USER MOD reduce.3.24.130724 H: found=0, std=0, add=822, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 825 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.0489 K(o=-0.049,f=-1.6!) USER MOD Single : A 18 CYS SG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 76:sc= 0.197 USER MOD Single : A 23 SER OG : rot -71:sc= 0.57 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 CYS SG : rot 180:sc= -0.178 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0.0465 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 75:sc= 0.0683 USER MOD Single : A 78 MET CE :methyl 150:sc= -0.245 (180deg=-1.31) USER MOD Single : A 82 THR OG1 : rot 75:sc= 1 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 74:sc= 0.144 USER MOD Single : A 88 SER OG : rot 56:sc= 0.44 USER MOD Single : A 90 CYS SG : rot 92:sc= 0.122 USER MOD Single : A 121 CYS SG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 95:sc= 0.0126 USER MOD Single : A 128 MET CE :methyl -127:sc= 0 (180deg=-0.13) USER MOD ----------------------------------------------------------------- ATOM 55 N GLU A 6 7.432 5.499 -8.887 1.00 30.43 N ATOM 56 CA GLU A 6 7.986 5.992 -10.142 1.00 71.01 C ATOM 57 C GLU A 6 7.352 7.325 -10.530 1.00 31.21 C ATOM 58 O GLU A 6 8.029 8.342 -10.682 1.00 33.02 O ATOM 59 CB GLU A 6 7.769 4.968 -11.258 1.00 64.21 C ATOM 60 CG GLU A 6 7.586 5.593 -12.631 1.00 13.12 C ATOM 61 CD GLU A 6 7.720 4.584 -13.754 1.00 72.43 C ATOM 62 OE1 GLU A 6 8.028 3.409 -13.462 1.00 74.00 O ATOM 63 OE2 GLU A 6 7.517 4.968 -14.925 1.00 65.30 O ATOM 0 HA GLU A 6 9.056 6.145 -10.002 1.00 71.01 H new ATOM 0 HB2 GLU A 6 8.622 4.290 -11.288 1.00 64.21 H new ATOM 0 HB3 GLU A 6 6.891 4.367 -11.022 1.00 64.21 H new ATOM 0 HG2 GLU A 6 6.604 6.062 -12.684 1.00 13.12 H new ATOM 0 HG3 GLU A 6 8.324 6.383 -12.768 1.00 13.12 H new ATOM 70 N PRO A 7 6.021 7.321 -10.695 1.00 32.41 N ATOM 71 CA PRO A 7 5.266 8.521 -11.067 1.00 75.41 C ATOM 72 C PRO A 7 5.221 9.550 -9.943 1.00 23.33 C ATOM 73 O PRO A 7 5.014 10.740 -10.184 1.00 63.32 O ATOM 74 CB PRO A 7 3.862 7.981 -11.354 1.00 11.40 C ATOM 75 CG PRO A 7 3.766 6.730 -10.552 1.00 33.32 C ATOM 76 CD PRO A 7 5.151 6.144 -10.530 1.00 55.22 C ATOM 0 HA PRO A 7 5.719 9.042 -11.911 1.00 75.41 H new ATOM 0 HB2 PRO A 7 3.095 8.698 -11.062 1.00 11.40 H new ATOM 0 HB3 PRO A 7 3.724 7.782 -12.417 1.00 11.40 H new ATOM 0 HG2 PRO A 7 3.415 6.940 -9.542 1.00 33.32 H new ATOM 0 HG3 PRO A 7 3.055 6.034 -10.998 1.00 33.32 H new ATOM 0 HD2 PRO A 7 5.352 5.623 -9.594 1.00 55.22 H new ATOM 0 HD3 PRO A 7 5.295 5.422 -11.334 1.00 55.22 H new ATOM 84 N LEU A 8 5.417 9.085 -8.714 1.00 23.02 N ATOM 85 CA LEU A 8 5.400 9.966 -7.551 1.00 25.20 C ATOM 86 C LEU A 8 6.641 10.852 -7.521 1.00 43.44 C ATOM 87 O LEU A 8 6.569 12.028 -7.163 1.00 32.02 O ATOM 88 CB LEU A 8 5.317 9.143 -6.264 1.00 70.23 C ATOM 89 CG LEU A 8 4.608 9.810 -5.085 1.00 41.43 C ATOM 90 CD1 LEU A 8 5.325 11.091 -4.687 1.00 41.23 C ATOM 91 CD2 LEU A 8 3.154 10.096 -5.430 1.00 13.22 C ATOM 0 H LEU A 8 5.589 8.103 -8.497 1.00 23.02 H new ATOM 0 HA LEU A 8 4.520 10.606 -7.624 1.00 25.20 H new ATOM 0 HB2 LEU A 8 4.805 8.207 -6.487 1.00 70.23 H new ATOM 0 HB3 LEU A 8 6.330 8.886 -5.955 1.00 70.23 H new ATOM 0 HG LEU A 8 4.632 9.126 -4.237 1.00 41.43 H new ATOM 0 HD11 LEU A 8 4.806 11.552 -3.846 1.00 41.23 H new ATOM 0 HD12 LEU A 8 6.350 10.859 -4.398 1.00 41.23 H new ATOM 0 HD13 LEU A 8 5.333 11.781 -5.531 1.00 41.23 H new ATOM 0 HD21 LEU A 8 2.665 10.571 -4.579 1.00 13.22 H new ATOM 0 HD22 LEU A 8 3.109 10.761 -6.292 1.00 13.22 H new ATOM 0 HD23 LEU A 8 2.645 9.161 -5.666 1.00 13.22 H new ATOM 103 N PHE A 9 7.779 10.282 -7.903 1.00 22.32 N ATOM 104 CA PHE A 9 9.036 11.020 -7.921 1.00 43.43 C ATOM 105 C PHE A 9 9.162 11.847 -9.197 1.00 45.54 C ATOM 106 O PHE A 9 9.910 12.825 -9.246 1.00 20.45 O ATOM 107 CB PHE A 9 10.220 10.058 -7.805 1.00 71.30 C ATOM 108 CG PHE A 9 11.422 10.664 -7.140 1.00 25.32 C ATOM 109 CD1 PHE A 9 12.365 11.358 -7.882 1.00 34.14 C ATOM 110 CD2 PHE A 9 11.611 10.540 -5.773 1.00 35.43 C ATOM 111 CE1 PHE A 9 13.472 11.916 -7.272 1.00 24.30 C ATOM 112 CE2 PHE A 9 12.716 11.096 -5.157 1.00 63.24 C ATOM 113 CZ PHE A 9 13.648 11.786 -5.908 1.00 71.41 C ATOM 0 H PHE A 9 7.856 9.311 -8.204 1.00 22.32 H new ATOM 0 HA PHE A 9 9.043 11.697 -7.067 1.00 43.43 H new ATOM 0 HB2 PHE A 9 9.909 9.178 -7.242 1.00 71.30 H new ATOM 0 HB3 PHE A 9 10.500 9.717 -8.802 1.00 71.30 H new ATOM 0 HD1 PHE A 9 12.233 11.464 -8.949 1.00 34.14 H new ATOM 0 HD2 PHE A 9 10.885 10.002 -5.181 1.00 35.43 H new ATOM 0 HE1 PHE A 9 14.200 12.454 -7.862 1.00 24.30 H new ATOM 0 HE2 PHE A 9 12.851 10.991 -4.091 1.00 63.24 H new ATOM 0 HZ PHE A 9 14.512 12.223 -5.430 1.00 71.41 H new ATOM 123 N TYR A 10 8.427 11.448 -10.229 1.00 11.22 N ATOM 124 CA TYR A 10 8.458 12.150 -11.507 1.00 31.33 C ATOM 125 C TYR A 10 7.762 13.503 -11.402 1.00 42.51 C ATOM 126 O TYR A 10 8.333 14.538 -11.750 1.00 24.25 O ATOM 127 CB TYR A 10 7.791 11.304 -12.593 1.00 23.21 C ATOM 128 CG TYR A 10 8.560 11.275 -13.895 1.00 13.22 C ATOM 129 CD1 TYR A 10 9.669 10.453 -14.052 1.00 55.11 C ATOM 130 CD2 TYR A 10 8.176 12.070 -14.968 1.00 72.22 C ATOM 131 CE1 TYR A 10 10.374 10.424 -15.240 1.00 12.45 C ATOM 132 CE2 TYR A 10 8.874 12.047 -16.160 1.00 23.51 C ATOM 133 CZ TYR A 10 9.973 11.223 -16.290 1.00 72.35 C ATOM 134 OH TYR A 10 10.672 11.196 -17.475 1.00 72.14 O ATOM 0 H TYR A 10 7.802 10.642 -10.206 1.00 11.22 H new ATOM 0 HA TYR A 10 9.501 12.318 -11.775 1.00 31.33 H new ATOM 0 HB2 TYR A 10 7.674 10.284 -12.227 1.00 23.21 H new ATOM 0 HB3 TYR A 10 6.790 11.692 -12.781 1.00 23.21 H new ATOM 0 HD1 TYR A 10 9.985 9.826 -13.232 1.00 55.11 H new ATOM 0 HD2 TYR A 10 7.317 12.717 -14.868 1.00 72.22 H new ATOM 0 HE1 TYR A 10 11.234 9.779 -15.346 1.00 12.45 H new ATOM 0 HE2 TYR A 10 8.561 12.670 -16.985 1.00 23.51 H new ATOM 0 HH TYR A 10 10.259 11.816 -18.112 1.00 72.14 H new ATOM 144 N THR A 11 6.523 13.489 -10.920 1.00 5.34 N ATOM 145 CA THR A 11 5.748 14.714 -10.769 1.00 31.12 C ATOM 146 C THR A 11 6.528 15.766 -9.989 1.00 14.04 C ATOM 147 O THR A 11 6.497 16.950 -10.324 1.00 54.41 O ATOM 148 CB THR A 11 4.410 14.447 -10.053 1.00 42.21 C ATOM 149 OG1 THR A 11 3.726 15.683 -9.817 1.00 21.30 O ATOM 150 CG2 THR A 11 4.637 13.727 -8.733 1.00 22.14 C ATOM 0 H THR A 11 6.035 12.642 -10.628 1.00 5.34 H new ATOM 0 HA THR A 11 5.546 15.086 -11.773 1.00 31.12 H new ATOM 0 HB THR A 11 3.800 13.811 -10.695 1.00 42.21 H new ATOM 0 HG1 THR A 11 2.876 15.505 -9.363 1.00 21.30 H new ATOM 0 HG21 THR A 11 3.678 13.549 -8.246 1.00 22.14 H new ATOM 0 HG22 THR A 11 5.132 12.774 -8.919 1.00 22.14 H new ATOM 0 HG23 THR A 11 5.264 14.341 -8.087 1.00 22.14 H new ATOM 158 N ILE A 12 7.226 15.327 -8.947 1.00 64.55 N ATOM 159 CA ILE A 12 8.016 16.231 -8.121 1.00 52.32 C ATOM 160 C ILE A 12 9.184 16.816 -8.908 1.00 23.34 C ATOM 161 O ILE A 12 9.572 17.965 -8.701 1.00 74.11 O ATOM 162 CB ILE A 12 8.560 15.519 -6.868 1.00 52.54 C ATOM 163 CG1 ILE A 12 7.426 15.245 -5.878 1.00 51.13 C ATOM 164 CG2 ILE A 12 9.650 16.356 -6.215 1.00 52.12 C ATOM 165 CD1 ILE A 12 7.801 14.268 -4.786 1.00 11.42 C ATOM 0 H ILE A 12 7.260 14.350 -8.655 1.00 64.55 H new ATOM 0 HA ILE A 12 7.351 17.037 -7.810 1.00 52.32 H new ATOM 0 HB ILE A 12 8.993 14.565 -7.169 1.00 52.54 H new ATOM 0 HG12 ILE A 12 7.117 16.186 -5.422 1.00 51.13 H new ATOM 0 HG13 ILE A 12 6.565 14.856 -6.422 1.00 51.13 H new ATOM 0 HG21 ILE A 12 10.025 15.840 -5.331 1.00 52.12 H new ATOM 0 HG22 ILE A 12 10.467 16.505 -6.921 1.00 52.12 H new ATOM 0 HG23 ILE A 12 9.241 17.323 -5.924 1.00 52.12 H new ATOM 0 HD11 ILE A 12 6.950 14.121 -4.121 1.00 11.42 H new ATOM 0 HD12 ILE A 12 8.082 13.314 -5.232 1.00 11.42 H new ATOM 0 HD13 ILE A 12 8.642 14.664 -4.217 1.00 11.42 H new ATOM 177 N ASN A 13 9.741 16.016 -9.812 1.00 12.12 N ATOM 178 CA ASN A 13 10.865 16.455 -10.631 1.00 72.52 C ATOM 179 C ASN A 13 10.404 17.430 -11.710 1.00 32.01 C ATOM 180 O ASN A 13 11.217 18.113 -12.333 1.00 42.42 O ATOM 181 CB ASN A 13 11.552 15.250 -11.277 1.00 63.02 C ATOM 182 CG ASN A 13 12.478 14.528 -10.316 1.00 54.54 C ATOM 183 OD1 ASN A 13 12.650 14.947 -9.171 1.00 61.54 O ATOM 184 ND2 ASN A 13 13.078 13.439 -10.780 1.00 23.42 N ATOM 0 H ASN A 13 9.433 15.061 -9.996 1.00 12.12 H new ATOM 0 HA ASN A 13 11.576 16.967 -9.983 1.00 72.52 H new ATOM 0 HB2 ASN A 13 10.795 14.555 -11.639 1.00 63.02 H new ATOM 0 HB3 ASN A 13 12.121 15.582 -12.145 1.00 63.02 H new ATOM 0 HD21 ASN A 13 13.712 12.911 -10.180 1.00 23.42 H new ATOM 0 HD22 ASN A 13 12.905 13.130 -11.736 1.00 23.42 H new ATOM 191 N LEU A 14 9.094 17.490 -11.925 1.00 22.12 N ATOM 192 CA LEU A 14 8.524 18.382 -12.928 1.00 14.41 C ATOM 193 C LEU A 14 8.222 19.752 -12.329 1.00 51.53 C ATOM 194 O LEU A 14 8.218 20.762 -13.035 1.00 32.41 O ATOM 195 CB LEU A 14 7.246 17.776 -13.511 1.00 64.44 C ATOM 196 CG LEU A 14 7.384 17.111 -14.881 1.00 62.34 C ATOM 197 CD1 LEU A 14 7.652 18.153 -15.956 1.00 25.10 C ATOM 198 CD2 LEU A 14 8.492 16.068 -14.859 1.00 21.30 C ATOM 0 H LEU A 14 8.407 16.932 -11.418 1.00 22.12 H new ATOM 0 HA LEU A 14 9.257 18.507 -13.725 1.00 14.41 H new ATOM 0 HB2 LEU A 14 6.864 17.037 -12.807 1.00 64.44 H new ATOM 0 HB3 LEU A 14 6.495 18.563 -13.585 1.00 64.44 H new ATOM 0 HG LEU A 14 6.445 16.610 -15.116 1.00 62.34 H new ATOM 0 HD11 LEU A 14 7.747 17.661 -16.924 1.00 25.10 H new ATOM 0 HD12 LEU A 14 6.825 18.862 -15.989 1.00 25.10 H new ATOM 0 HD13 LEU A 14 8.576 18.684 -15.726 1.00 25.10 H new ATOM 0 HD21 LEU A 14 8.576 15.605 -15.842 1.00 21.30 H new ATOM 0 HD22 LEU A 14 9.437 16.546 -14.601 1.00 21.30 H new ATOM 0 HD23 LEU A 14 8.258 15.304 -14.117 1.00 21.30 H new ATOM 210 N ILE A 15 7.972 19.780 -11.025 1.00 10.34 N ATOM 211 CA ILE A 15 7.673 21.027 -10.331 1.00 32.10 C ATOM 212 C ILE A 15 8.947 21.813 -10.038 1.00 74.54 C ATOM 213 O ILE A 15 8.932 23.043 -9.993 1.00 22.00 O ATOM 214 CB ILE A 15 6.926 20.770 -9.009 1.00 2.24 C ATOM 215 CG1 ILE A 15 5.608 20.040 -9.275 1.00 65.21 C ATOM 216 CG2 ILE A 15 6.673 22.082 -8.280 1.00 63.40 C ATOM 217 CD1 ILE A 15 4.677 20.792 -10.199 1.00 71.15 C ATOM 0 H ILE A 15 7.970 18.954 -10.427 1.00 10.34 H new ATOM 0 HA ILE A 15 7.033 21.611 -10.993 1.00 32.10 H new ATOM 0 HB ILE A 15 7.548 20.138 -8.375 1.00 2.24 H new ATOM 0 HG12 ILE A 15 5.824 19.063 -9.707 1.00 65.21 H new ATOM 0 HG13 ILE A 15 5.101 19.864 -8.326 1.00 65.21 H new ATOM 0 HG21 ILE A 15 6.144 21.884 -7.348 1.00 63.40 H new ATOM 0 HG22 ILE A 15 7.625 22.566 -8.062 1.00 63.40 H new ATOM 0 HG23 ILE A 15 6.068 22.736 -8.908 1.00 63.40 H new ATOM 0 HD11 ILE A 15 3.763 20.216 -10.343 1.00 71.15 H new ATOM 0 HD12 ILE A 15 4.431 21.759 -9.760 1.00 71.15 H new ATOM 0 HD13 ILE A 15 5.165 20.945 -11.162 1.00 71.15 H new ATOM 229 N ILE A 16 10.047 21.094 -9.843 1.00 33.44 N ATOM 230 CA ILE A 16 11.330 21.724 -9.558 1.00 32.34 C ATOM 231 C ILE A 16 11.661 22.791 -10.595 1.00 54.13 C ATOM 232 O ILE A 16 11.875 23.960 -10.273 1.00 62.14 O ATOM 233 CB ILE A 16 12.470 20.689 -9.521 1.00 74.41 C ATOM 234 CG1 ILE A 16 12.630 20.124 -8.108 1.00 43.30 C ATOM 235 CG2 ILE A 16 13.771 21.317 -9.998 1.00 32.53 C ATOM 236 CD1 ILE A 16 13.350 21.060 -7.162 1.00 33.01 C ATOM 0 H ILE A 16 10.076 20.075 -9.877 1.00 33.44 H new ATOM 0 HA ILE A 16 11.241 22.190 -8.577 1.00 32.34 H new ATOM 0 HB ILE A 16 12.218 19.868 -10.193 1.00 74.41 H new ATOM 0 HG12 ILE A 16 11.644 19.897 -7.702 1.00 43.30 H new ATOM 0 HG13 ILE A 16 13.177 19.183 -8.161 1.00 43.30 H new ATOM 0 HG21 ILE A 16 14.567 20.573 -9.966 1.00 32.53 H new ATOM 0 