USER MOD reduce.3.24.130724 H: found=0, std=0, add=573, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 576 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 4 MET CE :methyl -159:sc= -0.124 (180deg=-0.766) USER MOD Single : A 8 MET CE :methyl -140:sc= -1.12 (180deg=-4.21!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 34:sc= 0.745 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ -142:sc= 1.31 (180deg=0.752) USER MOD Single : A 23 SER OG : rot -111:sc= 1.12 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot -22:sc= 0.599 USER MOD Single : A 46 LYS NZ :NH3+ -153:sc= 0.145 (180deg=-0.779) USER MOD Single : A 47 LYS NZ :NH3+ -156:sc= 2.15 (180deg=1.98) USER MOD Single : A 48 ASN : amide:sc= -0.0827 X(o=-0.083,f=-0.39) USER MOD Single : A 50 GLN : amide:sc= -0.847 K(o=-0.85,f=-5!) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 4 16.284 18.254 4.621 1.00 0.00 N ATOM 2 CA MET A 4 14.827 18.047 4.736 1.00 0.00 C ATOM 3 C MET A 4 14.455 16.660 4.240 1.00 0.00 C ATOM 4 O MET A 4 14.913 16.228 3.182 1.00 0.00 O ATOM 5 CB MET A 4 14.069 19.107 3.931 1.00 0.00 C ATOM 6 CG MET A 4 12.558 18.989 4.052 1.00 0.00 C ATOM 7 SD MET A 4 11.678 20.212 3.068 1.00 0.00 S ATOM 8 CE MET A 4 12.315 21.729 3.772 1.00 0.00 C ATOM 0 HA MET A 4 14.548 18.138 5.786 1.00 0.00 H new ATOM 0 HB2 MET A 4 14.377 20.097 4.267 1.00 0.00 H new ATOM 0 HB3 MET A 4 14.350 19.025 2.881 1.00 0.00 H new ATOM 0 HG2 MET A 4 12.251 17.991 3.741 1.00 0.00 H new ATOM 0 HG3 MET A 4 12.273 19.099 5.098 1.00 0.00 H new ATOM 0 HE1 MET A 4 11.628 22.547 3.556 1.00 0.00 H new ATOM 0 HE2 MET A 4 12.415 21.615 4.851 1.00 0.00 H new ATOM 0 HE3 MET A 4 13.290 21.950 3.338 1.00 0.00 H new ATOM 20 N VAL A 5 13.628 15.965 4.999 1.00 0.00 N ATOM 21 CA VAL A 5 13.190 14.634 4.615 1.00 0.00 C ATOM 22 C VAL A 5 11.981 14.722 3.692 1.00 0.00 C ATOM 23 O VAL A 5 10.870 15.029 4.128 1.00 0.00 O ATOM 24 CB VAL A 5 12.839 13.772 5.849 1.00 0.00 C ATOM 25 CG1 VAL A 5 12.453 12.360 5.431 1.00 0.00 C ATOM 26 CG2 VAL A 5 14.003 13.742 6.830 1.00 0.00 C ATOM 0 H VAL A 5 13.246 16.299 5.884 1.00 0.00 H new ATOM 0 HA VAL A 5 14.017 14.156 4.090 1.00 0.00 H new ATOM 0 HB VAL A 5 11.982 14.225 6.347 1.00 0.00 H new ATOM 0 HG11 VAL A 5 12.210 11.772 6.316 1.00 0.00 H new ATOM 0 HG12 VAL A 5 11.585 12.400 4.773 1.00 0.00 H new ATOM 0 HG13 VAL A 5 13.287 11.896 4.904 1.00 0.00 H new ATOM 0 HG21 VAL A 5 13.737 13.130 7.692 1.00 0.00 H new ATOM 0 HG22 VAL A 5 14.880 13.318 6.341 1.00 0.00 H new ATOM 0 HG23 VAL A 5 14.227 14.756 7.160 1.00 0.00 H new ATOM 36 N ILE A 6 12.209 14.480 2.408 1.00 0.00 N ATOM 37 CA ILE A 6 11.139 14.494 1.423 1.00 0.00 C ATOM 38 C ILE A 6 10.840 13.075 0.969 1.00 0.00 C ATOM 39 O ILE A 6 11.754 12.318 0.643 1.00 0.00 O ATOM 40 CB ILE A 6 11.502 15.369 0.200 1.00 0.00 C ATOM 41 CG1 ILE A 6 11.799 16.803 0.640 1.00 0.00 C ATOM 42 CG2 ILE A 6 10.378 15.360 -0.827 1.00 0.00 C ATOM 43 CD1 ILE A 6 10.620 17.491 1.298 1.00 0.00 C ATOM 0 H ILE A 6 13.131 14.271 2.024 1.00 0.00 H new ATOM 0 HA ILE A 6 10.256 14.925 1.894 1.00 0.00 H new ATOM 0 HB ILE A 6 12.395 14.949 -0.263 1.00 0.00 H new ATOM 0 HG12 ILE A 6 12.639 16.795 1.335 1.00 0.00 H new ATOM 0 HG13 ILE A 6 12.110 17.384 -0.228 1.00 0.00 H new ATOM 0 HG21 ILE A 6 10.657 15.982 -1.677 1.00 0.00 H new ATOM 0 HG22 ILE A 6 10.203 14.339 -1.166 1.00 0.00 H new ATOM 0 HG23 ILE A 6 9.468 15.752 -0.374 1.00 0.00 H new ATOM 0 HD11 ILE A 6 10.903 18.504 1.584 1.00 0.00 H new ATOM 0 HD12 ILE A 6 9.785 17.531 0.598 1.00 0.00 H new ATOM 0 HD13 ILE A 6 10.322 16.933 2.186 1.00 0.00 H new ATOM 55 N GLY A 7 9.568 12.712 0.966 1.00 0.00 N ATOM 56 CA GLY A 7 9.188 11.362 0.627 1.00 0.00 C ATOM 57 C GLY A 7 8.886 10.557 1.867 1.00 0.00 C ATOM 58 O GLY A 7 8.568 11.129 2.912 1.00 0.00 O ATOM 0 H GLY A 7 8.791 13.332 1.193 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.312 11.379 -0.022 1.00 0.00 H new ATOM 0 HA3 GLY A 7 9.991 10.884 0.066 1.00 0.00 H new ATOM 62 N MET A 8 8.985 9.241 1.766 1.00 0.00 N ATOM 63 CA MET A 8 8.703 8.378 2.902 1.00 0.00 C ATOM 64 C MET A 8 9.318 6.995 2.719 1.00 0.00 C ATOM 65 O MET A 8 9.511 6.530 1.590 1.00 0.00 O ATOM 66 CB MET A 8 7.189 8.248 3.120 1.00 0.00 C ATOM 67 CG MET A 8 6.448 7.484 2.027 1.00 0.00 C ATOM 68 SD MET A 8 6.384 8.364 0.451 1.00 0.00 S ATOM 69 CE MET A 8 5.486 7.184 -0.547 1.00 0.00 C ATOM 0 H MET A 8 9.257 8.749 0.915 1.00 0.00 H new ATOM 0 HA MET A 8 9.153 8.839 3.781 1.00 0.00 H new ATOM 0 HB2 MET A 8 7.015 7.750 4.074 1.00 0.00 H new ATOM 0 HB3 MET A 8 6.761 9.247 3.200 1.00 0.00 H new ATOM 0 HG2 MET A 8 6.933 6.519 1.876 1.00 0.00 H new ATOM 0 HG3 MET A 8 5.431 7.281 2.362 1.00 0.00 H new ATOM 0 HE1 MET A 8 5.918 7.150 -1.547 1.00 0.00 H new ATOM 0 HE2 MET A 8 5.551 6.197 -0.089 1.00 0.00 H new ATOM 0 HE3 MET A 8 4.441 7.485 -0.614 1.00 0.00 H new ATOM 79 N LYS A 9 9.636 6.355 3.836 1.00 0.00 N ATOM 80 CA LYS A 9 10.092 4.975 3.836 1.00 0.00 C ATOM 81 C LYS A 9 9.093 4.126 4.606 1.00 0.00 C ATOM 82 O LYS A 9 8.840 4.366 5.787 1.00 0.00 O ATOM 83 CB LYS A 9 11.488 4.876 4.460 1.00 0.00 C ATOM 84 CG LYS A 9 12.037 3.458 4.546 1.00 0.00 C ATOM 85 CD LYS A 9 13.472 3.446 5.052 1.00 0.00 C ATOM 86 CE LYS A 9 13.585 4.085 6.427 1.00 0.00 C ATOM 87 NZ LYS A 9 14.999 4.219 6.863 1.00 0.00 N ATOM 0 H LYS A 9 9.585 6.777 4.763 1.00 0.00 H new ATOM 0 HA LYS A 9 10.159 4.609 2.812 1.00 0.00 H new ATOM 0 HB2 LYS A 9 12.178 5.485 3.876 1.00 0.00 H new ATOM 0 HB3 LYS A 9 11.456 5.302 5.463 1.00 0.00 H new ATOM 0 HG2 LYS A 9 11.410 2.864 5.211 1.00 0.00 H new ATOM 0 HG3 LYS A 9 11.993 2.989 3.563 1.00 0.00 H new ATOM 0 HD2 LYS A 9 13.834 2.419 5.096 1.00 0.00 H new ATOM 0 HD3 LYS A 9 14.111 3.979 4.348 1.00 0.00 H new ATOM 0 HE2 LYS A 9 13.116 5.069 6.409 1.00 0.00 H new ATOM 0 HE3 LYS A 9 13.037 3.484 7.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 15.032 4.659 7.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 15.440 3.278 6.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 15.516 4.814 6.185 1.00 0.00 H new ATOM 101 N PHE A 10 8.511 3.147 3.936 1.00 0.00 N ATOM 102 CA PHE A 10 7.445 2.356 4.531 1.00 0.00 C ATOM 103 C PHE A 10 7.603 0.886 4.181 1.00 0.00 C ATOM 104 O PHE A 10 8.404 0.523 3.314 1.00 0.00 O ATOM 105 CB PHE A 10 6.076 2.870 4.067 1.00 0.00 C ATOM 106 CG PHE A 10 5.831 2.744 2.587 1.00 0.00 C ATOM 107 CD1 PHE A 10 6.370 3.660 1.698 1.00 0.00 C ATOM 108 CD2 PHE A 10 5.052 1.712 2.089 1.00 0.00 C ATOM 109 CE1 PHE A 10 6.135 3.550 0.341 1.00 0.00 C ATOM 110 CE2 PHE A 10 4.813 1.597 0.735 1.00 0.00 C ATOM 111 CZ PHE A 10 5.357 2.517 -0.142 1.00 0.00 C ATOM 0 H PHE A 10 8.757 2.880 2.983 1.00 0.00 H new ATOM 0 HA PHE A 10 7.509 2.458 5.614 1.00 0.00 H new ATOM 0 HB2 PHE A 10 5.297 2.324 4.599 1.00 0.00 H new ATOM 0 HB3 PHE A 10 5.980 3.918 4.350 1.00 0.00 H new ATOM 0 HD1 PHE A 10 6.981 4.469 2.070 1.00 0.00 H new ATOM 0 HD2 PHE A 10 4.627 0.989 2.769 1.00 0.00 H new ATOM 0 HE1 PHE A 10 6.560 4.272 -0.341 1.00 0.00 H new ATOM 0 HE2 PHE A 10 4.202 0.789 0.361 1.00 0.00 H new ATOM 0 HZ PHE A 10 5.174 2.428 -1.203 1.00 0.00 H new ATOM 121 N THR A 11 6.845 0.041 4.861 1.00 0.00 N ATOM 122 CA THR A 11 6.892 -1.381 4.601 1.00 0.00 C ATOM 123 C THR A 11 5.557 -1.874 4.050 1.00 0.00 C ATOM 124 O THR A 11 4.488 -1.448 4.491 1.00 0.00 O ATOM 125 CB THR A 11 7.279 -2.186 5.862 1.00 0.00 C ATOM 126 OG1 THR A 11 7.424 -3.573 5.541 1.00 0.00 O ATOM 127 CG2 THR A 11 6.250 -2.022 6.966 1.00 0.00 C ATOM 0 H THR A 11 6.193 0.318 5.595 1.00 0.00 H new ATOM 0 HA THR A 11 7.667 -1.545 3.852 1.00 0.00 H new ATOM 0 HB THR A 11 8.230 -1.795 6.222 1.00 0.00 H new ATOM 0 HG1 THR A 11 7.787 -3.663 4.635 1.00 0.00 H new ATOM 0 HG21 THR A 11 6.555 -2.602 7.837 1.00 0.00 H new ATOM 0 HG22 THR A 11 6.174 -0.970 7.239 1.00 0.00 H new ATOM 0 HG23 THR A 11 5.281 -2.376 6.615 1.00 0.00 H new ATOM 135 N VAL A 12 5.629 -2.752 3.066 1.00 0.00 N ATOM 136 CA VAL A 12 4.440 -3.350 2.486 1.00 0.00 C ATOM 137 C VAL A 12 4.578 -4.866 2.504 1.00 0.00 C ATOM 138 O VAL A 12 5.658 -5.399 2.247 1.00 0.00 O ATOM 139 CB VAL A 12 4.193 -2.848 1.040 1.00 0.00 C ATOM 140 CG1 VAL A 12 5.352 -3.206 0.121 1.00 0.00 C ATOM 141 CG2 VAL A 12 2.884 -3.395 0.485 1.00 0.00 C ATOM 0 H VAL A 12 6.505 -3.068 2.649 