USER MOD reduce.3.24.130724 H: found=0, std=0, add=511, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 509 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 Single : A 1 GLY N :NH3+ 172:sc= 0 (180deg=-0.0482) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 61:sc= 1.13 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= -0.0346 K(o=-0.035,f=-1.1) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0.0803 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 SER OG : rot 180:sc= -0.0505 USER MOD Single : A 48 TYR OH : rot -57:sc= 0.571 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc=-0.00423 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0352) USER MOD Single : A 54 LYS NZ :NH3+ 172:sc= -1.53 (180deg=-1.58) USER MOD Single : A 58 MET CE :methyl 140:sc= -0.0303 (180deg=-0.169) USER MOD Single : A 59 GLN : amide:sc= -0.166 K(o=-0.17,f=-0.82) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.938 -22.155 20.211 1.00 0.00 N ATOM 2 CA GLY A 1 -14.245 -20.752 20.003 1.00 0.00 C ATOM 3 C GLY A 1 -13.198 -20.049 19.161 1.00 0.00 C ATOM 4 O GLY A 1 -12.837 -18.905 19.436 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.605 -22.558 20.900 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.021 -22.666 19.309 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.968 -22.248 20.574 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.217 -20.664 19.517 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.325 -20.253 20.969 1.00 0.00 H new ATOM 8 N SER A 2 -12.709 -20.735 18.133 1.00 0.00 N ATOM 9 CA SER A 2 -11.692 -20.171 17.253 1.00 0.00 C ATOM 10 C SER A 2 -11.961 -18.692 16.992 1.00 0.00 C ATOM 11 O SER A 2 -13.056 -18.310 16.580 1.00 0.00 O ATOM 12 CB SER A 2 -11.655 -20.935 15.928 1.00 0.00 C ATOM 13 OG SER A 2 -10.325 -21.265 15.568 1.00 0.00 O ATOM 0 H SER A 2 -13.000 -21.682 17.889 1.00 0.00 H new ATOM 0 HA SER A 2 -10.725 -20.266 17.747 1.00 0.00 H new ATOM 0 HB2 SER A 2 -12.249 -21.845 16.012 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.108 -20.330 15.143 1.00 0.00 H new ATOM 0 HG SER A 2 -10.328 -21.754 14.719 1.00 0.00 H new ATOM 19 N SER A 3 -10.950 -17.862 17.234 1.00 0.00 N ATOM 20 CA SER A 3 -11.076 -16.424 17.030 1.00 0.00 C ATOM 21 C SER A 3 -10.317 -15.985 15.781 1.00 0.00 C ATOM 22 O SER A 3 -9.087 -15.952 15.768 1.00 0.00 O ATOM 23 CB SER A 3 -10.554 -15.666 18.251 1.00 0.00 C ATOM 24 OG SER A 3 -10.954 -14.307 18.218 1.00 0.00 O ATOM 0 H SER A 3 -10.035 -18.161 17.571 1.00 0.00 H new ATOM 0 HA SER A 3 -12.132 -16.192 16.893 1.00 0.00 H new ATOM 0 HB2 SER A 3 -10.927 -16.136 19.161 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.466 -15.727 18.283 1.00 0.00 H new ATOM 0 HG SER A 3 -10.609 -13.845 19.010 1.00 0.00 H new ATOM 30 N GLY A 4 -11.060 -15.646 14.732 1.00 0.00 N ATOM 31 CA GLY A 4 -10.442 -15.214 13.493 1.00 0.00 C ATOM 32 C GLY A 4 -11.234 -14.122 12.799 1.00 0.00 C ATOM 33 O GLY A 4 -11.942 -14.382 11.826 1.00 0.00 O ATOM 0 H GLY A 4 -12.080 -15.663 14.719 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.435 -14.852 13.700 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -10.343 -16.068 12.823 1.00 0.00 H new ATOM 37 N SER A 5 -11.116 -12.898 13.302 1.00 0.00 N ATOM 38 CA SER A 5 -11.831 -11.763 12.728 1.00 0.00 C ATOM 39 C SER A 5 -11.725 -11.769 11.207 1.00 0.00 C ATOM 40 O SER A 5 -10.628 -11.729 10.649 1.00 0.00 O ATOM 41 CB SER A 5 -11.278 -10.451 13.285 1.00 0.00 C ATOM 42 OG SER A 5 -12.070 -9.978 14.361 1.00 0.00 O ATOM 0 H SER A 5 -10.532 -12.666 14.106 1.00 0.00 H new ATOM 0 HA SER A 5 -12.882 -11.850 13.002 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.252 -10.600 13.623 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.248 -9.701 12.495 1.00 0.00 H new ATOM 0 HG SER A 5 -11.694 -9.139 14.700 1.00 0.00 H new ATOM 48 N SER A 6 -12.874 -11.818 10.540 1.00 0.00 N ATOM 49 CA SER A 6 -12.912 -11.833 9.082 1.00 0.00 C ATOM 50 C SER A 6 -13.989 -10.888 8.557 1.00 0.00 C ATOM 51 O SER A 6 -15.145 -11.276 8.392 1.00 0.00 O ATOM 52 CB SER A 6 -13.171 -13.252 8.572 1.00 0.00 C ATOM 53 OG SER A 6 -12.214 -14.162 9.088 1.00 0.00 O ATOM 0 H SER A 6 -13.791 -11.848 10.986 1.00 0.00 H new ATOM 0 HA SER A 6 -11.944 -11.493 8.715 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.173 -13.569 8.862 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.137 -13.262 7.483 1.00 0.00 H new ATOM 0 HG SER A 6 -12.272 -14.179 10.066 1.00 0.00 H new ATOM 59 N GLY A 7 -13.600 -9.644 8.298 1.00 0.00 N ATOM 60 CA GLY A 7 -14.542 -8.661 7.794 1.00 0.00 C ATOM 61 C GLY A 7 -13.923 -7.286 7.648 1.00 0.00 C ATOM 62 O GLY A 7 -13.910 -6.498 8.595 1.00 0.00 O ATOM 0 H GLY A 7 -12.649 -9.299 8.428 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.922 -8.989 6.827 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -15.396 -8.602 8.469 1.00 0.00 H new ATOM 66 N VAL A 8 -13.407 -6.994 6.459 1.00 0.00 N ATOM 67 CA VAL A 8 -12.782 -5.704 6.192 1.00 0.00 C ATOM 68 C VAL A 8 -12.009 -5.205 7.407 1.00 0.00 C ATOM 69 O VAL A 8 -12.086 -4.031 7.766 1.00 0.00 O ATOM 70 CB VAL A 8 -13.828 -4.646 5.792 1.00 0.00 C ATOM 71 CG1 VAL A 8 -14.361 -4.922 4.395 1.00 0.00 C ATOM 72 CG2 VAL A 8 -14.962 -4.610 6.806 1.00 0.00 C ATOM 0 H VAL A 8 -13.409 -7.634 5.665 1.00 0.00 H new ATOM 0 HA VAL A 8 -12.091 -5.853 5.362 1.00 0.00 H new ATOM 0 HB VAL A 8 -13.346 -3.669 5.784 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -15.098 -4.164 4.131 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -13.539 -4.894 3.680 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -14.828 -5.907 4.372 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -15.692 -3.857 6.509 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -15.444 -5.587 6.848 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -14.563 -4.360 7.789 1.00 0.00 H new ATOM 82 N GLY A 9 -11.264 -6.107 8.038 1.00 0.00 N ATOM 83 CA GLY A 9 -10.487 -5.740 9.208 1.00 0.00 C ATOM 84 C GLY A 9 -9.114 -5.206 8.848 1.00 0.00 C ATOM 85 O GLY A 9 -8.626 -4.257 9.463 1.00 0.00 O ATOM 0 H GLY A 9 -11.184 -7.085 7.760 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -11.029 -4.985 9.778 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -10.377 -6.610 9.855 1.00 0.00 H new ATOM 89 N THR A 10 -8.487 -5.816 7.846 1.00 0.00 N ATOM 90 CA THR A 10 -7.162 -5.399 7.406 1.00 0.00 C ATOM 91 C THR A 10 -7.213 -4.036 6.724 1.00 0.00 C ATOM 92 O THR A 10 -6.450 -3.132 7.066 1.00 0.00 O ATOM 93 CB THR A 10 -6.544 -6.423 6.436 1.00 0.00 C ATOM 94 OG1 THR A 10 -6.455 -7.705 7.069 1.00 0.00 O ATOM 95 CG2 THR A 10 -5.161 -5.977 5.987 1.00 0.00 C ATOM 0 H THR A 10 -8.877 -6.601 7.324 1.00 0.00 H new ATOM 0 HA THR A 10 -6.539 -5.333 8.298 1.00 0.00 H new ATOM 0 HB THR A 10 -7.188 -6.494 5.559 1.00 0.00 H new ATOM 0 HG1 THR A 10 -6.063 -8.351 6.445 1.00 0.00 H new ATOM 0 HG21 THR A 10 -4.745 -6.716 5.303 1.00 0.00 H new ATOM 0 HG22 THR A 10 -5.236 -5.015 5.480 1.00 0.00 H new ATOM 0 HG23 THR A 10 -4.510 -5.880 6.856 1.00 0.00 H new ATOM 103 N ILE A 11 -8.115 -3.897 5.760 1.00 0.00 N ATOM 104 CA ILE A 11 -8.266 -2.643 5.032 1.00 0.00 C ATOM 105 C ILE A 11 -8.403 -1.464 5.989 1.00 0.00 C ATOM 106 O ILE A 11 -7.638 -0.502 5.919 1.00 0.00 O ATOM 107 CB ILE A 11 -9.491 -2.677 4.099 1.00 0.00 C ATOM 108 CG1 ILE A 11 -9.425 -3.899 3.181 1.00 0.00 C ATOM 109 CG2 ILE A 11 -9.569 -1.397 3.281 1.00 0.00 C ATOM 110 CD1 ILE A 11 -10.567 -4.870 3.385 1.00 0.00 C ATOM 0 H ILE A 11 -8.752 -4.636 5.464 1.00 0.00 H new ATOM 0 HA ILE A 11 -7.365 -2.517 4.431 1.00 0.00 H new ATOM 0 HB ILE A 11 -10.392 -2.751 4.708 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -9.424 -3.564 2.144 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -8.482 -4.419 3.349 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.440 -1.436 2.627 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -9.657 -0.542 3.951 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -8.667 -1.295 2.678 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -10.456 -5.712 2.701 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -10.556 -5.233 4.413 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -11.513 -4.366 3.188 1.00 0.00 H new ATOM 122 N ASP A 12 -9.381 -1.547 6.884 1.00 0.00 N ATOM 123 CA ASP A 12 -9.617 -0.488 7.859 1.00 0.00 C ATOM 124 C ASP A 12 -8.299 0.090 8.364 1.00 0.00 C ATOM 125 O ASP A 12 -8.190 1.292 8.606 1.00 0.00 O ATOM 126 CB ASP A 12 -10.439 -1.021 9.033 1.00 0.00 C ATOM 127 CG ASP A 12 -10.816 0.069 10.018 1.00 0.00 C ATOM 128 OD1 ASP A 12 -9.962 0.935 10.302 1.00 0.00 O ATOM 129 OD2 ASP A 12 -11.966 0.056 10.504 1.00 0.00 O ATOM 0 H ASP A 12 -10.023 -2.336 6.955 1.00 0.00 H new ATOM 0 HA ASP A 12 -10.176 0.308 7.366 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -11.345 -1.493 8.654 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -9.870 -1.793 9.550 1.00 0.00 H new ATOM 134 N GLN A 13 -7.302 -0.774 8.521 1.00 0.00 N ATOM 135 CA GLN A 13 -5.992 -0.350 8.999 1.00 0.00 C ATOM 136 C GLN A 13 -5.145 0.195 7.854 1.00 0.00 C ATOM 137 O GLN A 13 -4.615 1.304 7.932 1.00 0.00 O ATOM 138 CB GLN A 13 -5.269 -1.517 9.674 1.00 0.00 C ATOM 139 CG GLN A 13 -5.933 -1.983 10.959 1.00 0.00 C ATOM 140 CD GLN A 13 -5.719 -3.460 11.224 1.00 0.00 C ATOM 141 OE1 GLN A 13 -4.861 -4.095 10.610 1.00 0.00 O ATOM 142 NE2 GLN A 13 -6.500 -4.017 12.142 1.00 0.00 N ATOM 0 H GLN A 13 -7.376 -1.772 8.324 1.00 0.00 H new ATOM 0 HA GLN A 13 -6.140 0.447 9.728 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -5.218 -2.354 8.977 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -4.243 -1.221 9.892 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -5.540 -1.407 11.796 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -7.002 -1.779 10.906 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -7.198 -3.454 12.627 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -6.402 -5.008 12.362 1.00 0.00 H new ATOM 151 N LEU A 14 -5.020 -0.591 6.791 1.00 0.00 N ATOM 152 CA LEU A 14 -4.236 -0.189 5.628 1.00 0.00 C ATOM 153 C LEU A 14 -4.551 1.250 5.232 1.00 0.00 C ATOM 154 O LEU A 14 -3.694 2.131 5.321 1.00 0.00 O ATOM 155 CB LEU A 14 -4.514 -1.126 4.452 1.00 0.00 C ATOM 156 CG LEU A 14 -3.880 -0.733 3.117 1.00 0.00 C ATOM 157 CD1 LEU A 14 -2.369 -0.625 3.255 1.00 0.00 C ATOM 158 CD2 LEU A 14 -4.248 -1.739 2.036 1.00 0.00 C ATOM 0 H LEU A 14 -5.452 -1.512 6.710 1.00 0.00 H new ATOM 0 HA LEU A 14 -3.180 -0.252 5.892 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -4.165 -2.124 4.718 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -5.593 -1.193 4.313 1.00 0.00 H new ATOM 0 HG LEU A 14 -4.268 0.243 2.825 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -1.935 -0.345 2.295 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -2.125 0.133 3.999 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -1.963 -1.586 3.570 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -3.788 -1.444 1.093 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -3.888 -2.728 2.321 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -5.331 -1.767 1.919 1.00 0.00 H new ATOM 170 N VAL A 15 -5.785 1.483 4.797 1.00 0.00 N ATOM 171 CA VAL A 15 -6.214 2.816 4.391 1.00 0.00 C ATOM 172 C VAL A 15 -5.668 3.880 5.336 1.00 0.00 C ATOM 173 O VAL A 15 -5.081 4.871 4.901 1.00 0.00 O ATOM 174 CB VAL A 15 -7.750 2.922 4.347 1.00 0.00 C ATOM 175 CG1 VAL A 15 -8.183 4.378 4.263 1.00 0.00 C ATOM 176 CG2 VAL A 15 -8.305 2.124 3.177 1.00 0.00 C ATOM 0 H VAL A 15 -6.506 0.766 4.717 1.00 0.00 H new ATOM 0 HA VAL A 15 -5.817 2.986 3.390 1.00 0.00 H new ATOM 0 HB VAL A 15 -8.153 2.501 5.268 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -9.271 4.433 4.233 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -7.817 4.918 5.136 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.772 4.828 3.360 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -9.391 2.210 3.161 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -7.896 2.513 2.245 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -8.025 1.076 3.286 1.00 0.00 H new ATOM 186 N LYS A 16 -5.866 3.670 6.633 1.00 0.00 N ATOM 187 CA LYS A 16 -5.394 4.610 7.642 1.00 0.00 C ATOM 188 C LYS A 16 -3.929 4.968 7.408 1.00 0.00 C ATOM 189 O LYS A 16 -3.529 6.121 7.570 1.00 0.00 O ATOM 190 CB LYS A 16 -5.566 4.017 9.042 1.00 0.00 C ATOM 191 CG LYS A 16 -4.362 4.224 9.944 1.00 0.00 C ATOM 192 CD LYS A 16 -4.511 3.470 11.254 1.00 0.00 C ATOM 193 CE LYS A 16 -3.411 3.841 12.239 1.00 0.00 C ATOM 194 NZ LYS A 16 -3.726 3.382 13.620 1.00 0.00 N ATOM 0 H LYS A 16 -6.351 2.856 7.010 1.00 0.00 H new ATOM 0 HA LYS A 16 -5.991 5.519 7.563 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -6.442 4.465 9.512 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -5.763 2.949 8.953 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.460 3.890 9.431 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.237 5.288 10.147 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -5.484 3.690 11.693 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.483 2.397 11.063 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -2.469 3.398 11.915 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -3.272 4.922 12.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -2.953 3.654 14.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -4.612 3.824 13.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.833 2.348 13.626 1.00 0.00 H new ATOM 208 N ARG A 17 -3.135 3.974 7.026 1.00 0.00 N ATOM 209 CA ARG A 17 -1.715 4.185 6.770 1.00 0.00 C ATOM 210 C ARG A 17 -1.510 5.079 5.550 1.00 0.00 C ATOM 211 O ARG A 17 -1.053 6.216 5.671 1.00 0.00 O ATOM 212 CB ARG A 17 -1.009 2.845 6.557 1.00 0.00 C ATOM 213 CG ARG A 17 -1.407 1.780 7.564 1.00 0.00 C ATOM 214 CD ARG A 17 -0.574 0.518 7.402 1.00 0.00 C ATOM 215 NE ARG A 17 -0.481 -0.241 8.645 1.00 0.00 N ATOM 216 CZ ARG A 17 -0.035 -1.490 8.712 1.00 0.00 C ATOM 217 NH1 ARG A 17 0.357 -2.118 7.611 1.00 0.00 N ATOM 218 NH2 ARG A 17 0.020 -2.116 9.881 1.00 0.00 N ATOM 0 H ARG A 17 -3.451 3.014 6.887 1.00 0.00 H new ATOM 0 HA ARG A 17 -1.284 4.681 7.640 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -1.229 2.484 5.553 1.00 0.00 H new ATOM 0 HB3 ARG A 17 0.069 2.999 6.611 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -1.285 2.170 8.574 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -2.463 1.538 7.441 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -1.014 -0.109 6.627 1.00 0.00 H new ATOM 0 HD3 ARG A 17 0.428 0.786 7.065 1.00 0.00 H new ATOM 0 HE ARG A 17 -0.775 0.213 9.510 1.00 0.00 H new ATOM 0 HH11 ARG A 17 0.316 -1.641 6.710 1.00 0.00 H new ATOM 0 HH12 ARG A 17 0.699 -3.077 7.665 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -0.281 -1.638 10.730 1.00 0.00 H new ATOM 0 HH22 ARG A 17 0.363 -3.075 9.930 1.00 0.00 H new ATOM 232 N VAL A 18 -1.851 4.558 4.376 1.00 0.00 N ATOM 233 CA VAL A 18 -1.705 5.309 3.134 1.00 0.00 C ATOM 234 C VAL A 18 -2.076 6.774 3.332 1.00 0.00 C ATOM 235 O VAL A 18 -1.603 7.648 2.605 1.00 0.00 O ATOM 236 CB VAL A 18 -2.580 4.716 2.014 1.00 0.00 C ATOM 237 CG1 VAL A 18 -1.973 3.424 1.490 1.00 0.00 C ATOM 238 CG2 VAL A 18 -3.998 4.485 2.512 1.00 0.00 C ATOM 0 H VAL A 18 -2.230 3.619 4.258 1.00 0.00 H new ATOM 0 HA VAL A 18 -0.657 5.239 2.842 1.00 0.00 H new ATOM 0 HB VAL A 18 -2.620 5.430 1.191 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -2.605 3.020 0.699 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.978 