HG22 ILE A 16 13.649 21.674 -11.020 1.00 32.53 H new ATOM 0 HG23 ILE A 16 14.030 22.154 -9.350 1.00 32.53 H new ATOM 0 HD11 ILE A 16 13.428 20.595 -6.179 1.00 33.01 H new ATOM 0 HD12 ILE A 16 14.349 21.267 -7.545 1.00 33.01 H new ATOM 0 HD13 ILE A 16 12.793 21.993 -7.079 1.00 33.01 H new ATOM 248 N PRO A 17 11.701 22.382 -11.872 1.00 45.32 N ATOM 249 CA PRO A 17 12.003 23.289 -12.984 1.00 60.42 C ATOM 250 C PRO A 17 10.880 24.289 -13.238 1.00 22.32 C ATOM 251 O PRO A 17 11.132 25.451 -13.557 1.00 41.31 O ATOM 252 CB PRO A 17 12.158 22.345 -14.179 1.00 63.41 C ATOM 253 CG PRO A 17 11.350 21.145 -13.822 1.00 13.41 C ATOM 254 CD PRO A 17 11.456 21.004 -12.329 1.00 10.03 C ATOM 0 HA PRO A 17 12.886 23.897 -12.786 1.00 60.42 H new ATOM 0 HB2 PRO A 17 11.796 22.807 -15.098 1.00 63.41 H new ATOM 0 HB3 PRO A 17 13.203 22.084 -14.344 1.00 63.41 H new ATOM 0 HG2 PRO A 17 10.312 21.268 -14.130 1.00 13.41 H new ATOM 0 HG3 PRO A 17 11.728 20.256 -14.326 1.00 13.41 H new ATOM 0 HD2 PRO A 17 10.542 20.594 -11.898 1.00 10.03 H new ATOM 0 HD3 PRO A 17 12.269 20.336 -12.045 1.00 10.03 H new ATOM 262 N CYS A 18 9.642 23.830 -13.093 1.00 60.14 N ATOM 263 CA CYS A 18 8.480 24.685 -13.307 1.00 51.14 C ATOM 264 C CYS A 18 8.589 25.966 -12.486 1.00 34.30 C ATOM 265 O CYS A 18 8.575 27.069 -13.032 1.00 4.01 O ATOM 266 CB CYS A 18 7.197 23.938 -12.942 1.00 74.10 C ATOM 267 SG CYS A 18 6.218 23.410 -14.368 1.00 41.41 S ATOM 0 H CYS A 18 9.417 22.871 -12.828 1.00 60.14 H new ATOM 0 HA CYS A 18 8.447 24.954 -14.363 1.00 51.14 H new ATOM 0 HB2 CYS A 18 7.456 23.061 -12.348 1.00 74.10 H new ATOM 0 HB3 CYS A 18 6.583 24.580 -12.311 1.00 74.10 H new ATOM 0 HG CYS A 18 5.155 22.785 -13.957 1.00 41.41 H new ATOM 273 N VAL A 19 8.694 25.811 -11.170 1.00 5.21 N ATOM 274 CA VAL A 19 8.805 26.955 -10.272 1.00 74.14 C ATOM 275 C VAL A 19 10.137 27.673 -10.458 1.00 55.13 C ATOM 276 O VAL A 19 10.268 28.855 -10.136 1.00 74.22 O ATOM 277 CB VAL A 19 8.666 26.528 -8.799 1.00 74.31 C ATOM 278 CG1 VAL A 19 7.317 25.865 -8.560 1.00 43.41 C ATOM 279 CG2 VAL A 19 9.803 25.598 -8.405 1.00 20.31 C ATOM 0 H VAL A 19 8.705 24.905 -10.702 1.00 5.21 H new ATOM 0 HA VAL A 19 7.991 27.635 -10.524 1.00 74.14 H new ATOM 0 HB VAL A 19 8.722 27.419 -8.174 1.00 74.31 H new ATOM 0 HG11 VAL A 19 7.237 25.570 -7.514 1.00 43.41 H new ATOM 0 HG12 VAL A 19 6.519 26.567 -8.801 1.00 43.41 H new ATOM 0 HG13 VAL A 19 7.228 24.983 -9.194 1.00 43.41 H new ATOM 0 HG21 VAL A 19 9.689 25.306 -7.361 1.00 20.31 H new ATOM 0 HG22 VAL A 19 9.781 24.709 -9.035 1.00 20.31 H new ATOM 0 HG23 VAL A 19 10.755 26.112 -8.536 1.00 20.31 H new ATOM 289 N LEU A 20 11.123 26.953 -10.980 1.00 71.43 N ATOM 290 CA LEU A 20 12.447 27.521 -11.210 1.00 73.13 C ATOM 291 C LEU A 20 12.406 28.562 -12.325 1.00 23.34 C ATOM 292 O LEU A 20 12.796 29.713 -12.126 1.00 63.24 O ATOM 293 CB LEU A 20 13.443 26.416 -11.565 1.00 61.21 C ATOM 294 CG LEU A 20 14.540 26.145 -10.535 1.00 32.24 C ATOM 295 CD1 LEU A 20 15.292 24.869 -10.878 1.00 71.55 C ATOM 296 CD2 LEU A 20 15.497 27.325 -10.452 1.00 64.41 C ATOM 0 H LEU A 20 11.031 25.974 -11.252 1.00 71.43 H new ATOM 0 HA LEU A 20 12.770 28.011 -10.292 1.00 73.13 H new ATOM 0 HB2 LEU A 20 12.888 25.492 -11.726 1.00 61.21 H new ATOM 0 HB3 LEU A 20 13.917 26.672 -12.512 1.00 61.21 H new ATOM 0 HG LEU A 20 14.071 26.014 -9.560 1.00 32.24 H new ATOM 0 HD11 LEU A 20 16.069 24.693 -10.134 1.00 71.55 H new ATOM 0 HD12 LEU A 20 14.598 24.028 -10.884 1.00 71.55 H new ATOM 0 HD13 LEU A 20 15.749 24.970 -11.862 1.00 71.55 H new ATOM 0 HD21 LEU A 20 16.271 27.114 -9.714 1.00 64.41 H new ATOM 0 HD22 LEU A 20 15.959 27.488 -11.426 1.00 64.41 H new ATOM 0 HD23 LEU A 20 14.948 28.219 -10.157 1.00 64.41 H new ATOM 308 N ILE A 21 11.930 28.150 -13.495 1.00 24.12 N ATOM 309 CA ILE A 21 11.836 29.048 -14.639 1.00 71.32 C ATOM 310 C ILE A 21 11.065 30.314 -14.282 1.00 73.13 C ATOM 311 O ILE A 21 11.495 31.425 -14.593 1.00 11.30 O ATOM 312 CB ILE A 21 11.151 28.363 -15.837 1.00 10.22 C ATOM 313 CG1 ILE A 21 11.941 27.124 -16.264 1.00 52.53 C ATOM 314 CG2 ILE A 21 11.015 29.338 -16.997 1.00 72.21 C ATOM 315 CD1 ILE A 21 13.293 27.446 -16.860 1.00 43.23 C ATOM 0 H ILE A 21 11.604 27.201 -13.676 1.00 24.12 H new ATOM 0 HA ILE A 21 12.856 29.313 -14.917 1.00 71.32 H new ATOM 0 HB ILE A 21 10.153 28.047 -15.535 1.00 10.22 H new ATOM 0 HG12 ILE A 21 12.079 26.475 -15.399 1.00 52.53 H new ATOM 0 HG13 ILE A 21 11.356 26.563 -16.993 1.00 52.53 H new ATOM 0 HG21 ILE A 21 10.529 28.840 -17.836 1.00 72.21 H new ATOM 0 HG22 ILE A 21 10.414 30.193 -16.685 1.00 72.21 H new ATOM 0 HG23 ILE A 21 12.004 29.681 -17.302 1.00 72.21 H new ATOM 0 HD11 ILE A 21 13.797 26.521 -17.140 1.00 43.23 H new ATOM 0 HD12 ILE A 21 13.162 28.069 -17.744 1.00 43.23 H new ATOM 0 HD13 ILE A 21 13.896 27.980 -16.126 1.00 43.23 H new ATOM 327 N THR A 22 9.922 30.139 -13.626 1.00 10.13 N ATOM 328 CA THR A 22 9.090 31.267 -13.225 1.00 63.12 C ATOM 329 C THR A 22 9.899 32.296 -12.443 1.00 72.14 C ATOM 330 O THR A 22 9.888 33.484 -12.766 1.00 74.34 O ATOM 331 CB THR A 22 7.897 30.808 -12.366 1.00 21.10 C ATOM 332 OG1 THR A 22 7.115 29.849 -13.086 1.00 54.25 O ATOM 333 CG2 THR A 22 7.025 31.991 -11.975 1.00 52.32 C ATOM 0 H THR A 22 9.551 29.226 -13.361 1.00 10.13 H new ATOM 0 HA THR A 22 8.714 31.724 -14.141 1.00 63.12 H new ATOM 0 HB THR A 22 8.287 30.349 -11.458 1.00 21.10 H new ATOM 0 HG1 THR A 22 7.576 28.984 -13.086 1.00 54.25 H new ATOM 0 HG21 THR A 22 6.189 31.642 -11.369 1.00 52.32 H new ATOM 0 HG22 THR A 22 7.616 32.705 -11.401 1.00 52.32 H new ATOM 0 HG23 THR A 22 6.644 32.475 -12.874 1.00 52.32 H new ATOM 341 N SER A 23 10.600 31.832 -11.414 1.00 44.50 N ATOM 342 CA SER A 23 11.413 32.714 -10.584 1.00 12.12 C ATOM 343 C SER A 23 12.380 33.527 -11.439 1.00 61.31 C ATOM 344 O SER A 23 12.620 34.706 -11.176 1.00 30.11 O ATOM 345 CB SER A 23 12.190 31.900 -9.548 1.00 5.22 C ATOM 346 OG SER A 23 13.497 31.603 -10.009 1.00 20.11 O ATOM 0 H SER A 23 10.622 30.851 -11.135 1.00 44.50 H new ATOM 0 HA SER A 23 10.745 33.404 -10.068 1.00 12.12 H new ATOM 0 HB2 SER A 23 12.249 32.457 -8.613 1.00 5.22 H new ATOM 0 HB3 SER A 23 11.657 30.974 -9.334 1.00 5.22 H new ATOM 0 HG SER A 23 13.447 30.947 -10.735 1.00 20.11 H new ATOM 352 N LEU A 24 12.933 32.888 -12.464 1.00 40.13 N ATOM 353 CA LEU A 24 13.875 33.550 -13.360 1.00 50.22 C ATOM 354 C LEU A 24 13.267 34.819 -13.948 1.00 52.43 C ATOM 355 O LEU A 24 13.923 35.858 -14.021 1.00 61.22 O ATOM 356 CB LEU A 24 14.292 32.602 -14.486 1.00 35.33 C ATOM 357 CG LEU A 24 15.674 32.846 -15.092 1.00 20.43 C ATOM 358 CD1 LEU A 24 16.021 31.750 -16.087 1.00 62.34 C ATOM 359 CD2 LEU A 24 15.730 34.212 -15.759 1.00 4.23 C ATOM 0 H LEU A 24 12.745 31.912 -12.695 1.00 40.13 H new ATOM 0 HA LEU A 24 14.756 33.826 -12.781 1.00 50.22 H new ATOM 0 HB2 LEU A 24 14.260 31.581 -14.105 1.00 35.33 H new ATOM 0 HB3 LEU A 24 13.551 32.669 -15.283 1.00 35.33 H new ATOM 0 HG LEU A 24 16.411 32.826 -14.289 1.00 20.43 H new ATOM 0 HD11 LEU A 24 17.008 31.940 -16.508 1.00 62.34 H new ATOM 0 HD12 LEU A 24 16.023 30.785 -15.580 1.00 62.34 H new ATOM 0 HD13 LEU A 24 15.281 31.738 -16.887 1.00 62.34 H new ATOM 0 HD21 LEU A 24 16.721 34.369 -16.185 1.00 4.23 H new ATOM 0 HD22 LEU A 24 14.983 34.261 -16.551 1.00 4.23 H new ATOM 0 HD23 LEU A 24 15.526 34.987 -15.020 1.00 4.23 H new ATOM 371 N ALA A 25 12.008 34.728 -14.365 1.00 10.34 N ATOM 372 CA ALA A 25 11.310 35.870 -14.942 1.00 51.11 C ATOM 373 C ALA A 25 11.079 36.958 -13.898 1.00 62.25 C ATOM 374 O ALA A 25 11.044 38.145 -14.223 1.00 43.02 O ATOM 375 CB ALA A 25 9.986 35.428 -15.548 1.00 30.02 C ATOM 0 H ALA A 25 11.451 33.875 -14.314 1.00 10.34 H new ATOM 0 HA ALA A 25 11.937 36.287 -15.730 1.00 51.11 H new ATOM 0 HB1 ALA A 25 9.475 36.291 -15.975 1.00 30.02 H new ATOM 0 HB2 ALA A 25 10.172 34.692 -16.330 1.00 30.02 H new ATOM 0 HB3 ALA A 25 9.361 34.984 -14.773 1.00 30.02 H new ATOM 381 N ILE A 26 10.922 36.545 -12.645 1.00 72.04 N ATOM 382 CA ILE A 26 10.695 37.485 -11.555 1.00 11.02 C ATOM 383 C ILE A 26 11.981 38.214 -11.181 1.00 51.31 C ATOM 384 O ILE A 26 11.976 39.423 -10.946 1.00 1.50 O ATOM 385 CB ILE A 26 10.139 36.775 -10.306 1.00 42.11 C ATOM 386 CG1 ILE A 26 8.733 36.239 -10.581 1.00 31.30 C ATOM 387 CG2 ILE A 26 10.127 37.725 -9.118 1.00 53.51 C ATOM 388 CD1 ILE A 26 8.238 35.273 -9.527 1.00 13.40 C ATOM 0 H ILE A 26 10.948 35.566 -12.360 1.00 72.04 H new ATOM 0 HA ILE A 26 9.960 38.208 -11.910 1.00 11.02 H new ATOM 0 HB ILE A 26 10.788 35.933 -10.066 1.00 42.11 H new ATOM 0 HG12 ILE A 26 8.040 37.078 -10.648 1.00 31.30 H new ATOM 0 HG13 ILE A 26 8.726 35.741 -11.551 1.00 31.30 H new ATOM 0 HG21 ILE A 26 9.732 37.209 -8.243 1.00 53.51 H new ATOM 0 HG22 ILE A 26 11.143 38.063 -8.912 1.00 53.51 H new ATOM 0 HG23 ILE A 26 9.498 38.585 -9.347 1.00 53.51 H new ATOM 0 HD11 ILE A 26 7.235 34.934 -9.787 1.00 13.40 H new ATOM 0 HD12 ILE A 26 8.909 34.416 -9.475 1.00 13.40 H new ATOM 0 HD13 ILE A 26 8.212 35.773 -8.559 1.00 13.40 H new ATOM 400 N LEU A 27 13.082 37.472 -11.130 1.00 14.42 N ATOM 401 CA LEU A 27 14.377 38.048 -10.787 1.00 2.44 C ATOM 402 C LEU A 27 14.759 39.153 -11.767 1.00 13.24 C ATOM 403 O LEU A 27 15.414 40.127 -11.396 1.00 13.51 O ATOM 404 CB LEU A 27 15.455 36.962 -10.780 1.00 54.41 C ATOM 405 CG LEU A 27 16.081 36.647 -9.422 1.00 4.05 C ATOM 406 CD1 LEU A 27 15.298 35.552 -8.714 1.00 3.24 C ATOM 407 CD2 LEU A 27 17.538 36.241 -9.588 1.00 24.22 C ATOM 0 H LEU A 27 13.103 36.470 -11.322 1.00 14.42 H new ATOM 0 HA LEU A 27 14.301 38.482 -9.790 1.00 2.44 H new ATOM 0 HB2 LEU A 27 15.021 36.045 -11.179 1.00 54.41 H new ATOM 0 HB3 LEU A 27 16.250 37.262 -11.463 1.00 54.41 H new ATOM 0 HG LEU A 27 16.043 37.547 -8.808 1.00 4.05 H new ATOM 0 HD11 LEU A 27 15.759 35.341 -7.749 1.00 3.24 H new ATOM 0 HD12 LEU A 27 14.270 35.880 -8.561 1.00 3.24 H new ATOM 0 HD13 LEU A 27 15.304 34.648 -9.324 1.00 3.24 H new ATOM 0 HD21 LEU A 27 17.968 36.020 -8.611 1.00 24.22 H new ATOM 0 HD22 LEU A 27 17.599 35.355 -10.220 1.00 24.22 H new ATOM 0 HD23 LEU A 27 18.092 37.057 -10.052 1.00 24.22 H new ATOM 419 N VAL A 28 14.343 38.996 -13.019 1.00 74.13 N ATOM 420 CA VAL A 28 14.638 39.981 -14.052 1.00 53.54 C ATOM 421 C VAL A 28 13.762 41.219 -13.897 1.00 54.50 C ATOM 422 O VAL A 28 14.258 42.346 -13.877 1.00 50.03 O ATOM 423 CB VAL A 28 14.434 39.395 -15.462 1.00 13.30 C ATOM 424 CG1 VAL A 28 14.469 40.498 -16.509 1.00 71.22 C ATOM 425 CG2 VAL A 28 15.486 38.336 -15.755 1.00 55.24 C ATOM 0 H VAL A 28 13.800 38.195 -13.343 1.00 74.13 H new ATOM 0 HA VAL A 28 15.684 40.262 -13.931 1.00 53.54 H new ATOM 0 HB VAL A 28 13.453 38.921 -15.502 1.00 13.30 H new ATOM 0 HG11 VAL A 28 14.323 40.065 -17.499 1.00 71.22 H new ATOM 0 HG12 VAL A 28 13.675 41.217 -16.307 1.00 71.22 H new ATOM 0 HG13 VAL A 28 15.434 41.004 -16.473 1.00 71.22 H new ATOM 0 HG21 VAL A 28 15.327 37.932 -16.755 1.00 55.24 H new ATOM 0 HG22 VAL A 28 16.478 38.783 -15.697 1.00 55.24 H new ATOM 0 HG23 VAL A 28 15.407 37.532 -15.023 1.00 55.24 H new ATOM 435 N PHE A 29 12.455 41.003 -13.786 1.00 61.15 N ATOM 436 CA PHE A 29 11.508 42.101 -13.633 1.00 44.41 C ATOM 437 C PHE A 29 11.792 42.890 -12.358 1.00 21.22 C ATOM 438 O PHE A 29 11.513 44.086 -12.280 1.00 13.44 O ATOM 439 CB PHE A 29 10.075 41.567 -13.608 1.00 12.43 C ATOM 440 CG PHE A 29 9.495 41.341 -14.975 1.00 11.53 C ATOM 441 CD1 PHE A 29 9.439 42.374 -15.897 1.00 74.21 C ATOM 442 CD2 PHE A 29 9.006 40.097 -15.337 1.00 73.21 C ATOM 443 CE1 PHE A 29 8.906 42.169 -17.156 1.00 