1.00 0.00 H new ATOM 0 HA VAL A 12 3.579 -3.052 3.084 1.00 0.00 H new ATOM 0 HB VAL A 12 4.120 -1.761 1.082 1.00 0.00 H new ATOM 0 HG11 VAL A 12 5.146 -2.839 -0.885 1.00 0.00 H new ATOM 0 HG12 VAL A 12 6.267 -2.747 0.494 1.00 0.00 H new ATOM 0 HG13 VAL A 12 5.474 -4.289 0.094 1.00 0.00 H new ATOM 0 HG21 VAL A 12 2.737 -3.026 -0.530 1.00 0.00 H new ATOM 0 HG22 VAL A 12 2.920 -4.484 0.474 1.00 0.00 H new ATOM 0 HG23 VAL A 12 2.057 -3.066 1.114 1.00 0.00 H new ATOM 151 N ILE A 13 3.505 -5.556 2.844 1.00 0.00 N ATOM 152 CA ILE A 13 3.535 -7.006 2.890 1.00 0.00 C ATOM 153 C ILE A 13 2.562 -7.581 1.861 1.00 0.00 C ATOM 154 O ILE A 13 1.366 -7.275 1.867 1.00 0.00 O ATOM 155 CB ILE A 13 3.247 -7.527 4.333 1.00 0.00 C ATOM 156 CG1 ILE A 13 3.507 -9.041 4.468 1.00 0.00 C ATOM 157 CG2 ILE A 13 1.833 -7.180 4.782 1.00 0.00 C ATOM 158 CD1 ILE A 13 2.414 -9.937 3.912 1.00 0.00 C ATOM 0 H ILE A 13 2.607 -5.139 3.091 1.00 0.00 H new ATOM 0 HA ILE A 13 4.536 -7.350 2.629 1.00 0.00 H new ATOM 0 HB ILE A 13 3.947 -7.015 4.993 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.442 -9.279 3.962 1.00 0.00 H new ATOM 0 HG13 ILE A 13 3.646 -9.277 5.523 1.00 0.00 H new ATOM 0 HG21 ILE A 13 1.668 -7.558 5.791 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.704 -6.098 4.775 1.00 0.00 H new ATOM 0 HG23 ILE A 13 1.113 -7.635 4.102 1.00 0.00 H new ATOM 0 HD11 ILE A 13 2.692 -10.981 4.055 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.478 -9.736 4.433 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.287 -9.738 2.848 1.00 0.00 H new ATOM 170 N THR A 14 3.102 -8.378 0.948 1.00 0.00 N ATOM 171 CA THR A 14 2.309 -9.018 -0.091 1.00 0.00 C ATOM 172 C THR A 14 2.636 -10.509 -0.157 1.00 0.00 C ATOM 173 O THR A 14 3.240 -11.060 0.766 1.00 0.00 O ATOM 174 CB THR A 14 2.579 -8.382 -1.473 1.00 0.00 C ATOM 175 OG1 THR A 14 3.973 -8.478 -1.793 1.00 0.00 O ATOM 176 CG2 THR A 14 2.142 -6.923 -1.507 1.00 0.00 C ATOM 0 H THR A 14 4.097 -8.598 0.907 1.00 0.00 H new ATOM 0 HA THR A 14 1.258 -8.878 0.161 1.00 0.00 H new ATOM 0 HB THR A 14 1.996 -8.929 -2.214 1.00 0.00 H new ATOM 0 HG1 THR A 14 4.136 -8.074 -2.671 1.00 0.00 H new ATOM 0 HG21 THR A 14 2.346 -6.505 -2.493 1.00 0.00 H new ATOM 0 HG22 THR A 14 1.074 -6.858 -1.299 1.00 0.00 H new ATOM 0 HG23 THR A 14 2.693 -6.360 -0.754 1.00 0.00 H new ATOM 184 N ASP A 15 2.253 -11.155 -1.253 1.00 0.00 N ATOM 185 CA ASP A 15 2.538 -12.573 -1.447 1.00 0.00 C ATOM 186 C ASP A 15 4.027 -12.800 -1.676 1.00 0.00 C ATOM 187 O ASP A 15 4.540 -13.894 -1.452 1.00 0.00 O ATOM 188 CB ASP A 15 1.738 -13.129 -2.628 1.00 0.00 C ATOM 189 CG ASP A 15 2.039 -12.415 -3.933 1.00 0.00 C ATOM 190 OD1 ASP A 15 1.603 -11.257 -4.091 1.00 0.00 O ATOM 191 OD2 ASP A 15 2.704 -13.011 -4.805 1.00 0.00 O ATOM 0 H ASP A 15 1.744 -10.719 -2.022 1.00 0.00 H new ATOM 0 HA ASP A 15 2.240 -13.101 -0.541 1.00 0.00 H new ATOM 0 HB2 ASP A 15 1.957 -14.191 -2.741 1.00 0.00 H new ATOM 0 HB3 ASP A 15 0.673 -13.045 -2.411 1.00 0.00 H new ATOM 196 N ASP A 16 4.722 -11.752 -2.109 1.00 0.00 N ATOM 197 CA ASP A 16 6.161 -11.831 -2.337 1.00 0.00 C ATOM 198 C ASP A 16 6.910 -11.648 -1.021 1.00 0.00 C ATOM 199 O ASP A 16 8.115 -11.887 -0.928 1.00 0.00 O ATOM 200 CB ASP A 16 6.592 -10.769 -3.356 1.00 0.00 C ATOM 201 CG ASP A 16 8.053 -10.891 -3.750 1.00 0.00 C ATOM 202 OD1 ASP A 16 8.363 -11.681 -4.663 1.00 0.00 O ATOM 203 OD2 ASP A 16 8.897 -10.189 -3.158 1.00 0.00 O ATOM 0 H ASP A 16 4.312 -10.839 -2.309 1.00 0.00 H new ATOM 0 HA ASP A 16 6.404 -12.814 -2.739 1.00 0.00 H new ATOM 0 HB2 ASP A 16 5.971 -10.855 -4.248 1.00 0.00 H new ATOM 0 HB3 ASP A 16 6.415 -9.778 -2.938 1.00 0.00 H new ATOM 208 N GLY A 17 6.182 -11.239 0.008 1.00 0.00 N ATOM 209 CA GLY A 17 6.777 -11.056 1.313 1.00 0.00 C ATOM 210 C GLY A 17 6.611 -9.641 1.819 1.00 0.00 C ATOM 211 O GLY A 17 5.845 -8.862 1.256 1.00 0.00 O ATOM 0 H GLY A 17 5.185 -11.030 -0.040 1.00 0.00 H new ATOM 0 HA2 GLY A 17 6.321 -11.749 2.020 1.00 0.00 H new ATOM 0 HA3 GLY A 17 7.838 -11.302 1.265 1.00 0.00 H new ATOM 215 N LYS A 18 7.327 -9.308 2.880 1.00 0.00 N ATOM 216 CA LYS A 18 7.257 -7.981 3.466 1.00 0.00 C ATOM 217 C LYS A 18 8.501 -7.189 3.083 1.00 0.00 C ATOM 218 O LYS A 18 9.612 -7.547 3.466 1.00 0.00 O ATOM 219 CB LYS A 18 7.135 -8.089 4.988 1.00 0.00 C ATOM 220 CG LYS A 18 6.928 -6.757 5.690 1.00 0.00 C ATOM 221 CD LYS A 18 6.814 -6.940 7.194 1.00 0.00 C ATOM 222 CE LYS A 18 5.572 -7.732 7.571 1.00 0.00 C ATOM 223 NZ LYS A 18 5.543 -8.056 9.021 1.00 0.00 N ATOM 0 H LYS A 18 7.967 -9.944 3.355 1.00 0.00 H new ATOM 0 HA LYS A 18 6.378 -7.461 3.086 1.00 0.00 H new ATOM 0 HB2 LYS A 18 6.301 -8.748 5.229 1.00 0.00 H new ATOM 0 HB3 LYS A 18 8.036 -8.559 5.382 1.00 0.00 H new ATOM 0 HG2 LYS A 18 7.761 -6.091 5.464 1.00 0.00 H new ATOM 0 HG3 LYS A 18 6.025 -6.279 5.310 1.00 0.00 H new ATOM 0 HD2 LYS A 18 7.700 -7.454 7.566 1.00 0.00 H new ATOM 0 HD3 LYS A 18 6.784 -5.964 7.678 1.00 0.00 H new ATOM 0 HE2 LYS A 18 4.682 -7.159 7.309 1.00 0.00 H new ATOM 0 HE3 LYS A 18 5.540 -8.655 6.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 4.681 -8.596 9.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 6.379 -8.624 9.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 5.548 -7.175 9.574 1.00 0.00 H new ATOM 237 N LYS A 19 8.313 -6.126 2.320 1.00 0.00 N ATOM 238 CA LYS A 19 9.431 -5.355 1.791 1.00 0.00 C ATOM 239 C LYS A 19 9.502 -3.959 2.401 1.00 0.00 C ATOM 240 O LYS A 19 8.497 -3.418 2.866 1.00 0.00 O ATOM 241 CB LYS A 19 9.313 -5.229 0.270 1.00 0.00 C ATOM 242 CG LYS A 19 10.238 -6.150 -0.510 1.00 0.00 C ATOM 243 CD LYS A 19 9.872 -7.616 -0.345 1.00 0.00 C ATOM 244 CE LYS A 19 10.847 -8.507 -1.097 1.00 0.00 C ATOM 245 NZ LYS A 19 10.483 -9.946 -1.005 1.00 0.00 N ATOM 0 H LYS A 19 7.394 -5.774 2.051 1.00 0.00 H new ATOM 0 HA LYS A 19 10.343 -5.891 2.055 1.00 0.00 H new ATOM 0 HB2 LYS A 19 8.283 -5.437 -0.021 1.00 0.00 H new ATOM 0 HB3 LYS A 19 9.523 -4.198 -0.014 1.00 0.00 H new ATOM 0 HG2 LYS A 19 10.202 -5.886 -1.567 1.00 0.00 H new ATOM 0 HG3 LYS A 19 11.265 -5.995 -0.178 1.00 0.00 H new ATOM 0 HD2 LYS A 19 9.875 -7.879 0.713 1.00 0.00 H new ATOM 0 HD3 LYS A 19 8.860 -7.786 -0.713 1.00 0.00 H new ATOM 0 HE2 LYS A 19 10.875 -8.208 -2.145 1.00 0.00 H new ATOM 0 HE3 LYS A 19 11.851 -8.362 -0.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 11.347 -10.518 -0.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 9.881 -10.099 -0.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 9.966 -10.229 -1.862 1.00 0.00 H new ATOM 259 N ILE A 20 10.703 -3.395 2.400 1.00 0.00 N ATOM 260 CA ILE A 20 10.917 -2.000 2.753 1.00 0.00 C ATOM 261 C ILE A 20 11.283 -1.225 1.494 1.00 0.00 C ATOM 262 O ILE A 20 12.261 -1.556 0.820 1.00 0.00 O ATOM 263 CB ILE A 20 12.055 -1.836 3.791 1.00 0.00 C ATOM 264 CG1 ILE A 20 11.651 -2.433 5.142 1.00 0.00 C ATOM 265 CG2 ILE A 20 12.440 -0.366 3.952 1.00 0.00 C ATOM 266 CD1 ILE A 20 10.571 -1.647 5.852 1.00 0.00 C ATOM 0 H ILE A 20 11.557 -3.895 2.154 1.00 0.00 H new ATOM 0 HA ILE A 20 9.998 -1.618 3.196 1.00 0.00 H new ATOM 0 HB ILE A 20 12.925 -2.379 3.421 1.00 0.00 H new ATOM 0 HG12 ILE A 20 11.304 -3.455 4.989 1.00 0.00 H new ATOM 0 HG13 ILE A 20 12.531 -2.487 5.784 1.00 0.00 H new ATOM 0 HG21 ILE A 20 13.241 -0.278 4.686 1.00 0.00 H new ATOM 0 HG22 ILE A 20 12.781 0.028 2.994 1.00 0.00 H new ATOM 0 HG23 ILE A 20 11.573 0.202 4.290 1.00 0.00 H new ATOM 0 HD11 ILE A 20 10.336 -2.128 6.801 1.00 0.00 H new ATOM 0 HD12 ILE A 20 10.922 -0.632 6.037 1.00 0.00 H new ATOM 0 HD13 ILE A 20 9.676 -1.614 5.230 1.00 0.00 H new ATOM 278 N LEU A 21 10.503 -0.212 1.165 1.00 0.00 N ATOM 279 CA LEU A 21 10.761 0.561 -0.034 1.00 0.00 C ATOM 280 C LEU A 21 10.805 2.048 0.276 1.00 0.00 C ATOM 281 O LEU A 21 10.310 2.497 1.313 1.00 0.00 O ATOM 282 CB LEU A 21 9.735 0.264 -1.140 1.00 0.00 C ATOM 283 CG LEU A 21 8.270 0.596 -0.832 1.00 0.00 C ATOM 284 CD1 LEU A 21 7.470 0.660 -2.123 1.00 0.00 C ATOM 285 CD2 LEU A 21 7.660 -0.438 0.103 1.00 0.00 C ATOM 0 H LEU A 21 9.693 0.092 1.706 1.00 0.00 H new ATOM 0 HA LEU A 21 11.739 0.259 -0.408 1.00 0.00 H new ATOM 0 HB2 LEU A 21 10.028 0.817 -2.032 1.00 0.00 H new ATOM 0 HB3 LEU A 21 9.798 -0.796 -1.386 1.00 0.00 H new ATOM 0 HG LEU A 21 8.238 1.567 -0.337 