USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 884 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 18 CYS SG : rot 169:sc= 1.06 USER MOD Set 1.2: A 73 TYR OH : rot 160:sc= 1.35 USER MOD Single : A 10 TYR OH : rot 165:sc= -0.0929 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.0698 X(o=-0.07,f=-0.07) USER MOD Single : A 22 SER OG : rot 93:sc= 0.333 USER MOD Single : A 23 CYS SG : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot -48:sc= 0.999 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc=-0.000374 USER MOD Single : A 35 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ -111:sc= -0.25 (180deg=-2.57!) USER MOD Single : A 40 THR OG1 : rot 78:sc= 1.02 USER MOD Single : A 42 CYS SG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot -64:sc= 0.495 USER MOD Single : A 50 THR OG1 : rot 74:sc= 0.394 USER MOD Single : A 57 THR OG1 : rot -38:sc= 1.03 USER MOD Single : A 69 SER OG : rot -21:sc= 0.403 USER MOD Single : A 77 THR OG1 : rot 172:sc= 1.01 USER MOD Single : A 78 MET CE :methyl -154:sc= -0.351 (180deg=-1.29) USER MOD Single : A 82 THR OG1 : rot 96:sc= 1.26 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 78:sc= 1.3 USER MOD Single : A 93 ASN : amide:sc= -0.059 K(o=-0.059,f=-1) USER MOD Single : A 116 MET CE :methyl 160:sc= -2.5 (180deg=-4.22!) USER MOD Single : A 121 CYS SG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 93:sc= 1.02 USER MOD ----------------------------------------------------------------- ATOM 64 N LEU A 8 -6.890 -6.442 -1.694 1.00 1.14 N ATOM 65 CA LEU A 8 -7.856 -7.408 -1.183 1.00 14.12 C ATOM 66 C LEU A 8 -7.226 -8.790 -1.049 1.00 70.41 C ATOM 67 O LEU A 8 -7.574 -9.559 -0.152 1.00 40.13 O ATOM 68 CB LEU A 8 -9.074 -7.477 -2.106 1.00 33.32 C ATOM 69 CG LEU A 8 -10.398 -7.859 -1.443 1.00 32.04 C ATOM 70 CD1 LEU A 8 -10.341 -9.286 -0.920 1.00 13.03 C ATOM 71 CD2 LEU A 8 -10.730 -6.890 -0.318 1.00 11.35 C ATOM 0 HA LEU A 8 -8.175 -7.078 -0.194 1.00 14.12 H new ATOM 0 HB2 LEU A 8 -9.197 -6.506 -2.585 1.00 33.32 H new ATOM 0 HB3 LEU A 8 -8.865 -8.198 -2.897 1.00 33.32 H new ATOM 0 HG LEU A 8 -11.188 -7.800 -2.192 1.00 32.04 H new ATOM 0 HD11 LEU A 8 -11.292 -9.540 -0.452 1.00 13.03 H new ATOM 0 HD12 LEU A 8 -10.150 -9.969 -1.747 1.00 13.03 H new ATOM 0 HD13 LEU A 8 -9.540 -9.373 -0.186 1.00 13.03 H new ATOM 0 HD21 LEU A 8 -11.675 -7.177 0.142 1.00 11.35 H new ATOM 0 HD22 LEU A 8 -9.939 -6.917 0.431 1.00 11.35 H new ATOM 0 HD23 LEU A 8 -10.814 -5.880 -0.720 1.00 11.35 H new ATOM 83 N PHE A 9 -6.295 -9.100 -1.946 1.00 12.23 N ATOM 84 CA PHE A 9 -5.615 -10.389 -1.927 1.00 63.44 C ATOM 85 C PHE A 9 -5.051 -10.687 -0.541 1.00 70.21 C ATOM 86 O PHE A 9 -4.985 -11.843 -0.121 1.00 0.30 O ATOM 87 CB PHE A 9 -4.489 -10.411 -2.963 1.00 40.45 C ATOM 88 CG PHE A 9 -3.276 -11.175 -2.515 1.00 51.22 C ATOM 89 CD1 PHE A 9 -3.278 -12.560 -2.507 1.00 22.31 C ATOM 90 CD2 PHE A 9 -2.134 -10.507 -2.102 1.00 34.44 C ATOM 91 CE1 PHE A 9 -2.163 -13.267 -2.095 1.00 52.43 C ATOM 92 CE2 PHE A 9 -1.017 -11.208 -1.689 1.00 62.34 C ATOM 93 CZ PHE A 9 -1.032 -12.589 -1.685 1.00 64.50 C ATOM 0 H PHE A 9 -5.995 -8.476 -2.695 1.00 12.23 H new ATOM 0 HA PHE A 9 -6.345 -11.159 -2.176 1.00 63.44 H new ATOM 0 HB2 PHE A 9 -4.865 -10.851 -3.887 1.00 40.45 H new ATOM 0 HB3 PHE A 9 -4.198 -9.386 -3.193 1.00 40.45 H new ATOM 0 HD1 PHE A 9 -4.161 -13.094 -2.826 1.00 22.31 H new ATOM 0 HD2 PHE A 9 -2.117 -9.427 -2.103 1.00 34.44 H new ATOM 0 HE1 PHE A 9 -2.177 -14.347 -2.094 1.00 52.43 H new ATOM 0 HE2 PHE A 9 -0.133 -10.676 -1.370 1.00 62.34 H new ATOM 0 HZ PHE A 9 -0.160 -13.138 -1.362 1.00 64.50 H new ATOM 103 N TYR A 10 -4.645 -9.637 0.164 1.00 74.11 N ATOM 104 CA TYR A 10 -4.084 -9.785 1.502 1.00 74.14 C ATOM 105 C TYR A 10 -5.184 -10.043 2.528 1.00 65.02 C ATOM 106 O TYR A 10 -4.982 -10.768 3.503 1.00 75.13 O ATOM 107 CB TYR A 10 -3.294 -8.533 1.887 1.00 35.45 C ATOM 108 CG TYR A 10 -2.537 -8.673 3.189 1.00 50.43 C ATOM 109 CD1 TYR A 10 -1.885 -9.856 3.513 1.00 43.33 C ATOM 110 CD2 TYR A 10 -2.473 -7.620 4.094 1.00 60.23 C ATOM 111 CE1 TYR A 10 -1.192 -9.987 4.701 1.00 73.43 C ATOM 112 CE2 TYR A 10 -1.782 -7.742 5.284 1.00 64.45 C ATOM 113 CZ TYR A 10 -1.143 -8.928 5.583 1.00 74.03 C ATOM 114 OH TYR A 10 -0.453 -9.055 6.766 1.00 14.35 O ATOM 0 H TYR A 10 -4.694 -8.674 -0.169 1.00 74.11 H new ATOM 0 HA TYR A 10 -3.411 -10.643 1.495 1.00 74.14 H new ATOM 0 HB2 TYR A 10 -2.589 -8.299 1.090 1.00 35.45 H new ATOM 0 HB3 TYR A 10 -3.980 -7.690 1.964 1.00 35.45 H new ATOM 0 HD1 TYR A 10 -1.920 -10.687 2.825 1.00 43.33 H new ATOM 0 HD2 TYR A 10 -2.972 -6.690 3.863 1.00 60.23 H new ATOM 0 HE1 TYR A 10 -0.691 -10.914 4.938 1.00 73.43 H new ATOM 0 HE2 TYR A 10 -1.742 -6.914 5.976 1.00 64.45 H new ATOM 0 HH TYR A 10 -0.310 -8.168 7.158 1.00 14.35 H new ATOM 124 N THR A 11 -6.348 -9.444 2.301 1.00 55.11 N ATOM 125 CA THR A 11 -7.480 -9.607 3.204 1.00 15.12 C ATOM 126 C THR A 11 -8.000 -11.040 3.182 1.00 40.23 C ATOM 127 O THR A 11 -8.499 -11.545 4.188 1.00 45.01 O ATOM 128 CB THR A 11 -8.631 -8.650 2.841 1.00 54.20 C ATOM 129 OG1 THR A 11 -8.403 -7.364 3.427 1.00 4.43 O ATOM 130 CG2 THR A 11 -9.966 -9.201 3.321 1.00 64.35 C ATOM 0 H THR A 11 -6.532 -8.841 1.499 1.00 55.11 H new ATOM 0 HA THR A 11 -7.121 -9.369 4.205 1.00 15.12 H new ATOM 0 HB THR A 11 -8.664 -8.554 1.756 1.00 54.20 H new ATOM 0 HG1 THR A 11 -9.139 -6.761 3.190 1.00 4.43 H new ATOM 0 HG21 THR A 11 -10.763 -8.508 3.053 1.00 64.35 H new ATOM 0 HG22 THR A 11 -10.151 -10.167 2.850 1.00 64.35 H new ATOM 0 HG23 THR A 11 -9.941 -9.324 4.404 1.00 64.35 H new ATOM 138 N ILE A 12 -7.880 -11.690 2.029 1.00 4.30 N ATOM 139 CA ILE A 12 -8.336 -13.066 1.877 1.00 2.22 C ATOM 140 C ILE A 12 -7.307 -14.050 2.423 1.00 4.54 C ATOM 141 O ILE A 12 -7.651 -15.151 2.849 1.00 11.15 O ATOM 142 CB ILE A 12 -8.621 -13.405 0.402 1.00 12.22 C ATOM 143 CG1 ILE A 12 -9.489 -12.317 -0.235 1.00 64.31 C ATOM 144 CG2 ILE A 12 -9.299 -14.763 0.292 1.00 2.54 C ATOM 145 CD1 ILE A 12 -10.866 -12.206 0.379 1.00 34.13 C ATOM 0 H ILE A 12 -7.471 -11.286 1.187 1.00 4.30 H new ATOM 0 HA ILE A 12 -9.260 -13.157 2.448 1.00 2.22 H new ATOM 0 HB ILE A 12 -7.674 -13.449 -0.135 1.00 12.22 H new ATOM 0 HG12 ILE A 12 -8.980 -11.357 -0.142 1.00 64.31 H new ATOM 0 HG13 ILE A 12 -9.591 -12.522 -1.301 1.00 64.31 H new ATOM 0 HG21 ILE A 12 -9.494 -14.988 -0.756 1.00 2.54 H new ATOM 0 HG22 ILE A 12 -8.649 -15.530 0.713 1.00 2.54 H new ATOM 0 HG23 ILE A 12 -10.241 -14.745 0.840 1.00 2.54 H new ATOM 0 HD11 ILE A 12 -11.425 -11.415 -0.122 1.00 34.13 H new ATOM 0 HD12 ILE A 12 -11.394 -13.153 0.263 1.00 34.13 H new ATOM 0 HD13 ILE A 12 -10.774 -11.970 1.439 1.00 34.13 H new ATOM 157 N ASN A 13 -6.041 -13.643 2.409 1.00 54.32 N ATOM 158 CA ASN A 13 -4.961 -14.488 2.904 1.00 60.11 C ATOM 159 C ASN A 13 -4.844 -14.387 4.422 1.00 65.53 C ATOM 160 O ASN A 13 -4.229 -15.239 5.066 1.00 42.23 O ATOM 161 CB ASN A 13 -3.635 -14.092 2.251 1.00 12.42 C ATOM 162 CG ASN A 13 -2.484 -14.972 2.698 1.00 34.33 C ATOM 163 OD1 ASN A 13 -2.512 -16.189 2.516 1.00 74.54 O ATOM 164 ND2 ASN A 13 -1.465 -14.359 3.288 1.00 22.11 N ATOM 0 H ASN A 13 -5.739 -12.733 2.060 1.00 54.32 H new ATOM 0 HA ASN A 13 -5.192 -15.521 2.643 1.00 60.11 H new ATOM 0 HB2 ASN A 13 -3.735 -14.152 1.167 1.00 12.42 H new ATOM 0 HB3 ASN A 13 -3.410 -13.053 2.493 1.00 12.42 H new ATOM 0 HD21 ASN A 13 -0.663 -14.899 3.611 1.00 22.11 H new ATOM 0 HD22 ASN A 13 -1.484 -13.348 3.418 1.00 22.11 H new ATOM 171 N LEU A 14 -5.437 -13.342 4.987 1.00 31.34 N ATOM 172 CA LEU A 14 -5.400 -13.130 6.430 1.00 13.12 C ATOM 173 C LEU A 14 -6.617 -13.757 7.104 1.00 5.11 C ATOM 174 O LEU A 14 -6.550 -14.177 8.260 1.00 60.54 O ATOM 175 CB LEU A 14 -5.344 -11.634 6.744 1.00 42.21 C ATOM 176 CG LEU A 14 -4.021 -10.932 6.434 1.00 60.42 C ATOM 177 CD1 LEU A 14 -4.165 -9.427 6.595 1.00 45.15 C ATOM 178 CD2 LEU A 14 -2.913 -11.463 7.331 1.00 23.24 C ATOM 0 H LEU A 14 -5.949 -12.628 4.469 1.00 31.34 H new ATOM 0 HA LEU A 14 -4.503 -13.611 6.820 1.00 13.12 H new ATOM 0 HB2 LEU A 14 -6.136 -11.136 6.185 1.00 42.21 H new ATOM 0 HB3 LEU A 14 -5.566 -11.497 7.802 1.00 42.21 H new ATOM 0 HG LEU A 14 -3.754 -11.142 5.398 1.00 60.42 H new ATOM 0 HD11 LEU A 14 -3.214 -8.944 6.370 1.00 45.15 H new ATOM 0 HD12 LEU A 14 -4.929 -9.059 5.910 1.00 45.15 H new ATOM 0 HD13 LEU A 14 -4.455 -9.197 7.620 1.00 45.15 H new ATOM 0 HD21 LEU A 14 -1.979 -10.952 7.097 1.00 23.24 H new ATOM 0 HD22 LEU A 14 -3.172 -11.284 8.374 1.00 23.24 H new ATOM 0 HD23 LEU A 14 -2.793 -12.534 7.166 1.00 23.24 H new ATOM 190 N ILE A 15 -7.725 -13.818 6.374 1.00 11.22 N ATOM 191 CA ILE A 15 -8.955 -14.397 6.901 1.00 41.44 C ATOM 192 C ILE A 15 -8.889 -15.920 6.902 1.00 60.14 C ATOM 193 O ILE A 15 -9.445 -16.575 7.784 1.00 5.22 O ATOM 194 CB ILE A 15 -10.182 -13.948 6.086 1.00 52.33 C ATOM 195 CG1 ILE A 15 -11.469 -14.452 6.741 1.00 33.43 C ATOM 196 CG2 ILE A 15 -10.079 -14.449 4.653 1.00 31.11 C ATOM 197 CD1 ILE A 15 -11.796 -13.758 8.045 1.00 60.11 C ATOM 0 H ILE A 15 -7.797 -13.474 5.416 1.00 11.22 H new ATOM 0 HA ILE A 15 -9.059 -14.040 7.926 1.00 41.44 H new ATOM 0 HB ILE A 15 -10.208 -12.858 6.068 1.00 52.33 H new ATOM 0 HG12 ILE A 15 -12.298 -14.314 6.047 1.00 33.43 H new ATOM 0 HG13 ILE A 15 -11.380 -15.523 6.921 1.00 33.43 H new ATOM 0 HG21 ILE A 15 -10.954 -14.123 4.090 1.00 31.11 H new ATOM 0 HG22 ILE A 15 -9.179 -14.045 4.190 1.00 31.11 H new ATOM 0 HG23 ILE A 15 -10.031 -15.538 4.651 1.00 31.11 H new ATOM 0 HD11 ILE A 15 -12.721 -14.166 8.452 1.00 60.11 H new ATOM 0 HD12 ILE A 15 -10.985 -13.918 8.756 1.00 60.11 H new ATOM 0 HD13 ILE A 15 -11.918 -12.689 7.868 1.00 60.11 H new ATOM 209 N ILE A 16 -8.205 -16.478 5.908 1.00 10.23 N ATOM 210 CA ILE A 16 -8.064 -17.924 5.796 1.00 21.34 C ATOM 211 C ILE A 16 -7.561 -18.530 7.102 1.00 31.23 C ATOM 212 O ILE A 16 -8.199 -19.398 7.699 1.00 64.32 O ATOM 213 CB ILE A 16 -7.099 -18.309 4.660 1.00 62.53 C ATOM 214 CG1 ILE A 16 -7.862 -18.457 3.342 1.00 45.34 C ATOM 215 CG2 ILE A 16 -6.366 -19.599 5.001 1.00 53.51 C ATOM 216 CD1 ILE A 16 -8.508 -19.813 3.166 1.00 41.13 C ATOM 0 H ILE A 16 -7.740 -15.950 5.169 1.00 10.23 H new ATOM 0 HA ILE A 16 -9.054 -18.321 5.571 1.00 21.34 H new ATOM 0 HB ILE A 16 -6.362 -17.514 4.545 1.00 62.53 H new ATOM 0 HG12 ILE A 16 -8.632 -17.687 3.289 1.00 45.34 H new ATOM 0 HG13 ILE A 16 -7.177 -18.280 2.513 1.00 45.34 H new ATOM 0 HG21 ILE A 16 -5.688 -19.858 4.188 1.00 53.51 H new ATOM 0 HG22 ILE A 16 -5.796 -19.461 5.920 1.00 53.51 H new ATOM 0 HG23 ILE A 16 -7.089 -20.403 5.140 1.00 53.51 H new ATOM 0 HD11 ILE A 16 -9.031 -19.846 2.210 1.00 41.13 H new ATOM 0 HD12 ILE A 16 -7.741 -20.587 3.186 1.00 41.13 H new ATOM 0 HD13 ILE A 16 -9.219 -19.985 3.974 1.00 41.13 H new ATOM 228 N PRO A 17 -6.391 -18.062 7.560 1.00 45.21 N ATOM 229 CA PRO A 17 -5.777 -18.542 8.802 1.00 42.44 C ATOM 230 C PRO A 17 -6.550 -18.099 10.039 1.00 3.52 C ATOM 231 O PRO A 17 -6.528 -18.772 11.070 1.00 2.33 O ATOM 232 CB PRO A 17 -4.387 -17.901 8.781 1.00 1.42 C ATOM 233 CG PRO A 17 -4.544 -16.682 7.938 1.00 30.32 C ATOM 234 CD PRO A 17 -5.576 -17.027 6.900 1.00 32.15 C ATOM 0 HA PRO A 17 -5.758 -19.631 8.854 1.00 42.44 H new ATOM 0 HB2 PRO A 17 -4.053 -17.646 9.787 1.00 1.42 H new ATOM 0 HB3 PRO A 17 -3.644 -18.580 8.361 1.00 1.42 H new ATOM 0 HG2 PRO A 17 -4.864 -15.831 8.539 1.00 30.32 H new ATOM 0 HG3 PRO A 17 -3.598 -16.406 7.472 1.00 30.32 H new ATOM 0 HD2 PRO A 17 -6.175 -16.159 6.625 1.00 32.15 H new ATOM 0 HD3 PRO A 17 -5.116 -17.400 5.985 1.00 32.15 H new ATOM 242 N CYS A 18 -7.232 -16.964 9.930 1.00 3.11 N ATOM 243 CA CYS A 18 -8.012 -16.431 11.041 1.00 2.23 C ATOM 244 C CYS A 18 -8.955 -17.491 11.601 1.00 0.42 C ATOM 245 O CYS A 18 -9.130 -17.603 12.815 1.00 1.54 O ATOM 246 CB CYS A 18 -8.810 -15.207 10.590 1.00 34.02 C ATOM 247 SG CYS A 18 -8.697 -13.796 11.715 1.00 1.10 S ATOM 0 H CYS A 18 -7.260 -16.395 9.084 1.00 3.11 H new ATOM 0 HA CYS A 18 -7.320 -16.134 11.829 1.00 2.23 H new ATOM 0 HB2 CYS A 18 -8.459 -14.901 9.604 1.00 34.02 H new ATOM 0 HB3 CYS A 18 -9.857 -15.489 10.482 1.00 34.02 H new ATOM 0 HG CYS A 18 -9.203 -12.744 11.143 1.00 1.10 H new ATOM 253 N LEU A 19 -9.562 -18.265 10.709 1.00 20.51 N ATOM 254 CA LEU A 19 -10.490 -19.316 11.114 1.00 64.24 C ATOM 255 C LEU A 19 -9.737 -20.573 11.538 1.00 72.43 C ATOM 256 O LEU A 19 -10.066 -21.195 12.549 1.00 63.21 O ATOM 257 CB LEU A 19 -11.450 -19.644 9.969 1.00 22.40 C ATOM 258 CG