9.190 1.00 10.00 H new ATOM 0 HD22 LEU A 34 -23.914 31.718 9.611 1.00 10.00 H new ATOM 0 HD23 LEU A 34 -24.486 33.380 9.889 1.00 10.00 H new ATOM 512 N ALA A 35 -20.507 35.440 9.379 1.00 10.00 N ATOM 513 CA ALA A 35 -19.757 35.869 10.537 1.00 10.00 C ATOM 514 C ALA A 35 -20.041 37.377 10.844 1.00 10.00 C ATOM 515 O ALA A 35 -19.873 37.818 11.983 1.00 10.00 O ATOM 516 CB ALA A 35 -18.292 35.493 10.259 1.00 10.00 C ATOM 0 H ALA A 35 -19.946 35.450 8.527 1.00 10.00 H new ATOM 0 HA ALA A 35 -20.053 35.373 11.461 1.00 10.00 H new ATOM 0 HB1 ALA A 35 -17.673 35.794 11.104 1.00 10.00 H new ATOM 0 HB2 ALA A 35 -18.214 34.415 10.117 1.00 10.00 H new ATOM 0 HB3 ALA A 35 -17.950 36.003 9.358 1.00 10.00 H new ATOM 522 N ALA A 36 -20.492 38.164 9.843 1.00 10.00 N ATOM 523 CA ALA A 36 -20.876 39.590 9.915 1.00 10.00 C ATOM 524 C ALA A 36 -22.298 39.888 10.461 1.00 10.00 C ATOM 525 O ALA A 36 -22.451 40.683 11.393 1.00 10.00 O ATOM 526 CB ALA A 36 -20.678 40.239 8.527 1.00 10.00 C ATOM 0 H ALA A 36 -20.605 37.794 8.899 1.00 10.00 H new ATOM 0 HA ALA A 36 -20.214 40.031 10.660 1.00 10.00 H new ATOM 0 HB1 ALA A 36 -20.960 41.291 8.574 1.00 10.00 H new ATOM 0 HB2 ALA A 36 -19.632 40.156 8.233 1.00 10.00 H new ATOM 0 HB3 ALA A 36 -21.303 39.728 7.794 1.00 10.00 H new ATOM 532 N LYS A 37 -23.334 39.258 9.887 1.00 10.00 N ATOM 533 CA LYS A 37 -24.783 39.445 10.185 1.00 10.00 C ATOM 534 C LYS A 37 -25.508 38.078 10.171 1.00 10.00 C ATOM 535 O LYS A 37 -26.563 37.925 9.556 1.00 10.00 O ATOM 536 CB LYS A 37 -25.344 40.330 9.069 1.00 10.00 C ATOM 537 CG LYS A 37 -26.663 41.037 9.372 1.00 10.00 C ATOM 538 CD LYS A 37 -27.210 41.584 8.049 1.00 10.00 C ATOM 539 CE LYS A 37 -28.534 42.291 8.324 1.00 10.00 C ATOM 540 NZ LYS A 37 -29.268 42.602 7.072 1.00 10.00 N ATOM 0 H LYS A 37 -23.186 38.561 9.158 1.00 10.00 H new ATOM 0 HA LYS A 37 -24.926 39.896 11.167 1.00 10.00 H new ATOM 0 HB2 LYS A 37 -24.598 41.086 8.823 1.00 10.00 H new ATOM 0 HB3 LYS A 37 -25.481 39.715 8.179 1.00 10.00 H new ATOM 0 HG2 LYS A 37 -27.374 40.345 9.823 1.00 10.00 H new ATOM 0 HG3 LYS A 37 -26.509 41.846 10.086 1.00 10.00 H new ATOM 0 HD2 LYS A 37 -26.497 42.277 7.603 1.00 10.00 H new ATOM 0 HD3 LYS A 37 -27.355 40.773 7.336 1.00 10.00 H new ATOM 0 HE2 LYS A 37 -29.155 41.662 8.962 1.00 10.00 H new ATOM 0 HE3 LYS A 37 -28.345 43.214 8.873 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 -30.184 43.036 7.305 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 -28.708 43.263 6.497 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 -29.427 41.725 6.536 1.00 10.00 H new ATOM 554 N PRO A 38 -24.961 37.070 10.855 1.00 10.00 N ATOM 555 CA PRO A 38 -25.314 35.672 10.728 1.00 10.00 C ATOM 556 C PRO A 38 -26.588 35.177 10.059 1.00 10.00 C ATOM 557 O PRO A 38 -26.569 34.897 8.864 1.00 10.00 O ATOM 558 CB PRO A 38 -24.895 34.950 12.002 1.00 10.00 C ATOM 559 CG PRO A 38 -24.081 35.976 12.798 1.00 10.00 C ATOM 560 CD PRO A 38 -23.975 37.217 11.909 1.00 10.00 C ATOM 0 HA PRO A 38 -24.739 35.371 9.852 1.00 10.00 H new ATOM 0 HB2 PRO A 38 -25.764 34.613 12.567 1.00 10.00 H new ATOM 0 HB3 PRO A 38 -24.300 34.066 11.775 1.00 10.00 H new ATOM 0 HG2 PRO A 38 -24.571 36.214 13.742 1.00 10.00 H new ATOM 0 HG3 PRO A 38 -23.093 35.585 13.041 1.00 10.00 H new ATOM 0 HD2 PRO A 38 -24.161 38.122 12.487 1.00 10.00 H new ATOM 0 HD3 PRO A 38 -22.973 37.306 11.490 1.00 10.00 H new ATOM 568 N SER A 39 -27.682 34.999 10.787 1.00 10.00 N ATOM 569 CA SER A 39 -28.852 34.323 10.254 1.00 10.00 C ATOM 570 C SER A 39 -29.679 35.178 9.286 1.00 10.00 C ATOM 571 O SER A 39 -30.789 34.776 8.936 1.00 10.00 O ATOM 572 CB SER A 39 -29.644 33.644 11.363 1.00 10.00 C ATOM 573 OG SER A 39 -30.141 34.584 12.305 1.00 10.00 O ATOM 0 H SER A 39 -27.782 35.315 11.752 1.00 10.00 H new ATOM 0 HA SER A 39 -28.498 33.520 9.608 1.00 10.00 H new ATOM 0 HB2 SER A 39 -30.476 33.089 10.929 1.00 10.00 H new ATOM 0 HB3 SER A 39 -29.009 32.919 11.872 1.00 10.00 H new ATOM 0 HG SER A 39 -30.645 34.114 13.001 1.00 10.00 H new ATOM 579 N ASP A 40 -29.156 36.345 8.863 1.00 10.00 N ATOM 580 CA ASP A 40 -29.677 37.149 7.749 1.00 10.00 C ATOM 581 C ASP A 40 -29.869 36.168 6.585 1.00 10.00 C ATOM 582 O ASP A 40 -28.890 35.692 6.017 1.00 10.00 O ATOM 583 CB ASP A 40 -28.741 38.312 7.388 1.00 10.00 C ATOM 584 CG ASP A 40 -29.209 39.022 6.106 1.00 10.00 C ATOM 585 OD1 ASP A 40 -28.871 38.571 4.988 1.00 10.00 O ATOM 586 OD2 ASP A 40 -29.929 40.042 6.226 1.00 10.00 O ATOM 0 H ASP A 40 -28.336 36.763 9.302 1.00 10.00 H new ATOM 0 HA ASP A 40 -30.618 37.631 8.013 1.00 10.00 H new ATOM 0 HB2 ASP A 40 -28.708 39.026 8.211 1.00 10.00 H new ATOM 0 HB3 ASP A 40 -27.727 37.937 7.250 1.00 10.00 H new ATOM 591 N PRO A 41 -31.103 35.803 6.221 1.00 10.00 N ATOM 592 CA PRO A 41 -31.301 34.677 5.326 1.00 10.00 C ATOM 593 C PRO A 41 -30.802 34.868 3.902 1.00 10.00 C ATOM 594 O PRO A 41 -30.510 33.882 3.235 1.00 10.00 O ATOM 595 CB PRO A 41 -32.797 34.405 5.378 1.00 10.00 C ATOM 596 CG PRO A 41 -33.398 35.776 5.704 1.00 10.00 C ATOM 597 CD PRO A 41 -32.364 36.391 6.634 1.00 10.00 C ATOM 0 HA PRO A 41 -30.696 33.834 5.659 1.00 10.00 H new ATOM 0 HB2 PRO A 41 -33.168 34.019 4.428 1.00 10.00 H new ATOM 0 HB3 PRO A 41 -33.045 33.667 6.141 1.00 10.00 H new ATOM 0 HG2 PRO A 41 -33.542 36.377 4.806 1.00 10.00 H new ATOM 0 HG3 PRO A 41 -34.371 35.686 6.186 1.00 10.00 H new ATOM 0 HD2 PRO A 41 -32.344 37.477 6.542 1.00 10.00 H new ATOM 0 HD3 PRO A 41 -32.584 36.164 7.677 1.00 10.00 H new ATOM 605 N ALA A 42 -30.664 36.102 3.431 1.00 10.00 N ATOM 606 CA ALA A 42 -30.144 36.373 2.110 1.00 10.00 C ATOM 607 C ALA A 42 -28.635 36.064 2.000 1.00 10.00 