USER MOD reduce.3.24.130724 H: found=0, std=0, add=678, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 678 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 0 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A -1 SER OG : rot -28:sc= 0.327 USER MOD Single : A -2 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot -170:sc= -0.322 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 174:sc= 0.0331 USER MOD Single : A 34 SER OG : rot -2:sc= 1.06 USER MOD Single : A 37 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 38 ASN : amide:sc= 1.19 K(o=1.2,f=0) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot -12:sc= 0.837 USER MOD Single : A 43 SER OG : rot -42:sc= 1.03 USER MOD Single : A 58 GLN : amide:sc= -0.232 X(o=-0.23,f=-0.23) USER MOD Single : A 63 SER OG : rot -130:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -0.189 X(o=-0.19,f=-0.2) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -2 8.288 15.336 5.209 1.00 0.00 N ATOM 2 CA GLY A -2 6.873 15.262 5.630 1.00 0.00 C ATOM 3 C GLY A -2 6.322 13.854 5.501 1.00 0.00 C ATOM 4 O GLY A -2 6.313 13.104 6.464 1.00 0.00 O ATOM 0 H1 GLY A -2 8.630 16.313 5.311 1.00 0.00 H new ATOM 0 H2 GLY A -2 8.861 14.705 5.805 1.00 0.00 H new ATOM 0 H3 GLY A -2 8.370 15.043 4.215 1.00 0.00 H new ATOM 0 HA2 GLY A -2 6.783 15.595 6.664 1.00 0.00 H new ATOM 0 HA3 GLY A -2 6.277 15.943 5.023 1.00 0.00 H new ATOM 10 N SER A -1 5.894 13.541 4.274 1.00 0.00 N ATOM 11 CA SER A -1 5.254 12.319 3.760 1.00 0.00 C ATOM 12 C SER A -1 4.102 11.678 4.573 1.00 0.00 C ATOM 13 O SER A -1 3.506 12.316 5.440 1.00 0.00 O ATOM 14 CB SER A -1 6.333 11.261 3.517 1.00 0.00 C ATOM 15 OG SER A -1 6.694 10.668 4.757 1.00 0.00 O ATOM 0 H SER A -1 6.000 14.222 3.522 1.00 0.00 H new ATOM 0 HA SER A -1 4.754 12.666 2.856 1.00 0.00 H new ATOM 0 HB2 SER A -1 5.964 10.499 2.830 1.00 0.00 H new ATOM 0 HB3 SER A -1 7.206 11.716 3.050 1.00 0.00 H new ATOM 0 HG SER A -1 6.554 11.313 5.481 1.00 0.00 H new ATOM 21 N HIS A 0 3.698 10.458 4.162 1.00 0.00 N ATOM 22 CA HIS A 0 2.596 9.627 4.689 1.00 0.00 C ATOM 23 C HIS A 0 3.143 8.463 5.541 1.00 0.00 C ATOM 24 O HIS A 0 4.327 8.140 5.483 1.00 0.00 O ATOM 25 CB HIS A 0 1.768 9.033 3.517 1.00 0.00 C ATOM 26 CG HIS A 0 0.985 10.012 2.666 1.00 0.00 C ATOM 27 ND1 HIS A 0 -0.179 10.667 3.038 1.00 0.00 N ATOM 28 CD2 HIS A 0 1.173 10.218 1.326 1.00 0.00 C ATOM 29 CE1 HIS A 0 -0.687 11.258 1.937 1.00 0.00 C ATOM 30 NE2 HIS A 0 0.123 11.007 0.887 1.00 0.00 N ATOM 0 H HIS A 0 4.173 9.991 3.390 1.00 0.00 H new ATOM 0 HA HIS A 0 1.966 10.265 5.310 1.00 0.00 H new ATOM 0 HB2 HIS A 0 2.448 8.485 2.865 1.00 0.00 H new ATOM 0 HB3 HIS A 0 1.068 8.307 3.930 1.00 0.00 H new ATOM 0 HD2 HIS A 0 1.986 9.838 0.725 1.00 0.00 H new ATOM 0 HE1 HIS A 0 -1.597 11.839 1.901 1.00 0.00 H new ATOM 0 HE2 HIS A 0 -0.015 11.341 -0.067 1.00 0.00 H new ATOM 39 N MET A 1 2.247 7.790 6.273 1.00 0.00 N ATOM 40 CA MET A 1 2.509 6.510 6.938 1.00 0.00 C ATOM 41 C MET A 1 2.637 5.363 5.911 1.00 0.00 C ATOM 42 O MET A 1 1.972 5.376 4.873 1.00 0.00 O ATOM 43 CB MET A 1 1.356 6.243 7.923 1.00 0.00 C ATOM 44 CG MET A 1 1.620 5.068 8.871 1.00 0.00 C ATOM 45 SD MET A 1 0.232 4.646 9.960 1.00 0.00 S ATOM 46 CE MET A 1 0.328 5.965 11.200 1.00 0.00 C ATOM 0 H MET A 1 1.297 8.130 6.422 1.00 0.00 H new ATOM 0 HA MET A 1 3.456 6.558 7.475 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.177 7.142 8.513 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.445 6.046 7.358 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.878 4.191 8.278 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.488 5.303 9.486 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.466 5.832 11.934 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.295 5.924 11.701 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.213 6.933 10.712 1.00 0.00 H new ATOM 56 N THR A 2 3.437 4.342 6.248 1.00 0.00 N ATOM 57 CA THR A 2 3.565 3.059 5.532 1.00 0.00 C ATOM 58 C THR A 2 3.627 1.915 6.549 1.00 0.00 C ATOM 59 O THR A 2 4.041 2.145 7.687 1.00 0.00 O ATOM 60 CB THR A 2 4.828 3.012 4.645 1.00 0.00 C ATOM 61 OG1 THR A 2 5.998 3.032 5.428 1.00 0.00 O ATOM 62 CG2 THR A 2 4.919 4.164 3.645 1.00 0.00 C ATOM 0 H THR A 2 4.043 4.388 7.067 1.00 0.00 H new ATOM 0 HA THR A 2 2.695 2.954 4.884 1.00 0.00 H new ATOM 0 HB THR A 2 4.743 2.079 4.088 1.00 0.00 H new ATOM 0 HG1 THR A 2 6.784 3.000 4.843 1.00 0.00 H new ATOM 0 HG21 THR A 2 5.832 4.064 3.057 1.00 0.00 H new ATOM 0 HG22 THR A 2 4.055 4.138 2.981 1.00 0.00 H new ATOM 0 HG23 THR A 2 4.935 5.112 4.183 1.00 0.00 H new ATOM 70 N LEU A 3 3.251 0.693 6.150 1.00 0.00 N ATOM 71 CA LEU A 3 3.332 -0.515 6.987 1.00 0.00 C ATOM 72 C LEU A 3 3.887 -1.710 6.185 1.00 0.00 C ATOM 73 O LEU A 3 4.176 -1.600 4.991 1.00 0.00 O ATOM 74 CB LEU A 3 1.954 -0.827 7.634 1.00 0.00 C ATOM 75 CG LEU A 3 1.586 -0.142 8.972 1.00 0.00 C ATOM 76 CD1 LEU A 3 2.692 -0.243 10.032 1.00 0.00 C ATOM 77 CD2 LEU A 3 1.120 1.311 8.852 1.00 0.00 C ATOM 0 H LEU A 3 2.875 0.511 5.220 1.00 0.00 H new ATOM 0 HA LEU A 3 4.035 -0.328 7.799 1.00 0.00 H new ATOM 0 HB2 LEU A 3 1.183 -0.569 6.908 1.00 0.00 H new ATOM 0 HB3 LEU A 3 1.899 -1.905 7.789 1.00 0.00 H new ATOM 0 HG LEU A 3 0.725 -0.722 9.304 1.00 0.00 H new ATOM 0 HD11 LEU A 3 2.368 0.258 10.944 1.00 0.00 H new ATOM 0 HD12 LEU A 3 2.896 -1.292 10.246 1.00 0.00 H new ATOM 0 HD13 LEU A 3 3.598 0.234 9.659 1.00 0.00 H new ATOM 0 HD21 LEU A 3 0.886 1.701 9.843 1.00 0.00 H new ATOM 0 HD22 LEU A 3 1.912 1.911 8.403 1.00 0.00 H new ATOM 0 HD23 LEU A 3 0.230 1.357 8.225 1.00 0.00 H new ATOM 89 N ARG A 4 4.064 -2.860 6.856 1.00 0.00 N ATOM 90 CA ARG A 4 4.558 -4.113 6.268 1.00 0.00 C ATOM 91 C ARG A 4 3.438 -5.157 6.140 1.00 0.00 C ATOM 92 O ARG A 4 2.479 -5.125 6.912 1.00 0.00 O ATOM 93 CB ARG A 4 5.696 -4.680 7.136 1.00 0.00 C ATOM 94 CG ARG A 4 6.957 -3.804 7.259 1.00 0.00 C ATOM 95 CD ARG A 4 7.852 -3.866 6.013 1.00 0.00 C ATOM 96 NE ARG A 4 9.141 -3.169 6.218 1.00 0.00 N ATOM 97 CZ ARG A 4 10.198 -3.576 6.917 1.00 0.00 C ATOM 98 NH1 ARG A 4 10.210 -4.722 7.561 1.00 0.00 N ATOM 99 NH2 ARG A 4 11.277 -2.833 6.988 1.00 0.00 N ATOM 0 H ARG A 4 3.861 -2.944 7.852 1.00 0.00 H new ATOM 0 HA ARG A 4 4.928 -3.891 5.267 1.00 0.00 H new ATOM 0 HB2 ARG A 4 5.306 -4.861 8.137 1.00 0.00 H new ATOM 0 HB3 ARG A 4 5.989 -5.647 6.728 1.00 0.00 H new ATOM 0 HG2 ARG A 4 6.659 -2.770 7.435 1.00 0.00 H new ATOM 0 HG3 ARG A 4 7.531 -4.123 8.129 1.00 0.00 H new ATOM 0 HD2 ARG A 4 8.041 -4.908 5.754 1.00 0.00 H new ATOM 0 HD3 ARG A 4 7.328 -3.418 5.168 1.00 0.00 H new ATOM 0 HE ARG A 4 9.231 -2.259 5.765 1.00 0.00 H new ATOM 0 HH11 ARG A 4 9.392 -5.330 7.535 1.00 0.00 H new ATOM 0 HH12 ARG A 4 11.038 -5.003 8.087 1.00 0.00 H new ATOM 0 HH21 ARG A 4 11.311 -1.935 6.505 1.00 0.00 H new ATOM 0 HH22 ARG A 4 12.082 -3.153 7.526 1.00 0.00 H new ATOM 113 N ILE A 5 3.606 -6.147 5.249 1.00 0.00 N ATOM 114 CA ILE A 5 2.631 -7.236 5.009 1.00 0.00 C ATOM 115 C ILE A 5 2.182 -7.927 6.305 1.00 0.00 C ATOM 116 O ILE A 5 0.990 -8.133 6.513 1.00 0.00 O ATOM 117 CB ILE A 5 3.162 -8.249 3.962 1.00 0.00 C ATOM 118 CG1 ILE A 5 2.053 -8.737 3.003 1.00 0.00 C ATOM 119 CG2 ILE A 5 3.949 -9.453 4.517 1.00 0.00 C ATOM 120 CD1 ILE A 5 0.858 -9.425 3.663 1.00 0.00 C ATOM 0 H ILE A 5 4.437 -6.219 4.662 1.00 0.00 H new ATOM 0 HA ILE A 5 1.737 -6.772 4.592 1.00 0.00 H new ATOM 0 HB ILE A 5 3.894 -7.659 3.410 1.00 0.00 H new ATOM 0 HG12 ILE A 5 1.688 -7.881 2.435 1.00 0.00 H new ATOM 0 HG13 ILE A 5 2.497 -9.429 2.287 1.00 0.00 H new ATOM 0 HG21 ILE A 5 4.269 -10.090 3.692 1.00 0.00 H new ATOM 0 HG22 ILE A 5 4.824 -9.096 5.060 1.00 0.00 H new ATOM 0 HG23 ILE A 5 3.311 -10.025 5.191 1.00 0.00 H new ATOM 0 HD11 ILE A 5 0.143 -9.726 2.897 1.00 0.00 H new ATOM 0 HD12 ILE A 5 1.200 -10.306 4.206 1.00 0.00 H new ATOM 0 HD13 ILE A 5 0.378 -8.735 4.357 1.00 0.00 H new ATOM 132 N ARG A 6 3.128 -8.197 7.217 1.00 0.00 N ATOM 133 CA ARG A 6 2.880 -8.734 8.560 1.00 0.00 C ATOM 134 C ARG A 6 1.786 -7.952 9.300 1.00 0.00 C ATOM 135 O ARG A 6 0.891 -8.552 9.885 1.00 0.00 O ATOM 136 CB ARG A 6 4.201 -8.808 9.360 1.00 0.00 C ATOM 137 CG ARG A 6 4.995 -7.486 9.388 1.00 0.00 C ATOM 138 CD ARG A 6 6.104 -7.443 10.448 1.00 0.00 C ATOM 139 NE ARG A 6 6.178 -6.100 11.057 1.00 0.00 N ATOM 140 CZ ARG A 6 7.175 -5.571 11.756 1.00 0.00 C ATOM 141 NH1 ARG A 6 8.312 -6.203 11.939 1.00 0.00 N ATOM 142 NH2 ARG A 6 7.039 -4.381 12.292 1.00 0.00 N ATOM 0 H ARG A 6 4.119 -8.042 7.032 1.00 0.00 H new ATOM 0 HA ARG A 6 2.499 -9.750 8.456 1.00 0.00 H new ATOM 0 HB2 ARG A 6 3.977 -9.106 10.384 1.00 0.00 H new ATOM 0 HB3 ARG A 6 4.830 -9.588 8.931 1.00 0.00 H new ATOM 0 HG2 ARG A 6 5.439 -7.321 8.406 1.00 0.00 H new ATOM 0 HG3 ARG A 6 4.303 -6.663 9.568 1.00 0.00 H new ATOM 0 HD2 ARG A 6 5.909 -8.189 11.218 1.00 0.00 H new ATOM 0 HD3 ARG A 6 7.061 -7.697 9.993 1.00 0.00 H new ATOM 0 HE ARG A 6 5.361 -5.504 10.924 1.00 0.00 H new ATOM 0 HH11 ARG A 6 8.450 -7.131 11.538 1.00 0.00 H new ATOM 0 HH12 ARG A 6 9.057 -5.766 12.482 1.00 0.00 H new ATOM 0 HH21 ARG A 6 6.168 -3.864 12.171 1.00 0.00 H new ATOM 0 HH22 ARG A 6 7.804 -3.973 12.829 1.00 0.00 H new ATOM 156 N THR A 7 1.831 -6.619 9.233 1.00 0.00 N ATOM 157 CA THR A 7 0.897 -5.697 9.884 1.00 0.00 C ATOM 158 C THR A 7 -0.443 -5.638 9.138 1.00 0.00 C ATOM 159 O THR A 7 -1.492 -5.569 9.774 1.00 0.00 O ATOM 160 CB THR A 7 1.539 -4.306 10.020 1.00 0.00 C ATOM 161 OG1 THR A 7 2.757 -4.407 10.732 1.00 0.00 O ATOM 162 CG2 THR A 7 0.647 -3.343 10.806 1.00 0.00 C ATOM 0 H THR A 7 2.551 -6.132 8.700 1.00 0.00 H new ATOM 0 HA THR A 7 0.681 -6.070 10.885 1.00 0.00 H new ATOM 0 HB THR A 7 1.691 -3.929 9.009 1.00 0.00 H new ATOM 0 HG1 THR A 7 3.162 -3.519 10.814 1.00 0.00 H new ATOM 0 HG21 THR A 7 1.136 -2.372 10.880 1.00 0.00 H new ATOM 0 HG22 THR A 7 -0.308 -3.230 10.292 1.00 0.00 H new ATOM 0 HG23 THR A 7 0.476 -3.740 11.807 1.00 0.00 H new ATOM 170 N ILE A 8 -0.426 -5.736 7.800 1.00 0.00 N ATOM 171 CA ILE A 8 -1.639 -5.866 6.973 1.00 0.00 C ATOM 172 C ILE A 8 -2.377 -7.182 7.271 1.00 