USER MOD reduce.3.24.130724 H: found=0, std=0, add=854, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 855 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 66 SER OG : rot -85:sc= 0.776 USER MOD Set 1.2: A 93 MET CE :methyl 144:sc= -2.51 (180deg=-6.73!) USER MOD Set 2.1: A 65 SER OG : rot -103:sc= 1.3 USER MOD Set 2.2: A 73 TYR OH : rot 130:sc= -0.0823 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 136:sc= 1.13 USER MOD Single : A 20 ASN : amide:sc= -0.186 K(o=-0.19,f=-2.7!) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 180:sc= -0.912 USER MOD Single : A 30 GLN : amide:sc= 0.15 X(o=0.15,f=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0.00464 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 41:sc= 0.403 USER MOD Single : A 46 ASN : amide:sc= -2.09 K(o=-2.1,f=-3.3!) USER MOD Single : A 49 THR OG1 : rot 180:sc= -0.195 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot -153:sc= 0.0762 USER MOD Single : A 58 TYR OH : rot 114:sc= -1.13! USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 151:sc= -0.146 (180deg=-0.709) USER MOD Single : A 74 LYS NZ :NH3+ -162:sc= -0.0161 (180deg=-0.151) USER MOD Single : A 75 SER OG : rot 18:sc= 0.109! USER MOD Single : A 77 TYR OH : rot 180:sc= -0.0162 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0.00774 USER MOD Single : A 83 ASN : amide:sc= -0.0395 X(o=-0.04,f=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -1.82 X(o=-1.8,f=-1.6) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 TYR OH : rot 15:sc= -1.9 USER MOD Single : A 96 HIS : no HD1:sc= -3.38 K(o=-3.4,f=-6!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -0.0015 K(o=-0.0015,f=-0.97) USER MOD Single : A 103 TYR OH : rot 150:sc= -2.54! USER MOD Single : A 104 ASN : amide:sc= -0.161 K(o=-0.16,f=-1.8!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 60:sc= -0.71 USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.89 USER MOD Single : A 118 THR OG1 : rot -130:sc=0.000214 USER MOD Single : A 120 SER OG : rot 180:sc= -3.97! USER MOD Single : A 121 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N ASP A 8 9.566 -24.676 -6.096 1.00 0.00 N ATOM 67 CA ASP A 8 9.820 -23.730 -5.016 1.00 0.00 C ATOM 68 C ASP A 8 10.659 -22.555 -5.508 1.00 0.00 C ATOM 69 O ASP A 8 10.400 -21.405 -5.156 1.00 0.00 O ATOM 70 CB ASP A 8 10.528 -24.428 -3.853 1.00 0.00 C ATOM 71 CG ASP A 8 9.936 -25.790 -3.548 1.00 0.00 C ATOM 72 OD1 ASP A 8 10.289 -26.760 -4.249 1.00 0.00 O ATOM 73 OD2 ASP A 8 9.118 -25.885 -2.608 1.00 0.00 O ATOM 0 HA ASP A 8 8.860 -23.347 -4.669 1.00 0.00 H new ATOM 0 HB2 ASP A 8 11.586 -24.540 -4.090 1.00 0.00 H new ATOM 0 HB3 ASP A 8 10.465 -23.800 -2.964 1.00 0.00 H new ATOM 78 N GLU A 9 11.667 -22.854 -6.322 1.00 0.00 N ATOM 79 CA GLU A 9 12.545 -21.823 -6.860 1.00 0.00 C ATOM 80 C GLU A 9 11.747 -20.589 -7.272 1.00 0.00 C ATOM 81 O GLU A 9 12.152 -19.458 -7.006 1.00 0.00 O ATOM 82 CB GLU A 9 13.327 -22.362 -8.059 1.00 0.00 C ATOM 83 CG GLU A 9 12.442 -22.884 -9.178 1.00 0.00 C ATOM 84 CD GLU A 9 13.233 -23.293 -10.406 1.00 0.00 C ATOM 85 OE1 GLU A 9 14.282 -22.669 -10.671 1.00 0.00 O ATOM 86 OE2 GLU A 9 12.803 -24.237 -11.100 1.00 0.00 O ATOM 0 H GLU A 9 11.895 -23.802 -6.623 1.00 0.00 H new ATOM 0 HA GLU A 9 13.247 -21.536 -6.077 1.00 0.00 H new ATOM 0 HB2 GLU A 9 13.965 -21.570 -8.451 1.00 0.00 H new ATOM 0 HB3 GLU A 9 13.984 -23.164 -7.723 1.00 0.00 H new ATOM 0 HG2 GLU A 9 11.872 -23.740 -8.816 1.00 0.00 H new ATOM 0 HG3 GLU A 9 11.721 -22.115 -9.455 1.00 0.00 H new ATOM 93 N GLU A 10 10.611 -20.817 -7.924 1.00 0.00 N ATOM 94 CA GLU A 10 9.757 -19.725 -8.375 1.00 0.00 C ATOM 95 C GLU A 10 9.165 -18.971 -7.187 1.00 0.00 C ATOM 96 O GLU A 10 9.186 -17.741 -7.143 1.00 0.00 O ATOM 97 CB GLU A 10 8.633 -20.260 -9.264 1.00 0.00 C ATOM 98 CG GLU A 10 9.042 -20.446 -10.716 1.00 0.00 C ATOM 99 CD GLU A 10 7.854 -20.660 -11.634 1.00 0.00 C ATOM 100 OE1 GLU A 10 7.039 -19.725 -11.775 1.00 0.00 O ATOM 101 OE2 GLU A 10 7.740 -21.762 -12.210 1.00 0.00 O ATOM 0 H GLU A 10 10.261 -21.748 -8.151 1.00 0.00 H new ATOM 0 HA GLU A 10 10.370 -19.034 -8.954 1.00 0.00 H new ATOM 0 HB2 GLU A 10 8.290 -21.215 -8.867 1.00 0.00 H new ATOM 0 HB3 GLU A 10 7.787 -19.574 -9.218 1.00 0.00 H new ATOM 0 HG2 GLU A 10 9.599 -19.570 -11.048 1.00 0.00 H new ATOM 0 HG3 GLU A 10 9.715 -21.300 -10.794 1.00 0.00 H new ATOM 108 N THR A 11 8.637 -19.719 -6.223 1.00 0.00 N ATOM 109 CA THR A 11 8.038 -19.124 -5.035 1.00 0.00 C ATOM 110 C THR A 11 9.028 -18.214 -4.317 1.00 0.00 C ATOM 111 O THR A 11 8.692 -17.093 -3.934 1.00 0.00 O ATOM 112 CB THR A 11 7.545 -20.204 -4.053 1.00 0.00 C ATOM 113 OG1 THR A 11 6.684 -21.126 -4.731 1.00 0.00 O ATOM 114 CG2 THR A 11 6.802 -19.574 -2.885 1.00 0.00 C ATOM 0 H THR A 11 8.612 -20.739 -6.242 1.00 0.00 H new ATOM 0 HA THR A 11 7.186 -18.534 -5.373 1.00 0.00 H new ATOM 0 HB THR A 11 8.414 -20.736 -3.666 1.00 0.00 H new ATOM 0 HG1 THR A 11 6.376 -21.810 -4.101 1.00 0.00 H new ATOM 0 HG21 THR A 11 6.463 -20.356 -2.205 1.00 0.00 H new ATOM 0 HG22 THR A 11 7.468 -18.895 -2.354 1.00 0.00 H new ATOM 0 HG23 THR A 11 5.941 -19.020 -3.258 1.00 0.00 H new ATOM 122 N LYS A 12 10.250 -18.703 -4.137 1.00 0.00 N ATOM 123 CA LYS A 12 11.291 -17.933 -3.466 1.00 0.00 C ATOM 124 C LYS A 12 11.423 -16.544 -4.082 1.00 0.00 C ATOM 125 O LYS A 12 11.292 -15.534 -3.391 1.00 0.00 O ATOM 126 CB LYS A 12 12.631 -18.669 -3.549 1.00 0.00 C ATOM 127 CG LYS A 12 12.759 -19.813 -2.558 1.00 0.00 C ATOM 128 CD LYS A 12 14.135 -20.454 -2.621 1.00 0.00 C ATOM 129 CE LYS A 12 14.128 -21.851 -2.019 1.00 0.00 C ATOM 130 NZ LYS A 12 15.487 -22.458 -2.011 1.00 0.00 N ATOM 0 H LYS A 12 10.544 -19.629 -4.446 1.00 0.00 H new ATOM 0 HA LYS A 12 11.008 -17.821 -2.419 1.00 0.00 H new ATOM 0 HB2 LYS A 12 12.760 -19.058 -4.559 1.00 0.00 H new ATOM 0 HB3 LYS A 12 13.438 -17.957 -3.376 1.00 0.00 H new ATOM 0 HG2 LYS A 12 12.574 -19.444 -1.549 1.00 0.00 H new ATOM 0 HG3 LYS A 12 11.997 -20.564 -2.767 1.00 0.00 H new ATOM 0 HD2 LYS A 12 14.466 -20.505 -3.658 1.00 0.00 H new ATOM 0 HD3 LYS A 12 14.853 -19.831 -2.088 1.00 0.00 H new ATOM 0 HE2 LYS A 12 13.745 -21.805 -1.000 1.00 0.00 H new ATOM 0 HE3 LYS A 12 13.449 -22.488 -2.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 15.440 -23.409 -1.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 15.843 -22.525 -2.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 16.129 -21.864 -1.448 1.00 0.00 H new ATOM 144 N ALA A 13 11.681 -16.501 -5.385 1.00 0.00 N ATOM 145 CA ALA A 13 11.827 -15.236 -6.094 1.00 0.00 C ATOM 146 C ALA A 13 10.625 -14.330 -5.851 1.00 0.00 C ATOM 147 O ALA A 13 10.742 -13.104 -5.882 1.00 0.00 O ATOM 148 CB ALA A 13 12.012 -15.484 -7.583 1.00 0.00 C ATOM 0 H ALA A 13 11.793 -17.328 -5.971 1.00 0.00 H new ATOM 0 HA ALA A 13 12.713 -14.731 -5.709 1.00 0.00 H new ATOM 0 HB1 ALA A 13 12.120 -14.530 -8.100 1.00 0.00 H new ATOM 0 HB2 ALA A 13 12.906 -16.087 -7.743 1.00 0.00 H new ATOM 0 HB3 ALA A 13 11.143 -16.013 -7.975 1.00 0.00 H new ATOM 154 N PHE A 14 9.469 -14.939 -5.611 1.00 0.00 N ATOM 155 CA PHE A 14 8.244 -14.187 -5.366 1.00 0.00 C ATOM 156 C PHE A 14 8.186 -13.700 -3.921 1.00 0.00 C ATOM 157 O PHE A 14 7.670 -12.618 -3.640 1.00 0.00 O ATOM 158 CB PHE A 14 7.019 -15.050 -5.675 1.00 0.00 C ATOM 159 CG PHE A 14 6.540 -14.925 -7.093 1.00 0.00 C ATOM 160 CD1 PHE A 14 5.931 -13.761 -7.532 1.00 0.00 C ATOM 161 CD2 PHE A 14 6.699 -15.972 -7.986 1.00 0.00 C ATOM 162 CE1 PHE A 14 5.488 -13.643 -8.836 1.00 0.00 C ATOM 163 CE2 PHE A 14 6.259 -15.860 -9.292 1.00 0.00 C ATOM 164 CZ PHE A 14 5.654 -14.694 -9.717 1.00 0.00 C ATOM 0 H PHE A 14 9.355 -15.952 -5.581 1.00 0.00 H new ATOM 0 HA PHE A 14 8.242 -13.319 -6.025 1.00 0.00 H new ATOM 0 HB2 PHE A 14 7.259 -16.094 -5.472 1.00 0.00 H new ATOM 0 HB3 PHE A 14 6.209 -14.772 -5.001 1.00 0.00 H new ATOM 0 HD1 PHE A 14 5.801 -12.936 -6.847 1.00 0.00 H new ATOM 0 HD2 PHE A 14 7.172 -16.886 -7.658 1.00 0.00 H new ATOM 0 HE1 PHE A 14 5.013 -12.731 -9.166 1.00 0.00 H new ATOM 0 HE2 PHE A 14 6.388 -16.683 -9.979 1.00 0.00 H new ATOM 0 HZ PHE A 14 5.311 -14.604 -10.737 1.00 0.00 H new ATOM 174 N GLU A 15 8.719 -14.507 -3.008 1.00 0.00 N ATOM 175 CA GLU A 15 8.726 -14.159 -1.592 1.00 0.00 C ATOM 176 C GLU A 15 9.595 -12.931 -1.338 1.00 0.00 C ATOM 177 O GLU A 15 9.350 -12.165 -0.407 1.00 0.00 O ATOM 178 CB GLU A 15 9.231 -15.337 -0.757 1.00 0.00 C ATOM 179 CG GLU A 15 8.294 -16.533 -0.763 1.00 0.00 C ATOM 180 CD GLU A 15 8.370 -17.339 0.519 1.00 0.00 C ATOM 181 OE1 GLU A 15 9.497 -17.645 0.962 1.00 0.00 O ATOM 182 OE2 GLU A 15 7.303 -17.664 1.080 1.00 0.00 O ATOM 0 H GLU A 15 9.151 -15.405 -3.224 1.00 0.00 H new ATOM 0 HA GLU A 15 7.703 -13.926 -1.296 1.00 0.00 H new ATOM 0 HB2 GLU A 15 10.205 -15.648 -1.134 1.00 0.00 H new ATOM 0 HB3 GLU A 15 9.378 -15.006 0.271 1.00 0.00 H new ATOM 0 HG2 GLU A 15 7.271 -16.188 -0.911 1.00 0.00 H new ATOM 0 HG3 GLU A 15 8.538 -17.177 -1.608 1.00 0.00 H new ATOM 189 N ALA A 16 10.613 -12.751 -2.174 1.00 0.00 N ATOM 190 CA ALA A 16 11.518 -11.616 -2.042 1.00 0.00 C ATOM 191 C ALA A 16 11.065 -10.448 -2.911 1.00 0.00 C ATOM 192 O ALA A 16 11.041 -9.300 -2.463 1.00 0.00 O ATOM 193 CB ALA A 16 12.937 -12.028 -2.405 1.00 0.00 C ATOM 0 H ALA A 16 10.831 -13.377 -2.949 1.00 0.00 H new ATOM 0 HA ALA A 16 11.501 -11.288 -1.003 1.00 0.00 H new ATOM 0 HB1 ALA A 16 13.602 -11.171 -2.302 1.00 0.00 H new ATOM 0 HB2 ALA A 16 13.266 -12.825 -1.738 1.00 0.00 H new ATOM 0 HB3 ALA A 16 12.960 -12.384 -3.435 1.00 0.00 H new ATOM 199 N LEU A 17 10.708 -10.746 -4.155 1.00 0.00 N ATOM 200 CA LEU A 17 10.256 -9.720 -5.088 1.00 0.00 C ATOM 201 C LEU A 17 8.974 -9.058 -4.591 1.00 0.00 C ATOM 202 O LEU A 17 8.890 -7.833 -4.499 1.00 0.00 O ATOM 203 CB LEU A 17 10.026 -10.327 -6.473 1.00 0.00 C ATOM 204 CG LEU A 17 9.140 -9.519 -7.421 1.00 0.00 C ATOM 205 CD1 LEU A 17 9.935 -8.397 -8.069 1.00 0.00 C ATOM 206 CD2 LEU A 17 8.530 -10.424 -8.482 1.00 0.00 C ATOM 0 H LEU A 17 10.723 -11.690 -4.541 1.00 0.00 H new ATOM 0 HA LEU A 17 11.033 -8.959 -5.156 1.00 0.00 H new ATOM 0 HB2 LEU A 17 10.996 -10.472 -6.949 1.00 0.00 H new ATOM 0 HB3 LEU A 17 9.582 -11.314 -6.346 1.00 0.00 H new ATOM 0 HG LEU A 17 8.331 -9.075 -6.841 1.00 0.00 H new ATOM 0 HD11 LEU A 17 9.287 -7.833 -8.740 1.00 0.00 H new ATOM 0 HD12 LEU A 17 10.323 -7.733 -7.297 1.00 0.00 H new ATOM 0 HD13 LEU A 17 10.765 -8.819 -8.635 1.00 0.00 H new ATOM 0 HD21 LEU A 17 7.902 -9.832 -9.148 1.00 0.00 H new ATOM 0 HD22 LEU A 17 9.325 -10.897 -9.058 1.00 0.00 H new ATOM 0 HD23 LEU A 17 7.925 -11.192 -8.001 1.00 0.00 H new ATOM 218 N LEU A 18 7.979 -9.877 -4.269 1.00 0.00 N ATOM 219 CA LEU A 18 6.701 -9.372 -3.779 1.00 0.00 C ATOM 220 C LEU A 18 6.895 -8.527 -2.523 1.00 0.00 C ATOM 221 O LEU A 18 6.104 -7.627 -2.241 1.00 0.00 O ATOM 222 CB LEU A 18 5.750 -10.534 -3.483 1.00 0.00 C ATOM 223 CG LEU A 18 5.329 -11.379 -4.686 1.00 0.00 C ATOM 224 CD1 LEU A 18 4.616 -12.641 -4.228 1.00 0.00 C ATOM 225 CD2 LEU A 18 4.440 -10.571 -5.621 1.00 0.00 C ATOM 0 H LEU A 18 8.032 -10.893 -4.338 1.00 0.00 H new ATOM 0 HA LEU A 18 6.266 -8.743 -4.555 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.225 -11.189 -2.752 1.00 0.00 H new ATOM 0 HB3 LEU A 18 4.852 -10.132 -3.014 1.00 0.00 H new ATOM 0 HG LEU A 18 6.226 -11.671 -5.232 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.324 -13.230 -5.098 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.285 -13.229 -3.600 1.00 0.00 H new ATOM 0 HD13 LEU A 18 3.727 -12.370 -3.658 1.00 0.00 H new ATOM 0 HD21 LEU A 18 4.150 -11.188 -6.471 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.547 -10.248 -5.086 1.00 0.00 H new ATOM 0 HD23 LEU A 18 4.985 -9.697 -5.977 1.00 0.00 H new ATOM 237 N SER A 19 7.953 -8.823 -1.775 1.00 0.00 N ATOM 238 CA SER A 19 8.251 -8.092 -0.549 1.00 0.00 C ATOM 239 C SER A 19 9.383 -7.094 -0.773 1.00 0.00 C ATOM 240 O SER A 19 10.140 -6.783 0.146 1.00 0.00 O ATOM 241 CB SER A 19 8.625 -9.064 0.571 1.00 0.00 C ATOM 242 OG SER A 19 7.945 -10.298 0.424 1.00 0.00 O ATOM 0 H SER A 19 8.618 -9.564 -1.996 1.00 0.00 H new ATOM 0 HA SER A 19 7.357 -7.540 -0.257 1.00 0.00 H new ATOM 0 HB2 SER A 19 9.701 -9.235 0.564 1.00 0.00 H new ATOM 0 HB3 SER A 19 8.379 -8.623 1.537 1.00 0.00 H new ATOM 0 HG SER A 19 8.570 -11.037 0.582 1.00 0.00 H new ATOM 248 N ASN A 20 9.493 -6.598 -2.001 1.00 0.00 N ATOM 249 CA ASN A 20 10.533 -5.636 -2.346 1.00 0.00 C ATOM 250 C ASN A 20 9.924 -4.345 -2.884 1.00 0.00 C ATOM 251 O ASN A 20 10.551 -3.629 -3.665 1.00 0.00 O ATOM 252 CB ASN A 20 11.485 -6.235 -3.384 1.00 0.00 C ATOM 253 CG ASN A 20 12.878 -5.639 -3.303 1.00 0.00 C ATOM 254 OD1 ASN A 20 13.185 -4.874 -2.388 1.00 0.00 O ATOM 255 ND2 ASN A 20 13.727 -5.987 -4.262 1.00 0.00 N ATOM 0 H ASN A 20 8.875 -6.846 -2.773 1.00 0.00 H new ATOM 0 HA ASN A 20 11.092 -5.402 -1.440 1.00 0.00 H new ATOM 0 HB2 ASN A 20 11.545 -7.314 -3.238 1.00 