USER MOD reduce.3.24.130724 H: found=0, std=0, add=515, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 518 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 102 HIS : no HE2:sc= -3.42 K(o=-2,f=-9.5!) USER MOD Set 1.2: A 105 ASN : amide:sc= 1.41 K(o=-2,f=-9!) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 84 HIS : no HD1:sc= -0.084 X(o=-0.084,f=-0.15) USER MOD Single : A 88 LYS NZ :NH3+ 160:sc= -0.049 (180deg=-0.405) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.116 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HE2:sc= 0.924 K(o=0.92,f=-5.9!) USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=-0.0043) USER MOD Single : A 107 HIS : no HD1:sc= 1.34 K(o=1.3,f=-5.3!) USER MOD Single : A 108 LYS NZ :NH3+ -107:sc= 1.02 (180deg=-0.723!) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ -138:sc= 0.934 (180deg=-0.552) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl 155:sc= -1.3 (180deg=-3.23!) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot -30:sc= 0.682 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 SER OG : rot 76:sc= 1.08 USER MOD Single : A 138 ASN : amide:sc= -0.816 K(o=-0.82,f=-0.12) USER MOD Single : A 143 ASN : amide:sc= -0.0982 X(o=-0.098,f=-0.14) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 75 16.587 2.485 4.554 1.00 0.00 N ATOM 2 CA GLY A 75 15.339 3.088 5.064 1.00 0.00 C ATOM 3 C GLY A 75 14.160 2.785 4.166 1.00 0.00 C ATOM 4 O GLY A 75 14.341 2.272 3.061 1.00 0.00 O ATOM 0 HA2 GLY A 75 15.138 2.712 6.067 1.00 0.00 H new ATOM 0 HA3 GLY A 75 15.465 4.168 5.147 1.00 0.00 H new ATOM 10 N PRO A 76 12.934 3.088 4.613 1.00 0.00 N ATOM 11 CA PRO A 76 11.721 2.836 3.829 1.00 0.00 C ATOM 12 C PRO A 76 11.624 3.753 2.611 1.00 0.00 C ATOM 13 O PRO A 76 11.699 4.980 2.736 1.00 0.00 O ATOM 14 CB PRO A 76 10.588 3.140 4.817 1.00 0.00 C ATOM 15 CG PRO A 76 11.185 4.093 5.792 1.00 0.00 C ATOM 16 CD PRO A 76 12.630 3.702 5.919 1.00 0.00 C ATOM 0 HA PRO A 76 11.695 1.822 3.430 1.00 0.00 H new ATOM 0 HB2 PRO A 76 9.728 3.578 4.311 1.00 0.00 H new ATOM 0 HB3 PRO A 76 10.239 2.233 5.312 1.00 0.00 H new ATOM 0 HG2 PRO A 76 11.088 5.121 5.443 1.00 0.00 H new ATOM 0 HG3 PRO A 76 10.679 4.034 6.755 1.00 0.00 H new ATOM 0 HD2 PRO A 76 13.265 4.567 6.114 1.00 0.00 H new ATOM 0 HD3 PRO A 76 12.786 3.001 6.739 1.00 0.00 H new ATOM 24 N LEU A 77 11.476 3.162 1.439 1.00 0.00 N ATOM 25 CA LEU A 77 11.364 3.935 0.207 1.00 0.00 C ATOM 26 C LEU A 77 10.022 4.655 0.147 1.00 0.00 C ATOM 27 O LEU A 77 9.056 4.239 0.790 1.00 0.00 O ATOM 28 CB LEU A 77 11.558 3.048 -1.036 1.00 0.00 C ATOM 29 CG LEU A 77 13.003 2.610 -1.355 1.00 0.00 C ATOM 30 CD1 LEU A 77 13.919 3.816 -1.496 1.00 0.00 C ATOM 31 CD2 LEU A 77 13.537 1.643 -0.305 1.00 0.00 C ATOM 0 H LEU A 77 11.430 2.151 1.310 1.00 0.00 H new ATOM 0 HA LEU A 77 12.160 4.679 0.210 1.00 0.00 H new ATOM 0 HB2 LEU A 77 10.950 2.152 -0.913 1.00 0.00 H new ATOM 0 HB3 LEU A 77 11.166 3.583 -1.901 1.00 0.00 H new ATOM 0 HG LEU A 77 12.984 2.084 -2.310 1.00 0.00 H new ATOM 0 HD11 LEU A 77 14.931 3.480 -1.721 1.00 0.00 H new ATOM 0 HD12 LEU A 77 13.560 4.453 -2.305 1.00 0.00 H new ATOM 0 HD13 LEU A 77 13.923 4.381 -0.564 1.00 0.00 H new ATOM 0 HD21 LEU A 77 14.557 1.355 -0.561 1.00 0.00 H new ATOM 0 HD22 LEU A 77 13.531 2.127 0.672 1.00 0.00 H new ATOM 0 HD23 LEU A 77 12.906 0.755 -0.274 1.00 0.00 H new ATOM 43 N GLY A 78 9.967 5.724 -0.629 1.00 0.00 N ATOM 44 CA GLY A 78 8.758 6.518 -0.700 1.00 0.00 C ATOM 45 C GLY A 78 7.962 6.284 -1.959 1.00 0.00 C ATOM 46 O GLY A 78 6.745 6.099 -1.906 1.00 0.00 O ATOM 0 H GLY A 78 10.736 6.057 -1.211 1.00 0.00 H new ATOM 0 HA2 GLY A 78 8.133 6.292 0.164 1.00 0.00 H new ATOM 0 HA3 GLY A 78 9.021 7.574 -0.636 1.00 0.00 H new ATOM 50 N SER A 79 8.641 6.313 -3.097 1.00 0.00 N ATOM 51 CA SER A 79 7.997 6.101 -4.385 1.00 0.00 C ATOM 52 C SER A 79 7.326 4.730 -4.433 1.00 0.00 C ATOM 53 O SER A 79 6.218 4.587 -4.949 1.00 0.00 O ATOM 54 CB SER A 79 9.028 6.231 -5.508 1.00 0.00 C ATOM 55 OG SER A 79 8.415 6.166 -6.789 1.00 0.00 O ATOM 0 H SER A 79 9.645 6.483 -3.154 1.00 0.00 H new ATOM 0 HA SER A 79 7.227 6.860 -4.521 1.00 0.00 H new ATOM 0 HB2 SER A 79 9.561 7.176 -5.406 1.00 0.00 H new ATOM 0 HB3 SER A 79 9.768 5.436 -5.417 1.00 0.00 H new ATOM 0 HG SER A 79 9.100 6.254 -7.484 1.00 0.00 H new ATOM 61 N ASP A 80 7.994 3.743 -3.875 1.00 0.00 N ATOM 62 CA ASP A 80 7.462 2.399 -3.832 1.00 0.00 C ATOM 63 C ASP A 80 7.958 1.653 -2.618 1.00 0.00 C ATOM 64 O ASP A 80 9.160 1.528 -2.386 1.00 0.00 O ATOM 65 CB ASP A 80 7.744 1.615 -5.138 1.00 0.00 C ATOM 66 CG ASP A 80 9.212 1.359 -5.407 1.00 0.00 C ATOM 67 OD1 ASP A 80 9.867 2.214 -6.037 1.00 0.00 O ATOM 68 OD2 ASP A 80 9.712 0.282 -5.021 1.00 0.00 O ATOM 0 H ASP A 80 8.912 3.848 -3.443 1.00 0.00 H new ATOM 0 HA ASP A 80 6.379 2.487 -3.748 1.00 0.00 H new ATOM 0 HB2 ASP A 80 7.223 0.659 -5.094 1.00 0.00 H new ATOM 0 HB3 ASP A 80 7.324 2.168 -5.978 1.00 0.00 H new ATOM 73 N LEU A 81 7.019 1.189 -1.829 1.00 0.00 N ATOM 74 CA LEU A 81 7.311 0.446 -0.624 1.00 0.00 C ATOM 75 C LEU A 81 7.183 -1.035 -0.930 1.00 0.00 C ATOM 76 O LEU A 81 6.173 -1.473 -1.472 1.00 0.00 O ATOM 77 CB LEU A 81 6.334 0.890 0.491 1.00 0.00 C ATOM 78 CG LEU A 81 6.552 0.331 1.922 1.00 0.00 C ATOM 79 CD1 LEU A 81 6.006 -1.086 2.067 1.00 0.00 C ATOM 80 CD2 LEU A 81 8.022 0.381 2.306 1.00 0.00 C ATOM 0 H LEU A 81 6.023 1.317 -2.005 1.00 0.00 H new ATOM 0 HA LEU A 81 8.326 0.639 -0.276 1.00 0.00 H new ATOM 0 HB2 LEU A 81 6.368 1.978 0.550 1.00 0.00 H new ATOM 0 HB3 LEU A 81 5.326 0.619 0.178 1.00 0.00 H new ATOM 0 HG LEU A 81 5.994 0.969 2.607 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.179 -1.440 3.083 1.00 0.00 H new ATOM 0 HD12 LEU A 81 4.936 -1.087 1.859 1.00 0.00 H new ATOM 0 HD13 LEU A 81 6.513 -1.745 1.362 1.00 0.00 H new ATOM 0 HD21 LEU A 81 8.149 -0.016 3.313 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.602 -0.218 1.604 1.00 0.00 H new ATOM 0 HD23 LEU A 81 8.371 1.413 2.277 1.00 0.00 H new ATOM 92 N ILE A 82 8.203 -1.799 -0.610 1.00 0.00 N ATOM 93 CA ILE A 82 8.200 -3.211 -0.918 1.00 0.00 C ATOM 94 C ILE A 82 7.612 -4.023 0.225 1.00 0.00 C ATOM 95 O ILE A 82 7.810 -3.703 1.395 1.00 0.00 O ATOM 96 CB ILE A 82 9.622 -3.730 -1.228 1.00 0.00 C ATOM 97 CG1 ILE A 82 10.276 -2.884 -2.310 1.00 0.00 C ATOM 98 CG2 ILE A 82 9.575 -5.179 -1.659 1.00 0.00 C ATOM 99 CD1 ILE A 82 11.624 -3.404 -2.755 1.00 0.00 C ATOM 0 H ILE A 82 9.044 -1.467 -0.137 1.00 0.00 H new ATOM 0 HA ILE A 82 7.579 -3.335 -1.805 1.00 0.00 H new ATOM 0 HB ILE A 82 10.218 -3.655 -0.319 1.00 0.00 H new ATOM 0 HG12 ILE A 82 9.612 -2.836 -3.173 1.00 0.00 H new ATOM 0 HG13 ILE A 82 10.393 -1.865 -1.941 1.00 0.00 H new ATOM 0 HG21 ILE A 82 10.585 -5.528 -1.873 1.00 0.00 H new ATOM 0 HG22 ILE A 82 9.145 -5.783 -0.860 1.00 0.00 H new ATOM 0 HG23 ILE A 82 8.961 -5.272 -2.555 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.029 -2.750 -3.527 1.00 0.00 H new ATOM 0 HD12 ILE A 82 12.305 -3.425 -1.904 1.00 0.00 H new ATOM 0 HD13 ILE A 82 11.511 -4.412 -3.155 1.00 0.00 H new ATOM 111 N VAL A 83 6.919 -5.082 -0.124 1.00 0.00 N ATOM 112 CA VAL A 83 6.300 -5.973 0.831 1.00 0.00 C ATOM 113 C VAL A 83 6.646 -7.406 0.462 1.00 0.00 C ATOM 114 O VAL A 83 7.153 -7.660 -0.633 1.00 0.00 O ATOM 115 CB VAL A 83 4.760 -5.811 0.860 1.00 0.00 C ATOM 116 CG1 VAL A 83 4.368 -4.451 1.413 1.00 0.00 C ATOM 117 CG2 VAL A 83 4.180 -6.008 -0.533 1.00 0.00 C ATOM 0 H VAL A 83 6.767 -5.353 -1.095 1.00 0.00 H new ATOM 0 HA VAL A 83 6.679 -5.724 1.822 1.00 0.00 H new ATOM 0 HB VAL A 83 4.349 -6.575 1.520 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.282 -4.362 1.423 1.00 0.00 H new ATOM 0 HG12 VAL A 83 4.750 -4.347 2.429 1.00 0.00 H new ATOM 0 HG13 VAL A 83 4.791 -3.667 0.785 