LEU A 19 -11.802 -18.486 9.035 1.00 44.00 C ATOM 259 CD1 LEU A 19 -12.842 -18.920 8.014 1.00 32.25 C ATOM 260 CD2 LEU A 19 -12.301 -17.290 9.833 1.00 61.31 C ATOM 0 H LEU A 19 -9.429 -18.185 9.701 1.00 20.51 H new ATOM 0 HA LEU A 19 -11.063 -18.953 11.967 1.00 64.24 H new ATOM 0 HB2 LEU A 19 -11.012 -20.445 9.373 1.00 22.40 H new ATOM 0 HB3 LEU A 19 -12.374 -20.033 10.397 1.00 22.40 H new ATOM 0 HG LEU A 19 -10.900 -18.189 8.500 1.00 44.00 H new ATOM 0 HD11 LEU A 19 -13.080 -18.082 7.358 1.00 32.25 H new ATOM 0 HD12 LEU A 19 -12.447 -19.745 7.421 1.00 32.25 H new ATOM 0 HD13 LEU A 19 -13.746 -19.244 8.530 1.00 32.25 H new ATOM 0 HD21 LEU A 19 -12.547 -16.475 9.152 1.00 61.31 H new ATOM 0 HD22 LEU A 19 -13.190 -17.574 10.396 1.00 61.31 H new ATOM 0 HD23 LEU A 19 -11.524 -16.963 10.524 1.00 61.31 H new ATOM 272 N LEU A 20 -8.725 -20.941 10.760 1.00 71.32 N ATOM 273 CA LEU A 20 -7.923 -22.124 11.056 1.00 53.43 C ATOM 274 C LEU A 20 -7.414 -22.090 12.493 1.00 64.21 C ATOM 275 O LEU A 20 -7.466 -23.094 13.204 1.00 71.32 O ATOM 276 CB LEU A 20 -6.744 -22.220 10.086 1.00 1.23 C ATOM 277 CG LEU A 20 -6.690 -23.477 9.218 1.00 65.20 C ATOM 278 CD1 LEU A 20 -7.656 -23.361 8.049 1.00 21.14 C ATOM 279 CD2 LEU A 20 -5.273 -23.720 8.719 1.00 44.33 C ATOM 0 H LEU A 20 -8.440 -20.438 9.920 1.00 71.32 H new ATOM 0 HA LEU A 20 -8.556 -23.003 10.936 1.00 53.43 H new ATOM 0 HB2 LEU A 20 -6.768 -21.350 9.430 1.00 1.23 H new ATOM 0 HB3 LEU A 20 -5.820 -22.160 10.661 1.00 1.23 H new ATOM 0 HG LEU A 20 -6.991 -24.329 9.828 1.00 65.20 H new ATOM 0 HD11 LEU A 20 -7.603 -24.265 7.442 1.00 21.14 H new ATOM 0 HD12 LEU A 20 -8.671 -23.236 8.427 1.00 21.14 H new ATOM 0 HD13 LEU A 20 -7.387 -22.499 7.439 1.00 21.14 H new ATOM 0 HD21 LEU A 20 -5.253 -24.619 8.103 1.00 44.33 H new ATOM 0 HD22 LEU A 20 -4.945 -22.866 8.126 1.00 44.33 H new ATOM 0 HD23 LEU A 20 -4.605 -23.849 9.570 1.00 44.33 H new ATOM 291 N ILE A 21 -6.923 -20.930 12.914 1.00 10.44 N ATOM 292 CA ILE A 21 -6.407 -20.765 14.268 1.00 74.02 C ATOM 293 C ILE A 21 -7.543 -20.690 15.283 1.00 4.12 C ATOM 294 O ILE A 21 -7.401 -21.135 16.422 1.00 2.21 O ATOM 295 CB ILE A 21 -5.540 -19.498 14.390 1.00 60.34 C ATOM 296 CG1 ILE A 21 -6.382 -18.249 14.121 1.00 60.44 C ATOM 297 CG2 ILE A 21 -4.363 -19.568 13.428 1.00 52.42 C ATOM 298 CD1 ILE A 21 -5.558 -17.024 13.792 1.00 61.32 C ATOM 0 H ILE A 21 -6.871 -20.090 12.338 1.00 10.44 H new ATOM 0 HA ILE A 21 -5.790 -21.639 14.480 1.00 74.02 H new ATOM 0 HB ILE A 21 -5.151 -19.438 15.406 1.00 60.34 H new ATOM 0 HG12 ILE A 21 -7.063 -18.451 13.295 1.00 60.44 H new ATOM 0 HG13 ILE A 21 -6.996 -18.039 14.997 1.00 60.44 H new ATOM 0 HG21 ILE A 21 -3.759 -18.666 13.525 1.00 52.42 H new ATOM 0 HG22 ILE A 21 -3.753 -20.440 13.663 1.00 52.42 H new ATOM 0 HG23 ILE A 21 -4.733 -19.648 12.406 1.00 52.42 H new ATOM 0 HD11 ILE A 21 -6.221 -16.177 13.613 1.00 61.32 H new ATOM 0 HD12 ILE A 21 -4.895 -16.796 14.627 1.00 61.32 H new ATOM 0 HD13 ILE A 21 -4.964 -17.215 12.898 1.00 61.32 H new ATOM 310 N SER A 22 -8.670 -20.125 14.862 1.00 63.21 N ATOM 311 CA SER A 22 -9.830 -19.990 15.735 1.00 3.10 C ATOM 312 C SER A 22 -10.414 -21.357 16.078 1.00 2.12 C ATOM 313 O SER A 22 -10.512 -21.726 17.249 1.00 21.01 O ATOM 314 CB SER A 22 -10.897 -19.119 15.069 1.00 20.21 C ATOM 315 OG SER A 22 -10.676 -17.746 15.339 1.00 11.33 O ATOM 0 H SER A 22 -8.804 -19.753 13.922 1.00 63.21 H new ATOM 0 HA SER A 22 -9.505 -19.511 16.659 1.00 3.10 H new ATOM 0 HB2 SER A 22 -10.888 -19.287 13.992 1.00 20.21 H new ATOM 0 HB3 SER A 22 -11.884 -19.409 15.429 1.00 20.21 H new ATOM 0 HG SER A 22 -10.136 -17.354 14.621 1.00 11.33 H new ATOM 321 N CYS A 23 -10.800 -22.103 15.049 1.00 31.14 N ATOM 322 CA CYS A 23 -11.376 -23.430 15.240 1.00 3.35 C ATOM 323 C CYS A 23 -10.401 -24.344 15.976 1.00 74.33 C ATOM 324 O CYS A 23 -10.810 -25.211 16.749 1.00 33.42 O ATOM 325 CB CYS A 23 -11.752 -24.044 13.892 1.00 60.24 C ATOM 326 SG CYS A 23 -13.507 -23.903 13.480 1.00 60.20 S ATOM 0 H CYS A 23 -10.725 -21.812 14.074 1.00 31.14 H new ATOM 0 HA CYS A 23 -12.276 -23.326 15.846 1.00 3.35 H new ATOM 0 HB2 CYS A 23 -11.166 -23.562 13.109 1.00 60.24 H new ATOM 0 HB3 CYS A 23 -11.474 -25.098 13.895 1.00 60.24 H new ATOM 0 HG CYS A 23 -13.726 -24.449 12.321 1.00 60.20 H new ATOM 332 N LEU A 24 -9.111 -24.146 15.728 1.00 33.54 N ATOM 333 CA LEU A 24 -8.077 -24.955 16.366 1.00 54.43 C ATOM 334 C LEU A 24 -8.256 -24.972 17.880 1.00 35.14 C ATOM 335 O LEU A 24 -8.405 -26.033 18.487 1.00 20.42 O ATOM 336 CB LEU A 24 -6.690 -24.416 16.011 1.00 54.11 C ATOM 337 CG LEU A 24 -5.768 -25.378 15.261 1.00 54.02 C ATOM 338 CD1 LEU A 24 -4.837 -24.612 14.335 1.00 42.42 C ATOM 339 CD2 LEU A 24 -4.971 -26.225 16.241 1.00 25.31 C ATOM 0 H LEU A 24 -8.756 -23.433 15.091 1.00 33.54 H new ATOM 0 HA LEU A 24 -8.169 -25.976 15.997 1.00 54.43 H new ATOM 0 HB2 LEU A 24 -6.815 -23.518 15.406 1.00 54.11 H new ATOM 0 HB3 LEU A 24 -6.193 -24.113 16.933 1.00 54.11 H new ATOM 0 HG LEU A 24 -6.383 -26.043 14.655 1.00 54.02 H new ATOM 0 HD11 LEU A 24 -4.188 -25.313 13.810 1.00 42.42 H new ATOM 0 HD12 LEU A 24 -5.426 -24.050 13.610 1.00 42.42 H new ATOM 0 HD13 LEU A 24 -4.228 -23.923 14.920 1.00 42.42 H new ATOM 0 HD21 LEU A 24 -4.320 -26.904 15.690 1.00 25.31 H new ATOM 0 HD22 LEU A 24 -4.366 -25.576 16.874 1.00 25.31 H new ATOM 0 HD23 LEU A 24 -5.655 -26.803 16.862 1.00 25.31 H new ATOM 351 N THR A 25 -8.244 -23.789 18.487 1.00 44.15 N ATOM 352 CA THR A 25 -8.405 -23.668 19.930 1.00 53.22 C ATOM 353 C THR A 25 -9.690 -24.343 20.398 1.00 43.53 C ATOM 354 O THR A 25 -9.709 -25.017 21.427 1.00 10.04 O ATOM 355 CB THR A 25 -8.424 -22.192 20.371 1.00 20.11 C ATOM 356 OG1 THR A 25 -9.562 -21.528 19.811 1.00 50.40 O ATOM 357 CG2 THR A 25 -7.151 -21.481 19.937 1.00 21.41 C ATOM 0 H THR A 25 -8.124 -22.901 18.000 1.00 44.15 H new ATOM 0 HA THR A 25 -7.549 -24.165 20.387 1.00 53.22 H new ATOM 0 HB THR A 25 -8.485 -22.162 21.459 1.00 20.11 H new ATOM 0 HG1 THR A 25 -9.625 -21.737 18.856 1.00 50.40 H new ATOM 0 HG21 THR A 25 -7.187 -20.440 20.259 1.00 21.41 H new ATOM 0 HG22 THR A 25 -6.288 -21.971 20.389 1.00 21.41 H new ATOM 0 HG23 THR A 25 -7.064 -21.521 18.851 1.00 21.41 H new ATOM 365 N VAL A 26 -10.762 -24.157 19.634 1.00 31.24 N ATOM 366 CA VAL A 26 -12.051 -24.750 19.970 1.00 11.02 C ATOM 367 C VAL A 26 -11.986 -26.272 19.918 1.00 74.24 C ATOM 368 O VAL A 26 -12.612 -26.960 20.726 1.00 51.42 O ATOM 369 CB VAL A 26 -13.159 -24.261 19.018 1.00 22.01 C ATOM 370 CG1 VAL A 26 -14.418 -25.096 19.190 1.00 33.43 C ATOM 371 CG2 VAL A 26 -13.451 -22.787 19.254 1.00 44.25 C ATOM 0 H VAL A 26 -10.763 -23.601 18.779 1.00 31.24 H new ATOM 0 HA VAL A 26 -12.290 -24.434 20.986 1.00 11.02 H new ATOM 0 HB VAL A 26 -12.811 -24.380 17.992 1.00 22.01 H new ATOM 0 HG11 VAL A 26 -15.189 -24.736 18.509 1.00 33.43 H new ATOM 0 HG12 VAL A 26 -14.196 -26.140 18.967 1.00 33.43 H new ATOM 0 HG13 VAL A 26 -14.773 -25.012 20.217 1.00 33.43 H new ATOM 0 HG21 VAL A 26 -14.236 -22.458 18.573 1.00 44.25 H new ATOM 0 HG22 VAL A 26 -13.779 -22.641 20.283 1.00 44.25 H new ATOM 0 HG23 VAL A 26 -12.548 -22.204 19.075 1.00 44.25 H new ATOM 381 N LEU A 27 -11.225 -26.794 18.962 1.00 52.42 N ATOM 382 CA LEU A 27 -11.077 -28.236 18.803 1.00 34.32 C ATOM 383 C LEU A 27 -10.557 -28.875 20.087 1.00 11.20 C ATOM 384 O LEU A 27 -11.083 -29.889 20.546 1.00 51.20 O ATOM 385 CB LEU A 27 -10.128 -28.547 17.645 1.00 73.25 C ATOM 386 CG LEU A 27 -10.641 -29.546 16.607 1.00 61.15 C ATOM 387 CD1 LEU A 27 -11.103 -30.828 17.282 1.00 65.11 C ATOM 388 CD2 LEU A 27 -11.770 -28.935 15.790 1.00 13.43 C ATOM 0 H LEU A 27 -10.701 -26.240 18.285 1.00 52.42 H new ATOM 0 HA LEU A 27 -12.059 -28.655 18.582 1.00 34.32 H new ATOM 0 HB2 LEU A 27 -9.891 -27.613 17.135 1.00 73.25 H new ATOM 0 HB3 LEU A 27 -9.195 -28.930 18.059 1.00 73.25 H new ATOM 0 HG LEU A 27 -9.821 -29.790 15.931 1.00 61.15 H new ATOM 0 HD11 LEU A 27 -11.465 -31.527 16.527 1.00 65.11 H new ATOM 0 HD12 LEU A 27 -10.269 -31.276 17.821 1.00 65.11 H new ATOM 0 HD13 LEU A 27 -11.907 -30.601 17.982 1.00 65.11 H new ATOM 0 HD21 LEU A 27 -12.122 -29.660 15.057 1.00 13.43 H new ATOM 0 HD22 LEU A 27 -12.591 -28.661 16.452 1.00 13.43 H new ATOM 0 HD23 LEU A 27 -11.406 -28.046 15.275 1.00 13.43 H new ATOM 400 N VAL A 28 -9.522 -28.273 20.664 1.00 44.02 N ATOM 401 CA VAL A 28 -8.932 -28.781 21.897 1.00 41.42 C ATOM 402 C VAL A 28 -9.961 -28.823 23.021 1.00 4.01 C ATOM 403 O VAL A 28 -9.995 -29.767 23.811 1.00 61.14 O ATOM 404 CB VAL A 28 -7.735 -27.919 22.343 1.00 74.42 C ATOM 405 CG1 VAL A 28 -7.496 -28.071 23.837 1.00 2.22 C ATOM 406 CG2 VAL A 28 -6.489 -28.291 21.554 1.00 23.13 C ATOM 0 H VAL A 28 -9.075 -27.433 20.297 1.00 44.02 H new ATOM 0 HA VAL A 28 -8.584 -29.793 21.689 1.00 41.42 H new ATOM 0 HB VAL A 28 -7.966 -26.873 22.141 1.00 74.42 H new ATOM 0 HG11 VAL A 28 -6.647 -27.455 24.134 1.00 2.22 H new ATOM 0 HG12 VAL A 28 -8.384 -27.752 24.382 1.00 2.22 H new ATOM 0 HG13 VAL A 28 -7.285 -29.115 24.067 1.00 2.22 H new ATOM 0 HG21 VAL A 28 -5.653 -27.673 21.881 1.00 23.13 H new ATOM 0 HG22 VAL A 28 -6.252 -29.341 21.723 1.00 23.13 H new ATOM 0 HG23 VAL A 28 -6.668 -28.126 20.492 1.00 23.13 H new ATOM 416 N PHE A 29 -10.799 -27.794 23.088 1.00 42.11 N ATOM 417 CA PHE A 29 -11.829 -27.713 24.116 1.00 14.34 C ATOM 418 C PHE A 29 -12.920 -28.753 23.877 1.00 24.22 C ATOM 419 O PHE A 29 -13.638 -29.139 24.800 1.00 41.03 O ATOM 420 CB PHE A 29 -12.443 -26.311 24.144 1.00 73.53 C ATOM 421 CG PHE A 29 -12.289 -25.615 25.466 1.00 71.24 C ATOM 422 CD1 PHE A 29 -11.031 -25.342 25.977 1.00 22.33 C ATOM 423 CD2 PHE A 29 -13.403 -25.234 26.197 1.00 63.12 C ATOM 424 CE1 PHE A 29 -10.885 -24.701 27.193 1.00 34.33 C ATOM 425 CE2 PHE A 29 -13.264 -24.593 27.413 1.00 5.40 C ATOM 426 CZ PHE A 29 -12.003 -24.327 27.912 1.00 15.05 C ATOM 0 H PHE A 29 -10.785 -27.005 22.442 1.00 42.11 H new ATOM 0 HA PHE A 29 -11.362 -27.917 25.079 1.00 14.34 H new ATOM 0 HB2 PHE A 29 -11.979 -25.704 23.367 1.00 73.53 H new ATOM 0 HB3 PHE A 29 -13.503 -26.383 23.902 1.00 73.53 H new ATOM 0 HD1 PHE A 29 -10.154 -25.633 25.419 1.00 22.33 H new ATOM 0 HD2 PHE A 29 -14.391 -25.440 25.812 1.00 63.12 H new ATOM 0 HE1 PHE A 29 -9.898 -24.493 27.580 1.00 34.33 H new ATOM 0 HE2 PHE A 29 -14.140 -24.300 27.973 1.00 5.40 H new ATOM 0 HZ PHE A 29 -11.892 -23.827 28.863 1.00 15.05 H new ATOM 436 N TYR A 30 -13.037 -29.203 22.633 1.00 41.22 N ATOM 437 CA TYR A 30 -14.041 -30.196 22.270 1.00 21.04 C ATOM 438 C TYR A 30 -13.452 -31.603 22.304 1.00 32.12 C ATOM 439 O TYR A 30 -14.159 -32.590 22.093 1.00 4.10 O ATOM 440 CB TYR A 30 -14.603 -29.900 20.879 1.00 41.40 C ATOM 441 CG TYR A 30 -16.022 -30.385 20.683 1.00 4.51 C ATOM 442 CD1 TYR A 30 -16.280 -31.666 20.213 1.00 32.12 C ATOM 443 CD2 TYR A 30 -17.104 -29.561 20.969 1.00 44.10 C ATOM 444 CE1 TYR A 30 -17.575 -32.113 20.032 1.00 2.21 C ATOM 445 CE2 TYR A 30 -18.402 -30.000 20.792 1.00 4.33 C ATOM 446 CZ TYR A 30 -18.632 -31.276 20.323 1.00 20.11 C ATOM 447 OH TYR A 30 -19.923 -31.718 20.145 1.00 11.14 O ATOM 0 H TYR A 30 -12.449 -28.896 21.858 1.00 41.22 H new ATOM 0 HA TYR A 30 -14.849 -30.142 23.000 1.00 21.04 H new ATOM 0 HB2 TYR A 30 -14.568 -28.825 20.704 1.00 41.40 H new ATOM 0 HB3 TYR A 30 -13.962 -30.366 20.131 1.00 41.40 H new ATOM 0 HD1 TYR A 30 -15.455 -32.324 19.985 1.00 32.12 H new ATOM 0 HD2 TYR A 30 -16.927 -28.561 21.336 1.00 44.10 H new ATOM 0 HE1 TYR A 30 -17.758 -33.112 19.665 1.00 2.21 H new ATOM 0 HE2 TYR A 30 -19.232 -29.347 21.020 1.00 4.33 H new ATOM 0 HH TYR A 30 -20.550 -31.008 20.397 1.00 11.14 H new ATOM 457 N LEU A 31 -12.154 -31.688 22.572 1.00 42.40 N ATOM 458 CA LEU A 31 -11.468 -32.973 22.635 1.00 63.52 C ATOM 459 C LEU A 31 -10.080 -32.821 23.250 1.00 51.24 C ATOM 460 O LEU A 31 -9.058 -32.977 22.582 1.00 43.23 O ATOM 461 CB LEU A 31 -11.354 -33.582 21.236 1.00 31.10 C ATOM 462 CG LEU A 31 -11.222 -35.104 21.175 1.00 74.20 C ATOM 463 CD1 LEU A 31 -12.582 -35.765 21.340 1.00 54.35 C ATOM 464 CD2 LEU A 31 -10.575 -35.531 19.866 1.00 61.52 C ATOM 0 H LEU A 31 -11.555 -30.882 22.749 1.00 42.40 H new ATOM 0 HA LEU A 31 -12.055 -33.639 23.268 1.00 63.52 H new ATOM 0 HB2 LEU A 31 -12.233 -33.290 20.662 1.00 31.10 H new ATOM 0 HB3 LEU A 31 -10.489 -33.142 20.740 1.00 31.10 H new ATOM 0 HG LEU A 31 -10.582 -35.427 21.996 1.00 74.20 H new ATOM 0 HD11 LEU A 31 -12.468 -36.848 21.294 1.00 54.35 H new ATOM 0 HD12 LEU A 31 -13.008 -35.486 22.304 1.00 54.35 H new ATOM 0 HD13 LEU A 31 -13.246 -35.436 20.541 1.00 54.35 H new ATOM 0 HD21 LEU A 31 -10.489 -36.617 19.840 1.00 61.52 H new ATOM 0 HD22 LEU A 31 -11.189 -35.195 19.030 1.00 61.52 H new ATOM 0 HD23 LEU A 31 -9.583 -35.087 19.789 1.00 61.52 H new ATOM 476 N PRO A 32 -10.041 -32.510 24.554 1.00 74.50 N ATOM 477 CA PRO A 32 -8.785 -32.333 25.288 1.00 13.24 C ATOM 478 C PRO A 32 -8.034 -33.646 25.478 1.00 20.12 C ATOM 479 O PRO A 32 -8.497 -34.704 25.053 1.00 33.31 O ATOM 480 CB PRO A 32 -9.240 -31.777 26.640 1.00 13.11 C ATOM 481 CG PRO A 32 -10.639 -32.264 26.798 1.00 14.52 C ATOM 482 CD PRO A 32 -11.221 -32.310 25.412 1.00 0.33 C ATOM 0 HA PRO A 32 -8.090 -31.683 24.756 1.00 13.24 H new ATOM 0 HB2 PRO A 32 -8.603 -32.133 27.449 1.00 13.11 H new ATOM 0 HB3 PRO A 32 -9.196 -30.688 26.655 1.00 13.11 H new ATOM 0 HG2 PRO A 32 -10.659 -33.250 27.262 1.00 14.52 H new ATOM 0 HG3 PRO A 32 -11.214 -31.597 27.441 1.00 14.52 H new ATOM 0 HD2 PRO A 32 -11.939 -33.123 25.304 1.00 0.33 H new ATOM 0 HD3 PRO A 32 -11.746 -31.387 25.165 1.00 0.33 H new ATOM 490 N SER A 33 -6.872 -33.571 26.120 1.00 52.43 N ATOM 491 CA SER A 33 -6.055 -34.754 26.363 1.00 51.41 C ATOM 492 C SER A 33 -5.187 -34.568 27.604 1.00 61.33 C ATOM 493 O SER A 33 -5.380 -35.242 28.615 1.00 14.22 O ATOM 494 CB SER A 33 -5.173 -35.048 25.148 1.00 24.34 C ATOM 495 OG SER A 33 -3.983 -35.716 25.532 1.00 32.34 O ATOM 0 H SER A 33 -6.476 -32.703 26.481 1.00 52.43 H new ATOM 0 HA SER A 33 -6.722 -35.599 26.531 1.00 51.41 H new ATOM 0 HB2 SER A 33 -5.724 -35.661 24.434 1.00 24.34 H new ATOM 0 HB3 SER A 33 -4.923 -34.116 24.642 1.00 24.34 H new ATOM 0 HG SER A 33 -3.437 -35.894 24.738 1.00 32.34 H new ATOM 501 N GLU A 34 -4.230 -33.650 27.517 1.00 64.12 N ATOM 502 CA GLU A 34 -3.331 -33.376 28.632 1.00 21.40 C ATOM 503 C GLU A 34 -3.888 -32.268 29.520 1.00 1.42 C ATOM 504 O GLU A 34 -5.009 -31.799 29.317 1.00 44.12 O ATOM 505 CB GLU A 34 -1.946 -32.983 28.115 1.00 25.30 C ATOM 506 CG GLU A 34 -0.809 -33.736 28.786 1.00 31.40 C ATOM 507 CD GLU A 34 -0.074 -34.656 27.830 1.00 0.32 C ATOM 508 OE1 GLU A 34 -0.734 -35.251 26.953 1.00 43.53 O ATOM 509 OE2 GLU A 34 1.162 -34.780 27.960 1.00 0.21 O ATOM 0 H GLU A 34 -4.057 -33.084 26.687 1.00 64.12 H new ATOM 0 HA GLU A 34 -3.244 -34.285 29.227 1.00 21.40 H new ATOM 0 HB2 GLU A 34 -1.904 -33.162 27.041 1.00 25.30 H new ATOM 0 HB3 GLU A 34 -1.801 -31.913 28.266 1.00 25.30 H new ATOM 0 HG2 GLU A 34 -0.104 -33.020 29.210 1.00 31.40 H new ATOM 0 HG3 GLU A 34 -1.206 -34.322 29.615 1.00 31.40 H new ATOM 516 N CYS A 35 -3.098 -31.854 30.505 1.00 53.22 N ATOM 517 CA CYS A 35 -3.512 -30.801 31.426 1.00 51.03 C ATOM 518 C CYS A 35 -2.874 -29.468 31.050 1.00 41.24 C ATOM 519 O CYS A 35 -3.407 -28.403 31.360 1.00 23.31 O ATOM 520 CB CYS A 35 -3.136 -31.173 32.861 1.00 73.23 C ATOM 521 SG CYS A 35 -3.641 -32.840 33.347 1.00 11.13 S ATOM 0 H CYS A 35 -2.168 -32.231 30.686 1.00 53.22 H new ATOM 0 HA CYS A 35 -4.595 -30.697 31.357 1.00 51.03 H new ATOM 0 HB2 CYS A 35 -2.056 -31.084 32.977 1.00 73.23 H new ATOM 0 HB3 CYS A 35 -3.590 -30.454 33.543 1.00 73.23 H new ATOM 0 HG CYS A 35 -3.277 -33.063 34.575 1.00 11.13 H new ATOM 527 N GLY A 36 -1.727 -29.534 30.380 1.00 73.44 N ATOM 528 CA GLY A 36 -1.034 -28.326 29.974 1.00 50.22 C ATOM 529 C GLY A 36 -1.260 -27.990 28.513 1.00 72.41 C ATOM 530 O GLY A 36 -0.967 -26.880 28.072 1.00 4.44 O ATOM 0 H GLY A 36 -1.266 -30.403 30.111 1.00 73.44 H new ATOM 0 HA2 GLY A 36 -1.371 -27.493 30.591 1.00 50.22 H new ATOM 0 HA3 GLY A 36 0.034 -28.446 30.155 1.00 50.22 H new ATOM 534 N GLU A 37 -1.782 -28.954 27.760 1.00 13.30 N ATOM 535 CA GLU A 37 -2.045 -28.754 26.340 1.00 63.54 C ATOM 536 C GLU A 37 -3.000 -27.585 26.122 1.00 54.04 C ATOM 537 O GLU A 37 -2.925 -26.886 25.111 1.00 71.44 O ATOM 538 CB GLU A 37 -2.629 -30.027 25.723 1.00 54.11 C ATOM 539 CG GLU A 37 -2.399 -30.139 24.225 1.00 14.31 C ATOM 540 CD GLU A 37 -1.004 -30.623 23.884 1.00 45.43 C ATOM 541 OE1 GLU A 37 -0.278 -31.039 24.811 1.00 64.43 O ATOM 542 OE2 GLU A 37 -0.637 -30.584 22.691 1.00 61.42 O ATOM 0 H GLU A 37 -2.031 -29.879 28.109 1.00 13.30 H new ATOM 0 HA GLU A 37 -1.099 -28.522 25.851 1.00 63.54 H new ATOM 0 HB2 GLU A 37 -2.189 -30.894 26.215 1.00 54.11 H new ATOM 0 HB3 GLU A 37 -3.700 -30.058 25.921 1.00 54.11 H new ATOM 0 HG2 GLU A 37 -3.132 -30.824 23.799 1.00 14.31 H new ATOM 0 HG3 GLU A 37 -2.565 -29.166 23.762 1.00 14.31 H new ATOM 549 N LYS A 38 -3.900 -27.378 27.077 1.00 11.12 N ATOM 550 CA LYS A 38 -4.871 -26.294 26.992 1.00 12.45 C ATOM 551 C LYS A 38 -4.217 -24.951 27.303 1.00 23.44 C ATOM 552 O LYS A 38 -4.399 -23.978 26.572 1.00 1.52 O ATOM 553 CB LYS A 38 -6.031 -26.544 27.959 1.00 11.51 C ATOM 554 CG LYS A 38 -7.239 -27.192 27.305 1.00 10.30 C ATOM 555 CD LYS A 38 -6.969 -28.645 26.952 1.00 14.12 C ATOM 556 CE LYS A 38 -6.975 -29.529 28.190 1.00 74.34 C ATOM 557 NZ LYS A 38 -8.322 -29.589 28.822 1.00 11.55 N ATOM 0 H LYS A 38 -3.977 -27.947 27.920 1.00 11.12 H new ATOM 0 HA LYS A 38 -5.255 -26.264 25.972 1.00 12.45 H new ATOM 0 HB2 LYS A 38 -5.684 -27.181 28.773 1.00 11.51 H new ATOM 0 HB3 LYS A 38 -6.334 -25.596 28.403 1.00 11.51 H new ATOM 0 HG2 LYS A 38 -8.094 -27.133 27.979 1.00 10.30 H new ATOM 0 HG3 LYS A 38 -7.505 -26.641 26.403 1.00 10.30 H new ATOM 0 HD2 LYS A 38 -7.724 -28.996 26.249 1.00 14.12 H new ATOM 0 HD3 LYS A 38 -6.005 -28.726 26.450 1.00 14.12 H new ATOM 0 HE2 LYS A 38 -6.656 -30.535 27.919 1.00 74.34 H new ATOM 0 HE3 LYS A 38 -6.252 -29.149 28.911 1.00 74.34 H new ATOM 0 HZ1 LYS A 38 -8.299 -29.093 29.736 1.00 11.55 H new ATOM 0 HZ2 LYS A 38 -9.019 -29.134 28.198 1.00 11.55 H new ATOM 0 HZ3 LYS A 38 -8.590 -30.582 28.974 1.00 11.55 H new ATOM 571 N ILE A 39 -3.454 -24.908 28.391 1.00 51.14 N ATOM 572 CA ILE A 39 -2.771 -23.686 28.796 1.00 50.45 C ATOM 573 C ILE A 39 -1.823 -23.199 27.705 1.00 3.21 C ATOM 574 O ILE A 39 -1.877 -22.040 27.291 1.00 60.44 O ATOM 575 CB ILE A 39 -1.975 -23.891 30.098 1.00 13.52 C ATOM 576 CG1 ILE A 39 -2.917 -24.277 31.241 1.00 44.10 C ATOM 577 CG2 ILE A 39 -1.198 -22.630 30.448 1.00 71.31 C ATOM 578 CD1 ILE A 39 -2.261 -25.137 32.299 1.00 74.13 C ATOM 0 H ILE A 39 -3.294 -25.705 29.007 1.00 51.14 H new ATOM 0 HA ILE A 39 -3.542 -22.935 28.966 1.00 50.45 H new ATOM 0 HB ILE A 39 -1.263 -24.703 29.948 1.00 13.52 H new ATOM 0 HG12 ILE A 39 -3.300 -23.370 31.708 1.00 44.10 H new ATOM 0 HG13 ILE A 39 -3.774 -24.811 30.830 1.00 44.10 H new ATOM 0 HG21 ILE A 39 -0.640 -22.791 31.371 1.00 71.31 H new ATOM 0 HG22 ILE A 39 -0.504 -22.394 29.641 1.00 71.31 H new ATOM 0 HG23 ILE A 39 -1.892 -21.801 30.583 1.00 71.31 H new ATOM 0 HD11 ILE A 39 -2.986 -25.372 33.078 1.00 74.13 H new ATOM 0 HD12 ILE A 39 -1.902 -26.061 31.846 1.00 74.13 H new ATOM 0 HD13 ILE A 39 -1.421 -24.598 32.737 1.00 74.13 H new ATOM 590 N THR A 40 -0.954 -24.092 27.242 1.00 62.02 N ATOM 591 CA THR A 40 0.006 -23.754 26.199 1.00 65.53 C ATOM 592 C THR A 40 -0.699 -23.253 24.944 1.00 64.24 C ATOM 593 O THR A 40 -0.237 -22.315 24.292 1.00 24.41 O ATOM 594 CB THR A 40 0.885 -24.965 25.831 1.00 5.13 C ATOM 595 OG1 THR A 40 1.221 -25.703 27.012 1.00 44.43 O ATOM 596 CG2 THR A 40 2.158 -24.516 25.128 1.00 33.23 C ATOM 0 H THR A 40 -0.895 -25.055 27.573 1.00 62.02 H new ATOM 0 HA THR A 40 0.640 -22.962 26.597 1.00 65.53 H new ATOM 0 HB THR A 40 0.320 -25.604 25.152 1.00 5.13 H new ATOM 0 HG1 THR A 40 0.453 -26.246 27.288 1.00 44.43 H new ATOM 0 HG21 THR A 40 2.762 -25.388 24.878 1.00 33.23 H new ATOM 0 HG22 THR A 40 1.900 -23.980 24.215 1.00 33.23 H new ATOM 0 HG23 THR A 40 2.725 -23.858 25.787 1.00 33.23 H new ATOM 604 N LEU A 41 -1.820 -23.883 24.609 1.00 3.53 N ATOM 605 CA LEU A 41 -2.590 -23.499 23.431 1.00 30.42 C ATOM 606 C LEU A 41 -3.015 -22.037 23.511 1.00 55.23 C ATOM 607 O LEU A 41 -2.887 -21.289 22.541 1.00 60.05 O ATOM 608 CB LEU A 41 -3.823 -24.394 23.291 1.00 62.05 C ATOM 609 CG LEU A 41 -4.823 -23.993 22.206 1.00 62.15 C ATOM 610 CD1 LEU A 41 -5.355 -25.224 21.489 1.00 62.34 C ATOM 611 CD2 LEU A 41 -5.966 -23.187 22.805 1.00 20.33 C ATOM 0 H LEU A 41 -2.216 -24.661 25.136 1.00 3.53 H new ATOM 0 HA LEU A 41 -1.955 -23.625 22.554 1.00 30.42 H new ATOM 0 HB2 LEU A 41 -3.488 -25.412 23.090 1.00 62.05 H new ATOM 0 HB3 LEU A 41 -4.344 -24.413 24.248 1.00 62.05 H new ATOM 0 HG LEU A 41 -4.307 -23.368 21.477 1.00 62.15 H new ATOM 0 HD11 LEU A 41 -6.065 -24.919 20.720 1.00 62.34 H new ATOM 0 HD12 LEU A 41 -4.527 -25.761 21.026 1.00 62.34 H new ATOM 0 HD13 LEU A 41 -5.854 -25.875 22.206 1.00 62.34 H new ATOM 0 HD21 LEU A 41 -6.668 -22.910 22.018 1.00 20.33 H new ATOM 0 HD22 LEU A 41 -6.480 -23.787 23.555 1.00 20.33 H new ATOM 0 HD23 LEU A 41 -5.570 -22.285 23.271 1.00 20.33 H new ATOM 623 N CYS A 42 -3.520 -21.635 24.672 1.00 20.30 N ATOM 624 CA CYS A 42 -3.963 -20.261 24.879 1.00 20.00 C ATOM 625 C CYS A 42 -2.842 -19.275 24.566 1.00 21.41 C ATOM 626 O CYS A 42 -3.079 -18.213 23.991 1.00 11.31 O ATOM 627 CB CYS A 42 -4.440 -20.069 26.319 1.00 14.51 C ATOM 628 SG CYS A 42 -4.289 -18.372 26.926 1.00 34.24 S ATOM 0 H CYS A 42 -3.633 -22.241 25.485 1.00 20.30 H new ATOM 0 HA CYS A 42 -4.793 -20.067 24.200 1.00 20.00 H new ATOM 0 HB2 CYS A 42 -5.483 -20.377 26.389 1.00 14.51 H new ATOM 0 HB3 CYS A 42 -3.868 -20.729 26.971 1.00 14.51 H new ATOM 0 HG CYS A 42 -4.719 -18.309 28.151 1.00 34.24 H new ATOM 634 N ILE A 43 -1.621 -19.634 24.949 1.00 34.55 N ATOM 635 CA ILE A 43 -0.464 -18.781 24.710 1.00 31.31 C ATOM 636 C ILE A 43 -0.004 -18.873 23.259 1.00 32.01 C ATOM 637 O ILE A 43 0.525 -17.911 22.703 1.00 5.01 O ATOM 638 CB ILE A 43 0.711 -19.154 25.634 1.00 53.12 C ATOM 639 CG1 ILE A 43 0.361 -18.842 27.090 1.00 23.34 C ATOM 640 CG2 ILE A 43 1.970 -18.411 25.215 1.00 42.33 C ATOM 641 CD1 ILE A 43 1.090 -19.716 28.087 1.00 61.41 C ATOM 0 H ILE A 43 -1.408 -20.510 25.426 1.00 34.55 H new ATOM 0 HA ILE A 43 -0.775 -17.759 24.926 1.00 31.31 H new ATOM 0 HB ILE A 43 0.898 -20.224 25.546 1.00 53.12 H new ATOM 0 HG12 ILE A 43 0.595 -17.797 27.296 1.00 23.34 H new ATOM 0 HG13 ILE A 43 -0.713 -18.962 27.231 1.00 23.34 H new ATOM 0 HG21 ILE A 43 2.791 -18.685 25.877 1.00 42.33 H new ATOM 0 HG22 ILE A 43 2.226 -18.678 24.190 1.00 42.33 H new ATOM 0 HG23 ILE A 43 1.796 -17.337 25.277 1.00 42.33 H new ATOM 0 HD11 ILE A 43 0.793 -19.439 29.099 1.00 61.41 H new ATOM 0 HD12 ILE A 43 0.837 -20.761 27.908 1.00 61.41 H new ATOM 0 HD13 ILE A 43 2.165 -19.578 27.974 1.00 61.41 H new ATOM 653 N SER A 44 -0.212 -20.036 22.651 1.00 61.34 N ATOM 654 CA SER A 44 0.183 -20.255 21.264 1.00 0.01 C ATOM 655 C SER A 44 -0.510 -19.260 20.338 1.00 13.04 C ATOM 656 O SER A 44 0.140 -18.437 19.694 1.00 51.12 O ATOM 657 CB SER A 44 -0.151 -21.685 20.836 1.00 61.30 C ATOM 658 OG SER A 44 0.886 -22.235 20.042 1.00 22.42 O ATOM 0 H SER A 44 -0.652 -20.841 23.097 1.00 61.34 H new ATOM 0 HA SER A 44 1.260 -20.104 21.191 1.00 0.01 H new ATOM 0 HB2 SER A 44 -0.305 -22.305 21.719 1.00 61.30 H new ATOM 0 HB3 SER A 44 -1.085 -21.691 20.275 1.00 61.30 H new ATOM 0 HG SER A 44 0.649 -23.150 19.783 1.00 22.42 H new ATOM 664 N VAL A 45 -1.836 -19.342 20.278 1.00 63.12 N ATOM 665 CA VAL A 45 -2.619 -18.449 19.432 1.00 31.24 C ATOM 666 C VAL A 45 -2.454 -16.997 19.866 1.00 53.11 C ATOM 667 O VAL A 45 -2.482 -16.084 19.040 1.00 55.34 O ATOM 668 CB VAL A 45 -4.115 -18.816 19.463 1.00 63.00 C ATOM 669 CG1 VAL A 45 -4.336 -20.205 18.883 1.00 50.42 C ATOM 670 CG2 VAL A 45 -4.655 -18.730 20.882 1.00 11.13 C ATOM 0 H VAL A 45 -2.390 -20.017 20.805 1.00 63.12 H new ATOM 0 HA VAL A 45 -2.245 -18.566 18.415 1.00 31.24 H new ATOM 0 HB VAL A 45 -4.660 -18.100 18.847 1.00 63.00 H new ATOM 0 HG11 VAL A 45 -5.398 -20.447 18.913 1.00 50.42 H new ATOM 0 HG12 VAL A 45 -3.988 -20.228 17.850 1.00 50.42 H new ATOM 0 HG13 VAL A 45 -3.780 -20.937 19.469 1.00 50.42 H new ATOM 0 HG21 VAL A 45 -5.713 -18.992 20.885 1.00 11.13 H new ATOM 0 HG22 VAL A 45 -4.108 -19.422 21.522 1.00 11.13 H new ATOM 0 HG23 VAL A 45 -4.532 -17.714 21.257 1.00 11.13 H new ATOM 680 N LEU A 46 -2.282 -16.790 21.167 1.00 42.44 N ATOM 681 CA LEU A 46 -2.111 -15.447 21.711 1.00 34.14 C ATOM 682 C LEU A 46 -0.915 -14.748 21.074 1.00 62.52 C ATOM 683 O LEU A 46 -1.040 -13.650 20.530 1.00 34.24 O ATOM 684 CB LEU A 46 -1.930 -15.510 23.229 1.00 33.41 C ATOM 685 CG LEU A 46 -1.277 -14.290 23.879 1.00 52.04 C ATOM 686 CD1 LEU A 46 -2.102 -13.040 23.615 1.00 44.41 C ATOM 687 CD2 