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.431 0.896 -1.896 1.00 0.00 H new ATOM 0 HD12 LEU A 21 7.885 1.433 -2.770 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.520 -0.303 -2.630 1.00 0.00 H new ATOM 0 HD21 LEU A 21 6.621 -0.178 0.305 1.00 0.00 H new ATOM 0 HD22 LEU A 21 7.704 -1.422 -0.364 1.00 0.00 H new ATOM 0 HD23 LEU A 21 8.218 -0.456 1.039 1.00 0.00 H new ATOM 297 N GLU A 22 11.400 2.798 -0.632 1.00 0.00 N ATOM 298 CA GLU A 22 11.652 4.213 -0.430 1.00 0.00 C ATOM 299 C GLU A 22 11.080 5.018 -1.589 1.00 0.00 C ATOM 300 O GLU A 22 11.146 4.588 -2.742 1.00 0.00 O ATOM 301 CB GLU A 22 13.161 4.436 -0.332 1.00 0.00 C ATOM 302 CG GLU A 22 13.580 5.878 -0.104 1.00 0.00 C ATOM 303 CD GLU A 22 15.062 6.072 -0.339 1.00 0.00 C ATOM 304 OE1 GLU A 22 15.869 5.542 0.453 1.00 0.00 O ATOM 305 OE2 GLU A 22 15.428 6.727 -1.336 1.00 0.00 O ATOM 0 H GLU A 22 11.723 2.443 -1.532 1.00 0.00 H new ATOM 0 HA GLU A 22 11.170 4.543 0.490 1.00 0.00 H new ATOM 0 HB2 GLU A 22 13.552 3.826 0.483 1.00 0.00 H new ATOM 0 HB3 GLU A 22 13.627 4.078 -1.250 1.00 0.00 H new ATOM 0 HG2 GLU A 22 13.017 6.531 -0.771 1.00 0.00 H new ATOM 0 HG3 GLU A 22 13.331 6.173 0.915 1.00 0.00 H new ATOM 312 N SER A 23 10.511 6.172 -1.283 1.00 0.00 N ATOM 313 CA SER A 23 10.009 7.065 -2.311 1.00 0.00 C ATOM 314 C SER A 23 10.540 8.471 -2.067 1.00 0.00 C ATOM 315 O SER A 23 10.629 8.916 -0.921 1.00 0.00 O ATOM 316 CB SER A 23 8.478 7.057 -2.323 1.00 0.00 C ATOM 317 OG SER A 23 7.964 7.790 -3.425 1.00 0.00 O ATOM 0 H SER A 23 10.386 6.512 -0.329 1.00 0.00 H new ATOM 0 HA SER A 23 10.355 6.722 -3.286 1.00 0.00 H new ATOM 0 HB2 SER A 23 8.119 6.029 -2.369 1.00 0.00 H new ATOM 0 HB3 SER A 23 8.103 7.485 -1.393 1.00 0.00 H new ATOM 0 HG SER A 23 7.531 8.607 -3.101 1.00 0.00 H new ATOM 323 N GLY A 24 10.897 9.158 -3.143 1.00 0.00 N ATOM 324 CA GLY A 24 11.465 10.486 -3.023 1.00 0.00 C ATOM 325 C GLY A 24 10.408 11.547 -2.825 1.00 0.00 C ATOM 326 O GLY A 24 10.709 12.669 -2.421 1.00 0.00 O ATOM 0 H GLY A 24 10.803 8.818 -4.100 1.00 0.00 H new ATOM 0 HA2 GLY A 24 12.159 10.507 -2.183 1.00 0.00 H new ATOM 0 HA3 GLY A 24 12.042 10.714 -3.919 1.00 0.00 H new ATOM 330 N ALA A 25 9.169 11.193 -3.116 1.00 0.00 N ATOM 331 CA ALA A 25 8.049 12.098 -2.936 1.00 0.00 C ATOM 332 C ALA A 25 6.864 11.346 -2.346 1.00 0.00 C ATOM 333 O ALA A 25 6.711 10.145 -2.589 1.00 0.00 O ATOM 334 CB ALA A 25 7.667 12.745 -4.262 1.00 0.00 C ATOM 0 H ALA A 25 8.912 10.276 -3.481 1.00 0.00 H new ATOM 0 HA ALA A 25 8.342 12.888 -2.245 1.00 0.00 H new ATOM 0 HB1 ALA A 25 6.825 13.420 -4.108 1.00 0.00 H new ATOM 0 HB2 ALA A 25 8.516 13.306 -4.651 1.00 0.00 H new ATOM 0 HB3 ALA A 25 7.385 11.971 -4.977 1.00 0.00 H new ATOM 340 N PRO A 26 6.029 12.028 -1.540 1.00 0.00 N ATOM 341 CA PRO A 26 4.823 11.428 -0.963 1.00 0.00 C ATOM 342 C PRO A 26 3.882 10.896 -2.043 1.00 0.00 C ATOM 343 O PRO A 26 3.728 11.504 -3.105 1.00 0.00 O ATOM 344 CB PRO A 26 4.169 12.576 -0.181 1.00 0.00 C ATOM 345 CG PRO A 26 4.821 13.821 -0.681 1.00 0.00 C ATOM 346 CD PRO A 26 6.200 13.426 -1.120 1.00 0.00 C ATOM 0 HA PRO A 26 5.056 10.568 -0.335 1.00 0.00 H new ATOM 0 HB2 PRO A 26 3.092 12.602 -0.349 1.00 0.00 H new ATOM 0 HB3 PRO A 26 4.321 12.457 0.892 1.00 0.00 H new ATOM 0 HG2 PRO A 26 4.257 14.250 -1.509 1.00 0.00 H new ATOM 0 HG3 PRO A 26 4.864 14.579 0.101 1.00 0.00 H new ATOM 0 HD2 PRO A 26 6.557 14.052 -1.938 1.00 0.00 H new ATOM 0 HD3 PRO A 26 6.923 13.518 -0.309 1.00 0.00 H new ATOM 354 N ARG A 27 3.253 9.767 -1.761 1.00 0.00 N ATOM 355 CA ARG A 27 2.458 9.058 -2.751 1.00 0.00 C ATOM 356 C ARG A 27 1.166 8.561 -2.106 1.00 0.00 C ATOM 357 O ARG A 27 1.100 8.452 -0.886 1.00 0.00 O ATOM 358 CB ARG A 27 3.280 7.872 -3.274 1.00 0.00 C ATOM 359 CG ARG A 27 2.990 7.468 -4.706 1.00 0.00 C ATOM 360 CD ARG A 27 3.478 8.513 -5.700 1.00 0.00 C ATOM 361 NE ARG A 27 3.444 8.014 -7.079 1.00 0.00 N ATOM 362 CZ ARG A 27 3.551 8.787 -8.162 1.00 0.00 C ATOM 363 NH1 ARG A 27 3.691 10.101 -8.041 1.00 0.00 N ATOM 364 NH2 ARG A 27 3.534 8.243 -9.370 1.00 0.00 N ATOM 0 H ARG A 27 3.278 9.318 -0.845 1.00 0.00 H new ATOM 0 HA ARG A 27 2.202 9.720 -3.578 1.00 0.00 H new ATOM 0 HB2 ARG A 27 4.338 8.119 -3.190 1.00 0.00 H new ATOM 0 HB3 ARG A 27 3.101 7.013 -2.627 1.00 0.00 H new ATOM 0 HG2 ARG A 27 3.470 6.513 -4.918 1.00 0.00 H new ATOM 0 HG3 ARG A 27 1.917 7.320 -4.832 1.00 0.00 H new ATOM 0 HD2 ARG A 27 2.858 9.406 -5.622 1.00 0.00 H new ATOM 0 HD3 ARG A 27 4.496 8.808 -5.446 1.00 0.00 H new ATOM 0 HE ARG A 27 3.331 7.010 -7.220 1.00 0.00 H new ATOM 0 HH11 ARG A 27 3.718 10.528 -7.115 1.00 0.00 H new ATOM 0 HH12 ARG A 27 3.772 10.684 -8.874 1.00 0.00 H new ATOM 0 HH21 ARG A 27 3.439 7.233 -9.473 1.00 0.00 H new ATOM 0 HH22 ARG A 27 3.616 8.835 -10.197 1.00 0.00 H new ATOM 378 N ARG A 28 0.142 8.292 -2.904 1.00 0.00 N ATOM 379 CA ARG A 28 -1.086 7.681 -2.396 1.00 0.00 C ATOM 380 C ARG A 28 -1.133 6.201 -2.736 1.00 0.00 C ATOM 381 O ARG A 28 -0.282 5.694 -3.469 1.00 0.00 O ATOM 382 CB ARG A 28 -2.322 8.356 -2.987 1.00 0.00 C ATOM 383 CG ARG A 28 -2.579 9.753 -2.466 1.00 0.00 C ATOM 384 CD ARG A 28 -3.591 10.471 -3.334 1.00 0.00 C ATOM 385 NE ARG A 28 -3.204 10.438 -4.746 1.00 0.00 N ATOM 386 CZ ARG A 28 -3.939 10.937 -5.736 1.00 0.00 C ATOM 387 NH1 ARG A 28 -5.053 11.613 -5.468 1.00 0.00 N ATOM 388 NH2 ARG A 28 -3.545 10.773 -6.995 1.00 0.00 N ATOM 0 H ARG A 28 0.134 8.486 -3.905 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.085 7.810 -1.314 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -2.214 8.399 -4.071 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -3.194 7.737 -2.778 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -2.944 9.702 -1.440 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -1.646 10.316 -2.445 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -4.570 10.008 -3.213 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -3.685 11.506 -3.005 1.00 0.00 H new ATOM 0 HE ARG A 28 -2.313 10.004 -4.986 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -5.346 11.750 -4.501 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -5.614 11.994 -6.230 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -2.683 10.267 -7.198 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -4.105 11.153 -7.758 1.00 0.00 H new ATOM 402 N ILE A 29 -2.139 5.515 -2.212 1.00 0.00 N ATOM 403 CA ILE A 29 -2.351 4.112 -2.529 1.00 0.00 C ATOM 404 C ILE A 29 -2.771 3.970 -3.988 1.00 0.00 C ATOM 405 O ILE A 29 -2.283 3.096 -4.700 1.00 0.00 O ATOM 406 CB ILE A 29 -3.428 3.476 -1.627 1.00 0.00 C ATOM 407 CG1 ILE A 29 -3.098 3.697 -0.148 1.00 0.00 C ATOM 408 CG2 ILE A 29 -3.572 1.989 -1.927 1.00 0.00 C ATOM 409 CD1 ILE A 29 -4.017 2.949 0.785 1.00 0.00 C ATOM 0 H ILE A 29 -2.822 5.909 -1.565 1.00 0.00 H new ATOM 0 HA ILE A 29 -1.410 3.590 -2.354 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.380 3.963 -1.841 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -2.070 3.386 0.038 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.154 4.763 0.075 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -4.337 1.560 -1.280 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -3.861 1.854 -2.969 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -2.621 1.488 -1.747 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.729 3.149 1.817 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -5.044 3.277 0.625 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -3.943 1.879 0.588 1.00 0.00 H new ATOM 421 N LYS A 30 -3.663 4.856 -4.427 1.00 0.00 N ATOM 422 CA LYS A 30 -4.102 4.895 -5.819 1.00 0.00 C ATOM 423 C LYS A 30 -2.919 5.165 -6.735 1.00 0.00 C ATOM 424 O LYS A 30 -2.867 4.684 -7.862 1.00 0.00 O ATOM 425 CB LYS A 30 -5.167 5.980 -6.006 1.00 0.00 C ATOM 426 CG LYS A 30 -5.698 6.099 -7.427 1.00 0.00 C ATOM 427 CD LYS A 30 -6.867 7.064 -7.490 1.00 0.00 C ATOM 428 CE LYS A 30 -7.426 7.184 -8.895 1.00 0.00 C ATOM 429 NZ LYS A 30 -8.715 7.923 -8.908 1.00 0.00 N ATOM 0 H LYS A 30 -4.098 5.561 -3.833 1.00 0.00 H new ATOM 0 HA LYS A 30 -4.534 3.928 -6.077 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -6.001 5.773 -5.335 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -4.747 6.940 -5.706 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -4.903 6.441 -8.089 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -6.011 5.118 -7.786 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -7.653 6.727 -6.814 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -6.546 8.046 -7.142 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -6.705 7.697 -9.532 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -7.572 6.189 -9.