C ATOM 608 O ALA A 42 -28.212 35.457 1.012 1.00 10.00 O ATOM 609 CB ALA A 42 -30.519 37.816 1.776 1.00 10.00 C ATOM 0 H ALA A 42 -30.912 36.938 3.960 1.00 10.00 H new ATOM 0 HA ALA A 42 -30.587 35.710 1.367 1.00 10.00 H new ATOM 0 HB1 ALA A 42 -30.146 38.068 0.783 1.00 10.00 H new ATOM 0 HB2 ALA A 42 -31.604 37.924 1.795 1.00 10.00 H new ATOM 0 HB3 ALA A 42 -30.075 38.487 2.512 1.00 10.00 H new ATOM 615 N LEU A 43 -27.825 36.388 3.022 1.00 10.00 N ATOM 616 CA LEU A 43 -26.428 35.957 3.109 1.00 10.00 C ATOM 617 C LEU A 43 -26.272 34.511 3.614 1.00 10.00 C ATOM 618 O LEU A 43 -25.458 33.765 3.069 1.00 10.00 O ATOM 619 CB LEU A 43 -25.624 36.989 3.925 1.00 10.00 C ATOM 620 CG LEU A 43 -25.791 36.931 5.442 1.00 10.00 C ATOM 621 CD1 LEU A 43 -24.871 35.919 6.074 1.00 10.00 C ATOM 622 CD2 LEU A 43 -25.308 38.182 6.154 1.00 10.00 C ATOM 0 H LEU A 43 -28.126 36.959 3.812 1.00 10.00 H new ATOM 0 HA LEU A 43 -26.010 35.926 2.103 1.00 10.00 H new ATOM 0 HB2 LEU A 43 -24.567 36.861 3.692 1.00 10.00 H new ATOM 0 HB3 LEU A 43 -25.906 37.986 3.588 1.00 10.00 H new ATOM 0 HG LEU A 43 -26.858 36.735 5.550 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -25.024 35.912 7.153 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -25.086 34.930 5.671 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -23.836 36.182 5.856 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -25.457 38.070 7.228 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -24.248 38.331 5.949 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -25.871 39.044 5.797 1.00 10.00 H new ATOM 634 N LEU A 44 -27.036 34.087 4.631 1.00 10.00 N ATOM 635 CA LEU A 44 -26.966 32.727 5.179 1.00 10.00 C ATOM 636 C LEU A 44 -27.373 31.749 4.095 1.00 10.00 C ATOM 637 O LEU A 44 -26.635 30.809 3.875 1.00 10.00 O ATOM 638 CB LEU A 44 -27.710 32.622 6.539 1.00 10.00 C ATOM 639 CG LEU A 44 -28.575 31.408 6.933 1.00 10.00 C ATOM 640 CD1 LEU A 44 -29.679 30.996 5.963 1.00 10.00 C ATOM 641 CD2 LEU A 44 -27.747 30.167 7.180 1.00 10.00 C ATOM 0 H LEU A 44 -27.722 34.681 5.097 1.00 10.00 H new ATOM 0 HA LEU A 44 -25.947 32.453 5.452 1.00 10.00 H new ATOM 0 HB2 LEU A 44 -26.952 32.726 7.315 1.00 10.00 H new ATOM 0 HB3 LEU A 44 -28.357 33.497 6.606 1.00 10.00 H new ATOM 0 HG LEU A 44 -29.054 31.785 7.837 1.00 10.00 H new ATOM 0 HD11 LEU A 44 -30.209 30.131 6.361 1.00 10.00 H new ATOM 0 HD12 LEU A 44 -30.378 31.823 5.835 1.00 10.00 H new ATOM 0 HD13 LEU A 44 -29.239 30.740 4.999 1.00 10.00 H new ATOM 0 HD21 LEU A 44 -28.403 29.341 7.454 1.00 10.00 H new ATOM 0 HD22 LEU A 44 -27.198 29.909 6.274 1.00 10.00 H new ATOM 0 HD23 LEU A 44 -27.042 30.355 7.990 1.00 10.00 H new ATOM 653 N ALA A 45 -28.430 31.957 3.312 1.00 10.00 N ATOM 654 CA ALA A 45 -28.761 30.977 2.294 1.00 10.00 C ATOM 655 C ALA A 45 -27.797 31.024 1.099 1.00 10.00 C ATOM 656 O ALA A 45 -27.678 30.030 0.389 1.00 10.00 O ATOM 657 CB ALA A 45 -30.236 31.048 1.935 1.00 10.00 C ATOM 0 H ALA A 45 -29.049 32.766 3.362 1.00 10.00 H new ATOM 0 HA ALA A 45 -28.609 29.980 2.708 1.00 10.00 H new ATOM 0 HB1 ALA A 45 -30.461 30.304 1.170 1.00 10.00 H new ATOM 0 HB2 ALA A 45 -30.836 30.848 2.823 1.00 10.00 H new ATOM 0 HB3 ALA A 45 -30.470 32.042 1.554 1.00 10.00 H new ATOM 663 N ALA A 46 -27.063 32.125 0.890 1.00 10.00 N ATOM 664 CA ALA A 46 -25.957 32.143 -0.058 1.00 10.00 C ATOM 665 C ALA A 46 -24.810 31.256 0.467 1.00 10.00 C ATOM 666 O ALA A 46 -24.197 30.525 -0.309 1.00 10.00 O ATOM 667 CB ALA A 46 -25.500 33.573 -0.341 1.00 10.00 C ATOM 0 H ALA A 46 -27.221 33.012 1.368 1.00 10.00 H new ATOM 0 HA ALA A 46 -26.292 31.731 -1.010 1.00 10.00 H new ATOM 0 HB1 ALA A 46 -24.674 33.557 -1.052 1.00 10.00 H new ATOM 0 HB2 ALA A 46 -26.329 34.143 -0.761 1.00 10.00 H new ATOM 0 HB3 ALA A 46 -25.171 34.040 0.587 1.00 10.00 H new ATOM 673 N TYR A 47 -24.567 31.238 1.786 1.00 10.00 N ATOM 674 CA TYR A 47 -23.677 30.279 2.438 1.00 10.00 C ATOM 675 C TYR A 47 -24.192 28.872 2.232 1.00 10.00 C ATOM 676 O TYR A 47 -23.455 28.045 1.714 1.00 10.00 O ATOM 677 CB TYR A 47 -23.542 30.554 3.935 1.00 10.00 C ATOM 678 CG TYR A 47 -22.610 29.607 4.679 1.00 10.00 C ATOM 679 CD1 TYR A 47 -21.249 29.519 4.347 1.00 10.00 C ATOM 680 CD2 TYR A 47 -23.138 28.726 5.648 1.00 10.00 C ATOM 681 CE1 TYR A 47 -20.420 28.561 4.962 1.00 10.00 C ATOM 682 CE2 TYR A 47 -22.313 27.776 6.280 1.00 10.00 C ATOM 683 CZ TYR A 47 -20.949 27.686 5.934 1.00 10.00 C ATOM 684 OH TYR A 47 -20.142 26.763 6.524 1.00 10.00 O ATOM 0 H TYR A 47 -24.992 31.901 2.435 1.00 10.00 H new ATOM 0 HA TYR A 47 -22.692 30.387 1.983 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -23.184 31.574 4.071 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -24.531 30.500 4.390 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -20.833 30.193 3.612 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -24.185 28.781 5.907 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -19.377 28.496 4.689 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -22.725 27.116 7.030 1.00 10.00 H new ATOM 0 HH TYR A 47 -20.661 26.241 7.171 1.00 10.00 H new ATOM 694 N GLN A 48 -25.473 28.642 2.534 1.00 10.00 N ATOM 695 CA GLN A 48 -26.153 27.371 2.320 1.00 10.00 C ATOM 696 C GLN A 48 -26.052 26.900 0.856 1.00 10.00 C ATOM 697 O GLN A 48 -25.974 25.702 0.577 1.00 10.00 O ATOM 698 CB GLN A 48 -27.622 27.412 2.771 1.00 10.00 C ATOM 699 CG GLN A 48 -27.931 27.817 4.214 1.00 10.00 C ATOM 700 CD GLN A 48 -27.296 26.903 5.259 1.00 10.00 C ATOM 701 OE1 GLN A 48 -26.202 27.134 5.749 1.00 10.00 O ATOM 702 NE2 GLN A 48 -27.951 25.825 5.638 1.00 10.00 N ATOM 0 H GLN A 48 -26.077 29.355 2.944 1.00 10.00 H new ATOM 