3.624 1.093 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -1.900 2.701 2.302 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -4.602 4.066 1.708 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -3.980 3.791 3.352 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -4.430 5.433 2.834 1.00 0.00 H new ATOM 248 N ILE A 19 -2.924 7.036 4.321 1.00 0.00 N ATOM 249 CA ILE A 19 -3.357 8.396 4.615 1.00 0.00 C ATOM 250 C ILE A 19 -2.271 9.172 5.352 1.00 0.00 C ATOM 251 O ILE A 19 -1.710 10.130 4.820 1.00 0.00 O ATOM 252 CB ILE A 19 -4.644 8.408 5.461 1.00 0.00 C ATOM 253 CG1 ILE A 19 -5.779 7.705 4.713 1.00 0.00 C ATOM 254 CG2 ILE A 19 -5.036 9.835 5.811 1.00 0.00 C ATOM 255 CD1 ILE A 19 -6.557 8.623 3.796 1.00 0.00 C ATOM 0 H ILE A 19 -3.325 6.324 4.932 1.00 0.00 H new ATOM 0 HA ILE A 19 -3.557 8.876 3.657 1.00 0.00 H new ATOM 0 HB ILE A 19 -4.456 7.867 6.388 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -5.364 6.885 4.127 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -6.463 7.264 5.438 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -5.947 9.826 6.409 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.233 10.304 6.380 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.209 10.400 4.895 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.345 8.058 3.299 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.001 9.429 4.380 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.886 9.044 3.048 1.00 0.00 H new ATOM 267 N GLU A 20 -1.978 8.750 6.578 1.00 0.00 N ATOM 268 CA GLU A 20 -0.957 9.405 7.387 1.00 0.00 C ATOM 269 C GLU A 20 0.408 9.322 6.712 1.00 0.00 C ATOM 270 O GLU A 20 1.304 10.115 6.999 1.00 0.00 O ATOM 271 CB GLU A 20 -0.891 8.769 8.777 1.00 0.00 C ATOM 272 CG GLU A 20 -2.252 8.391 9.339 1.00 0.00 C ATOM 273 CD GLU A 20 -2.539 9.059 10.670 1.00 0.00 C ATOM 274 OE1 GLU A 20 -2.854 10.267 10.670 1.00 0.00 O ATOM 275 OE2 GLU A 20 -2.450 8.373 11.710 1.00 0.00 O ATOM 0 H GLU A 20 -2.433 7.958 7.032 1.00 0.00 H new ATOM 0 HA GLU A 20 -1.229 10.456 7.489 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -0.266 7.877 8.730 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -0.404 9.463 9.462 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -3.026 8.668 8.623 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -2.303 7.309 9.461 1.00 0.00 H new ATOM 282 N GLY A 21 0.559 8.354 5.812 1.00 0.00 N ATOM 283 CA GLY A 21 1.819 8.183 5.111 1.00 0.00 C ATOM 284 C GLY A 21 2.808 7.340 5.892 1.00 0.00 C ATOM 285 O GLY A 21 3.902 7.051 5.410 1.00 0.00 O ATOM 0 H GLY A 21 -0.168 7.686 5.556 1.00 0.00 H new ATOM 0 HA2 GLY A 21 1.633 7.716 4.144 1.00 0.00 H new ATOM 0 HA3 GLY A 21 2.257 9.161 4.913 1.00 0.00 H new ATOM 289 N SER A 22 2.422 6.948 7.102 1.00 0.00 N ATOM 290 CA SER A 22 3.286 6.138 7.953 1.00 0.00 C ATOM 291 C SER A 22 4.040 5.097 7.130 1.00 0.00 C ATOM 292 O SER A 22 5.123 4.651 7.512 1.00 0.00 O ATOM 293 CB SER A 22 2.462 5.445 9.039 1.00 0.00 C ATOM 294 OG SER A 22 3.266 4.563 9.805 1.00 0.00 O ATOM 0 H SER A 22 1.518 7.178 7.515 1.00 0.00 H new ATOM 0 HA SER A 22 4.013 6.800 8.424 1.00 0.00 H new ATOM 0 HB2 SER A 22 2.013 6.193 9.692 1.00 0.00 H new ATOM 0 HB3 SER A 22 1.643 4.890 8.580 1.00 0.00 H new ATOM 0 HG SER A 22 2.716 4.134 10.493 1.00 0.00 H new ATOM 300 N LEU A 23 3.460 4.715 5.998 1.00 0.00 N ATOM 301 CA LEU A 23 4.076 3.727 5.118 1.00 0.00 C ATOM 302 C LEU A 23 4.665 4.393 3.878 1.00 0.00 C ATOM 303 O LEU A 23 4.058 5.294 3.298 1.00 0.00 O ATOM 304 CB LEU A 23 3.048 2.672 4.704 1.00 0.00 C ATOM 305 CG LEU A 23 2.260 2.967 3.427 1.00 0.00 C ATOM 306 CD1 LEU A 23 1.685 1.684 2.847 1.00 0.00 C ATOM 307 CD2 LEU A 23 1.154 3.974 3.703 1.00 0.00 C ATOM 0 H LEU A 23 2.564 5.074 5.667 1.00 0.00 H new ATOM 0 HA LEU A 23 4.884 3.243 5.666 1.00 0.00 H new ATOM 0 HB2 LEU A 23 3.565 1.721 4.577 1.00 0.00 H new ATOM 0 HB3 LEU A 23 2.340 2.543 5.522 1.00 0.00 H new ATOM 0 HG LEU A 23 2.941 3.399 2.694 1.00 0.00 H new ATOM 0 HD11 LEU A 23 1.128 1.913 1.939 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.497 0.996 2.611 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.018 1.222 3.575 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.604 4.172 2.783 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.474 3.571 4.453 1.00 0.00 H new ATOM 0 HD23 LEU A 23 1.591 4.902 4.071 1.00 0.00 H new ATOM 319 N SER A 24 5.848 3.943 3.476 1.00 0.00 N ATOM 320 CA SER A 24 6.521 4.496 2.306 1.00 0.00 C ATOM 321 C SER A 24 5.614 4.436 1.081 1.00 0.00 C ATOM 322 O SER A 24 4.643 3.680 1.031 1.00 0.00 O ATOM 323 CB SER A 24 7.820 3.737 2.031 1.00 0.00 C ATOM 324 OG SER A 24 7.766 2.424 2.564 1.00 0.00 O ATOM 0 H SER A 24 6.362 3.196 3.943 1.00 0.00 H new ATOM 0 HA SER A 24 6.757 5.540 2.512 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.997 3.690 0.956 1.00 0.00 H new ATOM 0 HB3 SER A 24 8.660 4.276 2.469 1.00 0.00 H new ATOM 0 HG SER A 24 8.607 1.959 2.374 1.00 0.00 H new ATOM 330 N PRO A 25 5.937 5.252 0.066 1.00 0.00 N ATOM 331 CA PRO A 25 5.166 5.310 -1.179 1.00 0.00 C ATOM 332 C PRO A 25 5.321 4.046 -2.018 1.00 0.00 C ATOM 333 O PRO A 25 4.460 3.721 -2.836 1.00 0.00 O ATOM 334 CB PRO A 25 5.765 6.515 -1.911 1.00 0.00 C ATOM 335 CG PRO A 25 7.150 6.632 -1.375 1.00 0.00 C ATOM 336 CD PRO A 25 7.081 6.179 0.057 1.00 0.00 C ATOM 0 HA PRO A 25 4.096 5.396 -0.991 1.00 0.00 H new ATOM 0 HB2 PRO A 25 5.770 6.361 -2.990 1.00 0.00 H new ATOM 0 HB3 PRO A 25 5.189 7.421 -1.721 1.00 0.00 H new ATOM 0 HG2 PRO A 25 7.843 6.014 -1.946 1.00 0.00 H new ATOM 0 HG3 PRO A 25 7.509 7.659 -1.442 1.00 0.00 H new ATOM 0 HD2 PRO A 25 8.002 5.684 0.367 1.00 0.00 H new ATOM 0 HD3 PRO A 25 6.925 7.017 0.737 1.00 0.00 H new ATOM 344 N LYS A 26 6.424 3.336 -1.809 1.00 0.00 N ATOM 345 CA LYS A 26 6.693 2.105 -2.544 1.00 0.00 C ATOM 346 C LYS A 26 5.919 0.934 -1.945 1.00 0.00 C ATOM 347 O LYS A 26 5.402 0.086 -2.671 1.00 0.00 O ATOM 348 CB LYS A 26 8.192 1.798 -2.535 1.00 0.00 C ATOM 349 CG LYS A 26 8.609 0.771 -3.574 1.00 0.00 C ATOM 350 CD LYS A 26 8.802 1.408 -4.940 1.00 0.00 C ATOM 351 CE LYS A 26 8.777 0.367 -6.048 1.00 0.00 C ATOM 352 NZ LYS A 26 9.653 0.750 -7.190 1.00 0.00 N ATOM 0 H LYS A 26 7.147 3.592 -1.136 1.00 0.00 H new ATOM 0 HA LYS A 26 6.364 2.247 -3.574 1.00 0.00 H new ATOM 0 HB2 LYS A 26 8.745 2.722 -2.707 1.00 0.00 H new ATOM 0 HB3 LYS A 26 8.475 1.437 -1.546 1.00 0.00 H new ATOM 0 HG2 LYS A 26 9.536 0.291 -3.261 1.00 0.00 H new ATOM 0 HG3 LYS A 26 7.852 -0.010 -3.639 1.00 0.00 H new ATOM 0 HD2 LYS A 26 8.017 2.145 -5.113 1.00 0.00 H new ATOM 0 HD3 LYS A 26 9.752 1.942 -4.963 1.00 0.00 H new ATOM 0 HE2 LYS A 26 9.100 -0.595 -5.650 1.00 0.00 H new ATOM 0 HE3 LYS A 26 7.754 0.238 -6.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 9.608 0.015 -7.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 9.330 1.655 -7.