0.00 H new ATOM 0 HB3 ASN A 20 11.080 -6.070 -4.382 1.00 0.00 H new ATOM 0 HD21 ASN A 20 14.678 -5.617 -4.260 1.00 0.00 H new ATOM 0 HD22 ASN A 20 13.429 -6.624 -5.001 1.00 0.00 H new ATOM 262 N ILE A 21 8.698 -4.055 -2.461 1.00 0.00 N ATOM 263 CA ILE A 21 8.005 -2.849 -2.898 1.00 0.00 C ATOM 264 C ILE A 21 8.193 -1.714 -1.898 1.00 0.00 C ATOM 265 O ILE A 21 8.741 -1.911 -0.813 1.00 0.00 O ATOM 266 CB ILE A 21 6.499 -3.105 -3.090 1.00 0.00 C ATOM 267 CG1 ILE A 21 5.769 -3.019 -1.748 1.00 0.00 C ATOM 268 CG2 ILE A 21 6.270 -4.462 -3.738 1.00 0.00 C ATOM 269 CD1 ILE A 21 6.237 -4.045 -0.740 1.00 0.00 C ATOM 0 H ILE A 21 8.164 -4.638 -1.817 1.00 0.00 H new ATOM 0 HA ILE A 21 8.442 -2.563 -3.855 1.00 0.00 H new ATOM 0 HB ILE A 21 6.097 -2.337 -3.751 1.00 0.00 H new ATOM 0 HG12 ILE A 21 5.908 -2.022 -1.331 1.00 0.00 H new ATOM 0 HG13 ILE A 21 4.700 -3.148 -1.916 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.200 -4.628 -3.867 1.00 0.00 H new ATOM 0 HG22 ILE A 21 6.761 -4.488 -4.711 1.00 0.00 H new ATOM 0 HG23 ILE A 21 6.684 -5.244 -3.101 1.00 0.00 H new ATOM 0 HD11 ILE A 21 5.677 -3.926 0.187 1.00 0.00 H new ATOM 0 HD12 ILE A 21 6.072 -5.047 -1.137 1.00 0.00 H new ATOM 0 HD13 ILE A 21 7.300 -3.903 -0.543 1.00 0.00 H new ATOM 281 N VAL A 22 7.733 -0.523 -2.270 1.00 0.00 N ATOM 282 CA VAL A 22 7.848 0.645 -1.404 1.00 0.00 C ATOM 283 C VAL A 22 6.484 1.071 -0.873 1.00 0.00 C ATOM 284 O VAL A 22 5.481 1.010 -1.584 1.00 0.00 O ATOM 285 CB VAL A 22 8.491 1.832 -2.146 1.00 0.00 C ATOM 286 CG1 VAL A 22 7.607 2.283 -3.299 1.00 0.00 C ATOM 287 CG2 VAL A 22 8.754 2.981 -1.184 1.00 0.00 C ATOM 0 H VAL A 22 7.278 -0.342 -3.165 1.00 0.00 H new ATOM 0 HA VAL A 22 8.487 0.359 -0.569 1.00 0.00 H new ATOM 0 HB VAL A 22 9.446 1.507 -2.558 1.00 0.00 H new ATOM 0 HG11 VAL A 22 8.077 3.122 -3.811 1.00 0.00 H new ATOM 0 HG12 VAL A 22 7.474 1.459 -4.000 1.00 0.00 H new ATOM 0 HG13 VAL A 22 6.635 2.592 -2.913 1.00 0.00 H new ATOM 0 HG21 VAL A 22 9.208 3.811 -1.725 1.00 0.00 H new ATOM 0 HG22 VAL A 22 7.813 3.308 -0.741 1.00 0.00 H new ATOM 0 HG23 VAL A 22 9.429 2.648 -0.396 1.00 0.00 H new ATOM 297 N LYS A 23 6.453 1.502 0.384 1.00 0.00 N ATOM 298 CA LYS A 23 5.213 1.940 1.013 1.00 0.00 C ATOM 299 C LYS A 23 4.478 2.941 0.128 1.00 0.00 C ATOM 300 O LYS A 23 5.084 3.792 -0.524 1.00 0.00 O ATOM 301 CB LYS A 23 5.504 2.567 2.378 1.00 0.00 C ATOM 302 CG LYS A 23 6.175 3.927 2.292 1.00 0.00 C ATOM 303 CD LYS A 23 6.365 4.543 3.668 1.00 0.00 C ATOM 304 CE LYS A 23 6.685 6.028 3.574 1.00 0.00 C ATOM 305 NZ LYS A 23 6.500 6.718 4.881 1.00 0.00 N ATOM 0 H LYS A 23 7.274 1.557 0.987 1.00 0.00 H new ATOM 0 HA LYS A 23 4.576 1.066 1.150 1.00 0.00 H new ATOM 0 HB2 LYS A 23 4.569 2.667 2.929 1.00 0.00 H new ATOM 0 HB3 LYS A 23 6.141 1.892 2.950 1.00 0.00 H new ATOM 0 HG2 LYS A 23 7.143 3.826 1.801 1.00 0.00 H new ATOM 0 HG3 LYS A 23 5.572 4.593 1.674 1.00 0.00 H new ATOM 0 HD2 LYS A 23 5.460 4.401 4.259 1.00 0.00 H new ATOM 0 HD3 LYS A 23 7.171 4.028 4.190 1.00 0.00 H new ATOM 0 HE2 LYS A 23 7.714 6.157 3.237 1.00 0.00 H new ATOM 0 HE3 LYS A 23 6.043 6.491 2.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 6.728 7.727 4.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 5.512 6.616 5.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 7.131 6.293 5.590 1.00 0.00 H new ATOM 319 N PRO A 24 3.141 2.840 0.103 1.00 0.00 N ATOM 320 CA PRO A 24 2.294 3.731 -0.697 1.00 0.00 C ATOM 321 C PRO A 24 2.275 5.155 -0.154 1.00 0.00 C ATOM 322 O PRO A 24 2.336 5.370 1.057 1.00 0.00 O ATOM 323 CB PRO A 24 0.906 3.096 -0.584 1.00 0.00 C ATOM 324 CG PRO A 24 0.939 2.340 0.699 1.00 0.00 C ATOM 325 CD PRO A 24 2.352 1.850 0.855 1.00 0.00 C ATOM 0 HA PRO A 24 2.653 3.824 -1.722 1.00 0.00 H new ATOM 0 HB2 PRO A 24 0.123 3.854 -0.577 1.00 0.00 H new ATOM 0 HB3 PRO A 24 0.703 2.436 -1.427 1.00 0.00 H new ATOM 0 HG2 PRO A 24 0.653 2.978 1.535 1.00 0.00 H new ATOM 0 HG3 PRO A 24 0.237 1.506 0.679 1.00 0.00 H new ATOM 0 HD2 PRO A 24 2.650 1.810 1.903 1.00 0.00 H new ATOM 0 HD3 PRO A 24 2.476 0.846 0.450 1.00 0.00 H new ATOM 333 N VAL A 25 2.190 6.127 -1.057 1.00 0.00 N ATOM 334 CA VAL A 25 2.161 7.532 -0.668 1.00 0.00 C ATOM 335 C VAL A 25 0.756 8.109 -0.795 1.00 0.00 C ATOM 336 O VAL A 25 0.102 7.954 -1.826 1.00 0.00 O ATOM 337 CB VAL A 25 3.129 8.371 -1.523 1.00 0.00 C ATOM 338 CG1 VAL A 25 3.035 9.842 -1.147 1.00 0.00 C ATOM 339 CG2 VAL A 25 4.554 7.862 -1.370 1.00 0.00 C ATOM 0 H VAL A 25 2.140 5.967 -2.063 1.00 0.00 H new ATOM 0 HA VAL A 25 2.476 7.578 0.375 1.00 0.00 H new ATOM 0 HB VAL A 25 2.843 8.269 -2.570 1.00 0.00 H new ATOM 0 HG11 VAL A 25 3.726 10.419 -1.761 1.00 0.00 H new ATOM 0 HG12 VAL A 25 2.018 10.196 -1.314 1.00 0.00 H new ATOM 0 HG13 VAL A 25 3.294 9.966 -0.095 1.00 0.00 H new ATOM 0 HG21 VAL A 25 5.224 8.467 -1.981 1.00 0.00 H new ATOM 0 HG22 VAL A 25 4.855 7.931 -0.325 1.00 0.00 H new ATOM 0 HG23 VAL A 25 4.606 6.823 -1.694 1.00 0.00 H new ATOM 349 N ALA A 26 0.298 8.776 0.259 1.00 0.00 N ATOM 350 CA ALA A 26 -1.029 9.378 0.264 1.00 0.00 C ATOM 351 C ALA A 26 -0.974 10.832 -0.194 1.00 0.00 C ATOM 352 O ALA A 26 -0.209 11.633 0.343 1.00 0.00 O ATOM 353 CB ALA A 26 -1.647 9.283 1.652 1.00 0.00 C ATOM 0 H ALA A 26 0.827 8.913 1.120 1.00 0.00 H new ATOM 0 HA ALA A 26 -1.654 8.826 -0.438 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -2.638 9.737 1.641 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -1.731 8.236 1.942 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -1.015 9.809 2.368 1.00 0.00 H new ATOM 359 N SER A 27 -1.789 11.165 -1.189 1.00 0.00 N ATOM 360 CA SER A 27 -1.829 12.522 -1.722 1.00 0.00 C ATOM 361 C SER A 27 -3.268 13.013 -1.849 1.00 0.00 C ATOM 362 O SER A 27 -4.215 12.254 -1.646 1.00 0.00 O ATOM 363 CB SER A 27 -1.138 12.577 -3.086 1.00 0.00 C ATOM 364 OG SER A 27 -1.824 11.784 -4.038 1.00 0.00 O ATOM 0 H SER A 27 -2.430 10.514 -1.643 1.00 0.00 H new ATOM 0 HA SER A 27 -1.300 13.175 -1.028 1.00 0.00 H new ATOM 0 HB2 SER A 27 -1.093 13.609 -3.433 1.00 0.00 H new ATOM 0 HB3 SER A 27 -0.110 12.228 -2.991 1.00 0.00 H new ATOM 0 HG SER A 27 -1.363 11.837 -4.901 1.00 0.00 H new ATOM 370 N ASP A 28 -3.423 14.289 -2.187 1.00 0.00 N ATOM 371 CA ASP A 28 -4.746 14.883 -2.342 1.00 0.00 C ATOM 372 C ASP A 28 -5.730 14.288 -1.340 1.00 0.00 C ATOM 373 O ASP A 28 -6.902 14.078 -1.655 1.00 0.00 O ATOM 374 CB ASP A 28 -5.259 14.671 -3.767 1.00 0.00 C ATOM 375 CG ASP A 28 -6.207 15.769 -4.210 1.00 0.00 C ATOM 376 OD1 ASP A 28 -7.006 16.237 -3.372 1.00 0.00 O ATOM 377 OD2 ASP A 28 -6.149 16.159 -5.395 1.00 0.00 O ATOM 0 H ASP A 28 -2.649 14.931 -2.359 1.00 0.00 H new ATOM 0 HA ASP A 28 -4.662 15.953 -2.149 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -4.412 14.627 -4.452 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.768 13.709 -3.828 1.00 0.00 H new ATOM 382 N ILE A 29 -5.246 14.019 -0.132 1.00 0.00 N ATOM 383 CA ILE A 29 -6.083 13.448 0.916 1.00 0.00 C ATOM 384 C ILE A 29 -7.346 14.278 1.124 1.00 0.00 C ATOM 385 O ILE A 29 -7.275 15.483 1.365 1.00 0.00 O ATOM 386 CB ILE A 29 -5.323 13.348 2.252 1.00 0.00 C ATOM 387 CG1 ILE A 29 -4.060 12.501 2.082 1.00 0.00 C ATOM 388 CG2 ILE A 29 -6.222 12.759 3.329 1.00 0.00 C ATOM 389 CD1 ILE A 29 -2.941 12.891 3.022 1.00 0.00 C ATOM 0 H ILE A 29 -4.279 14.187 0.145 1.00 0.00 H new ATOM 0 HA ILE A 29 -6.359 12.446 0.588 1.00 0.00 H new ATOM 0 HB ILE A 29 -5.027 14.350 2.562 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -4.311 11.453 2.244 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.708 12.590 1.054 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -5.671 12.694 4.267 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -7.095 13.398 3.464 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -6.545 11.762 3.028 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -2.078 12.249 2.846 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.663 13.930 2.845 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -3.275 12.775 4.053 1.00 0.00 H new ATOM 401 N GLN A 30 -8.499 13.624 1.029 1.00 0.00 N ATOM 402 CA GLN A 30 -9.778 14.302 1.208 1.00 0.00 C ATOM 403 C GLN A 30 -10.501 13.783 2.447 1.00 0.00 C ATOM 404 O GLN A 30 -9.959 12.975 3.201 1.00 0.00 O ATOM 405 CB GLN A 30 -10.658 14.110 -0.028 1.00 0.00 C ATOM 406 CG GLN A 30 -10.508 15.217 -1.059 1.00 0.00 C ATOM 407 CD GLN A 30 -10.737 14.730 -2.476 1.00 0.00 C ATOM 408 OE1 GLN A 30 -11.875 14.620 -2.931 1.00 0.00 O ATOM 409 NE2 GLN A 30 -9.652 14.434 -3.183 1.00 0.00 N ATOM 0 H GLN A 30 -8.574 12.627 0.829 1.00 0.00 H new ATOM 0 HA GLN A 30 -9.581 15.365 1.344 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -10.413 13.155 -0.494 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -11.701 14.054 0.284 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -11.215 16.015 -0.835 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -9.509 15.646 -0.983 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -8.727 14.540 -2.766 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -9.744 14.101 -4.143 1.00 0.00 H new ATOM 418 N ALA A 31 -11.727 14.253 2.651 1.00 0.00 N ATOM 419 CA ALA A 31 -12.525 13.835 3.797 1.00 0.00 C ATOM 420 C ALA A 31 -12.311 12.357 4.105 1.00 0.00 C ATOM 421 O ALA A 31 -11.678 12.005 5.100 1.00 0.00 O ATOM 422 CB ALA A 31 -13.999 14.116 3.545 1.00 0.00 C ATOM 0 H ALA A 31 -12.189 14.924 2.037 1.00 0.00 H new ATOM 0 HA ALA A 31 -12.200 14.411 4.664 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -14.583 13.799 4.409 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -14.143 15.184 3.382 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -14.329 13.567 2.663 1.00 0.00 H new ATOM 428 N ARG A 32 -12.844 11.495 3.244 1.00 0.00 N ATOM 429 CA ARG A 32 -12.713 10.054 3.426 1.00 0.00 C ATOM 430 C ARG A 32 -11.921 9.432 2.280 1.00 0.00 C ATOM 431 O ARG A 32 -11.316 8.370 2.432 1.00 0.00 O ATOM 432 CB ARG A 32 -14.094 9.403 3.519 1.00 0.00 C ATOM 433 CG ARG A 32 -15.104 10.226 4.301 1.00 0.00 C ATOM 434 CD ARG A 32 -16.520 9.998 3.794 1.00 0.00 C ATOM 435 NE ARG A 32 -16.873 10.925 2.722 1.00 0.00 N ATOM 436 CZ ARG A 32 -17.234 12.186 2.930 1.00 0.00 C ATOM 437 NH1 ARG A 32 -17.287 12.669 4.164 1.00 0.00 N ATOM 438 NH2 ARG A 32 -17.541 12.968 1.903 1.00 0.00 N ATOM 0 H ARG A 32 -13.370 11.769 2.414 1.00 0.00 H new ATOM 0 HA ARG A 32 -12.173 9.877 4.356 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -14.476 9.236 2.512 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -13.994 8.424 3.988 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -15.048 9.964 5.358 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -14.853 11.284 4.221 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -16.616 8.974 3.434 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -17.223 10.113 4.619 1.00 0.00 H new ATOM 0 HE ARG A 32 -16.840 10.585 1.761 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -17.050 12.072 4.956 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -17.565 13.638 4.321 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -17.500 12.601 0.952 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -17.818 13.936 2.064 1.00 0.00 H new ATOM 452 N THR A 33 -11.929 10.099 1.130 1.00 0.00 N ATOM 453 CA THR A 33 -11.214 9.612 -0.042 1.00 0.00 C ATOM 454 C THR A 33 -9.811 10.202 -0.115 1.00 0.00 C ATOM 455 O THR A 33 -9.577 11.330 0.318 1.00 0.00 O ATOM 456 CB THR A 33 -11.969 9.950 -1.342 1.00 0.00 C ATOM 457 OG1 THR A 33 -12.332 11.335 -1.351 1.00 0.00 O ATOM 458 CG2 THR A 33 -13.218 9.093 -1.481 1.00 0.00 C ATOM 0 H THR A 33 -12.424 10.979 0.986 1.00 0.00 H new ATOM 0 HA THR A 33 -11.145 8.529 0.058 1.00 0.00 H new ATOM 0 HB THR A 33 -11.309 9.742 -2.184 1.00 0.00 H new ATOM 0 HG1 THR A 33 -12.810 11.543 -2.181 1.00 0.00 H new ATOM 0 HG21 THR A 33 -13.734 9.350 -2.406 1.00 0.00 H new ATOM 0 HG22 THR A 33 -12.936 8.040 -1.503 1.00 0.00 H new ATOM 0 HG23 THR A 33 -13.880 9.274 -0.634 1.00 0.00 H new ATOM 466 N VAL A 34 -8.878 9.432 -0.667 1.00 0.00 N ATOM 467 CA VAL A 34 -7.497 9.879 -0.799 1.00 0.00 C ATOM 468 C VAL A 34 -6.818 9.223 -1.995 1.00 0.00 C ATOM 469 O VAL A 34 -7.260 8.181 -2.479 1.00 0.00 O ATOM 470 CB VAL A 34 -6.683 9.571 0.472 1.00 0.00 C ATOM 471 CG1 VAL A 34 -7.518 9.832 1.717 1.00 0.00 C ATOM 472 CG2 VAL A 34 -6.182 8.135 0.448 1.00 0.00 C ATOM 0 H VAL A 34 -9.054 8.495 -1.030 1.00 0.00 H new ATOM 0 HA VAL A 34 -7.528 10.958 -0.950 1.00 0.00 H new ATOM 0 HB VAL A 34 -5.818 10.233 0.498 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -6.927 9.609 2.605 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -7.823 10.878 1.738 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -8.403 9.196 1.701 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -5.609 7.934 1.353 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -7.032 7.454 0.398 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -5.546 