USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=25 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 22 SER OG : rot 96:sc= 0.55 USER MOD Set 1.2: A 121 CYS SG : rot 78:sc= 0.839 USER MOD Set 2.1: A 18 CYS SG : rot 180:sc= 0.318 USER MOD Set 2.2: A 73 TYR OH : rot 135:sc= 0.701 USER MOD Single : A 10 TYR OH : rot 150:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0.046 X(o=0.046,f=-0.0088) USER MOD Single : A 23 CYS SG : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 79:sc= 0.0182 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 CYS SG : rot -16:sc= 0.151 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 CYS SG : rot 180:sc= -0.0192 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 76:sc= 0.749 USER MOD Single : A 57 THR OG1 : rot -64:sc= 1.28 USER MOD Single : A 69 SER OG : rot -113:sc= -0.549 USER MOD Single : A 77 THR OG1 : rot -177:sc= 1.24 USER MOD Single : A 78 MET CE :methyl -135:sc= 0 (180deg=-1.8!) USER MOD Single : A 82 THR OG1 : rot 89:sc= 1.12 USER MOD Single : A 84 SER OG : rot 79:sc= 0.732 USER MOD Single : A 88 THR OG1 : rot 87:sc= 1.26 USER MOD Single : A 93 ASN : amide:sc=-0.000766 X(o=-0.00077,f=-0.016) USER MOD Single : A 116 MET CE :methyl 160:sc= -3.45 (180deg=-6.13!) USER MOD Single : A 125 THR OG1 : rot 96:sc= 1.27 USER MOD ----------------------------------------------------------------- ATOM 64 N LEU A 8 -6.927 -6.852 -2.424 1.00 43.04 N ATOM 65 CA LEU A 8 -7.841 -7.893 -1.968 1.00 13.21 C ATOM 66 C LEU A 8 -7.108 -9.217 -1.777 1.00 50.40 C ATOM 67 O LEU A 8 -7.420 -9.986 -0.868 1.00 15.00 O ATOM 68 CB LEU A 8 -8.985 -8.070 -2.969 1.00 5.42 C ATOM 69 CG LEU A 8 -10.289 -8.633 -2.405 1.00 14.23 C ATOM 70 CD1 LEU A 8 -10.095 -10.068 -1.940 1.00 4.42 C ATOM 71 CD2 LEU A 8 -10.795 -7.764 -1.262 1.00 74.13 C ATOM 0 HA LEU A 8 -8.252 -7.585 -1.007 1.00 13.21 H new ATOM 0 HB2 LEU A 8 -9.197 -7.102 -3.423 1.00 5.42 H new ATOM 0 HB3 LEU A 8 -8.644 -8.729 -3.768 1.00 5.42 H new ATOM 0 HG LEU A 8 -11.037 -8.628 -3.198 1.00 14.23 H new ATOM 0 HD11 LEU A 8 -11.034 -10.452 -1.542 1.00 4.42 H new ATOM 0 HD12 LEU A 8 -9.780 -10.684 -2.782 1.00 4.42 H new ATOM 0 HD13 LEU A 8 -9.332 -10.098 -1.162 1.00 4.42 H new ATOM 0 HD21 LEU A 8 -11.724 -8.180 -0.873 1.00 74.13 H new ATOM 0 HD22 LEU A 8 -10.049 -7.737 -0.468 1.00 74.13 H new ATOM 0 HD23 LEU A 8 -10.975 -6.752 -1.626 1.00 74.13 H new ATOM 83 N PHE A 9 -6.130 -9.475 -2.639 1.00 1.12 N ATOM 84 CA PHE A 9 -5.351 -10.705 -2.565 1.00 23.35 C ATOM 85 C PHE A 9 -4.811 -10.923 -1.154 1.00 1.10 C ATOM 86 O PHE A 9 -4.665 -12.059 -0.702 1.00 2.22 O ATOM 87 CB PHE A 9 -4.193 -10.662 -3.565 1.00 35.34 C ATOM 88 CG PHE A 9 -3.504 -11.985 -3.741 1.00 73.12 C ATOM 89 CD1 PHE A 9 -2.663 -12.480 -2.758 1.00 12.24 C ATOM 90 CD2 PHE A 9 -3.697 -12.734 -4.891 1.00 53.41 C ATOM 91 CE1 PHE A 9 -2.028 -13.697 -2.917 1.00 3.13 C ATOM 92 CE2 PHE A 9 -3.065 -13.951 -5.056 1.00 21.54 C ATOM 93 CZ PHE A 9 -2.228 -14.433 -4.068 1.00 32.11 C ATOM 0 H PHE A 9 -5.858 -8.849 -3.397 1.00 1.12 H new ATOM 0 HA PHE A 9 -6.008 -11.537 -2.816 1.00 23.35 H new ATOM 0 HB2 PHE A 9 -4.570 -10.326 -4.531 1.00 35.34 H new ATOM 0 HB3 PHE A 9 -3.464 -9.923 -3.233 1.00 35.34 H new ATOM 0 HD1 PHE A 9 -2.502 -11.908 -1.856 1.00 12.24 H new ATOM 0 HD2 PHE A 9 -4.349 -12.362 -5.667 1.00 53.41 H new ATOM 0 HE1 PHE A 9 -1.376 -14.072 -2.142 1.00 3.13 H new ATOM 0 HE2 PHE A 9 -3.225 -14.525 -5.957 1.00 21.54 H new ATOM 0 HZ PHE A 9 -1.731 -15.383 -4.196 1.00 32.11 H new ATOM 103 N TYR A 10 -4.516 -9.827 -0.464 1.00 51.44 N ATOM 104 CA TYR A 10 -3.990 -9.896 0.894 1.00 63.34 C ATOM 105 C TYR A 10 -5.090 -10.256 1.887 1.00 74.12 C ATOM 106 O TYR A 10 -4.853 -10.965 2.866 1.00 55.32 O ATOM 107 CB TYR A 10 -3.351 -8.563 1.284 1.00 3.34 C ATOM 108 CG TYR A 10 -2.479 -8.647 2.517 1.00 40.01 C ATOM 109 CD1 TYR A 10 -1.586 -9.697 2.690 1.00 20.10 C ATOM 110 CD2 TYR A 10 -2.548 -7.676 3.508 1.00 2.50 C ATOM 111 CE1 TYR A 10 -0.788 -9.778 3.815 1.00 73.41 C ATOM 112 CE2 TYR A 10 -1.753 -7.748 4.636 1.00 42.14 C ATOM 113 CZ TYR A 10 -0.875 -8.801 4.785 1.00 72.44 C ATOM 114 OH TYR A 10 -0.081 -8.878 5.906 1.00 72.00 O ATOM 0 H TYR A 10 -4.632 -8.879 -0.823 1.00 51.44 H new ATOM 0 HA TYR A 10 -3.230 -10.677 0.923 1.00 63.34 H new ATOM 0 HB2 TYR A 10 -2.752 -8.199 0.449 1.00 3.34 H new ATOM 0 HB3 TYR A 10 -4.138 -7.829 1.455 1.00 3.34 H new ATOM 0 HD1 TYR A 10 -1.514 -10.463 1.932 1.00 20.10 H new ATOM 0 HD2 TYR A 10 -3.235 -6.850 3.395 1.00 2.50 H new ATOM 0 HE1 TYR A 10 -0.100 -10.602 3.934 1.00 73.41 H new ATOM 0 HE2 TYR A 10 -1.819 -6.984 5.397 1.00 42.14 H new ATOM 0 HH TYR A 10 0.114 -7.974 6.231 1.00 72.00 H new ATOM 124 N THR A 11 -6.297 -9.763 1.627 1.00 13.41 N ATOM 125 CA THR A 11 -7.436 -10.030 2.497 1.00 62.33 C ATOM 126 C THR A 11 -7.823 -11.504 2.457 1.00 75.11 C ATOM 127 O THR A 11 -8.303 -12.056 3.448 1.00 72.14 O ATOM 128 CB THR A 11 -8.657 -9.179 2.101 1.00 31.03 C ATOM 129 OG1 THR A 11 -8.564 -7.881 2.699 1.00 31.45 O ATOM 130 CG2 THR A 11 -9.950 -9.852 2.537 1.00 61.32 C ATOM 0 H THR A 11 -6.511 -9.176 0.820 1.00 13.41 H new ATOM 0 HA THR A 11 -7.131 -9.764 3.509 1.00 62.33 H new ATOM 0 HB THR A 11 -8.666 -9.079 1.016 1.00 31.03 H new ATOM 0 HG1 THR A 11 -9.343 -7.345 2.441 1.00 31.45 H new ATOM 0 HG21 THR A 11 -10.799 -9.233 2.247 1.00 61.32 H new ATOM 0 HG22 THR A 11 -10.032 -10.828 2.058 1.00 61.32 H new ATOM 0 HG23 THR A 11 -9.947 -9.979 3.620 1.00 61.32 H new ATOM 138 N ILE A 12 -7.612 -12.136 1.307 1.00 12.32 N ATOM 139 CA ILE A 12 -7.938 -13.547 1.140 1.00 13.52 C ATOM 140 C ILE A 12 -6.896 -14.435 1.812 1.00 55.23 C ATOM 141 O ILE A 12 -7.211 -15.521 2.296 1.00 74.15 O ATOM 142 CB ILE A 12 -8.040 -13.929 -0.348 1.00 44.53 C ATOM 143 CG1 ILE A 12 -8.962 -12.955 -1.085 1.00 62.35 C ATOM 144 CG2 ILE A 12 -8.542 -15.357 -0.496 1.00 23.14 C ATOM 145 CD1 ILE A 12 -10.406 -13.038 -0.642 1.00 62.15 C ATOM 0 H ILE A 12 -7.217 -11.693 0.477 1.00 12.32 H new ATOM 0 HA ILE A 12 -8.907 -13.706 1.614 1.00 13.52 H new ATOM 0 HB ILE A 12 -7.047 -13.867 -0.792 1.00 44.53 H new ATOM 0 HG12 ILE A 12 -8.601 -11.938 -0.931 1.00 62.35 H new ATOM 0 HG13 ILE A 12 -8.907 -13.154 -2.155 1.00 62.35 H new ATOM 0 HG21 ILE A 12 -8.609 -15.612 -1.554 1.00 23.14 H new ATOM 0 HG22 ILE A 12 -7.850 -16.039 -0.001 1.00 23.14 H new ATOM 0 HG23 ILE A 12 -9.528 -15.445 -0.039 1.00 23.14 H new ATOM 0 HD11 ILE A 12 -11.001 -12.320 -1.206 1.00 62.15 H new ATOM 0 HD12 ILE A 12 -10.784 -14.044 -0.822 1.00 62.15 H new ATOM 0 HD13 ILE A 12 -10.474 -12.809 0.422 1.00 62.15 H new ATOM 157 N ASN A 13 -5.654 -13.964 1.839 1.00 40.44 N ATOM 158 CA ASN A 13 -4.565 -14.715 2.452 1.00 1.23 C ATOM 159 C ASN A 13 -4.538 -14.498 3.962 1.00 21.33 C ATOM 160 O ASN A 13 -3.959 -15.293 4.704 1.00 4.33 O ATOM 161 CB ASN A 13 -3.224 -14.300 1.842 1.00 14.03 C ATOM 162 CG ASN A 13 -2.418 -15.489 1.355 1.00 12.45 C ATOM 163 OD1 ASN A 13 -2.190 -16.444 2.098 1.00 42.22 O ATOM 164 ND2 ASN A 13 -1.983 -15.435 0.102 1.00 4.51 N ATOM 0 H ASN A 13 -5.377 -13.066 1.443 1.00 40.44 H new ATOM 0 HA ASN A 13 -4.733 -15.774 2.257 1.00 1.23 H new ATOM 0 HB2 ASN A 13 -3.402 -13.619 1.009 1.00 14.03 H new ATOM 0 HB3 ASN A 13 -2.645 -13.751 2.584 1.00 14.03 H new ATOM 0 HD21 ASN A 13 -1.436 -16.205 -0.281 1.00 4.51 H new ATOM 0 HD22 ASN A 13 -2.196 -14.623 -0.477 1.00 4.51 H new ATOM 171 N LEU A 14 -5.169 -13.419 4.411 1.00 44.42 N ATOM 172 CA LEU A 14 -5.218 -13.097 5.833 1.00 52.12 C ATOM 173 C LEU A 14 -6.468 -13.684 6.481 1.00 51.03 C ATOM 174 O LEU A 14 -6.473 -13.996 7.672 1.00 74.12 O ATOM 175 CB LEU A 14 -5.190 -11.581 6.034 1.00 4.22 C ATOM 176 CG LEU A 14 -3.867 -10.994 6.529 1.00 61.32 C ATOM 177 CD1 LEU A 14 -2.707 -11.517 5.696 1.00 43.21 C ATOM 178 CD2 LEU A 14 -3.911 -9.474 6.491 1.00 3.41 C ATOM 0 H LEU A 14 -5.654 -12.752 3.811 1.00 44.42 H new ATOM 0 HA LEU A 14 -4.342 -13.537 6.310 1.00 52.12 H new ATOM 0 HB2 LEU A 14 -5.444 -11.104 5.087 1.00 4.22 H new ATOM 0 HB3 LEU A 14 -5.972 -11.314 6.745 1.00 4.22 H new ATOM 0 HG LEU A 14 -3.716 -11.307 7.562 1.00 61.32 H new ATOM 0 HD11 LEU A 14 -1.774 -11.089 6.062 1.00 43.21 H new ATOM 0 HD12 LEU A 14 -2.663 -12.603 5.775 1.00 43.21 H new ATOM 0 HD13 LEU A 14 -2.851 -11.234 4.653 1.00 43.21 H new ATOM 0 HD21 LEU A 14 -2.962 -9.074 6.847 1.00 3.41 H new ATOM 0 HD22 LEU A 14 -4.085 -9.141 5.468 1.00 3.41 H new ATOM 0 HD23 LEU A 14 -4.718 -9.117 7.131 1.00 3.41 H new ATOM 190 N ILE A 15 -7.524 -13.833 5.688 1.00 33.34 N ATOM 191 CA ILE A 15 -8.778 -14.386 6.184 1.00 35.13 C ATOM 192 C ILE A 15 -8.694 -15.902 6.324 1.00 21.21 C ATOM 193 O ILE A 15 -9.297 -16.487 7.224 1.00 31.13 O ATOM 194 CB ILE A 15 -9.956 -14.032 5.256 1.00 24.32 C ATOM 195 CG1 ILE A 15 -11.275 -14.510 5.865 1.00 32.54 C ATOM 196 CG2 ILE A 15 -9.748 -14.646 3.880 1.00 61.41 C ATOM 197 CD1 ILE A 15 -11.662 -13.770 7.126 1.00 11.13 C ATOM 0 H ILE A 15 -7.536 -13.579 4.700 1.00 33.34 H new ATOM 0 HA ILE A 15 -8.952 -13.942 7.164 1.00 35.13 H new ATOM 0 HB ILE A 15 -10.000 -12.948 5.146 1.00 24.32 H new ATOM 0 HG12 ILE A 15 -12.069 -14.394 5.127 1.00 32.54 H new ATOM 0 HG13 ILE A 15 -11.199 -15.574 6.087 1.00 32.54 H new ATOM 0 HG21 ILE A 15 -10.588 -14.387 3.235 1.00 61.41 H new ATOM 0 HG22 ILE A 15 -8.825 -14.261 3.446 1.00 61.41 H new ATOM 0 HG23 ILE A 15 -9.681 -15.730 3.972 1.00 61.41 H new ATOM 0 HD11 ILE A 15 -12.607 -14.162 7.502 1.00 11.13 H new ATOM 0 HD12 ILE A 15 -10.887 -13.906 7.880 1.00 11.13 H new ATOM 0 HD13 ILE A 15 -11.771 -12.708 6.906 1.00 11.13 H new ATOM 209 N ILE A 16 -7.940 -16.532 5.429 1.00 33.23 N ATOM 210 CA ILE A 16 -7.774 -17.980 5.455 1.00 73.01 C ATOM 211 C ILE A 16 -7.343 -18.460 6.837 1.00 51.42 C ATOM 212 O ILE A 16 -8.003 -19.284 7.469 1.00 74.30 O ATOM 213 CB ILE A 16 -6.738 -18.446 4.416 1.00 62.34 C ATOM 214 CG1 ILE A 16 -7.418 -18.723 3.073 1.00 11.23 C ATOM 215 CG2 ILE A 16 -6.011 -19.687 4.912 1.00 4.14 C ATOM 216 CD1 ILE A 16 -8.128 -20.058 3.019 1.00 2.41 C ATOM 0 H ILE A 16 -7.435 -16.063 4.677 1.00 33.23 H new ATOM 0 HA ILE A 16 -8.744 -18.413 5.209 1.00 73.01 H new ATOM 0 HB ILE A 16 -6.006 -17.651 4.275 1.00 62.34 H new ATOM 0 HG12 ILE A 16 -8.137 -17.930 2.869 1.00 11.23 H new ATOM 0 HG13 ILE A 16 -6.669 -18.686 2.282 1.00 11.23 H new ATOM 0 HG21 ILE A 16 -5.282 -20.004 4.166 1.00 4.14 H new ATOM 0 HG22 ILE A 16 -5.498 -19.459 5.847 1.00 4.14 H new ATOM 0 HG23 ILE A 16 -6.731 -20.488 5.079 1.00 4.14 H new ATOM 0 HD11 ILE A 16 -8.587 -20.187 2.039 1.00 2.41 H new ATOM 0 HD12 ILE A 16 -7.410 -20.859 3.192 1.00 2.41 H new ATOM 0 HD13 ILE A 16 -8.900 -20.091 3.788 1.00 2.41 H new ATOM 228 N PRO A 17 -6.209 -17.930 7.319 1.00 30.54 N ATOM 229 CA PRO A 17 -5.665 -18.288 8.633 1.00 40.01 C ATOM 230 C PRO A 17 -6.518 -17.753 9.779 1.00 65.25 C ATOM 231 O PRO A 17 -6.554 -18.337 10.863 1.00 42.34 O ATOM 232 CB PRO A 17 -4.286 -17.625 8.638 1.00 45.40 C ATOM 233 CG PRO A 17 -4.408 -16.488 7.683 1.00 73.03 C ATOM 234 CD PRO A 17 -5.371 -16.942 6.620 1.00 23.13 C ATOM 0 HA PRO A 17 -5.635 -19.367 8.782 1.00 40.01 H new ATOM 0 HB2 PRO A 17 -4.018 -17.277 9.636 1.00 45.40 H new ATOM 0 HB3 PRO A 17 -3.510 -18.323 8.325 1.00 45.40 H new ATOM 0 HG2 PRO A 17 -4.775 -15.593 8.186 1.00 73.03 H new ATOM 0 HG3 PRO A 17 -3.440 -16.236 7.251 1.00 73.03 H new ATOM 0 HD2 PRO A 17 -5.964 -16.113 6.234 1.00 23.13 H new ATOM 0 HD3 PRO A 17 -4.852 -17.385 5.770 1.00 23.13 H new ATOM 242 N CYS A 18 -7.202 -16.642 9.532 1.00 42.24 N ATOM 243 CA CYS A 18 -8.054 -16.028 10.544 1.00 75.24 C ATOM 244 C CYS A 18 -9.075 -17.030 11.074 1.00 11.54 C ATOM 245 O CYS A 18 -9.449 -16.989 12.248 1.00 64.15 O ATOM 246 CB CYS A 18 -8.772 -14.808 9.964 1.00 33.50 C ATOM 247 SG CYS A 18 -8.502 -13.282 10.895 1.00 54.15 S ATOM 0 H CYS A 18 -7.183 -16.148 8.640 1.00 42.24 H new ATOM 0 HA CYS A 18 -7.421 -15.708 11.372 1.00 75.24 H new ATOM 0 HB2 CYS A 18 -8.439 -14.658 8.937 1.00 33.50 H new ATOM 0 HB3 CYS A 18 -9.842 -15.013 9.926 1.00 33.50 H new ATOM 0 HG CYS A 18 -9.147 -12.307 10.327 1.00 54.15 H new ATOM 253 N LEU A 19 -9.524 -17.926 10.203 1.00 32.45 N ATOM 254 CA LEU A 19 -10.504 -18.938 10.584 1.00 61.33 C ATOM 255 C LEU A 19 -9.822 -20.141 11.227 1.00 32.53 C ATOM 256 O LEU A 19 -10.244 -20.616 12.283 1.00 64.31 O ATOM 257 CB LEU A 19 -11.305 -19.386 9.360 1.00 51.00 C ATOM 258 CG LEU A 19 -11.788 -18.272 8.430 1.00 72.50 C ATOM 259 CD1 LEU A 19 -12.894 -18.781 7.519 1.00 