USER MOD reduce.3.24.130724 H: found=0, std=0, add=856, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 856 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 11 CYS SG : rot -27:sc= 0.137 USER MOD Set 1.2: A 17 HIS : no HD1:sc= 0 X(o=0.14,f=0.14) USER MOD Single : A 1 MET CE :methyl 164:sc= -0.031 (180deg=-0.356) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -113:sc= 0.662 (180deg=-0.238) USER MOD Single : A 4 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0315) USER MOD Single : A 9 THR OG1 : rot 41:sc= 0.269 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0.00216 USER MOD Single : A 18 THR OG1 : rot -159:sc= 0.537 USER MOD Single : A 19 TYR OH : rot -20:sc=-0.000823 USER MOD Single : A 20 MET CE :methyl -154:sc= 0 (180deg=-0.92) USER MOD Single : A 23 GLN : amide:sc= -1.21 K(o=-1.2,f=-3.1!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ -126:sc= -0.0225 (180deg=-0.231) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ -172:sc= -0.0112 (180deg=-0.116) USER MOD Single : A 32 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= 0.266 K(o=0.27,f=-7.7!) USER MOD Single : A 37 LYS NZ :NH3+ 152:sc= 1.06 (180deg=-0.12) USER MOD Single : A 40 THR OG1 : rot 139:sc= -0.142 USER MOD Single : A 41 GLN : amide:sc= -1.48! X(o=-1.5!,f=-1.2) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= -0.445 K(o=-0.44,f=-1.2) USER MOD Single : A 51 THR OG1 : rot -85:sc= 1.96 USER MOD Single : A 53 LYS NZ :NH3+ 165:sc= -0.0136 (180deg=-0.243) USER MOD Single : A 56 ASN : amide:sc= 1.23 K(o=1.2,f=-0.015) USER MOD Single : A 67 THR OG1 : rot 37:sc= 0.511 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -1.15 K(o=-1.1,f=-2.8!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 151:sc= -0.25 (180deg=-1.19) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 168:sc= 1.02 (180deg=0.627) USER MOD Single : A 97 ASN : amide:sc= -0.024 K(o=-0.024,f=-1.1!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.544 2.607 -7.846 1.00 0.00 N ATOM 2 CA MET A 1 -16.560 2.684 -6.748 1.00 0.00 C ATOM 3 C MET A 1 -15.249 1.997 -7.128 1.00 0.00 C ATOM 4 O MET A 1 -15.117 0.777 -7.021 1.00 0.00 O ATOM 5 CB MET A 1 -17.133 2.055 -5.468 1.00 0.00 C ATOM 6 CG MET A 1 -16.134 1.990 -4.319 1.00 0.00 C ATOM 7 SD MET A 1 -15.512 3.612 -3.833 1.00 0.00 S ATOM 8 CE MET A 1 -17.011 4.383 -3.226 1.00 0.00 C ATOM 0 H1 MET A 1 -18.423 3.082 -7.558 1.00 0.00 H new ATOM 0 H2 MET A 1 -17.159 3.075 -8.691 1.00 0.00 H new ATOM 0 H3 MET A 1 -17.744 1.610 -8.063 1.00 0.00 H new ATOM 0 HA MET A 1 -16.350 3.738 -6.563 1.00 0.00 H new ATOM 0 HB2 MET A 1 -18.003 2.629 -5.150 1.00 0.00 H new ATOM 0 HB3 MET A 1 -17.481 1.047 -5.693 1.00 0.00 H new ATOM 0 HG2 MET A 1 -16.608 1.516 -3.459 1.00 0.00 H new ATOM 0 HG3 MET A 1 -15.295 1.357 -4.609 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.754 5.263 -2.637 1.00 0.00 H new ATOM 0 HE2 MET A 1 -17.635 4.680 -4.069 1.00 0.00 H new ATOM 0 HE3 MET A 1 -17.557 3.675 -2.602 1.00 0.00 H new ATOM 20 N LYS A 2 -14.305 2.786 -7.614 1.00 0.00 N ATOM 21 CA LYS A 2 -12.941 2.333 -7.818 1.00 0.00 C ATOM 22 C LYS A 2 -12.038 3.031 -6.818 1.00 0.00 C ATOM 23 O LYS A 2 -11.551 4.131 -7.073 1.00 0.00 O ATOM 24 CB LYS A 2 -12.459 2.622 -9.243 1.00 0.00 C ATOM 25 CG LYS A 2 -12.825 1.552 -10.261 1.00 0.00 C ATOM 26 CD LYS A 2 -14.322 1.462 -10.491 1.00 0.00 C ATOM 27 CE LYS A 2 -14.665 0.393 -11.516 1.00 0.00 C ATOM 28 NZ LYS A 2 -14.230 -0.961 -11.081 1.00 0.00 N ATOM 0 H LYS A 2 -14.464 3.758 -7.878 1.00 0.00 H new ATOM 0 HA LYS A 2 -12.907 1.253 -7.671 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -12.878 3.574 -9.569 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -11.375 2.738 -9.230 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -12.327 1.768 -11.206 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -12.454 0.586 -9.919 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -14.823 1.239 -9.549 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -14.698 2.427 -10.831 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -15.741 0.389 -11.689 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -14.191 0.638 -12.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -13.469 -1.298 -11.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -13.881 -0.916 -10.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -15.035 -1.617 -11.132 1.00 0.00 H new ATOM 42 N ARG A 3 -11.857 2.410 -5.664 1.00 0.00 N ATOM 43 CA ARG A 3 -11.092 3.013 -4.587 1.00 0.00 C ATOM 44 C ARG A 3 -9.636 3.168 -4.994 1.00 0.00 C ATOM 45 O ARG A 3 -8.960 2.190 -5.308 1.00 0.00 O ATOM 46 CB ARG A 3 -11.191 2.162 -3.321 1.00 0.00 C ATOM 47 CG ARG A 3 -10.624 2.840 -2.085 1.00 0.00 C ATOM 48 CD ARG A 3 -11.469 4.033 -1.671 1.00 0.00 C ATOM 49 NE ARG A 3 -12.807 3.631 -1.239 1.00 0.00 N ATOM 50 CZ ARG A 3 -13.753 4.480 -0.835 1.00 0.00 C ATOM 51 NH1 ARG A 3 -13.533 5.789 -0.846 1.00 0.00 N ATOM 52 NH2 ARG A 3 -14.931 4.020 -0.441 1.00 0.00 N ATOM 0 H ARG A 3 -12.231 1.486 -5.449 1.00 0.00 H new ATOM 0 HA ARG A 3 -11.508 3.999 -4.381 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -12.237 1.914 -3.141 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -10.664 1.222 -3.483 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -10.576 2.124 -1.265 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -9.603 3.166 -2.283 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -10.971 4.567 -0.861 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -11.551 4.727 -2.507 1.00 0.00 H new ATOM 0 HE ARG A 3 -13.032 2.636 -1.247 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -12.635 6.153 -1.165 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -14.262 6.431 -0.535 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -15.115 3.017 -0.447 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -15.655 4.669 -0.132 1.00 0.00 H new ATOM 66 N LYS A 4 -9.172 4.404 -5.010 1.00 0.00 N ATOM 67 CA LYS A 4 -7.785 4.692 -5.324 1.00 0.00 C ATOM 68 C LYS A 4 -6.925 4.423 -4.104 1.00 0.00 C ATOM 69 O LYS A 4 -7.011 5.129 -3.098 1.00 0.00 O ATOM 70 CB LYS A 4 -7.634 6.139 -5.791 1.00 0.00 C ATOM 71 CG LYS A 4 -8.545 6.478 -6.955 1.00 0.00 C ATOM 72 CD LYS A 4 -8.325 5.531 -8.124 1.00 0.00 C ATOM 73 CE LYS A 4 -9.480 5.581 -9.108 1.00 0.00 C ATOM 74 NZ LYS A 4 -9.667 6.937 -9.683 1.00 0.00 N ATOM 0 H LYS A 4 -9.738 5.228 -4.808 1.00 0.00 H new ATOM 0 HA LYS A 4 -7.456 4.044 -6.136 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -7.850 6.809 -4.959 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -6.599 6.316 -6.082 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -9.585 6.426 -6.633 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.362 7.504 -7.276 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -7.399 5.792 -8.636 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -8.207 4.513 -7.752 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -9.301 4.868 -9.913 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -10.397 5.271 -8.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -10.409 6.906 -10.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -9.947 7.598 -8.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -8.776 7.258 -10.111 1.00 0.00 H new ATOM 88 N ILE A 5 -6.128 3.375 -4.183 1.00 0.00 N ATOM 89 CA ILE A 5 -5.300 2.967 -3.067 1.00 0.00 C ATOM 90 C ILE A 5 -3.826 3.099 -3.414 1.00 0.00 C ATOM 91 O ILE A 5 -3.368 2.598 -4.442 1.00 0.00 O ATOM 92 CB ILE A 5 -5.597 1.510 -2.654 1.00 0.00 C ATOM 93 CG1 ILE A 5 -7.080 1.346 -2.310 1.00 0.00 C ATOM 94 CG2 ILE A 5 -4.722 1.099 -1.475 1.00 0.00 C ATOM 95 CD1 ILE A 5 -7.468 -0.070 -1.938 1.00 0.00 C ATOM 0 H ILE A 5 -6.037 2.789 -5.013 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.535 3.625 -2.231 1.00 0.00 H new ATOM 0 HB ILE A 5 -5.364 0.857 -3.495 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -7.327 2.010 -1.482 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.679 1.665 -3.163 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -4.945 0.069 -1.198 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -3.672 1.180 -1.756 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -4.922 1.754 -0.627 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -8.533 -0.107 -1.708 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -7.254 -0.737 -2.773 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -6.897 -0.386 -1.065 1.00 0.00 H new ATOM 107 N ILE A 6 -3.091 3.786 -2.563 1.00 0.00 N ATOM 108 CA ILE A 6 -1.655 3.887 -2.713 1.00 0.00 C ATOM 109 C ILE A 6 -0.981 2.986 -1.689 1.00 0.00 C ATOM 110 O ILE A 6 -1.319 3.012 -0.503 1.00 0.00 O ATOM 111 CB ILE A 6 -1.128 5.342 -2.577 1.00 0.00 C ATOM 112 CG1 ILE A 6 -1.524 5.982 -1.232 1.00 0.00 C ATOM 113 CG2 ILE A 6 -1.622 6.190 -3.744 1.00 0.00 C ATOM 114 CD1 ILE A 6 -2.961 6.462 -1.153 1.00 0.00 C ATOM 0 H ILE A 6 -3.468 4.285 -1.757 1.00 0.00 H new ATOM 0 HA ILE A 6 -1.409 3.565 -3.725 1.00 0.00 H new ATOM 0 HB ILE A 6 -0.039 5.301 -2.600 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -1.354 5.256 -0.437 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -0.863 6.827 -1.039 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -1.247 7.208 -3.639 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -1.261 5.765 -4.681 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -2.712 6.204 -3.748 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -3.146 6.897 -0.171 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -3.136 7.215 -1.922 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -3.635 5.620 -1.310 1.00 0.00 H new ATOM 126 N ALA A 7 -0.058 2.165 -2.147 1.00 0.00 N ATOM 127 CA ALA A 7 0.580 1.194 -1.284 1.00 0.00 C ATOM 128 C ALA A 7 2.079 1.180 -1.505 1.00 0.00 C ATOM 129 O ALA A 7 2.550 1.305 -2.631 1.00 0.00 O ATOM 130 CB ALA A 7 -0.005 -0.189 -1.529 1.00 0.00 C ATOM 0 H ALA A 7 0.267 2.151 -3.114 1.00 0.00 H new ATOM 0 HA ALA A 7 0.392 1.478 -0.248 1.00 0.00 H new ATOM 0 HB1 ALA A 7 0.482 -0.911 -0.874 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -1.075 -0.174 -1.320 1.00 0.00 H new ATOM 0 HB3 ALA A 7 0.158 -0.474 -2.568 1.00 0.00 H new ATOM 136 N VAL A 8 2.827 1.037 -0.428 1.00 0.00 N ATOM 137 CA VAL A 8 4.272 0.961 -0.513 1.00 0.00 C ATOM 138 C VAL A 8 4.759 -0.257 0.247 1.00 0.00 C ATOM 139 O VAL A 8 4.331 -0.512 1.376 1.00 0.00 O ATOM 140 CB VAL A 8 4.961 2.228 0.047 1.00 0.00 C ATOM 141 CG1 VAL A 8 6.474 2.112 -0.055 1.00 0.00 C ATOM 142 CG2 VAL A 8 4.480 3.473 -0.680 1.00 0.00 C ATOM 0 H VAL A 8 2.456 0.971 0.520 1.00 0.00 H new ATOM 0 HA VAL A 8 4.536 0.883 -1.568 1.00 0.00 H new ATOM 0 HB VAL A 8 4.691 2.316 1.099 1.00 0.00 H new ATOM 0 HG11 VAL A 8 6.936 3.015 0.345 1.00 0.00 H new ATOM 0 HG12 VAL A 8 6.812 1.248 0.517 1.00 0.00 H new ATOM 0 HG13 VAL A 8 6.760 1.990 -1.100 1.00 0.00 H new ATOM 0 HG21 VAL A 8 4.979 4.350 -0.268 1.00 0.00 H new ATOM 0 HG22 VAL A 8 4.713 3.388 -1.741 1.00 0.00 H new ATOM 0 HG23 VAL A 8 3.402 3.575 -0.553 1.00 0.00 H new ATOM 152 N THR A 9 5.624 -1.020 -0.385 1.00 0.00 N ATOM 153 CA THR A 9 6.201 -2.185 0.242 1.00 0.00 C ATOM 154 C THR A 9 7.721 -2.094 0.197 1.00 0.00 C ATOM 155 O THR A 9 8.304 -1.721 -0.827 1.00 0.00 O ATOM 156 CB THR A 9 5.701 -3.487 -0.417 1.00 0.00 C ATOM 157 OG1 THR A 9 6.387 -4.618 0.129 1.00 0.00 O ATOM 158 CG2 THR A 9 5.876 -3.439 -1.923 1.00 0.00 C ATOM 0 H THR A 9 5.944 -0.851 -1.339 1.00 0.00 H new ATOM 0 HA THR A 9 5.881 -2.212 1.284 1.00 0.00 H new ATOM 0 HB THR A 9 4.637 -3.586 -0.204 1.00 0.00 H new ATOM 0 HG1 THR A 9 6.482 -4.507 1.098 1.00 0.00 H new ATOM 0 HG21 THR A 9 5.515 -4.370 -2.361 1.00 0.00 H new ATOM 0 HG22 THR A 9 5.307 -2.602 -2.329 1.00 0.00 H new ATOM 0 HG23 THR A 9 6.932 -3.310 -2.163 1.00 0.00 H new ATOM 166 N ALA A 10 8.357 -2.409 1.318 1.00 0.00 N ATOM 167 CA ALA A 10 9.794 -2.238 1.453 1.00 0.00 C ATOM 168 C ALA A 10 10.328 -3.011 2.648 1.00 0.00 C ATOM 169 O ALA A 10 10.199 -2.576 3.794 1.00 0.00 O ATOM 170 CB ALA A 10 10.142 -0.760 1.591 1.00 0.00 C ATOM 0 H ALA A 10 7.897 -2.785 2.147 1.00 0.00 H new ATOM 0 HA ALA A 10 10.264 -2.632 0.552 1.00 0.00 H new ATOM 0 HB1 ALA A 10 11.222 -0.648 1.691 1.00 0.00 H new ATOM 0 HB2 ALA A 10 9.802 -0.222 0.706 1.00 0.00 H new ATOM 0 HB3 ALA A 10 9.651 -0.352 2.475 1.00 0.00 H new ATOM 176 N CYS A 11 10.898 -4.175 