7.986 -0.425 1.00 0.00 H new ATOM 482 N VAL A 35 -5.739 9.839 -2.469 1.00 0.00 N ATOM 483 CA VAL A 35 -4.997 9.314 -3.608 1.00 0.00 C ATOM 484 C VAL A 35 -3.769 8.534 -3.152 1.00 0.00 C ATOM 485 O VAL A 35 -2.790 9.115 -2.681 1.00 0.00 O ATOM 486 CB VAL A 35 -4.551 10.443 -4.557 1.00 0.00 C ATOM 487 CG1 VAL A 35 -3.646 9.896 -5.650 1.00 0.00 C ATOM 488 CG2 VAL A 35 -5.761 11.143 -5.156 1.00 0.00 C ATOM 0 H VAL A 35 -5.360 10.703 -2.081 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.671 8.645 -4.143 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.984 11.175 -3.982 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -3.341 10.708 -6.310 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -2.763 9.444 -5.199 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -4.185 9.143 -6.225 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -5.428 11.938 -5.824 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.357 10.423 -5.717 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -6.367 11.571 -4.357 1.00 0.00 H new ATOM 498 N LEU A 36 -3.826 7.214 -3.295 1.00 0.00 N ATOM 499 CA LEU A 36 -2.717 6.353 -2.899 1.00 0.00 C ATOM 500 C LEU A 36 -1.935 5.876 -4.118 1.00 0.00 C ATOM 501 O LEU A 36 -2.444 5.108 -4.935 1.00 0.00 O ATOM 502 CB LEU A 36 -3.238 5.150 -2.110 1.00 0.00 C ATOM 503 CG LEU A 36 -2.209 4.416 -1.249 1.00 0.00 C ATOM 504 CD1 LEU A 36 -1.712 5.316 -0.128 1.00 0.00 C ATOM 505 CD2 LEU A 36 -2.804 3.135 -0.682 1.00 0.00 C ATOM 0 H LEU A 36 -4.628 6.717 -3.682 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.046 6.934 -2.266 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -4.048 5.488 -1.464 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -3.668 4.437 -2.814 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.360 4.151 -1.879 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.981 4.777 0.474 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.247 6.205 -0.554 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -2.552 5.612 0.500 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.058 2.626 -0.072 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.671 3.377 -0.067 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -3.110 2.483 -1.500 1.00 0.00 H new ATOM 517 N THR A 37 -0.692 6.334 -4.233 1.00 0.00 N ATOM 518 CA THR A 37 0.162 5.954 -5.352 1.00 0.00 C ATOM 519 C THR A 37 1.411 5.228 -4.867 1.00 0.00 C ATOM 520 O THR A 37 2.162 5.749 -4.042 1.00 0.00 O ATOM 521 CB THR A 37 0.584 7.183 -6.179 1.00 0.00 C ATOM 522 OG1 THR A 37 -0.523 8.080 -6.323 1.00 0.00 O ATOM 523 CG2 THR A 37 1.085 6.764 -7.553 1.00 0.00 C ATOM 0 H THR A 37 -0.254 6.969 -3.565 1.00 0.00 H new ATOM 0 HA THR A 37 -0.422 5.284 -5.983 1.00 0.00 H new ATOM 0 HB THR A 37 1.394 7.687 -5.652 1.00 0.00 H new ATOM 0 HG1 THR A 37 -0.246 8.860 -6.848 1.00 0.00 H new ATOM 0 HG21 THR A 37 1.377 7.648 -8.119 1.00 0.00 H new ATOM 0 HG22 THR A 37 1.945 6.104 -7.441 1.00 0.00 H new ATOM 0 HG23 THR A 37 0.292 6.239 -8.085 1.00 0.00 H new ATOM 531 N TRP A 38 1.629 4.025 -5.385 1.00 0.00 N ATOM 532 CA TRP A 38 2.790 3.228 -5.005 1.00 0.00 C ATOM 533 C TRP A 38 3.451 2.609 -6.232 1.00 0.00 C ATOM 534 O TRP A 38 2.810 2.425 -7.267 1.00 0.00 O ATOM 535 CB TRP A 38 2.381 2.130 -4.022 1.00 0.00 C ATOM 536 CG TRP A 38 1.470 1.103 -4.624 1.00 0.00 C ATOM 537 CD1 TRP A 38 1.840 -0.036 -5.281 1.00 0.00 C ATOM 538 CD2 TRP A 38 0.039 1.123 -4.627 1.00 0.00 C ATOM 539 NE1 TRP A 38 0.725 -0.726 -5.691 1.00 0.00 N ATOM 540 CE2 TRP A 38 -0.393 -0.036 -5.302 1.00 0.00 C ATOM 541 CE3 TRP A 38 -0.921 2.005 -4.124 1.00 0.00 C ATOM 542 CZ2 TRP A 38 -1.741 -0.332 -5.485 1.00 0.00 C ATOM 543 CZ3 TRP A 38 -2.258 1.711 -4.307 1.00 0.00 C ATOM 544 CH2 TRP A 38 -2.658 0.550 -4.982 1.00 0.00 C ATOM 0 H TRP A 38 1.017 3.580 -6.069 1.00 0.00 H new ATOM 0 HA TRP A 38 3.510 3.888 -4.522 1.00 0.00 H new ATOM 0 HB2 TRP A 38 3.277 1.635 -3.647 1.00 0.00 H new ATOM 0 HB3 TRP A 38 1.886 2.586 -3.164 1.00 0.00 H new ATOM 0 HD1 TRP A 38 2.859 -0.348 -5.453 1.00 0.00 H new ATOM 0 HE1 TRP A 38 0.729 -1.609 -6.202 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -0.623 2.902 -3.601 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -2.052 -1.226 -6.005 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -3.008 2.387 -3.923 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -3.711 0.347 -5.108 1.00 0.00 H new ATOM 555 N SER A 39 4.735 2.290 -6.109 1.00 0.00 N ATOM 556 CA SER A 39 5.483 1.694 -7.210 1.00 0.00 C ATOM 557 C SER A 39 5.645 0.191 -7.007 1.00 0.00 C ATOM 558 O SER A 39 5.563 -0.323 -5.891 1.00 0.00 O ATOM 559 CB SER A 39 6.857 2.354 -7.337 1.00 0.00 C ATOM 560 OG SER A 39 6.779 3.557 -8.081 1.00 0.00 O ATOM 0 H SER A 39 5.279 2.434 -5.258 1.00 0.00 H new ATOM 0 HA SER A 39 4.922 1.860 -8.129 1.00 0.00 H new ATOM 0 HB2 SER A 39 7.257 2.562 -6.345 1.00 0.00 H new ATOM 0 HB3 SER A 39 7.550 1.667 -7.822 1.00 0.00 H new ATOM 0 HG SER A 39 7.670 3.960 -8.146 1.00 0.00 H new ATOM 566 N PRO A 40 5.879 -0.533 -8.111 1.00 0.00 N ATOM 567 CA PRO A 40 6.058 -1.988 -8.081 1.00 0.00 C ATOM 568 C PRO A 40 7.368 -2.397 -7.416 1.00 0.00 C ATOM 569 O PRO A 40 8.264 -1.581 -7.201 1.00 0.00 O ATOM 570 CB PRO A 40 6.067 -2.375 -9.562 1.00 0.00 C ATOM 571 CG PRO A 40 6.520 -1.146 -10.272 1.00 0.00 C ATOM 572 CD PRO A 40 5.989 0.013 -9.475 1.00 0.00 C ATOM 0 HA PRO A 40 5.278 -2.483 -7.502 1.00 0.00 H new ATOM 0 HB2 PRO A 40 6.741 -3.211 -9.749 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.076 -2.683 -9.897 1.00 0.00 H new ATOM 0 HG2 PRO A 40 7.608 -1.110 -10.335 1.00 0.00 H new ATOM 0 HG3 PRO A 40 6.141 -1.123 -11.294 1.00 0.00 H new ATOM 0 HD2 PRO A 40 6.663 0.869 -9.512 1.00 0.00 H new ATOM 0 HD3 PRO A 40 5.024 0.351 -9.852 1.00 0.00 H new ATOM 580 N PRO A 41 7.484 -3.691 -7.082 1.00 0.00 N ATOM 581 CA PRO A 41 8.681 -4.238 -6.438 1.00 0.00 C ATOM 582 C PRO A 41 9.881 -4.272 -7.377 1.00 0.00 C ATOM 583 O PRO A 41 9.726 -4.344 -8.596 1.00 0.00 O ATOM 584 CB PRO A 41 8.260 -5.660 -6.056 1.00 0.00 C ATOM 585 CG PRO A 41 7.178 -6.006 -7.020 1.00 0.00 C ATOM 586 CD PRO A 41 6.455 -4.720 -7.310 1.00 0.00 C ATOM 0 HA PRO A 41 9.001 -3.631 -5.591 1.00 0.00 H new ATOM 0 HB2 PRO A 41 9.096 -6.355 -6.133 1.00 0.00 H new ATOM 0 HB3 PRO A 41 7.903 -5.704 -5.027 1.00 0.00 H new ATOM 0 HG2 PRO A 41 7.591 -6.436 -7.933 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.501 -6.748 -6.597 1.00 0.00 H new ATOM 0 HD2 PRO A 41 6.079 -4.692 -8.333 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.597 -4.584 -6.651 1.00 0.00 H new ATOM 594 N SER A 42 11.079 -4.220 -6.802 1.00 0.00 N ATOM 595 CA SER A 42 12.306 -4.241 -7.589 1.00 0.00 C ATOM 596 C SER A 42 12.820 -5.668 -7.756 1.00 0.00 C ATOM 597 O SER A 42 13.201 -6.319 -6.784 1.00 0.00 O ATOM 598 CB SER A 42 13.378 -3.375 -6.925 1.00 0.00 C ATOM 599 OG SER A 42 13.047 -1.999 -7.009 1.00 0.00 O ATOM 0 H SER A 42 11.225 -4.163 -5.794 1.00 0.00 H new ATOM 0 HA SER A 42 12.082 -3.836 -8.576 1.00 0.00 H new ATOM 0 HB2 SER A 42 13.486 -3.663 -5.879 1.00 0.00 H new ATOM 0 HB3 SER A 42 14.341 -3.551 -7.405 1.00 0.00 H new ATOM 0 HG SER A 42 13.747 -1.467 -6.576 1.00 0.00 H new ATOM 605 N SER A 43 12.828 -6.146 -8.996 1.00 0.00 N ATOM 606 CA SER A 43 13.291 -7.497 -9.291 1.00 0.00 C ATOM 607 C SER A 43 14.804 -7.602 -9.121 1.00 0.00 C ATOM 608 O SER A 43 15.568 -7.017 -9.889 1.00 0.00 O ATOM 609 CB SER A 43 12.898 -7.894 -10.715 1.00 0.00 C ATOM 610 OG SER A 43 13.376 -6.951 -11.658 1.00 0.00 O ATOM 0 H SER A 43 12.519 -5.618 -9.812 1.00 0.00 H new ATOM 0 HA SER A 43 12.815 -8.179 -8.587 1.00 0.00 H new ATOM 0 HB2 SER A 43 13.302 -8.880 -10.945 1.00 0.00 H new ATOM 0 HB3 SER A 43 11.813 -7.969 -10.789 1.00 0.00 H new ATOM 0 HG SER A 43 14.282 -6.671 -11.410 1.00 0.00 H new ATOM 616 N LEU A 44 15.228 -8.351 -8.110 1.00 0.00 N ATOM 617 CA LEU A 44 16.650 -8.534 -7.837 1.00 0.00 C ATOM 618 C LEU A 44 17.194 -9.750 -8.579 1.00 0.00 C ATOM 619 O LEU A 44 18.249 -10.281 -8.230 1.00 0.00 O ATOM 620 CB LEU A 44 16.885 -8.692 -6.334 1.00 0.00 C ATOM 621 CG LEU A 44 16.262 -7.618 -5.440 1.00 0.00 C ATOM 622 CD1 LEU A 44 16.143 -8.118 -4.009 1.00 0.00 C ATOM 623 CD2 LEU A 44 17.082 -6.338 -5.494 1.00 0.00 C ATOM 0 H LEU A 44 14.608 -8.842 -7.465 1.00 0.00 H new ATOM 0 HA LEU A 44 17.180 -7.649 -8.190 1.00 0.00 H new ATOM 0 HB2 LEU A 44 16.497 -9.663 -6.026 1.00 0.00 H new ATOM 0 HB3 LEU A 44 17.960 -8.707 -6.154 1.00 0.00 H new ATOM 0 HG LEU A 44 15.261 -7.400 -5.811 1.00 0.00 H new ATOM 0 HD11 LEU A 44 15.698 -7.341 -3.388 1.00 0.00 H new ATOM 0 HD12 LEU A 44 15.513 -9.007 -3.985 1.00 0.00 H new ATOM 0 HD13 LEU A 44 17.133 -8.365 -3.626 1.00 0.00 H new ATOM 0 HD21 LEU A 44 16.624 -5.585 -4.852 1.00 0.00 H new ATOM 0 HD22 LEU A 44 18.096 -6.541 -5.149 1.00 0.00 H new ATOM 0 HD23 LEU A 44 17.114 -5.970 -6.519 1.00 0.00 H new ATOM 635 N ILE A 45 16.470 -10.184 -9.605 1.00 0.00 N ATOM 636 CA ILE A 45 16.882 -11.335 -10.398 1.00 0.00 C ATOM 637 C ILE A 45 18.291 -11.146 -10.951 1.00 0.00 C ATOM 638 O ILE A 45 18.933 -12.102 -11.383 1.00 0.00 O ATOM 639 CB ILE A 45 15.914 -11.589 -11.568 1.00 0.00 C ATOM 640 CG1 ILE A 45 14.514 -11.908 -11.039 1.00 0.00 C ATOM 641 CG2 ILE A 45 16.426 -12.724 -12.443 1.00 0.00 C ATOM 642 CD1 ILE A 45 14.443 -13.198 -10.253 1.00 0.00 C ATOM 0 H ILE A 45 15.595 -9.756 -9.907 1.00 0.00 H new ATOM 0 HA ILE A 45 16.868 -12.198 -9.732 1.00 0.00 H new ATOM 0 HB ILE A 45 15.856 -10.686 -12.175 1.00 0.00 H new ATOM 0 HG12 ILE A 45 14.179 -11.087 -10.405 1.00 0.00 H new ATOM 0 HG13 ILE A 45 13.822 -11.966 -11.879 1.00 0.00 H new ATOM 0 HG21 ILE A 45 15.731 -12.891 -13.266 1.00 0.00 H new ATOM 0 HG22 ILE A 45 17.405 -12.462 -12.843 1.00 0.00 H new ATOM 0 HG23 ILE A 45 16.509 -13.633 -11.848 1.00 0.00 H new ATOM 0 HD11 ILE A 45 13.421 -13.359 -9.910 1.00 0.00 H new ATOM 0 HD12 ILE A 45 14.747 -14.029 -10.889 1.00 0.00 H new ATOM 0 HD13 ILE A 45 15.109 -13.137 -9.393 1.00 0.00 H new ATOM 654 N ASN A 46 18.766 -9.905 -10.931 1.00 0.00 N ATOM 655 CA ASN A 46 20.100 -9.589 -11.429 1.00 0.00 C ATOM 656 C ASN A 46 20.134 -9.625 -12.954 1.00 0.00 C ATOM 657 O ASN A 46 21.183 -9.846 -13.557 1.00 0.00 O ATOM 658 CB ASN A 46 21.125 -10.573 -10.862 1.00 0.00 C ATOM 659 CG ASN A 46 20.872 -10.893 -9.401 1.00 0.00 C ATOM 660 OD1 ASN A 46 20.635 -9.998 -8.590 1.00 0.00 O ATOM 661 ND2 ASN A 46 20.923 -12.176 -9.059 1.00 0.00 N ATOM 0 H ASN A 46 18.247 -9.102 -10.575 1.00 0.00 H new ATOM 0 HA ASN A 46 20.354 -8.581 -11.101 1.00 0.00 H new ATOM 0 HB2 ASN A 46 21.100 -11.495 -11.443 1.00 0.00 H new ATOM 0 HB3 ASN A 46 22.126 -10.155 -10.972 1.00 0.00 H new ATOM 0 HD21 ASN A 46 20.762 -12.452 -8.090 1.00 0.00 H new ATOM 0 HD22 ASN A 46 21.123 -12.884 -9.765 1.00 0.00 H new ATOM 668 N GLY A 47 18.977 -9.405 -13.572 1.00 0.00 N ATOM 669 CA GLY A 47 18.896 -9.416 -15.020 1.00 0.00 C ATOM 670 C GLY A 47 18.795 -10.819 -15.585 1.00 0.00 C ATOM 671 O GLY A 47 18.581 -10.999 -16.783 1.00 0.00 O ATOM 0 H GLY A 47 18.095 -9.219 -13.095 1.00 0.00 H new ATOM 0 HA2 GLY A 47 18.028 -8.837 -15.337 1.00 0.00 H new ATOM 0 HA3 GLY A 47 19.776 -8.924 -15.434 1.00 0.00 H new ATOM 675 N GLU A 48 18.951 -11.816 -14.720 1.00 0.00 N ATOM 676 CA GLU A 48 18.878 -13.210 -15.140 1.00 0.00 C ATOM 677 C GLU A 48 17.596 -13.476 -15.924 1.00 0.00 C ATOM 678 O GLU A 48 17.483 -14.479 -16.631 1.00 0.00 O ATOM 679 CB GLU A 48 18.948 -14.138 -13.925 1.00 0.00 C ATOM 680 CG GLU A 48 19.566 -15.492 -14.228 1.00 0.00 C ATOM 681 CD GLU A 48 20.040 -16.209 -12.978 1.00 0.00 C ATOM 682 OE1 GLU A 48 20.488 -15.524 -12.036 1.00 0.00 O ATOM 683 OE2 GLU A 48 19.963 -17.455 -12.943 1.00 0.00 O ATOM 0 H GLU A 48 19.129 -11.684 -13.724 1.00 0.00 H new ATOM 0 HA GLU A 48 19.729 -13.411 -15.790 1.00 0.00 H new ATOM 0 HB2 GLU A 48 19.527 -13.652 -13.140 1.00 0.00 H new ATOM 0 HB3 GLU A 48 17.942 -14.287 -13.534 1.00 0.00 H new ATOM 0 HG2 GLU A 48 18.835 -16.114 -14.744 1.00 0.00 H new ATOM 0 HG3 GLU A 48 20.408 -15.359 -14.908 1.00 0.00 H new ATOM 690 N THR A 49 16.631 -12.571 -15.794 1.00 0.00 N ATOM 691 CA THR A 49 15.357 -12.708 -16.487 1.00 0.00 C ATOM 692 C THR A 49 15.145 -11.569 -17.477 1.00 0.00 C ATOM 693 O THR A 49 15.646 -10.461 -17.281 1.00 0.00 O ATOM 694 CB THR A 49 14.178 -12.737 -15.496 1.00 0.00 C ATOM 695 OG1 THR A 49 12.969 -13.077 -16.182 1.00 0.00 O ATOM 696 CG2 THR A 49 14.015 -11.389 -14.809 1.00 0.00 C ATOM 0 H THR A 49 16.708 -11.735 -15.215 1.00 0.00 H new ATOM 0 HA THR A 49 15.391 -13.654 -17.027 1.00 0.00 H new ATOM 0 HB THR A 49 14.389 -13.491 -14.737 1.00 0.00 H new ATOM 0 HG1 THR A 49 12.225 -13.095 -15.544 1.00 0.00 H new ATOM 0 HG21 THR A 49 13.176 -11.434 -14.114 1.00 0.00 H new ATOM 0 HG22 THR A 49 14.926 -11.146 -14.263 1.00 0.00 H new ATOM 0 HG23 THR A 49 13.825 -10.620 -15.558 1.00 0.00 H new ATOM 704 N ASP A 50 14.400 -11.847 -18.542 