50.21 C ATOM 444 CE2 PHE A 29 8.472 39.886 -16.595 1.00 5.14 C ATOM 445 CZ PHE A 29 8.421 40.924 -17.505 1.00 24.22 C ATOM 0 H PHE A 29 12.028 40.077 -13.799 1.00 61.15 H new ATOM 0 HA PHE A 29 11.624 42.769 -14.486 1.00 44.41 H new ATOM 0 HB2 PHE A 29 10.055 40.628 -13.054 1.00 12.43 H new ATOM 0 HB3 PHE A 29 9.443 42.270 -13.066 1.00 12.43 H new ATOM 0 HD1 PHE A 29 9.816 43.350 -15.629 1.00 74.21 H new ATOM 0 HD2 PHE A 29 9.042 39.282 -14.629 1.00 73.21 H new ATOM 0 HE1 PHE A 29 8.869 42.982 -17.866 1.00 50.21 H new ATOM 0 HE2 PHE A 29 8.095 38.911 -16.866 1.00 5.14 H new ATOM 0 HZ PHE A 29 8.003 40.762 -18.487 1.00 24.22 H new ATOM 455 N TYR A 30 12.348 42.210 -11.361 1.00 41.40 N ATOM 456 CA TYR A 30 12.667 42.845 -10.088 1.00 1.32 C ATOM 457 C TYR A 30 13.997 43.589 -10.168 1.00 32.12 C ATOM 458 O TYR A 30 14.114 44.727 -9.711 1.00 51.04 O ATOM 459 CB TYR A 30 12.721 41.800 -8.972 1.00 52.22 C ATOM 460 CG TYR A 30 11.403 41.611 -8.256 1.00 11.14 C ATOM 461 CD1 TYR A 30 10.198 41.701 -8.941 1.00 52.45 C ATOM 462 CD2 TYR A 30 11.362 41.343 -6.893 1.00 4.10 C ATOM 463 CE1 TYR A 30 8.991 41.530 -8.291 1.00 41.10 C ATOM 464 CE2 TYR A 30 10.161 41.169 -6.235 1.00 34.14 C ATOM 465 CZ TYR A 30 8.978 41.264 -6.938 1.00 33.52 C ATOM 466 OH TYR A 30 7.778 41.092 -6.285 1.00 44.03 O ATOM 0 H TYR A 30 12.587 41.220 -11.410 1.00 41.40 H new ATOM 0 HA TYR A 30 11.881 43.566 -9.864 1.00 1.32 H new ATOM 0 HB2 TYR A 30 13.036 40.846 -9.394 1.00 52.22 H new ATOM 0 HB3 TYR A 30 13.480 42.094 -8.247 1.00 52.22 H new ATOM 0 HD1 TYR A 30 10.205 41.908 -10.001 1.00 52.45 H new ATOM 0 HD2 TYR A 30 12.286 41.270 -6.339 1.00 4.10 H new ATOM 0 HE1 TYR A 30 8.063 41.604 -8.839 1.00 41.10 H new ATOM 0 HE2 TYR A 30 10.148 40.960 -5.176 1.00 34.14 H new ATOM 0 HH TYR A 30 7.945 40.911 -5.336 1.00 44.03 H new ATOM 476 N LEU A 31 14.997 42.938 -10.752 1.00 32.24 N ATOM 477 CA LEU A 31 16.320 43.536 -10.893 1.00 72.05 C ATOM 478 C LEU A 31 16.761 43.542 -12.354 1.00 12.14 C ATOM 479 O LEU A 31 17.666 42.812 -12.757 1.00 70.43 O ATOM 480 CB LEU A 31 17.339 42.775 -10.044 1.00 60.31 C ATOM 481 CG LEU A 31 17.429 43.187 -8.574 1.00 61.43 C ATOM 482 CD1 LEU A 31 16.361 42.479 -7.755 1.00 72.12 C ATOM 483 CD2 LEU A 31 18.814 42.887 -8.020 1.00 63.33 C ATOM 0 H LEU A 31 14.917 41.996 -11.135 1.00 32.24 H new ATOM 0 HA LEU A 31 16.265 44.567 -10.544 1.00 72.05 H new ATOM 0 HB2 LEU A 31 17.098 41.713 -10.089 1.00 60.31 H new ATOM 0 HB3 LEU A 31 18.323 42.898 -10.496 1.00 60.31 H new ATOM 0 HG LEU A 31 17.257 44.261 -8.506 1.00 61.43 H new ATOM 0 HD11 LEU A 31 16.440 42.784 -6.712 1.00 72.12 H new ATOM 0 HD12 LEU A 31 15.375 42.744 -8.137 1.00 72.12 H new ATOM 0 HD13 LEU A 31 16.501 41.401 -7.829 1.00 72.12 H new ATOM 0 HD21 LEU A 31 18.860 43.187 -6.973 1.00 63.33 H new ATOM 0 HD22 LEU A 31 19.015 41.819 -8.101 1.00 63.33 H new ATOM 0 HD23 LEU A 31 19.561 43.441 -8.589 1.00 63.33 H new ATOM 495 N PRO A 32 16.109 44.387 -13.166 1.00 13.45 N ATOM 496 CA PRO A 32 16.418 44.511 -14.593 1.00 5.40 C ATOM 497 C PRO A 32 17.773 45.167 -14.837 1.00 43.13 C ATOM 498 O PRO A 32 17.999 46.312 -14.447 1.00 12.43 O ATOM 499 CB PRO A 32 15.291 45.400 -15.125 1.00 31.42 C ATOM 500 CG PRO A 32 14.841 46.188 -13.944 1.00 35.14 C ATOM 501 CD PRO A 32 15.019 45.288 -12.752 1.00 61.35 C ATOM 0 HA PRO A 32 16.479 43.539 -15.082 1.00 5.40 H new ATOM 0 HB2 PRO A 32 15.644 46.051 -15.924 1.00 31.42 H new ATOM 0 HB3 PRO A 32 14.477 44.803 -15.536 1.00 31.42 H new ATOM 0 HG2 PRO A 32 15.429 47.099 -13.836 1.00 35.14 H new ATOM 0 HG3 PRO A 32 13.800 46.492 -14.051 1.00 35.14 H new ATOM 0 HD2 PRO A 32 15.282 45.853 -11.858 1.00 61.35 H new ATOM 0 HD3 PRO A 32 14.106 44.737 -12.524 1.00 61.35 H new ATOM 509 N SER A 33 18.672 44.434 -15.486 1.00 61.33 N ATOM 510 CA SER A 33 20.006 44.943 -15.780 1.00 5.23 C ATOM 511 C SER A 33 20.109 45.391 -17.235 1.00 23.14 C ATOM 512 O SER A 33 20.997 46.163 -17.597 1.00 1.13 O ATOM 513 CB SER A 33 21.060 43.873 -15.488 1.00 32.30 C ATOM 514 OG SER A 33 21.492 43.244 -16.682 1.00 44.21 O ATOM 0 H SER A 33 18.500 43.485 -15.818 1.00 61.33 H new ATOM 0 HA SER A 33 20.187 45.806 -15.139 1.00 5.23 H new ATOM 0 HB2 SER A 33 21.913 44.326 -14.983 1.00 32.30 H new ATOM 0 HB3 SER A 33 20.647 43.127 -14.809 1.00 32.30 H new ATOM 0 HG SER A 33 22.166 42.566 -16.469 1.00 44.21 H new ATOM 520 N ASP A 34 19.195 44.900 -18.064 1.00 12.22 N ATOM 521 CA ASP A 34 19.180 45.250 -19.480 1.00 24.54 C ATOM 522 C ASP A 34 17.787 45.692 -19.916 1.00 62.30 C ATOM 523 O ASP A 34 16.838 45.651 -19.132 1.00 4.51 O ATOM 524 CB ASP A 34 19.640 44.060 -20.325 1.00 12.42 C ATOM 525 CG ASP A 34 21.121 44.113 -20.642 1.00 4.34 C ATOM 526 OD1 ASP A 34 21.572 45.136 -21.199 1.00 24.24 O ATOM 527 OD2 ASP A 34 21.830 43.132 -20.333 1.00 71.13 O ATOM 0 H ASP A 34 18.455 44.258 -17.780 1.00 12.22 H new ATOM 0 HA ASP A 34 19.868 46.081 -19.632 1.00 24.54 H new ATOM 0 HB2 ASP A 34 19.418 43.134 -19.794 1.00 12.42 H new ATOM 0 HB3 ASP A 34 19.073 44.038 -21.256 1.00 12.42 H new ATOM 532 N CYS A 35 17.672 46.114 -21.170 1.00 62.02 N ATOM 533 CA CYS A 35 16.395 46.566 -21.711 1.00 31.04 C ATOM 534 C CYS A 35 15.866 45.583 -22.749 1.00 75.44 C ATOM 535 O CYS A 35 14.675 45.572 -23.059 1.00 40.23 O ATOM 536 CB CYS A 35 16.544 47.954 -22.334 1.00 41.34 C ATOM 537 SG CYS A 35 16.709 49.292 -21.129 1.00 23.54 S ATOM 0 H CYS A 35 18.447 46.153 -21.831 1.00 62.02 H new ATOM 0 HA CYS A 35 15.679 46.619 -20.891 1.00 31.04 H new ATOM 0 HB2 CYS A 35 17.418 47.956 -22.985 1.00 41.34 H new ATOM 0 HB3 CYS A 35 15.677 48.152 -22.964 1.00 41.34 H new ATOM 0 HG CYS A 35 16.832 50.426 -21.753 1.00 23.54 H new ATOM 543 N GLY A 36 16.760 44.757 -23.286 1.00 12.44 N ATOM 544 CA GLY A 36 16.364 43.783 -24.285 1.00 70.23 C ATOM 545 C GLY A 36 16.343 42.369 -23.740 1.00 64.40 C ATOM 546 O GLY A 36 15.996 41.427 -24.452 1.00 53.54 O ATOM 0 H GLY A 36 17.751 44.746 -23.046 1.00 12.44 H new ATOM 0 HA2 GLY A 36 15.374 44.038 -24.664 1.00 70.23 H new ATOM 0 HA3 GLY A 36 17.051 43.833 -25.130 1.00 70.23 H new ATOM 550 N GLU A 37 16.719 42.219 -22.473 1.00 74.35 N ATOM 551 CA GLU A 37 16.744 40.908 -21.835 1.00 32.00 C ATOM 552 C GLU A 37 15.336 40.329 -21.726 1.00 22.22 C ATOM 553 O GLU A 37 15.145 39.114 -21.790 1.00 42.22 O ATOM 554 CB GLU A 37 17.376 41.005 -20.445 1.00 43.21 C ATOM 555 CG GLU A 37 17.789 39.661 -19.869 1.00 1.21 C ATOM 556 CD GLU A 37 18.438 39.786 -18.504 1.00 15.11 C ATOM 557 OE1 GLU A 37 17.744 40.208 -17.555 1.00 31.54 O ATOM 558 OE2 GLU A 37 19.638 39.463 -18.385 1.00 33.03 O ATOM 0 H GLU A 37 17.010 42.988 -21.869 1.00 74.35 H new ATOM 0 HA GLU A 37 17.345 40.242 -22.454 1.00 32.00 H new ATOM 0 HB2 GLU A 37 18.251 41.653 -20.497 1.00 43.21 H new ATOM 0 HB3 GLU A 37 16.668 41.480 -19.766 1.00 43.21 H new ATOM 0 HG2 GLU A 37 16.912 39.018 -19.793 1.00 1.21 H new ATOM 0 HG3 GLU A 37 18.483 39.174 -20.554 1.00 1.21 H new ATOM 565 N LYS A 38 14.353 41.207 -21.560 1.00 31.24 N ATOM 566 CA LYS A 38 12.962 40.785 -21.442 1.00 0.41 C ATOM 567 C LYS A 38 12.550 39.930 -22.636 1.00 13.33 C ATOM 568 O LYS A 38 12.079 38.805 -22.472 1.00 1.11 O ATOM 569 CB LYS A 38 12.045 42.006 -21.334 1.00 42.04 C ATOM 570 CG LYS A 38 11.676 42.365 -19.906 1.00 13.34 C ATOM 571 CD LYS A 38 12.908 42.677 -19.073 1.00 33.55 C ATOM 572 CE LYS A 38 12.556 43.505 -17.846 1.00 25.51 C ATOM 573 NZ LYS A 38 13.095 44.890 -17.939 1.00 72.21 N ATOM 0 H LYS A 38 14.494 42.216 -21.504 1.00 31.24 H new ATOM 0 HA LYS A 38 12.865 40.185 -20.537 1.00 0.41 H new ATOM 0 HB2 LYS A 38 12.536 42.861 -21.799 1.00 42.04 H new ATOM 0 HB3 LYS A 38 11.133 41.816 -21.899 1.00 42.04 H new ATOM 0 HG2 LYS A 38 11.009 43.227 -19.907 1.00 13.34 H new ATOM 0 HG3 LYS A 38 11.128 41.539 -19.452 1.00 13.34 H new ATOM 0 HD2 LYS A 38 13.383 41.747 -18.762 1.00 33.55 H new ATOM 0 HD3 LYS A 38 13.633 43.217 -19.682 1.00 33.55 H new ATOM 0 HE2 LYS A 38 11.473 43.544 -17.732 1.00 25.51 H new ATOM 0 HE3 LYS A 38 12.953 43.020 -16.954 1.00 25.51 H new ATOM 0 HZ1 LYS A 38 12.834 45.422 -17.084 1.00 72.21 H new ATOM 0 HZ2 LYS A 38 14.131 44.854 -18.022 1.00 72.21 H new ATOM 0 HZ3 LYS A 38 12.697 45.362 -18.776 1.00 72.21 H new ATOM 587 N MET A 39 12.731 40.471 -23.836 1.00 50.21 N ATOM 588 CA MET A 39 12.380 39.756 -25.057 1.00 71.43 C ATOM 589 C MET A 39 13.072 38.397 -25.109 1.00 53.13 C ATOM 590 O MET A 39 12.434 37.373 -25.356 1.00 62.33 O ATOM 591 CB MET A 39 12.762 40.583 -26.286 1.00 72.23 C ATOM 592 CG MET A 39 11.617 41.417 -26.837 1.00 74.23 C ATOM 593 SD MET A 39 11.343 41.143 -28.598 1.00 54.12 S ATOM 594 CE MET A 39 9.885 40.103 -28.556 1.00 62.44 C ATOM 0 H MET A 39 13.119 41.402 -23.989 1.00 50.21 H new ATOM 0 HA MET A 39 11.302 39.596 -25.057 1.00 71.43 H new ATOM 0 HB2 MET A 39 13.590 41.243 -26.027 1.00 72.23 H new ATOM 0 HB3 MET A 39 13.121 39.913 -27.067 1.00 72.23 H new ATOM 0 HG2 MET A 39 10.704 41.180 -26.290 1.00 74.23 H new ATOM 0 HG3 MET A 39 11.827 42.473 -26.666 1.00 74.23 H new ATOM 0 HE1 MET A 39 9.591 39.848 -29.574 1.00 62.44 H new ATOM 0 HE2 MET A 39 10.105 39.190 -28.002 1.00 62.44 H new ATOM 0 HE3 MET A 39 9.071 40.637 -28.066 1.00 62.44 H new ATOM 604 N THR A 40 14.380 38.395 -24.875 1.00 64.13 N ATOM 605 CA THR A 40 15.159 37.163 -24.897 1.00 73.21 C ATOM 606 C THR A 40 14.594 36.138 -23.920 1.00 12.43 C ATOM 607 O THR A 40 14.685 34.931 -24.148 1.00 3.33 O ATOM 608 CB THR A 40 16.636 37.426 -24.551 1.00 24.44 C ATOM 609 OG1 THR A 40 17.280 38.105 -25.634 1.00 63.24 O ATOM 610 CG2 THR A 40 17.364 36.122 -24.259 1.00 32.22 C ATOM 0 H THR A 40 14.923 39.233 -24.668 1.00 64.13 H new ATOM 0 HA THR A 40 15.096 36.767 -25.911 1.00 73.21 H new ATOM 0 HB THR A 40 16.671 38.051 -23.659 1.00 24.44 H new ATOM 0 HG1 THR A 40 18.218 38.270 -25.405 1.00 63.24 H new ATOM 0 HG21 THR A 40 18.406 36.333 -24.017 1.00 32.22 H new ATOM 0 HG22 THR A 40 16.890 35.622 -23.415 1.00 32.22 H new ATOM 0 HG23 THR A 40 17.319 35.476 -25.136 1.00 32.22 H new ATOM 618 N LEU A 41 14.009 36.626 -22.831 1.00 42.01 N ATOM 619 CA LEU A 41 13.428 35.752 -21.818 1.00 72.11 C ATOM 620 C LEU A 41 12.161 35.082 -22.340 1.00 32.44 C ATOM 621 O LEU A 41 11.957 33.882 -22.146 1.00 53.44 O ATOM 622 CB LEU A 41 13.113 36.547 -20.550 1.00 12.20 C ATOM 623 CG LEU A 41 13.165 35.765 -19.237 1.00 52.20 C ATOM 624 CD1 LEU A 41 13.195 36.716 -18.050 1.00 60.14 C ATOM 625 CD2 LEU A 41 11.979 34.817 -19.133 1.00 52.44 C ATOM 0 H LEU A 41 13.925 37.622 -22.627 1.00 42.01 H new ATOM 0 HA LEU A 41 14.156 34.976 -21.581 1.00 72.11 H new ATOM 0 HB2 LEU A 41 13.815 37.378 -20.483 1.00 12.20 H new ATOM 0 HB3 LEU A 41 12.117 36.978 -20.654 1.00 12.20 H new ATOM 0 HG LEU A 41 14.080 35.173 -19.225 1.00 52.20 H new ATOM 0 HD11 LEU A 41 13.232 36.142 -17.124 1.00 60.14 H new ATOM 0 HD12 LEU A 41 14.077 37.354 -18.117 1.00 60.14 H new ATOM 0 HD13 LEU A 41 12.298 37.335 -18.057 1.00 60.14 H new ATOM 0 HD21 LEU A 41 12.033 34.269 -18.192 1.00 52.44 H new ATOM 0 HD22 LEU A 41 11.052 35.389 -19.167 1.00 52.44 H new ATOM 0 HD23 LEU A 41 12.002 34.113 -19.965 1.00 52.44 H new ATOM 637 N CYS A 42 11.315 35.862 -23.002 1.00 52.23 N ATOM 638 CA CYS A 42 10.068 35.344 -23.553 1.00 72.35 C ATOM 639 C CYS A 42 10.324 34.109 -24.411 1.00 23.42 C ATOM 640 O CYS A 42 9.573 33.135 -24.354 1.00 72.31 O ATOM 641 CB CYS A 42 9.367 36.420 -24.384 1.00 71.53 C ATOM 642 SG CYS A 42 8.214 35.767 -25.615 1.00 42.33 S ATOM 0 H CYS A 42 11.470 36.856 -23.171 1.00 52.23 H new ATOM 0 HA CYS A 42 9.423 35.060 -22.722 1.00 72.35 