2.387 1.00 0.00 N ATOM 177 CA CYS A 11 11.551 -4.943 3.433 1.00 0.00 C ATOM 178 C CYS A 11 13.047 -4.629 3.450 1.00 0.00 C ATOM 179 O CYS A 11 13.728 -4.867 4.450 1.00 0.00 O ATOM 180 CB CYS A 11 11.314 -6.442 3.221 1.00 0.00 C ATOM 181 SG CYS A 11 11.992 -7.500 4.524 1.00 0.00 S ATOM 0 H CYS A 11 10.922 -4.608 1.464 1.00 0.00 H new ATOM 0 HA CYS A 11 11.125 -4.665 4.397 1.00 0.00 H new ATOM 0 HB2 CYS A 11 10.241 -6.621 3.147 1.00 0.00 H new ATOM 0 HB3 CYS A 11 11.753 -6.735 2.267 1.00 0.00 H new ATOM 0 HG CYS A 11 13.006 -6.907 5.081 1.00 0.00 H new ATOM 187 N ALA A 12 13.532 -4.070 2.333 1.00 0.00 N ATOM 188 CA ALA A 12 14.944 -3.711 2.147 1.00 0.00 C ATOM 189 C ALA A 12 15.852 -4.936 2.161 1.00 0.00 C ATOM 190 O ALA A 12 16.316 -5.383 1.113 1.00 0.00 O ATOM 191 CB ALA A 12 15.398 -2.692 3.184 1.00 0.00 C ATOM 0 H ALA A 12 12.949 -3.852 1.525 1.00 0.00 H new ATOM 0 HA ALA A 12 15.026 -3.254 1.161 1.00 0.00 H new ATOM 0 HB1 ALA A 12 16.447 -2.448 3.019 1.00 0.00 H new ATOM 0 HB2 ALA A 12 14.796 -1.788 3.093 1.00 0.00 H new ATOM 0 HB3 ALA A 12 15.276 -3.110 4.183 1.00 0.00 H new ATOM 197 N THR A 13 16.094 -5.472 3.351 1.00 0.00 N ATOM 198 CA THR A 13 16.945 -6.638 3.514 1.00 0.00 C ATOM 199 C THR A 13 16.345 -7.834 2.784 1.00 0.00 C ATOM 200 O THR A 13 16.997 -8.461 1.950 1.00 0.00 O ATOM 201 CB THR A 13 17.117 -6.977 5.007 1.00 0.00 C ATOM 202 OG1 THR A 13 17.403 -5.780 5.747 1.00 0.00 O ATOM 203 CG2 THR A 13 18.238 -7.985 5.217 1.00 0.00 C ATOM 0 H THR A 13 15.707 -5.112 4.223 1.00 0.00 H new ATOM 0 HA THR A 13 17.922 -6.410 3.088 1.00 0.00 H new ATOM 0 HB THR A 13 16.187 -7.419 5.364 1.00 0.00 H new ATOM 0 HG1 THR A 13 17.510 -6.000 6.696 1.00 0.00 H new ATOM 0 HG21 THR A 13 18.335 -8.204 6.280 1.00 0.00 H new ATOM 0 HG22 THR A 13 18.008 -8.903 4.677 1.00 0.00 H new ATOM 0 HG23 THR A 13 19.175 -7.570 4.845 1.00 0.00 H new ATOM 211 N GLY A 14 15.090 -8.130 3.090 1.00 0.00 N ATOM 212 CA GLY A 14 14.388 -9.186 2.395 1.00 0.00 C ATOM 213 C GLY A 14 13.616 -8.648 1.212 1.00 0.00 C ATOM 214 O GLY A 14 12.385 -8.630 1.219 1.00 0.00 O ATOM 0 H GLY A 14 14.545 -7.655 3.810 1.00 0.00 H new ATOM 0 HA2 GLY A 14 15.101 -9.937 2.055 1.00 0.00 H new ATOM 0 HA3 GLY A 14 13.704 -9.684 3.082 1.00 0.00 H new ATOM 218 N VAL A 15 14.347 -8.210 0.193 1.00 0.00 N ATOM 219 CA VAL A 15 13.752 -7.586 -0.984 1.00 0.00 C ATOM 220 C VAL A 15 12.757 -8.524 -1.679 1.00 0.00 C ATOM 221 O VAL A 15 11.790 -8.069 -2.286 1.00 0.00 O ATOM 222 CB VAL A 15 14.843 -7.126 -1.984 1.00 0.00 C ATOM 223 CG1 VAL A 15 15.600 -8.313 -2.563 1.00 0.00 C ATOM 224 CG2 VAL A 15 14.243 -6.277 -3.094 1.00 0.00 C ATOM 0 H VAL A 15 15.364 -8.277 0.159 1.00 0.00 H new ATOM 0 HA VAL A 15 13.205 -6.709 -0.639 1.00 0.00 H new ATOM 0 HB VAL A 15 15.555 -6.512 -1.433 1.00 0.00 H new ATOM 0 HG11 VAL A 15 16.358 -7.956 -3.260 1.00 0.00 H new ATOM 0 HG12 VAL A 15 16.081 -8.866 -1.756 1.00 0.00 H new ATOM 0 HG13 VAL A 15 14.904 -8.968 -3.087 1.00 0.00 H new ATOM 0 HG21 VAL A 15 15.030 -5.968 -3.781 1.00 0.00 H new ATOM 0 HG22 VAL A 15 13.497 -6.859 -3.635 1.00 0.00 H new ATOM 0 HG23 VAL A 15 13.771 -5.394 -2.662 1.00 0.00 H new ATOM 234 N ALA A 16 12.979 -9.830 -1.556 1.00 0.00 N ATOM 235 CA ALA A 16 12.083 -10.820 -2.146 1.00 0.00 C ATOM 236 C ALA A 16 10.694 -10.747 -1.514 1.00 0.00 C ATOM 237 O ALA A 16 9.685 -11.013 -2.166 1.00 0.00 O ATOM 238 CB ALA A 16 12.662 -12.220 -1.997 1.00 0.00 C ATOM 0 H ALA A 16 13.772 -10.227 -1.053 1.00 0.00 H new ATOM 0 HA ALA A 16 11.984 -10.595 -3.208 1.00 0.00 H new ATOM 0 HB1 ALA A 16 11.981 -12.945 -2.442 1.00 0.00 H new ATOM 0 HB2 ALA A 16 13.627 -12.271 -2.502 1.00 0.00 H new ATOM 0 HB3 ALA A 16 12.794 -12.448 -0.939 1.00 0.00 H new ATOM 244 N HIS A 17 10.649 -10.360 -0.242 1.00 0.00 N ATOM 245 CA HIS A 17 9.381 -10.233 0.471 1.00 0.00 C ATOM 246 C HIS A 17 8.614 -9.029 -0.052 1.00 0.00 C ATOM 247 O HIS A 17 7.385 -9.036 -0.104 1.00 0.00 O ATOM 248 CB HIS A 17 9.611 -10.095 1.980 1.00 0.00 C ATOM 249 CG HIS A 17 10.231 -11.304 2.607 1.00 0.00 C ATOM 250 ND1 HIS A 17 10.796 -11.302 3.864 1.00 0.00 N ATOM 251 CD2 HIS A 17 10.369 -12.566 2.139 1.00 0.00 C ATOM 252 CE1 HIS A 17 11.248 -12.511 4.142 1.00 0.00 C ATOM 253 NE2 HIS A 17 11.000 -13.296 3.111 1.00 0.00 N ATOM 0 H HIS A 17 11.472 -10.130 0.314 1.00 0.00 H new ATOM 0 HA HIS A 17 8.797 -11.137 0.298 1.00 0.00 H new ATOM 0 HB2 HIS A 17 10.252 -9.232 2.164 1.00 0.00 H new ATOM 0 HB3 HIS A 17 8.657 -9.893 2.467 1.00 0.00 H new ATOM 0 HD2 HIS A 17 10.042 -12.930 1.176 1.00 0.00 H new ATOM 0 HE1 HIS A 17 11.738 -12.807 5.058 1.00 0.00 H new ATOM 0 HE2 HIS A 17 11.239 -14.286 3.048 1.00 0.00 H new ATOM 262 N THR A 18 9.363 -8.010 -0.455 1.00 0.00 N ATOM 263 CA THR A 18 8.793 -6.803 -1.034 1.00 0.00 C ATOM 264 C THR A 18 7.969 -7.138 -2.281 1.00 0.00 C ATOM 265 O THR A 18 6.853 -6.650 -2.457 1.00 0.00 O ATOM 266 CB THR A 18 9.912 -5.809 -1.414 1.00 0.00 C ATOM 267 OG1 THR A 18 10.742 -5.531 -0.274 1.00 0.00 O ATOM 268 CG2 THR A 18 9.339 -4.509 -1.955 1.00 0.00 C ATOM 0 H THR A 18 10.381 -7.998 -0.389 1.00 0.00 H new ATOM 0 HA THR A 18 8.142 -6.347 -0.288 1.00 0.00 H new ATOM 0 HB THR A 18 10.512 -6.273 -2.197 1.00 0.00 H new ATOM 0 HG1 THR A 18 11.217 -4.685 -0.414 1.00 0.00 H new ATOM 0 HG21 THR A 18 10.153 -3.832 -2.213 1.00 0.00 H new ATOM 0 HG22 THR A 18 8.744 -4.716 -2.844 1.00 0.00 H new ATOM 0 HG23 THR A 18 8.708 -4.046 -1.196 1.00 0.00 H new ATOM 276 N TYR A 19 8.517 -8.001 -3.131 1.00 0.00 N ATOM 277 CA TYR A 19 7.855 -8.360 -4.380 1.00 0.00 C ATOM 278 C TYR A 19 6.638 -9.242 -4.132 1.00 0.00 C ATOM 279 O TYR A 19 5.598 -9.061 -4.766 1.00 0.00 O ATOM 280 CB TYR A 19 8.830 -9.056 -5.329 1.00 0.00 C ATOM 281 CG TYR A 19 9.861 -8.120 -5.913 1.00 0.00 C ATOM 282 CD1 TYR A 19 9.611 -7.438 -7.096 1.00 0.00 C ATOM 283 CD2 TYR A 19 11.076 -7.913 -5.280 1.00 0.00 C ATOM 284 CE1 TYR A 19 10.546 -6.575 -7.631 1.00 0.00 C ATOM 285 CE2 TYR A 19 12.016 -7.050 -5.809 1.00 0.00 C ATOM 286 CZ TYR A 19 11.747 -6.384 -6.983 1.00 0.00 C ATOM 287 OH TYR A 19 12.680 -5.521 -7.510 1.00 0.00 O ATOM 0 H TYR A 19 9.414 -8.463 -2.979 1.00 0.00 H new ATOM 0 HA TYR A 19 7.512 -7.437 -4.846 1.00 0.00 H new ATOM 0 HB2 TYR A 19 9.338 -9.858 -4.794 1.00 0.00 H new ATOM 0 HB3 TYR A 19 8.269 -9.520 -6.140 1.00 0.00 H new ATOM 0 HD1 TYR A 19 8.670 -7.585 -7.606 1.00 0.00 H new ATOM 0 HD2 TYR A 19 11.291 -8.434 -4.359 1.00 0.00 H new ATOM 0 HE1 TYR A 19 10.337 -6.052 -8.553 1.00 0.00 H new ATOM 0 HE2 TYR A 19 12.958 -6.899 -5.303 1.00 0.00 H new ATOM 0 HH TYR A 19 12.495 -5.381 -8.462 1.00 0.00 H new ATOM 297 N MET A 20 6.767 -10.183 -3.201 1.00 0.00 N ATOM 298 CA MET A 20 5.671 -11.094 -2.878 1.00 0.00 C ATOM 299 C MET A 20 4.465 -10.323 -2.349 1.00 0.00 C ATOM 300 O MET A 20 3.328 -10.573 -2.754 1.00 0.00 O ATOM 301 CB MET A 20 6.114 -12.128 -1.842 1.00 0.00 C ATOM 302 CG MET A 20 5.056 -13.180 -1.540 1.00 0.00 C ATOM 303 SD MET A 20 4.757 -14.285 -2.935 1.00 0.00 S ATOM 304 CE MET A 20 3.599 -15.443 -2.212 1.00 0.00 C ATOM 0 H MET A 20 7.617 -10.335 -2.658 1.00 0.00 H new ATOM 0 HA MET A 20 5.386 -11.611 -3.795 1.00 0.00 H new ATOM 0 HB2 MET A 20 7.016 -12.624 -2.199 1.00 0.00 H new ATOM 0 HB3 MET A 20 6.378 -11.614 -0.918 1.00 0.00 H new ATOM 0 HG2 MET A 20 5.369 -13.767 -0.677 1.00 0.00 H new ATOM 0 HG3 MET A 20 4.124 -12.685 -1.267 1.00 0.00 H new ATOM 0 HE1 MET A 20 3.667 -16.398 -2.732 1.00 0.00 H new ATOM 0 HE2 MET A 20 3.838 -15.586 -1.158 1.00 0.00 H new ATOM 0 HE3 MET A 20 2.586 -15.051 -2.305 1.00 0.00 H new ATOM 314 N ALA A 21 4.722 -9.379 -1.452 1.00 0.00 N ATOM 315 CA ALA A 21 3.662 -8.561 -0.887 1.00 0.00 C ATOM 316 C ALA A 21 2.988 -7.730 -1.970 1.00 0.00 C ATOM 317 O ALA A 21 1.764 -7.687 -2.056 1.00 0.00 O ATOM 318 CB ALA A 21 4.214 -7.657 0.203 1.00 0.00 C ATOM 0 H ALA A 21 5.655 -9.163 -1.102 1.00 0.00 H new ATOM 0 HA ALA A 21 2.916 -9.224 -0.448 1.00 0.00 H new ATOM 0 HB1 ALA A 21 3.408 -7.051 0.616 1.00 0.00 H new ATOM 0 HB2 ALA A 21 4.652 -8.266 0.994 1.00 0.00 H new ATOM 0 HB3 ALA A 21 4.979 -7.005 -0.218 1.00 0.00 H new ATOM 324 N ALA A 22 3.804 -7.091 -2.802 1.00 0.00 N ATOM 325 CA ALA A 22 3.305 -6.236 -3.874 1.00 0.00 C ATOM 326 C ALA A 22 2.382 -6.994 -4.824 1.00 0.00 C ATOM 327 O ALA A 22 1.273 -6.545 -5.102 1.00 0.00 O ATOM 328 CB ALA A 22 4.469 -5.640 -4.651 1.00 0.00 C ATOM 0 H ALA A 22 4.821 -7.150 -2.754 1.00 0.00 H new ATOM 0 HA ALA A 22 2.724 -5.437 -3.413 1.00 0.00 H new ATOM 0 HB1 ALA A 22 4.086 -5.004 -5.449 1.00 0.00 H new ATOM 0 HB2 ALA A 22 5.089 -5.046 -3.979 1.00 0.00 H new ATOM 0 HB3 ALA A 22 5.067 -6.442 -5.083 1.00 0.00 H new ATOM 334 N GLN A 23 2.833 -8.147 -5.313 1.00 0.00 N ATOM 335 CA GLN A 23 2.066 -8.893 -6.307 1.00 0.00 C ATOM 336 C GLN A 23 0.762 -9.435 -5.725 1.00 0.00 C ATOM 337 O GLN A 23 -0.281 -9.366 -6.376 1.00 0.00 O ATOM 338 CB GLN A 23 2.898 -10.030 -6.920 1.00 0.00 C ATOM 339 CG GLN A 23 3.466 -11.016 -5.911 1.00 0.00 C ATOM 340 CD GLN A 23 4.211 -12.163 -6.567 1.00 0.00 C ATOM 341 OE1 GLN A 23 5.181 -12.683 -6.017 1.00 0.00 O ATOM 342 NE2 GLN A 23 3.753 -12.579 -7.739 1.00 0.00 N ATOM 0 H GLN A 23 3.715 -8.581 -5.041 1.00 0.00 H new ATOM 0 HA GLN A 23 1.811 -8.192 -7.102 1.00 0.00 H new ATOM 0 HB2 GLN A 23 2.276 -10.575 -7.630 1.00 0.00 H new ATOM 0 HB3 GLN A 23 3.722 -9.595 -7.486 1.00 0.00 H new ATOM 0 HG2 GLN A 23 4.140 -10.490 -5.235 1.00 0.00 H new ATOM 0 HG3 GLN A 23 2.654 -11.416 -5.304 1.00 0.00 H new ATOM 0 HE21 GLN A 23 2.946 -12.122 -8.163 1.00 0.00 H new ATOM 0 HE22 GLN A 23 4.208 -13.357 -8.217 1.00 0.00 H new ATOM 351 N ALA A 24 0.813 -9.957 -4.502 1.00 0.00 N ATOM 352 CA ALA A 24 -0.376 -10.517 -3.867 1.00 0.00 C ATOM 353 C ALA A 24 -1.373 -9.416 -3.518 1.00 0.00 C ATOM 354 O ALA A 24 -2.568 -9.531 -3.800 1.00 0.00 O ATOM 355 CB ALA A 24 0.009 -11.303 -2.624 1.00 0.00 C ATOM 0 H ALA A 24 1.659 -10.004 -3.934 1.00 0.00 H new ATOM 0 HA ALA A 24 -0.854 -11.196 -4.573 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -0.888 -11.714 -2.161 1.00 0.00 H new ATOM 0 HB2 ALA A 24 0.680 -12.116 -2.901 1.00 0.00 H new ATOM 0 HB3 ALA A 24 0.511 -10.643 -1.917 1.00 0.00 H new ATOM 361 N LEU A 25 -0.863 -8.351 -2.916 1.00 0.00 N ATOM 362 CA LEU A 25 -1.675 -7.189 -2.561 1.00 0.00 C ATOM 363 C LEU A 25 -2.358 -6.597 -3.795 1.00 0.00 C ATOM 364 O LEU A 25 -3.559 -6.320 -3.787 1.00 0.00 O ATOM 365 CB LEU A 25 -0.786 -6.136 -1.896 1.00 0.00 C ATOM 366 CG LEU A 25 -1.458 -4.812 -1.542 1.00 0.00 C ATOM 367 CD1 LEU A 25 -2.506 -5.014 -0.459 1.00 0.00 C ATOM 368 CD2 LEU A 25 -0.405 -3.809 -1.103 1.00 0.00 C ATOM 0 H LEU A 25 0.120 -8.265 -2.660 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.454 -7.505 -1.867 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -0.372 -6.565 -0.983 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.053 -5.927 -2.560 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.967 -4.422 -2.424 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -2.973 -4.058 -0.222 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.266 -5.711 -0.813 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -2.032 -5.418 0.435 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -0.886 -2.864 -0.850 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.122 -4.193 -0.229 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.306 -3.649 -1.914 1.00 0.00 H new ATOM 380 N LYS A 26 -1.582 -6.425 -4.856 1.00 0.00 N ATOM 381 CA LYS A 26 -2.072 -5.819 -6.088 1.00 0.00 C ATOM 382 C LYS A 26 -3.080 -6.732 -6.782 1.00 0.00 C ATOM 383 O LYS A 26 -4.003 -6.265 -7.451 1.00 0.00 O ATOM 384 CB LYS A 26 -0.887 -5.529 -7.008 1.00 0.00 C ATOM 385 CG LYS A 26 -1.198 -4.610 -8.173 1.00 0.00 C ATOM 386 CD LYS A 26 0.086 -4.183 -8.864 1.00 0.00 C ATOM 387 CE LYS A 26 -0.162 -3.146 -9.947 1.00 0.00 C ATOM 388 NZ LYS A 26 1.113 -2.610 -10.494 1.00 0.00 N ATOM 0 H LYS A 26 -0.600 -6.700 -4.888 1.00 0.00 H new ATOM 0 HA LYS A 26 -2.583 -4.886 -5.849 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -0.086 -5.085 -6.417 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -0.509 -6.473 -7.399 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.849 -5.119 -8.883 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -1.738 -3.732 -7.819 1.00 0.00 H new ATOM 0 HD2 LYS A 26 0.776 -3.776 -8.125 1.00 0.00 H new ATOM 0 HD3 LYS A 26 0.568 -5.056 -9.303 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -0.745 -3.593 -10.753 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.756 -2.328 -9.