1.00 0.00 N ATOM 705 CA ASP A 50 14.120 -10.844 -19.563 1.00 0.00 C ATOM 706 C ASP A 50 13.343 -9.671 -18.974 1.00 0.00 C ATOM 707 O ASP A 50 12.349 -9.862 -18.274 1.00 0.00 O ATOM 708 CB ASP A 50 13.332 -11.466 -20.717 1.00 0.00 C ATOM 709 CG ASP A 50 13.667 -12.930 -20.923 1.00 0.00 C ATOM 710 OD1 ASP A 50 14.865 -13.251 -21.067 1.00 0.00 O ATOM 711 OD2 ASP A 50 12.730 -13.756 -20.940 1.00 0.00 O ATOM 0 H ASP A 50 13.979 -12.759 -18.720 1.00 0.00 H new ATOM 0 HA ASP A 50 15.072 -10.472 -19.942 1.00 0.00 H new ATOM 0 HB2 ASP A 50 12.265 -11.365 -20.521 1.00 0.00 H new ATOM 0 HB3 ASP A 50 13.541 -10.916 -21.634 1.00 0.00 H new ATOM 716 N GLU A 51 13.805 -8.458 -19.261 1.00 0.00 N ATOM 717 CA GLU A 51 13.153 -7.254 -18.758 1.00 0.00 C ATOM 718 C GLU A 51 11.636 -7.370 -18.869 1.00 0.00 C ATOM 719 O GLU A 51 10.907 -7.041 -17.933 1.00 0.00 O ATOM 720 CB GLU A 51 13.640 -6.024 -19.527 1.00 0.00 C ATOM 721 CG GLU A 51 13.725 -4.768 -18.676 1.00 0.00 C ATOM 722 CD GLU A 51 13.417 -3.509 -19.462 1.00 0.00 C ATOM 723 OE1 GLU A 51 12.220 -3.213 -19.662 1.00 0.00 O ATOM 724 OE2 GLU A 51 14.371 -2.820 -19.878 1.00 0.00 O ATOM 0 H GLU A 51 14.627 -8.283 -19.839 1.00 0.00 H new ATOM 0 HA GLU A 51 13.415 -7.142 -17.706 1.00 0.00 H new ATOM 0 HB2 GLU A 51 14.623 -6.235 -19.948 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.968 -5.840 -20.365 1.00 0.00 H new ATOM 0 HG2 GLU A 51 13.028 -4.851 -17.842 1.00 0.00 H new ATOM 0 HG3 GLU A 51 14.725 -4.690 -18.249 1.00 0.00 H new ATOM 731 N SER A 52 11.167 -7.840 -20.021 1.00 0.00 N ATOM 732 CA SER A 52 9.737 -7.995 -20.257 1.00 0.00 C ATOM 733 C SER A 52 9.261 -9.377 -19.820 1.00 0.00 C ATOM 734 O SER A 52 8.410 -9.987 -20.468 1.00 0.00 O ATOM 735 CB SER A 52 9.416 -7.778 -21.737 1.00 0.00 C ATOM 736 OG SER A 52 9.785 -6.474 -22.153 1.00 0.00 O ATOM 0 H SER A 52 11.757 -8.120 -20.805 1.00 0.00 H new ATOM 0 HA SER A 52 9.213 -7.245 -19.665 1.00 0.00 H new ATOM 0 HB2 SER A 52 9.943 -8.518 -22.339 1.00 0.00 H new ATOM 0 HB3 SER A 52 8.350 -7.929 -21.907 1.00 0.00 H new ATOM 0 HG SER A 52 9.571 -6.361 -23.103 1.00 0.00 H new ATOM 742 N SER A 53 9.816 -9.865 -18.716 1.00 0.00 N ATOM 743 CA SER A 53 9.452 -11.177 -18.192 1.00 0.00 C ATOM 744 C SER A 53 8.636 -11.043 -16.910 1.00 0.00 C ATOM 745 O SER A 53 7.553 -11.614 -16.787 1.00 0.00 O ATOM 746 CB SER A 53 10.708 -12.010 -17.927 1.00 0.00 C ATOM 747 OG SER A 53 10.380 -13.371 -17.707 1.00 0.00 O ATOM 0 H SER A 53 10.520 -9.372 -18.166 1.00 0.00 H new ATOM 0 HA SER A 53 8.841 -11.683 -18.939 1.00 0.00 H new ATOM 0 HB2 SER A 53 11.388 -11.929 -18.775 1.00 0.00 H new ATOM 0 HB3 SER A 53 11.234 -11.614 -17.058 1.00 0.00 H new ATOM 0 HG SER A 53 11.069 -13.787 -17.148 1.00 0.00 H new ATOM 753 N VAL A 54 9.166 -10.284 -15.956 1.00 0.00 N ATOM 754 CA VAL A 54 8.487 -10.073 -14.683 1.00 0.00 C ATOM 755 C VAL A 54 7.072 -9.548 -14.894 1.00 0.00 C ATOM 756 O VAL A 54 6.846 -8.568 -15.604 1.00 0.00 O ATOM 757 CB VAL A 54 9.262 -9.084 -13.791 1.00 0.00 C ATOM 758 CG1 VAL A 54 10.469 -9.763 -13.163 1.00 0.00 C ATOM 759 CG2 VAL A 54 9.685 -7.863 -14.594 1.00 0.00 C ATOM 0 H VAL A 54 10.063 -9.805 -16.040 1.00 0.00 H new ATOM 0 HA VAL A 54 8.441 -11.042 -14.185 1.00 0.00 H new ATOM 0 HB VAL A 54 8.603 -8.753 -12.988 1.00 0.00 H new ATOM 0 HG11 VAL A 54 11.003 -9.049 -12.537 1.00 0.00 H new ATOM 0 HG12 VAL A 54 10.137 -10.603 -12.553 1.00 0.00 H new ATOM 0 HG13 VAL A 54 11.133 -10.125 -13.948 1.00 0.00 H new ATOM 0 HG21 VAL A 54 10.231 -7.175 -13.949 1.00 0.00 H new ATOM 0 HG22 VAL A 54 10.327 -8.174 -15.418 1.00 0.00 H new ATOM 0 HG23 VAL A 54 8.801 -7.364 -14.991 1.00 0.00 H new ATOM 769 N PRO A 55 6.093 -10.215 -14.264 1.00 0.00 N ATOM 770 CA PRO A 55 4.682 -9.833 -14.367 1.00 0.00 C ATOM 771 C PRO A 55 4.383 -8.520 -13.651 1.00 0.00 C ATOM 772 O PRO A 55 5.160 -8.071 -12.810 1.00 0.00 O ATOM 773 CB PRO A 55 3.950 -10.992 -13.686 1.00 0.00 C ATOM 774 CG PRO A 55 4.949 -11.569 -12.744 1.00 0.00 C ATOM 775 CD PRO A 55 6.290 -11.392 -13.402 1.00 0.00 C ATOM 0 HA PRO A 55 4.379 -9.668 -15.401 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.062 -10.644 -13.158 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.618 -11.733 -14.413 1.00 0.00 H new ATOM 0 HG2 PRO A 55 4.917 -11.060 -11.781 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.743 -12.623 -12.554 1.00 0.00 H new ATOM 0 HD2 PRO A 55 7.079 -11.226 -12.668 1.00 0.00 H new ATOM 0 HD3 PRO A 55 6.573 -12.271 -13.981 1.00 0.00 H new ATOM 783 N GLU A 56 3.251 -7.911 -13.990 1.00 0.00 N ATOM 784 CA GLU A 56 2.851 -6.649 -13.379 1.00 0.00 C ATOM 785 C GLU A 56 1.434 -6.741 -12.819 1.00 0.00 C ATOM 786 O GLU A 56 0.694 -5.756 -12.807 1.00 0.00 O ATOM 787 CB GLU A 56 2.935 -5.513 -14.400 1.00 0.00 C ATOM 788 CG GLU A 56 1.846 -5.564 -15.458 1.00 0.00 C ATOM 789 CD GLU A 56 2.212 -4.789 -16.710 1.00 0.00 C ATOM 790 OE1 GLU A 56 2.941 -5.345 -17.558 1.00 0.00 O ATOM 791 OE2 GLU A 56 1.770 -3.629 -16.841 1.00 0.00 O ATOM 0 H GLU A 56 2.595 -8.271 -14.684 1.00 0.00 H new ATOM 0 HA GLU A 56 3.535 -6.440 -12.557 1.00 0.00 H new ATOM 0 HB2 GLU A 56 2.876 -4.559 -13.876 1.00 0.00 H new ATOM 0 HB3 GLU A 56 3.908 -5.547 -14.890 1.00 0.00 H new ATOM 0 HG2 GLU A 56 1.650 -6.603 -15.723 1.00 0.00 H new ATOM 0 HG3 GLU A 56 0.922 -5.161 -15.043 1.00 0.00 H new ATOM 798 N LEU A 57 1.063 -7.930 -12.357 1.00 0.00 N ATOM 799 CA LEU A 57 -0.265 -8.152 -11.796 1.00 0.00 C ATOM 800 C LEU A 57 -0.187 -8.406 -10.294 1.00 0.00 C ATOM 801 O LEU A 57 -1.079 -9.022 -9.711 1.00 0.00 O ATOM 802 CB LEU A 57 -0.942 -9.336 -12.490 1.00 0.00 C ATOM 803 CG LEU A 57 -1.201 -9.176 -13.989 1.00 0.00 C ATOM 804 CD1 LEU A 57 -1.920 -7.866 -14.270 1.00 0.00 C ATOM 805 CD2 LEU A 57 0.105 -9.248 -14.766 1.00 0.00 C ATOM 0 H LEU A 57 1.663 -8.755 -12.360 1.00 0.00 H new ATOM 0 HA LEU A 57 -0.858 -7.253 -11.963 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.324 -10.221 -12.341 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.894 -9.526 -11.995 1.00 0.00 H new ATOM 0 HG LEU A 57 -1.841 -9.995 -14.317 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.096 -7.770 -15.341 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.874 -7.855 -13.743 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.306 -7.033 -13.927 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.098 -9.132 -15.831 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.770 -8.450 -14.435 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.580 -10.213 -14.590 1.00 0.00 H new ATOM 817 N TYR A 58 0.885 -7.925 -9.674 1.00 0.00 N ATOM 818 CA TYR A 58 1.080 -8.099 -8.239 1.00 0.00 C ATOM 819 C TYR A 58 -0.098 -7.528 -7.456 1.00 0.00 C ATOM 820 O TYR A 58 -0.188 -6.320 -7.241 1.00 0.00 O ATOM 821 CB TYR A 58 2.379 -7.424 -7.794 1.00 0.00 C ATOM 822 CG TYR A 58 3.587 -7.845 -8.601 1.00 0.00 C ATOM 823 CD1 TYR A 58 3.970 -9.178 -8.671 1.00 0.00 C ATOM 824 CD2 TYR A 58 4.344 -6.908 -9.293 1.00 0.00 C ATOM 825 CE1 TYR A 58 5.074 -9.566 -9.406 1.00 0.00 C ATOM 826 CE2 TYR A 58 5.448 -7.287 -10.032 1.00 0.00 C ATOM 827 CZ TYR A 58 5.809 -8.617 -10.085 1.00 0.00 C ATOM 828 OH TYR A 58 6.908 -9.000 -10.819 1.00 0.00 O ATOM 0 H TYR A 58 1.632 -7.412 -10.142 1.00 0.00 H new ATOM 0 HA TYR A 58 1.145 -9.167 -8.034 1.00 0.00 H new ATOM 0 HB2 TYR A 58 2.261 -6.343 -7.869 1.00 0.00 H new ATOM 0 HB3 TYR A 58 2.556 -7.653 -6.743 1.00 0.00 H new ATOM 0 HD1 TYR A 58 3.395 -9.924 -8.142 1.00 0.00 H new ATOM 0 HD2 TYR A 58 4.065 -5.866 -9.253 1.00 0.00 H new ATOM 0 HE1 TYR A 58 5.360 -10.607 -9.448 1.00 0.00 H new ATOM 0 HE2 TYR A 58 6.025 -6.546 -10.565 1.00 0.00 H new ATOM 0 HH TYR A 58 6.740 -8.835 -11.770 1.00 0.00 H new ATOM 838 N GLY A 59 -0.999 -8.408 -7.030 1.00 0.00 N ATOM 839 CA GLY A 59 -2.160 -7.974 -6.274 1.00 0.00 C ATOM 840 C GLY A 59 -1.788 -7.108 -5.088 1.00 0.00 C ATOM 841 O GLY A 59 -1.245 -7.599 -4.097 1.00 0.00 O ATOM 0 H GLY A 59 -0.946 -9.413 -7.195 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -2.830 -7.418 -6.930 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.709 -8.848 -5.924 1.00 0.00 H new ATOM 845 N TYR A 60 -2.079 -5.815 -5.187 1.00 0.00 N ATOM 846 CA TYR A 60 -1.768 -4.877 -4.115 1.00 0.00 C ATOM 847 C TYR A 60 -2.968 -4.686 -3.193 1.00 0.00 C ATOM 848 O TYR A 60 -4.034 -4.250 -3.627 1.00 0.00 O ATOM 849 CB TYR A 60 -1.337 -3.530 -4.696 1.00 0.00 C ATOM 850 CG TYR A 60 -0.224 -3.638 -5.714 1.00 0.00 C ATOM 851 CD1 TYR A 60 1.054 -4.031 -5.336 1.00 0.00 C ATOM 852 CD2 TYR A 60 -0.450 -3.345 -7.054 1.00 0.00 C ATOM 853 CE1 TYR A 60 2.074 -4.131 -6.262 1.00 0.00 C ATOM 854 CE2 TYR A 60 0.564 -3.443 -7.987 1.00 0.00 C ATOM 855 CZ TYR A 60 1.824 -3.836 -7.586 1.00 0.00 C ATOM 856 OH TYR A 60 2.837 -3.933 -8.513 1.00 0.00 O ATOM 0 H TYR A 60 -2.530 -5.393 -5.999 1.00 0.00 H new ATOM 0 HA TYR A 60 -0.947 -5.292 -3.531 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -2.199 -3.052 -5.162 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -1.013 -2.880 -3.883 1.00 0.00 H new ATOM 0 HD1 TYR A 60 1.253 -4.262 -4.300 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -1.435 -3.036 -7.371 1.00 0.00 H new ATOM 0 HE1 TYR A 60 3.062 -4.438 -5.951 1.00 0.00 H new ATOM 0 HE2 TYR A 60 0.371 -3.213 -9.025 1.00 0.00 H new ATOM 0 HH TYR A 60 2.494 -3.692 -9.399 1.00 0.00 H new ATOM 866 N GLU A 61 -2.786 -5.015 -1.918 1.00 0.00 N ATOM 867 CA GLU A 61 -3.853 -4.879 -0.934 1.00 0.00 C ATOM 868 C GLU A 61 -3.556 -3.742 0.039 1.00 0.00 C ATOM 869 O GLU A 61 -2.486 -3.692 0.645 1.00 0.00 O ATOM 870 CB GLU A 61 -4.037 -6.189 -0.164 1.00 0.00 C ATOM 871 CG GLU A 61 -4.911 -6.051 1.071 1.00 0.00 C ATOM 872 CD GLU A 61 -6.392 -6.074 0.743 1.00 0.00 C ATOM 873 OE1 GLU A 61 -6.910 -5.040 0.272 1.00 0.00 O ATOM 874 OE2 GLU A 61 -7.031 -7.124 0.957 1.00 0.00 O ATOM 0 H GLU A 61 -1.910 -5.378 -1.543 1.00 0.00 H new ATOM 0 HA GLU A 61 -4.775 -4.646 -1.467 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.477 -6.933 -0.829 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -3.059 -6.566 0.134 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -4.684 -6.860 1.765 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -4.670 -5.118 1.580 1.00 0.00 H new ATOM 881 N VAL A 62 -4.511 -2.829 0.182 1.00 0.00 N ATOM 882 CA VAL A 62 -4.353 -1.692 1.081 1.00 0.00 C ATOM 883 C VAL A 62 -4.908 -2.005 2.466 1.00 0.00 C ATOM 884 O VAL A 62 -6.062 -2.411 2.607 1.00 0.00 O ATOM 885 CB VAL A 62 -5.057 -0.438 0.529 1.00 0.00 C ATOM 886 CG1 VAL A 62 -4.886 0.734 1.483 1.00 0.00 C ATOM 887 CG2 VAL A 62 -4.523 -0.093 -0.853 1.00 0.00 C ATOM 0 H VAL A 62 -5.402 -2.854 -0.313 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.284 -1.495 1.157 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.122 -0.650 0.440 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.390 1.611 1.076 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.320 0.482 2.450 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -3.825 0.950 1.607 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.031 0.795 -1.228 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -3.452 0.100 -0.791 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -4.703 -0.927 -1.531 1.00 0.00 H new ATOM 897 N LEU A 63 -4.080 -1.812 3.487 1.00 0.00 N ATOM 898 CA LEU A 63 -4.488 -2.073 4.863 1.00 0.00 C ATOM 899 C LEU A 63 -4.421 -0.801 5.701 1.00 0.00 C ATOM 900 O LEU A 63 -3.388 -0.132 5.750 1.00 0.00 O ATOM 901 CB LEU A 63 -3.599 -3.153 5.482 1.00 0.00 C ATOM 902 CG LEU A 63 -3.287 -4.357 4.593 1.00 0.00 C ATOM 903 CD1 LEU A 63 -2.081 -5.116 5.126 1.00 0.00 C ATOM 904 CD2 LEU A 63 -4.496 -5.276 4.494 1.00 0.00 C ATOM 0 H LEU A 63 -3.122 -1.476 3.388 1.00 0.00 H new ATOM 0 HA LEU A 63 -5.520 -2.423 4.850 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.657 -2.693 5.780 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -4.079 -3.513 6.392 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.050 -3.993 3.593 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -1.874 -5.970 4.481 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -1.214 -4.456 5.144 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -2.290 -5.467 6.136 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -4.255 -6.127 3.857 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.765 -5.632 5.489 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -5.335 -4.728 4.065 1.00 0.00 H new ATOM 916 N ILE A 64 -5.527 -0.474 6.360 1.00 0.00 N ATOM 917 CA ILE A 64 -5.592 0.716 7.199 1.00 0.00 C ATOM 918 C ILE A 64 -6.140 0.384 8.583 1.00 0.00 C ATOM 919 O ILE A 64 -6.977 -0.506 8.733 1.00 0.00 O ATOM 920 CB ILE A 64 -6.470 1.808 6.560 1.00 0.00 C ATOM 921 CG1 ILE A 64 -7.907 1.308 6.398 1.00 0.00 C ATOM 922 CG2 ILE A 64 -5.896 2.230 5.216 1.00 0.00 C ATOM 923 CD1 ILE A 64 -8.939 2.414 6.429 1.00 0.00 C ATOM 0 H ILE A 64 -6.390 -1.016 6.329 1.00 0.00 H new ATOM 