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -9.069 7.987 -9.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -9.410 7.420 -8.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -8.570 8.881 -8.529 1.00 0.00 H new ATOM 443 N ASP A 31 -1.966 5.931 -6.228 1.00 0.00 N ATOM 444 CA ASP A 31 -0.763 6.254 -6.975 1.00 0.00 C ATOM 445 C ASP A 31 0.101 5.012 -7.169 1.00 0.00 C ATOM 446 O ASP A 31 0.651 4.790 -8.243 1.00 0.00 O ATOM 447 CB ASP A 31 0.043 7.331 -6.252 1.00 0.00 C ATOM 448 CG ASP A 31 -0.633 8.690 -6.247 1.00 0.00 C ATOM 449 OD1 ASP A 31 -1.346 9.023 -7.212 1.00 0.00 O ATOM 450 OD2 ASP A 31 -0.447 9.437 -5.266 1.00 0.00 O ATOM 0 H ASP A 31 -2.004 6.343 -5.296 1.00 0.00 H new ATOM 0 HA ASP A 31 -1.065 6.630 -7.952 1.00 0.00 H new ATOM 0 HB2 ASP A 31 0.215 7.016 -5.223 1.00 0.00 H new ATOM 0 HB3 ASP A 31 1.021 7.422 -6.726 1.00 0.00 H new ATOM 455 N VAL A 32 0.215 4.201 -6.121 1.00 0.00 N ATOM 456 CA VAL A 32 1.013 2.982 -6.183 1.00 0.00 C ATOM 457 C VAL A 32 0.285 1.893 -6.968 1.00 0.00 C ATOM 458 O VAL A 32 0.833 1.321 -7.914 1.00 0.00 O ATOM 459 CB VAL A 32 1.359 2.453 -4.773 1.00 0.00 C ATOM 460 CG1 VAL A 32 2.181 1.175 -4.859 1.00 0.00 C ATOM 461 CG2 VAL A 32 2.103 3.511 -3.970 1.00 0.00 C ATOM 0 H VAL A 32 -0.235 4.366 -5.220 1.00 0.00 H new ATOM 0 HA VAL A 32 1.941 3.237 -6.695 1.00 0.00 H new ATOM 0 HB VAL A 32 0.425 2.224 -4.260 1.00 0.00 H new ATOM 0 HG11 VAL A 32 2.412 0.823 -3.854 1.00 0.00 H new ATOM 0 HG12 VAL A 32 1.612 0.411 -5.390 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.109 1.374 -5.395 1.00 0.00 H new ATOM 0 HG21 VAL A 32 2.337 3.119 -2.980 1.00 0.00 H new ATOM 0 HG22 VAL A 32 3.027 3.775 -4.484 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.478 4.398 -3.870 1.00 0.00 H new ATOM 471 N LEU A 33 -0.954 1.616 -6.579 1.00 0.00 N ATOM 472 CA LEU A 33 -1.763 0.615 -7.267 1.00 0.00 C ATOM 473 C LEU A 33 -1.997 1.009 -8.720 1.00 0.00 C ATOM 474 O LEU A 33 -2.040 0.155 -9.600 1.00 0.00 O ATOM 475 CB LEU A 33 -3.103 0.408 -6.553 1.00 0.00 C ATOM 476 CG LEU A 33 -3.092 -0.618 -5.411 1.00 0.00 C ATOM 477 CD1 LEU A 33 -2.090 -0.239 -4.331 1.00 0.00 C ATOM 478 CD2 LEU A 33 -4.483 -0.759 -4.817 1.00 0.00 C ATOM 0 H LEU A 33 -1.420 2.069 -5.793 1.00 0.00 H new ATOM 0 HA LEU A 33 -1.213 -0.326 -7.248 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -3.434 1.367 -6.154 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.843 0.097 -7.290 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.785 -1.578 -5.827 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -2.109 -0.987 -3.538 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -1.090 -0.193 -4.762 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -2.352 0.735 -3.917 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.461 -1.490 -4.008 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.811 0.204 -4.427 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.176 -1.093 -5.589 1.00 0.00 H new ATOM 490 N GLY A 34 -2.141 2.303 -8.969 1.00 0.00 N ATOM 491 CA GLY A 34 -2.308 2.781 -10.329 1.00 0.00 C ATOM 492 C GLY A 34 -1.037 2.650 -11.140 1.00 0.00 C ATOM 493 O GLY A 34 -1.082 2.389 -12.343 1.00 0.00 O ATOM 0 H GLY A 34 -2.145 3.031 -8.255 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -3.106 2.220 -10.814 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -2.619 3.826 -10.310 1.00 0.00 H new ATOM 497 N GLU A 35 0.100 2.818 -10.473 1.00 0.00 N ATOM 498 CA GLU A 35 1.405 2.748 -11.122 1.00 0.00 C ATOM 499 C GLU A 35 1.623 1.371 -11.753 1.00 0.00 C ATOM 500 O GLU A 35 2.066 1.263 -12.895 1.00 0.00 O ATOM 501 CB GLU A 35 2.512 3.015 -10.099 1.00 0.00 C ATOM 502 CG GLU A 35 3.823 3.479 -10.708 1.00 0.00 C ATOM 503 CD GLU A 35 3.801 4.951 -11.063 1.00 0.00 C ATOM 504 OE1 GLU A 35 3.288 5.304 -12.142 1.00 0.00 O ATOM 505 OE2 GLU A 35 4.297 5.766 -10.256 1.00 0.00 O ATOM 0 H GLU A 35 0.144 3.006 -9.471 1.00 0.00 H new ATOM 0 HA GLU A 35 1.437 3.505 -11.905 1.00 0.00 H new ATOM 0 HB2 GLU A 35 2.165 3.770 -9.393 1.00 0.00 H new ATOM 0 HB3 GLU A 35 2.692 2.104 -9.528 1.00 0.00 H new ATOM 0 HG2 GLU A 35 4.635 3.289 -10.006 1.00 0.00 H new ATOM 0 HG3 GLU A 35 4.032 2.894 -11.604 1.00 0.00 H new ATOM 512 N LEU A 36 1.297 0.324 -11.001 1.00 0.00 N ATOM 513 CA LEU A 36 1.530 -1.050 -11.449 1.00 0.00 C ATOM 514 C LEU A 36 0.246 -1.709 -11.951 1.00 0.00 C ATOM 515 O LEU A 36 0.241 -2.901 -12.265 1.00 0.00 O ATOM 516 CB LEU A 36 2.125 -1.878 -10.308 1.00 0.00 C ATOM 517 CG LEU A 36 3.491 -1.407 -9.814 1.00 0.00 C ATOM 518 CD1 LEU A 36 3.920 -2.220 -8.609 1.00 0.00 C ATOM 519 CD2 LEU A 36 4.527 -1.520 -10.921 1.00 0.00 C ATOM 0 H LEU A 36 0.870 0.398 -10.078 1.00 0.00 H new ATOM 0 HA LEU A 36 2.233 -1.011 -12.281 1.00 0.00 H new ATOM 0 HB2 LEU A 36 1.429 -1.867 -9.470 1.00 0.00 H new ATOM 0 HB3 LEU A 36 2.212 -2.913 -10.637 1.00 0.00 H new ATOM 0 HG LEU A 36 3.411 -0.360 -9.522 1.00 0.00 H new ATOM 0 HD11 LEU A 36 4.895 -1.875 -8.266 1.00 0.00 H new ATOM 0 HD12 LEU A 36 3.190 -2.098 -7.809 1.00 0.00 H new ATOM 0 HD13 LEU A 36 3.984 -3.273 -8.884 1.00 0.00 H new ATOM 0 HD21 LEU A 36 5.494 -1.180 -10.550 1.00 0.00 H new ATOM 0 HD22 LEU A 36 4.606 -2.559 -11.241 1.00 0.00 H new ATOM 0 HD23 LEU A 36 4.225 -0.902 -11.767 1.00 0.00 H new ATOM 531 N GLU A 37 -0.822 -0.918 -12.037 1.00 0.00 N ATOM 532 CA GLU A 37 -2.149 -1.402 -12.432 1.00 0.00 C ATOM 533 C GLU A 37 -2.585 -2.585 -11.562 1.00 0.00 C ATOM 534 O GLU A 37 -2.645 -3.731 -12.014 1.00 0.00 O ATOM 535 CB GLU A 37 -2.188 -1.788 -13.916 1.00 0.00 C ATOM 536 CG GLU A 37 -3.591 -2.101 -14.424 1.00 0.00 C ATOM 537 CD GLU A 37 -3.610 -2.517 -15.878 1.00 0.00 C ATOM 538 OE1 GLU A 37 -3.701 -1.628 -16.751 1.00 0.00 O ATOM 539 OE2 GLU A 37 -3.535 -3.736 -16.155 1.00 0.00 O ATOM 0 H GLU A 37 -0.794 0.081 -11.834 1.00 0.00 H new ATOM 0 HA GLU A 37 -2.851 -0.583 -12.278 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -1.769 -0.973 -14.507 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -1.550 -2.657 -14.074 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -4.023 -2.897 -13.818 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -4.224 -1.223 -14.294 1.00 0.00 H new ATOM 546 N ILE A 38 -2.862 -2.293 -10.304 1.00 0.00 N ATOM 547 CA ILE A 38 -3.299 -3.302 -9.355 1.00 0.00 C ATOM 548 C ILE A 38 -4.756 -3.064 -8.972 1.00 0.00 C ATOM 549 O ILE A 38 -5.092 -2.021 -8.414 1.00 0.00 O ATOM 550 CB ILE A 38 -2.430 -3.289 -8.077 1.00 0.00 C ATOM 551 CG1 ILE A 38 -0.951 -3.453 -8.432 1.00 0.00 C ATOM 552 CG2 ILE A 38 -2.874 -4.392 -7.123 1.00 0.00 C ATOM 553 CD1 ILE A 38 -0.021 -3.342 -7.243 1.00 0.00 C ATOM 0 H ILE A 38 -2.791 -1.354 -9.912 1.00 0.00 H new ATOM 0 HA ILE A 38 -3.195 -4.275 -9.836 1.00 0.00 H new ATOM 0 HB ILE A 38 -2.560 -2.327 -7.581 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -0.806 -4.424 -8.905 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -0.677 -2.696 -9.167 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -2.253 -4.370 -6.228 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -3.916 -4.235 -6.845 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.771 -5.360 -7.613 1.00 0.00 H new ATOM 0 HD11 ILE A 38 1.010 -3.469 -7.574 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -0.136 -2.361 -6.782 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -0.266 -4.116 -6.516 1.00 0.00 H new ATOM 565 N PRO A 39 -5.640 -4.020 -9.286 1.00 0.00 N ATOM 566 CA PRO A 39 -7.060 -3.932 -8.945 1.00 0.00 C ATOM 567 C PRO A 39 -7.292 -3.999 -7.436 1.00 0.00 C ATOM 568 O PRO A 39 -7.048 -5.026 -6.801 1.00 0.00 O ATOM 569 CB PRO A 39 -7.688 -5.151 -9.637 1.00 0.00 C ATOM 570 CG PRO A 39 -6.655 -5.640 -10.596 1.00 0.00 C ATOM 571 CD PRO A 39 -5.329 -5.259 -10.007 1.00 0.00 C ATOM 0 HA PRO A 39 -7.493 -2.984 -9.266 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -7.948 -5.923 -8.913 