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 0.906 -1.905 -11.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 1.658 -2.162 -9.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 1.668 -3.387 -10.905 1.00 0.00 H new ATOM 402 N LYS A 27 -2.902 -8.035 -6.598 1.00 0.00 N ATOM 403 CA LYS A 27 -3.781 -9.029 -7.190 1.00 0.00 C ATOM 404 C LYS A 27 -5.195 -8.900 -6.622 1.00 0.00 C ATOM 405 O LYS A 27 -6.177 -8.856 -7.368 1.00 0.00 O ATOM 406 CB LYS A 27 -3.219 -10.420 -6.902 1.00 0.00 C ATOM 407 CG LYS A 27 -4.002 -11.562 -7.529 1.00 0.00 C ATOM 408 CD LYS A 27 -3.433 -12.903 -7.096 1.00 0.00 C ATOM 409 CE LYS A 27 -2.062 -13.169 -7.706 1.00 0.00 C ATOM 410 NZ LYS A 27 -2.111 -13.267 -9.191 1.00 0.00 N ATOM 0 H LYS A 27 -2.147 -8.428 -6.036 1.00 0.00 H new ATOM 0 HA LYS A 27 -3.835 -8.871 -8.267 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -2.190 -10.463 -7.260 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -3.187 -10.568 -5.823 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -5.050 -11.495 -7.237 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -3.968 -11.480 -8.615 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -3.357 -12.930 -6.009 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -4.119 -13.698 -7.387 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -1.379 -12.370 -7.420 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -1.659 -14.095 -7.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -1.681 -14.164 -9.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -3.101 -13.233 -9.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -1.586 -12.473 -9.609 1.00 0.00 H new ATOM 424 N GLY A 28 -5.287 -8.821 -5.298 1.00 0.00 N ATOM 425 CA GLY A 28 -6.580 -8.718 -4.640 1.00 0.00 C ATOM 426 C GLY A 28 -7.255 -7.381 -4.892 1.00 0.00 C ATOM 427 O GLY A 28 -8.485 -7.289 -4.911 1.00 0.00 O ATOM 0 H GLY A 28 -4.487 -8.826 -4.666 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -7.228 -9.521 -4.992 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -6.451 -8.860 -3.567 1.00 0.00 H new ATOM 431 N ALA A 29 -6.449 -6.345 -5.094 1.00 0.00 N ATOM 432 CA ALA A 29 -6.968 -5.010 -5.354 1.00 0.00 C ATOM 433 C ALA A 29 -7.742 -4.967 -6.667 1.00 0.00 C ATOM 434 O ALA A 29 -8.834 -4.394 -6.736 1.00 0.00 O ATOM 435 CB ALA A 29 -5.834 -3.996 -5.370 1.00 0.00 C ATOM 0 H ALA A 29 -5.431 -6.406 -5.082 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.657 -4.752 -4.550 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -6.237 -3.002 -5.566 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -5.329 -3.999 -4.404 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -5.122 -4.259 -6.152 1.00 0.00 H new ATOM 441 N LYS A 30 -7.183 -5.582 -7.703 1.00 0.00 N ATOM 442 CA LYS A 30 -7.837 -5.610 -9.005 1.00 0.00 C ATOM 443 C LYS A 30 -9.081 -6.493 -8.957 1.00 0.00 C ATOM 444 O LYS A 30 -10.059 -6.240 -9.662 1.00 0.00 O ATOM 445 CB LYS A 30 -6.889 -6.115 -10.094 1.00 0.00 C ATOM 446 CG LYS A 30 -7.414 -5.850 -11.498 1.00 0.00 C ATOM 447 CD LYS A 30 -6.608 -6.569 -12.568 1.00 0.00 C ATOM 448 CE LYS A 30 -6.787 -8.076 -12.490 1.00 0.00 C ATOM 449 NZ LYS A 30 -6.278 -8.746 -13.714 1.00 0.00 N ATOM 0 H LYS A 30 -6.285 -6.064 -7.667 1.00 0.00 H new ATOM 0 HA LYS A 30 -8.128 -4.588 -9.250 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -5.918 -5.634 -9.977 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -6.732 -7.186 -9.965 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -8.455 -6.166 -11.558 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -7.395 -4.778 -11.693 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -6.915 -6.217 -13.553 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -5.552 -6.322 -12.456 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -6.261 -8.462 -11.617 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -7.843 -8.312 -12.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -6.415 -9.774 -13.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -6.797 -8.395 -14.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -5.265 -8.540 -13.827 1.00 0.00 H new ATOM 463 N LYS A 31 -9.033 -7.523 -8.113 1.00 0.00 N ATOM 464 CA LYS A 31 -10.155 -8.441 -7.936 1.00 0.00 C ATOM 465 C LYS A 31 -11.398 -7.684 -7.482 1.00 0.00 C ATOM 466 O LYS A 31 -12.497 -7.898 -7.997 1.00 0.00 O ATOM 467 CB LYS A 31 -9.800 -9.519 -6.904 1.00 0.00 C ATOM 468 CG LYS A 31 -10.952 -10.454 -6.571 1.00 0.00 C ATOM 469 CD LYS A 31 -11.351 -11.303 -7.766 1.00 0.00 C ATOM 470 CE LYS A 31 -12.628 -12.082 -7.497 1.00 0.00 C ATOM 471 NZ LYS A 31 -12.522 -12.934 -6.284 1.00 0.00 N ATOM 0 H LYS A 31 -8.221 -7.743 -7.537 1.00 0.00 H new ATOM 0 HA LYS A 31 -10.363 -8.917 -8.894 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -8.964 -10.108 -7.281 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -9.461 -9.034 -5.988 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -10.666 -11.103 -5.743 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -11.810 -9.870 -6.237 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -11.491 -10.663 -8.637 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -10.545 -11.996 -8.006 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -13.458 -11.386 -7.378 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -12.858 -12.708 -8.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -13.360 -13.546 -6.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -11.667 -13.523 -6.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -12.464 -12.330 -5.439 1.00 0.00 H new ATOM 485 N MET A 32 -11.206 -6.784 -6.528 1.00 0.00 N ATOM 486 CA MET A 32 -12.307 -6.015 -5.963 1.00 0.00 C ATOM 487 C MET A 32 -12.723 -4.878 -6.894 1.00 0.00 C ATOM 488 O MET A 32 -13.700 -4.173 -6.630 1.00 0.00 O ATOM 489 CB MET A 32 -11.914 -5.466 -4.589 1.00 0.00 C ATOM 490 CG MET A 32 -11.701 -6.543 -3.535 1.00 0.00 C ATOM 491 SD MET A 32 -13.233 -7.380 -3.077 1.00 0.00 S ATOM 492 CE MET A 32 -12.626 -8.558 -1.866 1.00 0.00 C ATOM 0 H MET A 32 -10.293 -6.567 -6.127 1.00 0.00 H new ATOM 0 HA MET A 32 -13.163 -6.680 -5.848 1.00 0.00 H new ATOM 0 HB2 MET A 32 -10.999 -4.883 -4.689 1.00 0.00 H new ATOM 0 HB3 MET A 32 -12.691 -4.783 -4.245 1.00 0.00 H new ATOM 0 HG2 MET A 32 -10.988 -7.277 -3.910 1.00 0.00 H new ATOM 0 HG3 MET A 32 -11.257 -6.094 -2.647 1.00 0.00 H new ATOM 0 HE1 MET A 32 -13.458 -9.153 -1.488 1.00 0.00 H new ATOM 0 HE2 MET A 32 -11.893 -9.215 -2.334 1.00 0.00 H new ATOM 0 HE3 MET A 32 -12.158 -8.022 -1.040 1.00 0.00 H new ATOM 502 N GLY A 33 -11.974 -4.705 -7.980 1.00 0.00 N ATOM 503 CA GLY A 33 -12.315 -3.704 -8.972 1.00 0.00 C ATOM 504 C GLY A 33 -11.895 -2.304 -8.566 1.00 0.00 C ATOM 505 O GLY A 33 -12.679 -1.361 -8.667 1.00 0.00 O ATOM 0 H GLY A 33 -11.134 -5.244 -8.190 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -11.839 -3.961 -9.918 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -13.392 -3.720 -9.142 1.00 0.00 H new ATOM 509 N ASN A 34 -10.656 -2.162 -8.113 1.00 0.00 N ATOM 510 CA ASN A 34 -10.143 -0.862 -7.689 1.00 0.00 C ATOM 511 C ASN A 34 -8.828 -0.553 -8.385 1.00 0.00 C ATOM 512 O ASN A 34 -8.282 -1.391 -9.102 1.00 0.00 O ATOM 513 CB ASN A 34 -9.940 -0.819 -6.169 1.00 0.00 C ATOM 514 CG ASN A 34 -11.203 -1.140 -5.394 1.00 0.00 C ATOM 515 OD1 ASN A 34 -12.030 -0.268 -5.135 1.00 0.00 O ATOM 516 ND2 ASN A 34 -11.348 -2.392 -5.002 1.00 0.00 N ATOM 0 H ASN A 34 -9.988 -2.928 -8.029 1.00 0.00 H new ATOM 0 HA ASN A 34 -10.881 -0.110 -7.966 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -9.160 -1.528 -5.892 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -9.586 0.172 -5.883 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -12.170 -2.666 -4.463 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -10.638 -3.086 -5.238 1.00 0.00 H new ATOM 523 N LEU A 35 -8.329 0.657 -8.177 1.00 0.00 N ATOM 524 CA LEU A 35 -7.054 1.067 -8.745 1.00 0.00 C ATOM 525 C LEU A 35 -6.031 1.241 -7.636 1.00 0.00 C ATOM 526 O LEU A 35 -6.251 1.996 -6.688 1.00 0.00 O ATOM 527 CB LEU A 35 -7.182 2.375 -9.537 1.00 0.00 C ATOM 528 CG LEU A 35 -7.780 2.259 -10.945 1.00 0.00 C ATOM 529 CD1 LEU A 35 -9.254 1.894 -10.894 1.00 0.00 C ATOM 530 CD2 LEU A 35 -7.579 3.559 -11.706 1.00 0.00 C ATOM 0 H LEU A 35 -8.790 1.374 -7.617 1.00 0.00 H new ATOM 0 HA LEU A 35 -6.728 0.287 -9.433 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -7.796 3.066 -8.960 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -6.192 2.823 -9.621 1.00 0.00 H new ATOM 0 HG LEU A 35 -7.260 1.457 -11.468 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -9.646 1.820 -11.908 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -9.374 0.936 -10.388 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -9.801 2.664 -10.349 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -8.007 3.466 -12.704 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -8.072 4.372 -11.174 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -6.513 3.772 -11.787 1.00 0.00 H new ATOM 542 N ILE A 36 -4.917 0.543 -7.756 1.00 0.00 N ATOM 543 CA ILE A 36 -3.901 0.575 -6.726 1.00 0.00 C ATOM 544 C ILE A 36 -2.541 0.924 -7.322 1.00 0.00 C ATOM 545 O ILE A 36 -2.198 0.491 -8.429 1.00 0.00 O ATOM 546 CB ILE A 36 -3.831 -0.776 -5.971 1.00 0.00 C ATOM 547 CG1 ILE A 36 -2.899 -0.668 -4.763 1.00 0.00 C ATOM 548 CG2 ILE A 36 -3.384 -1.894 -6.903 1.00 0.00 C ATOM 549 CD1 ILE A 36 -2.862 -1.917 -3.906 1.00 0.00 C ATOM 0 H ILE A 36 -4.695 -0.051 -8.555 1.00 0.00 H new ATOM 0 HA ILE A 36 -4.174 1.350 -6.010 1.00 0.00 H new ATOM 0 HB ILE A 36 -4.830 -1.019 -5.610 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -1.890 -0.448 -5.113 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.213 0.175 -4.147 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.342 -2.833 -6.351 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.093 -1.988 -7.725 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -2.396 -1.663 -7.301 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.180 -1.764 -3.070 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.862 -2.127 -3.525 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -2.518 -2.760 -4.506 1.00 0.00 H new ATOM 561 N LYS A 37 -1.790 1.737 -6.599 1.00 0.00 N ATOM 562 CA LYS A 37 -0.438 2.098 -6.993 1.00 0.00 C ATOM 563 C LYS A 37 0.545 1.587 -5.954 1.00 0.00 C ATOM 564 O LYS A 37 0.659 2.154 -4.868 1.00 0.00 O ATOM 565 CB LYS A 37 -0.311 3.618 -7.154 1.00 0.00 C ATOM 566 CG LYS A 37 -1.055 4.173 -8.361 1.00 0.00 C ATOM 567 CD LYS A 37 -0.469 3.654 -9.666 1.00 0.00 C ATOM 568 CE LYS A 37 0.939 4.184 -9.900 1.00 0.00 C ATOM 569 NZ LYS A 37 0.944 5.605 -10.347 1.00 0.00 N ATOM 0 H LYS A 37 -2.098 2.164 -5.726 1.00 0.00 H new ATOM 0 HA LYS A 37 -0.212 1.638 -7.955 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -0.688 4.102 -6.253 1.00 0.00 H new ATOM 0 HB3 LYS A 37 0.744 3.878 -7.238 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -2.108 3.897 -8.299 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -1.009 5.262 -8.348 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -0.450 2.564 -9.648 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -1.111 3.948 -10.496 1.00 0.00 H new ATOM 0 HE2 LYS A 37 1.516 4.093 -8.980 1.00 0.00 H new ATOM 0 HE3 LYS A 37 1.436 3.568 -10.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 1.831 6.059 -10.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 0.866 5.643 -11.