0 HA ILE A 64 -4.573 1.090 7.295 1.00 0.00 H new ATOM 0 HB ILE A 64 -6.480 2.677 7.218 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -7.992 0.770 5.454 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -8.127 0.595 7.192 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -6.528 3.002 4.777 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -4.889 2.622 5.357 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -5.860 1.369 4.549 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -9.934 1.986 6.309 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -8.882 2.938 7.383 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -8.745 3.116 5.618 1.00 0.00 H new ATOM 935 N SER A 65 -5.664 1.107 9.591 1.00 0.00 N ATOM 936 CA SER A 65 -6.105 0.888 10.964 1.00 0.00 C ATOM 937 C SER A 65 -6.433 2.212 11.647 1.00 0.00 C ATOM 938 O SER A 65 -5.651 2.718 12.453 1.00 0.00 O ATOM 939 CB SER A 65 -5.027 0.145 11.756 1.00 0.00 C ATOM 940 OG SER A 65 -3.782 0.818 11.678 1.00 0.00 O ATOM 0 H SER A 65 -4.973 1.850 9.483 1.00 0.00 H new ATOM 0 HA SER A 65 -7.009 0.280 10.937 1.00 0.00 H new ATOM 0 HB2 SER A 65 -5.332 0.058 12.799 1.00 0.00 H new ATOM 0 HB3 SER A 65 -4.921 -0.869 11.369 1.00 0.00 H new ATOM 0 HG SER A 65 -3.194 0.347 11.051 1.00 0.00 H new ATOM 946 N SER A 66 -7.594 2.769 11.319 1.00 0.00 N ATOM 947 CA SER A 66 -8.025 4.036 11.897 1.00 0.00 C ATOM 948 C SER A 66 -7.741 4.074 13.396 1.00 0.00 C ATOM 949 O SER A 66 -7.520 5.140 13.972 1.00 0.00 O ATOM 950 CB SER A 66 -9.518 4.256 11.644 1.00 0.00 C ATOM 951 OG SER A 66 -9.731 4.959 10.432 1.00 0.00 O ATOM 0 H SER A 66 -8.253 2.362 10.656 1.00 0.00 H new ATOM 0 HA SER A 66 -7.461 4.836 11.417 1.00 0.00 H new ATOM 0 HB2 SER A 66 -10.029 3.294 11.605 1.00 0.00 H new ATOM 0 HB3 SER A 66 -9.952 4.814 12.473 1.00 0.00 H new ATOM 0 HG SER A 66 -9.667 5.923 10.597 1.00 0.00 H new ATOM 957 N THR A 67 -7.749 2.902 14.023 1.00 0.00 N ATOM 958 CA THR A 67 -7.494 2.799 15.454 1.00 0.00 C ATOM 959 C THR A 67 -6.018 3.018 15.767 1.00 0.00 C ATOM 960 O THR A 67 -5.664 3.885 16.565 1.00 0.00 O ATOM 961 CB THR A 67 -7.925 1.427 16.005 1.00 0.00 C ATOM 962 OG1 THR A 67 -9.251 1.116 15.561 1.00 0.00 O ATOM 963 CG2 THR A 67 -7.878 1.415 17.525 1.00 0.00 C ATOM 0 H THR A 67 -7.929 2.010 13.562 1.00 0.00 H new ATOM 0 HA THR A 67 -8.085 3.578 15.936 1.00 0.00 H new ATOM 0 HB THR A 67 -7.231 0.675 15.630 1.00 0.00 H new ATOM 0 HG1 THR A 67 -9.517 0.241 15.914 1.00 0.00 H new ATOM 0 HG21 THR A 67 -8.187 0.436 17.891 1.00 0.00 H new ATOM 0 HG22 THR A 67 -6.862 1.624 17.859 1.00 0.00 H new ATOM 0 HG23 THR A 67 -8.552 2.177 17.916 1.00 0.00 H new ATOM 971 N GLY A 68 -5.159 2.226 15.132 1.00 0.00 N ATOM 972 CA GLY A 68 -3.731 2.350 15.355 1.00 0.00 C ATOM 973 C GLY A 68 -2.937 1.272 14.645 1.00 0.00 C ATOM 974 O GLY A 68 -3.470 0.211 14.319 1.00 0.00 O ATOM 0 H GLY A 68 -5.427 1.501 14.467 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -3.397 3.329 15.011 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -3.528 2.301 16.425 1.00 0.00 H new ATOM 978 N LYS A 69 -1.659 1.543 14.403 1.00 0.00 N ATOM 979 CA LYS A 69 -0.789 0.588 13.726 1.00 0.00 C ATOM 980 C LYS A 69 -0.555 -0.645 14.594 1.00 0.00 C ATOM 981 O LYS A 69 0.031 -1.630 14.144 1.00 0.00 O ATOM 982 CB LYS A 69 0.551 1.243 13.381 1.00 0.00 C ATOM 983 CG LYS A 69 1.257 1.851 14.580 1.00 0.00 C ATOM 984 CD LYS A 69 2.767 1.816 14.415 1.00 0.00 C ATOM 985 CE LYS A 69 3.271 3.021 13.634 1.00 0.00 C ATOM 986 NZ LYS A 69 4.714 3.283 13.889 1.00 0.00 N ATOM 0 H LYS A 69 -1.202 2.416 14.666 1.00 0.00 H new ATOM 0 HA LYS A 69 -1.282 0.275 12.805 1.00 0.00 H new ATOM 0 HB2 LYS A 69 1.203 0.498 12.925 1.00 0.00 H new ATOM 0 HB3 LYS A 69 0.385 2.020 12.635 1.00 0.00 H new ATOM 0 HG2 LYS A 69 0.928 2.882 14.713 1.00 0.00 H new ATOM 0 HG3 LYS A 69 0.976 1.308 15.483 1.00 0.00 H new ATOM 0 HD2 LYS A 69 3.241 1.793 15.396 1.00 0.00 H new ATOM 0 HD3 LYS A 69 3.057 0.900 13.900 1.00 0.00 H new ATOM 0 HE2 LYS A 69 3.115 2.854 12.568 1.00 0.00 H new ATOM 0 HE3 LYS A 69 2.688 3.901 13.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 5.019 4.111 13.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 4.860 3.467 14.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 5.273 2.454 13.604 1.00 0.00 H new ATOM 1000 N ASP A 70 -1.017 -0.583 15.837 1.00 0.00 N ATOM 1001 CA ASP A 70 -0.861 -1.696 16.767 1.00 0.00 C ATOM 1002 C ASP A 70 -2.211 -2.332 17.085 1.00 0.00 C ATOM 1003 O ASP A 70 -2.462 -2.745 18.217 1.00 0.00 O ATOM 1004 CB ASP A 70 -0.190 -1.221 18.057 1.00 0.00 C ATOM 1005 CG ASP A 70 1.180 -0.622 17.810 1.00 0.00 C ATOM 1006 OD1 ASP A 70 2.041 -1.325 17.242 1.00 0.00 O ATOM 1007 OD2 ASP A 70 1.392 0.550 18.185 1.00 0.00 O ATOM 0 H ASP A 70 -1.503 0.226 16.225 1.00 0.00 H new ATOM 0 HA ASP A 70 -0.229 -2.447 16.293 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.825 -0.480 18.542 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -0.097 -2.061 18.746 1.00 0.00 H new ATOM 1012 N GLY A 71 -3.076 -2.407 16.079 1.00 0.00 N ATOM 1013 CA GLY A 71 -4.390 -2.992 16.272 1.00 0.00 C ATOM 1014 C GLY A 71 -4.718 -4.039 15.226 1.00 0.00 C ATOM 1015 O GLY A 71 -3.933 -4.959 14.990 1.00 0.00 O ATOM 0 H GLY A 71 -2.890 -2.073 15.133 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -4.441 -3.444 17.263 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -5.143 -2.204 16.242 1.00 0.00 H new ATOM 1019 N LYS A 72 -5.881 -3.903 14.599 1.00 0.00 N ATOM 1020 CA LYS A 72 -6.312 -4.844 13.572 1.00 0.00 C ATOM 1021 C LYS A 72 -6.426 -4.156 12.216 1.00 0.00 C ATOM 1022 O LYS A 72 -7.101 -3.135 12.082 1.00 0.00 O ATOM 1023 CB LYS A 72 -7.657 -5.467 13.955 1.00 0.00 C ATOM 1024 CG LYS A 72 -8.023 -6.683 13.122 1.00 0.00 C ATOM 1025 CD LYS A 72 -8.790 -6.292 11.870 1.00 0.00 C ATOM 1026 CE LYS A 72 -9.683 -7.424 11.387 1.00 0.00 C ATOM 1027 NZ LYS A 72 -10.731 -7.769 12.387 1.00 0.00 N ATOM 0 H LYS A 72 -6.543 -3.149 14.784 1.00 0.00 H new ATOM 0 HA LYS A 72 -5.561 -5.631 13.498 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.629 -5.752 15.007 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -8.439 -4.716 13.849 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -7.116 -7.219 12.842 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -8.625 -7.367 13.720 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -9.397 -5.410 12.075 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -8.088 -6.020 11.082 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -10.157 -7.137 10.448 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -9.074 -8.304 11.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -11.569 -8.141 11.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -10.364 -8.490 13.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -10.993 -6.917 12.923 1.00 0.00 H new ATOM 1041 N TYR A 73 -5.764 -4.722 11.213 1.00 0.00 N ATOM 1042 CA TYR A 73 -5.790 -4.162 9.867 1.00 0.00 C ATOM 1043 C TYR A 73 -6.831 -4.868 9.004 1.00 0.00 C ATOM 1044 O TYR A 73 -7.034 -6.077 9.118 1.00 0.00 O ATOM 1045 CB TYR A 73 -4.410 -4.276 9.217 1.00 0.00 C ATOM 1046 CG TYR A 73 -3.503 -3.104 9.514 1.00 0.00 C ATOM 1047 CD1 TYR A 73 -2.713 -3.084 10.658 1.00 0.00 C ATOM 1048 CD2 TYR A 73 -3.435 -2.016 8.653 1.00 0.00 C ATOM 1049 CE1 TYR A 73 -1.883 -2.015 10.934 1.00 0.00 C ATOM 1050 CE2 TYR A 73 -2.606 -0.944 8.920 1.00 0.00 C ATOM 1051 CZ TYR A 73 -1.832 -0.947 10.062 1.00 0.00 C ATOM 1052 OH TYR A 73 -1.007 0.120 10.332 1.00 0.00 O ATOM 0 H TYR A 73 -5.203 -5.568 11.307 1.00 0.00 H new ATOM 0 HA TYR A 73 -6.061 -3.109 9.944 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -3.930 -5.192 9.561 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -4.532 -4.366 8.138 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -2.749 -3.919 11.343 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -4.041 -2.008 7.759 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -1.277 -2.015 11.828 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -2.564 -0.108 8.238 1.00 0.00 H new ATOM 0 HH TYR A 73 -0.465 0.323 9.541 1.00 0.00 H new ATOM 1062 N LYS A 74 -7.489 -4.104 8.138 1.00 0.00 N ATOM 1063 CA LYS A 74 -8.508 -4.654 7.253 1.00 0.00 C ATOM 1064 C LYS A 74 -8.208 -4.310 5.797 1.00 0.00 C ATOM 1065 O LYS A 74 -7.263 -3.576 5.506 1.00 0.00 O ATOM 1066 CB LYS A 74 -9.890 -4.121 7.639 1.00 0.00 C ATOM 1067 CG LYS A 74 -10.189 -2.741 7.077 1.00 0.00 C ATOM 1068 CD LYS A 74 -11.551 -2.239 7.526 1.00 0.00 C ATOM 1069 CE LYS A 74 -11.595 -0.720 7.578 1.00 0.00 C ATOM 1070 NZ LYS A 74 -10.804 -0.181 8.719 1.00 0.00 N ATOM 0 H LYS A 74 -7.334 -3.102 8.031 1.00 0.00 H new ATOM 0 HA LYS A 74 -8.500 -5.739 7.361 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -10.650 -4.819 7.289 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -9.966 -4.086 8.726 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -9.418 -2.041 7.399 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -10.154 -2.775 5.988 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -12.318 -2.603 6.842 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -11.783 -2.645 8.511 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -11.208 -0.313 6.644 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -12.630 -0.389 7.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -11.093 0.800 8.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -10.974 -0.762 9.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -9.792 -0.203 8.481 1.00 0.00 H new ATOM 1084 N SER A 75 -9.017 -4.843 4.888 1.00 0.00 N ATOM 1085 CA SER A 75 -8.836 -4.594 3.463 1.00 0.00 C ATOM 1086 C SER A 75 -9.862 -3.587 2.952 1.00 0.00 C ATOM 1087 O SER A 75 -11.061 -3.727 3.196 1.00 0.00 O ATOM 1088 CB SER A 75 -8.952 -5.901 2.676 1.00 0.00 C ATOM 1089 OG SER A 75 -10.296 -6.349 2.627 1.00 0.00 O ATOM 0 H SER A 75 -9.805 -5.451 5.113 1.00 0.00 H new ATOM 0 HA SER A 75 -7.840 -4.177 3.317 1.00 0.00 H new ATOM 0 HB2 SER A 75 -8.577 -5.754 1.663 1.00 0.00 H new ATOM 0 HB3 SER A 75 -8.327 -6.665 3.139 1.00 0.00 H new ATOM 0 HG SER A 75 -10.896 -5.608 2.852 1.00 0.00 H new ATOM 1095 N VAL A 76 -9.383 -2.571 2.242 1.00 0.00 N ATOM 1096 CA VAL A 76 -10.257 -1.540 1.696 1.00 0.00 C ATOM 1097 C VAL A 76 -10.328 -1.629 0.175 1.00 0.00 C ATOM 1098 O VAL A 76 -11.318 -1.225 -0.435 1.00 0.00 O ATOM 1099 CB VAL A 76 -9.781 -0.131 2.095 1.00 0.00 C ATOM 1100 CG1 VAL A 76 -9.834 0.043 3.605 1.00 0.00 C ATOM 1101 CG2 VAL A 76 -8.376 0.125 1.570 1.00 0.00 C ATOM 0 H VAL A 76 -8.394 -2.440 2.031 1.00 0.00 H new ATOM 0 HA VAL A 76 -11.249 -1.712 2.114 1.00 0.00 H new ATOM 0 HB VAL A 76 -10.452 0.601 1.645 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -9.494 1.045 3.868 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -10.858 -0.095 3.951 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -9.188 -0.696 4.079 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -8.055 1.125 1.861 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -7.691 -0.612 1.989 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -8.374 0.045 0.483 1.00 0.00 H new ATOM 1111 N TYR A 77 -9.272 -2.162 -0.430 1.00 0.00 N ATOM 1112 CA TYR A 77 -9.213 -2.303 -1.880 1.00 0.00 C ATOM 1113 C TYR A 77 -8.203 -3.372 -2.283 1.00 0.00 C ATOM 1114 O TYR A 77 -7.195 -3.577 -1.606 1.00 0.00 O ATOM 1115 CB TYR A 77 -8.846 -0.967 -2.529 1.00 0.00 C ATOM 1116 CG TYR A 77 -8.484 -1.084 -3.992 1.00 0.00 C ATOM 1117 CD1 TYR A 77 -7.246 -1.578 -4.385 1.00 0.00 C ATOM 1118 CD2 TYR A 77 -9.381 -0.702 -4.982 1.00 0.00 C ATOM 1119 CE1 TYR A 77 -6.911 -1.685 -5.721 1.00 0.00 C ATOM 1120 CE2 TYR A 77 -9.055 -0.807 -6.321 1.00 0.00 C ATOM 1121 CZ TYR A 77 -7.819 -1.299 -6.685 1.00 0.00 C ATOM 1122 OH TYR A 77 -7.490 -1.406 -8.017 1.00 0.00 O ATOM 0 H TYR A 77 -8.446 -2.503 0.061 1.00 0.00 H new ATOM 0 HA TYR A 77 -10.198 -2.610 -2.230 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -9.685 -0.279 -2.425 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.006 -0.529 -1.989 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -6.533 -1.884 -3.633 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -10.350 -0.316 -4.700 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -5.943 -2.069 -6.009 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -9.764 -0.506 -7.078 1.00 0.00 H new ATOM 0 HH TYR A 77 -8.240 -1.093 -8.565 1.00 0.00 H new ATOM 1132 N VAL A 78 -8.479 -4.051 -3.392 1.00 0.00 N ATOM 1133 CA VAL A 78 -7.595 -5.098 -3.888 1.00 0.00 C ATOM 1134 C VAL A 78 -7.613 -5.158 -5.411 1.00 0.00 C ATOM 1135 O VAL A 78 -8.604 -5.567 -6.015 1.00 0.00 O ATOM 1136 CB VAL A 78 -7.988 -6.478 -3.327 1.00 0.00 C ATOM 1137 CG1 VAL A 78 -7.097 -7.565 -3.908 1.00 0.00 C ATOM 1138 CG2 VAL A 78 -7.917 -6.474 -1.807 1.00 0.00 C ATOM 0 H VAL A 78 -9.309 -3.894 -3.964 1.00 0.00 H new ATOM 0 HA VAL A 78 -6.590 -4.849 -3.549 1.00 