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -8.607 -4.878 -10.155 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -6.727 -6.719 -10.730 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -6.790 -5.188 -11.579 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -4.946 -6.031 -9.339 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -4.574 -5.101 -10.777 1.00 0.00 H new ATOM 579 N ILE A 40 -7.769 -2.897 -6.875 1.00 0.00 N ATOM 580 CA ILE A 40 -8.020 -2.802 -5.441 1.00 0.00 C ATOM 581 C ILE A 40 -9.347 -3.479 -5.080 1.00 0.00 C ATOM 582 O ILE A 40 -9.634 -3.749 -3.917 1.00 0.00 O ATOM 583 CB ILE A 40 -8.037 -1.318 -4.983 1.00 0.00 C ATOM 584 CG1 ILE A 40 -8.141 -1.216 -3.455 1.00 0.00 C ATOM 585 CG2 ILE A 40 -9.176 -0.559 -5.655 1.00 0.00 C ATOM 586 CD1 ILE A 40 -8.181 0.207 -2.938 1.00 0.00 C ATOM 0 H ILE A 40 -7.992 -2.048 -7.395 1.00 0.00 H new ATOM 0 HA ILE A 40 -7.212 -3.317 -4.922 1.00 0.00 H new ATOM 0 HB ILE A 40 -7.096 -0.860 -5.287 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -9.040 -1.737 -3.126 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -7.291 -1.731 -3.007 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -9.169 0.478 -5.320 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -9.047 -0.592 -6.737 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -10.127 -1.020 -5.389 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -8.255 0.197 -1.851 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -7.271 0.728 -3.235 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -9.046 0.722 -3.356 1.00 0.00 H new ATOM 598 N GLU A 41 -10.139 -3.774 -6.099 1.00 0.00 N ATOM 599 CA GLU A 41 -11.457 -4.360 -5.913 1.00 0.00 C ATOM 600 C GLU A 41 -11.367 -5.849 -5.554 1.00 0.00 C ATOM 601 O GLU A 41 -12.327 -6.433 -5.046 1.00 0.00 O ATOM 602 CB GLU A 41 -12.270 -4.174 -7.196 1.00 0.00 C ATOM 603 CG GLU A 41 -13.742 -4.516 -7.061 1.00 0.00 C ATOM 604 CD GLU A 41 -14.491 -4.335 -8.362 1.00 0.00 C ATOM 605 OE1 GLU A 41 -14.713 -3.179 -8.769 1.00 0.00 O ATOM 606 OE2 GLU A 41 -14.865 -5.349 -8.986 1.00 0.00 O ATOM 0 H GLU A 41 -9.888 -3.615 -7.075 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.949 -3.854 -5.082 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -12.179 -3.138 -7.522 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -11.836 -4.795 -7.980 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -13.844 -5.548 -6.725 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -14.191 -3.885 -6.294 1.00 0.00 H new ATOM 613 N THR A 42 -10.215 -6.463 -5.804 1.00 0.00 N ATOM 614 CA THR A 42 -10.081 -7.902 -5.614 1.00 0.00 C ATOM 615 C THR A 42 -9.210 -8.256 -4.403 1.00 0.00 C ATOM 616 O THR A 42 -9.132 -9.421 -4.013 1.00 0.00 O ATOM 617 CB THR A 42 -9.525 -8.589 -6.886 1.00 0.00 C ATOM 618 OG1 THR A 42 -9.415 -10.004 -6.687 1.00 0.00 O ATOM 619 CG2 THR A 42 -8.166 -8.024 -7.270 1.00 0.00 C ATOM 0 H THR A 42 -9.372 -5.994 -6.134 1.00 0.00 H new ATOM 0 HA THR A 42 -11.085 -8.278 -5.420 1.00 0.00 H new ATOM 0 HB THR A 42 -10.226 -8.391 -7.697 1.00 0.00 H new ATOM 0 HG1 THR A 42 -9.369 -10.197 -5.727 1.00 0.00 H new ATOM 0 HG21 THR A 42 -7.803 -8.527 -8.166 1.00 0.00 H new ATOM 0 HG22 THR A 42 -8.258 -6.956 -7.465 1.00 0.00 H new ATOM 0 HG23 THR A 42 -7.462 -8.184 -6.454 1.00 0.00 H new ATOM 627 N VAL A 43 -8.563 -7.264 -3.799 1.00 0.00 N ATOM 628 CA VAL A 43 -7.713 -7.521 -2.638 1.00 0.00 C ATOM 629 C VAL A 43 -7.996 -6.517 -1.524 1.00 0.00 C ATOM 630 O VAL A 43 -8.668 -5.513 -1.742 1.00 0.00 O ATOM 631 CB VAL A 43 -6.204 -7.491 -2.988 1.00 0.00 C ATOM 632 CG1 VAL A 43 -5.885 -8.464 -4.112 1.00 0.00 C ATOM 633 CG2 VAL A 43 -5.739 -6.092 -3.354 1.00 0.00 C ATOM 0 H VAL A 43 -8.608 -6.287 -4.088 1.00 0.00 H new ATOM 0 HA VAL A 43 -7.957 -8.527 -2.296 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.662 -7.801 -2.095 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.819 -8.423 -4.338 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -6.152 -9.475 -3.805 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -6.455 -8.193 -5.001 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -4.676 -6.113 -3.593 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.298 -5.737 -4.220 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -5.909 -5.420 -2.512 1.00 0.00 H new ATOM 643 N VAL A 44 -7.488 -6.799 -0.331 1.00 0.00 N ATOM 644 CA VAL A 44 -7.724 -5.934 0.819 1.00 0.00 C ATOM 645 C VAL A 44 -6.480 -5.121 1.152 1.00 0.00 C ATOM 646 O VAL A 44 -5.417 -5.681 1.410 1.00 0.00 O ATOM 647 CB VAL A 44 -8.136 -6.750 2.065 1.00 0.00 C ATOM 648 CG1 VAL A 44 -8.434 -5.832 3.243 1.00 0.00 C ATOM 649 CG2 VAL A 44 -9.338 -7.632 1.758 1.00 0.00 C ATOM 0 H VAL A 44 -6.912 -7.617 -0.134 1.00 0.00 H new ATOM 0 HA VAL A 44 -8.539 -5.262 0.549 1.00 0.00 H new ATOM 0 HB VAL A 44 -7.299 -7.392 2.338 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.722 -6.431 4.107 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -7.545 -5.250 3.485 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.249 -5.157 2.981 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -9.611 -8.198 2.649 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -10.178 -7.009 1.452 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.087 -8.322 0.953 1.00 0.00 H new ATOM 659 N VAL A 45 -6.618 -3.803 1.143 1.00 0.00 N ATOM 660 CA VAL A 45 -5.515 -2.922 1.497 1.00 0.00 C ATOM 661 C VAL A 45 -5.719 -2.369 2.902 1.00 0.00 C ATOM 662 O VAL A 45 -6.778 -1.820 3.217 1.00 0.00 O ATOM 663 CB VAL A 45 -5.380 -1.751 0.497 1.00 0.00 C ATOM 664 CG1 VAL A 45 -4.179 -0.882 0.841 1.00 0.00 C ATOM 665 CG2 VAL A 45 -5.272 -2.273 -0.929 1.00 0.00 C ATOM 0 H VAL A 45 -7.482 -3.321 0.895 1.00 0.00 H new ATOM 0 HA VAL A 45 -4.598 -3.509 1.461 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.277 -1.136 0.571 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -4.104 -0.065 0.124 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -4.300 -0.474 1.845 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -3.271 -1.484 0.801 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -5.178 -1.433 -1.618 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -4.395 -2.914 -1.016 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.166 -2.846 -1.175 1.00 0.00 H new ATOM 675 N LYS A 46 -4.713 -2.526 3.748 1.00 0.00 N ATOM 676 CA LYS A 46 -4.800 -2.063 5.123 1.00 0.00 C ATOM 677 C LYS A 46 -3.685 -1.085 5.462 1.00 0.00 C ATOM 678 O LYS A 46 -2.555 -1.222 4.989 1.00 0.00 O ATOM 679 CB LYS A 46 -4.714 -3.235 6.100 1.00 0.00 C ATOM 680 CG LYS A 46 -5.902 -4.179 6.074 1.00 0.00 C ATOM 681 CD LYS A 46 -5.677 -5.316 7.050 1.00 0.00 C ATOM 682 CE LYS A 46 -6.827 -6.303 7.067 1.00 0.00 C ATOM 683 NZ LYS A 46 -6.575 -7.408 8.030 1.00 0.00 N ATOM 0 H LYS A 46 -3.827 -2.970 3.506 1.00 0.00 H new ATOM 0 HA LYS A 46 -5.763 -1.561 5.218 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -3.811 -3.805 5.882 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -4.605 -2.840 7.110 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -6.813 -3.639 6.334 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -6.042 -4.574 5.068 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -4.757 -5.839 6.788 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -5.537 -4.909 8.051 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -7.749 -5.787 7.335 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -6.971 -6.714 6.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -7.087 -8.259 7.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -5.556 -7.612 8.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -6.905 -7.127 8.975 1.00 0.00 H new ATOM 697 N LYS A 47 -4.013 -0.107 6.292 1.00 0.00 N ATOM 698 CA LYS A 47 -3.009 0.742 6.911 1.00 0.00 C ATOM 699 C LYS A 47 -2.774 0.280 8.336 1.00 0.00 C ATOM 700 O LYS A 47 -3.594 0.539 9.218 1.00 0.00 O ATOM 701 CB LYS A 47 -3.438 2.210 6.922 1.00 0.00 C ATOM 702 CG LYS A 47 -3.509 2.851 5.550 1.00 0.00 C ATOM 703 CD LYS A 47 -2.234 2.624 4.760 1.00 0.00 C ATOM 704 CE LYS A 47 -1.947 3.791 3.834 1.00 0.00 C ATOM 705 NZ LYS A 47 -1.500 4.986 4.592 1.00 0.00 N ATOM 0 H LYS A 47 -4.973 0.119 6.553 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.093 0.662 6.326 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -4.416 2.287 7.397 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -2.739 2.776 7.538 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.356 2.441 5.000 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.686 3.921 5.657 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -1.398 2.486 5.446 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -2.323 1.707 4.177 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -1.179 3.506 3.115 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -2.844 4.034 3.