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.097 -5.891 -0.496 1.00 0.00 H new ATOM 0 HG22 VAL A 83 4.602 -5.266 -1.211 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.425 -7.008 -0.891 1.00 0.00 H new ATOM 127 N HIS A 84 6.369 -8.330 1.349 1.00 0.00 N ATOM 128 CA HIS A 84 6.690 -9.728 1.101 1.00 0.00 C ATOM 129 C HIS A 84 5.477 -10.624 1.296 1.00 0.00 C ATOM 130 O HIS A 84 4.974 -10.776 2.406 1.00 0.00 O ATOM 131 CB HIS A 84 7.867 -10.191 1.981 1.00 0.00 C ATOM 132 CG HIS A 84 7.649 -10.031 3.458 1.00 0.00 C ATOM 133 ND1 HIS A 84 7.319 -11.078 4.289 1.00 0.00 N ATOM 134 CD2 HIS A 84 7.721 -8.938 4.249 1.00 0.00 C ATOM 135 CE1 HIS A 84 7.194 -10.638 5.522 1.00 0.00 C ATOM 136 NE2 HIS A 84 7.435 -9.342 5.527 1.00 0.00 N ATOM 0 H HIS A 84 5.924 -8.148 2.248 1.00 0.00 H new ATOM 0 HA HIS A 84 6.995 -9.813 0.058 1.00 0.00 H new ATOM 0 HB2 HIS A 84 8.070 -11.241 1.769 1.00 0.00 H new ATOM 0 HB3 HIS A 84 8.758 -9.631 1.696 1.00 0.00 H new ATOM 0 HD2 HIS A 84 7.959 -7.933 3.933 1.00 0.00 H new ATOM 0 HE1 HIS A 84 6.938 -11.236 6.384 1.00 0.00 H new ATOM 0 HE2 HIS A 84 7.412 -8.738 6.349 1.00 0.00 H new ATOM 145 N GLU A 85 5.011 -11.212 0.212 1.00 0.00 N ATOM 146 CA GLU A 85 3.852 -12.083 0.258 1.00 0.00 C ATOM 147 C GLU A 85 4.213 -13.482 -0.216 1.00 0.00 C ATOM 148 O GLU A 85 4.357 -13.724 -1.420 1.00 0.00 O ATOM 149 CB GLU A 85 2.722 -11.526 -0.610 1.00 0.00 C ATOM 150 CG GLU A 85 2.334 -10.094 -0.286 1.00 0.00 C ATOM 151 CD GLU A 85 1.953 -9.897 1.169 1.00 0.00 C ATOM 152 OE1 GLU A 85 1.262 -10.765 1.729 1.00 0.00 O ATOM 153 OE2 GLU A 85 2.308 -8.854 1.746 1.00 0.00 O ATOM 0 H GLU A 85 5.419 -11.102 -0.716 1.00 0.00 H new ATOM 0 HA GLU A 85 3.514 -12.134 1.293 1.00 0.00 H new ATOM 0 HB2 GLU A 85 3.022 -11.581 -1.656 1.00 0.00 H new ATOM 0 HB3 GLU A 85 1.845 -12.163 -0.496 1.00 0.00 H new ATOM 0 HG2 GLU A 85 3.166 -9.434 -0.530 1.00 0.00 H new ATOM 0 HG3 GLU A 85 1.497 -9.799 -0.918 1.00 0.00 H new ATOM 160 N GLY A 86 4.379 -14.394 0.727 1.00 0.00 N ATOM 161 CA GLY A 86 4.698 -15.767 0.388 1.00 0.00 C ATOM 162 C GLY A 86 6.058 -15.904 -0.268 1.00 0.00 C ATOM 163 O GLY A 86 6.222 -16.669 -1.218 1.00 0.00 O ATOM 0 H GLY A 86 4.298 -14.209 1.727 1.00 0.00 H new ATOM 0 HA2 GLY A 86 4.671 -16.376 1.292 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.934 -16.159 -0.283 1.00 0.00 H new ATOM 167 N GLY A 87 7.028 -15.157 0.231 1.00 0.00 N ATOM 168 CA GLY A 87 8.369 -15.215 -0.320 1.00 0.00 C ATOM 169 C GLY A 87 8.554 -14.311 -1.525 1.00 0.00 C ATOM 170 O GLY A 87 9.674 -14.123 -2.000 1.00 0.00 O ATOM 0 H GLY A 87 6.913 -14.509 1.010 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.086 -14.934 0.452 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.595 -16.243 -0.605 1.00 0.00 H new ATOM 174 N LYS A 88 7.464 -13.743 -2.017 1.00 0.00 N ATOM 175 CA LYS A 88 7.523 -12.877 -3.182 1.00 0.00 C ATOM 176 C LYS A 88 7.485 -11.422 -2.775 1.00 0.00 C ATOM 177 O LYS A 88 6.615 -11.000 -2.009 1.00 0.00 O ATOM 178 CB LYS A 88 6.369 -13.175 -4.135 1.00 0.00 C ATOM 179 CG LYS A 88 6.413 -14.554 -4.761 1.00 0.00 C ATOM 180 CD LYS A 88 7.658 -14.743 -5.609 1.00 0.00 C ATOM 181 CE LYS A 88 7.595 -16.030 -6.409 1.00 0.00 C ATOM 182 NZ LYS A 88 6.480 -16.016 -7.386 1.00 0.00 N ATOM 0 H LYS A 88 6.529 -13.866 -1.628 1.00 0.00 H new ATOM 0 HA LYS A 88 8.465 -13.073 -3.694 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.429 -13.065 -3.594 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.368 -12.429 -4.929 1.00 0.00 H new ATOM 0 HG2 LYS A 88 6.388 -15.311 -3.977 1.00 0.00 H new ATOM 0 HG3 LYS A 88 5.526 -14.703 -5.377 1.00 0.00 H new ATOM 0 HD2 LYS A 88 7.770 -13.897 -6.287 1.00 0.00 H new ATOM 0 HD3 LYS A 88 8.539 -14.755 -4.967 1.00 0.00 H new ATOM 0 HE2 LYS A 88 8.538 -16.177 -6.935 1.00 0.00 H new ATOM 0 HE3 LYS A 88 7.473 -16.874 -5.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 6.658 -16.725 -8.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 5.589 -16.240 -6.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 6.410 -15.073 -7.819 1.00 0.00 H new ATOM 196 N THR A 89 8.426 -10.666 -3.275 1.00 0.00 N ATOM 197 CA THR A 89 8.502 -9.257 -3.002 1.00 0.00 C ATOM 198 C THR A 89 7.645 -8.462 -3.979 1.00 0.00 C ATOM 199 O THR A 89 7.765 -8.618 -5.196 1.00 0.00 O ATOM 200 CB THR A 89 9.951 -8.777 -3.097 1.00 0.00 C ATOM 201 OG1 THR A 89 10.778 -9.832 -3.619 1.00 0.00 O ATOM 202 CG2 THR A 89 10.458 -8.350 -1.736 1.00 0.00 C ATOM 0 H THR A 89 9.165 -11.013 -3.886 1.00 0.00 H new ATOM 0 HA THR A 89 8.127 -9.093 -1.992 1.00 0.00 H new ATOM 0 HB THR A 89 9.993 -7.919 -3.768 1.00 0.00 H new ATOM 0 HG1 THR A 89 11.705 -9.521 -3.680 1.00 0.00 H new ATOM 0 HG21 THR A 89 11.490 -8.011 -1.822 1.00 0.00 H new ATOM 0 HG22 THR A 89 9.840 -7.537 -1.356 1.00 0.00 H new ATOM 0 HG23 THR A 89 10.409 -9.194 -1.048 1.00 0.00 H new ATOM 210 N TYR A 90 6.781 -7.624 -3.448 1.00 0.00 N ATOM 211 CA TYR A 90 5.923 -6.788 -4.266 1.00 0.00 C ATOM 212 C TYR A 90 6.159 -5.331 -3.943 1.00 0.00 C ATOM 213 O TYR A 90 6.504 -4.987 -2.819 1.00 0.00 O ATOM 214 CB TYR A 90 4.447 -7.137 -4.051 1.00 0.00 C ATOM 215 CG TYR A 90 4.046 -8.480 -4.605 1.00 0.00 C ATOM 216 CD1 TYR A 90 4.139 -9.630 -3.836 1.00 0.00 C ATOM 217 CD2 TYR A 90 3.576 -8.597 -5.906 1.00 0.00 C ATOM 218 CE1 TYR A 90 3.774 -10.858 -4.347 1.00 0.00 C ATOM 219 CE2 TYR A 90 3.209 -9.821 -6.422 1.00 0.00 C ATOM 220 CZ TYR A 90 3.310 -10.948 -5.641 1.00 0.00 C ATOM 221 OH TYR A 90 2.952 -12.169 -6.155 1.00 0.00 O ATOM 0 H TYR A 90 6.652 -7.502 -2.444 1.00 0.00 H new ATOM 0 HA TYR A 90 6.169 -6.971 -5.312 1.00 0.00 H new ATOM 0 HB2 TYR A 90 4.232 -7.118 -2.983 1.00 0.00 H new ATOM 0 HB3 TYR A 90 3.831 -6.366 -4.514 1.00 0.00 H new ATOM 0 HD1 TYR A 90 4.503 -9.563 -2.821 1.00 0.00 H new ATOM 0 HD2 TYR A 90 3.497 -7.715 -6.524 1.00 0.00 H new ATOM 0 HE1 TYR A 90 3.852 -11.745 -3.736 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.844 -9.895 -7.436 1.00 0.00 H new ATOM 0 HH TYR A 90 2.645 -12.058 -7.079 1.00 0.00 H new ATOM 231 N HIS A 91 5.989 -4.485 -4.925 1.00 0.00 N ATOM 232 CA HIS A 91 6.168 -3.054 -4.742 1.00 0.00 C ATOM 233 C HIS A 91 4.810 -2.367 -4.630 1.00 0.00 C ATOM 234 O HIS A 91 3.850 -2.763 -5.294 1.00 0.00 O ATOM 235 CB HIS A 91 6.969 -2.444 -5.904 1.00 0.00 C ATOM 236 CG HIS A 91 8.378 -2.958 -6.027 1.00 0.00 C ATOM 237 ND1 HIS A 91 9.488 -2.159 -5.882 1.00 0.00 N ATOM 238 CD2 HIS A 91 8.850 -4.194 -6.313 1.00 0.00 C ATOM 239 CE1 HIS A 91 10.575 -2.874 -6.078 1.00 0.00 C ATOM 240 NE2 HIS A 91 10.217 -4.113 -6.340 1.00 0.00 N ATOM 0 H HIS A 91 5.724 -4.758 -5.871 1.00 0.00 H new ATOM 0 HA HIS A 91 6.729 -2.897 -3.821 1.00 0.00 H new ATOM 0 HB2 HIS A 91 6.441 -2.642 -6.837 1.00 0.00 H new ATOM 0 HB3 HIS A 91 7.000 -1.362 -5.779 1.00 0.00 H new ATOM 0 HD1 HIS A 91 9.471 -1.164 -5.657 1.00 0.00 H new ATOM 0 HD2 HIS A 91 8.258 -5.080 -6.488 1.00 0.00 H new ATOM 0 HE1 HIS A 91 11.589 -2.506 -6.032 1.00 0.00 H new ATOM 249 N VAL A 92 4.730 -1.358 -3.785 1.00 0.00 N ATOM 250 CA VAL A 92 3.498 -0.611 -3.590 1.00 0.00 C ATOM 251 C VAL A 92 3.698 0.848 -3.968 1.00 0.00 C ATOM 252 O VAL A 92 4.614 1.506 -3.471 1.00 0.00 O ATOM 253 CB VAL A 92 3.013 -0.686 -2.125 1.00 0.00 C ATOM 254 CG1 VAL A 92 1.773 0.172 -1.921 1.00 0.00 C ATOM 255 CG2 VAL A 92 2.748 -2.128 -1.713 1.00 0.00 C ATOM 0 H VAL A 92 5.511 -1.032 -3.216 1.00 0.00 H new ATOM 0 HA VAL A 92 2.742 -1.063 -4.233 1.00 0.00 H new ATOM 0 HB VAL A 92 3.805 -0.294 -1.487 1.00 0.00 H new ATOM 0 HG11 VAL A 92 1.450 0.103 -0.882 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.005 1.210 -2.161 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.975 -0.182 -2.573 1.00 0.00 H new ATOM 0 HG21 VAL A 92 2.408 -2.154 -0.678 1.00 0.00 H new ATOM 0 HG22 VAL A 92 1.980 -2.556 -2.358 