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 10.634 0.848 -6.858 1.00 0.00 H new ATOM 366 N GLU A 27 5.845 0.896 -0.619 1.00 0.00 N ATOM 367 CA GLU A 27 5.133 -0.171 0.076 1.00 0.00 C ATOM 368 C GLU A 27 3.711 -0.313 -0.457 1.00 0.00 C ATOM 369 O GLU A 27 3.219 -1.425 -0.657 1.00 0.00 O ATOM 370 CB GLU A 27 5.101 0.102 1.580 1.00 0.00 C ATOM 371 CG GLU A 27 6.009 -0.813 2.386 1.00 0.00 C ATOM 372 CD GLU A 27 5.305 -2.075 2.846 1.00 0.00 C ATOM 373 OE1 GLU A 27 4.448 -1.981 3.748 1.00 0.00 O ATOM 374 OE2 GLU A 27 5.611 -3.156 2.301 1.00 0.00 O ATOM 0 H GLU A 27 6.269 1.591 -0.004 1.00 0.00 H new ATOM 0 HA GLU A 27 5.665 -1.105 -0.105 1.00 0.00 H new ATOM 0 HB2 GLU A 27 5.392 1.137 1.759 1.00 0.00 H new ATOM 0 HB3 GLU A 27 4.078 -0.008 1.939 1.00 0.00 H new ATOM 0 HG2 GLU A 27 6.875 -1.084 1.782 1.00 0.00 H new ATOM 0 HG3 GLU A 27 6.384 -0.273 3.255 1.00 0.00 H new ATOM 381 N ARG A 28 3.055 0.820 -0.685 1.00 0.00 N ATOM 382 CA ARG A 28 1.689 0.822 -1.193 1.00 0.00 C ATOM 383 C ARG A 28 1.583 0.000 -2.475 1.00 0.00 C ATOM 384 O ARG A 28 0.727 -0.878 -2.594 1.00 0.00 O ATOM 385 CB ARG A 28 1.221 2.256 -1.455 1.00 0.00 C ATOM 386 CG ARG A 28 1.097 3.096 -0.195 1.00 0.00 C ATOM 387 CD ARG A 28 0.672 4.520 -0.514 1.00 0.00 C ATOM 388 NE ARG A 28 1.577 5.162 -1.463 1.00 0.00 N ATOM 389 CZ ARG A 28 1.386 6.383 -1.951 1.00 0.00 C ATOM 390 NH1 ARG A 28 0.327 7.090 -1.580 1.00 0.00 N ATOM 391 NH2 ARG A 28 2.255 6.899 -2.810 1.00 0.00 N ATOM 0 H ARG A 28 3.447 1.748 -0.526 1.00 0.00 H new ATOM 0 HA ARG A 28 1.047 0.369 -0.437 1.00 0.00 H new ATOM 0 HB2 ARG A 28 1.922 2.739 -2.136 1.00 0.00 H new ATOM 0 HB3 ARG A 28 0.255 2.228 -1.959 1.00 0.00 H new ATOM 0 HG2 ARG A 28 0.370 2.640 0.477 1.00 0.00 H new ATOM 0 HG3 ARG A 28 2.052 3.109 0.330 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -0.338 4.514 -0.924 1.00 0.00 H new ATOM 0 HD3 ARG A 28 0.639 5.103 0.406 1.00 0.00 H new ATOM 0 HE ARG A 28 2.401 4.645 -1.768 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -0.343 6.697 -0.919 1.00 0.00 H new ATOM 0 HH12 ARG A 28 0.182 8.027 -1.956 1.00 0.00 H new ATOM 0 HH21 ARG A 28 3.071 6.358 -3.097 1.00 0.00 H new ATOM 0 HH22 ARG A 28 2.107 7.836 -3.184 1.00 0.00 H new ATOM 405 N THR A 29 2.460 0.289 -3.432 1.00 0.00 N ATOM 406 CA THR A 29 2.464 -0.421 -4.705 1.00 0.00 C ATOM 407 C THR A 29 2.854 -1.883 -4.516 1.00 0.00 C ATOM 408 O THR A 29 2.544 -2.732 -5.353 1.00 0.00 O ATOM 409 CB THR A 29 3.431 0.232 -5.708 1.00 0.00 C ATOM 410 OG1 THR A 29 2.846 1.421 -6.251 1.00 0.00 O ATOM 411 CG2 THR A 29 3.773 -0.731 -6.836 1.00 0.00 C ATOM 0 H THR A 29 3.177 1.010 -3.349 1.00 0.00 H new ATOM 0 HA THR A 29 1.450 -0.367 -5.102 1.00 0.00 H new ATOM 0 HB THR A 29 4.349 0.488 -5.179 1.00 0.00 H new ATOM 0 HG1 THR A 29 3.469 1.831 -6.887 1.00 0.00 H new ATOM 0 HG21 THR A 29 4.458 -0.247 -7.532 1.00 0.00 H new ATOM 0 HG22 THR A 29 4.245 -1.622 -6.423 1.00 0.00 H new ATOM 0 HG23 THR A 29 2.861 -1.014 -7.362 1.00 0.00 H new ATOM 419 N LEU A 30 3.537 -2.171 -3.413 1.00 0.00 N ATOM 420 CA LEU A 30 3.969 -3.531 -3.114 1.00 0.00 C ATOM 421 C LEU A 30 2.828 -4.348 -2.518 1.00 0.00 C ATOM 422 O LEU A 30 2.747 -5.561 -2.717 1.00 0.00 O ATOM 423 CB LEU A 30 5.155 -3.510 -2.148 1.00 0.00 C ATOM 424 CG LEU A 30 6.439 -2.868 -2.676 1.00 0.00 C ATOM 425 CD1 LEU A 30 7.417 -2.618 -1.538 1.00 0.00 C ATOM 426 CD2 LEU A 30 7.075 -3.746 -3.745 1.00 0.00 C ATOM 0 H LEU A 30 3.803 -1.480 -2.711 1.00 0.00 H new ATOM 0 HA LEU A 30 4.277 -4.000 -4.048 1.00 0.00 H new ATOM 0 HB2 LEU A 30 4.853 -2.981 -1.244 1.00 0.00 H new ATOM 0 HB3 LEU A 30 5.379 -4.536 -1.856 1.00 0.00 H new ATOM 0 HG LEU A 30 6.184 -1.909 -3.127 1.00 0.00 H new ATOM 0 HD11 LEU A 30 8.325 -2.161 -1.932 1.00 0.00 H new ATOM 0 HD12 LEU A 30 6.962 -1.949 -0.807 1.00 0.00 H new ATOM 0 HD13 LEU A 30 7.666 -3.564 -1.058 1.00 0.00 H new ATOM 0 HD21 LEU A 30 7.987 -3.273 -4.109 1.00 0.00 H new ATOM 0 HD22 LEU A 30 7.316 -4.720 -3.320 1.00 0.00 H new ATOM 0 HD23 LEU A 30 6.378 -3.874 -4.573 1.00 0.00 H new ATOM 438 N LEU A 31 1.946 -3.674 -1.787 1.00 0.00 N ATOM 439 CA LEU A 31 0.805 -4.337 -1.162 1.00 0.00 C ATOM 440 C LEU A 31 0.150 -5.319 -2.128 1.00 0.00 C ATOM 441 O LEU A 31 -0.187 -6.443 -1.753 1.00 0.00 O ATOM 442 CB LEU A 31 -0.220 -3.300 -0.698 1.00 0.00 C ATOM 443 CG LEU A 31 0.249 -2.333 0.390 1.00 0.00 C ATOM 444 CD1 LEU A 31 -0.752 -1.202 0.566 1.00 0.00 C ATOM 445 CD2 LEU A 31 0.459 -3.071 1.705 1.00 0.00 C ATOM 0 H LEU A 31 1.998 -2.670 -1.612 1.00 0.00 H new ATOM 0 HA LEU A 31 1.167 -4.893 -0.298 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.534 -2.717 -1.564 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -1.101 -3.828 -0.332 1.00 0.00 H new ATOM 0 HG LEU A 31 1.202 -1.903 0.081 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -0.402 -0.524 1.344 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -0.853 -0.656 -0.372 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -1.720 -1.614 0.852 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.793 -2.367 2.468 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -0.479 -3.529 2.019 1.00 0.00 H new ATOM 0 HD23 LEU A 31 1.214 -3.846 1.571 1.00 0.00 H new ATOM 457 N LYS A 32 -0.025 -4.890 -3.373 1.00 0.00 N ATOM 458 CA LYS A 32 -0.636 -5.731 -4.395 1.00 0.00 C ATOM 459 C LYS A 32 0.104 -7.059 -4.519 1.00 0.00 C ATOM 460 O LYS A 32 -0.510 -8.103 -4.735 1.00 0.00 O ATOM 461 CB LYS A 32 -0.640 -5.009 -5.745 1.00 0.00 C ATOM 462 CG LYS A 32 -1.169 -3.588 -5.672 1.00 0.00 C ATOM 463 CD LYS A 32 -2.187 -3.316 -6.766 1.00 0.00 C ATOM 464 CE LYS A 32 -2.745 -1.903 -6.671 1.00 0.00 C ATOM 465 NZ LYS A 32 -2.552 -1.145 -7.938 1.00 0.00 N ATOM 0 H LYS A 32 0.248 -3.963 -3.699 1.00 0.00 H new ATOM 0 HA LYS A 32 -1.664 -5.934 -4.096 1.00 0.00 H new ATOM 0 HB2 LYS A 32 0.376 -4.990 -6.141 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -1.246 -5.578 -6.450 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -1.627 -3.419 -4.697 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.341 -2.885 -5.761 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -1.722 -3.460 -7.741 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -3.002 -4.036 -6.693 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -3.808 -1.947 -6.432 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -2.256 -1.374 -5.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -2.945 -0.188 -7.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -1.536 -1.081 -8.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -3.040 -1.636 -8.714 1.00 0.00 H new ATOM 479 N GLU A 33 1.426 -7.012 -4.380 1.00 0.00 N ATOM 480 CA GLU A 33 2.248 -8.212 -4.476 1.00 0.00 C ATOM 481 C GLU A 33 2.022 -9.123 -3.273 1.00 0.00 C ATOM 482 O GLU A 33 2.349 -10.310 -3.310 1.00 0.00 O ATOM 483 CB GLU A 33 3.728 -7.836 -4.577 1.00 0.00 C ATOM 484 CG GLU A 33 4.024 -6.812 -5.658 1.00 0.00 C ATOM 485 CD GLU A 33 5.469 -6.849 -6.117 1.00 0.00 C ATOM 486 OE1 GLU A 33 5.961 -7.948 -6.443 1.00 0.00 O ATOM 487 OE2 GLU A 33 6.108 -5.775 -6.149 1.00 0.00 O ATOM 0 H GLU A 33 1.950 -6.155 -4.201 1.00 0.00 H new ATOM 0 HA GLU A 33 1.956 -8.751 -5.377 1.00 0.00 H new ATOM 0 HB2 GLU A 33 4.061 -7.444 -3.616 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.310 -8.737 -4.772 1.00 0.00 H new ATOM 0 HG2 GLU A 33 3.371 -6.992 -6.512 1.00 0.00 H new ATOM 0 HG3 GLU A 33 3.791 -5.815 -5.283 1.00 0.00 H new ATOM 494 N ASP A 34 1.465 -8.559 -2.207 1.00 0.00 N ATOM 495 CA ASP A 34 1.196 -9.319 -0.992 1.00 0.00 C ATOM 496 C ASP A 34 -0.133 -10.060 -1.098 1.00 0.00 C ATOM 497 O ASP A 34 -1.101 -9.570 -1.681 1.00 0.00 O ATOM 498 CB ASP A 34 1.181 -8.391 0.223 1.00 0.00 C ATOM 499 CG ASP A 34 1.941 -8.968 1.401 1.00 0.00 C ATOM 500 OD1 ASP A 34 2.932 -9.693 1.171 1.00 0.00 O ATOM 501 OD2 ASP A 34 1.544 -8.696 2.554 1.00 0.00 O ATOM 0 H ASP A 34 1.191 -7.578 -2.160 1.00 0.00 H new ATOM 0 HA ASP A 34 1.992 -10.053 -0.868 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.617 -7.430 -0.052 1.00 0.00 H new ATOM 0 HB3 ASP A 34 0.149 -8.200 0.518 1.00 0.00 H new ATOM 506 N PRO A 35 -0.185 -11.271 -0.523 1.00 0.00 N ATOM 507 CA PRO A 35 -1.390 -12.105 -0.540 1.00 0.00 C ATOM 508 C PRO A 35 -2.502 -11.535 0.334 1.00 0.00 C ATOM 509 O PRO A 35 -3.684 -11.748 0.068 1.00 0.00 O ATOM 510 CB PRO A 35 -0.903 -13.443 0.022 1.00 0.00 C ATOM 511 CG PRO A 35 0.278 -13.095 0.860 1.00 0.00 C ATOM 512 CD PRO A 35 0.930 -11.918 0.189 1.00 0.00 C ATOM 0 HA PRO A 35 -1.821 -12.177 -1.538 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -1.678 -13.930 0.614 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -0.632 -14.133 -0.777 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -0.025 -12.846 1.877 1.00 0.00 H new ATOM 0 HG3 PRO A 35 0.968 -13.936 0.930 1.00 0.00 H new ATOM 0 HD2 PRO A 35 1.388 -11.245 0.914 1.00 0.00 H new ATOM 0 HD3 PRO A 35 1.717 -12.232 -0.497 1.00 0.00 H new ATOM 520 N ALA A 36 -2.115 -10.808 1.378 1.00 0.00 N ATOM 521 CA ALA A 36 -3.079 -10.205 2.289 1.00 0.00 C ATOM 522 C ALA A 36 -3.889 -9.118 1.589 1.00 0.00 C ATOM 523 O ALA A 36 -5.040 -8.863 1.945 1.00 0.00 O ATOM 524 CB ALA A 36 -2.370 -9.635 3.508 1.00 0.00 C ATOM 0 H ALA A 36 -1.140 -10.623 1.613 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.769 -10.983 2.616 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.103 -9.188 4.179 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.841 -10.434 4.028 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -1.657 -8.874 3.191 1.00 0.00 H new ATOM 530 N TYR A 37 -3.281 -8.481 0.595 1.00 0.00 N ATOM 531 CA TYR A 37 -3.945 -7.419 -0.152 1.00 0.00 C ATOM 532 C TYR A 37 -4.227 -7.856 -1.586 1.00 0.00 C ATOM 533 O TYR A 37 -3.812 -7.198 -2.540 1.00 0.00 O ATOM 534 CB TYR A 37 -3.085 -6.153 -0.151 1.00 0.00 C ATOM 535 CG TYR A 37 -2.623 -5.736 1.226 1.00 0.00 C ATOM 536 CD1 TYR A 37 -3.515 -5.201 2.148 1.00 0.00 C ATOM 537 CD2 TYR A 37 -1.294 -5.874 1.606 1.00 0.00 C ATOM 538 CE1 TYR A 37 -3.096 -4.817 3.407 1.00 0.00 C ATOM 539 CE2 TYR A 37 -0.866 -5.495 2.863 1.00 0.00 C ATOM 540 CZ TYR A 37 -1.772 -4.967 3.760 1.00 0.00 C ATOM 541 OH TYR A 37 -1.350 -4.587 5.014 1.00 0.00 O ATOM 0 H TYR A 37 -2.329 -8.681 0.288 1.00 0.00 H new ATOM 0 HA TYR A 37 -4.896 -7.205 0.336 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -2.213 -6.316 -0.784 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -3.654 -5.337 -0.597 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -4.553 -5.084 1.875 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -0.582 -6.285 0.905 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -3.802 -4.402 4.111 1.00 0.00 H new ATOM 0 HE2 TYR A 37 0.171 -5.611 3.142 1.00 0.00 H new ATOM 0 HH TYR A 37 -0.389 -4.760 5.102 1.00 0.00 H new ATOM 551 N TRP A 38 -4.935 -8.970 -1.730 1.00 0.00 N ATOM 552 CA TRP A 38 -5.274 -9.495 -3.047 1.00 0.00 C ATOM 553 C TRP A 38 -6.448 -8.733 -3.652 1.00 0.00 C ATOM 554 O TRP A 38 -6.488 -8.493 -4.859 1.00 0.00 O ATOM 555 CB TRP A 38 -5.611 -10.984 -2.953 1.00 0.00 C ATOM 556 CG TRP A 38 -6.788 -11.272 -2.071 1.00 0.00 C ATOM 557 CD1 TRP A 38 -6.756 -11.750 -0.791 1.00 0.00 C ATOM 558 CD2 TRP A 38 -8.170 -11.103 -2.402 1.00 0.00 C ATOM 559 NE1 TRP A 38 -8.035 -11.887 -0.308 1.00 0.00 N ATOM 560 CE2 TRP A 38 -8.921 -11.497 -1.277 1.00 0.00 C ATOM 561 CE3 TRP A 38 -8.847 -10.655 -3.540 1.00 0.00 C ATOM 562 CZ2 TRP A 38 -10.312 -11.456 -1.259 1.00 0.00 C ATOM 563 CZ3 TRP A 38 -10.229 -10.616 -3.521 1.00 0.00 C ATOM 564 CH2 TRP A 38 -10.950 -11.014 -2.386 1.00 0.00 C ATOM 0 H TRP A 38 -5.285 -9.527 -0.951 1.00 0.00 H new ATOM 0 HA TRP A 38 -4.408 -9.365 -3.696 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -5.813 -11.367 -3.953 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -4.742 -11.523 -2.575 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -5.857 -11.985 -0.240 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -8.284 -12.225 0.622 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -8.300 -10.345 -4.418 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -10.869 -11.762 -0.386 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -10.762 -10.273 -4.395 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -12.029 -10.971 -2.402 1.00 0.00 H new ATOM 575 N PHE A 39 -7.401 -8.354 -2.807 1.00 0.00 N ATOM 576 CA PHE A 39 -8.575 -7.619 -3.259 1.00 0.00 C ATOM 577 C PHE A 39 -8.170 -6.391 -4.069 1.00 0.00 C ATOM 578 O PHE A 39 -8.893 -5.959 -4.968 1.00 0.00 O ATOM 579 CB PHE A 39 -9.430 -7.196 -2.063 1.00 0.00 C ATOM 580 CG PHE A 39 -8.642 -6.545 -0.963 1.00 0.00 C ATOM 581 CD1 PHE A 39 -8.387 -5.183 -0.988 1.00 0.00 C ATOM 582 CD2 PHE A 39 -8.156 -7.295 0.096 1.00 0.00 C ATOM 583 CE1 PHE A 39 -7.661 -4.582 0.024 1.00 0.00 C ATOM 584 CE2 PHE A 39 -7.430 -6.699 1.110 1.00 0.00 C ATOM 585 CZ PHE A 39 -7.182 -5.340 1.073 1.00 0.00 C ATOM 0 H PHE A 39 -7.383 -8.544 -1.805 1.00 0.00 H new ATOM 0 HA PHE A 39 -9.160 -8.278 -3.900 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -10.201 -6.505 -2.404 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -9.941 -8.072 -1.664 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -8.759 -4.585 -1.806 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -8.347 -8.358 0.129 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -7.469 -3.520 -0.007 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -7.057 -7.295 1.930 1.00 0.00 H new ATOM 0 HZ PHE A 39 -6.614 -4.872 1.864 1.00 0.00 H new ATOM 595 N LEU A 40 -7.010 -5.832 -3.744 1.00 0.00 N ATOM 596 CA LEU A 40 -6.508 -4.653 -4.439 1.00 0.00 C ATOM 597 C LEU A 40 -6.683 -4.795 -5.948 1.00 0.00 C ATOM 598 O LEU A 40 -7.186 -3.888 -6.612 1.00 0.00 O ATOM 599 CB LEU A 40 -5.032 -4.429 -4.105 1.00 0.00 C ATOM 600 CG LEU A 40 -4.719 -4.077 -2.649 1.00 0.00 C ATOM 601 CD1 LEU A 40 -3.220 -3.910 -2.451 1.00 0.00 C ATOM 602 CD2 LEU A 40 -5.457 -2.811 -2.237 1.00 0.00 C ATOM 0 H LEU A 40 -6.399 -6.177 -3.003 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.085 -3.791 -4.104 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.480 -5.332 -4.366 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -4.654 -3.629 -4.741 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.060 -4.896 -2.015 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -3.016 -3.660 -1.410 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -2.713 -4.841 -2.707 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.855 -3.110 -3.095 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -5.223 -2.575 -1.199 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -5.146 -1.984 -2.876 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -6.531 -2.966 -2.341 1.00 0.00 H new ATOM 614 N SER A 41 -6.267 -5.939 -6.481 1.00 0.00 N ATOM 615 CA SER A 41 -6.377 -6.199 -7.912 1.00 0.00 C ATOM 616 C SER A 41 -7.839 -6.234 -8.348 1.00 0.00 C ATOM 617 O SER A 41 -8.192 -5.739 -9.417 1.00 0.00 O ATOM 618 CB SER A 41 -5.695 -7.522 -8.265 1.00 0.00 C ATOM 619 OG SER A 41 -4.285 -7.403 -8.200 1.00 0.00 O ATOM 0 H SER A 41 -5.851 -6.700 -5.944 1.00 0.00 H new ATOM 0 HA SER A 41 -5.878 -5.388 -8.443 1.00 0.00 H new ATOM 0 HB2 SER A 41 -6.029 -8.301 -7.580 1.00 0.00 H new ATOM 0 HB3 SER A 41 -5.991 -7.831 -9.267 1.00 0.00 H new ATOM 0 HG SER A 41 -3.873 -8.263 -8.428 1.00 0.00 H new ATOM 625 N ASP A 42 -8.684 -6.825 -7.510 1.00 0.00 N ATOM 626 CA ASP A 42 -10.108 -6.926 -7.807 1.00 0.00 C ATOM 627 C ASP A 42 -10.813 -5.599 -7.542 1.00 0.00 C ATOM 628 O ASP A 42 -10.344 -4.784 -6.749 1.00 0.00 O ATOM 629 CB ASP A 42 -10.749 -8.034 -6.968 1.00 0.00 C ATOM 630 CG ASP A 42 -11.887 -8.724 -7.693 1.00 0.00 C ATOM 631 OD1 ASP A 42 -12.757 -8.016 -8.241 1.00 0.00 O ATOM 632 OD2 ASP A 42 -11.908 -9.973 -7.711 1.00 0.00 O ATOM 0 H ASP A 42 -8.408 -7.241 -6.621 1.00 0.00 H new ATOM 0 HA ASP A 42 -10.217 -7.171 -8.863 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -9.990 -8.771 -6.704 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -11.120 -7.610 -6.035 1.00 0.00 H new ATOM 637 N GLU A 43 -11.941 -5.390 -8.213 1.00 0.00 N ATOM 638 CA GLU A 43 -12.710 -4.161 -8.052 1.00 0.00 C ATOM 639 C GLU A 43 -14.157 -4.469 -7.678 1.00 0.00 C ATOM 640 O GLU A 43 -14.772 -3.751 -6.891 1.00 0.00 O ATOM 641 CB GLU A 43 -12.669 -3.335 -9.339 1.00 