0.00 H new ATOM 0 HB VAL A 78 -9.016 -6.691 -3.620 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -7.390 -8.532 -3.500 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -7.203 -7.582 -4.993 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -6.058 -7.361 -3.648 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -8.198 -7.456 -1.427 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -6.901 -6.239 -1.491 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -8.602 -5.723 -1.413 1.00 0.00 H new ATOM 1148 N GLY A 79 -6.510 -4.746 -6.028 1.00 0.00 N ATOM 1149 CA GLY A 79 -6.420 -4.760 -7.476 1.00 0.00 C ATOM 1150 C GLY A 79 -4.990 -4.869 -7.967 1.00 0.00 C ATOM 1151 O GLY A 79 -4.069 -5.070 -7.176 1.00 0.00 O ATOM 0 H GLY A 79 -5.677 -4.403 -5.550 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -6.999 -5.597 -7.865 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.869 -3.850 -7.874 1.00 0.00 H new ATOM 1155 N GLU A 80 -4.803 -4.737 -9.277 1.00 0.00 N ATOM 1156 CA GLU A 80 -3.475 -4.824 -9.871 1.00 0.00 C ATOM 1157 C GLU A 80 -2.878 -3.434 -10.077 1.00 0.00 C ATOM 1158 O GLU A 80 -1.672 -3.239 -9.936 1.00 0.00 O ATOM 1159 CB GLU A 80 -3.537 -5.567 -11.207 1.00 0.00 C ATOM 1160 CG GLU A 80 -3.967 -7.018 -11.077 1.00 0.00 C ATOM 1161 CD GLU A 80 -5.468 -7.171 -10.923 1.00 0.00 C ATOM 1162 OE1 GLU A 80 -6.208 -6.660 -11.791 1.00 0.00 O ATOM 1163 OE2 GLU A 80 -5.904 -7.800 -9.937 1.00 0.00 O ATOM 0 H GLU A 80 -5.554 -4.570 -9.946 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.834 -5.378 -9.185 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.231 -5.049 -11.869 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -2.556 -5.529 -11.680 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -3.638 -7.571 -11.957 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -3.470 -7.464 -10.216 1.00 0.00 H new ATOM 1170 N GLU A 81 -3.734 -2.473 -10.412 1.00 0.00 N ATOM 1171 CA GLU A 81 -3.291 -1.102 -10.638 1.00 0.00 C ATOM 1172 C GLU A 81 -2.370 -0.636 -9.515 1.00 0.00 C ATOM 1173 O GLU A 81 -2.461 -1.111 -8.383 1.00 0.00 O ATOM 1174 CB GLU A 81 -4.496 -0.165 -10.747 1.00 0.00 C ATOM 1175 CG GLU A 81 -5.061 -0.061 -12.154 1.00 0.00 C ATOM 1176 CD GLU A 81 -5.737 -1.340 -12.608 1.00 0.00 C ATOM 1177 OE1 GLU A 81 -6.157 -2.130 -11.737 1.00 0.00 O ATOM 1178 OE2 GLU A 81 -5.847 -1.549 -13.834 1.00 0.00 O ATOM 0 H GLU A 81 -4.736 -2.618 -10.533 1.00 0.00 H new ATOM 0 HA GLU A 81 -2.734 -1.077 -11.575 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -5.280 -0.515 -10.075 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -4.205 0.829 -10.407 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -5.779 0.758 -12.193 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -4.257 0.186 -12.847 1.00 0.00 H new ATOM 1185 N THR A 82 -1.481 0.299 -9.837 1.00 0.00 N ATOM 1186 CA THR A 82 -0.541 0.829 -8.857 1.00 0.00 C ATOM 1187 C THR A 82 -1.111 2.058 -8.158 1.00 0.00 C ATOM 1188 O THR A 82 -0.680 2.415 -7.062 1.00 0.00 O ATOM 1189 CB THR A 82 0.802 1.203 -9.512 1.00 0.00 C ATOM 1190 OG1 THR A 82 0.571 1.959 -10.706 1.00 0.00 O ATOM 1191 CG2 THR A 82 1.608 -0.044 -9.844 1.00 0.00 C ATOM 0 H THR A 82 -1.393 0.705 -10.769 1.00 0.00 H new ATOM 0 HA THR A 82 -0.372 0.041 -8.123 1.00 0.00 H new ATOM 0 HB THR A 82 1.370 1.806 -8.804 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.430 2.194 -11.115 1.00 0.00 H new ATOM 0 HG21 THR A 82 2.552 0.245 -10.306 1.00 0.00 H new ATOM 0 HG22 THR A 82 1.807 -0.603 -8.929 1.00 0.00 H new ATOM 0 HG23 THR A 82 1.043 -0.669 -10.535 1.00 0.00 H new ATOM 1199 N ASN A 83 -2.084 2.699 -8.797 1.00 0.00 N ATOM 1200 CA ASN A 83 -2.713 3.889 -8.235 1.00 0.00 C ATOM 1201 C ASN A 83 -4.201 3.654 -7.994 1.00 0.00 C ATOM 1202 O ASN A 83 -4.918 3.188 -8.880 1.00 0.00 O ATOM 1203 CB ASN A 83 -2.519 5.084 -9.170 1.00 0.00 C ATOM 1204 CG ASN A 83 -3.656 6.083 -9.074 1.00 0.00 C ATOM 1205 OD1 ASN A 83 -4.410 6.276 -10.028 1.00 0.00 O ATOM 1206 ND2 ASN A 83 -3.784 6.725 -7.919 1.00 0.00 N ATOM 0 H ASN A 83 -2.454 2.415 -9.704 1.00 0.00 H new ATOM 0 HA ASN A 83 -2.237 4.104 -7.278 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -1.580 5.582 -8.929 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -2.437 4.729 -10.197 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -4.530 7.410 -7.796 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -3.136 6.534 -7.155 1.00 0.00 H new ATOM 1213 N ILE A 84 -4.659 3.980 -6.790 1.00 0.00 N ATOM 1214 CA ILE A 84 -6.061 3.806 -6.433 1.00 0.00 C ATOM 1215 C ILE A 84 -6.496 4.834 -5.394 1.00 0.00 C ATOM 1216 O ILE A 84 -5.664 5.495 -4.772 1.00 0.00 O ATOM 1217 CB ILE A 84 -6.332 2.393 -5.885 1.00 0.00 C ATOM 1218 CG1 ILE A 84 -5.857 2.286 -4.434 1.00 0.00 C ATOM 1219 CG2 ILE A 84 -5.645 1.348 -6.751 1.00 0.00 C ATOM 1220 CD1 ILE A 84 -6.923 2.645 -3.422 1.00 0.00 C ATOM 0 H ILE A 84 -4.079 4.366 -6.045 1.00 0.00 H new ATOM 0 HA ILE A 84 -6.638 3.949 -7.346 1.00 0.00 H new ATOM 0 HB ILE A 84 -7.406 2.209 -5.911 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.517 1.268 -4.246 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -4.997 2.941 -4.292 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -5.846 0.354 -6.351 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -6.026 1.412 -7.770 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -4.570 1.527 -6.754 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -6.517 2.547 -2.415 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -7.247 3.673 -3.584 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -7.774 1.974 -3.537 1.00 0.00 H new ATOM 1232 N THR A 85 -7.806 4.964 -5.210 1.00 0.00 N ATOM 1233 CA THR A 85 -8.352 5.911 -4.246 1.00 0.00 C ATOM 1234 C THR A 85 -9.082 5.189 -3.119 1.00 0.00 C ATOM 1235 O THR A 85 -9.853 4.259 -3.360 1.00 0.00 O ATOM 1236 CB THR A 85 -9.322 6.901 -4.918 1.00 0.00 C ATOM 1237 OG1 THR A 85 -8.598 7.784 -5.783 1.00 0.00 O ATOM 1238 CG2 THR A 85 -10.077 7.711 -3.876 1.00 0.00 C ATOM 0 H THR A 85 -8.509 4.425 -5.716 1.00 0.00 H new ATOM 0 HA THR A 85 -7.508 6.464 -3.834 1.00 0.00 H new ATOM 0 HB THR A 85 -10.043 6.329 -5.502 1.00 0.00 H new ATOM 0 HG1 THR A 85 -9.221 8.409 -6.208 1.00 0.00 H new ATOM 0 HG21 THR A 85 -10.756 8.403 -4.375 1.00 0.00 H new ATOM 0 HG22 THR A 85 -10.649 7.039 -3.237 1.00 0.00 H new ATOM 0 HG23 THR A 85 -9.368 8.273 -3.268 1.00 0.00 H new ATOM 1246 N LEU A 86 -8.836 5.622 -1.888 1.00 0.00 N ATOM 1247 CA LEU A 86 -9.471 5.017 -0.722 1.00 0.00 C ATOM 1248 C LEU A 86 -10.895 5.534 -0.548 1.00 0.00 C ATOM 1249 O LEU A 86 -11.236 6.614 -1.027 1.00 0.00 O ATOM 1250 CB LEU A 86 -8.653 5.309 0.538 1.00 0.00 C ATOM 1251 CG LEU A 86 -7.278 4.644 0.614 1.00 0.00 C ATOM 1252 CD1 LEU A 86 -7.408 3.201 1.077 1.00 0.00 C ATOM 1253 CD2 LEU A 86 -6.577 4.712 -0.734 1.00 0.00 C ATOM 0 H LEU A 86 -8.201 6.390 -1.671 1.00 0.00 H new ATOM 0 HA LEU A 86 -9.512 3.939 -0.880 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -8.518 6.388 0.617 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -9.234 4.996 1.405 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.674 5.185 1.342 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.420 2.744 1.125 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -7.868 3.176 2.065 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.030 2.648 0.373 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.600 4.234 -0.661 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -7.178 4.196 -1.483 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -6.450 5.754 -1.026 1.00 0.00 H new ATOM 1265 N ASN A 87 -11.722 4.755 0.142 1.00 0.00 N ATOM 1266 CA ASN A 87 -13.109 5.135 0.381 1.00 0.00 C ATOM 1267 C ASN A 87 -13.623 4.529 1.684 1.00 0.00 C ATOM 1268 O ASN A 87 -13.039 3.583 2.213 1.00 0.00 O ATOM 1269 CB ASN A 87 -13.991 4.686 -0.786 1.00 0.00 C ATOM 1270 CG ASN A 87 -13.917 5.636 -1.966 1.00 0.00 C ATOM 1271 OD1 ASN A 87 -14.756 6.524 -2.115 1.00 0.00 O ATOM 1272 ND2 ASN A 87 -12.909 5.452 -2.811 1.00 0.00 N ATOM 0 H ASN A 87 -11.455 3.857 0.545 1.00 0.00 H new ATOM 0 HA ASN A 87 -13.153 6.221 0.464 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -13.686 3.690 -1.106 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -15.025 4.610 -0.448 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -12.807 6.060 -3.623 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -12.237 4.702 -2.647 1.00 0.00 H new ATOM 1279 N ASP A 88 -14.718 5.080 2.195 1.00 0.00 N ATOM 1280 CA ASP A 88 -15.312 4.594 3.434 1.00 0.00 C ATOM 1281 C ASP A 88 -14.383 4.847 4.618 1.00 0.00 C ATOM 1282 O ASP A 88 -14.333 4.057 5.561 1.00 0.00 O ATOM 1283 CB ASP A 88 -15.623 3.100 3.324 1.00 0.00 C ATOM 1284 CG ASP A 88 -16.327 2.749 2.028 1.00 0.00 C ATOM 1285 OD1 ASP A 88 -17.380 3.357 1.741 1.00 0.00 O ATOM 1286 OD2 ASP A 88 -15.824 1.868 1.300 1.00 0.00 O ATOM 0 H ASP A 88 -15.213 5.864 1.770 1.00 0.00 H new ATOM 0 HA ASP A 88 -16.241 5.139 3.601 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -14.695 2.533 3.395 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -16.246 2.799 4.166 1.00 0.00 H new ATOM 1291 N LEU A 89 -13.649 5.952 4.561 1.00 0.00 N ATOM 1292 CA LEU A 89 -12.720 6.309 5.627 1.00 0.00 C ATOM 1293 C LEU A 89 -13.334 7.349 6.559 1.00 0.00 C ATOM 1294 O LEU A 89 -14.339 7.979 6.227 1.00 0.00 O ATOM 1295 CB LEU A 89 -11.415 6.845 5.036 1.00 0.00 C ATOM 1296 CG LEU A 89 -10.697 5.923 4.049 1.00 0.00 C ATOM 1297 CD1 LEU A 89 -9.391 6.551 3.586 1.00 0.00 C ATOM 1298 CD2 LEU A 89 -10.442 4.562 4.680 1.00 0.00 C ATOM 0 H LEU A 89 -13.679 6.617 3.788 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.507 5.410 6.205 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -11.628 7.788 4.533 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -10.733 7.068 5.856 1.00 0.00 H new ATOM 0 HG LEU A 89 -11.338 5.783 3.179 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -8.894 5.881 2.884 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -9.598 7.502 3.095 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -8.744 6.721 4.446 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -9.931 3.919 3.964 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -9.821 4.683 5.567 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -11.392 4.108 4.962 1.00 0.00 H new ATOM 1310 N LYS A 90 -12.722 7.527 7.724 1.00 0.00 N ATOM 1311 CA LYS A 90 -13.206 8.494 8.703 1.00 0.00 C ATOM 1312 C LYS A 90 -12.470 9.823 8.564 1.00 0.00 C ATOM 1313 O LYS A 90 -11.245 9.895 8.661 1.00 0.00 O ATOM 1314 CB LYS A 90 -13.028 7.946 10.121 1.00 0.00 C ATOM 1315 CG LYS A 90 -14.057 8.470 11.108 1.00 0.00 C ATOM 1316 CD LYS A 90 -14.352 7.453 12.198 1.00 0.00 C ATOM 1317 CE LYS A 90 -15.442 6.481 11.773 1.00 0.00 C ATOM 1318 NZ LYS A 90 -16.803 7.017 12.052 1.00 0.00 N ATOM 0 H LYS A 90 -11.889 7.014 8.014 1.00 0.00 H new ATOM 0 HA LYS A 90 -14.266 8.665 8.516 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -13.086 6.858 10.091 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -12.031 8.202 10.478 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -13.693 9.393 11.559 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -14.978 8.715 10.579 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -13.443 6.900 12.437 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -14.659 7.971 13.107 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -15.346 6.271 10.708 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -15.310 5.535 12.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -17.518 6.325 11.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -16.904 7.194 13.