USER MOD reduce.3.24.130724 H: found=0, std=0, add=678, rem=0, adj=16 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 HE2:sc= -0.424 K(o=-0.42,f=-1.8) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 35:sc= 0.428 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.00533 USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A -2 GLY N :NH3+ -141:sc= 0.183 (180deg=0) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot -47:sc= 0.384 USER MOD Single : A 18 THR OG1 : rot -61:sc= 0.31! USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 146:sc= 1.18 USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.088) USER MOD Single : A 38 ASN :FLIP amide:sc= -0.212 F(o=-1.5,f=-0.21) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 170:sc= -0.0989 USER MOD Single : A 58 GLN : amide:sc= -0.0645 X(o=-0.065,f=-0.065) USER MOD Single : A 63 SER OG : rot 163:sc= 1.2 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -0.0607 X(o=-0.061,f=-0.091) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 THR OG1 : rot -29:sc= 0.473 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -2 0.968 16.255 8.370 1.00 0.00 N ATOM 2 CA GLY A -2 1.911 15.303 7.740 1.00 0.00 C ATOM 3 C GLY A -2 1.193 14.535 6.642 1.00 0.00 C ATOM 4 O GLY A -2 0.198 15.060 6.156 1.00 0.00 O ATOM 0 H1 GLY A -2 1.462 17.146 8.578 1.00 0.00 H new ATOM 0 H2 GLY A -2 0.177 16.441 7.721 1.00 0.00 H new ATOM 0 H3 GLY A -2 0.602 15.847 9.254 1.00 0.00 H new ATOM 0 HA2 GLY A -2 2.764 15.840 7.326 1.00 0.00 H new ATOM 0 HA3 GLY A -2 2.301 14.612 8.487 1.00 0.00 H new ATOM 10 N SER A -1 1.664 13.337 6.254 1.00 0.00 N ATOM 11 CA SER A -1 0.978 12.543 5.208 1.00 0.00 C ATOM 12 C SER A -1 1.346 11.051 5.093 1.00 0.00 C ATOM 13 O SER A -1 0.492 10.252 4.727 1.00 0.00 O ATOM 14 CB SER A -1 1.231 13.185 3.826 1.00 0.00 C ATOM 15 OG SER A -1 0.013 13.562 3.223 1.00 0.00 O ATOM 0 H SER A -1 2.501 12.899 6.638 1.00 0.00 H new ATOM 0 HA SER A -1 -0.065 12.563 5.525 1.00 0.00 H new ATOM 0 HB2 SER A -1 1.874 14.058 3.937 1.00 0.00 H new ATOM 0 HB3 SER A -1 1.759 12.481 3.183 1.00 0.00 H new ATOM 0 HG SER A -1 0.192 13.968 2.349 1.00 0.00 H new ATOM 21 N HIS A 0 2.615 10.675 5.302 1.00 0.00 N ATOM 22 CA HIS A 0 3.236 9.491 4.677 1.00 0.00 C ATOM 23 C HIS A 0 3.320 8.236 5.571 1.00 0.00 C ATOM 24 O HIS A 0 3.578 8.358 6.772 1.00 0.00 O ATOM 25 CB HIS A 0 4.645 9.921 4.226 1.00 0.00 C ATOM 26 CG HIS A 0 5.497 10.498 5.344 1.00 0.00 C ATOM 27 ND1 HIS A 0 5.917 9.818 6.472 1.00 0.00 N ATOM 28 CD2 HIS A 0 5.919 11.794 5.455 1.00 0.00 C ATOM 29 CE1 HIS A 0 6.606 10.678 7.245 1.00 0.00 C ATOM 30 NE2 HIS A 0 6.618 11.888 6.647 1.00 0.00 N ATOM 0 H HIS A 0 3.249 11.187 5.915 1.00 0.00 H new ATOM 0 HA HIS A 0 2.598 9.179 3.850 1.00 0.00 H new ATOM 0 HB2 HIS A 0 5.158 9.060 3.798 1.00 0.00 H new ATOM 0 HB3 HIS A 0 4.552 10.663 3.433 1.00 0.00 H new ATOM 0 HD1 HIS A 0 5.736 8.836 6.682 1.00 0.00 H new ATOM 0 HD2 HIS A 0 5.741 12.591 4.749 1.00 0.00 H new ATOM 0 HE1 HIS A 0 7.073 10.439 8.189 1.00 0.00 H new ATOM 39 N MET A 1 3.254 7.028 4.984 1.00 0.00 N ATOM 40 CA MET A 1 3.489 5.758 5.698 1.00 0.00 C ATOM 41 C MET A 1 3.878 4.586 4.766 1.00 0.00 C ATOM 42 O MET A 1 3.714 4.679 3.550 1.00 0.00 O ATOM 43 CB MET A 1 2.228 5.407 6.514 1.00 0.00 C ATOM 44 CG MET A 1 2.574 4.666 7.810 1.00 0.00 C ATOM 45 SD MET A 1 1.228 4.648 9.023 1.00 0.00 S ATOM 46 CE MET A 1 1.951 5.735 10.284 1.00 0.00 C ATOM 0 H MET A 1 3.035 6.903 3.996 1.00 0.00 H new ATOM 0 HA MET A 1 4.345 5.905 6.356 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.684 6.321 6.753 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.564 4.790 5.909 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.847 3.639 7.569 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.451 5.131 8.261 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.255 5.841 11.116 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.884 5.303 10.645 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.149 6.715 9.850 1.00 0.00 H new ATOM 56 N THR A 2 4.351 3.478 5.356 1.00 0.00 N ATOM 57 CA THR A 2 4.690 2.178 4.738 1.00 0.00 C ATOM 58 C THR A 2 4.361 1.052 5.725 1.00 0.00 C ATOM 59 O THR A 2 4.703 1.197 6.902 1.00 0.00 O ATOM 60 CB THR A 2 6.200 2.056 4.455 1.00 0.00 C ATOM 61 OG1 THR A 2 6.928 2.292 5.645 1.00 0.00 O ATOM 62 CG2 THR A 2 6.715 3.003 3.377 1.00 0.00 C ATOM 0 H THR A 2 4.522 3.462 6.361 1.00 0.00 H new ATOM 0 HA THR A 2 4.123 2.109 3.809 1.00 0.00 H new ATOM 0 HB THR A 2 6.349 1.042 4.084 1.00 0.00 H new ATOM 0 HG1 THR A 2 6.427 1.940 6.410 1.00 0.00 H new ATOM 0 HG21 THR A 2 7.786 2.851 3.241 1.00 0.00 H new ATOM 0 HG22 THR A 2 6.198 2.802 2.439 1.00 0.00 H new ATOM 0 HG23 THR A 2 6.530 4.034 3.680 1.00 0.00 H new ATOM 70 N LEU A 3 3.772 -0.066 5.276 1.00 0.00 N ATOM 71 CA LEU A 3 3.355 -1.181 6.148 1.00 0.00 C ATOM 72 C LEU A 3 3.769 -2.547 5.555 1.00 0.00 C ATOM 73 O LEU A 3 4.084 -2.621 4.370 1.00 0.00 O ATOM 74 CB LEU A 3 1.832 -1.097 6.413 1.00 0.00 C ATOM 75 CG LEU A 3 1.305 0.271 6.922 1.00 0.00 C ATOM 76 CD1 LEU A 3 0.878 1.232 5.798 1.00 0.00 C ATOM 77 CD2 LEU A 3 0.070 0.078 7.809 1.00 0.00 C ATOM 0 H LEU A 3 3.569 -0.226 4.289 1.00 0.00 H new ATOM 0 HA LEU A 3 3.871 -1.093 7.104 1.00 0.00 H new ATOM 0 HB2 LEU A 3 1.308 -1.345 5.490 1.00 0.00 H new ATOM 0 HB3 LEU A 3 1.568 -1.861 7.144 1.00 0.00 H new ATOM 0 HG LEU A 3 2.146 0.704 7.464 1.00 0.00 H new ATOM 0 HD11 LEU A 3 0.522 2.166 6.233 1.00 0.00 H new ATOM 0 HD12 LEU A 3 1.731 1.436 5.150 1.00 0.00 H new ATOM 0 HD13 LEU A 3 0.079 0.776 5.213 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -0.284 1.049 8.156 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -0.717 -0.412 7.235 1.00 0.00 H new ATOM 0 HD23 LEU A 3 0.332 -0.541 8.668 1.00 0.00 H new ATOM 89 N ARG A 4 3.779 -3.638 6.344 1.00 0.00 N ATOM 90 CA ARG A 4 4.231 -4.987 5.913 1.00 0.00 C ATOM 91 C ARG A 4 3.052 -5.948 5.722 1.00 0.00 C ATOM 92 O ARG A 4 1.976 -5.705 6.265 1.00 0.00 O ATOM 93 CB ARG A 4 5.192 -5.584 6.961 1.00 0.00 C ATOM 94 CG ARG A 4 6.449 -4.741 7.220 1.00 0.00 C ATOM 95 CD ARG A 4 7.241 -5.305 8.409 1.00 0.00 C ATOM 96 NE ARG A 4 8.019 -4.257 9.097 1.00 0.00 N ATOM 97 CZ ARG A 4 7.546 -3.348 9.946 1.00 0.00 C ATOM 98 NH1 ARG A 4 6.268 -3.277 10.249 1.00 0.00 N ATOM 99 NH2 ARG A 4 8.356 -2.483 10.509 1.00 0.00 N ATOM 0 H ARG A 4 3.469 -3.613 7.316 1.00 0.00 H new ATOM 0 HA ARG A 4 4.740 -4.866 4.957 1.00 0.00 H new ATOM 0 HB2 ARG A 4 4.654 -5.710 7.900 1.00 0.00 H new ATOM 0 HB3 ARG A 4 5.497 -6.578 6.633 1.00 0.00 H new ATOM 0 HG2 ARG A 4 7.077 -4.731 6.329 1.00 0.00 H new ATOM 0 HG3 ARG A 4 6.166 -3.708 7.422 1.00 0.00 H new ATOM 0 HD2 ARG A 4 6.554 -5.770 9.116 1.00 0.00 H new ATOM 0 HD3 ARG A 4 7.915 -6.087 8.059 1.00 0.00 H new ATOM 0 HE ARG A 4 9.020 -4.226 8.902 1.00 0.00 H new ATOM 0 HH11 ARG A 4 5.607 -3.931 9.829 1.00 0.00 H new ATOM 0 HH12 ARG A 4 5.938 -2.568 10.904 1.00 0.00 H new ATOM 0 HH21 ARG A 4 9.353 -2.505 10.297 1.00 0.00 H new ATOM 0 HH22 ARG A 4 7.988 -1.788 11.159 1.00 0.00 H new ATOM 113 N ILE A 5 3.274 -7.097 5.063 1.00 0.00 N ATOM 114 CA ILE A 5 2.262 -8.171 4.930 1.00 0.00 C ATOM 115 C ILE A 5 1.695 -8.579 6.299 1.00 0.00 C ATOM 116 O ILE A 5 0.481 -8.589 6.483 1.00 0.00 O ATOM 117 CB ILE A 5 2.810 -9.362 4.095 1.00 0.00 C ATOM 118 CG1 ILE A 5 1.705 -10.165 3.366 1.00 0.00 C ATOM 119 CG2 ILE A 5 3.769 -10.295 4.857 1.00 0.00 C ATOM 120 CD1 ILE A 5 0.606 -10.793 4.232 1.00 0.00 C ATOM 0 H ILE A 5 4.160 -7.313 4.605 1.00 0.00 H new ATOM 0 HA ILE A 5 1.414 -7.781 4.366 1.00 0.00 H new ATOM 0 HB ILE A 5 3.414 -8.874 3.330 1.00 0.00 H new ATOM 0 HG12 ILE A 5 1.228 -9.503 2.643 1.00 0.00 H new ATOM 0 HG13 ILE A 5 2.185 -10.963 2.799 1.00 0.00 H new ATOM 0 HG21 ILE A 5 4.100 -11.096 4.195 1.00 0.00 H new ATOM 0 HG22 ILE A 5 4.634 -9.727 5.200 1.00 0.00 H new ATOM 0 HG23 ILE A 5 3.253 -10.724 5.716 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -0.100 -11.325 3.594 1.00 0.00 H new ATOM 0 HD12 ILE A 5 1.054 -11.492 4.938 1.00 0.00 H new ATOM 0 HD13 ILE A 5 0.082 -10.010 4.779 1.00 0.00 H new ATOM 132 N ARG A 6 2.573 -8.792 7.293 1.00 0.00 N ATOM 133 CA ARG A 6 2.212 -9.042 8.694 1.00 0.00 C ATOM 134 C ARG A 6 1.252 -7.980 9.236 1.00 0.00 C ATOM 135 O ARG A 6 0.283 -8.325 9.903 1.00 0.00 O ATOM 136 CB ARG A 6 3.486 -9.130 9.556 1.00 0.00 C ATOM 137 CG ARG A 6 4.198 -10.483 9.399 1.00 0.00 C ATOM 138 CD ARG A 6 5.482 -10.541 10.242 1.00 0.00 C ATOM 139 NE ARG A 6 6.033 -11.909 10.302 1.00 0.00 N ATOM 140 CZ ARG A 6 5.664 -12.888 11.122 1.00 0.00 C ATOM 141 NH1 ARG A 6 4.737 -12.716 12.038 1.00 0.00 N ATOM 142 NH2 ARG A 6 6.222 -14.073 11.038 1.00 0.00 N ATOM 0 H ARG A 6 3.581 -8.795 7.137 1.00 0.00 H new ATOM 0 HA ARG A 6 1.686 -9.995 8.742 1.00 0.00 H new ATOM 0 HB2 ARG A 6 4.168 -8.327 9.277 1.00 0.00 H new ATOM 0 HB3 ARG A 6 3.226 -8.977 10.603 1.00 0.00 H new ATOM 0 HG2 ARG A 6 3.526 -11.287 9.700 1.00 0.00 H new ATOM 0 HG3 ARG A 6 4.442 -10.648 8.350 1.00 0.00 H new ATOM 0 HD2 ARG A 6 6.226 -9.867 9.818 1.00 0.00 H new ATOM 0 HD3 ARG A 6 5.271 -10.189 11.252 1.00 0.00 H new ATOM 0 HE ARG A 6 6.779 -12.127 9.642 1.00 0.00 H new ATOM 0 HH11 ARG A 6 4.278 -11.810 12.135 1.00 0.00 H new ATOM 0 HH12 ARG A 6 4.477 -13.488 12.652 1.00 0.00 H new ATOM 0 HH21 ARG A 6 6.945 -14.248 10.340 1.00 0.00 H new ATOM 0 HH22 ARG A 6 5.933 -14.819 11.671 1.00 0.00 H new ATOM 156 N THR A 7 1.497 -6.702 8.927 1.00 0.00 N ATOM 157 CA THR A 7 0.669 -5.566 9.349 1.00 0.00 C ATOM 158 C THR A 7 -0.698 -5.557 8.661 1.00 0.00 C ATOM 159 O THR A 7 -1.697 -5.318 9.334 1.00 0.00 O ATOM 160 CB THR A 7 1.386 -4.229 9.097 1.00 0.00 C ATOM 161 OG1 THR A 7 2.753 -4.289 9.459 1.00 0.00 O ATOM 162 CG2 THR A 7 0.763 -3.114 9.937 1.00 0.00 C ATOM 0 H THR A 7 2.298 -6.421 8.361 1.00 0.00 H new ATOM 0 HA THR A 7 0.506 -5.686 10.420 1.00 0.00 H new ATOM 0 HB THR A 7 1.285 -4.028 8.030 1.00 0.00 H new ATOM 0 HG1 THR A 7 3.176 -3.423 9.283 1.00 0.00 H new ATOM 0 HG21 THR A 7 1.285 -2.177 9.743 1.00 0.00 H new ATOM 0 HG22 THR A 7 -0.289 -3.004 9.673 1.00 0.00 H new ATOM 0 HG23 THR A 7 