0 HA GLN A 48 -25.634 26.644 2.945 1.00 10.00 H new ATOM 0 HB2 GLN A 48 -28.152 28.100 2.113 1.00 10.00 H new ATOM 0 HB3 GLN A 48 -28.047 26.422 2.606 1.00 10.00 H new ATOM 0 HG2 GLN A 48 -27.584 28.837 4.378 1.00 10.00 H new ATOM 0 HG3 GLN A 48 -29.012 27.821 4.357 1.00 10.00 H new ATOM 0 HE21 GLN A 48 -28.866 25.617 5.238 1.00 10.00 H new ATOM 0 HE22 GLN A 48 -27.543 25.198 6.331 1.00 10.00 H new ATOM 711 N SER A 49 -25.998 27.845 -0.085 1.00 10.00 N ATOM 712 CA SER A 49 -25.795 27.582 -1.499 1.00 10.00 C ATOM 713 C SER A 49 -24.366 27.167 -1.800 1.00 10.00 C ATOM 714 O SER A 49 -24.131 26.132 -2.414 1.00 10.00 O ATOM 715 CB SER A 49 -26.119 28.831 -2.345 1.00 10.00 C ATOM 716 OG SER A 49 -26.336 28.452 -3.693 1.00 10.00 O ATOM 0 H SER A 49 -26.098 28.838 0.128 1.00 10.00 H new ATOM 0 HA SER A 49 -26.469 26.765 -1.757 1.00 10.00 H new ATOM 0 HB2 SER A 49 -27.004 29.330 -1.950 1.00 10.00 H new ATOM 0 HB3 SER A 49 -25.298 29.545 -2.286 1.00 10.00 H new ATOM 0 HG SER A 49 -26.543 29.247 -4.227 1.00 10.00 H new ATOM 722 N LYS A 50 -23.386 27.943 -1.329 1.00 10.00 N ATOM 723 CA LYS A 50 -21.964 27.709 -1.567 1.00 10.00 C ATOM 724 C LYS A 50 -21.470 26.425 -0.909 1.00 10.00 C ATOM 725 O LYS A 50 -20.695 25.696 -1.504 1.00 10.00 O ATOM 726 CB LYS A 50 -21.190 28.967 -1.143 1.00 10.00 C ATOM 727 CG LYS A 50 -21.547 30.159 -2.051 1.00 10.00 C ATOM 728 CD LYS A 50 -20.429 30.504 -3.022 1.00 10.00 C ATOM 729 CE LYS A 50 -20.118 29.376 -4.011 1.00 10.00 C ATOM 730 NZ LYS A 50 -20.497 29.740 -5.404 1.00 10.00 N ATOM 0 H LYS A 50 -23.566 28.769 -0.759 1.00 10.00 H new ATOM 0 HA LYS A 50 -21.786 27.542 -2.629 1.00 10.00 H new ATOM 0 HB2 LYS A 50 -21.423 29.211 -0.106 1.00 10.00 H new ATOM 0 HB3 LYS A 50 -20.118 28.774 -1.192 1.00 10.00 H new ATOM 0 HG2 LYS A 50 -22.452 29.927 -2.612 1.00 10.00 H new ATOM 0 HG3 LYS A 50 -21.769 31.029 -1.433 1.00 10.00 H new ATOM 0 HD2 LYS A 50 -20.703 31.400 -3.578 1.00 10.00 H new ATOM 0 HD3 LYS A 50 -19.527 30.742 -2.458 1.00 10.00 H new ATOM 0 HE2 LYS A 50 -19.054 29.143 -3.973 1.00 10.00 H new ATOM 0 HE3 LYS A 50 -20.653 28.474 -3.713 1.00 10.00 H new ATOM 0 HZ1 LYS A 50 -20.464 28.892 -6.006 1.00 10.00 H new ATOM 0 HZ2 LYS A 50 -21.460 30.132 -5.411 1.00 10.00 H new ATOM 0 HZ3 LYS A 50 -19.832 30.451 -5.770 1.00 10.00 H new ATOM 744 N LEU A 51 -22.007 26.110 0.260 1.00 10.00 N ATOM 745 CA LEU A 51 -21.916 24.866 1.020 1.00 10.00 C ATOM 746 C LEU A 51 -22.344 23.665 0.165 1.00 10.00 C ATOM 747 O LEU A 51 -21.720 22.607 0.215 1.00 10.00 O ATOM 748 CB LEU A 51 -22.840 25.159 2.224 1.00 10.00 C ATOM 749 CG LEU A 51 -23.352 24.048 3.149 1.00 10.00 C ATOM 750 CD1 LEU A 51 -24.034 24.740 4.331 1.00 10.00 C ATOM 751 CD2 LEU A 51 -24.428 23.171 2.499 1.00 10.00 C ATOM 0 H LEU A 51 -22.580 26.793 0.756 1.00 10.00 H new ATOM 0 HA LEU A 51 -20.911 24.589 1.339 1.00 10.00 H new ATOM 0 HB2 LEU A 51 -22.315 25.875 2.855 1.00 10.00 H new ATOM 0 HB3 LEU A 51 -23.719 25.668 1.828 1.00 10.00 H new ATOM 0 HG LEU A 51 -22.503 23.418 3.415 1.00 10.00 H new ATOM 0 HD11 LEU A 51 -24.417 23.988 5.021 1.00 10.00 H new ATOM 0 HD12 LEU A 51 -23.313 25.373 4.848 1.00 10.00 H new ATOM 0 HD13 LEU A 51 -24.859 25.353 3.967 1.00 10.00 H new ATOM 0 HD21 LEU A 51 -24.748 22.405 3.205 1.00 10.00 H new ATOM 0 HD22 LEU A 51 -25.282 23.789 2.222 1.00 10.00 H new ATOM 0 HD23 LEU A 51 -24.020 22.695 1.607 1.00 10.00 H new ATOM 763 N SER A 52 -23.364 23.840 -0.671 1.00 10.00 N ATOM 764 CA SER A 52 -23.769 22.859 -1.667 1.00 10.00 C ATOM 765 C SER A 52 -22.899 22.896 -2.921 1.00 10.00 C ATOM 766 O SER A 52 -22.503 21.844 -3.412 1.00 10.00 O ATOM 767 CB SER A 52 -25.227 23.054 -2.073 1.00 10.00 C ATOM 768 OG SER A 52 -26.105 23.031 -0.955 1.00 10.00 O ATOM 0 H SER A 52 -23.940 24.682 -0.673 1.00 10.00 H new ATOM 0 HA SER A 52 -23.643 21.886 -1.192 1.00 10.00 H new ATOM 0 HB2 SER A 52 -25.332 24.005 -2.596 1.00 10.00 H new ATOM 0 HB3 SER A 52 -25.515 22.271 -2.774 1.00 10.00 H new ATOM 0 HG SER A 52 -26.050 23.886 -0.478 1.00 10.00 H new ATOM 774 N GLU A 53 -22.528 24.080 -3.419 1.00 10.00 N ATOM 775 CA GLU A 53 -21.636 24.231 -4.562 1.00 10.00 C ATOM 776 C GLU A 53 -20.270 23.577 -4.320 1.00 10.00 C ATOM 777 O GLU A 53 -19.627 23.087 -5.239 1.00 10.00 O ATOM 778 CB GLU A 53 -21.330 25.674 -4.919 1.00 10.00 C ATOM 779 CG GLU A 53 -22.324 26.629 -5.544 1.00 10.00 C ATOM 780 CD GLU A 53 -22.996 26.079 -6.817 1.00 10.00 C ATOM 781 OE1 GLU A 53 -22.303 25.939 -7.854 1.00 10.00 O ATOM 782 OE2 GLU A 53 -24.222 25.816 -6.798 1.00 10.00 O ATOM 0 H GLU A 53 -22.845 24.968 -3.031 1.00 10.00 H new ATOM 0 HA GLU A 53 -22.186 23.749 -5.371 1.00 10.00 H new ATOM 0 HB2 GLU A 53 -20.993 26.149 -3.997 1.00 10.00 H new ATOM 0 HB3 GLU A 53 -20.474 25.644 -5.594 1.00 10.00 H new ATOM 0 HG2 GLU A 53 -23.095 26.868 -4.811 1.00 10.00 H new ATOM 0 HG3 GLU A 53 -21.815 27.562 -5.787 1.00 10.00 H new ATOM 789 N TYR A 54 -19.798 23.590 -3.078 1.00 10.00 N ATOM 790 CA TYR A 54 -18.559 22.956 -2.662 1.00 10.00 C ATOM 791 C TYR A 54 -18.682 21.427 -2.727 1.00 10.00 C ATOM 792 O TYR A 54 -17.751 20.745 -3.162 1.00 10.00 O ATOM 793 CB TYR A 54 -18.110 23.550 -1.321 1.00 10.00 C ATOM 794 CG TYR A 54 -17.570 22.561 -0.346 1.00 10.00 C ATOM 795 CD1 TYR A 54 -16.241 22.149 -0.478 1.00 10.00 C ATOM 796 CD2 TYR A 54 -18.394 22.036 0.655 1.00 10.00 C ATOM 797 CE1 TYR A 54 -15.728 21.188 0.397 1.00 10.00 C ATOM 798 CE2 TYR A 54 -17.894 21.062 1.524 1.00 10.00 C ATOM 799 CZ TYR A 54 -16.550 20.631 1.406 1.00 10.00 C ATOM 800 OH TYR A 54 -16.063 19.685 2.256 1.00 10.00 O ATOM 0 H TYR A 54 -20.284 24.057 -2.312 1.00 10.00 H new ATOM 0 HA TYR A 54 -17.746 