H new ATOM 0 HB2 CYS A 42 8.826 37.087 -23.713 1.00 71.53 H new ATOM 0 HB3 CYS A 42 10.121 37.021 -24.891 1.00 71.53 H new ATOM 0 HG CYS A 42 7.670 36.752 -26.265 1.00 42.33 H new ATOM 648 N ILE A 43 11.389 34.157 -25.205 1.00 35.31 N ATOM 649 CA ILE A 43 11.743 33.042 -26.074 1.00 62.14 C ATOM 650 C ILE A 43 12.322 31.881 -25.272 1.00 53.31 C ATOM 651 O ILE A 43 12.211 30.722 -25.670 1.00 62.13 O ATOM 652 CB ILE A 43 12.762 33.467 -27.148 1.00 2.40 C ATOM 653 CG1 ILE A 43 12.161 34.543 -28.055 1.00 2.43 C ATOM 654 CG2 ILE A 43 13.203 32.263 -27.966 1.00 43.24 C ATOM 655 CD1 ILE A 43 11.087 34.021 -28.982 1.00 73.24 C ATOM 0 H ILE A 43 12.021 34.956 -25.264 1.00 35.31 H new ATOM 0 HA ILE A 43 10.824 32.720 -26.563 1.00 62.14 H new ATOM 0 HB ILE A 43 13.638 33.885 -26.651 1.00 2.40 H new ATOM 0 HG12 ILE A 43 11.741 35.336 -27.436 1.00 2.43 H new ATOM 0 HG13 ILE A 43 12.957 34.991 -28.650 1.00 2.43 H new ATOM 0 HG21 ILE A 43 13.923 32.580 -28.721 1.00 43.24 H new ATOM 0 HG22 ILE A 43 13.666 31.527 -27.309 1.00 43.24 H new ATOM 0 HG23 ILE A 43 12.336 31.818 -28.455 1.00 43.24 H new ATOM 0 HD11 ILE A 43 10.707 34.838 -29.595 1.00 73.24 H new ATOM 0 HD12 ILE A 43 11.507 33.249 -29.627 1.00 73.24 H new ATOM 0 HD13 ILE A 43 10.272 33.599 -28.394 1.00 73.24 H new ATOM 667 N SER A 44 12.938 32.202 -24.139 1.00 34.45 N ATOM 668 CA SER A 44 13.536 31.186 -23.280 1.00 73.21 C ATOM 669 C SER A 44 12.460 30.319 -22.634 1.00 34.42 C ATOM 670 O SER A 44 12.432 29.102 -22.819 1.00 25.23 O ATOM 671 CB SER A 44 14.395 31.843 -22.198 1.00 54.43 C ATOM 672 OG SER A 44 15.716 31.332 -22.215 1.00 70.42 O ATOM 0 H SER A 44 13.036 33.157 -23.794 1.00 34.45 H new ATOM 0 HA SER A 44 14.168 30.549 -23.899 1.00 73.21 H new ATOM 0 HB2 SER A 44 14.417 32.922 -22.352 1.00 54.43 H new ATOM 0 HB3 SER A 44 13.947 31.670 -21.219 1.00 54.43 H new ATOM 0 HG SER A 44 16.245 31.769 -21.515 1.00 70.42 H new ATOM 678 N VAL A 45 11.573 30.954 -21.874 1.00 43.50 N ATOM 679 CA VAL A 45 10.494 30.243 -21.200 1.00 73.03 C ATOM 680 C VAL A 45 9.673 29.424 -22.191 1.00 24.15 C ATOM 681 O VAL A 45 9.162 28.354 -21.855 1.00 44.45 O ATOM 682 CB VAL A 45 9.559 31.215 -20.457 1.00 11.33 C ATOM 683 CG1 VAL A 45 9.000 32.256 -21.414 1.00 51.44 C ATOM 684 CG2 VAL A 45 8.436 30.453 -19.770 1.00 12.45 C ATOM 0 H VAL A 45 11.581 31.961 -21.710 1.00 43.50 H new ATOM 0 HA VAL A 45 10.960 29.574 -20.476 1.00 73.03 H new ATOM 0 HB VAL A 45 10.137 31.734 -19.692 1.00 11.33 H new ATOM 0 HG11 VAL A 45 8.342 32.934 -20.870 1.00 51.44 H new ATOM 0 HG12 VAL A 45 9.820 32.823 -21.855 1.00 51.44 H new ATOM 0 HG13 VAL A 45 8.437 31.759 -22.204 1.00 51.44 H new ATOM 0 HG21 VAL A 45 7.785 31.155 -19.250 1.00 12.45 H new ATOM 0 HG22 VAL A 45 7.858 29.906 -20.515 1.00 12.45 H new ATOM 0 HG23 VAL A 45 8.859 29.751 -19.052 1.00 12.45 H new ATOM 694 N LEU A 46 9.551 29.932 -23.412 1.00 4.12 N ATOM 695 CA LEU A 46 8.793 29.247 -24.453 1.00 50.41 C ATOM 696 C LEU A 46 9.446 27.918 -24.817 1.00 35.42 C ATOM 697 O LEU A 46 8.767 26.900 -24.962 1.00 71.13 O ATOM 698 CB LEU A 46 8.683 30.132 -25.696 1.00 61.45 C ATOM 699 CG LEU A 46 7.334 30.113 -26.417 1.00 23.44 C ATOM 700 CD1 LEU A 46 6.301 30.908 -25.635 1.00 15.03 C ATOM 701 CD2 LEU A 46 7.476 30.662 -27.829 1.00 31.43 C ATOM 0 H LEU A 46 9.967 30.816 -23.706 1.00 4.12 H new ATOM 0 HA LEU A 46 7.793 29.046 -24.068 1.00 50.41 H new ATOM 0 HB2 LEU A 46 8.903 31.160 -25.406 1.00 61.45 H new ATOM 0 HB3 LEU A 46 9.455 29.828 -26.403 1.00 61.45 H new ATOM 0 HG LEU A 46 6.993 29.080 -26.484 1.00 23.44 H new ATOM 0 HD11 LEU A 46 5.348 30.884 -26.163 1.00 15.03 H new ATOM 0 HD12 LEU A 46 6.179 30.470 -24.644 1.00 15.03 H new ATOM 0 HD13 LEU A 46 6.635 31.941 -25.537 1.00 15.03 H new ATOM 0 HD21 LEU A 46 6.507 30.641 -28.327 1.00 31.43 H new ATOM 0 HD22 LEU A 46 7.839 31.689 -27.785 1.00 31.43 H new ATOM 0 HD23 LEU A 46 8.184 30.050 -28.388 1.00 31.43 H new ATOM 713 N LEU A 47 10.766 27.932 -24.960 1.00 41.34 N ATOM 714 CA LEU A 47 11.512 26.727 -25.305 1.00 33.30 C ATOM 715 C LEU A 47 11.287 25.632 -24.266 1.00 45.34 C ATOM 716 O LEU A 47 11.159 24.457 -24.607 1.00 23.32 O ATOM 717 CB LEU A 47 13.005 27.041 -25.417 1.00 15.21 C ATOM 718 CG LEU A 47 13.691 26.588 -26.706 1.00 50.41 C ATOM 719 CD1 LEU A 47 15.186 26.860 -26.639 1.00 31.35 C ATOM 720 CD2 LEU A 47 13.426 25.112 -26.961 1.00 60.21 C ATOM 0 H LEU A 47 11.343 28.765 -24.842 1.00 41.34 H new ATOM 0 HA LEU A 47 11.150 26.369 -26.269 1.00 33.30 H new ATOM 0 HB2 LEU A 47 13.138 28.118 -25.318 1.00 15.21 H new ATOM 0 HB3 LEU A 47 13.518 26.578 -24.574 1.00 15.21 H new ATOM 0 HG LEU A 47 13.276 27.159 -27.536 1.00 50.41 H new ATOM 0 HD11 LEU A 47 15.658 26.531 -27.565 1.00 31.35 H new ATOM 0 HD12 LEU A 47 15.356 27.928 -26.505 1.00 31.35 H new ATOM 0 HD13 LEU A 47 15.618 26.316 -25.799 1.00 31.35 H new ATOM 0 HD21 LEU A 47 13.922 24.807 -27.883 1.00 60.21 H new ATOM 0 HD22 LEU A 47 13.813 24.524 -26.129 1.00 60.21 H new ATOM 0 HD23 LEU A 47 12.353 24.946 -27.054 1.00 60.21 H new ATOM 732 N ALA A 48 11.239 26.028 -22.999 1.00 21.15 N ATOM 733 CA ALA A 48 11.026 25.081 -21.911 1.00 11.53 C ATOM 734 C ALA A 48 9.726 24.307 -22.104 1.00 25.04 C ATOM 735 O ALA A 48 9.701 23.080 -21.995 1.00 12.34 O ATOM 736 CB ALA A 48 11.016 25.808 -20.574 1.00 22.43 C ATOM 0 H ALA A 48 11.345 26.998 -22.700 1.00 21.15 H new ATOM 0 HA ALA A 48 11.849 24.366 -21.918 1.00 11.53 H new ATOM 0 HB1 ALA A 48 10.856 25.089 -19.770 1.00 22.43 H new ATOM 0 HB2 ALA A 48 11.972 26.311 -20.426 1.00 22.43 H new ATOM 0 HB3 ALA A 48 10.213 26.545 -20.567 1.00 22.43 H new ATOM 742 N LEU A 49 8.649 25.030 -22.390 1.00 24.10 N ATOM 743 CA LEU A 49 7.345 24.410 -22.598 1.00 2.33 C ATOM 744 C LEU A 49 7.408 23.368 -23.709 1.00 63.15 C ATOM 745 O LEU A 49 6.762 22.322 -23.633 1.00 50.44 O ATOM 746 CB LEU A 49 6.302 25.475 -22.940 1.00 15.00 C ATOM 747 CG LEU A 49 4.995 25.413 -22.149 1.00 35.52 C ATOM 748 CD1 LEU A 49 4.089 26.576 -22.521 1.00 50.21 C ATOM 749 CD2 LEU A 49 4.288 24.086 -22.390 1.00 2.34 C ATOM 0 H LEU A 49 8.653 26.046 -22.483 1.00 24.10 H new ATOM 0 HA LEU A 49 7.056 23.910 -21.674 1.00 2.33 H new ATOM 0 HB2 LEU A 49 6.750 26.457 -22.786 1.00 15.00 H new ATOM 0 HB3 LEU A 49 6.065 25.396 -24.001 1.00 15.00 H new ATOM 0 HG LEU A 49 5.232 25.489 -21.088 1.00 35.52 H new ATOM 0 HD11 LEU A 49 3.164 26.514 -21.948 1.00 50.21 H new ATOM 0 HD12 LEU A 49 4.593 27.516 -22.297 1.00 50.21 H new ATOM 0 HD13 LEU A 49 3.860 26.532 -23.586 1.00 50.21 H new ATOM 0 HD21 LEU A 49 3.360 24.059 -21.819 1.00 2.34 H new ATOM 0 HD22 LEU A 49 4.064 23.980 -23.452 1.00 2.34 H new ATOM 0 HD23 LEU A 49 4.933 23.267 -22.072 1.00 2.34 H new ATOM 761 N THR A 50 8.193 23.659 -24.742 1.00 64.53 N ATOM 762 CA THR A 50 8.342 22.747 -25.869 1.00 64.34 C ATOM 763 C THR A 50 9.079 21.478 -25.456 1.00 62.34 C ATOM 764 O THR A 50 8.675 20.370 -25.811 1.00 5.02 O ATOM 765 CB THR A 50 9.101 23.412 -27.033 1.00 62.54 C ATOM 766 OG1 THR A 50 8.947 24.834 -26.970 1.00 72.31 O ATOM 767 CG2 THR A 50 8.593 22.900 -28.373 1.00 12.30 C ATOM 0 H THR A 50 8.735 24.519 -24.821 1.00 64.53 H new ATOM 0 HA THR A 50 7.337 22.488 -26.201 1.00 64.34 H new ATOM 0 HB THR A 50 10.157 23.158 -26.941 1.00 62.54 H new ATOM 0 HG1 THR A 50 9.434 25.249 -27.712 1.00 72.31 H new ATOM 0 HG21 THR A 50 9.144 23.384 -29.180 1.00 12.30 H new ATOM 0 HG22 THR A 50 8.739 21.821 -28.430 1.00 12.30 H new ATOM 0 HG23 THR A 50 7.532 23.128 -28.471 1.00 12.30 H new ATOM 775 N VAL A 51 10.162 21.646 -24.704 1.00 62.01 N ATOM 776 CA VAL A 51 10.955 20.513 -24.241 1.00 12.31 C ATOM 777 C VAL A 51 10.107 19.548 -23.420 1.00 53.04 C ATOM 778 O VAL A 51 10.284 18.332 -23.495 1.00 34.13 O ATOM 779 CB VAL A 51 12.153 20.977 -23.391 1.00 72.31 C ATOM 780 CG1 VAL A 51 12.756 19.804 -22.633 1.00 72.33 C ATOM 781 CG2 VAL A 51 13.198 21.650 -24.267 1.00 43.03 C ATOM 0 H VAL A 51 10.511 22.556 -24.402 1.00 62.01 H new ATOM 0 HA VAL A 51 11.325 20.001 -25.129 1.00 12.31 H new ATOM 0 HB VAL A 51 11.799 21.706 -22.662 1.00 72.31 H new ATOM 0 HG11 VAL A 51 13.601 20.151 -22.038 1.00 72.33 H new ATOM 0 HG12 VAL A 51 12.003 19.370 -21.975 1.00 72.33 H new ATOM 0 HG13 VAL A 51 13.097 19.049 -23.342 1.00 72.33 H new ATOM 0 HG21 VAL A 51 14.037 21.972 -23.650 1.00 43.03 H new ATOM 0 HG22 VAL A 51 13.550 20.945 -25.020 1.00 43.03 H new ATOM 0 HG23 VAL A 51 12.757 22.516 -24.759 1.00 43.03 H new ATOM 791 N PHE A 52 9.184 20.098 -22.638 1.00 3.03 N ATOM 792 CA PHE A 52 8.308 19.286 -21.802 1.00 31.22 C ATOM 793 C PHE A 52 7.365 18.445 -22.658 1.00 44.11 C ATOM 794 O PHE A 52 7.182 17.252 -22.412 1.00 1.10 O ATOM 795 CB PHE A 52 7.499 20.177 -20.857 1.00 54.15 C ATOM 796 CG PHE A 52 8.278 20.649 -19.663 1.00 62.15 C ATOM 797 CD1 PHE A 52 8.926 19.742 -18.840 1.00 51.20 C ATOM 798 CD2 PHE A 52 8.363 21.999 -19.364 1.00 52.23 C ATOM 799 CE1 PHE A 52 9.645 20.173 -17.741 1.00 15.03 C ATOM 800 CE2 PHE A 52 9.080 22.436 -18.267 1.00 22.14 C ATOM 801 CZ PHE A 52 9.721 21.522 -17.453 1.00 72.31 C ATOM 0 H PHE A 52 9.023 21.103 -22.566 1.00 3.03 H new ATOM 0 HA PHE A 52 8.931 18.614 -21.212 1.00 31.22 H new ATOM 0 HB2 PHE A 52 7.136 21.044 -21.410 1.00 54.15 H new ATOM 0 HB3 PHE A 52 6.622 19.628 -20.514 1.00 54.15 H new ATOM 0 HD1 PHE A 52 8.869 18.686 -19.060 1.00 51.20 H new ATOM 0 HD2 PHE A 52 7.863 22.718 -19.996 1.00 52.23 H new ATOM 0 HE1 PHE A 52 10.147 19.456 -17.108 1.00 15.03 H new ATOM 0 HE2 PHE A 52 9.139 23.491 -18.046 1.00 22.14 H new ATOM 0 HZ PHE A 52 10.280 21.861 -16.594 1.00 72.31 H new ATOM 811 N LEU A 53 6.769 19.075 -23.664 1.00 45.33 N ATOM 812 CA LEU A 53 5.845 18.387 -24.558 1.00 73.21 C ATOM 813 C LEU A 53 6.473 17.115 -25.117 1.00 65.52 C ATOM 814 O LEU A 53 5.952 16.015 -24.925 1.00 50.23 O ATOM 815 CB LEU A 53 5.429 19.310 -25.705 1.00 5.55 C ATOM 816 CG LEU A 53 3.958 19.726 -25.732 1.00 42.13 C ATOM 817 CD1 LEU A 53 3.753 20.900 -26.677 1.00 71.13 C ATOM 818 CD2 LEU A 53 3.080 18.552 -26.139 1.00 31.22 C ATOM 0 H LEU A 53 6.909 20.062 -23.881 1.00 45.33 H new ATOM 0 HA LEU A 53 4.961 18.112 -23.983 1.00 73.21 H new ATOM 0 HB2 LEU A 53 6.040 20.211 -25.659 1.00 5.55 H new ATOM 0 HB3 LEU A 53 5.663 18.814 -26.647 1.00 5.55 H new ATOM 0 HG LEU A 53 3.670 20.039 -24.729 1.00 42.13 H new ATOM 0 HD11 LEU A 53 2.700 21.182 -26.683 1.00 71.13 H new ATOM 0 HD12 LEU A 53 4.354 21.746 -26.342 1.00 71.13 H new ATOM 0 HD13 LEU A 53 4.058 20.614 -27.684 1.00 71.13 H new ATOM 0 HD21 LEU A 53 2.036 18.866 -26.153 1.00 31.22 H new ATOM 0 HD22 LEU A 53 3.369 18.209 -27.132 1.00 31.22 H new ATOM 0 HD23 LEU A 53 3.205 17.739 -25.424 1.00 31.22 H new ATOM 830 N LEU A 54 7.598 17.271 -25.808 1.00 35.43 N ATOM 831 CA LEU A 54 8.300 16.134 -26.393 1.00 72.13 C ATOM 832 C LEU A 54 8.735 15.148 -25.314 1.00 74.40 C ATOM 833 O LEU A 54 8.763 13.937 -25.539 1.00 74.11 O ATOM 834 CB LEU A 54 9.519 16.614 -27.183 1.00 21.05 C ATOM 835 CG LEU A 54 10.194 15.572 -28.075 1.00 21.33 C ATOM 836 CD1 LEU A 54 9.194 14.982 -29.057 1.00 21.20 C ATOM 837 CD2 LEU A 54 11.373 16.187 -28.815 1.00 73.43 C ATOM 0 H LEU A 54 8.043 18.173 -25.976 1.00 35.43 H new ATOM 0 HA LEU A 54 7.614 15.624 -27.069 1.00 72.13 H new ATOM 0 HB2 LEU A 54 9.215 17.454 -27.807 1.00 21.05 H new ATOM 0 HB3 LEU A 54 10.258 16.992 -26.477 1.00 21.05 H new ATOM 0 HG LEU A 54 10.568 14.767 -27.442 1.00 21.33 H new ATOM 0 HD11 LEU A 54 9.692 14.242 -29.684 1.00 21.20 H new ATOM 0 HD12 LEU A 54 8.383 14.505 -28.507 1.00 21.20 H new ATOM 0 HD13 LEU A 54 8.789 15.776 -29.685 1.00 21.20 