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 50 THR OG1 : rot 70:sc= 0.878 USER MOD Set 1.2: A 78 MET CE :methyl 176:sc= -1.96 (180deg=-2.02) USER MOD Set 2.1: A 18 CYS SG : rot 150:sc= 1.14 USER MOD Set 2.2: A 73 TYR OH : rot -148:sc= 1.4 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=-0.0012) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 CYS SG : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 170:sc= -1.72 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 84:sc= 0.566 USER MOD Single : A 42 CYS SG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc=-0.00215 USER MOD Single : A 48 SER OG : rot -63:sc= 0.0753 USER MOD Single : A 57 THR OG1 : rot -60:sc= 1.24 USER MOD Single : A 69 SER OG : rot 12:sc= 0.698 USER MOD Single : A 77 THR OG1 : rot 171:sc= 0.86 USER MOD Single : A 82 THR OG1 : rot 79:sc= 0.959 USER MOD Single : A 84 SER OG : rot -127:sc= 1.44 USER MOD Single : A 88 THR OG1 : rot 98:sc= 1.24 USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 116 MET CE :methyl 165:sc= -2.97 (180deg=-4.62!) USER MOD Single : A 121 CYS SG : rot 82:sc= 0.146 USER MOD Single : A 125 THR OG1 : rot 77:sc= 1.19 USER MOD ----------------------------------------------------------------- ATOM 64 N LEU A 8 -6.803 -5.748 -1.860 1.00 32.32 N ATOM 65 CA LEU A 8 -7.770 -6.736 -1.393 1.00 11.10 C ATOM 66 C LEU A 8 -7.131 -8.117 -1.289 1.00 1.12 C ATOM 67 O LEU A 8 -7.468 -8.903 -0.404 1.00 30.44 O ATOM 68 CB LEU A 8 -8.972 -6.788 -2.338 1.00 12.34 C ATOM 69 CG LEU A 8 -10.295 -7.236 -1.716 1.00 15.51 C ATOM 70 CD1 LEU A 8 -10.211 -8.687 -1.268 1.00 40.54 C ATOM 71 CD2 LEU A 8 -10.667 -6.336 -0.546 1.00 41.54 C ATOM 0 HA LEU A 8 -8.108 -6.437 -0.401 1.00 11.10 H new ATOM 0 HB2 LEU A 8 -9.113 -5.797 -2.769 1.00 12.34 H new ATOM 0 HB3 LEU A 8 -8.733 -7.462 -3.161 1.00 12.34 H new ATOM 0 HG LEU A 8 -11.075 -7.155 -2.473 1.00 15.51 H new ATOM 0 HD11 LEU A 8 -11.162 -8.988 -0.828 1.00 40.54 H new ATOM 0 HD12 LEU A 8 -9.992 -9.321 -2.127 1.00 40.54 H new ATOM 0 HD13 LEU A 8 -9.419 -8.794 -0.527 1.00 40.54 H new ATOM 0 HD21 LEU A 8 -11.611 -6.670 -0.116 1.00 41.54 H new ATOM 0 HD22 LEU A 8 -9.886 -6.384 0.213 1.00 41.54 H new ATOM 0 HD23 LEU A 8 -10.771 -5.309 -0.896 1.00 41.54 H new ATOM 83 N PHE A 9 -6.205 -8.405 -2.197 1.00 42.44 N ATOM 84 CA PHE A 9 -5.517 -9.690 -2.207 1.00 62.32 C ATOM 85 C PHE A 9 -4.943 -10.010 -0.830 1.00 64.52 C ATOM 86 O PHE A 9 -4.850 -11.174 -0.439 1.00 71.44 O ATOM 87 CB PHE A 9 -4.398 -9.686 -3.251 1.00 4.15 C ATOM 88 CG PHE A 9 -3.178 -10.451 -2.824 1.00 63.52 C ATOM 89 CD1 PHE A 9 -3.129 -11.830 -2.953 1.00 23.10 C ATOM 90 CD2 PHE A 9 -2.080 -9.792 -2.294 1.00 71.42 C ATOM 91 CE1 PHE A 9 -2.007 -12.538 -2.562 1.00 15.30 C ATOM 92 CE2 PHE A 9 -0.956 -10.495 -1.902 1.00 12.51 C ATOM 93 CZ PHE A 9 -0.920 -11.869 -2.035 1.00 12.12 C ATOM 0 H PHE A 9 -5.914 -7.765 -2.936 1.00 42.44 H new ATOM 0 HA PHE A 9 -6.243 -10.461 -2.467 1.00 62.32 H new ATOM 0 HB2 PHE A 9 -4.777 -10.111 -4.180 1.00 4.15 H new ATOM 0 HB3 PHE A 9 -4.115 -8.655 -3.465 1.00 4.15 H new ATOM 0 HD1 PHE A 9 -3.977 -12.358 -3.364 1.00 23.10 H new ATOM 0 HD2 PHE A 9 -2.103 -8.718 -2.186 1.00 71.42 H new ATOM 0 HE1 PHE A 9 -1.981 -13.612 -2.669 1.00 15.30 H new ATOM 0 HE2 PHE A 9 -0.106 -9.970 -1.492 1.00 12.51 H new ATOM 0 HZ PHE A 9 -0.043 -12.419 -1.727 1.00 12.12 H new ATOM 103 N TYR A 10 -4.558 -8.970 -0.100 1.00 1.30 N ATOM 104 CA TYR A 10 -3.990 -9.139 1.232 1.00 2.12 C ATOM 105 C TYR A 10 -5.081 -9.439 2.255 1.00 22.45 C ATOM 106 O TYR A 10 -4.869 -10.196 3.204 1.00 3.31 O ATOM 107 CB TYR A 10 -3.220 -7.883 1.645 1.00 72.04 C ATOM 108 CG TYR A 10 -2.286 -8.102 2.814 1.00 54.45 C ATOM 109 CD1 TYR A 10 -1.467 -9.222 2.874 1.00 35.30 C ATOM 110 CD2 TYR A 10 -2.223 -7.187 3.857 1.00 4.53 C ATOM 111 CE1 TYR A 10 -0.614 -9.426 3.941 1.00 64.25 C ATOM 112 CE2 TYR A 10 -1.370 -7.382 4.927 1.00 15.51 C ATOM 113 CZ TYR A 10 -0.568 -8.503 4.964 1.00 35.14 C ATOM 114 OH TYR A 10 0.282 -8.702 6.028 1.00 51.12 O ATOM 0 H TYR A 10 -4.629 -8.000 -0.408 1.00 1.30 H new ATOM 0 HA TYR A 10 -3.303 -9.985 1.201 1.00 2.12 H new ATOM 0 HB2 TYR A 10 -2.643 -7.524 0.793 1.00 72.04 H new ATOM 0 HB3 TYR A 10 -3.932 -7.099 1.902 1.00 72.04 H new ATOM 0 HD1 TYR A 10 -1.498 -9.946 2.073 1.00 35.30 H new ATOM 0 HD2 TYR A 10 -2.851 -6.309 3.832 1.00 4.53 H new ATOM 0 HE1 TYR A 10 0.014 -10.304 3.974 1.00 64.25 H new ATOM 0 HE2 TYR A 10 -1.332 -6.660 5.730 1.00 15.51 H new ATOM 0 HH TYR A 10 0.193 -7.959 6.661 1.00 51.12 H new ATOM 124 N THR A 11 -6.251 -8.841 2.056 1.00 73.41 N ATOM 125 CA THR A 11 -7.377 -9.043 2.960 1.00 64.12 C ATOM 126 C THR A 11 -7.875 -10.483 2.904 1.00 10.35 C ATOM 127 O THR A 11 -8.361 -11.020 3.900 1.00 10.33 O ATOM 128 CB THR A 11 -8.543 -8.095 2.625 1.00 52.30 C ATOM 129 OG1 THR A 11 -8.332 -6.820 3.243 1.00 25.51 O ATOM 130 CG2 THR A 11 -9.867 -8.678 3.095 1.00 71.31 C ATOM 0 H THR A 11 -6.444 -8.212 1.276 1.00 73.41 H new ATOM 0 HA THR A 11 -7.018 -8.824 3.966 1.00 64.12 H new ATOM 0 HB THR A 11 -8.582 -7.972 1.543 1.00 52.30 H new ATOM 0 HG1 THR A 11 -9.077 -6.223 3.023 1.00 25.51 H new ATOM 0 HG21 THR A 11 -10.676 -7.990 2.847 1.00 71.31 H new ATOM 0 HG22 THR A 11 -10.039 -9.634 2.601 1.00 71.31 H new ATOM 0 HG23 THR A 11 -9.836 -8.828 4.174 1.00 71.31 H new ATOM 138 N ILE A 12 -7.751 -11.102 1.736 1.00 62.33 N ATOM 139 CA ILE A 12 -8.187 -12.481 1.552 1.00 14.23 C ATOM 140 C ILE A 12 -7.138 -13.462 2.064 1.00 74.44 C ATOM 141 O ILE A 12 -7.462 -14.580 2.463 1.00 60.12 O ATOM 142 CB ILE A 12 -8.481 -12.786 0.072 1.00 73.04 C ATOM 143 CG1 ILE A 12 -9.354 -11.685 -0.535 1.00 64.23 C ATOM 144 CG2 ILE A 12 -9.158 -14.142 -0.066 1.00 10.34 C ATOM 145 CD1 ILE A 12 -10.721 -11.578 0.102 1.00 12.32 C ATOM 0 H ILE A 12 -7.352 -10.671 0.902 1.00 62.33 H new ATOM 0 HA ILE A 12 -9.105 -12.601 2.128 1.00 14.23 H new ATOM 0 HB ILE A 12 -7.537 -12.816 -0.471 1.00 73.04 H new ATOM 0 HG12 ILE A 12 -8.840 -10.729 -0.436 1.00 64.23 H new ATOM 0 HG13 ILE A 12 -9.473 -11.874 -1.602 1.00 64.23 H new ATOM 0 HG21 ILE A 12 -9.359 -14.343 -1.118 1.00 10.34 H new ATOM 0 HG22 ILE A 12 -8.504 -14.917 0.333 1.00 10.34 H new ATOM 0 HG23 ILE A 12 -10.096 -14.138 0.489 1.00 10.34 H new ATOM 0 HD11 ILE A 12 -11.284 -10.778 -0.378 1.00 12.32 H new ATOM 0 HD12 ILE A 12 -11.254 -12.521 -0.020 1.00 12.32 H new ATOM 0 HD13 ILE A 12 -10.611 -11.358 1.164 1.00 12.32 H new ATOM 157 N ASN A 13 -5.880 -13.035 2.050 1.00 61.33 N ATOM 158 CA ASN A 13 -4.782 -13.876 2.513 1.00 32.33 C ATOM 159 C ASN A 13 -4.646 -13.805 4.031 1.00 30.12 C ATOM 160 O ASN A 13 -4.043 -14.681 4.653 1.00 13.13 O ATOM 161 CB ASN A 13 -3.470 -13.449 1.852 1.00 74.33 C ATOM 162 CG ASN A 13 -3.195 -14.211 0.570 1.00 63.12 C ATOM 163 OD1 ASN A 13 -4.063 -14.327 -0.296 1.00 3.15 O ATOM 164 ND2 ASN A 13 -1.981 -14.735 0.443 1.00 72.25 N ATOM 0 H ASN A 13 -5.595 -12.112 1.723 1.00 61.33 H new ATOM 0 HA ASN A 13 -5.003 -14.906 2.233 1.00 32.33 H new ATOM 0 HB2 ASN A 13 -3.505 -12.381 1.636 1.00 74.33 H new ATOM 0 HB3 ASN A 13 -2.647 -13.606 2.549 1.00 74.33 H new ATOM 0 HD21 ASN A 13 -1.737 -15.258 -0.398 1.00 72.25 H new ATOM 0 HD22 ASN A 13 -1.293 -14.614 1.186 1.00 72.25 H new ATOM 171 N LEU A 14 -5.210 -12.757 4.622 1.00 71.43 N ATOM 172 CA LEU A 14 -5.153 -12.571 6.067 1.00 21.35 C ATOM 173 C LEU A 14 -6.375 -13.185 6.744 1.00 5.53 C ATOM 174 O LEU A 14 -6.307 -13.616 7.896 1.00 52.13 O ATOM 175 CB LEU A 14 -5.061 -11.082 6.407 1.00 73.54 C ATOM 176 CG LEU A 14 -3.739 -10.396 6.064 1.00 24.10 C ATOM 177 CD1 LEU A 14 -3.846 -8.894 6.277 1.00 62.14 C ATOM 178 CD2 LEU A 14 -2.605 -10.975 6.899 1.00 75.25 C ATOM 0 H LEU A 14 -5.712 -12.023 4.122 1.00 71.43 H new ATOM 0 HA LEU A 14 -4.262 -13.077 6.439 1.00 21.35 H new ATOM 0 HB2 LEU A 14 -5.864 -10.561 