0.848 -3.365 10.994 1.00 0.00 H new ATOM 170 N ILE A 8 -0.769 -5.841 7.350 1.00 0.00 N ATOM 171 CA ILE A 8 -2.059 -5.991 6.654 1.00 0.00 C ATOM 172 C ILE A 8 -2.833 -7.182 7.240 1.00 0.00 C ATOM 173 O ILE A 8 -3.986 -7.039 7.644 1.00 0.00 O ATOM 174 CB ILE A 8 -1.908 -6.128 5.118 1.00 0.00 C ATOM 175 CG1 ILE A 8 -0.969 -5.049 4.533 1.00 0.00 C ATOM 176 CG2 ILE A 8 -3.306 -6.026 4.480 1.00 0.00 C ATOM 177 CD1 ILE A 8 -0.995 -4.891 3.004 1.00 0.00 C ATOM 0 H ILE A 8 0.047 -5.971 6.753 1.00 0.00 H new ATOM 0 HA ILE A 8 -2.624 -5.074 6.820 1.00 0.00 H new ATOM 0 HB ILE A 8 -1.457 -7.095 4.893 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -1.226 -4.090 4.982 1.00 0.00 H new ATOM 0 HG13 ILE A 8 0.052 -5.280 4.837 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -3.220 -6.120 3.398 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -3.941 -6.825 4.864 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -3.749 -5.061 4.726 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -0.298 -4.107 2.707 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -0.704 -5.831 2.536 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -2.001 -4.622 2.683 1.00 0.00 H new ATOM 189 N ALA A 9 -2.192 -8.353 7.327 1.00 0.00 N ATOM 190 CA ALA A 9 -2.800 -9.574 7.845 1.00 0.00 C ATOM 191 C ALA A 9 -3.285 -9.431 9.296 1.00 0.00 C ATOM 192 O ALA A 9 -4.350 -9.954 9.633 1.00 0.00 O ATOM 193 CB ALA A 9 -1.792 -10.714 7.717 1.00 0.00 C ATOM 0 H ALA A 9 -1.223 -8.476 7.034 1.00 0.00 H new ATOM 0 HA ALA A 9 -3.690 -9.789 7.254 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -2.233 -11.634 8.101 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -1.526 -10.849 6.669 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -0.897 -10.474 8.290 1.00 0.00 H new ATOM 199 N ARG A 10 -2.563 -8.673 10.139 1.00 0.00 N ATOM 200 CA ARG A 10 -2.934 -8.332 11.523 1.00 0.00 C ATOM 201 C ARG A 10 -4.322 -7.697 11.685 1.00 0.00 C ATOM 202 O ARG A 10 -4.837 -7.719 12.798 1.00 0.00 O ATOM 203 CB ARG A 10 -1.839 -7.446 12.153 1.00 0.00 C ATOM 204 CG ARG A 10 -0.769 -8.278 12.879 1.00 0.00 C ATOM 205 CD ARG A 10 -1.169 -8.521 14.341 1.00 0.00 C ATOM 206 NE ARG A 10 -0.408 -9.630 14.948 1.00 0.00 N ATOM 207 CZ ARG A 10 -0.754 -10.913 14.973 1.00 0.00 C ATOM 208 NH1 ARG A 10 -1.864 -11.344 14.420 1.00 0.00 N ATOM 209 NH2 ARG A 10 0.015 -11.796 15.566 1.00 0.00 N ATOM 0 H ARG A 10 -1.670 -8.265 9.864 1.00 0.00 H new ATOM 0 HA ARG A 10 -3.006 -9.280 12.057 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -1.366 -6.847 11.375 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -2.296 -6.751 12.857 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -0.636 -9.233 12.370 1.00 0.00 H new ATOM 0 HG3 ARG A 10 0.189 -7.760 12.840 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -1.004 -7.611 14.917 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -2.235 -8.742 14.393 1.00 0.00 H new ATOM 0 HE ARG A 10 0.476 -9.387 15.395 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -2.490 -10.687 13.954 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -2.101 -12.336 14.457 1.00 0.00 H new ATOM 0 HH21 ARG A 10 0.883 -11.499 16.011 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -0.256 -12.779 15.582 1.00 0.00 H new ATOM 223 N MET A 11 -4.969 -7.241 10.604 1.00 0.00 N ATOM 224 CA MET A 11 -6.397 -6.901 10.585 1.00 0.00 C ATOM 225 C MET A 11 -7.318 -8.056 11.007 1.00 0.00 C ATOM 226 O MET A 11 -8.447 -7.800 11.425 1.00 0.00 O ATOM 227 CB MET A 11 -6.810 -6.483 9.165 1.00 0.00 C ATOM 228 CG MET A 11 -6.293 -5.101 8.757 1.00 0.00 C ATOM 229 SD MET A 11 -7.293 -3.724 9.395 1.00 0.00 S ATOM 230 CE MET A 11 -6.081 -2.811 10.388 1.00 0.00 C ATOM 0 H MET A 11 -4.508 -7.096 9.706 1.00 0.00 H new ATOM 0 HA MET A 11 -6.516 -6.093 11.307 1.00 0.00 H new ATOM 0 HB2 MET A 11 -6.441 -7.224 8.456 1.00 0.00 H new ATOM 0 HB3 MET A 11 -7.898 -6.490 9.095 1.00 0.00 H new ATOM 0 HG2 MET A 11 -5.268 -4.988 9.111 1.00 0.00 H new ATOM 0 HG3 MET A 11 -6.263 -5.042 7.669 1.00 0.00 H new ATOM 0 HE1 MET A 11 -6.560 -1.941 10.837 1.00 0.00 H new ATOM 0 HE2 MET A 11 -5.693 -3.458 11.174 1.00 0.00 H new ATOM 0 HE3 MET A 11 -5.260 -2.484 9.750 1.00 0.00 H new ATOM 240 N THR A 12 -6.936 -9.328 10.800 1.00 0.00 N ATOM 241 CA THR A 12 -7.812 -10.476 11.136 1.00 0.00 C ATOM 242 C THR A 12 -7.106 -11.839 11.220 1.00 0.00 C ATOM 243 O THR A 12 -7.717 -12.809 11.659 1.00 0.00 O ATOM 244 CB THR A 12 -8.994 -10.625 10.136 1.00 0.00 C ATOM 245 OG1 THR A 12 -9.335 -9.410 9.501 1.00 0.00 O ATOM 246 CG2 THR A 12 -10.280 -11.075 10.831 1.00 0.00 C ATOM 0 H THR A 12 -6.034 -9.592 10.404 1.00 0.00 H new ATOM 0 HA THR A 12 -8.167 -10.221 12.134 1.00 0.00 H new ATOM 0 HB THR A 12 -8.636 -11.361 9.416 1.00 0.00 H new ATOM 0 HG1 THR A 12 -9.399 -8.698 10.171 1.00 0.00 H new ATOM 0 HG21 THR A 12 -11.079 -11.166 10.095 1.00 0.00 H new ATOM 0 HG22 THR A 12 -10.116 -12.040 11.310 1.00 0.00 H new ATOM 0 HG23 THR A 12 -10.563 -10.340 11.584 1.00 0.00 H new ATOM 254 N GLY A 13 -5.856 -11.971 10.763 1.00 0.00 N ATOM 255 CA GLY A 13 -5.141 -13.244 10.631 1.00 0.00 C ATOM 256 C GLY A 13 -5.660 -14.100 9.471 1.00 0.00 C ATOM 257 O GLY A 13 -4.869 -14.510 8.629 1.00 0.00 O ATOM 0 H GLY A 13 -5.298 -11.171 10.466 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -4.079 -13.045 10.483 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -5.234 -13.806 11.561 1.00 0.00 H new ATOM 261 N ILE A 14 -6.979 -14.329 9.385 1.00 0.00 N ATOM 262 CA ILE A 14 -7.613 -15.203 8.379 1.00 0.00 C ATOM 263 C ILE A 14 -7.236 -14.804 6.945 1.00 0.00 C ATOM 264 O ILE A 14 -7.067 -15.667 6.085 1.00 0.00 O ATOM 265 CB ILE A 14 -9.152 -15.364 8.591 1.00 0.00 C ATOM 266 CG1 ILE A 14 -10.091 -14.459 7.749 1.00 0.00 C ATOM 267 CG2 ILE A 14 -9.559 -15.199 10.069 1.00 0.00 C ATOM 268 CD1 ILE A 14 -10.383 -14.981 6.332 1.00 0.00 C ATOM 0 H ILE A 14 -7.651 -13.905 10.024 1.00 0.00 H new ATOM 0 HA ILE A 14 -7.200 -16.200 8.534 1.00 0.00 H new ATOM 0 HB ILE A 14 -9.302 -16.382 8.231 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -11.035 -14.343 8.281 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -9.645 -13.467 7.672 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -10.638 -15.320 10.165 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -9.055 -15.954 10.672 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -9.273 -14.206 10.417 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -11.046 -14.286 5.818 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -9.449 -15.069 5.777 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -10.861 -15.959 6.396 1.00 0.00 H new ATOM 280 N ARG A 15 -7.055 -13.497 6.691 1.00 0.00 N ATOM 281 CA ARG A 15 -6.616 -12.987 5.391 1.00 0.00 C ATOM 282 C ARG A 15 -5.137 -13.240 5.085 1.00 0.00 C ATOM 283 O ARG A 15 -4.789 -13.129 3.917 1.00 0.00 O ATOM 284 CB ARG A 15 -6.972 -11.497 5.205 1.00 0.00 C ATOM 285 CG ARG A 15 -8.487 -11.263 5.061 1.00 0.00 C ATOM 286 CD ARG A 15 -9.093 -10.566 6.286 1.00 0.00 C ATOM 287 NE ARG A 15 -10.471 -11.024 6.540 1.00 0.00 N ATOM 288 CZ ARG A 15 -11.468 -10.335 7.079 1.00 0.00 C ATOM 289 NH1 ARG A 15 -11.396 -9.045 7.301 1.00 0.00 N ATOM 290 NH2 ARG A 15 -12.568 -10.955 7.429 1.00 0.00 N ATOM 0 H ARG A 15 -7.211 -12.767 7.386 1.00 0.00 H new ATOM 0 HA ARG A 15 -7.177 -13.569 4.660 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -6.600 -10.929 6.058 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -6.463 -11.114 4.321 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -8.675 -10.659 4.173 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -8.986 -12.220 4.907 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -8.475 -10.764 7.162 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -9.090 -9.487 6.131 1.00 0.00 H new ATOM 0 HE ARG A 15 -10.683 -11.984 6.269 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -10.549 -8.532 7.057 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -12.187 -8.554 7.718 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -12.654 -11.961 7.286 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -13.339 -10.431 7.844 1.00 0.00 H new ATOM 304 N GLU A 16 -4.265 -13.629 6.026 1.00 0.00 N ATOM 305 CA GLU A 16 -2.848 -13.881 5.699 1.00 0.00 C ATOM 306 C GLU A 16 -2.715 -14.917 4.576 1.00 0.00 C ATOM 307 O GLU A 16 -2.032 -14.677 3.579 1.00 0.00 O ATOM 308 CB GLU A 16 -2.039 -14.343 6.925 1.00 0.00 C ATOM 309 CG GLU A 16 -0.546 -14.016 6.732 1.00 0.00 C ATOM 310 CD GLU A 16 0.372 -15.116 7.270 1.00 0.00 C ATOM 311 OE1 GLU A 16 0.597 -15.127 8.501 1.00 0.00 O ATOM 312 OE2 GLU A 16 0.855 -15.910 6.432 1.00 0.00 O ATOM 0 H GLU A 16 -4.507 -13.775 7.006 1.00 0.00 H new ATOM 0 HA GLU A 16 -2.437 -12.930 5.361 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -2.413 -13.851 7.823 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -2.168 -15.415 7.072 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -0.345 -13.867 5.671 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -0.316 -13.077 7.235 1.00 0.00 H new ATOM 319 N ALA A 17 -3.460 -16.023 4.704 1.00 0.00 N ATOM 320 CA ALA A 17 -3.555 -17.100 3.726 1.00 0.00 C ATOM 321 C ALA A 17 -4.114 -16.656 2.364 1.00 0.00 C ATOM 322 O ALA A 17 -3.832 -17.310 1.362 1.00 0.00 O ATOM 323 CB ALA A 17 -4.431 -18.203 4.328 1.00 0.00 C ATOM 0 H ALA A 17 -4.035 -16.193 5.529 1.00 0.00 H new ATOM 0 HA ALA A 17 -2.546 -17.456 3.519 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.521 -19.025 3.617 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.975 -18.568 5.249 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -5.421 -17.803 4.547 1.00 0.00 H new ATOM 329 N THR A 18 -4.879 -15.554 2.300 1.00 0.00 N ATOM 330 CA THR A 18 -5.345 -14.985 1.031 1.00 0.00 C ATOM 331 C THR A 18 -4.320 -13.985 0.486 1.00 0.00 C ATOM 332 O THR A 18 -3.902 -14.127 -0.654 1.00 0.00 O ATOM 333 CB THR A 18 -6.798 -14.464 1.129 1.00 0.00 C ATOM 334 OG1 THR A 18 -7.461 -14.712 -0.094 1.00 0.00 O ATOM 335 CG2 THR A 18 -7.000 -12.990 1.483 1.00 0.00 C ATOM 0 H THR A 18 -5.189 -15.037 3.123 1.00 0.00 H new