23.175 -3.355 1.00 10.00 H new ATOM 0 HB2 TYR A 54 -17.347 24.304 -1.512 1.00 10.00 H new ATOM 0 HB3 TYR A 54 -18.957 24.062 -0.865 1.00 10.00 H new ATOM 0 HD1 TYR A 54 -15.615 22.570 -1.251 1.00 10.00 H new ATOM 0 HD2 TYR A 54 -19.412 22.382 0.756 1.00 10.00 H new ATOM 0 HE1 TYR A 54 -14.700 20.869 0.303 1.00 10.00 H new ATOM 0 HE2 TYR A 54 -18.532 20.638 2.285 1.00 10.00 H new ATOM 0 HH TYR A 54 -16.766 19.417 2.884 1.00 10.00 H new ATOM 810 N ASN A 55 -19.865 20.883 -2.426 1.00 10.00 N ATOM 811 CA ASN A 55 -20.158 19.483 -2.678 1.00 10.00 C ATOM 812 C ASN A 55 -20.354 19.206 -4.193 1.00 10.00 C ATOM 813 O ASN A 55 -20.174 18.076 -4.632 1.00 10.00 O ATOM 814 CB ASN A 55 -21.400 19.034 -1.902 1.00 10.00 C ATOM 815 CG ASN A 55 -21.206 17.667 -1.268 1.00 10.00 C ATOM 816 OD1 ASN A 55 -21.250 17.500 -0.057 1.00 10.00 O ATOM 817 ND2 ASN A 55 -20.968 16.648 -2.064 1.00 10.00 N ATOM 0 H ASN A 55 -20.636 21.402 -2.005 1.00 10.00 H new ATOM 0 HA ASN A 55 -19.299 18.908 -2.333 1.00 10.00 H new ATOM 0 HB2 ASN A 55 -21.628 19.765 -1.126 1.00 10.00 H new ATOM 0 HB3 ASN A 55 -22.258 19.004 -2.574 1.00 10.00 H new ATOM 0 HD21 ASN A 55 -20.820 15.718 -1.672 1.00 10.00 H new ATOM 0 HD22 ASN A 55 -20.931 16.787 -3.074 1.00 10.00 H new ATOM 824 N LEU A 56 -20.741 20.201 -5.003 1.00 10.00 N ATOM 825 CA LEU A 56 -20.756 20.148 -6.470 1.00 10.00 C ATOM 826 C LEU A 56 -19.337 20.196 -7.039 1.00 10.00 C ATOM 827 O LEU A 56 -19.082 19.523 -8.031 1.00 10.00 O ATOM 828 CB LEU A 56 -21.592 21.294 -7.057 1.00 10.00 C ATOM 829 CG LEU A 56 -23.077 21.028 -7.336 1.00 10.00 C ATOM 830 CD1 LEU A 56 -23.844 20.338 -6.208 1.00 10.00 C ATOM 831 CD2 LEU A 56 -23.723 22.386 -7.605 1.00 10.00 C ATOM 0 H LEU A 56 -21.064 21.098 -4.640 1.00 10.00 H new ATOM 0 HA LEU A 56 -21.214 19.201 -6.755 1.00 10.00 H new ATOM 0 HB2 LEU A 56 -21.526 22.140 -6.373 1.00 10.00 H new ATOM 0 HB3 LEU A 56 -21.126 21.603 -7.993 1.00 10.00 H new ATOM 0 HG LEU A 56 -23.126 20.337 -8.177 1.00 10.00 H new ATOM 0 HD11 LEU A 56 -24.883 20.197 -6.507 1.00 10.00 H new ATOM 0 HD12 LEU A 56 -23.392 19.368 -6.000 1.00 10.00 H new ATOM 0 HD13 LEU A 56 -23.806 20.956 -5.311 1.00 10.00 H new ATOM 0 HD21 LEU A 56 -24.785 22.250 -7.810 1.00 10.00 H new ATOM 0 HD22 LEU A 56 -23.601 23.026 -6.731 1.00 10.00 H new ATOM 0 HD23 LEU A 56 -23.244 22.852 -8.466 1.00 10.00 H new ATOM 843 N TYR A 57 -18.403 20.924 -6.419 1.00 10.00 N ATOM 844 CA TYR A 57 -16.985 20.829 -6.749 1.00 10.00 C ATOM 845 C TYR A 57 -16.554 19.352 -6.565 1.00 10.00 C ATOM 846 O TYR A 57 -15.911 18.751 -7.426 1.00 10.00 O ATOM 847 CB TYR A 57 -16.127 21.844 -5.962 1.00 10.00 C ATOM 848 CG TYR A 57 -14.688 21.373 -5.898 1.00 10.00 C ATOM 849 CD1 TYR A 57 -14.352 20.380 -4.962 1.00 10.00 C ATOM 850 CD2 TYR A 57 -13.779 21.712 -6.920 1.00 10.00 C ATOM 851 CE1 TYR A 57 -13.164 19.644 -5.102 1.00 10.00 C ATOM 852 CE2 TYR A 57 -12.556 21.021 -7.027 1.00 10.00 C ATOM 853 CZ TYR A 57 -12.255 19.967 -6.135 1.00 10.00 C ATOM 854 OH TYR A 57 -11.106 19.253 -6.286 1.00 10.00 O ATOM 0 H TYR A 57 -18.612 21.592 -5.677 1.00 10.00 H new ATOM 0 HA TYR A 57 -16.817 21.110 -7.789 1.00 10.00 H new ATOM 0 HB2 TYR A 57 -16.176 22.822 -6.441 1.00 10.00 H new ATOM 0 HB3 TYR A 57 -16.524 21.962 -4.954 1.00 10.00 H new ATOM 0 HD1 TYR A 57 -15.011 20.182 -4.130 1.00 10.00 H new ATOM 0 HD2 TYR A 57 -14.019 22.499 -7.619 1.00 10.00 H new ATOM 0 HE1 TYR A 57 -12.946 18.834 -4.422 1.00 10.00 H new ATOM 0 HE2 TYR A 57 -11.846 21.298 -7.793 1.00 10.00 H new ATOM 0 HH TYR A 57 -10.598 19.608 -7.045 1.00 10.00 H new ATOM 864 N ARG A 58 -17.011 18.737 -5.464 1.00 10.00 N ATOM 865 CA ARG A 58 -16.845 17.325 -5.098 1.00 10.00 C ATOM 866 C ARG A 58 -17.492 16.373 -6.116 1.00 10.00 C ATOM 867 O ARG A 58 -16.913 15.350 -6.471 1.00 10.00 O ATOM 868 CB ARG A 58 -17.458 17.142 -3.691 1.00 10.00 C ATOM 869 CG ARG A 58 -16.615 16.369 -2.680 1.00 10.00 C ATOM 870 CD ARG A 58 -15.509 17.228 -2.064 1.00 10.00 C ATOM 871 NE ARG A 58 -14.676 16.417 -1.153 1.00 10.00 N ATOM 872 CZ ARG A 58 -14.924 16.135 0.115 1.00 10.00 C ATOM 873 NH1 ARG A 58 -15.960 16.611 0.745 1.00 10.00 N ATOM 874 NH2 ARG A 58 -14.124 15.365 0.791 1.00 10.00 N ATOM 0 H ARG A 58 -17.542 19.249 -4.759 1.00 10.00 H new ATOM 0 HA ARG A 58 -15.785 17.070 -5.096 1.00 10.00 H new ATOM 0 HB2 ARG A 58 -17.667 18.129 -3.278 1.00 10.00 H new ATOM 0 HB3 ARG A 58 -18.415 16.632 -3.799 1.00 10.00 H new ATOM 0 HG2 ARG A 58 -17.260 15.990 -1.888 1.00 10.00 H new ATOM 0 HG3 ARG A 58 -16.169 15.503 -3.170 1.00 10.00 H new ATOM 0 HD2 ARG A 58 -14.888 17.654 -2.852 1.00 10.00 H new ATOM 0 HD3 ARG A 58 -15.949 18.063 -1.519 1.00 10.00 H new ATOM 0 HE ARG A 58 -13.816 16.033 -1.544 1.00 10.00 H new ATOM 0 HH11 ARG A 58 -16.614 17.225 0.260 1.00 10.00 H new ATOM 0 HH12 ARG A 58 -16.117 16.370 1.724 1.00 10.00 H new ATOM 0 HH21 ARG A 58 -13.296 14.972 0.344 1.00 10.00 H new ATOM 0 HH22 ARG A 58 -14.325 15.154 1.769 1.00 10.00 H new ATOM 888 N ASN A 59 -18.674 16.738 -6.619 1.00 10.00 N ATOM 889 CA ASN A 59 -19.418 16.015 -7.651 1.00 10.00 C ATOM 890 C ASN A 59 -18.705 16.066 -9.013 1.00 10.00 C ATOM 891 O ASN A 59 -18.573 15.056 -9.704 1.00 10.00 O ATOM 892 CB ASN A 59 -20.845 16.590 -7.764 1.00 10.00 C ATOM 893 CG ASN A 59 -21.757 15.695 -8.591 1.00 10.00 C ATOM 894 OD1 ASN A 59 -21.869 14.498 -8.367 1.00 10.00 O ATOM 895 ND2 ASN A 59 -22.436 16.239 -9.577 1.00 10.00 N ATOM 0 H ASN A 59 -19.158 17.579 -6.305 1.00 10.00 H new ATOM 0 HA ASN A 59 -19.473 14.967 -7.356 1.00 10.00 H new ATOM 0 HB2 ASN A 59 -21.266 16.713 -6.766 1.00 10.00 H new ATOM 0 HB3 ASN A 59 -20.802 17.581 -8.217 1.00 10.00 H new ATOM 0 HD21 