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 0.138 6.106 -9.921 1.00 0.00 H new ATOM 583 N VAL A 38 1.232 0.501 -6.275 1.00 0.00 N ATOM 584 CA VAL A 38 2.143 -0.122 -5.325 1.00 0.00 C ATOM 585 C VAL A 38 3.590 0.238 -5.640 1.00 0.00 C ATOM 586 O VAL A 38 4.083 -0.024 -6.740 1.00 0.00 O ATOM 587 CB VAL A 38 2.000 -1.662 -5.295 1.00 0.00 C ATOM 588 CG1 VAL A 38 2.799 -2.255 -4.144 1.00 0.00 C ATOM 589 CG2 VAL A 38 0.539 -2.069 -5.194 1.00 0.00 C ATOM 0 H VAL A 38 1.177 0.035 -7.180 1.00 0.00 H new ATOM 0 HA VAL A 38 1.872 0.266 -4.343 1.00 0.00 H new ATOM 0 HB VAL A 38 2.400 -2.055 -6.230 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.684 -3.339 -4.142 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.852 -2.002 -4.264 1.00 0.00 H new ATOM 0 HG13 VAL A 38 2.434 -1.850 -3.201 1.00 0.00 H new ATOM 0 HG21 VAL A 38 0.465 -3.156 -5.175 1.00 0.00 H new ATOM 0 HG22 VAL A 38 0.110 -1.660 -4.280 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -0.006 -1.683 -6.055 1.00 0.00 H new ATOM 599 N GLU A 39 4.259 0.836 -4.670 1.00 0.00 N ATOM 600 CA GLU A 39 5.658 1.202 -4.805 1.00 0.00 C ATOM 601 C GLU A 39 6.541 0.107 -4.222 1.00 0.00 C ATOM 602 O GLU A 39 6.378 -0.277 -3.064 1.00 0.00 O ATOM 603 CB GLU A 39 5.935 2.523 -4.081 1.00 0.00 C ATOM 604 CG GLU A 39 7.381 2.983 -4.180 1.00 0.00 C ATOM 605 CD GLU A 39 7.698 4.145 -3.260 1.00 0.00 C ATOM 606 OE1 GLU A 39 7.279 5.280 -3.561 1.00 0.00 O ATOM 607 OE2 GLU A 39 8.387 3.928 -2.242 1.00 0.00 O ATOM 0 H GLU A 39 3.849 1.081 -3.769 1.00 0.00 H new ATOM 0 HA GLU A 39 5.884 1.323 -5.864 1.00 0.00 H new ATOM 0 HB2 GLU A 39 5.288 3.296 -4.495 1.00 0.00 H new ATOM 0 HB3 GLU A 39 5.669 2.414 -3.030 1.00 0.00 H new ATOM 0 HG2 GLU A 39 8.039 2.148 -3.941 1.00 0.00 H new ATOM 0 HG3 GLU A 39 7.595 3.273 -5.209 1.00 0.00 H new ATOM 614 N THR A 40 7.462 -0.404 -5.028 1.00 0.00 N ATOM 615 CA THR A 40 8.399 -1.404 -4.559 1.00 0.00 C ATOM 616 C THR A 40 9.744 -0.764 -4.241 1.00 0.00 C ATOM 617 O THR A 40 10.479 -0.341 -5.139 1.00 0.00 O ATOM 618 CB THR A 40 8.585 -2.535 -5.592 1.00 0.00 C ATOM 619 OG1 THR A 40 8.820 -1.986 -6.896 1.00 0.00 O ATOM 620 CG2 THR A 40 7.362 -3.441 -5.630 1.00 0.00 C ATOM 0 H THR A 40 7.577 -0.140 -6.007 1.00 0.00 H new ATOM 0 HA THR A 40 7.986 -1.841 -3.650 1.00 0.00 H new ATOM 0 HB THR A 40 9.449 -3.127 -5.291 1.00 0.00 H new ATOM 0 HG1 THR A 40 9.516 -2.506 -7.350 1.00 0.00 H new ATOM 0 HG21 THR A 40 7.517 -4.230 -6.365 1.00 0.00 H new ATOM 0 HG22 THR A 40 7.208 -3.886 -4.647 1.00 0.00 H new ATOM 0 HG23 THR A 40 6.484 -2.856 -5.905 1.00 0.00 H new ATOM 628 N GLN A 41 10.043 -0.659 -2.958 1.00 0.00 N ATOM 629 CA GLN A 41 11.297 -0.082 -2.516 1.00 0.00 C ATOM 630 C GLN A 41 12.180 -1.177 -1.932 1.00 0.00 C ATOM 631 O GLN A 41 11.917 -1.693 -0.847 1.00 0.00 O ATOM 632 CB GLN A 41 11.021 1.023 -1.493 1.00 0.00 C ATOM 633 CG GLN A 41 12.230 1.874 -1.148 1.00 0.00 C ATOM 634 CD GLN A 41 11.857 3.145 -0.401 1.00 0.00 C ATOM 635 OE1 GLN A 41 12.633 3.663 0.401 1.00 0.00 O ATOM 636 NE2 GLN A 41 10.667 3.668 -0.666 1.00 0.00 N ATOM 0 H GLN A 41 9.431 -0.968 -2.203 1.00 0.00 H new ATOM 0 HA GLN A 41 11.823 0.365 -3.360 1.00 0.00 H new ATOM 0 HB2 GLN A 41 10.234 1.671 -1.879 1.00 0.00 H new ATOM 0 HB3 GLN A 41 10.639 0.568 -0.579 1.00 0.00 H new ATOM 0 HG2 GLN A 41 12.920 1.289 -0.540 1.00 0.00 H new ATOM 0 HG3 GLN A 41 12.758 2.137 -2.065 1.00 0.00 H new ATOM 0 HE21 GLN A 41 10.048 3.213 -1.337 1.00 0.00 H new ATOM 0 HE22 GLN A 41 10.371 4.525 -0.199 1.00 0.00 H new ATOM 645 N GLY A 42 13.203 -1.560 -2.679 1.00 0.00 N ATOM 646 CA GLY A 42 14.064 -2.640 -2.248 1.00 0.00 C ATOM 647 C GLY A 42 15.191 -2.155 -1.367 1.00 0.00 C ATOM 648 O GLY A 42 14.984 -1.815 -0.206 1.00 0.00 O ATOM 0 H GLY A 42 13.452 -1.143 -3.576 1.00 0.00 H new ATOM 0 HA2 GLY A 42 13.474 -3.379 -1.706 1.00 0.00 H new ATOM 0 HA3 GLY A 42 14.479 -3.142 -3.122 1.00 0.00 H new ATOM 652 N ALA A 43 16.383 -2.103 -1.928 1.00 0.00 N ATOM 653 CA ALA A 43 17.555 -1.672 -1.184 1.00 0.00 C ATOM 654 C ALA A 43 18.144 -0.432 -1.831 1.00 0.00 C ATOM 655 O ALA A 43 18.969 -0.530 -2.738 1.00 0.00 O ATOM 656 CB ALA A 43 18.586 -2.789 -1.113 1.00 0.00 C ATOM 0 H ALA A 43 16.568 -2.354 -2.899 1.00 0.00 H new ATOM 0 HA ALA A 43 17.258 -1.428 -0.164 1.00 0.00 H new ATOM 0 HB1 ALA A 43 19.456 -2.446 -0.552 1.00 0.00 H new ATOM 0 HB2 ALA A 43 18.151 -3.655 -0.614 1.00 0.00 H new ATOM 0 HB3 ALA A 43 18.891 -3.067 -2.122 1.00 0.00 H new ATOM 662 N THR A 44 17.662 0.734 -1.398 1.00 0.00 N ATOM 663 CA THR A 44 18.065 2.020 -1.976 1.00 0.00 C ATOM 664 C THR A 44 17.480 2.193 -3.390 1.00 0.00 C ATOM 665 O THR A 44 17.491 3.285 -3.959 1.00 0.00 O ATOM 666 CB THR A 44 19.610 2.164 -1.997 1.00 0.00 C ATOM 667 OG1 THR A 44 20.134 1.959 -0.674 1.00 0.00 O ATOM 668 CG2 THR A 44 20.041 3.539 -2.497 1.00 0.00 C ATOM 0 H THR A 44 16.984 0.815 -0.640 1.00 0.00 H new ATOM 0 HA THR A 44 17.664 2.811 -1.343 1.00 0.00 H new ATOM 0 HB THR A 44 20.003 1.412 -2.681 1.00 0.00 H new ATOM 0 HG1 THR A 44 21.110 2.049 -0.691 1.00 0.00 H new ATOM 0 HG21 THR A 44 21.129 3.601 -2.497 1.00 0.00 H new ATOM 0 HG22 THR A 44 19.669 3.691 -3.510 1.00 0.00 H new ATOM 0 HG23 THR A 44 19.634 4.309 -1.841 1.00 0.00 H new ATOM 676 N GLY A 45 16.919 1.117 -3.929 1.00 0.00 N ATOM 677 CA GLY A 45 16.382 1.150 -5.266 1.00 0.00 C ATOM 678 C GLY A 45 14.872 1.125 -5.266 1.00 0.00 C ATOM 679 O GLY A 45 14.258 0.116 -4.906 1.00 0.00 O ATOM 0 H GLY A 45 16.829 0.218 -3.455 1.00 0.00 H new ATOM 0 HA2 GLY A 45 16.730 2.049 -5.775 1.00 0.00 H new ATOM 0 HA3 GLY A 45 16.759 0.297 -5.830 1.00 0.00 H new ATOM 683 N ILE A 46 14.274 2.241 -5.643 1.00 0.00 N ATOM 684 CA ILE A 46 12.828 2.343 -5.730 1.00 0.00 C ATOM 685 C ILE A 46 12.404 2.185 -7.183 1.00 0.00 C ATOM 686 O ILE A 46 12.964 2.830 -8.068 1.00 0.00 O ATOM 687 CB ILE A 46 12.327 3.700 -5.196 1.00 0.00 C ATOM 688 CG1 ILE A 46 13.027 4.048 -3.881 1.00 0.00 C ATOM 689 CG2 ILE A 46 10.822 3.661 -4.994 1.00 0.00 C ATOM 690 CD1 ILE A 46 12.625 5.392 -3.317 1.00 0.00 C ATOM 0 H ILE A 46 14.771 3.095 -5.895 1.00 0.00 H new ATOM 0 HA ILE A 46 12.390 1.555 -5.118 1.00 0.00 H new ATOM 0 HB ILE A 46 12.564 4.470 -5.930 1.00 0.00 H new ATOM 0 HG12 ILE A 46 12.806 3.274 -3.146 1.00 0.00 H new ATOM 0 HG13 ILE A 46 14.105 4.038 -4.040 1.00 0.00 H new ATOM 0 HG21 ILE A 46 10.480 4.625 -4.617 1.00 0.00 H new ATOM 0 HG22 ILE A 46 10.333 3.449 -5.945 1.00 0.00 H new ATOM 0 HG23 ILE A 46 10.571 2.881 -4.275 1.00 0.00 H new ATOM 0 HD11 ILE A 46 13.161 5.571 -2.385 1.00 0.00 H new ATOM 0 HD12 ILE A 46 12.872 6.176 -4.033 1.00 0.00 H new ATOM 0 HD13 ILE A 46 11.552 5.400 -3.126 1.00 0.00 H new ATOM 702 N GLU A 47 11.426 1.331 -7.437 1.00 0.00 N ATOM 703 CA GLU A 47 11.052 1.012 -8.811 1.00 0.00 C ATOM 704 C GLU A 47 9.759 1.703 -9.224 1.00 0.00 C ATOM 705 O GLU A 47 9.100 1.283 -10.176 1.00 0.00 O ATOM 706 CB GLU A 47 10.910 -0.498 -8.968 1.00 0.00 C ATOM 707 CG GLU A 47 12.146 -1.262 -8.536 1.00 0.00 C ATOM 708 CD GLU A 47 11.985 -2.754 -8.684 1.00 0.00 C ATOM 709 OE1 GLU A 47 11.117 -3.330 -7.997 1.00 0.00 O ATOM 710 OE2 GLU A 47 12.724 -3.357 -9.488 1.00 0.00 O ATOM 0 H GLU A 47 10.881 0.850 -6.722 1.00 0.00 H new ATOM 0 HA GLU A 47 11.843 1.379 -9.465 1.00 0.00 H new ATOM 0 HB2 GLU A 47 10.057 -0.839 -8.382 1.00 0.00 H new ATOM 0 HB3 GLU A 47 10.694 -0.730 -10.011 1.00 0.00 H new ATOM 0 HG2 GLU A 47 12.999 -0.931 -9.129 1.00 0.00 H new ATOM 0 HG3 GLU A 47 12.370 -1.026 -7.496 1.00 0.00 H new ATOM 717 N ASN A 48 9.406 2.773 -8.532 1.00 0.00 N ATOM 718 CA ASN A 48 8.180 3.500 -8.839 1.00 0.00 C ATOM 719 C ASN A 48 8.225 4.904 -8.250 1.00 0.00 C ATOM 720 O ASN A 48 8.323 5.888 -8.985 1.00 0.00 O ATOM 721 CB ASN A 48 6.958 2.751 -8.290 1.00 0.00 C ATOM 722 CG ASN A 48 5.649 3.277 -8.856 1.00 0.00 C ATOM 723 OD1 ASN A 48 5.091 4.259 -8.363 1.00 0.00 O ATOM 724 ND2 ASN A 48 5.136 2.610 -9.880 1.00 0.00 N ATOM 0 H ASN A 48 9.946 3.158 -7.757 1.00 0.00 H new ATOM 0 HA ASN A 48 8.096 3.574 -9.923 1.00 0.00 H new ATOM 0 HB2 ASN A 48 7.051 1.690 -8.524 1.00 0.00 H new ATOM 0 HB3 ASN A 48 6.941 2.838 -7.204 1.00 0.00 H new ATOM 0 HD21 ASN A 48 4.249 2.905 -10.288 1.00 0.00 H new ATOM 0 HD22 ASN A 48 5.628 1.802 -10.260 1.00 0.00 H new ATOM 731 N GLU A 49 8.185 4.971 -6.920 1.00 0.00 N ATOM 732 CA GLU A 49 8.092 6.229 -6.183 1.00 0.00 C ATOM 733 C GLU A 49 6.802 6.961 -6.540 1.00 0.00 C ATOM 734 O GLU A 49 6.715 7.639 -7.571 1.00 0.00 O ATOM 735 CB GLU A 49 9.318 7.123 -6.404 1.00 0.00 C ATOM 736 CG GLU A 49 9.220 8.463 -5.690 1.00 0.00 C ATOM 737 CD GLU A 49 10.550 9.177 -5.577 1.00 0.00 C ATOM 738 OE1 GLU A 49 11.279 9.260 -6.586 1.00 0.00 O ATOM 739 OE2 GLU A 49 10.866 9.669 -4.475 1.00 0.00 O ATOM 0 H GLU A 49 8.217 4.147 -6.320 1.00 0.00 H new ATOM 0 HA GLU A 49 8.071 5.986 -5.121 1.00 0.00 H new ATOM 0 HB2 GLU A 49 10.209 6.599 -6.058 1.00 0.00 H new ATOM 0 HB3 GLU A 49 9.445 7.297 -7.473 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.516 9.101 -6.224 1.00 0.00 H new ATOM 0 HG3 GLU A 49 8.813 8.306 -4.691 1.00 0.00 H new ATOM 746 N LEU A 50 5.801 6.795 -5.687 1.00 0.00 N ATOM 747 CA LEU A 50 4.487 7.391 -5.909 1.00 0.00 C ATOM 748 C LEU A 50 4.585 8.911 -5.953 1.00 0.00 C ATOM 749 O LEU A 50 5.194 9.533 -5.076 1.00 0.00 O ATOM 750 CB LEU A 50 3.515 6.958 -4.807 1.00 0.00 C ATOM 751 CG LEU A 50 3.338 5.445 -4.647 1.00 0.00 C ATOM 752 CD1 LEU A 50 2.379 5.134 -3.510 1.00 0.00 C ATOM 753 CD2 LEU A 50 2.843 4.823 -5.945 1.00 0.00 C ATOM 0 H LEU A 50 5.873 6.249 -4.828 1.00 0.00 H new ATOM 0 HA LEU A 50 4.111 7.041 -6.870 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.861 7.369 -3.858 1.00 0.00 H new ATOM 0 HB3 LEU A 50 2.540 7.402 -5.010 1.00 0.00 H new ATOM 0 HG LEU A 50 4.309 5.013 -4.406 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.267 4.054 -3.413 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.773 5.543 -2.580 1.00 0.00 H new ATOM 0 HD13 LEU A 50 1.408 5.582 -3.720 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.724 3.748 -5.811 1.00 0.00 H new ATOM 0 HD22 LEU A 50 1.884 5.264 -6.217 1.00 0.00 H new ATOM 0 HD23 LEU A 50 3.567 5.012 -6.738 1.00 0.00 H new ATOM 765 N THR A 51 3.995 9.503 -6.983 1.00 0.00 N ATOM 766 CA THR A 51 4.042 10.944 -7.160 1.00 0.00 C ATOM 767 C THR A 51 3.107 11.625 -6.172 1.00 0.00 C ATOM 768 O THR A 51 2.185 10.997 -5.651 1.00 0.00 O ATOM 769 CB THR A 51 3.629 11.355 -8.588 1.00 0.00 C ATOM 770 OG1 THR A 51 2.227 11.125 -8.782 1.00 0.00 O ATOM 771 CG2 THR A 51 4.422 10.578 -9.629 1.00 0.00 C ATOM 0 H THR A 51 3.478 9.005 -7.708 1.00 0.00 H new ATOM 0 HA THR A 51 5.072 11.257 -6.986 1.00 0.00 H new ATOM 0 HB THR A 51 3.843 12.417 -8.709 1.00 0.00 H new ATOM 0 HG1 THR A 51 2.082 10.192 -9.046 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.112 10.886 -10.627 1.00 0.00 H new ATOM 0 HG22 THR A 51 5.486 10.779 -9.501 1.00 0.00 H new ATOM 0 HG23 THR A 51 4.237 9.511 -9.505 1.00 0.00 H new ATOM 779 N GLU A 52 3.338 12.907 -5.925 1.00 0.00 N ATOM 780 CA GLU A 52 2.470 13.684 -5.053 1.00 0.00 C ATOM 781 C GLU A 52 1.043 13.678 -5.596 1.00 0.00 C ATOM 782 O GLU A 52 0.074 13.658 -4.832 1.00 0.00 O ATOM 783 CB GLU A 52 3.015 15.111 -4.921 1.00 0.00 C ATOM 784 CG GLU A 52 2.117 16.062 -4.146 1.00 0.00 C ATOM 785 CD GLU A 52 1.372 17.018 -5.055 1.00 0.00 C ATOM 786 OE1 GLU A 52 1.977 18.024 -5.481 1.00 0.00 O ATOM 787 OE2 GLU A 52 0.190 16.766 -5.362 1.00 0.00 O ATOM 0 H GLU A 52 4.120 13.431 -6.317 1.00 0.00 H new ATOM 0 HA GLU A 52 2.450 13.235 -4.060 1.00 0.00 H new ATOM 0 HB2 GLU A 52 3.988 15.070 -4.431 1.00 0.00 H new ATOM 0 HB3 GLU A 52 3.177 15.518 -5.919 1.00 0.00 H new ATOM 0 HG2 GLU A 52 1.399 15.486 -3.562 1.00 0.00 H new ATOM 0 HG3 GLU A 52 2.719 16.632 -3.439 1.00 0.00 H new ATOM 794 N LYS A 53 0.925 13.650 -6.918 1.00 0.00 N ATOM 795 CA LYS A 53 -0.374 13.613 -7.567 1.00 0.00 C ATOM 796 C LYS A 53 -1.082 12.295 -7.254 1.00 0.00 C ATOM 797 O LYS A 53 -2.220 12.295 -6.783 1.00 0.00 O ATOM 798 CB LYS A 53 -0.220 13.787 -9.080 1.00 0.00 C ATOM 799 CG LYS A 53 -1.417 14.459 -9.733 1.00 0.00 C ATOM 800 CD LYS A 53 -1.604 15.872 -9.205 1.00 0.00 C ATOM 801 CE LYS A 53 -2.834 16.545 -9.791 1.00 0.00 C ATOM 802 NZ LYS A 53 -4.083 15.812 -9.456 1.00 0.00 N ATOM 0 H LYS A 53 1.717 13.652 -7.561 1.00 0.00 H new ATOM 0 HA LYS A 53 -0.979 14.435 -7.184 1.00 0.00 H new ATOM 0 HB2 LYS A 53 0.674 14.377 -9.282 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -0.067 12.810 -9.537 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -1.278 14.486 -10.814 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -2.316 13.874 -9.542 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -1.690 15.844 -8.119 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -0.720 16.466 -9.440 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -2.902 17.566 -9.416 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -2.731 16.609 -10.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -4.904 16.421 -9.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -4.147 14.952 -10.