H new ATOM 0 HD21 LEU A 54 11.842 15.431 -29.445 1.00 73.43 H new ATOM 0 HD22 LEU A 54 11.023 17.011 -29.437 1.00 73.43 H new ATOM 0 HD23 LEU A 54 12.100 16.560 -28.094 1.00 73.43 H new ATOM 849 N LEU A 55 9.071 15.673 -24.141 1.00 60.31 N ATOM 850 CA LEU A 55 9.502 14.838 -23.025 1.00 4.42 C ATOM 851 C LEU A 55 8.519 13.697 -22.787 1.00 23.34 C ATOM 852 O LEU A 55 8.853 12.527 -22.978 1.00 24.03 O ATOM 853 CB LEU A 55 9.640 15.681 -21.756 1.00 12.32 C ATOM 854 CG LEU A 55 11.017 15.675 -21.091 1.00 70.54 C ATOM 855 CD1 LEU A 55 11.370 17.063 -20.581 1.00 22.22 C ATOM 856 CD2 LEU A 55 11.057 14.661 -19.957 1.00 31.00 C ATOM 0 H LEU A 55 9.053 16.672 -23.938 1.00 60.31 H new ATOM 0 HA LEU A 55 10.472 14.410 -23.277 1.00 4.42 H new ATOM 0 HB2 LEU A 55 9.381 16.712 -21.999 1.00 12.32 H new ATOM 0 HB3 LEU A 55 8.907 15.330 -21.030 1.00 12.32 H new ATOM 0 HG LEU A 55 11.758 15.386 -21.836 1.00 70.54 H new ATOM 0 HD11 LEU A 55 12.353 17.039 -20.111 1.00 22.22 H new ATOM 0 HD12 LEU A 55 11.384 17.765 -21.415 1.00 22.22 H new ATOM 0 HD13 LEU A 55 10.627 17.382 -19.851 1.00 22.22 H new ATOM 0 HD21 LEU A 55 12.044 14.670 -19.495 1.00 31.00 H new ATOM 0 HD22 LEU A 55 10.305 14.919 -19.211 1.00 31.00 H new ATOM 0 HD23 LEU A 55 10.850 13.666 -20.351 1.00 31.00 H new ATOM 868 N ILE A 56 7.306 14.044 -22.371 1.00 2.42 N ATOM 869 CA ILE A 56 6.274 13.049 -22.110 1.00 70.12 C ATOM 870 C ILE A 56 5.807 12.389 -23.404 1.00 5.25 C ATOM 871 O ILE A 56 5.350 11.246 -23.400 1.00 4.33 O ATOM 872 CB ILE A 56 5.059 13.671 -21.397 1.00 51.13 C ATOM 873 CG1 ILE A 56 5.520 14.570 -20.248 1.00 54.11 C ATOM 874 CG2 ILE A 56 4.130 12.581 -20.884 1.00 61.34 C ATOM 875 CD1 ILE A 56 5.339 16.046 -20.526 1.00 1.02 C ATOM 0 H ILE A 56 7.014 15.007 -22.207 1.00 2.42 H new ATOM 0 HA ILE A 56 6.719 12.296 -21.460 1.00 70.12 H new ATOM 0 HB ILE A 56 4.509 14.282 -22.113 1.00 51.13 H new ATOM 0 HG12 ILE A 56 4.966 14.308 -19.347 1.00 54.11 H new ATOM 0 HG13 ILE A 56 6.572 14.373 -20.043 1.00 54.11 H new ATOM 0 HG21 ILE A 56 3.276 13.037 -20.383 1.00 61.34 H new ATOM 0 HG22 ILE A 56 3.779 11.978 -21.721 1.00 61.34 H new ATOM 0 HG23 ILE A 56 4.668 11.946 -20.180 1.00 61.34 H new ATOM 0 HD11 ILE A 56 5.687 16.623 -19.669 1.00 1.02 H new ATOM 0 HD12 ILE A 56 5.916 16.323 -21.408 1.00 1.02 H new ATOM 0 HD13 ILE A 56 4.284 16.257 -20.701 1.00 1.02 H new ATOM 1056 N SER A 69 -2.428 13.430 -15.779 1.00 42.53 N ATOM 1057 CA SER A 69 -1.420 14.072 -14.944 1.00 4.32 C ATOM 1058 C SER A 69 -0.575 15.045 -15.762 1.00 31.34 C ATOM 1059 O SER A 69 -0.728 16.261 -15.653 1.00 12.41 O ATOM 1060 CB SER A 69 -0.520 13.019 -14.294 1.00 3.40 C ATOM 1061 OG SER A 69 -1.032 12.618 -13.035 1.00 24.10 O ATOM 0 HA SER A 69 -1.934 14.633 -14.163 1.00 4.32 H new ATOM 0 HB2 SER A 69 -0.437 12.152 -14.949 1.00 3.40 H new ATOM 0 HB3 SER A 69 0.485 13.422 -14.170 1.00 3.40 H new ATOM 0 HG SER A 69 -0.440 11.944 -12.641 1.00 24.10 H new ATOM 1067 N VAL A 70 0.318 14.499 -16.581 1.00 73.43 N ATOM 1068 CA VAL A 70 1.187 15.316 -17.419 1.00 51.21 C ATOM 1069 C VAL A 70 0.373 16.242 -18.316 1.00 41.01 C ATOM 1070 O VAL A 70 0.809 17.344 -18.647 1.00 31.10 O ATOM 1071 CB VAL A 70 2.103 14.443 -18.297 1.00 50.22 C ATOM 1072 CG1 VAL A 70 3.025 13.598 -17.432 1.00 20.12 C ATOM 1073 CG2 VAL A 70 1.274 13.566 -19.223 1.00 63.31 C ATOM 0 H VAL A 70 0.459 13.494 -16.682 1.00 73.43 H new ATOM 0 HA VAL A 70 1.803 15.914 -16.748 1.00 51.21 H new ATOM 0 HB VAL A 70 2.721 15.098 -18.911 1.00 50.22 H new ATOM 0 HG11 VAL A 70 3.665 12.988 -18.070 1.00 20.12 H new ATOM 0 HG12 VAL A 70 3.644 14.250 -16.815 1.00 20.12 H new ATOM 0 HG13 VAL A 70 2.429 12.950 -16.790 1.00 20.12 H new ATOM 0 HG21 VAL A 70 1.937 12.956 -19.836 1.00 63.31 H new ATOM 0 HG22 VAL A 70 0.629 12.918 -18.630 1.00 63.31 H new ATOM 0 HG23 VAL A 70 0.661 14.195 -19.868 1.00 63.31 H new ATOM 1083 N GLY A 71 -0.813 15.786 -18.707 1.00 15.53 N ATOM 1084 CA GLY A 71 -1.670 16.587 -19.562 1.00 34.31 C ATOM 1085 C GLY A 71 -2.454 17.628 -18.787 1.00 24.30 C ATOM 1086 O GLY A 71 -2.687 18.731 -19.279 1.00 71.25 O ATOM 0 H GLY A 71 -1.196 14.877 -18.447 1.00 15.53 H new ATOM 0 HA2 GLY A 71 -1.062 17.084 -20.318 1.00 34.31 H new ATOM 0 HA3 GLY A 71 -2.364 15.933 -20.090 1.00 34.31 H new ATOM 1090 N GLU A 72 -2.861 17.276 -17.572 1.00 33.34 N ATOM 1091 CA GLU A 72 -3.625 18.188 -16.729 1.00 12.22 C ATOM 1092 C GLU A 72 -2.826 19.454 -16.433 1.00 64.11 C ATOM 1093 O GLU A 72 -3.331 20.568 -16.575 1.00 62.34 O ATOM 1094 CB GLU A 72 -4.016 17.501 -15.419 1.00 14.22 C ATOM 1095 CG GLU A 72 -5.469 17.715 -15.029 1.00 54.44 C ATOM 1096 CD GLU A 72 -5.679 17.701 -13.528 1.00 32.53 C ATOM 1097 OE1 GLU A 72 -5.535 16.619 -12.920 1.00 30.01 O ATOM 1098 OE2 GLU A 72 -5.988 18.769 -12.961 1.00 5.35 O ATOM 0 H GLU A 72 -2.675 16.367 -17.149 1.00 33.34 H new ATOM 0 HA GLU A 72 -4.530 18.468 -17.268 1.00 12.22 H new ATOM 0 HB2 GLU A 72 -3.827 16.431 -15.509 1.00 14.22 H new ATOM 0 HB3 GLU A 72 -3.375 17.872 -14.619 1.00 14.22 H new ATOM 0 HG2 GLU A 72 -5.812 18.668 -15.431 1.00 54.44 H new ATOM 0 HG3 GLU A 72 -6.082 16.937 -15.485 1.00 54.44 H new ATOM 1105 N TYR A 73 -1.576 19.274 -16.021 1.00 21.05 N ATOM 1106 CA TYR A 73 -0.707 20.400 -15.702 1.00 3.35 C ATOM 1107 C TYR A 73 -0.386 21.212 -16.953 1.00 2.33 C ATOM 1108 O TYR A 73 -0.409 22.444 -16.931 1.00 71.42 O ATOM 1109 CB TYR A 73 0.588 19.905 -15.055 1.00 42.23 C ATOM 1110 CG TYR A 73 0.365 19.055 -13.825 1.00 15.31 C ATOM 1111 CD1 TYR A 73 -0.602 19.398 -12.887 1.00 25.44 C ATOM 1112 CD2 TYR A 73 1.120 17.911 -13.600 1.00 75.10 C ATOM 1113 CE1 TYR A 73 -0.809 18.625 -11.761 1.00 31.35 C ATOM 1114 CE2 TYR A 73 0.918 17.131 -12.478 1.00 12.33 C ATOM 1115 CZ TYR A 73 -0.047 17.492 -11.561 1.00 13.31 C ATOM 1116 OH TYR A 73 -0.250 16.719 -10.441 1.00 13.02 O ATOM 0 H TYR A 73 -1.142 18.359 -15.900 1.00 21.05 H new ATOM 0 HA TYR A 73 -1.234 21.044 -14.998 1.00 3.35 H new ATOM 0 HB2 TYR A 73 1.152 19.328 -15.787 1.00 42.23 H new ATOM 0 HB3 TYR A 73 1.201 20.765 -14.786 1.00 42.23 H new ATOM 0 HD1 TYR A 73 -1.201 20.283 -13.041 1.00 25.44 H new ATOM 0 HD2 TYR A 73 1.878 17.626 -14.315 1.00 75.10 H new ATOM 0 HE1 TYR A 73 -1.563 18.906 -11.041 1.00 31.35 H new ATOM 0 HE2 TYR A 73 1.512 16.243 -12.320 1.00 12.33 H new ATOM 0 HH TYR A 73 0.367 15.958 -10.452 1.00 13.02 H new ATOM 1126 N LEU A 74 -0.087 20.514 -18.042 1.00 60.14 N ATOM 1127 CA LEU A 74 0.238 21.168 -19.305 1.00 43.11 C ATOM 1128 C LEU A 74 -0.841 22.175 -19.690 1.00 45.32 C ATOM 1129 O LEU A 74 -0.541 23.315 -20.046 1.00 60.30 O ATOM 1130 CB LEU A 74 0.400 20.127 -20.415 1.00 12.44 C ATOM 1131 CG LEU A 74 1.771 20.072 -21.088 1.00 64.02 C ATOM 1132 CD1 LEU A 74 2.071 21.383 -21.799 1.00 35.13 C ATOM 1133 CD2 LEU A 74 2.855 19.757 -20.067 1.00 51.41 C ATOM 0 H LEU A 74 -0.063 19.495 -18.077 1.00 60.14 H new ATOM 0 HA LEU A 74 1.179 21.703 -19.177 1.00 43.11 H new ATOM 0 HB2 LEU A 74 0.182 19.144 -19.998 1.00 12.44 H new ATOM 0 HB3 LEU A 74 -0.351 20.322 -21.181 1.00 12.44 H new ATOM 0 HG LEU A 74 1.757 19.275 -21.831 1.00 64.02 H new ATOM 0 HD11 LEU A 74 3.051 21.324 -22.272 1.00 35.13 H new ATOM 0 HD12 LEU A 74 1.312 21.567 -22.559 1.00 35.13 H new ATOM 0 HD13 LEU A 74 2.065 22.199 -21.076 1.00 35.13 H new ATOM 0 HD21 LEU A 74 3.824 19.722 -20.564 1.00 51.41 H new ATOM 0 HD22 LEU A 74 2.869 20.531 -19.300 1.00 51.41 H new ATOM 0 HD23 LEU A 74 2.650 18.792 -19.604 1.00 51.41 H new ATOM 1145 N MET A 75 -2.096 21.747 -19.615 1.00 15.45 N ATOM 1146 CA MET A 75 -3.220 22.614 -19.952 1.00 71.51 C ATOM 1147 C MET A 75 -3.185 23.896 -19.127 1.00 43.34 C ATOM 1148 O MET A 75 -3.310 24.996 -19.666 1.00 51.14 O ATOM 1149 CB MET A 75 -4.543 21.881 -19.721 1.00 54.31 C ATOM 1150 CG MET A 75 -5.671 22.366 -20.618 1.00 64.45 C ATOM 1151 SD MET A 75 -6.794 23.495 -19.774 1.00 35.30 S ATOM 1152 CE MET A 75 -7.848 22.336 -18.904 1.00 40.33 C ATOM 0 H MET A 75 -2.361 20.806 -19.324 1.00 15.45 H new ATOM 0 HA MET A 75 -3.139 22.880 -21.006 1.00 71.51 H new ATOM 0 HB2 MET A 75 -4.392 20.814 -19.886 1.00 54.31 H new ATOM 0 HB3 MET A 75 -4.840 22.003 -18.679 1.00 54.31 H new ATOM 0 HG2 MET A 75 -5.248 22.865 -21.490 1.00 64.45 H new ATOM 0 HG3 MET A 75 -6.233 21.507 -20.984 1.00 64.45 H new ATOM 0 HE1 MET A 75 -8.598 22.884 -18.333 1.00 40.33 H new ATOM 0 HE2 MET A 75 -8.344 21.685 -19.623 1.00 40.33 H new ATOM 0 HE3 MET A 75 -7.244 21.734 -18.225 1.00 40.33 H new ATOM 1162 N PHE A 76 -3.013 23.748 -17.818 1.00 15.11 N ATOM 1163 CA PHE A 76 -2.963 24.895 -16.919 1.00 1.11 C ATOM 1164 C PHE A 76 -1.714 25.734 -17.177 1.00 33.44 C ATOM 1165 O PHE A 76 -1.692 26.935 -16.907 1.00 22.02 O ATOM 1166 CB PHE A 76 -2.986 24.429 -15.462 1.00 13.23 C ATOM 1167 CG PHE A 76 -4.337 24.549 -14.815 1.00 42.45 C ATOM 1168 CD1 PHE A 76 -5.471 24.083 -15.459 1.00 75.33 C ATOM 1169 CD2 PHE A 76 -4.472 25.129 -13.564 1.00 43.54 C ATOM 1170 CE1 PHE A 76 -6.716 24.191 -14.867 1.00 42.43 C ATOM 1171 CE2 PHE A 76 -5.713 25.240 -12.967 1.00 52.44 C ATOM 1172 CZ PHE A 76 -6.837 24.772 -13.620 1.00 62.01 C ATOM 0 H PHE A 76 -2.906 22.845 -17.356 1.00 15.11 H new ATOM 0 HA PHE A 76 -3.840 25.513 -17.109 1.00 1.11 H new ATOM 0 HB2 PHE A 76 -2.661 23.390 -15.416 1.00 13.23 H new ATOM 0 HB3 PHE A 76 -2.265 25.014 -14.891 1.00 13.23 H new ATOM 0 HD1 PHE A 76 -5.382 23.630 -16.435 1.00 75.33 H new ATOM 0 HD2 PHE A 76 -3.597 25.499 -13.050 1.00 43.54 H new ATOM 0 HE1 PHE A 76 -7.592 23.822 -15.379 1.00 42.43 H new ATOM 0 HE2 PHE A 76 -5.804 25.692 -11.991 1.00 52.44 H new ATOM 0 HZ PHE A 76 -7.808 24.860 -13.156 1.00 62.01 H new ATOM 1182 N THR A 77 -0.675 25.091 -17.701 1.00 10.13 N ATOM 1183 CA THR A 77 0.578 25.775 -17.993 1.00 40.45 C ATOM 1184 C THR A 77 0.433 26.695 -19.200 1.00 41.33 C ATOM 1185 O THR A 77 0.871 27.845 -19.172 1.00 64.12 O ATOM 1186 CB THR A 77 1.717 24.773 -18.260 1.00 74.22 C ATOM 1187 OG1 THR A 77 2.184 24.222 -17.024 1.00 4.32 O ATOM 1188 CG2 THR A 77 2.869 25.445 -18.990 1.00 65.14 C ATOM 0 H THR A 77 -0.677 24.097 -17.932 1.00 10.13 H new ATOM 0 HA THR A 77 0.826 26.369 -17.113 1.00 40.45 H new ATOM 0 HB THR A 77 1.327 23.973 -18.889 1.00 74.22 H new ATOM 0 HG1 THR A 77 1.536 23.566 -16.693 1.00 4.32 H new ATOM 0 HG21 THR A 77 3.661 24.718 -19.167 1.00 65.14 H new ATOM 0 HG22 THR A 77 2.516 25.837 -19.944 1.00 65.14 H new ATOM 0 HG23 THR A 77 3.257 26.263 -18.383 1.00 65.14 H new ATOM 1196 N MET A 78 -0.185 26.182 -20.259 1.00 20.01 N ATOM 1197 CA MET A 78 -0.389 26.960 -21.476 1.00 30.53 C ATOM 1198 C MET A 78 -1.196 28.221 -21.186 1.00 4.43 C ATOM 1199 O MET A 78 -0.948 29.276 -21.770 1.00 51.30 O ATOM 1200 CB MET A 78 -1.104 26.115 -22.532 1.00 63.03 C ATOM 1201 CG MET A 78 -0.461 24.756 -22.761 1.00 15.34 C ATOM 1202 SD MET A 78 -0.027 24.475 -24.488 1.00 21.12 S ATOM 1203 CE MET A 78 1.017 25.894 -24.810 1.00 3.13 C ATOM 0 H MET A 78 -0.553 25.232 -20.299 1.00 20.01 H new ATOM 0 HA MET A 78 0.589 27.255 -21.857 1.00 30.53 H new ATOM 0 HB2 MET A 78 -2.141 25.971 -22.229 1.00 63.03 H new ATOM 0 HB3 MET A 78 -1.121 26.663 -23.474 1.00 63.03 H new ATOM 0 HG2 MET A 78 0.436 24.675 -22.147 1.00 15.34 H new ATOM 0 HG3 MET A 78 -1.145 23.974 -22.431 1.00 15.34 H new ATOM 0 HE1 MET A 78 1.759 25.636 -25.565 1.00 3.13 H new ATOM 0 HE2 MET A 78 0.406 26.721 -25.170 1.00 3.13 H new ATOM 0 HE3 MET A 78 1.523 26.190 -23.891 1.00 3.13 H new ATOM 1213 N VAL A 79 -2.162 28.106 -20.280 1.00 24.21 N ATOM 1214 CA VAL A 79 -3.004 29.238 -19.912 1.00 71.41 C ATOM 1215 C VAL A 79 -2.182 30.349 -19.269 