ASN A 59 -23.052 15.663 -10.150 1.00 10.00 H new ATOM 0 HD22 ASN A 59 -22.346 17.237 -9.768 1.00 10.00 H new ATOM 902 N ALA A 60 -18.193 17.243 -9.371 1.00 10.00 N ATOM 903 CA ALA A 60 -17.340 17.484 -10.522 1.00 10.00 C ATOM 904 C ALA A 60 -16.045 16.664 -10.418 1.00 10.00 C ATOM 905 O ALA A 60 -15.639 16.047 -11.398 1.00 10.00 O ATOM 906 CB ALA A 60 -17.108 18.993 -10.653 1.00 10.00 C ATOM 0 H ALA A 60 -18.374 18.093 -8.836 1.00 10.00 H new ATOM 0 HA ALA A 60 -17.822 17.146 -11.439 1.00 10.00 H new ATOM 0 HB1 ALA A 60 -16.469 19.189 -11.514 1.00 10.00 H new ATOM 0 HB2 ALA A 60 -18.065 19.498 -10.789 1.00 10.00 H new ATOM 0 HB3 ALA A 60 -16.626 19.367 -9.750 1.00 10.00 H new ATOM 912 N GLN A 61 -15.488 16.522 -9.210 1.00 10.00 N ATOM 913 CA GLN A 61 -14.392 15.619 -8.826 1.00 10.00 C ATOM 914 C GLN A 61 -14.827 14.139 -8.674 1.00 10.00 C ATOM 915 O GLN A 61 -14.267 13.332 -7.931 1.00 10.00 O ATOM 916 CB GLN A 61 -13.705 16.189 -7.598 1.00 10.00 C ATOM 917 CG GLN A 61 -12.324 15.561 -7.301 1.00 10.00 C ATOM 918 CD GLN A 61 -11.988 15.483 -5.808 1.00 10.00 C ATOM 919 OE1 GLN A 61 -12.595 16.103 -4.943 1.00 10.00 O ATOM 920 NE2 GLN A 61 -11.002 14.690 -5.439 1.00 10.00 N ATOM 0 H GLN A 61 -15.813 17.074 -8.416 1.00 10.00 H new ATOM 0 HA GLN A 61 -13.669 15.575 -9.641 1.00 10.00 H new ATOM 0 HB2 GLN A 61 -13.583 17.264 -7.729 1.00 10.00 H new ATOM 0 HB3 GLN A 61 -14.352 16.045 -6.733 1.00 10.00 H new ATOM 0 HG2 GLN A 61 -12.294 14.557 -7.724 1.00 10.00 H new ATOM 0 HG3 GLN A 61 -11.554 16.143 -7.807 1.00 10.00 H new ATOM 0 HE21 GLN A 61 -10.481 14.163 -6.140 1.00 10.00 H new ATOM 0 HE22 GLN A 61 -10.760 14.603 -4.452 1.00 10.00 H new ATOM 929 N SER A 62 -15.872 13.793 -9.408 1.00 10.00 N ATOM 930 CA SER A 62 -16.395 12.457 -9.679 1.00 10.00 C ATOM 931 C SER A 62 -16.956 12.380 -11.118 1.00 10.00 C ATOM 932 O SER A 62 -17.617 11.420 -11.516 1.00 10.00 O ATOM 933 CB SER A 62 -17.416 12.098 -8.604 1.00 10.00 C ATOM 934 OG SER A 62 -17.638 10.697 -8.543 1.00 10.00 O ATOM 0 H SER A 62 -16.431 14.507 -9.875 1.00 10.00 H new ATOM 0 HA SER A 62 -15.599 11.713 -9.632 1.00 10.00 H new ATOM 0 HB2 SER A 62 -17.066 12.454 -7.635 1.00 10.00 H new ATOM 0 HB3 SER A 62 -18.357 12.608 -8.810 1.00 10.00 H new ATOM 0 HG SER A 62 -17.741 10.342 -9.451 1.00 10.00 H new ATOM 940 N ASN A 63 -16.633 13.401 -11.924 1.00 10.00 N ATOM 941 CA ASN A 63 -17.005 13.601 -13.312 1.00 10.00 C ATOM 942 C ASN A 63 -15.758 13.720 -14.182 1.00 10.00 C ATOM 943 O ASN A 63 -15.570 12.948 -15.110 1.00 10.00 O ATOM 944 CB ASN A 63 -17.902 14.845 -13.400 1.00 10.00 C ATOM 945 CG ASN A 63 -18.854 14.772 -14.580 1.00 10.00 C ATOM 946 OD1 ASN A 63 -18.532 15.167 -15.691 1.00 10.00 O ATOM 947 ND2 ASN A 63 -20.046 14.253 -14.385 1.00 10.00 N ATOM 0 H ASN A 63 -16.055 14.168 -11.582 1.00 10.00 H new ATOM 0 HA ASN A 63 -17.565 12.744 -13.688 1.00 10.00 H new ATOM 0 HB2 ASN A 63 -18.474 14.947 -12.478 1.00 10.00 H new ATOM 0 HB3 ASN A 63 -17.280 15.736 -13.489 1.00 10.00 H new ATOM 0 HD21 ASN A 63 -20.703 14.180 -15.161 1.00 10.00 H new ATOM 0 HD22 ASN A 63 -20.313 13.924 -13.457 1.00 10.00 H new ATOM 954 N THR A 64 -14.839 14.595 -13.783 1.00 10.00 N ATOM 955 CA THR A 64 -13.472 14.735 -14.312 1.00 10.00 C ATOM 956 C THR A 64 -12.710 13.411 -14.367 1.00 10.00 C ATOM 957 O THR A 64 -12.155 12.995 -15.380 1.00 10.00 O ATOM 958 CB THR A 64 -12.747 15.776 -13.461 1.00 10.00 C ATOM 959 OG1 THR A 64 -11.464 16.052 -13.963 1.00 10.00 O ATOM 960 CG2 THR A 64 -12.649 15.389 -11.985 1.00 10.00 C ATOM 0 H THR A 64 -15.032 15.267 -13.040 1.00 10.00 H new ATOM 0 HA THR A 64 -13.525 15.065 -15.350 1.00 10.00 H new ATOM 0 HB THR A 64 -13.359 16.676 -13.523 1.00 10.00 H new ATOM 0 HG1 THR A 64 -10.920 15.237 -13.937 1.00 10.00 H new ATOM 0 HG21 THR A 64 -12.123 16.171 -11.438 1.00 10.00 H new ATOM 0 HG22 THR A 64 -13.651 15.269 -11.573 1.00 10.00 H new ATOM 0 HG23 THR A 64 -12.103 14.450 -11.890 1.00 10.00 H new ATOM 968 N VAL A 65 -12.861 12.664 -13.286 1.00 10.00 N ATOM 969 CA VAL A 65 -12.454 11.283 -13.020 1.00 10.00 C ATOM 970 C VAL A 65 -12.927 10.284 -14.092 1.00 10.00 C ATOM 971 O VAL A 65 -12.273 9.275 -14.357 1.00 10.00 O ATOM 972 CB VAL A 65 -13.059 10.911 -11.647 1.00 10.00 C ATOM 973 CG1 VAL A 65 -12.287 9.786 -10.968 1.00 10.00 C ATOM 974 CG2 VAL A 65 -13.096 12.061 -10.637 1.00 10.00 C ATOM 0 H VAL A 65 -13.330 13.056 -12.469 1.00 10.00 H new ATOM 0 HA VAL A 65 -11.366 11.223 -13.031 1.00 10.00 H new ATOM 0 HB VAL A 65 -14.077 10.615 -11.900 1.00 10.00 H new ATOM 0 HG11 VAL A 65 -12.747 9.558 -10.007 1.00 10.00 H new ATOM 0 HG12 VAL A 65 -12.307 8.898 -11.600 1.00 10.00 H new ATOM 0 HG13 VAL A 65 -11.254 10.097 -10.811 1.00 10.00 H new ATOM 0 HG21 VAL A 65 -13.535 11.711 -9.703 1.00 10.00 H new ATOM 0 HG22 VAL A 65 -12.082 12.415 -10.451 1.00 10.00 H new ATOM 0 HG23 VAL A 65 -13.697 12.877 -11.037 1.00 10.00 H new ATOM 984 N LYS A 66 -14.056 10.602 -14.737 1.00 10.00 N ATOM 985 CA LYS A 66 -14.786 9.885 -15.784 1.00 10.00 C ATOM 986 C LYS A 66 -14.779 10.646 -17.133 1.00 10.00 C ATOM 987 O LYS A 66 -15.480 10.277 -18.074 1.00 10.00 O ATOM 988 CB LYS A 66 -16.222 9.631 -15.273 1.00 10.00 C ATOM 989 CG LYS A 66 -16.411 8.337 -14.462 1.00 10.00 C ATOM 990 CD LYS A 66 -15.711 8.336 -13.092 1.00 10.00 C ATOM 991 CE LYS A 66 -16.155 7.169 -12.199 1.00 10.00 C ATOM 992 NZ LYS A 66 -15.716 5.847 -12.722 1.00 10.00 N ATOM 0 H LYS A 66 -14.535 11.473 -14.508 1.00 10.00 H new ATOM 0 HA LYS A 66 -14.291 8.936 -15.987 1.00 10.00 H new ATOM 0 HB2 LYS A 66 -16.525 10.476 -14.654 1.00 10.00 H new ATOM 0 HB3 LYS A 66 -16.896 9.605 -16.129 1.00 10.00 H new ATOM 0 HG2 