LEU A 46 -1.103 -14.511 25.374 1.00 13.22 C ATOM 0 H LEU A 46 -2.257 -17.534 21.864 1.00 42.44 H new ATOM 0 HA LEU A 46 -3.008 -14.872 21.481 1.00 34.14 H new ATOM 0 HB2 LEU A 46 -2.908 -15.660 23.685 1.00 33.41 H new ATOM 0 HB3 LEU A 46 -1.330 -16.388 23.467 1.00 33.41 H new ATOM 0 HG LEU A 46 -0.291 -14.150 23.436 1.00 52.04 H new ATOM 0 HD11 LEU A 46 -1.622 -12.181 24.085 1.00 44.41 H new ATOM 0 HD12 LEU A 46 -2.174 -12.872 22.540 1.00 44.41 H new ATOM 0 HD13 LEU A 46 -3.102 -13.169 24.030 1.00 44.41 H new ATOM 0 HD21 LEU A 46 -0.637 -13.632 25.820 1.00 13.22 H new ATOM 0 HD22 LEU A 46 -2.078 -14.677 25.833 1.00 13.22 H new ATOM 0 HD23 LEU A 46 -0.470 -15.382 25.542 1.00 13.22 H new ATOM 699 N LEU A 47 0.245 -15.393 21.142 1.00 50.32 N ATOM 700 CA LEU A 47 1.465 -14.835 20.569 1.00 40.40 C ATOM 701 C LEU A 47 1.268 -14.493 19.096 1.00 51.24 C ATOM 702 O LEU A 47 1.645 -13.412 18.643 1.00 62.01 O ATOM 703 CB LEU A 47 2.623 -15.822 20.725 1.00 40.22 C ATOM 704 CG LEU A 47 3.998 -15.207 20.991 1.00 34.44 C ATOM 705 CD1 LEU A 47 4.625 -15.822 22.233 1.00 64.14 C ATOM 706 CD2 LEU A 47 4.907 -15.391 19.785 1.00 12.30 C ATOM 0 H LEU A 47 0.366 -16.302 21.588 1.00 50.32 H new ATOM 0 HA LEU A 47 1.703 -13.917 21.107 1.00 40.40 H new ATOM 0 HB2 LEU A 47 2.387 -16.502 21.544 1.00 40.22 H new ATOM 0 HB3 LEU A 47 2.686 -16.424 19.818 1.00 40.22 H new ATOM 0 HG LEU A 47 3.870 -14.138 21.164 1.00 34.44 H new ATOM 0 HD11 LEU A 47 5.603 -15.373 22.407 1.00 64.14 H new ATOM 0 HD12 LEU A 47 3.982 -15.638 23.094 1.00 64.14 H new ATOM 0 HD13 LEU A 47 4.740 -16.896 22.089 1.00 64.14 H new ATOM 0 HD21 LEU A 47 5.881 -14.947 19.992 1.00 12.30 H new ATOM 0 HD22 LEU A 47 5.029 -16.455 19.580 1.00 12.30 H new ATOM 0 HD23 LEU A 47 4.463 -14.903 18.917 1.00 12.30 H new ATOM 718 N SER A 48 0.673 -15.420 18.353 1.00 74.43 N ATOM 719 CA SER A 48 0.426 -15.218 16.930 1.00 63.03 C ATOM 720 C SER A 48 -0.536 -14.055 16.705 1.00 64.42 C ATOM 721 O SER A 48 -0.365 -13.263 15.777 1.00 24.31 O ATOM 722 CB SER A 48 -0.141 -16.493 16.302 1.00 10.14 C ATOM 723 OG SER A 48 -1.556 -16.447 16.246 1.00 33.54 O ATOM 0 H SER A 48 0.353 -16.319 18.713 1.00 74.43 H new ATOM 0 HA SER A 48 1.376 -14.979 16.453 1.00 63.03 H new ATOM 0 HB2 SER A 48 0.262 -16.618 15.297 1.00 10.14 H new ATOM 0 HB3 SER A 48 0.175 -17.360 16.882 1.00 10.14 H new ATOM 0 HG SER A 48 -1.919 -16.425 17.156 1.00 33.54 H new ATOM 729 N LEU A 49 -1.548 -13.959 17.560 1.00 65.30 N ATOM 730 CA LEU A 49 -2.538 -12.894 17.456 1.00 14.33 C ATOM 731 C LEU A 49 -1.888 -11.526 17.638 1.00 51.12 C ATOM 732 O LEU A 49 -2.188 -10.581 16.906 1.00 24.44 O ATOM 733 CB LEU A 49 -3.639 -13.090 18.500 1.00 20.43 C ATOM 734 CG LEU A 49 -5.036 -12.612 18.101 1.00 24.54 C ATOM 735 CD1 LEU A 49 -4.973 -11.210 17.517 1.00 51.11 C ATOM 736 CD2 LEU A 49 -5.667 -13.578 17.109 1.00 24.20 C ATOM 0 H LEU A 49 -1.704 -14.606 18.333 1.00 65.30 H new ATOM 0 HA LEU A 49 -2.978 -12.937 16.460 1.00 14.33 H new ATOM 0 HB2 LEU A 49 -3.696 -14.151 18.744 1.00 20.43 H new ATOM 0 HB3 LEU A 49 -3.345 -12.569 19.411 1.00 20.43 H new ATOM 0 HG LEU A 49 -5.659 -12.583 18.995 1.00 24.54 H new ATOM 0 HD11 LEU A 49 -5.976 -10.886 17.239 1.00 51.11 H new ATOM 0 HD12 LEU A 49 -4.563 -10.525 18.259 1.00 51.11 H new ATOM 0 HD13 LEU A 49 -4.334 -11.212 16.634 1.00 51.11 H new ATOM 0 HD21 LEU A 49 -6.660 -13.222 16.836 1.00 24.20 H new ATOM 0 HD22 LEU A 49 -5.046 -13.640 16.216 1.00 24.20 H new ATOM 0 HD23 LEU A 49 -5.748 -14.565 17.564 1.00 24.20 H new ATOM 748 N THR A 50 -0.994 -11.426 18.617 1.00 72.52 N ATOM 749 CA THR A 50 -0.300 -10.175 18.894 1.00 33.20 C ATOM 750 C THR A 50 0.819 -9.933 17.888 1.00 4.14 C ATOM 751 O THR A 50 1.239 -8.796 17.673 1.00 11.32 O ATOM 752 CB THR A 50 0.291 -10.164 20.316 1.00 1.13 C ATOM 753 OG1 THR A 50 -0.634 -10.754 21.236 1.00 21.42 O ATOM 754 CG2 THR A 50 0.615 -8.744 20.756 1.00 23.23 C ATOM 0 H THR A 50 -0.734 -12.197 19.232 1.00 72.52 H new ATOM 0 HA THR A 50 -1.039 -9.378 18.810 1.00 33.20 H new ATOM 0 HB THR A 50 1.213 -10.745 20.307 1.00 1.13 H new ATOM 0 HG1 THR A 50 -0.648 -11.726 21.108 1.00 21.42 H new ATOM 0 HG21 THR A 50 1.031 -8.761 21.763 1.00 23.23 H new ATOM 0 HG22 THR A 50 1.342 -8.308 20.071 1.00 23.23 H new ATOM 0 HG23 THR A 50 -0.295 -8.144 20.750 1.00 23.23 H new ATOM 762 N VAL A 51 1.300 -11.009 17.274 1.00 72.32 N ATOM 763 CA VAL A 51 2.370 -10.913 16.289 1.00 63.14 C ATOM 764 C VAL A 51 1.856 -10.342 14.972 1.00 32.01 C ATOM 765 O VAL A 51 2.430 -9.401 14.425 1.00 41.44 O ATOM 766 CB VAL A 51 3.014 -12.287 16.023 1.00 33.10 C ATOM 767 CG1 VAL A 51 3.588 -12.345 14.616 1.00 44.31 C ATOM 768 CG2 VAL A 51 4.088 -12.581 17.059 1.00 21.00 C ATOM 0 H VAL A 51 0.965 -11.958 17.442 1.00 72.32 H new ATOM 0 HA VAL A 51 3.122 -10.242 16.704 1.00 63.14 H new ATOM 0 HB VAL A 51 2.242 -13.053 16.106 1.00 33.10 H new ATOM 0 HG11 VAL A 51 4.039 -13.323 14.447 1.00 44.31 H new ATOM 0 HG12 VAL A 51 2.791 -12.182 13.891 1.00 44.31 H new ATOM 0 HG13 VAL A 51 4.347 -11.571 14.500 1.00 44.31 H new ATOM 0 HG21 VAL A 51 4.532 -13.555 16.856 1.00 21.00 H new ATOM 0 HG22 VAL A 51 4.860 -11.813 17.011 1.00 21.00 H new ATOM 0 HG23 VAL A 51 3.642 -12.586 18.054 1.00 21.00 H new ATOM 778 N PHE A 52 0.769 -10.918 14.468 1.00 0.43 N ATOM 779 CA PHE A 52 0.176 -10.466 13.215 1.00 62.22 C ATOM 780 C PHE A 52 -0.532 -9.127 13.399 1.00 5.00 C ATOM 781 O PHE A 52 -0.643 -8.337 12.461 1.00 53.51 O ATOM 782 CB PHE A 52 -0.811 -11.510 12.688 1.00 15.44 C ATOM 783 CG PHE A 52 -2.016 -10.911 12.020 1.00 61.13 C ATOM 784 CD1 PHE A 52 -1.936 -10.426 10.724 1.00 11.24 C ATOM 785 CD2 PHE A 52 -3.228 -10.833 12.687 1.00 61.43 C ATOM 786 CE1 PHE A 52 -3.043 -9.875 10.106 1.00 44.21 C ATOM 787 CE2 PHE A 52 -4.338 -10.284 12.073 1.00 2.03 C ATOM 788 CZ PHE A 52 -4.245 -9.803 10.782 1.00 42.01 C ATOM 0 H PHE A 52 0.281 -11.698 14.908 1.00 0.43 H new ATOM 0 HA PHE A 52 0.978 -10.335 12.489 1.00 62.22 H new ATOM 0 HB2 PHE A 52 -0.297 -12.159 11.979 1.00 15.44 H new ATOM 0 HB3 PHE A 52 -1.139 -12.139 13.516 1.00 15.44 H new ATOM 0 HD1 PHE A 52 -0.998 -10.479 10.191 1.00 11.24 H new ATOM 0 HD2 PHE A 52 -3.306 -11.205 13.698 1.00 61.43 H new ATOM 0 HE1 PHE A 52 -2.968 -9.501 9.096 1.00 44.21 H new ATOM 0 HE2 PHE A 52 -5.278 -10.231 12.603 1.00 2.03 H new ATOM 0 HZ PHE A 52 -5.111 -9.371 10.302 1.00 42.01 H new ATOM 798 N LEU A 53 -1.008 -8.879 14.614 1.00 53.02 N ATOM 799 CA LEU A 53 -1.706 -7.636 14.923 1.00 52.33 C ATOM 800 C LEU A 53 -0.799 -6.431 14.695 1.00 1.12 C ATOM 801 O LEU A 53 -1.183 -5.468 14.030 1.00 44.12 O ATOM 802 CB LEU A 53 -2.199 -7.651 16.371 1.00 54.13 C ATOM 803 CG LEU A 53 -2.271 -6.293 17.070 1.00 52.35 C ATOM 804 CD1 LEU A 53 -3.208 -5.357 16.322 1.00 14.22 C ATOM 805 CD2 LEU A 53 -2.721 -6.459 18.514 1.00 63.22 C ATOM 0 H LEU A 53 -0.923 -9.522 15.401 1.00 53.02 H new ATOM 0 HA LEU A 53 -2.563 -7.554 14.255 1.00 52.33 H new ATOM 0 HB2 LEU A 53 -3.192 -8.100 16.391 1.00 54.13 H new ATOM 0 HB3 LEU A 53 -1.543 -8.301 16.950 1.00 54.13 H new ATOM 0 HG LEU A 53 -1.274 -5.853 17.070 1.00 52.35 H new ATOM 0 HD11 LEU A 53 -3.247 -4.395 16.834 1.00 14.22 H new ATOM 0 HD12 LEU A 53 -2.843 -5.212 15.305 1.00 14.22 H new ATOM 0 HD13 LEU A 53 -4.207 -5.792 16.290 1.00 14.22 H new ATOM 0 HD21 LEU A 53 -2.766 -5.482 18.996 1.00 63.22 H new ATOM 0 HD22 LEU A 53 -3.708 -6.921 18.537 1.00 63.22 H new ATOM 0 HD23 LEU A 53 -2.011 -7.093 19.046 1.00 63.22 H new ATOM 817 N LEU A 54 0.407 -6.492 15.250 1.00 53.22 N ATOM 818 CA LEU A 54 1.371 -5.407 15.106 1.00 51.54 C ATOM 819 C LEU A 54 1.774 -5.227 13.646 1.00 43.14 C ATOM 820 O LEU A 54 1.916 -4.102 13.163 1.00 33.32 O ATOM 821 CB LEU A 54 2.610 -5.682 15.959 1.00 62.32 C ATOM 822 CG LEU A 54 3.361 -4.452 16.469 1.00 1.11 C ATOM 823 CD1 LEU A 54 3.170 -4.294 17.970 1.00 63.44 C ATOM 824 CD2 LEU A 54 4.840 -4.549 16.125 1.00 23.20 C ATOM 0 H LEU A 54 0.740 -7.281 15.804 1.00 53.22 H new ATOM 0 HA LEU A 54 0.899 -4.487 15.449 1.00 51.54 H new ATOM 0 HB2 LEU A 54 2.309 -6.281 16.818 1.00 62.32 H new ATOM 0 HB3 LEU A 54 3.302 -6.288 15.374 1.00 62.32 H new ATOM 0 HG LEU A 54 2.951 -3.570 15.977 1.00 1.11 H new ATOM 0 HD11 LEU A 54 3.712 -3.413 18.315 1.00 63.44 H new ATOM 0 HD12 LEU A 54 2.109 -4.177 18.191 1.00 63.44 H new ATOM 0 HD13 LEU A 54 3.552 -5.178 18.480 1.00 63.44 H new ATOM 0 HD21 LEU A 54 5.359 -3.665 16.496 1.00 23.20 H new ATOM 0 HD22 LEU A 54 5.264 -5.440 16.589 1.00 23.20 H new ATOM 0 HD23 LEU A 54 4.959 -4.612 15.043 1.00 23.20 H new ATOM 836 N LEU A 55 1.956 -6.342 12.946 1.00 3.52 N ATOM 837 CA LEU A 55 2.341 -6.308 11.539 1.00 2.25 C ATOM 838 C LEU A 55 1.372 -5.452 10.730 1.00 2.12 C ATOM 839 O LEU A 55 1.757 -4.829 9.740 1.00 1.23 O ATOM 840 CB LEU A 55 2.386 -7.726 10.969 1.00 72.25 C ATOM 841 CG LEU A 55 3.744 -8.197 10.446 1.00 33.13 C ATOM 842 CD1 LEU A 55 3.838 -9.714 10.498 1.00 65.11 C ATOM 843 CD2 LEU A 55 3.973 -7.694 9.029 1.00 63.45 C ATOM 0 H LEU A 55 1.843 -7.280 13.330 1.00 3.52 H new ATOM 0 HA LEU A 55 3.334 -5.863 11.469 1.00 2.25 H new ATOM 0 HB2 LEU A 55 2.058 -8.418 11.744 1.00 72.25 H new ATOM 0 HB3 LEU A 55 1.663 -7.792 10.156 1.00 72.25 H new ATOM 0 HG LEU A 55 4.523 -7.783 11.087 1.00 33.13 H new ATOM 0 HD11 LEU A 55 4.811 -10.031 10.122 1.00 65.11 H new ATOM 0 HD12 LEU A 55 3.719 -10.051 11.528 1.00 65.11 H new ATOM 0 HD13 LEU A 55 3.051 -10.149 9.881 1.00 65.11 H new ATOM 0 HD21 LEU A 55 4.944 -8.039 8.673 1.00 63.45 H new ATOM 0 HD22 LEU A 55 3.190 -8.078 8.376 1.00 63.45 H new ATOM 0 HD23 LEU A 55 3.950 -6.604 9.022 1.00 63.45 H new ATOM 855 N ILE A 56 0.115 -5.425 11.159 1.00 51.30 N ATOM 856 CA ILE A 56 -0.908 -4.642 10.476 1.00 21.31 C ATOM 857 C ILE A 56 -0.889 -3.190 10.939 1.00 11.52 C ATOM 858 O ILE A 56 -1.334 -2.292 10.223 1.00 4.51 O ATOM 859 CB ILE A 56 -2.314 -5.226 10.711 1.00 64.01 C ATOM 860 CG1 ILE A 56 -2.392 -6.656 10.172 1.00 54.11 C ATOM 861 CG2 ILE A 56 -3.368 -4.348 10.054 1.00 13.24 C ATOM 862 CD1 ILE A 56 -2.067 -6.765 8.699 1.00 70.13 C ATOM 0 H ILE A 56 -0.220 -5.936 11.976 1.00 51.30 H new ATOM 0 HA ILE A 56 -0.679 -4.684 9.411 1.00 21.31 H new ATOM 0 HB ILE A 56 -2.507 -5.251 11.783 1.00 64.01 H new ATOM 0 HG12 ILE A 56 -1.704 -7.286 10.735 1.00 54.11 H new ATOM 0 HG13 ILE A 56 -3.395 -7.046 10.344 1.00 54.11 H new ATOM 0 HG21 ILE A 56 -4.356 -4.773 10.229 1.00 13.24 H new ATOM 0 HG22 ILE A 56 -3.324 -3.346 10.480 1.00 13.24 H new ATOM 0 HG23 ILE A 56 -3.180 -4.295 8.982 1.00 13.24 H new ATOM 0 HD11 ILE A 56 -2.142 -7.806 8.386 1.00 70.13 H new ATOM 0 HD12 ILE A 56 -2.771 -6.162 8.125 1.00 70.13 H new ATOM 0 HD13 ILE A 56 -1.053 -6.405 8.522 1.00 70.13 H new ATOM 874 N THR A 57 -0.370 -2.964 12.142 1.00 23.11 N ATOM 875 CA THR A 57 -0.292 -1.621 12.701 1.00 2.54 C ATOM 876 C THR A 57 0.954 -0.892 12.211 1.00 24.22 C ATOM 877 O THR A 57 1.040 0.333 12.291 1.00 33.32 O ATOM 878 CB THR A 57 -0.281 -1.653 14.241 1.00 12.14 C ATOM 879 OG1 THR A 57 0.968 -2.170 14.712 1.00 64.01 O ATOM 880 CG2 THR A 57 -1.422 -2.508 14.773 1.00 41.35 C ATOM 0 H THR A 57 0.003 -3.695 12.748 1.00 23.11 H new ATOM 0 HA THR A 57 -1.179 -1.086 12.362 1.00 2.54 H new ATOM 0 HB THR A 57 -0.412 -0.634 14.604 1.00 12.14 H new ATOM 0 HG1 THR A 57 1.268 -2.890 14.119 1.00 64.01 H new ATOM 0 HG21 THR A 57 -1.394 -2.515 15.863 1.00 41.35 H new ATOM 0 HG22 THR A 57 -2.373 -2.095 14.438 1.00 41.35 H new ATOM 0 HG23 THR A 57 -1.317 -3.527 14.400 1.00 41.35 H new ATOM 888 N GLU A 58 1.918 -1.654 11.703 1.00 22.12 N ATOM 889 CA GLU A 58 3.160 -1.079 11.200 1.00 22.20 C ATOM 890 C GLU A 58 3.033 -0.717 9.723 1.00 31.11 C ATOM 891 O GLU A 58 3.566 0.298 9.274 1.00 10.10 O ATOM 892 CB GLU A 58 4.319 -2.059 11.398 1.00 13.23 C ATOM 893 CG GLU A 58 4.069 -3.428 10.788 1.00 3.14 C ATOM 894 CD GLU A 58 5.263 -4.353 10.923 1.00 45.34 C ATOM 895 OE1 GLU A 58 5.654 -4.653 12.070 1.00 30.52 O ATOM 896 OE2 GLU A 58 5.807 -4.775 9.881 1.00 24.32 O ATOM 0 H GLU A 58 1.863 -2.670 11.629 1.00 22.12 H new ATOM 0 HA GLU A 58 3.363 -0.168 11.764 1.00 22.20 H new ATOM 0 HB2 GLU A 58 5.222 -1.634 10.959 1.00 13.23 H new ATOM 0 HB3 GLU A 58 4.507 -2.175 12.465 1.00 13.23 H new ATOM 0 HG2 GLU A 58 3.204 -3.884 11.270 1.00 3.14 H new ATOM 0 HG3 GLU A 58 3.821 -3.312 9.733 1.00 3.14 H new ATOM 903 N ILE A 59 2.324 -1.555 8.974 1.00 41.43 N ATOM 904 CA ILE A 59 2.126 -1.323 7.548 1.00 5.02 C ATOM 905 C ILE A 59 0.987 -0.340 7.304 1.00 51.32 C ATOM 906 O