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -4.073 15.550 -8.450 1.00 0.00 H new ATOM 816 N ASP A 54 -0.392 11.176 -7.494 1.00 0.00 N ATOM 817 CA ASP A 54 -0.940 9.845 -7.203 1.00 0.00 C ATOM 818 C ASP A 54 -1.323 9.726 -5.738 1.00 0.00 C ATOM 819 O ASP A 54 -2.355 9.146 -5.396 1.00 0.00 O ATOM 820 CB ASP A 54 0.069 8.736 -7.539 1.00 0.00 C ATOM 821 CG ASP A 54 0.185 8.451 -9.022 1.00 0.00 C ATOM 822 OD1 ASP A 54 -0.663 7.700 -9.557 1.00 0.00 O ATOM 823 OD2 ASP A 54 1.139 8.945 -9.656 1.00 0.00 O ATOM 0 H ASP A 54 0.548 11.164 -7.889 1.00 0.00 H new ATOM 0 HA ASP A 54 -1.826 9.724 -7.827 1.00 0.00 H new ATOM 0 HB2 ASP A 54 1.049 9.019 -7.154 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -0.224 7.821 -7.024 1.00 0.00 H new ATOM 828 N VAL A 55 -0.479 10.281 -4.886 1.00 0.00 N ATOM 829 CA VAL A 55 -0.682 10.246 -3.446 1.00 0.00 C ATOM 830 C VAL A 55 -1.972 10.954 -3.031 1.00 0.00 C ATOM 831 O VAL A 55 -2.644 10.529 -2.088 1.00 0.00 O ATOM 832 CB VAL A 55 0.529 10.874 -2.726 1.00 0.00 C ATOM 833 CG1 VAL A 55 0.231 11.152 -1.268 1.00 0.00 C ATOM 834 CG2 VAL A 55 1.733 9.963 -2.850 1.00 0.00 C ATOM 0 H VAL A 55 0.369 10.770 -5.173 1.00 0.00 H new ATOM 0 HA VAL A 55 -0.777 9.201 -3.152 1.00 0.00 H new ATOM 0 HB VAL A 55 0.746 11.829 -3.206 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.108 11.594 -0.795 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -0.608 11.843 -1.194 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -0.022 10.219 -0.764 1.00 0.00 H new ATOM 0 HG21 VAL A 55 2.584 10.413 -2.339 1.00 0.00 H new ATOM 0 HG22 VAL A 55 1.507 8.998 -2.397 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.975 9.822 -3.903 1.00 0.00 H new ATOM 844 N ASN A 56 -2.319 12.023 -3.737 1.00 0.00 N ATOM 845 CA ASN A 56 -3.543 12.761 -3.444 1.00 0.00 C ATOM 846 C ASN A 56 -4.753 12.095 -4.085 1.00 0.00 C ATOM 847 O ASN A 56 -5.865 12.178 -3.563 1.00 0.00 O ATOM 848 CB ASN A 56 -3.436 14.211 -3.917 1.00 0.00 C ATOM 849 CG ASN A 56 -2.703 15.097 -2.930 1.00 0.00 C ATOM 850 OD1 ASN A 56 -3.316 15.689 -2.040 1.00 0.00 O ATOM 851 ND2 ASN A 56 -1.396 15.211 -3.082 1.00 0.00 N ATOM 0 H ASN A 56 -1.774 12.398 -4.513 1.00 0.00 H new ATOM 0 HA ASN A 56 -3.676 12.755 -2.362 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -2.919 14.238 -4.876 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -4.437 14.609 -4.082 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -0.859 15.805 -2.450 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -0.924 14.705 -3.831 1.00 0.00 H new ATOM 858 N ILE A 57 -4.535 11.448 -5.226 1.00 0.00 N ATOM 859 CA ILE A 57 -5.597 10.706 -5.894 1.00 0.00 C ATOM 860 C ILE A 57 -6.028 9.523 -5.032 1.00 0.00 C ATOM 861 O ILE A 57 -7.221 9.303 -4.808 1.00 0.00 O ATOM 862 CB ILE A 57 -5.155 10.198 -7.287 1.00 0.00 C ATOM 863 CG1 ILE A 57 -4.782 11.379 -8.186 1.00 0.00 C ATOM 864 CG2 ILE A 57 -6.260 9.368 -7.932 1.00 0.00 C ATOM 865 CD1 ILE A 57 -4.222 10.969 -9.529 1.00 0.00 C ATOM 0 H ILE A 57 -3.635 11.423 -5.705 1.00 0.00 H new ATOM 0 HA ILE A 57 -6.436 11.388 -6.035 1.00 0.00 H new ATOM 0 HB ILE A 57 -4.278 9.562 -7.161 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -5.666 11.997 -8.344 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -4.048 11.999 -7.671 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -5.930 9.020 -8.911 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -6.487 8.510 -7.299 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.155 9.980 -8.047 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -3.981 11.859 -10.110 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -3.319 10.377 -9.381 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -4.962 10.375 -10.066 1.00 0.00 H new ATOM 877 N GLY A 58 -5.045 8.769 -4.551 1.00 0.00 N ATOM 878 CA GLY A 58 -5.317 7.692 -3.626 1.00 0.00 C ATOM 879 C GLY A 58 -5.822 8.211 -2.295 1.00 0.00 C ATOM 880 O GLY A 58 -5.377 9.256 -1.822 1.00 0.00 O ATOM 0 H GLY A 58 -4.060 8.888 -4.789 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -6.057 7.019 -4.059 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -4.409 7.109 -3.469 1.00 0.00 H new ATOM 884 N GLU A 59 -6.748 7.487 -1.688 1.00 0.00 N ATOM 885 CA GLU A 59 -7.347 7.920 -0.434 1.00 0.00 C ATOM 886 C GLU A 59 -6.684 7.228 0.748 1.00 0.00 C ATOM 887 O GLU A 59 -5.996 7.866 1.549 1.00 0.00 O ATOM 888 CB GLU A 59 -8.852 7.643 -0.435 1.00 0.00 C ATOM 889 CG GLU A 59 -9.607 8.392 -1.522 1.00 0.00 C ATOM 890 CD GLU A 59 -11.100 8.156 -1.461 1.00 0.00 C ATOM 891 OE1 GLU A 59 -11.572 7.150 -2.026 1.00 0.00 O ATOM 892 OE2 GLU A 59 -11.813 8.976 -0.849 1.00 0.00 O ATOM 0 H GLU A 59 -7.102 6.598 -2.042 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.190 8.994 -0.336 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -9.016 6.573 -0.561 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.264 7.916 0.536 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -9.407 9.459 -1.428 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -9.233 8.082 -2.498 1.00 0.00 H new ATOM 899 N VAL A 60 -6.873 5.921 0.849 1.00 0.00 N ATOM 900 CA VAL A 60 -6.314 5.159 1.937 1.00 0.00 C ATOM 901 C VAL A 60 -4.976 4.554 1.517 1.00 0.00 C ATOM 902 O VAL A 60 -4.788 4.178 0.357 1.00 0.00 O ATOM 903 CB VAL A 60 -7.292 4.054 2.394 1.00 0.00 C ATOM 904 CG1 VAL A 60 -7.543 3.039 1.288 1.00 0.00 C ATOM 905 CG2 VAL A 60 -6.774 3.377 3.640 1.00 0.00 C ATOM 0 H VAL A 60 -7.414 5.370 0.182 1.00 0.00 H new ATOM 0 HA VAL A 60 -6.147 5.829 2.781 1.00 0.00 H new ATOM 0 HB VAL A 60 -8.247 4.525 2.626 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -8.235 2.276 1.644 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -7.973 3.543 0.422 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -6.601 2.570 1.004 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -7.474 2.601 3.950 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -5.802 2.928 3.433 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -6.671 4.113 4.438 1.00 0.00 H new ATOM 915 N VAL A 61 -4.045 4.489 2.454 1.00 0.00 N ATOM 916 CA VAL A 61 -2.705 4.013 2.162 1.00 0.00 C ATOM 917 C VAL A 61 -2.463 2.654 2.809 1.00 0.00 C ATOM 918 O VAL A 61 -2.929 2.392 3.920 1.00 0.00 O ATOM 919 CB VAL A 61 -1.638 5.005 2.669 1.00 0.00 C ATOM 920 CG1 VAL A 61 -0.264 4.642 2.124 1.00 0.00 C ATOM 921 CG2 VAL A 61 -2.012 6.434 2.302 1.00 0.00 C ATOM 0 H VAL A 61 -4.194 4.761 3.426 1.00 0.00 H new ATOM 0 HA VAL A 61 -2.623 3.923 1.079 1.00 0.00 H new ATOM 0 HB VAL A 61 -1.597 4.938 3.756 1.00 0.00 H new ATOM 0 HG11 VAL A 61 0.474 5.354 2.494 1.00 0.00 H new ATOM 0 HG12 VAL A 61 0.004 3.638 2.453 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -0.285 4.674 1.035 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -1.246 7.116 2.669 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -2.088 6.523 1.218 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -2.971 6.687 2.755 1.00 0.00 H new ATOM 931 N ILE A 62 -1.745 1.793 2.107 1.00 0.00 N ATOM 932 CA ILE A 62 -1.387 0.487 2.637 1.00 0.00 C ATOM 933 C ILE A 62 0.126 0.343 2.713 1.00 0.00 C ATOM 934 O ILE A 62 0.820 0.407 1.695 1.00 0.00 O ATOM 935 CB ILE A 62 -1.974 -0.658 1.778 1.00 0.00 C ATOM 936 CG1 ILE A 62 -3.504 -0.595 1.781 1.00 0.00 C ATOM 937 CG2 ILE A 62 -1.489 -2.012 2.289 1.00 0.00 C ATOM 938 CD1 ILE A 62 -4.162 -1.663 0.934 1.00 0.00 C ATOM 0 H ILE A 62 -1.397 1.975 1.166 1.00 0.00 H new ATOM 0 HA ILE A 62 -1.811 0.414 3.638 1.00 0.00 H new ATOM 0 HB ILE A 62 -1.627 -0.536 0.752 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.860 -0.688 2.807 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -3.819 0.385 1.422 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -1.912 -2.806 1.673 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.401 -2.052 2.237 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -1.808 -2.146 3.323 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -5.245 -1.553 0.987 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -3.837 -1.558 -0.101 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.879 -2.648 1.306 1.00 0.00 H new ATOM 950 N PHE A 63 0.638 0.175 3.918 1.00 0.00 N ATOM 951 CA PHE A 63 2.058 -0.035 4.118 1.00 0.00 C ATOM 952 C PHE A 63 2.343 -1.479 4.469 1.00 0.00 C ATOM 953 O PHE A 63 1.845 -1.999 5.467 1.00 0.00 O ATOM 954 CB PHE A 63 2.613 0.876 5.217 1.00 0.00 C ATOM 955 CG PHE A 63 3.069 2.218 4.720 1.00 0.00 C ATOM 956 CD1 PHE A 63 3.630 2.346 3.461 1.00 0.00 C ATOM 957 CD2 PHE A 63 2.937 3.347 5.510 1.00 0.00 C ATOM 958 CE1 PHE A 63 4.050 3.575 3.000 1.00 0.00 C ATOM 959 CE2 PHE A 63 3.355 4.581 5.052 1.00 0.00 C ATOM 960 CZ PHE A 63 3.913 4.693 3.795 1.00 0.00 C ATOM 0 H PHE A 63 0.088 0.180 4.777 1.00 0.00 H new ATOM 0 HA PHE A 63 2.554 0.213 3.180 1.00 0.00 H new ATOM 0 HB2 PHE A 63 1.845 1.022 5.977 1.00 0.00 H new ATOM 0 HB3 PHE A 63 3.451 0.375 5.702 1.00 0.00 H new ATOM 0 HD1 PHE A 63 3.740 1.474 2.834 1.00 0.00 H new ATOM 0 HD2 PHE A 63 2.502 3.262 6.495 1.00 0.00 H new ATOM 0 HE1 PHE A 63 4.486 3.662 2.016 1.00 0.00 H new ATOM 0 HE2 PHE A 63 3.245 5.456 5.676 1.00 0.00 H new ATOM 0 HZ PHE A 63 4.242 5.656 3.434 1.00 0.00 H new ATOM 970 N ALA A 64 3.127 -2.124 3.630 1.00 0.00 N ATOM 971 CA ALA A 64 3.634 -3.445 3.927 1.00 0.00 C ATOM 972 C ALA A 64 5.151 -3.396 3.873 1.00 0.00 C ATOM 973 O ALA A 64 5.760 -3.629 2.827 1.00 0.00 O ATOM 974 CB ALA A 64 3.082 -4.464 2.943 1.00 0.00 C ATOM 0 H ALA A 64 3.428 -1.750 2.730 1.00 0.00 H new ATOM 0 HA ALA A 64 3.315 -3.754 4.922 1.00 0.00 H new ATOM 0 HB1 ALA A 64 3.475 -5.452 3.183 1.00 0.00 H new ATOM 0 HB2 ALA A 64 1.994 -4.481 3.008 1.00 0.00 H new ATOM 0 HB3 ALA A 64 3.380 -4.191 1.931 1.00 0.00 H new ATOM 980 N VAL A 65 5.762 -3.082 5.001 1.00 0.00 N ATOM 981 CA VAL A 65 7.180 -2.770 5.024 1.00 0.00 C ATOM 982 C VAL A 65 7.861 -3.334 6.257 1.00 0.00 C ATOM 983 O VAL A 65 7.216 -3.904 7.139 1.00 0.00 O ATOM 984 CB VAL A 65 7.427 -1.239 4.986 1.00 0.00 C ATOM 985 CG1 VAL A 65 6.947 -0.634 3.673 1.00 0.00 C ATOM 986 CG2 VAL A 65 6.752 -0.555 6.169 1.00 0.00 C ATOM 0 H VAL A 65 5.301 -3.036 5.910 1.00 0.00 H new ATOM 0 HA VAL A 65 7.605 -3.232 4.133 1.00 0.00 H new ATOM 0 HB VAL A 65 8.502 -1.074 5.058 1.00 0.00 H new ATOM 0 HG11 VAL A 65 7.134 0.440 3.677 1.00 0.00 H new ATOM 0 HG12 VAL A 65 7.485 -1.093 2.843 1.00 0.00 H new ATOM 0 HG13 VAL A 65 5.878 -0.816 3.558 1.00 0.00 H new ATOM 0 HG21 VAL A 65 6.938 0.518 6.123 1.00 0.00 H new ATOM 0 HG22 VAL A 65 5.678 -0.739 6.132 1.00 0.00 H new ATOM 0 HG23 VAL A 65 7.157 -0.954 7.099 1.00 0.00 H new ATOM 996 N ASP A 66 9.172 -3.179 6.291 1.00 0.00 N ATOM 997 CA ASP A 66 9.975 -3.540 7.449 1.00 0.00 C ATOM 998 C ASP A 66 10.988 -2.438 7.736 1.00 0.00 C ATOM 999 O ASP A 66 11.529 -2.339 8.837 1.00 0.00 O ATOM 1000 CB ASP A 66 10.691 -4.876 7.204 1.00 0.00 C ATOM 1001 CG ASP A 66 11.683 -5.226 8.298 1.00 0.00 C ATOM 1002 OD1 ASP A 66 11.258 -5.716 9.368 1.00 0.00 O ATOM 1003 OD2 ASP A 66 12.897 -5.027 8.086 1.00 0.00 O ATOM 0 H ASP A 66 9.713 -2.798 5.515 1.00 0.00 H new ATOM 0 HA ASP A 66 9.322 -3.654 8.314 1.00 0.00 H new ATOM 0 HB2 ASP A 66 9.949 -5.671 7.126 1.00 0.00 H new ATOM 0 HB3 ASP A 66 11.213 -4.832 6.248 1.00 0.00 H new ATOM 1008 N THR A 67 11.216 -1.586 6.746 1.00 0.00 N ATOM 1009 CA THR A 67 12.229 -0.551 6.852 1.00 0.00 C ATOM 1010 C THR A 67 11.614 0.842 6.663 1.00 0.00 C ATOM 1011 O THR A 67 10.392 1.006 6.716 1.00 0.00 O ATOM 1012 CB THR A 67 13.353 -0.786 5.811 1.00 0.00 C ATOM 1013 OG1 THR A 67 14.446 0.116 6.028 1.00 0.00 O ATOM 1014 CG2 THR A 67 12.828 -0.619 4.391 1.00 0.00 C ATOM 0 H THR A 67 10.711 -1.593 5.860 1.00 0.00 H new ATOM 0 HA THR A 67 12.659 -0.601 7.852 1.00 0.00 H new ATOM 0 HB THR A 67 13.706 -1.809 5.937 1.00 0.00 H new ATOM 0 HG1 THR A 67 14.574 0.250 6.990 1.00 0.00 H new ATOM 0 HG21 THR A 67 13.638 -0.789 3.681 1.00 0.00 H new ATOM 0 HG22 THR A 67 12.030 -1.339 4.211 1.00 0.00 H new ATOM 0 HG23 THR A 67 12.440 0.392 4.263 1.00 0.00 H new ATOM 1022 N LYS A 68 12.474 1.829 6.460 1.00 0.00 N ATOM 1023 CA LYS A 68 12.063 3.211 6.261 1.00 0.00 C ATOM 1024 C LYS A 68 11.389 3.390 4.905 1.00 0.00 C ATOM 1025 O LYS A 68 11.666 2.653 3.960 1.00 0.00 O ATOM 1026 CB LYS A 68 13.290 4.119 6.363 1.00 0.00 C ATOM 1027 CG LYS A 68 14.385 3.748 5.375 1.00 0.00 C ATOM 1028 CD LYS A 68 15.712 4.400 5.720 1.00 0.00 C ATOM 1029 CE LYS A 68 16.817 3.915 4.798 1.00 0.00 C ATOM 1030 NZ LYS A 68 18.157 4.375 5.247 1.00 0.00 N ATOM 0 H LYS A 68 13.484 1.692 6.428 1.00 0.00 H new ATOM 0 HA LYS A 68 11.341 3.479 7.032 1.00 0.00 H new ATOM 0 HB2 LYS A 68 12.987 5.152 6.191 1.00 0.00 H new ATOM 0 HB3 LYS A 68 13.689 4.069 7.376 1.00 0.00 H new ATOM 0 HG2 LYS A 68 14.507 2.665 5.360 1.00 0.00 H new ATOM 0 HG3 LYS A 68 14.084 4.049 4.371 1.00 0.00 H new ATOM 0 HD2 LYS A 68 15.619 5.483 5.643 1.00 0.00 H new ATOM 0 HD3 LYS A 68 15.973 4.176 6.754 1.00 0.00 H new ATOM 0 HE2 LYS A 68 16.803 2.826 4.756 1.00 0.00 H new ATOM 0 HE3 LYS A 68 16.630 4.275 3.