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -1.698 5.843 4.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -2.010 5.034 5.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -0.478 4.920 4.774 1.00 0.00 H new ATOM 719 N ASN A 48 -1.677 -0.441 8.543 1.00 0.00 N ATOM 720 CA ASN A 48 -1.287 -0.942 9.868 1.00 0.00 C ATOM 721 C ASN A 48 -2.322 -1.935 10.432 1.00 0.00 C ATOM 722 O ASN A 48 -2.172 -2.444 11.540 1.00 0.00 O ATOM 723 CB ASN A 48 -1.080 0.235 10.834 1.00 0.00 C ATOM 724 CG ASN A 48 -0.338 -0.158 12.099 1.00 0.00 C ATOM 725 OD1 ASN A 48 -0.946 -0.514 13.111 1.00 0.00 O ATOM 726 ND2 ASN A 48 0.984 -0.086 12.053 1.00 0.00 N ATOM 0 H ASN A 48 -1.028 -0.698 7.799 1.00 0.00 H new ATOM 0 HA ASN A 48 -0.347 -1.484 9.759 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -0.525 1.023 10.324 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -2.051 0.652 11.103 1.00 0.00 H new ATOM 0 HD21 ASN A 48 1.537 -0.330 12.875 1.00 0.00 H new ATOM 0 HD22 ASN A 48 1.449 0.213 11.196 1.00 0.00 H new ATOM 733 N GLY A 49 -3.358 -2.229 9.655 1.00 0.00 N ATOM 734 CA GLY A 49 -4.403 -3.129 10.108 1.00 0.00 C ATOM 735 C GLY A 49 -5.790 -2.616 9.775 1.00 0.00 C ATOM 736 O GLY A 49 -6.760 -3.378 9.782 1.00 0.00 O ATOM 0 H GLY A 49 -3.494 -1.858 8.715 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -4.260 -4.107 9.649 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -4.318 -3.267 11.186 1.00 0.00 H new ATOM 740 N GLN A 50 -5.885 -1.327 9.469 1.00 0.00 N ATOM 741 CA GLN A 50 -7.164 -0.705 9.131 1.00 0.00 C ATOM 742 C GLN A 50 -7.461 -0.845 7.645 1.00 0.00 C ATOM 743 O GLN A 50 -6.622 -0.521 6.811 1.00 0.00 O ATOM 744 CB GLN A 50 -7.144 0.783 9.493 1.00 0.00 C ATOM 745 CG GLN A 50 -7.126 1.069 10.985 1.00 0.00 C ATOM 746 CD GLN A 50 -8.450 0.766 11.662 1.00 0.00 C ATOM 747 OE1 GLN A 50 -9.174 -0.149 11.270 1.00 0.00 O ATOM 748 NE2 GLN A 50 -8.777 1.541 12.679 1.00 0.00 N ATOM 0 H GLN A 50 -5.090 -0.689 9.448 1.00 0.00 H new ATOM 0 HA GLN A 50 -7.941 -1.214 9.702 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -6.267 1.243 9.037 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -8.019 1.262 9.055 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -6.340 0.476 11.454 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -6.873 2.117 11.146 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -8.149 2.289 12.973 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -9.658 1.392 13.171 1.00 0.00 H new ATOM 757 N ILE A 51 -8.651 -1.320 7.320 1.00 0.00 N ATOM 758 CA ILE A 51 -9.065 -1.427 5.930 1.00 0.00 C ATOM 759 C ILE A 51 -9.275 -0.028 5.355 1.00 0.00 C ATOM 760 O ILE A 51 -10.077 0.755 5.873 1.00 0.00 O ATOM 761 CB ILE A 51 -10.360 -2.269 5.757 1.00 0.00 C ATOM 762 CG1 ILE A 51 -10.104 -3.758 6.042 1.00 0.00 C ATOM 763 CG2 ILE A 51 -10.926 -2.104 4.353 1.00 0.00 C ATOM 764 CD1 ILE A 51 -9.876 -4.090 7.502 1.00 0.00 C ATOM 0 H ILE A 51 -9.346 -1.637 7.996 1.00 0.00 H new ATOM 0 HA ILE A 51 -8.273 -1.945 5.389 1.00 0.00 H new ATOM 0 HB ILE A 51 -11.087 -1.900 6.481 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -10.955 -4.335 5.680 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -9.234 -4.080 5.470 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -11.832 -2.702 4.253 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -11.162 -1.055 4.177 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -10.189 -2.437 3.622 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -9.704 -5.161 7.609 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -9.006 -3.544 7.868 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -10.754 -3.804 8.082 1.00 0.00 H new ATOM 776 N VAL A 52 -8.532 0.289 4.307 1.00 0.00 N ATOM 777 CA VAL A 52 -8.582 1.611 3.705 1.00 0.00 C ATOM 778 C VAL A 52 -8.896 1.526 2.221 1.00 0.00 C ATOM 779 O VAL A 52 -9.024 0.436 1.660 1.00 0.00 O ATOM 780 CB VAL A 52 -7.248 2.366 3.876 1.00 0.00 C ATOM 781 CG1 VAL A 52 -7.008 2.730 5.330 1.00 0.00 C ATOM 782 CG2 VAL A 52 -6.089 1.540 3.337 1.00 0.00 C ATOM 0 H VAL A 52 -7.884 -0.355 3.854 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.373 2.155 4.221 1.00 0.00 H new ATOM 0 HB VAL A 52 -7.312 3.290 3.301 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -6.061 3.261 5.420 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -7.817 3.369 5.684 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -6.974 1.822 5.932 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -5.158 2.091 3.468 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -6.031 0.596 3.880 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -6.247 1.340 2.277 1.00 0.00 H new ATOM 792 N ILE A 53 -9.015 2.683 1.590 1.00 0.00 N ATOM 793 CA ILE A 53 -9.198 2.747 0.152 1.00 0.00 C ATOM 794 C ILE A 53 -7.977 3.372 -0.508 1.00 0.00 C ATOM 795 O ILE A 53 -7.030 3.776 0.167 1.00 0.00 O ATOM 796 CB ILE A 53 -10.458 3.542 -0.244 1.00 0.00 C ATOM 797 CG1 ILE A 53 -10.448 4.933 0.396 1.00 0.00 C ATOM 798 CG2 ILE A 53 -11.711 2.774 0.149 1.00 0.00 C ATOM 799 CD1 ILE A 53 -11.619 5.799 -0.017 1.00 0.00 C ATOM 0 H ILE A 53 -8.988 3.591 2.053 1.00 0.00 H new ATOM 0 HA ILE A 53 -9.327 1.722 -0.197 1.00 0.00 H new ATOM 0 HB ILE A 53 -10.458 3.672 -1.326 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -10.452 4.825 1.481 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -9.520 5.440 0.129 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -12.593 3.347 -0.136 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -11.723 1.811 -0.362 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -11.716 2.613 1.227 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -11.546 6.769 0.475 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -11.605 5.938 -1.098 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -12.551 5.314 0.274 1.00 0.00 H new ATOM 811 N ASP A 54 -8.022 3.478 -1.824 1.00 0.00 N ATOM 812 CA ASP A 54 -6.891 3.963 -2.609 1.00 0.00 C ATOM 813 C ASP A 54 -6.695 5.473 -2.453 1.00 0.00 C ATOM 814 O ASP A 54 -5.705 6.032 -2.924 1.00 0.00 O ATOM 815 CB ASP A 54 -7.103 3.604 -4.081 1.00 0.00 C ATOM 816 CG ASP A 54 -8.406 4.154 -4.627 1.00 0.00 C ATOM 817 OD1 ASP A 54 -9.479 3.638 -4.243 1.00 0.00 O ATOM 818 OD2 ASP A 54 -8.367 5.107 -5.431 1.00 0.00 O ATOM 0 H ASP A 54 -8.840 3.232 -2.382 1.00 0.00 H new ATOM 0 HA ASP A 54 -5.987 3.480 -2.238 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -6.272 3.992 -4.670 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -7.094 2.520 -4.193 1.00 0.00 H new ATOM 823 N GLU A 55 -7.621 6.117 -1.759 1.00 0.00 N ATOM 824 CA GLU A 55 -7.603 7.569 -1.593 1.00 0.00 C ATOM 825 C GLU A 55 -6.642 7.992 -0.477 1.00 0.00 C ATOM 826 O GLU A 55 -6.461 9.182 -0.219 1.00 0.00 O ATOM 827 CB GLU A 55 -9.022 8.055 -1.276 1.00 0.00 C ATOM 828 CG GLU A 55 -9.209 9.561 -1.364 1.00 0.00 C ATOM 829 CD GLU A 55 -9.182 10.070 -2.788 1.00 0.00 C ATOM 830 OE1 GLU A 55 -8.083 10.338 -3.312 1.00 0.00 O ATOM 831 OE2 GLU A 55 -10.267 10.213 -3.390 1.00 0.00 O ATOM 0 H GLU A 55 -8.403 5.654 -1.296 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.252 8.021 -2.521 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -9.719 7.575 -1.963 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -9.288 7.727 -0.271 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -10.159 9.833 -0.903 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -8.424 10.055 -0.791 1.00 0.00 H new ATOM 838 N GLU A 56 -6.022 7.024 0.184 1.00 0.00 N ATOM 839 CA GLU A 56 -5.132 7.322 1.301 1.00 0.00 C ATOM 840 C GLU A 56 -3.698 7.533 0.832 1.00 0.00 C ATOM 841 O GLU A 56 -3.270 6.954 -0.167 1.00 0.00 O ATOM 842 CB GLU A 56 -5.174 6.191 2.331 1.00 0.00 C ATOM 843 CG GLU