1.00 0.00 H new ATOM 0 HG23 VAL A 92 3.666 -2.708 -1.808 1.00 0.00 H new ATOM 265 N VAL A 93 2.847 1.338 -4.841 1.00 0.00 N ATOM 266 CA VAL A 93 2.909 2.707 -5.300 1.00 0.00 C ATOM 267 C VAL A 93 1.499 3.272 -5.503 1.00 0.00 C ATOM 268 O VAL A 93 0.647 2.632 -6.122 1.00 0.00 O ATOM 269 CB VAL A 93 3.728 2.814 -6.617 1.00 0.00 C ATOM 270 CG1 VAL A 93 3.140 1.931 -7.711 1.00 0.00 C ATOM 271 CG2 VAL A 93 3.834 4.261 -7.086 1.00 0.00 C ATOM 0 H VAL A 93 2.089 0.795 -5.254 1.00 0.00 H new ATOM 0 HA VAL A 93 3.413 3.297 -4.534 1.00 0.00 H new ATOM 0 HB VAL A 93 4.735 2.455 -6.404 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.736 2.030 -8.618 1.00 0.00 H new ATOM 0 HG12 VAL A 93 3.148 0.892 -7.383 1.00 0.00 H new ATOM 0 HG13 VAL A 93 2.115 2.239 -7.916 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.412 4.303 -8.009 1.00 0.00 H new ATOM 0 HG22 VAL A 93 2.835 4.660 -7.265 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.330 4.856 -6.320 1.00 0.00 H new ATOM 281 N CYS A 94 1.255 4.455 -4.971 1.00 0.00 N ATOM 282 CA CYS A 94 -0.045 5.093 -5.102 1.00 0.00 C ATOM 283 C CYS A 94 0.099 6.509 -5.618 1.00 0.00 C ATOM 284 O CYS A 94 0.915 7.280 -5.121 1.00 0.00 O ATOM 285 CB CYS A 94 -0.791 5.091 -3.769 1.00 0.00 C ATOM 286 SG CYS A 94 -1.434 3.461 -3.275 1.00 0.00 S ATOM 0 H CYS A 94 1.940 4.996 -4.443 1.00 0.00 H new ATOM 0 HA CYS A 94 -0.626 4.519 -5.823 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -0.121 5.456 -2.990 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -1.622 5.794 -3.830 1.00 0.00 H new ATOM 291 N HIS A 95 -0.683 6.846 -6.628 1.00 0.00 N ATOM 292 CA HIS A 95 -0.645 8.181 -7.211 1.00 0.00 C ATOM 293 C HIS A 95 -1.868 8.977 -6.769 1.00 0.00 C ATOM 294 O HIS A 95 -1.930 10.198 -6.939 1.00 0.00 O ATOM 295 CB HIS A 95 -0.584 8.102 -8.741 1.00 0.00 C ATOM 296 CG HIS A 95 0.535 7.249 -9.261 1.00 0.00 C ATOM 297 ND1 HIS A 95 0.341 6.209 -10.143 1.00 0.00 N ATOM 298 CD2 HIS A 95 1.867 7.288 -9.023 1.00 0.00 C ATOM 299 CE1 HIS A 95 1.497 5.648 -10.423 1.00 0.00 C ATOM 300 NE2 HIS A 95 2.443 6.281 -9.759 1.00 0.00 N ATOM 0 H HIS A 95 -1.354 6.214 -7.064 1.00 0.00 H new ATOM 0 HA HIS A 95 0.253 8.689 -6.860 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -1.530 7.709 -9.113 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -0.477 9.109 -9.143 1.00 0.00 H new ATOM 0 HD2 HIS A 95 2.381 7.982 -8.375 1.00 0.00 H new ATOM 0 HE1 HIS A 95 1.646 4.809 -11.086 1.00 0.00 H new ATOM 0 HE2 HIS A 95 3.438 6.060 -9.787 1.00 0.00 H new ATOM 309 N GLU A 96 -2.812 8.275 -6.165 1.00 0.00 N ATOM 310 CA GLU A 96 -4.045 8.876 -5.677 1.00 0.00 C ATOM 311 C GLU A 96 -4.238 8.505 -4.221 1.00 0.00 C ATOM 312 O GLU A 96 -3.903 7.389 -3.809 1.00 0.00 O ATOM 313 CB GLU A 96 -5.273 8.425 -6.493 1.00 0.00 C ATOM 314 CG GLU A 96 -5.406 9.057 -7.878 1.00 0.00 C ATOM 315 CD GLU A 96 -4.466 8.465 -8.902 1.00 0.00 C ATOM 316 OE1 GLU A 96 -4.594 7.255 -9.201 1.00 0.00 O ATOM 317 OE2 GLU A 96 -3.612 9.205 -9.434 1.00 0.00 O ATOM 0 H GLU A 96 -2.746 7.271 -5.998 1.00 0.00 H new ATOM 0 HA GLU A 96 -3.957 9.957 -5.787 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -5.234 7.342 -6.608 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -6.172 8.652 -5.920 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -6.432 8.938 -8.226 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -5.218 10.128 -7.800 1.00 0.00 H new ATOM 324 N GLU A 97 -4.762 9.429 -3.444 1.00 0.00 N ATOM 325 CA GLU A 97 -4.984 9.190 -2.033 1.00 0.00 C ATOM 326 C GLU A 97 -6.234 8.354 -1.815 1.00 0.00 C ATOM 327 O GLU A 97 -7.354 8.819 -2.038 1.00 0.00 O ATOM 328 CB GLU A 97 -5.084 10.504 -1.273 1.00 0.00 C ATOM 329 CG GLU A 97 -3.824 11.345 -1.350 1.00 0.00 C ATOM 330 CD GLU A 97 -3.904 12.590 -0.504 1.00 0.00 C ATOM 331 OE1 GLU A 97 -3.753 12.481 0.727 1.00 0.00 O ATOM 332 OE2 GLU A 97 -4.103 13.689 -1.068 1.00 0.00 O ATOM 0 H GLU A 97 -5.043 10.355 -3.766 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.129 8.634 -1.648 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -5.921 11.080 -1.668 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -5.308 10.294 -0.227 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -2.972 10.746 -1.028 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -3.643 11.626 -2.387 1.00 0.00 H new ATOM 339 N GLY A 98 -6.037 7.126 -1.395 1.00 0.00 N ATOM 340 CA GLY A 98 -7.138 6.237 -1.160 1.00 0.00 C ATOM 341 C GLY A 98 -6.672 4.816 -0.970 1.00 0.00 C ATOM 342 O GLY A 98 -5.498 4.513 -1.200 1.00 0.00 O ATOM 0 H GLY A 98 -5.118 6.724 -1.210 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -7.687 6.562 -0.276 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -7.831 6.284 -2.000 1.00 0.00 H new ATOM 346 N PRO A 99 -7.555 3.931 -0.512 1.00 0.00 N ATOM 347 CA PRO A 99 -7.236 2.529 -0.319 1.00 0.00 C ATOM 348 C PRO A 99 -7.451 1.697 -1.588 1.00 0.00 C ATOM 349 O PRO A 99 -8.446 1.866 -2.300 1.00 0.00 O ATOM 350 CB PRO A 99 -8.222 2.109 0.763 1.00 0.00 C ATOM 351 CG PRO A 99 -9.427 2.962 0.528 1.00 0.00 C ATOM 352 CD PRO A 99 -8.941 4.239 -0.116 1.00 0.00 C ATOM 0 HA PRO A 99 -6.189 2.375 -0.059 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -8.466 1.049 0.687 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -7.810 2.271 1.759 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -10.142 2.452 -0.118 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -9.940 3.173 1.466 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -9.552 4.510 -0.977 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -8.981 5.077 0.579 1.00 0.00 H new ATOM 360 N ILE A 100 -6.520 0.805 -1.858 1.00 0.00 N ATOM 361 CA ILE A 100 -6.594 -0.088 -3.007 1.00 0.00 C ATOM 362 C ILE A 100 -6.130 -1.486 -2.600 1.00 0.00 C ATOM 363 O ILE A 100 -5.427 -1.628 -1.606 1.00 0.00 O ATOM 364 CB ILE A 100 -5.764 0.441 -4.226 1.00 0.00 C ATOM 365 CG1 ILE A 100 -4.463 1.141 -3.776 1.00 0.00 C ATOM 366 CG2 ILE A 100 -6.608 1.375 -5.090 1.00 0.00 C ATOM 367 CD1 ILE A 100 -3.383 0.201 -3.281 1.00 0.00 C ATOM 0 H ILE A 100 -5.685 0.675 -1.287 1.00 0.00 H new ATOM 0 HA ILE A 100 -7.633 -0.130 -3.332 1.00 0.00 H new ATOM 0 HB ILE A 100 -5.478 -0.424 -4.825 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -4.069 1.719 -4.612 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -4.702 1.849 -2.983 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -6.012 1.731 -5.931 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -7.479 0.837 -5.464 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -6.937 2.225 -4.493 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -2.506 0.777 -2.986 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.754 -0.360 -2.423 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -3.111 -0.492 -4.077 1.00 0.00 H new ATOM 379 N PRO A 101 -6.533 -2.543 -3.336 1.00 0.00 N ATOM 380 CA PRO A 101 -6.168 -3.928 -2.996 1.00 0.00 C ATOM 381 C PRO A 101 -4.663 -4.178 -3.062 1.00 0.00 C ATOM 382 O PRO A 101 -3.898 -3.355 -3.576 1.00 0.00 O ATOM 383 CB PRO A 101 -6.887 -4.759 -4.065 1.00 0.00 C ATOM 384 CG PRO A 101 -7.099 -3.811 -5.188 1.00 0.00 C ATOM 385 CD PRO A 101 -7.367 -2.487 -4.546 1.00 0.00 C ATOM 0 HA PRO A 101 -6.451 -4.176 -1.973 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -6.286 -5.614 -4.375 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -7.833 -5.152 -3.693 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -6.222 -3.764 -5.833 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -7.937 -4.122 -5.812 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -7.085 -1.657 -5.195 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -8.422 -2.359 -4.305 1.00 0.00 H new ATOM 393 N HIS A 102 -4.246 -5.316 -2.551 1.00 0.00 N ATOM 394 CA HIS A 102 -2.851 -5.681 -2.537 