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 18.883 4.023 4.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 18.180 5.415 5.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 18.347 4.010 6.202 1.00 0.00 H new ATOM 1044 N VAL A 69 10.502 4.369 4.819 1.00 0.00 N ATOM 1045 CA VAL A 69 9.803 4.662 3.580 1.00 0.00 C ATOM 1046 C VAL A 69 9.911 6.150 3.249 1.00 0.00 C ATOM 1047 O VAL A 69 9.729 7.002 4.115 1.00 0.00 O ATOM 1048 CB VAL A 69 8.316 4.247 3.663 1.00 0.00 C ATOM 1049 CG1 VAL A 69 7.535 4.726 2.450 1.00 0.00 C ATOM 1050 CG2 VAL A 69 8.184 2.741 3.810 1.00 0.00 C ATOM 0 H VAL A 69 10.249 4.977 5.598 1.00 0.00 H new ATOM 0 HA VAL A 69 10.274 4.083 2.786 1.00 0.00 H new ATOM 0 HB VAL A 69 7.893 4.725 4.547 1.00 0.00 H new ATOM 0 HG11 VAL A 69 6.494 4.417 2.542 1.00 0.00 H new ATOM 0 HG12 VAL A 69 7.586 5.813 2.390 1.00 0.00 H new ATOM 0 HG13 VAL A 69 7.964 4.292 1.547 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.129 2.472 3.866 1.00 0.00 H new ATOM 0 HG22 VAL A 69 8.638 2.250 2.949 1.00 0.00 H new ATOM 0 HG23 VAL A 69 8.690 2.419 4.720 1.00 0.00 H new ATOM 1060 N ARG A 70 10.200 6.449 1.991 1.00 0.00 N ATOM 1061 CA ARG A 70 10.411 7.822 1.549 1.00 0.00 C ATOM 1062 C ARG A 70 9.098 8.462 1.125 1.00 0.00 C ATOM 1063 O ARG A 70 9.022 9.668 0.908 1.00 0.00 O ATOM 1064 CB ARG A 70 11.394 7.857 0.379 1.00 0.00 C ATOM 1065 CG ARG A 70 12.774 7.307 0.711 1.00 0.00 C ATOM 1066 CD ARG A 70 13.698 7.352 -0.498 1.00 0.00 C ATOM 1067 NE ARG A 70 13.955 8.721 -0.948 1.00 0.00 N ATOM 1068 CZ ARG A 70 13.330 9.303 -1.970 1.00 0.00 C ATOM 1069 NH1 ARG A 70 12.417 8.632 -2.662 1.00 0.00 N ATOM 1070 NH2 ARG A 70 13.622 10.553 -2.303 1.00 0.00 N ATOM 0 H ARG A 70 10.295 5.753 1.251 1.00 0.00 H new ATOM 0 HA ARG A 70 10.823 8.385 2.386 1.00 0.00 H new ATOM 0 HB2 ARG A 70 10.976 7.285 -0.450 1.00 0.00 H new ATOM 0 HB3 ARG A 70 11.498 8.886 0.036 1.00 0.00 H new ATOM 0 HG2 ARG A 70 13.211 7.885 1.526 1.00 0.00 H new ATOM 0 HG3 ARG A 70 12.682 6.279 1.062 1.00 0.00 H new ATOM 0 HD2 ARG A 70 14.643 6.870 -0.249 1.00 0.00 H new ATOM 0 HD3 ARG A 70 13.254 6.781 -1.313 1.00 0.00 H new ATOM 0 HE ARG A 70 14.658 9.264 -0.447 1.00 0.00 H new ATOM 0 HH11 ARG A 70 12.193 7.669 -2.411 1.00 0.00 H new ATOM 0 HH12 ARG A 70 11.939 9.080 -3.444 1.00 0.00 H new ATOM 0 HH21 ARG A 70 14.326 11.070 -1.776 1.00 0.00 H new ATOM 0 HH22 ARG A 70 13.143 10.997 -3.086 1.00 0.00 H new ATOM 1084 N ASN A 71 8.079 7.642 0.932 1.00 0.00 N ATOM 1085 CA ASN A 71 6.749 8.155 0.642 1.00 0.00 C ATOM 1086 C ASN A 71 5.988 8.475 1.928 1.00 0.00 C ATOM 1087 O ASN A 71 4.907 9.054 1.879 1.00 0.00 O ATOM 1088 CB ASN A 71 5.944 7.176 -0.210 1.00 0.00 C ATOM 1089 CG ASN A 71 5.484 7.804 -1.512 1.00 0.00 C ATOM 1090 OD1 ASN A 71 4.454 8.471 -1.558 1.00 0.00 O ATOM 1091 ND2 ASN A 71 6.224 7.573 -2.584 1.00 0.00 N ATOM 0 H ASN A 71 8.145 6.625 0.970 1.00 0.00 H new ATOM 0 HA ASN A 71 6.879 9.076 0.075 1.00 0.00 H new ATOM 0 HB2 ASN A 71 6.552 6.298 -0.426 1.00 0.00 H new ATOM 0 HB3 ASN A 71 5.077 6.833 0.354 1.00 0.00 H new ATOM 0 HD21 ASN A 71 5.945 7.954 -3.488 1.00 0.00 H new ATOM 0 HD22 ASN A 71 7.074 7.014 -2.506 1.00 0.00 H new ATOM 1098 N LYS A 72 6.560 8.098 3.075 1.00 0.00 N ATOM 1099 CA LYS A 72 5.871 8.224 4.365 1.00 0.00 C ATOM 1100 C LYS A 72 5.408 9.645 4.633 1.00 0.00 C ATOM 1101 O LYS A 72 4.304 9.852 5.122 1.00 0.00 O ATOM 1102 CB LYS A 72 6.758 7.764 5.521 1.00 0.00 C ATOM 1103 CG LYS A 72 6.864 6.258 5.656 1.00 0.00 C ATOM 1104 CD LYS A 72 7.623 5.862 6.914 1.00 0.00 C ATOM 1105 CE LYS A 72 6.851 6.231 8.171 1.00 0.00 C ATOM 1106 NZ LYS A 72 7.586 5.852 9.406 1.00 0.00 N ATOM 0 H LYS A 72 7.498 7.703 3.138 1.00 0.00 H new ATOM 0 HA LYS A 72 4.995 7.578 4.301 1.00 0.00 H new ATOM 0 HB2 LYS A 72 7.757 8.177 5.385 1.00 0.00 H new ATOM 0 HB3 LYS A 72 6.367 8.175 6.452 1.00 0.00 H new ATOM 0 HG2 LYS A 72 5.865 5.823 5.681 1.00 0.00 H new ATOM 0 HG3 LYS A 72 7.369 5.848 4.781 1.00 0.00 H new ATOM 0 HD2 LYS A 72 7.811 4.788 6.904 1.00 0.00 H new ATOM 0 HD3 LYS A 72 8.595 6.356 6.924 1.00 0.00 H new ATOM 0 HE2 LYS A 72 6.660 7.304 8.177 1.00 0.00 H new ATOM 0 HE3 LYS A 72 5.881 5.735 8.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 7.026 6.121 10.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 7.746 4.824 9.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 8.501 6.345 9.430 1.00 0.00 H new ATOM 1120 N GLU A 73 6.249 10.616 4.314 1.00 0.00 N ATOM 1121 CA GLU A 73 5.907 12.022 4.530 1.00 0.00 C ATOM 1122 C GLU A 73 4.642 12.413 3.766 1.00 0.00 C ATOM 1123 O GLU A 73 3.857 13.242 4.229 1.00 0.00 O ATOM 1124 CB GLU A 73 7.066 12.949 4.136 1.00 0.00 C ATOM 1125 CG GLU A 73 7.851 12.495 2.914 1.00 0.00 C ATOM 1126 CD GLU A 73 8.996 11.567 3.270 1.00 0.00 C ATOM 1127 OE1 GLU A 73 8.741 10.383 3.569 1.00 0.00 O ATOM 1128 OE2 GLU A 73 10.156 12.023 3.262 1.00 0.00 O ATOM 0 H GLU A 73 7.171 10.462 3.906 1.00 0.00 H new ATOM 0 HA GLU A 73 5.717 12.142 5.597 1.00 0.00 H new ATOM 0 HB2 GLU A 73 6.669 13.946 3.947 1.00 0.00 H new ATOM 0 HB3 GLU A 73 7.750 13.033 4.981 1.00 0.00 H new ATOM 0 HG2 GLU A 73 7.178 11.988 2.222 1.00 0.00 H new ATOM 0 HG3 GLU A 73 8.244 13.368 2.394 1.00 0.00 H new ATOM 1135 N ARG A 74 4.445 11.802 2.607 1.00 0.00 N ATOM 1136 CA ARG A 74 3.276 12.053 1.789 1.00 0.00 C ATOM 1137 C ARG A 74 2.005 11.503 2.427 1.00 0.00 C ATOM 1138 O ARG A 74 0.938 12.105 2.316 1.00 0.00 O ATOM 1139 CB ARG A 74 3.496 11.438 0.417 1.00 0.00 C ATOM 1140 CG ARG A 74 4.378 12.292 -0.463 1.00 0.00 C ATOM 1141 CD ARG A 74 5.019 11.489 -1.582 1.00 0.00 C ATOM 1142 NE ARG A 74 6.337 10.967 -1.216 1.00 0.00 N ATOM 1143 CZ ARG A 74 7.349 10.842 -2.077 1.00 0.00 C ATOM 1144 NH1 ARG A 74 7.166 11.107 -3.365 1.00 0.00 N ATOM 1145 NH2 ARG A 74 8.538 10.421 -1.659 1.00 0.00 N ATOM 0 H ARG A 74 5.092 11.120 2.211 1.00 0.00 H new ATOM 0 HA ARG A 74 3.140 13.131 1.697 1.00 0.00 H new ATOM 0 HB2 ARG A 74 3.947 10.453 0.532 1.00 0.00 H new ATOM 0 HB3 ARG A 74 2.533 11.292 -0.071 1.00 0.00 H new ATOM 0 HG2 ARG A 74 3.787 13.101 -0.891 1.00 0.00 H new ATOM 0 HG3 ARG A 74 5.157 12.753 0.144 1.00 0.00 H new ATOM 0 HD2 ARG A 74 4.365 10.659 -1.849 1.00 0.00 H new ATOM 0 HD3 ARG A 74 5.114 12.118 -2.467 1.00 0.00 H new ATOM 0 HE ARG A 74 6.490 10.683 -0.248 1.00 0.00 H new ATOM 0 HH11 ARG A 74 6.250 11.407 -3.699 1.00 0.00 H new ATOM 0 HH12 ARG A 74 7.941 11.011 -4.021 1.00 0.00 H new ATOM 0 HH21 ARG A 74 8.681 10.191 -0.676 1.00 0.00 H new ATOM 0 HH22 ARG A 74 9.308 10.327 -2.322 1.00 0.00 H new ATOM 1159 N PHE A 75 2.116 10.368 3.100 1.00 0.00 N ATOM 1160 CA PHE A 75 0.970 9.746 3.737 1.00 0.00 C ATOM 1161 C PHE A 75 0.937 10.063 5.227 1.00 0.00 C ATOM 1162 O PHE A 75 0.148 9.486 5.975 1.00 0.00 O ATOM 1163 CB PHE A 75 1.035 8.234 3.550 1.00 0.00 C ATOM 1164 CG PHE A 75 1.351 7.807 2.148 1.00 0.00 C ATOM 1165 CD1 PHE A 75 0.633 8.306 1.076 1.00 0.00 C ATOM 1166 CD2 PHE A 75 2.370 6.904 1.906 1.00 0.00 C ATOM 1167 CE1 PHE A 75 0.927 7.909 -0.212 1.00 0.00 C ATOM 1168 CE2 PHE A 75 2.666 6.502 0.622 1.00 0.00 C ATOM 1169 CZ PHE A 75 1.944 7.005 -0.440 1.00 0.00 C ATOM 0 H PHE A 75 2.992 9.859 3.218 1.00 0.00 H new ATOM 0 HA PHE A 75 0.066 10.142 3.273 1.00 0.00 H new ATOM 0 HB2 PHE A 75 1.791 7.827 4.222 1.00 0.00 H new ATOM 0 HB3 PHE A 75 0.079 7.800 3.845 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -0.165 9.013 1.249 1.00 0.00 H new ATOM 0 HD2 PHE A 75 2.941 6.509 2.734 1.00 0.00 H new ATOM 0 HE1 PHE A 75 0.361 8.306 -1.042 1.00 0.00 H new ATOM 0 HE2 PHE A 75 3.462 5.794 0.447 1.00 0.00 H new ATOM 0 HZ PHE A 75 2.174 6.692 -1.448 1.00 0.00 H new ATOM 1179 N ASP A 76 1.773 11.001 5.645 1.00 0.00 N ATOM 1180 CA ASP A 76 1.990 11.252 7.067 1.00 0.00 C ATOM 1181 C ASP A 76 0.771 11.896 7.707 1.00 0.00 C ATOM 1182 O ASP A 76 0.402 11.568 8.837 1.00 0.00 O ATOM 1183 CB ASP A 76 3.221 12.136 7.275 1.00 0.00 C ATOM 1184 CG ASP A 76 3.589 12.281 8.737 1.00 0.00 C ATOM 1185 OD1 ASP A 76 4.075 11.294 9.331 1.00 0.00 O ATOM 1186 OD2 ASP A 76 3.402 13.378 9.298 1.00 0.00 O ATOM 0 H ASP A 76 2.313 11.602 5.023 1.00 0.00 H new ATOM 0 HA ASP A 76 2.159 10.290 7.550 1.00 0.00 H new ATOM 0 HB2 ASP A 76 4.065 11.712 6.731 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.032 13.122 6.851 1.00 0.00 H new ATOM 1191 N GLY A 77 0.145 12.806 6.982 1.00 0.00 N ATOM 1192 CA GLY A 77 -1.052 13.449 7.478 1.00 0.00 C ATOM 1193 C GLY A 77 -2.300 12.855 6.867 1.00 0.00 C ATOM 1194 O GLY A 77 -3.325 13.525 6.744 1.00 0.00 O ATOM 0 H GLY A 77 0.444 13.112 6.056 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -1.095 13.350 8.563 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -1.011 14.515 7.257 1.00 0.00 H new ATOM 1198 N LYS A 78 -2.209 11.592 6.470 1.00 0.00 N ATOM 1199 CA LYS A 78 -3.314 10.924 5.804 1.00 0.00 C ATOM 1200 C LYS A 78 -3.610 9.597 6.498 1.00 0.00 C ATOM 1201 O LYS A 78 -2.978 9.262 7.502 1.00 0.00 O ATOM 1202 CB LYS A 78 -2.984 10.707 4.318 1.00 0.00 C ATOM 1203 CG LYS A 78 -2.115 11.817 3.736 1.00 0.00 C ATOM 1204 CD LYS A 78 -2.367 12.085 2.256 1.00 0.00 C ATOM 1205 CE LYS A 78 -2.022 10.903 1.356 1.00 0.00 C ATOM 1206 NZ LYS A 78 -3.095 9.869 1.331 1.00 0.00 N ATOM 0 H LYS A 78 -1.380 11.012 6.599 1.00 0.00 H new ATOM 0 HA LYS A 78 -4.204 11.551 5.865 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -2.472 9.752 4.200 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -3.912 10.643 3.750 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -2.291 12.735 4.297 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -1.066 11.555 3.875 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -3.416 12.344 2.115 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -1.781 12.950 1.947 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -1.845 11.262 0.342 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -1.093 10.449 1.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -3.082 9.377 0.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -2.933 9.182 2.