55.35 C ATOM 260 CD2 LEU A 19 -12.268 -17.074 9.237 1.00 65.44 C ATOM 0 H LEU A 19 -9.226 -17.973 9.229 1.00 32.45 H new ATOM 0 HA LEU A 19 -11.183 -18.495 11.313 1.00 61.33 H new ATOM 0 HB2 LEU A 19 -10.690 -20.075 8.781 1.00 51.00 H new ATOM 0 HB3 LEU A 19 -12.174 -19.947 9.704 1.00 51.00 H new ATOM 0 HG LEU A 19 -10.951 -17.954 7.809 1.00 72.50 H new ATOM 0 HD11 LEU A 19 -13.226 -17.975 6.864 1.00 55.35 H new ATOM 0 HD12 LEU A 19 -12.517 -19.607 6.916 1.00 55.35 H new ATOM 0 HD13 LEU A 19 -13.733 -19.126 8.123 1.00 55.35 H new ATOM 0 HD21 LEU A 19 -12.608 -16.291 8.559 1.00 65.44 H new ATOM 0 HD22 LEU A 19 -13.092 -17.377 9.883 1.00 65.44 H new ATOM 0 HD23 LEU A 19 -11.449 -16.695 9.847 1.00 65.44 H new ATOM 272 N LEU A 20 -8.766 -20.629 10.586 1.00 23.14 N ATOM 273 CA LEU A 20 -8.023 -21.776 11.097 1.00 31.14 C ATOM 274 C LEU A 20 -7.623 -21.561 12.553 1.00 0.05 C ATOM 275 O LEU A 20 -7.720 -22.473 13.375 1.00 25.11 O ATOM 276 CB LEU A 20 -6.777 -22.022 10.245 1.00 21.52 C ATOM 277 CG LEU A 20 -6.566 -23.459 9.764 1.00 2.53 C ATOM 278 CD1 LEU A 20 -7.405 -23.736 8.527 1.00 40.12 C ATOM 279 CD2 LEU A 20 -5.093 -23.715 9.481 1.00 42.24 C ATOM 0 H LEU A 20 -8.405 -20.248 9.711 1.00 23.14 H new ATOM 0 HA LEU A 20 -8.671 -22.651 11.043 1.00 31.14 H new ATOM 0 HB2 LEU A 20 -6.824 -21.371 9.372 1.00 21.52 H new ATOM 0 HB3 LEU A 20 -5.902 -21.721 10.821 1.00 21.52 H new ATOM 0 HG LEU A 20 -6.887 -24.138 10.554 1.00 2.53 H new ATOM 0 HD11 LEU A 20 -7.242 -24.763 8.199 1.00 40.12 H new ATOM 0 HD12 LEU A 20 -8.460 -23.594 8.763 1.00 40.12 H new ATOM 0 HD13 LEU A 20 -7.116 -23.051 7.730 1.00 40.12 H new ATOM 0 HD21 LEU A 20 -4.961 -24.742 9.140 1.00 42.24 H new ATOM 0 HD22 LEU A 20 -4.746 -23.029 8.708 1.00 42.24 H new ATOM 0 HD23 LEU A 20 -4.515 -23.558 10.392 1.00 42.24 H new ATOM 291 N ILE A 21 -7.176 -20.349 12.866 1.00 62.41 N ATOM 292 CA ILE A 21 -6.765 -20.014 14.224 1.00 64.15 C ATOM 293 C ILE A 21 -7.974 -19.781 15.122 1.00 11.34 C ATOM 294 O ILE A 21 -7.934 -20.062 16.320 1.00 21.40 O ATOM 295 CB ILE A 21 -5.872 -18.760 14.248 1.00 44.54 C ATOM 296 CG1 ILE A 21 -6.658 -17.538 13.767 1.00 64.15 C ATOM 297 CG2 ILE A 21 -4.635 -18.973 13.387 1.00 11.03 C ATOM 298 CD1 ILE A 21 -5.780 -16.422 13.245 1.00 60.15 C ATOM 0 H ILE A 21 -7.089 -19.583 12.198 1.00 62.41 H new ATOM 0 HA ILE A 21 -6.195 -20.863 14.600 1.00 64.15 H new ATOM 0 HB ILE A 21 -5.550 -18.581 15.274 1.00 44.54 H new ATOM 0 HG12 ILE A 21 -7.347 -17.846 12.980 1.00 64.15 H new ATOM 0 HG13 ILE A 21 -7.263 -17.158 14.590 1.00 64.15 H new ATOM 0 HG21 ILE A 21 -4.014 -18.078 13.414 1.00 11.03 H new ATOM 0 HG22 ILE A 21 -4.067 -19.821 13.770 1.00 11.03 H new ATOM 0 HG23 ILE A 21 -4.937 -19.174 12.359 1.00 11.03 H new ATOM 0 HD11 ILE A 21 -6.404 -15.589 12.922 1.00 60.15 H new ATOM 0 HD12 ILE A 21 -5.109 -16.087 14.036 1.00 60.15 H new ATOM 0 HD13 ILE A 21 -5.194 -16.785 12.401 1.00 60.15 H new ATOM 310 N SER A 22 -9.050 -19.266 14.536 1.00 40.31 N ATOM 311 CA SER A 22 -10.271 -18.993 15.284 1.00 55.50 C ATOM 312 C SER A 22 -10.928 -20.290 15.744 1.00 34.31 C ATOM 313 O SER A 22 -11.131 -20.507 16.940 1.00 43.34 O ATOM 314 CB SER A 22 -11.251 -18.188 14.427 1.00 65.02 C ATOM 315 OG SER A 22 -11.047 -16.795 14.591 1.00 32.34 O ATOM 0 H SER A 22 -9.101 -19.029 13.545 1.00 40.31 H new ATOM 0 HA SER A 22 -10.004 -18.409 16.165 1.00 55.50 H new ATOM 0 HB2 SER A 22 -11.126 -18.456 13.378 1.00 65.02 H new ATOM 0 HB3 SER A 22 -12.274 -18.444 14.702 1.00 65.02 H new ATOM 0 HG SER A 22 -10.467 -16.463 13.875 1.00 32.34 H new ATOM 321 N CYS A 23 -11.259 -21.150 14.787 1.00 31.01 N ATOM 322 CA CYS A 23 -11.894 -22.427 15.093 1.00 73.15 C ATOM 323 C CYS A 23 -10.987 -23.292 15.961 1.00 4.22 C ATOM 324 O CYS A 23 -11.457 -24.027 16.830 1.00 33.11 O ATOM 325 CB CYS A 23 -12.242 -23.169 13.801 1.00 14.02 C ATOM 326 SG CYS A 23 -13.757 -22.589 13.002 1.00 42.32 S ATOM 0 H CYS A 23 -11.098 -20.986 13.793 1.00 31.01 H new ATOM 0 HA CYS A 23 -12.811 -22.225 15.647 1.00 73.15 H new ATOM 0 HB2 CYS A 23 -11.413 -23.067 13.101 1.00 14.02 H new ATOM 0 HB3 CYS A 23 -12.344 -24.232 14.021 1.00 14.02 H new ATOM 0 HG CYS A 23 -13.966 -23.275 11.918 1.00 42.32 H new ATOM 332 N LEU A 24 -9.683 -23.200 15.720 1.00 35.12 N ATOM 333 CA LEU A 24 -8.709 -23.975 16.480 1.00 65.34 C ATOM 334 C LEU A 24 -8.915 -23.791 17.979 1.00 11.55 C ATOM 335 O LEU A 24 -9.071 -24.762 18.721 1.00 42.34 O ATOM 336 CB LEU A 24 -7.287 -23.562 16.094 1.00 11.22 C ATOM 337 CG LEU A 24 -6.165 -24.115 16.974 1.00 54.20 C ATOM 338 CD1 LEU A 24 -6.366 -25.602 17.223 1.00 11.51 C ATOM 339 CD2 LEU A 24 -4.809 -23.858 16.333 1.00 12.13 C ATOM 0 H LEU A 24 -9.277 -22.597 15.005 1.00 35.12 H new ATOM 0 HA LEU A 24 -8.853 -25.028 16.240 1.00 65.34 H new ATOM 0 HB2 LEU A 24 -7.105 -23.877 15.067 1.00 11.22 H new ATOM 0 HB3 LEU A 24 -7.230 -22.474 16.108 1.00 11.22 H new ATOM 0 HG LEU A 24 -6.194 -23.600 17.934 1.00 54.20 H new ATOM 0 HD11 LEU A 24 -5.558 -25.978 17.851 1.00 11.51 H new ATOM 0 HD12 LEU A 24 -7.320 -25.761 17.725 1.00 11.51 H new ATOM 0 HD13 LEU A 24 -6.364 -26.134 16.272 1.00 11.51 H new ATOM 0 HD21 LEU A 24 -4.022 -24.258 16.973 1.00 12.13 H new ATOM 0 HD22 LEU A 24 -4.768 -24.346 15.359 1.00 12.13 H new ATOM 0 HD23 LEU A 24 -4.664 -22.785 16.207 1.00 12.13 H new ATOM 351 N THR A 25 -8.917 -22.537 18.421 1.00 14.44 N ATOM 352 CA THR A 25 -9.106 -22.224 19.832 1.00 1.13 C ATOM 353 C THR A 25 -10.421 -22.794 20.351 1.00 51.11 C ATOM 354 O THR A 25 -10.497 -23.279 21.480 1.00 51.30 O ATOM 355 CB THR A 25 -9.086 -20.703 20.078 1.00 30.43 C ATOM 356 OG1 THR A 25 -7.922 -20.125 19.477 1.00 74.03 O ATOM 357 CG2 THR A 25 -9.099 -20.396 21.568 1.00 1.01 C ATOM 0 H THR A 25 -8.790 -21.722 17.822 1.00 14.44 H new ATOM 0 HA THR A 25 -8.277 -22.683 20.371 1.00 1.13 H new ATOM 0 HB THR A 25 -9.980 -20.272 19.626 1.00 30.43 H new ATOM 0 HG1 THR A 25 -8.070 -20.017 18.514 1.00 74.03 H new ATOM 0 HG21 THR A 25 -9.084 -19.316 21.717 1.00 1.01 H new ATOM 0 HG22 THR A 25 -10.001 -20.812 22.017 1.00 1.01 H new ATOM 0 HG23 THR A 25 -8.221 -20.839 22.038 1.00 1.01 H new ATOM 365 N VAL A 26 -11.456 -22.733 19.519 1.00 71.31 N ATOM 366 CA VAL A 26 -12.769 -23.246 19.893 1.00 1.41 C ATOM 367 C VAL A 26 -12.762 -24.768 19.973 1.00 55.04 C ATOM 368 O VAL A 26 -13.571 -25.367 20.683 1.00 24.05 O ATOM 369 CB VAL A 26 -13.852 -22.799 18.893 1.00 65.24 C ATOM 370 CG1 VAL A 26 -15.217 -23.316 19.318 1.00 75.01 C ATOM 371 CG2 VAL A 26 -13.863 -21.284 18.761 1.00 1.35 C ATOM 0 H VAL A 26 -11.411 -22.333 18.582 1.00 71.31 H new ATOM 0 HA VAL A 26 -13.001 -22.835 20.876 1.00 1.41 H new ATOM 0 HB VAL A 26 -13.618 -23.223 17.917 1.00 65.24 H new ATOM 0 HG11 VAL A 26 -15.969 -22.990 18.600 1.00 75.01 H new ATOM 0 HG12 VAL A 26 -15.198 -24.405 19.355 1.00 75.01 H new ATOM 0 HG13 VAL A 26 -15.464 -22.924 20.305 1.00 75.01 H new ATOM 0 HG21 VAL A 26 -14.634 -20.986 18.051 1.00 1.35 H new ATOM 0 HG22 VAL A 26 -14.072 -20.836 19.732 1.00 1.35 H new ATOM 0 HG23 VAL A 26 -12.891 -20.943 18.405 1.00 1.35 H new ATOM 381 N LEU A 27 -11.846 -25.389 19.239 1.00 25.21 N ATOM 382 CA LEU A 27 -11.733 -26.844 19.226 1.00 4.44 C ATOM 383 C LEU A 27 -11.285 -27.367 20.587 1.00 1.03 C ATOM 384 O LEU A 27 -11.887 -28.288 21.139 1.00 72.22 O ATOM 385 CB LEU A 27 -10.745 -27.289 18.146 1.00 13.31 C ATOM 386 CG LEU A 27 -11.222 -28.410 17.222 1.00 40.10 C ATOM 387 CD1 LEU A 27 -11.667 -29.617 18.033 1.00 64.21 C ATOM 388 CD2 LEU A 27 -12.352 -27.920 16.328 1.00 22.10 C ATOM 0 H LEU A 27 -11.170 -24.908 18.645 1.00 25.21 H new ATOM 0 HA LEU A 27 -12.716 -27.258 19.003 1.00 4.44 H new ATOM 0 HB2 LEU A 27 -10.492 -26.423 17.534 1.00 13.31 H new ATOM 0 HB3 LEU A 27 -9.826 -27.614 18.634 1.00 13.31 H new ATOM 0 HG LEU A 27 -10.388 -28.711 16.588 1.00 40.10 H new ATOM 0 HD11 LEU A 27 -12.003 -30.405 17.359 1.00 64.21 H new ATOM 0 HD12 LEU A 27 -10.831 -29.982 18.630 1.00 64.21 H new ATOM 0 HD13 LEU A 27 -12.486 -29.330 18.693 1.00 64.21 H new ATOM 0 HD21 LEU A 27 -12.679 -28.731 15.677 1.00 22.10 H new ATOM 0 HD22 LEU A 27 -13.188 -27.591 16.945 1.00 22.10 H new ATOM 0 HD23 LEU A 27 -12.000 -27.087 15.720 1.00 22.10 H new ATOM 400 N VAL A 28 -10.225 -26.772 21.125 1.00 10.32 N ATOM 401 CA VAL A 28 -9.698 -27.175 22.423 1.00 32.34 C ATOM 402 C VAL A 28 -10.619 -26.729 23.553 1.00 12.42 C ATOM 403 O VAL A 28 -10.591 -27.288 24.650 1.00 44.42 O ATOM 404 CB VAL A 28 -8.291 -26.596 22.663 1.00 14.20 C ATOM 405 CG1 VAL A 28 -8.383 -25.208 23.279 1.00 32.24 C ATOM 406 CG2 VAL A 28 -7.475 -27.528 23.546 1.00 12.51 C ATOM 0 H VAL A 28 -9.714 -26.009 20.681 1.00 10.32 H new ATOM 0 HA VAL A 28 -9.638 -28.263 22.415 1.00 32.34 H new ATOM 0 HB VAL A 28 -7.784 -26.508 21.702 1.00 14.20 H new ATOM 0 HG11 VAL A 28 -7.379 -24.815 23.441 1.00 32.24 H new ATOM 0 HG12 VAL A 28 -8.927 -24.546 22.605 1.00 32.24 H new ATOM 0 HG13 VAL A 28 -8.908 -25.267 24.232 1.00 32.24 H new ATOM 0 HG21 VAL A 28 -6.484 -27.103 23.705 1.00 12.51 H new ATOM 0 HG22 VAL A 28 -7.976 -27.650 24.506 1.00 12.51 H new ATOM 0 HG23 VAL A 28 -7.380 -28.499 23.060 1.00 12.51 H new ATOM 416 N PHE A 29 -11.436 -25.717 23.278 1.00 35.41 N ATOM 417 CA PHE A 29 -12.367 -25.194 24.272 1.00 62.42 C ATOM 418 C PHE A 29 -13.631 -26.047 24.335 1.00 1.30 C ATOM 419 O PHE A 29 -14.336 -26.056 25.344 1.00 33.51 O ATOM 420 CB PHE A 29 -12.732 -23.744 23.947 1.00 65.45 C ATOM 421 CG PHE A 29 -11.981 -22.738 24.771 1.00 33.14 C ATOM 422 CD1 PHE A 29 -10.596 -22.702 24.753 1.00 14.11 C ATOM 423 CD2 PHE A 29 -12.661 -21.829 25.566 1.00 51.45 C ATOM 424 CE1 PHE A 29 -9.903 -21.777 25.511 1.00 41.23 C ATOM 425 CE2 PHE A 29 -11.973 -20.901 26.325 1.00 71.22 C ATOM 426 CZ PHE A 29 -10.592 -20.876 26.298 1.00 13.04 C ATOM 0 H PHE A 29 -11.472 -25.243 22.376 1.00 35.41 H new ATOM 0 HA PHE A 29 -11.878 -25.229 25.245 1.00 62.42 H new ATOM 0 HB2 PHE A 29 -12.536 -23.556 22.891 1.00 65.45 H new ATOM 0 HB3 PHE A 29 -13.802 -23.603 24.102 1.00 65.45 H new ATOM 0 HD1 PHE A 29 -10.052 -23.405 24.140 1.00 14.11 H new ATOM 0 HD2 PHE A 29 -13.741 -21.846 25.593 1.00 51.45 H new ATOM 0 HE1 PHE A 29 -8.823 -21.759 25.488 1.00 41.23 H new ATOM 0 HE2 PHE A 29 -12.515 -20.196 26.939 1.00 71.22 H new ATOM 0 HZ PHE A 29 -10.052 -20.153 26.892 1.00 13.04 H new ATOM 436 N TYR A 30 -13.911 -26.760 23.250 1.00 23.22 N ATOM 437 CA TYR A 30 -15.091 -27.614 23.180 1.00 40.50 C ATOM 438 C TYR A 30 -14.781 -29.016 23.695 1.00 42.30 C ATOM 439 O TYR A 30 -15.544 -29.586 24.475 1.00 21.55 O ATOM 440 CB TYR A 30 -15.607 -27.689 21.742 1.00 1.20 C ATOM 441 CG TYR A 30 -16.662 -28.751 21.532 1.00 22.50 C ATOM 442 CD1 TYR A 30 -17.886 -28.681 22.185 1.00 55.22 C ATOM 443 CD2 TYR A 30 -16.434 -29.827 20.682 1.00 2.51 C ATOM 444 CE1 TYR A 30 -18.853 -29.650 21.997 1.00 51.33 C ATOM 445 CE2 TYR A 30 -17.395 -30.799 20.487 1.00 71.12 C ATOM 446 CZ TYR A 30 -18.603 -30.706 21.146 1.00 21.54 C ATOM 447 OH TYR A 30 -19.563 -31.674 20.956 1.00 64.13 O ATOM 0 H TYR A 30 -13.337 -26.764 22.407 1.00 23.22 H new ATOM 0 HA TYR A 30 -15.863 -27.177 23.814 1.00 40.50 H new ATOM 0 HB2 TYR A 30 -16.019 -26.719 21.462 1.00 1.20 H new ATOM 0 HB3 TYR A 30 -14.768 -27.885 21.074 1.00 1.20 H new ATOM 0 HD1 TYR A 30 -18.085 -27.855 22.851 1.00 55.22 H new ATOM 0 HD2 TYR A 30 -15.489 -29.904 20.165 1.00 2.51 H new ATOM 0 HE1 TYR A 30 -19.799 -29.581 22.513 1.00 51.33 H new ATOM 0 HE2 TYR A 30 -17.202 -31.628 19.822 1.00 71.12 H new ATOM 0 HH TYR A 30 -19.229 -32.346 20.326 1.00 64.13 H new ATOM 457 N LEU A 31 -13.655 -29.565 23.253 1.00 31.40 N ATOM 458 CA LEU A 31 -13.241 -30.901 23.669 1.00 73.14 C ATOM 459 C LEU A 31 -11.797 -30.896 24.158 1.00 65.13 C ATOM 460 O LEU A 31 -10.894 -31.427 23.510 1.00 51.23 O ATOM 461 CB LEU A 31 -13.396 -31.888 22.510 1.00 12.01 C ATOM 462 CG LEU A 31 -13.121 -33.356 22.838 1.00 74.13 C ATOM 463 CD1 LEU A 31 -14.310 -33.974 23.558 1.00 51.15 C ATOM 464 CD2 LEU A 31 -12.800 -34.134 21.570 1.00 21.21 C ATOM 0 H LEU A 31 -13.013 -29.106 22.607 1.00 31.40 H new ATOM 0 HA LEU A 31 -13.883 -31.214 24.493 1.00 73.14 H new ATOM 0 HB2 LEU A 31 -14.412 -31.807 22.123 1.00 12.01 H new ATOM 0 HB3 LEU A 31 -12.724 -31.584 21.707 1.00 12.01 H new ATOM 0 HG LEU A 31 -12.256 -33.405 23.500 1.00 74.13 H new ATOM 0 HD11 LEU A 31 -14.096 -35.019 23.783 1.00 51.15 H new ATOM 0 HD12 LEU A 31 -14.495 -33.433 24.486 1.00 51.15 H new ATOM 0 HD13 LEU A 31 -15.193 -33.914 22.921 1.00 51.15 H new ATOM 0 HD21 LEU A 31 -12.607 -35.177 21.822 1.00 21.21 H new ATOM 0 HD22 LEU A 31 -13.645 -34.077 20.884 1.00 21.21 H new ATOM 0 HD23 LEU A 31 -11.917 -33.706 21.094 1.00 21.21 H new ATOM 476 N PRO A 32 -11.570 -30.284 25.330 1.00 74.52 N ATOM 477 CA PRO A 32 -10.237 -30.198 25.933 1.00 33.14 C ATOM 478 C PRO A 32 -9.737 -31.550 26.431 1.00 74.13 C ATOM 479 O PRO A 32 -10.473 -32.294 27.080 1.00 4.20 O ATOM 480 CB PRO A 32 -10.441 -29.238 27.108 1.00 34.22 C ATOM 481 CG PRO A 32 -11.885 -29.363 27.453 1.00 54.13 C ATOM 482 CD PRO A 32 -12.599 -29.631 26.156 1.00 2.44 C ATOM 0 HA PRO A 32 -9.487 -29.864 25.216 1.00 33.14 H new ATOM 0 HB2 PRO A 32 -9.807 -29.507 27.953 1.00 34.22 H new ATOM 0 HB3 PRO A 32 -10.187 -28.215 26.832 1.00 34.22 H new ATOM 0 HG2 PRO A 32 -12.048 -30.174 28.163 1.00 54.13 H new ATOM 0 HG3 PRO A 32 -12.255 -28.451 27.921 1.00 54.13 H new ATOM 0 HD2 PRO A 32 -13.467 -30.275 26.300 1.00 2.44 H new ATOM 0 HD3 PRO A 32 -12.958 -28.710 25.697 1.00 2.44 H new ATOM 490 N SER A 33 -8.483 -31.862 26.122 1.00 3.12 N ATOM 491 CA SER A 33 -7.886 -33.126 26.536 1.00 64.55 C ATOM 492 C SER A 33 -7.344 -33.032 27.959 1.00 43.04 C ATOM 493 O SER A 33 -7.598 -33.904 28.789 1.00 5.53 O ATOM 494 CB SER A 33 -6.762 -33.522 25.575 1.00 34.42 C ATOM 495 OG SER A 33 -6.399 -34.881 25.748 1.00 24.03 O ATOM 0 H SER A 33 -7.861 -31.257 25.586 1.00 3.12 H new ATOM 0 HA SER A 33 -8.662 -33.891 26.512 1.00 64.55 H new ATOM 0 HB2 SER A 33 -7.083 -33.356 24.547 1.00 34.42 H new ATOM 0 HB3 SER A 33 -5.893 -32.886 25.744 1.00 34.42 H new ATOM 0 HG SER A 33 -5.681 -35.110 25.122 1.00 24.03 H new ATOM 501 N GLU A 34 -6.596 -31.967 28.231 1.00 60.11 N ATOM 502 CA GLU A 34 -6.017 -31.759 29.553 1.00 14.31 C ATOM 503 C GLU A 34 -6.241 -30.325 30.025 1.00 14.01 C ATOM 504 O GLU A 34 -6.426 -29.415 29.216 1.00 60.45 O ATOM 505 CB GLU A 34 -4.520 -32.073 29.534 1.00 31.13 C ATOM 506 CG GLU A 34 -4.056 -32.898 30.723 1.00 74.41 C ATOM 507 CD GLU A 34 -2.556 -32.832 30.929 1.00 24.31 C ATOM 508 OE1 GLU A 34 -2.029 -31.712 31.098 1.00 73.34 O ATOM 509 OE2 GLU A 34 -1.908 -33.900 30.922 1.00 44.42 O ATOM 0 H GLU A 34 -6.377 -31.236 27.554 1.00 60.11 H new ATOM 0 HA GLU A 34 -6.514 -32.435 30.249 1.00 14.31 H new ATOM 0 HB2 GLU A 34 -4.281 -32.609 28.615 1.00 31.13 H new ATOM 0 HB3 GLU A 34 -3.961 -31.137 29.511 1.00 31.13 H new ATOM 0 HG2 GLU A 34 -4.558 -32.545 31.624 1.00 74.41 H new ATOM 0 HG3 GLU A 34 -4.354 -33.937 30.578 1.00 74.41 H new ATOM 516 N CYS A 35 -6.224 -30.132 31.339 1.00 13.22 N ATOM 517 CA CYS A 35 -6.427 -28.809 31.920 1.00 22.33 C ATOM 518 C CYS A 35 -5.177 -27.949 31.763 1.00 72.11 C ATOM 519 O CYS A 35 -5.263 -26.728 31.639 1.00 31.11 O ATOM 520 CB CYS A 35 -6.794 -28.930 33.400 1.00 73.41 C ATOM 521 SG CYS A 35 -6.838 -27.352 34.281 1.00 34.11 S ATOM 0 H CYS A 35 -6.072 -30.874 32.022 1.00 13.22 H new ATOM 0 HA CYS A 35 -7.247 -28.327 31.388 1.00 22.33 H new ATOM 0 HB2 CYS A 35 -7.770 -29.408 33.483 1.00 73.41 H new ATOM 0 HB3 CYS A 35 -6.075 -29.587 33.889 1.00 73.41 H new ATOM 0 HG CYS A 35 -6.220 -26.447 33.582 1.00 34.11 H new ATOM 527 N GLY A 36 -4.015 -28.595 31.770 1.00 31.43 N ATOM 528 CA GLY A 36 -2.764 -27.874 31.630 1.00 50.45 C ATOM 529 C GLY A 36 -2.428 -27.572 30.182 1.00 33.14 C ATOM 530 O GLY A 36 -1.962 -26.479 29.862 1.00 22.51 O ATOM 0 H GLY A 36 -3.918 -29.605 31.870 1.00 31.43 H new ATOM 0 HA2 GLY A 36 -2.822 -26.940 32.189 1.00 50.45 H new ATOM 0 HA3 GLY A 36 -1.959 -28.461 32.072 1.00 50.45 H new ATOM 534 N GLU A 37 -2.665 -28.544 29.307 1.00 43.03 N ATOM 535 CA GLU A 37 -2.381 -28.377 27.886 1.00 13.21 C ATOM 536 C GLU A 37 -3.158 -27.195 27.312 1.00 65.11 C ATOM 537 O GLU A 37 -2.738 -26.579 26.332 1.00 1.32 O ATOM 538 CB GLU A 37 -2.733 -29.653 27.119 1.00 34.35 C ATOM 539 CG GLU A 37 -1.809 -30.820 27.423 1.00 63.21 C ATOM 540 CD GLU A 37 -0.578 -30.835 26.537 1.00 1.33 C ATOM 541 OE1 GLU A 37 -0.247 -29.775 25.965 1.00 74.14 O ATOM 542 OE2 GLU A 37 0.054 -31.905 26.417 1.00 44.43 O ATOM 0 H GLU A 37 -3.052 -29.454 29.556 1.00 43.03 H new ATOM 0 HA GLU A 37 -1.315 -28.178 27.776 1.00 13.21 H new ATOM 0 HB2 GLU A 37 -3.757 -29.940 27.358 1.00 34.35 H new ATOM 0 HB3 GLU A 37 -2.701 -29.444 26.050 1.00 34.35 H new ATOM 0 HG2 GLU A 37 -1.500 -30.772 28.467 1.00 63.21 H new ATOM 0 HG3 GLU A 37 -2.356 -31.754 27.295 1.00 63.21 H new ATOM 549 N LYS A 38 -4.293 -26.885 27.929 1.00 42.14 N ATOM 550 CA LYS A 38 -5.129 -25.777 27.481 1.00 32.43 C ATOM 551 C LYS A 38 -4.381 -24.452 27.590 1.00 74.40 C ATOM 552 O LYS A 38 -4.251 -23.721 26.608 1.00 4.32 O ATOM 553 CB LYS A 38 -6.417 -25.718 28.307 1.00 44.14 C ATOM 554 CG LYS A 38 -7.678 -25.888 27.478 1.00 14.43 C ATOM 555 CD LYS A 38 -8.843 -26.367 28.328 1.00 30.43 C ATOM 556 CE LYS A 38 -9.178 -25.372 29.428 1.00 3.52 C ATOM 557 NZ LYS A 38 -10.393 -25.774 30.189 1.00 2.54 N ATOM 0 H LYS A 38 -4.655 -27.385 28.741 1.00 42.14 H new ATOM 0 HA LYS A 38 -5.383 -25.945 26.434 1.00 32.43 H new ATOM 0 HB2 LYS A 38 -6.386 -26.496 29.070 1.00 44.14 H new ATOM 0 HB3 LYS A 38 -6.461 -24.762 28.829 1.00 44.14 H new ATOM 0 HG2 LYS A 38 -7.936 -24.939 27.007 1.00 14.43 H new ATOM 0 HG3 LYS A 38 -7.494 -26.602 26.676 1.00 14.43 H new ATOM 0 HD2 LYS A 38 -9.717 -26.519 27.695 1.00 30.43 H new ATOM 0 HD3 LYS A 38 -8.598 -27.332 28.771 1.00 30.43 H new ATOM 0 HE2 LYS A 38 -8.333 -25.288 30.111 1.00 3.52 H new ATOM 0 HE3 LYS A 38 -9.333 -24.386 28.991 1.00 3.52 H new ATOM 0 HZ1 LYS A 38 -10.588 -25.070 30.929 1.00 2.54 H new ATOM 0 HZ2 LYS A 38 -11.205 -25.830 29.542 1.00 2.54 H new ATOM 0 HZ3 LYS A 38 -10.236 -26.704 30.628 1.00 2.54 H new ATOM 571 N ILE A 39 -3.892 -24.151 28.788 1.00 61.11 N ATOM 572 CA ILE A 39 -3.155 -22.916 29.023 1.00 52.52 C ATOM 573 C ILE A 39 -2.014 -22.758 28.024 1.00 2.31 C ATOM 574 O ILE A 39 -1.842 -21.697 27.423 1.00 44.13 O ATOM 575 CB ILE A 39 -2.583 -22.864 30.452 1.00 61.33 C ATOM 576 CG1 ILE A 39 -3.717 -22.838 31.478 1.00 32.42 C ATOM 577 CG2 ILE A 39 -1.682 -21.649 30.618 1.00 35.44 C ATOM 578 CD1 ILE A 39 -3.411 -23.619 32.737 1.00 22.02 C ATOM 0 H ILE A 39 -3.993 -24.745 29.611 1.00 61.11 H new ATOM 0 HA ILE A 39 -3.863 -22.097 28.895 1.00 52.52 H new ATOM 0 HB ILE A 39 -1.986 -23.760 30.622 1.00 61.33 H new ATOM 0 HG12 ILE A 39 -3.931 -21.803 31.745 1.00 32.42 H new ATOM 0 HG13 ILE A 39 -4.620 -23.242 31.020 1.00 32.42 H new ATOM 0 HG21 ILE A 39 -1.285 -21.626 31.633 1.00 35.44 H new ATOM 0 HG22 ILE A 39 -0.857 -21.708 29.907 1.00 35.44 H new ATOM 0 HG23 ILE A 39 -2.257 -20.742 30.433 1.00 35.44 H new ATOM 0 HD11 ILE A 39 -4.259 -23.557 33.419 1.00 22.02 H new ATOM 0 HD12 ILE A 39 -3.226 -24.663 32.482 1.00 22.02 H new ATOM 0 HD13 ILE A 39 -2.527 -23.201 33.218 1.00 22.02 H new ATOM 590 N THR A 40 -1.236 -23.822 27.850 1.00 44.41 N ATOM 591 CA THR A 40 -0.111 -23.802 26.924 1.00 63.24 C ATOM 592 C THR A 40 -0.576 -23.525 25.499 1.00 53.12 C ATOM 593 O THR A 40 0.153 -22.937 24.699 1.00 4.25 O ATOM 594 CB THR A 40 0.661 -25.135 26.949 1.00 21.10 C ATOM 595 OG1 THR A 40 0.879 -25.549 28.302 1.00 31.24 O ATOM 596 CG2 THR A 40 1.997 -25.001 26.233 1.00 14.12 C ATOM 0 H THR A 40 -1.365 -24.708 28.338 1.00 44.41 H new ATOM 0 HA THR A 40 0.551 -23.000 27.250 1.00 63.24 H new ATOM 0 HB THR A 40 0.063 -25.885 26.431 1.00 21.10 H new ATOM 0 HG1 THR A 40 1.369 -26.398 28.309 1.00 31.24 H new ATOM 0 HG21 THR A 40 2.524 -25.955 26.264 1.00 14.12 H new ATOM 0 HG22 THR A 40 1.827 -24.714 25.195 1.00 14.12 H new ATOM 0 HG23 THR A 40 2.599 -24.238 26.726 1.00 14.12 H new ATOM 604 N LEU A 41 -1.795 -23.951 25.186 1.00 13.24 N ATOM 605 CA LEU A 41 -2.359 -23.747 23.857 1.00 74.44 C ATOM 606 C LEU A 41 -2.781 -22.295 23.660 1.00 15.24 C ATOM 607 O LEU A 41 -2.551 -21.709 22.602 1.00 53.40 O ATOM 608 CB LEU A 41 -3.559 -24.672 23.643 1.00 61.21 C ATOM 609 CG LEU A 41 -3.738 -25.224 22.228 1.00 3.30 C ATOM 610 CD1 LEU A 41 -4.433 -26.576 22.266 1.00 53.51 C ATOM 611 CD2 LEU A 41 -4.521 -24.243 21.368 1.00 11.42 C ATOM 0 H LEU A 41 -2.412 -24.440 25.835 1.00 13.24 H new ATOM 0 HA LEU A 41 -1.589 -23.984 23.123 1.00 74.44 H new ATOM 0 HB2 LEU A 41 -3.471 -25.513 24.331 1.00 61.21 H new ATOM 0 HB3 LEU A 41 -4.464 -24.129 23.917 1.00 61.21 H new ATOM 0 HG LEU A 41 -2.752 -25.359 21.784 1.00 3.30 H new ATOM 0 HD11 LEU A 41 -4.552 -26.953 21.250 1.00 53.51 H new ATOM 0 HD12 LEU A 41 -3.833 -27.277 22.846 1.00 53.51 H new ATOM 0 HD13 LEU A 41 -5.414 -26.468 22.730 1.00 53.51 H new ATOM 0 HD21 LEU A 41 -4.639 -24.652 20.365 1.00 11.42 H new ATOM 0 HD22 LEU A 41 -5.504 -24.076 21.809 1.00 11.42 H new ATOM 0 HD23 LEU A 41 -3.982 -23.297 21.313 1.00 11.42 H new ATOM 623 N CYS A 42 -3.398 -21.720 24.687 1.00 43.40 N ATOM 624 CA CYS A 42 -3.851 -20.334 24.628 1.00 23.33 C ATOM 625 C CYS A 42 -2.699 -19.400 24.272 1.00 62.30 C ATOM 626 O CYS A 42 -2.862 -18.472 23.480 1.00 51.31 O ATOM 627 CB CYS A 42 -4.464 -19.920 25.966 1.00 14.52 C ATOM 628 SG CYS A 42 -4.342 -18.150 26.318 1.00 71.15 S ATOM 0 H CYS A 42 -3.596 -22.191 25.570 1.00 43.40 H new ATOM 0 HA CYS A 42 -4.610 -20.258 23.849 1.00 23.33 H new ATOM 0 HB2 CYS A 42 -5.515 -20.210 25.977 1.00 14.52 H new ATOM 0 HB3 CYS A 42 -3.972 -20.473 26.766 1.00 14.52 H new ATOM 0 HG CYS A 42 -4.890 -17.898 27.470 1.00 71.15 H new ATOM 634 N ILE A 43 -1.536 -19.652 24.863 1.00 44.20 N ATOM 635 CA ILE A 43 -0.357 -18.833 24.608 1.00 10.01 C ATOM 636 C ILE A 43 0.161 -19.042 23.189 1.00 23.13 C ATOM 637 O ILE A 43 0.569 -18.093 22.520 1.00 3.22 O ATOM 638 CB ILE A 43 0.773 -19.146 25.607 1.00 72.23 C ATOM 639 CG1 ILE A 43 0.440 -18.568 26.984 1.00 65.40 C ATOM 640 CG2 ILE A 43 2.096 -18.593 25.100 1.00 63.33 C ATOM 641 CD1 ILE A 43 1.288 -19.140 28.099 1.00 12.43 C ATOM 0 H ILE A 43 -1.385 -20.416 25.521 1.00 44.20 H new ATOM 0 HA ILE A 43 -0.662 -17.794 24.731 1.00 10.01 H new ATOM 0 HB ILE A 43 0.866 -20.228 25.701 1.00 72.23 H new ATOM 0 HG12 ILE A 43 0.571 -17.486 26.957 1.00 65.40 H new ATOM 0 HG13 ILE A 43 -0.611 -18.756 27.204 1.00 65.40 H new ATOM 0 HG21 ILE A 43 2.885 -18.822 25.817 1.00 63.33 H new ATOM 0 HG22 ILE A 43 2.336 -19.048 24.139 1.00 63.33 H new ATOM 0 HG23 ILE A 43 2.017 -17.512 24.981 1.00 63.33 H new ATOM 0 HD11 ILE A 43 0.998 -18.686 29.046 1.00 12.43 H new ATOM 0 HD12 ILE A 43 1.139 -20.218 28.153 1.00 12.43 H new ATOM 0 HD13 ILE A 43 2.339 -18.929 27.902 1.00 12.43 H new ATOM 653 N SER A 44 0.141 -20.291 22.736 1.00 74.43 N ATOM 654 CA SER A 44 0.610 -20.626 21.396 1.00 23.24 C ATOM 655 C SER A 44 -0.171 -19.853 20.338 1.00 64.41 C ATOM 656 O SER A 44 0.412 -19.182 19.487 1.00 44.24 O ATOM 657 CB SER A 44 0.478 -22.130 21.148 1.00 52.13 C ATOM 658 OG SER A 44 1.315 -22.546 20.083 1.00 24.42 O ATOM 0 H SER A 44 -0.195 -21.088 23.277 1.00 74.43 H new ATOM 0 HA SER A 44 1.661 -20.344 21.324 1.00 23.24 H new ATOM 0 HB2 SER A 44 0.739 -22.676 22.055 1.00 52.13 H new ATOM 0 HB3 SER A 44 -0.559 -22.374 20.917 1.00 52.13 H new ATOM 0 HG SER A 44 1.214 -23.511 19.945 1.00 24.42 H new ATOM 664 N VAL A 45 -1.495 -19.954 20.398 1.00 42.34 N ATOM 665 CA VAL A 45 -2.357 -19.264 19.446 1.00 75.13 C ATOM 666 C VAL A 45 -2.178 -17.753 19.536 1.00 10.11 C ATOM 667 O VAL A 45 -2.301 -17.041 18.538 1.00 24.22 O ATOM 668 CB VAL A 45 -3.840 -19.609 19.680 1.00 12.11 C ATOM 669 CG1 VAL A 45 -4.729 -18.816 18.734 1.00 0.21 C ATOM 670 CG2 VAL A 45 -4.072 -21.103 19.515 1.00 22.32 C ATOM 0 H VAL A 45 -1.994 -20.507 21.095 1.00 42.34 H new ATOM 0 HA VAL A 45 -2.065 -19.602 18.452 1.00 75.13 H new ATOM 0 HB VAL A 45 -4.101 -19.334 20.702 1.00 12.11 H new ATOM 0 HG11 VAL A 45 -5.773 -19.073 18.914 1.00 0.21 H new ATOM 0 HG12 VAL A 45 -4.583 -17.750 18.906 1.00 0.21 H new ATOM 0 HG13 VAL A 45 -4.469 -19.056 17.703 1.00 0.21 H new ATOM 0 HG21 VAL A 45 -5.125 -21.329 19.684 1.00 22.32 H new ATOM 0 HG22 VAL A 45 -3.794 -21.405 18.505 1.00 22.32 H new ATOM 0 HG23 VAL A 45 -3.464 -21.648 20.237 1.00 22.32 H new ATOM 680 N LEU A 46 -1.886 -17.268 20.738 1.00 35.31 N ATOM 681 CA LEU A 46 -1.689 -15.840 20.960 1.00 41.02 C ATOM 682 C LEU A 46 -0.366 -15.374 20.360 1.00 11.34 C ATOM 683 O LEU A 46 -0.270 -14.269 19.823 1.00 35.33 O ATOM 684 CB LEU A 46 -1.722 -15.527 22.457 1.00 52.13 C ATOM 685 CG LEU A 46 -2.927 -14.723 22.948 1.00 62.22 C ATOM 686 CD1 LEU A 46 -3.129 -14.923 24.442 1.00 45.22 C ATOM 687 CD2 LEU A 46 -2.751 -13.247 22.624 1.00 2.20 C ATOM 0 