5.886 1.00 73.54 H new ATOM 0 HB3 LEU A 14 -5.243 -10.962 7.475 1.00 73.54 H new ATOM 0 HG LEU A 14 -3.519 -10.579 5.012 1.00 24.10 H new ATOM 0 HD11 LEU A 14 -2.895 -8.423 6.028 1.00 62.14 H new ATOM 0 HD12 LEU A 14 -4.630 -8.491 5.636 1.00 62.14 H new ATOM 0 HD13 LEU A 14 -4.089 -8.691 7.320 1.00 62.14 H new ATOM 0 HD21 LEU A 14 -1.671 -10.475 6.641 1.00 75.25 H new ATOM 0 HD22 LEU A 14 -2.818 -10.823 7.957 1.00 75.25 H new ATOM 0 HD23 LEU A 14 -2.513 -12.042 6.697 1.00 75.25 H new ATOM 190 N ILE A 15 -7.489 -13.222 6.021 1.00 3.53 N ATOM 191 CA ILE A 15 -8.724 -13.785 6.551 1.00 31.10 C ATOM 192 C ILE A 15 -8.683 -15.309 6.538 1.00 71.44 C ATOM 193 O ILE A 15 -9.240 -15.963 7.420 1.00 23.05 O ATOM 194 CB ILE A 15 -9.950 -13.309 5.749 1.00 44.30 C ATOM 195 CG1 ILE A 15 -11.240 -13.807 6.403 1.00 22.12 C ATOM 196 CG2 ILE A 15 -9.859 -13.790 4.309 1.00 55.25 C ATOM 197 CD1 ILE A 15 -11.447 -13.283 7.807 1.00 51.01 C ATOM 0 H ILE A 15 -7.561 -12.869 5.067 1.00 3.53 H new ATOM 0 HA ILE A 15 -8.814 -13.435 7.579 1.00 31.10 H new ATOM 0 HB ILE A 15 -9.964 -12.219 5.747 1.00 44.30 H new ATOM 0 HG12 ILE A 15 -12.088 -13.512 5.785 1.00 22.12 H new ATOM 0 HG13 ILE A 15 -11.228 -14.897 6.429 1.00 22.12 H new ATOM 0 HG21 ILE A 15 -10.732 -13.446 3.755 1.00 55.25 H new ATOM 0 HG22 ILE A 15 -8.956 -13.390 3.848 1.00 55.25 H new ATOM 0 HG23 ILE A 15 -9.824 -14.879 4.291 1.00 55.25 H new ATOM 0 HD11 ILE A 15 -12.381 -13.677 8.208 1.00 51.01 H new ATOM 0 HD12 ILE A 15 -10.618 -13.600 8.440 1.00 51.01 H new ATOM 0 HD13 ILE A 15 -11.492 -12.194 7.786 1.00 51.01 H new ATOM 209 N ILE A 16 -8.019 -15.869 5.532 1.00 73.01 N ATOM 210 CA ILE A 16 -7.903 -17.316 5.406 1.00 71.55 C ATOM 211 C ILE A 16 -7.396 -17.942 6.700 1.00 21.42 C ATOM 212 O ILE A 16 -8.041 -18.806 7.296 1.00 44.13 O ATOM 213 CB ILE A 16 -6.957 -17.707 4.255 1.00 41.03 C ATOM 214 CG1 ILE A 16 -7.736 -17.829 2.944 1.00 54.03 C ATOM 215 CG2 ILE A 16 -6.242 -19.011 4.576 1.00 75.22 C ATOM 216 CD1 ILE A 16 -6.853 -18.016 1.730 1.00 25.35 C ATOM 0 H ILE A 16 -7.554 -15.342 4.793 1.00 73.01 H new ATOM 0 HA ILE A 16 -8.902 -17.694 5.189 1.00 71.55 H new ATOM 0 HB ILE A 16 -6.208 -16.924 4.139 1.00 41.03 H new ATOM 0 HG12 ILE A 16 -8.423 -18.672 3.016 1.00 54.03 H new ATOM 0 HG13 ILE A 16 -8.343 -16.934 2.807 1.00 54.03 H new ATOM 0 HG21 ILE A 16 -5.577 -19.274 3.753 1.00 75.22 H new ATOM 0 HG22 ILE A 16 -5.659 -18.891 5.489 1.00 75.22 H new ATOM 0 HG23 ILE A 16 -6.977 -19.804 4.716 1.00 75.22 H new ATOM 0 HD11 ILE A 16 -7.474 -18.095 0.837 1.00 25.35 H new ATOM 0 HD12 ILE A 16 -6.183 -17.162 1.632 1.00 25.35 H new ATOM 0 HD13 ILE A 16 -6.265 -18.927 1.845 1.00 25.35 H new ATOM 228 N PRO A 17 -6.213 -17.497 7.149 1.00 11.32 N ATOM 229 CA PRO A 17 -5.594 -17.998 8.380 1.00 42.32 C ATOM 230 C PRO A 17 -6.346 -17.554 9.630 1.00 71.13 C ATOM 231 O PRO A 17 -6.323 -18.237 10.654 1.00 13.15 O ATOM 232 CB PRO A 17 -4.194 -17.378 8.350 1.00 32.40 C ATOM 233 CG PRO A 17 -4.341 -16.150 7.520 1.00 31.10 C ATOM 234 CD PRO A 17 -5.390 -16.469 6.490 1.00 3.15 C ATOM 0 HA PRO A 17 -5.593 -19.087 8.421 1.00 42.32 H new ATOM 0 HB2 PRO A 17 -3.846 -17.137 9.355 1.00 32.40 H new ATOM 0 HB3 PRO A 17 -3.466 -18.064 7.916 1.00 32.40 H new ATOM 0 HG2 PRO A 17 -4.641 -15.299 8.132 1.00 31.10 H new ATOM 0 HG3 PRO A 17 -3.396 -15.884 7.046 1.00 31.10 H new ATOM 0 HD2 PRO A 17 -5.978 -15.589 6.230 1.00 3.15 H new ATOM 0 HD3 PRO A 17 -4.946 -16.841 5.566 1.00 3.15 H new ATOM 242 N CYS A 18 -7.012 -16.408 9.538 1.00 22.32 N ATOM 243 CA CYS A 18 -7.771 -15.873 10.663 1.00 75.53 C ATOM 244 C CYS A 18 -8.726 -16.923 11.223 1.00 62.24 C ATOM 245 O CYS A 18 -8.890 -17.044 12.437 1.00 11.34 O ATOM 246 CB CYS A 18 -8.555 -14.633 10.232 1.00 42.42 C ATOM 247 SG CYS A 18 -8.501 -13.275 11.424 1.00 1.44 S ATOM 0 H CYS A 18 -7.042 -15.832 8.697 1.00 22.32 H new ATOM 0 HA CYS A 18 -7.065 -15.595 11.446 1.00 75.53 H new ATOM 0 HB2 CYS A 18 -8.162 -14.281 9.278 1.00 42.42 H new ATOM 0 HB3 CYS A 18 -9.595 -14.914 10.064 1.00 42.42 H new ATOM 0 HG CYS A 18 -8.595 -12.141 10.795 1.00 1.44 H new ATOM 253 N LEU A 19 -9.354 -17.680 10.330 1.00 52.13 N ATOM 254 CA LEU A 19 -10.295 -18.719 10.734 1.00 25.41 C ATOM 255 C LEU A 19 -9.558 -19.992 11.141 1.00 40.34 C ATOM 256 O LEU A 19 -9.882 -20.613 12.154 1.00 52.14 O ATOM 257 CB LEU A 19 -11.270 -19.023 9.596 1.00 52.22 C ATOM 258 CG LEU A 19 -11.613 -17.851 8.675 1.00 12.03 C ATOM 259 CD1 LEU A 19 -12.670 -18.260 7.661 1.00 31.24 C ATOM 260 CD2 LEU A 19 -12.086 -16.655 9.488 1.00 13.15 C ATOM 0 H LEU A 19 -9.229 -17.594 9.321 1.00 52.13 H new ATOM 0 HA LEU A 19 -10.854 -18.353 11.595 1.00 25.41 H new ATOM 0 HB2 LEU A 19 -10.850 -19.825 8.989 1.00 52.22 H new ATOM 0 HB3 LEU A 19 -12.196 -19.402 10.029 1.00 52.22 H new ATOM 0 HG LEU A 19 -10.712 -17.564 8.133 1.00 12.03 H new ATOM 0 HD11 LEU A 19 -12.901 -17.413 7.015 1.00 31.24 H new ATOM 0 HD12 LEU A 19 -12.294 -19.086 7.057 1.00 31.24 H new ATOM 0 HD13 LEU A 19 -13.573 -18.574 8.184 1.00 31.24 H new ATOM 0 HD21 LEU A 19 -12.326 -15.830 8.817 1.00 13.15 H new ATOM 0 HD22 LEU A 19 -12.974 -16.930 10.057 1.00 13.15 H new ATOM 0 HD23 LEU A 19 -11.297 -16.347 10.174 1.00 13.15 H new ATOM 272 N LEU A 20 -8.564 -20.373 10.346 1.00 73.32 N ATOM 273 CA LEU A 20 -7.779 -21.571 10.624 1.00 50.13 C ATOM 274 C LEU A 20 -7.247 -21.554 12.053 1.00 14.13 C ATOM 275 O LEU A 20 -7.330 -22.553 12.768 1.00 0.15 O ATOM 276 CB LEU A 20 -6.616 -21.683 9.636 1.00 11.43 C ATOM 277 CG LEU A 20 -6.977 -22.144 8.224 1.00 62.21 C ATOM 278 CD1 LEU A 20 -5.798 -21.952 7.282 1.00 31.02 C ATOM 279 CD2 LEU A 20 -7.421 -23.600 8.236 1.00 42.45 C ATOM 0 H LEU A 20 -8.283 -19.870 9.504 1.00 73.32 H new ATOM 0 HA LEU A 20 -8.431 -22.437 10.509 1.00 50.13 H new ATOM 0 HB2 LEU A 20 -6.130 -20.710 9.566 1.00 11.43 H new ATOM 0 HB3 LEU A 20 -5.882 -22.377 10.047 1.00 11.43 H new ATOM 0 HG LEU A 20 -7.806 -21.535 7.864 1.00 62.21 H new ATOM 0 HD11 LEU A 20 -6.074 -22.286 6.282 1.00 31.02 H new ATOM 0 HD12 LEU A 20 -5.525 -20.897 7.251 1.00 31.02 H new ATOM 0 HD13 LEU A 20 -4.949 -22.536 7.638 1.00 31.02 H new ATOM 0 HD21 LEU A 20 -7.674 -23.912 7.223 1.00 42.45 H new ATOM 0 HD22 LEU A 20 -6.612 -24.224 8.616 1.00 42.45 H new ATOM 0 HD23 LEU A 20 -8.295 -23.709 8.878 1.00 42.45 H new ATOM 291 N ILE A 21 -6.704 -20.413 12.463 1.00 12.35 N ATOM 292 CA ILE A 21 -6.163 -20.265 13.809 1.00 64.24 C ATOM 293 C ILE A 21 -7.278 -20.188 14.845 1.00 14.41 C ATOM 294 O ILE A 21 -7.124 -20.653 15.974 1.00 11.44 O ATOM 295 CB ILE A 21 -5.280 -19.008 13.926 1.00 74.25 C ATOM 296 CG1 ILE A 21 -6.110 -17.750 13.662 1.00 40.13 C ATOM 297 CG2 ILE A 21 -4.110 -19.091 12.957 1.00 52.52 C ATOM 298 CD1 ILE A 21 -5.282 -16.560 13.231 1.00 1.52 C ATOM 0 H ILE A 21 -6.627 -19.578 11.883 1.00 12.35 H new ATOM 0 HA ILE A 21 -5.552 -21.147 14.002 1.00 64.24 H new ATOM 0 HB ILE A 21 -4.883 -18.953 14.940 1.00 74.25 H new ATOM 0 HG12 ILE A 21 -6.849 -17.967 12.890 1.00 40.13 H new ATOM 0 HG13 ILE A 21 -6.660 -17.491 14.566 1.00 40.13 H new ATOM 0 HG21 ILE A 21 -3.495 -18.196 13.051 1.00 52.52 H new ATOM 0 HG22 ILE A 21 -3.508 -19.970 13.187 1.00 52.52 H new ATOM 0 HG23 ILE A 21 -4.487 -19.166 11.937 1.00 52.52 H new ATOM 0 HD11 ILE A 21 -5.936 -15.704 13.061 1.00 1.52 H new ATOM 0 HD12 ILE A 21 -4.561 -16.317 14.011 1.00 1.52 H new ATOM 0 HD13 ILE A 21 -4.752 -16.800 12.309 1.00 1.52 H new ATOM 310 N SER A 22 -8.403 -19.598 14.453 1.00 74.34 N ATOM 311 CA SER A 22 -9.546 -19.458 15.348 1.00 5.12 C ATOM 312 C SER A 22 -10.139 -20.821 15.689 1.00 75.31 C ATOM 313 O SER A 22 -10.216 -21.203 16.857 1.00 3.14 O ATOM 314 CB SER A 22 -10.614 -18.568 14.710 1.00 33.34 C ATOM 315 OG SER A 22 -11.601 -18.198 15.657 1.00 35.33 O ATOM 0 H SER A 22 -8.547 -19.209 13.521 1.00 