0.00 C ATOM 173 O ILE A 8 -3.608 -7.202 7.338 1.00 0.00 O ATOM 174 CB ILE A 8 -1.295 -5.743 5.467 1.00 0.00 C ATOM 175 CG1 ILE A 8 -0.638 -4.375 5.197 1.00 0.00 C ATOM 176 CG2 ILE A 8 -2.555 -5.921 4.599 1.00 0.00 C ATOM 177 CD1 ILE A 8 -0.324 -4.099 3.727 1.00 0.00 C ATOM 0 H ILE A 8 0.436 -5.727 7.255 1.00 0.00 H new ATOM 0 HA ILE A 8 -2.311 -5.048 7.231 1.00 0.00 H new ATOM 0 HB ILE A 8 -0.594 -6.534 5.201 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -1.298 -3.590 5.567 1.00 0.00 H new ATOM 0 HG13 ILE A 8 0.287 -4.311 5.771 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -2.287 -5.830 3.546 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -2.986 -6.906 4.780 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -3.285 -5.153 4.855 1.00 0.00 H new ATOM 0 HD11 ILE A 8 0.136 -3.115 3.632 1.00 0.00 H new ATOM 0 HD12 ILE A 8 0.363 -4.858 3.353 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -1.246 -4.126 3.147 1.00 0.00 H new ATOM 189 N ALA A 9 -1.648 -8.286 7.448 1.00 0.00 N ATOM 190 CA ALA A 9 -2.200 -9.586 7.817 1.00 0.00 C ATOM 191 C ALA A 9 -2.713 -9.617 9.269 1.00 0.00 C ATOM 192 O ALA A 9 -3.828 -10.086 9.514 1.00 0.00 O ATOM 193 CB ALA A 9 -1.125 -10.647 7.573 1.00 0.00 C ATOM 0 H ALA A 9 -0.634 -8.298 7.336 1.00 0.00 H new ATOM 0 HA ALA A 9 -3.073 -9.793 7.198 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -1.515 -11.629 7.842 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -0.844 -10.644 6.520 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -0.249 -10.425 8.183 1.00 0.00 H new ATOM 199 N ARG A 10 -1.935 -9.056 10.215 1.00 0.00 N ATOM 200 CA ARG A 10 -2.227 -8.909 11.659 1.00 0.00 C ATOM 201 C ARG A 10 -3.599 -8.322 12.000 1.00 0.00 C ATOM 202 O ARG A 10 -4.056 -8.534 13.118 1.00 0.00 O ATOM 203 CB ARG A 10 -1.146 -8.027 12.308 1.00 0.00 C ATOM 204 CG ARG A 10 0.063 -8.785 12.875 1.00 0.00 C ATOM 205 CD ARG A 10 -0.207 -9.337 14.286 1.00 0.00 C ATOM 206 NE ARG A 10 0.933 -9.098 15.192 1.00 0.00 N ATOM 207 CZ ARG A 10 2.085 -9.754 15.245 1.00 0.00 C ATOM 208 NH1 ARG A 10 2.335 -10.786 14.474 1.00 0.00 N ATOM 209 NH2 ARG A 10 3.022 -9.369 16.081 1.00 0.00 N ATOM 0 H ARG A 10 -1.023 -8.666 9.977 1.00 0.00 H new ATOM 0 HA ARG A 10 -2.231 -9.926 12.051 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -0.791 -7.311 11.567 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -1.604 -7.452 13.113 1.00 0.00 H new ATOM 0 HG2 ARG A 10 0.319 -9.608 12.208 1.00 0.00 H new ATOM 0 HG3 ARG A 10 0.925 -8.119 12.906 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -1.102 -8.868 14.695 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -0.407 -10.407 14.226 1.00 0.00 H new ATOM 0 HE ARG A 10 0.822 -8.335 15.859 1.00 0.00 H new ATOM 0 HH11 ARG A 10 1.633 -11.107 13.808 1.00 0.00 H new ATOM 0 HH12 ARG A 10 3.232 -11.267 14.541 1.00 0.00 H new ATOM 0 HH21 ARG A 10 2.864 -8.566 16.689 1.00 0.00 H new ATOM 0 HH22 ARG A 10 3.908 -9.873 16.122 1.00 0.00 H new ATOM 223 N MET A 11 -4.268 -7.647 11.058 1.00 0.00 N ATOM 224 CA MET A 11 -5.679 -7.258 11.158 1.00 0.00 C ATOM 225 C MET A 11 -6.575 -8.428 11.601 1.00 0.00 C ATOM 226 O MET A 11 -7.464 -8.220 12.422 1.00 0.00 O ATOM 227 CB MET A 11 -6.166 -6.736 9.796 1.00 0.00 C ATOM 228 CG MET A 11 -5.598 -5.375 9.379 1.00 0.00 C ATOM 229 SD MET A 11 -6.544 -3.936 9.954 1.00 0.00 S ATOM 230 CE MET A 11 -5.436 -3.271 11.223 1.00 0.00 C ATOM 0 H MET A 11 -3.833 -7.349 10.185 1.00 0.00 H new ATOM 0 HA MET A 11 -5.750 -6.478 11.916 1.00 0.00 H new ATOM 0 HB2 MET A 11 -5.910 -7.469 9.031 1.00 0.00 H new ATOM 0 HB3 MET A 11 -7.254 -6.667 9.819 1.00 0.00 H new ATOM 0 HG2 MET A 11 -4.578 -5.294 9.755 1.00 0.00 H new ATOM 0 HG3 MET A 11 -5.540 -5.341 8.291 1.00 0.00 H new ATOM 0 HE1 MET A 11 -5.884 -2.382 11.667 1.00 0.00 H new ATOM 0 HE2 MET A 11 -5.277 -4.022 11.997 1.00 0.00 H new ATOM 0 HE3 MET A 11 -4.480 -3.008 10.770 1.00 0.00 H new ATOM 240 N THR A 12 -6.355 -9.642 11.066 1.00 0.00 N ATOM 241 CA THR A 12 -7.124 -10.849 11.442 1.00 0.00 C ATOM 242 C THR A 12 -6.348 -12.172 11.375 1.00 0.00 C ATOM 243 O THR A 12 -6.879 -13.195 11.798 1.00 0.00 O ATOM 244 CB THR A 12 -8.373 -11.040 10.552 1.00 0.00 C ATOM 245 OG1 THR A 12 -7.986 -11.369 9.235 1.00 0.00 O ATOM 246 CG2 THR A 12 -9.330 -9.848 10.500 1.00 0.00 C ATOM 0 H THR A 12 -5.640 -9.817 10.360 1.00 0.00 H new ATOM 0 HA THR A 12 -7.382 -10.647 12.482 1.00 0.00 H new ATOM 0 HB THR A 12 -8.926 -11.851 11.026 1.00 0.00 H new ATOM 0 HG1 THR A 12 -8.768 -11.333 8.646 1.00 0.00 H new ATOM 0 HG21 THR A 12 -10.172 -10.085 9.849 1.00 0.00 H new ATOM 0 HG22 THR A 12 -9.697 -9.632 11.503 1.00 0.00 H new ATOM 0 HG23 THR A 12 -8.804 -8.976 10.110 1.00 0.00 H new ATOM 254 N GLY A 13 -5.172 -12.223 10.738 1.00 0.00 N ATOM 255 CA GLY A 13 -4.488 -13.470 10.379 1.00 0.00 C ATOM 256 C GLY A 13 -5.160 -14.224 9.222 1.00 0.00 C ATOM 257 O GLY A 13 -4.477 -14.564 8.263 1.00 0.00 O ATOM 0 H GLY A 13 -4.662 -11.387 10.454 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -3.457 -13.244 10.106 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -4.451 -14.120 11.253 1.00 0.00 H new ATOM 261 N ILE A 14 -6.486 -14.443 9.263 1.00 0.00 N ATOM 262 CA ILE A 14 -7.229 -15.241 8.259 1.00 0.00 C ATOM 263 C ILE A 14 -6.939 -14.790 6.818 1.00 0.00 C ATOM 264 O ILE A 14 -6.755 -15.614 5.923 1.00 0.00 O ATOM 265 CB ILE A 14 -8.756 -15.355 8.570 1.00 0.00 C ATOM 266 CG1 ILE A 14 -9.723 -14.367 7.861 1.00 0.00 C ATOM 267 CG2 ILE A 14 -9.041 -15.279 10.084 1.00 0.00 C ATOM 268 CD1 ILE A 14 -10.117 -14.766 6.428 1.00 0.00 C ATOM 0 H ILE A 14 -7.083 -14.069 10.001 1.00 0.00 H new ATOM 0 HA ILE A 14 -6.844 -16.257 8.340 1.00 0.00 H new ATOM 0 HB ILE A 14 -8.976 -16.336 8.148 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -10.629 -14.275 8.460 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -9.258 -13.382 7.834 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -10.114 -15.362 10.257 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -8.527 -16.095 10.592 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -8.683 -14.326 10.474 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -10.793 -14.018 6.015 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -9.222 -14.828 5.809 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -10.615 -15.735 6.444 1.00 0.00 H new ATOM 280 N ARG A 15 -6.848 -13.469 6.610 1.00 0.00 N ATOM 281 CA ARG A 15 -6.540 -12.829 5.333 1.00 0.00 C ATOM 282 C ARG A 15 -5.109 -13.088 4.833 1.00 0.00 C ATOM 283 O ARG A 15 -4.868 -12.912 3.645 1.00 0.00 O ATOM 284 CB ARG A 15 -6.877 -11.326 5.443 1.00 0.00 C ATOM 285 CG ARG A 15 -5.797 -10.500 6.166 1.00 0.00 C ATOM 286 CD ARG A 15 -6.314 -9.352 7.038 1.00 0.00 C ATOM 287 NE ARG A 15 -7.164 -8.398 6.304 1.00 0.00 N ATOM 288 CZ ARG A 15 -6.760 -7.411 5.518 1.00 0.00 C ATOM 289 NH1 ARG A 15 -5.506 -7.055 5.410 1.00 0.00 N ATOM 290 NH2 ARG A 15 -7.640 -6.747 4.815 1.00 0.00 N ATOM 0 H ARG A 15 -6.994 -12.794 7.360 1.00 0.00 H new ATOM 0 HA ARG A 15 -7.163 -13.285 4.563 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -7.022 -10.921 4.441 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -7.823 -11.213 5.972 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -5.210 -11.172 6.792 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -5.119 -10.088 5.418 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -6.881 -9.766 7.872 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -5.465 -8.818 7.464 1.00 0.00 H new ATOM 0 HE ARG A 15 -8.172 -8.510 6.413 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -4.789 -7.545 5.945 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -5.245 -6.288 4.791 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -8.629 -6.990 4.874 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -7.338 -5.986 4.207 1.00 0.00 H new ATOM 304 N GLU A 16 -4.161 -13.527 5.675 1.00 0.00 N ATOM 305 CA GLU A 16 -2.764 -13.766 5.273 1.00 0.00 C ATOM 306 C GLU A 16 -2.683 -14.738 4.097 1.00 0.00 C ATOM 307 O GLU A 16 -2.057 -14.420 3.087 1.00 0.00 O ATOM 308 CB GLU A 16 -1.914 -14.288 6.439 1.00 0.00 C ATOM 309 CG GLU A 16 -0.416 -14.117 6.129 1.00 0.00 C ATOM 310 CD GLU A 16 0.414 -15.222 6.778 1.00 0.00 C ATOM 311 OE1 GLU A 16 0.573 -16.269 6.112 1.00 0.00 O ATOM 312 OE2 GLU A 16 0.868 -15.001 7.923 1.00 0.00 O ATOM 0 H GLU A 16 -4.342 -13.727 6.659 1.00 0.00 H new ATOM 0 HA GLU A 16 -2.360 -12.803 4.962 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -2.167 -13.749 7.352 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -2.137 -15.340 6.618 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -0.262 -14.129 5.050 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -0.077 -13.145 6.488 1.00 0.00 H new ATOM 319 N ALA A 17 -3.393 -15.868 4.200 1.00 0.00 N ATOM 320 CA ALA A 17 -3.509 -16.877 3.153 1.00 0.00 C ATOM 321 C ALA A 17 -3.949 -16.271 1.810 1.00 0.00 C ATOM 322 O ALA A 17 -3.417 -16.661 0.767 1.00 0.00 O ATOM 323 CB ALA A 17 -4.487 -17.955 3.629 1.00 0.00 C ATOM 0 H ALA A 17 -3.917 -16.108 5.042 1.00 0.00 H new ATOM 0 HA ALA A 17 -2.529 -17.320 2.973 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.588 -18.720 2.859 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.110 -18.409 4.545 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -5.460 -17.504 3.822 1.00 0.00 H new ATOM 329 N THR A 18 -4.876 -15.298 1.851 1.00 0.00 N ATOM 330 CA THR A 18 -5.367 -14.547 0.690 1.00 0.00 C ATOM 331 C THR A 18 -4.325 -13.552 0.178 1.00 0.00 C ATOM 332 O THR A 18 -4.081 -13.517 -1.023 1.00 0.00 O ATOM 333 CB THR A 18 -6.746 -13.898 0.973 1.00 0.00 C ATOM 334 OG1 THR A 18 -7.607 -14.236 -0.087 1.00 0.00 O ATOM 335 CG2 THR A 18 -6.826 -12.371 1.070 1.00 0.00 C ATOM 0 H THR A 18 -5.316 -15.006 2.723 1.00 0.00 H new ATOM 0 HA THR A 18 -5.528 -15.256 -0.122 1.00 0.00 H new ATOM 0 HB THR A 18 -7.001 -14.280 1.961 1.00 0.00 H new ATOM 0 HG1 THR A 18 -8.489 -13.838 0.069 1.00 0.00 H new ATOM 0 HG21 THR A 18 -7.855 -12.073 1.271 1.00 0.00 H new ATOM 0 HG22 THR A 18 -6.183 -12.024 1.879 