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -4.020 10.325 1.465 1.00 0.00 H new ATOM 1220 N VAL A 79 -4.563 8.846 5.968 1.00 0.00 N ATOM 1221 CA VAL A 79 -4.966 7.585 6.580 1.00 0.00 C ATOM 1222 C VAL A 79 -4.224 6.420 5.940 1.00 0.00 C ATOM 1223 O VAL A 79 -4.300 6.215 4.728 1.00 0.00 O ATOM 1224 CB VAL A 79 -6.485 7.349 6.458 1.00 0.00 C ATOM 1225 CG1 VAL A 79 -6.895 6.083 7.197 1.00 0.00 C ATOM 1226 CG2 VAL A 79 -7.256 8.551 6.982 1.00 0.00 C ATOM 0 H VAL A 79 -5.072 9.085 5.117 1.00 0.00 H new ATOM 0 HA VAL A 79 -4.711 7.647 7.638 1.00 0.00 H new ATOM 0 HB VAL A 79 -6.727 7.220 5.403 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.970 5.936 7.098 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -6.371 5.227 6.771 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -6.638 6.178 8.252 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -8.326 8.366 6.888 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -7.007 8.714 8.031 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -6.988 9.435 6.404 1.00 0.00 H new ATOM 1236 N VAL A 80 -3.504 5.665 6.756 1.00 0.00 N ATOM 1237 CA VAL A 80 -2.701 4.563 6.261 1.00 0.00 C ATOM 1238 C VAL A 80 -2.699 3.397 7.246 1.00 0.00 C ATOM 1239 O VAL A 80 -2.635 3.592 8.459 1.00 0.00 O ATOM 1240 CB VAL A 80 -1.247 5.019 5.979 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -0.671 5.784 7.159 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -0.357 3.835 5.633 1.00 0.00 C ATOM 0 H VAL A 80 -3.461 5.798 7.766 1.00 0.00 H new ATOM 0 HA VAL A 80 -3.149 4.226 5.326 1.00 0.00 H new ATOM 0 HB VAL A 80 -1.277 5.688 5.119 1.00 0.00 H new ATOM 0 HG11 VAL A 80 0.350 6.090 6.931 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -1.280 6.667 7.353 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.669 5.144 8.041 1.00 0.00 H new ATOM 0 HG21 VAL A 80 0.657 4.186 5.440 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.346 3.133 6.466 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -0.744 3.337 4.744 1.00 0.00 H new ATOM 1252 N LEU A 81 -2.798 2.191 6.708 1.00 0.00 N ATOM 1253 CA LEU A 81 -2.675 0.983 7.503 1.00 0.00 C ATOM 1254 C LEU A 81 -1.277 0.411 7.341 1.00 0.00 C ATOM 1255 O LEU A 81 -0.840 0.139 6.221 1.00 0.00 O ATOM 1256 CB LEU A 81 -3.699 -0.065 7.073 1.00 0.00 C ATOM 1257 CG LEU A 81 -3.585 -1.398 7.811 1.00 0.00 C ATOM 1258 CD1 LEU A 81 -4.174 -1.300 9.211 1.00 0.00 C ATOM 1259 CD2 LEU A 81 -4.251 -2.498 7.016 1.00 0.00 C ATOM 0 H LEU A 81 -2.965 2.025 5.716 1.00 0.00 H new ATOM 0 HA LEU A 81 -2.859 1.240 8.546 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -4.700 0.338 7.228 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -3.590 -0.245 6.004 1.00 0.00 H new ATOM 0 HG LEU A 81 -2.528 -1.643 7.915 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.080 -2.263 9.714 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -3.638 -0.540 9.779 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.227 -1.027 9.144 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.162 -3.441 7.555 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.305 -2.259 6.876 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -3.767 -2.588 6.043 1.00 0.00 H new ATOM 1271 N GLU A 82 -0.577 0.239 8.446 1.00 0.00 N ATOM 1272 CA GLU A 82 0.759 -0.322 8.411 1.00 0.00 C ATOM 1273 C GLU A 82 0.736 -1.748 8.941 1.00 0.00 C ATOM 1274 O GLU A 82 0.495 -1.978 10.129 1.00 0.00 O ATOM 1275 CB GLU A 82 1.727 0.542 9.224 1.00 0.00 C ATOM 1276 CG GLU A 82 3.184 0.133 9.075 1.00 0.00 C ATOM 1277 CD GLU A 82 3.778 -0.412 10.358 1.00 0.00 C ATOM 1278 OE1 GLU A 82 4.323 0.388 11.152 1.00 0.00 O ATOM 1279 OE2 GLU A 82 3.717 -1.638 10.580 1.00 0.00 O ATOM 0 H GLU A 82 -0.912 0.480 9.379 1.00 0.00 H new ATOM 0 HA GLU A 82 1.107 -0.338 7.378 1.00 0.00 H new ATOM 0 HB2 GLU A 82 1.618 1.582 8.917 1.00 0.00 H new ATOM 0 HB3 GLU A 82 1.450 0.490 10.277 1.00 0.00 H new ATOM 0 HG2 GLU A 82 3.266 -0.622 8.293 1.00 0.00 H new ATOM 0 HG3 GLU A 82 3.766 0.995 8.748 1.00 0.00 H new ATOM 1286 N VAL A 83 0.936 -2.702 8.048 1.00 0.00 N ATOM 1287 CA VAL A 83 1.016 -4.104 8.424 1.00 0.00 C ATOM 1288 C VAL A 83 2.372 -4.690 8.034 1.00 0.00 C ATOM 1289 O VAL A 83 3.088 -4.121 7.205 1.00 0.00 O ATOM 1290 CB VAL A 83 -0.109 -4.934 7.762 1.00 0.00 C ATOM 1291 CG1 VAL A 83 -1.471 -4.534 8.309 1.00 0.00 C ATOM 1292 CG2 VAL A 83 -0.079 -4.777 6.246 1.00 0.00 C ATOM 0 H VAL A 83 1.047 -2.529 7.049 1.00 0.00 H new ATOM 0 HA VAL A 83 0.895 -4.155 9.506 1.00 0.00 H new ATOM 0 HB VAL A 83 0.063 -5.983 8.003 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -2.246 -5.131 7.828 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -1.496 -4.706 9.385 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -1.649 -3.478 8.106 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -0.879 -5.370 5.803 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -0.218 -3.728 5.986 1.00 0.00 H new ATOM 0 HG23 VAL A 83 0.882 -5.121 5.864 1.00 0.00 H new ATOM 1302 N PRO A 84 2.754 -5.820 8.645 1.00 0.00 N ATOM 1303 CA PRO A 84 3.968 -6.544 8.264 1.00 0.00 C ATOM 1304 C PRO A 84 3.945 -6.919 6.784 1.00 0.00 C ATOM 1305 O PRO A 84 2.880 -7.175 6.222 1.00 0.00 O ATOM 1306 CB PRO A 84 3.931 -7.800 9.137 1.00 0.00 C ATOM 1307 CG PRO A 84 3.065 -7.439 10.295 1.00 0.00 C ATOM 1308 CD PRO A 84 2.048 -6.472 9.764 1.00 0.00 C ATOM 0 HA PRO A 84 4.870 -5.950 8.408 1.00 0.00 H new ATOM 0 HB2 PRO A 84 3.524 -8.650 8.589 1.00 0.00 H new ATOM 0 HB3 PRO A 84 4.931 -8.082 9.465 1.00 0.00 H new ATOM 0 HG2 PRO A 84 2.583 -8.323 10.712 1.00 0.00 H new ATOM 0 HG3 PRO A 84 3.652 -6.988 11.096 1.00 0.00 H new ATOM 0 HD2 PRO A 84 1.145 -6.982 9.428 1.00 0.00 H new ATOM 0 HD3 PRO A 84 1.744 -5.751 10.523 1.00 0.00 H new ATOM 1316 N VAL A 85 5.114 -6.966 6.159 1.00 0.00 N ATOM 1317 CA VAL A 85 5.204 -7.220 4.724 1.00 0.00 C ATOM 1318 C VAL A 85 4.663 -8.617 4.373 1.00 0.00 C ATOM 1319 O VAL A 85 4.213 -8.856 3.254 1.00 0.00 O ATOM 1320 CB VAL A 85 6.662 -7.054 4.219 1.00 0.00 C ATOM 1321 CG1 VAL A 85 7.568 -8.159 4.743 1.00 0.00 C ATOM 1322 CG2 VAL A 85 6.713 -6.985 2.701 1.00 0.00 C ATOM 0 H VAL A 85 6.013 -6.832 6.621 1.00 0.00 H new ATOM 0 HA VAL A 85 4.583 -6.481 4.218 1.00 0.00 H new ATOM 0 HB VAL A 85 7.035 -6.109 4.613 1.00 0.00 H new ATOM 0 HG11 VAL A 85 8.580 -8.008 4.368 1.00 0.00 H new ATOM 0 HG12 VAL A 85 7.578 -8.135 5.833 1.00 0.00 H new ATOM 0 HG13 VAL A 85 7.196 -9.126 4.404 1.00 0.00 H new ATOM 0 HG21 VAL A 85 7.747 -6.869 2.377 1.00 0.00 H new ATOM 0 HG22 VAL A 85 6.302 -7.903 2.281 1.00 0.00 H new ATOM 0 HG23 VAL A 85 6.126 -6.134 2.356 1.00 0.00 H new ATOM 1332 N SER A 86 4.696 -9.524 5.345 1.00 0.00 N ATOM 1333 CA SER A 86 4.174 -10.880 5.169 1.00 0.00 C ATOM 1334 C SER A 86 2.638 -10.916 5.184 1.00 0.00 C ATOM 1335 O SER A 86 2.027 -11.876 4.710 1.00 0.00 O ATOM 1336 CB SER A 86 4.724 -11.794 6.266 1.00 0.00 C ATOM 1337 OG SER A 86 6.141 -11.763 6.295 1.00 0.00 O ATOM 0 H SER A 86 5.082 -9.344 6.272 1.00 0.00 H new ATOM 0 HA SER A 86 4.501 -11.233 4.191 1.00 0.00 H new ATOM 0 HB2 SER A 86 4.331 -11.483 7.234 1.00 0.00 H new ATOM 0 HB3 SER A 86 4.383 -12.815 6.097 1.00 0.00 H new ATOM 0 HG SER A 86 6.467 -12.354 7.006 1.00 0.00 H new ATOM 1343 N ALA A 87 2.019 -9.876 5.733 1.00 0.00 N ATOM 1344 CA ALA A 87 0.572 -9.866 5.969 1.00 0.00 C ATOM 1345 C ALA A 87 -0.271 -9.857 4.677 1.00 0.00 C ATOM 1346 O ALA A 87 -1.172 -10.684 4.535 1.00 0.00 O ATOM 1347 CB ALA A 87 0.188 -8.696 6.866 1.00 0.00 C ATOM 0 H ALA A 87 2.496 -9.023 6.026 1.00 0.00 H new ATOM 0 HA ALA A 87 0.341 -10.806 6.471 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -0.889 -8.703 7.032 1.00 0.00 H new ATOM 0 HB2 ALA A 87 0.703 -8.787 7.823 1.00 0.00 H new ATOM 0 HB3 ALA A 87 0.476 -7.760 6.387 1.00 0.00 H new ATOM 1353 N PRO A 88 -0.015 -8.940 3.716 1.00 0.00 N ATOM 1354 CA PRO A 88 -0.864 -8.805 2.522 1.00 0.00 C ATOM 1355 C PRO A 88 -0.672 -9.931 1.506 1.00 0.00 C ATOM 1356 O PRO A 88 -1.133 -9.833 0.372 1.00 0.00 O ATOM 1357 CB PRO A 88 -0.417 -7.470 1.926 1.00 0.00 C ATOM 1358 CG PRO A 88 1.007 -7.345 2.335 1.00 0.00 C ATOM 1359 CD PRO A 88 1.101 -7.971 3.698 1.00 0.00 C ATOM 0 HA PRO A 88 -1.922 -8.853 2.780 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -0.522 -7.464 0.841 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -1.015 -6.643 2.309 1.00 0.00 H new ATOM 0 HG2 PRO A 88 1.663 -7.851 1.627 1.00 0.00 H new ATOM 0 HG3 PRO A 88 1.315 -6.300 2.363 1.00 0.00 H new ATOM 0 HD2 PRO A 88 2.062 -8.464 3.847 1.00 0.00 H new ATOM 0 HD3 PRO A 88 0.998 -7.227 4.488 1.00 0.00 H new ATOM 1367 N ILE A 89 -0.001 -10.996 1.913 1.00 0.00 N ATOM 1368 CA ILE A 89 0.249 -12.116 1.021 1.00 0.00 C ATOM 1369 C ILE A 89 -0.954 -13.061 0.973 1.00 0.00 C ATOM 1370 O ILE A 89 -1.524 -13.297 -0.092 1.00 0.00 O ATOM 1371 CB ILE A 89 1.517 -12.891 1.444 1.00 0.00 C ATOM 1372 CG1 ILE A 89 2.747 -11.987 1.310 1.00 0.00 C ATOM 1373 CG2 ILE A 89 1.683 -14.150 0.605 1.00 0.00 C ATOM 1374 CD1 ILE A 89 4.022 -12.602 1.850 1.00 0.00 C ATOM 0 H ILE A 89 0.379 -11.109 2.853 1.00 0.00 H new ATOM 0 HA ILE A 89 0.409 -11.710 0.022 1.00 0.00 H new ATOM 0 HB ILE A 89 1.413 -13.193 2.486 1.00 0.00 H new ATOM 0 HG12 ILE A 89 2.891 -11.740 0.258 1.00 0.00 H new ATOM 0 HG13 ILE A 89 2.556 -11.051 1.834 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.582 -14.681 0.919 1.00 0.00 H new ATOM 0 HG22 ILE A 89 0.815 -14.795 0.741 1.00 0.00 H new ATOM 0 HG23 ILE A 89 1.772 -13.877 -0.447 1.00 0.00 H new ATOM 0 HD11 ILE A 89 4.847 -11.902 1.719 1.00 0.00 H new ATOM 0 HD12 ILE A 89 3.899 -12.824 2.910 1.00 0.00 H new ATOM 0 HD13 ILE A 89 4.239 -13.524 1.310 1.00 0.00 H new ATOM 1386 N LYS A 90 -1.345 -13.596 2.124 1.00 0.00 N ATOM 1387 CA LYS A 90 -2.481 -14.511 2.182 1.00 0.00 C ATOM 1388 C LYS A 90 -3.760 -13.777 2.572 1.00 0.00 C ATOM 1389 O LYS A 90 -4.861 -14.311 2.434 1.00 0.00 O ATOM 1390 CB LYS A 90 -2.217 -15.648 3.172 1.00 0.00 C ATOM 1391 CG LYS A 90 -1.001 -16.495 2.832 1.00 0.00 C ATOM 1392 CD LYS A 90 -0.921 -17.725 3.719 1.00 0.00 C ATOM 1393 CE LYS A 90 0.305 -18.561 3.401 1.00 0.00 C ATOM 1394 NZ LYS A 90 0.266 -19.882 4.083 1.00 0.00 N ATOM 0 H LYS A 90 -0.898 -13.415 3.023 1.00 0.00 H new ATOM 0 HA LYS A 90 -2.611 -14.933 1.185 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.085 -15.225 4.168 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -3.096 -16.292 3.212 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -1.048 -16.800 1.787 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -0.096 -15.899 2.950 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.893 -17.419 4.765 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.819 -18.329 3.587 1.00 0.00 H new ATOM 0 HE2 LYS A 90 0.373 -18.710 2.323 1.00 0.00 H new ATOM 0 HE3 LYS A 90 1.202 -18.021 3.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 1.120 -20.423 3.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 0.226 -19.740 5.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -0.576 -20.408 3.773 1.00 0.00 H new ATOM 1408 N ASP A 91 -3.616 -12.550 3.052 1.00 0.00 N ATOM 1409 CA ASP A 91 -4.760 -11.785 3.534 1.00 0.00 C ATOM 1410 C ASP A 91 -4.846 -10.434 2.840 1.00 0.00 C ATOM 1411 O ASP A 91 -5.225 -9.436 3.450 1.00 0.00 O ATOM 1412 CB ASP A 91 -4.680 -11.585 5.051 1.00 0.00 C ATOM 1413 CG ASP A 91 -4.944 -12.860 5.828 1.00 0.00 C ATOM 1414 OD1 ASP A 91 -6.110 -13.313 5.867 1.00 0.00 O ATOM 1415 OD2 ASP A 91 -3.987 -13.417 6.403 1.00 0.00 O ATOM 0 H ASP A 91 -2.722 -12.063 3.119 1.00 0.00 H new ATOM 0 HA ASP A 91 -5.659 -12.354 3.300 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -3.692 -11.205 5.311 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -5.403 -10.826 5.351 1.00 0.00 H new ATOM 1420 N ALA A 92 -4.524 -10.416 1.553 1.00 0.00 N ATOM 1421 CA ALA A 92 -4.557 -9.185 0.764 1.00 0.00 C ATOM 1422 C ALA A 92 -5.930 -8.520 0.829 1.00 0.00 C ATOM 1423 O ALA A 92 -6.033 -7.315 1.060 1.00 0.00 O ATOM 1424 CB ALA A 92 -4.182 -9.475 -0.681 1.00 0.00 C ATOM 0 H ALA A 92 -4.235 -11.242 1.029 1.00 0.00 H new ATOM 0 HA ALA A 92 -3.829 -8.495 1.190 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -4.211 -8.550 -1.257 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -3.177 -9.895 -0.719 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -4.889 -10.188 -1.104 1.00 0.00 H new ATOM 1430 N GLU A 93 -6.978 -9.316 0.650 1.00 0.00 N ATOM 1431 CA GLU A 93 -8.346 -8.806 0.679 1.00 0.00 C ATOM 1432 C GLU A 93 -8.695 -8.272 2.064 1.00 0.00 C ATOM 1433 O GLU A 93 -9.437 -7.298 2.199 1.00 0.00 O ATOM 1434 CB GLU A 93 -9.328 -9.909 0.282 1.00 0.00 C ATOM 1435 CG GLU A 93 -9.096 -10.463 -1.115 1.00 0.00 C ATOM 1436 CD GLU A 93 -9.871 -11.738 -1.366 1.00 0.00 C ATOM 1437 OE1 GLU A 93 -9.441 -12.801 -0.867 1.00 0.00 O ATOM 1438 OE2 GLU A 93 -10.909 -11.690 -2.059 1.00 0.00 O ATOM 0 H GLU A 93 -6.907 -10.320 0.483 1.00 0.00 H new ATOM 0 HA GLU A 93 -8.421 -7.987 -0.036 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -9.256 -10.724 1.003 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -10.344 -9.518 0.344 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -9.385 -9.714 -1.852 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -8.032 -10.654 -1.255 1.00 0.00 H new ATOM 1445 N LYS A 94 -8.134 -8.903 3.092 1.00 0.00 N ATOM 1446 CA LYS A 94 -8.393 -8.506 4.470 1.00 0.00 C ATOM 1447 C LYS A 94 -7.808 -7.124 4.719 1.00 0.00 C ATOM 1448 O LYS A 94 -8.437 -6.267 5.340 1.00 0.00 O ATOM 1449 CB LYS A 94 -7.763 -9.501 5.448 1.00 0.00 C ATOM 1450 CG LYS A 94 -8.058 -10.958 5.133 1.00 0.00 C ATOM 1451 CD LYS A 94 -9.507 -11.325 5.391 1.00 0.00 C ATOM 1452 CE LYS A 94 -9.734 -12.811 5.168 1.00 0.00 C ATOM 1453 NZ LYS A 94 -8.855 -13.645 6.033 1.00 0.00 N ATOM 0 H LYS A 94 -7.496 -9.693 2.995 1.00 0.00 H new ATOM 0 HA LYS A 94 -9.471 -8.491 4.628 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -6.683 -9.354 5.453 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -8.119 -9.279 6.454 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -7.816 -11.157 4.089 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -7.412 -11.595 5.737 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -9.778 -11.060 6.413 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -10.156 -10.750 4.730 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -10.777 -13.053 5.371 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -9.548 -13.053 4.