H LEU A 46 -1.780 -17.843 21.574 1.00 35.31 H new ATOM 0 HA LEU A 46 -2.500 -15.305 20.466 1.00 41.02 H new ATOM 0 HB2 LEU A 46 -1.691 -16.468 23.005 1.00 52.13 H new ATOM 0 HB3 LEU A 46 -0.816 -14.978 22.713 1.00 52.13 H new ATOM 0 HG LEU A 46 -3.816 -15.084 22.431 1.00 62.22 H new ATOM 0 HD11 LEU A 46 -3.991 -14.343 24.773 1.00 45.22 H new ATOM 0 HD12 LEU A 46 -3.301 -15.979 24.648 1.00 45.22 H new ATOM 0 HD13 LEU A 46 -2.240 -14.590 24.977 1.00 45.22 H new ATOM 0 HD21 LEU A 46 -3.618 -12.690 22.981 1.00 2.20 H new ATOM 0 HD22 LEU A 46 -1.852 -12.872 23.113 1.00 2.20 H new ATOM 0 HD23 LEU A 46 -2.657 -13.120 21.546 1.00 2.20 H new ATOM 699 N LEU A 47 0.652 -16.223 20.454 1.00 55.52 N ATOM 700 CA LEU A 47 1.969 -15.899 19.919 1.00 44.24 C ATOM 701 C LEU A 47 1.881 -15.527 18.442 1.00 62.01 C ATOM 702 O LEU A 47 2.345 -14.464 18.031 1.00 53.55 O ATOM 703 CB LEU A 47 2.921 -17.082 20.102 1.00 31.42 C ATOM 704 CG LEU A 47 4.002 -16.915 21.170 1.00 4.22 C ATOM 705 CD1 LEU A 47 4.855 -18.170 21.268 1.00 64.04 C ATOM 706 CD2 LEU A 47 4.869 -15.701 20.866 1.00 33.30 C ATOM 0 H LEU A 47 0.590 -17.140 20.896 1.00 55.52 H new ATOM 0 HA LEU A 47 2.355 -15.041 20.469 1.00 44.24 H new ATOM 0 HB2 LEU A 47 2.329 -17.964 20.347 1.00 31.42 H new ATOM 0 HB3 LEU A 47 3.409 -17.281 19.148 1.00 31.42 H new ATOM 0 HG LEU A 47 3.514 -16.757 22.132 1.00 4.22 H new ATOM 0 HD11 LEU A 47 5.619 -18.032 22.033 1.00 64.04 H new ATOM 0 HD12 LEU A 47 4.225 -19.019 21.533 1.00 64.04 H new ATOM 0 HD13 LEU A 47 5.334 -18.360 20.308 1.00 64.04 H new ATOM 0 HD21 LEU A 47 5.633 -15.597 21.636 1.00 33.30 H new ATOM 0 HD22 LEU A 47 5.348 -15.830 19.895 1.00 33.30 H new ATOM 0 HD23 LEU A 47 4.248 -14.805 20.848 1.00 33.30 H new ATOM 718 N SER A 48 1.281 -16.410 17.650 1.00 41.44 N ATOM 719 CA SER A 48 1.133 -16.175 16.218 1.00 1.00 C ATOM 720 C SER A 48 0.228 -14.975 15.955 1.00 62.11 C ATOM 721 O SER A 48 0.460 -14.199 15.027 1.00 62.22 O ATOM 722 CB SER A 48 0.563 -17.418 15.532 1.00 20.13 C ATOM 723 OG SER A 48 1.571 -18.391 15.320 1.00 44.13 O ATOM 0 H SER A 48 0.890 -17.294 17.975 1.00 41.44 H new ATOM 0 HA SER A 48 2.119 -15.961 15.806 1.00 1.00 H new ATOM 0 HB2 SER A 48 -0.233 -17.842 16.144 1.00 20.13 H new ATOM 0 HB3 SER A 48 0.117 -17.138 14.578 1.00 20.13 H new ATOM 0 HG SER A 48 1.181 -19.176 14.882 1.00 44.13 H new ATOM 729 N LEU A 49 -0.804 -14.829 16.778 1.00 31.11 N ATOM 730 CA LEU A 49 -1.746 -13.724 16.636 1.00 3.10 C ATOM 731 C LEU A 49 -1.042 -12.383 16.816 1.00 12.45 C ATOM 732 O LEU A 49 -1.078 -11.526 15.933 1.00 55.33 O ATOM 733 CB LEU A 49 -2.879 -13.859 17.654 1.00 20.44 C ATOM 734 CG LEU A 49 -4.296 -13.671 17.111 1.00 2.41 C ATOM 735 CD1 LEU A 49 -5.288 -13.510 18.252 1.00 32.43 C ATOM 736 CD2 LEU A 49 -4.354 -12.469 16.179 1.00 63.32 C ATOM 0 H LEU A 49 -1.010 -15.462 17.551 1.00 31.11 H new ATOM 0 HA LEU A 49 -2.164 -13.762 15.630 1.00 3.10 H new ATOM 0 HB2 LEU A 49 -2.815 -14.847 18.110 1.00 20.44 H new ATOM 0 HB3 LEU A 49 -2.716 -13.130 18.448 1.00 20.44 H new ATOM 0 HG LEU A 49 -4.568 -14.561 16.543 1.00 2.41 H new ATOM 0 HD11 LEU A 49 -6.291 -13.377 17.846 1.00 32.43 H new ATOM 0 HD12 LEU A 49 -5.266 -14.400 18.882 1.00 32.43 H new ATOM 0 HD13 LEU A 49 -5.019 -12.637 18.847 1.00 32.43 H new ATOM 0 HD21 LEU A 49 -5.370 -12.350 15.802 1.00 63.32 H new ATOM 0 HD22 LEU A 49 -4.062 -11.571 16.724 1.00 63.32 H new ATOM 0 HD23 LEU A 49 -3.672 -12.624 15.343 1.00 63.32 H new ATOM 748 N THR A 50 -0.400 -12.207 17.967 1.00 24.21 N ATOM 749 CA THR A 50 0.314 -10.971 18.263 1.00 34.24 C ATOM 750 C THR A 50 1.447 -10.739 17.271 1.00 41.10 C ATOM 751 O THR A 50 1.889 -9.607 17.071 1.00 33.32 O ATOM 752 CB THR A 50 0.891 -10.985 19.691 1.00 3.53 C ATOM 753 OG1 THR A 50 -0.057 -11.558 20.598 1.00 21.11 O ATOM 754 CG2 THR A 50 1.246 -9.576 20.145 1.00 63.45 C ATOM 0 H THR A 50 -0.360 -12.905 18.710 1.00 24.21 H new ATOM 0 HA THR A 50 -0.409 -10.160 18.179 1.00 34.24 H new ATOM 0 HB THR A 50 1.799 -11.589 19.686 1.00 3.53 H new ATOM 0 HG1 THR A 50 -0.065 -12.532 20.491 1.00 21.11 H new ATOM 0 HG21 THR A 50 1.652 -9.611 21.156 1.00 63.45 H new ATOM 0 HG22 THR A 50 1.990 -9.153 19.470 1.00 63.45 H new ATOM 0 HG23 THR A 50 0.351 -8.954 20.134 1.00 63.45 H new ATOM 762 N VAL A 51 1.914 -11.818 16.650 1.00 3.53 N ATOM 763 CA VAL A 51 2.996 -11.731 15.676 1.00 12.33 C ATOM 764 C VAL A 51 2.508 -11.122 14.366 1.00 2.35 C ATOM 765 O VAL A 51 3.047 -10.119 13.897 1.00 62.43 O ATOM 766 CB VAL A 51 3.606 -13.116 15.390 1.00 11.30 C ATOM 767 CG1 VAL A 51 4.191 -13.162 13.987 1.00 73.04 C ATOM 768 CG2 VAL A 51 4.664 -13.456 16.429 1.00 73.42 C ATOM 0 H VAL A 51 1.560 -12.762 16.804 1.00 3.53 H new ATOM 0 HA VAL A 51 3.762 -11.088 16.109 1.00 12.33 H new ATOM 0 HB VAL A 51 2.815 -13.863 15.452 1.00 11.30 H new ATOM 0 HG11 VAL A 51 4.617 -14.148 13.803 1.00 73.04 H new ATOM 0 HG12 VAL A 51 3.405 -12.965 13.258 1.00 73.04 H new ATOM 0 HG13 VAL A 51 4.971 -12.406 13.893 1.00 73.04 H new ATOM 0 HG21 VAL A 51 5.085 -14.438 16.212 1.00 73.42 H new ATOM 0 HG22 VAL A 51 5.456 -12.707 16.400 1.00 73.42 H new ATOM 0 HG23 VAL A 51 4.210 -13.467 17.420 1.00 73.42 H new ATOM 778 N PHE A 52 1.484 -11.734 13.781 1.00 42.31 N ATOM 779 CA PHE A 52 0.923 -11.252 12.524 1.00 60.20 C ATOM 780 C PHE A 52 0.279 -9.881 12.706 1.00 51.01 C ATOM 781 O PHE A 52 0.251 -9.068 11.781 1.00 10.21 O ATOM 782 CB PHE A 52 -0.109 -12.246 11.988 1.00 74.21 C ATOM 783 CG PHE A 52 -1.280 -11.590 11.313 1.00 5.51 C ATOM 784 CD1 PHE A 52 -1.129 -10.970 10.083 1.00 63.32 C ATOM 785 CD2 PHE A 52 -2.530 -11.591 11.909 1.00 13.03 C ATOM 786 CE1 PHE A 52 -2.204 -10.365 9.459 1.00 64.42 C ATOM 787 CE2 PHE A 52 -3.609 -10.988 11.290 1.00 62.20 C ATOM 788 CZ PHE A 52 -3.445 -10.374 10.064 1.00 50.41 C ATOM 0 H PHE A 52 1.026 -12.564 14.157 1.00 42.31 H new ATOM 0 HA PHE A 52 1.736 -11.159 11.804 1.00 60.20 H new ATOM 0 HB2 PHE A 52 0.378 -12.917 11.281 1.00 74.21 H new ATOM 0 HB3 PHE A 52 -0.472 -12.860 12.812 1.00 74.21 H new ATOM 0 HD1 PHE A 52 -0.160 -10.959 9.606 1.00 63.32 H new ATOM 0 HD2 PHE A 52 -2.663 -12.068 12.869 1.00 13.03 H new ATOM 0 HE1 PHE A 52 -2.073 -9.886 8.500 1.00 64.42 H new ATOM 0 HE2 PHE A 52 -4.579 -10.997 11.765 1.00 62.20 H new ATOM 0 HZ PHE A 52 -4.286 -9.901 9.579 1.00 50.41 H new ATOM 798 N LEU A 53 -0.239 -9.631 13.904 1.00 65.53 N ATOM 799 CA LEU A 53 -0.884 -8.359 14.208 1.00 4.05 C ATOM 800 C LEU A 53 0.085 -7.197 14.013 1.00 52.11 C ATOM 801 O LEU A 53 -0.192 -6.265 13.256 1.00 5.03 O ATOM 802 CB LEU A 53 -1.410 -8.363 15.645 1.00 51.23 C ATOM 803 CG LEU A 53 -1.434 -7.009 16.354 1.00 2.44 C ATOM 804 CD1 LEU A 53 -2.308 -6.023 15.595 1.00 72.12 C ATOM 805 CD2 LEU A 53 -1.924 -7.166 17.787 1.00 40.55 C ATOM 0 H LEU A 53 -0.225 -10.293 14.680 1.00 65.53 H new ATOM 0 HA LEU A 53 -1.720 -8.230 13.521 1.00 4.05 H new ATOM 0 HB2 LEU A 53 -2.423 -8.765 15.639 1.00 51.23 H new ATOM 0 HB3 LEU A 53 -0.799 -9.048 16.233 1.00 51.23 H new ATOM 0 HG LEU A 53 -0.418 -6.616 16.379 1.00 2.44 H new ATOM 0 HD11 LEU A 53 -2.312 -5.065 16.115 1.00 72.12 H new ATOM 0 HD12 LEU A 53 -1.913 -5.887 14.588 1.00 72.12 H new ATOM 0 HD13 LEU A 53 -3.326 -6.409 15.537 1.00 72.12 H new ATOM 0 HD21 LEU A 53 -1.935 -6.192 18.277 1.00 40.55 H new ATOM 0 HD22 LEU A 53 -2.932 -7.581 17.783 1.00 40.55 H new ATOM 0 HD23 LEU A 53 -1.257 -7.837 18.328 1.00 40.55 H new ATOM 817 N LEU A 54 1.222 -7.259 14.697 1.00 35.35 N ATOM 818 CA LEU A 54 2.233 -6.213 14.598 1.00 63.24 C ATOM 819 C LEU A 54 2.625 -5.971 13.143 1.00 34.23 C ATOM 820 O LEU A 54 2.814 -4.829 12.722 1.00 72.32 O ATOM 821 CB LEU A 54 3.470 -6.593 15.414 1.00 50.30 C ATOM 822 CG LEU A 54 4.286 -5.428 15.977 1.00 71.41 C ATOM 823 CD1 LEU A 54 4.101 -5.326 17.483 1.00 64.30 C ATOM 824 CD2 LEU A 54 5.758 -5.591 15.628 1.00 61.01 C ATOM 0 H LEU A 54 1.467 -8.023 15.327 1.00 35.35 H new ATOM 0 HA LEU A 54 1.809 -5.293 14.999 1.00 63.24 H new ATOM 0 HB2 LEU A 54 3.153 -7.224 16.245 1.00 50.30 H new ATOM 0 HB3 LEU A 54 4.123 -7.198 14.786 1.00 50.30 H new ATOM 0 HG LEU A 54 3.926 -4.504 15.524 1.00 71.41 H new ATOM 0 HD11 LEU A 54 4.689 -4.492 17.866 1.00 64.30 H new ATOM 0 HD12 LEU A 54 3.048 -5.162 17.710 1.00 64.30 H new ATOM 0 HD13 LEU A 54 4.434 -6.251 17.954 1.00 64.30 H new ATOM 0 HD21 LEU A 54 6.324 -4.753 16.036 1.00 61.01 H new ATOM 0 HD22 LEU A 54 6.132 -6.523 16.053 1.00 61.01 H new ATOM 0 HD23 LEU A 54 5.875 -5.614 14.545 1.00 61.01 H new ATOM 836 N LEU A 55 2.742 -7.052 12.380 1.00 23.11 N ATOM 837 CA LEU A 55 3.109 -6.958 10.971 1.00 13.22 C ATOM 838 C LEU A 55 2.173 -6.011 10.227 1.00 15.34 C ATOM 839 O LEU A 55 2.598 -5.273 9.338 1.00 5.45 O ATOM 840 CB LEU A 55 3.074 -8.342 10.321 1.00 22.02 C ATOM 841 CG LEU A 55 4.148 -8.615 9.267 1.00 74.40 C ATOM 842 CD1 LEU A 55 3.781 -9.835 8.436 1.00 24.53 C ATOM 843 CD2 LEU A 55 4.340 -7.398 8.374 1.00 24.32 C ATOM 0 H LEU A 55 2.588 -8.004 12.713 1.00 23.11 H new ATOM 0 HA LEU A 55 4.122 -6.560 10.911 1.00 13.22 H new ATOM 0 HB2 LEU A 55 3.164 -9.093 11.106 1.00 22.02 H new ATOM 0 HB3 LEU A 55 2.096 -8.480 9.859 1.00 22.02 H new ATOM 0 HG LEU A 55 5.089 -8.818 9.778 1.00 74.40 H new ATOM 0 HD11 LEU A 55 4.556 -10.014 7.691 1.00 24.53 H new ATOM 0 HD12 LEU A 55 3.694 -10.705 9.086 1.00 24.53 H new ATOM 0 HD13 LEU A 55 2.829 -9.661 7.934 1.00 24.53 H new ATOM 0 HD21 LEU A 55 5.108 -7.610 7.630 1.00 24.32 H new ATOM 0 HD22 LEU A 55 3.402 -7.164 7.871 1.00 24.32 H new ATOM 0 HD23 LEU A 55 4.648 -6.547 8.981 1.00 24.32 H new ATOM 855 N ILE A 56 0.897 -6.036 10.598 1.00 11.12 N ATOM 856 CA ILE A 56 -0.098 -5.177 9.968 1.00 33.04 C ATOM 857 C ILE A 56 0.056 -3.730 10.425 1.00 62.31 C ATOM 858 O ILE A 56 -0.331 -2.799 9.718 1.00 64.13 O ATOM 859 CB ILE A 56 -1.530 -5.652 10.280 1.00 1.21 C ATOM 860 CG1 ILE A 56 -1.763 -7.050 9.705 1.00 73.31 C ATOM 861 CG2 ILE A 56 -2.547 -4.667 9.723 1.00 34.41 C ATOM 862 CD1 ILE A 56 -1.580 -7.125 8.205 1.00 30.23 C ATOM 0 H ILE A 56 0.528 -6.642 11.331 1.00 11.12 H new ATOM 0 HA ILE A 56 0.070 -5.236 8.893 1.00 33.04 H new ATOM 0 HB ILE A 56 -1.654 -5.700 11.362 1.00 1.21 H new ATOM 0 HG12 ILE A 56 -1.076 -7.749 10.182 1.00 73.31 H new ATOM 0 HG13 ILE A 56 -2.773 -7.374 9.956 1.00 73.31 H new ATOM 0 HG21 ILE A 56 -3.554 -5.016 9.951 1.00 34.41 H new ATOM 0 HG22 ILE A 56 -2.391 -3.688 10.176 1.00 34.41 H new ATOM 0 HG23 ILE A 56 -2.426 -4.591 8.642 1.00 34.41 H new ATOM 0 HD11 ILE A 56 -1.761 -8.145 7.867 1.00 30.23 H new ATOM 0 HD12 ILE A 56 -2.285 -6.451 7.718 1.00 30.23 H new ATOM 0 HD13 ILE A 56 -0.562 -6.833 7.948 1.00 30.23 H new ATOM 874 N THR A 57 0.626 -3.548 11.612 1.00 42.40 N ATOM 875 CA THR A 57 0.833 -2.214 12.163 1.00 20.55 C ATOM 876 C THR A 57 2.073 -1.559 11.567 1.00 24.11 C ATOM 877 O THR A 57 2.275 -0.353 11.704 1.00 40.03 O ATOM 878 CB THR A 57 0.975 -2.257 13.697 1.00 45.34 C ATOM 879 OG1 THR A 57 2.303 -2.657 14.054 1.00 0.35 O ATOM 880 CG2 THR A 57 -0.032 -3.219 14.307 1.00 23.44 C ATOM 0 H THR A 57 0.952 -4.307 12.210 1.00 42.40 H new ATOM 0 HA THR A 57 -0.046 -1.624 11.903 1.00 20.55 H new ATOM 0 HB THR A 57 0.780 -1.258 14.087 1.00 45.34 H new ATOM 0 HG1 THR A 57 2.463 -3.573 13.744 1.00 0.35 H new ATOM 0 HG21 THR A 57 0.088 -3.232 15.390 1.00 23.44 H new ATOM 0 HG22 THR A 57 -1.042 -2.895 14.057 1.00 23.44 H new ATOM 0 HG23 THR A 57 0.136 -4.221 13.911 1.00 23.44 H new ATOM 888 N GLU A 58 2.901 -2.362 10.905 1.00 10.31 N ATOM 889 CA GLU A 58 4.122 -1.858 10.288 1.00 41.41 C ATOM 890 C GLU A 58 3.857 -1.390 8.860 1.00 61.44 C ATOM 891 O GLU A 58 4.428 -0.399 8.404 1.00 53.02 O ATOM 892 CB GLU A 58 5.205 -2.939 10.290 1.00 52.21 C ATOM 893 CG GLU A 58 5.617 -3.385 11.683 1.00 41.23 C ATOM 894 CD GLU A 58 6.355 -2.303 12.447 1.00 63.00 C ATOM 895 OE1 GLU A 58 7.316 -1.733 11.888 1.00 11.01 O ATOM 896 OE2 GLU A 58 5.973 -2.027 13.603 1.00 3.31 O ATOM 0 H GLU A 58 2.748 -3.363 10.783 1.00 10.31 H new ATOM 0 HA GLU A 58 4.469 -1.006 10.873 1.00 41.41 H new ATOM 0 HB2 GLU A 58 4.845 -3.804 9.733 1.00 52.21 H new ATOM 0 HB3 GLU A 58 6.082 -2.563 9.763 1.00 52.21 H new ATOM 0 HG2 GLU A 58 4.730 -3.680 12.243 1.00 41.23 H new ATOM 0 HG3 GLU A 58 6.252 -4.267 11.605 1.00 41.23 H new ATOM 903 N ILE A 59 2.989 -2.112 8.159 1.00 14.20 N ATOM 904 CA ILE A 59 2.648 -1.772 6.783 1.00 14.53 C ATOM 905 C ILE A 59 1.685 -0.590 6.732 1.00 70.02 C ATOM 906 O ILE A 59 1.718 0.210 5.796 1.00 31.21 O ATOM 907 CB ILE A 59 2.015 -2.967 6.048 1.00 74.51 C ATOM 908 CG1 ILE A 59 0.682 -3.347 6.698 1.00 42.54 C ATOM 909 CG2 ILE A 59 2.967 -4.154 6.049 1.00 51.05 C ATOM 910 CD1 ILE A 59 0.209 -4.738 6.338 1.00 12.53 C ATOM 0 H ILE A 59 2.509 -2.936 8.521 1.00 14.20 H new ATOM 0 HA ILE A 59 3.579 -1.502 6.285 1.00 14.53 H new ATOM 0 HB ILE A 59 1.825 -2.679 5.014 1.00 74.51 H new ATOM 0 HG12 ILE A 59 0.782 -3.275 7.781 1.00 42.54 H new ATOM 0 HG13 ILE A 59 -0.078 -2.625 6.399 1.00 42.54 H new ATOM 0 HG21 ILE A 59 2.505 -4.991 5.526 1.00 51.05 H new ATOM 0 HG22 ILE A 59 3.893 -3.878 5.546 1.00 51.05 H new ATOM 0 HG23 ILE A 59 3.185 -4.444 7.077 1.00 51.05 H new ATOM 0 HD11 ILE A 59 -0.741 -4.939 6.834 1.00 12.53 H new ATOM 0 HD12 ILE A 59 0.077 -4.809 5.258 1.00 12.53 H new ATOM 0 HD13 ILE A 59 0.949 -5.469 6.662 1.00 12.53 H new ATOM 922 N ILE A 60 0.830 -0.486 7.744 1.00 42.23 N ATOM 923 CA ILE A 60 -0.140 0.600 7.815 1.00 4.00 C ATOM 924 C ILE A 60 -1.130 0.530 6.657 1.00 22.45 C ATOM 925 O ILE A 60 -1.073 1.314 5.711 1.00 42.54 O ATOM 926 CB ILE A 60 0.553 1.975 7.800 1.00 1.53 C ATOM 927 CG1 ILE A 60 1.676 2.017 8.839 1.00 34.42 C ATOM 928 CG2 ILE A 60 -0.459 3.081 8.062 1.00 62.01 C ATOM 929 CD1 ILE A 60 3.055 2.150 8.233 1.00 22.23 C ATOM 0 H ILE A 60 0.789 -1.140 8.526 1.00 42.23 H new ATOM 0 HA ILE A 60 -0.677 0.482 8.756 1.00 4.00 H new ATOM 0 HB ILE A 60 0.990 2.134 6.814 1.00 1.53 H new ATOM 0 HG12 ILE A 60 1.503 2.854 9.515 1.00 34.42 H new ATOM 0 HG13 ILE A 60 1.638 1.108 9.440 1.00 34.42 H new ATOM 0 HG21 ILE A 60 0.046 4.047 8.048 1.00 62.01 H new ATOM 0 HG22 ILE A 60 -1.227 3.062 7.289 1.00 62.01 H new ATOM 0 HG23 ILE A 60 -0.922 2.927 9.037 1.00 62.01 H new ATOM 0 HD11 ILE A 60 3.801 2.173 9.028 1.00 22.23 H new ATOM 0 HD12 ILE A 60 3.248 1.300 7.579 1.00 22.23 H new ATOM 0 HD13 ILE A 60 3.111 3.073 7.655 1.00 22.23 H new ATOM 941 N PRO A 61 -2.062 -0.432 6.734 1.00 42.03 N ATOM 942 CA PRO A 61 -3.085 -0.627 5.702 1.00 44.32 C ATOM 943 C PRO A 61 -4.110 0.502 5.682 1.00 60.33 C ATOM 944 O PRO A 61 -4.943 0.581 4.778 1.00 24.45 O ATOM 945 CB PRO A 61 -3.749 -1.946 6.105 1.00 3.40 C ATOM 946 CG PRO A 61 -3.521 -2.051 7.574 1.00 41.05 C ATOM 947 CD PRO A 61 -2.189 -1.403 7.834 1.00 52.24 C ATOM 0 HA PRO A 61 -2.656 -0.639 4.700 1.00 44.32 H new ATOM 0 HB2 PRO A 61 -4.813 -1.942 5.869 1.00 3.40 H new ATOM 0 HB3 PRO A 61 -3.308 -2.790 5.574 1.00 3.40 H new ATOM 0 HG2 PRO A 61 -4.314 -1.549 8.129 1.00 41.05 H new ATOM 0 HG3 PRO A 61 -3.517 -3.093 7.895 1.00 41.05 H new ATOM 0 HD2 PRO A 61 -2.164 -0.913 8.807 1.00 52.24 H new ATOM 0 HD3 PRO A 61 -1.378 -2.132 7.822 1.00 52.24 H new ATOM 1043 N SER A 69 -10.207 -1.372 6.946 1.00 43.24 N ATOM 1044 CA SER A 69 -9.211 -2.437 6.915 1.00 12.14 C ATOM 1045 C SER A 69 -9.396 -3.386 8.095 1.00 23.52 C ATOM 1046 O SER A 69 -10.380 -3.297 8.830 1.00 42.01 O ATOM 1047 CB SER A 69 -7.800 -1.846 6.938 1.00 53.14 C ATOM 1048 OG SER A 69 -6.847 -2.784 6.468 1.00 11.34 O ATOM 0 HA SER A 69 -9.346 -3.001 5.992 1.00 12.14 H new ATOM 0 HB2 SER A 69 -7.768 -0.949 6.320 1.00 53.14 H new ATOM 0 HB3 SER A 69 -7.546 -1.542 7.954 1.00 53.14 H new ATOM 0 HG SER A 69 -6.255 -3.046 7.204 1.00 11.34 H new ATOM 1054 N ILE A 70 -8.442 -4.295 8.270 1.00 72.23 N ATOM 1055 CA ILE A 70 -8.498 -5.261 9.360 1.00 12.11 C ATOM 1056 C ILE A 70 -8.216 -4.592 10.701 1.00 34.44 C ATOM 1057 O ILE A 70 -8.466 -5.169 11.759 1.00 14.00 O ATOM 1058 CB ILE A 70 -7.492 -6.407 9.149 1.00 23.32 C ATOM 1059 CG1 ILE A 70 -7.884 -7.621 9.994 1.00 61.42 C ATOM 1060 CG2 ILE A 70 -6.084 -5.947 9.496 1.00 42.42 C ATOM 1061 CD1 ILE A 70 -6.975 -8.814 9.796 1.00 23.03 C ATOM 0 H ILE A 70 -7.621 -4.382 7.671 1.00 72.23 H new ATOM 0 HA ILE A 70 -9.507 -5.672 9.366 1.00 12.11 H new ATOM 0 HB ILE A 70 -7.510 -6.697 8.098 1.00 23.32 H new ATOM 0 HG12 ILE A 70 -7.875 -7.339 11.047 1.00 61.42 H new ATOM 0 HG13 ILE A 70 -8.906 -7.909 9.749 1.00 61.42 H new ATOM 0 HG21 ILE A 70 -5.384 -6.769 9.342 1.00 42.42 H new ATOM 0 HG22 ILE A 70 -5.807 -5.109 8.856 1.00 42.42 H new ATOM 0 HG23 ILE A 70 -6.051 -5.633 10.539 1.00 42.42 H new ATOM 0 HD11 ILE A 70 -7.312 -9.637 10.426 1.00 23.03 H new ATOM 0 HD12 ILE A 70 -7.002 -9.122 8.751 1.00 23.03 H new ATOM 0 HD13 ILE A 70 -5.955 -8.543 10.068 1.00 23.03 H new ATOM 1073 N GLY A 71 -7.695 -3.370 10.650 1.00 73.14 N ATOM 1074 CA GLY A 71 -7.390 -2.642 11.867 1.00 3.21 C ATOM 1075 C GLY A 71 -8.571 -2.576 12.815 1.00 4.31 C ATOM 1076 O GLY A 71 -8.395 -2.498 14.030 1.00 3.24 O ATOM 0 H GLY A 71 -7.479 -2.871 9.787 1.00 73.14 H new ATOM 0 HA2 GLY A 71 -6.550 -3.119 12.371 1.00 3.21 H new ATOM 0 HA3 GLY A 71 -7.076 -1.630 11.612 1.00 3.21 H new ATOM 1080 N GLU A 72 -9.777 -2.605 12.258 1.00 72.31 N ATOM 1081 CA GLU A 72 -10.991 -2.545 13.063 1.00 34.53 C ATOM 1082 C GLU A 72 -11.362 -3.928 13.593 1.00 42.13 C ATOM 1083 O GLU A 72 -11.977 -4.055 14.651 1.00 15.44 O ATOM 1084 CB GLU A 72 -12.148 -1.976 12.240 1.00 55.20 C ATOM 1085 CG GLU A 72 -12.003 -0.496 11.929 1.00 52.42 C ATOM 1086 CD GLU A 72 -13.114 0.340 12.536 1.00 64.22 C ATOM 1087 OE1 GLU A 72 -14.271 -0.127 12.544 1.00 35.55 O ATOM 1088 OE2 GLU A 72 -12.824 1.461 13.002 1.00 1.55 O ATOM 0 H GLU A 72 -9.940 -2.670 11.253 1.00 72.31 H new ATOM 0 HA GLU A 72 -10.801 -1.888 13.912 1.00 34.53 H new ATOM 0 HB2 GLU A 72 -12.224 -2.530 11.304 1.00 55.20 H new ATOM 0 HB3 GLU A 72 -13.081 -2.135 12.781 1.00 55.20 H new ATOM 0 HG2 GLU A 72 -11.042 -0.143 12.303 1.00 52.42 H new ATOM 0 HG3 GLU A 72 -11.996 -0.355 10.848 1.00 52.42 H new ATOM 1095 N TYR A 73 -10.983 -4.961 12.848 1.00 2.25 N ATOM 1096 CA TYR A 73 -11.277 -6.334 13.240 1.00 32.02 C ATOM 1097 C TYR A 73 -10.310 -6.812 14.319 1.00 61.12 C ATOM 1098 O TYR A 73 -10.721 -7.385 15.329 1.00 11.40 O ATOM 1099 CB TYR A 73 -11.202 -7.260 12.025 1.00 33.44 C ATOM 1100 CG TYR A 73 -11.039 -8.720 12.386 1.00 41.32 C ATOM 1101 CD1 TYR A 73 -12.140 -9.504 12.708 1.00 3.41 C ATOM 1102 CD2 TYR A 73 -9.783 -9.315 12.403 1.00 54.31 C ATOM 1103 CE1 TYR A 73 -11.995 -10.837 13.039 1.00 62.03 C ATOM 1104 CE2 TYR A 73 -9.629 -10.648 12.731 1.00 51.11 C ATOM 1105 CZ TYR A 73 -10.738 -11.405 13.048 1.00 3.45 C ATOM 1106 OH TYR A 73 -10.589 -12.733 13.376 1.00 53.11 O ATOM 0 H TYR A 73 -10.472 -4.873 11.970 1.00 2.25 H new ATOM 0 HA TYR A 73 -12.288 -6.360 13.647 1.00 32.02 H new ATOM 0 HB2 TYR A 73 -12.108 -7.140 11.431 1.00 33.44 H new ATOM 0 HB3 TYR A 73 -10.366 -6.954 11.396 1.00 33.44 H new ATOM 0 HD1 TYR A 73 -13.126 -9.063 12.699 1.00 3.41 H new ATOM 0 HD2 TYR A 73 -8.913 -8.725 12.156 1.00 54.31 H new ATOM 0 HE1 TYR A 73 -12.861 -11.431 13.289 1.00 62.03 H new ATOM 0 HE2 TYR A 73 -8.646 -11.095 12.739 1.00 51.11 H new ATOM 0 HH TYR A 73 -9.972 -13.159 12.744 1.00 53.11 H new ATOM 1116 N LEU A 74 -9.022 -6.573 14.097 1.00 12.44 N ATOM 1117 CA LEU A 74 -7.994 -6.977 15.050 1.00 61.32 C ATOM 1118 C LEU A 74 -8.239 -6.347 16.417 1.00 52.32 C ATOM 1119 O LEU A 74 -7.846 -6.897 17.446 1.00 33.51 O ATOM 1120 CB LEU A 74 -6.609 -6.582 14.534 1.00 12.20 C ATOM 1121 CG LEU A 74 -5.784 -7.702 13.899 1.00 12.21 C ATOM 1122 CD1 LEU A 74 -4.784 -7.131 12.906 1.00 51.11 C ATOM 1123 CD2 LEU A 74 -5.071 -8.512 14.971 1.00 25.04 C ATOM 0 H LEU A 74 -8.665 -6.102 13.266 1.00 12.44 H new ATOM 0 HA LEU A 74 -8.040 -8.061 15.158 1.00 61.32 H new ATOM 0 HB2 LEU A 74 -6.731 -5.786 13.799 1.00 12.20 H new ATOM 0 HB3 LEU A 74 -6.039 -6.165 15.364 1.00 12.20 H new ATOM 0 HG LEU A 74 -6.461 -8.366 13.361 1.00 12.21 H new ATOM 0 HD11 LEU A 74 -4.206 -7.943 12.464 1.00 51.11 H new ATOM 0 HD12 LEU A 74 -5.317 -6.595 12.120 1.00 51.11 H new ATOM 0 HD13 LEU A 74 -4.111 -6.445 13.421 1.00 51.11 H new ATOM 0 HD21 LEU A 74 -4.489 -9.305 14.501 1.00 25.04 H new ATOM 0 HD22 LEU A 74 -4.406 -7.860 15.537 1.00 25.04 H new ATOM 0 HD23 LEU A 74 -5.807 -8.952 15.644 1.00 25.04 H new ATOM 1135 N LEU A 75 -8.893 -5.190 16.420 1.00 23.12 N ATOM 1136 CA LEU A 75 -9.193 -4.485 17.661 1.00 12.23 C ATOM 1137 C LEU A 75 -10.427 -5.074 18.337 1.00 10.14 C ATOM 1138 O LEU A 75 -10.354 -5.574 19.460 1.00 5.32 O ATOM 1139 CB LEU A 75 -9.411 -2.996 17.385 1.00 21.10 C ATOM 1140 CG LEU A 75 -8.881 -2.032 18.447 1.00 43.23 C ATOM 1141 CD1 LEU A 75 -7.782 -1.153 17.869 1.00 22.50 C ATOM 1142 CD2 LEU A 75 -10.011 -1.178 19.004 1.00 64.31 C ATOM 0 H LEU A 75 -9.225 -4.721 15.577 1.00 23.12 H new ATOM 0 HA LEU A 75 -8.342 -4.603 18.332 1.00 12.23 H new ATOM 0 HB2 LEU A 75 -8.940 -2.751 16.433 1.00 21.10 H new ATOM 0 HB3 LEU A 75 -10.480 -2.822 17.266 1.00 21.10 H new ATOM 0 HG LEU A 75 -8.459 -2.618 19.263 1.00 43.23 H new ATOM 0 HD11 LEU A 75 -7.417 -0.473 18.639 1.00 22.50 H new ATOM 0 HD12 LEU A 75 -6.961 -1.779 17.519 1.00 22.50 H new ATOM 0 HD13 LEU A 75 -8.179 -0.576 17.034 1.00 22.50 H new ATOM 0 HD21 LEU A 75 -9.615 -0.498 19.758 1.00 64.31 H new ATOM 0 HD22 LEU A 75 -10.463 -0.601 18.197 1.00 64.31 H new ATOM 0 HD23 LEU A 75 -10.765 -1.822 19.456 1.00 64.31 H new ATOM 1154 N PHE A 76 -11.560 -5.014 17.646 1.00 51.54 N ATOM 1155 CA PHE A 76 -12.810 -5.542 18.179 1.00 73.15 C ATOM 1156 C PHE A 76 -12.656 -7.007 18.576 1.00 22.20 C ATOM 1157 O PHE A 76 -13.277 -7.473 19.532 1.00 2.53 O ATOM 1158 CB PHE A 76 -13.931 -5.397 17.147 1.00 62.43 C ATOM 1159 CG PHE A 76 -14.669 -4.093 17.242 1.00 4.41 C ATOM 1160 CD1 PHE A 76 -14.047 -2.903 16.898 1.00 70.23 C ATOM 1161 CD2 PHE A 76 -15.984 -4.055 17.677 1.00 62.42 C ATOM 1162 CE1 PHE A 76 -14.723 -1.701 16.984 1.00 52.31 C ATOM 1163 CE2 PHE A 76 -16.665 -2.856 17.765 1.00 71.24 C ATOM 1164 CZ PHE A 76 -16.034 -1.677 17.419 1.00 23.30 C ATOM 0 H PHE A 76 -11.638 -4.605 16.715 1.00 51.54 H new ATOM 0 HA PHE A 76 -13.068 -4.968 19.069 1.00 73.15 H new ATOM 0 HB2 PHE A 76 -13.508 -5.494 16.147 1.00 62.43 H new ATOM 0 HB3 PHE A 76 -14.639 -6.216 17.274 1.00 62.43 H new ATOM 0 HD1 PHE A 76 -13.022 -2.915 16.559 1.00 70.23 H new ATOM 0 HD2 PHE A 76 -16.482 -4.973 17.950 1.00 62.42 H new ATOM 0 HE1 PHE A 76 -14.227 -0.781 16.711 1.00 52.31 H new ATOM 0 HE2 PHE A 76 -17.690 -2.841 18.104 1.00 71.24 H new ATOM 0 HZ PHE A 76 -16.564 -0.739 17.488 1.00 23.30 H new ATOM 1174 N THR A 77 -11.823 -7.731 17.834 1.00 0.12 N ATOM 1175 CA THR A 77 -11.587 -9.143 18.107 1.00 72.03 C ATOM 1176 C THR A 77 -10.776 -9.329 19.384 1.00 50.41 C ATOM 1177 O THR A 77 -11.207 -10.015 20.310 1.00 70.33 O ATOM 1178 CB THR A 77 -10.849 -9.825 16.939 1.00 2.24 C ATOM 1179 OG1 THR A 77 -11.719 -9.936 15.808 1.00 62.14 O ATOM 1180 CG2 THR A 77 -10.355 -11.206 17.344 1.00 54.20 C ATOM 0 H THR A 77 -11.301 -7.362 17.039 1.00 0.12 H new ATOM 0 HA THR A 77 -12.565 -9.608 18.231 1.00 72.03 H new ATOM 0 HB THR A 77 -9.988 -9.212 16.675 1.00 2.24 H new ATOM 0 HG1 THR A 77 -11.255 -10.406 15.084 1.00 62.14 H new ATOM 0 HG21 THR A 77 -9.837 -11.668 16.504 1.00 54.20 H new ATOM 0 HG22 THR A 77 -9.670 -11.115 18.187 1.00 54.20 H new ATOM 0 HG23 THR A 77 -11.204 -11.826 17.632 1.00 54.20 H new ATOM 1188 N MET A 78 -9.600 -8.711 19.427 1.00 23.52 N ATOM 1189 CA MET A 78 -8.729 -8.808 20.593 1.00 11.21 C ATOM 1190 C MET A 78 -9.481 -8.431 21.866 1.00 41.44 C ATOM 1191 O MET A 78 -9.215 -8.974 22.938 1.00 35.03 O ATOM 1192 CB MET A 78 -7.508 -7.902 20.421 1.00 71.33 C ATOM 1193 CG MET A 78 -6.389 -8.539 19.613 1.00 5.13 C ATOM 1194 SD MET A 78 -5.158 -9.350 20.652 1.00 60.33 S ATOM 1195 CE MET A 78 -3.951 -9.844 19.424 1.00 51.23 C ATOM 0 H MET A 78 -9.229 -8.138 18.669 1.00 23.52 H new ATOM 0 HA MET A 78 -8.396 -9.842 20.681 1.00 11.21 H new ATOM 0 HB2 MET A 78 -7.817 -6.978 19.933 1.00 71.33 H new ATOM 0 HB3 MET A 78 -7.126 -7.630 21.405 1.00 71.33 H new ATOM 0 HG2 MET A 78 -6.814 -9.268 18.923 1.00 5.13 H new ATOM 0 HG3 MET A 78 -5.902 -7.774 19.008 1.00 5.13 H new ATOM 0 HE1 MET A 78 -3.641 -10.872 19.612 1.00 51.23 H new ATOM 0 HE2 MET A 78 -4.393 -9.774 18.430 1.00 51.23 H new ATOM 0 HE3 MET A 78 -3.083 -9.187 19.482 1.00 51.23 H new ATOM 1205 N ILE A 79 -10.418 -7.498 21.739 1.00 15.30 N ATOM 1206 CA ILE A 79 -11.208 -7.049 22.879 1.00 32.52 C ATOM 1207 C ILE A 79 -12.249 -8.093 23.271 1.00 2.13 C ATOM 1208 O ILE A 79 -12.523 -8.298 24.454 1.00 63.30 O ATOM 1209 CB ILE A 79 -11.921 -5.717 22.581 1.00 3.15 C ATOM 1210 CG1 ILE A 79 -10.897 -4.591 22.419 1.00 31.33 C ATOM 1211 CG2 ILE A 79 -12.909 -5.386 23.690 1.00 51.34 C ATOM 1212 CD1 ILE A 79 -11.473 -3.334 21.806 1.00 72.43 C ATOM 0 H ILE A 79 -10.649 -7.038 20.858 1.00 15.30 H new ATOM 0 HA