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -16.939 7.907 11.531 1.00 0.00 H new ATOM 1332 N PRO A 91 -13.234 10.901 8.334 1.00 0.00 N ATOM 1333 CA PRO A 91 -12.676 12.248 8.179 1.00 0.00 C ATOM 1334 C PRO A 91 -12.121 12.799 9.488 1.00 0.00 C ATOM 1335 O PRO A 91 -12.598 12.456 10.569 1.00 0.00 O ATOM 1336 CB PRO A 91 -13.876 13.078 7.716 1.00 0.00 C ATOM 1337 CG PRO A 91 -15.065 12.348 8.236 1.00 0.00 C ATOM 1338 CD PRO A 91 -14.701 10.889 8.208 1.00 0.00 C ATOM 0 HA PRO A 91 -11.836 12.264 7.485 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -13.831 14.093 8.111 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -13.905 13.159 6.629 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -15.308 12.670 9.249 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -15.943 12.543 7.620 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -15.170 10.342 9.026 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -15.021 10.413 7.281 1.00 0.00 H new ATOM 1346 N ALA A 92 -11.110 13.656 9.383 1.00 0.00 N ATOM 1347 CA ALA A 92 -10.492 14.257 10.558 1.00 0.00 C ATOM 1348 C ALA A 92 -9.840 13.195 11.439 1.00 0.00 C ATOM 1349 O ALA A 92 -10.028 13.184 12.655 1.00 0.00 O ATOM 1350 CB ALA A 92 -11.523 15.044 11.353 1.00 0.00 C ATOM 0 H ALA A 92 -10.702 13.949 8.495 1.00 0.00 H new ATOM 0 HA ALA A 92 -9.713 14.940 10.219 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -11.047 15.487 12.228 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -11.940 15.833 10.727 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -12.322 14.376 11.674 1.00 0.00 H new ATOM 1356 N MET A 93 -9.075 12.305 10.816 1.00 0.00 N ATOM 1357 CA MET A 93 -8.395 11.240 11.544 1.00 0.00 C ATOM 1358 C MET A 93 -7.016 10.970 10.950 1.00 0.00 C ATOM 1359 O MET A 93 -6.741 11.332 9.805 1.00 0.00 O ATOM 1360 CB MET A 93 -9.233 9.961 11.519 1.00 0.00 C ATOM 1361 CG MET A 93 -9.055 9.094 12.755 1.00 0.00 C ATOM 1362 SD MET A 93 -9.264 7.337 12.407 1.00 0.00 S ATOM 1363 CE MET A 93 -11.003 7.122 12.782 1.00 0.00 C ATOM 0 H MET A 93 -8.910 12.300 9.809 1.00 0.00 H new ATOM 0 HA MET A 93 -8.269 11.563 12.577 1.00 0.00 H new ATOM 0 HB2 MET A 93 -10.285 10.228 11.421 1.00 0.00 H new ATOM 0 HB3 MET A 93 -8.968 9.380 10.636 1.00 0.00 H new ATOM 0 HG2 MET A 93 -8.062 9.262 13.172 1.00 0.00 H new ATOM 0 HG3 MET A 93 -9.775 9.398 13.514 1.00 0.00 H new ATOM 0 HE1 MET A 93 -11.439 6.403 12.088 1.00 0.00 H new ATOM 0 HE2 MET A 93 -11.112 6.754 13.802 1.00 0.00 H new ATOM 0 HE3 MET A 93 -11.517 8.078 12.684 1.00 0.00 H new ATOM 1373 N ASP A 94 -6.154 10.333 11.734 1.00 0.00 N ATOM 1374 CA ASP A 94 -4.804 10.013 11.285 1.00 0.00 C ATOM 1375 C ASP A 94 -4.480 8.544 11.536 1.00 0.00 C ATOM 1376 O ASP A 94 -4.542 8.070 12.671 1.00 0.00 O ATOM 1377 CB ASP A 94 -3.783 10.902 11.997 1.00 0.00 C ATOM 1378 CG ASP A 94 -2.441 10.924 11.291 1.00 0.00 C ATOM 1379 OD1 ASP A 94 -2.329 10.306 10.210 1.00 0.00 O ATOM 1380 OD2 ASP A 94 -1.504 11.558 11.817 1.00 0.00 O ATOM 0 H ASP A 94 -6.366 10.028 12.684 1.00 0.00 H new ATOM 0 HA ASP A 94 -4.752 10.199 10.212 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -4.173 11.918 12.062 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -3.647 10.547 13.019 1.00 0.00 H new ATOM 1385 N TYR A 95 -4.137 7.828 10.471 1.00 0.00 N ATOM 1386 CA TYR A 95 -3.808 6.412 10.576 1.00 0.00 C ATOM 1387 C TYR A 95 -2.764 6.017 9.536 1.00 0.00 C ATOM 1388 O TYR A 95 -2.499 6.761 8.591 1.00 0.00 O ATOM 1389 CB TYR A 95 -5.066 5.560 10.401 1.00 0.00 C ATOM 1390 CG TYR A 95 -6.025 6.101 9.364 1.00 0.00 C ATOM 1391 CD1 TYR A 95 -7.021 7.004 9.714 1.00 0.00 C ATOM 1392 CD2 TYR A 95 -5.933 5.710 8.034 1.00 0.00 C ATOM 1393 CE1 TYR A 95 -7.899 7.500 8.770 1.00 0.00 C ATOM 1394 CE2 TYR A 95 -6.806 6.202 7.083 1.00 0.00 C ATOM 1395 CZ TYR A 95 -7.787 7.097 7.456 1.00 0.00 C ATOM 1396 OH TYR A 95 -8.659 7.590 6.512 1.00 0.00 O ATOM 0 H TYR A 95 -4.080 8.205 9.525 1.00 0.00 H new ATOM 0 HA TYR A 95 -3.392 6.234 11.568 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -4.773 4.548 10.120 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -5.582 5.488 11.358 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -7.110 7.324 10.742 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -5.166 5.009 7.739 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -8.669 8.200 9.059 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -6.721 5.888 6.053 1.00 0.00 H new ATOM 0 HH TYR A 95 -9.125 8.372 6.874 1.00 0.00 H new ATOM 1406 N HIS A 96 -2.175 4.839 9.716 1.00 0.00 N ATOM 1407 CA HIS A 96 -1.161 4.342 8.793 1.00 0.00 C ATOM 1408 C HIS A 96 -1.797 3.520 7.677 1.00 0.00 C ATOM 1409 O HIS A 96 -2.946 3.093 7.785 1.00 0.00 O ATOM 1410 CB HIS A 96 -0.131 3.496 9.541 1.00 0.00 C ATOM 1411 CG HIS A 96 0.388 4.146 10.787 1.00 0.00 C ATOM 1412 ND1 HIS A 96 -0.296 4.131 11.984 1.00 0.00 N ATOM 1413 CD2 HIS A 96 1.532 4.832 11.017 1.00 0.00 C ATOM 1414 CE1 HIS A 96 0.404 4.781 12.897 1.00 0.00 C ATOM 1415 NE2 HIS A 96 1.518 5.216 12.336 1.00 0.00 N ATOM 0 H HIS A 96 -2.382 4.211 10.492 1.00 0.00 H new ATOM 0 HA HIS A 96 -0.660 5.201 8.347 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -0.580 2.538 9.801 1.00 0.00 H new ATOM 0 HB3 HIS A 96 0.706 3.285 8.875 1.00 0.00 H new ATOM 0 HD2 HIS A 96 2.311 5.039 10.298 1.00 0.00 H new ATOM 0 HE1 HIS A 96 0.115 4.931 13.927 1.00 0.00 H new ATOM 0 HE2 HIS A 96 2.249 5.750 12.806 1.00 0.00 H new ATOM 1424 N ALA A 97 -1.044 3.304 6.604 1.00 0.00 N ATOM 1425 CA ALA A 97 -1.534 2.533 5.468 1.00 0.00 C ATOM 1426 C ALA A 97 -0.390 1.827 4.749 1.00 0.00 C ATOM 1427 O ALA A 97 0.569 2.463 4.311 1.00 0.00 O ATOM 1428 CB ALA A 97 -2.289 3.435 4.504 1.00 0.00 C ATOM 0 H ALA A 97 -0.091 3.652 6.497 1.00 0.00 H new ATOM 0 HA ALA A 97 -2.216 1.771 5.845 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.649 2.846 3.661 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.137 3.888 5.018 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -1.623 4.218 4.141 1.00 0.00 H new ATOM 1434 N LYS A 98 -0.496 0.507 4.631 1.00 0.00 N ATOM 1435 CA LYS A 98 0.530 -0.287 3.965 1.00 0.00 C ATOM 1436 C LYS A 98 -0.056 -1.048 2.780 1.00 0.00 C ATOM 1437 O LYS A 98 -1.273 -1.196 2.665 1.00 0.00 O ATOM 1438 CB LYS A 98 1.166 -1.268 4.952 1.00 0.00 C ATOM 1439 CG LYS A 98 0.197 -1.793 5.997 1.00 0.00 C ATOM 1440 CD LYS A 98 0.887 -2.726 6.978 1.00 0.00 C ATOM 1441 CE LYS A 98 1.543 -1.956 8.113 1.00 0.00 C ATOM 1442 NZ LYS A 98 1.647 -2.775 9.352 1.00 0.00 N ATOM 0 H LYS A 98 -1.283 -0.035 4.988 1.00 0.00 H new ATOM 0 HA LYS A 98 1.297 0.393 3.594 1.00 0.00 H new ATOM 0 HB2 LYS A 98 1.581 -2.110 4.398 1.00 0.00 H new ATOM 0 HB3 LYS A 98 1.998 -0.776 5.455 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -0.244 -0.956 6.538 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -0.620 -2.321 5.505 1.00 0.00 H new ATOM 0 HD2 LYS A 98 0.160 -3.428 7.386 1.00 0.00 H new ATOM 0 HD3 LYS A 98 1.640 -3.315 6.454 1.00 0.00 H new ATOM 0 HE2 LYS A 98 2.538 -1.634 7.806 1.00 0.00 H new ATOM 0 HE3 LYS A 98 0.967 -1.055 8.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 2.100 -2.214 10.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 0.696 -3.061 9.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 2.218 -3.623 9.161 1.00 0.00 H new ATOM 1456 N VAL A 99 0.817 -1.532 1.902 1.00 0.00 N ATOM 1457 CA VAL A 99 0.386 -2.280 0.728 1.00 0.00 C ATOM 1458 C VAL A 99 1.091 -3.630 0.647 1.00 0.00 C ATOM 1459 O VAL A 99 2.311 -3.712 0.787 1.00 0.00 O ATOM 1460 CB VAL A 99 0.655 -1.495 -0.569 1.00 0.00 C ATOM 1461 CG1 VAL A 99 2.127 -1.572 -0.945 1.00 0.00 C ATOM 1462 CG2 VAL A 99 -0.220 -2.015 -1.699 1.00 0.00 C ATOM 0 H VAL A 99 1.828 -1.419 1.982 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.687 -2.439 0.831 1.00 0.00 H new ATOM 0 HB VAL A 99 0.403 -0.449 -0.398 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.298 -1.011 -1.864 1.00 0.00 H new ATOM 0 HG12 VAL A 99 2.730 -1.146 -0.143 1.00 0.00 H new ATOM 0 HG13 VAL A 99 2.410 -2.614 -1.098 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.016 -1.448 -2.607 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.002 -3.069 -1.872 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -1.270 -1.901 -1.428 1.00 0.00 H new ATOM 1472 N GLN A 100 0.314 -4.684 0.421 1.00 0.00 N ATOM 1473 CA GLN A 100 0.865 -6.031 0.322 1.00 0.00 C ATOM 1474 C GLN A 100 0.730 -6.572 -1.097 1.00 0.00 C ATOM 1475 O GLN A 100 -0.300 -6.387 -1.746 1.00 0.00 O ATOM 1476 CB GLN A 100 0.161 -6.966 1.307 1.00 0.00 C ATOM 1477 CG GLN A 100 0.932 -8.246 1.588 1.00 0.00 C ATOM 1478 CD GLN A 100 0.312 -9.069 2.700 1.00 0.00 C ATOM 1479 OE1 GLN A 100 -0.709 -8.689 3.273 1.00 0.00 O ATOM 1480 NE2 GLN A 100 0.928 -10.204 3.010 1.00 0.00 N ATOM 0 H GLN A 100 -0.698 -4.632 0.303 1.00 0.00 H new ATOM 0 HA GLN A 100 1.925 -5.982 0.572 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -0.001 -6.436 2.246 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -0.822 -7.223 0.912 1.00 0.00 H new ATOM 0 HG2 GLN A 100 0.977 -8.846 0.679 1.00 0.00 H new ATOM 0 HG3 GLN A 100 1.959 -7.996 1.855 1.00 0.00 H new ATOM 0 HE21 GLN A 100 1.772 -10.480 2.508 1.00 0.00 H new ATOM 0 HE22 GLN A 100 0.557 -10.800 3.750 1.00 0.00 H new ATOM 1489 N ALA A 101 1.775 -7.239 -1.573 1.00 0.00 N ATOM 1490 CA ALA A 101 1.772 -7.808 -2.915 1.00 0.00 C ATOM 1491 C ALA A 101 1.487 -9.305 -2.876 1.00 0.00 C ATOM 1492 O ALA A 101 2.065 -10.035 -2.072 1.00 0.00 O ATOM 1493 CB ALA A 101 3.101 -7.540 -3.606 1.00 0.00 C ATOM 0 H ALA A 101 2.635 -7.399 -1.049 1.00 0.00 H new ATOM 0 HA ALA A 101 0.976 -7.328 -3.484 1.00 0.00 H new ATOM 0 HB1 ALA A 101 3.084 -7.971 -4.607 1.00 0.00 H new ATOM 0 HB2 ALA A 101 3.264 -6.465 -3.676 1.00 0.00 H new ATOM 0 HB3 ALA A 101 3.908 -7.992 -3.030 1.00 0.00 H new ATOM 1499 N GLU A 102 0.591 -9.756 -3.749 1.00 0.00 N ATOM 1500 CA GLU A 102 0.228 -11.167 -3.812 1.00 0.00 C ATOM 1501 C GLU A 102 0.270 -11.676 -5.250 1.00 0.00 C ATOM 1502 O GLU A 102 -0.411 -11.146 -6.128 1.00 0.00 O ATOM 1503 CB GLU A 102 -1.167 -11.384 -3.223 1.00 0.00 C ATOM 1504 CG GLU A 102 -1.676 -12.808 -3.374 1.00 0.00 C ATOM 1505 CD GLU A 102 -3.189 -12.882 -3.446 1.00 0.00 C ATOM 1506 OE1 GLU A 102 -3.856 -12.233 -2.614 1.00 0.00 O ATOM 1507 OE2 GLU A 102 -3.705 -13.589 -4.337 1.00 0.00 O ATOM 0 H GLU A 102 0.103 -9.165 -4.422 1.00 0.00 H new ATOM 0 HA GLU A 102 0.954 -11.729 -3.225 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -1.150 -11.123 -2.165 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -1.867 -10.703 -3.708 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -1.251 -13.248 -4.276 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.326 -13.406 -2.532 1.00 0.00 H new ATOM 1514 N TYR A 103 1.075 -12.706 -5.483 1.00 0.00 N ATOM 1515 CA TYR A 103 1.209 -13.286 -6.814 1.00 0.00 C ATOM 1516 C TYR A 103 1.299 -14.807 -6.740 1.00 0.00 C ATOM 1517 O TYR A 103 1.995 -15.358 -5.888 1.00 0.00 O ATOM 1518 CB TYR A 103 2.447 -12.725 -7.515 1.00 0.00 C ATOM 1519 CG TYR A 103 2.352 -12.748 -9.024 1.00 0.00 C ATOM 1520 CD1 TYR A 103 2.576 -13.920 -9.736 1.00 0.00 C ATOM 1521 CD2 TYR A 103 2.036 -11.599 -9.738 1.00 0.00 C ATOM 1522 CE1 TYR A 103 2.490 -13.946 -11.115 1.00 0.00 C ATOM 1523 CE2 TYR A 103 1.947 -11.615 -11.116 1.00 0.00 C ATOM 1524 CZ TYR A 103 2.176 -12.791 -11.800 1.00 0.00 C ATOM 1525 OH TYR A 103 2.088 -12.813 -13.173 1.00 0.00 O ATOM 0 H TYR A 103 1.645 -13.157 -4.767 1.00 0.00 H new ATOM 0 HA TYR A 103 0.322 -13.020 -7.389 1.00 0.00 H new ATOM 0 HB2 TYR A 103 2.607 -11.698 -7.185 1.00 0.00 H new ATOM 0 HB3 TYR A 103 3.321 -13.299 -7.206 1.00 0.00 H new ATOM 0 HD1 TYR A 103 2.822 -14.826 -9.202 1.00 0.00 H new ATOM 0 HD2 TYR A 103 1.857 -10.677 -9.206 1.00 0.00 H new ATOM 0 HE1 TYR A 103 2.668 -14.865 -11.653 1.00 0.00 H new ATOM 0 HE2 TYR A 103 1.700 -10.712 -11.655 1.00 0.00 H new ATOM 0 HH TYR A 103 1.437 -12.144 -13.470 1.00 0.00 H new ATOM 1535 N ASN A 104 0.589 -15.480 -7.640 1.00 0.00 N ATOM 1536 CA ASN A 104 0.587 -16.938 -7.677 1.00 0.00 C ATOM 1537 C ASN A 104 0.228 -17.517 -6.313 1.00 0.00 C ATOM 1538 O ASN A 104 0.774 -18.539 -5.897 1.00 0.00 O ATOM 1539 CB ASN A 104 1.956 -17.459 -8.120 1.00 0.00 C ATOM 1540 CG ASN A 104 1.898 -18.893 -8.609 1.00 0.00 C ATOM 1541 OD1 ASN A 104 0.837 -19.517 -8.611 1.00 0.00 O ATOM 1542 ND2 ASN A 104 3.043 -19.423 -9.025 1.00 0.00 N ATOM 0 H ASN A 104 0.008 -15.039 -8.353 1.00 0.00 H new ATOM 0 HA ASN A 104 -0.167 -17.257 -8.397 1.00 0.00 H new ATOM 0 HB2 ASN A 104 2.344 -16.822 -8.915 1.00 0.00 H new ATOM 0 HB3 ASN A 104 2.655 -17.390 -7.287 1.00 0.00 H new ATOM 0 HD21 ASN A 104 3.066 -20.385 -9.364 1.00 0.00 H new ATOM 0 HD22 ASN A 104 3.899 -18.868 -9.005 1.00 0.00 H new ATOM 1549 N SER A 105 -0.695 -16.856 -5.620 1.00 0.00 N ATOM 1550 CA SER A 105 -1.125 -17.303 -4.300 1.00 0.00 C ATOM 1551 C SER A 105 0.022 -17.220 -3.298 1.00 0.00 C ATOM 1552 O SER A 105 0.108 -18.026 -2.370 1.00 0.00 O ATOM 1553 CB SER A 105 -1.653 -18.737 -4.372 1.00 0.00 C ATOM 1554 OG SER A 105 -2.739 -18.837 -5.277 1.00 0.00 O ATOM 0 H SER A 105 -1.159 -16.010 -5.951 1.00 0.00 H new ATOM 0 HA SER A 105 -1.926 -16.645 -3.963 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.852 -19.407 -4.685 1.00 0.00 H new ATOM 0 HB3 SER A 105 -1.971 -19.061 -3.381 1.00 0.00 H new ATOM 0 HG SER A 105 -3.057 -19.764 -5.306 1.00 0.00 H new ATOM 1560 N ILE A 106 0.899 -16.242 -3.492 1.00 0.00 N ATOM 1561 CA ILE A 106 2.040 -16.053 -2.605 1.00 0.00 C ATOM 1562 C ILE A 106 2.015 -14.669 -1.964 1.00 0.00 C ATOM 1563 O ILE A 106 2.294 -13.664 -2.618 1.00 0.00 O ATOM 1564 CB ILE A 106 3.373 -16.234 -3.355 1.00 0.00 C ATOM 1565 CG1 ILE A 106 3.456 -17.637 -3.959 1.00 0.00 C ATOM 1566 CG2 ILE A 106 4.546 -15.984 -2.419 1.00 0.00 C ATOM 1567 CD1 ILE A 106 4.604 -17.811 -4.928 1.00 0.00 C ATOM 0 H ILE A 106 0.842 -15.568 -4.255 1.00 0.00 H new ATOM 0 HA ILE A 106 1.964 -16.813 -1.827 1.00 0.00 H new ATOM 0 HB ILE A 106 3.419 -15.506 -4.165 1.00 0.00 H new ATOM 0 HG12 ILE A 106 3.557 -18.365 -3.154 1.00 0.00 H new ATOM 0 HG13 ILE A 106 2.521 -17.858 -4.473 1.00 0.00 H new ATOM 0 HG21 ILE A 106 5.481 -16.116 -2.964 1.00 0.00 H new ATOM 0 HG22 ILE A 106 4.492 -14.967 -2.032 1.00 0.00 H new ATOM 0 HG23 ILE A 106 4.507 -16.690 -1.590 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.601 -18.829 -5.317 1.00 0.00 H new ATOM 0 HD12 ILE A 106 4.493 -17.107 -5.753 1.00 0.00 H new ATOM 0 HD13 ILE A 106 5.546 -17.622 -4.414 1.00 0.00 H new ATOM 1579 N LYS A 107 1.679 -14.625 -0.679 1.00 0.00 N ATOM 1580 CA LYS A 107 1.620 -13.365 0.054 1.00 0.00 C ATOM 1581 C LYS A 107 2.904 -13.135 0.844 1.00 0.00 C ATOM 1582 O LYS A 107 3.157 -13.804 1.845 1.00 0.00 O ATOM 1583 CB LYS A 107 0.417 -13.358 1.000 1.00 0.00 C ATOM 1584 CG LYS A 107 -0.908 -13.605 0.301 1.00 0.00 C ATOM 1585 CD LYS A 107 -2.084 -13.220 1.184 1.00 0.00 C ATOM 1586 CE LYS A 107 -3.375 -13.866 0.705 1.00 0.00 C ATOM 1587 NZ LYS A 107 -3.628 -15.168 1.381 1.00 0.00 N ATOM 0 H LYS A 107 1.443 -15.447 -0.123 1.00 0.00 H new ATOM 0 HA LYS A 107 1.510 -12.557 -0.669 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.562 -14.121 1.765 1.00 0.00 H new ATOM 0 HB3 LYS A 107 0.374 -12.397 1.513 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -0.944 -13.032 -0.625 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -0.986 -14.657 0.028 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -1.884 -13.523 2.212 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -2.198 -12.136 1.188 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -4.210 -13.191 0.893 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -3.326 -14.020 -0.