1.00 0.00 C ATOM 395 C HIS A 102 -2.537 -6.504 -3.787 1.00 0.00 C ATOM 396 O HIS A 102 -3.156 -7.539 -4.017 1.00 0.00 O ATOM 397 CB HIS A 102 -2.545 -6.488 -1.271 1.00 0.00 C ATOM 398 CG HIS A 102 -1.130 -6.394 -0.814 1.00 0.00 C ATOM 399 ND1 HIS A 102 -0.266 -7.458 -0.805 1.00 0.00 N ATOM 400 CD2 HIS A 102 -0.433 -5.348 -0.333 1.00 0.00 C ATOM 401 CE1 HIS A 102 0.903 -7.069 -0.344 1.00 0.00 C ATOM 402 NE2 HIS A 102 0.830 -5.792 -0.050 1.00 0.00 N ATOM 0 H HIS A 102 -4.865 -6.011 -2.135 1.00 0.00 H new ATOM 0 HA HIS A 102 -2.230 -4.785 -2.536 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -3.198 -6.145 -0.468 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -2.787 -7.535 -1.454 1.00 0.00 H new ATOM 0 HD1 HIS A 102 -0.494 -8.405 -1.109 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -0.803 -4.343 -0.196 1.00 0.00 H new ATOM 0 HE1 HIS A 102 1.775 -7.695 -0.227 1.00 0.00 H new ATOM 411 N PRO A 103 -1.568 -6.057 -4.605 1.00 0.00 N ATOM 412 CA PRO A 103 -1.223 -6.720 -5.886 1.00 0.00 C ATOM 413 C PRO A 103 -0.769 -8.179 -5.726 1.00 0.00 C ATOM 414 O PRO A 103 -0.832 -8.959 -6.671 1.00 0.00 O ATOM 415 CB PRO A 103 -0.075 -5.862 -6.439 1.00 0.00 C ATOM 416 CG PRO A 103 0.442 -5.101 -5.265 1.00 0.00 C ATOM 417 CD PRO A 103 -0.737 -4.866 -4.373 1.00 0.00 C ATOM 0 HA PRO A 103 -2.094 -6.780 -6.539 1.00 0.00 H new ATOM 0 HB2 PRO A 103 0.704 -6.483 -6.880 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -0.427 -5.189 -7.221 1.00 0.00 H new ATOM 0 HG2 PRO A 103 1.218 -5.664 -4.746 1.00 0.00 H new ATOM 0 HG3 PRO A 103 0.889 -4.157 -5.578 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -0.441 -4.777 -3.328 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -1.264 -3.948 -4.634 1.00 0.00 H new ATOM 425 N GLY A 104 -0.313 -8.537 -4.537 1.00 0.00 N ATOM 426 CA GLY A 104 0.160 -9.894 -4.314 1.00 0.00 C ATOM 427 C GLY A 104 -0.895 -10.804 -3.710 1.00 0.00 C ATOM 428 O GLY A 104 -0.756 -12.028 -3.745 1.00 0.00 O ATOM 0 H GLY A 104 -0.260 -7.921 -3.726 1.00 0.00 H new ATOM 0 HA2 GLY A 104 0.494 -10.316 -5.262 1.00 0.00 H new ATOM 0 HA3 GLY A 104 1.027 -9.866 -3.654 1.00 0.00 H new ATOM 432 N ASN A 105 -1.948 -10.209 -3.158 1.00 0.00 N ATOM 433 CA ASN A 105 -3.033 -10.960 -2.512 1.00 0.00 C ATOM 434 C ASN A 105 -4.228 -10.056 -2.231 1.00 0.00 C ATOM 435 O ASN A 105 -4.203 -9.253 -1.299 1.00 0.00 O ATOM 436 CB ASN A 105 -2.581 -11.710 -1.234 1.00 0.00 C ATOM 437 CG ASN A 105 -1.589 -10.956 -0.372 1.00 0.00 C ATOM 438 OD1 ASN A 105 -1.542 -9.726 -0.362 1.00 0.00 O ATOM 439 ND2 ASN A 105 -0.793 -11.701 0.366 1.00 0.00 N ATOM 0 H ASN A 105 -2.078 -9.197 -3.143 1.00 0.00 H new ATOM 0 HA ASN A 105 -3.339 -11.730 -3.220 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -3.461 -11.940 -0.634 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -2.137 -12.662 -1.526 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -0.104 -11.261 0.976 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -0.865 -12.718 0.328 1.00 0.00 H new ATOM 446 N VAL A 106 -5.250 -10.159 -3.072 1.00 0.00 N ATOM 447 CA VAL A 106 -6.481 -9.350 -2.949 1.00 0.00 C ATOM 448 C VAL A 106 -7.141 -9.432 -1.546 1.00 0.00 C ATOM 449 O VAL A 106 -7.970 -8.586 -1.194 1.00 0.00 O ATOM 450 CB VAL A 106 -7.523 -9.735 -4.031 1.00 0.00 C ATOM 451 CG1 VAL A 106 -8.616 -8.688 -4.115 1.00 0.00 C ATOM 452 CG2 VAL A 106 -6.860 -9.910 -5.385 1.00 0.00 C ATOM 0 H VAL A 106 -5.260 -10.803 -3.863 1.00 0.00 H new ATOM 0 HA VAL A 106 -6.160 -8.319 -3.098 1.00 0.00 H new ATOM 0 HB VAL A 106 -7.971 -10.686 -3.743 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -9.338 -8.976 -4.880 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -9.120 -8.610 -3.152 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -8.178 -7.724 -4.374 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -7.612 -10.180 -6.126 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -6.380 -8.976 -5.678 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -6.111 -10.700 -5.324 1.00 0.00 H new ATOM 462 N HIS A 107 -6.773 -10.434 -0.747 1.00 0.00 N ATOM 463 CA HIS A 107 -7.313 -10.561 0.624 1.00 0.00 C ATOM 464 C HIS A 107 -6.717 -9.505 1.559 1.00 0.00 C ATOM 465 O HIS A 107 -6.981 -9.501 2.764 1.00 0.00 O ATOM 466 CB HIS A 107 -7.064 -11.957 1.198 1.00 0.00 C ATOM 467 CG HIS A 107 -8.040 -12.990 0.736 1.00 0.00 C ATOM 468 ND1 HIS A 107 -8.612 -13.909 1.584 1.00 0.00 N ATOM 469 CD2 HIS A 107 -8.544 -13.255 -0.492 1.00 0.00 C ATOM 470 CE1 HIS A 107 -9.419 -14.692 0.902 1.00 0.00 C ATOM 471 NE2 HIS A 107 -9.398 -14.317 -0.357 1.00 0.00 N ATOM 0 H HIS A 107 -6.113 -11.165 -1.012 1.00 0.00 H new ATOM 0 HA HIS A 107 -8.389 -10.400 0.555 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -6.058 -12.276 0.926 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -7.097 -11.902 2.286 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -8.316 -12.728 -1.407 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -10.001 -15.506 1.308 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -9.932 -14.747 -1.112 1.00 0.00 H new ATOM 480 N LYS A 108 -5.936 -8.611 0.993 1.00 0.00 N ATOM 481 CA LYS A 108 -5.317 -7.536 1.724 1.00 0.00 C ATOM 482 C LYS A 108 -5.373 -6.283 0.888 1.00 0.00 C ATOM 483 O LYS A 108 -5.529 -6.354 -0.333 1.00 0.00 O ATOM 484 CB LYS A 108 -3.861 -7.859 2.083 1.00 0.00 C ATOM 485 CG LYS A 108 -3.709 -9.011 3.063 1.00 0.00 C ATOM 486 CD LYS A 108 -2.390 -8.944 3.813 1.00 0.00 C ATOM 487 CE LYS A 108 -1.200 -9.112 2.887 1.00 0.00 C ATOM 488 NZ LYS A 108 0.070 -9.255 3.638 1.00 0.00 N ATOM 0 H LYS A 108 -5.712 -8.614 -0.002 1.00 0.00 H new ATOM 0 HA LYS A 108 -5.861 -7.394 2.658 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -3.316 -8.098 1.170 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -3.396 -6.970 2.508 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -4.534 -8.993 3.776 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -3.773 -9.957 2.525 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -2.315 -7.987 4.330 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -2.367 -9.721 4.577 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -1.351 -9.990 2.258 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -1.133 -8.251 2.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 0.627 -8.381 3.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -0.138 -9.430 4.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 0.613 -10.054 3.252 1.00 0.00 H new ATOM 502 N TYR A 109 -5.257 -5.153 1.525 1.00 0.00 N ATOM 503 CA TYR A 109 -5.294 -3.897 0.821 1.00 0.00 C ATOM 504 C TYR A 109 -4.329 -2.911 1.431 1.00 0.00 C ATOM 505 O TYR A 109 -3.719 -3.182 2.458 1.00 0.00 O ATOM 506 CB TYR A 109 -6.704 -3.321 0.766 1.00 0.00 C ATOM 507 CG TYR A 109 -7.193 -2.680 2.044 1.00 0.00 C ATOM 508 CD1 TYR A 109 -7.441 -3.431 3.182 1.00 0.00 C ATOM 509 CD2 TYR A 109 -7.421 -1.315 2.096 1.00 0.00 C ATOM 510 CE1 TYR A 109 -7.900 -2.837 4.338 1.00 0.00 C ATOM 511 CE2 TYR A 109 -7.880 -0.709 3.242 1.00 0.00 C ATOM 512 CZ TYR A 109 -8.119 -1.476 4.366 1.00 0.00 C ATOM 513 OH TYR A 109 -8.575 -0.880 5.521 1.00 0.00 O ATOM 0 H TYR A 109 -5.135 -5.073 2.535 1.00 0.00 H new ATOM 0 HA TYR A 109 -4.983 -4.088 -0.206 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -6.744 -2.579 -0.031 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -7.394 -4.119 0.493 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -7.272 -4.498 3.163 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -7.234 -0.714 1.218 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -8.087 -3.435 5.218 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -8.052 0.357 3.263 1.00 0.00 H new ATOM 0 HH TYR A 109 -8.676 0.084 5.374 1.00 0.00 H new ATOM 523 N ILE A 110 -4.185 -1.782 0.798 