ATOM 0 HA THR A 18 -5.407 -15.773 0.281 1.00 0.00 H new ATOM 0 HB THR A 18 -7.209 -15.013 1.976 1.00 0.00 H new ATOM 0 HG1 THR A 18 -7.006 -14.230 -0.816 1.00 0.00 H new ATOM 0 HG21 THR A 18 -8.066 -12.767 1.516 1.00 0.00 H new ATOM 0 HG22 THR A 18 -6.556 -12.786 2.457 1.00 0.00 H new ATOM 0 HG23 THR A 18 -6.522 -12.366 0.728 1.00 0.00 H new ATOM 343 N LEU A 19 -3.811 -13.061 1.310 1.00 0.00 N ATOM 344 CA LEU A 19 -2.785 -12.069 0.968 1.00 0.00 C ATOM 345 C LEU A 19 -1.517 -12.737 0.403 1.00 0.00 C ATOM 346 O LEU A 19 -1.076 -12.410 -0.699 1.00 0.00 O ATOM 347 CB LEU A 19 -2.458 -11.246 2.230 1.00 0.00 C ATOM 348 CG LEU A 19 -3.621 -10.391 2.779 1.00 0.00 C ATOM 349 CD1 LEU A 19 -3.396 -10.013 4.255 1.00 0.00 C ATOM 350 CD2 LEU A 19 -3.827 -9.119 1.963 1.00 0.00 C ATOM 0 H LEU A 19 -4.118 -12.981 2.279 1.00 0.00 H new ATOM 0 HA LEU A 19 -3.168 -11.412 0.187 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.129 -11.928 3.014 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -1.618 -10.588 2.007 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.517 -11.007 2.699 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.234 -9.412 4.608 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -3.321 -10.920 4.855 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.473 -9.440 4.347 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.654 -8.547 2.383 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.919 -8.517 1.992 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.055 -9.382 0.930 1.00 0.00 H new ATOM 362 N ARG A 20 -0.954 -13.709 1.140 1.00 0.00 N ATOM 363 CA ARG A 20 0.221 -14.488 0.721 1.00 0.00 C ATOM 364 C ARG A 20 -0.056 -15.381 -0.489 1.00 0.00 C ATOM 365 O ARG A 20 0.864 -15.646 -1.256 1.00 0.00 O ATOM 366 CB ARG A 20 0.732 -15.341 1.896 1.00 0.00 C ATOM 367 CG ARG A 20 1.402 -14.501 2.997 1.00 0.00 C ATOM 368 CD ARG A 20 2.833 -14.078 2.635 1.00 0.00 C ATOM 369 NE ARG A 20 3.750 -15.228 2.697 1.00 0.00 N ATOM 370 CZ ARG A 20 5.067 -15.212 2.551 1.00 0.00 C ATOM 371 NH1 ARG A 20 5.715 -14.131 2.182 1.00 0.00 N ATOM 372 NH2 ARG A 20 5.760 -16.303 2.788 1.00 0.00 N ATOM 0 H ARG A 20 -1.309 -13.979 2.057 1.00 0.00 H new ATOM 0 HA ARG A 20 0.984 -13.771 0.418 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -0.102 -15.896 2.326 1.00 0.00 H new ATOM 0 HB3 ARG A 20 1.445 -16.076 1.522 1.00 0.00 H new ATOM 0 HG2 ARG A 20 0.801 -13.611 3.185 1.00 0.00 H new ATOM 0 HG3 ARG A 20 1.421 -15.074 3.924 1.00 0.00 H new ATOM 0 HD2 ARG A 20 2.848 -13.649 1.633 1.00 0.00 H new ATOM 0 HD3 ARG A 20 3.171 -13.300 3.320 1.00 0.00 H new ATOM 0 HE ARG A 20 3.324 -16.138 2.872 1.00 0.00 H new ATOM 0 HH11 ARG A 20 5.204 -13.268 1.998 1.00 0.00 H new ATOM 0 HH12 ARG A 20 6.730 -14.155 2.080 1.00 0.00 H new ATOM 0 HH21 ARG A 20 5.284 -17.156 3.082 1.00 0.00 H new ATOM 0 HH22 ARG A 20 6.774 -16.297 2.677 1.00 0.00 H new ATOM 386 N ALA A 21 -1.304 -15.816 -0.699 1.00 0.00 N ATOM 387 CA ALA A 21 -1.688 -16.473 -1.942 1.00 0.00 C ATOM 388 C ALA A 21 -1.726 -15.474 -3.107 1.00 0.00 C ATOM 389 O ALA A 21 -1.146 -15.754 -4.155 1.00 0.00 O ATOM 390 CB ALA A 21 -3.024 -17.196 -1.772 1.00 0.00 C ATOM 0 H ALA A 21 -2.061 -15.722 -0.021 1.00 0.00 H new ATOM 0 HA ALA A 21 -0.933 -17.220 -2.186 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -3.297 -17.681 -2.709 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -2.934 -17.947 -0.987 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -3.795 -16.476 -1.499 1.00 0.00 H new ATOM 396 N TRP A 22 -2.371 -14.310 -2.940 1.00 0.00 N ATOM 397 CA TRP A 22 -2.494 -13.277 -3.971 1.00 0.00 C ATOM 398 C TRP A 22 -1.148 -12.801 -4.506 1.00 0.00 C ATOM 399 O TRP A 22 -1.061 -12.533 -5.703 1.00 0.00 O ATOM 400 CB TRP A 22 -3.278 -12.063 -3.483 1.00 0.00 C ATOM 401 CG TRP A 22 -4.664 -12.242 -2.955 1.00 0.00 C ATOM 402 CD1 TRP A 22 -5.449 -13.337 -3.080 1.00 0.00 C ATOM 403 CD2 TRP A 22 -5.431 -11.279 -2.173 1.00 0.00 C ATOM 404 NE1 TRP A 22 -6.628 -13.126 -2.395 1.00 0.00 N ATOM 405 CE2 TRP A 22 -6.687 -11.859 -1.867 1.00 0.00 C ATOM 406 CE3 TRP A 22 -5.185 -9.990 -1.652 1.00 0.00 C ATOM 407 CZ2 TRP A 22 -7.648 -11.195 -1.101 1.00 0.00 C ATOM 408 CZ3 TRP A 22 -6.156 -9.295 -0.908 1.00 0.00 C ATOM 409 CH2 TRP A 22 -7.392 -9.897 -0.627 1.00 0.00 C ATOM 0 H TRP A 22 -2.830 -14.058 -2.065 1.00 0.00 H new ATOM 0 HA TRP A 22 -3.039 -13.762 -4.781 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -2.689 -11.589 -2.698 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -3.333 -11.356 -4.311 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -5.194 -14.232 -3.628 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -7.365 -13.824 -2.293 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -4.226 -9.525 -1.829 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -8.587 -11.678 -0.873 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -5.950 -8.296 -0.552 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -8.138 -9.369 -0.053 1.00 0.00 H new ATOM 420 N GLU A 23 -0.106 -12.788 -3.665 1.00 0.00 N ATOM 421 CA GLU A 23 1.300 -12.557 -4.027 1.00 0.00 C ATOM 422 C GLU A 23 1.755 -13.398 -5.242 1.00 0.00 C ATOM 423 O GLU A 23 2.590 -12.935 -6.018 1.00 0.00 O ATOM 424 CB GLU A 23 2.157 -12.827 -2.772 1.00 0.00 C ATOM 425 CG GLU A 23 3.570 -12.225 -2.793 1.00 0.00 C ATOM 426 CD GLU A 23 4.240 -12.347 -1.408 1.00 0.00 C ATOM 427 OE1 GLU A 23 4.715 -13.454 -1.064 1.00 0.00 O ATOM 428 OE2 GLU A 23 4.264 -11.332 -0.672 1.00 0.00 O ATOM 0 H GLU A 23 -0.226 -12.946 -2.664 1.00 0.00 H new ATOM 0 HA GLU A 23 1.426 -11.524 -4.350 1.00 0.00 H new ATOM 0 HB2 GLU A 23 1.628 -12.438 -1.902 1.00 0.00 H new ATOM 0 HB3 GLU A 23 2.242 -13.905 -2.637 1.00 0.00 H new ATOM 0 HG2 GLU A 23 4.176 -12.736 -3.541 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.519 -11.176 -3.086 1.00 0.00 H new ATOM 435 N ARG A 24 1.143 -14.577 -5.465 1.00 0.00 N ATOM 436 CA ARG A 24 1.279 -15.397 -6.683 1.00 0.00 C ATOM 437 C ARG A 24 -0.007 -15.458 -7.530 1.00 0.00 C ATOM 438 O ARG A 24 0.077 -15.584 -8.749 1.00 0.00 O ATOM 439 CB ARG A 24 1.719 -16.817 -6.277 1.00 0.00 C ATOM 440 CG ARG A 24 2.366 -17.580 -7.445 1.00 0.00 C ATOM 441 CD ARG A 24 2.314 -19.097 -7.223 1.00 0.00 C ATOM 442 NE ARG A 24 3.031 -19.838 -8.280 1.00 0.00 N ATOM 443 CZ ARG A 24 2.653 -20.037 -9.539 1.00 0.00 C ATOM 444 NH1 ARG A 24 1.535 -19.543 -10.024 1.00 0.00 N ATOM 445 NH2 ARG A 24 3.406 -20.745 -10.347 1.00 0.00 N ATOM 0 H ARG A 24 0.519 -14.999 -4.778 1.00 0.00 H new ATOM 0 HA ARG A 24 2.030 -14.923 -7.315 1.00 0.00 H new ATOM 0 HB2 ARG A 24 2.426 -16.754 -5.450 1.00 0.00 H new ATOM 0 HB3 ARG A 24 0.855 -17.374 -5.915 1.00 0.00 H new ATOM 0 HG2 ARG A 24 1.853 -17.329 -8.373 1.00 0.00 H new ATOM 0 HG3 ARG A 24 3.403 -17.263 -7.558 1.00 0.00 H new ATOM 0 HD2 ARG A 24 2.751 -19.336 -6.253 1.00 0.00 H new ATOM 0 HD3 ARG A 24 1.274 -19.423 -7.194 1.00 0.00 H new ATOM 0 HE ARG A 24 3.926 -20.247 -8.011 1.00 0.00 H new ATOM 0 HH11 ARG A 24 0.923 -18.985 -9.428 1.00 0.00 H new ATOM 0 HH12 ARG A 24 1.279 -19.718 -10.996 1.00 0.00 H new ATOM 0 HH21 ARG A 24 4.282 -21.143 -10.009 1.00 0.00 H new ATOM 0 HH22 ARG A 24 3.115 -20.897 -11.313 1.00 0.00 H new ATOM 459 N ARG A 25 -1.190 -15.423 -6.901 1.00 0.00 N ATOM 460 CA ARG A 25 -2.503 -15.668 -7.522 1.00 0.00 C ATOM 461 C ARG A 25 -3.026 -14.482 -8.354 1.00 0.00 C ATOM 462 O ARG A 25 -3.781 -14.725 -9.290 1.00 0.00 O ATOM 463 CB ARG A 25 -3.490 -16.115 -6.421 1.00 0.00 C ATOM 464 CG ARG A 25 -4.713 -16.907 -6.911 1.00 0.00 C ATOM 465 CD ARG A 25 -5.585 -17.373 -5.728 1.00 0.00 C ATOM 466 NE ARG A 25 -4.965 -18.486 -4.979 1.00 0.00 N ATOM 467 CZ ARG A 25 -5.385 -19.027 -3.839 1.00 0.00 C ATOM 468 NH1 ARG A 25 -6.445 -18.584 -3.203 1.00 0.00 N ATOM 469 NH2 ARG A 25 -4.730 -20.033 -3.305 1.00 0.00 N ATOM 0 H ARG A 25 -1.263 -15.215 -5.905 1.00 0.00 H new ATOM 0 HA ARG A 25 -2.395 -16.467 -8.256 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -2.949 -16.726 -5.698 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -3.841 -15.230 -5.891 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -5.307 -16.286 -7.582 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -4.383 -17.772 -7.486 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -5.756 -16.534 -5.053 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -6.560 -17.687 -6.100 1.00 0.00 H new ATOM 0 HE ARG A 25 -4.118 -18.885 -5.383 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -6.976 -17.800 -3.581 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -6.737 -19.024 -2.331 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -3.897 -20.401 -3.765 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -5.054 -20.446 -2.431 1.00 0.00 H new ATOM 483 N TYR A 26 -2.614 -13.238 -8.051 1.00 0.00 N ATOM 484 CA TYR A 26 -3.012 -12.027 -8.804 1.00 0.00 C ATOM 485 C TYR A 26 -1.944 -10.921 -8.854 1.00 0.00 C ATOM 486 O TYR A 26 -1.849 -10.214 -9.854 1.00 0.00 O ATOM 487 CB TYR A 26 -4.290 -11.400 -8.212 1.00 0.00 C ATOM 488 CG TYR A 26 -5.432 -12.369 -7.994 1.00 0.00 C ATOM 489 CD1 TYR A 26 -6.300 -12.704 -9.052 1.00 0.00 C ATOM 490 CD2 TYR A 26 -5.577 -12.983 -6.738 1.00 0.00 C ATOM 491 CE1 TYR A 26 -7.296 -13.680 -8.866 1.00 0.00 C ATOM 492 CE2 TYR A 26 -6.548 -13.979 -6.557 1.00 0.00 C ATOM 493 CZ TYR A 26 -7.409 -14.332 -7.618 1.00 0.00 C ATOM 494 OH TYR A 26 -8.340 -15.303 -7.424 1.00 0.00 O ATOM 0 H TYR A 26 -1.989 -13.039 -7.270 1.00 0.00 H new ATOM 0 HA TYR A 26 -3.170 -12.390 -9.819 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -4.041 -10.934 -7.259 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -4.629 -10.605 -8.876 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -6.201 -12.211 -10.008 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -4.943 -12.689 -5.915 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -7.970 -13.929 -9.672 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -6.637 -14.477 -5.603 1.00 0.00 H new ATOM 0 HH TYR A 26 -8.273 -15.641 -6.507 1.00 0.00 H new ATOM 504 N GLY A 27 -1.176 -10.730 -7.774 1.00 0.00 