74.34 H new ATOM 0 HA SER A 22 -9.199 -18.992 16.270 1.00 5.12 H new ATOM 0 HB2 SER A 22 -10.148 -17.673 14.298 1.00 33.34 H new ATOM 0 HB3 SER A 22 -11.082 -19.095 13.879 1.00 33.34 H new ATOM 0 HG SER A 22 -12.271 -17.628 15.225 1.00 35.33 H new ATOM 321 N CYS A 23 -10.559 -21.550 14.661 1.00 62.33 N ATOM 322 CA CYS A 23 -11.147 -22.872 14.850 1.00 51.43 C ATOM 323 C CYS A 23 -10.195 -23.787 15.612 1.00 2.24 C ATOM 324 O CYS A 23 -10.622 -24.603 16.430 1.00 73.11 O ATOM 325 CB CYS A 23 -11.499 -23.494 13.498 1.00 61.22 C ATOM 326 SG CYS A 23 -12.861 -22.672 12.638 1.00 4.34 S ATOM 0 H CYS A 23 -10.503 -21.248 13.688 1.00 62.33 H new ATOM 0 HA CYS A 23 -12.058 -22.757 15.437 1.00 51.43 H new ATOM 0 HB2 CYS A 23 -10.616 -23.473 12.860 1.00 61.22 H new ATOM 0 HB3 CYS A 23 -11.759 -24.542 13.649 1.00 61.22 H new ATOM 0 HG CYS A 23 -13.082 -23.269 11.505 1.00 4.34 H new ATOM 332 N LEU A 24 -8.902 -23.647 15.339 1.00 54.21 N ATOM 333 CA LEU A 24 -7.888 -24.462 15.998 1.00 32.22 C ATOM 334 C LEU A 24 -8.048 -24.410 17.514 1.00 11.42 C ATOM 335 O LEU A 24 -8.099 -25.444 18.181 1.00 40.11 O ATOM 336 CB LEU A 24 -6.488 -23.987 15.605 1.00 55.12 C ATOM 337 CG LEU A 24 -5.540 -25.061 15.072 1.00 61.31 C ATOM 338 CD1 LEU A 24 -5.905 -25.435 13.644 1.00 70.03 C ATOM 339 CD2 LEU A 24 -4.097 -24.584 15.148 1.00 41.01 C ATOM 0 H LEU A 24 -8.531 -22.976 14.666 1.00 54.21 H new ATOM 0 HA LEU A 24 -8.019 -25.494 15.672 1.00 32.22 H new ATOM 0 HB2 LEU A 24 -6.589 -23.211 14.846 1.00 55.12 H new ATOM 0 HB3 LEU A 24 -6.026 -23.523 16.476 1.00 55.12 H new ATOM 0 HG LEU A 24 -5.642 -25.949 15.695 1.00 61.31 H new ATOM 0 HD11 LEU A 24 -5.219 -26.201 13.282 1.00 70.03 H new ATOM 0 HD12 LEU A 24 -6.925 -25.819 13.618 1.00 70.03 H new ATOM 0 HD13 LEU A 24 -5.833 -24.553 13.007 1.00 70.03 H new ATOM 0 HD21 LEU A 24 -3.436 -25.361 14.764 1.00 41.01 H new ATOM 0 HD22 LEU A 24 -3.980 -23.681 14.549 1.00 41.01 H new ATOM 0 HD23 LEU A 24 -3.839 -24.368 16.185 1.00 41.01 H new ATOM 351 N THR A 25 -8.129 -23.197 18.054 1.00 31.40 N ATOM 352 CA THR A 25 -8.284 -23.009 19.491 1.00 74.31 C ATOM 353 C THR A 25 -9.507 -23.754 20.014 1.00 73.11 C ATOM 354 O THR A 25 -9.429 -24.476 21.008 1.00 0.43 O ATOM 355 CB THR A 25 -8.413 -21.517 19.852 1.00 60.35 C ATOM 356 OG1 THR A 25 -7.510 -20.741 19.056 1.00 72.33 O ATOM 357 CG2 THR A 25 -8.120 -21.290 21.327 1.00 72.01 C ATOM 0 H THR A 25 -8.090 -22.331 17.517 1.00 31.40 H new ATOM 0 HA THR A 25 -7.387 -23.413 19.961 1.00 74.31 H new ATOM 0 HB THR A 25 -9.437 -21.204 19.649 1.00 60.35 H new ATOM 0 HG1 THR A 25 -7.708 -19.788 19.172 1.00 72.33 H new ATOM 0 HG21 THR A 25 -8.217 -20.229 21.558 1.00 72.01 H new ATOM 0 HG22 THR A 25 -8.827 -21.859 21.930 1.00 72.01 H new ATOM 0 HG23 THR A 25 -7.105 -21.619 21.551 1.00 72.01 H new ATOM 365 N VAL A 26 -10.637 -23.575 19.337 1.00 35.33 N ATOM 366 CA VAL A 26 -11.877 -24.232 19.733 1.00 74.40 C ATOM 367 C VAL A 26 -11.774 -25.745 19.571 1.00 3.25 C ATOM 368 O VAL A 26 -12.472 -26.502 20.247 1.00 10.11 O ATOM 369 CB VAL A 26 -13.072 -23.720 18.908 1.00 55.25 C ATOM 370 CG1 VAL A 26 -14.366 -24.362 19.385 1.00 51.11 C ATOM 371 CG2 VAL A 26 -13.161 -22.203 18.984 1.00 64.02 C ATOM 0 H VAL A 26 -10.719 -22.981 18.512 1.00 35.33 H new ATOM 0 HA VAL A 26 -12.040 -23.992 20.784 1.00 74.40 H new ATOM 0 HB VAL A 26 -12.918 -24.001 17.866 1.00 55.25 H new ATOM 0 HG11 VAL A 26 -15.199 -23.988 18.790 1.00 51.11 H new ATOM 0 HG12 VAL A 26 -14.298 -25.444 19.274 1.00 51.11 H new ATOM 0 HG13 VAL A 26 -14.530 -24.115 20.434 1.00 51.11 H new ATOM 0 HG21 VAL A 26 -14.011 -21.858 18.395 1.00 64.02 H new ATOM 0 HG22 VAL A 26 -13.291 -21.898 20.022 1.00 64.02 H new ATOM 0 HG23 VAL A 26 -12.245 -21.765 18.589 1.00 64.02 H new ATOM 381 N LEU A 27 -10.898 -26.179 18.672 1.00 24.44 N ATOM 382 CA LEU A 27 -10.701 -27.603 18.422 1.00 51.05 C ATOM 383 C LEU A 27 -10.252 -28.322 19.689 1.00 21.43 C ATOM 384 O LEU A 27 -10.919 -29.242 20.163 1.00 22.32 O ATOM 385 CB LEU A 27 -9.668 -27.808 17.312 1.00 0.41 C ATOM 386 CG LEU A 27 -9.847 -29.058 16.450 1.00 12.23 C ATOM 387 CD1 LEU A 27 -9.890 -30.304 17.320 1.00 35.35 C ATOM 388 CD2 LEU A 27 -11.110 -28.949 15.609 1.00 53.35 C ATOM 0 H LEU A 27 -10.313 -25.566 18.104 1.00 24.44 H new ATOM 0 HA LEU A 27 -11.654 -28.026 18.106 1.00 51.05 H new ATOM 0 HB2 LEU A 27 -9.688 -26.935 16.659 1.00 0.41 H new ATOM 0 HB3 LEU A 27 -8.678 -27.844 17.767 1.00 0.41 H new ATOM 0 HG LEU A 27 -8.993 -29.138 15.778 1.00 12.23 H new ATOM 0 HD11 LEU A 27 -10.018 -31.184 16.689 1.00 35.35 H new ATOM 0 HD12 LEU A 27 -8.958 -30.390 17.878 1.00 35.35 H new ATOM 0 HD13 LEU A 27 -10.725 -30.233 18.017 1.00 35.35 H new ATOM 0 HD21 LEU A 27 -11.221 -29.847 15.002 1.00 53.35 H new ATOM 0 HD22 LEU A 27 -11.975 -28.844 16.264 1.00 53.35 H new ATOM 0 HD23 LEU A 27 -11.040 -28.078 14.958 1.00 53.35 H new ATOM 400 N VAL A 28 -9.118 -27.896 20.236 1.00 44.45 N ATOM 401 CA VAL A 28 -8.581 -28.497 21.451 1.00 44.55 C ATOM 402 C VAL A 28 -9.519 -28.279 22.632 1.00 30.32 C ATOM 403 O VAL A 28 -9.504 -29.042 23.599 1.00 54.31 O ATOM 404 CB VAL A 28 -7.195 -27.920 21.797 1.00 61.02 C ATOM 405 CG1 VAL A 28 -7.336 -26.656 22.631 1.00 24.35 C ATOM 406 CG2 VAL A 28 -6.353 -28.958 22.523 1.00 0.14 C ATOM 0 H VAL A 28 -8.553 -27.136 19.857 1.00 44.45 H new ATOM 0 HA VAL A 28 -8.484 -29.566 21.260 1.00 44.55 H new ATOM 0 HB VAL A 28 -6.687 -27.658 20.869 1.00 61.02 H new ATOM 0 HG11 VAL A 28 -6.347 -26.263 22.866 1.00 24.35 H new ATOM 0 HG12 VAL A 28 -7.899 -25.910 22.069 1.00 24.35 H new ATOM 0 HG13 VAL A 28 -7.863 -26.888 23.556 1.00 24.35 H new ATOM 0 HG21 VAL A 28 -5.377 -28.534 22.760 1.00 0.14 H new ATOM 0 HG22 VAL A 28 -6.854 -29.253 23.445 1.00 0.14 H new ATOM 0 HG23 VAL A 28 -6.223 -29.832 21.885 1.00 0.14 H new ATOM 416 N PHE A 29 -10.335 -27.234 22.548 1.00 34.10 N ATOM 417 CA PHE A 29 -11.282 -26.915 23.611 1.00 65.41 C ATOM 418 C PHE A 29 -12.510 -27.816 23.533 1.00 35.54 C ATOM 419 O PHE A 29 -13.315 -27.869 24.464 1.00 60.10 O ATOM 420 CB PHE A 29 -11.705 -25.448 23.523 1.00 41.33 C ATOM 421 CG PHE A 29 -10.937 -24.546 24.446 1.00 43.32 C ATOM 422 CD1 PHE A 29 -9.610 -24.239 24.190 1.00 0.44 C ATOM 423 CD2 PHE A 29 -11.541 -24.005 25.569 1.00 32.24 C ATOM 424 CE1 PHE A 29 -8.900 -23.409 25.038 1.00 52.43 C ATOM 425 CE2 PHE A 29 -10.837 -23.174 26.420 1.00 62.31 C ATOM 426 CZ PHE A 29 -9.514 -22.877 26.154 1.00 13.45 C ATOM 0 H PHE A 29 -10.360 -26.593 21.755 1.00 34.10 H new ATOM 0 HA PHE A 29 -10.788 -27.086 24.567 1.00 65.41 H new ATOM 0 HB2 PHE A 29 -11.575 -25.102 22.498 1.00 41.33 H new ATOM 0 HB3 PHE A 29 -12.768 -25.370 23.753 1.00 41.33 H new ATOM 0 HD1 PHE A 29 -9.125 -24.653 23.318 1.00 0.44 H new ATOM 0 HD2 PHE A 29 -12.574 -24.235 25.782 1.00 32.24 H new ATOM 0 HE1 PHE A 29 -7.866 -23.177 24.827 1.00 52.43 H new ATOM 0 HE2 PHE A 29 -11.320 -22.757 27.291 1.00 62.31 H new ATOM 0 HZ PHE A 29 -8.961 -22.229 26.818 1.00 13.45 H new ATOM 436 N TYR A 30 -12.649 -28.523 22.417 1.00 23.32 N ATOM 437 CA TYR A 30 -13.781 -29.420 22.216 1.00 65.04 C ATOM 438 C TYR A 30 -13.461 -30.823 22.723 1.00 71.02 C ATOM 439 O TYR A 30 -14.188 -31.379 23.547 1.00 13.21 O ATOM 440 CB TYR A 30 -14.157 -29.475 20.734 1.00 13.31 C ATOM 441 CG TYR A 30 -15.466 -30.183 20.468 1.00 71.31 C ATOM 442 CD1 TYR A 30 -15.513 -31.563 20.314 1.00 32.34 C ATOM 443 CD2 TYR A 30 -16.656 -29.472 20.371 1.00 71.41 C ATOM 444 CE1 TYR A 30 -16.707 -32.215 20.070 1.00 2.53 C ATOM 445 CE2 TYR A 30 -17.855 -30.115 20.129 1.00 64.55 C ATOM 446 CZ TYR A 30 -17.875 -31.486 19.978 1.00 23.45 C ATOM 447 OH TYR A 30 -19.066 -32.132 19.737 1.00 42.42 O ATOM 0 H TYR A 30 -11.992 -28.492 21.638 1.00 23.32 H new ATOM 0 HA TYR A 30 -14.626 -29.032 22.785 1.00 65.04 H new ATOM 0 HB2 TYR A 30 -14.218 -28.459 20.345 1.00 13.31 H new ATOM 0 HB3 TYR A 30 -13.362 -29.980 20.185 1.00 13.31 H new ATOM 0 HD1 TYR A 30 -14.601 -32.136 20.386 1.00 32.34 H new ATOM 0 HD2 TYR A 30 -16.644 -28.398 20.487 1.00 71.41 H new ATOM 0 HE1 TYR A 30 -16.726 -33.288 19.952 1.00 2.53 H new ATOM 0 HE2 TYR A 30 -18.771 -29.547 20.058 1.00 64.55 H new ATOM 0 HH TYR A 30 -19.793 -31.476 19.702 1.00 42.42 H new ATOM 457 N LEU A 31 -12.368 -31.390 22.225 1.00 60.23 N ATOM 458 CA LEU A 31 -11.950 -32.729 22.627 1.00 45.34 C ATOM 459 C LEU A 31 -10.487 -32.735 23.058 1.00 23.15 C ATOM 460 O LEU A 31 -9.611 -33.250 22.363 1.00 22.11 O ATOM 461 CB LEU A 31 -12.158 -33.716 21.477 1.00 31.21 C ATOM 462 CG LEU A 31 -11.926 -35.191 21.809 1.00 53.22 C ATOM 463 CD1 LEU A 31 -13.111 -35.758 22.576 1.00 63.02 C ATOM 464 CD2 LEU A 31 -11.679 -35.991 20.538 1.00 1.31 C ATOM 0 H LEU A 31 -11.755 -30.944 21.542 1.00 60.23 H new ATOM 0 HA LEU A 31 -12.562 -33.035 23.476 1.00 45.34 H new ATOM 0 HB2 LEU A 31 -13.177 -33.603 21.108 1.00 31.21 H new ATOM 0 HB3 LEU A 31 -11.491 -33.438 20.661 1.00 31.21 H new ATOM 0 HG LEU A 31 -11.041 -35.267 22.440 1.00 53.22 H new ATOM 0 HD11 LEU A 31 -12.928 -36.808 22.804 1.00 63.02 H new ATOM 0 HD12 LEU A 31 -13.242 -35.203 23.505 1.00 63.02 H new ATOM 0 HD13 LEU A 31 -14.013 -35.670 21.970 1.00 63.02 H new ATOM 0 HD21 LEU A 31 -11.516 -37.038 20.793 1.00 1.31 H new ATOM 0 HD22 LEU A 31 -12.545 -35.908 19.882 1.00 1.31 H new ATOM 0 HD23 LEU A 31 -10.799 -35.601 20.028 1.00 1.31 H new ATOM 476 N PRO A 32 -10.214 -32.152 24.235 1.00 12.40 N ATOM 477 CA PRO A 32 -8.858 -32.079 24.788 1.00 74.43 C ATOM 478 C PRO A 32 -8.340 -33.443 25.233 1.00 55.12 C ATOM 479 O PRO A 32 -9.013 -34.162 25.972 1.00 41.13 O ATOM 480 CB PRO A 32 -9.015 -31.148 25.992 1.00 14.12 C ATOM 481 CG PRO A 32 -10.445 -31.281 26.390 1.00 1.11 C ATOM 482 CD PRO A 32 -11.209 -31.518 25.117 1.00 42.33 C ATOM 0 HA PRO A 32 -8.136 -31.727 24.051 1.00 74.43 H new ATOM 0 HB2 PRO A 32 -8.349 -31.437 26.805 1.00 14.12 H new ATOM 0 HB3 PRO A 32 -8.771 -30.118 25.731 1.00 14.12 H new ATOM 0 HG2 PRO A 32 -10.581 -32.108 27.086 1.00 1.11 H new ATOM 0 HG3 PRO A 32 -10.795 -30.380 26.893 1.00 1.11 H new ATOM 0 HD2 PRO A 32 -12.071 -32.165 25.280 1.00 42.33 H new ATOM 0 HD3 PRO A 32 -11.585 -30.586 24.694 1.00 42.33 H new ATOM 490 N SER A 33 -7.141 -33.792 24.779 1.00 71.34 N ATOM 491 CA SER A 33 -6.534 -35.072 25.128 1.00 54.53 C ATOM 492 C SER A 33 -5.678 -34.942 26.384 1.00 54.11 C ATOM 493 O SER A 33 -5.795 -35.741 27.312 1.00 60.51 O ATOM 494 CB SER A 33 -5.682 -35.589 23.967 1.00 34.54 C ATOM 495 OG SER A 33 -6.445 -35.683 22.777 1.00 70.03 O ATOM 0 H SER A 33 -6.570 -33.207 24.169 1.00 71.34 H new ATOM 0 HA SER A 33 -7.335 -35.784 25.327 1.00 54.53 H new ATOM 0 HB2 SER A 33 -4.835 -34.922 23.808 1.00 34.54 H new ATOM 0 HB3 SER A 33 -5.274 -36.568 24.219 1.00 34.54 H new ATOM 0 HG SER A 33 -5.877 -36.014 22.050 1.00 70.03 H new ATOM 501 N GLU A 34 -4.818 -33.928 26.404 1.00 33.44 N ATOM 502 CA GLU A 34 -3.942 -33.694 27.546 1.00 21.20 C ATOM 503 C GLU A 34 -4.372 -32.449 28.316 1.00 54.00 C ATOM 504 O GLU A 34 -5.206 -31.673 27.846 1.00 24.03 O ATOM 505 CB GLU A 34 -2.492 -33.544 27.082 1.00 63.04 C ATOM 506 CG GLU A 34 -1.741 -34.862 26.993 1.00 74.32 C ATOM 507 CD GLU A 34 -0.298 -34.743 27.440 1.00 24.14 C ATOM 508 OE1 GLU A 34 0.303 -33.669 27.229 1.00 62.25 O ATOM 509 OE2 GLU A 34 0.231 -35.725 28.003 1.00 3.32 O ATOM 0 H GLU A 34 -4.709 -33.257 25.644 1.00 33.44 H new ATOM 0 HA GLU A 34 -4.017 -34.555 28.211 1.00 21.20 H new ATOM 0 HB2 GLU A 34 -2.480 -33.062 26.104 1.00 63.04 H new ATOM 0 HB3 GLU A 34 -1.966 -32.882 27.770 1.00 63.04 H new ATOM 0 HG2 GLU A 34 -2.247 -35.606 27.607 1.00 74.32 H new ATOM 0 HG3 GLU A 34 -1.770 -35.224 25.965 1.00 74.32 H new ATOM 516 N CYS A 35 -3.799 -32.266 29.500 1.00 14.42 N ATOM 517 CA CYS A 35 -4.124 -31.116 30.337 1.00 52.21 C ATOM 518 C CYS A 35 -3.095 -30.005 30.158 1.00 44.12 C ATOM 519 O CYS A 35 -3.295 -28.879 30.612 1.00 32.42 O ATOM 520 CB CYS A 35 -4.193 -31.532 31.807 1.00 0.30 C ATOM 521 SG CYS A 35 -5.118 -33.057 32.100 1.00 34.20 S ATOM 0 H CYS A 35 -3.107 -32.899 29.902 1.00 14.42 H new ATOM 0 HA CYS A 35 -5.098 -30.737 30.028 1.00 52.21 H new ATOM 0 HB2 CYS A 35 -3.179 -31.656 32.186 1.00 0.30 H new ATOM 0 HB3 CYS A 35 -4.651 -30.726 32.380 1.00 0.30 H new ATOM 0 HG CYS A 35 -5.118 -33.327 33.372 1.00 34.20 H new ATOM 527 N GLY A 36 -1.990 -30.330 29.493 1.00 21.21 N ATOM 528 CA GLY A 36 -0.944 -29.350 29.267 1.00 11.33 C ATOM 529 C GLY A 36 -1.004 -28.748 27.877 1.00 23.22 C ATOM 530 O GLY A 36 -0.766 -27.554 27.701 1.00 45.13 O ATOM 0 H GLY A 36 -1.801 -31.255 29.107 1.00 21.21 H new ATOM 0 HA2 GLY A 36 -1.029 -28.555 30.008 1.00 11.33 H new ATOM 0 HA3 GLY A 36 0.028 -29.820 29.414 1.00 11.33 H new ATOM 534 N GLU A 37 -1.321 -29.578 26.888 1.00 0.31 N ATOM 535 CA GLU A 37 -1.408 -29.120 25.506 1.00 12.14 C ATOM 536 C GLU A 37 -2.580 -28.160 25.324 1.00 12.23 C ATOM 537 O GLU A 37 -2.582 -27.329 24.415 1.00 34.52 O ATOM 538 CB GLU A 37 -1.559 -30.312 24.559 1.00 34.13 C ATOM 539 CG GLU A 37 -0.333 -30.565 23.698 1.00 13.22 C ATOM 540 CD GLU A 37 0.767 -31.291 24.448 1.00 35.10 C ATOM 541 OE1 GLU A 37 1.389 -30.670 25.335 1.00 44.14 O ATOM 542 OE2 GLU A 37 1.005 -32.480 24.149 1.00 54.35 O ATOM 0 H GLU A 37 -1.522 -30.570 27.018 1.00 0.31 H new ATOM 0 HA GLU A 37 -0.486 -28.590 25.267 1.00 12.14 H new ATOM 0 HB2 GLU A 37 -1.772 -31.206 25.145 1.00 34.13 H new ATOM 0 HB3 GLU A 37 -2.419 -30.144 23.911 1.00 34.13 H new ATOM 0 HG2 GLU A 37 -0.621 -31.152 22.826 1.00 13.22 H new ATOM 0 HG3 GLU A 37 0.050 -29.613 23.330 1.00 13.22 H new ATOM 549 N LYS A 38 -3.576 -28.280 26.195 1.00 14.22 N ATOM 550 CA LYS A 38 -4.755 -27.424 26.133 1.00 10.41 C ATOM 551 C LYS A 38 -4.370 -25.956 26.285 1.00 2.44 C ATOM 552 O LYS A 38 -4.644 -25.138 25.406 1.00 23.21 O ATOM 553 CB LYS A 38 -5.754 -27.816 27.224 1.00 4.34 C ATOM 554 CG LYS A 38 -7.196 -27.493 26.873 1.00 22.54 C ATOM 555 CD LYS A 38 -8.165 -28.406 27.605 1.00 32.53 C ATOM 556 CE LYS A 38 -8.491 -27.876 28.993 1.00 52.31 C ATOM 557 NZ LYS A 38 -9.622 -28.616 29.618 1.00 11.32 N ATOM 0 H LYS A 38 -3.590 -28.962 26.953 1.00 14.22 H new ATOM 0 HA LYS A 38 -5.221 -27.560 25.157 1.00 10.41 H new ATOM 0 HB2 LYS A 38 -5.667 -28.885 27.418 1.00 4.34 H new ATOM 0 HB3 LYS A 38 -5.490 -27.302 28.148 1.00 4.34 H new ATOM 0 HG2 LYS A 38 -7.410 -26.455 27.127 1.00 22.54 H new ATOM 0 HG3 LYS A 38 -7.341 -27.594 25.797 1.00 22.54 H new ATOM 0 HD2 LYS A 38 -9.084 -28.502 27.026 1.00 32.53 H new ATOM 0 HD3 LYS A 38 -7.734 -29.404 27.687 1.00 32.53 H new ATOM 0 HE2 LYS A 38 -7.609 -27.956 29.629 1.00 52.31 H new ATOM 0 HE3 LYS A 38 -8.742 -26.817 28.928 1.00 52.31 H new ATOM 0 HZ1 LYS A 38 -9.813 -28.225 30.562 1.00 11.32 H new ATOM 0 HZ2 LYS A 38 -10.471 -28.519 29.025 1.00 11.32 H new ATOM 0 HZ3 LYS A 38 -9.373 -29.622 29.704 1.00 11.32 H new ATOM 571 N ILE A 39 -3.732 -25.629 27.405 1.00 54.15 N ATOM 572 CA ILE A 39 -3.308 -24.260 27.669 1.00 2.04 C ATOM 573 C ILE A 39 -2.204 -23.831 26.709 1.00 61.23 C ATOM 574 O ILE A 39 -2.166 -22.685 26.260 1.00 3.12 O ATOM 575 CB ILE A 39 -2.806 -24.096 29.116 1.00 21.22 C ATOM 576 CG1 ILE A 39 -3.967 -24.247 30.102 1.00 45.32 C ATOM 577 CG2 ILE A 39 -2.127 -22.746 29.292 1.00 64.24 C ATOM 578 CD1 ILE A 39 -3.799 -25.405 31.060 1.00 2.35 C ATOM 0 H ILE A 39 -3.498 -26.293 28.143 1.00 54.15 H new ATOM 0 HA ILE A 39 -4.182 -23.625 27.521 1.00 2.04 H new ATOM 0 HB ILE A 39 -2.075 -24.878 29.322 1.00 21.22 H new ATOM 0 HG12 ILE A 39 -4.070 -23.325 30.674 1.00 45.32 H new ATOM 0 HG13 ILE A 39 -4.893 -24.380 29.543 1.00 45.32 H new ATOM 0 HG21 ILE A 39 -1.778 -22.646 30.320 1.00 64.24 H new ATOM 0 HG22 ILE A 39 -1.278 -22.674 28.612 1.00 64.24 H new ATOM 0 HG23 ILE A 39 -2.838 -21.950 29.071 1.00 64.24 H new ATOM 0 HD11 ILE A 39 -4.658 -25.451 31.729 1.00 2.35 H new ATOM 0 HD12 ILE A 39 -3.727 -26.335 30.497 1.00 2.35 H new ATOM 0 HD13 ILE A 39 -2.891 -25.264 31.646 1.00 2.35 H new ATOM 590 N THR A 40 -1.306 -24.760 26.394 1.00 34.34 N ATOM 591 CA THR A 40 -0.202 -24.480 25.486 1.00 4.43 C ATOM 592 C THR A 40 -0.708 -23.934 24.156 1.00 33.11 C ATOM 593 O THR A 40 -0.184 -22.947 23.638 1.00 34.01 O ATOM 594 CB THR A 40 0.643 -25.740 25.223 1.00 62.42 C ATOM 595 OG1 THR A 40 1.393 -26.082 26.394 1.00 12.52 O ATOM 596 CG2 THR A 40 1.592 -25.522 24.054 1.00 55.34 C ATOM 0 H THR A 40 -1.323 -25.714 26.755 1.00 34.34 H new ATOM 0 HA THR A 40 0.422 -23.728 25.970 1.00 4.43 H new ATOM 0 HB THR A 40 -0.034 -26.557 24.974 1.00 62.42 H new ATOM 0 HG1 THR A 40 0.830 -26.604 27.002 1.00 12.52 H new ATOM 0 HG21 THR A 40 2.178 -26.426 23.888 1.00 55.34 H new ATOM 0 HG22 THR A 40 1.017 -25.292 23.157 1.00 55.34 H new ATOM 0 HG23 THR A 40 2.262 -24.692 24.279 1.00 55.34 H new ATOM 604 N LEU A 41 -1.730 -24.581 23.608 1.00 75.45 N ATOM 605 CA LEU A 41 -2.309 -24.160 22.336 1.00 33.24 C ATOM 606 C LEU A 41 -2.899 -22.758 22.445 1.00 54.21 C ATOM 607 O LEU A 41 -2.701 -21.920 21.564 1.00 72.31 O ATOM 608 CB LEU A 41 -3.390 -25.148 21.894 1.00 52.25 C ATOM 609 CG LEU A 41 -3.260 -25.692 20.470 1.00 10.34 C ATOM 610 CD1 LEU A 41 -2.922 -27.174 20.494 1.00 30.23 C ATOM 611 CD2 LEU A 41 -4.542 -25.448 19.687 1.00 45.51 C ATOM 0 H LEU A 41 -2.175 -25.399 24.024 1.00 75.45 H new ATOM 0 HA LEU A 41 -1.514 -24.143 21.590 1.00 33.24 H new ATOM 0 HB2 LEU A 41 -3.388 -25.991 22.585 1.00 52.25 H new ATOM 0 HB3 LEU A 41 -4.360 -24.660 21.988 1.00 52.25 H new ATOM 0 HG LEU A 41 -2.447 -25.163 19.972 1.00 10.34 H new ATOM 0 HD11 LEU A 41 -2.833 -27.544 19.472 1.00 30.23 H new ATOM 0 HD12 LEU A 41 -1.977 -27.323 21.017 1.00 30.23 H new ATOM 0 HD13 LEU A 41 -3.712 -27.719 21.010 1.00 30.23 H new ATOM 0 HD21 LEU A 41 -4.432 -25.841 18.676 1.00 45.51 H new ATOM 0 HD22 LEU A 41 -5.373 -25.950 20.183 1.00 45.51 H new ATOM 0 HD23 LEU A 41 -4.741 -24.377 19.640 1.00 45.51 H new ATOM 623 N CYS A 42 -3.623 -22.509 23.531 1.00 42.53 N ATOM 624 CA CYS A 42 -4.241 -21.206 23.755 1.00 23.55 C ATOM 625 C CYS A 42 -3.207 -20.090 23.657 1.00 43.41 C ATOM 626 O CYS A 42 -3.506 -18.994 23.182 1.00 42.34 O ATOM 627 CB CYS A 42 -4.919 -21.170 25.126 1.00 71.43 C ATOM 628 SG CYS A 42 -5.249 -19.503 25.742 1.00 21.04 S ATOM 0 H CYS A 42 -3.796 -23.191 24.269 1.00 42.53 H new ATOM 0 HA CYS A 42 -4.992 -21.049 22.981 1.00 23.55 H new ATOM 0 HB2 CYS A 42 -5.860 -21.718 25.069 1.00 71.43 H new ATOM 0 HB3 CYS A 42 -4.289 -21.693 25.845 1.00 71.43 H new ATOM 0 HG CYS A 42 -5.825 -19.576 26.905 1.00 21.04 H new ATOM 634 N ILE A 43 -1.991 -20.375 24.110 1.00 3.32 N ATOM 635 CA ILE A 43 -0.913 -19.394 24.073 1.00 1.04 C ATOM 636 C ILE A 43 -0.379 -19.216 22.656 1.00 74.40 C ATOM 637 O ILE A 43 0.017 -18.119 22.264 1.00 54.03 O ATOM 638 CB ILE A 43 0.249 -19.799 25.000 1.00 14.01 C ATOM 639 CG1 ILE A 43 -0.205 -19.779 26.461 1.00 31.22 C ATOM 640 CG2 ILE A 43 1.437 -18.871 24.796 1.00 20.22 C ATOM 641 CD1 ILE A 43 0.665 -20.613 27.376 1.00 43.54 C ATOM 0 H ILE A 43 -1.727 -21.277 24.507 1.00 3.32 H new ATOM 0 HA ILE A 43 -1.334 -18.451 24.421 1.00 1.04 H new ATOM 0 HB ILE A 43 0.558 -20.814 24.749 1.00 14.01 H new ATOM 0 HG12 ILE A 43 -0.210 -18.749 26.817 1.00 31.22 H new ATOM 0 HG13 ILE A 43 -1.231 -20.141 26.519 1.00 31.22 H new ATOM 0 HG21 ILE A 43 2.250 -19.170 25.458 1.00 20.22 H new ATOM 0 HG22 ILE A 43 1.772 -18.931 23.760 1.00 20.22 H new ATOM 0 HG23 ILE A 43 1.142 -17.847 25.023 1.00 20.22 H new ATOM 0 HD11 ILE A 43 0.284 -20.552 28.395 1.00 43.54 H new ATOM 0 HD12 ILE A 43 0.651 -21.651 27.045 1.00 43.54 H new ATOM 0 HD13 ILE A 43 1.688 -20.237 27.348 1.00 43.54 H new ATOM 653 N SER A 44 -0.374 -20.304 21.891 1.00 2.51 N ATOM 654 CA SER A 44 0.113 -20.269 20.517 1.00 52.21 C ATOM 655 C SER A 44 -0.708 -19.297 19.674 1.00 32.34 C ATOM 656 O SER A 44 -0.191 -18.294 19.182 1.00 33.22 O ATOM 657 CB SER A 44 0.060 -21.668 19.899 1.00 1.44 C ATOM 658 OG SER A 44 0.372 -22.661 20.860 1.00 22.32 O ATOM 0 H SER A 44 -0.701 -21.219 22.200 1.00 2.51 H new ATOM 0 HA SER A 44 1.147 -19.925 20.533 1.00 52.21 H new ATOM 0 HB2 SER A 44 -0.934 -21.852 19.491 1.00 1.44 H new ATOM 0 HB3 SER A 44 0.762 -21.729 19.067 1.00 1.44 H new ATOM 0 HG SER A 44 0.330 -23.546 20.441 1.00 22.32 H new ATOM 664 N VAL A 45 -1.992 -19.603 19.512 1.00 3.14 N ATOM 665 CA VAL A 45 -2.886 -18.758 18.731 1.00 51.54 C ATOM 666 C VAL A 45 -2.840 -17.313 19.215 1.00 1.21 C ATOM 667 O VAL A 45 -2.912 -16.376 18.418 1.00 23.40 O ATOM 668 CB VAL A 45 -4.339 -19.264 18.798 1.00 31.05 C ATOM 669 CG1 VAL A 45 -4.486 -20.570 18.032 1.00 10.40 C ATOM 670 CG2 VAL A 45 -4.777 -19.434 20.246 1.00 43.55 C ATOM 0 H VAL A 45 -2.435 -20.430 19.912 1.00 3.14 H new ATOM 0 HA VAL A 45 -2.541 -18.803 17.698 1.00 51.54 H new ATOM 0 HB VAL A 45 -4.986 -18.522 18.330 1.00 31.05 H new ATOM 0 HG11 VAL A 45 -5.519 -20.912 18.091 1.00 10.40 H new ATOM 0 HG12 VAL A 45 -4.215 -20.412 16.988 1.00 10.40 H new ATOM 0 HG13 VAL A 45 -3.829 -21.323 18.468 1.00 10.40 H new ATOM 0 HG21 VAL A 45 -5.806 -19.792 20.275 1.00 43.55 H new ATOM 0 HG22 VAL A 45 -4.127 -20.156 20.740 1.00 43.55 H new ATOM 0 HG23 VAL A 45 -4.712 -18.475 20.761 1.00 43.55 H new ATOM 680 N LEU A 46 -2.719 -17.138 20.526 1.00 31.14 N ATOM 681 CA LEU A 46 -2.662 -15.806 21.119 1.00 74.12 C ATOM 682 C LEU A 46 -1.456 -15.030 20.600 1.00 72.24 C ATOM 683 O LEU A 46 -1.595 -13.923 20.077 1.00 65.52 O ATOM 684 CB LEU A 46 -2.600 -15.907 22.644 1.00 74.01 C ATOM 685 CG LEU A 46 -2.395 -14.592 23.396 1.00 42.52 C ATOM 686 CD1 LEU A 46 -3.459 -13.580 23.002 1.00 54.51 C ATOM 687 CD2 LEU A 46 -2.411 -14.828 24.899 1.00 73.11 C ATOM 0 H LEU A 46 -2.658 -17.902 21.199 1.00 31.14 H new ATOM 0 HA LEU A 46 -3.567 -15.269 20.833 1.00 74.12 H new ATOM 0 HB2 LEU A 46 -3.525 -16.363 22.996 1.00 74.01 H new ATOM 0 HB3 LEU A 46 -1.789 -16.585 22.911 1.00 74.01 H new ATOM 0 HG LEU A 46 -1.420 -14.188 23.123 1.00 42.52 H new ATOM 0 HD11 LEU A 46 -3.297 -12.650 23.547 1.00 54.51 H new ATOM 0 HD12 LEU A 46 -3.399 -13.387 21.931 1.00 54.51 H new ATOM 0 HD13 LEU A 46 -4.445 -13.976 23.245 1.00 54.51 H new ATOM 0 HD21 LEU A 46 -2.264 -13.881 25.418 1.00 73.11 H new ATOM 0 HD22 LEU A 46 -3.371 -15.256 25.190 1.00 73.11 H new ATOM 0 HD23 LEU A 46 -1.610 -15.517 25.168 1.00 73.11 H new ATOM 699 N LEU A 47 -0.274 -15.618 20.745 1.00 21.12 N ATOM 700 CA LEU A 47 0.958 -14.983 20.289 1.00 74.23 C ATOM 701 C LEU A 47 0.929 -14.760 18.780 1.00 35.11 C ATOM 702 O LEU A 47 1.235 -13.670 18.298 1.00 54.32 O ATOM 703 CB LEU A 47 2.167 -15.841 20.666 1.00 51.13 C ATOM 704 CG LEU A 47 3.233 -15.158 21.523 1.00 32.25 C ATOM 705 CD1 LEU A 47 4.241 -16.177 22.033 1.00 51.52 C ATOM 706 CD2 LEU A 47 3.932 -14.062 20.733 1.00 61.12 C ATOM 0 H LEU A 47 -0.142 -16.534 21.175 1.00 21.12 H new ATOM 0 HA LEU A 47 1.041 -14.013 20.780 1.00 74.23 H new ATOM 0 HB2 LEU A 47 1.810 -16.722 21.199 1.00 51.13 H new ATOM 0 HB3 LEU A 47 2.638 -16.193 19.748 1.00 51.13 H new ATOM 0 HG LEU A 47 2.743 -14.701 22.382 1.00 32.25 H new ATOM 0 HD11 LEU A 47 4.992 -15.673 22.641 1.00 51.52 H new ATOM 0 HD12 LEU A 47 3.728 -16.925 22.637 1.00 51.52 H new ATOM 0 HD13 LEU A 47 4.726 -16.664 21.187 1.00 51.52 H new ATOM 0 HD21 LEU A 47 4.687 -13.587 21.359 1.00 61.12 H new ATOM 0 HD22 LEU A 47 4.409 -14.495 19.854 1.00 61.12 H new ATOM 0 HD23 LEU A 47 3.201 -13.317 20.419 1.00 61.12 H new ATOM 718 N SER A 48 0.556 -15.800 18.040 1.00 4.14 N ATOM 719 CA SER A 48 0.488 -15.718 16.586 1.00 25.10 C ATOM 720 C SER A 48 -0.445 -14.594 