A 56 -6.514 6.043 3.033 1.00 0.00 C ATOM 844 CD GLU A 56 -6.858 7.243 3.888 1.00 0.00 C ATOM 845 OE1 GLU A 56 -6.148 7.489 4.888 1.00 0.00 O ATOM 846 OE2 GLU A 56 -7.842 7.942 3.571 1.00 0.00 O ATOM 0 H GLU A 56 -6.117 6.031 -0.031 1.00 0.00 H new ATOM 0 HA GLU A 56 -5.481 8.247 1.761 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -4.930 5.252 1.834 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -4.401 6.366 3.079 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -7.296 5.896 2.288 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -6.496 5.150 3.657 1.00 0.00 H new ATOM 853 N GLU A 57 -2.966 8.361 1.567 1.00 0.00 N ATOM 854 CA GLU A 57 -1.565 8.631 1.277 1.00 0.00 C ATOM 855 C GLU A 57 -0.680 7.611 1.977 1.00 0.00 C ATOM 856 O GLU A 57 -1.085 7.008 2.967 1.00 0.00 O ATOM 857 CB GLU A 57 -1.158 10.034 1.748 1.00 0.00 C ATOM 858 CG GLU A 57 -1.741 11.183 0.938 1.00 0.00 C ATOM 859 CD GLU A 57 -3.235 11.347 1.116 1.00 0.00 C ATOM 860 OE1 GLU A 57 -3.720 11.270 2.270 1.00 0.00 O ATOM 861 OE2 GLU A 57 -3.930 11.583 0.109 1.00 0.00 O ATOM 0 H GLU A 57 -3.326 8.863 2.379 1.00 0.00 H new ATOM 0 HA GLU A 57 -1.436 8.566 0.197 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -1.461 10.153 2.788 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -0.071 10.107 1.723 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -1.244 12.110 1.226 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -1.524 11.020 -0.118 1.00 0.00 H new ATOM 868 N ILE A 58 0.522 7.424 1.465 1.00 0.00 N ATOM 869 CA ILE A 58 1.505 6.575 2.116 1.00 0.00 C ATOM 870 C ILE A 58 2.429 7.453 2.950 1.00 0.00 C ATOM 871 O ILE A 58 2.882 8.498 2.478 1.00 0.00 O ATOM 872 CB ILE A 58 2.365 5.783 1.106 1.00 0.00 C ATOM 873 CG1 ILE A 58 1.583 5.446 -0.173 1.00 0.00 C ATOM 874 CG2 ILE A 58 2.879 4.511 1.757 1.00 0.00 C ATOM 875 CD1 ILE A 58 0.431 4.484 0.026 1.00 0.00 C ATOM 0 H ILE A 58 0.843 7.850 0.596 1.00 0.00 H new ATOM 0 HA ILE A 58 0.965 5.856 2.731 1.00 0.00 H new ATOM 0 HB ILE A 58 3.206 6.413 0.817 1.00 0.00 H new ATOM 0 HG12 ILE A 58 1.197 6.371 -0.601 1.00 0.00 H new ATOM 0 HG13 ILE A 58 2.272 5.021 -0.903 1.00 0.00 H new ATOM 0 HG21 ILE A 58 3.485 3.955 1.041 1.00 0.00 H new ATOM 0 HG22 ILE A 58 3.486 4.766 2.626 1.00 0.00 H new ATOM 0 HG23 ILE A 58 2.035 3.897 2.072 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -0.062 4.305 -0.929 1.00 0.00 H new ATOM 0 HD12 ILE A 58 0.808 3.541 0.422 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -0.284 4.913 0.729 1.00 0.00 H new ATOM 887 N PHE A 59 2.706 7.049 4.179 1.00 0.00 N ATOM 888 CA PHE A 59 3.498 7.876 5.079 1.00 0.00 C ATOM 889 C PHE A 59 4.805 7.191 5.452 1.00 0.00 C ATOM 890 O PHE A 59 4.998 6.006 5.186 1.00 0.00 O ATOM 891 CB PHE A 59 2.702 8.198 6.345 1.00 0.00 C ATOM 892 CG PHE A 59 1.421 8.941 6.079 1.00 0.00 C ATOM 893 CD1 PHE A 59 1.439 10.297 5.791 1.00 0.00 C ATOM 894 CD2 PHE A 59 0.202 8.283 6.118 1.00 0.00 C ATOM 895 CE1 PHE A 59 0.265 10.983 5.545 1.00 0.00 C ATOM 896 CE2 PHE A 59 -0.976 8.965 5.874 1.00 0.00 C ATOM 897 CZ PHE A 59 -0.944 10.316 5.588 1.00 0.00 C ATOM 0 H PHE A 59 2.398 6.161 4.575 1.00 0.00 H new ATOM 0 HA PHE A 59 3.734 8.803 4.557 1.00 0.00 H new ATOM 0 HB2 PHE A 59 2.472 7.268 6.865 1.00 0.00 H new ATOM 0 HB3 PHE A 59 3.324 8.792 7.014 1.00 0.00 H new ATOM 0 HD1 PHE A 59 2.382 10.823 5.759 1.00 0.00 H new ATOM 0 HD2 PHE A 59 0.172 7.227 6.341 1.00 0.00 H new ATOM 0 HE1 PHE A 59 0.293 12.039 5.319 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -1.920 8.442 5.907 1.00 0.00 H new ATOM 0 HZ PHE A 59 -1.863 10.850 5.398 1.00 0.00 H new ATOM 907 N ASP A 60 5.707 7.953 6.051 1.00 0.00 N ATOM 908 CA ASP A 60 6.966 7.416 6.544 1.00 0.00 C ATOM 909 C ASP A 60 6.729 6.604 7.808 1.00 0.00 C ATOM 910 O ASP A 60 6.065 7.066 8.738 1.00 0.00 O ATOM 911 CB ASP A 60 7.959 8.545 6.818 1.00 0.00 C ATOM 912 CG ASP A 60 9.254 8.045 7.419 1.00 0.00 C ATOM 913 OD1 ASP A 60 10.076 7.469 6.678 1.00 0.00 O ATOM 914 OD2 ASP A 60 9.455 8.228 8.639 1.00 0.00 O ATOM 0 H ASP A 60 5.589 8.954 6.208 1.00 0.00 H new ATOM 0 HA ASP A 60 7.389 6.763 5.780 1.00 0.00 H new ATOM 0 HB2 ASP A 60 8.173 9.070 5.887 1.00 0.00 H new ATOM 0 HB3 ASP A 60 7.504 9.269 7.494 1.00 0.00 H new ATOM 919 N GLY A 61 7.254 5.389 7.831 1.00 0.00 N ATOM 920 CA GLY A 61 7.027 4.506 8.956 1.00 0.00 C ATOM 921 C GLY A 61 5.631 3.919 8.926 1.00 0.00 C ATOM 922 O GLY A 61 5.122 3.445 9.943 1.00 0.00 O ATOM 0 H GLY A 61 7.834 4.998 7.089 1.00 0.00 H new ATOM 0 HA2 GLY A 61 7.762 3.701 8.943 1.00 0.00 H new ATOM 0 HA3 GLY A 61 7.172 5.055 9.886 1.00 0.00 H new ATOM 926 N ASP A 62 5.012 3.969 7.756 1.00 0.00 N ATOM 927 CA ASP A 62 3.669 3.437 7.572 1.00 0.00 C ATOM 928 C ASP A 62 3.759 1.984 7.124 1.00 0.00 C ATOM 929 O ASP A 62 4.783 1.558 6.584 1.00 0.00 O ATOM 930 CB ASP A 62 2.915 4.283 6.540 1.00 0.00 C ATOM 931 CG ASP A 62 1.452 3.915 6.398 1.00 0.00 C ATOM 932 OD1 ASP A 62 0.864 3.371 7.358 1.00 0.00 O ATOM 933 OD2 ASP A 62 0.875 4.197 5.327 1.00 0.00 O ATOM 0 H ASP A 62 5.421 4.375 6.915 1.00 0.00 H new ATOM 0 HA ASP A 62 3.121 3.478 8.513 1.00 0.00 H new ATOM 0 HB2 ASP A 62 2.990 5.334 6.821 1.00 0.00 H new ATOM 0 HB3 ASP A 62 3.402 4.176 5.571 1.00 0.00 H new ATOM 938 N ILE A 63 2.705 1.223 7.354 1.00 0.00 N ATOM 939 CA ILE A 63 2.721 -0.200 7.059 1.00 0.00 C ATOM 940 C ILE A 63 1.523 -0.591 6.209 1.00 0.00 C ATOM 941 O ILE A 63 0.374 -0.512 6.649 1.00 0.00 O ATOM 942 CB ILE A 63 2.752 -1.053 8.345 1.00 0.00 C ATOM 943 CG1 ILE A 63 3.986 -0.685 9.180 1.00 0.00 C ATOM 944 CG2 ILE A 63 2.738 -2.542 8.005 1.00 0.00 C ATOM 945 CD1 ILE A 63 4.299 -1.662 10.289 1.00 0.00 C ATOM 0 H ILE A 63 1.827 1.565 7.744 1.00 0.00 H new ATOM 0 HA ILE A 63 3.635 -0.399 6.499 1.00 0.00 H new ATOM 0 HB ILE A 63 1.860 -0.843 8.934 1.00 0.00 H new ATOM 0 HG12 ILE A 63 4.850 -0.614 8.519 1.00 0.00 H new ATOM 0 HG13 ILE A 63 3.835 0.303 9.614 1.00 0.00 H new ATOM 0 HG21 ILE A 63 2.760 -3.126 8.925 1.00 0.00 H new ATOM 0 HG22 ILE A 63 1.832 -2.779 7.447 1.00 0.00 H new ATOM 0 HG23 ILE A 63 3.611 -2.785 7.400 1.00 0.00 H new ATOM 0 HD11 ILE A 63 5.185 -1.328 10.829 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.454 -1.716 10.975 1.00 0.00 H new ATOM 0 HD13 ILE A 63 4.484 -2.648 9.863 1.00 0.00 H new ATOM 957 N ILE A 64 1.805 -1.009 4.989 1.00 0.00 N ATOM 958 CA ILE A 64 0.767 -1.384 4.048 1.00 0.00 C ATOM 959 C ILE A 64 0.561 -2.893 4.063 1.00 0.00 C ATOM 960 O ILE A 64 1.399 -3.647 3.566 1.00 0.00 O ATOM 961 CB ILE A 64 1.124 -0.955 2.609 1.00 0.00 C ATOM 962 CG1 ILE A 64 1.630 0.492 2.577 1.00 0.00 C ATOM 963 CG2 ILE A 64 -0.083 -1.112 1.693 1.00 0.00 C ATOM 964 CD1 ILE A 64 0.621 1.508 3.057 1.00 0.00 C ATOM 0 H ILE A 64 2.754 -1.098 4.625 1.00 0.00 H new ATOM 0 HA ILE A 64 -0.146 -0.873 4.356 1.00 0.00 H new ATOM 0 HB ILE A 64 1.924 -1.604 2.251 1.00 0.00 H new ATOM 0 HG12 ILE A 64 2.526 0.566 3.193 1.00 0.00 H new ATOM 0 HG13 ILE A 64 1.923 0.741 1.557 1.00 0.00 H new ATOM 0 HG21 ILE A 64 0.185 -0.805 0.682 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -0.400 -2.155 1.684 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.899 -0.488 2.057 1.00 0.00 H new ATOM 0 HD11 ILE A 64 1.056 2.506 3.003 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -0.267 1.465 2.426 1.00 0.00 H new ATOM 0 HD13 ILE A 64 0.345 1.288 4.088 1.00 0.00 H new ATOM 976 N GLU A 65 -0.543 -3.339 4.643 1.00 0.00 N ATOM 977 CA GLU A 65 -0.861 -4.756 4.641 1.00 0.00 C ATOM 978 C GLU A 65 -1.830 -5.058 3.509 1.00 0.00 C ATOM 979 O GLU A 65 -3.020 -4.765 3.604 1.00 0.00 O ATOM 980 CB GLU A 65 -1.451 -5.203 5.985 1.00 0.00 C ATOM 981 CG GLU A 65 -1.754 -6.695 6.038 1.00 0.00 C ATOM 982 CD GLU A 65 -2.230 -7.158 7.401 1.00 0.00 C ATOM 983 OE1 GLU A 65 -1.375 -7.374 8.288 1.00 0.00 O ATOM 984 OE2 GLU A 65 -3.455 -7.325 7.586 1.00 0.00 O ATOM 0 H GLU A 65 -1.226 -2.747 5.116 1.00 0.00 H new ATOM 0 HA GLU A 65 0.062 -5.315 4.488 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -0.753 -4.952 6.783 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -2.368 -4.645 6.176 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -2.515 -6.932 5.294 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -0.858 -7.252 5.765 1.00 0.00 H new ATOM 991 N VAL