1.00 0.00 H new ATOM 0 HG23 THR A 18 -6.497 -11.929 0.129 1.00 0.00 H new ATOM 343 N LEU A 19 -3.670 -12.786 1.060 1.00 0.00 N ATOM 344 CA LEU A 19 -2.617 -11.831 0.698 1.00 0.00 C ATOM 345 C LEU A 19 -1.443 -12.547 0.003 1.00 0.00 C ATOM 346 O LEU A 19 -1.060 -12.189 -1.113 1.00 0.00 O ATOM 347 CB LEU A 19 -2.129 -11.083 1.952 1.00 0.00 C ATOM 348 CG LEU A 19 -3.176 -10.223 2.694 1.00 0.00 C ATOM 349 CD1 LEU A 19 -2.779 -10.051 4.165 1.00 0.00 C ATOM 350 CD2 LEU A 19 -3.318 -8.835 2.074 1.00 0.00 C ATOM 0 H LEU A 19 -3.861 -12.814 2.062 1.00 0.00 H new ATOM 0 HA LEU A 19 -3.032 -11.107 -0.003 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.731 -11.817 2.653 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -1.300 -10.437 1.663 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.128 -10.747 2.612 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.526 -9.443 4.675 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.720 -11.029 4.643 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -1.808 -9.559 4.225 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.064 -8.264 2.627 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.360 -8.317 2.117 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.632 -8.931 1.035 1.00 0.00 H new ATOM 362 N ARG A 20 -0.899 -13.594 0.645 1.00 0.00 N ATOM 363 CA ARG A 20 0.189 -14.416 0.097 1.00 0.00 C ATOM 364 C ARG A 20 -0.237 -15.261 -1.107 1.00 0.00 C ATOM 365 O ARG A 20 0.613 -15.637 -1.910 1.00 0.00 O ATOM 366 CB ARG A 20 0.850 -15.245 1.215 1.00 0.00 C ATOM 367 CG ARG A 20 0.022 -16.410 1.791 1.00 0.00 C ATOM 368 CD ARG A 20 0.286 -17.777 1.144 1.00 0.00 C ATOM 369 NE ARG A 20 -0.736 -18.148 0.146 1.00 0.00 N ATOM 370 CZ ARG A 20 -0.593 -19.063 -0.806 1.00 0.00 C ATOM 371 NH1 ARG A 20 0.520 -19.746 -0.954 1.00 0.00 N ATOM 372 NH2 ARG A 20 -1.576 -19.326 -1.633 1.00 0.00 N ATOM 0 H ARG A 20 -1.207 -13.896 1.569 1.00 0.00 H new ATOM 0 HA ARG A 20 0.943 -13.738 -0.302 1.00 0.00 H new ATOM 0 HB2 ARG A 20 1.786 -15.650 0.831 1.00 0.00 H new ATOM 0 HB3 ARG A 20 1.106 -14.571 2.033 1.00 0.00 H new ATOM 0 HG2 ARG A 20 0.224 -16.486 2.859 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -1.036 -16.172 1.683 1.00 0.00 H new ATOM 0 HD2 ARG A 20 1.265 -17.764 0.666 1.00 0.00 H new ATOM 0 HD3 ARG A 20 0.321 -18.540 1.921 1.00 0.00 H new ATOM 0 HE ARG A 20 -1.630 -17.659 0.191 1.00 0.00 H new ATOM 0 HH11 ARG A 20 1.307 -19.580 -0.327 1.00 0.00 H new ATOM 0 HH12 ARG A 20 0.597 -20.442 -1.696 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -2.461 -18.826 -1.549 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -1.456 -20.031 -2.361 1.00 0.00 H new ATOM 386 N ALA A 21 -1.542 -15.528 -1.276 1.00 0.00 N ATOM 387 CA ALA A 21 -2.076 -16.044 -2.534 1.00 0.00 C ATOM 388 C ALA A 21 -2.001 -14.963 -3.612 1.00 0.00 C ATOM 389 O ALA A 21 -1.408 -15.207 -4.658 1.00 0.00 O ATOM 390 CB ALA A 21 -3.512 -16.564 -2.375 1.00 0.00 C ATOM 0 H ALA A 21 -2.245 -15.392 -0.550 1.00 0.00 H new ATOM 0 HA ALA A 21 -1.464 -16.893 -2.839 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -3.872 -16.939 -3.333 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -3.528 -17.370 -1.641 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -4.157 -15.753 -2.037 1.00 0.00 H new ATOM 396 N TRP A 22 -2.571 -13.777 -3.365 1.00 0.00 N ATOM 397 CA TRP A 22 -2.599 -12.678 -4.326 1.00 0.00 C ATOM 398 C TRP A 22 -1.215 -12.274 -4.831 1.00 0.00 C ATOM 399 O TRP A 22 -1.110 -12.029 -6.031 1.00 0.00 O ATOM 400 CB TRP A 22 -3.272 -11.445 -3.757 1.00 0.00 C ATOM 401 CG TRP A 22 -4.678 -11.510 -3.273 1.00 0.00 C ATOM 402 CD1 TRP A 22 -5.648 -12.362 -3.670 1.00 0.00 C ATOM 403 CD2 TRP A 22 -5.299 -10.599 -2.325 1.00 0.00 C ATOM 404 NE1 TRP A 22 -6.833 -12.018 -3.047 1.00 0.00 N ATOM 405 CE2 TRP A 22 -6.682 -10.907 -2.246 1.00 0.00 C ATOM 406 CE3 TRP A 22 -4.833 -9.524 -1.544 1.00 0.00 C ATOM 407 CZ2 TRP A 22 -7.563 -10.159 -1.457 1.00 0.00 C ATOM 408 CZ3 TRP A 22 -5.707 -8.774 -0.738 1.00 0.00 C ATOM 409 CH2 TRP A 22 -7.074 -9.086 -0.693 1.00 0.00 C ATOM 0 H TRP A 22 -3.030 -13.556 -2.481 1.00 0.00 H new ATOM 0 HA TRP A 22 -3.174 -13.067 -5.166 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -2.660 -11.099 -2.924 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -3.231 -10.672 -4.525 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -5.519 -13.180 -4.363 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -7.711 -12.524 -3.166 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -3.783 -9.271 -1.565 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -8.614 -10.405 -1.435 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -5.324 -7.953 -0.150 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -7.745 -8.506 -0.076 1.00 0.00 H new ATOM 420 N GLU A 23 -0.167 -12.292 -3.988 1.00 0.00 N ATOM 421 CA GLU A 23 1.243 -12.144 -4.406 1.00 0.00 C ATOM 422 C GLU A 23 1.571 -12.996 -5.648 1.00 0.00 C ATOM 423 O GLU A 23 2.322 -12.556 -6.518 1.00 0.00 O ATOM 424 CB GLU A 23 2.206 -12.428 -3.215 1.00 0.00 C ATOM 425 CG GLU A 23 3.502 -13.193 -3.586 1.00 0.00 C ATOM 426 CD GLU A 23 4.570 -13.337 -2.485 1.00 0.00 C ATOM 427 OE1 GLU A 23 4.384 -12.832 -1.358 1.00 0.00 O ATOM 428 OE2 GLU A 23 5.614 -13.971 -2.791 1.00 0.00 O ATOM 0 H GLU A 23 -0.275 -12.412 -2.981 1.00 0.00 H new ATOM 0 HA GLU A 23 1.396 -11.107 -4.706 1.00 0.00 H new ATOM 0 HB2 GLU A 23 2.482 -11.478 -2.756 1.00 0.00 H new ATOM 0 HB3 GLU A 23 1.667 -13.002 -2.461 1.00 0.00 H new ATOM 0 HG2 GLU A 23 3.222 -14.192 -3.919 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.960 -12.690 -4.438 1.00 0.00 H new ATOM 435 N ARG A 24 0.976 -14.192 -5.750 1.00 0.00 N ATOM 436 CA ARG A 24 1.210 -15.176 -6.810 1.00 0.00 C ATOM 437 C ARG A 24 0.029 -15.340 -7.782 1.00 0.00 C ATOM 438 O ARG A 24 0.196 -15.944 -8.837 1.00 0.00 O ATOM 439 CB ARG A 24 1.597 -16.496 -6.119 1.00 0.00 C ATOM 440 CG ARG A 24 2.609 -17.320 -6.932 1.00 0.00 C ATOM 441 CD ARG A 24 3.712 -17.923 -6.047 1.00 0.00 C ATOM 442 NE ARG A 24 4.550 -16.899 -5.376 1.00 0.00 N ATOM 443 CZ ARG A 24 5.694 -17.117 -4.734 1.00 0.00 C ATOM 444 NH1 ARG A 24 6.226 -18.319 -4.690 1.00 0.00 N ATOM 445 NH2 ARG A 24 6.341 -16.160 -4.110 1.00 0.00 N ATOM 0 H ARG A 24 0.290 -14.512 -5.066 1.00 0.00 H new ATOM 0 HA ARG A 24 2.017 -14.827 -7.455 1.00 0.00 H new ATOM 0 HB2 ARG A 24 2.018 -16.277 -5.138 1.00 0.00 H new ATOM 0 HB3 ARG A 24 0.699 -17.092 -5.955 1.00 0.00 H new ATOM 0 HG2 ARG A 24 2.086 -18.121 -7.454 1.00 0.00 H new ATOM 0 HG3 ARG A 24 3.063 -16.686 -7.694 1.00 0.00 H new ATOM 0 HD2 ARG A 24 3.254 -18.560 -5.291 1.00 0.00 H new ATOM 0 HD3 ARG A 24 4.350 -18.562 -6.658 1.00 0.00 H new ATOM 0 HE ARG A 24 4.217 -15.936 -5.410 1.00 0.00 H new ATOM 0 HH11 ARG A 24 5.761 -19.100 -5.152 1.00 0.00 H new ATOM 0 HH12 ARG A 24 7.104 -18.470 -4.194 1.00 0.00 H new ATOM 0 HH21 ARG A 24 5.968 -15.210 -4.107 1.00 0.00 H new ATOM 0 HH22 ARG A 24 7.216 -16.366 -3.628 1.00 0.00 H new ATOM 459 N ARG A 25 -1.146 -14.790 -7.442 1.00 0.00 N ATOM 460 CA ARG A 25 -2.402 -14.813 -8.215 1.00 0.00 C ATOM 461 C ARG A 25 -2.614 -13.560 -9.086 1.00 0.00 C ATOM 462 O ARG A 25 -3.087 -13.701 -10.209 1.00 0.00 O ATOM 463 CB ARG A 25 -3.590 -14.986 -7.246 1.00 0.00 C ATOM 464 CG ARG A 25 -4.283 -16.353 -7.258 1.00 0.00 C ATOM 465 CD ARG A 25 -5.430 -16.324 -6.231 1.00 0.00 C ATOM 466 NE ARG A 25 -6.110 -17.623 -6.103 1.00 0.00 N ATOM 467 CZ ARG A 25 -7.062 -18.119 -6.886 1.00 0.00 C ATOM 468 NH1 ARG A 25 -7.543 -17.464 -7.920 1.00 0.00 N ATOM 469 NH2 ARG A 25 -7.558 -19.306 -6.627 1.00 0.00 N ATOM 0 H ARG A 25 -1.254 -14.284 -6.563 1.00 0.00 H new ATOM 0 HA ARG A 25 -2.336 -15.655 -8.904 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -3.237 -14.790 -6.234 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -4.334 -14.223 -7.477 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -4.670 -16.574 -8.253 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -3.572 -17.141 -7.011 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -5.035 -16.028 -5.259 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -6.156 -15.566 -6.524 1.00 0.00 H new ATOM 0 HE ARG A 25 -5.816 -18.211 -5.323 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -7.185 -16.537 -8.148 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -8.274 -17.884 -8.494 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -7.212 -19.840 -5.830 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -8.289 -19.694 -7.223 1.00 0.00 H new ATOM 483 N TYR A 26 -2.307 -12.355 -8.576 1.00 0.00 N ATOM 484 CA TYR A 26 -2.590 -11.065 -9.249 1.00 0.00 C ATOM 485 C TYR A 26 -1.542 -9.963 -9.020 1.00 0.00 C ATOM 486 O TYR A 26 -1.462 -9.025 -9.814 1.00 0.00 O ATOM 487 CB TYR A 26 -3.934 -10.479 -8.770 1.00 0.00 C ATOM 488 CG TYR A 26 -5.095 -11.444 -8.709 1.00 0.00 C ATOM 489 CD1 TYR A 26 -5.721 -11.891 -9.890 1.00 0.00 C ATOM 490 CD2 TYR A 26 -5.515 -11.932 -7.461 1.00 0.00 C ATOM 491 CE1 TYR A 26 -6.728 -12.873 -9.824 1.00 0.00 C ATOM 492 CE2 TYR A 26 -6.516 -12.914 -7.393 1.00 0.00 C ATOM 493 CZ TYR A 26 -7.109 -13.407 -8.575 1.00 0.00 C ATOM 494 OH TYR A 26 -8.017 -14.420 -8.506 1.00 0.00 O ATOM 0 H TYR A 26 -1.849 -12.243 -7.672 1.00 0.00 H new ATOM 0 HA TYR A 26 -2.591 -11.327 -10.307 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -3.789 -10.054 -7.777 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -4.205 -9.657 -9.432 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -5.428 -11.481 -10.845 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -5.068 -11.552 -6.554 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -7.208 -13.217 -10.728 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -6.833 -13.293 -6.433 1.00 0.00 H new ATOM 0 HH TYR A 26 -8.091 -14.730 -7.579 1.00 0.00 H new ATOM 504 N GLY A 27 -0.805 -10.030 -7.905 1.00 0.00 N ATOM 505 CA GLY A 27 0.175 -9.051 -7.441 1.00 0.00 C ATOM 506 C GLY A 27 -0.353 -8.049 -6.405 1.00 0.00 C ATOM 507 O GLY A 27 0.458 -7.460 -5.704 1.00 0.00 O ATOM 0 H GLY A 27 -0.885 -10.820 -7.265 1.00 0.00 H new ATOM 0 HA2 GLY A 27 1.023 -9.583 -7.011 1.00 0.00 H new ATOM 0 HA3 GLY A 27 0.550 -8.498 -8.302 1.00 0.00 H new ATOM 511 N PHE A 28 -1.673 -7.834 -6.297 1.00 0.00 N ATOM 512 CA PHE A 28 -2.286 -6.889 -5.348 1.00 0.00 C ATOM 513 C PHE A 28 -2.305 -7.437 -3.900 1.00 0.00 C ATOM 514 O PHE A 28 -2.572 -8.615 -3.720 1.00 0.00 O ATOM 515 CB PHE A 28 -3.716 -6.576 -5.814 1.00 0.00 C ATOM 516 CG PHE A 28 -4.618 -5.867 -4.811 1.00 0.00 C ATOM 517 CD1 PHE A 28 -5.326 -6.613 -3.846 1.00 0.00 C ATOM 518 CD2 PHE A 28 -4.797 -4.471 -4.870 1.00 0.00 C ATOM 519 CE1 PHE A 28 -6.255 -5.984 -2.998 1.00 0.00 C ATOM 520 CE2 PHE A 28 -5.694 -3.835 -3.993 1.00 0.00 C ATOM 521 CZ PHE A 28 -6.446 -4.595 -3.081 1.00 0.00 C ATOM 0 H PHE A 28 -2.357 -8.320 -6.876 1.00 0.00 H new ATOM 0 HA PHE A 28 -1.682 -5.982 -5.334 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -3.655 -5.961 -6.712 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -4.194 -7.513 -6.100 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -5.153 -7.675 -3.758 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -4.244 -3.887 -5.591 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -6.820 -6.567 -2.285 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -5.805 -2.761 -4.021 1.00 0.00 H new ATOM 0 HZ PHE A 28 -7.171 -4.111 -2.444 1.00 0.00 H new ATOM 531 N PRO A 29 -2.120 -6.605 -2.857 1.00 0.00 N ATOM 532 CA PRO A 29 -1.539 -5.278 -2.944 1.00 0.00 C ATOM 533 C PRO A 29 -0.090 -5.407 -3.417 1.00 0.00 C ATOM 534 O PRO A 29 0.650 -6.290 -2.960 1.00 0.00 O ATOM 535 CB PRO A 29 -1.641 -4.699 -1.535 1.00 0.00 C ATOM 536 CG PRO A 29 -1.593 -5.930 -0.628 1.00 0.00 C ATOM 537 CD PRO A 29 -2.293 -6.997 -1.464 1.00 0.00 C ATOM 0 HA PRO A 29 -2.045 -4.625 -3.654 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -0.819 -4.015 -1.324 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.566 -4.138 -1.399 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -0.569 -6.214 -0.386 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.107 -5.756 0.317 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -1.860 -7.980 -1.280 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.350 -7.061 -1.207 1.00 0.00 H new ATOM 545 N ARG A 30 0.310 -4.512 -4.328 1.00 0.00 N ATOM 546 CA ARG A 30 1.661 -4.506 -4.885 1.00 0.00 C ATOM 547 C ARG A 30 2.632 -3.896 -3.874 1.00 0.00 C ATOM 548 O ARG A 30 2.412 -2.764 -3.447 1.00 0.00 O ATOM 549 CB ARG A 30 1.704 -3.775 -6.238 1.00 0.00 C ATOM 550 CG ARG A 30 1.622 -4.822 -7.359 1.00 0.00 C ATOM 551 CD ARG A 30 1.462 -4.221 -8.754 1.00 0.00 C ATOM 552 NE ARG A 30 2.706 -3.622 -9.268 1.00 0.00 N ATOM 553 CZ ARG A 30 2.810 -2.879 -10.363 1.00 0.00 C ATOM 554 NH1 ARG A 30 1.749 -2.497 -11.037 1.00 0.00 N ATOM 555 NH2 ARG A 30 3.985 -2.511 -10.813 1.00 0.00 N ATOM 0 H ARG A 30 -0.293 -3.776 -4.696 1.00 0.00 H new ATOM 0 HA ARG A 30 1.970 -5.533 -5.078 1.00 0.00 H new ATOM 0 HB2 ARG A 30 0.875 -3.071 -6.315 1.00 0.00 H new ATOM 0 HB3 ARG A 30 2.623 -3.196 -6.327 1.00 0.00 H new ATOM 0 HG2 ARG A 30 2.524 -5.434 -7.339 1.00 0.00 H new ATOM 0 HG3 ARG A 30 0.781 -5.487 -7.161 1.00 0.00 H new ATOM 0 HD2 ARG A 30 1.128 -4.997 -9.442 1.00 0.00 H new ATOM 0 HD3 ARG A 30 0.682 -3.460 -8.729 1.00 0.00 H new ATOM 0 HE ARG A 30 3.560 -3.793 -8.737 1.00 0.00 H new ATOM 0 HH11 ARG A 30 0.819 -2.771 -10.722 1.00 0.00 H new ATOM 0 HH12 ARG A 30 1.856 -1.926 -11.876 1.00 0.00 H new ATOM 0 HH21 ARG A 30 4.832 -2.796 -10.321 1.00 0.00 H new ATOM 0 HH22 ARG A 30 4.053 -1.940 -11.656 1.00 0.00 H new ATOM 569 N PRO A 31 3.673 -4.635 -3.447 1.00 0.00 N ATOM 570 CA PRO A 31 4.644 -4.113 -2.500 1.00 0.00 C ATOM 571 C PRO A 31 5.478 -3.012 -3.156 1.00 0.00 C ATOM 572 O PRO A 31 5.772 -3.073 -4.352 1.00 0.00 O ATOM 573 CB PRO A 31 5.474 -5.325 -2.092 1.00 0.00 C ATOM 574 CG PRO A 31 5.442 -6.226 -3.322 1.00 0.00 C ATOM 575 CD PRO A 31 4.034 -5.986 -3.861 1.00 0.00 C ATOM 0 HA PRO A 31 4.190 -3.646 -1.626 1.00 0.00 H new ATOM 0 HB2 PRO A 31 6.494 -5.041 -1.832 1.00 0.00 H new ATOM 0 HB3 PRO A 31 5.050 -5.824 -1.221 1.00 0.00 H new ATOM 0 HG2 PRO A 31 6.208 -5.952 -4.048 1.00 0.00 H new ATOM 0 HG3 PRO A 31 5.607 -7.272 -3.065 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.010 -6.082 -4.947 1.00 0.00 H new ATOM 0 HD3 PRO A 31 3.332 -6.718 -3.461 1.00 0.00 H new ATOM 583 N LEU A 32 5.854 -1.998 -2.373 1.00 0.00 N ATOM 584 CA LEU A 32 6.621 -0.873 -2.907 1.00 0.00 C ATOM 585 C LEU A 32 8.043 -1.344 -3.268 1.00 0.00 C ATOM 586 O LEU A 32 8.621 -2.190 -2.582 1.00 0.00 O ATOM 587 CB LEU A 32 6.647 0.329 -1.938 1.00 0.00 C ATOM 588 CG LEU A 32 5.362 0.624 -1.132 1.00 0.00 C ATOM 589 CD1 LEU A 32 5.525 1.947 -0.379 1.00 0.00 C ATOM 590 CD2 LEU A 32 4.085 0.702 -1.976 1.00 0.00 C ATOM 0 H LEU A 32 5.642 -1.934 -1.377 1.00 0.00 H new ATOM 0 HA LEU A 32 6.126 -0.519 -3.811 1.00 0.00 H new ATOM 0 HB2 LEU A 32 7.460 0.172 -1.229 1.00 0.00 H new ATOM 0 HB3 LEU A 32 6.894 1.220 -2.514 1.00 0.00 H new ATOM 0 HG LEU A 32 5.240 -0.221 -0.455 1.00 0.00 H new ATOM 0 HD11 LEU A 32 4.619 2.156 0.190 1.00 0.00 H new ATOM 0 HD12 LEU A 32 6.373 1.876 0.302 1.00 0.00 H new ATOM 0 HD13 LEU A 32 5.699 2.753 -1.092 1.00 0.00 H new ATOM 0 HD21 LEU A 32 3.233 0.912 -1.329 1.00 0.00 H new ATOM 0 HD22 LEU A 32 4.185 1.498 -2.714 1.00 0.00 H new ATOM 0 HD23 LEU A 32 3.927 -0.248 -2.486 1.00 0.00 H new ATOM 602 N ARG A 33 8.630 -0.793 -4.338 1.00 0.00 N ATOM 603 CA ARG A 33 9.985 -1.157 -4.776 1.00 0.00 C ATOM 604 C ARG A 33 11.027 -0.545 -3.828 1.00 0.00 C ATOM 605 O ARG A 33 11.433 0.606 -3.976 1.00 0.00 O ATOM 606 CB ARG A 33 10.188 -0.780 -6.253 1.00 0.00 C ATOM 607 CG ARG A 33 11.441 -1.456 -6.835 1.00 0.00 C ATOM 608 CD ARG A 33 11.544 -1.239 -8.354 1.00 0.00 C ATOM 609 NE ARG A 33 12.859 -0.699 -8.747 1.00 0.00 N ATOM 610 CZ ARG A 33 13.215 -0.273 -9.953 1.00 0.00 C ATOM 611 NH1 ARG A 33 12.394 -0.325 -10.977 1.00 0.00 N ATOM 612 NH2 ARG A 33 14.416 0.219 -10.152 1.00 0.00 N ATOM 0 H ARG A 33 8.183 -0.086 -4.922 1.00 0.00 H new ATOM 0 HA ARG A 33 10.120 -2.237 -4.721 1.00 0.00 H new ATOM 0 HB2 ARG A 33 9.312 -1.076 -6.830 1.00 0.00 H new ATOM 0 HB3 ARG A 33 10.280 0.302 -6.345 1.00 0.00 H new ATOM 0 HG2 ARG A 33 12.331 -1.056 -6.348 1.00 0.00 H new ATOM 0 HG3 ARG A 33 11.413 -2.524 -6.620 1.00 0.00 H new ATOM 0 HD2 ARG A 33 11.372 -2.185 -8.868 1.00 0.00 H new ATOM 0 HD3 ARG A 33 10.760 -0.554 -8.676 1.00 0.00 H new ATOM 0 HE ARG A 33 13.569 -0.647 -8.016 1.00 0.00 H new ATOM 0 HH11 ARG A 33 11.453 -0.701 -10.858 1.00 0.00 H new ATOM 0 HH12 ARG A 33 12.697 0.010 -11.891 1.00 0.00 H new ATOM 0 HH21 ARG A 33 15.079 0.275 -9.379 1.00 0.00 H new ATOM 0 HH22 ARG A 33 14.686 0.545 -11.080 1.00 0.00 H new ATOM 626 N SER A 34 11.404 -1.284 -2.786 1.00 0.00 N ATOM 627 CA SER A 34 12.378 -0.893 -1.755 1.00 0.00 C ATOM 628 C SER A 34 12.915 -2.144 -1.038 1.00 0.00 C ATOM 629 O SER A 34 12.667 -3.261 -1.489 1.00 0.00 O ATOM 630 CB SER A 34 11.724 0.095 -0.777 1.00 0.00 C ATOM 631 OG SER A 34 11.440 1.312 -1.443 1.00 0.00 O ATOM 0 H SER A 34 11.024 -2.217 -2.625 1.00 0.00 H new ATOM 0 HA SER A 34 13.228 -0.392 -2.217 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.806 -0.332 -0.374 1.00 0.00 H new ATOM 0 HB3 SER A 34 12.388 0.278 0.068 1.00 0.00 H new ATOM 0 HG SER A 34 11.751 1.258 -2.371 1.00 0.00 H new ATOM 637 N GLU A 35 13.699 -1.971 0.035 1.00 0.00 N ATOM 638 CA GLU A 35 14.279 -3.092 0.787 1.00 0.00 C ATOM 639 C GLU A 35 13.211 -3.998 1.438 1.00 0.00 C ATOM 640 O GLU A 35 12.087 -3.569 1.711 1.00 0.00 O ATOM 641 CB GLU A 35 15.299 -2.559 1.819 1.00 0.00 C ATOM 642 CG GLU A 35 14.700 -2.291 3.214 1.00 0.00 C ATOM 643 CD GLU A 35 15.639 -1.545 4.168 1.00 0.00 C ATOM 644 OE1 GLU A 35 16.872 -1.653 3.988 1.00 0.00 O ATOM 645 OE2 GLU A 35 15.096 -0.903 5.095 1.00 0.00 O ATOM 0 H GLU A 35 13.948 -1.054 0.405 1.00 0.00 H new ATOM 0 HA GLU A 35 14.803 -3.732 0.078 1.00 0.00 H new ATOM 0 HB2 GLU A 35 16.111 -3.279 1.916 1.00 0.00 H new ATOM 0 HB3 GLU A 35 15.735 -1.635 1.439 1.00 0.00 H new ATOM 0 HG2 GLU A 35 13.783 -1.713 3.098 1.00 0.00 H new ATOM 0 HG3 GLU A 35 14.422 -3.243 3.667 1.00 0.00 H new ATOM 652 N GLY A 36 13.602 -5.240 1.757 1.00 0.00 N ATOM 653 CA GLY A 36 12.754 -6.222 2.433 1.00 0.00 C ATOM 654 C GLY A 36 12.505 -7.469 1.582 1.00 0.00 C ATOM 655 O GLY A 36 11.841 -7.405 0.551 1.00 0.00 O ATOM 0 H GLY A 36 14.535 -5.593 1.547 1.00 0.00 H new ATOM 0 HA2 GLY A 36 13.222 -6.515 3.373 1.00 0.00 H new ATOM 0 HA3 GLY A 36 11.799 -5.761 2.683 1.00 0.00 H new ATOM 659 N ASN A 37 13.036 -8.612 2.036 1.00 0.00 N ATOM 660 CA ASN A 37 12.847 -9.917 1.396 1.00 0.00 C ATOM 661 C ASN A 37 11.749 -10.719 2.119 1.00 0.00 C ATOM 662 O ASN A 37 10.700 -10.998 1.544 1.00 0.00 O ATOM 663 CB ASN A 37 14.194 -10.669 1.354 1.00 0.00 C ATOM 664 CG ASN A 37 15.168 -10.112 0.318 1.00 0.00 C ATOM 665 OD1 ASN A 37 15.302 -8.916 0.119 1.00 0.00 O ATOM 666 ND2 ASN A 37 15.900 -10.971 -0.360 1.00 0.00 N ATOM 0 H ASN A 37 13.618 -8.655 2.872 1.00 0.00 H new ATOM 0 HA ASN A 37 12.509 -9.779 0.369 1.00 0.00 H new ATOM 0 HB2 ASN A 37 14.658 -10.623 2.339 1.00 0.00 H new ATOM 0 HB3 ASN A 37 14.008 -11.721 1.138 1.00 0.00 H new ATOM 0 HD21 ASN A 37 16.575 -10.635 -1.047 1.00 0.00 H new ATOM 0 HD22 ASN A 37 15.792 -11.972 -0.198 1.00 0.00 H new ATOM 673 N ASN A 38 11.983 -11.062 3.395 1.00 0.00 N ATOM 674 CA ASN A 38 11.010 -11.716 4.280 1.00 0.00 C ATOM 675 C ASN A 38 9.763 -10.847 4.543 1.00 0.00 C ATOM 676 O ASN A 38 8.679 -11.360 4.812 1.00 0.00 O ATOM 677 CB ASN A 38 11.738 -12.038 5.598 1.00 0.00 C ATOM 678 CG ASN A 38 10.821 -12.697 6.619 1.00 0.00 C ATOM 679 OD1 ASN A 38 10.521 -13.875 6.542 1.00 0.00 O ATOM 680 ND2 ASN A 38 10.354 -11.958 7.604 1.00 0.00 N ATOM 0 H ASN A 38 12.879 -10.887 3.851 1.00 0.00 H new ATOM 0 HA ASN A 38 10.640 -12.622 3.800 1.00 0.00 H new ATOM 0 HB2 ASN A 38 12.582 -12.697 5.393 1.00 0.00 H new ATOM 0 HB3 ASN A 38 12.146 -11.119 6.019 1.00 0.00 H new ATOM 0 HD21 ASN A 38 9.739 -12.372 8.305 1.00 0.00 H new ATOM 0 HD22 