ILE A 59 0.946 0.335 6.275 1.00 41.33 O ATOM 907 CB ILE A 59 1.826 -2.636 6.801 1.00 41.31 C ATOM 908 CG1 ILE A 59 0.517 -3.246 7.304 1.00 34.43 C ATOM 909 CG2 ILE A 59 2.975 -3.618 6.973 1.00 43.25 C ATOM 910 CD1 ILE A 59 0.377 -4.720 6.991 1.00 51.55 C ATOM 0 H ILE A 59 1.877 -2.400 9.330 1.00 41.43 H new ATOM 0 HA ILE A 59 3.055 -0.901 7.165 1.00 5.02 H new ATOM 0 HB ILE A 59 1.718 -2.416 5.739 1.00 41.31 H new ATOM 0 HG12 ILE A 59 0.450 -3.104 8.383 1.00 34.43 H new ATOM 0 HG13 ILE A 59 -0.320 -2.707 6.859 1.00 34.43 H new ATOM 0 HG21 ILE A 59 2.748 -4.541 6.439 1.00 43.25 H new ATOM 0 HG22 ILE A 59 3.890 -3.182 6.571 1.00 43.25 H new ATOM 0 HG23 ILE A 59 3.112 -3.836 8.032 1.00 43.25 H new ATOM 0 HD11 ILE A 59 -0.575 -5.085 7.377 1.00 51.55 H new ATOM 0 HD12 ILE A 59 0.411 -4.868 5.912 1.00 51.55 H new ATOM 0 HD13 ILE A 59 1.193 -5.270 7.459 1.00 51.55 H new ATOM 922 N ILE A 60 0.064 -0.263 8.257 1.00 63.11 N ATOM 923 CA ILE A 60 -1.074 0.640 8.146 1.00 14.24 C ATOM 924 C ILE A 60 -1.797 0.454 6.816 1.00 5.13 C ATOM 925 O ILE A 60 -1.658 1.253 5.890 1.00 75.35 O ATOM 926 CB ILE A 60 -0.641 2.112 8.281 1.00 64.22 C ATOM 927 CG1 ILE A 60 0.190 2.308 9.551 1.00 35.40 C ATOM 928 CG2 ILE A 60 -1.858 3.024 8.291 1.00 32.13 C ATOM 929 CD1 ILE A 60 1.663 2.519 9.283 1.00 1.52 C ATOM 0 H ILE A 60 0.082 -0.815 9.114 1.00 63.11 H new ATOM 0 HA ILE A 60 -1.752 0.393 8.963 1.00 14.24 H new ATOM 0 HB ILE A 60 -0.023 2.374 7.422 1.00 64.22 H new ATOM 0 HG12 ILE A 60 -0.198 3.166 10.100 1.00 35.40 H new ATOM 0 HG13 ILE A 60 0.067 1.436 10.194 1.00 35.40 H new ATOM 0 HG21 ILE A 60 -1.535 4.061 8.387 1.00 32.13 H new ATOM 0 HG22 ILE A 60 -2.412 2.901 7.361 1.00 32.13 H new ATOM 0 HG23 ILE A 60 -2.500 2.765 9.133 1.00 32.13 H new ATOM 0 HD11 ILE A 60 2.190 2.651 10.228 1.00 1.52 H new ATOM 0 HD12 ILE A 60 2.066 1.651 8.761 1.00 1.52 H new ATOM 0 HD13 ILE A 60 1.797 3.408 8.666 1.00 1.52 H new ATOM 941 N PRO A 61 -2.588 -0.625 6.718 1.00 3.45 N ATOM 942 CA PRO A 61 -3.350 -0.940 5.507 1.00 42.04 C ATOM 943 C PRO A 61 -4.493 0.041 5.269 1.00 44.23 C ATOM 944 O PRO A 61 -5.087 0.067 4.191 1.00 43.31 O ATOM 945 CB PRO A 61 -3.898 -2.341 5.787 1.00 61.40 C ATOM 946 CG PRO A 61 -3.954 -2.436 7.273 1.00 52.03 C ATOM 947 CD PRO A 61 -2.800 -1.619 7.784 1.00 63.14 C ATOM 0 HA PRO A 61 -2.733 -0.880 4.611 1.00 42.04 H new ATOM 0 HB2 PRO A 61 -4.885 -2.476 5.344 1.00 61.40 H new ATOM 0 HB3 PRO A 61 -3.252 -3.111 5.365 1.00 61.40 H new ATOM 0 HG2 PRO A 61 -4.901 -2.054 7.653 1.00 52.03 H new ATOM 0 HG3 PRO A 61 -3.874 -3.472 7.601 1.00 52.03 H new ATOM 0 HD2 PRO A 61 -3.035 -1.143 8.736 1.00 63.14 H new ATOM 0 HD3 PRO A 61 -1.913 -2.232 7.944 1.00 63.14 H new ATOM 1043 N SER A 69 -11.569 -1.274 6.425 1.00 63.32 N ATOM 1044 CA SER A 69 -10.273 -1.637 6.986 1.00 23.41 C ATOM 1045 C SER A 69 -10.432 -2.672 8.096 1.00 10.00 C ATOM 1046 O SER A 69 -11.479 -2.751 8.740 1.00 62.33 O ATOM 1047 CB SER A 69 -9.562 -0.396 7.529 1.00 53.23 C ATOM 1048 OG SER A 69 -10.481 0.486 8.151 1.00 24.01 O ATOM 0 HA SER A 69 -9.670 -2.073 6.190 1.00 23.41 H new ATOM 0 HB2 SER A 69 -8.798 -0.695 8.246 1.00 53.23 H new ATOM 0 HB3 SER A 69 -9.051 0.120 6.716 1.00 53.23 H new ATOM 0 HG SER A 69 -11.385 0.305 7.818 1.00 24.01 H new ATOM 1054 N ILE A 70 -9.386 -3.462 8.314 1.00 74.42 N ATOM 1055 CA ILE A 70 -9.409 -4.491 9.346 1.00 31.30 C ATOM 1056 C ILE A 70 -9.215 -3.884 10.731 1.00 34.45 C ATOM 1057 O ILE A 70 -9.457 -4.537 11.746 1.00 55.01 O ATOM 1058 CB ILE A 70 -8.320 -5.553 9.106 1.00 21.43 C ATOM 1059 CG1 ILE A 70 -8.684 -6.858 9.818 1.00 62.23 C ATOM 1060 CG2 ILE A 70 -6.968 -5.043 9.583 1.00 53.11 C ATOM 1061 CD1 ILE A 70 -7.740 -7.999 9.508 1.00 72.04 C ATOM 0 H ILE A 70 -8.512 -3.409 7.790 1.00 74.42 H new ATOM 0 HA ILE A 70 -10.388 -4.968 9.295 1.00 31.30 H new ATOM 0 HB ILE A 70 -8.255 -5.750 8.036 1.00 21.43 H new ATOM 0 HG12 ILE A 70 -8.691 -6.685 10.894 1.00 62.23 H new ATOM 0 HG13 ILE A 70 -9.696 -7.147 9.535 1.00 62.23 H new ATOM 0 HG21 ILE A 70 -6.209 -5.805 9.407 1.00 53.11 H new ATOM 0 HG22 ILE A 70 -6.707 -4.137 9.036 1.00 53.11 H new ATOM 0 HG23 ILE A 70 -7.018 -4.821 10.649 1.00 53.11 H new ATOM 0 HD11 ILE A 70 -8.059 -8.891 10.047 1.00 72.04 H new ATOM 0 HD12 ILE A 70 -7.750 -8.199 8.437 1.00 72.04 H new ATOM 0 HD13 ILE A 70 -6.730 -7.730 9.817 1.00 72.04 H new ATOM 1073 N GLY A 71 -8.778 -2.629 10.766 1.00 34.11 N ATOM 1074 CA GLY A 71 -8.561 -1.954 12.032 1.00 12.12 C ATOM 1075 C GLY A 71 -9.773 -2.021 12.940 1.00 21.24 C ATOM 1076 O GLY A 71 -9.641 -2.000 14.164 1.00 41.34 O ATOM 0 H GLY A 71 -8.570 -2.068 9.940 1.00 34.11 H new ATOM 0 HA2 GLY A 71 -7.707 -2.403 12.538 1.00 12.12 H new ATOM 0 HA3 GLY A 71 -8.308 -0.910 11.845 1.00 12.12 H new ATOM 1080 N GLU A 72 -10.957 -2.101 12.341 1.00 64.14 N ATOM 1081 CA GLU A 72 -12.197 -2.169 13.105 1.00 45.10 C ATOM 1082 C GLU A 72 -12.463 -3.593 13.585 1.00 5.32 C ATOM 1083 O GLU A 72 -13.073 -3.802 14.634 1.00 44.00 O ATOM 1084 CB GLU A 72 -13.372 -1.677 12.258 1.00 43.15 C ATOM 1085 CG GLU A 72 -13.313 -0.192 11.940 1.00 74.22 C ATOM 1086 CD GLU A 72 -14.456 0.260 11.051 1.00 32.43 C ATOM 1087 OE1 GLU A 72 -14.618 -0.315 9.954 1.00 14.54 O ATOM 1088 OE2 GLU A 72 -15.189 1.188 11.454 1.00 63.31 O ATOM 0 H GLU A 72 -11.084 -2.120 11.329 1.00 64.14 H new ATOM 0 HA GLU A 72 -12.092 -1.524 13.977 1.00 45.10 H new ATOM 0 HB2 GLU A 72 -13.397 -2.239 11.325 1.00 43.15 H new ATOM 0 HB3 GLU A 72 -14.303 -1.891 12.784 1.00 43.15 H new ATOM 0 HG2 GLU A 72 -13.334 0.376 12.870 1.00 74.22 H new ATOM 0 HG3 GLU A 72 -12.366 0.034 11.450 1.00 74.22 H new ATOM 1095 N TYR A 73 -12.001 -4.568 12.810 1.00 10.22 N ATOM 1096 CA TYR A 73 -12.191 -5.972 13.154 1.00 72.03 C ATOM 1097 C TYR A 73 -11.207 -6.406 14.236 1.00 74.21 C ATOM 1098 O TYR A 73 -11.597 -6.991 15.248 1.00 41.13 O ATOM 1099 CB TYR A 73 -12.022 -6.850 11.913 1.00 44.14 C ATOM 1100 CG TYR A 73 -11.778 -8.308 12.231 1.00 54.11 C ATOM 1101 CD1 TYR A 73 -12.817 -9.132 12.646 1.00 54.35 C ATOM 1102 CD2 TYR A 73 -10.509 -8.862 12.116 1.00 52.22 C ATOM 1103 CE1 TYR A 73 -12.599 -10.464 12.938 1.00 34.01 C ATOM 1104 CE2 TYR A 73 -10.282 -10.194 12.405 1.00 52.43 C ATOM 1105 CZ TYR A 73 -11.330 -10.990 12.816 1.00 73.31 C ATOM 1106 OH TYR A 73 -11.109 -12.317 13.105 1.00 73.50 O ATOM 0 H TYR A 73 -11.492 -4.412 11.940 1.00 10.22 H new ATOM 0 HA TYR A 73 -13.203 -6.091 13.540 1.00 72.03 H new ATOM 0 HB2 TYR A 73 -12.916 -6.766 11.295 1.00 44.14 H new ATOM 0 HB3 TYR A 73 -11.189 -6.471 11.321 1.00 44.14 H new ATOM 0 HD1 TYR A 73 -13.812 -8.724 12.742 1.00 54.35 H new ATOM 0 HD2 TYR A 73 -9.686 -8.241 11.795 1.00 52.22 H new ATOM 0 HE1 TYR A 73 -13.418 -11.090 13.260 1.00 34.01 H new ATOM 0 HE2 TYR A 73 -9.290 -10.609 12.310 1.00 52.43 H new ATOM 0 HH TYR A 73 -10.278 -12.611 12.677 1.00 73.50 H new ATOM 1116 N LEU A 74 -9.930 -6.116 14.016 1.00 50.43 N ATOM 1117 CA LEU A 74 -8.888 -6.474 14.972 1.00 61.55 C ATOM 1118 C LEU A 74 -9.124 -5.793 16.316 1.00 44.14 C ATOM 1119 O LEU A 74 -8.767 -6.328 17.366 1.00 5.32 O ATOM 1120 CB LEU A 74 -7.512 -6.088 14.425 1.00 34.22 C ATOM 1121 CG LEU A 74 -6.640 -7.241 13.928 1.00 24.23 C ATOM 1122 CD1 LEU A 74 -5.637 -6.746 12.897 1.00 35.10 C ATOM 1123 CD2 LEU A 74 -5.923 -7.908 15.093 1.00 31.34 C ATOM 0 H LEU A 74 -9.591 -5.634 13.184 1.00 50.43 H new ATOM 0 HA LEU A 74 -8.922 -7.553 15.122 1.00 61.55 H new ATOM 0 HB2 LEU A 74 -7.654 -5.386 13.603 1.00 34.22 H new ATOM 0 HB3 LEU A 74 -6.968 -5.558 15.207 1.00 34.22 H new ATOM 0 HG LEU A 74 -7.285 -7.980 13.452 1.00 24.23 H new ATOM 0 HD11 LEU A 74 -5.025 -7.581 12.555 1.00 35.10 H new ATOM 0 HD12 LEU A 74 -6.169 -6.315 12.049 1.00 35.10 H new ATOM 0 HD13 LEU A 74 -4.997 -5.987 13.347 1.00 35.10 H new ATOM 0 HD21 LEU A 74 -5.307 -8.726 14.721 1.00 31.34 H new ATOM 0 HD22 LEU A 74 -5.290 -7.178 15.597 1.00 31.34 H new ATOM 0 HD23 LEU A 74 -6.658 -8.298 15.797 1.00 31.34 H new ATOM 1135 N LEU A 75 -9.729 -4.611 16.275 1.00 4.15 N ATOM 1136 CA LEU A 75 -10.015 -3.856 17.491 1.00 62.33 C ATOM 1137 C LEU A 75 -11.080 -4.557 18.329 1.00 44.24 C ATOM 1138 O LEU A 75 -10.835 -4.932 19.475 1.00 25.52 O ATOM 1139 CB LEU A 75 -10.476 -2.441 17.139 1.00 40.21 C ATOM 1140 CG LEU A 75 -10.848 -1.543 18.320 1.00 73.34 C ATOM 1141 CD1 LEU A 75 -9.612 -1.187 19.130 1.00 44.11 C ATOM 1142 CD2 LEU A 75 -11.550 -0.284 17.832 1.00 61.11 C ATOM 0 H LEU A 75 -10.031 -4.155 15.414 1.00 4.15 H new ATOM 0 HA LEU A 75 -9.098 -3.797 18.078 1.00 62.33 H new ATOM 0 HB2 LEU A 75 -9.683 -1.952 16.573 1.00 40.21 H new ATOM 0 HB3 LEU A 75 -11.340 -2.516 16.479 1.00 40.21 H new ATOM 0 HG LEU A 75 -11.535 -2.090 18.966 1.00 73.34 H new ATOM 0 HD11 LEU A 75 -9.896 -0.548 19.966 1.00 44.11 H new ATOM 0 HD12 LEU A 75 -9.151 -2.099 19.511 1.00 44.11 H new ATOM 0 HD13 LEU A 75 -8.901 -0.659 18.495 1.00 44.11 H new ATOM 0 HD21 LEU A 75 -11.807 0.343 18.686 1.00 61.11 H new ATOM 0 HD22 LEU A 75 -10.887 0.266 17.164 1.00 61.11 H new ATOM 0 HD23 LEU A 75 -12.459 -0.559 17.296 1.00 61.11 H new ATOM 1154 N PHE A 76 -12.262 -4.731 17.748 1.00 70.32 N ATOM 1155 CA PHE A 76 -13.365 -5.388 18.440 1.00 25.24 C ATOM 1156 C PHE A 76 -12.983 -6.809 18.845 1.00 73.35 C ATOM 1157 O PHE A 76 -13.146 -7.204 20.000 1.00 74.34 O ATOM 1158 CB PHE A 76 -14.609 -5.415 17.551 1.00 35.33 C ATOM 1159 CG PHE A 76 -15.558 -4.280 17.813 1.00 62.30 C ATOM 1160 CD1 PHE A 76 -15.082 -2.995 18.018 1.00 24.54 C ATOM 1161 CD2 PHE A 76 -16.926 -4.498 17.854 1.00 25.31 C ATOM 1162 CE1 PHE A 76 -15.952 -1.949 18.259 1.00 5.40 C ATOM 1163 CE2 PHE A 76 -17.800 -3.455 18.094 1.00 72.51 C ATOM 1164 CZ PHE A 76 -17.313 -2.179 18.298 1.00 64.42 C ATOM 0 H PHE A 76 -12.481 -4.426 16.800 1.00 70.32 H new ATOM 0 HA PHE A 76 -13.586 -4.819 19.343 1.00 25.24 H new ATOM 0 HB2 PHE A 76 -14.300 -5.386 16.506 1.00 35.33 H new ATOM 0 HB3 PHE A 76 -15.133 -6.359 17.702 1.00 35.33 H new ATOM 0 HD1 PHE A 76 -14.019 -2.809 17.989 1.00 24.54 H new ATOM 0 HD2 PHE A 76 -17.313 -5.494 17.697 1.00 25.31 H new ATOM 0 HE1 PHE A 76 -15.568 -0.952 18.417 1.00 5.40 H new ATOM 0 HE2 PHE A 76 -18.864 -3.638 18.122 1.00 72.51 H new ATOM 0 HZ PHE A 76 -17.995 -1.363 18.488 1.00 64.42 H new ATOM 1174 N THR A 77 -12.475 -7.575 17.884 1.00 23.11 N ATOM 1175 CA THR A 77 -12.072 -8.953 18.138 1.00 43.52 C ATOM 1176 C THR A 77 -11.104 -9.035 19.312 1.00 3.35 C ATOM 1177 O THR A 77 -11.196 -9.938 20.143 1.00 70.33 O ATOM 1178 CB THR A 77 -11.410 -9.582 16.897 1.00 12.12 C ATOM 1179 OG1 THR A 77 -12.380 -9.750 15.857 1.00 1.40 O ATOM 1180 CG2 THR A 77 -10.788 -10.927 17.239 1.00 33.35 C ATOM 0 H THR A 77 -12.333 -7.264 16.923 1.00 23.11 H new ATOM 0 HA THR A 77 -12.979 -9.508 18.379 1.00 43.52 H new ATOM 0 HB THR A 77 -10.622 -8.912 16.554 1.00 12.12 H new ATOM 0 HG1 THR A 77 -11.931 -10.033 15.033 1.00 1.40 H new ATOM 0 HG21 THR A 77 -10.327 -11.352 16.347 1.00 33.35 H new ATOM 0 HG22 THR A 77 -10.030 -10.792 18.010 1.00 33.35 H new ATOM 0 HG23 THR A 77 -11.561 -11.603 17.605 1.00 33.35 H new ATOM 1188 N MET A 78 -10.176 -8.085 19.376 1.00 20.23 N ATOM 1189 CA MET A 78 -9.192 -8.050 20.452 1.00 63.02 C ATOM 1190 C MET A 78 -9.875 -8.075 21.815 1.00 12.43 C ATOM 1191 O MET A 78 -9.583 -8.931 22.651 1.00 53.14 O ATOM 1192 CB MET A 78 -8.316 -6.802 20.330 1.00 43.32 C ATOM 1193 CG MET A 78 -6.963 -7.069 19.691 1.00 43.13 C ATOM 1194 SD MET A 78 -5.839 -5.665 19.830 1.00 34.32 S ATOM 1195 CE MET A 78 -6.140 -4.835 18.272 1.00 14.31 C ATOM 0 H MET A 78 -10.085 -7.330 18.696 1.00 20.23 H new ATOM 0 HA MET A 78 -8.564 -8.936 20.365 1.00 63.02 H new ATOM 0 HB2 MET A 78 -8.845 -6.053 19.741 1.00 43.32 H new ATOM 0 HB3 MET A 78 -8.163 -6.377 21.322 1.00 43.32 H new ATOM 0 HG2 MET A 78 -6.509 -7.941 20.162 1.00 43.13 H new ATOM 0 HG3 MET A 78 -7.105 -7.313 18.638 1.00 43.13 H new ATOM 0 HE1 MET A 78 -5.258 -4.260 17.990 1.00 14.31 H new ATOM 0 HE2 MET A 78 -6.352 -5.575 17.501 1.00 14.31 H new ATOM 0 HE3 MET A 78 -6.993 -4.164 18.376 1.00 14.31 H new ATOM 1205 N ILE A 79 -10.785 -7.131 22.033 1.00 4.33 N ATOM 1206 CA ILE A 79 -11.509 -7.046 23.295 1.00 12.32 C ATOM 1207 C ILE A 79 -12.459 -8.226 23.464 1.00 34.41 C ATOM 1208 O ILE A 79 -12.796 -8.611 24.584 1.00 21.02 O ATOM 1209 CB ILE A 79 -12.313 -5.736 23.396 1.00 40.13 C ATOM 1210 CG1 ILE A 79 -11.421 -4.538 23.063 1.00 52.10 C ATOM 1211 CG2 ILE A 79 -12.912 -5.587 24.786 1.00 22.33 C ATOM 1212 CD1 ILE A 79 -10.093 -4.554 23.786 1.00 