A 66 -1.311 -5.611 2.427 1.00 0.00 N ATOM 992 CA VAL A 66 -2.139 -5.948 1.287 1.00 0.00 C ATOM 993 C VAL A 66 -2.461 -7.431 1.296 1.00 0.00 C ATOM 994 O VAL A 66 -1.606 -8.272 1.011 1.00 0.00 O ATOM 995 CB VAL A 66 -1.469 -5.563 -0.050 1.00 0.00 C ATOM 996 CG1 VAL A 66 -2.295 -6.047 -1.236 1.00 0.00 C ATOM 997 CG2 VAL A 66 -1.272 -4.057 -0.123 1.00 0.00 C ATOM 0 H VAL A 66 -0.322 -5.835 2.316 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.061 -5.372 1.372 1.00 0.00 H new ATOM 0 HB VAL A 66 -0.495 -6.050 -0.096 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.800 -5.762 -2.164 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.391 -7.132 -1.194 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.285 -5.593 -1.199 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.799 -3.797 -1.070 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -2.239 -3.560 -0.052 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.636 -3.733 0.701 1.00 0.00 H new ATOM 1007 N ILE A 67 -3.693 -7.742 1.645 1.00 0.00 N ATOM 1008 CA ILE A 67 -4.152 -9.111 1.666 1.00 0.00 C ATOM 1009 C ILE A 67 -4.770 -9.447 0.324 1.00 0.00 C ATOM 1010 O ILE A 67 -5.932 -9.124 0.061 1.00 0.00 O ATOM 1011 CB ILE A 67 -5.192 -9.361 2.780 1.00 0.00 C ATOM 1012 CG1 ILE A 67 -4.669 -8.858 4.129 1.00 0.00 C ATOM 1013 CG2 ILE A 67 -5.544 -10.842 2.860 1.00 0.00 C ATOM 1014 CD1 ILE A 67 -5.608 -9.139 5.280 1.00 0.00 C ATOM 0 H ILE A 67 -4.397 -7.057 1.920 1.00 0.00 H new ATOM 0 HA ILE A 67 -3.291 -9.748 1.868 1.00 0.00 H new ATOM 0 HB ILE A 67 -6.097 -8.805 2.535 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -3.706 -9.325 4.334 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -4.496 -7.784 4.065 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -6.278 -10.999 3.650 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.961 -11.169 1.907 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -4.645 -11.418 3.080 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -5.175 -8.756 6.204 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -6.565 -8.649 5.097 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -5.762 -10.214 5.370 1.00 0.00 H new ATOM 1026 N ARG A 68 -3.973 -10.047 -0.541 1.00 0.00 N ATOM 1027 CA ARG A 68 -4.455 -10.457 -1.843 1.00 0.00 C ATOM 1028 C ARG A 68 -5.319 -11.693 -1.700 1.00 0.00 C ATOM 1029 O ARG A 68 -5.195 -12.445 -0.732 1.00 0.00 O ATOM 1030 CB ARG A 68 -3.297 -10.746 -2.802 1.00 0.00 C ATOM 1031 CG ARG A 68 -2.274 -11.704 -2.232 1.00 0.00 C ATOM 1032 CD ARG A 68 -1.589 -12.517 -3.318 1.00 0.00 C ATOM 1033 NE ARG A 68 -2.476 -13.522 -3.909 1.00 0.00 N ATOM 1034 CZ ARG A 68 -2.093 -14.768 -4.202 1.00 0.00 C ATOM 1035 NH1 ARG A 68 -0.850 -15.157 -3.951 1.00 0.00 N ATOM 1036 NH2 ARG A 68 -2.950 -15.627 -4.740 1.00 0.00 N ATOM 0 H ARG A 68 -2.991 -10.260 -0.364 1.00 0.00 H new ATOM 0 HA ARG A 68 -5.043 -9.639 -2.259 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -3.696 -11.160 -3.728 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.804 -9.808 -3.058 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -1.525 -11.144 -1.672 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -2.761 -12.378 -1.527 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -1.233 -11.846 -4.100 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -0.713 -13.012 -2.899 1.00 0.00 H new ATOM 0 HE ARG A 68 -3.440 -13.256 -4.108 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -0.186 -14.505 -3.534 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -0.558 -16.108 -4.175 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -3.909 -15.338 -4.933 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -2.650 -16.576 -4.961 1.00 0.00 H new ATOM 1050 N VAL A 69 -6.191 -11.907 -2.662 1.00 0.00 N ATOM 1051 CA VAL A 69 -7.066 -13.055 -2.621 1.00 0.00 C ATOM 1052 C VAL A 69 -6.356 -14.290 -3.165 1.00 0.00 C ATOM 1053 O VAL A 69 -5.798 -14.279 -4.265 1.00 0.00 O ATOM 1054 CB VAL A 69 -8.381 -12.804 -3.402 1.00 0.00 C ATOM 1055 CG1 VAL A 69 -8.099 -12.439 -4.852 1.00 0.00 C ATOM 1056 CG2 VAL A 69 -9.296 -14.019 -3.326 1.00 0.00 C ATOM 0 H VAL A 69 -6.311 -11.305 -3.476 1.00 0.00 H new ATOM 0 HA VAL A 69 -7.328 -13.228 -1.577 1.00 0.00 H new ATOM 0 HB VAL A 69 -8.888 -11.960 -2.934 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -9.041 -12.269 -5.374 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -7.495 -11.532 -4.888 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -7.559 -13.254 -5.334 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -10.213 -13.820 -3.881 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -8.791 -14.883 -3.758 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -9.541 -14.226 -2.284 1.00 0.00 H new ATOM 1066 N ILE A 70 -6.320 -15.329 -2.352 1.00 0.00 N ATOM 1067 CA ILE A 70 -5.917 -16.635 -2.818 1.00 0.00 C ATOM 1068 C ILE A 70 -7.156 -17.329 -3.367 1.00 0.00 C ATOM 1069 O ILE A 70 -8.023 -17.776 -2.615 1.00 0.00 O ATOM 1070 CB ILE A 70 -5.243 -17.473 -1.695 1.00 0.00 C ATOM 1071 CG1 ILE A 70 -4.960 -18.901 -2.176 1.00 0.00 C ATOM 1072 CG2 ILE A 70 -6.083 -17.482 -0.422 1.00 0.00 C ATOM 1073 CD1 ILE A 70 -3.909 -18.978 -3.262 1.00 0.00 C ATOM 0 H ILE A 70 -6.567 -15.290 -1.363 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.164 -16.532 -3.599 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.291 -16.999 -1.455 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -4.638 -19.504 -1.327 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -5.886 -19.341 -2.546 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -5.581 -18.077 0.341 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -6.208 -16.461 -0.062 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.061 -17.914 -0.634 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.761 -20.018 -3.552 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -4.237 -18.403 -4.128 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.970 -18.569 -2.889 1.00 0.00 H new ATOM 1085 N TYR A 71 -7.272 -17.350 -4.686 1.00 0.00 N ATOM 1086 CA TYR A 71 -8.496 -17.795 -5.330 1.00 0.00 C ATOM 1087 C TYR A 71 -8.757 -19.272 -5.063 1.00 0.00 C ATOM 1088 O TYR A 71 -8.112 -20.151 -5.634 1.00 0.00 O ATOM 1089 CB TYR A 71 -8.452 -17.516 -6.830 1.00 0.00 C ATOM 1090 CG TYR A 71 -9.810 -17.579 -7.483 1.00 0.00 C ATOM 1091 CD1 TYR A 71 -10.727 -16.550 -7.309 1.00 0.00 C ATOM 1092 CD2 TYR A 71 -10.180 -18.660 -8.271 1.00 0.00 C ATOM 1093 CE1 TYR A 71 -11.973 -16.596 -7.898 1.00 0.00 C ATOM 1094 CE2 TYR A 71 -11.425 -18.712 -8.866 1.00 0.00 C ATOM 1095 CZ TYR A 71 -12.317 -17.679 -8.676 1.00 0.00 C ATOM 1096 OH TYR A 71 -13.557 -17.726 -9.267 1.00 0.00 O ATOM 0 H TYR A 71 -6.534 -17.064 -5.330 1.00 0.00 H new ATOM 0 HA TYR A 71 -9.322 -17.228 -4.900 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -8.020 -16.529 -6.998 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -7.791 -18.239 -7.309 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -10.459 -15.698 -6.701 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -9.484 -19.472 -8.421 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -12.674 -15.788 -7.750 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -11.699 -19.559 -9.478 1.00 0.00 H new ATOM 0 HH TYR A 71 -13.642 -18.555 -9.783 1.00 0.00 H new ATOM 1106 N GLY A 72 -9.702 -19.523 -4.175 1.00 0.00 N ATOM 1107 CA GLY A 72 -10.066 -20.874 -3.828 1.00 0.00 C ATOM 1108 C GLY A 72 -11.341 -20.908 -3.020 1.00 0.00 C ATOM 1109 O GLY A 72 -12.416 -20.623 -3.543 1.00 0.00 O ATOM 0 H GLY A 72 -10.230 -18.802 -3.683 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -10.193 -21.463 -4.736 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -9.259 -21.335 -3.258 1.00 0.00 H new ATOM 1113 N GLY A 73 -11.224 -21.235 -1.744 1.00 0.00 N ATOM 1114 CA GLY A 73 -12.384 -21.300 -0.883 1.00 0.00 C ATOM 1115 C GLY A 73 -12.193 -22.311 0.219 1.00 0.00 C ATOM 1116 O GLY A 73 -11.419 -23.269 0.008 1.00 0.00 O ATOM 1117 OXT GLY A 73 -12.803 -22.160 1.294 1.00 0.00 O ATOM 0 H GLY A 73 -10.340 -21.458 -1.287 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -12.573 -20.318 -0.450 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -13.263 -21.563 -1.472 1.00 0.00 H new TER 1121 GLY A 73