1.00 0.00 N ATOM 524 CA ILE A 110 -3.284 -0.765 1.263 1.00 0.00 C ATOM 525 C ILE A 110 -3.992 0.570 1.307 1.00 0.00 C ATOM 526 O ILE A 110 -4.764 0.897 0.407 1.00 0.00 O ATOM 527 CB ILE A 110 -2.069 -0.639 0.328 1.00 0.00 C ATOM 528 CG1 ILE A 110 -1.556 -2.020 -0.062 1.00 0.00 C ATOM 529 CG2 ILE A 110 -0.965 0.164 1.006 1.00 0.00 C ATOM 530 CD1 ILE A 110 -0.949 -2.065 -1.436 1.00 0.00 C ATOM 0 H ILE A 110 -4.689 -1.540 -0.055 1.00 0.00 H new ATOM 0 HA ILE A 110 -2.946 -1.049 2.260 1.00 0.00 H new ATOM 0 HB ILE A 110 -2.377 -0.115 -0.577 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -0.812 -2.342 0.667 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -2.379 -2.733 -0.013 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -0.110 0.246 0.335 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -1.335 1.161 1.246 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -0.659 -0.340 1.923 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -0.605 -3.077 -1.649 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -1.697 -1.773 -2.174 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -0.105 -1.377 -1.484 1.00 0.00 H new ATOM 542 N ILE A 111 -3.747 1.323 2.349 1.00 0.00 N ATOM 543 CA ILE A 111 -4.305 2.650 2.460 1.00 0.00 C ATOM 544 C ILE A 111 -3.223 3.636 2.121 1.00 0.00 C ATOM 545 O ILE A 111 -2.196 3.698 2.805 1.00 0.00 O ATOM 546 CB ILE A 111 -4.857 2.975 3.879 1.00 0.00 C ATOM 547 CG1 ILE A 111 -5.869 1.926 4.339 1.00 0.00 C ATOM 548 CG2 ILE A 111 -5.499 4.356 3.891 1.00 0.00 C ATOM 549 CD1 ILE A 111 -5.241 0.701 4.965 1.00 0.00 C ATOM 0 H ILE A 111 -3.163 1.040 3.136 1.00 0.00 H new ATOM 0 HA ILE A 111 -5.151 2.711 1.775 1.00 0.00 H new ATOM 0 HB ILE A 111 -4.017 2.962 4.573 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -6.548 2.382 5.059 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -6.471 1.617 3.484 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -5.881 4.571 4.889 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -4.756 5.105 3.618 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -6.320 4.382 3.175 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -6.024 0.004 5.265 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -4.584 0.219 4.241 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -4.662 0.996 5.840 1.00 0.00 H new ATOM 561 N CYS A 112 -3.424 4.390 1.078 1.00 0.00 N ATOM 562 CA CYS A 112 -2.426 5.332 0.649 1.00 0.00 C ATOM 563 C CYS A 112 -2.859 6.749 0.959 1.00 0.00 C ATOM 564 O CYS A 112 -3.930 7.195 0.544 1.00 0.00 O ATOM 565 CB CYS A 112 -2.136 5.154 -0.839 1.00 0.00 C ATOM 566 SG CYS A 112 -1.429 3.520 -1.249 1.00 0.00 S ATOM 0 H CYS A 112 -4.270 4.372 0.508 1.00 0.00 H new ATOM 0 HA CYS A 112 -1.505 5.140 1.199 1.00 0.00 H new ATOM 0 HB2 CYS A 112 -3.059 5.294 -1.401 1.00 0.00 H new ATOM 0 HB3 CYS A 112 -1.445 5.932 -1.163 1.00 0.00 H new ATOM 571 N SER A 113 -2.030 7.448 1.695 1.00 0.00 N ATOM 572 CA SER A 113 -2.316 8.803 2.090 1.00 0.00 C ATOM 573 C SER A 113 -1.116 9.679 1.799 1.00 0.00 C ATOM 574 O SER A 113 0.025 9.218 1.854 1.00 0.00 O ATOM 575 CB SER A 113 -2.673 8.853 3.579 1.00 0.00 C ATOM 576 OG SER A 113 -3.187 10.124 3.946 1.00 0.00 O ATOM 0 H SER A 113 -1.137 7.092 2.037 1.00 0.00 H new ATOM 0 HA SER A 113 -3.169 9.174 1.521 1.00 0.00 H new ATOM 0 HB2 SER A 113 -3.410 8.082 3.804 1.00 0.00 H new ATOM 0 HB3 SER A 113 -1.788 8.631 4.175 1.00 0.00 H new ATOM 0 HG SER A 113 -3.407 10.125 4.901 1.00 0.00 H new ATOM 582 N LYS A 114 -1.362 10.926 1.485 1.00 0.00 N ATOM 583 CA LYS A 114 -0.299 11.837 1.169 1.00 0.00 C ATOM 584 C LYS A 114 -0.247 12.969 2.179 1.00 0.00 C ATOM 585 O LYS A 114 -1.157 13.797 2.260 1.00 0.00 O ATOM 586 CB LYS A 114 -0.461 12.356 -0.258 1.00 0.00 C ATOM 587 CG LYS A 114 0.509 13.451 -0.657 1.00 0.00 C ATOM 588 CD LYS A 114 0.455 13.688 -2.153 1.00 0.00 C ATOM 589 CE LYS A 114 0.939 15.071 -2.524 1.00 0.00 C ATOM 590 NZ LYS A 114 0.012 16.129 -2.041 1.00 0.00 N ATOM 0 H LYS A 114 -2.297 11.332 1.442 1.00 0.00 H new ATOM 0 HA LYS A 114 0.653 11.309 1.226 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -0.345 11.520 -0.948 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -1.478 12.730 -0.379 1.00 0.00 H new ATOM 0 HG2 LYS A 114 0.265 14.372 -0.128 1.00 0.00 H new ATOM 0 HG3 LYS A 114 1.521 13.173 -0.363 1.00 0.00 H new ATOM 0 HD2 LYS A 114 1.066 12.942 -2.661 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -0.568 13.555 -2.505 1.00 0.00 H new ATOM 0 HE2 LYS A 114 1.930 15.235 -2.100 1.00 0.00 H new ATOM 0 HE3 LYS A 114 1.039 15.143 -3.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -0.105 16.852 -2.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -0.912 15.707 -1.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 0.404 16.569 -1.184 1.00 0.00 H new ATOM 604 N SER A 115 0.809 12.976 2.958 1.00 0.00 N ATOM 605 CA SER A 115 1.022 13.981 3.964 1.00 0.00 C ATOM 606 C SER A 115 1.888 15.075 3.373 1.00 0.00 C ATOM 607 O SER A 115 3.107 14.921 3.259 1.00 0.00 O ATOM 608 CB SER A 115 1.704 13.359 5.186 1.00 0.00 C ATOM 609 OG SER A 115 1.646 14.221 6.312 1.00 0.00 O ATOM 0 H SER A 115 1.549 12.276 2.908 1.00 0.00 H new ATOM 0 HA SER A 115 0.069 14.401 4.284 1.00 0.00 H new ATOM 0 HB2 SER A 115 1.224 12.411 5.428 1.00 0.00 H new ATOM 0 HB3 SER A 115 2.745 13.138 4.949 1.00 0.00 H new ATOM 0 HG SER A 115 2.089 13.793 7.075 1.00 0.00 H new ATOM 615 N GLY A 116 1.256 16.158 2.977 1.00 0.00 N ATOM 616 CA GLY A 116 1.969 17.222 2.320 1.00 0.00 C ATOM 617 C GLY A 116 2.530 16.753 0.994 1.00 0.00 C ATOM 618 O GLY A 116 1.792 16.589 0.029 1.00 0.00 O ATOM 0 H GLY A 116 0.257 16.321 3.099 1.00 0.00 H new ATOM 0 HA2 GLY A 116 1.301 18.068 2.159 1.00 0.00 H new ATOM 0 HA3 GLY A 116 2.779 17.572 2.960 1.00 0.00 H new ATOM 622 N SER A 117 3.827 16.517 0.950 1.00 0.00 N ATOM 623 CA SER A 117 4.470 16.040 -0.257 1.00 0.00 C ATOM 624 C SER A 117 5.025 14.616 -0.079 1.00 0.00 C ATOM 625 O SER A 117 5.737 14.114 -0.947 1.00 0.00 O ATOM 626 CB SER A 117 5.591 16.993 -0.664 1.00 0.00 C ATOM 627 OG SER A 117 5.102 18.318 -0.822 1.00 0.00 O ATOM 0 H SER A 117 4.458 16.649 1.741 1.00 0.00 H new ATOM 0 HA SER A 117 3.718 16.008 -1.045 1.00 0.00 H new ATOM 0 HB2 SER A 117 6.377 16.979 0.091 1.00 0.00 H new ATOM 0 HB3 SER A 117 6.040 16.654 -1.597 1.00 0.00 H new ATOM 0 HG SER A 117 5.839 18.910 -1.081 1.00 0.00 H new ATOM 633 N LEU A 118 4.687 13.963 1.025 1.00 0.00 N ATOM 634 CA LEU A 118 5.227 12.634 1.307 1.00 0.00 C ATOM 635 C LEU A 118 4.096 11.614 1.463 1.00 0.00 C ATOM 636 O LEU A 118 3.093 11.883 2.116 1.00 0.00 O ATOM 637 CB LEU A 118 6.119 12.694 2.565 1.00 0.00 C ATOM 638 CG LEU A 118 7.062 11.502 2.797 1.00 0.00 C ATOM 639 CD1 LEU A 118 8.237 11.921 3.664 1.00 0.00 C ATOM 640 CD2 LEU A 118 6.326 10.353 3.455 1.00 0.00 C ATOM 0 H LEU A 118 4.049 14.324 1.734 1.00 0.00 H new ATOM 0 HA LEU A 118 5.841 12.308 0.468 1.00 0.00 H new ATOM 0 HB2 LEU A 118 6.722 13.600 2.512 1.00 0.00 H new ATOM 0 HB3 LEU A 118 5.472 12.792 3.437 1.00 0.00 H new ATOM 0 HG LEU A 118 7.432 11.170 1.827 1.00 0.00 H new ATOM 0 HD11 LEU A 118 8.897 11.067 3.820 1.00 0.00 H new ATOM 0 HD12 LEU A 118 8.789 12.720 3.168 1.00 0.00 H new ATOM 0 HD13 LEU A 118 7.870 12.277 4.627 1.00 0.00 H new ATOM 0 HD21 LEU A 118 7.013 9.521 3.609 1.00 0.00 H new ATOM 0 HD22 LEU A 118 5.929 10.678 4.416 1.00 0.00 H new ATOM 0 HD23 LEU A 118 5.506 10.031 2.813 1.00 0.00 H new ATOM 652 N TRP A 119 4.265 10.451 0.855 1.00 0.00 N ATOM 653 CA TRP A 119 3.241 9.412 0.882 1.00 0.00 C ATOM 654 C TRP A 119 3.458 8.416 2.014 1.00 0.00 C ATOM 655 O TRP A 119 4.567 7.929 2.229 1.00 0.00 O ATOM 656 CB TRP A 119 3.212 8.650 -0.447 1.00 0.00 C ATOM 657 CG TRP A 119 2.684 9.442 -1.597 1.00 0.00 C ATOM 658 CD1 TRP A 119 3.382 