ILE A 79 -10.513 -6.902 23.706 1.00 32.52 H new ATOM 0 HB ILE A 79 -12.473 -5.818 21.647 1.00 3.15 H new ATOM 0 HG12 ILE A 79 -10.477 -4.350 23.395 1.00 31.33 H new ATOM 0 HG13 ILE A 79 -10.075 -4.945 21.797 1.00 31.33 H new ATOM 0 HG21 ILE A 79 -13.405 -4.442 23.465 1.00 51.34 H new ATOM 0 HG22 ILE A 79 -13.653 -6.179 23.763 1.00 51.34 H new ATOM 0 HG23 ILE A 79 -12.377 -5.300 24.637 1.00 51.34 H new ATOM 0 HD11 ILE A 79 -10.691 -2.579 21.721 1.00 72.43 H new ATOM 0 HD12 ILE A 79 -11.868 -3.560 20.815 1.00 72.43 H new ATOM 0 HD13 ILE A 79 -12.276 -2.955 22.439 1.00 72.43 H new ATOM 1224 N PHE A 80 -12.825 -8.751 22.271 1.00 61.01 N ATOM 1225 CA PHE A 80 -13.835 -9.775 22.511 1.00 53.23 C ATOM 1226 C PHE A 80 -13.201 -11.044 23.072 1.00 11.14 C ATOM 1227 O PHE A 80 -13.606 -11.541 24.123 1.00 32.41 O ATOM 1228 CB PHE A 80 -14.584 -10.096 21.216 1.00 53.44 C ATOM 1229 CG PHE A 80 -15.791 -10.966 21.421 1.00 50.02 C ATOM 1230 CD1 PHE A 80 -16.975 -10.429 21.901 1.00 70.43 C ATOM 1231 CD2 PHE A 80 -15.742 -12.320 21.133 1.00 23.54 C ATOM 1232 CE1 PHE A 80 -18.087 -11.228 22.091 1.00 25.32 C ATOM 1233 CE2 PHE A 80 -16.850 -13.124 21.321 1.00 33.35 C ATOM 1234 CZ PHE A 80 -18.025 -12.577 21.800 1.00 24.11 C ATOM 0 H PHE A 80 -12.610 -8.594 21.286 1.00 61.01 H new ATOM 0 HA PHE A 80 -14.541 -9.388 23.245 1.00 53.23 H new ATOM 0 HB2 PHE A 80 -14.894 -9.163 20.744 1.00 53.44 H new ATOM 0 HB3 PHE A 80 -13.902 -10.591 20.525 1.00 53.44 H new ATOM 0 HD1 PHE A 80 -17.030 -9.375 22.129 1.00 70.43 H new ATOM 0 HD2 PHE A 80 -14.827 -12.753 20.757 1.00 23.54 H new ATOM 0 HE1 PHE A 80 -19.004 -10.798 22.467 1.00 25.32 H new ATOM 0 HE2 PHE A 80 -16.798 -14.179 21.094 1.00 33.35 H new ATOM 0 HZ PHE A 80 -18.893 -13.203 21.947 1.00 24.11 H new ATOM 1244 N VAL A 81 -12.204 -11.563 22.364 1.00 64.42 N ATOM 1245 CA VAL A 81 -11.512 -12.774 22.791 1.00 71.05 C ATOM 1246 C VAL A 81 -10.982 -12.632 24.213 1.00 53.11 C ATOM 1247 O VAL A 81 -10.904 -13.608 24.959 1.00 23.42 O ATOM 1248 CB VAL A 81 -10.341 -13.113 21.849 1.00 3.45 C ATOM 1249 CG1 VAL A 81 -10.840 -13.320 20.428 1.00 74.21 C ATOM 1250 CG2 VAL A 81 -9.285 -12.018 21.898 1.00 74.10 C ATOM 0 H VAL A 81 -11.857 -11.164 21.492 1.00 64.42 H new ATOM 0 HA VAL A 81 -12.241 -13.584 22.758 1.00 71.05 H new ATOM 0 HB VAL A 81 -9.884 -14.043 22.186 1.00 3.45 H new ATOM 0 HG11 VAL A 81 -9.998 -13.558 19.778 1.00 74.21 H new ATOM 0 HG12 VAL A 81 -11.556 -14.141 20.410 1.00 74.21 H new ATOM 0 HG13 VAL A 81 -11.324 -12.409 20.076 1.00 74.21 H new ATOM 0 HG21 VAL A 81 -8.465 -12.273 21.227 1.00 74.10 H new ATOM 0 HG22 VAL A 81 -9.727 -11.072 21.587 1.00 74.10 H new ATOM 0 HG23 VAL A 81 -8.905 -11.924 22.915 1.00 74.10 H new ATOM 1260 N THR A 82 -10.619 -11.408 24.584 1.00 15.10 N ATOM 1261 CA THR A 82 -10.096 -11.137 25.917 1.00 13.10 C ATOM 1262 C THR A 82 -11.143 -11.426 26.987 1.00 5.34 C ATOM 1263 O THR A 82 -10.923 -12.247 27.879 1.00 12.21 O ATOM 1264 CB THR A 82 -9.631 -9.675 26.051 1.00 0.34 C ATOM 1265 OG1 THR A 82 -8.327 -9.521 25.479 1.00 14.12 O ATOM 1266 CG2 THR A 82 -9.603 -9.248 27.511 1.00 12.42 C ATOM 0 H THR A 82 -10.678 -10.589 23.980 1.00 15.10 H new ATOM 0 HA THR A 82 -9.241 -11.797 26.062 1.00 13.10 H new ATOM 0 HB THR A 82 -10.339 -9.041 25.517 1.00 0.34 H new ATOM 0 HG1 THR A 82 -8.411 -9.312 24.525 1.00 14.12 H new ATOM 0 HG21 THR A 82 -9.272 -8.212 27.581 1.00 12.42 H new ATOM 0 HG22 THR A 82 -10.603 -9.339 27.936 1.00 12.42 H new ATOM 0 HG23 THR A 82 -8.915 -9.887 28.064 1.00 12.42 H new ATOM 1274 N LEU A 83 -12.281 -10.747 26.894 1.00 63.11 N ATOM 1275 CA LEU A 83 -13.363 -10.932 27.855 1.00 43.42 C ATOM 1276 C LEU A 83 -13.947 -12.337 27.754 1.00 25.21 C ATOM 1277 O LEU A 83 -14.523 -12.851 28.713 1.00 42.11 O ATOM 1278 CB LEU A 83 -14.461 -9.893 27.621 1.00 11.14 C ATOM 1279 CG LEU A 83 -14.031 -8.429 27.714 1.00 43.51 C ATOM 1280 CD1 LEU A 83 -15.095 -7.521 27.117 1.00 43.32 C ATOM 1281 CD2 LEU A 83 -13.750 -8.045 29.160 1.00 71.44 C ATOM 0 H LEU A 83 -12.478 -10.063 26.163 1.00 63.11 H new ATOM 0 HA LEU A 83 -12.953 -10.800 28.856 1.00 43.42 H new ATOM 0 HB2 LEU A 83 -14.889 -10.063 26.633 1.00 11.14 H new ATOM 0 HB3 LEU A 83 -15.256 -10.064 28.347 1.00 11.14 H new ATOM 0 HG LEU A 83 -13.112 -8.304 27.141 1.00 43.51 H new ATOM 0 HD11 LEU A 83 -14.771 -6.483 27.192 1.00 43.32 H new ATOM 0 HD12 LEU A 83 -15.247 -7.779 26.069 1.00 43.32 H new ATOM 0 HD13 LEU A 83 -16.030 -7.650 27.662 1.00 43.32 H new ATOM 0 HD21 LEU A 83 -13.445 -6.999 29.206 1.00 71.44 H new ATOM 0 HD22 LEU A 83 -14.652 -8.187 29.756 1.00 71.44 H new ATOM 0 HD23 LEU A 83 -12.952 -8.673 29.555 1.00 71.44 H new ATOM 1293 N SER A 84 -13.791 -12.955 26.587 1.00 13.34 N ATOM 1294 CA SER A 84 -14.304 -14.301 26.361 1.00 54.22 C ATOM 1295 C SER A 84 -13.544 -15.321 27.202 1.00 3.13 C ATOM 1296 O SER A 84 -14.145 -16.131 27.908 1.00 21.04 O ATOM 1297 CB SER A 84 -14.201 -14.666 24.879 1.00 64.22 C ATOM 1298 OG SER A 84 -15.147 -13.946 24.108 1.00 33.25 O ATOM 0 H SER A 84 -13.314 -12.545 25.784 1.00 13.34 H new ATOM 0 HA SER A 84 -15.352 -14.319 26.661 1.00 54.22 H new ATOM 0 HB2 SER A 84 -13.195 -14.452 24.518 1.00 64.22 H new ATOM 0 HB3 SER A 84 -14.364 -15.736 24.753 1.00 64.22 H new ATOM 0 HG SER A 84 -14.819 -13.035 23.955 1.00 33.25 H new ATOM 1304 N ILE A 85 -12.218 -15.275 27.121 1.00 13.32 N ATOM 1305 CA ILE A 85 -11.375 -16.194 27.875 1.00 2.55 C ATOM 1306 C ILE A 85 -11.508 -15.956 29.376 1.00 60.21 C ATOM 1307 O ILE A 85 -11.257 -16.852 30.182 1.00 63.31 O ATOM 1308 CB ILE A 85 -9.894 -16.056 27.475 1.00 71.22 C ATOM 1309 CG1 ILE A 85 -9.715 -16.361 25.986 1.00 35.32 C ATOM 1310 CG2 ILE A 85 -9.029 -16.981 28.318 1.00 32.12 C ATOM 1311 CD1 ILE A 85 -8.704 -15.468 25.303 1.00 25.14 C ATOM 0 H ILE A 85 -11.705 -14.611 26.541 1.00 13.32 H new ATOM 0 HA ILE A 85 -11.715 -17.202 27.637 1.00 2.55 H new ATOM 0 HB ILE A 85 -9.578 -15.029 27.657 1.00 71.22 H new ATOM 0 HG12 ILE A 85 -9.406 -17.400 25.871 1.00 35.32 H new ATOM 0 HG13 ILE A 85 -10.677 -16.257 25.484 1.00 35.32 H new ATOM 0 HG21 ILE A 85 -7.985 -16.872 28.023 1.00 32.12 H new ATOM 0 HG22 ILE A 85 -9.138 -16.721 29.371 1.00 32.12 H new ATOM 0 HG23 ILE A 85 -9.343 -18.013 28.164 1.00 32.12 H new ATOM 0 HD11 ILE A 85 -8.629 -15.741 24.250 1.00 25.14 H new ATOM 0 HD12 ILE A 85 -9.022 -14.429 25.386 1.00 25.14 H new ATOM 0 HD13 ILE A 85 -7.731 -15.589 25.779 1.00 25.14 H new ATOM 1323 N VAL A 86 -11.907 -14.743 29.745 1.00 42.05 N ATOM 1324 CA VAL A 86 -12.077 -14.388 31.148 1.00 1.24 C ATOM 1325 C VAL A 86 -13.428 -14.859 31.675 1.00 41.13 C ATOM 1326 O VAL A 86 -13.512 -15.462 32.745 1.00 72.32 O ATOM 1327 CB VAL A 86 -11.957 -12.867 31.361 1.00 14.00 C ATOM 1328 CG1 VAL A 86 -12.897 -12.407 32.465 1.00 4.34 C ATOM 1329 CG2 VAL A 86 -10.520 -12.485 31.679 1.00 64.21 C ATOM 0 H VAL A 86 -12.119 -13.989 29.091 1.00 42.05 H new ATOM 0 HA VAL A 86 -11.281 -14.889 31.699 1.00 1.24 H new ATOM 0 HB VAL A 86 -12.246 -12.364 30.438 1.00 14.00 H new ATOM 0 HG11 VAL A 86 -12.799 -11.330 32.601 1.00 4.34 H new ATOM 0 HG12 VAL A 86 -13.925 -12.646 32.191 1.00 4.34 H new ATOM 0 HG13 VAL A 86 -12.642 -12.915 33.395 1.00 4.34 H new ATOM 0 HG21 VAL A 86 -10.454 -11.407 31.826 1.00 64.21 H new ATOM 0 HG22 VAL A 86 -10.200 -12.996 32.587 1.00 64.21 H new ATOM 0 HG23 VAL A 86 -9.874 -12.778 30.852 1.00 64.21 H new ATOM 1339 N ILE A 87 -14.482 -14.580 30.916 1.00 52.02 N ATOM 1340 CA ILE A 87 -15.830 -14.977 31.305 1.00 4.22 C ATOM 1341 C ILE A 87 -16.022 -16.483 31.161 1.00 15.42 C ATOM 1342 O ILE A 87 -16.830 -17.087 31.868 1.00 65.41 O ATOM 1343 CB ILE A 87 -16.896 -14.251 30.463 1.00 23.13 C ATOM 1344 CG1 ILE A 87 -16.864 -12.748 30.746 1.00 12.25 C ATOM 1345 CG2 ILE A 87 -18.276 -14.821 30.752 1.00 74.25 C ATOM 1346 CD1 ILE A 87 -17.163 -12.398 32.188 1.00 62.05 C ATOM 0 H ILE A 87 -14.429 -14.081 30.028 1.00 52.02 H new ATOM 0 HA ILE A 87 -15.953 -14.696 32.351 1.00 4.22 H new ATOM 0 HB ILE A 87 -16.673 -14.407 29.407 1.00 23.13 H new ATOM 0 HG12 ILE A 87 -15.881 -12.358 30.482 1.00 12.25 H new ATOM 0 HG13 ILE A 87 -17.588 -12.250 30.102 1.00 12.25 H new ATOM 0 HG21 ILE A 87 -19.019 -14.298 30.150 1.00 74.25 H new ATOM 0 HG22 ILE A 87 -18.290 -15.883 30.505 1.00 74.25 H new ATOM 0 HG23 ILE A 87 -18.509 -14.691 31.809 1.00 74.25 H new ATOM 0 HD11 ILE A 87 -17.123 -11.316 32.316 1.00 62.05 H new ATOM 0 HD12 ILE A 87 -18.158 -12.758 32.451 1.00 62.05 H new ATOM 0 HD13 ILE A 87 -16.424 -12.867 32.837 1.00 62.05 H new ATOM 1358 N THR A 88 -15.274 -17.084 30.241 1.00 34.34 N ATOM 1359 CA THR A 88 -15.362 -18.520 30.004 1.00 0.45 C ATOM 1360 C THR A 88 -14.675 -19.303 31.117 1.00 62.42 C ATOM 1361 O THR A 88 -15.209 -20.296 31.612 1.00 12.33 O ATOM 1362 CB THR A 88 -14.730 -18.906 28.654 1.00 42.31 C ATOM 1363 OG1 THR A 88 -15.486 -18.338 27.579 1.00 40.42 O ATOM 1364 CG2 THR A 88 -14.671 -20.418 28.496 1.00 14.42 C ATOM 0 H THR A 88 -14.601 -16.599 29.648 1.00 34.34 H new ATOM 0 HA THR A 88 -16.422 -18.774 29.986 1.00 0.45 H new ATOM 0 HB THR A 88 -13.713 -18.514 28.629 1.00 42.31 H new ATOM 0 HG1 THR A 88 -15.166 -17.429 27.398 1.00 40.42 H new ATOM 0 HG21 THR A 88 -14.221 -20.666 27.535 1.00 14.42 H new ATOM 0 HG22 THR A 88 -14.070 -20.845 29.299 1.00 14.42 H new ATOM 0 HG23 THR A 88 -15.680 -20.828 28.541 1.00 14.42 H new ATOM 1372 N VAL A 89 -13.487 -18.852 31.506 1.00 1.52 N ATOM 1373 CA VAL A 89 -12.727 -19.510 32.562 1.00 11.11 C ATOM 1374 C VAL A 89 -13.393 -19.318 33.920 1.00 52.31 C ATOM 1375 O VAL A 89 -13.195 -20.113 34.839 1.00 42.21 O ATOM 1376 CB VAL A 89 -11.284 -18.977 32.631 1.00 44.13 C ATOM 1377 CG1 VAL A 89 -11.202 -17.773 33.557 1.00 71.10 C ATOM 1378 CG2 VAL A 89 -10.332 -20.074 33.084 1.00 51.13 C ATOM 0 H VAL A 89 -13.030 -18.033 31.105 1.00 1.52 H new ATOM 0 HA VAL A 89 -12.703 -20.572 32.319 1.00 11.11 H new ATOM 0 HB VAL A 89 -10.986 -18.658 31.632 1.00 44.13 H new ATOM 0 HG11 VAL A 89 -10.175 -17.411 33.593 1.00 71.10 H new ATOM 0 HG12 VAL A 89 -11.853 -16.982 33.184 1.00 71.10 H new ATOM 0 HG13 VAL A 89 -11.520 -18.062 34.559 1.00 71.10 H new ATOM 0 HG21 VAL A 89 -9.317 -19.680 33.127 1.00 51.13 H new ATOM 0 HG22 VAL A 89 -10.627 -20.426 34.072 1.00 51.13 H new ATOM 0 HG23 VAL A 89 -10.370 -20.903 32.377 1.00 51.13 H new ATOM 1388 N PHE A 90 -14.185 -18.257 34.040 1.00 61.24 N ATOM 1389 CA PHE A 90 -14.881 -17.960 35.286 1.00 51.40 C ATOM 1390 C PHE A 90 -16.032 -18.935 35.512 1.00 33.22 C ATOM 1391 O PHE A 90 -16.094 -19.614 36.537 1.00 4.14 O ATOM 1392 CB PHE A 90 -15.410 -16.524 35.269 1.00 11.02 C ATOM 1393 CG PHE A 90 -14.606 -15.579 36.116 1.00 52.14 C ATOM 1394 CD1 PHE A 90 -13.263 -15.364 35.852 1.00 11.53 C ATOM 1395 CD2 PHE A 90 -15.194 -14.906 37.175 1.00 25.42 C ATOM 1396 CE1 PHE A 90 -12.520 -14.494 36.629 1.00 34.20 C ATOM 1397 CE2 PHE A 90 -14.456 -14.036 37.955 1.00 11.30 C ATOM 1398 CZ PHE A 90 -13.118 -13.830 37.682 1.00 23.35 C ATOM 0 H PHE A 90 -14.360 -17.589 33.289 1.00 61.24 H new ATOM 0 HA PHE A 90 -14.170 -18.069 36.105 1.00 51.40 H new ATOM 0 HB2 PHE A 90 -15.419 -16.161 34.241 1.00 11.02 H new ATOM 0 HB3 PHE A 90 -16.443 -16.522 35.617 1.00 11.02 H new ATOM 0 HD1 PHE A 90 -12.791 -15.882 35.030 1.00 11.53 H new ATOM 0 HD2 PHE A 90 -16.240 -15.063 37.393 1.00 25.42 H new ATOM 0 HE1 PHE A 90 -11.474 -14.334 36.413 1.00 34.20 H new ATOM 0 HE2 PHE A 90 -14.925 -13.517 38.778 1.00 11.30 H new ATOM 0 HZ PHE A 90 -12.540 -13.151 38.291 1.00 23.35 H new ATOM 1408 N VAL A 91 -16.944 -18.999 34.547 1.00 32.21 N ATOM 1409 CA VAL A 91 -18.094 -19.891 34.639 1.00 21.25 C ATOM 1410 C VAL A 91 -17.655 -21.329 34.894 1.00 41.15 C ATOM 1411 O VAL A 91 -18.342 -22.088 35.578 1.00 14.11 O ATOM 1412 CB VAL A 91 -18.945 -19.845 33.356 1.00 3.14 C ATOM 1413 CG1 VAL A 91 -18.080 -20.105 32.132 1.00 1.23 C ATOM 1414 CG2 VAL A 91 -20.085 -20.849 33.437 1.00 65.10 C ATOM 0 H VAL A 91 -16.909 -18.444 33.692 1.00 32.21 H new ATOM 0 HA VAL A 91 -18.697 -19.544 35.478 1.00 21.25 H new ATOM 0 HB VAL A 91 -19.376 -18.848 33.262 1.00 3.14 H new ATOM 0 HG11 VAL A 91 -18.698 -20.069 31.235 1.00 1.23 H new ATOM 0 HG12 VAL A 91 -17.302 -19.344 32.068 1.00 1.23 H new ATOM 0 HG13 VAL A 91 -17.619 -21.089 32.215 1.00 1.23 H new ATOM 0 HG21 VAL A 91 -20.676 -20.803 32.522 1.00 65.10 H new ATOM 0 HG22 VAL A 91 -19.678 -21.853 33.556 1.00 65.10 H new ATOM 0 HG23 VAL A 91 -20.719 -20.611 34.291 1.00 65.10 H new ATOM 