ASN A 38 10.607 -10.972 7.666 1.00 0.00 H new ATOM 687 N TYR A 39 9.925 -9.526 4.463 1.00 0.00 N ATOM 688 CA TYR A 39 8.897 -8.518 4.700 1.00 0.00 C ATOM 689 C TYR A 39 8.661 -7.749 3.404 1.00 0.00 C ATOM 690 O TYR A 39 9.595 -7.533 2.638 1.00 0.00 O ATOM 691 CB TYR A 39 9.333 -7.539 5.811 1.00 0.00 C ATOM 692 CG TYR A 39 10.473 -7.998 6.703 1.00 0.00 C ATOM 693 CD1 TYR A 39 11.803 -7.786 6.285 1.00 0.00 C ATOM 694 CD2 TYR A 39 10.211 -8.651 7.924 1.00 0.00 C ATOM 695 CE1 TYR A 39 12.876 -8.247 7.070 1.00 0.00 C ATOM 696 CE2 TYR A 39 11.282 -9.098 8.720 1.00 0.00 C ATOM 697 CZ TYR A 39 12.615 -8.906 8.292 1.00 0.00 C ATOM 698 OH TYR A 39 13.637 -9.369 9.057 1.00 0.00 O ATOM 0 H TYR A 39 10.824 -9.111 4.218 1.00 0.00 H new ATOM 0 HA TYR A 39 7.980 -9.011 5.022 1.00 0.00 H new ATOM 0 HB2 TYR A 39 9.622 -6.598 5.343 1.00 0.00 H new ATOM 0 HB3 TYR A 39 8.469 -7.330 6.441 1.00 0.00 H new ATOM 0 HD1 TYR A 39 11.999 -7.267 5.358 1.00 0.00 H new ATOM 0 HD2 TYR A 39 9.193 -8.808 8.248 1.00 0.00 H new ATOM 0 HE1 TYR A 39 13.893 -8.098 6.740 1.00 0.00 H new ATOM 0 HE2 TYR A 39 11.084 -9.589 9.661 1.00 0.00 H new ATOM 0 HH TYR A 39 13.276 -9.794 9.863 1.00 0.00 H new ATOM 708 N ARG A 40 7.434 -7.265 3.202 1.00 0.00 N ATOM 709 CA ARG A 40 7.063 -6.414 2.070 1.00 0.00 C ATOM 710 C ARG A 40 6.470 -5.105 2.587 1.00 0.00 C ATOM 711 O ARG A 40 5.629 -5.142 3.485 1.00 0.00 O ATOM 712 CB ARG A 40 6.066 -7.149 1.164 1.00 0.00 C ATOM 713 CG ARG A 40 6.699 -8.130 0.164 1.00 0.00 C ATOM 714 CD ARG A 40 6.917 -9.526 0.764 1.00 0.00 C ATOM 715 NE ARG A 40 7.542 -10.434 -0.214 1.00 0.00 N ATOM 716 CZ ARG A 40 7.353 -11.746 -0.314 1.00 0.00 C ATOM 717 NH1 ARG A 40 6.707 -12.427 0.600 1.00 0.00 N ATOM 718 NH2 ARG A 40 7.798 -12.404 -1.358 1.00 0.00 N ATOM 0 H ARG A 40 6.656 -7.457 3.833 1.00 0.00 H new ATOM 0 HA ARG A 40 7.950 -6.184 1.480 1.00 0.00 H new ATOM 0 HB2 ARG A 40 5.363 -7.696 1.792 1.00 0.00 H new ATOM 0 HB3 ARG A 40 5.489 -6.409 0.609 1.00 0.00 H new ATOM 0 HG2 ARG A 40 6.058 -8.212 -0.714 1.00 0.00 H new ATOM 0 HG3 ARG A 40 7.655 -7.731 -0.175 1.00 0.00 H new ATOM 0 HD2 ARG A 40 7.549 -9.450 1.649 1.00 0.00 H new ATOM 0 HD3 ARG A 40 5.962 -9.939 1.089 1.00 0.00 H new ATOM 0 HE ARG A 40 8.186 -10.012 -0.883 1.00 0.00 H new ATOM 0 HH11 ARG A 40 6.331 -11.951 1.420 1.00 0.00 H new ATOM 0 HH12 ARG A 40 6.580 -13.433 0.492 1.00 0.00 H new ATOM 0 HH21 ARG A 40 8.293 -11.909 -2.100 1.00 0.00 H new ATOM 0 HH22 ARG A 40 7.649 -13.411 -1.428 1.00 0.00 H new ATOM 732 N VAL A 41 6.941 -3.981 2.041 1.00 0.00 N ATOM 733 CA VAL A 41 6.507 -2.601 2.326 1.00 0.00 C ATOM 734 C VAL A 41 5.242 -2.221 1.548 1.00 0.00 C ATOM 735 O VAL A 41 5.101 -2.593 0.382 1.00 0.00 O ATOM 736 CB VAL A 41 7.624 -1.598 1.957 1.00 0.00 C ATOM 737 CG1 VAL A 41 8.706 -1.550 3.040 1.00 0.00 C ATOM 738 CG2 VAL A 41 8.306 -1.901 0.613 1.00 0.00 C ATOM 0 H VAL A 41 7.684 -4.007 1.342 1.00 0.00 H new ATOM 0 HA VAL A 41 6.289 -2.556 3.393 1.00 0.00 H new ATOM 0 HB VAL A 41 7.119 -0.636 1.873 1.00 0.00 H new ATOM 0 HG11 VAL A 41 9.478 -0.836 2.752 1.00 0.00 H new ATOM 0 HG12 VAL A 41 8.261 -1.241 3.986 1.00 0.00 H new ATOM 0 HG13 VAL A 41 9.151 -2.539 3.154 1.00 0.00 H new ATOM 0 HG21 VAL A 41 9.078 -1.156 0.421 1.00 0.00 H new ATOM 0 HG22 VAL A 41 8.759 -2.892 0.650 1.00 0.00 H new ATOM 0 HG23 VAL A 41 7.565 -1.870 -0.186 1.00 0.00 H new ATOM 748 N TYR A 42 4.360 -1.433 2.178 1.00 0.00 N ATOM 749 CA TYR A 42 3.063 -1.022 1.632 1.00 0.00 C ATOM 750 C TYR A 42 2.613 0.369 2.077 1.00 0.00 C ATOM 751 O TYR A 42 2.920 0.816 3.186 1.00 0.00 O ATOM 752 CB TYR A 42 2.014 -2.015 2.124 1.00 0.00 C ATOM 753 CG TYR A 42 2.106 -3.334 1.412 1.00 0.00 C ATOM 754 CD1 TYR A 42 1.633 -3.395 0.098 1.00 0.00 C ATOM 755 CD2 TYR A 42 2.724 -4.453 2.003 1.00 0.00 C ATOM 756 CE1 TYR A 42 1.753 -4.584 -0.617 1.00 0.00 C ATOM 757 CE2 TYR A 42 2.827 -5.653 1.274 1.00 0.00 C ATOM 758 CZ TYR A 42 2.316 -5.734 -0.038 1.00 0.00 C ATOM 759 OH TYR A 42 2.361 -6.893 -0.751 1.00 0.00 O ATOM 0 H TYR A 42 4.536 -1.054 3.108 1.00 0.00 H new ATOM 0 HA TYR A 42 3.170 -0.999 0.547 1.00 0.00 H new ATOM 0 HB2 TYR A 42 2.139 -2.172 3.195 1.00 0.00 H new ATOM 0 HB3 TYR A 42 1.020 -1.593 1.978 1.00 0.00 H new ATOM 0 HD1 TYR A 42 1.179 -2.528 -0.358 1.00 0.00 H new ATOM 0 HD2 TYR A 42 3.116 -4.391 3.008 1.00 0.00 H new ATOM 0 HE1 TYR A 42 1.406 -4.623 -1.639 1.00 0.00 H new ATOM 0 HE2 TYR A 42 3.299 -6.515 1.721 1.00 0.00 H new ATOM 0 HH TYR A 42 1.800 -6.808 -1.550 1.00 0.00 H new ATOM 769 N SER A 43 1.795 1.006 1.234 1.00 0.00 N ATOM 770 CA SER A 43 1.119 2.265 1.541 1.00 0.00 C ATOM 771 C SER A 43 -0.239 2.057 2.230 1.00 0.00 C ATOM 772 O SER A 43 -0.816 0.966 2.248 1.00 0.00 O ATOM 773 CB SER A 43 0.909 3.053 0.244 1.00 0.00 C ATOM 774 OG SER A 43 -0.131 2.457 -0.495 1.00 0.00 O ATOM 0 H SER A 43 1.582 0.652 0.301 1.00 0.00 H new ATOM 0 HA SER A 43 1.755 2.815 2.234 1.00 0.00 H new ATOM 0 HB2 SER A 43 0.663 4.090 0.470 1.00 0.00 H new ATOM 0 HB3 SER A 43 1.828 3.064 -0.342 1.00 0.00 H new ATOM 0 HG SER A 43 -0.037 1.482 -0.464 1.00 0.00 H new ATOM 780 N ARG A 44 -0.787 3.159 2.757 1.00 0.00 N ATOM 781 CA ARG A 44 -2.141 3.213 3.314 1.00 0.00 C ATOM 782 C ARG A 44 -3.236 3.079 2.244 1.00 0.00 C ATOM 783 O ARG A 44 -4.300 2.545 2.547 1.00 0.00 O ATOM 784 CB ARG A 44 -2.308 4.528 4.094 1.00 0.00 C ATOM 785 CG ARG A 44 -3.176 4.382 5.355 1.00 0.00 C ATOM 786 CD ARG A 44 -2.367 3.811 6.537 1.00 0.00 C ATOM 787 NE ARG A 44 -2.901 4.237 7.848 1.00 0.00 N ATOM 788 CZ ARG A 44 -2.823 5.451 8.387 1.00 0.00 C ATOM 789 NH1 ARG A 44 -2.286 6.462 7.743 1.00 0.00 N ATOM 790 NH2 ARG A 44 -3.293 5.683 9.590 1.00 0.00 N ATOM 0 H ARG A 44 -0.294 4.050 2.808 1.00 0.00 H new ATOM 0 HA ARG A 44 -2.262 2.358 3.980 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -1.324 4.900 4.380 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -2.754 5.277 3.439 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -3.586 5.354 5.630 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -4.021 3.728 5.142 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -2.371 2.722 6.483 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -1.329 4.131 6.450 1.00 0.00 H new ATOM 0 HE ARG A 44 -3.380 3.524 8.398 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -1.914 6.328 6.803 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -2.241 7.381 8.183 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -3.724 4.928 10.123 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -3.227 6.618 9.992 1.00 0.00 H new ATOM 804 N GLU A 45 -2.993 3.542 1.010 1.00 0.00 N ATOM 805 CA GLU A 45 -3.967 3.470 -0.090 1.00 0.00 C ATOM 806 C GLU A 45 -4.135 2.042 -0.632 1.00 0.00 C ATOM 807 O GLU A 45 -5.269 1.641 -0.901 1.00 0.00 O ATOM 808 CB GLU A 45 -3.649 4.496 -1.196 1.00 0.00 C ATOM 809 CG GLU A 45 -2.239 4.408 -1.790 1.00 0.00 C ATOM 810 CD GLU A 45 -2.019 5.472 -2.873 1.00 0.00 C ATOM 811 OE1 GLU A 45 -2.500 5.252 -4.006 1.00 0.00 O ATOM 812 OE2 GLU A 45 -1.384 6.501 -2.544 1.00 0.00 O ATOM 0 H GLU A 45 -2.111 3.980 0.745 1.00 0.00 H new ATOM 0 HA GLU A 45 -4.938 3.745 0.322 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -4.373 4.372 -2.002 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.792 5.498 -0.791 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -1.501 4.535 -0.998 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -2.083 3.417 -2.215 1.00 0.00 H new ATOM 819 N GLU A 46 -3.063 1.231 -0.675 1.00 0.00 N ATOM 820 CA GLU A 46 -3.224 -0.221 -0.829 1.00 0.00 C ATOM 821 C GLU A 46 -4.103 -0.779 0.300 1.00 0.00 C ATOM 822 O GLU A 46 -5.082 -1.473 0.026 1.00 0.00 O ATOM 823 CB GLU A 46 -1.884 -0.982 -0.850 1.00 0.00 C ATOM 824 CG GLU A 46 -1.140 -0.984 -2.205 1.00 0.00 C ATOM 825 CD GLU A 46 0.039 -0.008 -2.305 1.00 0.00 C ATOM 826 OE1 GLU A 46 0.619 0.348 -1.244 1.00 0.00 O ATOM 827 OE2 GLU A 46 0.354 0.398 -3.440 1.00 0.00 O ATOM 0 H GLU A 46 -2.096 1.550 -0.607 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.701 -0.375 -1.797 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -1.228 -0.548 -0.096 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -2.068 -2.015 -0.555 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -0.774 -1.992 -2.398 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -1.854 -0.748 -2.994 1.00 0.00 H new ATOM 834 N VAL A 47 -3.772 -0.474 1.563 1.00 0.00 N ATOM 835 CA VAL A 47 -4.510 -0.975 2.733 1.00 0.00 C ATOM 836 C VAL A 47 -5.993 -0.587 2.727 1.00 0.00 C ATOM 837 O VAL A 47 -6.811 -1.444 3.049 1.00 0.00 O ATOM 838 CB VAL A 47 -3.807 -0.592 4.050 1.00 0.00 C ATOM 839 CG1 VAL A 47 -4.667 -0.864 5.296 1.00 0.00 C ATOM 840 CG2 VAL A 47 -2.530 -1.426 4.188 1.00 0.00 C ATOM 0 H VAL A 47 -2.984 0.128 1.803 1.00 0.00 H new ATOM 0 HA VAL A 47 -4.497 -2.063 2.662 1.00 0.00 H new ATOM 0 HB VAL A 47 -3.607 0.478 4.000 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -4.115 -0.573 6.190 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -5.589 -0.286 5.235 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -4.907 -1.926 5.348 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -2.023 -1.164 5.117 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -2.787 -2.485 4.201 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -1.870 -1.223 3.345 1.00 0.00 H new ATOM 850 N GLU A 48 -6.365 0.642 2.344 1.00 0.00 N ATOM 851 CA GLU A 48 -7.769 1.067 2.195 1.00 0.00 C ATOM 852 C GLU A 48 -8.541 0.100 1.282 1.00 0.00 C ATOM 853 O GLU A 48 -9.539 -0.499 1.700 1.00 0.00 O ATOM 854 CB GLU A 48 -7.825 2.508 1.653 1.00 0.00 C ATOM 855 CG GLU A 48 -9.242 3.118 1.672 1.00 0.00 C ATOM 856 CD GLU A 48 -9.629 3.689 3.041 1.00 0.00 C ATOM 857 OE1 GLU A 48 -9.244 4.842 3.317 1.00 0.00 O ATOM 858 OE2 GLU A 48 -10.297 2.990 3.845 1.00 0.00 O ATOM 0 H GLU A 48 -5.695 1.379 2.126 1.00 0.00 H new ATOM 0 HA GLU A 48 -8.249 1.046 3.174 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -7.160 3.136 2.245 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -7.447 2.518 0.631 