N ATOM 505 CA GLY A 27 -0.197 -9.653 -7.618 1.00 0.00 C ATOM 506 C GLY A 27 -0.713 -8.409 -6.881 1.00 0.00 C ATOM 507 O GLY A 27 -0.007 -7.405 -6.874 1.00 0.00 O ATOM 0 H GLY A 27 -1.222 -11.342 -6.960 1.00 0.00 H new ATOM 0 HA2 GLY A 27 0.667 -10.043 -7.080 1.00 0.00 H new ATOM 0 HA3 GLY A 27 0.151 -9.353 -8.606 1.00 0.00 H new ATOM 511 N PHE A 28 -1.908 -8.456 -6.273 1.00 0.00 N ATOM 512 CA PHE A 28 -2.468 -7.415 -5.399 1.00 0.00 C ATOM 513 C PHE A 28 -2.579 -7.944 -3.955 1.00 0.00 C ATOM 514 O PHE A 28 -3.017 -9.077 -3.795 1.00 0.00 O ATOM 515 CB PHE A 28 -3.855 -6.997 -5.905 1.00 0.00 C ATOM 516 CG PHE A 28 -4.669 -6.126 -4.953 1.00 0.00 C ATOM 517 CD1 PHE A 28 -5.419 -6.718 -3.912 1.00 0.00 C ATOM 518 CD2 PHE A 28 -4.753 -4.735 -5.154 1.00 0.00 C ATOM 519 CE1 PHE A 28 -6.294 -5.944 -3.134 1.00 0.00 C ATOM 520 CE2 PHE A 28 -5.606 -3.954 -4.353 1.00 0.00 C ATOM 521 CZ PHE A 28 -6.393 -4.562 -3.359 1.00 0.00 C ATOM 0 H PHE A 28 -2.536 -9.253 -6.381 1.00 0.00 H new ATOM 0 HA PHE A 28 -1.806 -6.549 -5.413 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -3.732 -6.460 -6.845 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -4.428 -7.898 -6.125 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -5.318 -7.775 -3.713 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -4.161 -4.266 -5.926 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -6.890 -6.411 -2.364 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -5.656 -2.885 -4.502 1.00 0.00 H new ATOM 0 HZ PHE A 28 -7.073 -3.966 -2.769 1.00 0.00 H new ATOM 531 N PRO A 29 -2.261 -7.151 -2.912 1.00 0.00 N ATOM 532 CA PRO A 29 -1.498 -5.914 -3.022 1.00 0.00 C ATOM 533 C PRO A 29 -0.113 -6.234 -3.593 1.00 0.00 C ATOM 534 O PRO A 29 0.383 -7.350 -3.428 1.00 0.00 O ATOM 535 CB PRO A 29 -1.424 -5.359 -1.603 1.00 0.00 C ATOM 536 CG PRO A 29 -1.500 -6.607 -0.719 1.00 0.00 C ATOM 537 CD PRO A 29 -2.394 -7.551 -1.518 1.00 0.00 C ATOM 0 HA PRO A 29 -1.951 -5.182 -3.690 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -0.499 -4.807 -1.437 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.246 -4.673 -1.398 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -0.514 -7.038 -0.546 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -1.926 -6.382 0.259 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -2.088 -8.588 -1.379 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.431 -7.478 -1.189 1.00 0.00 H new ATOM 545 N ARG A 30 0.507 -5.274 -4.284 1.00 0.00 N ATOM 546 CA ARG A 30 1.807 -5.506 -4.912 1.00 0.00 C ATOM 547 C ARG A 30 2.911 -4.989 -3.990 1.00 0.00 C ATOM 548 O ARG A 30 3.009 -3.774 -3.824 1.00 0.00 O ATOM 549 CB ARG A 30 1.876 -4.879 -6.311 1.00 0.00 C ATOM 550 CG ARG A 30 3.052 -5.532 -7.050 1.00 0.00 C ATOM 551 CD ARG A 30 3.145 -5.095 -8.513 1.00 0.00 C ATOM 552 NE ARG A 30 4.381 -5.612 -9.129 1.00 0.00 N ATOM 553 CZ ARG A 30 4.622 -6.849 -9.549 1.00 0.00 C ATOM 554 NH1 ARG A 30 3.700 -7.783 -9.545 1.00 0.00 N ATOM 555 NH2 ARG A 30 5.819 -7.172 -9.982 1.00 0.00 N ATOM 0 H ARG A 30 0.132 -4.336 -4.421 1.00 0.00 H new ATOM 0 HA ARG A 30 1.951 -6.577 -5.055 1.00 0.00 H new ATOM 0 HB2 ARG A 30 0.944 -5.044 -6.852 1.00 0.00 H new ATOM 0 HB3 ARG A 30 2.018 -3.800 -6.242 1.00 0.00 H new ATOM 0 HG2 ARG A 30 3.982 -5.280 -6.540 1.00 0.00 H new ATOM 0 HG3 ARG A 30 2.948 -6.616 -7.005 1.00 0.00 H new ATOM 0 HD2 ARG A 30 2.278 -5.459 -9.063 1.00 0.00 H new ATOM 0 HD3 ARG A 30 3.128 -4.007 -8.575 1.00 0.00 H new ATOM 0 HE ARG A 30 5.140 -4.941 -9.246 1.00 0.00 H new ATOM 0 HH11 ARG A 30 2.760 -7.570 -9.211 1.00 0.00 H new ATOM 0 HH12 ARG A 30 3.924 -8.722 -9.876 1.00 0.00 H new ATOM 0 HH21 ARG A 30 6.562 -6.473 -9.995 1.00 0.00 H new ATOM 0 HH22 ARG A 30 6.006 -8.121 -10.305 1.00 0.00 H new ATOM 569 N PRO A 31 3.722 -5.860 -3.362 1.00 0.00 N ATOM 570 CA PRO A 31 4.744 -5.389 -2.447 1.00 0.00 C ATOM 571 C PRO A 31 5.848 -4.696 -3.238 1.00 0.00 C ATOM 572 O PRO A 31 6.412 -5.279 -4.171 1.00 0.00 O ATOM 573 CB PRO A 31 5.239 -6.616 -1.699 1.00 0.00 C ATOM 574 CG PRO A 31 4.987 -7.767 -2.674 1.00 0.00 C ATOM 575 CD PRO A 31 3.751 -7.317 -3.456 1.00 0.00 C ATOM 0 HA PRO A 31 4.370 -4.654 -1.734 1.00 0.00 H new ATOM 0 HB2 PRO A 31 6.296 -6.531 -1.446 1.00 0.00 H new ATOM 0 HB3 PRO A 31 4.698 -6.759 -0.764 1.00 0.00 H new ATOM 0 HG2 PRO A 31 5.841 -7.928 -3.332 1.00 0.00 H new ATOM 0 HG3 PRO A 31 4.809 -8.705 -2.148 1.00 0.00 H new ATOM 0 HD2 PRO A 31 3.809 -7.640 -4.496 1.00 0.00 H new ATOM 0 HD3 PRO A 31 2.844 -7.753 -3.037 1.00 0.00 H new ATOM 583 N LEU A 32 6.132 -3.442 -2.881 1.00 0.00 N ATOM 584 CA LEU A 32 7.122 -2.643 -3.593 1.00 0.00 C ATOM 585 C LEU A 32 8.519 -3.283 -3.469 1.00 0.00 C ATOM 586 O LEU A 32 8.786 -4.125 -2.603 1.00 0.00 O ATOM 587 CB LEU A 32 7.106 -1.140 -3.203 1.00 0.00 C ATOM 588 CG LEU A 32 6.275 -0.666 -1.989 1.00 0.00 C ATOM 589 CD1 LEU A 32 6.697 0.754 -1.597 1.00 0.00 C ATOM 590 CD2 LEU A 32 4.767 -0.620 -2.272 1.00 0.00 C ATOM 0 H LEU A 32 5.687 -2.960 -2.100 1.00 0.00 H new ATOM 0 HA LEU A 32 6.843 -2.649 -4.647 1.00 0.00 H new ATOM 0 HB2 LEU A 32 8.139 -0.840 -3.026 1.00 0.00 H new ATOM 0 HB3 LEU A 32 6.757 -0.583 -4.072 1.00 0.00 H new ATOM 0 HG LEU A 32 6.463 -1.389 -1.195 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.109 1.085 -0.741 1.00 0.00 H new ATOM 0 HD12 LEU A 32 7.755 0.760 -1.335 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.527 1.429 -2.436 1.00 0.00 H new ATOM 0 HD21 LEU A 32 4.240 -0.280 -1.381 1.00 0.00 H new ATOM 0 HD22 LEU A 32 4.572 0.069 -3.094 1.00 0.00 H new ATOM 0 HD23 LEU A 32 4.417 -1.616 -2.542 1.00 0.00 H new ATOM 602 N ARG A 33 9.421 -2.875 -4.366 1.00 0.00 N ATOM 603 CA ARG A 33 10.841 -3.222 -4.296 1.00 0.00 C ATOM 604 C ARG A 33 11.475 -2.625 -3.037 1.00 0.00 C ATOM 605 O ARG A 33 11.100 -1.546 -2.582 1.00 0.00 O ATOM 606 CB ARG A 33 11.549 -2.737 -5.570 1.00 0.00 C ATOM 607 CG ARG A 33 11.572 -3.827 -6.654 1.00 0.00 C ATOM 608 CD ARG A 33 11.484 -3.226 -8.065 1.00 0.00 C ATOM 609 NE ARG A 33 12.273 -3.991 -9.049 1.00 0.00 N ATOM 610 CZ ARG A 33 13.560 -3.817 -9.332 1.00 0.00 C ATOM 611 NH1 ARG A 33 14.302 -2.950 -8.681 1.00 0.00 N ATOM 612 NH2 ARG A 33 14.133 -4.517 -10.282 1.00 0.00 N ATOM 0 H ARG A 33 9.183 -2.290 -5.167 1.00 0.00 H new ATOM 0 HA ARG A 33 10.950 -4.305 -4.233 1.00 0.00 H new ATOM 0 HB2 ARG A 33 11.042 -1.852 -5.954 1.00 0.00 H new ATOM 0 HB3 ARG A 33 12.570 -2.441 -5.329 1.00 0.00 H new ATOM 0 HG2 ARG A 33 12.488 -4.411 -6.564 1.00 0.00 H new ATOM 0 HG3 ARG A 33 10.740 -4.513 -6.498 1.00 0.00 H new ATOM 0 HD2 ARG A 33 10.441 -3.198 -8.381 1.00 0.00 H new ATOM 0 HD3 ARG A 33 11.838 -2.195 -8.041 1.00 0.00 H new ATOM 0 HE ARG A 33 11.784 -4.724 -9.562 1.00 0.00 H new ATOM 0 HH11 ARG A 33 13.893 -2.387 -7.935 1.00 0.00 H new ATOM 0 HH12 ARG A 33 15.287 -2.840 -8.922 1.00 0.00 H new ATOM 0 HH21 ARG A 33 13.590 -5.201 -10.810 1.00 0.00 H new ATOM 0 HH22 ARG A 33 15.121 -4.377 -10.493 1.00 0.00 H new ATOM 626 N SER A 34 12.456 -3.346 -2.504 1.00 0.00 N ATOM 627 CA SER A 34 13.162 -3.035 -1.268 1.00 0.00 C ATOM 628 C SER A 34 14.567 -3.653 -1.291 1.00 0.00 C ATOM 629 O SER A 34 14.913 -4.387 -2.219 1.00 0.00 O ATOM 630 CB SER A 34 12.340 -3.561 -0.084 1.00 0.00 C ATOM 631 OG SER A 34 12.218 -4.971 -0.117 1.00 0.00 O ATOM 0 H SER A 34 12.795 -4.202 -2.943 1.00 0.00 H new ATOM 0 HA SER A 34 13.280 -1.956 -1.165 1.00 0.00 H new ATOM 0 HB2 SER A 34 12.813 -3.258 0.850 1.00 0.00 H new ATOM 0 HB3 SER A 34 11.348 -3.109 -0.100 1.00 0.00 H new ATOM 0 HG SER A 34 12.207 -5.320 0.799 1.00 0.00 H new ATOM 637 N GLU A 35 15.386 -3.338 -0.283 1.00 0.00 N ATOM 638 CA GLU A 35 16.702 -3.954 -0.091 1.00 0.00 C ATOM 639 C GLU A 35 16.612 -5.399 0.442 1.00 0.00 C ATOM 640 O GLU A 35 15.544 -5.853 0.843 1.00 0.00 O ATOM 641 CB GLU A 35 17.530 -3.093 0.877 1.00 0.00 C ATOM 642 CG GLU A 35 18.974 -2.956 0.378 1.00 0.00 C ATOM 643 CD GLU A 35 19.927 -2.664 1.535 1.00 0.00 C ATOM 644 OE1 GLU A 35 19.751 -1.605 2.177 1.00 0.00 O ATOM 645 OE2 GLU A 35 20.795 -3.531 1.774 1.00 0.00 O ATOM 0 H GLU A 35 15.153 -2.644 0.427 1.00 0.00 H new ATOM 0 HA GLU A 35 17.185 -4.004 -1.067 1.00 0.00 H new ATOM 0 HB2 GLU A 35 17.077 -2.106 0.972 1.00 0.00 H new ATOM 0 HB3 GLU A 35 17.524 -3.544 1.869 1.00 0.00 H new ATOM 0 HG2 GLU A 35 19.277 -3.874 -0.125 1.00 0.00 H new ATOM 0 HG3 GLU A 35 19.034 -2.154 -0.358 1.00 0.00 H new ATOM 652 N GLY A 36 17.751 -6.107 0.515 1.00 0.00 N ATOM 653 CA GLY A 36 17.831 -7.511 0.942 1.00 0.00 C ATOM 654 C GLY A 36 17.185 -7.788 2.305 1.00 0.00 C ATOM 655 O GLY A 36 16.315 -8.649 2.414 1.00 0.00 O ATOM 0 H GLY A 36 18.659 -5.710 0.274 1.00 0.00 H new ATOM 0 HA2 GLY A 36 17.350 -8.136 0.190 1.00 0.00 H new ATOM 0 HA3 GLY A 36 18.879 -7.809 0.981 1.00 0.00 H new ATOM 659 N ASN A 37 17.607 -7.064 3.348 1.00 0.00 N ATOM 660 CA ASN A 37 17.051 -7.194 4.699 1.00 0.00 C ATOM 661 C ASN A 37 15.695 -6.487 4.874 1.00 0.00 C ATOM 662 O ASN A 37 14.963 -6.799 5.812 1.00 0.00 O ATOM 663 CB ASN A 37 18.065 -6.638 5.712 1.00 0.00 C ATOM 664 CG ASN A 37 19.404 -7.357 5.648 1.00 0.00 C ATOM 665 OD1 ASN A 37 20.243 -7.066 4.814 1.00 0.00 O ATOM 666 ND2 ASN A 37 19.643 -8.322 6.512 1.00 0.00 N ATOM 0 H ASN A 37 18.349 -6.367 3.278 1.00 0.00 H new ATOM 0 HA ASN A 37 16.867 -8.254 4.872 1.00 0.00 H new ATOM 0 HB2 ASN A 37 18.217 -5.575 5.523 1.00 0.00 H new ATOM 0 HB3 ASN A 37 17.655 -6.728 6.718 1.00 0.00 H new ATOM 0 HD21 ASN A 37 20.530 -8.825 6.482 1.00 0.00 H new ATOM 0 HD22 ASN A 37 18.941 -8.566 7.211 1.00 0.00 H new ATOM 673 N ASN A 38 15.350 -5.536 3.997 1.00 0.00 N ATOM 674 CA ASN A 38 14.083 -4.816 4.048 1.00 0.00 C ATOM 675 C ASN A 38 12.977 -5.686 3.444 1.00 0.00 C ATOM 676 O ASN A 38 12.792 -5.714 2.225 1.00 0.00 O ATOM 677 CB ASN A 38 14.228 -3.462 3.336 1.00 0.00 C ATOM 678 CG ASN A 38 13.028 -2.530 3.514 1.00 0.00 C ATOM 679 OD1 ASN A 38 11.800 -2.937 3.245 1.00 0.00 O flip ATOM 680 ND2 ASN A 38 13.185 -1.385 3.898 1.00 0.00 N flip ATOM 0 H ASN A 38 15.952 -5.246 3.227 1.00 0.00 H new ATOM 0 HA ASN A 38 13.804 -4.607 5.081 1.00 0.00 H new ATOM 0 HB2 ASN A 38 15.121 -2.961 3.709 1.00 0.00 H new ATOM 0 HB3 ASN A 38 14.383 -3.638 2.272 1.00 0.00 H new ATOM 0 HD21 ASN A 38 14.122 -1.043 4.113 1.00 0.00 H new ATOM 0 HD22 ASN A 38 12.380 -0.768 4.004 1.00 0.00 H new ATOM 687 N TYR A 39 12.203 -6.353 4.302 1.00 0.00 N ATOM 688 CA TYR A 39 11.073 -7.197 3.909 1.00 0.00 C ATOM 689 C TYR A 39 10.057 -6.478 3.000 1.00 0.00 C ATOM 690 O TYR A 39 10.041 -5.249 2.880 1.00 0.00 O ATOM 691 CB TYR A 39 10.362 -7.748 5.161 1.00 0.00 C ATOM 692 CG TYR A 39 11.256 -7.980 6.366 1.00 0.00 C ATOM 693 CD1 TYR A 39 12.319 -8.901 6.295 1.00 0.00 C ATOM 694 CD2 TYR A 39 11.064 -7.213 7.532 1.00 0.00 C ATOM 695 CE1 TYR A 39 13.200 -9.047 7.384 1.00 0.00 C ATOM 696 CE2 TYR A 39 11.936 -7.361 8.625 1.00 0.00 C ATOM 697 CZ TYR A 39 13.012 -8.271 8.550 1.00 0.00 C ATOM 698 OH TYR A 39 13.867 -8.386 9.600 1.00 0.00 O ATOM 0 H TYR A 39 12.347 -6.321 5.311 1.00 0.00 H new ATOM 0 HA TYR A 39 11.490 -8.016 3.323 1.00 0.00 H new ATOM 0 HB2 TYR A 39 9.571 -7.054 5.444 1.00 0.00 H new ATOM 0 HB3 TYR A 39 9.880 -8.690 4.900 1.00 0.00 H new ATOM 0 HD1 TYR A 39 12.459 -9.496 5.405 1.00 0.00 H new ATOM 0 HD2 TYR A 39 10.246 -6.510 7.586 1.00 0.00 H new ATOM 0 HE1 TYR A 39 14.018 -9.751 7.328 1.00 0.00 H new ATOM 0 HE2 TYR A 39 11.782 -6.779 9.521 1.00 0.00 H new ATOM 0 HH TYR A 39 13.589 -7.778 10.317 1.00 0.00 H new ATOM 708 N ARG A 40 9.174 -7.277 2.391 1.00 0.00 N ATOM 709 CA ARG A 40 8.102 -6.842 1.493 1.00 0.00 C ATOM 710 C ARG A 40 7.110 -5.909 2.201 1.00 0.00 C ATOM 711 O ARG A 40 6.451 -6.291 3.172 1.00 0.00 O ATOM 712 CB ARG A 40 7.417 -8.084 0.893 1.00 0.00 C ATOM 713 CG ARG A 40 8.321 -8.867 -0.080 1.00 0.00 C ATOM 714 CD ARG A 40 8.687 -8.081 -1.351 1.00 0.00 C ATOM 715 NE ARG A 40 9.689 -8.786 -2.162 1.00 0.00 N ATOM 716 CZ ARG A 40 10.089 -8.436 -3.378 1.00 0.00 C ATOM 717 NH1 ARG A 40 9.598 -7.388 -4.004 1.00 0.00 N ATOM 718 NH2 ARG A 40 11.006 -9.151 -3.991 1.00 0.00 N ATOM 0 H ARG A 40 9.189 -8.289 2.517 1.00 0.00 H new ATOM 0 HA ARG A 40 8.528 -6.254 0.680 1.00 0.00 H new ATOM 0 HB2 ARG A 40 7.106 -8.745 1.702 1.00 0.00 H new ATOM 0 HB3 ARG A 40 6.513 -7.774 0.369 1.00 0.00 H new ATOM 0 HG2 ARG A 40 9.237 -9.151 0.438 1.00 0.00 H new ATOM 0 HG3 ARG A 40 7.818 -9.790 -0.367 1.00 0.00 H new ATOM 0 HD2 ARG A 40 7.789 -7.915 -1.947 1.00 0.00 H new ATOM 0 HD3 ARG A 40 9.071 -7.099 -1.073 1.00 0.00 H new ATOM 0 HE ARG A 40 10.115 -9.618 -1.754 1.00 0.00 H new ATOM 0 HH11 ARG A 40 8.885 -6.813 -3.555 1.00 0.00 H new ATOM 0 HH12 ARG A 40 9.930 -7.150 -4.939 1.00 0.00 H new ATOM 0 HH21 ARG A 40 11.406 -9.969 -3.532 1.00 0.00 H new ATOM 0 HH22 ARG A 40 11.318 -8.887 -4.926 1.00 0.00 H new ATOM 732 N VAL A 41 7.027 -4.678 1.688 1.00 0.00 N ATOM 733 CA VAL A 41 6.200 -3.581 2.202 1.00 0.00 C ATOM 734 C VAL A 41 5.210 -3.075 1.153 1.00 0.00 C ATOM 735 O VAL A 41 5.360 -3.321 -0.044 1.00 0.00 O ATOM 736 CB VAL A 41 7.062 -2.411 2.739 1.00 0.00 C ATOM 737 CG1 VAL A 41 7.680 -2.759 4.095 1.00 0.00 C ATOM 738 CG2 VAL A 41 8.168 -1.968 1.769 1.00 0.00 C ATOM 0 H VAL A 41 7.561 -4.406 0.863 1.00 0.00 H new ATOM 0 HA VAL A 41 5.629 -3.990 3.036 1.00 0.00 H new ATOM 0 HB VAL A 41 6.376 -1.571 2.850 1.00 0.00 H new ATOM 0 HG11 VAL A 41 8.280 -1.920 4.448 1.00 0.00 H new ATOM 0 HG12 VAL A 41 6.887 -2.966 4.814 1.00 0.00 H new ATOM 0 HG13 VAL A 41 8.314 -3.639 3.991 1.00 0.00 H new ATOM 0 HG21 VAL A 41 8.731 -1.146 2.210 1.00 0.00 H new ATOM 0 HG22 VAL A 41 8.839 -2.805 1.576 1.00 0.00 H new ATOM 0 HG23 VAL A 41 7.719 -1.639 0.832 1.00 0.00 H new ATOM 748 N TYR A 42 4.205 -2.345 1.635 1.00 0.00 N ATOM 749 CA TYR A 42 3.050 -1.843 0.907 1.00 0.00 C ATOM 750 C TYR A 42 2.781 -0.377 1.255 1.00 0.00 C ATOM 751 O TYR A 42 3.058 0.082 2.373 1.00 0.00 O ATOM 752 CB TYR A 42 1.833 -2.692 1.286 1.00 0.00 C ATOM 753 CG TYR A 42 1.976 -4.162 0.957 1.00 0.00 C ATOM 754 CD1 TYR A 42 1.868 -4.581 -0.379 1.00 0.00 C ATOM 755 CD2 TYR A 42 2.188 -5.110 1.978 1.00 0.00 C ATOM 756 CE1 TYR A 42 1.914 -5.953 -0.682 1.00 0.00 C ATOM 757 CE2 TYR A 42 2.254 -6.480 1.663 1.00 0.00 C ATOM 758 CZ TYR A 42 2.108 -6.910 0.329 1.00 0.00 C ATOM 759 OH TYR A 42 2.145 -8.229 -0.005 1.00 0.00 O ATOM 0 H TYR A 42 4.179 -2.071 2.617 1.00 0.00 H new ATOM 0 HA TYR A 42 3.244 -1.907 -0.164 1.00 0.00 H new ATOM 0 HB2 TYR A 42 1.649 -2.587 2.355 1.00 0.00 H new ATOM 0 HB3 TYR A 42 0.956 -2.300 0.772 1.00 0.00 H new ATOM 0 HD1 TYR A 42 1.750 -3.854 -1.169 1.00 0.00 H new ATOM 0 HD2 TYR A 42 2.300 -4.785 3.002 1.00 0.00 H new ATOM 0 HE1 TYR A 42 1.799 -6.276 -1.706 1.00 0.00 H new ATOM 0 HE2 TYR A 42 2.417 -7.205 2.447 1.00 0.00 H new ATOM 0 HH TYR A 42 2.287 -8.767 0.802 1.00 0.00 H new ATOM 769 N SER A 43 2.202 0.337 0.288 1.00 0.00 N ATOM 770 CA SER A 43 1.735 1.712 0.405 1.00 0.00 C ATOM 771 C SER A 43 0.396 1.794 1.145 1.00 0.00 C ATOM 772 O SER A 43 -0.347 0.815 1.279 1.00 0.00 O ATOM 773 CB SER A 43 1.588 2.307 -1.001 1.00 0.00 C ATOM 774 OG SER A 43 1.386 3.705 -0.908 1.00 0.00 O ATOM 0 H SER A 43 2.040 -0.050 -0.642 1.00 0.00 H new ATOM 0 HA SER A 43 2.466 2.277 0.983 1.00 0.00 H new ATOM 0 HB2 SER A 43 2.481 2.097 -1.590 1.00 0.00 H new ATOM 0 HB3 SER A 43 0.748 1.842 -1.517 1.00 0.00 H new ATOM 0 HG SER A 43 1.453 4.105 -1.800 1.00 0.00 H new ATOM 780 N ARG A 44 0.050 3.011 1.574 1.00 0.00 N ATOM 781 CA ARG A 44 -1.233 3.320 2.208 1.00 0.00 C ATOM 782 C ARG A 44 -2.412 3.043 1.269 1.00 0.00 C ATOM 783 O ARG A 44 -3.428 2.537 1.733 1.00 0.00 O ATOM 784 CB ARG A 44 -1.221 4.778 2.698 1.00 0.00 C ATOM 785 CG ARG A 44 -2.302 5.066 3.750 1.00 0.00 C ATOM 786 CD ARG A 44 -1.893 4.537 5.132 1.00 0.00 C ATOM 787 NE ARG A 44 -2.954 4.756 6.131 1.00 0.00 N ATOM 788 CZ ARG A 44 -3.958 3.940 6.424 1.00 0.00 C ATOM 789 NH1 ARG A 44 -4.142 2.802 5.795 1.00 0.00 N ATOM 790 NH2 ARG A 44 -4.808 4.266 7.369 1.00 0.00 N ATOM 0 H ARG A 44 0.664 3.821 1.489 1.00 0.00 H new ATOM 0 HA ARG A 44 -1.369 2.663 3.067 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -0.242 5.006 3.119 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -1.364 5.443 1.846 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -2.479 6.140 3.808 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -3.241 4.604 3.445 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -1.671 3.472 5.064 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -0.978 5.033 5.456 1.00 0.00 H new ATOM 0 HE ARG A 44 -2.912 5.631 6.654 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -3.501 2.520 5.053 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -4.926 2.200 6.048 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -4.695 5.144 7.875 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -5.581 3.641 7.597 1.00 0.00 H new ATOM 804 N GLU A 45 -2.264 3.328 -0.030 1.00 0.00 N ATOM 805 CA GLU A 45 -3.266 3.053 -1.071 1.00 0.00 C ATOM 806 C GLU A 45 -3.517 1.551 -1.277 1.00 0.00 C ATOM 807 O GLU A 45 -4.679 1.147 -1.316 1.00 0.00 O ATOM 808 CB GLU A 45 -2.902 3.750 -2.396 1.00 0.00 C ATOM 809 CG GLU A 45 -1.473 3.464 -2.883 1.00 0.00 C ATOM 810 CD GLU A 45 -1.149 4.134 -4.219 1.00 0.00 C ATOM 811 OE1 GLU A 45 -1.889 3.882 -5.196 1.00 0.00 O ATOM 812 OE2 GLU A 45 -0.144 4.882 -4.230 1.00 0.00 O ATOM 0 H GLU A 45 -1.421 3.769 -0.398 1.00 0.00 H new ATOM 0 HA GLU A 45 -4.206 3.474 -0.714 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -3.607 3.435 -3.166 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.024 4.826 -2.274 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -0.763 3.807 -2.130 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -1.338 2.387 -2.981 1.00 0.00 H new ATOM 819 N GLU A 46 -2.464 0.715 -1.332 1.00 0.00 N ATOM 820 CA GLU A 46 -2.619 -0.744 -1.327 1.00 0.00 C ATOM 821 C GLU A 46 -3.385 -1.180 -0.080 1.00 0.00 C ATOM 822 O GLU A 46 -4.371 -1.898 -0.203 1.00 0.00 O ATOM 823 CB GLU A 46 -1.274 -1.491 -1.369 1.00 0.00 C ATOM 824 CG GLU A 46 -0.646 -1.644 -2.768 1.00 0.00 C ATOM 825 CD GLU A 46 0.611 -0.789 -2.966 1.00 0.00 C ATOM 826 OE1 GLU A 46 1.469 -0.807 -2.053 1.00 0.00 O ATOM 827 OE2 GLU A 46 0.705 -0.134 -4.023 1.00 0.00 O ATOM 0 H GLU A 46 -1.495 1.030 -1.380 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.169 -1.001 -2.232 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -0.566 -0.966 -0.727 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -1.416 -2.484 -0.942 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -0.394 -2.692 -2.933 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -1.385 -1.372 -3.522 1.00 0.00 H new ATOM 834 N VAL A 47 -2.965 -0.733 1.112 1.00 0.00 N ATOM 835 CA VAL A 47 -3.648 -1.068 2.368 1.00 0.00 C ATOM 836 C VAL A 47 -5.111 -0.616 2.373 1.00 0.00 C ATOM 837 O VAL A 47 -5.968 -1.401 2.767 1.00 0.00 O ATOM 838 CB VAL A 47 -2.869 -0.530 3.583 1.00 0.00 C ATOM 839 CG1 VAL A 47 -3.646 -0.677 4.901 1.00 0.00 C ATOM 840 CG2 VAL A 47 -1.570 -1.329 3.722 1.00 0.00 C ATOM 0 H VAL A 47 -2.148 -0.134 1.232 1.00 0.00 H new ATOM 0 HA VAL A 47 -3.667 -2.155 2.447 1.00 0.00 H new ATOM 0 HB VAL A 47 -2.690 0.531 3.408 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -3.048 -0.281 5.722 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -4.583 -0.124 4.835 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -3.859 -1.731 5.082 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -1.006 -0.960 4.579 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -1.805 -2.383 3.869 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -0.973 -1.213 2.817 1.00 0.00 H new ATOM 850 N GLU A 48 -5.418 0.611 1.939 1.00 0.00 N ATOM 851 CA GLU A 48 -6.791 1.116 1.851 1.00 0.00 C ATOM 852 C GLU A 48 -7.644 0.253 0.913 1.00 0.00 C ATOM 853 O GLU A 48 -8.696 -0.254 1.316 1.00 0.00 O ATOM 854 CB GLU A 48 -6.782 2.588 1.400 1.00 0.00 C ATOM 855 CG GLU A 48 -8.148 3.273 1.560 1.00 0.00 C ATOM 856 CD GLU A 48 -8.508 3.493 3.041 1.00 0.00 C ATOM 857 OE1 GLU A 48 -8.909 2.510 3.710 1.00 0.00 O ATOM 858 OE2 GLU A 48 -8.350 4.639 3.513 1.00 0.00 O ATOM 0 H GLU A 48 -4.715 1.286 1.637 1.00 0.00 H new ATOM 0 HA GLU A 48 -7.244 1.059 2.841 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -6.037 