LYS A 66 -17.478 8.170 -14.311 1.00 10.00 H new ATOM 0 HG3 LYS A 66 -16.037 7.498 -15.048 1.00 10.00 H new ATOM 0 HD2 LYS A 66 -14.632 8.284 -13.240 1.00 10.00 H new ATOM 0 HD3 LYS A 66 -15.918 9.277 -12.582 1.00 10.00 H new ATOM 0 HE2 LYS A 66 -15.752 7.310 -11.196 1.00 10.00 H new ATOM 0 HE3 LYS A 66 -17.241 7.178 -12.110 1.00 10.00 H new ATOM 0 HZ1 LYS A 66 -16.042 5.095 -12.082 1.00 10.00 H new ATOM 0 HZ2 LYS A 66 -16.121 5.696 -13.668 1.00 10.00 H new ATOM 0 HZ3 LYS A 66 -14.678 5.825 -12.782 1.00 10.00 H new ATOM 1006 N VAL A 67 -13.929 11.669 -17.246 1.00 10.00 N ATOM 1007 CA VAL A 67 -13.641 12.506 -18.410 1.00 10.00 C ATOM 1008 C VAL A 67 -12.210 12.309 -18.876 1.00 10.00 C ATOM 1009 O VAL A 67 -11.954 12.301 -20.074 1.00 10.00 O ATOM 1010 CB VAL A 67 -13.929 13.958 -18.044 1.00 10.00 C ATOM 1011 CG1 VAL A 67 -13.237 14.989 -18.914 1.00 10.00 C ATOM 1012 CG2 VAL A 67 -15.433 14.154 -18.057 1.00 10.00 C ATOM 0 H VAL A 67 -13.370 11.960 -16.444 1.00 10.00 H new ATOM 0 HA VAL A 67 -14.279 12.219 -19.246 1.00 10.00 H new ATOM 0 HB VAL A 67 -13.511 14.130 -17.052 1.00 10.00 H new ATOM 0 HG11 VAL A 67 -13.504 15.990 -18.575 1.00 10.00 H new ATOM 0 HG12 VAL A 67 -12.157 14.859 -18.844 1.00 10.00 H new ATOM 0 HG13 VAL A 67 -13.551 14.861 -19.950 1.00 10.00 H new ATOM 0 HG21 VAL A 67 -15.668 15.186 -17.798 1.00 10.00 H new ATOM 0 HG22 VAL A 67 -15.820 13.932 -19.052 1.00 10.00 H new ATOM 0 HG23 VAL A 67 -15.894 13.484 -17.331 1.00 10.00 H new ATOM 1022 N PHE A 68 -11.281 12.069 -17.953 1.00 10.00 N ATOM 1023 CA PHE A 68 -9.937 11.599 -18.275 1.00 10.00 C ATOM 1024 C PHE A 68 -10.066 10.256 -19.032 1.00 10.00 C ATOM 1025 O PHE A 68 -9.321 9.969 -19.968 1.00 10.00 O ATOM 1026 CB PHE A 68 -9.144 11.491 -16.967 1.00 10.00 C ATOM 1027 CG PHE A 68 -8.674 12.826 -16.410 1.00 10.00 C ATOM 1028 CD1 PHE A 68 -7.805 13.643 -17.159 1.00 10.00 C ATOM 1029 CD2 PHE A 68 -9.112 13.260 -15.144 1.00 10.00 C ATOM 1030 CE1 PHE A 68 -7.402 14.895 -16.657 1.00 10.00 C ATOM 1031 CE2 PHE A 68 -8.728 14.520 -14.651 1.00 10.00 C ATOM 1032 CZ PHE A 68 -7.871 15.338 -15.407 1.00 10.00 C ATOM 0 H PHE A 68 -11.442 12.196 -16.954 1.00 10.00 H new ATOM 0 HA PHE A 68 -9.395 12.285 -18.925 1.00 10.00 H new ATOM 0 HB2 PHE A 68 -9.764 10.996 -16.219 1.00 10.00 H new ATOM 0 HB3 PHE A 68 -8.276 10.854 -17.133 1.00 10.00 H new ATOM 0 HD1 PHE A 68 -7.447 13.308 -18.121 1.00 10.00 H new ATOM 0 HD2 PHE A 68 -9.747 12.621 -14.548 1.00 10.00 H new ATOM 0 HE1 PHE A 68 -6.732 15.516 -17.232 1.00 10.00 H new ATOM 0 HE2 PHE A 68 -9.091 14.859 -13.692 1.00 10.00 H new ATOM 0 HZ PHE A 68 -7.573 16.305 -15.029 1.00 10.00 H new ATOM 1042 N LYS A 69 -11.117 9.493 -18.685 1.00 10.00 N ATOM 1043 CA LYS A 69 -11.645 8.310 -19.370 1.00 10.00 C ATOM 1044 C LYS A 69 -11.964 8.591 -20.844 1.00 10.00 C ATOM 1045 O LYS A 69 -11.832 7.712 -21.683 1.00 10.00 O ATOM 1046 CB LYS A 69 -12.924 7.891 -18.601 1.00 10.00 C ATOM 1047 CG LYS A 69 -13.885 6.933 -19.339 1.00 10.00 C ATOM 1048 CD LYS A 69 -15.005 7.696 -20.084 1.00 10.00 C ATOM 1049 CE LYS A 69 -15.537 6.915 -21.291 1.00 10.00 C ATOM 1050 NZ LYS A 69 -16.535 7.710 -22.055 1.00 10.00 N ATOM 0 H LYS A 69 -11.660 9.709 -17.849 1.00 10.00 H new ATOM 0 HA LYS A 69 -10.901 7.514 -19.373 1.00 10.00 H new ATOM 0 HB2 LYS A 69 -12.622 7.419 -17.666 1.00 10.00 H new ATOM 0 HB3 LYS A 69 -13.476 8.793 -18.338 1.00 10.00 H new ATOM 0 HG2 LYS A 69 -13.321 6.331 -20.051 1.00 10.00 H new ATOM 0 HG3 LYS A 69 -14.331 6.244 -18.622 1.00 10.00 H new ATOM 0 HD2 LYS A 69 -15.825 7.898 -19.395 1.00 10.00 H new ATOM 0 HD3 LYS A 69 -14.624 8.661 -20.418 1.00 10.00 H new ATOM 0 HE2 LYS A 69 -14.708 6.644 -21.945 1.00 10.00 H new ATOM 0 HE3 LYS A 69 -15.993 5.985 -20.952 1.00 10.00 H new ATOM 0 HZ1 LYS A 69 -16.925 7.130 -22.825 1.00 10.00 H new ATOM 0 HZ2 LYS A 69 -17.304 8.005 -21.420 1.00 10.00 H new ATOM 0 HZ3 LYS A 69 -16.075 8.552 -22.456 1.00 10.00 H new ATOM 1064 N ASP A 70 -12.402 9.806 -21.164 1.00 10.00 N ATOM 1065 CA ASP A 70 -12.770 10.256 -22.503 1.00 10.00 C ATOM 1066 C ASP A 70 -11.558 10.629 -23.358 1.00 10.00 C ATOM 1067 O ASP A 70 -11.547 10.378 -24.564 1.00 10.00 O ATOM 1068 CB ASP A 70 -13.833 11.360 -22.435 1.00 10.00 C ATOM 1069 CG ASP A 70 -14.951 11.105 -23.457 1.00 10.00 C ATOM 1070 OD1 ASP A 70 -15.679 10.095 -23.289 1.00 10.00 O ATOM 1071 OD2 ASP A 70 -15.110 11.907 -24.409 1.00 10.00 O ATOM 0 H ASP A 70 -12.515 10.538 -20.463 1.00 10.00 H new ATOM 0 HA ASP A 70 -13.223 9.411 -23.022 1.00 10.00 H new ATOM 0 HB2 ASP A 70 -14.255 11.403 -21.431 1.00 10.00 H new ATOM 0 HB3 ASP A 70 -13.371 12.328 -22.629 1.00 10.00 H new ATOM 1076 N ILE A 71 -10.500 11.141 -22.724 1.00 10.00 N ATOM 1077 CA ILE A 71 -9.201 11.323 -23.368 1.00 10.00 C ATOM 1078 C ILE A 71 -8.625 9.946 -23.689 1.00 10.00 C ATOM 1079 O ILE A 71 -8.134 9.683 -24.779 1.00 10.00 O ATOM 1080 CB ILE A 71 -8.225 12.136 -22.470 1.00 10.00 C ATOM 1081 CG1 ILE A 71 -8.503 13.650 -22.520 1.00 10.00 C ATOM 1082 CG2 ILE A 71 -6.749 11.904 -22.842 1.00 10.00 C ATOM 1083 CD1 ILE A 71 -9.828 13.996 -21.845 1.00 10.00 C ATOM 0 H ILE A 71 -10.522 11.441 -21.749 1.00 10.00 H new ATOM 0 HA ILE A 71 -9.333 11.896 -24.286 1.00 10.00 H new ATOM 0 HB ILE A 71 -8.404 11.768 -21.460 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -7.692 14.187 -22.029 1.00 10.00 H new ATOM 0 HG13 ILE A 71 -8.524 13.984 -23.558 1.00 10.00 H new ATOM 0 HG21 ILE A 71 -6.111 12.495 -22.185 1.00 10.00 H new ATOM 0 HG22 ILE A 71 -6.507 10.847 -22.729 1.00 10.00 H new ATOM 0 HG23 ILE A 71 -6.583 12.206 -23.876 1.00 10.00 H new ATOM 0 HD11 ILE A 71 -9.993 15.072 -21.898 1.00 10.00 H new