10.294 -2.402 1.00 0.00 C ATOM 659 CD2 TRP A 119 1.339 9.444 -2.080 1.00 0.00 C ATOM 660 NE1 TRP A 119 2.551 10.829 -3.352 1.00 0.00 N ATOM 661 CE2 TRP A 119 1.291 10.322 -3.176 1.00 0.00 C ATOM 662 CE3 TRP A 119 0.168 8.787 -1.690 1.00 0.00 C ATOM 663 CZ2 TRP A 119 0.120 10.560 -3.886 1.00 0.00 C ATOM 664 CZ3 TRP A 119 -0.993 9.025 -2.397 1.00 0.00 C ATOM 665 CH2 TRP A 119 -1.008 9.905 -3.483 1.00 0.00 C ATOM 0 H TRP A 119 5.105 10.199 0.334 1.00 0.00 H new ATOM 0 HA TRP A 119 2.290 9.918 1.047 1.00 0.00 H new ATOM 0 HB2 TRP A 119 4.223 8.317 -0.684 1.00 0.00 H new ATOM 0 HB3 TRP A 119 2.601 7.755 -0.326 1.00 0.00 H new ATOM 0 HD1 TRP A 119 4.435 10.515 -2.305 1.00 0.00 H new ATOM 0 HE1 TRP A 119 2.826 11.496 -4.073 1.00 0.00 H new ATOM 0 HE3 TRP A 119 0.172 8.106 -0.852 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 0.103 11.239 -4.726 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -1.904 8.523 -2.107 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -1.933 10.071 -4.015 1.00 0.00 H new ATOM 676 N TYR A 120 2.392 8.125 2.729 1.00 0.00 N ATOM 677 CA TYR A 120 2.405 7.109 3.762 1.00 0.00 C ATOM 678 C TYR A 120 1.435 6.009 3.389 1.00 0.00 C ATOM 679 O TYR A 120 0.266 6.277 3.086 1.00 0.00 O ATOM 680 CB TYR A 120 2.027 7.692 5.126 1.00 0.00 C ATOM 681 CG TYR A 120 3.101 8.546 5.757 1.00 0.00 C ATOM 682 CD1 TYR A 120 4.095 7.971 6.541 1.00 0.00 C ATOM 683 CD2 TYR A 120 3.122 9.921 5.577 1.00 0.00 C ATOM 684 CE1 TYR A 120 5.079 8.743 7.125 1.00 0.00 C ATOM 685 CE2 TYR A 120 4.104 10.699 6.157 1.00 0.00 C ATOM 686 CZ TYR A 120 5.080 10.104 6.930 1.00 0.00 C ATOM 687 OH TYR A 120 6.061 10.878 7.510 1.00 0.00 O ATOM 0 H TYR A 120 1.490 8.587 2.611 1.00 0.00 H new ATOM 0 HA TYR A 120 3.416 6.709 3.839 1.00 0.00 H new ATOM 0 HB2 TYR A 120 1.123 8.290 5.014 1.00 0.00 H new ATOM 0 HB3 TYR A 120 1.786 6.873 5.804 1.00 0.00 H new ATOM 0 HD1 TYR A 120 4.097 6.902 6.696 1.00 0.00 H new ATOM 0 HD2 TYR A 120 2.359 10.390 4.974 1.00 0.00 H new ATOM 0 HE1 TYR A 120 5.844 8.281 7.732 1.00 0.00 H new ATOM 0 HE2 TYR A 120 4.108 11.768 6.006 1.00 0.00 H new ATOM 0 HH TYR A 120 5.919 11.818 7.273 1.00 0.00 H new ATOM 697 N ILE A 121 1.906 4.782 3.391 1.00 0.00 N ATOM 698 CA ILE A 121 1.070 3.658 3.020 1.00 0.00 C ATOM 699 C ILE A 121 1.019 2.618 4.132 1.00 0.00 C ATOM 700 O ILE A 121 1.991 2.428 4.875 1.00 0.00 O ATOM 701 CB ILE A 121 1.529 3.004 1.673 1.00 0.00 C ATOM 702 CG1 ILE A 121 2.932 2.386 1.780 1.00 0.00 C ATOM 703 CG2 ILE A 121 1.491 4.023 0.542 1.00 0.00 C ATOM 704 CD1 ILE A 121 2.934 0.933 2.220 1.00 0.00 C ATOM 0 H ILE A 121 2.863 4.535 3.645 1.00 0.00 H new ATOM 0 HA ILE A 121 0.064 4.049 2.869 1.00 0.00 H new ATOM 0 HB ILE A 121 0.829 2.198 1.453 1.00 0.00 H new ATOM 0 HG12 ILE A 121 3.426 2.463 0.812 1.00 0.00 H new ATOM 0 HG13 ILE A 121 3.522 2.970 2.486 1.00 0.00 H new ATOM 0 HG21 ILE A 121 1.813 3.549 -0.385 1.00 0.00 H new ATOM 0 HG22 ILE A 121 0.474 4.398 0.424 1.00 0.00 H new ATOM 0 HG23 ILE A 121 2.158 4.852 0.777 1.00 0.00 H new ATOM 0 HD11 ILE A 121 3.960 0.570 2.271 1.00 0.00 H new ATOM 0 HD12 ILE A 121 2.470 0.850 3.203 1.00 0.00 H new ATOM 0 HD13 ILE A 121 2.373 0.335 1.502 1.00 0.00 H new ATOM 716 N THR A 122 -0.115 1.966 4.254 1.00 0.00 N ATOM 717 CA THR A 122 -0.308 0.937 5.254 1.00 0.00 C ATOM 718 C THR A 122 -1.034 -0.251 4.637 1.00 0.00 C ATOM 719 O THR A 122 -2.126 -0.093 4.097 1.00 0.00 O ATOM 720 CB THR A 122 -1.146 1.473 6.437 1.00 0.00 C ATOM 721 OG1 THR A 122 -0.612 2.726 6.886 1.00 0.00 O ATOM 722 CG2 THR A 122 -1.146 0.483 7.589 1.00 0.00 C ATOM 0 H THR A 122 -0.930 2.133 3.664 1.00 0.00 H new ATOM 0 HA THR A 122 0.672 0.630 5.620 1.00 0.00 H new ATOM 0 HB THR A 122 -2.171 1.613 6.094 1.00 0.00 H new ATOM 0 HG1 THR A 122 -1.149 3.061 7.635 1.00 0.00 H new ATOM 0 HG21 THR A 122 -1.742 0.881 8.411 1.00 0.00 H new ATOM 0 HG22 THR A 122 -1.573 -0.463 7.256 1.00 0.00 H new ATOM 0 HG23 THR A 122 -0.123 0.320 7.928 1.00 0.00 H new ATOM 730 N VAL A 123 -0.436 -1.434 4.705 1.00 0.00 N ATOM 731 CA VAL A 123 -1.073 -2.617 4.153 1.00 0.00 C ATOM 732 C VAL A 123 -1.843 -3.374 5.236 1.00 0.00 C ATOM 733 O VAL A 123 -1.260 -3.934 6.162 1.00 0.00 O ATOM 734 CB VAL A 123 -0.066 -3.559 3.427 1.00 0.00 C ATOM 735 CG1 VAL A 123 1.146 -3.854 4.294 1.00 0.00 C ATOM 736 CG2 VAL A 123 -0.750 -4.852 3.005 1.00 0.00 C ATOM 0 H VAL A 123 0.476 -1.596 5.131 1.00 0.00 H new ATOM 0 HA VAL A 123 -1.779 -2.271 3.398 1.00 0.00 H new ATOM 0 HB VAL A 123 0.284 -3.042 2.533 1.00 0.00 H new ATOM 0 HG11 VAL A 123 1.827 -4.514 3.756 1.00 0.00 H new ATOM 0 HG12 VAL A 123 1.658 -2.922 4.533 1.00 0.00 H new ATOM 0 HG13 VAL A 123 0.825 -4.339 5.216 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -0.030 -5.496 2.500 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -1.138 -5.363 3.886 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -1.572 -4.624 2.326 1.00 0.00 H new ATOM 746 N MET A 124 -3.151 -3.355 5.117 1.00 0.00 N ATOM 747 CA MET A 124 -4.026 -4.007 6.080 1.00 0.00 C ATOM 748 C MET A 124 -4.730 -5.198 5.441 1.00 0.00 C ATOM 749 O MET A 124 -4.948 -5.216 4.236 1.00 0.00 O ATOM 750 CB MET A 124 -5.069 -3.015 6.602 1.00 0.00 C ATOM 751 CG MET A 124 -4.500 -1.749 7.239 1.00 0.00 C ATOM 752 SD MET A 124 -4.052 -1.933 8.984 1.00 0.00 S ATOM 753 CE MET A 124 -2.544 -2.897 8.884 1.00 0.00 C ATOM 0 H MET A 124 -3.643 -2.890 4.354 1.00 0.00 H new ATOM 0 HA MET A 124 -3.417 -4.360 6.912 1.00 0.00 H new ATOM 0 HB2 MET A 124 -5.718 -2.726 5.775 1.00 0.00 H new ATOM 0 HB3 MET A 124 -5.694 -3.523 7.336 1.00 0.00 H new ATOM 0 HG2 MET A 124 -3.617 -1.439 6.680 1.00 0.00 H new ATOM 0 HG3 MET A 124 -5.233 -0.948 7.146 1.00 0.00 H new ATOM 0 HE1 MET A 124 -1.937 -2.716 9.771 1.00 0.00 H new ATOM 0 HE2 MET A 124 -2.793 -3.957 8.824 1.00 0.00 H new ATOM 0 HE3 MET A 124 -1.984 -2.605 7.996 1.00 0.00 H new ATOM 763 N PRO A 125 -5.076 -6.217 6.234 1.00 0.00 N ATOM 764 CA PRO A 125 -5.790 -7.381 5.739 1.00 0.00 C ATOM 765 C PRO A 125 -7.311 -7.204 5.802 1.00 0.00 C ATOM 766 O PRO A 125 -7.841 -6.571 6.725 1.00 0.00 O ATOM 767 CB PRO A 125 -5.344 -8.473 6.704 1.00 0.00 C ATOM 768 CG PRO A 125 -5.147 -7.765 8.008 1.00 0.00 C ATOM 769 CD PRO A 125 -4.769 -6.334 7.675 1.00 0.00 C ATOM 0 HA PRO A 125 -5.575 -7.588 4.691 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -6.095 -9.259 6.789 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -4.422 -8.948 6.367 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -6.058 -7.795 8.606 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -4.364 -8.245 8.595 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -5.343 -5.620 8.266 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -3.715 -6.141 7.877 1.00 0.00 H new ATOM 777 N CYS A 126 -8.004 -7.740 4.813 1.00 0.00 N ATOM 778 CA CYS A 126 -9.458 -7.696 4.795 1.00 0.00 C ATOM 779 C CYS A 126 -10.030 -8.780 5.685 1.00 0.00 C ATOM 780 O CYS A 126 -9.295 -9.648 6.167 1.00 0.00 O ATOM 781 CB CYS A 126 -10.000 -7.878 3.374 1.00 0.00 C ATOM 782 SG CYS A 126 -9.821 -6.425 2.290 1.00 0.00 S ATOM 0 H CYS A 126 -7.585 -8.211 4.011 1.00 0.00 H new ATOM 0 HA CYS A 126 -9.761 -6.717 5.166 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -9.489 -8.723 2.912 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -11.056 -8.139 3.435 1.00 0.00 H new ATOM 787 N SER A 127 -11.330 -8.712 5.922 1.00 0.00 N ATOM 788 CA SER A 127 -12.023 -9.720 6.693 1.00 0.00 C ATOM 789 C SER A 127 -11.774 -11.109 6.092 1.00 0.00 C ATOM 790 O SER A 127 -11.630 -11.253 4.871 1.00 0.00 O ATOM 791 CB SER A 127 -13.515 -9.411 6.713 1.00 0.00 C ATOM 792 OG SER A 127 -13.753 -8.096 7.196 1.00 0.00 O ATOM 0 H SER A 127 -11.929 -7.958 5.585 1.00 0.00 H new ATOM 0 HA SER A 127 -11.645 -9.714 7.715 1.00 0.00 H new ATOM 0 HB2 