16.148 1.00 13.22 C ATOM 721 O SER A 48 -0.210 -13.935 15.135 1.00 50.34 O ATOM 722 CB SER A 48 0.012 -17.049 16.001 1.00 61.00 C ATOM 723 OG SER A 48 -1.360 -16.991 15.653 1.00 52.15 O ATOM 0 H SER A 48 0.296 -16.709 18.424 1.00 4.14 H new ATOM 0 HA SER A 48 1.489 -15.502 16.212 1.00 25.10 H new ATOM 0 HB2 SER A 48 0.604 -17.295 15.119 1.00 61.00 H new ATOM 0 HB3 SER A 48 0.173 -17.847 16.726 1.00 61.00 H new ATOM 0 HG SER A 48 -1.896 -16.839 16.459 1.00 52.15 H new ATOM 729 N LEU A 49 -1.506 -14.380 16.919 1.00 21.51 N ATOM 730 CA LEU A 49 -2.477 -13.336 16.612 1.00 0.14 C ATOM 731 C LEU A 49 -1.908 -11.955 16.923 1.00 62.23 C ATOM 732 O LEU A 49 -2.332 -10.953 16.347 1.00 43.53 O ATOM 733 CB LEU A 49 -3.765 -13.560 17.407 1.00 5.24 C ATOM 734 CG LEU A 49 -4.887 -14.295 16.674 1.00 21.00 C ATOM 735 CD1 LEU A 49 -5.943 -14.774 17.658 1.00 52.12 C ATOM 736 CD2 LEU A 49 -5.510 -13.397 15.615 1.00 22.11 C ATOM 0 H LEU A 49 -1.715 -14.916 17.761 1.00 21.51 H new ATOM 0 HA LEU A 49 -2.702 -13.385 15.547 1.00 0.14 H new ATOM 0 HB2 LEU A 49 -3.519 -14.121 18.309 1.00 5.24 H new ATOM 0 HB3 LEU A 49 -4.143 -12.590 17.729 1.00 5.24 H new ATOM 0 HG LEU A 49 -4.461 -15.167 16.177 1.00 21.00 H new ATOM 0 HD11 LEU A 49 -6.734 -15.295 17.118 1.00 52.12 H new ATOM 0 HD12 LEU A 49 -5.487 -15.453 18.379 1.00 52.12 H new ATOM 0 HD13 LEU A 49 -6.366 -13.918 18.183 1.00 52.12 H new ATOM 0 HD21 LEU A 49 -6.307 -13.937 15.103 1.00 22.11 H new ATOM 0 HD22 LEU A 49 -5.922 -12.506 16.090 1.00 22.11 H new ATOM 0 HD23 LEU A 49 -4.748 -13.104 14.893 1.00 22.11 H new ATOM 748 N THR A 50 -0.943 -11.910 17.836 1.00 63.00 N ATOM 749 CA THR A 50 -0.314 -10.653 18.222 1.00 32.13 C ATOM 750 C THR A 50 0.785 -10.263 17.240 1.00 33.33 C ATOM 751 O THR A 50 0.818 -9.137 16.745 1.00 13.42 O ATOM 752 CB THR A 50 0.285 -10.737 19.639 1.00 50.32 C ATOM 753 OG1 THR A 50 -0.521 -11.587 20.462 1.00 22.22 O ATOM 754 CG2 THR A 50 0.380 -9.355 20.268 1.00 23.24 C ATOM 0 H THR A 50 -0.580 -12.730 18.322 1.00 63.00 H new ATOM 0 HA THR A 50 -1.094 -9.892 18.210 1.00 32.13 H new ATOM 0 HB THR A 50 1.289 -11.154 19.562 1.00 50.32 H new ATOM 0 HG1 THR A 50 -0.431 -12.515 20.161 1.00 22.22 H new ATOM 0 HG21 THR A 50 0.806 -9.439 21.268 1.00 23.24 H new ATOM 0 HG22 THR A 50 1.018 -8.719 19.654 1.00 23.24 H new ATOM 0 HG23 THR A 50 -0.615 -8.916 20.333 1.00 23.24 H new ATOM 762 N VAL A 51 1.683 -11.202 16.961 1.00 23.35 N ATOM 763 CA VAL A 51 2.783 -10.957 16.036 1.00 23.33 C ATOM 764 C VAL A 51 2.274 -10.397 14.713 1.00 71.51 C ATOM 765 O VAL A 51 2.877 -9.492 14.136 1.00 21.31 O ATOM 766 CB VAL A 51 3.584 -12.244 15.763 1.00 73.44 C ATOM 767 CG1 VAL A 51 4.380 -12.650 16.993 1.00 5.22 C ATOM 768 CG2 VAL A 51 2.654 -13.366 15.326 1.00 63.55 C ATOM 0 H VAL A 51 1.670 -12.140 17.362 1.00 23.35 H new ATOM 0 HA VAL A 51 3.437 -10.225 16.509 1.00 23.33 H new ATOM 0 HB VAL A 51 4.288 -12.048 14.954 1.00 73.44 H new ATOM 0 HG11 VAL A 51 4.939 -13.561 16.780 1.00 5.22 H new ATOM 0 HG12 VAL A 51 5.074 -11.852 17.257 1.00 5.22 H new ATOM 0 HG13 VAL A 51 3.699 -12.828 17.825 1.00 5.22 H new ATOM 0 HG21 VAL A 51 3.236 -14.268 15.137 1.00 63.55 H new ATOM 0 HG22 VAL A 51 1.926 -13.562 16.113 1.00 63.55 H new ATOM 0 HG23 VAL A 51 2.133 -13.073 14.414 1.00 63.55 H new ATOM 778 N PHE A 52 1.159 -10.942 14.237 1.00 50.44 N ATOM 779 CA PHE A 52 0.568 -10.497 12.980 1.00 15.21 C ATOM 780 C PHE A 52 -0.176 -9.178 13.166 1.00 15.30 C ATOM 781 O PHE A 52 -0.227 -8.347 12.258 1.00 54.11 O ATOM 782 CB PHE A 52 -0.387 -11.562 12.436 1.00 13.43 C ATOM 783 CG PHE A 52 -1.590 -10.990 11.742 1.00 52.21 C ATOM 784 CD1 PHE A 52 -1.461 -10.343 10.524 1.00 42.34 C ATOM 785 CD2 PHE A 52 -2.850 -11.099 12.308 1.00 52.21 C ATOM 786 CE1 PHE A 52 -2.566 -9.816 9.882 1.00 43.33 C ATOM 787 CE2 PHE A 52 -3.959 -10.574 11.671 1.00 64.25 C ATOM 788 CZ PHE A 52 -3.816 -9.931 10.457 1.00 51.33 C ATOM 0 H PHE A 52 0.647 -11.692 14.702 1.00 50.44 H new ATOM 0 HA PHE A 52 1.374 -10.341 12.263 1.00 15.21 H new ATOM 0 HB2 PHE A 52 0.154 -12.202 11.739 1.00 13.43 H new ATOM 0 HB3 PHE A 52 -0.719 -12.195 13.259 1.00 13.43 H new ATOM 0 HD1 PHE A 52 -0.485 -10.249 10.070 1.00 42.34 H new ATOM 0 HD2 PHE A 52 -2.967 -11.600 13.258 1.00 52.21 H new ATOM 0 HE1 PHE A 52 -2.452 -9.315 8.932 1.00 43.33 H new ATOM 0 HE2 PHE A 52 -4.936 -10.667 12.122 1.00 64.25 H new ATOM 0 HZ PHE A 52 -4.681 -9.519 9.958 1.00 51.33 H new ATOM 798 N LEU A 53 -0.753 -8.992 14.348 1.00 21.24 N ATOM 799 CA LEU A 53 -1.495 -7.774 14.655 1.00 33.40 C ATOM 800 C LEU A 53 -0.586 -6.551 14.590 1.00 72.41 C ATOM 801 O LEU A 53 -0.871 -5.590 13.874 1.00 63.42 O ATOM 802 CB LEU A 53 -2.132 -7.877 16.042 1.00 30.41 C ATOM 803 CG LEU A 53 -2.300 -6.562 16.803 1.00 41.31 C ATOM 804 CD1 LEU A 53 -3.172 -5.597 16.015 1.00 50.13 C ATOM 805 CD2 LEU A 53 -2.893 -6.815 18.181 1.00 4.35 C ATOM 0 H LEU A 53 -0.721 -9.669 15.110 1.00 21.24 H new ATOM 0 HA LEU A 53 -2.281 -7.659 13.909 1.00 33.40 H new ATOM 0 HB2 LEU A 53 -3.113 -8.340 15.936 1.00 30.41 H new ATOM 0 HB3 LEU A 53 -1.526 -8.550 16.649 1.00 30.41 H new ATOM 0 HG LEU A 53 -1.316 -6.110 16.930 1.00 41.31 H new ATOM 0 HD11 LEU A 53 -3.280 -4.667 16.572 1.00 50.13 H new ATOM 0 HD12 LEU A 53 -2.707 -5.391 15.051 1.00 50.13 H new ATOM 0 HD13 LEU A 53 -4.155 -6.041 15.856 1.00 50.13 H new ATOM 0 HD21 LEU A 53 -3.005 -5.868 18.708 1.00 4.35 H new ATOM 0 HD22 LEU A 53 -3.869 -7.290 18.076 1.00 4.35 H new ATOM 0 HD23 LEU A 53 -2.230 -7.469 18.748 1.00 4.35 H new ATOM 817 N LEU A 54 0.509 -6.595 15.340 1.00 44.50 N ATOM 818 CA LEU A 54 1.463 -5.491 15.366 1.00 12.30 C ATOM 819 C LEU A 54 1.986 -5.190 13.965 1.00 23.12 C ATOM 820 O LEU A 54 2.080 -4.030 13.561 1.00 33.23 O ATOM 821 CB LEU A 54 2.629 -5.820 16.299 1.00 63.30 C ATOM 822 CG LEU A 54 3.083 -4.695 17.230 1.00 62.05 C ATOM 823 CD1 LEU A 54 3.674 -5.266 18.509 1.00 33.23 C ATOM 824 CD2 LEU A 54 4.092 -3.798 16.528 1.00 5.44 C ATOM 0 H LEU A 54 0.759 -7.383 15.938 1.00 44.50 H new ATOM 0 HA LEU A 54 0.947 -4.606 15.739 1.00 12.30 H new ATOM 0 HB2 LEU A 54 2.348 -6.678 16.909 1.00 63.30 H new ATOM 0 HB3 LEU A 54 3.480 -6.126 15.690 1.00 63.30 H new ATOM 0 HG LEU A 54 2.213 -4.094 17.494 1.00 62.05 H new ATOM 0 HD11 LEU A 54 3.991 -4.451 19.159 1.00 33.23 H new ATOM 0 HD12 LEU A 54 2.922 -5.866 19.021 1.00 33.23 H new ATOM 0 HD13 LEU A 54 4.533 -5.891 18.265 1.00 33.23 H new ATOM 0 HD21 LEU A 54 4.405 -3.003 17.205 1.00 5.44 H new ATOM 0 HD22 LEU A 54 4.961 -4.387 16.235 1.00 5.44 H new ATOM 0 HD23 LEU A 54 3.634 -3.360 15.641 1.00 5.44 H new ATOM 836 N LEU A 55 2.325 -6.242 13.228 1.00 55.25 N ATOM 837 CA LEU A 55 2.837 -6.091 11.870 1.00 74.21 C ATOM 838 C LEU A 55 1.898 -5.235 11.026 1.00 71.23 C ATOM 839 O LEU A 55 2.342 -4.468 10.171 1.00 71.11 O ATOM 840 CB LEU A 55 3.020 -7.463 11.218 1.00 54.23 C ATOM 841 CG LEU A 55 4.449 -7.829 10.816 1.00 74.54 C ATOM 842 CD1 LEU A 55 4.907 -6.981 9.640 1.00 74.05 C ATOM 843 CD2 LEU A 55 5.394 -7.663 11.996 1.00 2.11 C ATOM 0 H LEU A 55 2.255 -7.208 13.547 1.00 55.25 H new ATOM 0 HA LEU A 55 3.803 -5.590 11.926 1.00 74.21 H new ATOM 0 HB2 LEU A 55 2.652 -8.223 11.907 1.00 54.23 H new ATOM 0 HB3 LEU A 55 2.391 -7.508 10.329 1.00 54.23 H new ATOM 0 HG LEU A 55 4.463 -8.875 10.510 1.00 74.54 H new ATOM 0 HD11 LEU A 55 5.926 -7.256 9.368 1.00 74.05 H new ATOM 0 HD12 LEU A 55 4.246 -7.151 8.790 1.00 74.05 H new ATOM 0 HD13 LEU A 55 4.877 -5.927 9.918 1.00 74.05 H new ATOM 0 HD21 LEU A 55 6.406 -7.928 11.691 1.00 2.11 H new ATOM 0 HD22 LEU A 55 5.376 -6.627 12.334 1.00 2.11 H new ATOM 0 HD23 LEU A 55 5.078 -8.315 12.810 1.00 2.11 H new ATOM 855 N ILE A 56 0.599 -5.370 11.273 1.00 64.52 N ATOM 856 CA ILE A 56 -0.401 -4.607 10.538 1.00 52.23 C ATOM 857 C ILE A 56 -0.448 -3.159 11.015 1.00 31.43 