1424 N LEU A 92 -16.506 -21.697 34.338 1.00 23.55 N ATOM 1425 CA LEU A 92 -15.973 -23.045 34.505 1.00 32.41 C ATOM 1426 C LEU A 92 -15.200 -23.167 35.814 1.00 23.31 C ATOM 1427 O LEU A 92 -15.023 -24.264 36.342 1.00 62.31 O ATOM 1428 CB LEU A 92 -15.065 -23.405 33.328 1.00 75.54 C ATOM 1429 CG LEU A 92 -14.496 -24.825 33.329 1.00 50.43 C ATOM 1430 CD1 LEU A 92 -14.507 -25.405 31.923 1.00 22.10 C ATOM 1431 CD2 LEU A 92 -13.086 -24.833 33.900 1.00 2.13 C ATOM 0 H LEU A 92 -15.926 -21.082 33.768 1.00 23.55 H new ATOM 0 HA LEU A 92 -16.812 -23.740 34.534 1.00 32.41 H new ATOM 0 HB2 LEU A 92 -15.626 -23.260 32.405 1.00 75.54 H new ATOM 0 HB3 LEU A 92 -14.233 -22.701 33.309 1.00 75.54 H new ATOM 0 HG LEU A 92 -15.127 -25.449 33.962 1.00 50.43 H new ATOM 0 HD11 LEU A 92 -14.099 -26.415 31.943 1.00 22.10 H new ATOM 0 HD12 LEU A 92 -15.531 -25.435 31.550 1.00 22.10 H new ATOM 0 HD13 LEU A 92 -13.900 -24.781 31.267 1.00 22.10 H new ATOM 0 HD21 LEU A 92 -12.696 -25.851 33.893 1.00 2.13 H new ATOM 0 HD22 LEU A 92 -12.444 -24.195 33.293 1.00 2.13 H new ATOM 0 HD23 LEU A 92 -13.106 -24.459 34.924 1.00 2.13 H new ATOM 1443 N ASN A 93 -14.743 -22.032 36.333 1.00 22.44 N ATOM 1444 CA ASN A 93 -13.990 -22.012 37.582 1.00 4.11 C ATOM 1445 C ASN A 93 -14.889 -22.354 38.766 1.00 55.22 C ATOM 1446 O ASN A 93 -14.442 -22.942 39.750 1.00 2.45 O ATOM 1447 CB ASN A 93 -13.350 -20.638 37.794 1.00 62.35 C ATOM 1448 CG ASN A 93 -13.304 -20.241 39.256 1.00 1.13 C ATOM 1449 OD1 ASN A 93 -12.513 -20.777 40.032 1.00 22.22 O ATOM 1450 ND2 ASN A 93 -14.155 -19.296 39.640 1.00 61.15 N ATOM 0 H ASN A 93 -14.881 -21.115 35.908 1.00 22.44 H new ATOM 0 HA ASN A 93 -13.205 -22.765 37.515 1.00 4.11 H new ATOM 0 HB2 ASN A 93 -12.337 -20.646 37.390 1.00 62.35 H new ATOM 0 HB3 ASN A 93 -13.910 -19.889 37.234 1.00 62.35 H new ATOM 0 HD21 ASN A 93 -14.170 -18.988 40.612 1.00 61.15 H new ATOM 0 HD22 ASN A 93 -14.793 -18.879 38.963 1.00 61.15 H new ATOM 1457 N VAL A 94 -16.161 -21.982 38.662 1.00 55.10 N ATOM 1458 CA VAL A 94 -17.125 -22.250 39.722 1.00 34.44 C ATOM 1459 C VAL A 94 -17.424 -23.742 39.829 1.00 54.43 C ATOM 1460 O VAL A 94 -17.905 -24.218 40.858 1.00 52.34 O ATOM 1461 CB VAL A 94 -18.444 -21.489 39.489 1.00 63.05 C ATOM 1462 CG1 VAL A 94 -19.355 -22.272 38.556 1.00 63.43 C ATOM 1463 CG2 VAL A 94 -19.138 -21.207 40.812 1.00 21.35 C ATOM 0 H VAL A 94 -16.548 -21.494 37.854 1.00 55.10 H new ATOM 0 HA VAL A 94 -16.675 -21.904 40.653 1.00 34.44 H new ATOM 0 HB VAL A 94 -18.213 -20.535 39.016 1.00 63.05 H new ATOM 0 HG11 VAL A 94 -20.282 -21.719 38.403 1.00 63.43 H new ATOM 0 HG12 VAL A 94 -18.857 -22.417 37.597 1.00 63.43 H new ATOM 0 HG13 VAL A 94 -19.581 -23.243 38.998 1.00 63.43 H new ATOM 0 HG21 VAL A 94 -20.068 -20.669 40.628 1.00 21.35 H new ATOM 0 HG22 VAL A 94 -19.357 -22.148 41.316 1.00 21.35 H new ATOM 0 HG23 VAL A 94 -18.487 -20.601 41.442 1.00 21.35 H new ATOM 1644 N GLY A 108 -27.100 -27.841 26.238 1.00 24.31 N ATOM 1645 CA GLY A 108 -27.306 -26.936 25.123 1.00 62.03 C ATOM 1646 C GLY A 108 -26.385 -25.733 25.175 1.00 53.22 C ATOM 1647 O GLY A 108 -26.365 -24.918 24.252 1.00 73.13 O ATOM 0 HA2 GLY A 108 -27.145 -27.473 24.188 1.00 62.03 H new ATOM 0 HA3 GLY A 108 -28.342 -26.597 25.121 1.00 62.03 H new ATOM 1651 N ILE A 109 -25.623 -25.620 26.257 1.00 0.41 N ATOM 1652 CA ILE A 109 -24.697 -24.507 26.426 1.00 41.44 C ATOM 1653 C ILE A 109 -23.443 -24.702 25.580 1.00 51.11 C ATOM 1654 O ILE A 109 -22.790 -23.735 25.188 1.00 63.04 O ATOM 1655 CB ILE A 109 -24.286 -24.334 27.900 1.00 74.01 C ATOM 1656 CG1 ILE A 109 -25.527 -24.279 28.794 1.00 24.13 C ATOM 1657 CG2 ILE A 109 -23.446 -23.077 28.072 1.00 33.41 C ATOM 1658 CD1 ILE A 109 -25.205 -24.121 30.264 1.00 72.01 C ATOM 0 H ILE A 109 -25.628 -26.285 27.030 1.00 0.41 H new ATOM 0 HA ILE A 109 -25.220 -23.609 26.096 1.00 41.44 H new ATOM 0 HB ILE A 109 -23.684 -25.193 28.198 1.00 74.01 H new ATOM 0 HG12 ILE A 109 -26.157 -23.448 28.477 1.00 24.13 H new ATOM 0 HG13 ILE A 109 -26.107 -25.191 28.653 1.00 24.13 H new ATOM 0 HG21 ILE A 109 -23.163 -22.969 29.119 1.00 33.41 H new ATOM 0 HG22 ILE A 109 -22.547 -23.153 27.460 1.00 33.41 H new ATOM 0 HG23 ILE A 109 -24.025 -22.207 27.761 1.00 33.41 H new ATOM 0 HD11 ILE A 109 -26.131 -24.089 30.838 1.00 72.01 H new ATOM 0 HD12 ILE A 109 -24.600 -24.965 30.597 1.00 72.01 H new ATOM 0 HD13 ILE A 109 -24.651 -23.195 30.418 1.00 72.01 H new ATOM 1670 N ASP A 110 -23.114 -25.958 25.301 1.00 31.42 N ATOM 1671 CA ASP A 110 -21.940 -26.281 24.499 1.00 61.40 C ATOM 1672 C ASP A 110 -22.205 -26.024 23.019 1.00 53.10 C ATOM 1673 O ASP A 110 -21.405 -25.384 22.337 1.00 63.12 O ATOM 1674 CB ASP A 110 -21.537 -27.741 24.711 1.00 22.51 C ATOM 1675 CG ASP A 110 -20.261 -27.878 25.518 1.00 64.41 C ATOM 1676 OD1 ASP A 110 -19.337 -27.063 25.311 1.00 60.42 O ATOM 1677 OD2 ASP A 110 -20.186 -28.800 26.357 1.00 3.10 O ATOM 0 H ASP A 110 -23.644 -26.770 25.618 1.00 31.42 H new ATOM 0 HA ASP A 110 -21.122 -25.636 24.821 1.00 61.40 H new ATOM 0 HB2 ASP A 110 -22.344 -28.267 25.221 1.00 22.51 H new ATOM 0 HB3 ASP A 110 -21.404 -28.223 23.742 1.00 22.51 H new ATOM 1682 N ARG A 111 -23.333 -26.527 22.529 1.00 35.30 N ATOM 1683 CA ARG A 111 -23.703 -26.354 21.129 1.00 12.45 C ATOM 1684 C ARG A 111 -23.820 -24.873 20.777 1.00 25.45 C ATOM 1685 O ARG A 111 -23.348 -24.436 19.727 1.00 31.33 O ATOM 1686 CB ARG A 111 -25.026 -27.064 20.837 1.00 13.25 C ATOM 1687 CG ARG A 111 -26.159 -26.643 21.759 1.00 35.41 C ATOM 1688 CD ARG A 111 -27.391 -27.513 21.561 1.00 62.44 C ATOM 1689 NE ARG A 111 -27.972 -27.344 20.231 1.00 21.44 N ATOM 1690 CZ ARG A 111 -29.132 -27.876 19.864 1.00 55.22 C ATOM 1691 NH1 ARG A 111 -29.832 -28.606 20.721 1.00 14.11 N ATOM 1692 NH2 ARG A 111 -29.595 -27.677 18.636 1.00 34.02 N ATOM 0 H ARG A 111 -24.007 -27.058 23.081 1.00 35.30 H new ATOM 0 HA ARG A 111 -22.918 -26.796 20.515 1.00 12.45 H new ATOM 0 HB2 ARG A 111 -25.315 -26.865 19.805 1.00 13.25 H new ATOM 0 HB3 ARG A 111 -24.878 -28.140 20.925 1.00 13.25 H new ATOM 0 HG2 ARG A 111 -25.829 -26.708 22.796 1.00 35.41 H new ATOM 0 HG3 ARG A 111 -26.414 -25.600 21.571 1.00 35.41 H new ATOM 0 HD2 ARG A 111 -27.124 -28.559 21.710 1.00 62.44 H new ATOM 0 HD3 ARG A 111 -28.136 -27.264 22.317 1.00 62.44 H new ATOM 0 HE ARG A 111 -27.459 -26.787 19.548 1.00 21.44 H new ATOM 0 HH11 ARG A 111 -29.480 -28.761 21.666 1.00 14.11 H new ATOM 0 HH12 ARG A 111 -30.723 -29.013 20.436 1.00 14.11 H new ATOM 0 HH21 ARG A 111 -29.060 -27.115 17.974 1.00 34.02 H new ATOM 0 HH22 ARG A 111 -30.486 -28.086 18.354 1.00 34.02 H new ATOM 1706 N ILE A 112 -24.450 -24.108 21.662 1.00 73.22 N ATOM 1707 CA ILE A 112 -24.628 -22.678 21.444 1.00 2.15 C ATOM 1708 C ILE A 112 -23.314 -21.927 21.628 1.00 45.42 C ATOM 1709 O ILE A 112 -23.065 -20.918 20.967 1.00 61.24 O ATOM 1710 CB ILE A 112 -25.680 -22.089 22.402 1.00 35.33 C ATOM 1711 CG1 ILE A 112 -27.055 -22.699 22.121 1.00 54.23 C ATOM 1712 CG2 ILE A 112 -25.729 -20.575 22.269 1.00 13.54 C ATOM 1713 CD1 ILE A 112 -27.557 -22.436 20.718 1.00 13.32 C ATOM 0 H ILE A 112 -24.845 -24.454 22.536 1.00 73.22 H new ATOM 0 HA ILE A 112 -24.974 -22.556 20.418 1.00 2.15 H new ATOM 0 HB ILE A 112 -25.396 -22.335 23.425 1.00 35.33 H new ATOM 0 HG12 ILE A 112 -27.006 -23.775 22.285 1.00 54.23 H new ATOM 0 HG13 ILE A 112 -27.774 -22.300 22.836 1.00 54.23 H new ATOM 0 HG21 ILE A 112 -26.477 -20.174 22.952 1.00 13.54 H new ATOM 0 HG22 ILE A 112 -24.753 -20.156 22.513 1.00 13.54 H new ATOM 0 HG23 ILE A 112 -25.992 -20.308 21.246 1.00 13.54 H new ATOM 0 HD11 ILE A 112 -28.536 -22.897 20.590 1.00 13.32 H new ATOM 0 HD12 ILE A 112 -27.638 -21.361 20.556 1.00 13.32 H new ATOM 0 HD13 ILE A 112 -26.859 -22.860 19.996 1.00 13.32 H new ATOM 1725 N PHE A 113 -22.474 -22.426 22.529 1.00 41.31 N ATOM 1726 CA PHE A 113 -21.184 -21.802 22.799 1.00 25.42 C ATOM 1727 C PHE A 113 -20.368 -21.663 21.517 1.00 24.33 C ATOM 1728 O PHE A 113 -20.006 -20.557 21.115 1.00 42.31 O ATOM 1729 CB PHE A 113 -20.402 -22.623 23.828 1.00 54.23 C ATOM 1730 CG PHE A 113 -18.959 -22.224 23.942 1.00 41.25 C ATOM 1731 CD1 PHE A 113 -17.996 -22.821 23.143 1.00 14.34 C ATOM 1732 CD2 PHE A 113 -18.564 -21.252 24.847 1.00 34.12 C ATOM 1733 CE1 PHE A 113 -16.667 -22.456 23.245 1.00 12.53 C ATOM 1734 CE2 PHE A 113 -17.237 -20.883 24.953 1.00 1.42 C ATOM 1735 CZ PHE A 113 -16.287 -21.486 24.152 1.00 1.13 C ATOM 0 H PHE A 113 -22.663 -23.260 23.084 1.00 41.31 H new ATOM 0 HA PHE A 113 -21.367 -20.806 23.202 1.00 25.42 H new ATOM 0 HB2 PHE A 113 -20.878 -22.517 24.803 1.00 54.23 H new ATOM 0 HB3 PHE A 113 -20.459 -23.678 23.558 1.00 54.23 H new ATOM 0 HD1 PHE A 113 -18.288 -23.580 22.433 1.00 14.34 H new ATOM 0 HD2 PHE A 113 -19.302 -20.777 25.477 1.00 34.12 H new ATOM 0 HE1 PHE A 113 -15.927 -22.928 22.616 1.00 12.53 H new ATOM 0 HE2 PHE A 113 -16.942 -20.123 25.662 1.00 1.42 H new ATOM 0 HZ PHE A 113 -15.249 -21.200 24.235 1.00 1.13 H new ATOM 1745 N LEU A 114 -20.081 -22.793 20.880 1.00 23.24 N ATOM 1746 CA LEU A 114 -19.307 -22.799 19.644 1.00 63.22 C ATOM 1747 C LEU A 114 -20.067 -22.098 18.522 1.00 22.33 C ATOM 1748 O LEU A 114 -19.466 -21.591 17.575 1.00 73.21 O ATOM 1749 CB LEU A 114 -18.977 -24.235 19.232 1.00 32.12 C ATOM 1750 CG LEU A 114 -20.048 -24.963 18.419 1.00 52.22 C ATOM 1751 CD1 LEU A 114 -19.777 -24.819 16.929 1.00 10.33 C ATOM 1752 CD2 LEU A 114 -20.110 -26.432 18.812 1.00 52.41 C ATOM 0 H LEU A 114 -20.373 -23.717 21.199 1.00 23.24 H new ATOM 0 HA LEU A 114 -18.379 -22.257 19.823 1.00 63.22 H new ATOM 0 HB2 LEU A 114 -18.055 -24.222 18.651 1.00 32.12 H new ATOM 0 HB3 LEU A 114 -18.778 -24.814 20.134 1.00 32.12 H new ATOM 0 HG LEU A 114 -21.014 -24.508 18.638 1.00 52.22 H new ATOM 0 HD11 LEU A 114 -20.549 -25.343 16.366 1.00 10.33 H new ATOM 0 HD12 LEU A 114 -19.785 -23.763 16.658 1.00 10.33 H new ATOM 0 HD13 LEU A 114 -18.803 -25.247 16.693 1.00 10.33 H new ATOM 0 HD21 LEU A 114 -20.878 -26.934 18.223 1.00 52.41 H new ATOM 0 HD22 LEU A 114 -19.144 -26.900 18.623 1.00 52.41 H new ATOM 0 HD23 LEU A 114 -20.353 -26.515 19.871 1.00 52.41 H new ATOM 1764 N TRP A 115 -21.390 -22.072 18.638 1.00 65.32 N ATOM 1765 CA TRP A 115 -22.232 -21.431 17.634 1.00 23.13 C ATOM 1766 C TRP A 115 -22.032 -19.920 17.642 1.00 54.54 C ATOM 1767 O TRP A 115 -22.229 -19.254 16.626 1.00 55.34 O ATOM 1768 CB TRP A 115 -23.703 -21.765 17.885 1.00 72.22 C ATOM 1769 CG TRP A 115 -24.302 -22.640 16.826 1.00 72.33 C ATOM 1770 CD1 TRP A 115 -24.879 -23.865 17.004 1.00 31.24 C ATOM 1771 CD2 TRP A 115 -24.381 -22.358 15.424 1.00 31.03 C ATOM 1772 NE1 TRP A 115 -25.312 -24.361 15.798 1.00 20.44 N ATOM 1773 CE2 TRP A 115 -25.019 -23.455 14.814 1.00 71.54 C ATOM 1774 CE3 TRP A 115 -23.977 -21.284 14.626 1.00 31.43 C ATOM 1775 CZ2 TRP A 115 -25.260 -23.508 13.443 1.00 24.12 C ATOM 1776 CZ3 TRP A 115 -24.216 -21.338 13.266 1.00 32.33 C ATOM 1777 CH2 TRP A 115 -24.853 -22.443 12.686 1.00 73.21 C ATOM 0 H TRP A 115 -21.902 -22.487 19.416 1.00 65.32 H new ATOM 0 HA TRP A 115 -21.942 -21.812 16.655 1.00 23.13 H new ATOM 0 HB2 TRP A 115 -23.796 -22.261 18.851 1.00 72.22 H new ATOM 0 HB3 TRP A 115 -24.273 -20.838 17.946 1.00 72.22 H new ATOM 0 HD1 TRP A 115 -24.980 -24.370 17.953 1.00 31.24 H new ATOM 0 HE1 TRP A 115 -25.776 -25.258 15.658 1.00 20.44 H new ATOM 0 HE3 TRP A 115 -23.487 -20.427 15.064 1.00 31.43 H new ATOM 0 HZ2 TRP A 115 -25.750 -24.359 12.994 1.00 24.12 H new ATOM 0 HZ3 TRP A 115 -23.907 -20.514 12.640 1.00 32.33 H new ATOM 0 HH2 TRP A 115 -25.026 -22.455 11.620 1.00 73.21 H new ATOM 1788 N MET A 116 -21.640 -19.384 18.793 1.00 34.21 N ATOM 1789 CA MET A 116 -21.413 -17.950 18.931 1.00 73.23 C ATOM 1790 C MET A 116 -20.069 -17.552 18.328 1.00 35.44 C ATOM 1791 O MET A 116 -19.985 -16.608 17.543 1.00 73.34 O ATOM 1792 CB MET A 116 -21.465 -17.543 20.404 1.00 34.04 C ATOM 1793 CG MET A 116 -22.356 -16.341 20.672 1.00 51.45 C ATOM 1794 SD MET A 116 -21.432 -14.910 21.265 1.00 75.21 S ATOM 1795 CE MET A 116 -20.125 -14.821 20.044 1.00 61.30 C ATOM 0 H MET A 116 -21.473 -19.921 19.644 1.00 34.21 H new ATOM 0 HA MET A 116 -22.203 -17.429 18.390 1.00 73.23 H new ATOM 0 HB2 MET A 116 -21.822 -18.388 20.993 1.00 34.04 H new ATOM 0 HB3 MET A 116 -20.455 -17.319 20.746 1.00 34.04 H new ATOM 0 HG2 MET A 116 -22.884 -16.074 19.757 1.00 51.45 H new ATOM 0 HG3 MET A 116 -23.112 -16.611 21.409 1.00 51.45 H new ATOM 0 HE1 MET A 116 -19.691 -13.821 