ATOM 0 HD12 ILE A 71 -10.641 13.478 -22.353 1.00 10.00 H new ATOM 0 HD13 ILE A 71 -9.797 13.685 -20.801 1.00 10.00 H new ATOM 1095 N ASP A 72 -8.726 9.036 -22.735 1.00 10.00 N ATOM 1096 CA ASP A 72 -8.305 7.656 -22.868 1.00 10.00 C ATOM 1097 C ASP A 72 -9.131 6.866 -23.897 1.00 10.00 C ATOM 1098 O ASP A 72 -8.581 6.069 -24.650 1.00 10.00 O ATOM 1099 CB ASP A 72 -8.328 7.099 -21.456 1.00 10.00 C ATOM 1100 CG ASP A 72 -7.948 5.613 -21.382 1.00 10.00 C ATOM 1101 OD1 ASP A 72 -6.736 5.297 -21.439 1.00 10.00 O ATOM 1102 OD2 ASP A 72 -8.858 4.762 -21.234 1.00 10.00 O ATOM 0 H ASP A 72 -9.117 9.247 -21.817 1.00 10.00 H new ATOM 0 HA ASP A 72 -7.303 7.571 -23.288 1.00 10.00 H new ATOM 0 HB2 ASP A 72 -7.641 7.674 -20.835 1.00 10.00 H new ATOM 0 HB3 ASP A 72 -9.325 7.233 -21.036 1.00 10.00 H new ATOM 1107 N ALA A 73 -10.425 7.154 -24.030 1.00 10.00 N ATOM 1108 CA ALA A 73 -11.259 6.649 -25.115 1.00 10.00 C ATOM 1109 C ALA A 73 -10.775 7.180 -26.485 1.00 10.00 C ATOM 1110 O ALA A 73 -10.875 6.474 -27.485 1.00 10.00 O ATOM 1111 CB ALA A 73 -12.723 7.020 -24.850 1.00 10.00 C ATOM 0 H ALA A 73 -10.929 7.754 -23.377 1.00 10.00 H new ATOM 0 HA ALA A 73 -11.177 5.563 -25.151 1.00 10.00 H new ATOM 0 HB1 ALA A 73 -13.346 6.643 -25.661 1.00 10.00 H new ATOM 0 HB2 ALA A 73 -13.046 6.577 -23.908 1.00 10.00 H new ATOM 0 HB3 ALA A 73 -12.819 8.104 -24.793 1.00 10.00 H new ATOM 1117 N ALA A 74 -10.188 8.383 -26.544 1.00 10.00 N ATOM 1118 CA ALA A 74 -9.504 8.888 -27.729 1.00 10.00 C ATOM 1119 C ALA A 74 -8.188 8.128 -28.016 1.00 10.00 C ATOM 1120 O ALA A 74 -7.864 7.875 -29.176 1.00 10.00 O ATOM 1121 CB ALA A 74 -9.280 10.403 -27.592 1.00 10.00 C ATOM 0 H ALA A 74 -10.178 9.035 -25.760 1.00 10.00 H new ATOM 0 HA ALA A 74 -10.142 8.710 -28.595 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -8.769 10.777 -28.479 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -10.242 10.905 -27.489 1.00 10.00 H new ATOM 0 HB3 ALA A 74 -8.670 10.602 -26.711 1.00 10.00 H new ATOM 1127 N ILE A 75 -7.457 7.698 -26.978 1.00 10.00 N ATOM 1128 CA ILE A 75 -6.303 6.780 -27.094 1.00 10.00 C ATOM 1129 C ILE A 75 -6.763 5.419 -27.653 1.00 10.00 C ATOM 1130 O ILE A 75 -6.100 4.831 -28.508 1.00 10.00 O ATOM 1131 CB ILE A 75 -5.522 6.586 -25.767 1.00 10.00 C ATOM 1132 CG1 ILE A 75 -5.077 7.941 -25.185 1.00 10.00 C ATOM 1133 CG2 ILE A 75 -4.286 5.690 -25.979 1.00 10.00 C ATOM 1134 CD1 ILE A 75 -4.517 7.887 -23.757 1.00 10.00 C ATOM 0 H ILE A 75 -7.650 7.980 -26.017 1.00 10.00 H new ATOM 0 HA ILE A 75 -5.605 7.250 -27.787 1.00 10.00 H new ATOM 0 HB ILE A 75 -6.196 6.100 -25.062 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -4.317 8.368 -25.840 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -5.928 8.621 -25.199 1.00 10.00 H new ATOM 0 HG21 ILE A 75 -3.757 5.570 -25.034 1.00 10.00 H new ATOM 0 HG22 ILE A 75 -4.603 4.713 -26.344 1.00 10.00 H new ATOM 0 HG23 ILE A 75 -3.623 6.152 -26.710 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -4.233 8.890 -23.440 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -5.278 7.495 -23.082 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -3.642 7.237 -23.734 1.00 10.00 H new ATOM 1146 N LEU A 76 -7.932 4.937 -27.220 1.00 10.00 N ATOM 1147 CA LEU A 76 -8.610 3.771 -27.793 1.00 10.00 C ATOM 1148 C LEU A 76 -8.931 3.983 -29.281 1.00 10.00 C ATOM 1149 O LEU A 76 -8.541 3.151 -30.099 1.00 10.00 O ATOM 1150 CB LEU A 76 -9.869 3.443 -26.962 1.00 10.00 C ATOM 1151 CG LEU A 76 -9.687 2.355 -25.893 1.00 10.00 C ATOM 1152 CD1 LEU A 76 -8.591 2.649 -24.868 1.00 10.00 C ATOM 1153 CD2 LEU A 76 -11.001 2.141 -25.142 1.00 10.00 C ATOM 0 H LEU A 76 -8.444 5.356 -26.444 1.00 10.00 H new ATOM 0 HA LEU A 76 -7.941 2.912 -27.747 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -10.209 4.356 -26.473 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -10.662 3.131 -27.642 1.00 10.00 H new ATOM 0 HG LEU A 76 -9.380 1.463 -26.439 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -8.533 1.829 -24.152 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -7.634 2.754 -25.379 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -8.824 3.574 -24.341 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -10.866 1.368 -24.385 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -11.301 3.072 -24.661 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -11.775 1.830 -25.844 1.00 10.00 H new ATOM 1165 N GLU A 77 -9.554 5.101 -29.669 1.00 10.00 N ATOM 1166 CA GLU A 77 -9.777 5.461 -31.080 1.00 10.00 C ATOM 1167 C GLU A 77 -8.475 5.488 -31.902 1.00 10.00 C ATOM 1168 O GLU A 77 -8.465 5.047 -33.053 1.00 10.00 O ATOM 1169 CB GLU A 77 -10.506 6.810 -31.213 1.00 10.00 C ATOM 1170 CG GLU A 77 -11.975 6.747 -30.781 1.00 10.00 C ATOM 1171 CD GLU A 77 -12.687 8.089 -31.039 1.00 10.00 C ATOM 1172 OE1 GLU A 77 -12.557 9.024 -30.212 1.00 10.00 O ATOM 1173 OE2 GLU A 77 -13.388 8.220 -32.073 1.00 10.00 O ATOM 0 H GLU A 77 -9.921 5.788 -29.011 1.00 10.00 H new ATOM 0 HA GLU A 77 -10.411 4.674 -31.489 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -9.988 7.556 -30.610 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -10.453 7.144 -32.249 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -12.484 5.951 -31.325 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -12.035 6.497 -29.722 1.00 10.00 H new ATOM 1180 N HIS A 78 -7.363 5.921 -31.297 1.00 10.00 N ATOM 1181 CA HIS A 78 -6.021 5.938 -31.890 1.00 10.00 C ATOM 1182 C HIS A 78 -5.470 4.538 -32.269 1.00 10.00 C ATOM 1183 O HIS A 78 -4.470 4.455 -32.985 1.00 10.00 O ATOM 1184 CB HIS A 78 -5.068 6.716 -30.957 1.00 10.00 C ATOM 1185 CG HIS A 78 -3.839 7.258 -31.643 1.00 