3.135 1.978 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -6.476 2.640 0.355 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -8.136 4.232 1.043 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -8.918 2.664 1.086 1.00 0.00 H new ATOM 865 N ALA A 49 -7.156 0.037 -0.317 1.00 0.00 N ATOM 866 CA ALA A 49 -7.775 -0.849 -1.289 1.00 0.00 C ATOM 867 C ALA A 49 -8.009 -2.236 -0.679 1.00 0.00 C ATOM 868 O ALA A 49 -9.152 -2.679 -0.605 1.00 0.00 O ATOM 869 CB ALA A 49 -6.906 -0.898 -2.550 1.00 0.00 C ATOM 0 H ALA A 49 -6.306 0.484 -0.661 1.00 0.00 H new ATOM 0 HA ALA A 49 -8.756 -0.467 -1.573 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -7.365 -1.561 -3.283 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -6.819 0.104 -2.971 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -5.914 -1.271 -2.294 1.00 0.00 H new ATOM 875 N VAL A 50 -6.954 -2.898 -0.188 1.00 0.00 N ATOM 876 CA VAL A 50 -7.019 -4.219 0.446 1.00 0.00 C ATOM 877 C VAL A 50 -8.002 -4.251 1.608 1.00 0.00 C ATOM 878 O VAL A 50 -8.753 -5.211 1.710 1.00 0.00 O ATOM 879 CB VAL A 50 -5.636 -4.685 0.925 1.00 0.00 C ATOM 880 CG1 VAL A 50 -5.704 -5.981 1.744 1.00 0.00 C ATOM 881 CG2 VAL A 50 -4.717 -4.991 -0.253 1.00 0.00 C ATOM 0 H VAL A 50 -6.008 -2.519 -0.222 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.376 -4.906 -0.321 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.257 -3.864 1.534 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -4.700 -6.266 2.058 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -6.328 -5.823 2.624 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -6.133 -6.775 1.133 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.746 -5.318 0.119 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.157 -5.780 -0.862 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.590 -4.093 -0.858 1.00 0.00 H new ATOM 891 N ARG A 51 -8.028 -3.240 2.485 1.00 0.00 N ATOM 892 CA ARG A 51 -8.949 -3.206 3.625 1.00 0.00 C ATOM 893 C ARG A 51 -10.412 -3.142 3.171 1.00 0.00 C ATOM 894 O ARG A 51 -11.256 -3.812 3.770 1.00 0.00 O ATOM 895 CB ARG A 51 -8.555 -2.062 4.574 1.00 0.00 C ATOM 896 CG ARG A 51 -9.312 -2.136 5.911 1.00 0.00 C ATOM 897 CD ARG A 51 -10.416 -1.077 6.038 1.00 0.00 C ATOM 898 NE ARG A 51 -9.880 0.202 6.540 1.00 0.00 N ATOM 899 CZ ARG A 51 -10.534 1.113 7.249 1.00 0.00 C ATOM 900 NH1 ARG A 51 -11.834 1.049 7.419 1.00 0.00 N ATOM 901 NH2 ARG A 51 -9.892 2.106 7.817 1.00 0.00 N ATOM 0 H ARG A 51 -7.415 -2.427 2.424 1.00 0.00 H new ATOM 0 HA ARG A 51 -8.864 -4.138 4.183 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -7.482 -2.100 4.762 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -8.760 -1.105 4.094 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -9.754 -3.127 6.017 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -8.603 -2.013 6.730 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -10.885 -0.920 5.067 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -11.192 -1.438 6.713 1.00 0.00 H new ATOM 0 HE ARG A 51 -8.906 0.407 6.319 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -12.366 0.286 7.001 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -12.312 1.763 7.969 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -8.880 2.183 7.716 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -10.405 2.801 8.360 1.00 0.00 H new ATOM 915 N ARG A 52 -10.709 -2.399 2.096 1.00 0.00 N ATOM 916 CA ARG A 52 -12.018 -2.421 1.425 1.00 0.00 C ATOM 917 C ARG A 52 -12.286 -3.790 0.782 1.00 0.00 C ATOM 918 O ARG A 52 -13.271 -4.445 1.124 1.00 0.00 O ATOM 919 CB ARG A 52 -12.108 -1.263 0.406 1.00 0.00 C ATOM 920 CG ARG A 52 -13.429 -0.492 0.554 1.00 0.00 C ATOM 921 CD ARG A 52 -13.539 0.655 -0.466 1.00 0.00 C ATOM 922 NE ARG A 52 -13.529 1.981 0.180 1.00 0.00 N ATOM 923 CZ ARG A 52 -13.759 3.152 -0.407 1.00 0.00 C ATOM 924 NH1 ARG A 52 -13.998 3.253 -1.694 1.00 0.00 N ATOM 925 NH2 ARG A 52 -13.753 4.256 0.304 1.00 0.00 N ATOM 0 H ARG A 52 -10.042 -1.760 1.663 1.00 0.00 H new ATOM 0 HA ARG A 52 -12.802 -2.270 2.167 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -11.269 -0.582 0.550 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -12.027 -1.659 -0.606 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -14.266 -1.177 0.422 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -13.503 -0.089 1.564 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -12.711 0.591 -1.172 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -14.458 0.540 -1.041 1.00 0.00 H new ATOM 0 HE ARG A 52 -13.325 2.002 1.179 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -14.011 2.416 -2.277 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -14.170 4.168 -2.110 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -13.572 4.216 1.307 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -13.929 5.154 -0.147 1.00 0.00 H new ATOM 939 N VAL A 53 -11.387 -4.235 -0.103 1.00 0.00 N ATOM 940 CA VAL A 53 -11.428 -5.515 -0.824 1.00 0.00 C ATOM 941 C VAL A 53 -11.647 -6.694 0.139 1.00 0.00 C ATOM 942 O VAL A 53 -12.580 -7.456 -0.065 1.00 0.00 O ATOM 943 CB VAL A 53 -10.190 -5.658 -1.748 1.00 0.00 C ATOM 944 CG1 VAL A 53 -10.000 -7.077 -2.297 1.00 0.00 C ATOM 945 CG2 VAL A 53 -10.263 -4.670 -2.931 1.00 0.00 C ATOM 0 H VAL A 53 -10.566 -3.683 -0.350 1.00 0.00 H new ATOM 0 HA VAL A 53 -12.295 -5.530 -1.485 1.00 0.00 H new ATOM 0 HB VAL A 53 -9.331 -5.428 -1.118 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -9.117 -7.105 -2.935 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -9.872 -7.774 -1.468 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -10.877 -7.363 -2.879 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -9.383 -4.792 -3.562 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -11.160 -4.870 -3.517 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -10.298 -3.649 -2.551 1.00 0.00 H new ATOM 955 N ALA A 54 -10.880 -6.821 1.227 1.00 0.00 N ATOM 956 CA ALA A 54 -11.003 -7.871 2.247 1.00 0.00 C ATOM 957 C ALA A 54 -12.394 -7.952 2.896 1.00 0.00 C ATOM 958 O ALA A 54 -12.875 -9.053 3.177 1.00 0.00 O ATOM 959 CB ALA A 54 -9.924 -7.653 3.313 1.00 0.00 C ATOM 0 H ALA A 54 -10.124 -6.167 1.431 1.00 0.00 H new ATOM 0 HA ALA A 54 -10.864 -8.828 1.743 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -10.005 -8.427 4.076 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -8.939 -7.703 2.849 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -10.059 -6.674 3.773 1.00 0.00 H new ATOM 965 N ARG A 55 -13.057 -6.808 3.125 1.00 0.00 N ATOM 966 CA ARG A 55 -14.442 -6.781 3.607 1.00 0.00 C ATOM 967 C ARG A 55 -15.424 -7.163 2.494 1.00 0.00 C ATOM 968 O ARG A 55 -16.268 -8.022 2.722 1.00 0.00 O ATOM 969 CB ARG A 55 -14.734 -5.424 4.264 1.00 0.00 C ATOM 970 CG ARG A 55 -16.127 -5.384 4.916 1.00 0.00 C ATOM 971 CD ARG A 55 -16.224 -4.287 5.987 1.00 0.00 C ATOM 972 NE ARG A 55 -15.693 -4.745 7.290 1.00 0.00 N ATOM 973 CZ ARG A 55 -15.191 -4.007 8.274 1.00 0.00 C ATOM 974 NH1 ARG A 55 -15.013 -2.713 8.155 1.00 0.00 N ATOM 975 NH2 ARG A 55 -14.862 -4.563 9.418 1.00 0.00 N ATOM 0 H ARG A 55 -12.650 -5.884 2.982 1.00 0.00 H new ATOM 0 HA ARG A 55 -14.581 -7.539 4.378 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.975 -5.216 5.018 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -14.662 -4.636 3.514 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -16.882 -5.211 4.149 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -16.345 -6.352 5.366 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -15.671 -3.407 5.658 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -17.264 -3.984 6.104 1.00 0.00 H new ATOM 0 HE ARG A 55 -15.715 -5.752 7.453 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -15.263 -2.242 7.286 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -14.625 -2.178 8.932 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -14.992 -5.566 9.554 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -14.477 -3.992 10.170 1.00 0.00 H new ATOM 989 N LEU A 56 -15.256 -6.612 1.286 1.00 0.00 N ATOM 990 CA LEU A 56 -16.020 -6.962 0.076 1.00 0.00 C ATOM 991 C LEU A 56 -15.876 -8.442 -0.339 1.00 0.00 C ATOM 992 O LEU A 56 -16.777 -8.990 -0.974 1.00 0.00 O ATOM 993 CB LEU A 56 -15.585 -6.016 -1.062 1.00 0.00 C ATOM 994 CG LEU A 56 -16.367 -4.689 -1.164 1.00 0.00 C ATOM 995 CD1 LEU A 56 -16.667 -3.988 0.167 1.00 0.00 C ATOM 996 CD2 LEU A 56 -15.567 -3.715 -2.037 1.00 0.00 C ATOM 0 H LEU A 56 -14.561 -5.885 1.115 1.00 0.00 H new ATOM 0 HA LEU A 56 -17.080 -6.834 0.296 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.528 -5.785 -0.933 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.682 -6.547 -2.009 1.00 0.00 H new ATOM 0 HG LEU A 56 -17.334 -4.959 -1.587 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -17.219 -3.068 -0.023 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -17.264 -4.646 0.798 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -15.731 -3.752 0.673 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -16.107 -2.772 -2.119 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -14.592 -3.537 -1.584 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -15.432 -4.143 -3.030 1.00 0.00 H new ATOM 1008 N ILE A 57 -14.763 -9.093 0.018 1.00 0.00 N ATOM 1009 CA ILE A 57 -14.506 -10.536 -0.087 1.00 0.00 C ATOM 1010 C ILE A 57 -15.381 -11.318 0.878 1.00 0.00 C ATOM 1011 O ILE A 57 -16.031 -12.262 0.439 1.00 0.00 O ATOM 1012 CB ILE A 57 -13.005 -10.823 0.118 1.00 0.00 C ATOM 1013 CG1 ILE A 57 -12.262 -10.394 -1.160 1.00 0.00 C ATOM 1014 CG2 ILE A 57 -12.688 -12.306 0.414 1.00 0.00 C ATOM 1015 CD1 ILE A 57 -10.785 -10.135 -0.895 1.00 0.00 C ATOM 0 H ILE A 57 -13.966 -8.595 0.414 1.00 0.00 H new ATOM 0 HA ILE A 57 -14.772 -10.872 -1.089 1.00 0.00 H new ATOM 0 HB ILE A 57 -12.681 -10.261 0.994 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -12.365 -11.170 -1.918 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -12.723 -9.492 -1.563 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -11.613 -12.429 0.546 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -13.203 -12.614 1.324 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -13.024 -12.923 -0.419 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -10.296 -9.835 -1.822 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -10.682 -9.340 -0.156 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -10.318 -11.045 -0.517 1.00 0.00 H new ATOM 1027 N GLN A 58 -15.432 -10.936 2.158 1.00 0.00 N ATOM 1028 CA GLN A 58 -16.277 -11.611 3.148 1.00 0.00 C ATOM 1029 C GLN A 58 -17.768 -11.658 2.774 1.00 0.00 C ATOM 1030 O GLN A 58 -18.474 -12.522 3.286 1.00 0.00 O ATOM 1031 CB GLN A 58 -16.077 -10.975 4.534 1.00 0.00 C ATOM 1032 CG GLN A 58 -15.067 -11.746 5.390 1.00 0.00 C ATOM 1033 CD GLN A 58 -15.582 -13.112 5.838 1.00 0.00 C ATOM 1034 OE1 GLN A 58 -16.402 -13.221 6.733 1.00 0.00 O ATOM 1035 NE2 GLN A 58 -15.085 -14.203 5.286 1.00 0.00 N ATOM 0 H GLN A 58 -14.893 -10.156 2.535 1.00 0.00 H new ATOM 0 HA GLN A 58 -15.952 -12.651 3.169 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -15.737 -9.947 4.413 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -17.034 -10.935 5.054 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -14.146 -11.880 4.823 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -14.817 -11.152 6.269 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -14.398 -14.127 4.536 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -15.388 -15.122 5.609 1.00 0.00 H new ATOM 1044 N GLU A 59 -18.227 -10.801 1.857 1.00 0.00 N ATOM 1045 CA GLU A 59 -19.581 -10.852 1.302 1.00 0.00 C ATOM 1046 C GLU A 59 -19.833 -12.099 0.426 1.00 0.00 C ATOM 1047 O GLU A 59 -20.941 -12.626 0.459 1.00 0.00 O ATOM 1048 CB GLU A 59 -19.870 -9.588 0.464 1.00 0.00 C ATOM 1049 CG GLU A 59 -19.464 -8.231 1.076 1.00 0.00 C ATOM 1050 CD GLU A 59 -20.275 -7.777 2.300 1.00 0.00 C ATOM 1051 OE1 GLU A 59 -20.721 -8.643 3.084 1.00 0.00 O ATOM 1052 OE2 GLU A 59 -20.411 -6.542 2.453 1.00 0.00 O ATOM 0 H GLU A 59 -17.661 -10.043 1.475 1.00 0.00 H new ATOM 0 HA GLU A 59 -20.254 -10.906 2.158 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -19.360 -9.693 -0.494 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -20.939 -9.558 0.254 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -18.413 -8.282 1.360 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -19.549 -7.466 0.304 1.00 0.00 H new ATOM 1059 N GLU A 60 -18.842 -12.556 -0.364 1.00 0.00 N ATOM 1060 CA GLU A 60 -19.022 -13.567 -1.438 1.00 0.00 C ATOM 1061 C GLU A 60 -17.747 -14.333 -1.854 1.00 0.00 C ATOM 1062 O GLU A 60 -17.819 -15.499 -2.233 1.00 0.00 O ATOM 1063 CB GLU A 60 -19.553 -12.875 -2.718 1.00 0.00 C ATOM 1064 CG GLU A 60 -21.080 -12.847 -2.878 1.00 0.00 C ATOM 1065 CD GLU A 60 -21.651 -14.218 -3.270 1.00 0.00 C ATOM 1066 OE1 GLU A 60 -21.641 -15.128 -2.412 1.00 0.00 O ATOM 1067 OE2 GLU A 60 -22.082 -14.346 -4.438 1.00 0.00 O ATOM 0 H GLU A 60 -17.879 -12.232 -0.277 1.00 0.00 H new ATOM 0 HA GLU A 60 -19.715 -14.291 -1.010 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -19.186 -11.849 -2.732 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -19.125 -13.379 -3.585 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -21.535 -12.520 -1.943 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -21.350 -12.113 -3.637 1.00 0.00 H new ATOM 1074 N GLY A 61 -16.577 -13.684 -1.865 1.00 0.00 N ATOM 1075 CA GLY A 61 -15.290 -14.262 -2.270 1.00 0.00 C ATOM 1076 C GLY A 61 -14.848 -13.879 -3.687 1.00 0.00 C ATOM 1077 O GLY A 61 -13.674 -13.579 -3.893 1.00 0.00 O ATOM 0 H GLY A 61 -16.497 -12.707 -1.582 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -14.523 -13.944 -1.564 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -15.355 -15.348 -2.203 1.00 0.00 H new ATOM 1081 N LEU A 62 -15.776 -13.814 -4.653 1.00 0.00 N ATOM 1082 CA LEU A 62 -15.536 -13.321 -6.024 1.00 0.00 C ATOM 1083 C LEU A 62 -14.831 -11.953 -6.027 1.00 0.00 C ATOM 1084 O LEU A 62 -13.905 -11.737 -6.813 1.00 0.00 O ATOM 1085 CB LEU A 62 -16.883 -13.317 -6.774 1.00 0.00 C ATOM 1086 CG LEU A 62 -17.000 -12.413 -8.019 1.00 0.00 C ATOM 1087 CD1 LEU A 62 -16.025 -12.754 -9.154 1.00 0.00 C ATOM 1088 CD2 LEU A 62 -18.421 -12.523 -8.575 1.00 0.00 C ATOM 0 H LEU A 62 -16.740 -14.110 -4.502 1.00 0.00 H new ATOM 0 HA LEU A 62 -14.848 -13.985 -6.548 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -17.102 -14.340 -7.079 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -17.660 -13.022 -6.069 1.00 0.00 H new ATOM 0 HG LEU A 62 -16.751 -11.407 -7.680 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -16.180 -12.067 -9.986 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -15.000 -12.662 -8.794 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -16.201 -13.776 -9.490 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -18.517 -11.888 -9.456 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -18.625 -13.558 -8.849 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -19.134 -12.201 -7.816 1.00 0.00 H new ATOM 1100 N SER A 63 -15.187 -11.081 -5.076 1.00 0.00 N ATOM 1101 CA SER A 63 -14.537 -9.802 -4.790 1.00 0.00 C ATOM 1102 C SER A 63 -13.019 -9.874 -4.576 1.00 0.00 C ATOM 1103 O SER A 63 -12.406 -8.815 -4.539 1.00 0.00 O ATOM 1104 CB SER A 63 -15.148 -9.177 -3.541 1.00 0.00 C ATOM 1105 OG SER A 63 -16.537 -8.970 -3.647 1.00 0.00 O ATOM 0 H SER A 63 -15.976 -11.260 -4.455 1.00 0.00 H new ATOM 0 HA SER A 63 -14.706 -9.203 -5.685 1.00 0.00 H new ATOM 0 HB2 SER A 63 -14.947 -9.821 -2.685 1.00 0.00 H new ATOM 0 HB3 SER A 63 -14.659 -8.223 -3.344 1.00 0.00 H new ATOM 0 HG SER A 63 -16.917 -8.837 -2.754 1.00 0.00 H new ATOM 1111 N VAL A 64 -12.383 -11.051 -4.479 1.00 0.00 N ATOM 1112 CA VAL A 64 -10.938 -11.171 -4.716 1.00 0.00 C ATOM 1113 C VAL A 64 -10.647 -10.648 -6.126 1.00 0.00 C ATOM 1114 O VAL A 64 -10.216 -9.508 -6.282 1.00 0.00 O ATOM 1115 CB VAL A 64 -10.424 -12.614 -4.504 1.00 0.00 C ATOM 1116 CG1 VAL A 64 -8.945 -12.729 -4.881 1.00 0.00 C ATOM 1117 CG2 VAL A 64 -10.518 -13.080 -3.047 1.00 0.00 C ATOM 0 H VAL A 64 -12.844 -11.929 -4.239 1.00 0.00 H new ATOM 0 HA VAL A 64 -10.396 -10.571 -3.985 1.00 0.00 H new ATOM 0 HB VAL A 64 -11.062 -13.231 -5.136 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -8.608 -13.753 -4.723 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -8.815 -12.462 -5.930 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.357 -12.054 -4.259 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.142 -14.100 -2.966 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -9.921 -12.422 -2.415 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -11.558 -13.050 -2.722 1.00 0.00 H new ATOM 1127 N SER A 65 -10.917 -11.444 -7.167 1.00 0.00 N ATOM 1128 CA SER A 65 -10.614 -11.042 -8.540 1.00 0.00 C ATOM 1129 C SER A 65 -11.442 -9.832 -8.974 1.00 0.00 C ATOM 1130 O SER A 65 -10.930 -8.992 -9.713 1.00 0.00 O ATOM 1131 CB SER A 65 -10.834 -12.207 -9.506 1.00 0.00 C ATOM 1132 OG SER A 65 -10.099 -11.978 -10.692 1.00 0.00 O ATOM 0 H SER A 65 -11.343 -12.367 -7.083 1.00 0.00 H new ATOM 0 HA SER A 65 -9.563 -10.753 -8.568 1.00 0.00 H new ATOM 0 HB2 SER A 65 -10.518 -13.142 -9.044 1.00 0.00 H new ATOM 0 HB3 SER A 65 -11.895 -12.308 -9.736 1.00 0.00 H new ATOM 0 HG SER A 65 -10.237 -12.724 -11.312 1.00 0.00 H new ATOM 1138 N GLU A 66 -12.698 -9.729 -8.513 1.00 0.00 N ATOM 1139 CA GLU A 66 -13.574 -8.610 -8.852 1.00 0.00 C ATOM 1140 C GLU A 66 -13.106 -7.298 -8.231 1.00 0.00 C ATOM 1141 O GLU A 66 -12.853 -6.357 -8.975 1.00 0.00 O ATOM 1142 CB GLU A 66 -15.043 -8.883 -8.481 1.00 0.00 C ATOM 1143 CG GLU A 66 -15.931 -8.793 -9.728 1.00 0.00 C ATOM 1144 CD GLU A 66 -17.423 -8.664 -9.404 1.00 0.00 C ATOM 1145 OE1 GLU A 66 -17.841 -9.101 -8.310 1.00 0.00 O ATOM 1146 OE2 GLU A 66 -18.121 -8.075 -10.258 1.00 0.00 O ATOM 0 H GLU A 66 -13.128 -10.419 -7.897 1.00 0.00 H new ATOM 0 HA GLU A 66 -13.515 -8.508 -9.936 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -15.134 -9.872 -8.032 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.377 -8.162 -7.735 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -15.621 -7.935 -10.325 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.775 -9.681 -10.341 1.00 0.00 H new ATOM 1153 N ALA A 67 -12.988 -7.199 -6.897 1.00 0.00 N ATOM 1154 CA ALA A 67 -12.639 -5.925 -6.279 1.00 0.00 C ATOM 1155 C ALA A 67 -11.169 -5.552 -6.533 1.00 0.00 C ATOM 1156 O ALA A 67 -10.872 -4.362 -6.579 1.00 0.00 O ATOM 1157 CB ALA A 67 -13.040 -5.881 -4.802 1.00 0.00 C ATOM 0 H ALA A 67 -13.127 -7.971 -6.245 1.00 0.00 H new ATOM 0 HA ALA A 67 -13.227 -5.146 -6.765 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -12.763 -4.916 -4.378 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -14.117 -6.020 -4.713 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -12.526 -6.676 -4.261 1.00 0.00 H new ATOM 1163 N ILE A 68 -10.278 -6.526 -6.813 1.00 0.00 N ATOM 1164 CA ILE A 68 -8.975 -6.260 -7.441 1.00 0.00 C ATOM 1165 C ILE A 68 -9.173 -5.575 -8.797 1.00 0.00 C ATOM 1166 O ILE A 68 -8.724 -4.444 -8.965 1.00 0.00 O ATOM 1167 CB ILE A 68 -8.103 -7.537 -7.559 1.00 0.00 C ATOM 1168 CG1 ILE A 68 -7.623 -7.957 -6.155 1.00 0.00 C ATOM 1169 CG2 ILE A 68 -6.856 -7.268 -8.435 1.00 0.00 C ATOM 1170 CD1 ILE A 68 -7.029 -9.373 -6.048 1.00 0.00 C ATOM 0 H ILE A 68 -10.444 -7.512 -6.610 1.00 0.00 H new ATOM 0 HA ILE A 68 -8.423 -5.581 -6.790 1.00 0.00 H new ATOM 0 HB ILE A 68 -8.705 -8.323 -8.015 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -6.872 -7.242 -5.819 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -8.465 -7.883 -5.466 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -6.258 -8.176 -8.505 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -7.171 -6.963 -9.433 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -6.259 -6.475 -7.985 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -6.725 -9.563 -5.019 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -7.779 -10.106 -6.346 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -6.162 -9.454 -6.704 1.00 0.00 H new ATOM 1182 N ALA A 69 -9.828 -6.228 -9.769 1.00 0.00 N ATOM 1183 CA ALA