20.048 1.00 61.30 H new ATOM 0 HE2 MET A 116 -19.353 -15.553 20.283 1.00 61.30 H new ATOM 0 HE3 MET A 116 -20.534 -15.035 19.057 1.00 61.30 H new ATOM 1805 N PHE A 117 -19.021 -18.278 18.702 1.00 63.02 N ATOM 1806 CA PHE A 117 -17.680 -18.000 18.199 1.00 14.42 C ATOM 1807 C PHE A 117 -17.675 -17.929 16.675 1.00 50.31 C ATOM 1808 O PHE A 117 -17.039 -17.054 16.086 1.00 25.41 O ATOM 1809 CB PHE A 117 -16.701 -19.075 18.674 1.00 1.34 C ATOM 1810 CG PHE A 117 -16.220 -18.868 20.082 1.00 12.42 C ATOM 1811 CD1 PHE A 117 -17.092 -18.992 21.152 1.00 73.34 C ATOM 1812 CD2 PHE A 117 -14.896 -18.548 20.336 1.00 12.51 C ATOM 1813 CE1 PHE A 117 -16.653 -18.803 22.448 1.00 11.34 C ATOM 1814 CE2 PHE A 117 -14.451 -18.357 21.631 1.00 72.23 C ATOM 1815 CZ PHE A 117 -15.331 -18.484 22.688 1.00 1.30 C ATOM 0 H PHE A 117 -19.074 -19.063 19.351 1.00 63.02 H new ATOM 0 HA PHE A 117 -17.365 -17.033 18.591 1.00 14.42 H new ATOM 0 HB2 PHE A 117 -17.182 -20.050 18.603 1.00 1.34 H new ATOM 0 HB3 PHE A 117 -15.841 -19.094 18.004 1.00 1.34 H new ATOM 0 HD1 PHE A 117 -18.127 -19.239 20.970 1.00 73.34 H new ATOM 0 HD2 PHE A 117 -14.204 -18.447 19.513 1.00 12.51 H new ATOM 0 HE1 PHE A 117 -17.343 -18.905 23.273 1.00 11.34 H new ATOM 0 HE2 PHE A 117 -13.416 -18.109 21.816 1.00 72.23 H new ATOM 0 HZ PHE A 117 -14.986 -18.334 23.700 1.00 1.30 H new ATOM 1825 N ILE A 118 -18.388 -18.855 16.043 1.00 0.11 N ATOM 1826 CA ILE A 118 -18.466 -18.898 14.588 1.00 10.52 C ATOM 1827 C ILE A 118 -19.445 -17.855 14.059 1.00 1.35 C ATOM 1828 O ILE A 118 -19.369 -17.450 12.899 1.00 73.01 O ATOM 1829 CB ILE A 118 -18.896 -20.289 14.088 1.00 32.20 C ATOM 1830 CG1 ILE A 118 -20.301 -20.624 14.592 1.00 75.40 C ATOM 1831 CG2 ILE A 118 -17.899 -21.346 14.540 1.00 15.11 C ATOM 1832 CD1 ILE A 118 -20.796 -21.982 14.144 1.00 11.04 C ATOM 0 H ILE A 118 -18.920 -19.586 16.516 1.00 0.11 H new ATOM 0 HA ILE A 118 -17.467 -18.679 14.212 1.00 10.52 H new ATOM 0 HB ILE A 118 -18.914 -20.278 12.998 1.00 32.20 H new ATOM 0 HG12 ILE A 118 -20.306 -20.586 15.681 1.00 75.40 H new ATOM 0 HG13 ILE A 118 -20.995 -19.860 14.243 1.00 75.40 H new ATOM 0 HG21 ILE A 118 -18.217 -22.324 14.179 1.00 15.11 H new ATOM 0 HG22 ILE A 118 -16.914 -21.113 14.137 1.00 15.11 H new ATOM 0 HG23 ILE A 118 -17.851 -21.359 15.629 1.00 15.11 H new ATOM 0 HD11 ILE A 118 -21.798 -22.152 14.538 1.00 11.04 H new ATOM 0 HD12 ILE A 118 -20.823 -22.018 13.055 1.00 11.04 H new ATOM 0 HD13 ILE A 118 -20.124 -22.755 14.516 1.00 11.04 H new ATOM 1844 N ILE A 119 -20.362 -17.423 14.919 1.00 44.53 N ATOM 1845 CA ILE A 119 -21.354 -16.424 14.539 1.00 65.32 C ATOM 1846 C ILE A 119 -20.711 -15.054 14.350 1.00 23.44 C ATOM 1847 O ILE A 119 -21.150 -14.259 13.520 1.00 72.23 O ATOM 1848 CB ILE A 119 -22.472 -16.314 15.591 1.00 14.52 C ATOM 1849 CG1 ILE A 119 -23.811 -16.752 14.993 1.00 43.53 C ATOM 1850 CG2 ILE A 119 -22.563 -14.890 16.120 1.00 11.10 C ATOM 1851 CD1 ILE A 119 -24.656 -17.573 15.940 1.00 35.13 C ATOM 0 H ILE A 119 -20.439 -17.749 15.883 1.00 44.53 H new ATOM 0 HA ILE A 119 -21.787 -16.752 13.594 1.00 65.32 H new ATOM 0 HB ILE A 119 -22.233 -16.976 16.423 1.00 14.52 H new ATOM 0 HG12 ILE A 119 -24.372 -15.867 14.692 1.00 43.53 H new ATOM 0 HG13 ILE A 119 -23.624 -17.333 14.090 1.00 43.53 H new ATOM 0 HG21 ILE A 119 -23.358 -14.828 16.863 1.00 11.10 H new ATOM 0 HG22 ILE A 119 -21.615 -14.611 16.579 1.00 11.10 H new ATOM 0 HG23 ILE A 119 -22.782 -14.209 15.297 1.00 11.10 H new ATOM 0 HD11 ILE A 119 -25.590 -17.848 15.449 1.00 35.13 H new ATOM 0 HD12 ILE A 119 -24.114 -18.476 16.221 1.00 35.13 H new ATOM 0 HD13 ILE A 119 -24.874 -16.988 16.833 1.00 35.13 H new ATOM 1863 N VAL A 120 -19.666 -14.785 15.127 1.00 65.54 N ATOM 1864 CA VAL A 120 -18.959 -13.513 15.044 1.00 52.32 C ATOM 1865 C VAL A 120 -17.900 -13.543 13.948 1.00 5.52 C ATOM 1866 O VAL A 120 -17.587 -12.515 13.345 1.00 64.41 O ATOM 1867 CB VAL A 120 -18.287 -13.155 16.383 1.00 75.40 C ATOM 1868 CG1 VAL A 120 -19.336 -12.883 17.451 1.00 71.04 C ATOM 1869 CG2 VAL A 120 -17.346 -14.268 16.820 1.00 53.31 C ATOM 0 H VAL A 120 -19.291 -15.431 15.821 1.00 65.54 H new ATOM 0 HA VAL A 120 -19.703 -12.753 14.805 1.00 52.32 H new ATOM 0 HB VAL A 120 -17.700 -12.247 16.244 1.00 75.40 H new ATOM 0 HG11 VAL A 120 -18.843 -12.632 18.390 1.00 71.04 H new ATOM 0 HG12 VAL A 120 -19.966 -12.051 17.138 1.00 71.04 H new ATOM 0 HG13 VAL A 120 -19.952 -13.772 17.591 1.00 71.04 H new ATOM 0 HG21 VAL A 120 -16.880 -13.999 17.768 1.00 53.31 H new ATOM 0 HG22 VAL A 120 -17.909 -15.193 16.942 1.00 53.31 H new ATOM 0 HG23 VAL A 120 -16.574 -14.410 16.063 1.00 53.31 H new ATOM 1879 N CYS A 121 -17.351 -14.726 13.696 1.00 41.43 N ATOM 1880 CA CYS A 121 -16.325 -14.890 12.672 1.00 51.11 C ATOM 1881 C CYS A 121 -16.879 -14.562 11.289 1.00 13.03 C ATOM 1882 O CYS A 121 -16.330 -13.726 10.570 1.00 23.34 O ATOM 1883 CB CYS A 121 -15.781 -16.319 12.691 1.00 44.04 C ATOM 1884 SG CYS A 121 -14.688 -16.674 14.087 1.00 62.34 S ATOM 0 H CYS A 121 -17.599 -15.585 14.186 1.00 41.43 H new ATOM 0 HA CYS A 121 -15.513 -14.197 12.892 1.00 51.11 H new ATOM 0 HB2 CYS A 121 -16.619 -17.015 12.714 1.00 44.04 H new ATOM 0 HB3 CYS A 121 -15.239 -16.502 11.763 1.00 44.04 H new ATOM 0 HG CYS A 121 -15.400 -16.871 15.157 1.00 62.34 H new ATOM 1890 N LEU A 122 -17.970 -15.226 10.922 1.00 23.02 N ATOM 1891 CA LEU A 122 -18.598 -15.007 9.624 1.00 15.33 C ATOM 1892 C LEU A 122 -19.222 -13.617 9.549 1.00 0.42 C ATOM 1893 O LEU A 122 -19.104 -12.925 8.537 1.00 64.23 O ATOM 1894 CB LEU A 122 -19.666 -16.072 9.366 1.00 1.51 C ATOM 1895 CG LEU A 122 -19.335 -17.107 8.291 1.00 43.13 C ATOM 1896 CD1 LEU A 122 -19.236 -16.445 6.925 1.00 71.30 C ATOM 1897 CD2 LEU A 122 -18.040 -17.832 8.629 1.00 52.21 C ATOM 0 H LEU A 122 -18.438 -15.920 11.505 1.00 23.02 H new ATOM 0 HA LEU A 122 -17.827 -15.081 8.857 1.00 15.33 H new ATOM 0 HB2 LEU A 122 -19.860 -16.598 10.301 1.00 1.51 H new ATOM 0 HB3 LEU A 122 -20.592 -15.569 9.085 1.00 1.51 H new ATOM 0 HG LEU A 122 -20.141 -17.840 8.259 1.00 43.13 H new ATOM 0 HD11 LEU A 122 -19.000 -17.197 6.172 1.00 71.30 H new ATOM 0 HD12 LEU A 122 -20.187 -15.973 6.680 1.00 71.30 H new ATOM 0 HD13 LEU A 122 -18.450 -15.690 6.943 1.00 71.30 H new ATOM 0 HD21 LEU A 122 -17.820 -18.565 7.853 1.00 52.21 H new ATOM 0 HD22 LEU A 122 -17.224 -17.111 8.689 1.00 52.21 H new ATOM 0 HD23 LEU A 122 -18.147 -18.340 9.588 1.00 52.21 H new ATOM 1909 N LEU A 123 -19.884 -13.212 10.627 1.00 33.13 N ATOM 1910 CA LEU A 123 -20.525 -11.903 10.685 1.00 0.22 C ATOM 1911 C LEU A 123 -19.503 -10.787 10.491 1.00 22.44 C ATOM 1912 O LEU A 123 -19.645 -9.948 9.603 1.00 34.22 O ATOM 1913 CB LEU A 123 -21.245 -11.724 12.023 1.00 4.11 C ATOM 1914 CG LEU A 123 -21.899 -10.362 12.257 1.00 43.34 C ATOM 1915 CD1 LEU A 123 -20.906 -9.393 12.880 1.00 41.32 C ATOM 1916 CD2 LEU A 123 -22.446 -9.802 10.952 1.00 44.05 C ATOM 0 H LEU A 123 -19.991 -13.771 11.473 1.00 33.13 H new ATOM 0 HA LEU A 123 -21.254 -11.847 9.877 1.00 0.22 H new ATOM 0 HB2 LEU A 123 -22.014 -12.492 12.105 1.00 4.11 H new ATOM 0 HB3 LEU A 123 -20.529 -11.903 12.825 1.00 4.11 H new ATOM 0 HG LEU A 123 -22.730 -10.494 12.950 1.00 43.34 H new ATOM 0 HD11 LEU A 123 -21.389 -8.429 13.039 1.00 41.32 H new ATOM 0 HD12 LEU A 123 -20.562 -9.789 13.836 1.00 41.32 H new ATOM 0 HD13 LEU A 123 -20.054 -9.266 12.212 1.00 41.32 H new ATOM 0 HD21 LEU A 123 -22.908 -8.832 11.137 1.00 44.05 H new ATOM 0 HD22 LEU A 123 -21.632 -9.685 10.237 1.00 44.05 H new ATOM 0 HD23 LEU A 123 -23.191 -10.487 10.546 1.00 44.05 H new ATOM 1928 N GLY A 124 -18.470 -10.786 11.328 1.00 23.25 N ATOM 1929 CA GLY A 124 -17.437 -9.771 11.231 1.00 14.13 C ATOM 1930 C GLY A 124 -16.860 -9.663 9.834 1.00 24.31 C ATOM 1931 O GLY A 124 -16.506 -8.574 9.382 1.00 50.23 O ATOM 0 H GLY A 124 -18.330 -11.470 12.072 1.00 23.25 H new ATOM 0 HA2 GLY A 124 -17.851 -8.807 11.525 1.00 14.13 H new ATOM 0 HA3 GLY A 124 -16.637 -10.003 11.934 1.00 14.13 H new ATOM 1935 N THR A 125 -16.761 -10.797 9.147 1.00 31.30 N ATOM 1936 CA THR A 125 -16.220 -10.827 7.794 1.00 5.33 C ATOM 1937 C THR A 125 -17.188 -10.195 6.801 1.00 62.45 C ATOM 1938 O THR A 125 -16.803 -9.343 6.000 1.00 54.30 O ATOM 1939 CB THR A 125 -15.907 -12.267 7.345 1.00 14.24 C ATOM 1940 OG1 THR A 125 -15.177 -12.952 8.369 1.00 11.32 O ATOM 1941 CG2 THR A 125 -15.103 -12.269 6.054 1.00 12.21 C ATOM 0 H THR A 125 -17.049 -11.707 9.506 1.00 31.30 H new ATOM 0 HA THR A 125 -15.294 -10.251 7.811 1.00 5.33 H new ATOM 0 HB THR A 125 -16.851 -12.782 7.167 1.00 14.24 H new ATOM 0 HG1 THR A 125 -15.798 -13.471 8.922 1.00 11.32 H new ATOM 0 HG21 THR A 125 -14.894 -13.297 5.757 1.00 12.21 H new ATOM 0 HG22 THR A 125 -15.674 -11.773 5.269 1.00 12.21 H new ATOM 0 HG23 THR A 125 -14.164 -11.738 6.210 1.00 12.21 H new ATOM 1949 N VAL A 126 -18.447 -10.619 6.857 1.00 4.32 N ATOM 1950 CA VAL A 126 -19.471 -10.093 5.963 1.00 40.02 C ATOM 1951 C VAL A 126 -19.603 -8.581 6.107 1.00 34.14 C ATOM 1952 O VAL A 126 -19.574 -7.848 5.120 1.00 3.42 O ATOM 1953 CB VAL A 126 -20.840 -10.745 6.232 1.00 20.35 C ATOM 1954 CG1 VAL A 126 -21.965 -9.854 5.729 1.00 61.04 C ATOM 1955 CG2 VAL A 126 -20.910 -12.122 5.588 1.00 0.44 C ATOM 0 H VAL A 126 -18.782 -11.325 7.512 1.00 4.32 H new ATOM 0 HA VAL A 126 -19.157 -10.332 4.947 1.00 40.02 H new ATOM 0 HB VAL A 126 -20.960 -10.866 7.309 1.00 20.35 H new ATOM 0 HG11 VAL A 126 -22.924 -10.332 5.928 1.00 61.04 H new ATOM 0 HG12 VAL A 126 -21.925 -8.893 6.242 1.00 61.04 H new ATOM 0 HG13 VAL A 126 -21.853 -9.698 4.656 1.00 61.04 H new ATOM 0 HG21 VAL A 126 -21.884 -12.568 5.788 1.00 0.44 H new ATOM 0 HG22 VAL A 126 -20.768 -12.028 4.511 1.00 0.44 H new ATOM 0 HG23 VAL A 126 -20.128 -12.758 6.003 1.00 0.44 H new ATOM 1965 N GLY A 127 -19.749 -8.121 7.346 1.00 13.14 N ATOM 1966 CA GLY A 127 -19.884 -6.698 7.598 1.00 23.02 C ATOM 1967 C GLY A 127 -18.646 -5.919 7.198 1.00 75.11 C ATOM 1968 O GLY A 127 -18.745 -4.814 6.664 1.00 55.45 O ATOM 0 H GLY A 127 -19.776 -8.708 8.180 1.00 13.14 H new ATOM 0 HA2 GLY A 127 -20.744 -6.315 7.049 1.00 23.02 H new ATOM 0 HA3 GLY A 127 -20.085 -6.537 8.657 1.00 23.02 H new ATOM 1972 N LEU A 128 -17.478 -6.494 7.457 1.00 24.35 N ATOM 1973 CA LEU A 128 -16.215 -5.846 7.122 1.00 5.10 C ATOM 1974 C LEU A 128 -16.087 -5.649 5.615 1.00 50.21 C ATOM 1975 O LEU A 128 -15.490 -4.676 5.154 1.00 51.33 O ATOM 1976 CB LEU A 128 -15.039 -6.676 7.641 1.00 60.05 C ATOM 1977 CG LEU A 128 -13.644 -6.129 7.334 1.00 33.20 C ATOM 1978 CD1 LEU A 128 -13.568 -4.647 7.665 1.00 45.23 C ATOM 1979 CD2 LEU A 128 -12.586 -6.905 8.105 1.00 50.02 C ATOM 0 H LEU A 128 -17.379 -7.408 7.898 1.00 24.35 H new ATOM 0 HA LEU A 128 -16.200 -4.867 7.601 1.00 5.10 H new ATOM 0 HB2 LEU A 128 -15.139 -6.775 8.722 1.00 60.05 H new ATOM 0 HB3 LEU A 128 -15.115 -7.679 7.221 1.00 60.05 H new ATOM 0 HG LEU A 128 -13.452 -6.253 6.268 1.00 33.20 H new ATOM 0 HD11 LEU A 128 -12.568 -4.275 7.440 1.00 45.23 H new ATOM 0 HD12 LEU A 128 -14.300 -4.103 7.069 1.00 45.23 H new ATOM 0 HD13 LEU A 128 -13.781 -4.499 8.724 1.00 45.23 H new ATOM 0 HD21 LEU A 128 -11.600 -6.503 7.875 1.00 50.02 H new ATOM 0 HD22 LEU A 128 -12.775 -6.813 9.175 1.00 50.02 H new ATOM 0 HD23 LEU A 128 -12.625 -7.956 7.819 1.00 50.02 H new ATOM 1991 N PHE A 129 -16.654 -6.578 4.852 1.00 44.31 N ATOM 1992 CA PHE A 129 -16.605 -6.506 3.396 1.00 5.42 C ATOM 1993 C PHE A 129 -17.667 -5.549 2.863 1.00 73.42 C ATOM 1994 O PHE A 129 -17.379 -4.679 2.040 1.00 32.11 O ATOM 1995 CB PHE A 129 -16.802 -7.896 2.789 1.00 53.13 C ATOM 1996 CG PHE A 129 -15.522 -8.545 2.348 1.00 64.21 C ATOM 1997 CD1 PHE A 129 -14.664 -9.117 3.274 1.00 13.53 C ATOM 1998 CD2 PHE A 129 -15.175 -8.584 1.007 1.00 43.51 C ATOM 1999 CE1 PHE A 129 -13.485 -9.715 2.872 1.00 32.11 C ATOM 2000 CE2 PHE A 129 -13.997 -9.181 0.599 1.00 72.03 C ATOM 2001 CZ PHE A 129 -13.151 -9.746 1.532 1.00 22.45 C ATOM 0 H PHE A 129 -17.153 -7.389 5.218 1.00 44.31 H new ATOM 0 HA PHE A 129 -15.624 -6.128 3.108 1.00 5.42 H new ATOM 0 HB2 PHE A 129 -17.291 -8.538 3.522 1.00 53.13 H new ATOM 0 HB3 PHE A 129 -17.474 -7.818 1.934 1.00 53.13 H new ATOM 0 HD1 PHE A 129 -14.920 -9.095 4.323 1.00 13.53 H new ATOM 0 HD2 PHE A 129 -15.832 -8.143 0.272 1.00 43.51 H new ATOM 0 HE1 PHE A 129 -12.826 -10.157 3.604 1.00 32.11 H new ATOM 0 HE2 PHE A 129 -13.739 -9.205 -0.449 1.00 72.03 H new ATOM 0 HZ PHE A 129 -12.230 -10.211 1.215 1.00 22.45 H new