C ATOM 858 O ILE A 56 -0.790 -2.253 10.255 1.00 75.22 O ATOM 859 CB ILE A 56 -1.803 -5.229 10.682 1.00 25.15 C ATOM 860 CG1 ILE A 56 -1.865 -6.573 9.954 1.00 32.34 C ATOM 861 CG2 ILE A 56 -2.862 -4.279 10.144 1.00 30.13 C ATOM 862 CD1 ILE A 56 -1.647 -6.463 8.462 1.00 53.34 C ATOM 0 H ILE A 56 0.215 -6.001 11.977 1.00 64.52 H new ATOM 0 HA ILE A 56 -0.108 -4.632 9.488 1.00 52.23 H new ATOM 0 HB ILE A 56 -2.002 -5.401 11.740 1.00 25.15 H new ATOM 0 HG12 ILE A 56 -1.112 -7.240 10.375 1.00 32.34 H new ATOM 0 HG13 ILE A 56 -2.836 -7.032 10.138 1.00 32.34 H new ATOM 0 HG21 ILE A 56 -3.847 -4.733 10.253 1.00 30.13 H new ATOM 0 HG22 ILE A 56 -2.830 -3.344 10.703 1.00 30.13 H new ATOM 0 HG23 ILE A 56 -2.669 -4.079 9.090 1.00 30.13 H new ATOM 0 HD11 ILE A 56 -1.705 -7.454 8.012 1.00 53.34 H new ATOM 0 HD12 ILE A 56 -2.415 -5.822 8.028 1.00 53.34 H new ATOM 0 HD13 ILE A 56 -0.664 -6.033 8.269 1.00 53.34 H new ATOM 874 N THR A 57 -0.100 -2.948 12.281 1.00 41.22 N ATOM 875 CA THR A 57 -0.102 -1.611 12.861 1.00 45.34 C ATOM 876 C THR A 57 1.128 -0.821 12.426 1.00 61.41 C ATOM 877 O THR A 57 1.183 0.397 12.588 1.00 25.03 O ATOM 878 CB THR A 57 -0.145 -1.666 14.399 1.00 3.44 C ATOM 879 OG1 THR A 57 1.146 -2.011 14.914 1.00 44.44 O ATOM 880 CG2 THR A 57 -1.173 -2.680 14.876 1.00 55.20 C ATOM 0 H THR A 57 0.187 -3.686 12.924 1.00 41.22 H new ATOM 0 HA THR A 57 -0.999 -1.110 12.498 1.00 45.34 H new ATOM 0 HB THR A 57 -0.431 -0.681 14.767 1.00 3.44 H new ATOM 0 HG1 THR A 57 1.409 -2.892 14.575 1.00 44.44 H new ATOM 0 HG21 THR A 57 -1.185 -2.701 15.966 1.00 55.20 H new ATOM 0 HG22 THR A 57 -2.160 -2.399 14.508 1.00 55.20 H new ATOM 0 HG23 THR A 57 -0.912 -3.668 14.497 1.00 55.20 H new ATOM 888 N GLU A 58 2.111 -1.524 11.872 1.00 25.13 N ATOM 889 CA GLU A 58 3.341 -0.887 11.414 1.00 34.14 C ATOM 890 C GLU A 58 3.208 -0.429 9.965 1.00 45.22 C ATOM 891 O GLU A 58 3.704 0.635 9.592 1.00 53.22 O ATOM 892 CB GLU A 58 4.522 -1.850 11.551 1.00 72.14 C ATOM 893 CG GLU A 58 4.808 -2.264 12.985 1.00 52.55 C ATOM 894 CD GLU A 58 5.343 -1.121 13.825 1.00 5.13 C ATOM 895 OE1 GLU A 58 6.402 -0.565 13.464 1.00 21.13 O ATOM 896 OE2 GLU A 58 4.705 -0.783 14.844 1.00 50.34 O ATOM 0 H GLU A 58 2.080 -2.534 11.729 1.00 25.13 H new ATOM 0 HA GLU A 58 3.522 -0.012 12.038 1.00 34.14 H new ATOM 0 HB2 GLU A 58 4.323 -2.742 10.957 1.00 72.14 H new ATOM 0 HB3 GLU A 58 5.413 -1.381 11.133 1.00 72.14 H new ATOM 0 HG2 GLU A 58 3.893 -2.646 13.438 1.00 52.55 H new ATOM 0 HG3 GLU A 58 5.530 -3.080 12.987 1.00 52.55 H new ATOM 903 N ILE A 59 2.538 -1.239 9.153 1.00 22.40 N ATOM 904 CA ILE A 59 2.341 -0.918 7.745 1.00 13.52 C ATOM 905 C ILE A 59 1.235 0.117 7.568 1.00 54.22 C ATOM 906 O ILE A 59 1.243 0.891 6.610 1.00 10.33 O ATOM 907 CB ILE A 59 1.990 -2.173 6.925 1.00 43.25 C ATOM 908 CG1 ILE A 59 0.630 -2.726 7.353 1.00 12.15 C ATOM 909 CG2 ILE A 59 3.073 -3.230 7.085 1.00 14.14 C ATOM 910 CD1 ILE A 59 0.412 -4.169 6.957 1.00 21.41 C ATOM 0 H ILE A 59 2.122 -2.123 9.446 1.00 22.40 H new ATOM 0 HA ILE A 59 3.282 -0.508 7.380 1.00 13.52 H new ATOM 0 HB ILE A 59 1.932 -1.896 5.872 1.00 43.25 H new ATOM 0 HG12 ILE A 59 0.535 -2.636 8.435 1.00 12.15 H new ATOM 0 HG13 ILE A 59 -0.157 -2.114 6.912 1.00 12.15 H new ATOM 0 HG21 ILE A 59 2.811 -4.111 6.500 1.00 14.14 H new ATOM 0 HG22 ILE A 59 4.025 -2.831 6.734 1.00 14.14 H new ATOM 0 HG23 ILE A 59 3.160 -3.505 8.136 1.00 14.14 H new ATOM 0 HD11 ILE A 59 -0.573 -4.494 7.293 1.00 21.41 H new ATOM 0 HD12 ILE A 59 0.475 -4.262 5.873 1.00 21.41 H new ATOM 0 HD13 ILE A 59 1.177 -4.793 7.419 1.00 21.41 H new ATOM 922 N ILE A 60 0.285 0.126 8.497 1.00 23.45 N ATOM 923 CA ILE A 60 -0.826 1.067 8.445 1.00 1.43 C ATOM 924 C ILE A 60 -1.614 0.916 7.149 1.00 53.22 C ATOM 925 O ILE A 60 -1.530 1.745 6.242 1.00 73.52 O ATOM 926 CB ILE A 60 -0.337 2.523 8.569 1.00 62.42 C ATOM 927 CG1 ILE A 60 0.595 2.670 9.773 1.00 25.21 C ATOM 928 CG2 ILE A 60 -1.520 3.471 8.689 1.00 34.23 C ATOM 929 CD1 ILE A 60 2.024 2.991 9.395 1.00 5.33 C ATOM 0 H ILE A 60 0.263 -0.509 9.295 1.00 23.45 H new ATOM 0 HA ILE A 60 -1.474 0.837 9.290 1.00 1.43 H new ATOM 0 HB ILE A 60 0.220 2.781 7.668 1.00 62.42 H new ATOM 0 HG12 ILE A 60 0.214 3.458 10.423 1.00 25.21 H new ATOM 0 HG13 ILE A 60 0.579 1.745 10.350 1.00 25.21 H new ATOM 0 HG21 ILE A 60 -1.158 4.495 8.776 1.00 34.23 H new ATOM 0 HG22 ILE A 60 -2.149 3.382 7.803 1.00 34.23 H new ATOM 0 HG23 ILE A 60 -2.102 3.216 9.574 1.00 34.23 H new ATOM 0 HD11 ILE A 60 2.628 3.081 10.298 1.00 5.33 H new ATOM 0 HD12 ILE A 60 2.423 2.192 8.770 1.00 5.33 H new ATOM 0 HD13 ILE A 60 2.052 3.931 8.844 1.00 5.33 H new ATOM 941 N PRO A 61 -2.401 -0.166 7.058 1.00 73.13 N ATOM 942 CA PRO A 61 -3.222 -0.451 5.877 1.00 14.32 C ATOM 943 C PRO A 61 -4.383 0.527 5.729 1.00 34.13 C ATOM 944 O PRO A 61 -5.057 0.554 4.700 1.00 72.24 O ATOM 945 CB PRO A 61 -3.745 -1.865 6.141 1.00 23.10 C ATOM 946 CG PRO A 61 -3.724 -2.006 7.624 1.00 65.41 C ATOM 947 CD PRO A 61 -2.550 -1.195 8.100 1.00 35.24 C ATOM 0 HA PRO A 61 -2.652 -0.358 4.952 1.00 14.32 H new ATOM 0 HB2 PRO A 61 -4.752 -1.995 5.745 1.00 23.10 H new ATOM 0 HB3 PRO A 61 -3.116 -2.616 5.663 1.00 23.10 H new ATOM 0 HG2 PRO A 61 -4.653 -1.643 8.064 1.00 65.41 H new ATOM 0 HG3 PRO A 61 -3.620 -3.051 7.915 1.00 65.41 H new ATOM 0 HD2 PRO A 61 -2.738 -0.752 9.078 1.00 35.24 H new ATOM 0 HD3 PRO A 61 -1.652 -1.805 8.194 1.00 35.24 H new ATOM 1043 N SER A 69 -10.230 0.623 8.737 1.00 74.25 N ATOM 1044 CA SER A 69 -9.028 0.090 9.366 1.00 63.01 C ATOM 1045 C SER A 69 -9.324 -1.227 10.076 1.00 73.51 C ATOM 1046 O SER A 69 -10.294 -1.335 10.828 1.00 65.32 O ATOM 1047 CB SER A 69 -8.457 1.102 10.361 1.00 24.45 C ATOM 1048 OG SER A 69 -8.890 2.416 10.058 1.00 50.20 O ATOM 0 HA SER A 69 -8.291 -0.097 8.585 1.00 63.01 H new ATOM 0 HB2 SER A 69 -8.768 0.838 11.372 1.00 24.45 H new ATOM 0 HB3 SER A 69 -7.368 1.061 10.341 1.00 24.45 H new ATOM 0 HG SER A 69 -9.605 2.379 9.389 1.00 50.20 H new ATOM 1054 N ILE A 70 -8.483 -2.226 9.831 1.00 31.53 N ATOM 1055 CA ILE A 70 -8.654 -3.536 10.447 1.00 22.43 C ATOM 1056 C ILE A 70 -8.377 -3.479 11.946 1.00 71.42 C ATOM 1057 O ILE A 70 -8.711 -4.405 12.685 1.00 43.40 O ATOM 1058 CB ILE A 70 -7.727 -4.586 9.805 1.00 11.41 C ATOM 1059 CG1 ILE A 70 -8.273 -5.995 10.044 1.00 12.31 C ATOM 1060 CG2 ILE A 70 -6.317 -4.457 10.360 1.00 25.15 C ATOM 1061 CD1 ILE A 70 -7.513 -7.071 9.302 1.00 62.41 C ATOM 0 H ILE A 70 -7.677 -2.153 9.211 1.00 31.53 H new ATOM 0 HA ILE A 70 -9.691 -3.829 10.282 1.00 22.43 H new ATOM 0 HB ILE A 70 -7.691 -4.409 8.730 1.00 11.41 H new ATOM 0 HG12 ILE A 70 -8.243 -6.211 11.112 1.00 12.31 H new ATOM 0 HG13 ILE A 70 -9.320 -6.026 9.742 1.00 12.31 H new ATOM 0 HG21 ILE A 70 -5.674 -5.205 9.897 1.00 25.15 H new ATOM 0 HG22 ILE A 70 -5.930 -3.461 10.143 1.00 25.15 H new ATOM 0 HG23 ILE A 70 -6.335 -4.612 11.439 1.00 25.15 H new ATOM 0 HD11 ILE A 70 -7.955 -8.044 9.518 1.00 62.41 H new ATOM 0 HD12 ILE A 70 -7.564 -6.879 8.230 1.00 62.41 H new ATOM 0 HD13 ILE A 70 -6.471 -7.067 9.622 1.00 62.41 H new ATOM 1073 N GLY A 71 -7.766 -2.385 12.388 1.00 1.52 N ATOM 1074 CA GLY A 71 -7.456 -2.226 13.797 1.00 12.21 C ATOM 1075 C GLY A 71 -8.667 -2.438 14.684 1.00 22.13 C ATOM 1076 O GLY A 71 -8.536 -2.867 15.830 1.00 32.02 O ATOM 0 H GLY A 71 -7.480 -1.605 11.796 1.00 1.52 H new ATOM 0 HA2 GLY A 71 -6.676 -2.934 14.077 1.00 12.21 H new ATOM 0 HA3 GLY A 71 -7.055 -1.227 13.967 1.00 12.21 H new ATOM 1080 N GLU A 72 -9.848 -2.136 14.154 1.00 3.40 N ATOM 1081 CA GLU A 72 -11.086 -2.294 14.908 1.00 41.22 C ATOM 1082 C GLU A 72 -11.511 -3.759 14.954 1.00 54.42 C ATOM 1083 O GLU A 72 -12.117 -4.210 15.926 1.00 55.01 O ATOM 1084 CB GLU A 72 -12.199 -1.447 14.287 1.00 61.34 C ATOM 1085 CG GLU A 72 -11.841 0.023 14.150 1.00 12.12 C ATOM 1086 