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -4.517 -15.576 1.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -2.844 -15.821 1.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -3.701 -15.018 2.408 1.00 0.00 H new ATOM 1601 N GLY A 108 3.712 -12.182 0.388 1.00 0.00 N ATOM 1602 CA GLY A 108 4.959 -11.880 1.066 1.00 0.00 C ATOM 1603 C GLY A 108 4.759 -10.997 2.282 1.00 0.00 C ATOM 1604 O GLY A 108 3.968 -11.319 3.169 1.00 0.00 O ATOM 0 H GLY A 108 3.525 -11.614 -0.438 1.00 0.00 H new ATOM 0 HA2 GLY A 108 5.438 -12.811 1.371 1.00 0.00 H new ATOM 0 HA3 GLY A 108 5.637 -11.386 0.370 1.00 0.00 H new ATOM 1608 N THR A 109 5.479 -9.880 2.325 1.00 0.00 N ATOM 1609 CA THR A 109 5.379 -8.950 3.443 1.00 0.00 C ATOM 1610 C THR A 109 5.049 -7.542 2.958 1.00 0.00 C ATOM 1611 O THR A 109 5.654 -7.025 2.020 1.00 0.00 O ATOM 1612 CB THR A 109 6.686 -8.907 4.257 1.00 0.00 C ATOM 1613 OG1 THR A 109 6.978 -10.206 4.782 1.00 0.00 O ATOM 1614 CG2 THR A 109 6.581 -7.905 5.396 1.00 0.00 C ATOM 0 H THR A 109 6.137 -9.598 1.599 1.00 0.00 H new ATOM 0 HA THR A 109 4.573 -9.310 4.083 1.00 0.00 H new ATOM 0 HB THR A 109 7.492 -8.594 3.593 1.00 0.00 H new ATOM 0 HG1 THR A 109 7.811 -10.171 5.297 1.00 0.00 H new ATOM 0 HG21 THR A 109 7.516 -7.892 5.957 1.00 0.00 H new ATOM 0 HG22 THR A 109 6.388 -6.912 4.990 1.00 0.00 H new ATOM 0 HG23 THR A 109 5.764 -8.192 6.059 1.00 0.00 H new ATOM 1622 N PRO A 110 4.066 -6.906 3.613 1.00 0.00 N ATOM 1623 CA PRO A 110 3.634 -5.548 3.266 1.00 0.00 C ATOM 1624 C PRO A 110 4.682 -4.499 3.620 1.00 0.00 C ATOM 1625 O PRO A 110 5.240 -4.510 4.717 1.00 0.00 O ATOM 1626 CB PRO A 110 2.373 -5.351 4.111 1.00 0.00 C ATOM 1627 CG PRO A 110 2.544 -6.274 5.268 1.00 0.00 C ATOM 1628 CD PRO A 110 3.301 -7.462 4.741 1.00 0.00 C ATOM 0 HA PRO A 110 3.468 -5.434 2.195 1.00 0.00 H new ATOM 0 HB2 PRO A 110 2.275 -4.317 4.441 1.00 0.00 H new ATOM 0 HB3 PRO A 110 1.474 -5.591 3.543 1.00 0.00 H new ATOM 0 HG2 PRO A 110 3.092 -5.789 6.076 1.00 0.00 H new ATOM 0 HG3 PRO A 110 1.578 -6.575 5.673 1.00 0.00 H new ATOM 0 HD2 PRO A 110 3.957 -7.889 5.500 1.00 0.00 H new ATOM 0 HD3 PRO A 110 2.628 -8.256 4.418 1.00 0.00 H new ATOM 1636 N SER A 111 4.946 -3.593 2.683 1.00 0.00 N ATOM 1637 CA SER A 111 5.930 -2.538 2.895 1.00 0.00 C ATOM 1638 C SER A 111 5.639 -1.775 4.184 1.00 0.00 C ATOM 1639 O SER A 111 4.716 -2.114 4.923 1.00 0.00 O ATOM 1640 CB SER A 111 5.937 -1.573 1.708 1.00 0.00 C ATOM 1641 OG SER A 111 4.621 -1.318 1.249 1.00 0.00 O ATOM 0 H SER A 111 4.492 -3.569 1.770 1.00 0.00 H new ATOM 0 HA SER A 111 6.912 -3.003 2.982 1.00 0.00 H new ATOM 0 HB2 SER A 111 6.411 -0.636 2.000 1.00 0.00 H new ATOM 0 HB3 SER A 111 6.533 -1.993 0.898 1.00 0.00 H new ATOM 0 HG SER A 111 4.093 -0.921 1.973 1.00 0.00 H new ATOM 1647 N GLU A 112 6.436 -0.744 4.446 1.00 0.00 N ATOM 1648 CA GLU A 112 6.265 0.067 5.646 1.00 0.00 C ATOM 1649 C GLU A 112 4.851 0.637 5.721 1.00 0.00 C ATOM 1650 O GLU A 112 4.038 0.429 4.820 1.00 0.00 O ATOM 1651 CB GLU A 112 7.287 1.205 5.669 1.00 0.00 C ATOM 1652 CG GLU A 112 8.725 0.729 5.790 1.00 0.00 C ATOM 1653 CD GLU A 112 9.718 1.718 5.210 1.00 0.00 C ATOM 1654 OE1 GLU A 112 9.841 2.830 5.766 1.00 0.00 O ATOM 1655 OE2 GLU A 112 10.371 1.381 4.201 1.00 0.00 O ATOM 0 H GLU A 112 7.206 -0.451 3.844 1.00 0.00 H new ATOM 0 HA GLU A 112 6.426 -0.574 6.513 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.183 1.794 4.757 1.00 0.00 H new ATOM 0 HB3 GLU A 112 7.061 1.868 6.504 1.00 0.00 H new ATOM 0 HG2 GLU A 112 8.960 0.558 6.841 1.00 0.00 H new ATOM 0 HG3 GLU A 112 8.831 -0.228 5.280 1.00 0.00 H new ATOM 1662 N ALA A 113 4.566 1.356 6.801 1.00 0.00 N ATOM 1663 CA ALA A 113 3.252 1.957 6.994 1.00 0.00 C ATOM 1664 C ALA A 113 3.272 3.442 6.647 1.00 0.00 C ATOM 1665 O ALA A 113 4.164 4.176 7.071 1.00 0.00 O ATOM 1666 CB ALA A 113 2.784 1.754 8.427 1.00 0.00 C ATOM 0 H ALA A 113 5.227 1.537 7.556 1.00 0.00 H new ATOM 0 HA ALA A 113 2.551 1.463 6.321 1.00 0.00 H new ATOM 0 HB1 ALA A 113 1.802 2.208 8.557 1.00 0.00 H new ATOM 0 HB2 ALA A 113 2.722 0.687 8.642 1.00 0.00 H new ATOM 0 HB3 ALA A 113 3.493 2.221 9.111 1.00 0.00 H new ATOM 1672 N GLU A 114 2.282 3.877 5.873 1.00 0.00 N ATOM 1673 CA GLU A 114 2.188 5.275 5.468 1.00 0.00 C ATOM 1674 C GLU A 114 1.064 5.984 6.219 1.00 0.00 C ATOM 1675 O GLU A 114 -0.104 5.609 6.107 1.00 0.00 O ATOM 1676 CB GLU A 114 1.953 5.378 3.960 1.00 0.00 C ATOM 1677 CG GLU A 114 1.709 6.798 3.477 1.00 0.00 C ATOM 1678 CD GLU A 114 2.995 7.576 3.278 1.00 0.00 C ATOM 1679 OE1 GLU A 114 3.764 7.224 2.358 1.00 0.00 O ATOM 1680 OE2 GLU A 114 3.233 8.535 4.041 1.00 0.00 O ATOM 0 H GLU A 114 1.535 3.282 5.514 1.00 0.00 H new ATOM 0 HA GLU A 114 3.131 5.762 5.715 1.00 0.00 H new ATOM 0 HB2 GLU A 114 2.818 4.969 3.437 1.00 0.00 H new ATOM 0 HB3 GLU A 114 1.096 4.760 3.691 1.00 0.00 H new ATOM 0 HG2 GLU A 114 1.158 6.768 2.537 1.00 0.00 H new ATOM 0 HG3 GLU A 114 1.081 7.320 4.199 1.00 0.00 H new ATOM 1687 N ILE A 115 1.426 7.009 6.983 1.00 0.00 N ATOM 1688 CA ILE A 115 0.448 7.771 7.751 1.00 0.00 C ATOM 1689 C ILE A 115 -0.005 9.011 6.988 1.00 0.00 C ATOM 1690 O ILE A 115 0.816 9.770 6.471 1.00 0.00 O ATOM 1691 CB ILE A 115 1.017 8.201 9.116 1.00 0.00 C ATOM 1692 CG1 ILE A 115 -0.059 8.911 9.940 1.00 0.00 C ATOM 1693 CG2 ILE A 115 2.227 9.103 8.925 1.00 0.00 C ATOM 1694 CD1 ILE A 115 0.197 8.871 11.430 1.00 0.00 C ATOM 0 H ILE A 115 2.388 7.331 7.087 1.00 0.00 H new ATOM 0 HA ILE A 115 -0.407 7.115 7.913 1.00 0.00 H new ATOM 0 HB ILE A 115 1.335 7.310 9.658 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -0.125 9.950 9.619 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -1.026 8.452 9.733 1.00 0.00 H new ATOM 0 HG21 ILE A 115 2.618 9.399 9.899 1.00 0.00 H new ATOM 0 HG22 ILE A 115 2.998 8.566 8.372 1.00 0.00 H new ATOM 0 HG23 ILE A 115 1.934 9.992 8.367 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -0.605 9.393 11.951 1.00 0.00 H new ATOM 0 HD12 ILE A 115 0.233 7.834 11.765 1.00 0.00 H new ATOM 0 HD13 ILE A 115 1.148 9.356 11.649 1.00 0.00 H new ATOM 1706 N PHE A 116 -1.317 9.212 6.922 1.00 0.00 N ATOM 1707 CA PHE A 116 -1.880 10.361 6.223 1.00 0.00 C ATOM 1708 C PHE A 116 -3.145 10.855 6.919 1.00 0.00 C ATOM 1709 O PHE A 116 -4.136 10.131 7.019 1.00 0.00 O ATOM 1710 CB PHE A 116 -2.193 9.998 4.770 1.00 0.00 C ATOM 1711 CG PHE A 116 -3.209 8.900 4.632 1.00 0.00 C ATOM 1712 CD1 PHE A 116 -4.564 9.189 4.632 1.00 0.00 C ATOM 1713 CD2 PHE A 116 -2.809 7.580 4.501 1.00 0.00 C ATOM 1714 CE1 PHE A 116 -5.502 8.181 4.506 1.00 0.00 C ATOM 1715 CE2 PHE A 116 -3.742 6.568 4.374 1.00 0.00 C ATOM 1716 CZ PHE A 116 -5.090 6.869 4.376 1.00 0.00 C ATOM 0 H PHE A 116 -2.010 8.594 7.344 1.00 0.00 H new ATOM 0 HA PHE A 116 -1.141 11.162 6.239 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -2.557 10.886 4.252 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -1.272 9.694 4.273 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -4.891 10.213 4.732 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -1.756 7.339 4.498 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -6.555 8.419 4.509 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -3.417 5.543 4.273 1.00 0.00 H new ATOM 0 HZ PHE A 116 -5.821 6.080 4.276 1.00 0.00 H new ATOM 1726 N THR A 117 -3.104 12.093 7.400 1.00 0.00 N ATOM 1727 CA THR A 117 -4.244 12.685 8.088 1.00 0.00 C ATOM 1728 C THR A 117 -5.273 13.212 7.095 1.00 0.00 C ATOM 1729 O THR A 117 -4.936 13.953 6.170 1.00 0.00 O ATOM 1730 CB THR A 117 -3.807 13.834 9.016 1.00 0.00 C ATOM 1731 OG1 THR A 117 -2.820 13.367 9.942 1.00 0.00 O ATOM 1732 CG2 THR A 117 -4.997 14.398 9.776 1.00 0.00 C ATOM 0 H THR A 117 -2.292 12.706 7.326 1.00 0.00 H new ATOM 0 HA THR A 117 -4.694 11.895 8.689 1.00 0.00 H new ATOM 0 HB THR A 117 -3.381 14.627 8.401 1.00 0.00 H new ATOM 0 HG1 THR A 117 -2.546 14.104 10.528 1.00 0.00 H new ATOM 0 HG21 THR A 117 -4.664 15.208 10.425 1.00 0.00 H new ATOM 0 HG22 THR A 117 -5.733 14.779 9.068 1.00 0.00 H new ATOM 0 HG23 THR A 117 -5.449 13.611 10.381 1.00 0.00 H new ATOM 1740 N THR A 118 -6.530 12.828 7.291 1.00 0.00 N ATOM 1741 CA THR A 118 -7.608 13.262 6.412 1.00 0.00 C ATOM 1742 C THR A 118 -8.290 14.513 6.954 1.00 0.00 C ATOM 1743 O THR A 118 -8.065 14.909 8.099 1.00 0.00 O ATOM 1744 CB THR A 118 -8.664 12.155 6.228 1.00 0.00 C ATOM 1745 OG1 THR A 118 -9.223 11.796 7.497 1.00 0.00 O ATOM 1746 CG2 THR A 118 -8.052 10.927 5.572 1.00 0.00 C ATOM 0 H THR A 118 -6.827 12.217 8.052 1.00 0.00 H new ATOM 0 HA THR A 118 -7.156 13.487 5.446 1.00 0.00 H new ATOM 0 HB THR A 118 -9.452 12.539 5.580 1.00 0.00 H new ATOM 0 HG1 THR A 118 -9.199 10.822 7.601 1.00 0.00 H new ATOM 0 HG21 THR A 118 -8.816 10.159 5.453 1.00 0.00 H new ATOM 0 HG22 THR A 118 -7.653 11.197 4.594 1.00 0.00 H new ATOM 0 HG23 THR A 118 -7.247 10.543 6.198 1.00 0.00 H new ATOM 1754 N LEU A 119 -9.124 15.133 6.126 1.00 0.00 N ATOM 1755 CA LEU A 119 -9.839 16.340 6.523 1.00 0.00 C ATOM 1756 C LEU A 119 -11.215 15.998 7.086 1.00 0.00 C ATOM 1757 O LEU A 119 -11.750 14.919 6.830 1.00 0.00 O ATOM 1758 CB LEU A 119 -9.985 17.286 5.330 1.00 0.00 C ATOM 1759 CG LEU A 119 -10.123 16.621 3.959 1.00 0.00 C ATOM 1760 CD1 LEU A 119 -10.925 17.505 3.016 1.00 0.00 C ATOM 1761 CD2 LEU A 119 -8.752 16.318 3.373 1.00 0.00 C ATOM 0 H LEU A 119 -9.321 14.819 5.176 1.00 0.00 H new ATOM 0 HA LEU A 119 -9.260 16.835 7.303 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -10.859 17.916 5.496 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -9.117 17.945 5.306 1.00 0.00 H new ATOM 0 HG LEU A 119 -10.658 15.680 4.085 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -11.013 17.016 2.046 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -11.919 17.671 3.430 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -10.418 18.462 2.895 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -8.869 15.845 2.398 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -8.191 17.246 3.261 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -8.212 15.646 4.040 1.00 0.00 H new ATOM 1773 N SER A 120 -11.783 16.924 7.852 1.00 0.00 N ATOM 1774 CA SER A 120 -13.095 16.719 8.453 1.00 0.00 C ATOM 1775 C SER A 120 -14.188 16.731 7.387 1.00 0.00 C ATOM 1776 O SER A 120 -14.100 17.462 6.400 1.00 0.00 O ATOM 1777 CB SER A 120 -13.376 17.801 9.498 1.00 0.00 C ATOM 1778 OG SER A 120 -12.934 17.396 10.782 1.00 0.00 O ATOM 0 H SER A 120 -11.355 17.824 8.071 1.00 0.00 H new ATOM 0 HA SER A 120 -13.096 15.744 8.940 1.00 0.00 H new ATOM 0 HB2 SER A 120 -12.875 18.726 9.212 1.00 0.00 H new ATOM 0 HB3 SER A 120 -14.445 18.013 9.528 1.00 0.00 H new ATOM 0 HG SER A 120 -13.123 18.105 11.432 1.00 0.00 H new ATOM 1784 N CYS A 121 -15.216 15.916 7.595 1.00 0.00 N ATOM 1785 CA CYS A 121 -16.326 15.830 6.653 1.00 0.00 C ATOM 1786 C CYS A 121 -16.605 17.188 6.016 1.00 0.00 C ATOM 1787 O CYS A 121 -16.857 17.280 4.815 1.00 0.00 O ATOM 1788 CB CYS A 121 -17.582 15.316 7.358 1.00 0.00 C ATOM 1789 SG CYS A 121 -18.110 16.332 8.758 1.00 0.00 S ATOM 0 H CYS A 121 -15.304 15.305 8.407 1.00 0.00 H new ATOM 0 HA CYS A 121 -16.048 15.130 5.865 1.00 0.00 H new ATOM 0 HB2 CYS A 121 -18.396 15.262 6.635 1.00 0.00 H new ATOM 0 HB3 CYS A 121 -17.399 14.300 7.708 1.00 0.00 H new ATOM 0 HG CYS A 121 -19.180 15.819 9.288 1.00 0.00 H new