23.21 C ATOM 0 H ILE A 79 -11.038 -6.415 21.352 1.00 4.33 H new ATOM 0 HA ILE A 79 -10.762 -7.067 24.089 1.00 12.32 H new ATOM 0 HB ILE A 79 -13.128 -5.771 22.673 1.00 40.13 H new ATOM 0 HG12 ILE A 79 -11.240 -4.518 21.988 1.00 52.10 H new ATOM 0 HG13 ILE A 79 -11.951 -3.619 23.314 1.00 52.10 H new ATOM 0 HG21 ILE A 79 -13.477 -4.656 24.841 1.00 22.33 H new ATOM 0 HG22 ILE A 79 -13.576 -6.427 24.988 1.00 22.33 H new ATOM 0 HG23 ILE A 79 -12.113 -5.570 25.527 1.00 22.33 H new ATOM 0 HD11 ILE A 79 -9.513 -3.676 23.502 1.00 23.21 H new ATOM 0 HD12 ILE A 79 -10.265 -4.543 24.862 1.00 23.21 H new ATOM 0 HD13 ILE A 79 -9.542 -5.455 23.516 1.00 23.21 H new ATOM 1224 N PHE A 80 -12.888 -8.799 22.344 1.00 64.10 N ATOM 1225 CA PHE A 80 -13.799 -9.937 22.367 1.00 23.43 C ATOM 1226 C PHE A 80 -13.097 -11.185 22.896 1.00 61.15 C ATOM 1227 O PHE A 80 -13.525 -11.781 23.884 1.00 13.42 O ATOM 1228 CB PHE A 80 -14.351 -10.204 20.966 1.00 74.23 C ATOM 1229 CG PHE A 80 -15.708 -10.849 20.969 1.00 40.11 C ATOM 1230 CD1 PHE A 80 -15.839 -12.217 21.144 1.00 30.00 C ATOM 1231 CD2 PHE A 80 -16.852 -10.087 20.796 1.00 11.32 C ATOM 1232 CE1 PHE A 80 -17.086 -12.813 21.148 1.00 60.51 C ATOM 1233 CE2 PHE A 80 -18.102 -10.677 20.800 1.00 64.44 C ATOM 1234 CZ PHE A 80 -18.219 -12.043 20.974 1.00 4.44 C ATOM 0 H PHE A 80 -12.619 -8.493 21.409 1.00 64.10 H new ATOM 0 HA PHE A 80 -14.625 -9.695 23.035 1.00 23.43 H new ATOM 0 HB2 PHE A 80 -14.407 -9.262 20.420 1.00 74.23 H new ATOM 0 HB3 PHE A 80 -13.654 -10.845 20.426 1.00 74.23 H new ATOM 0 HD1 PHE A 80 -14.956 -12.825 21.279 1.00 30.00 H new ATOM 0 HD2 PHE A 80 -16.766 -9.020 20.656 1.00 11.32 H new ATOM 0 HE1 PHE A 80 -17.174 -13.880 21.287 1.00 60.51 H new ATOM 0 HE2 PHE A 80 -18.986 -10.071 20.667 1.00 64.44 H new ATOM 0 HZ PHE A 80 -19.194 -12.507 20.974 1.00 4.44 H new ATOM 1244 N VAL A 81 -12.016 -11.576 22.228 1.00 5.34 N ATOM 1245 CA VAL A 81 -11.253 -12.752 22.630 1.00 51.13 C ATOM 1246 C VAL A 81 -10.653 -12.570 24.019 1.00 31.13 C ATOM 1247 O VAL A 81 -10.432 -13.541 24.745 1.00 45.54 O ATOM 1248 CB VAL A 81 -10.122 -13.055 21.630 1.00 64.33 C ATOM 1249 CG1 VAL A 81 -10.687 -13.280 20.235 1.00 1.25 C ATOM 1250 CG2 VAL A 81 -9.099 -11.929 21.624 1.00 14.24 C ATOM 0 H VAL A 81 -11.649 -11.096 21.406 1.00 5.34 H new ATOM 0 HA VAL A 81 -11.949 -13.591 22.646 1.00 51.13 H new ATOM 0 HB VAL A 81 -9.620 -13.970 21.944 1.00 64.33 H new ATOM 0 HG11 VAL A 81 -9.873 -13.493 19.543 1.00 1.25 H new ATOM 0 HG12 VAL A 81 -11.377 -14.124 20.254 1.00 1.25 H new ATOM 0 HG13 VAL A 81 -11.217 -12.385 19.908 1.00 1.25 H new ATOM 0 HG21 VAL A 81 -8.307 -12.161 20.912 1.00 14.24 H new ATOM 0 HG22 VAL A 81 -9.585 -10.997 21.336 1.00 14.24 H new ATOM 0 HG23 VAL A 81 -8.670 -11.822 22.620 1.00 14.24 H new ATOM 1260 N THR A 82 -10.392 -11.319 24.386 1.00 22.33 N ATOM 1261 CA THR A 82 -9.817 -11.009 25.689 1.00 22.21 C ATOM 1262 C THR A 82 -10.725 -11.483 26.818 1.00 72.02 C ATOM 1263 O THR A 82 -10.285 -12.184 27.730 1.00 11.22 O ATOM 1264 CB THR A 82 -9.566 -9.498 25.847 1.00 14.42 C ATOM 1265 OG1 THR A 82 -8.464 -9.095 25.026 1.00 32.23 O ATOM 1266 CG2 THR A 82 -9.279 -9.146 27.299 1.00 50.40 C ATOM 0 H THR A 82 -10.570 -10.504 23.799 1.00 22.33 H new ATOM 0 HA THR A 82 -8.865 -11.536 25.747 1.00 22.21 H new ATOM 0 HB THR A 82 -10.465 -8.968 25.532 1.00 14.42 H new ATOM 0 HG1 THR A 82 -8.801 -8.742 24.176 1.00 32.23 H new ATOM 0 HG21 THR A 82 -9.105 -8.074 27.386 1.00 50.40 H new ATOM 0 HG22 THR A 82 -10.132 -9.426 27.917 1.00 50.40 H new ATOM 0 HG23 THR A 82 -8.394 -9.686 27.636 1.00 50.40 H new ATOM 1274 N LEU A 83 -11.995 -11.097 26.751 1.00 63.54 N ATOM 1275 CA LEU A 83 -12.967 -11.484 27.768 1.00 44.05 C ATOM 1276 C LEU A 83 -13.298 -12.969 27.667 1.00 74.40 C ATOM 1277 O LEU A 83 -13.707 -13.592 28.647 1.00 22.11 O ATOM 1278 CB LEU A 83 -14.243 -10.654 27.623 1.00 51.32 C ATOM 1279 CG LEU A 83 -14.088 -9.145 27.817 1.00 11.11 C ATOM 1280 CD1 LEU A 83 -15.414 -8.437 27.582 1.00 65.42 C ATOM 1281 CD2 LEU A 83 -13.558 -8.838 29.210 1.00 23.31 C ATOM 0 H LEU A 83 -12.375 -10.517 26.003 1.00 63.54 H new ATOM 0 HA LEU A 83 -12.527 -11.295 28.747 1.00 44.05 H new ATOM 0 HB2 LEU A 83 -14.657 -10.832 26.631 1.00 51.32 H new ATOM 0 HB3 LEU A 83 -14.974 -11.020 28.344 1.00 51.32 H new ATOM 0 HG LEU A 83 -13.368 -8.777 27.086 1.00 11.11 H new ATOM 0 HD11 LEU A 83 -15.284 -7.364 27.725 1.00 65.42 H new ATOM 0 HD12 LEU A 83 -15.754 -8.629 26.564 1.00 65.42 H new ATOM 0 HD13 LEU A 83 -16.156 -8.810 28.289 1.00 65.42 H new ATOM 0 HD21 LEU A 83 -13.454 -7.760 29.330 1.00 23.31 H new ATOM 0 HD22 LEU A 83 -14.254 -9.221 29.957 1.00 23.31 H new ATOM 0 HD23 LEU A 83 -12.586 -9.313 29.342 1.00 23.31 H new ATOM 1293 N SER A 84 -13.118 -13.532 26.476 1.00 0.51 N ATOM 1294 CA SER A 84 -13.400 -14.944 26.247 1.00 44.21 C ATOM 1295 C SER A 84 -12.335 -15.822 26.897 1.00 35.54 C ATOM 1296 O SER A 84 -12.586 -16.985 27.218 1.00 41.21 O ATOM 1297 CB SER A 84 -13.470 -15.235 24.747 1.00 41.45 C ATOM 1298 OG SER A 84 -14.784 -15.044 24.251 1.00 20.52 O ATOM 0 H SER A 84 -12.778 -13.031 25.655 1.00 0.51 H new ATOM 0 HA SER A 84 -14.364 -15.175 26.700 1.00 44.21 H new ATOM 0 HB2 SER A 84 -12.778 -14.582 24.214 1.00 41.45 H new ATOM 0 HB3 SER A 84 -13.152 -16.260 24.557 1.00 41.45 H new ATOM 0 HG SER A 84 -14.802 -15.235 23.290 1.00 20.52 H new ATOM 1304 N ILE A 85 -11.148 -15.258 27.089 1.00 22.51 N ATOM 1305 CA ILE A 85 -10.046 -15.989 27.702 1.00 24.30 C ATOM 1306 C ILE A 85 -10.181 -16.016 29.221 1.00 61.13 C ATOM 1307 O ILE A 85 -10.156 -17.081 29.838 1.00 13.23 O ATOM 1308 CB ILE A 85 -8.685 -15.372 27.330 1.00 43.31 C ATOM 1309 CG1 ILE A 85 -8.409 -15.553 25.836 1.00 54.33 C ATOM 1310 CG2 ILE A 85 -7.574 -15.999 28.159 1.00 61.44 C ATOM 1311 CD1 ILE A 85 -7.627 -14.412 25.223 1.00 23.51 C ATOM 0 H ILE A 85 -10.924 -14.297 26.829 1.00 22.51 H new ATOM 0 HA ILE A 85 -10.091 -17.008 27.317 1.00 24.30 H new ATOM 0 HB ILE A 85 -8.716 -14.304 27.548 1.00 43.31 H new ATOM 0 HG12 ILE A 85 -7.858 -16.482 25.686 1.00 54.33 H new ATOM 0 HG13 ILE A 85 -9.358 -15.657 25.309 1.00 54.33 H new ATOM 0 HG21 ILE A 85 -6.619 -15.552 27.884 1.00 61.44 H new ATOM 0 HG22 ILE A 85 -7.766 -15.823 29.217 1.00 61.44 H new ATOM 0 HG23 ILE A 85 -7.540 -17.072 27.970 1.00 61.44 H new ATOM 0 HD11 ILE A 85 -7.468 -14.608 24.163 1.00 23.51 H new ATOM 0 HD12 ILE A 85 -8.186 -13.483 25.341 1.00 23.51 H new ATOM 0 HD13 ILE A 85 -6.663 -14.321 25.723 1.00 23.51 H new ATOM 1323 N VAL A 86 -10.326 -14.837 29.817 1.00 24.14 N ATOM 1324 CA VAL A 86 -10.468 -14.725 31.264 1.00 11.21 C ATOM 1325 C VAL A 86 -11.665 -15.527 31.762 1.00 11.22 C ATOM 1326 O VAL A 86 -11.618 -16.129 32.835 1.00 32.21 O ATOM 1327 CB VAL A 86 -10.631 -13.256 31.700 1.00 64.52 C ATOM 1328 CG1 VAL A 86 -9.348 -12.479 31.447 1.00 24.34 C ATOM 1329 CG2 VAL A 86 -11.804 -12.613 30.977 1.00 72.45 C ATOM 0 H VAL A 86 -10.348 -13.946 29.321 1.00 24.14 H new ATOM 0 HA VAL A 86 -9.556 -15.128 31.704 1.00 11.21 H new ATOM 0 HB VAL A 86 -10.837 -13.233 32.770 1.00 64.52 H new ATOM 0 HG11 VAL A 86 -9.482 -11.444 31.761 1.00 24.34 H new ATOM 0 HG12 VAL A 86 -8.533 -12.928 32.015 1.00 24.34 H new ATOM 0 HG13 VAL A 86 -9.109 -12.508 30.384 1.00 24.34 H new ATOM 0 HG21 VAL A 86 -11.904 -11.576 31.297 1.00 72.45 H new ATOM 0 HG22 VAL A 86 -11.631 -12.646 29.901 1.00 72.45 H new ATOM 0 HG23 VAL A 86 -12.719 -13.156 31.214 1.00 72.45 H new ATOM 1339 N ILE A 87 -12.736 -15.530 30.976 1.00 33.22 N ATOM 1340 CA ILE A 87 -13.946 -16.260 31.337 1.00 44.30 C ATOM 1341 C ILE A 87 -13.754 -17.762 31.162 1.00 71.45 C ATOM 1342 O ILE A 87 -14.108 -18.552 32.038 1.00 2.32 O ATOM 1343 CB ILE A 87 -15.150 -15.805 30.492 1.00 35.03 C ATOM 1344 CG1 ILE A 87 -15.551 -14.376 30.863 1.00 3.42 C ATOM 1345 CG2 ILE A 87 -16.322 -16.756 30.686 1.00 71.00 C ATOM 1346 CD1 ILE A 87 -16.062 -14.240 32.280 1.00 13.42 C ATOM 0 H ILE A 87 -12.791 -15.036 30.086 1.00 33.22 H new ATOM 0 HA ILE A 87 -14.146 -16.042 32.386 1.00 44.30 H new ATOM 0 HB ILE A 87 -14.864 -15.821 29.440 1.00 35.03 H new ATOM 0 HG12 ILE A 87 -14.690 -13.720 30.731 1.00 3.42 H new ATOM 0 HG13 ILE A 87 -16.322 -14.033 30.173 1.00 3.42 H new ATOM 0 HG21 ILE A 87 -17.166 -16.421 30.082 1.00 71.00 H new ATOM 0 HG22 ILE A 87 -16.031 -17.760 30.378 1.00 71.00 H new ATOM 0 HG23 ILE A 87 -16.610 -16.769 31.737 1.00 71.00 H new ATOM 0 HD11 ILE A 87 -16.327 -13.201 32.473 1.00 13.42 H new ATOM 0 HD12 ILE A 87 -16.942 -14.870 32.411 1.00 13.42 H new ATOM 0 HD13 ILE A 87 -15.285 -14.552 32.978 1.00 13.42 H new ATOM 1358 N THR A 88 -13.190 -18.153 30.023 1.00 42.43 N ATOM 1359 CA THR A 88 -12.950 -19.560 29.732 1.00 70.43 C ATOM 1360 C THR A 88 -12.203 -20.239 30.875 1.00 53.44 C ATOM 1361 O THR A 88 -12.403 -21.423 31.144 1.00 72.23 O ATOM 1362 CB THR A 88 -12.144 -19.736 28.431 1.00 4.21 C ATOM 1363 OG1 THR A 88 -13.000 -19.561 27.297 1.00 63.44 O ATOM 1364 CG2 THR A 88 -11.496 -21.111 28.377 1.00 23.14 C ATOM 0 H THR A 88 -12.891 -17.514 29.287 1.00 42.43 H new ATOM 0 HA THR A 88 -13.927 -20.028 29.611 1.00 70.43 H new ATOM 0 HB THR A 88 -11.358 -18.981 28.412 1.00 4.21 H new ATOM 0 HG1 THR A 88 -13.163 -18.605 27.155 1.00 63.44 H new ATOM 0 HG21 THR A 88 -10.933 -21.212 27.449 1.00 23.14 H new ATOM 0 HG22 THR A 88 -10.822 -21.229 29.226 1.00 23.14 H new ATOM 0 HG23 THR A 88 -12.268 -21.879 28.417 1.00 23.14 H new ATOM 1372 N VAL A 89 -11.342 -19.480 31.545 1.00 20.13 N ATOM 1373 CA VAL A 89 -10.566 -20.008 32.661 1.00 13.13 C ATOM 1374 C VAL A 89 -11.433 -20.171 33.905 1.00 52.13 C ATOM 1375 O VAL A 89 -11.343 -21.176 34.610 1.00 3.45 O ATOM 1376 CB VAL A 89 -9.373 -19.094 32.997 1.00 23.11 C ATOM 1377 CG1 VAL A 89 -9.014 -19.204 34.471 1.00 21.12 C ATOM 1378 CG2 VAL A 89 -8.177 -19.437 32.122 1.00 62.22 C ATOM 0 H VAL A 89 -11.164 -18.498 31.335 1.00 20.13 H new ATOM 0 HA VAL A 89 -10.191 -20.984 32.352 1.00 13.13 H new ATOM 0 HB VAL A 89 -9.660 -18.062 32.794 1.00 23.11 H new ATOM 0 HG11 VAL A 89 -8.169 -18.551 34.689 1.00 21.12 H new ATOM 0 HG12 VAL A 89 -9.869 -18.905 35.077 1.00 21.12 H new ATOM 0 HG13 VAL A 89 -8.746 -20.234 34.704 1.00 21.12 H new ATOM 0 HG21 VAL A 89 -7.343 -18.782 32.373 1.00 62.22 H new ATOM 0 HG22 VAL A 89 -7.887 -20.474 32.292 1.00 62.22 H new ATOM 0 HG23 VAL A 89 -8.442 -19.302 31.074 1.00 62.22 H new ATOM 1388 N PHE A 90 -12.274 -19.176 34.167 1.00 32.04 N ATOM 1389 CA PHE A 90 -13.158 -19.208 35.327 1.00 73.43 C ATOM 1390 C PHE A 90 -14.215 -20.299 35.175 1.00 44.03 C ATOM 1391 O PHE A 90 -14.380 -21.146 36.053 1.00 10.41 O ATOM 1392 CB PHE A 90 -13.836 -17.850 35.516 1.00 4.52 C ATOM 1393 CG PHE A 90 -12.925 -16.800 36.087 1.00 20.30 C ATOM 1394 CD1 PHE A 90 -12.170 -17.061 37.219 1.00 14.34 C ATOM 1395 CD2 PHE A 90 -12.824 -15.553 35.491 1.00 31.34 C ATOM 1396 CE1 PHE A 90 -11.331 -16.098 37.747 1.00 11.52 C ATOM 1397 CE2 PHE A 90 -11.986 -14.586 36.014 1.00 33.43 C ATOM 1398 CZ PHE A 90 -11.240 -14.858 37.144 1.00 21.42 C ATOM 0 H PHE A 90 -12.362 -18.338 33.592 1.00 32.04 H new ATOM 0 HA PHE A 90 -12.554 -19.431 36.207 1.00 73.43 H new ATOM 0 HB2 PHE A 90 -14.217 -17.506 34.554 1.00 4.52 H new ATOM 0 HB3 PHE A 90 -14.696 -17.971 36.174 1.00 4.52 H new ATOM 0 HD1 PHE A 90 -12.238 -18.028 37.694 1.00 14.34 H new ATOM 0 HD2 PHE A 90 -13.406 -15.334 34.608 1.00 31.34 H new ATOM 0 HE1 PHE A 90 -10.747 -16.314 38.630 1.00 11.52 H new ATOM 0 HE2 PHE A 90 -11.915 -13.619 35.539 1.00 33.43 H new ATOM 0 HZ PHE A 90 -10.587 -14.103 37.556 1.00 21.42 H new ATOM 1408 N VAL A 91 -14.928 -20.271 34.053 1.00 31.44 N ATOM 1409 CA VAL A 91 -15.969 -21.257 33.785 1.00 45.11 C ATOM 1410 C VAL A 91 -15.434 -22.676 33.939 1.00 30.31 C ATOM 1411 O VAL A 91 -16.142 -23.571 34.402 1.00 74.40 O ATOM 1412 CB VAL A 91 -16.548 -21.089 32.368 1.00 62.44 C ATOM 1413 CG1 VAL A 91 -15.451 -21.229 31.322 1.00 15.05 C ATOM 1414 CG2 VAL A 91 -17.659 -22.099 32.124 1.00 15.11 C ATOM 0 H VAL A 91 -14.804 -19.577 33.316 1.00 31.44 H new ATOM 0 HA VAL A 91 -16.761 -21.089 34.515 1.00 45.11 H new ATOM 0 HB VAL A 91 -16.972 -20.088 32.284 1.00 62.44 H new ATOM 0 HG11 VAL A 91 -15.879 -21.107 30.327 1.00 15.05 H new ATOM 0 HG12 VAL A 91 -14.692 -20.464 31.486 1.00 15.05 H new ATOM 0 HG13 VAL A 91 -14.995 -22.216 31.403 1.00 15.05 H new ATOM 0 HG21 VAL A 91 -18.057 -21.966 31.118 1.00 15.11 H new ATOM 0 HG22 VAL A 91 -17.262 -23.109 32.227 1.00 15.11 H new ATOM 0 HG23 VAL A 