1.00 63.23 C ATOM 1216 O VAL A 79 -2.105 31.461 -19.792 1.00 43.35 O ATOM 1217 CB VAL A 79 -4.121 28.813 -18.941 1.00 14.24 C ATOM 1218 CG1 VAL A 79 -4.769 30.034 -18.305 1.00 50.13 C ATOM 1219 CG2 VAL A 79 -5.158 27.963 -19.660 1.00 2.21 C ATOM 0 H VAL A 79 -2.381 27.240 -19.787 1.00 24.21 H new ATOM 0 HA VAL A 79 -3.454 29.610 -20.832 1.00 71.41 H new ATOM 0 HB VAL A 79 -3.678 28.211 -18.147 1.00 14.24 H new ATOM 0 HG11 VAL A 79 -5.556 29.714 -17.622 1.00 50.13 H new ATOM 0 HG12 VAL A 79 -4.017 30.599 -17.754 1.00 50.13 H new ATOM 0 HG13 VAL A 79 -5.198 30.665 -19.083 1.00 50.13 H new ATOM 0 HG21 VAL A 79 -5.940 27.672 -18.958 1.00 2.21 H new ATOM 0 HG22 VAL A 79 -5.598 28.538 -20.475 1.00 2.21 H new ATOM 0 HG23 VAL A 79 -4.681 27.070 -20.062 1.00 2.21 H new ATOM 1229 N LEU A 80 -1.568 30.041 -18.132 1.00 62.43 N ATOM 1230 CA LEU A 80 -0.749 31.013 -17.417 1.00 13.42 C ATOM 1231 C LEU A 80 0.364 31.550 -18.310 1.00 41.53 C ATOM 1232 O LEU A 80 0.616 32.755 -18.351 1.00 35.02 O ATOM 1233 CB LEU A 80 -0.150 30.379 -16.161 1.00 5.03 C ATOM 1234 CG LEU A 80 -0.008 31.298 -14.947 1.00 4.11 C ATOM 1235 CD1 LEU A 80 0.401 32.697 -15.381 1.00 61.05 C ATOM 1236 CD2 LEU A 80 -1.307 31.342 -14.156 1.00 61.40 C ATOM 0 H LEU A 80 -1.622 29.126 -17.685 1.00 62.43 H new ATOM 0 HA LEU A 80 -1.389 31.846 -17.126 1.00 13.42 H new ATOM 0 HB2 LEU A 80 -0.770 29.528 -15.877 1.00 5.03 H new ATOM 0 HB3 LEU A 80 0.835 29.986 -16.411 1.00 5.03 H new ATOM 0 HG LEU A 80 0.774 30.897 -14.302 1.00 4.11 H new ATOM 0 HD11 LEU A 80 0.497 33.337 -14.504 1.00 61.05 H new ATOM 0 HD12 LEU A 80 1.357 32.651 -15.903 1.00 61.05 H new ATOM 0 HD13 LEU A 80 -0.357 33.107 -16.048 1.00 61.05 H new ATOM 0 HD21 LEU A 80 -1.187 32.001 -13.296 1.00 61.40 H new ATOM 0 HD22 LEU A 80 -2.108 31.718 -14.792 1.00 61.40 H new ATOM 0 HD23 LEU A 80 -1.558 30.339 -13.812 1.00 61.40 H new ATOM 1248 N VAL A 81 1.028 30.649 -19.027 1.00 75.22 N ATOM 1249 CA VAL A 81 2.112 31.032 -19.923 1.00 40.02 C ATOM 1250 C VAL A 81 1.657 32.101 -20.911 1.00 24.14 C ATOM 1251 O VAL A 81 2.340 33.106 -21.113 1.00 55.12 O ATOM 1252 CB VAL A 81 2.648 29.819 -20.707 1.00 55.10 C ATOM 1253 CG1 VAL A 81 3.372 30.274 -21.965 1.00 73.41 C ATOM 1254 CG2 VAL A 81 3.563 28.980 -19.829 1.00 21.33 C ATOM 0 H VAL A 81 0.834 29.648 -19.005 1.00 75.22 H new ATOM 0 HA VAL A 81 2.911 31.434 -19.299 1.00 40.02 H new ATOM 0 HB VAL A 81 1.803 29.200 -21.007 1.00 55.10 H new ATOM 0 HG11 VAL A 81 3.744 29.404 -22.506 1.00 73.41 H new ATOM 0 HG12 VAL A 81 2.682 30.829 -22.601 1.00 73.41 H new ATOM 0 HG13 VAL A 81 4.209 30.916 -21.691 1.00 73.41 H new ATOM 0 HG21 VAL A 81 3.933 28.127 -20.399 1.00 21.33 H new ATOM 0 HG22 VAL A 81 4.405 29.587 -19.497 1.00 21.33 H new ATOM 0 HG23 VAL A 81 3.008 28.623 -18.961 1.00 21.33 H new ATOM 1264 N THR A 82 0.499 31.878 -21.524 1.00 0.11 N ATOM 1265 CA THR A 82 -0.047 32.821 -22.491 1.00 55.32 C ATOM 1266 C THR A 82 -0.139 34.224 -21.901 1.00 24.34 C ATOM 1267 O THR A 82 0.230 35.205 -22.546 1.00 4.11 O ATOM 1268 CB THR A 82 -1.445 32.387 -22.971 1.00 51.04 C ATOM 1269 OG1 THR A 82 -1.343 31.202 -23.769 1.00 21.14 O ATOM 1270 CG2 THR A 82 -2.107 33.493 -23.780 1.00 33.51 C ATOM 0 H THR A 82 -0.079 31.052 -21.368 1.00 0.11 H new ATOM 0 HA THR A 82 0.635 32.831 -23.341 1.00 55.32 H new ATOM 0 HB THR A 82 -2.059 32.183 -22.094 1.00 51.04 H new ATOM 0 HG1 THR A 82 -1.182 30.429 -23.188 1.00 21.14 H new ATOM 0 HG21 THR A 82 -3.093 33.164 -24.108 1.00 33.51 H new ATOM 0 HG22 THR A 82 -2.210 34.385 -23.161 1.00 33.51 H new ATOM 0 HG23 THR A 82 -1.493 33.724 -24.651 1.00 33.51 H new ATOM 1278 N PHE A 83 -0.632 34.311 -20.670 1.00 2.43 N ATOM 1279 CA PHE A 83 -0.772 35.595 -19.992 1.00 24.12 C ATOM 1280 C PHE A 83 0.587 36.267 -19.815 1.00 14.33 C ATOM 1281 O PHE A 83 0.701 37.490 -19.896 1.00 2.21 O ATOM 1282 CB PHE A 83 -1.441 35.406 -18.629 1.00 72.31 C ATOM 1283 CG PHE A 83 -2.930 35.601 -18.660 1.00 71.15 C ATOM 1284 CD1 PHE A 83 -3.743 34.723 -19.360 1.00 24.13 C ATOM 1285 CD2 PHE A 83 -3.517 36.662 -17.990 1.00 73.04 C ATOM 1286 CE1 PHE A 83 -5.113 34.901 -19.391 1.00 22.22 C ATOM 1287 CE2 PHE A 83 -4.887 36.845 -18.018 1.00 32.24 C ATOM 1288 CZ PHE A 83 -5.686 35.962 -18.718 1.00 1.31 C ATOM 0 H PHE A 83 -0.941 33.508 -20.122 1.00 2.43 H new ATOM 0 HA PHE A 83 -1.398 36.238 -20.610 1.00 24.12 H new ATOM 0 HB2 PHE A 83 -1.221 34.404 -18.261 1.00 72.31 H new ATOM 0 HB3 PHE A 83 -1.005 36.109 -17.919 1.00 72.31 H new ATOM 0 HD1 PHE A 83 -3.301 33.891 -19.887 1.00 24.13 H new ATOM 0 HD2 PHE A 83 -2.897 37.354 -17.439 1.00 73.04 H new ATOM 0 HE1 PHE A 83 -5.735 34.211 -19.941 1.00 22.22 H new ATOM 0 HE2 PHE A 83 -5.332 37.677 -17.493 1.00 32.24 H new ATOM 0 HZ PHE A 83 -6.757 36.101 -18.739 1.00 1.31 H new ATOM 1298 N SER A 84 1.613 35.459 -19.572 1.00 23.24 N ATOM 1299 CA SER A 84 2.963 35.975 -19.378 1.00 64.33 C ATOM 1300 C SER A 84 3.455 36.694 -20.631 1.00 14.22 C ATOM 1301 O SER A 84 4.137 37.716 -20.546 1.00 33.25 O ATOM 1302 CB SER A 84 3.921 34.836 -19.022 1.00 0.01 C ATOM 1303 OG SER A 84 5.103 35.334 -18.419 1.00 62.44 O ATOM 0 H SER A 84 1.536 34.444 -19.505 1.00 23.24 H new ATOM 0 HA SER A 84 2.937 36.690 -18.556 1.00 64.33 H new ATOM 0 HB2 SER A 84 3.428 34.140 -18.343 1.00 0.01 H new ATOM 0 HB3 SER A 84 4.176 34.276 -19.922 1.00 0.01 H new ATOM 0 HG SER A 84 5.698 34.587 -18.200 1.00 62.44 H new ATOM 1309 N ILE A 85 3.103 36.153 -21.792 1.00 53.43 N ATOM 1310 CA ILE A 85 3.506 36.744 -23.063 1.00 21.54 C ATOM 1311 C ILE A 85 2.863 38.112 -23.262 1.00 60.30 C ATOM 1312 O ILE A 85 3.533 39.078 -23.627 1.00 25.25 O ATOM 1313 CB ILE A 85 3.133 35.835 -24.249 1.00 53.41 C ATOM 1314 CG1 ILE A 85 3.799 34.466 -24.101 1.00 43.21 C ATOM 1315 CG2 ILE A 85 3.536 36.488 -25.563 1.00 23.21 C ATOM 1316 CD1 ILE A 85 5.298 34.499 -24.303 1.00 21.13 C ATOM 0 H ILE A 85 2.540 35.307 -21.879 1.00 53.43 H new ATOM 0 HA ILE A 85 4.590 36.857 -23.029 1.00 21.54 H new ATOM 0 HB ILE A 85 2.052 35.692 -24.253 1.00 53.41 H new ATOM 0 HG12 ILE A 85 3.583 34.071 -23.108 1.00 43.21 H new ATOM 0 HG13 ILE A 85 3.358 33.777 -24.821 1.00 43.21 H new ATOM 0 HG21 ILE A 85 3.266 35.834 -26.392 1.00 23.21 H new ATOM 0 HG22 ILE A 85 3.018 37.441 -25.669 1.00 23.21 H new ATOM 0 HG23 ILE A 85 4.613 36.657 -25.570 1.00 23.21 H new ATOM 0 HD11 ILE A 85 5.703 33.494 -24.183 1.00 21.13 H new ATOM 0 HD12 ILE A 85 5.522 34.864 -25.305 1.00 21.13 H new ATOM 0 HD13 ILE A 85 5.750 35.163 -23.566 1.00 21.13 H new ATOM 1328 N VAL A 86 1.558 38.187 -23.019 1.00 4.53 N ATOM 1329 CA VAL A 86 0.824 39.438 -23.169 1.00 1.14 C ATOM 1330 C VAL A 86 1.453 40.548 -22.334 1.00 0.01 C ATOM 1331 O VAL A 86 1.500 41.705 -22.753 1.00 4.21 O ATOM 1332 CB VAL A 86 -0.651 39.275 -22.758 1.00 15.31 C ATOM 1333 CG1 VAL A 86 -1.352 40.625 -22.738 1.00 54.10 C ATOM 1334 CG2 VAL A 86 -1.362 38.310 -23.695 1.00 44.32 C ATOM 0 H VAL A 86 0.988 37.397 -22.718 1.00 4.53 H new ATOM 0 HA VAL A 86 0.872 39.709 -24.224 1.00 1.14 H new ATOM 0 HB VAL A 86 -0.685 38.859 -21.751 1.00 15.31 H new ATOM 0 HG11 VAL A 86 -2.393 40.490 -22.445 1.00 54.10 H new ATOM 0 HG12 VAL A 86 -0.856 41.282 -22.023 1.00 54.10 H new ATOM 0 HG13 VAL A 86 -1.309 41.072 -23.731 1.00 54.10 H new ATOM 0 HG21 VAL A 86 -2.403 38.207 -23.390 1.00 44.32 H new ATOM 0 HG22 VAL A 86 -1.319 38.694 -24.714 1.00 44.32 H new ATOM 0 HG23 VAL A 86 -0.874 37.336 -23.654 1.00 44.32 H new ATOM 1344 N THR A 87 1.937 40.188 -21.149 1.00 15.42 N ATOM 1345 CA THR A 87 2.563 41.153 -20.254 1.00 14.31 C ATOM 1346 C THR A 87 3.935 41.571 -20.769 1.00 51.43 C ATOM 1347 O THR A 87 4.423 42.656 -20.454 1.00 0.44 O ATOM 1348 CB THR A 87 2.713 40.584 -18.830 1.00 50.25 C ATOM 1349 OG1 THR A 87 1.440 40.150 -18.339 1.00 52.14 O ATOM 1350 CG2 THR A 87 3.296 41.627 -17.889 1.00 44.34 C ATOM 0 H THR A 87 1.907 39.235 -20.787 1.00 15.42 H new ATOM 0 HA THR A 87 1.909 42.024 -20.222 1.00 14.31 H new ATOM 0 HB THR A 87 3.395 39.734 -18.872 1.00 50.25 H new ATOM 0 HG1 THR A 87 1.182 39.318 -18.788 1.00 52.14 H new ATOM 0 HG21 THR A 87 3.392 41.202 -16.890 1.00 44.34 H new ATOM 0 HG22 THR A 87 4.278 41.934 -18.249 1.00 44.34 H new ATOM 0 HG23 THR A 87 2.636 42.494 -17.853 1.00 44.34 H new ATOM 1358 N SER A 88 4.553 40.704 -21.565 1.00 14.01 N ATOM 1359 CA SER A 88 5.871 40.983 -22.122 1.00 61.40 C ATOM 1360 C SER A 88 5.824 42.191 -23.052 1.00 55.02 C ATOM 1361 O SER A 88 6.513 43.187 -22.831 1.00 32.20 O ATOM 1362 CB SER A 88 6.396 39.762 -22.880 1.00 21.31 C ATOM 1363 OG SER A 88 6.306 38.591 -22.086 1.00 51.23 O ATOM 0 H SER A 88 4.162 39.803 -21.838 1.00 14.01 H new ATOM 0 HA SER A 88 6.546 41.208 -21.297 1.00 61.40 H new ATOM 0 HB2 SER A 88 5.825 39.627 -23.799 1.00 21.31 H new ATOM 0 HB3 SER A 88 7.433 39.929 -23.171 1.00 21.31 H new ATOM 0 HG SER A 88 5.380 38.466 -21.791 1.00 51.23 H new ATOM 1369 N VAL A 89 5.004 42.096 -24.095 1.00 23.43 N ATOM 1370 CA VAL A 89 4.865 43.180 -25.059 1.00 14.20 C ATOM 1371 C VAL A 89 4.255 44.418 -24.410 1.00 23.32 C ATOM 1372 O VAL A 89 4.674 45.544 -24.682 1.00 34.31 O ATOM 1373 CB VAL A 89 3.991 42.759 -26.255 1.00 72.52 C ATOM 1374 CG1 VAL A 89 3.947 43.863 -27.300 1.00 64.35 C ATOM 1375 CG2 VAL A 89 4.506 41.461 -26.860 1.00 31.05 C ATOM 0 H VAL A 89 4.426 41.279 -24.293 1.00 23.43 H new ATOM 0 HA VAL A 89 5.867 43.416 -25.416 1.00 14.20 H new ATOM 0 HB VAL A 89 2.975 42.589 -25.898 1.00 72.52 H new ATOM 0 HG11 VAL A 89 3.325 43.547 -28.137 1.00 64.35 H new ATOM 0 HG12 VAL A 89 3.528 44.767 -26.857 1.00 64.35 H new ATOM 0 HG13 VAL A 89 4.957 44.068 -27.656 1.00 64.35 H new ATOM 0 HG21 VAL A 89 3.877 41.178 -27.704 1.00 31.05 H new ATOM 0 HG22 VAL A 89 5.531 41.601 -27.203 1.00 31.05 H new ATOM 0 HG23 VAL A 89 4.479 40.673 -26.107 1.00 31.05 H new ATOM 1385 N CYS A 90 3.266 44.201 -23.550 1.00 52.44 N ATOM 1386 CA CYS A 90 2.598 45.300 -22.861 1.00 73.15 C ATOM 1387 C CYS A 90 3.606 46.165 -22.112 1.00 33.00 C ATOM 1388 O CYS A 90 3.610 47.389 -22.245 1.00 60.24 O ATOM 1389 CB CYS A 90 1.550 44.757 -21.888 1.00 40.15 C ATOM 1390 SG CYS A 90 -0.049 44.396 -22.651 1.00 61.34 S ATOM 0 H CYS A 90 2.909 43.275 -23.313 1.00 52.44 H new ATOM 0 HA CYS A 90 2.102 45.918 -23.610 1.00 73.15 H new ATOM 0 HB2 CYS A 90 1.934 43.847 -21.427 1.00 40.15 H new ATOM 0 HB3 CYS A 90 1.403 45.482 -21.087 1.00 40.15 H new ATOM 0 HG CYS A 90 -0.077 43.154 -23.033 1.00 61.34 H new ATOM 1396 N VAL A 91 4.458 45.521 -21.322 1.00 25.34 N ATOM 1397 CA VAL A 91 5.471 46.231 -20.550 1.00 22.13 C ATOM 1398 C VAL A 91 6.382 47.048 -21.459 1.00 25.31 C ATOM 1399 O VAL A 91 6.758 48.174 -21.130 1.00 53.14 O ATOM 1400 CB VAL A 91 6.330 45.257 -19.721 1.00 2.41 C ATOM 1401 CG1 VAL A 91 7.580 45.954 -19.205 1.00 13.45 C ATOM 1402 CG2 VAL A 91 5.519 44.678 -18.572 1.00 3.24 C ATOM 0 H VAL A 91 4.467 44.508 -21.199 1.00 25.34 H new ATOM 0 HA VAL A 91 4.941 46.902 -19.874 1.00 22.13 H new ATOM 0 HB VAL A 91 6.642 44.435 -20.366 1.00 2.41 H new ATOM 0 HG11 VAL A 91 8.174 45.251 -18.622 1.00 13.45 H new ATOM 0 HG12 VAL A 91 8.169 46.315 -20.048 1.00 13.45 H new ATOM 0 HG13 VAL A 91 7.293 46.796 -18.575 1.00 13.45 H new ATOM 0 HG21 VAL A 91 6.141 43.992 -17.997 1.00 3.24 H new ATOM 0 HG22 VAL A 91 5.176 45.486 -17.925 1.00 3.24 H new ATOM 0 HG23 VAL A 91 4.658 44.141 -18.969 1.00 3.24 H new ATOM 1412 N LEU A 92 6.735 46.474 -22.604 1.00 21.32 N ATOM 1413 CA LEU A 92 7.603 47.149 -23.563 1.00 32.22 C ATOM 1414 C LEU A 92 6.889 48.335 -24.202 1.00 13.52 C ATOM 1415 O LEU A 92 7.506 49.357 -24.499 1.00 10.34 O ATOM 