10.00 C ATOM 1186 ND1 HIS A 78 -2.596 6.666 -31.692 1.00 10.00 N ATOM 1187 CD2 HIS A 78 -3.743 8.447 -32.317 1.00 10.00 C ATOM 1188 CE1 HIS A 78 -1.771 7.471 -32.384 1.00 10.00 C ATOM 1189 NE2 HIS A 78 -2.427 8.576 -32.786 1.00 10.00 N ATOM 0 H HIS A 78 -7.374 6.283 -30.344 1.00 10.00 H new ATOM 0 HA HIS A 78 -6.093 6.452 -32.848 1.00 10.00 H new ATOM 0 HB2 HIS A 78 -5.614 7.545 -30.507 1.00 10.00 H new ATOM 0 HB3 HIS A 78 -4.757 6.060 -30.144 1.00 10.00 H new ATOM 0 HD2 HIS A 78 -4.541 9.160 -32.462 1.00 10.00 H new ATOM 0 HE1 HIS A 78 -0.731 7.261 -32.588 1.00 10.00 H new ATOM 0 HE2 HIS A 78 -2.043 9.353 -33.325 1.00 10.00 H new ATOM 1197 N HIS A 79 -6.129 3.439 -31.862 1.00 10.00 N ATOM 1198 CA HIS A 79 -5.819 2.071 -32.317 1.00 10.00 C ATOM 1199 C HIS A 79 -7.029 1.296 -32.884 1.00 10.00 C ATOM 1200 O HIS A 79 -6.852 0.442 -33.756 1.00 10.00 O ATOM 1201 CB HIS A 79 -5.094 1.296 -31.203 1.00 10.00 C ATOM 1202 CG HIS A 79 -5.977 0.733 -30.119 1.00 10.00 C ATOM 1203 ND1 HIS A 79 -6.633 -0.479 -30.148 1.00 10.00 N ATOM 1204 CD2 HIS A 79 -6.200 1.279 -28.883 1.00 10.00 C ATOM 1205 CE1 HIS A 79 -7.238 -0.659 -28.963 1.00 10.00 C ATOM 1206 NE2 HIS A 79 -7.016 0.398 -28.160 1.00 10.00 N ATOM 0 H HIS A 79 -6.903 3.476 -31.198 1.00 10.00 H new ATOM 0 HA HIS A 79 -5.149 2.171 -33.171 1.00 10.00 H new ATOM 0 HB2 HIS A 79 -4.540 0.475 -31.658 1.00 10.00 H new ATOM 0 HB3 HIS A 79 -4.361 1.958 -30.742 1.00 10.00 H new ATOM 0 HD2 HIS A 79 -5.815 2.223 -28.528 1.00 10.00 H new ATOM 0 HE1 HIS A 79 -7.820 -1.528 -28.693 1.00 10.00 H new ATOM 0 HE2 HIS A 79 -7.371 0.531 -27.213 1.00 10.00 H new ATOM 1214 N HIS A 80 -8.263 1.626 -32.481 1.00 10.00 N ATOM 1215 CA HIS A 80 -9.501 1.104 -33.087 1.00 10.00 C ATOM 1216 C HIS A 80 -9.693 1.547 -34.553 1.00 10.00 C ATOM 1217 O HIS A 80 -10.469 0.929 -35.281 1.00 10.00 O ATOM 1218 CB HIS A 80 -10.722 1.499 -32.240 1.00 10.00 C ATOM 1219 CG HIS A 80 -10.878 0.706 -30.964 1.00 10.00 C ATOM 1220 ND1 HIS A 80 -10.081 0.780 -29.846 1.00 10.00 N ATOM 1221 CD2 HIS A 80 -11.865 -0.205 -30.688 1.00 10.00 C ATOM 1222 CE1 HIS A 80 -10.569 -0.059 -28.918 1.00 10.00 C ATOM 1223 NE2 HIS A 80 -11.661 -0.689 -29.388 1.00 10.00 N ATOM 0 H HIS A 80 -8.435 2.274 -31.712 1.00 10.00 H new ATOM 0 HA HIS A 80 -9.406 0.018 -33.102 1.00 10.00 H new ATOM 0 HB2 HIS A 80 -10.648 2.557 -31.989 1.00 10.00 H new ATOM 0 HB3 HIS A 80 -11.622 1.376 -32.842 1.00 10.00 H new ATOM 0 HD1 HIS A 80 -9.258 1.373 -29.739 1.00 10.00 H new ATOM 0 HD2 HIS A 80 -12.661 -0.499 -31.356 1.00 10.00 H new ATOM 0 HE1 HIS A 80 -10.146 -0.207 -27.935 1.00 10.00 H new ATOM 1231 N HIS A 81 -8.954 2.562 -35.020 1.00 10.00 N ATOM 1232 CA HIS A 81 -8.888 3.001 -36.425 1.00 10.00 C ATOM 1233 C HIS A 81 -8.559 1.861 -37.425 1.00 10.00 C ATOM 1234 O HIS A 81 -8.883 1.961 -38.611 1.00 10.00 O ATOM 1235 CB HIS A 81 -7.860 4.149 -36.512 1.00 10.00 C ATOM 1236 CG HIS A 81 -7.984 5.060 -37.713 1.00 10.00 C ATOM 1237 ND1 HIS A 81 -8.374 4.716 -38.987 1.00 10.00 N ATOM 1238 CD2 HIS A 81 -7.708 6.402 -37.733 1.00 10.00 C ATOM 1239 CE1 HIS A 81 -8.342 5.816 -39.757 1.00 10.00 C ATOM 1240 NE2 HIS A 81 -7.939 6.877 -39.034 1.00 10.00 N ATOM 0 H HIS A 81 -8.362 3.123 -34.408 1.00 10.00 H new ATOM 0 HA HIS A 81 -9.878 3.344 -36.725 1.00 10.00 H new ATOM 0 HB2 HIS A 81 -7.945 4.756 -35.610 1.00 10.00 H new ATOM 0 HB3 HIS A 81 -6.860 3.716 -36.511 1.00 10.00 H new ATOM 0 HD1 HIS A 81 -8.643 3.782 -39.295 1.00 10.00 H new ATOM 0 HD2 HIS A 81 -7.371 6.992 -36.894 1.00 10.00 H new ATOM 0 HE1 HIS A 81 -8.602 5.845 -40.805 1.00 10.00 H new ATOM 1248 N HIS A 82 -7.947 0.764 -36.959 1.00 10.00 N ATOM 1249 CA HIS A 82 -7.688 -0.452 -37.740 1.00 10.00 C ATOM 1250 C HIS A 82 -8.964 -1.185 -38.231 1.00 10.00 C ATOM 1251 O HIS A 82 -8.904 -1.910 -39.229 1.00 10.00 O ATOM 1252 CB HIS A 82 -6.821 -1.380 -36.871 1.00 10.00 C ATOM 1253 CG HIS A 82 -6.366 -2.641 -37.563 1.00 10.00 C ATOM 1254 ND1 HIS A 82 -6.772 -3.925 -37.270 1.00 10.00 N ATOM 1255 CD2 HIS A 82 -5.466 -2.729 -38.593 1.00 10.00 C ATOM 1256 CE1 HIS A 82 -6.137 -4.768 -38.104 1.00 10.00 C ATOM 1257 NE2 HIS A 82 -5.324 -4.083 -38.932 1.00 10.00 N ATOM 0 H HIS A 82 -7.608 0.697 -35.999 1.00 10.00 H new ATOM 0 HA HIS A 82 -7.176 -0.161 -38.657 1.00 10.00 H new ATOM 0 HB2 HIS A 82 -5.943 -0.828 -36.536 1.00 10.00 H new ATOM 0 HB3 HIS A 82 -7.385 -1.653 -35.979 1.00 10.00 H new ATOM 0 HD2 HIS A 82 -4.955 -1.901 -39.062 1.00 10.00 H new ATOM 0 HE1 HIS A 82 -6.261 -5.841 -38.109 1.00 10.00 H new ATOM 0 HE2 HIS A 82 -4.725 -4.472 -39.660 1.00 10.00 H new ATOM 1265 N HIS A 83 -10.107 -1.008 -37.549 1.00 10.00 N ATOM 1266 CA HIS A 83 -11.402 -1.639 -37.865 1.00 10.00 C ATOM 1267 C HIS A 83 -11.925 -1.291 -39.278 1.00 10.00 C ATOM 1268 O HIS A 83 -12.070 -0.087 -39.600 1.00 10.00 O ATOM 1269 CB HIS A 83 -12.413 -1.264 -36.769 1.00 10.00 C ATOM 1270 CG HIS A 83 -13.749 -1.950 -36.909 1.00 10.00 C ATOM 1271 ND1 HIS A 83 -14.109 -3.159 -36.355 1.00 10.00 N ATOM 1272 CD2 HIS A 83 -14.842 -1.483 -37.591 1.00 10.00 C ATOM 1273 CE1 HIS A 83 -15.384 -3.416 -36.693 1.00 10.00 C ATOM 1274 NE2 HIS A 83 -15.879 -2.418 -37.449 1.00 10.00 N ATOM 1275 OXT HIS A 83 -12.211 -2.229 -40.059 1.00 10.00 O ATOM 0 H HIS A 83 -10.158 -0.399 -36.732 1.00 10.00 H new ATOM 0 HA HIS A 83 -11.260 -2.720 -37.881 1.00 10.00 H new ATOM 0 HB2 HIS A 83 -11.988 -1.512 -35.796 1.00 10.00 H new ATOM 0 HB3 HIS A 83 -12.566 -0.185 -36.784 1.00 10.00 H new ATOM 0 HD2 HIS A 83 -14.896 -0.556 -38.142 1.00 10.00 H new ATOM 0 HE1 HIS A 83 -15.934 -4.298 -36.400 1.00 10.00 H new ATOM 0 HE2 HIS A 83 -16.819 -2.354 -37.840 1.00 10.00 H new TER 1283 HIS A 83