91 -18.456 -21.947 32.852 1.00 15.11 H new ATOM 1424 N LEU A 92 -14.180 -22.876 33.549 1.00 1.21 N ATOM 1425 CA LEU A 92 -13.548 -24.187 33.644 1.00 35.44 C ATOM 1426 C LEU A 92 -12.925 -24.393 35.021 1.00 3.31 C ATOM 1427 O LEU A 92 -12.661 -25.522 35.432 1.00 42.05 O ATOM 1428 CB LEU A 92 -12.481 -24.341 32.560 1.00 63.20 C ATOM 1429 CG LEU A 92 -11.835 -25.723 32.445 1.00 51.53 C ATOM 1430 CD1 LEU A 92 -11.421 -26.000 31.008 1.00 72.11 C ATOM 1431 CD2 LEU A 92 -10.637 -25.831 33.377 1.00 14.01 C ATOM 0 H LEU A 92 -13.580 -22.146 33.164 1.00 1.21 H new ATOM 0 HA LEU A 92 -14.317 -24.945 33.497 1.00 35.44 H new ATOM 0 HB2 LEU A 92 -12.930 -24.091 31.599 1.00 63.20 H new ATOM 0 HB3 LEU A 92 -11.695 -23.609 32.745 1.00 63.20 H new ATOM 0 HG LEU A 92 -12.569 -26.472 32.741 1.00 51.53 H new ATOM 0 HD11 LEU A 92 -10.963 -26.987 30.945 1.00 72.11 H new ATOM 0 HD12 LEU A 92 -12.299 -25.965 30.363 1.00 72.11 H new ATOM 0 HD13 LEU A 92 -10.703 -25.246 30.684 1.00 72.11 H new ATOM 0 HD21 LEU A 92 -10.190 -26.821 33.282 1.00 14.01 H new ATOM 0 HD22 LEU A 92 -9.900 -25.073 33.112 1.00 14.01 H new ATOM 0 HD23 LEU A 92 -10.962 -25.677 34.406 1.00 14.01 H new ATOM 1443 N ASN A 93 -12.694 -23.293 35.730 1.00 5.34 N ATOM 1444 CA ASN A 93 -12.102 -23.352 37.062 1.00 33.33 C ATOM 1445 C ASN A 93 -12.959 -24.198 38.000 1.00 5.22 C ATOM 1446 O ASN A 93 -12.450 -25.068 38.707 1.00 12.02 O ATOM 1447 CB ASN A 93 -11.939 -21.943 37.634 1.00 14.51 C ATOM 1448 CG ASN A 93 -10.635 -21.771 38.388 1.00 65.54 C ATOM 1449 OD1 ASN A 93 -10.026 -22.747 38.827 1.00 62.45 O ATOM 1450 ND2 ASN A 93 -10.199 -20.526 38.541 1.00 21.41 N ATOM 0 H ASN A 93 -12.908 -22.350 35.405 1.00 5.34 H new ATOM 0 HA ASN A 93 -11.120 -23.817 36.976 1.00 33.33 H new ATOM 0 HB2 ASN A 93 -11.984 -21.217 36.822 1.00 14.51 H new ATOM 0 HB3 ASN A 93 -12.773 -21.727 38.302 1.00 14.51 H new ATOM 0 HD21 ASN A 93 -9.327 -20.349 39.039 1.00 21.41 H new ATOM 0 HD22 ASN A 93 -10.736 -19.747 38.160 1.00 21.41 H new ATOM 1457 N VAL A 94 -14.262 -23.936 38.000 1.00 2.14 N ATOM 1458 CA VAL A 94 -15.190 -24.673 38.849 1.00 24.45 C ATOM 1459 C VAL A 94 -16.350 -25.236 38.036 1.00 13.35 C ATOM 1460 O VAL A 94 -16.470 -24.971 36.840 1.00 53.51 O ATOM 1461 CB VAL A 94 -15.749 -23.783 39.975 1.00 72.21 C ATOM 1462 CG1 VAL A 94 -15.906 -24.582 41.260 1.00 73.13 C ATOM 1463 CG2 VAL A 94 -14.851 -22.575 40.195 1.00 61.42 C ATOM 0 H VAL A 94 -14.699 -23.219 37.421 1.00 2.14 H new ATOM 0 HA VAL A 94 -14.629 -25.496 39.292 1.00 24.45 H new ATOM 0 HB VAL A 94 -16.734 -23.425 39.676 1.00 72.21 H new ATOM 0 HG11 VAL A 94 -16.302 -23.936 42.044 1.00 73.13 H new ATOM 0 HG12 VAL A 94 -16.593 -25.411 41.091 1.00 73.13 H new ATOM 0 HG13 VAL A 94 -14.935 -24.972 41.567 1.00 73.13 H new ATOM 0 HG21 VAL A 94 -15.261 -21.957 40.994 1.00 61.42 H new ATOM 0 HG22 VAL A 94 -13.852 -22.910 40.472 1.00 61.42 H new ATOM 0 HG23 VAL A 94 -14.796 -21.991 39.277 1.00 61.42 H new ATOM 1644 N GLY A 108 -25.938 -29.339 26.221 1.00 54.13 N ATOM 1645 CA GLY A 108 -25.977 -28.586 24.981 1.00 41.03 C ATOM 1646 C GLY A 108 -25.085 -27.361 25.018 1.00 23.13 C ATOM 1647 O GLY A 108 -25.183 -26.487 24.156 1.00 22.14 O ATOM 0 HA2 GLY A 108 -25.669 -29.231 24.158 1.00 41.03 H new ATOM 0 HA3 GLY A 108 -27.003 -28.279 24.778 1.00 41.03 H new ATOM 1651 N ILE A 109 -24.214 -27.296 26.020 1.00 64.15 N ATOM 1652 CA ILE A 109 -23.301 -26.169 26.166 1.00 53.23 C ATOM 1653 C ILE A 109 -22.127 -26.283 25.199 1.00 55.40 C ATOM 1654 O ILE A 109 -21.530 -25.279 24.811 1.00 53.54 O ATOM 1655 CB ILE A 109 -22.759 -26.066 27.604 1.00 54.13 C ATOM 1656 CG1 ILE A 109 -23.874 -26.348 28.613 1.00 22.43 C ATOM 1657 CG2 ILE A 109 -22.155 -24.691 27.845 1.00 42.23 C ATOM 1658 CD1 ILE A 109 -23.459 -26.121 30.050 1.00 12.02 C ATOM 0 H ILE A 109 -24.122 -28.010 26.742 1.00 64.15 H new ATOM 0 HA ILE A 109 -23.872 -25.269 25.936 1.00 53.23 H new ATOM 0 HB ILE A 109 -21.977 -26.813 27.736 1.00 54.13 H new ATOM 0 HG12 ILE A 109 -24.729 -25.711 28.385 1.00 22.43 H new ATOM 0 HG13 ILE A 109 -24.205 -27.380 28.497 1.00 22.43 H new ATOM 0 HG21 ILE A 109 -21.776 -24.634 28.866 1.00 42.23 H new ATOM 0 HG22 ILE A 109 -21.337 -24.525 27.144 1.00 42.23 H new ATOM 0 HG23 ILE A 109 -22.919 -23.927 27.698 1.00 42.23 H new ATOM 0 HD11 ILE A 109 -24.298 -26.340 30.710 1.00 12.02 H new ATOM 0 HD12 ILE A 109 -22.624 -26.777 30.295 1.00 12.02 H new ATOM 0 HD13 ILE A 109 -23.156 -25.082 30.181 1.00 12.02 H new ATOM 1670 N ASP A 110 -21.803 -27.512 24.813 1.00 13.31 N ATOM 1671 CA ASP A 110 -20.702 -27.757 23.889 1.00 74.43 C ATOM 1672 C ASP A 110 -21.091 -27.370 22.465 1.00 33.33 C ATOM 1673 O ASP A 110 -20.348 -26.671 21.777 1.00 52.41 O ATOM 1674 CB ASP A 110 -20.288 -29.229 23.935 1.00 32.02 C ATOM 1675 CG ASP A 110 -18.852 -29.412 24.384 1.00 23.20 C ATOM 1676 OD1 ASP A 110 -17.968 -28.711 23.848 1.00 71.14 O ATOM 1677 OD2 ASP A 110 -18.611 -30.256 25.272 1.00 32.13 O ATOM 0 H ASP A 110 -22.287 -28.354 25.125 1.00 13.31 H new ATOM 0 HA ASP A 110 -19.858 -27.140 24.197 1.00 74.43 H new ATOM 0 HB2 ASP A 110 -20.949 -29.768 24.613 1.00 32.02 H new ATOM 0 HB3 ASP A 110 -20.416 -29.671 22.947 1.00 32.02 H new ATOM 1682 N ARG A 111 -22.260 -27.831 22.030 1.00 4.05 N ATOM 1683 CA ARG A 111 -22.746 -27.535 20.688 1.00 1.24 C ATOM 1684 C ARG A 111 -22.938 -26.033 20.499 1.00 52.01 C ATOM 1685 O ARG A 111 -22.579 -25.478 19.460 1.00 3.54 O ATOM 1686 CB ARG A 111 -24.064 -28.265 20.428 1.00 75.51 C ATOM 1687 CG ARG A 111 -25.143 -27.960 21.455 1.00 60.54 C ATOM 1688 CD ARG A 111 -26.313 -28.924 21.336 1.00 32.43 C ATOM 1689 NE ARG A 111 -27.586 -28.281 21.652 1.00 21.54 N ATOM 1690 CZ ARG A 111 -28.225 -27.468 20.819 1.00 1.44 C ATOM 1691 NH1 ARG A 111 -27.713 -27.199 19.626 1.00 23.13 N ATOM 1692 NH2 ARG A 111 -29.379 -26.921 21.179 1.00 12.12 N ATOM 0 H ARG A 111 -22.887 -28.411 22.588 1.00 4.05 H new ATOM 0 HA ARG A 111 -22.000 -27.881 19.973 1.00 1.24 H new ATOM 0 HB2 ARG A 111 -24.430 -27.994 19.438 1.00 75.51 H new ATOM 0 HB3 ARG A 111 -23.878 -29.339 20.417 1.00 75.51 H new ATOM 0 HG2 ARG A 111 -24.720 -28.021 22.458 1.00 60.54 H new ATOM 0 HG3 ARG A 111 -25.497 -26.938 21.320 1.00 60.54 H new ATOM 0 HD2 ARG A 111 -26.351 -29.325 20.323 1.00 32.43 H new ATOM 0 HD3 ARG A 111 -26.157 -29.768 22.007 1.00 32.43 H new ATOM 0 HE ARG A 111 -28.007 -28.467 22.562 1.00 21.54 H new ATOM 0 HH11 ARG A 111 -26.826 -27.617 19.346 1.00 23.13 H new ATOM 0 HH12 ARG A 111 -28.206 -26.574 18.988 1.00 23.13 H new ATOM 0 HH21 ARG A 111 -29.776 -27.125 22.096 1.00 12.12 H new ATOM 0 HH22 ARG A 111 -29.869 -26.297 20.539 1.00 12.12 H new ATOM 1706 N ILE A 112 -23.507 -25.383 21.508 1.00 15.32 N ATOM 1707 CA ILE A 112 -23.747 -23.946 21.452 1.00 2.05 C ATOM 1708 C ILE A 112 -22.442 -23.166 21.577 1.00 73.15 C ATOM 1709 O ILE A 112 -22.299 -22.081 21.013 1.00 71.03 O ATOM 1710 CB ILE A 112 -24.711 -23.492 22.565 1.00 63.33 C ATOM 1711 CG1 ILE A 112 -26.088 -24.130 22.368 1.00 43.45 C ATOM 1712 CG2 ILE A 112 -24.821 -21.975 22.584 1.00 70.14 C ATOM 1713 CD1 ILE A 112 -26.740 -23.765 21.052 1.00 3.53 C ATOM 0 H ILE A 112 -23.810 -25.828 22.374 1.00 15.32 H new ATOM 0 HA ILE A 112 -24.201 -23.739 20.483 1.00 2.05 H new ATOM 0 HB ILE A 112 -24.314 -23.819 23.526 1.00 63.33 H new ATOM 0 HG12 ILE A 112 -25.989 -25.214 22.427 1.00 43.45 H new ATOM 0 HG13 ILE A 112 -26.741 -23.824 23.185 1.00 43.45 H new ATOM 0 HG21 ILE A 112 -25.505 -21.670 23.375 1.00 70.14 H new ATOM 0 HG22 ILE A 112 -23.838 -21.541 22.767 1.00 70.14 H new ATOM 0 HG23 ILE A 112 -25.199 -21.626 21.623 1.00 70.14 H new ATOM 0 HD11 ILE A 112 -27.712 -24.252 20.980 1.00 3.53 H new ATOM 0 HD12 ILE A 112 -26.871 -22.684 20.998 1.00 3.53 H new ATOM 0 HD13 ILE A 112 -26.107 -24.095 20.228 1.00 3.53 H new ATOM 1725 N PHE A 113 -21.492 -23.727 22.317 1.00 31.20 N ATOM 1726 CA PHE A 113 -20.198 -23.085 22.515 1.00 62.13 C ATOM 1727 C PHE A 113 -19.533 -22.778 21.176 1.00 10.31 C ATOM 1728 O PHE A 113 -19.249 -21.621 20.862 1.00 73.03 O ATOM 1729 CB PHE A 113 -19.285 -23.978 23.357 1.00 21.41 C ATOM 1730 CG PHE A 113 -17.849 -23.537 23.359 1.00 53.43 C ATOM 1731 CD1 PHE A 113 -16.965 -24.007 22.401 1.00 1.53 C ATOM 1732 CD2 PHE A 113 -17.384 -22.652 24.318 1.00 12.41 C ATOM 1733 CE1 PHE A 113 -15.643 -23.602 22.400 1.00 53.33 C ATOM 1734 CE2 PHE A 113 -16.064 -22.243 24.321 1.00 0.12 C ATOM 1735 CZ PHE A 113 -15.192 -22.719 23.362 1.00 72.43 C ATOM 0 H PHE A 113 -21.594 -24.625 22.790 1.00 31.20 H new ATOM 0 HA PHE A 113 -20.364 -22.146 23.043 1.00 62.13 H new ATOM 0 HB2 PHE A 113 -19.653 -23.995 24.383 1.00 21.41 H new ATOM 0 HB3 PHE A 113 -19.342 -24.999 22.981 1.00 21.41 H new ATOM 0 HD1 PHE A 113 -17.313 -24.697 21.647 1.00 1.53 H new ATOM 0 HD2 PHE A 113 -18.061 -22.277 25.072 1.00 12.41 H new ATOM 0 HE1 PHE A 113 -14.964 -23.976 21.648 1.00 53.33 H new ATOM 0 HE2 PHE A 113 -15.715 -21.551 25.073 1.00 0.12 H new ATOM 0 HZ PHE A 113 -14.160 -22.402 23.364 1.00 72.43 H new ATOM 1745 N LEU A 114 -19.287 -23.821 20.392 1.00 63.05 N ATOM 1746 CA LEU A 114 -18.654 -23.664 19.086 1.00 35.32 C ATOM 1747 C LEU A 114 -19.554 -22.879 18.136 1.00 25.15 C ATOM 1748 O LEU A 114 -19.076 -22.250 17.192 1.00 71.41 O ATOM 1749 CB LEU A 114 -18.332 -25.034 18.486 1.00 51.10 C ATOM 1750 CG LEU A 114 -19.468 -25.716 17.722 1.00 24.35 C ATOM 1751 CD1 LEU A 114 -19.356 -25.432 16.233 1.00 44.13 C ATOM 1752 CD2 LEU A 114 -19.460 -27.215 17.983 1.00 32.52 C ATOM 0 H LEU A 114 -19.516 -24.784 20.637 1.00 63.05 H new ATOM 0 HA LEU A 114 -17.727 -23.107 19.223 1.00 35.32 H new ATOM 0 HB2 LEU A 114 -17.483 -24.923 17.812 1.00 51.10 H new ATOM 0 HB3 LEU A 114 -18.014 -25.696 19.292 1.00 51.10 H new ATOM 0 HG LEU A 114 -20.415 -25.310 18.078 1.00 24.35 H new ATOM 0 HD11 LEU A 114 -20.173 -25.925 15.706 1.00 44.13 H new ATOM 0 HD12 LEU A 114 -19.411 -24.357 16.063 1.00 44.13 H new ATOM 0 HD13 LEU A 114 -18.404 -25.810 15.861 1.00 44.13 H new ATOM 0 HD21 LEU A 114 -20.275 -27.685 17.432 1.00 32.52 H new ATOM 0 HD22 LEU A 114 -18.510 -27.636 17.655 1.00 32.52 H new ATOM 0 HD23 LEU A 114 -19.590 -27.399 19.049 1.00 32.52 H new ATOM 1764 N TRP A 115 -20.856 -22.919 18.395 1.00 5.40 N ATOM 1765 CA TRP A 115 -21.821 -22.209 17.564 1.00 14.41 C ATOM 1766 C TRP A 115 -21.665 -20.700 17.716 1.00 10.43 C ATOM 1767 O TRP A 115 -21.992 -19.938 16.807 1.00 41.13 O ATOM 1768 CB TRP A 115 -23.246 -22.626 17.932 1.00 11.14 C ATOM 1769 CG TRP A 115 -23.934 -23.407 16.854 1.00 41.22 C ATOM 1770 CD1 TRP A 115 -24.453 -24.666 16.957 1.00 1.34 C ATOM 1771 CD2 TRP A 115 -24.175 -22.981 15.508 1.00 14.55 C ATOM 1772 NE1 TRP A 115 -25.002 -25.048 15.757 1.00 15.23 N ATOM 1773 CE2 TRP A 115 -24.846 -24.031 14.853 1.00 60.45 C ATOM 1774 CE3 TRP A 115 -23.892 -21.813 14.795 1.00 54.13 C ATOM 1775 CZ2 TRP A 115 -25.235 -23.948 13.518 1.00 12.34 C ATOM 1776 CZ3 TRP A 115 -24.279 -21.732 13.471 1.00 51.54 C ATOM 1777 CH2 TRP A 115 -24.945 -22.793 12.844 1.00 52.03 C ATOM 0 H TRP A 115 -21.267 -23.435 19.173 1.00 5.40 H new ATOM 0 HA TRP A 115 -21.630 -22.472 16.524 1.00 14.41 H new ATOM 0 HB2 TRP A 115 -23.218 -23.224 18.843 1.00 11.14 H new ATOM 0 HB3 TRP A 115 -23.832 -21.734 18.155 1.00 11.14 H new ATOM 0 HD1 TRP A 115 -24.435 -25.272 17.851 1.00 1.34 H new ATOM 0 HE1 TRP A 115 -25.453 -25.944 15.570 1.00 15.23 H new ATOM 0 HE3 TRP A 115 -23.380 -20.989 15.270 1.00 54.13 H new ATOM 0 HZ2 TRP A 115 -25.747 -24.766 13.032 1.00 12.34 H new ATOM 0 HZ3 TRP A 115 -24.064 -20.835 12.910 1.00 51.54 H new ATOM 0 HH2 TRP A 115 -25.235 -22.697 11.808 1.00 52.03 H new ATOM 1788 N MET A 116 -21.163 -20.274 18.871 1.00 33.42 N ATOM 1789 CA MET A 116 -20.963 -18.855 19.141 1.00 62.34 C ATOM 1790 C MET A 116 -19.706 -18.342 18.445 1.00 24.45 C ATOM 1791 O MET A 116 -19.735 -17.317 17.764 1.00 33.22 O ATOM 1792 CB MET A 116 -20.863 -18.609 20.647 1.00 21.43 C ATOM 1793 CG MET A 116 -21.752 -17.479 21.139 1.00 41.43 C ATOM 1794 SD MET A 116 -20.809 -16.094 21.806 1.00 33.15 S ATOM 1795 CE MET A 116 -19.641 -15.809 20.479 1.00 1.44 C ATOM 0 H MET A 116 -20.887 -20.891 19.635 1.00 33.42 H new ATOM 0 HA MET A 116 -21.822 -18.311 18.749 1.00 62.34 H new ATOM 0 HB2 MET A 116 -21.128 -19.525 21.175 1.00 21.43 H new ATOM 0 HB3 MET A 116 -19.828 -18.383 20.902 1.00 21.43 H new ATOM 0 HG2 MET A 116 -22.375 -17.127 20.316 1.00 41.43 H new ATOM 0 HG3 MET A 116 -22.425 -17.859 21.908 1.00 41.43 H new ATOM 0 HE1 MET A 116 -19.236 -14.801 20.561 1.00 1.44 H new ATOM 0 HE2 MET A 116 -18.829 -16.533 20.547 1.00 1.44 H new ATOM 0 HE3 MET A 116 -20.146 -15.920 19.520 1.00 1.44 H new ATOM 1805 N PHE A 117 -18.602 -19.061 18.622 1.00 20.32 N ATOM 1806 CA PHE A 117 -17.334 -18.678 18.013 1.00 41.32 C ATOM 1807 C PHE A 117 -17.499 -18.445 16.514 1.00 53.41 C ATOM 1808 O PHE A 117 -16.957 -17.488 15.960 1.00 5.13 O ATOM 1809 CB PHE A 117 -16.278 -19.757 18.259 1.00 72.50 C ATOM 1810 CG PHE A 117 -15.650 -19.682 19.621 1.00 34.54 C ATOM 1811 CD1 PHE A 117 -16.395 -19.954 20.758 1.00 61.52 C ATOM 1812 CD2 PHE A 117 -14.316 -19.339 19.766 1.00 63.33 C ATOM 1813 CE1 PHE A 117 -15.820 -19.887 22.013 1.00 12.31 C ATOM 1814 CE2 PHE A 117 -13.736 -19.270 21.018 1.00 25.42 C ATOM 1815 CZ PHE A 117 -14.489 -19.543 22.143 1.00 21.23 C ATOM 0 H PHE A 117 -18.560 -19.912 19.182 1.00 20.32 H new ATOM 0 HA PHE A 117 -17.006 -17.747 18.474 1.00 41.32 H new ATOM 0 HB2 PHE A 117 -16.736 -20.738 18.133 1.00 72.50 H new ATOM 0 HB3 PHE A 117 -15.498 -19.670 17.503 1.00 72.50 H new ATOM 0 HD1 PHE A 117 -17.437 -20.221 20.662 1.00 61.52 H new ATOM 0 HD2 PHE A 117 -13.722 -19.123 18.890 1.00 63.33 H new ATOM 0 HE1 PHE A 117 -16.411 -20.103 22.891 1.00 12.31 H new ATOM 0 HE2 PHE A 117 -12.694 -19.003 21.117 1.00 25.42 H new ATOM 0 HZ PHE A 117 -14.038 -19.488 23.123 1.00 21.23 H new ATOM 1825 N ILE A 118 -18.252 -19.326 15.864 1.00 43.12 N ATOM 1826 CA ILE A 118 -18.489 -19.216 14.430 1.00 72.32 C ATOM 1827 C ILE A 118 -19.549 -18.163 14.127 1.00 15.11 C ATOM 1828 O ILE A 118 -19.614 -17.634 13.017 1.00 73.21 O ATOM 1829 CB ILE A 118 -18.933 -20.563 13.828 1.00 2.31 C ATOM 1830 CG1 ILE A 118 -20.264 -21.005 14.439 1.00 70.31 C ATOM 1831 CG2 ILE A 118 -17.863 -21.621 14.052 1.00 31.12 C ATOM 1832 CD1 ILE A 118 -20.769 -22.324 13.896 1.00 12.23 C ATOM 0 H ILE A 118 -18.708 -20.123 16.307 1.00 43.12 H new ATOM 0 HA ILE A 118 -17.544 -18.918 13.976 1.00 72.32 H new ATOM 0 HB ILE A 118 -19.072 -20.437 12.754 1.00 2.31 H new ATOM 0 HG12 ILE A 118 -20.149 -21.086 15.520 1.00 70.31 H new ATOM 0 HG13 ILE A 118 -21.013 -20.235 14.255 1.00 70.31 H new ATOM 0 HG21 ILE A 118 -18.191 -22.567 13.621 1.00 31.12 H new ATOM 0 HG22 ILE A 118 -16.935 -21.307 13.574 1.00 31.12 H new ATOM 0 HG23 ILE A 118 -17.695 -21.748 15.121 1.00 31.12 H new ATOM 0 HD11 ILE A 118 -21.716 -22.575 14.373 1.00 12.23 H new ATOM 0 HD12 ILE A 118 -20.916 -22.242 12.819 1.00 12.23 H new ATOM 0 HD13 ILE A 118 -20.039 -23.106 14.104 1.00 12.23 H new ATOM 1844 N ILE A 119 -20.377 -17.862 15.122 1.00 52.21 N ATOM 1845 CA ILE A 119 -21.433 -16.869 14.963 1.00 62.32 C ATOM 1846 C ILE A 119 -20.854 -15.462 14.860 1.00 24.42 C ATOM 1847 O ILE A 119 -21.404 -14.601 14.175 1.00 55.14 O ATOM 1848 CB ILE A 119 -22.432 -16.917 16.134 1.00 4.01 C ATOM 1849 CG1 ILE A 119 -23.814 -17.344 15.637 1.00 53.41 C ATOM 1850 CG2 ILE A 119 -22.505 -15.562 16.823 1.00 71.41 C ATOM 1851 CD1 ILE A 119 -24.525 -18.296 16.572 1.00 35.04 C ATOM 0 H ILE A 119 -20.337 -18.291 16.046 1.00 52.21 H new ATOM 0 HA ILE A 119 -21.958 -17.112 14.039 1.00 62.32 H new ATOM 0 HB ILE A 119 -22.085 -17.653 16.859 1.00 4.01 H new ATOM 0 HG12 ILE A 119 -24.431 -16.456 15.497 1.00 53.41 H new ATOM 0 HG13 ILE A 119 -23.710 -17.817 14.660 1.00 53.41 H new ATOM 0 HG21 ILE A 119 -23.215 -15.611 17.649 1.00 71.41 H new ATOM 0 HG22 ILE A 119 -21.520 -15.295 17.207 1.00 71.41 H new ATOM 0 HG23 ILE A 119 -22.832 -14.807 16.108 1.00 71.41 H new ATOM 0 HD11 ILE A 119 -25.498 -18.556 16.156 1.00 35.04 H new ATOM 0 HD12 ILE A 119 -23.929 -19.200 16.693 1.00 35.04 H new ATOM 0 HD13 ILE A 119 -24.661 -17.819 17.543 1.00 35.04 H new ATOM 1863 N VAL A 120 -19.737 -15.237 15.545 1.00 10.43 N ATOM 1864 CA VAL A 120 -19.080 -13.935 15.529 1.00 14.14 C ATOM 1865 C VAL A 120 -18.148 -13.804 14.330 1.00 21.43 C ATOM 1866 O VAL A 120 -17.933 -12.707 13.815 1.00 43.31 O ATOM 1867 CB VAL A 120 -18.275 -13.697 16.820 1.00 0.25 C ATOM 1868 CG1 VAL A 120 -19.206 -13.583 18.018 1.00 73.03 C ATOM 1869 CG2 VAL A 120 -17.260 -14.811 17.028 1.00 51.20 C ATOM 0 H VAL A 120 -19.268 -15.939 16.118 1.00 10.43 H new ATOM 0 HA VAL A 120 -19.867 -13.184 15.457 1.00 14.14 H new ATOM 0 HB VAL A 120 -17.733 -12.756 16.721 1.00 0.25 H new ATOM 0 HG11 VAL A 120 -18.619 -13.415 18.921 1.00 73.03 H new ATOM 0 HG12 VAL A 120 -19.890 -12.747 17.869 1.00 73.03 H new ATOM 0 HG13 VAL A 120 -19.778 -14.505 18.124 1.00 73.03 H new ATOM 0 HG21 VAL A 120 -16.700 -14.627 17.945 1.00 51.20 H new ATOM 0 HG22 VAL A 120 -17.779 -15.766 17.106 1.00 51.20 H new ATOM 0 HG23 VAL A 120 -16.573 -14.839 16.183 1.00 51.20 H new ATOM 1879 N CYS A 121 -17.597 -14.931 13.891 1.00 55.41 N ATOM 1880 CA CYS A 121 -16.687 -14.943 12.751 1.00 1.24 C ATOM 1881 C CYS A 121 -17.407 -14.517 11.476 1.00 63.32 C ATOM 1882 O CYS A 121 -16.912 -13.679 10.721 1.00 62.22 O ATOM 1883 CB CYS A 121 -16.082 -16.336 12.570 1.00 54.20 C ATOM 1884 SG CYS A 121 -14.510 -16.576 13.430 1.00 41.24 S ATOM 0 H CYS A 121 -17.764 -15.847 14.307 1.00 55.41 H new ATOM 0 HA CYS A 121 -15.886 -14.230 12.949 1.00 1.24 H new ATOM 0 HB2 CYS A 121 -16.796 -17.079 12.926 1.00 54.20 H new ATOM 0 HB3 CYS A 121 -15.934 -16.520 11.506 1.00 54.20 H new ATOM 0 HG CYS A 121 -14.080 -17.784 13.218 1.00 41.24 H new ATOM 1890 N LEU A 122 -18.576 -15.101 11.240 1.00 34.21 N ATOM 1891 CA LEU A 122 -19.365 -14.784 10.054 1.00 24.02 C ATOM 1892 C LEU A 122 -20.037 -13.422 10.195 1.00 20.25 C ATOM 1893 O LEU A 122 -20.204 -12.695 9.215 1.00 61.50 O ATOM 1894 CB LEU A 122 -20.421 -15.865 9.816 1.00 43.44 C ATOM 1895 CG LEU A 122 -20.254 -16.696 8.543 1.00 34.44 C ATOM 1896 CD1 LEU A 122 -20.287 -15.803 7.313 1.00 1.33 C ATOM 1897 CD2 LEU A 122 -18.958 -17.493 8.592 1.00 15.43 C ATOM 0 H LEU A 122 -18.999 -15.797 11.854 1.00 34.21 H new ATOM 0 HA LEU A 122 -18.691 -14.749 9.198 1.00 24.02 H new ATOM 0 HB2 LEU A 122 -20.419 -16.541 10.671 1.00 43.44 H new ATOM 0 HB3 LEU A 122 -21.401 -15.388 9.789 1.00 43.44 H new ATOM 0 HG LEU A 122 -21.086 -17.397 8.479 1.00 34.44 H new ATOM 0 HD11 LEU A 122 -20.167 -16.413 6.417 1.00 1.33 H new ATOM 0 HD12 LEU A 122 -21.242 -15.279 7.269 1.00 1.33 H new ATOM 0 HD13 LEU A 122 -19.476 -15.076 7.369 1.00 1.33 H new ATOM 0 HD21 LEU A 122 -18.856 -18.078 7.678 1.00 15.43 H new ATOM 0 HD22 LEU A 122 -18.114 -16.809 8.681 1.00 15.43 H new ATOM 0 HD23 LEU A 122 -18.975 -18.163 9.452 1.00 15.43 H new ATOM 1909 N LEU A 123 -20.419 -13.081 11.421 1.00 33.42 N ATOM 1910 CA LEU A 123 -21.072 -11.805 11.692 1.00 44.10 C ATOM 1911 C LEU A 123 -20.129 -10.640 11.405 1.00 34.22 C ATOM 1912 O LEU A 123 -20.397 -9.812 10.536 1.00 44.13 O ATOM 1913 CB LEU A 123 -21.542 -11.749 13.146 1.00 14.23 C ATOM 1914 CG LEU A 123 -22.163 -10.427 13.600 1.00 32.23 C ATOM 1915 CD1 LEU A 123 -21.090 -9.485 14.123 1.00 21.12 C ATOM 1916 CD2 LEU A 123 -22.934 -9.780 12.459 1.00 44.12 C ATOM 0 H LEU A 123 -20.288 -13.670 12.243 1.00 33.42 H new ATOM 0 HA LEU A 123 -21.937 -11.720 11.034 1.00 44.10 H new ATOM 0 HB2 LEU A 123 -22.272 -12.543 13.302 1.00 14.23 H new ATOM 0 HB3 LEU A 123 -20.691 -11.968 13.791 1.00 14.23 H new ATOM 0 HG LEU A 123 -22.861 -10.635 14.411 1.00 32.23 H new ATOM 0 HD11 LEU A 123 -21.551 -8.550 14.441 1.00 21.12 H new ATOM 0 HD12 LEU A 123 -20.582 -9.946 14.970 1.00 21.12 H new ATOM 0 HD13 LEU A 123 -20.367 -9.283 13.333 1.00 21.12 H new ATOM 0 HD21 LEU A 123 -23.369 -8.841 12.800 1.00 44.12 H new ATOM 0 HD22 LEU A 123 -22.257 -9.585 11.627 1.00 44.12 H new ATOM 0 HD23 LEU A 123 -23.729 -10.450 12.131 1.00 44.12 H new ATOM 1928 N GLY A 124 -19.024 -10.585 12.142 1.00 42.32 N ATOM 1929 CA GLY A 124 -18.057 -9.519 11.950 1.00 34.11 C ATOM 1930 C GLY A 124 -17.566 -9.432 10.519 1.00 74.44 C ATOM 1931 O GLY A 124 -17.279 -8.345 10.017 1.00 55.12 O ATOM 0 H GLY A 124 -18.781 -11.259 12.868 1.00 42.32 H new ATOM 0 HA2 GLY A 124 -18.508 -8.568 12.235 1.00 34.11 H new ATOM 0 HA3 GLY A 124 -17.207 -9.680 12.613 1.00 34.11 H new ATOM 1935 N THR A 125 -17.467 -10.582 9.858 1.00 52.32 N ATOM 1936 CA THR A 125 -17.005 -10.632 8.477 1.00 44.23 C ATOM 1937 C THR A 125 -18.006 -9.970 7.537 1.00 1.32 C ATOM 1938 O THR A 125 -17.653 -9.077 6.767 1.00 40.23 O ATOM 1939 CB THR A 125 -16.767 -12.082 8.016 1.00 32.40 C ATOM 1940 OG1 THR A 125 -15.558 -12.588 8.593 1.00 34.14 O ATOM 1941 CG2 THR A 125 -16.682 -12.161 6.499 1.00 34.42 C ATOM 0 H THR A 125 -17.701 -11.491 10.258 1.00 52.32 H new ATOM 0 HA THR A 125 -16.062 -10.087 8.440 1.00 44.23 H new ATOM 0 HB THR A 125 -17.610 -12.688 8.349 1.00 32.40 H new ATOM 0 HG1 THR A 125 -15.765 -13.057 9.428 1.00 34.14 H new ATOM 0 HG21 THR A 125 -16.514 -13.195 6.197 1.00 34.42 H new ATOM 0 HG22 THR A 125 -17.615 -11.803 6.063 1.00 34.42 H new ATOM 0 HG23 THR A 125 -15.857 -11.542 6.148 1.00 34.42 H new ATOM 1949 N VAL A 126 -19.257 -10.412 7.606 1.00 34.42 N ATOM 1950 CA VAL A 126 -20.311 -9.861 6.763 1.00 71.14 C ATOM 1951 C VAL A 126 -20.526 -8.379 7.050 1.00 34.52 C ATOM 1952 O VAL A 126 -20.551 -7.556 6.136 1.00 33.24 O ATOM 1953 CB VAL A 126 -21.641 -10.611 6.964 1.00 14.43 C ATOM 1954 CG1 VAL A 126 -22.808 -9.770 6.468 1.00 34.35 C ATOM 1955 CG2 VAL A 126 -21.606 -11.958 6.258 1.00 2.44 C ATOM 0 H VAL A 126 -19.566 -11.151 8.238 1.00 34.42 H new ATOM 0 HA VAL A 126 -19.987 -9.984 5.730 1.00 71.14 H new ATOM 0 HB VAL A 126 -21.780 -10.790 8.030 1.00 14.43 H new ATOM 0 HG11 VAL A 126 -23.739 -10.316 6.618 1.00 34.35 H new ATOM 0 HG12 VAL A 126 -22.843 -8.833 7.023 1.00 34.35 H new ATOM 0 HG13 VAL A 126 -22.679 -9.558 5.407 1.00 34.35 H new ATOM 0 HG21 VAL A 126 -22.554 -12.474 6.411 1.00 2.44 H new ATOM 0 HG22 VAL A 126 -21.444 -11.805 5.191 1.00 2.44 H new ATOM 0 HG23 VAL A 126 -20.795 -12.561 6.666 1.00 2.44 H new ATOM 1965 N GLY A 127 -20.681 -8.047 8.328 1.00 15.52 N ATOM 1966 CA GLY A 127 -20.892 -6.664 8.714 1.00 13.41 C ATOM 1967 C GLY A 127 -19.743 -5.765 8.302 1.00 13.01 C ATOM 1968 O GLY A 127 -19.933 -4.572 8.063 1.00 12.42 O ATOM 0 H GLY A 127 -20.664 -8.711 9.102 1.00 15.52 H new ATOM 0 HA2 GLY A 127 -21.814 -6.300 8.261 1.00 13.41 H new ATOM 0 HA3 GLY A 127 -21.024 -6.608 9.795 1.00 13.41 H new ATOM 1972 N LEU A 128 -18.547 -6.337 8.220 1.00 72.13 N ATOM 1973 CA LEU A 128 -17.361 -5.579 7.835 1.00 34.31 C ATOM 1974 C LEU A 128 -17.457 -5.118 6.384 1.00 1.25 C ATOM 1975 O LEU A 128 -17.093 -3.988 6.056 1.00 33.31 O ATOM 1976 CB LEU A 128 -16.104 -6.428 8.031 1.00 70.25 C ATOM 1977 CG LEU A 128 -14.792 -5.802 7.557 1.00 25.54 C ATOM 1978 CD1 LEU A 128 -14.648 -4.389 8.100 1.00 22.23 C ATOM 1979 CD2 LEU A 128 -13.608 -6.661 7.980 1.00 34.11 C ATOM 0 H LEU A 128 -18.372 -7.323 8.415 1.00 72.13 H new ATOM 0 HA LEU A 128 -17.300 -4.698 8.473 1.00 34.31 H new ATOM 0 HB2 LEU A 128 -16.010 -6.662 9.091 1.00 70.25 H new ATOM 0 HB3 LEU A 128 -16.243 -7.373 7.507 1.00 70.25 H new ATOM 0 HG LEU A 128 -14.808 -5.751 6.468 1.00 25.54 H new ATOM 0 HD11 LEU A 128 -13.708 -3.960 7.752 1.00 22.23 H new ATOM 0 HD12 LEU A 128 -15.479 -3.777 7.748 1.00 22.23 H new ATOM 0 HD13 LEU A 128 -14.653 -4.416 9.190 1.00 22.23 H new ATOM 0 HD21 LEU A 128 -12.682 -6.201 7.634 1.00 34.11 H new ATOM 0 HD22 LEU A 128 -13.588 -6.744 9.067 1.00 34.11 H new ATOM 0 HD23 LEU A 128 -13.704 -7.655 7.542 1.00 34.11 H new ATOM 1991 N PHE A 129 -17.950 -5.998 5.520 1.00 34.41 N ATOM 1992 CA PHE A 129 -18.095 -5.681 4.104 1.00 32.12 C ATOM 1993 C PHE A 129 -19.521 -5.238 3.789 1.00 1.22 C ATOM 1994 O PHE A 129 -19.891 -5.079 2.625 1.00 32.12 O ATOM 1995 CB PHE A 129 -17.725 -6.894 3.248 1.00 52.24 C ATOM 1996 CG PHE A 129 -16.264 -6.962 2.905 1.00 74.40 C ATOM 1997 CD1 PHE A 129 -15.349 -7.466 3.815 1.00 61.33 C ATOM 1998 CD2 PHE A 129 -15.807 -6.523 1.673 1.00 2.53 C ATOM 1999 CE1 PHE A 129 -14.004 -7.531 3.502 1.00 21.24 C ATOM 2000 CE2 PHE A 129 -14.463 -6.585 1.355 1.00 33.44 C ATOM 2001 CZ PHE A 129 -13.561 -7.089 2.271 1.00 24.14 C ATOM 0 H PHE A 129 -18.256 -6.937 5.775 1.00 34.41 H new ATOM 0 HA PHE A 129 -17.418 -4.859 3.870 1.00 32.12 H new ATOM 0 HB2 PHE A 129 -18.008 -7.803 3.778 1.00 52.24 H new ATOM 0 HB3 PHE A 129 -18.306 -6.869 2.326 1.00 52.24 H new ATOM 0 HD1 PHE A 129 -15.690 -7.812 4.780 1.00 61.33 H new ATOM 0 HD2 PHE A 129 -16.508 -6.128 0.953 1.00 2.53 H new ATOM 0 HE1 PHE A 129 -13.301 -7.927 4.219 1.00 21.24 H new ATOM 0 HE2 PHE A 129 -14.119 -6.240 0.391 1.00 33.44 H new ATOM 0 HZ PHE A 129 -12.510 -7.137 2.025 1.00 24.14 H new