1416 CB LEU A 92 8.058 46.169 -24.646 1.00 0.30 C ATOM 1417 CG LEU A 92 9.368 45.429 -24.374 1.00 1.10 C ATOM 1418 CD1 LEU A 92 9.470 44.187 -25.246 1.00 4.23 C ATOM 1419 CD2 LEU A 92 10.558 46.348 -24.609 1.00 63.42 C ATOM 0 H LEU A 92 6.434 45.543 -22.891 1.00 21.32 H new ATOM 0 HA LEU A 92 8.477 47.520 -23.027 1.00 32.22 H new ATOM 0 HB2 LEU A 92 7.270 45.430 -24.793 1.00 0.30 H new ATOM 0 HB3 LEU A 92 8.161 46.716 -25.583 1.00 0.30 H new ATOM 0 HG LEU A 92 9.377 45.116 -23.330 1.00 1.10 H new ATOM 0 HD11 LEU A 92 10.409 43.673 -25.039 1.00 4.23 H new ATOM 0 HD12 LEU A 92 8.636 43.520 -25.029 1.00 4.23 H new ATOM 0 HD13 LEU A 92 9.439 44.476 -26.296 1.00 4.23 H new ATOM 0 HD21 LEU A 92 11.482 45.805 -24.411 1.00 63.42 H new ATOM 0 HD22 LEU A 92 10.554 46.691 -25.643 1.00 63.42 H new ATOM 0 HD23 LEU A 92 10.492 47.207 -23.941 1.00 63.42 H new ATOM 1632 N GLY A 108 3.393 51.628 -10.760 1.00 43.41 N ATOM 1633 CA GLY A 108 3.734 50.360 -10.142 1.00 53.12 C ATOM 1634 C GLY A 108 2.998 49.193 -10.770 1.00 51.24 C ATOM 1635 O GLY A 108 2.995 48.088 -10.228 1.00 22.05 O ATOM 0 HA2 GLY A 108 4.808 50.196 -10.226 1.00 53.12 H new ATOM 0 HA3 GLY A 108 3.500 50.403 -9.078 1.00 53.12 H new ATOM 1639 N ILE A 109 2.371 49.439 -11.916 1.00 61.30 N ATOM 1640 CA ILE A 109 1.628 48.399 -12.618 1.00 1.34 C ATOM 1641 C ILE A 109 2.478 47.147 -12.804 1.00 33.32 C ATOM 1642 O ILE A 109 1.973 46.026 -12.737 1.00 55.02 O ATOM 1643 CB ILE A 109 1.143 48.887 -13.996 1.00 24.32 C ATOM 1644 CG1 ILE A 109 0.633 47.708 -14.827 1.00 54.12 C ATOM 1645 CG2 ILE A 109 2.265 49.611 -14.726 1.00 74.41 C ATOM 1646 CD1 ILE A 109 1.663 47.153 -15.786 1.00 11.42 C ATOM 0 H ILE A 109 2.363 50.349 -12.378 1.00 61.30 H new ATOM 0 HA ILE A 109 0.762 48.158 -12.002 1.00 1.34 H new ATOM 0 HB ILE A 109 0.320 49.587 -13.849 1.00 24.32 H new ATOM 0 HG12 ILE A 109 0.309 46.913 -14.155 1.00 54.12 H new ATOM 0 HG13 ILE A 109 -0.244 48.025 -15.392 1.00 54.12 H new ATOM 0 HG21 ILE A 109 1.907 49.950 -15.698 1.00 74.41 H new ATOM 0 HG22 ILE A 109 2.587 50.470 -14.138 1.00 74.41 H new ATOM 0 HG23 ILE A 109 3.106 48.932 -14.866 1.00 74.41 H new ATOM 0 HD11 ILE A 109 1.232 46.320 -16.341 1.00 11.42 H new ATOM 0 HD12 ILE A 109 1.969 47.933 -16.482 1.00 11.42 H new ATOM 0 HD13 ILE A 109 2.531 46.805 -15.226 1.00 11.42 H new ATOM 1658 N ASP A 110 3.771 47.345 -13.036 1.00 34.23 N ATOM 1659 CA ASP A 110 4.692 46.231 -13.229 1.00 2.14 C ATOM 1660 C ASP A 110 4.817 45.402 -11.954 1.00 72.13 C ATOM 1661 O ASP A 110 4.740 44.174 -11.991 1.00 72.32 O ATOM 1662 CB ASP A 110 6.068 46.747 -13.653 1.00 0.45 C ATOM 1663 CG ASP A 110 6.329 46.552 -15.133 1.00 72.02 C ATOM 1664 OD1 ASP A 110 5.584 47.135 -15.948 1.00 42.33 O ATOM 1665 OD2 ASP A 110 7.277 45.815 -15.477 1.00 11.01 O ATOM 0 H ASP A 110 4.205 48.266 -13.095 1.00 34.23 H new ATOM 0 HA ASP A 110 4.292 45.594 -14.018 1.00 2.14 H new ATOM 0 HB2 ASP A 110 6.146 47.807 -13.410 1.00 0.45 H new ATOM 0 HB3 ASP A 110 6.839 46.231 -13.080 1.00 0.45 H new ATOM 1670 N ARG A 111 5.011 46.081 -10.829 1.00 14.52 N ATOM 1671 CA ARG A 111 5.148 45.407 -9.543 1.00 44.44 C ATOM 1672 C ARG A 111 3.857 44.688 -9.166 1.00 21.43 C ATOM 1673 O ARG A 111 3.883 43.647 -8.507 1.00 64.14 O ATOM 1674 CB ARG A 111 5.522 46.414 -8.453 1.00 74.32 C ATOM 1675 CG ARG A 111 7.003 46.420 -8.111 1.00 54.25 C ATOM 1676 CD ARG A 111 7.858 46.653 -9.347 1.00 3.52 C ATOM 1677 NE ARG A 111 9.000 47.520 -9.066 1.00 52.12 N ATOM 1678 CZ ARG A 111 8.896 48.828 -8.861 1.00 3.33 C ATOM 1679 NH1 ARG A 111 7.709 49.418 -8.904 1.00 24.32 N ATOM 1680 NH2 ARG A 111 9.982 49.550 -8.611 1.00 34.21 N ATOM 0 H ARG A 111 5.077 47.098 -10.781 1.00 14.52 H new ATOM 0 HA ARG A 111 5.943 44.666 -9.632 1.00 44.44 H new ATOM 0 HB2 ARG A 111 5.229 47.413 -8.777 1.00 74.32 H new ATOM 0 HB3 ARG A 111 4.951 46.190 -7.552 1.00 74.32 H new ATOM 0 HG2 ARG A 111 7.205 47.199 -7.375 1.00 54.25 H new ATOM 0 HG3 ARG A 111 7.276 45.470 -7.652 1.00 54.25 H new ATOM 0 HD2 ARG A 111 8.214 45.696 -9.727 1.00 3.52 H new ATOM 0 HD3 ARG A 111 7.247 47.100 -10.131 1.00 3.52 H new ATOM 0 HE ARG A 111 9.928 47.098 -9.025 1.00 52.12 H new ATOM 0 HH11 ARG A 111 6.872 48.867 -9.095 1.00 24.32 H new ATOM 0 HH12 ARG A 111 7.633 50.423 -8.746 1.00 24.32 H new ATOM 0 HH21 ARG A 111 10.897 49.100 -8.576 1.00 34.21 H new ATOM 0 HH22 ARG A 111 9.901 50.555 -8.454 1.00 34.21 H new ATOM 1694 N LEU A 112 2.729 45.249 -9.586 1.00 73.40 N ATOM 1695 CA LEU A 112 1.426 44.661 -9.292 1.00 62.10 C ATOM 1696 C LEU A 112 1.268 43.313 -9.987 1.00 72.43 C ATOM 1697 O LEU A 112 1.006 42.297 -9.343 1.00 35.13 O ATOM 1698 CB LEU A 112 0.307 45.608 -9.729 1.00 61.32 C ATOM 1699 CG LEU A 112 -0.528 46.224 -8.606 1.00 63.10 C ATOM 1700 CD1 LEU A 112 -0.712 47.716 -8.835 1.00 73.02 C ATOM 1701 CD2 LEU A 112 -1.877 45.528 -8.501 1.00 22.33 C ATOM 0 H LEU A 112 2.690 46.110 -10.131 1.00 73.40 H new ATOM 0 HA LEU A 112 1.360 44.504 -8.215 1.00 62.10 H new ATOM 0 HB2 LEU A 112 0.749 46.416 -10.311 1.00 61.32 H new ATOM 0 HB3 LEU A 112 -0.362 45.064 -10.396 1.00 61.32 H new ATOM 0 HG LEU A 112 0.004 46.085 -7.665 1.00 63.10 H new ATOM 0 HD11 LEU A 112 -1.309 48.137 -8.026 1.00 73.02 H new ATOM 0 HD12 LEU A 112 0.263 48.203 -8.859 1.00 73.02 H new ATOM 0 HD13 LEU A 112 -1.222 47.878 -9.785 1.00 73.02 H new ATOM 0 HD21 LEU A 112 -2.458 45.979 -7.697 1.00 22.33 H new ATOM 0 HD22 LEU A 112 -2.416 45.635 -9.442 1.00 22.33 H new ATOM 0 HD23 LEU A 112 -1.725 44.470 -8.289 1.00 22.33 H new ATOM 1713 N PHE A 113 1.431 43.310 -11.306 1.00 53.02 N ATOM 1714 CA PHE A 113 1.307 42.086 -12.089 1.00 41.24 C ATOM 1715 C PHE A 113 2.311 41.037 -11.621 1.00 43.12 C ATOM 1716 O PHE A 113 2.046 39.836 -11.683 1.00 62.25 O ATOM 1717 CB PHE A 113 1.518 42.383 -13.576 1.00 1.05 C ATOM 1718 CG PHE A 113 0.238 42.601 -14.331 1.00 3.12 C ATOM 1719 CD1 PHE A 113 -0.672 41.569 -14.490 1.00 60.33 C ATOM 1720 CD2 PHE A 113 -0.055 43.839 -14.881 1.00 22.51 C ATOM 1721 CE1 PHE A 113 -1.850 41.767 -15.186 1.00 21.44 C ATOM 1722 CE2 PHE A 113 -1.231 44.043 -15.577 1.00 34.51 C ATOM 1723 CZ PHE A 113 -2.131 43.005 -15.728 1.00 44.35 C ATOM 0 H PHE A 113 1.649 44.141 -11.855 1.00 53.02 H new ATOM 0 HA PHE A 113 0.301 41.691 -11.943 1.00 41.24 H new ATOM 0 HB2 PHE A 113 2.145 43.269 -13.676 1.00 1.05 H new ATOM 0 HB3 PHE A 113 2.062 41.555 -14.030 1.00 1.05 H new ATOM 0 HD1 PHE A 113 -0.459 40.599 -14.066 1.00 60.33 H new ATOM 0 HD2 PHE A 113 0.644 44.654 -14.764 1.00 22.51 H new ATOM 0 HE1 PHE A 113 -2.550 40.953 -15.306 1.00 21.44 H new ATOM 0 HE2 PHE A 113 -1.447 45.012 -16.002 1.00 34.51 H new ATOM 0 HZ PHE A 113 -3.052 43.162 -16.269 1.00 44.35 H new ATOM 1733 N LEU A 114 3.465 41.499 -11.153 1.00 4.20 N ATOM 1734 CA LEU A 114 4.511 40.602 -10.674 1.00 61.22 C ATOM 1735 C LEU A 114 4.123 39.977 -9.338 1.00 12.00 C ATOM 1736 O LEU A 114 4.207 38.762 -9.162 1.00 64.42 O ATOM 1737 CB LEU A 114 5.833 41.358 -10.532 1.00 23.34 C ATOM 1738 CG LEU A 114 6.893 41.063 -11.594 1.00 30.22 C ATOM 1739 CD1 LEU A 114 7.319 39.604 -11.532 1.00 3.31 C ATOM 1740 CD2 LEU A 114 6.369 41.409 -12.980 1.00 44.00 C ATOM 0 H LEU A 114 3.700 42.490 -11.095 1.00 4.20 H new ATOM 0 HA LEU A 114 4.633 39.803 -11.406 1.00 61.22 H new ATOM 0 HB2 LEU A 114 5.620 42.427 -10.547 1.00 23.34 H new ATOM 0 HB3 LEU A 114 6.255 41.130 -9.553 1.00 23.34 H new ATOM 0 HG LEU A 114 7.766 41.684 -11.392 1.00 30.22 H new ATOM 0 HD11 LEU A 114 8.074 39.413 -12.295 1.00 3.31 H new ATOM 0 HD12 LEU A 114 7.735 39.388 -10.548 1.00 3.31 H new ATOM 0 HD13 LEU A 114 6.454 38.965 -11.709 1.00 3.31 H new ATOM 0 HD21 LEU A 114 7.136 41.193 -13.723 1.00 44.00 H new ATOM 0 HD22 LEU A 114 5.480 40.814 -13.192 1.00 44.00 H new ATOM 0 HD23 LEU A 114 6.114 42.468 -13.019 1.00 44.00 H new ATOM 1752 N TRP A 115 3.695 40.815 -8.401 1.00 44.50 N ATOM 1753 CA TRP A 115 3.291 40.345 -7.081 1.00 24.30 C ATOM 1754 C TRP A 115 2.224 39.262 -7.192 1.00 60.33 C ATOM 1755 O TRP A 115 2.325 38.211 -6.558 1.00 71.14 O ATOM 1756 CB TRP A 115 2.768 41.510 -6.240 1.00 33.34 C ATOM 1757 CG TRP A 115 2.976 41.320 -4.768 1.00 4.35 C ATOM 1758 CD1 TRP A 115 3.928 41.917 -3.991 1.00 42.42 C ATOM 1759 CD2 TRP A 115 2.218 40.475 -3.896 1.00 75.23 C ATOM 1760 NE1 TRP A 115 3.807 41.494 -2.690 1.00 33.04 N ATOM 1761 CE2 TRP A 115 2.764 40.609 -2.605 1.00 2.40 C ATOM 1762 CE3 TRP A 115 1.128 39.619 -4.081 1.00 24.04 C ATOM 1763 CZ2 TRP A 115 2.258 39.919 -1.507 1.00 61.21 C ATOM 1764 CZ3 TRP A 115 0.628 38.934 -2.990 1.00 35.01 C ATOM 1765 CH2 TRP A 115 1.191 39.088 -1.716 1.00 65.54 C ATOM 0 H TRP A 115 3.619 41.824 -8.531 1.00 44.50 H new ATOM 0 HA TRP A 115 4.166 39.917 -6.591 1.00 24.30 H new ATOM 0 HB2 TRP A 115 3.265 42.428 -6.554 1.00 33.34 H new ATOM 0 HB3 TRP A 115 1.704 41.641 -6.435 1.00 33.34 H new ATOM 0 HD1 TRP A 115 4.667 42.619 -4.348 1.00 42.42 H new ATOM 0 HE1 TRP A 115 4.398 41.790 -1.913 1.00 33.04 H new ATOM 0 HE3 TRP A 115 0.685 39.496 -5.058 1.00 24.04 H new ATOM 0 HZ2 TRP A 115 2.692 40.035 -0.525 1.00 61.21 H new ATOM 0 HZ3 TRP A 115 -0.212 38.268 -3.122 1.00 35.01 H new ATOM 0 HH2 TRP A 115 0.775 38.540 -0.883 1.00 65.54 H new ATOM 1776 N ILE A 116 1.203 39.524 -8.001 1.00 40.31 N ATOM 1777 CA ILE A 116 0.118 38.570 -8.195 1.00 42.44 C ATOM 1778 C ILE A 116 0.609 37.318 -8.914 1.00 3.30 C ATOM 1779 O ILE A 116 0.011 36.248 -8.799 1.00 52.40 O ATOM 1780 CB ILE A 116 -1.039 39.190 -9.001 1.00 10.32 C ATOM 1781 CG1 ILE A 116 -0.562 39.583 -10.401 1.00 10.15 C ATOM 1782 CG2 ILE A 116 -1.606 40.398 -8.270 1.00 5.31 C ATOM 1783 CD1 ILE A 116 -1.675 40.063 -11.306 1.00 20.13 C ATOM 0 H ILE A 116 1.104 40.389 -8.533 1.00 40.31 H new ATOM 0 HA ILE A 116 -0.245 38.299 -7.204 1.00 42.44 H new ATOM 0 HB ILE A 116 -1.830 38.447 -9.103 1.00 10.32 H new ATOM 0 HG12 ILE A 116 0.188 40.369 -10.313 1.00 10.15 H new ATOM 0 HG13 ILE A 116 -0.073 38.726 -10.863 1.00 10.15 H new ATOM 0 HG21 ILE A 116 -2.423 40.825 -8.852 1.00 5.31 H new ATOM 0 HG22 ILE A 116 -1.979 40.090 -7.293 1.00 5.31 H new ATOM 0 HG23 ILE A 116 -0.823 41.145 -8.140 1.00 5.31 H new ATOM 0 HD11 ILE A 116 -1.264 40.324 -12.281 1.00 20.13 H new ATOM 0 HD12 ILE A 116 -2.415 39.271 -11.424 1.00 20.13 H new ATOM 0 HD13 ILE A 116 -2.149 40.940 -10.866 1.00 20.13 H new ATOM 1795 N PHE A 117 1.704 37.459 -9.654 1.00 71.53 N ATOM 1796 CA PHE A 117 2.277 36.338 -10.392 1.00 10.45 C ATOM 1797 C PHE A 117 2.827 35.283 -9.436 1.00 41.24 C ATOM 1798 O PHE A 117 2.664 34.083 -9.658 1.00 15.32 O ATOM 1799 CB PHE A 117 3.388 36.828 -11.323 1.00 13.21 C ATOM 1800 CG PHE A 117 3.358 36.186 -12.681 1.00 1.35 C ATOM 1801 CD1 PHE A 117 3.574 34.825 -12.823 1.00 11.13 C ATOM 1802 CD2 PHE A 117 3.115 36.944 -13.815 1.00 10.44 C ATOM 1803 CE1 PHE A 117 3.547 34.231 -14.071 1.00 10.25 C ATOM 1804 CE2 PHE A 117 3.086 36.356 -15.065 1.00 24.02 C ATOM 1805 CZ PHE A 117 3.304 34.998 -15.193 1.00 71.01 C ATOM 0 H PHE A 117 2.212 38.337 -9.759 1.00 71.53 H new ATOM 0 HA PHE A 117 1.486 35.885 -10.989 1.00 10.45 H new ATOM 0 HB2 PHE A 117 3.304 37.909 -11.439 1.00 13.21 H new ATOM 0 HB3 PHE A 117 4.354 36.631 -10.858 1.00 13.21 H new ATOM 0 HD1 PHE A 117 3.766 34.221 -11.948 1.00 11.13 H new ATOM 0 HD2 PHE A 117 2.946 38.007 -13.721 1.00 10.44 H new ATOM 0 HE1 PHE A 117 3.716 33.169 -14.168 1.00 10.25 H new ATOM 0 HE2 PHE A 117 2.893 36.957 -15.941 1.00 24.02 H new ATOM 0 HZ PHE A 117 3.284 34.537 -16.169 1.00 71.01 H new ATOM 1815 N VAL A 118 3.481 35.740 -8.373 1.00 21.31 N ATOM 1816 CA VAL A 118 4.056 34.837 -7.383 1.00 33.50 