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -9.301 3.909 0.924 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -9.965 2.354 1.386 1.00 0.00 H new ATOM 865 N ALA A 49 -8.039 -0.095 0.053 1.00 0.00 N ATOM 866 CA ALA A 49 -8.590 -1.048 -0.901 1.00 0.00 C ATOM 867 C ALA A 49 -8.607 -2.463 -0.313 1.00 0.00 C ATOM 868 O ALA A 49 -9.670 -3.069 -0.230 1.00 0.00 O ATOM 869 CB ALA A 49 -7.801 -0.975 -2.211 1.00 0.00 C ATOM 0 H ALA A 49 -7.230 0.414 -0.303 1.00 0.00 H new ATOM 0 HA ALA A 49 -9.626 -0.788 -1.116 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -8.214 -1.688 -2.924 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -7.871 0.032 -2.622 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -6.755 -1.217 -2.020 1.00 0.00 H new ATOM 875 N VAL A 50 -7.460 -2.985 0.136 1.00 0.00 N ATOM 876 CA VAL A 50 -7.297 -4.342 0.689 1.00 0.00 C ATOM 877 C VAL A 50 -8.247 -4.620 1.858 1.00 0.00 C ATOM 878 O VAL A 50 -8.789 -5.721 1.957 1.00 0.00 O ATOM 879 CB VAL A 50 -5.836 -4.543 1.128 1.00 0.00 C ATOM 880 CG1 VAL A 50 -5.600 -5.821 1.940 1.00 0.00 C ATOM 881 CG2 VAL A 50 -4.892 -4.593 -0.070 1.00 0.00 C ATOM 0 H VAL A 50 -6.586 -2.459 0.126 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.552 -5.052 -0.097 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.629 -3.680 1.761 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -4.547 -5.890 2.211 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -6.207 -5.794 2.845 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.878 -6.689 1.342 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.869 -4.736 0.278 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.173 -5.421 -0.720 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.959 -3.657 -0.625 1.00 0.00 H new ATOM 891 N ARG A 51 -8.448 -3.649 2.759 1.00 0.00 N ATOM 892 CA ARG A 51 -9.404 -3.727 3.869 1.00 0.00 C ATOM 893 C ARG A 51 -10.839 -3.859 3.351 1.00 0.00 C ATOM 894 O ARG A 51 -11.551 -4.751 3.816 1.00 0.00 O ATOM 895 CB ARG A 51 -9.191 -2.530 4.815 1.00 0.00 C ATOM 896 CG ARG A 51 -10.036 -2.611 6.103 1.00 0.00 C ATOM 897 CD ARG A 51 -11.062 -1.474 6.216 1.00 0.00 C ATOM 898 NE ARG A 51 -10.413 -0.191 6.564 1.00 0.00 N ATOM 899 CZ ARG A 51 -10.660 1.005 6.039 1.00 0.00 C ATOM 900 NH1 ARG A 51 -11.690 1.244 5.265 1.00 0.00 N ATOM 901 NH2 ARG A 51 -9.843 2.013 6.233 1.00 0.00 N ATOM 0 H ARG A 51 -7.937 -2.766 2.735 1.00 0.00 H new ATOM 0 HA ARG A 51 -9.225 -4.630 4.453 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -8.136 -2.472 5.084 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -9.436 -1.609 4.285 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -10.557 -3.568 6.130 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -9.374 -2.584 6.968 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -11.595 -1.369 5.271 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -11.803 -1.725 6.974 1.00 0.00 H new ATOM 0 HE ARG A 51 -9.695 -0.228 7.288 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -12.345 0.495 5.042 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -11.837 2.179 4.886 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -9.001 1.886 6.795 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -10.050 2.923 5.822 1.00 0.00 H new ATOM 915 N ARG A 52 -11.246 -3.044 2.363 1.00 0.00 N ATOM 916 CA ARG A 52 -12.520 -3.234 1.646 1.00 0.00 C ATOM 917 C ARG A 52 -12.603 -4.606 0.977 1.00 0.00 C ATOM 918 O ARG A 52 -13.560 -5.328 1.240 1.00 0.00 O ATOM 919 CB ARG A 52 -12.778 -2.115 0.619 1.00 0.00 C ATOM 920 CG ARG A 52 -13.770 -1.080 1.167 1.00 0.00 C ATOM 921 CD ARG A 52 -14.253 -0.118 0.073 1.00 0.00 C ATOM 922 NE ARG A 52 -15.428 -0.646 -0.653 1.00 0.00 N ATOM 923 CZ ARG A 52 -16.243 0.049 -1.442 1.00 0.00 C ATOM 924 NH1 ARG A 52 -15.995 1.300 -1.756 1.00 0.00 N ATOM 925 NH2 ARG A 52 -17.334 -0.498 -1.924 1.00 0.00 N ATOM 0 H ARG A 52 -10.706 -2.241 2.040 1.00 0.00 H new ATOM 0 HA ARG A 52 -13.305 -3.182 2.401 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -11.838 -1.624 0.367 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -13.169 -2.546 -0.302 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -14.627 -1.593 1.604 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -13.297 -0.512 1.968 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -14.506 0.843 0.522 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -13.443 0.064 -0.633 1.00 0.00 H new ATOM 0 HE ARG A 52 -15.633 -1.638 -0.538 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -15.161 1.761 -1.393 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -16.636 1.810 -2.363 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -17.564 -1.465 -1.695 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -17.952 0.044 -2.528 1.00 0.00 H new ATOM 939 N VAL A 53 -11.618 -4.967 0.147 1.00 0.00 N ATOM 940 CA VAL A 53 -11.546 -6.236 -0.590 1.00 0.00 C ATOM 941 C VAL A 53 -11.727 -7.423 0.358 1.00 0.00 C ATOM 942 O VAL A 53 -12.638 -8.218 0.148 1.00 0.00 O ATOM 943 CB VAL A 53 -10.255 -6.334 -1.443 1.00 0.00 C ATOM 944 CG1 VAL A 53 -10.137 -7.711 -2.103 1.00 0.00 C ATOM 945 CG2 VAL A 53 -10.206 -5.257 -2.542 1.00 0.00 C ATOM 0 H VAL A 53 -10.818 -4.361 -0.038 1.00 0.00 H new ATOM 0 HA VAL A 53 -12.373 -6.267 -1.300 1.00 0.00 H new ATOM 0 HB VAL A 53 -9.422 -6.177 -0.758 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -9.223 -7.753 -2.695 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -10.107 -8.482 -1.333 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -10.997 -7.879 -2.751 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -9.285 -5.363 -3.115 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -11.062 -5.376 -3.206 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -10.237 -4.268 -2.084 1.00 0.00 H new ATOM 955 N ALA A 54 -10.930 -7.525 1.430 1.00 0.00 N ATOM 956 CA ALA A 54 -11.052 -8.591 2.428 1.00 0.00 C ATOM 957 C ALA A 54 -12.424 -8.633 3.127 1.00 0.00 C ATOM 958 O ALA A 54 -12.941 -9.721 3.388 1.00 0.00 O ATOM 959 CB ALA A 54 -9.942 -8.417 3.461 1.00 0.00 C ATOM 0 H ALA A 54 -10.178 -6.865 1.629 1.00 0.00 H new ATOM 0 HA ALA A 54 -10.958 -9.542 1.903 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -10.018 -9.203 4.212 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -8.972 -8.479 2.967 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -10.042 -7.444 3.942 1.00 0.00 H new ATOM 965 N ARG A 55 -13.027 -7.473 3.431 1.00 0.00 N ATOM 966 CA ARG A 55 -14.362 -7.418 4.041 1.00 0.00 C ATOM 967 C ARG A 55 -15.460 -7.841 3.054 1.00 0.00 C ATOM 968 O ARG A 55 -16.313 -8.638 3.421 1.00 0.00 O ATOM 969 CB ARG A 55 -14.606 -6.028 4.648 1.00 0.00 C ATOM 970 CG ARG A 55 -15.832 -6.044 5.575 1.00 0.00 C ATOM 971 CD ARG A 55 -16.128 -4.662 6.168 1.00 0.00 C ATOM 972 NE ARG A 55 -15.233 -4.320 7.292 1.00 0.00 N ATOM 973 CZ ARG A 55 -15.124 -3.134 7.881 1.00 0.00 C ATOM 974 NH1 ARG A 55 -15.740 -2.072 7.412 1.00 0.00 N ATOM 975 NH2 ARG A 55 -14.396 -2.990 8.964 1.00 0.00 N ATOM 0 H ARG A 55 -12.608 -6.558 3.263 1.00 0.00 H new ATOM 0 HA ARG A 55 -14.405 -8.143 4.853 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.726 -5.711 5.207 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -14.757 -5.300 3.851 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -16.702 -6.392 5.018 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -15.665 -6.756 6.383 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -16.029 -3.908 5.388 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -17.162 -4.632 6.511 1.00 0.00 H new ATOM 0 HE ARG A 55 -14.640 -5.068 7.652 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -16.319 -2.146 6.576 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -15.639 -1.174 7.884 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -13.908 -3.793 9.361 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -14.319 -2.075 9.409 1.00 0.00 H new ATOM 989 N LEU A 56 -15.405 -7.375 1.803 1.00 0.00 N ATOM 990 CA LEU A 56 -16.273 -7.835 0.710 1.00 0.00 C ATOM 991 C LEU A 56 -16.086 -9.336 0.413 1.00 0.00 C ATOM 992 O LEU A 56 -17.053 -10.044 0.147 1.00 0.00 O ATOM 993 CB LEU A 56 -16.007 -6.962 -0.533 1.00 0.00 C ATOM 994 CG LEU A 56 -16.971 -5.761 -0.622 1.00 0.00 C ATOM 995 CD1 LEU A 56 -16.306 -4.542 -1.272 1.00 0.00 C ATOM 996 CD2 LEU A 56 -18.201 -6.134 -1.456 1.00 0.00 C ATOM 0 H LEU A 56 -14.744 -6.654 1.514 1.00 0.00 H new ATOM 0 HA LEU A 56 -17.315 -7.724 1.010 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.980 -6.599 -0.506 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -16.106 -7.572 -1.431 1.00 0.00 H new ATOM 0 HG LEU A 56 -17.258 -5.507 0.398 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -17.019 -3.719 -1.315 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -15.440 -4.242 -0.682 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -15.985 -4.798 -2.282 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -18.875 -5.279 -1.513 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -17.887 -6.416 -2.461 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -18.717 -6.973 -0.988 1.00 0.00 H new ATOM 1008 N ILE A 57 -14.860 -9.858 0.518 1.00 0.00 N ATOM 1009 CA ILE A 57 -14.564 -11.295 0.426 1.00 0.00 C ATOM 1010 C ILE A 57 -15.297 -12.111 1.489 1.00 0.00 C ATOM 1011 O ILE A 57 -15.754 -13.207 1.176 1.00 0.00 O ATOM 1012 CB ILE A 57 -13.039 -11.518 0.470 1.00 0.00 C ATOM 1013 CG1 ILE A 57 -12.499 -11.218 -0.937 1.00 0.00 C ATOM 1014 CG2 ILE A 57 -12.598 -12.913 0.959 1.00 0.00 C ATOM 1015 CD1 ILE A 57 -11.001 -10.964 -0.925 1.00 0.00 C ATOM 0 H ILE A 57 -14.030 -9.286 0.672 1.00 0.00 H new ATOM 0 HA ILE A 57 -14.938 -11.658 -0.531 1.00 0.00 H new ATOM 0 HB ILE A 57 -12.620 -10.845 1.218 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -12.720 -12.057 -1.597 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -13.012 -10.347 -1.345 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -11.510 -12.973 0.955 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -12.967 -13.077 1.972 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -13.006 -13.676 0.297 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -10.659 -10.756 -1.939 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -10.782 -10.109 -0.286 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -10.486 -11.845 -0.542 1.00 0.00 H new ATOM 1027 N GLN A 58 -15.471 -11.587 2.710 1.00 0.00 N ATOM 1028 CA GLN A 58 -16.276 -12.262 3.734 1.00 0.00 C ATOM 1029 C GLN A 58 -17.749 -12.468 3.325 1.00 0.00 C ATOM 1030 O GLN A 58 -18.416 -13.302 3.931 1.00 0.00 O ATOM 1031 CB GLN A 58 -16.167 -11.527 5.091 1.00 0.00 C ATOM 1032 CG GLN A 58 -15.241 -12.225 6.099 1.00 0.00 C ATOM 1033 CD GLN A 58 -15.707 -13.634 6.460 1.00 0.00 C ATOM 1034 OE1 GLN A 58 -16.662 -13.830 7.194 1.00 0.00 O ATOM 1035 NE2 GLN A 58 -15.038 -14.664 5.978 1.00 0.00 N ATOM 0 H GLN A 58 -15.066 -10.701 3.011 1.00 0.00 H new ATOM 0 HA GLN A 58 -15.857 -13.262 3.841 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -15.803 -10.514 4.917 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -17.162 -11.438 5.527 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -14.234 -12.276 5.684 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -15.182 -11.624 7.006 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -14.238 -14.510 5.364 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -15.320 -15.614 6.220 1.00 0.00 H new ATOM 1044 N GLU A 59 -18.252 -11.773 2.295 1.00 0.00 N ATOM 1045 CA GLU A 59 -19.612 -11.965 1.777 1.00 0.00 C ATOM 1046 C GLU A 59 -19.713 -13.110 0.751 1.00 0.00 C ATOM 1047 O GLU A 59 -20.774 -13.718 0.631 1.00 0.00 O ATOM 1048 CB GLU A 59 -20.138 -10.658 1.154 1.00 0.00 C ATOM 1049 CG GLU A 59 -19.985 -9.448 2.094 1.00 0.00 C ATOM 1050 CD GLU A 59 -20.685 -8.200 1.550 1.00 0.00 C ATOM 1051 OE1 GLU A 59 -21.936 -8.176 1.587 1.00 0.00 O ATOM 1052 OE2 GLU A 59 -19.962 -7.267 1.131 1.00 0.00 O ATOM 0 H GLU A 59 -17.723 -11.058 1.796 1.00 0.00 H new ATOM 0 HA GLU A 59 -20.230 -12.246 2.630 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -19.602 -10.462 0.225 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -21.190 -10.781 0.895 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -20.397 -9.696 3.072 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -18.926 -9.234 2.239 1.00 0.00 H new ATOM 1059 N GLU A 60 -18.627 -13.425 0.028 1.00 0.00 N ATOM 1060 CA GLU A 60 -18.580 -14.516 -0.961 1.00 0.00 C ATOM 1061 C GLU A 60 -17.145 -14.986 -1.233 1.00 0.00 C ATOM 1062 O GLU A 60 -16.842 -16.170 -1.103 1.00 0.00 O ATOM 1063 CB GLU A 60 -19.255 -14.075 -2.279 1.00 0.00 C ATOM 1064 CG GLU A 60 -19.123 -15.131 -3.392 1.00 0.00 C ATOM 1065 CD GLU A 60 -19.991 -14.813 -4.613 1.00 0.00 C ATOM 1066 OE1 GLU A 60 -19.880 -13.670 -5.110 1.00 0.00 O ATOM 1067 OE2 GLU A 60 -20.725 -15.724 -5.054 1.00 0.00 O ATOM 0 H GLU A 60 -17.744 -12.922 0.114 1.00 0.00 H new ATOM 0 HA GLU A 60 -19.127 -15.360 -0.540 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -20.311 -13.877 -2.094 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -18.809 -13.139 -2.616 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -18.080 -15.199 -3.701 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -19.403 -16.107 -2.996 1.00 0.00 H new ATOM 1074 N GLY A 61 -16.283 -14.062 -1.670 1.00 0.00 N ATOM 1075 CA GLY A 61 -14.899 -14.332 -2.060 1.00 0.00 C ATOM 1076 C GLY A 61 -14.593 -14.011 -3.522 1.00 0.00 C ATOM 1077 O GLY A 61 -13.428 -13.803 -3.850 1.00 0.00 O ATOM 0 H GLY A 61 -16.538 -13.079 -1.764 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -14.233 -13.750 -1.423 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -14.679 -15.383 -1.875 1.00 0.00 H new ATOM 1081 N LEU A 62 -15.614 -13.861 -4.379 1.00 0.00 N ATOM 1082 CA LEU A 62 -15.505 -13.327 -5.745 1.00 0.00 C ATOM 1083 C LEU A 62 -14.689 -12.026 -5.783 1.00 0.00 C ATOM 1084 O LEU A 62 -13.838 -11.857 -6.659 1.00 0.00 O ATOM 1085 CB LEU A 62 -16.933 -13.149 -6.299 1.00 0.00 C ATOM 1086 CG LEU A 62 -17.091 -12.249 -7.541 1.00 0.00 C ATOM 1087 CD1 LEU A 62 -16.319 -12.752 -8.767 1.00 0.00 C ATOM 1088 CD2 LEU A 62 -18.568 -12.138 -7.920 1.00 0.00 C ATOM 0 H LEU A 62 -16.570 -14.117 -4.132 1.00 0.00 H new ATOM 0 HA LEU A 62 -14.959 -14.025 -6.380 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -17.328 -14.135 -6.542 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -17.558 -12.742 -5.504 1.00 0.00 H new ATOM 0 HG LEU A 62 -16.675 -11.281 -7.262 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -16.477 -12.069 -9.602 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -15.255 -12.799 -8.533 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -16.675 -13.746 -9.039 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -18.671 -11.501 -8.798 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -18.962 -13.130 -8.143 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -19.125 -11.704 -7.089 1.00 0.00 H new ATOM 1100 N SER A 63 -14.879 -11.154 -4.783 1.00 0.00 N ATOM 1101 CA SER A 63 -14.106 -9.927 -4.585 1.00 0.00 C ATOM 1102 C SER A 63 -12.590 -10.117 -4.500 1.00 0.00 C ATOM 1103 O SER A 63 -11.888 -9.133 -4.704 1.00 0.00 O ATOM 1104 CB SER A 63 -14.642 -9.126 -3.398 1.00 0.00 C ATOM 1105 OG SER A 63 -15.832 -8.495 -3.823 1.00 0.00 O ATOM 0 H SER A 63 -15.596 -11.290 -4.071 1.00 0.00 H new ATOM 0 HA SER A 63 -14.253 -9.352 -5.499 1.00 0.00 H new ATOM 0 HB2 SER A 63 -14.836 -9.781 -2.548 1.00 0.00 H new ATOM 0 HB3 SER A 63 -13.911 -8.387 -3.071 1.00 0.00 H new ATOM 0 HG SER A 63 -15.798 -7.543 -3.593 1.00 0.00 H new ATOM 1111 N VAL A 64 -12.067 -11.343 -4.329 1.00 0.00 N ATOM 1112 CA VAL A 64 -10.669 -11.656 -4.649 1.00 0.00 C ATOM 1113 C VAL A 64 -10.342 -11.194 -6.067 1.00 0.00 C ATOM 1114 O VAL A 64 -9.495 -10.331 -6.227 1.00 0.00 O ATOM 1115 CB VAL A 64 -10.340 -13.154 -4.450 1.00 0.00 C ATOM 1116 CG1 VAL A 64 -9.025 -13.534 -5.138 1.00 0.00 C ATOM 1117 CG2 VAL A 64 -10.205 -13.518 -2.969 1.00 0.00 C ATOM 0 H VAL A 64 -12.598 -12.136 -3.969 1.00 0.00 H new ATOM 0 HA VAL A 64 -10.036 -11.111 -3.948 1.00 0.00 H new ATOM 0 HB VAL A 64 -11.172 -13.702 -4.892 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -8.824 -14.593 -4.978 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -9.103 -13.337 -6.207 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.211 -12.943 -4.719 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -9.974 -14.579 -2.875 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -9.403 -12.931 -2.522 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -11.142 -13.304 -2.455 1.00 0.00 H new ATOM 1127 N SER A 65 -10.980 -11.754 -7.099 1.00 0.00 N ATOM 1128 CA SER A 65 -10.703 -11.327 -8.473 1.00 0.00 C ATOM 1129 C SER A 65 -11.424 -10.014 -8.790 1.00 0.00 C ATOM 1130 O SER A 65 -10.823 -9.099 -9.350 1.00 0.00 O ATOM 1131 CB SER A 65 -11.090 -12.432 -9.459 1.00 0.00 C ATOM 1132 OG SER A 65 -10.394 -12.241 -10.672 1.00 0.00 O ATOM 0 H SER A 65 -11.680 -12.491 -7.013 1.00 0.00 H new ATOM 0 HA SER A 65 -9.633 -11.144 -8.574 1.00 0.00 H new ATOM 0 HB2 SER A 65 -10.851 -13.409 -9.040 1.00 0.00 H new ATOM 0 HB3 SER A 65 -12.165 -12.416 -9.637 1.00 0.00 H new ATOM 0 HG SER A 65 -10.639 -12.948 -11.305 1.00 0.00 H new ATOM 1138 N GLU A 66 -12.697 -9.897 -8.388 1.00 0.00 N ATOM 1139 CA GLU A 66 -13.571 -8.787 -8.765 1.00 0.00 C ATOM 1140 C GLU A 66 -13.100 -7.447 -8.195 1.00 0.00 C ATOM 1141 O GLU A 66 -12.927 -6.501 -8.956 1.00 0.00 O ATOM 1142 CB GLU A 66 -15.013 -9.083 -8.327 1.00 0.00 C ATOM 1143 CG GLU A 66 -16.053 -8.266 -9.102 1.00 0.00 C ATOM 1144 CD GLU A 66 -16.531 -9.009 -10.351 1.00 0.00 C ATOM 1145 OE1 GLU A 66 -15.661 -9.323 -11.193 1.00 0.00 O ATOM 1146 OE2 GLU A 66 -17.753 -9.256 -10.440 1.00 0.00 O ATOM 0 H GLU A 66 -13.151 -10.582 -7.784 1.00 0.00 H new ATOM 0 HA GLU A 66 -13.531 -8.697 -9.851 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -15.218 -10.145 -8.463 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.114 -8.873 -7.262 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -16.905 -8.052 -8.456 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.623 -7.307 -9.390 1.00 0.00 H new ATOM 1153 N ALA A 67 -12.880 -7.335 -6.876 1.00 0.00 N ATOM 1154 CA ALA A 67 -12.515 -6.055 -6.275 1.00 0.00 C ATOM 1155 C ALA A 67 -11.062 -5.657 -6.600 1.00 0.00 C ATOM 1156 O ALA A 67 -10.757 -4.466 -6.669 1.00 0.00 O ATOM 1157 CB ALA A 67 -12.807 -6.062 -4.775 1.00 0.00 C ATOM 0 H ALA A 67 -12.949 -8.110 -6.216 1.00 0.00 H new ATOM 0 HA ALA A 67 -13.139 -5.281 -6.722 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -12.528 -5.100 -4.346 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -13.870 -6.238 -4.612 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -12.231 -6.854 -4.296 1.00 0.00 H new ATOM 1163 N ILE A 68 -10.186 -6.637 -6.885 1.00 0.00 N ATOM 1164 CA ILE A 68 -8.877 -6.391 -7.506 1.00 0.00 C ATOM 1165 C ILE A 68 -9.068 -5.823 -8.916 1.00 0.00 C ATOM 1166 O ILE A 68 -8.533 -4.756 -9.209 1.00 0.00 O ATOM 1167 CB ILE A 68 -7.974 -7.649 -7.476 1.00 0.00 C ATOM 1168 CG1 ILE A 68 -7.603 -7.938 -6.004 1.00 0.00 C ATOM 1169 CG2 ILE A 68 -6.696 -7.433 -8.315 1.00 0.00 C ATOM 1170 CD1 ILE A 68 -6.715 -9.170 -5.764 1.00 0.00 C ATOM 0 H ILE A 68 -10.368 -7.622 -6.690 1.00 0.00 H new ATOM 0 HA ILE A 68 -8.346 -5.643 -6.918 1.00 0.00 H new ATOM 0 HB ILE A 68 -8.510 -8.495 -7.907 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -7.094 -7.063 -5.599 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -8.524 -8.062 -5.435 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -6.080 -8.331 -8.277 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -6.971 -7.225 -9.349 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -6.134 -6.590 -7.912 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -6.519 -9.275 -4.697 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -7.224 -10.062 -6.129 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -5.771 -9.048 -6.296 1.00 0.00 H new ATOM 1182 N ALA A 69 -9.833 -6.490 -9.790 1.00 0.00 N ATOM 1183 CA ALA A 69 -10.126 -5.990 -11.132 1.00 0.00 C ATOM 1184 C ALA A 69 -10.754 -4.585 -11.102 1.00 0.00 C ATOM 1185 O ALA A 69 -10.299 -3.717 -11.842 1.00 0.00 O ATOM 1186 CB ALA A 69 -10.998 -7.005 -11.879 1.00 0.00 C ATOM 0 H ALA A 69 -10.264 -7.391 -9.583 1.00 0.00 H new ATOM 0 HA ALA A 69 -9.188 -5.879 -11.676 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -11.216 -6.631 -12.879 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -10.468 -7.955 -11.954 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -11.931 -7.152 -11.336 1.00 0.00 H new ATOM 1192 N GLN A 70 -11.720 -4.342 -10.203 1.00 0.00 N ATOM 1193 CA GLN A 70 -12.296 -3.028 -9.894 1.00 0.00 C ATOM 1194 C GLN A 70 -11.204 -2.009 -9.552 1.00 0.00 C ATOM 1195 O GLN A 70 -10.987 -1.094 -10.341 1.00 0.00 O ATOM 1196 CB GLN A 70 -13.339 -3.133 -8.773 1.00 0.00 C ATOM 1197 CG GLN A 70 -14.661 -3.764 -9.238 1.00 0.00 C ATOM 1198 CD GLN A 70 -15.592 -4.114 -8.075 1.00 0.00 C ATOM 1199 OE1 GLN A 70 -15.536 -3.564 -6.985 1.00 0.00 O ATOM 1200 NE2 GLN A 70 -16.494 -5.057 -8.260 1.00 0.00 N ATOM 0 H GLN A 70 -12.138 -5.089 -9.649 1.00 0.00 H new ATOM 0 HA GLN A 70 -12.807 -2.669 -10.787 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -12.928 -3.726 -7.956 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -13.538 -2.138 -8.376 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -15.171 -3.074 -9.911 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -14.446 -4.667 -9.810 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -16.560 -5.530 -9.161 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -17.126 -5.314 -7.502 1.00 0.00 H new ATOM 1209 N VAL A 71 -10.464 -2.179 -8.444 1.00 0.00 N ATOM 1210 CA VAL A 71 -9.445 -1.195 -8.036 1.00 0.00 C ATOM 1211 C VAL A 71 -8.296 -1.047 -9.053 1.00 0.00 C ATOM 1212 O VAL A 71 -7.653 -0.003 -9.090 1.00 0.00 O ATOM 1213 CB VAL A 71 -8.942 -1.474 -6.604 1.00 0.00 C ATOM 1214 CG1 VAL A 71 -7.880 -2.575 -6.532 1.00 0.00 C ATOM 1215 CG2 VAL A 71 -8.389 -0.204 -5.947 1.00 0.00 C ATOM 0 H VAL A 71 -10.550 -2.981 -7.819 1.00 0.00 H new ATOM 0 HA VAL A 71 -9.936 -0.222 -8.025 1.00 0.00 H new ATOM 0 HB VAL A 71 -9.819 -1.824 -6.059 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -7.573 -2.717 -5.496 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -8.294 -3.506 -6.919 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -7.016 -2.286 -7.130 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -8.044 -0.436 -4.940 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -7.556 0.178 -6.537 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -9.174 0.551 -5.896 1.00 0.00 H new ATOM 1225 N LYS A 72 -8.052 -2.052 -9.913 1.00 0.00 N ATOM 1226 CA LYS A 72 -7.140 -1.950 -11.062 1.00 0.00 C ATOM 1227 C LYS A 72 -7.722 -1.167 -12.250 1.00 0.00 C ATOM 1228 O LYS A 72 -6.951 -0.504 -12.939 1.00 0.00 O ATOM 1229 CB LYS A 72 -6.702 -3.347 -11.535 1.00 0.00 C ATOM 1230 CG LYS A 72 -5.732 -4.059 -10.565 1.00 0.00 C ATOM 1231 CD LYS A 72 -4.404 -4.444 -11.235 1.00 0.00 C ATOM 1232 CE LYS A 72 -4.605 -5.465 -12.368 1.00 0.00 C ATOM 1233 NZ LYS A 72 -4.177 -6.834 -11.985 1.00 0.00 N ATOM 0 H LYS A 72 -8.490 -2.969 -9.827 1.00 0.00 H new ATOM 0 HA LYS A 72 -6.280 -1.386 -10.702 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.587 -3.969 -11.670 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -6.224 -3.257 -12.510 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -5.530 -3.407 -9.715 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -6.210 -4.956 -10.172 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -3.926 -3.549 -11.634 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -3.728 -4.860 -10.488 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -5.657 -5.484 -12.653 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -4.043 -5.144 -13.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -4.333 -7.483 -12.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -3.167 -6.826 -11.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -4.731 -7.154 -11.165 1.00 0.00 H new ATOM 1247 N THR A 73 -9.030 -1.263 -12.534 1.00 0.00 N ATOM 1248 CA THR A 73 -9.675 -0.484 -13.611 1.00 0.00 C ATOM 1249 C THR A 73 -10.061 0.935 -13.167 1.00 0.00 C ATOM 1250 O THR A 73 -10.047 1.858 -13.979 1.00 0.00 O ATOM 1251 CB THR A 73 -10.865 -1.242 -14.245 1.00 0.00 C ATOM 1252 OG1 THR A 73 -11.226 -0.631 -15.462 1.00 0.00 O ATOM 1253 CG2 THR A 73 -12.145 -1.346 -13.409 1.00 0.00 C ATOM 0 H THR A 73 -9.669 -1.877 -12.030 1.00 0.00 H new ATOM 0 HA THR A 73 -8.925 -0.364 -14.392 1.00 0.00 H new ATOM 0 HB THR A 73 -10.483 -2.257 -14.354 1.00 0.00 H new ATOM 0 HG1 THR A 73 -11.979 -1.115 -15.861 1.00 0.00 H new ATOM 0 HG21 THR A 73 -12.900 -1.900 -13.967 1.00 0.00 H new ATOM 0 HG22 THR A 73 -11.929 -1.866 -12.476 1.00 0.00 H new ATOM 0 HG23 THR A 73 -12.518 -0.346 -13.189 1.00 0.00 H new ATOM 1261 N GLU A 74 -10.355 1.128 -11.877 1.00 0.00 N ATOM 1262 CA GLU A 74 -10.580 2.434 -11.257 1.00 0.00 C ATOM 1263 C GLU A 74 -9.287 3.270 -11.186 1.00 0.00 C ATOM 1264 O GLU A 74 -8.185 2.720 -11.120 1.00 0.00 O ATOM 1265 CB GLU A 74 -11.154 2.232 -9.843 1.00 0.00 C ATOM 1266 CG GLU A 74 -12.635 1.830 -9.881 1.00 0.00 C ATOM 1267 CD GLU A 74 -13.162 1.543 -8.474 1.00 0.00 C ATOM 1268 OE1 GLU A 74 -13.454 2.525 -7.755 1.00 0.00 O ATOM 1269 OE2 GLU A 74 -13.268 0.345 -8.127 1.00 0.00 O ATOM 0 H GLU A 74 -10.445 0.355 -11.217 1.00 0.00 H new ATOM 0 HA GLU A 74 -11.289 2.985 -11.876 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -10.582 1.462 -9.325 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -11.042 3.153 -9.270 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -13.221 2.629 -10.337 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -12.760 0.946 -10.507 1.00 0.00 H new ATOM 1276 N PRO A 75 -9.393 4.613 -11.160 1.00 0.00 N ATOM 1277 CA PRO A 75 -8.237 5.486 -10.994 1.00 0.00 C ATOM 1278 C PRO A 75 -7.718 5.432 -9.540 1.00 0.00 C ATOM 1279 O PRO A 75 -8.519 5.563 -8.610 1.00 0.00 O ATOM 1280 CB PRO A 75 -8.739 6.881 -11.377 1.00 0.00 C ATOM 1281 CG PRO A 75 -10.228 6.847 -11.031 1.00 0.00 C ATOM 1282 CD PRO A 75 -10.619 5.390 -11.282 1.00 0.00 C ATOM 0 HA PRO A 75 -7.393 5.188 -11.615 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -8.218 7.660 -10.820 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -8.580 7.086 -12.436 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -10.406 7.138 -9.996 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -10.801 7.530 -11.657 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -11.364 5.057 -10.560 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -11.059 5.270 -12.272 1.00 0.00 H new ATOM 1290 N PRO A 76 -6.398 5.294 -9.302 1.00 0.00 N ATOM 1291 CA PRO A 76 -5.808 5.320 -7.960 1.00 0.00 C ATOM 1292 C PRO A 76 -5.793 6.751 -7.385 1.00 0.00 C ATOM 1293 O PRO A 76 -4.754 7.410 -7.296 1.00 0.00 O ATOM 1294 CB PRO A 76 -4.419 4.691 -8.121 1.00 0.00 C ATOM 1295 CG PRO A 76 -4.032 5.066 -9.550 1.00 0.00 C ATOM 1296 CD PRO A 76 -5.367 5.021 -10.295 1.00 0.00 C ATOM 0 HA PRO A 76 -6.387 4.756 -7.229 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -3.710 5.088 -7.394 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -4.447 3.610 -7.981 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -3.577 6.055 -9.598 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -3.312 4.363 -9.970 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -5.391 5.761 -11.095 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -5.521 4.046 -10.758 1.00 0.00 H new ATOM 1304 N ARG A 77 -6.982 7.245 -7.023 1.00 0.00 N ATOM 1305 CA ARG A 77 -7.217 8.549 -6.400 1.00 0.00 C ATOM 1306 C ARG A 77 -8.535 8.517 -5.618 1.00 0.00 C ATOM 1307 O ARG A 77 -9.588 8.301 -6.212 1.00 0.00 O ATOM 1308 CB ARG A 77 -7.239 9.640 -7.493 1.00 0.00 C ATOM 1309 CG ARG A 77 -6.621 10.968 -7.034 1.00 0.00 C ATOM 1310 CD ARG A 77 -5.095 10.854 -6.905 1.00 0.00 C ATOM 1311 NE ARG A 77 -4.461 12.181 -6.806 1.00 0.00 N ATOM 1312 CZ ARG A 77 -3.164 12.426 -6.668 1.00 0.00 C ATOM 1313 NH1 ARG A 77 -2.292 11.455 -6.524 1.00 0.00 N ATOM 1314 NH2 ARG A 77 -2.722 13.662 -6.676 1.00 0.00 N ATOM 0 H ARG A 77 -7.846 6.721 -7.164 1.00 0.00 H new ATOM 0 HA ARG A 77 -6.415 8.780 -5.699 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -6.699 9.279 -8.369 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -8.269 9.814 -7.803 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -6.871 11.754 -7.747 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -7.049 11.259 -6.075 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -4.846 10.264 -6.023 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -4.695 10.322 -7.768 1.00 0.00 H new ATOM 0 HE ARG A 77 -5.080 12.991 -6.848 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -2.606 10.485 -6.516 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -1.301 11.671 -6.420 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -3.376 14.437 -6.788 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -1.725 13.848 -6.570 1.00 0.00 H new ATOM 1328 N GLU A 78 -8.460 8.698 -4.298 1.00 0.00 N ATOM 1329 CA GLU A 78 -9.618 8.947 -3.425 1.00 0.00 C ATOM 1330 C GLU A 78 -10.064 10.414 -3.529 1.00 0.00 C ATOM 1331 O GLU A 78 -9.168 11.293 -3.519 1.00 0.00 O ATOM 1332 CB GLU A 78 -9.263 8.517 -1.987 1.00 0.00 C ATOM 1333 CG GLU A 78 -10.473 8.280 -1.058 1.00 0.00 C ATOM 1334 CD GLU A 78 -10.780 9.421 -0.069 1.00 0.00 C ATOM 1335 OE1 GLU A 78 -9.826 9.917 0.577 1.00 0.00 O ATOM 1336 OE2 GLU A 78 -11.984 9.721 0.113 1.00 0.00 O ATOM 1337 OXT GLU A 78 -11.285 10.623 -3.688 1.00 0.00 O ATOM 0 H GLU A 78 -7.575 8.676 -3.791 1.00 0.00 H new ATOM 0 HA GLU A 78 -10.473 8.351 -3.744 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -8.675 7.601 -2.033 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -8.627 9.282 -1.542 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -11.355 8.109 -1.675 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -10.300 7.366 -0.490 1.00 0.00 H new TER 1344 GLU A 78