0.00 C ATOM 642 CG GLU A 43 -11.412 -2.495 -9.483 1.00 0.00 C ATOM 643 CD GLU A 43 -11.602 -1.314 -10.414 1.00 0.00 C ATOM 644 OE1 GLU A 43 -11.890 -1.540 -11.608 1.00 0.00 O ATOM 645 OE2 GLU A 43 -11.465 -0.162 -9.948 1.00 0.00 O ATOM 0 H GLU A 43 -12.343 -6.056 -8.873 1.00 0.00 H new ATOM 0 HA GLU A 43 -12.259 -3.584 -7.244 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -12.747 -4.006 -10.194 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -13.539 -2.679 -9.368 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -11.107 -2.133 -8.501 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -10.602 -3.121 -9.857 1.00 0.00 H new ATOM 652 N ASN A 44 -14.694 -5.542 -8.249 1.00 0.00 N ATOM 653 CA ASN A 44 -16.069 -5.946 -7.977 1.00 0.00 C ATOM 654 C ASN A 44 -16.148 -6.788 -6.708 1.00 0.00 C ATOM 655 O ASN A 44 -16.786 -7.841 -6.688 1.00 0.00 O ATOM 656 CB ASN A 44 -16.635 -6.733 -9.161 1.00 0.00 C ATOM 657 CG ASN A 44 -16.451 -6.006 -10.479 1.00 0.00 C ATOM 658 OD1 ASN A 44 -17.081 -4.977 -10.727 1.00 0.00 O ATOM 659 ND2 ASN A 44 -15.586 -6.539 -11.334 1.00 0.00 N ATOM 0 H ASN A 44 -14.198 -6.148 -8.903 1.00 0.00 H new ATOM 0 HA ASN A 44 -16.664 -5.044 -7.831 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -16.146 -7.706 -9.214 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -17.696 -6.918 -8.996 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -15.422 -6.094 -12.237 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -15.086 -7.393 -11.087 1.00 0.00 H new ATOM 666 N SER A 45 -15.496 -6.317 -5.650 1.00 0.00 N ATOM 667 CA SER A 45 -15.489 -7.028 -4.377 1.00 0.00 C ATOM 668 C SER A 45 -15.810 -6.081 -3.224 1.00 0.00 C ATOM 669 O SER A 45 -16.118 -4.907 -3.436 1.00 0.00 O ATOM 670 CB SER A 45 -14.129 -7.688 -4.145 1.00 0.00 C ATOM 671 OG SER A 45 -13.079 -6.742 -4.241 1.00 0.00 O ATOM 0 H SER A 45 -14.966 -5.446 -5.649 1.00 0.00 H new ATOM 0 HA SER A 45 -16.258 -7.800 -4.416 1.00 0.00 H new ATOM 0 HB2 SER A 45 -14.112 -8.156 -3.161 1.00 0.00 H new ATOM 0 HB3 SER A 45 -13.976 -8.481 -4.878 1.00 0.00 H new ATOM 0 HG SER A 45 -12.221 -7.189 -4.087 1.00 0.00 H new ATOM 677 N LEU A 46 -15.735 -6.599 -2.003 1.00 0.00 N ATOM 678 CA LEU A 46 -16.019 -5.801 -0.815 1.00 0.00 C ATOM 679 C LEU A 46 -14.728 -5.274 -0.194 1.00 0.00 C ATOM 680 O LEU A 46 -14.634 -4.101 0.162 1.00 0.00 O ATOM 681 CB LEU A 46 -16.789 -6.633 0.211 1.00 0.00 C ATOM 682 CG LEU A 46 -16.546 -6.283 1.679 1.00 0.00 C ATOM 683 CD1 LEU A 46 -15.243 -6.897 2.167 1.00 0.00 C ATOM 684 CD2 LEU A 46 -16.530 -4.773 1.871 1.00 0.00 C ATOM 0 H LEU A 46 -15.480 -7.567 -1.810 1.00 0.00 H new ATOM 0 HA LEU A 46 -16.631 -4.951 -1.116 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -17.855 -6.531 0.006 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -16.535 -7.682 0.062 1.00 0.00 H new ATOM 0 HG LEU A 46 -17.362 -6.697 2.271 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -15.088 -6.637 3.214 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -15.291 -7.981 2.066 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -14.415 -6.514 1.571 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -16.356 -4.542 2.922 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -15.734 -4.338 1.267 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -17.489 -4.357 1.562 1.00 0.00 H new ATOM 696 N GLU A 47 -13.737 -6.151 -0.068 1.00 0.00 N ATOM 697 CA GLU A 47 -12.452 -5.773 0.509 1.00 0.00 C ATOM 698 C GLU A 47 -11.828 -4.615 -0.264 1.00 0.00 C ATOM 699 O GLU A 47 -11.072 -3.819 0.293 1.00 0.00 O ATOM 700 CB GLU A 47 -11.499 -6.970 0.515 1.00 0.00 C ATOM 701 CG GLU A 47 -11.986 -8.133 1.361 1.00 0.00 C ATOM 702 CD GLU A 47 -11.032 -8.476 2.488 1.00 0.00 C ATOM 703 OE1 GLU A 47 -10.322 -7.566 2.962 1.00 0.00 O ATOM 704 OE2 GLU A 47 -10.995 -9.656 2.895 1.00 0.00 O ATOM 0 H GLU A 47 -13.799 -7.127 -0.357 1.00 0.00 H new ATOM 0 HA GLU A 47 -12.624 -5.450 1.536 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -11.354 -7.313 -0.509 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.526 -6.646 0.884 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -12.963 -7.889 1.779 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -12.121 -9.008 0.725 1.00 0.00 H new ATOM 711 N TYR A 48 -12.150 -4.528 -1.550 1.00 0.00 N ATOM 712 CA TYR A 48 -11.619 -3.470 -2.401 1.00 0.00 C ATOM 713 C TYR A 48 -12.478 -2.212 -2.306 1.00 0.00 C ATOM 714 O TYR A 48 -12.006 -1.103 -2.554 1.00 0.00 O ATOM 715 CB TYR A 48 -11.547 -3.943 -3.853 1.00 0.00 C ATOM 716 CG TYR A 48 -11.096 -2.870 -4.818 1.00 0.00 C ATOM 717 CD1 TYR A 48 -11.993 -1.928 -5.308 1.00 0.00 C ATOM 718 CD2 TYR A 48 -9.775 -2.797 -5.241 1.00 0.00 C ATOM 719 CE1 TYR A 48 -11.587 -0.945 -6.190 1.00 0.00 C ATOM 720 CE2 TYR A 48 -9.360 -1.818 -6.122 1.00 0.00 C ATOM 721 CZ TYR A 48 -10.270 -0.894 -6.594 1.00 0.00 C ATOM 722 OH TYR A 48 -9.860 0.083 -7.473 1.00 0.00 O ATOM 0 H TYR A 48 -12.776 -5.178 -2.026 1.00 0.00 H new ATOM 0 HA TYR A 48 -10.614 -3.229 -2.054 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -10.862 -4.789 -3.917 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -12.529 -4.304 -4.158 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -13.026 -1.965 -4.994 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -9.060 -3.519 -4.874 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -12.297 -0.221 -6.561 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -8.329 -1.776 -6.440 1.00 0.00 H new ATOM 0 HH TYR A 48 -10.391 0.028 -8.295 1.00 0.00 H new ATOM 732 N LYS A 49 -13.744 -2.394 -1.946 1.00 0.00 N ATOM 733 CA LYS A 49 -14.671 -1.277 -1.815 1.00 0.00 C ATOM 734 C LYS A 49 -14.257 -0.356 -0.672 1.00 0.00 C ATOM 735 O LYS A 49 -14.620 0.820 -0.646 1.00 0.00 O ATOM 736 CB LYS A 49 -16.093 -1.791 -1.579 1.00 0.00 C ATOM 737 CG LYS A 49 -17.004 -1.635 -2.785 1.00 0.00 C ATOM 738 CD LYS A 49 -18.005 -2.775 -2.878 1.00 0.00 C ATOM 739 CE LYS A 49 -18.236 -3.196 -4.322 1.00 0.00 C ATOM 740 NZ LYS A 49 -19.128 -2.245 -5.041 1.00 0.00 N ATOM 0 H LYS A 49 -14.152 -3.306 -1.740 1.00 0.00 H new ATOM 0 HA LYS A 49 -14.646 -0.708 -2.744 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -16.048 -2.844 -1.302 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -16.528 -1.257 -0.734 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -17.537 -0.686 -2.720 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -16.403 -1.602 -3.694 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -17.643 -3.627 -2.303 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -18.951 -2.468 -2.431 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -17.279 -3.258 -4.840 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -18.675 -4.193 -4.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -19.261 -2.567 -6.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -20.050 -2.204 -4.