C ATOM 1817 C VAL A 118 2.965 34.138 -6.578 1.00 5.21 C ATOM 1818 O VAL A 118 3.099 32.970 -6.214 1.00 63.44 O ATOM 1819 CB VAL A 118 4.992 35.586 -6.416 1.00 62.44 C ATOM 1820 CG1 VAL A 118 5.721 34.604 -5.511 1.00 41.41 C ATOM 1821 CG2 VAL A 118 5.980 36.444 -7.191 1.00 45.21 C ATOM 0 H VAL A 118 3.626 36.730 -8.175 1.00 21.31 H new ATOM 0 HA VAL A 118 4.633 34.092 -7.931 1.00 33.50 H new ATOM 0 HB VAL A 118 4.389 36.242 -5.788 1.00 62.44 H new ATOM 0 HG11 VAL A 118 6.378 35.151 -4.835 1.00 41.41 H new ATOM 0 HG12 VAL A 118 4.994 34.036 -4.930 1.00 41.41 H new ATOM 0 HG13 VAL A 118 6.314 33.921 -6.119 1.00 41.41 H new ATOM 0 HG21 VAL A 118 6.634 36.966 -6.493 1.00 45.21 H new ATOM 0 HG22 VAL A 118 6.579 35.809 -7.844 1.00 45.21 H new ATOM 0 HG23 VAL A 118 5.436 37.172 -7.793 1.00 45.21 H new ATOM 1831 N PHE A 119 1.885 34.862 -6.303 1.00 24.13 N ATOM 1832 CA PHE A 119 0.771 34.312 -5.540 1.00 11.22 C ATOM 1833 C PHE A 119 0.192 33.082 -6.232 1.00 62.22 C ATOM 1834 O PHE A 119 0.158 31.992 -5.660 1.00 45.05 O ATOM 1835 CB PHE A 119 -0.320 35.369 -5.357 1.00 54.13 C ATOM 1836 CG PHE A 119 -1.564 34.840 -4.702 1.00 21.11 C ATOM 1837 CD1 PHE A 119 -1.516 34.308 -3.424 1.00 34.34 C ATOM 1838 CD2 PHE A 119 -2.780 34.874 -5.365 1.00 13.14 C ATOM 1839 CE1 PHE A 119 -2.659 33.820 -2.817 1.00 40.14 C ATOM 1840 CE2 PHE A 119 -3.926 34.388 -4.763 1.00 51.54 C ATOM 1841 CZ PHE A 119 -3.865 33.860 -3.489 1.00 32.31 C ATOM 0 H PHE A 119 1.758 35.830 -6.597 1.00 24.13 H new ATOM 0 HA PHE A 119 1.146 34.013 -4.561 1.00 11.22 H new ATOM 0 HB2 PHE A 119 0.076 36.188 -4.757 1.00 54.13 H new ATOM 0 HB3 PHE A 119 -0.580 35.783 -6.331 1.00 54.13 H new ATOM 0 HD1 PHE A 119 -0.575 34.274 -2.895 1.00 34.34 H new ATOM 0 HD2 PHE A 119 -2.833 35.284 -6.363 1.00 13.14 H new ATOM 0 HE1 PHE A 119 -2.609 33.409 -1.820 1.00 40.14 H new ATOM 0 HE2 PHE A 119 -4.868 34.421 -5.289 1.00 51.54 H new ATOM 0 HZ PHE A 119 -4.759 33.479 -3.018 1.00 32.31 H new ATOM 1851 N VAL A 120 -0.263 33.265 -7.468 1.00 33.34 N ATOM 1852 CA VAL A 120 -0.840 32.171 -8.239 1.00 74.44 C ATOM 1853 C VAL A 120 0.164 31.038 -8.423 1.00 14.11 C ATOM 1854 O VAL A 120 -0.212 29.867 -8.495 1.00 12.42 O ATOM 1855 CB VAL A 120 -1.316 32.650 -9.624 1.00 24.02 C ATOM 1856 CG1 VAL A 120 -0.155 33.235 -10.414 1.00 0.32 C ATOM 1857 CG2 VAL A 120 -1.969 31.508 -10.387 1.00 63.24 C ATOM 0 H VAL A 120 -0.243 34.160 -7.956 1.00 33.34 H new ATOM 0 HA VAL A 120 -1.698 31.805 -7.675 1.00 74.44 H new ATOM 0 HB VAL A 120 -2.060 33.434 -9.483 1.00 24.02 H new ATOM 0 HG11 VAL A 120 -0.510 33.568 -11.389 1.00 0.32 H new ATOM 0 HG12 VAL A 120 0.264 34.082 -9.871 1.00 0.32 H new ATOM 0 HG13 VAL A 120 0.614 32.474 -10.548 1.00 0.32 H new ATOM 0 HG21 VAL A 120 -2.299 31.864 -11.363 1.00 63.24 H new ATOM 0 HG22 VAL A 120 -1.249 30.701 -10.520 1.00 63.24 H new ATOM 0 HG23 VAL A 120 -2.828 31.139 -9.826 1.00 63.24 H new ATOM 1867 N CYS A 121 1.441 31.394 -8.497 1.00 61.04 N ATOM 1868 CA CYS A 121 2.501 30.407 -8.673 1.00 52.11 C ATOM 1869 C CYS A 121 2.640 29.532 -7.432 1.00 31.13 C ATOM 1870 O CYS A 121 2.681 28.305 -7.525 1.00 51.14 O ATOM 1871 CB CYS A 121 3.829 31.103 -8.973 1.00 63.42 C ATOM 1872 SG CYS A 121 5.288 30.146 -8.496 1.00 74.24 S ATOM 0 H CYS A 121 1.768 32.358 -8.438 1.00 61.04 H new ATOM 0 HA CYS A 121 2.235 29.770 -9.516 1.00 52.11 H new ATOM 0 HB2 CYS A 121 3.881 31.318 -10.040 1.00 63.42 H new ATOM 0 HB3 CYS A 121 3.850 32.061 -8.454 1.00 63.42 H new ATOM 0 HG CYS A 121 6.362 30.816 -8.791 1.00 74.24 H new ATOM 1878 N VAL A 122 2.714 30.171 -6.269 1.00 11.24 N ATOM 1879 CA VAL A 122 2.849 29.451 -5.008 1.00 4.41 C ATOM 1880 C VAL A 122 1.596 28.639 -4.702 1.00 24.24 C ATOM 1881 O VAL A 122 1.663 27.425 -4.507 1.00 73.24 O ATOM 1882 CB VAL A 122 3.122 30.415 -3.838 1.00 13.32 C ATOM 1883 CG1 VAL A 122 2.706 29.784 -2.518 1.00 24.32 C ATOM 1884 CG2 VAL A 122 4.589 30.816 -3.808 1.00 71.33 C ATOM 0 H VAL A 122 2.683 31.186 -6.174 1.00 11.24 H new ATOM 0 HA VAL A 122 3.698 28.776 -5.118 1.00 4.41 H new ATOM 0 HB VAL A 122 2.526 31.316 -3.986 1.00 13.32 H new ATOM 0 HG11 VAL A 122 2.906 30.480 -1.703 1.00 24.32 H new ATOM 0 HG12 VAL A 122 1.641 29.553 -2.545 1.00 24.32 H new ATOM 0 HG13 VAL A 122 3.272 28.866 -2.359 1.00 24.32 H new ATOM 0 HG21 VAL A 122 4.763 31.497 -2.975 1.00 71.33 H new ATOM 0 HG22 VAL A 122 5.207 29.927 -3.685 1.00 71.33 H new ATOM 0 HG23 VAL A 122 4.850 31.312 -4.743 1.00 71.33 H new ATOM 1894 N PHE A 123 0.454 29.316 -4.660 1.00 51.33 N ATOM 1895 CA PHE A 123 -0.816 28.657 -4.377 1.00 42.40 C ATOM 1896 C PHE A 123 -1.060 27.506 -5.348 1.00 43.13 C ATOM 1897 O PHE A 123 -1.334 26.380 -4.937 1.00 35.23 O ATOM 1898 CB PHE A 123 -1.966 29.663 -4.461 1.00 32.21 C ATOM 1899 CG PHE A 123 -3.059 29.407 -3.463 1.00 55.32 C ATOM 1900 CD1 PHE A 123 -3.958 28.370 -3.651 1.00 31.42 C ATOM 1901 CD2 PHE A 123 -3.189 30.205 -2.338 1.00 2.50 C ATOM 1902 CE1 PHE A 123 -4.965 28.131 -2.734 1.00 51.54 C ATOM 1903 CE2 PHE A 123 -4.193 29.972 -1.418 1.00 75.00 C ATOM 1904 CZ PHE A 123 -5.083 28.935 -1.617 1.00 75.40 C ATOM 0 H PHE A 123 0.381 30.321 -4.818 1.00 51.33 H new ATOM 0 HA PHE A 123 -0.770 28.252 -3.366 1.00 42.40 H new ATOM 0 HB2 PHE A 123 -1.572 30.667 -4.307 1.00 32.21 H new ATOM 0 HB3 PHE A 123 -2.388 29.637 -5.465 1.00 32.21 H new ATOM 0 HD1 PHE A 123 -3.871 27.741 -4.524 1.00 31.42 H new ATOM 0 HD2 PHE A 123 -2.497 31.019 -2.178 1.00 2.50 H new ATOM 0 HE1 PHE A 123 -5.658 27.317 -2.891 1.00 51.54 H new ATOM 0 HE2 PHE A 123 -4.282 30.600 -0.544 1.00 75.00 H new ATOM 0 HZ PHE A 123 -5.870 28.753 -0.900 1.00 75.40 H new ATOM 1914 N GLY A 124 -0.957 27.799 -6.641 1.00 74.34 N ATOM 1915 CA GLY A 124 -1.170 26.779 -7.652 1.00 35.03 C ATOM 1916 C GLY A 124 -0.240 25.594 -7.485 1.00 0.12 C ATOM 1917 O GLY A 124 -0.686 24.447 -7.428 1.00 4.42 O ATOM 0 H GLY A 124 -0.730 28.724 -7.006 1.00 74.34 H new ATOM 0 HA2 GLY A 124 -2.203 26.435 -7.605 1.00 35.03 H new ATOM 0 HA3 GLY A 124 -1.024 27.215 -8.640 1.00 35.03 H new ATOM 1921 N THR A 125 1.058 25.869 -7.408 1.00 4.33 N ATOM 1922 CA THR A 125 2.055 24.817 -7.250 1.00 14.45 C ATOM 1923 C THR A 125 1.772 23.974 -6.012 1.00 34.22 C ATOM 1924 O THR A 125 1.803 22.744 -6.067 1.00 52.01 O ATOM 1925 CB THR A 125 3.476 25.401 -7.145 1.00 3.11 C ATOM 1926 OG1 THR A 125 3.988 25.681 -8.453 1.00 25.35 O ATOM 1927 CG2 THR A 125 4.406 24.435 -6.426 1.00 43.32 C ATOM 0 H THR A 125 1.444 26.812 -7.453 1.00 4.33 H new ATOM 0 HA THR A 125 1.994 24.187 -8.138 1.00 14.45 H new ATOM 0 HB THR A 125 3.424 26.326 -6.570 1.00 3.11 H new ATOM 0 HG1 THR A 125 3.814 26.619 -8.679 1.00 25.35 H new ATOM 0 HG21 THR A 125 5.404 24.869 -6.364 1.00 43.32 H new ATOM 0 HG22 THR A 125 4.029 24.247 -5.421 1.00 43.32 H new ATOM 0 HG23 THR A 125 4.452 23.496 -6.978 1.00 43.32 H new ATOM 1935 N ILE A 126 1.495 24.642 -4.897 1.00 21.41 N ATOM 1936 CA ILE A 126 1.205 23.952 -3.646 1.00 74.01 C ATOM 1937 C ILE A 126 -0.050 23.095 -3.770 1.00 35.25 C ATOM 1938 O ILE A 126 -0.162 22.044 -3.140 1.00 24.23 O ATOM 1939 CB ILE A 126 1.021 24.946 -2.484 1.00 42.44 C ATOM 1940 CG1 ILE A 126 2.380 25.462 -2.007 1.00 1.53 C ATOM 1941 CG2 ILE A 126 0.266 24.289 -1.339 1.00 14.30 C ATOM 1942 CD1 ILE A 126 2.280 26.597 -1.012 1.00 13.34 C ATOM 0 H ILE A 126 1.465 25.660 -4.834 1.00 21.41 H new ATOM 0 HA ILE A 126 2.061 23.311 -3.433 1.00 74.01 H new ATOM 0 HB ILE A 126 0.435 25.794 -2.839 1.00 42.44 H new ATOM 0 HG12 ILE A 126 2.933 24.640 -1.553 1.00 1.53 H new ATOM 0 HG13 ILE A 126 2.956 25.796 -2.870 1.00 1.53 H new ATOM 0 HG21 ILE A 126 0.144 25.004 -0.526 1.00 14.30 H new ATOM 0 HG22 ILE A 126 -0.715 23.966 -1.688 1.00 14.30 H new ATOM 0 HG23 ILE A 126 0.827 23.425 -0.982 1.00 14.30 H new ATOM 0 HD11 ILE A 126 3.281 26.912 -0.718 1.00 13.34 H new ATOM 0 HD12 ILE A 126 1.755 27.436 -1.469 1.00 13.34 H new ATOM 0 HD13 ILE A 126 1.732 26.262 -0.132 1.00 13.34 H new ATOM 1954 N GLY A 127 -0.994 23.551 -4.588 1.00 30.20 N ATOM 1955 CA GLY A 127 -2.229 22.813 -4.781 1.00 64.31 C ATOM 1956 C GLY A 127 -1.995 21.438 -5.375 1.00 32.32 C ATOM 1957 O GLY A 127 -2.449 20.433 -4.828 1.00 14.21 O ATOM 0 H GLY A 127 -0.926 24.418 -5.120 1.00 30.20 H new ATOM 0 HA2 GLY A 127 -2.741 22.710 -3.824 1.00 64.31 H new ATOM 0 HA3 GLY A 127 -2.890 23.381 -5.436 1.00 64.31 H new ATOM 1961 N MET A 128 -1.286 21.392 -6.498 1.00 54.40 N ATOM 1962 CA MET A 128 -0.994 20.130 -7.167 1.00 34.45 C ATOM 1963 C MET A 128 0.083 19.353 -6.416 1.00 13.34 C ATOM 1964 O MET A 128 0.093 18.122 -6.422 1.00 40.12 O ATOM 1965 CB MET A 128 -0.546 20.382 -8.607 1.00 54.43 C ATOM 1966 CG MET A 128 0.736 21.191 -8.712 1.00 5.12 C ATOM 1967 SD MET A 128 1.090 21.718 -10.400 1.00 13.24 S ATOM 1968 CE MET A 128 -0.087 23.055 -10.590 1.00 4.41 C ATOM 0 H MET A 128 -0.903 22.215 -6.964 1.00 54.40 H new ATOM 0 HA MET A 128 -1.907 19.534 -7.178 1.00 34.45 H new ATOM 0 HB2 MET A 128 -0.403 19.424 -9.107 1.00 54.43 H new ATOM 0 HB3 MET A 128 -1.340 20.905 -9.140 1.00 54.43 H new ATOM 0 HG2 MET A 128 0.661 22.069 -8.070 1.00 5.12 H new ATOM 0 HG3 MET A 128 1.569 20.594 -8.340 1.00 5.12 H new ATOM 0 HE1 MET A 128 -0.682 22.891 -11.488 1.00 4.41 H new ATOM 0 HE2 MET A 128 -0.743 23.088 -9.720 1.00 4.41 H new ATOM 0 HE3 MET A 128 0.448 24.001 -10.677 1.00 4.41 H new ATOM 1978 N PHE A 129 0.988 20.080 -5.769 1.00 51.53 N ATOM 1979 CA PHE A 129 2.070 19.460 -5.015 1.00 23.54 C ATOM 1980 C PHE A 129 1.529 18.723 -3.793 1.00 13.44 C ATOM 1981 O PHE A 129 2.203 17.865 -3.221 1.00 53.23 O ATOM 1982 CB PHE A 129 3.088 20.516 -4.578 1.00 73.23 C ATOM 1983 CG PHE A 129 4.343 19.934 -3.994 1.00 32.34 C ATOM 1984 CD1 PHE A 129 5.389 19.543 -4.814 1.00 75.41 C ATOM 1985 CD2 PHE A 129 4.477 19.777 -2.623 1.00 54.14 C ATOM 1986 CE1 PHE A 129 6.545 19.007 -4.279 1.00 60.13 C ATOM 1987 CE2 PHE A 129 5.631 19.243 -2.083 1.00 32.51 C ATOM 1988 CZ PHE A 129 6.666 18.856 -2.912 1.00 33.22 C ATOM 0 H PHE A 129 0.993 21.100 -5.752 1.00 51.53 H new ATOM 0 HA PHE A 129 2.563 18.737 -5.665 1.00 23.54 H new ATOM 0 HB2 PHE A 129 3.349 21.134 -5.437 1.00 73.23 H new ATOM 0 HB3 PHE A 129 2.625 21.173 -3.842 1.00 73.23 H new ATOM 0 HD1 PHE A 129 5.300 19.658 -5.884 1.00 75.41 H new ATOM 0 HD2 PHE A 129 3.670 20.075 -1.970 1.00 54.14 H new ATOM 0 HE1 PHE A 129 7.353 18.707 -4.930 1.00 60.13 H new ATOM 0 HE2 PHE A 129 5.724 19.128 -1.013 1.00 32.51 H new ATOM 0 HZ PHE A 129 7.568 18.436 -2.492 1.00 33.22 H new ATOM 1998 N LEU A 130 0.308 19.066 -3.397 1.00 33.54 N ATOM 1999 CA LEU A 130 -0.326 18.438 -2.242 1.00 1.31 C ATOM 2000 C LEU A 130 -1.025 17.143 -2.641 1.00 61.22 C ATOM 2001 O LEU A 130 -1.658 16.488 -1.814 1.00 1.05 O ATOM 2002 CB LEU A 130 -1.332 19.398 -1.603 1.00 65.04 C ATOM 2003 CG LEU A 130 -1.073 19.767 -0.142 1.00 44.13 C ATOM 2004 CD1 LEU A 130 -0.018 20.859 -0.046 1.00 74.03 C ATOM 2005 CD2 LEU A 130 -2.363 20.208 0.533 1.00 0.11 C ATOM 0 H LEU A 130 -0.263 19.775 -3.858 1.00 33.54 H new ATOM 0 HA LEU A 130 0.452 18.200 -1.517 1.00 1.31 H new ATOM 0 HB2 LEU A 130 -1.352 20.316 -2.191 1.00 65.04 H new ATOM 0 HB3 LEU A 130 -2.324 18.953 -1.674 1.00 65.04 H new ATOM 0 HG LEU A 130 -0.699 18.883 0.375 1.00 44.13 H new ATOM 0 HD11 LEU A 130 0.153 21.109 1.001 1.00 74.03 H new ATOM 0 HD12 LEU A 130 0.912 20.506 -0.492 1.00 74.03 H new ATOM 0 HD13 LEU A 130 -0.362 21.745 -0.579 1.00 74.03 H new ATOM 0 HD21 LEU A 130 -2.160 20.467 1.572 1.00 0.11 H new ATOM 0 HD22 LEU A 130 -2.766 21.078 0.014 1.00 0.11 H new ATOM 0 HD23 LEU A 130 -3.089 19.396 0.497 1.00 0.11 H new