A 69 -10.013 -5.655 -11.104 1.00 0.00 C ATOM 1184 C ALA A 69 -10.712 -4.285 -11.055 1.00 0.00 C ATOM 1185 O ALA A 69 -10.246 -3.347 -11.698 1.00 0.00 O ATOM 1186 CB ALA A 69 -10.762 -6.657 -11.986 1.00 0.00 C ATOM 0 H ALA A 69 -10.238 -7.155 -9.652 1.00 0.00 H new ATOM 0 HA ALA A 69 -9.033 -5.469 -11.544 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -10.901 -6.233 -12.981 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -10.184 -7.578 -12.062 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -11.735 -6.874 -11.545 1.00 0.00 H new ATOM 1192 N GLN A 70 -11.765 -4.149 -10.238 1.00 0.00 N ATOM 1193 CA GLN A 70 -12.448 -2.887 -9.951 1.00 0.00 C ATOM 1194 C GLN A 70 -11.473 -1.842 -9.398 1.00 0.00 C ATOM 1195 O GLN A 70 -11.275 -0.833 -10.063 1.00 0.00 O ATOM 1196 CB GLN A 70 -13.637 -3.101 -9.005 1.00 0.00 C ATOM 1197 CG GLN A 70 -14.801 -3.874 -9.654 1.00 0.00 C ATOM 1198 CD GLN A 70 -15.840 -4.322 -8.625 1.00 0.00 C ATOM 1199 OE1 GLN A 70 -16.138 -3.631 -7.663 1.00 0.00 O ATOM 1200 NE2 GLN A 70 -16.436 -5.488 -8.790 1.00 0.00 N ATOM 0 H GLN A 70 -12.176 -4.942 -9.744 1.00 0.00 H new ATOM 0 HA GLN A 70 -12.843 -2.502 -10.891 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -13.297 -3.643 -8.123 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -14.000 -2.132 -8.663 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -15.281 -3.244 -10.402 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -14.409 -4.747 -10.176 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -16.196 -6.075 -9.589 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -17.136 -5.802 -8.118 1.00 0.00 H new ATOM 1209 N VAL A 71 -10.823 -2.059 -8.244 1.00 0.00 N ATOM 1210 CA VAL A 71 -9.913 -1.055 -7.656 1.00 0.00 C ATOM 1211 C VAL A 71 -8.658 -0.793 -8.512 1.00 0.00 C ATOM 1212 O VAL A 71 -8.000 0.230 -8.341 1.00 0.00 O ATOM 1213 CB VAL A 71 -9.579 -1.400 -6.187 1.00 0.00 C ATOM 1214 CG1 VAL A 71 -8.391 -2.358 -6.033 1.00 0.00 C ATOM 1215 CG2 VAL A 71 -9.322 -0.131 -5.364 1.00 0.00 C ATOM 0 H VAL A 71 -10.908 -2.917 -7.699 1.00 0.00 H new ATOM 0 HA VAL A 71 -10.449 -0.106 -7.652 1.00 0.00 H new ATOM 0 HB VAL A 71 -10.460 -1.917 -5.806 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -8.216 -2.554 -4.975 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -8.611 -3.295 -6.544 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -7.500 -1.907 -6.470 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -9.090 -0.406 -4.335 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -8.482 0.416 -5.792 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -10.211 0.499 -5.379 1.00 0.00 H new ATOM 1225 N LYS A 72 -8.329 -1.682 -9.463 1.00 0.00 N ATOM 1226 CA LYS A 72 -7.310 -1.451 -10.496 1.00 0.00 C ATOM 1227 C LYS A 72 -7.826 -0.642 -11.695 1.00 0.00 C ATOM 1228 O LYS A 72 -7.012 0.070 -12.281 1.00 0.00 O ATOM 1229 CB LYS A 72 -6.723 -2.793 -10.972 1.00 0.00 C ATOM 1230 CG LYS A 72 -5.911 -3.557 -9.908 1.00 0.00 C ATOM 1231 CD LYS A 72 -4.405 -3.254 -9.888 1.00 0.00 C ATOM 1232 CE LYS A 72 -4.065 -1.859 -9.344 1.00 0.00 C ATOM 1233 NZ LYS A 72 -3.527 -0.959 -10.394 1.00 0.00 N ATOM 0 H LYS A 72 -8.773 -2.598 -9.536 1.00 0.00 H new ATOM 0 HA LYS A 72 -6.530 -0.848 -10.031 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.539 -3.430 -11.313 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -6.082 -2.608 -11.834 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -6.324 -3.328 -8.926 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -6.048 -4.626 -10.069 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -3.900 -4.005 -9.280 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -4.011 -3.346 -10.900 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -4.960 -1.413 -8.910 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -3.334 -1.953 -8.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -3.313 -0.030 -9.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -2.658 -1.369 -10.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -4.233 -0.846 -11.149 1.00 0.00 H new ATOM 1247 N THR A 73 -9.116 -0.723 -12.063 1.00 0.00 N ATOM 1248 CA THR A 73 -9.722 0.111 -13.122 1.00 0.00 C ATOM 1249 C THR A 73 -10.375 1.405 -12.613 1.00 0.00 C ATOM 1250 O THR A 73 -10.651 2.291 -13.422 1.00 0.00 O ATOM 1251 CB THR A 73 -10.722 -0.669 -14.002 1.00 0.00 C ATOM 1252 OG1 THR A 73 -11.016 0.149 -15.113 1.00 0.00 O ATOM 1253 CG2 THR A 73 -12.057 -1.060 -13.349 1.00 0.00 C ATOM 0 H THR A 73 -9.774 -1.373 -11.633 1.00 0.00 H new ATOM 0 HA THR A 73 -8.870 0.403 -13.736 1.00 0.00 H new ATOM 0 HB THR A 73 -10.233 -1.614 -14.238 1.00 0.00 H new ATOM 0 HG1 THR A 73 -10.928 1.091 -14.858 1.00 0.00 H new ATOM 0 HG21 THR A 73 -12.669 -1.602 -14.069 1.00 0.00 H new ATOM 0 HG22 THR A 73 -11.867 -1.695 -12.484 1.00 0.00 H new ATOM 0 HG23 THR A 73 -12.583 -0.160 -13.030 1.00 0.00 H new ATOM 1261 N GLU A 74 -10.647 1.508 -11.312 1.00 0.00 N ATOM 1262 CA GLU A 74 -11.143 2.684 -10.601 1.00 0.00 C ATOM 1263 C GLU A 74 -9.969 3.632 -10.294 1.00 0.00 C ATOM 1264 O GLU A 74 -9.088 3.267 -9.512 1.00 0.00 O ATOM 1265 CB GLU A 74 -11.845 2.214 -9.312 1.00 0.00 C ATOM 1266 CG GLU A 74 -12.342 3.356 -8.416 1.00 0.00 C ATOM 1267 CD GLU A 74 -13.180 2.829 -7.241 1.00 0.00 C ATOM 1268 OE1 GLU A 74 -12.625 2.062 -6.420 1.00 0.00 O ATOM 1269 OE2 GLU A 74 -14.372 3.204 -7.170 1.00 0.00 O ATOM 0 H GLU A 74 -10.517 0.715 -10.684 1.00 0.00 H new ATOM 0 HA GLU A 74 -11.861 3.233 -11.211 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -12.692 1.584 -9.582 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -11.155 1.593 -8.741 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -11.489 3.916 -8.033 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -12.939 4.050 -9.008 1.00 0.00 H new ATOM 1276 N PRO A 75 -9.906 4.837 -10.892 1.00 0.00 N ATOM 1277 CA PRO A 75 -8.873 5.808 -10.548 1.00 0.00 C ATOM 1278 C PRO A 75 -9.112 6.389 -9.138 1.00 0.00 C ATOM 1279 O PRO A 75 -10.261 6.492 -8.703 1.00 0.00 O ATOM 1280 CB PRO A 75 -8.959 6.881 -11.638 1.00 0.00 C ATOM 1281 CG PRO A 75 -10.434 6.858 -12.038 1.00 0.00 C ATOM 1282 CD PRO A 75 -10.818 5.385 -11.885 1.00 0.00 C ATOM 0 HA PRO A 75 -7.879 5.363 -10.511 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -8.659 7.860 -11.264 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -8.310 6.650 -12.482 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -11.035 7.499 -11.394 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -10.579 7.207 -13.060 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -11.854 5.283 -11.562 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -10.726 4.857 -12.834 1.00 0.00 H new ATOM 1290 N PRO A 76 -8.049 6.809 -8.425 1.00 0.00 N ATOM 1291 CA PRO A 76 -8.168 7.361 -7.077 1.00 0.00 C ATOM 1292 C PRO A 76 -8.850 8.739 -7.078 1.00 0.00 C ATOM 1293 O PRO A 76 -8.853 9.453 -8.085 1.00 0.00 O ATOM 1294 CB PRO A 76 -6.730 7.421 -6.549 1.00 0.00 C ATOM 1295 CG PRO A 76 -5.900 7.621 -7.815 1.00 0.00 C ATOM 1296 CD PRO A 76 -6.654 6.779 -8.842 1.00 0.00 C ATOM 0 HA PRO A 76 -8.803 6.746 -6.439 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -6.594 8.242 -5.845 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -6.454 6.504 -6.028 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -5.852 8.670 -8.107 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -4.873 7.279 -7.685 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -6.536 7.187 -9.846 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -6.274 5.758 -8.866 1.00 0.00 H new ATOM 1304 N ARG A 77 -9.429 9.109 -5.929 1.00 0.00 N ATOM 1305 CA ARG A 77 -10.088 10.397 -5.697 1.00 0.00 C ATOM 1306 C ARG A 77 -10.030 10.784 -4.217 1.00 0.00 C ATOM 1307 O ARG A 77 -10.708 10.180 -3.387 1.00 0.00 O ATOM 1308 CB ARG A 77 -11.549 10.373 -6.196 1.00 0.00 C ATOM 1309 CG ARG A 77 -11.717 11.189 -7.486 1.00 0.00 C ATOM 1310 CD ARG A 77 -13.192 11.555 -7.696 1.00 0.00 C ATOM 1311 NE ARG A 77 -13.402 12.330 -8.932 1.00 0.00 N ATOM 1312 CZ ARG A 77 -13.087 13.602 -9.152 1.00 0.00 C ATOM 1313 NH1 ARG A 77 -12.502 14.352 -8.243 1.00 0.00 N ATOM 1314 NH2 ARG A 77 -13.362 14.152 -10.312 1.00 0.00 N ATOM 0 H ARG A 77 -9.452 8.500 -5.111 1.00 0.00 H new ATOM 0 HA ARG A 77 -9.548 11.152 -6.268 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -11.857 9.343 -6.373 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -12.205 10.773 -5.423 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -11.114 12.096 -7.432 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -11.353 10.615 -8.338 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -13.789 10.644 -7.735 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -13.547 12.132 -6.842 1.00 0.00 H new ATOM 0 HE ARG A 77 -13.839 11.833 -9.708 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -12.274 13.961 -7.329 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -12.277 15.325 -8.452 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -13.816 13.603 -11.042 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -13.121 15.128 -10.483 1.00 0.00 H new ATOM 1328 N GLU A 78 -9.251 11.824 -3.929 1.00 0.00 N ATOM 1329 CA GLU A 78 -9.169 12.531 -2.648 1.00 0.00 C ATOM 1330 C GLU A 78 -9.884 13.893 -2.701 1.00 0.00 C ATOM 1331 O GLU A 78 -10.147 14.387 -3.824 1.00 0.00 O ATOM 1332 CB GLU A 78 -7.694 12.673 -2.223 1.00 0.00 C ATOM 1333 CG GLU A 78 -6.916 11.343 -2.156 1.00 0.00 C ATOM 1334 CD GLU A 78 -6.235 10.972 -3.487 1.00 0.00 C ATOM 1335 OE1 GLU A 78 -5.098 11.449 -3.701 1.00 0.00 O ATOM 1336 OE2 GLU A 78 -6.843 10.211 -4.277 1.00 0.00 O ATOM 1337 OXT GLU A 78 -10.181 14.409 -1.601 1.00 0.00 O ATOM 0 H GLU A 78 -8.620 12.222 -4.625 1.00 0.00 H new ATOM 0 HA GLU A 78 -9.689 11.941 -1.893 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -7.190 13.339 -2.923 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.656 13.151 -1.244 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -6.159 11.411 -1.374 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -7.599 10.544 -1.869 1.00 0.00 H new TER 1344 GLU A 78