SER A 127 -13.925 -9.514 5.708 1.00 0.00 H new ATOM 0 HB3 SER A 127 -14.032 -10.134 7.344 1.00 0.00 H new ATOM 0 HG SER A 127 -14.717 -7.918 7.199 1.00 0.00 H new ATOM 798 N ILE A 128 -11.709 -12.110 6.934 1.00 0.00 N ATOM 799 CA ILE A 128 -11.451 -13.456 6.479 1.00 0.00 C ATOM 800 C ILE A 128 -12.558 -13.927 5.542 1.00 0.00 C ATOM 801 O ILE A 128 -13.741 -13.914 5.897 1.00 0.00 O ATOM 802 CB ILE A 128 -11.265 -14.446 7.670 1.00 0.00 C ATOM 803 CG1 ILE A 128 -9.913 -14.202 8.375 1.00 0.00 C ATOM 804 CG2 ILE A 128 -11.353 -15.893 7.197 1.00 0.00 C ATOM 805 CD1 ILE A 128 -9.764 -12.832 9.013 1.00 0.00 C ATOM 0 H ILE A 128 -11.832 -12.019 7.943 1.00 0.00 H new ATOM 0 HA ILE A 128 -10.513 -13.442 5.924 1.00 0.00 H new ATOM 0 HB ILE A 128 -12.071 -14.266 8.382 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -9.779 -14.962 9.145 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -9.111 -14.338 7.649 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -11.220 -16.562 8.047 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -12.329 -16.069 6.745 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -10.573 -16.083 6.460 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -8.784 -12.754 9.483 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -9.862 -12.062 8.248 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -10.539 -12.695 9.767 1.00 0.00 H new ATOM 817 N GLY A 129 -12.165 -14.325 4.343 1.00 0.00 N ATOM 818 CA GLY A 129 -13.124 -14.751 3.349 1.00 0.00 C ATOM 819 C GLY A 129 -13.544 -13.632 2.409 1.00 0.00 C ATOM 820 O GLY A 129 -14.426 -13.820 1.573 1.00 0.00 O ATOM 0 H GLY A 129 -11.192 -14.360 4.040 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -12.696 -15.566 2.766 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -14.007 -15.147 3.851 1.00 0.00 H new ATOM 824 N THR A 130 -12.916 -12.467 2.535 1.00 0.00 N ATOM 825 CA THR A 130 -13.252 -11.337 1.676 1.00 0.00 C ATOM 826 C THR A 130 -12.033 -10.861 0.883 1.00 0.00 C ATOM 827 O THR A 130 -10.899 -11.263 1.163 1.00 0.00 O ATOM 828 CB THR A 130 -13.842 -10.139 2.475 1.00 0.00 C ATOM 829 OG1 THR A 130 -12.855 -9.586 3.344 1.00 0.00 O ATOM 830 CG2 THR A 130 -15.054 -10.569 3.291 1.00 0.00 C ATOM 0 H THR A 130 -12.180 -12.282 3.216 1.00 0.00 H new ATOM 0 HA THR A 130 -14.016 -11.698 0.987 1.00 0.00 H new ATOM 0 HB THR A 130 -14.155 -9.382 1.756 1.00 0.00 H new ATOM 0 HG1 THR A 130 -12.234 -10.290 3.624 1.00 0.00 H new ATOM 0 HG21 THR A 130 -15.446 -9.712 3.839 1.00 0.00 H new ATOM 0 HG22 THR A 130 -15.824 -10.956 2.623 1.00 0.00 H new ATOM 0 HG23 THR A 130 -14.761 -11.347 3.996 1.00 0.00 H new ATOM 838 N LYS A 131 -12.281 -10.021 -0.109 1.00 0.00 N ATOM 839 CA LYS A 131 -11.236 -9.455 -0.941 1.00 0.00 C ATOM 840 C LYS A 131 -11.534 -7.978 -1.193 1.00 0.00 C ATOM 841 O LYS A 131 -12.698 -7.587 -1.294 1.00 0.00 O ATOM 842 CB LYS A 131 -11.150 -10.216 -2.264 1.00 0.00 C ATOM 843 CG LYS A 131 -12.434 -10.195 -3.072 1.00 0.00 C ATOM 844 CD LYS A 131 -12.290 -10.988 -4.350 1.00 0.00 C ATOM 845 CE LYS A 131 -13.604 -11.073 -5.096 1.00 0.00 C ATOM 846 NZ LYS A 131 -13.498 -11.923 -6.308 1.00 0.00 N ATOM 0 H LYS A 131 -13.220 -9.712 -0.360 1.00 0.00 H new ATOM 0 HA LYS A 131 -10.277 -9.543 -0.431 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -10.347 -9.789 -2.865 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -10.879 -11.252 -2.059 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -13.248 -10.606 -2.476 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -12.701 -9.165 -3.308 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -11.538 -10.522 -4.986 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -11.935 -11.992 -4.119 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -14.371 -11.477 -4.435 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -13.925 -10.071 -5.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -14.419 -11.956 -6.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -12.784 -11.524 -6.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -13.217 -12.886 -6.033 1.00 0.00 H new ATOM 860 N PHE A 132 -10.501 -7.169 -1.280 1.00 0.00 N ATOM 861 CA PHE A 132 -10.676 -5.733 -1.451 1.00 0.00 C ATOM 862 C PHE A 132 -10.848 -5.348 -2.921 1.00 0.00 C ATOM 863 O PHE A 132 -10.092 -5.792 -3.786 1.00 0.00 O ATOM 864 CB PHE A 132 -9.490 -4.992 -0.850 1.00 0.00 C ATOM 865 CG PHE A 132 -9.722 -3.522 -0.640 1.00 0.00 C ATOM 866 CD1 PHE A 132 -10.282 -3.063 0.537 1.00 0.00 C ATOM 867 CD2 PHE A 132 -9.368 -2.608 -1.606 1.00 0.00 C ATOM 868 CE1 PHE A 132 -10.483 -1.717 0.742 1.00 0.00 C ATOM 869 CE2 PHE A 132 -9.569 -1.260 -1.410 1.00 0.00 C ATOM 870 CZ PHE A 132 -10.125 -0.814 -0.236 1.00 0.00 C ATOM 0 H PHE A 132 -9.529 -7.475 -1.236 1.00 0.00 H new ATOM 0 HA PHE A 132 -11.589 -5.446 -0.930 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -9.238 -5.449 0.107 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -8.627 -5.122 -1.502 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -10.565 -3.768 1.304 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -8.927 -2.952 -2.530 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -10.920 -1.369 1.666 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -9.290 -0.554 -2.178 1.00 0.00 H new ATOM 0 HZ PHE A 132 -10.282 0.243 -0.079 1.00 0.00 H new ATOM 880 N ASP A 133 -11.849 -4.520 -3.189 1.00 0.00 N ATOM 881 CA ASP A 133 -12.105 -4.025 -4.542 1.00 0.00 C ATOM 882 C ASP A 133 -11.538 -2.618 -4.691 1.00 0.00 C ATOM 883 O ASP A 133 -11.788 -1.753 -3.851 1.00 0.00 O ATOM 884 CB ASP A 133 -13.613 -4.032 -4.844 1.00 0.00 C ATOM 885 CG ASP A 133 -13.940 -3.592 -6.264 1.00 0.00 C ATOM 886 OD1 ASP A 133 -13.936 -4.448 -7.172 1.00 0.00 O ATOM 887 OD2 ASP A 133 -14.221 -2.390 -6.476 1.00 0.00 O ATOM 0 H ASP A 133 -12.502 -4.174 -2.486 1.00 0.00 H new ATOM 0 HA ASP A 133 -11.613 -4.684 -5.258 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -14.005 -5.036 -4.682 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -14.122 -3.373 -4.140 1.00 0.00 H new ATOM 892 N PRO A 134 -10.770 -2.371 -5.769 1.00 0.00 N ATOM 893 CA PRO A 134 -10.091 -1.085 -5.994 1.00 0.00 C ATOM 894 C PRO A 134 -11.039 0.096 -6.155 1.00 0.00 C ATOM 895 O PRO A 134 -10.801 1.168 -5.607 1.00 0.00 O ATOM 896 CB PRO A 134 -9.303 -1.309 -7.295 1.00 0.00 C ATOM 897 CG PRO A 134 -9.980 -2.459 -7.962 1.00 0.00 C ATOM 898 CD PRO A 134 -10.504 -3.329 -6.858 1.00 0.00 C ATOM 0 HA PRO A 134 -9.476 -0.822 -5.134 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -9.321 -0.420 -7.926 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -8.256 -1.532 -7.089 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -10.790 -2.115 -8.605 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -9.283 -3.009 -8.594 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -11.408 -3.859 -7.158 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -9.776 -4.084 -6.561 1.00 0.00 H new ATOM 906 N ILE A 135 -12.107 -0.097 -6.900 1.00 0.00 N ATOM 907 CA ILE A 135 -13.030 0.986 -7.171 1.00 0.00 C ATOM 908 C ILE A 135 -13.995 1.200 -6.016 1.00 0.00 C ATOM 909 O ILE A 135 -14.184 2.327 -5.563 1.00 0.00 O ATOM 910 CB ILE A 135 -13.807 0.757 -8.487 1.00 0.00 C ATOM 911 CG1 ILE A 135 -12.826 0.519 -9.648 1.00 0.00 C ATOM 912 CG2 ILE A 135 -14.726 1.939 -8.790 1.00 0.00 C ATOM 913 CD1 ILE A 135 -11.762 1.597 -9.792 1.00 0.00 C ATOM 0 H ILE A 135 -12.357 -0.989 -7.327 1.00 0.00 H new ATOM 0 HA ILE A 135 -12.431 1.890 -7.285 1.00 0.00 H new ATOM 0 HB ILE A 135 -14.430 -0.130 -8.370 1.00 0.00 H new ATOM 0 HG12 ILE A 135 -12.336 -0.444 -9.504 1.00 0.00 H new ATOM 0 HG13 ILE A 135 -13.390 0.453 -10.579 1.00 0.00 H new ATOM 0 HG21 ILE A 135 -15.262 1.754 -9.721 1.00 0.00 H new ATOM 0 HG22 ILE A 135 -15.442 2.061 -7.977 1.00 0.00 H new ATOM 0 HG23 ILE A 135 -14.131 2.847 -8.888 1.00 0.00 H new ATOM 0 HD11 ILE A 135 -11.111 1.356 -10.632 1.00 0.00 H new ATOM 0 HD12 ILE A 135 -12.241 2.560 -9.969 1.00 0.00 H new ATOM 0 HD13 ILE A 135 -11.171 1.649 -8.878 1.00 0.00 H new ATOM 925 N SER A 136 -14.603 0.127 -5.539 1.00 0.00 N ATOM 926 CA SER A 136 -15.534 0.216 -4.424 1.00 0.00 C ATOM 927 C SER A 136 -14.817 0.694 -3.156 1.00 0.00 C ATOM 928 O SER A 136 -15.407 1.384 -2.321 1.00 0.00 O ATOM 929 CB SER A 136 -16.177 -1.146 -4.186 1.00 0.00 C ATOM 930 OG SER A 136 -16.621 -1.712 -5.410 1.00 0.00 O ATOM 0 H SER A 136 -14.470 -0.816 -5.905 1.00 0.00 H new ATOM 0 HA SER A 136 -16.309 0.942 -4.669 1.00 0.00 H new ATOM 0 HB2 SER A 136 -15.460 -1.814 -3.710 1.00 0.00 H new ATOM 0 HB3 SER A 136 -17.019 -1.042 -3.501 1.00 0.00 H new ATOM 0 HG SER A 136 -15.851 -2.058 -5.909 1.00 0.00 H new ATOM 936 N ARG A 137 -13.553 0.288 -3.017 1.00 0.00 N ATOM 937 CA ARG A 137 -12.704 0.691 -1.895 1.00 0.00 C ATOM 938 C ARG A 137 -13.181 0.076 -0.587 1.00 0.00 C ATOM 939 O ARG A 137 -13.199 0.726 0.456 1.00 0.00 O ATOM 940 CB ARG A 137 -12.591 2.219 -1.785 1.00 0.00 C ATOM 941 CG ARG A 137 -11.807 2.857 -2.923 1.00 0.00 C ATOM 942 CD ARG A 137 -11.745 4.370 -2.785 1.00 0.00 C ATOM 943 NE ARG A 137 -13.054 4.996 -2.973 1.00 0.00 N ATOM 944 CZ ARG A 137 -13.403 6.186 -2.480 1.00 0.00 C ATOM 945 NH1 ARG A 137 -12.539 6.889 -1.760 1.00 0.00 N ATOM 946 NH2 ARG A 137 -14.613 6.674 -2.718 1.00 0.00 N ATOM 0 H ARG A 137 -13.089 -0.331 -3.681 1.00 0.00 H new ATOM 0 HA ARG A 137 -11.704 0.306 -2.095 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -13.593 2.648 -1.760 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -12.112 2.472 -0.839 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -10.795 2.451 -2.940 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -12.271 2.597 -3.875 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -11.359 4.628 -1.799 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -11.044 4.771 -3.516 1.00 0.00 H new ATOM 0 HE ARG A 137 -13.749 4.487 -3.519 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -11.605 6.520 -1.582 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -12.809 7.798 -1.385 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -15.277 6.140 -3.278 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -14.879 7.584 -2.341 1.00 0.00 H new ATOM 960 N ASN A 138 -13.541 -1.193 -0.658 1.00 0.00 N ATOM 961 CA ASN A 138 -13.956 -1.963 0.503 1.00 0.00 C ATOM 962 C ASN A 138 -13.754 -3.439 0.208 1.00 0.00 C ATOM 963 O ASN A 138 -13.456 -3.804 -0.937 1.00 0.00 O ATOM 964 CB ASN A 138 -15.423 -1.677 0.890 1.00 0.00 C ATOM 965 CG ASN A 138 -16.434 -2.159 -0.137 1.00 0.00 C ATOM 966 OD1 ASN A 138 -16.869 -3.311 -0.109 1.00 0.00 O ATOM 967 ND2 ASN A 138 -16.835 -1.277 -1.027 1.00 0.00 N ATOM 0 H ASN A 138 -13.554 -1.723 -1.529 1.00 0.00 H new ATOM 0 HA ASN A 138 -13.345 -1.668 1.356 1.00 0.00 H new ATOM 0 HB2 ASN A 138 -15.636 -2.154 1.847 1.00 0.00 H new ATOM 0 HB3 ASN A 138 -15.548 -0.604 1.033 1.00 0.00 H new ATOM 0 HD21 ASN A 138 -17.530 -1.538 -1.726 1.00 0.00 H new ATOM 0 HD22 ASN A 138 -16.451 -0.332 -1.018 1.00 0.00 H new ATOM 974 N CYS A 139 -13.911 -4.284 1.207 1.00 0.00 N ATOM 975 CA CYS A 139 -13.699 -5.708 1.014 1.00 0.00 C ATOM 976 C CYS A 139 -15.035 -6.430 0.871 1.00 0.00 C ATOM 977 O CYS A 139 -15.914 -6.306 1.725 1.00 0.00 O ATOM 978 CB CYS A 139 -12.897 -6.298 2.189 1.00 0.00 C ATOM 979 SG CYS A 139 -11.459 -5.284 2.709 1.00 0.00 S ATOM 0 H CYS A 139 -14.182 -4.015 2.153 1.00 0.00 H new ATOM 0 HA CYS A 139 -13.126 -5.850 0.097 1.00 0.00 H new ATOM 0 HB2 CYS A 139 -13.564 -6.424 3.041 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -12.544 -7.291 1.910 1.00 0.00 H new ATOM 984 N VAL A 140 -15.180 -7.171 -0.218 1.00 0.00 N ATOM 985 CA VAL A 140 -16.397 -7.921 -0.492 1.00 0.00 C ATOM 986 C VAL A 140 -16.122 -9.412 -0.353 1.00 0.00 C ATOM 987 O VAL A 140 -14.968 -9.827 -0.354 1.00 0.00 O ATOM 988 CB VAL A 140 -16.945 -7.624 -1.914 1.00 0.00 C ATOM 989 CG1 VAL A 140 -17.300 -6.149 -2.059 1.00 0.00 C ATOM 990 CG2 VAL A 140 -15.941 -8.041 -2.985 1.00 0.00 C ATOM 0 H VAL A 140 -14.460 -7.269 -0.934 1.00 0.00 H new ATOM 0 HA VAL A 140 -17.151 -7.611 0.231 1.00 0.00 H new ATOM 0 HB VAL A 140 -17.853 -8.211 -2.053 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -17.682 -5.964 -3.063 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -18.062 -5.885 -1.326 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -16.410 -5.542 -1.892 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -16.349 -7.822 -3.972 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -15.011 -7.489 -2.847 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -15.744 -9.110 -2.903 1.00 0.00 H new ATOM 1000 N LEU A 141 -17.170 -10.208 -0.235 1.00 0.00 N ATOM 1001 CA LEU A 141 -17.020 -11.652 -0.069 1.00 0.00 C ATOM 1002 C LEU A 141 -16.278 -12.268 -1.254 1.00 0.00 C ATOM 1003 O LEU A 141 -16.728 -12.177 -2.395 1.00 0.00 O ATOM 1004 CB LEU A 141 -18.387 -12.321 0.099 1.00 0.00 C ATOM 1005 CG LEU A 141 -18.358 -13.807 0.467 1.00 0.00 C ATOM 1006 CD1 LEU A 141 -17.797 -14.004 1.867 1.00 0.00 C ATOM 1007 CD2 LEU A 141 -19.744 -14.411 0.356 1.00 0.00 C ATOM 0 H LEU A 141 -18.137 -9.883 -0.250 1.00 0.00 H new ATOM 0 HA LEU A 141 -16.431 -11.823 0.832 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -18.941 -11.785 0.870 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -18.944 -12.207 -0.831 1.00 0.00 H new ATOM 0 HG LEU A 141 -17.703 -14.320 -0.237 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -17.785 -15.067 2.108 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -16.781 -13.611 1.911 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -18.422 -13.475 2.587 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -19.703 -15.467 0.621 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -20.422 -13.893 1.034 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -20.105 -14.308 -0.667 1.00 0.00 H new ATOM 1019 N ASP A 142 -15.148 -12.889 -0.973 1.00 0.00 N ATOM 1020 CA ASP A 142 -14.338 -13.520 -2.003 1.00 0.00 C ATOM 1021 C ASP A 142 -14.861 -14.912 -2.309 1.00 0.00 C ATOM 1022 O ASP A 142 -14.567 -15.870 -1.597 1.00 0.00 O ATOM 1023 CB ASP A 142 -12.870 -13.580 -1.571 1.00 0.00 C ATOM 1024 CG ASP A 142 -11.982 -14.289 -2.575 1.00 0.00 C ATOM 1025 OD1 ASP A 142 -12.096 -14.016 -3.782 1.00 0.00 O ATOM 1026 OD2 ASP A 142 -11.144 -15.108 -2.152 1.00 0.00 O ATOM 0 H ASP A 142 -14.766 -12.971 -0.031 1.00 0.00 H new ATOM 0 HA ASP A 142 -14.404 -12.919 -2.910 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -12.500 -12.566 -1.421 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -12.801 -14.090 -0.610 1.00 0.00 H new ATOM 1031 N ASN A 143 -15.654 -15.009 -3.356 1.00 0.00 N ATOM 1032 CA ASN A 143 -16.260 -16.267 -3.741 1.00 0.00 C ATOM 1033 C ASN A 143 -16.258 -16.426 -5.253 1.00 0.00 C ATOM 1034 O ASN A 143 -15.704 -17.427 -5.738 1.00 0.00 O ATOM 1035 CB ASN A 143 -17.689 -16.401 -3.164 1.00 0.00 C ATOM 1036 CG ASN A 143 -18.689 -15.412 -3.747 1.00 0.00 C ATOM 1037 OD1 ASN A 143 -19.415 -15.726 -4.690 1.00 0.00 O ATOM 1038 ND2 ASN A 143 -18.734 -14.217 -3.191 1.00 0.00 N ATOM 1039 OXT ASN A 143 -16.776 -15.532 -5.955 1.00 0.00 O ATOM 0 H ASN A 143 -15.896 -14.224 -3.961 1.00 0.00 H new ATOM 0 HA ASN A 143 -15.660 -17.073 -3.318 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -18.049 -17.414 -3.344 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -17.647 -16.265 -2.083 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -19.387 -13.516 -3.541 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -18.116 -13.994 -2.411 1.00 0.00 H new TER 1046 ASN A 143