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -9.176 -14.634 6.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -7.875 -13.589 5.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -8.899 -13.296 7.012 1.00 0.00 H new ATOM 1467 N VAL A 95 -6.595 -6.925 4.212 1.00 0.00 N ATOM 1468 CA VAL A 95 -5.889 -5.660 4.349 1.00 0.00 C ATOM 1469 C VAL A 95 -6.674 -4.533 3.691 1.00 0.00 C ATOM 1470 O VAL A 95 -6.830 -3.455 4.262 1.00 0.00 O ATOM 1471 CB VAL A 95 -4.481 -5.744 3.718 1.00 0.00 C ATOM 1472 CG1 VAL A 95 -3.739 -4.425 3.859 1.00 0.00 C ATOM 1473 CG2 VAL A 95 -3.679 -6.874 4.344 1.00 0.00 C ATOM 0 H VAL A 95 -6.077 -7.636 3.696 1.00 0.00 H new ATOM 0 HA VAL A 95 -5.787 -5.451 5.414 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.603 -5.952 2.655 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.751 -4.513 3.406 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.300 -3.637 3.357 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -3.633 -4.178 4.915 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.691 -6.916 3.886 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.575 -6.697 5.415 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -4.195 -7.820 4.181 1.00 0.00 H new ATOM 1483 N ILE A 96 -7.188 -4.805 2.498 1.00 0.00 N ATOM 1484 CA ILE A 96 -7.963 -3.821 1.752 1.00 0.00 C ATOM 1485 C ILE A 96 -9.228 -3.434 2.517 1.00 0.00 C ATOM 1486 O ILE A 96 -9.543 -2.252 2.666 1.00 0.00 O ATOM 1487 CB ILE A 96 -8.350 -4.361 0.356 1.00 0.00 C ATOM 1488 CG1 ILE A 96 -7.090 -4.682 -0.455 1.00 0.00 C ATOM 1489 CG2 ILE A 96 -9.220 -3.357 -0.389 1.00 0.00 C ATOM 1490 CD1 ILE A 96 -7.375 -5.343 -1.786 1.00 0.00 C ATOM 0 H ILE A 96 -7.082 -5.702 2.025 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.337 -2.938 1.627 1.00 0.00 H new ATOM 0 HB ILE A 96 -8.925 -5.277 0.488 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -6.536 -3.760 -0.629 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -6.446 -5.335 0.134 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -9.480 -3.758 -1.369 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -10.130 -3.171 0.181 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -8.673 -2.423 -0.513 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.436 -5.540 -2.303 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.902 -6.283 -1.620 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -7.993 -4.683 -2.395 1.00 0.00 H new ATOM 1502 N ASN A 97 -9.935 -4.438 3.017 1.00 0.00 N ATOM 1503 CA ASN A 97 -11.170 -4.211 3.762 1.00 0.00 C ATOM 1504 C ASN A 97 -10.899 -3.477 5.069 1.00 0.00 C ATOM 1505 O ASN A 97 -11.670 -2.605 5.473 1.00 0.00 O ATOM 1506 CB ASN A 97 -11.874 -5.537 4.057 1.00 0.00 C ATOM 1507 CG ASN A 97 -12.553 -6.131 2.837 1.00 0.00 C ATOM 1508 OD1 ASN A 97 -12.959 -5.416 1.917 1.00 0.00 O ATOM 1509 ND2 ASN A 97 -12.688 -7.447 2.823 1.00 0.00 N ATOM 0 H ASN A 97 -9.676 -5.420 2.921 1.00 0.00 H new ATOM 0 HA ASN A 97 -11.817 -3.591 3.142 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -11.146 -6.250 4.445 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -12.616 -5.382 4.840 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -13.141 -7.905 2.032 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -12.339 -8.004 3.603 1.00 0.00 H new ATOM 1516 N ALA A 98 -9.800 -3.831 5.724 1.00 0.00 N ATOM 1517 CA ALA A 98 -9.437 -3.215 6.993 1.00 0.00 C ATOM 1518 C ALA A 98 -9.033 -1.761 6.790 1.00 0.00 C ATOM 1519 O ALA A 98 -9.333 -0.899 7.617 1.00 0.00 O ATOM 1520 CB ALA A 98 -8.315 -3.992 7.667 1.00 0.00 C ATOM 0 H ALA A 98 -9.145 -4.541 5.397 1.00 0.00 H new ATOM 0 HA ALA A 98 -10.311 -3.240 7.644 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -8.059 -3.515 8.613 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -8.642 -5.015 7.853 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -7.439 -4.003 7.018 1.00 0.00 H new ATOM 1526 N ALA A 99 -8.362 -1.493 5.676 1.00 0.00 N ATOM 1527 CA ALA A 99 -7.965 -0.139 5.326 1.00 0.00 C ATOM 1528 C ALA A 99 -9.194 0.744 5.137 1.00 0.00 C ATOM 1529 O ALA A 99 -9.199 1.913 5.525 1.00 0.00 O ATOM 1530 CB ALA A 99 -7.112 -0.145 4.067 1.00 0.00 C ATOM 0 H ALA A 99 -8.081 -2.201 4.998 1.00 0.00 H new ATOM 0 HA ALA A 99 -7.370 0.270 6.143 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -6.823 0.876 3.818 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -6.217 -0.744 4.236 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.683 -0.571 3.242 1.00 0.00 H new ATOM 1536 N LEU A 100 -10.245 0.169 4.559 1.00 0.00 N ATOM 1537 CA LEU A 100 -11.493 0.895 4.357 1.00 0.00 C ATOM 1538 C LEU A 100 -12.200 1.121 5.689 1.00 0.00 C ATOM 1539 O LEU A 100 -12.876 2.120 5.873 1.00 0.00 O ATOM 1540 CB LEU A 100 -12.419 0.142 3.398 1.00 0.00 C ATOM 1541 CG LEU A 100 -11.831 -0.154 2.018 1.00 0.00 C ATOM 1542 CD1 LEU A 100 -12.823 -0.941 1.177 1.00 0.00 C ATOM 1543 CD2 LEU A 100 -11.442 1.137 1.315 1.00 0.00 C ATOM 0 H LEU A 100 -10.257 -0.794 4.224 1.00 0.00 H new ATOM 0 HA LEU A 100 -11.249 1.861 3.914 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -12.706 -0.802 3.862 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -13.331 0.724 3.269 1.00 0.00 H new ATOM 0 HG LEU A 100 -10.933 -0.757 2.148 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -12.389 -1.144 0.198 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -13.054 -1.883 1.674 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -13.738 -0.361 1.056 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -11.025 0.906 0.335 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -12.324 1.766 1.196 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -10.697 1.665 1.910 1.00 0.00 H new ATOM 1555 N ALA A 101 -12.030 0.194 6.622 1.00 0.00 N ATOM 1556 CA ALA A 101 -12.638 0.326 7.941 1.00 0.00 C ATOM 1557 C ALA A 101 -12.015 1.482 8.713 1.00 0.00 C ATOM 1558 O ALA A 101 -12.682 2.134 9.518 1.00 0.00 O ATOM 1559 CB ALA A 101 -12.501 -0.969 8.722 1.00 0.00 C ATOM 0 H ALA A 101 -11.479 -0.654 6.492 1.00 0.00 H new ATOM 0 HA ALA A 101 -13.698 0.540 7.806 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -12.960 -0.852 9.704 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -12.999 -1.774 8.182 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -11.445 -1.212 8.842 1.00 0.00 H new ATOM 1565 N LEU A 102 -10.737 1.741 8.450 1.00 0.00 N ATOM 1566 CA LEU A 102 -10.032 2.847 9.088 1.00 0.00 C ATOM 1567 C LEU A 102 -10.641 4.182 8.680 1.00 0.00 C ATOM 1568 O LEU A 102 -10.738 5.103 9.488 1.00 0.00 O ATOM 1569 CB LEU A 102 -8.546 2.824 8.724 1.00 0.00 C ATOM 1570 CG LEU A 102 -7.777 1.586 9.185 1.00 0.00 C ATOM 1571 CD1 LEU A 102 -6.320 1.686 8.763 1.00 0.00 C ATOM 1572 CD2 LEU A 102 -7.889 1.419 10.693 1.00 0.00 C ATOM 0 H LEU A 102 -10.169 1.199 7.799 1.00 0.00 H new ATOM 0 HA LEU A 102 -10.133 2.729 10.167 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -8.453 2.906 7.641 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.071 3.706 9.152 1.00 0.00 H new ATOM 0 HG LEU A 102 -8.215 0.707 8.712 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -5.783 0.798 9.097 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -6.260 1.759 7.677 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -5.871 2.572 9.212 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -7.335 0.533 11.003 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -7.475 2.297 11.188 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -8.937 1.307 10.970 1.00 0.00 H new ATOM 1584 N ILE A 103 -11.056 4.277 7.424 1.00 0.00 N ATOM 1585 CA ILE A 103 -11.689 5.491 6.923 1.00 0.00 C ATOM 1586 C ILE A 103 -13.200 5.386 7.059 1.00 0.00 C ATOM 1587 O ILE A 103 -13.927 6.325 6.736 1.00 0.00 O ATOM 1588 CB ILE A 103 -11.335 5.758 5.440 1.00 0.00 C ATOM 1589 CG1 ILE A 103 -11.967 4.699 4.529 1.00 0.00 C ATOM 1590 CG2 ILE A 103 -9.827 5.778 5.255 1.00 0.00 C ATOM 1591 CD1 ILE A 103 -11.706 4.922 3.054 1.00 0.00 C ATOM 0 H ILE A 103 -10.966 3.531 6.735 1.00 0.00 H new ATOM 0 HA ILE A 103 -11.313 6.321 7.521 1.00 0.00 H new ATOM 0 HB ILE A 103 -11.738 6.732 5.162 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -11.586 3.717 4.811 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -13.044 4.684 4.699 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -9.591 5.967 4.208 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -9.395 6.566 5.872 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -9.411 4.815 5.553 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -12.185 4.132 2.476 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -12.112 5.888 2.755 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -10.632 4.907 2.868 1.00 0.00 H new ATOM 1603 N ASP A 104 -13.645 4.236 7.568 1.00 0.00 N ATOM 1604 CA ASP A 104 -15.057 3.870 7.607 1.00 0.00 C ATOM 1605 C ASP A 104 -15.612 3.795 6.191 1.00 0.00 C ATOM 1606 O ASP A 104 -15.995 4.807 5.604 1.00 0.00 O ATOM 1607 CB ASP A 104 -15.867 4.836 8.469 1.00 0.00 C ATOM 1608 CG ASP A 104 -17.315 4.414 8.597 1.00 0.00 C ATOM 1609 OD1 ASP A 104 -17.572 3.309 9.118 1.00 0.00 O ATOM 1610 OD2 ASP A 104 -18.206 5.174 8.171 1.00 0.00 O ATOM 0 H ASP A 104 -13.028 3.528 7.967 1.00 0.00 H new ATOM 0 HA ASP A 104 -15.143 2.887 8.069 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -15.419 4.897 9.461 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -15.819 5.835 8.035 1.00 0.00 H new ATOM 1615 N GLU A 105 -15.609 2.580 5.650 1.00 0.00 N ATOM 1616 CA GLU A 105 -15.993 2.318 4.264 1.00 0.00 C ATOM 1617 C GLU A 105 -17.261 3.063 3.856 1.00 0.00 C ATOM 1618 O GLU A 105 -18.315 2.949 4.489 1.00 0.00 O ATOM 1619 CB GLU A 105 -16.144 0.811 4.034 1.00 0.00 C ATOM 1620 CG GLU A 105 -17.032 0.114 5.048 1.00 0.00 C ATOM 1621 CD GLU A 105 -17.016 -1.392 4.892 1.00 0.00 C ATOM 1622 OE1 GLU A 105 -17.792 -1.922 4.067 1.00 0.00 O ATOM 1623 OE2 GLU A 105 -16.226 -2.056 5.594 1.00 0.00 O ATOM 0 H GLU A 105 -15.338 1.742 6.164 1.00 0.00 H new ATOM 0 HA GLU A 105 -15.193 2.697 3.628 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -16.551 0.646 3.037 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -15.156 0.351 4.055 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -16.704 0.376 6.054 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -18.054 0.477 4.941 1.00 0.00 H new ATOM 1630 N LYS A 106 -17.126 3.847 2.800 1.00 0.00 N ATOM 1631 CA LYS A 106 -18.214 4.659 2.285 1.00 0.00 C ATOM 1632 C LYS A 106 -17.946 5.007 0.824 1.00 0.00 C ATOM 1633 O LYS A 106 -18.809 4.721 -0.026 1.00 0.00 O ATOM 1634 CB LYS A 106 -18.386 5.934 3.127 1.00 0.00 C ATOM 1635 CG LYS A 106 -17.121 6.774 3.249 1.00 0.00 C ATOM 1636 CD LYS A 106 -17.323 7.977 4.160 1.00 0.00 C ATOM 1637 CE LYS A 106 -17.672 7.554 5.580 1.00 0.00 C ATOM 1638 NZ LYS A 106 -17.680 8.711 6.514 1.00 0.00 N ATOM 1639 OXT LYS A 106 -16.849 5.522 0.529 1.00 0.00 O ATOM 0 H LYS A 106 -16.256 3.938 2.275 1.00 0.00 H new ATOM 0 HA LYS A 106 -19.142 4.091 2.348 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -19.174 6.545 2.685 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -18.721 5.655 4.126 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -16.311 6.156 3.638 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -16.815 7.115 2.260 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -16.416 8.581 4.173 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -18.119 8.606 3.761 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -18.651 7.075 5.586 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -16.952 6.812 5.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -17.922 8.383 7.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -16.739 9.153 6.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -18.385 9.407 6.198 1.00 0.00 H new TER 1653 LYS A 106