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -18.697 -1.299 -5.043 1.00 0.00 H new ATOM 754 N TYR A 50 -13.493 -0.898 0.270 1.00 0.00 N ATOM 755 CA TYR A 50 -13.029 -0.125 1.416 1.00 0.00 C ATOM 756 C TYR A 50 -11.756 0.645 1.076 1.00 0.00 C ATOM 757 O TYR A 50 -11.718 1.872 1.164 1.00 0.00 O ATOM 758 CB TYR A 50 -12.778 -1.047 2.611 1.00 0.00 C ATOM 759 CG TYR A 50 -14.037 -1.439 3.350 1.00 0.00 C ATOM 760 CD1 TYR A 50 -15.175 -1.839 2.659 1.00 0.00 C ATOM 761 CD2 TYR A 50 -14.090 -1.408 4.738 1.00 0.00 C ATOM 762 CE1 TYR A 50 -16.327 -2.198 3.329 1.00 0.00 C ATOM 763 CE2 TYR A 50 -15.240 -1.765 5.416 1.00 0.00 C ATOM 764 CZ TYR A 50 -16.355 -2.160 4.707 1.00 0.00 C ATOM 765 OH TYR A 50 -17.502 -2.516 5.380 1.00 0.00 O ATOM 0 H TYR A 50 -13.182 -1.869 0.263 1.00 0.00 H new ATOM 0 HA TYR A 50 -13.806 0.593 1.676 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -12.275 -1.949 2.263 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -12.099 -0.551 3.305 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -15.157 -1.869 1.580 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -13.218 -1.100 5.296 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -17.202 -2.507 2.777 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -15.265 -1.735 6.495 1.00 0.00 H new ATOM 0 HH TYR A 50 -17.353 -2.435 6.345 1.00 0.00 H new ATOM 775 N TYR A 51 -10.717 -0.086 0.687 1.00 0.00 N ATOM 776 CA TYR A 51 -9.441 0.526 0.334 1.00 0.00 C ATOM 777 C TYR A 51 -9.654 1.790 -0.492 1.00 0.00 C ATOM 778 O TYR A 51 -8.899 2.756 -0.378 1.00 0.00 O ATOM 779 CB TYR A 51 -8.574 -0.466 -0.442 1.00 0.00 C ATOM 780 CG TYR A 51 -7.304 0.142 -0.991 1.00 0.00 C ATOM 781 CD1 TYR A 51 -6.241 0.457 -0.152 1.00 0.00 C ATOM 782 CD2 TYR A 51 -7.164 0.404 -2.348 1.00 0.00 C ATOM 783 CE1 TYR A 51 -5.079 1.014 -0.649 1.00 0.00 C ATOM 784 CE2 TYR A 51 -6.005 0.958 -2.854 1.00 0.00 C ATOM 785 CZ TYR A 51 -4.965 1.262 -2.000 1.00 0.00 C ATOM 786 OH TYR A 51 -3.809 1.816 -2.499 1.00 0.00 O ATOM 0 H TYR A 51 -10.733 -1.103 0.608 1.00 0.00 H new ATOM 0 HA TYR A 51 -8.929 0.800 1.257 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -8.315 -1.299 0.212 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -9.156 -0.877 -1.267 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -6.325 0.263 0.907 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -7.977 0.170 -3.020 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -4.264 1.254 0.018 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -5.913 1.152 -3.912 1.00 0.00 H new ATOM 0 HH TYR A 51 -3.891 1.925 -3.469 1.00 0.00 H new ATOM 796 N LYS A 52 -10.689 1.777 -1.326 1.00 0.00 N ATOM 797 CA LYS A 52 -11.004 2.922 -2.171 1.00 0.00 C ATOM 798 C LYS A 52 -11.935 3.892 -1.450 1.00 0.00 C ATOM 799 O LYS A 52 -11.810 5.109 -1.591 1.00 0.00 O ATOM 800 CB LYS A 52 -11.651 2.454 -3.477 1.00 0.00 C ATOM 801 CG LYS A 52 -10.672 1.814 -4.447 1.00 0.00 C ATOM 802 CD LYS A 52 -9.816 2.858 -5.144 1.00 0.00 C ATOM 803 CE LYS A 52 -10.637 3.697 -6.112 1.00 0.00 C ATOM 804 NZ LYS A 52 -10.804 5.096 -5.629 1.00 0.00 N ATOM 0 H LYS A 52 -11.324 0.986 -1.434 1.00 0.00 H new ATOM 0 HA LYS A 52 -10.073 3.441 -2.398 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -12.440 1.739 -3.246 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -12.126 3.306 -3.963 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -10.030 1.115 -3.910 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -11.220 1.236 -5.191 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -9.354 3.507 -4.400 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -9.007 2.365 -5.684 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -10.151 3.705 -7.088 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -11.617 3.240 -6.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -11.540 5.571 -6.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -11.084 5.086 -4.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -9.905 5.609 -5.732 1.00 0.00 H new ATOM 818 N LEU A 53 -12.865 3.345 -0.675 1.00 0.00 N ATOM 819 CA LEU A 53 -13.816 4.163 0.071 1.00 0.00 C ATOM 820 C LEU A 53 -13.153 4.792 1.291 1.00 0.00 C ATOM 821 O LEU A 53 -12.946 6.006 1.343 1.00 0.00 O ATOM 822 CB LEU A 53 -15.014 3.317 0.506 1.00 0.00 C ATOM 823 CG LEU A 53 -15.923 3.938 1.568 1.00 0.00 C ATOM 824 CD1 LEU A 53 -15.486 3.511 2.960 1.00 0.00 C ATOM 825 CD2 LEU A 53 -15.923 5.455 1.449 1.00 0.00 C ATOM 0 H LEU A 53 -12.981 2.340 -0.547 1.00 0.00 H new ATOM 0 HA LEU A 53 -14.162 4.963 -0.584 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -15.616 3.096 -0.375 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -14.643 2.365 0.886 1.00 0.00 H new ATOM 0 HG LEU A 53 -16.939 3.581 1.403 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -16.144 3.962 3.702 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -15.539 2.425 3.041 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -14.461 3.839 3.136 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -16.575 5.880 2.212 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -14.909 5.831 1.587 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -16.285 5.743 0.462 1.00 0.00 H new ATOM 837 N LYS A 54 -12.820 3.961 2.272 1.00 0.00 N ATOM 838 CA LYS A 54 -12.176 4.433 3.492 1.00 0.00 C ATOM 839 C LYS A 54 -11.079 5.444 3.172 1.00 0.00 C ATOM 840 O LYS A 54 -10.818 6.360 3.953 1.00 0.00 O ATOM 841 CB LYS A 54 -11.587 3.256 4.272 1.00 0.00 C ATOM 842 CG LYS A 54 -11.616 3.448 5.778 1.00 0.00 C ATOM 843 CD LYS A 54 -12.947 3.017 6.370 1.00 0.00 C ATOM 844 CE LYS A 54 -12.964 3.177 7.882 1.00 0.00 C ATOM 845 NZ LYS A 54 -12.564 1.923 8.577 1.00 0.00 N ATOM 0 H LYS A 54 -12.986 2.955 2.246 1.00 0.00 H new ATOM 0 HA LYS A 54 -12.932 4.924 4.105 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -12.139 2.351 4.019 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -10.556 3.100 3.954 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -10.811 2.873 6.234 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -11.434 4.496 6.016 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -13.750 3.610 5.932 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -13.141 1.976 6.111 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -12.289 3.983 8.169 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -13.963 3.468 8.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -12.457 2.109 9.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -13.295 1.198 8.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -11.660 1.585 8.190 1.00 0.00 H new ATOM 859 N LEU A 55 -10.444 5.274 2.018 1.00 0.00 N ATOM 860 CA LEU A 55 -9.376 6.174 1.594 1.00 0.00 C ATOM 861 C LEU A 55 -9.939 7.527 1.171 1.00 0.00 C ATOM 862 O LEU A 55 -9.367 8.572 1.477 1.00 0.00 O ATOM 863 CB LEU A 55 -8.588 5.553 0.439 1.00 0.00 C ATOM 864 CG LEU A 55 -7.331 6.305 0.002 1.00 0.00 C ATOM 865 CD1 LEU A 55 -6.263 6.234 1.082 1.00 0.00 C ATOM 866 CD2 LEU A 55 -6.803 5.746 -1.311 1.00 0.00 C ATOM 0 H LEU A 55 -10.649 4.523 1.359 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.707 6.329 2.441 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -8.301 4.541 0.725 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.252 5.465 -0.421 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.593 7.352 -0.152 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -5.376 6.775 0.753 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.643 6.684 1.999 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.004 5.192 1.269 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.908 6.294 -1.606 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -6.558 4.691 -1.185 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.564 5.852 -2.084 1.00 0.00 H new ATOM 878 N ALA A 56 -11.066 7.498 0.466 1.00 0.00 N ATOM 879 CA ALA A 56 -11.710 8.722 0.005 1.00 0.00 C ATOM 880 C ALA A 56 -12.207 9.557 1.180 1.00 0.00 C ATOM 881 O ALA A 56 -11.961 10.760 1.245 1.00 0.00 O ATOM 882 CB ALA A 56 -12.860 8.391 -0.935 1.00 0.00 C ATOM 0 H ALA A 56 -11.551 6.641 0.202 1.00 0.00 H new ATOM 0 HA ALA A 56 -10.970 9.311 -0.537 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -13.332 9.314 -1.272 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -12.479 7.843 -1.797 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -13.594 7.779 -0.411 1.00 0.00 H new ATOM 888 N GLU A 57 -12.909 8.910 2.105 1.00 0.00 N ATOM 889 CA GLU A 57 -13.441 9.595 3.277 1.00 0.00 C ATOM 890 C GLU A 57 -12.316 10.034 4.209 1.00 0.00 C ATOM 891 O GLU A 57 -12.397 11.085 4.844 1.00 0.00 O ATOM 892 CB GLU A 57 -14.415 8.686 4.028 1.00 0.00 C ATOM 893 CG GLU A 57 -13.740 7.524 4.738 1.00 0.00 C ATOM 894 CD GLU A 57 -14.711 6.692 5.552 1.00 0.00 C ATOM 895 OE1 GLU A 57 -15.404 7.267 6.416 1.00 0.00 O ATOM 896 OE2 GLU A 57 -14.778 5.466 5.325 1.00 0.00 O ATOM 0 H GLU A 57 -13.122 7.913 2.065 1.00 0.00 H new ATOM 0 HA GLU A 57 -13.973 10.483 2.936 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -14.962 9.280 4.760 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -15.149 8.294 3.324 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -13.252 6.887 4.000 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -12.959 7.909 5.394 1.00 0.00 H new ATOM 903 N MET A 58 -11.268 9.222 4.285 1.00 0.00 N ATOM 904 CA MET A 58 -10.125 9.525 5.139 1.00 0.00 C ATOM 905 C MET A 58 -9.271 10.632 4.529 1.00 0.00 C ATOM 906 O MET A 58 -8.722 11.470 5.244 1.00 0.00 O ATOM 907 CB MET A 58 -9.277 8.272 5.358 1.00 0.00 C ATOM 908 CG MET A 58 -9.914 7.264 6.301 1.00 0.00 C ATOM 909 SD MET A 58 -9.800 7.761 8.029 1.00 0.00 S ATOM 910 CE MET A 58 -8.104 7.322 8.397 1.00 0.00 C ATOM 0 H MET A 58 -11.186 8.348 3.765 1.00 0.00 H new ATOM 0 HA MET A 58 -10.503 9.870 6.101 1.00 0.00 H new ATOM 0 HB2 MET A 58 -9.096 7.793 4.396 1.00 0.00 H new ATOM 0 HB3 MET A 58 -8.306 8.566 5.756 1.00 0.00 H new ATOM 0 HG2 MET A 58 -10.962 7.134 6.033 1.00 0.00 H new ATOM 0 HG3 MET A 58 -9.430 6.296 6.173 1.00 0.00 H new ATOM 0 HE1 MET A 58 -7.656 8.094 9.023 1.00 0.00 H new ATOM 0 HE2 MET A 58 -8.081 6.368 8.924 1.00 0.00 H new ATOM 0 HE3 MET A 58 -7.541 7.236 7.468 1.00 0.00 H new ATOM 920 N GLN A 59 -9.162 10.628 3.205 1.00 0.00 N ATOM 921 CA GLN A 59 -8.373 11.632 2.500 1.00 0.00 C ATOM 922 C GLN A 59 -9.029 13.005 2.594 1.00 0.00 C ATOM 923 O GLN A 59 -8.378 13.993 2.935 1.00 0.00 O ATOM 924 CB GLN A 59 -8.199 11.236 1.033 1.00 0.00 C ATOM 925 CG GLN A 59 -7.004 10.329 0.785 1.00 0.00 C ATOM 926 CD GLN A 59 -6.270 10.670 -0.497 1.00 0.00 C ATOM 927 OE1 GLN A 59 -6.110 11.841 -0.843 1.00 0.00 O ATOM 928 NE2 GLN A 59 -5.817 9.646 -1.211 1.00 0.00 N ATOM 0 H GLN A 59 -9.610 9.941 2.598 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.393 11.685 2.974 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -9.104 10.733 0.691 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -8.090 12.139 0.432 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -6.314 10.405 1.626 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -7.341 9.293 0.742 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -5.971 8.691 -0.888 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -5.315 9.815 -2.083 1.00 0.00 H new ATOM 937 N ARG A 60 -10.321 13.060 2.290 1.00 0.00 N ATOM 938 CA ARG A 60 -11.066 14.313 2.339 1.00 0.00 C ATOM 939 C ARG A 60 -11.042 14.904 3.745 1.00 0.00 C ATOM 940 O ARG A 60 -11.042 16.123 3.918 1.00 0.00 O ATOM 941 CB ARG A 60 -12.511 14.091 1.892 1.00 0.00 C ATOM 942 CG ARG A 60 -13.383 13.436 2.951 1.00 0.00 C ATOM 943 CD ARG A 60 -14.837 13.367 2.511 1.00 0.00 C ATOM 944 NE ARG A 60 -15.620 12.461 3.348 1.00 0.00 N ATOM 945 CZ ARG A 60 -16.812 11.986 3.003 1.00 0.00 C ATOM 946 NH1 ARG A 60 -17.354 12.331 1.844 1.00 0.00 N ATOM 947 NH2 ARG A 60 -17.462 11.167 3.819 1.00 0.00 N ATOM 0 H ARG A 60 -10.874 12.251 2.007 1.00 0.00 H new ATOM 0 HA ARG A 60 -10.588 15.018 1.659 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -12.948 15.051 1.616 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -12.514 13.470 0.996 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -13.016 12.430 3.155 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -13.310 13.998 3.882 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -15.275 14.365 2.549 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -14.886 13.036 1.474 1.00 0.00 H new ATOM 0 HE ARG A 60 -15.230 12.177 4.247 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -16.856 12.962 1.216 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -18.269 11.966 1.580 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -17.047 10.901 4.712 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -18.377 10.803 3.554 1.00 0.00 H new ATOM 961 N SER A 61 -11.023 14.032 4.749 1.00 0.00 N ATOM 962 CA SER A 61 -11.004 14.467 6.140 1.00 0.00 C ATOM 963 C SER A 61 -9.930 15.528 6.363 1.00 0.00 C ATOM 964 O SER A 61 -10.224 16.645 6.786 1.00 0.00 O ATOM 965 CB SER A 61 -10.760 13.274 7.067 1.00 0.00 C ATOM 966 OG SER A 61 -10.872 13.654 8.426 1.00 0.00 O ATOM 0 H SER A 61 -11.020 13.020 4.624 1.00 0.00 H new ATOM 0 HA SER A 61 -11.975 14.904 6.371 1.00 0.00 H new ATOM 0 HB2 SER A 61 -11.479 12.485 6.846 1.00 0.00 H new ATOM 0 HB3 SER A 61 -9.768 12.862 6.882 1.00 0.00 H new ATOM 0 HG SER A 61 -10.714 12.874 8.998 1.00 0.00 H new ATOM 972 N GLY A 62 -8.684 15.168 6.075 1.00 0.00 N ATOM 973 CA GLY A 62 -7.584 16.098 6.250 1.00 0.00 C ATOM 974 C GLY A 62 -7.871 17.456 5.641 1.00 0.00 C ATOM 975 O GLY A 62 -8.658 17.586 4.704 1.00 0.00 O ATOM 0 H GLY A 62 -8.416 14.249 5.723 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -7.378 16.216 7.314 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -6.685 15.682 5.796 1.00 0.00 H new ATOM 979 N PRO A 63 -7.224 18.500 6.181 1.00 0.00 N ATOM 980 CA PRO A 63 -7.398 19.874 5.701 1.00 0.00 C ATOM 981 C PRO A 63 -6.791 20.087 4.319 1.00 0.00 C ATOM 982 O PRO A 63 -5.620 19.780 4.091 1.00 0.00 O ATOM 983 CB PRO A 63 -6.657 20.711 6.747 1.00 0.00 C ATOM 984 CG PRO A 63 -5.644 19.786 7.325 1.00 0.00 C ATOM 985 CD PRO A 63 -6.271 18.419 7.302 1.00 0.00 C ATOM 0 HA PRO A 63 -8.450 20.138 5.592 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -6.184 21.582 6.294 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -7.338 21.080 7.513 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -4.723 19.803 6.743 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -5.383 20.079 8.342 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -5.527 17.638 7.142 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -6.774 18.192 8.242 1.00 0.00 H new ATOM 993 N SER A 64 -7.593 20.615 3.400 1.00 0.00 N ATOM 994 CA SER A 64 -7.135 20.866 2.038 1.00 0.00 C ATOM 995 C SER A 64 -6.738 19.563 1.350 1.00 0.00 C ATOM 996 O SER A 64 -5.731 18.946 1.698 1.00 0.00 O ATOM 997 CB SER A 64 -5.949 21.833 2.047 1.00 0.00 C ATOM 998 OG SER A 64 -6.027 22.742 0.963 1.00 0.00 O ATOM 0 H SER A 64 -8.563 20.877 3.574 1.00 0.00 H new ATOM 0 HA SER A 64 -7.957 21.315 1.481 1.00 0.00 H new ATOM 0 HB2 SER A 64 -5.931 22.384 2.987 1.00 0.00 H new ATOM 0 HB3 SER A 64 -5.017 21.271 1.989 1.00 0.00 H new ATOM 0 HG SER A 64 -5.260 23.351 0.991 1.00 0.00 H new ATOM 1004 N SER A 65 -7.537 19.150 0.372 1.00 0.00 N ATOM 1005 CA SER A 65 -7.273 17.919 -0.363 1.00 0.00 C ATOM 1006 C SER A 65 -6.011 18.053 -1.210 1.00 0.00 C ATOM 1007 O SER A 65 -5.176 17.150 -1.248 1.00 0.00 O ATOM 1008 CB SER A 65 -8.464 17.567 -1.256 1.00 0.00 C ATOM 1009 OG SER A 65 -8.828 18.662 -2.077 1.00 0.00 O ATOM 0 H SER A 65 -8.373 19.650 0.070 1.00 0.00 H new ATOM 0 HA SER A 65 -7.122 17.118 0.361 1.00 0.00 H new ATOM 0 HB2 SER A 65 -8.214 16.709 -1.879 1.00 0.00 H new ATOM 0 HB3 SER A 65 -9.312 17.275 -0.637 1.00 0.00 H new ATOM 0 HG SER A 65 -9.590 18.410 -2.639 1.00 0.00 H new ATOM 1015 N GLY A 66 -5.878 19.188 -1.890 1.00 0.00 N ATOM 1016 CA GLY A 66 -4.717 19.421 -2.728 1.00 0.00 C ATOM 1017 C GLY A 66 -3.590 20.104 -1.979 1.00 0.00 C ATOM 1018 O GLY A 66 -3.214 19.678 -0.887 1.00 0.00 O ATOM 0 H GLY A 66 -6.555 19.951 -1.875 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.362 18.470 -3.124 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -5.006 20.034 -3.582 1.00 0.00 H new TER 1022 GLY A 66