CD GLU A 72 -11.161 0.575 15.388 1.00 45.23 C ATOM 1087 OE1 GLU A 72 -11.869 0.861 16.376 1.00 41.43 O ATOM 1088 OE2 GLU A 72 -9.921 0.721 15.368 1.00 4.23 O ATOM 0 H GLU A 72 -9.974 -1.781 13.206 1.00 3.40 H new ATOM 0 HA GLU A 72 -10.907 -1.953 15.928 1.00 41.22 H new ATOM 0 HB2 GLU A 72 -12.441 -1.846 13.302 1.00 61.34 H new ATOM 0 HB3 GLU A 72 -13.097 -1.538 14.898 1.00 61.34 H new ATOM 0 HG2 GLU A 72 -11.184 0.155 13.290 1.00 12.12 H new ATOM 0 HG3 GLU A 72 -12.746 0.597 13.951 1.00 12.12 H new ATOM 1095 N TYR A 73 -11.190 -4.495 13.896 1.00 32.11 N ATOM 1096 CA TYR A 73 -11.541 -5.908 13.813 1.00 14.14 C ATOM 1097 C TYR A 73 -10.588 -6.756 14.650 1.00 71.12 C ATOM 1098 O TYR A 73 -11.018 -7.580 15.458 1.00 22.31 O ATOM 1099 CB TYR A 73 -11.516 -6.377 12.358 1.00 44.02 C ATOM 1100 CG TYR A 73 -11.461 -7.880 12.207 1.00 61.50 C ATOM 1101 CD1 TYR A 73 -12.538 -8.675 12.578 1.00 74.45 C ATOM 1102 CD2 TYR A 73 -10.332 -8.506 11.693 1.00 44.12 C ATOM 1103 CE1 TYR A 73 -12.492 -10.049 12.442 1.00 33.42 C ATOM 1104 CE2 TYR A 73 -10.277 -9.879 11.553 1.00 72.25 C ATOM 1105 CZ TYR A 73 -11.360 -10.647 11.929 1.00 2.51 C ATOM 1106 OH TYR A 73 -11.310 -12.015 11.791 1.00 15.23 O ATOM 0 H TYR A 73 -10.687 -4.137 13.084 1.00 32.11 H new ATOM 0 HA TYR A 73 -12.549 -6.030 14.209 1.00 14.14 H new ATOM 0 HB2 TYR A 73 -12.404 -6.001 11.849 1.00 44.02 H new ATOM 0 HB3 TYR A 73 -10.652 -5.938 11.858 1.00 44.02 H new ATOM 0 HD1 TYR A 73 -13.427 -8.211 12.980 1.00 74.45 H new ATOM 0 HD2 TYR A 73 -9.482 -7.908 11.398 1.00 44.12 H new ATOM 0 HE1 TYR A 73 -13.338 -10.652 12.736 1.00 33.42 H new ATOM 0 HE2 TYR A 73 -9.391 -10.349 11.151 1.00 72.25 H new ATOM 0 HH TYR A 73 -10.388 -12.323 11.918 1.00 15.23 H new ATOM 1116 N LEU A 74 -9.291 -6.548 14.450 1.00 15.41 N ATOM 1117 CA LEU A 74 -8.275 -7.292 15.186 1.00 42.34 C ATOM 1118 C LEU A 74 -8.422 -7.075 16.688 1.00 20.13 C ATOM 1119 O LEU A 74 -8.100 -7.955 17.488 1.00 44.02 O ATOM 1120 CB LEU A 74 -6.877 -6.868 14.732 1.00 3.12 C ATOM 1121 CG LEU A 74 -6.178 -7.805 13.746 1.00 11.40 C ATOM 1122 CD1 LEU A 74 -5.128 -7.050 12.945 1.00 33.12 C ATOM 1123 CD2 LEU A 74 -5.549 -8.979 14.481 1.00 63.33 C ATOM 0 H LEU A 74 -8.918 -5.871 13.785 1.00 15.41 H new ATOM 0 HA LEU A 74 -8.413 -8.353 14.976 1.00 42.34 H new ATOM 0 HB2 LEU A 74 -6.949 -5.881 14.275 1.00 3.12 H new ATOM 0 HB3 LEU A 74 -6.246 -6.766 15.615 1.00 3.12 H new ATOM 0 HG LEU A 74 -6.924 -8.194 13.053 1.00 11.40 H new ATOM 0 HD11 LEU A 74 -4.641 -7.733 12.249 1.00 33.12 H new ATOM 0 HD12 LEU A 74 -5.605 -6.244 12.388 1.00 33.12 H new ATOM 0 HD13 LEU A 74 -4.384 -6.632 13.623 1.00 33.12 H new ATOM 0 HD21 LEU A 74 -5.056 -9.635 13.764 1.00 63.33 H new ATOM 0 HD22 LEU A 74 -4.816 -8.609 15.198 1.00 63.33 H new ATOM 0 HD23 LEU A 74 -6.324 -9.535 15.009 1.00 63.33 H new ATOM 1135 N LEU A 75 -8.913 -5.900 17.066 1.00 45.20 N ATOM 1136 CA LEU A 75 -9.105 -5.568 18.473 1.00 12.24 C ATOM 1137 C LEU A 75 -10.353 -6.248 19.027 1.00 21.05 C ATOM 1138 O LEU A 75 -10.278 -7.026 19.979 1.00 51.20 O ATOM 1139 CB LEU A 75 -9.216 -4.052 18.650 1.00 62.33 C ATOM 1140 CG LEU A 75 -9.033 -3.527 20.074 1.00 20.21 C ATOM 1141 CD1 LEU A 75 -8.451 -2.122 20.054 1.00 31.25 C ATOM 1142 CD2 LEU A 75 -10.357 -3.548 20.824 1.00 1.31 C ATOM 0 H LEU A 75 -9.185 -5.161 16.418 1.00 45.20 H new ATOM 0 HA LEU A 75 -8.239 -5.930 19.027 1.00 12.24 H new ATOM 0 HB2 LEU A 75 -8.472 -3.576 18.011 1.00 62.33 H new ATOM 0 HB3 LEU A 75 -10.195 -3.735 18.290 1.00 62.33 H new ATOM 0 HG LEU A 75 -8.333 -4.180 20.595 1.00 20.21 H new ATOM 0 HD11 LEU A 75 -8.328 -1.765 21.076 1.00 31.25 H new ATOM 0 HD12 LEU A 75 -7.482 -2.137 19.555 1.00 31.25 H new ATOM 0 HD13 LEU A 75 -9.126 -1.456 19.516 1.00 31.25 H new ATOM 0 HD21 LEU A 75 -10.208 -3.171 21.836 1.00 1.31 H new ATOM 0 HD22 LEU A 75 -11.079 -2.918 20.305 1.00 1.31 H new ATOM 0 HD23 LEU A 75 -10.733 -4.570 20.869 1.00 1.31 H new ATOM 1154 N PHE A 76 -11.499 -5.951 18.425 1.00 74.45 N ATOM 1155 CA PHE A 76 -12.764 -6.535 18.857 1.00 61.12 C ATOM 1156 C PHE A 76 -12.669 -8.057 18.915 1.00 3.10 C ATOM 1157 O PHE A 76 -13.133 -8.684 19.868 1.00 62.32 O ATOM 1158 CB PHE A 76 -13.892 -6.119 17.910 1.00 21.33 C ATOM 1159 CG PHE A 76 -14.784 -5.050 18.474 1.00 63.13 C ATOM 1160 CD1 PHE A 76 -14.260 -3.831 18.871 1.00 4.24 C ATOM 1161 CD2 PHE A 76 -16.146 -5.265 18.606 1.00 12.33 C ATOM 1162 CE1 PHE A 76 -15.077 -2.845 19.390 1.00 55.51 C ATOM 1163 CE2 PHE A 76 -16.969 -4.282 19.124 1.00 60.23 C ATOM 1164 CZ PHE A 76 -16.434 -3.071 19.517 1.00 21.12 C ATOM 0 H PHE A 76 -11.579 -5.309 17.636 1.00 74.45 H new ATOM 0 HA PHE A 76 -12.984 -6.164 19.858 1.00 61.12 H new ATOM 0 HB2 PHE A 76 -13.458 -5.764 16.975 1.00 21.33 H new ATOM 0 HB3 PHE A 76 -14.495 -6.995 17.669 1.00 21.33 H new ATOM 0 HD1 PHE A 76 -13.200 -3.649 18.774 1.00 4.24 H new ATOM 0 HD2 PHE A 76 -16.570 -6.210 18.301 1.00 12.33 H new ATOM 0 HE1 PHE A 76 -14.655 -1.899 19.696 1.00 55.51 H new ATOM 0 HE2 PHE A 76 -18.030 -4.461 19.221 1.00 60.23 H new ATOM 0 HZ PHE A 76 -17.075 -2.302 19.923 1.00 21.12 H new ATOM 1174 N THR A 77 -12.064 -8.646 17.888 1.00 4.10 N ATOM 1175 CA THR A 77 -11.908 -10.093 17.820 1.00 33.42 C ATOM 1176 C THR A 77 -11.018 -10.604 18.947 1.00 63.21 C ATOM 1177 O THR A 77 -11.286 -11.650 19.537 1.00 61.53 O ATOM 1178 CB THR A 77 -11.311 -10.532 16.470 1.00 44.42 C ATOM 1179 OG1 THR A 77 -12.165 -10.116 15.398 1.00 23.22 O ATOM 1180 CG2 THR A 77 -11.128 -12.041 16.423 1.00 23.14 C ATOM 0 H THR A 77 -11.674 -8.142 17.092 1.00 4.10 H new ATOM 0 HA THR A 77 -12.904 -10.523 17.924 1.00 33.42 H new ATOM 0 HB THR A 77 -10.334 -10.061 16.360 1.00 44.42 H new ATOM 0 HG1 THR A 77 -11.716 -10.275 14.542 1.00 23.22 H new ATOM 0 HG21 THR A 77 -10.705 -12.326 15.460 1.00 23.14 H new ATOM 0 HG22 THR A 77 -10.454 -12.351 17.221 1.00 23.14 H new ATOM 0 HG23 THR A 77 -12.094 -12.529 16.554 1.00 23.14 H new ATOM 1188 N MET A 78 -9.958 -9.859 19.241 1.00 4.23 N ATOM 1189 CA MET A 78 -9.028 -10.236 20.300 1.00 73.52 C ATOM 1190 C MET A 78 -9.708 -10.183 21.664 1.00 2.24 C ATOM 1191 O MET A 78 -9.532 -11.079 22.491 1.00 54.32 O ATOM 1192 CB MET A 78 -7.807 -9.315 20.289 1.00 71.05 C ATOM 1193 CG MET A 78 -6.599 -9.916 19.590 1.00 65.32 C ATOM 1194 SD MET A 78 -5.039 -9.251 20.203 1.00 11.23 S ATOM 1195 CE MET A 78 -3.904 -9.833 18.946 1.00 73.30 C ATOM 0 H MET A 78 -9.721 -8.991 18.761 1.00 4.23 H new ATOM 0 HA MET A 78 -8.702 -11.260 20.116 1.00 73.52 H new ATOM 0 HB2 MET A 78 -8.073 -8.379 19.797 1.00 71.05 H new ATOM 0 HB3 MET A 78 -7.537 -9.070 21.316 1.00 71.05 H new ATOM 0 HG2 MET A 78 -6.607 -10.998 19.726 1.00 65.32 H new ATOM 0 HG3 MET A 78 -6.673 -9.728 18.519 1.00 65.32 H new ATOM 0 HE1 MET A 78 -2.907 -9.442 19.147 1.00 73.30 H new ATOM 0 HE2 MET A 78 -3.876 -10.923 18.958 1.00 73.30 H new ATOM 0 HE3 MET A 78 -4.238 -9.489 17.967 1.00 73.30 H new ATOM 1205 N ILE A 79 -10.483 -9.128 21.894 1.00 44.05 N ATOM 1206 CA ILE A 79 -11.188 -8.959 23.158 1.00 73.33 C ATOM 1207 C ILE A 79 -12.331 -9.961 23.288 1.00 64.15 C ATOM 1208 O ILE A 79 -12.702 -10.355 24.393 1.00 33.31 O ATOM 1209 CB ILE A 79 -11.752 -7.533 23.302 1.00 71.42 C ATOM 1210 CG1 ILE A 79 -10.613 -6.513 23.347 1.00 23.25 C ATOM 1211 CG2 ILE A 79 -12.615 -7.429 24.551 1.00 43.44 C ATOM 1212 CD1 ILE A 79 -9.797 -6.575 24.620 1.00 64.44 C ATOM 0 H ILE A 79 -10.638 -8.378 21.221 1.00 44.05 H new ATOM 0 HA ILE A 79 -10.461 -9.135 23.951 1.00 73.33 H new ATOM 0 HB ILE A 79 -12.375 -7.314 22.435 1.00 71.42 H new ATOM 0 HG12 ILE A 79 -9.954 -6.678 22.494 1.00 23.25 H new ATOM 0 HG13 ILE A 79 -11.029 -5.511 23.240 1.00 23.25 H new ATOM 0 HG21 ILE A 79 -13.007 -6.416 24.639 1.00 43.44 H new ATOM 0 HG22 ILE A 79 -13.444 -8.133 24.480 1.00 43.44 H new ATOM 0 HG23 ILE A 79 -12.014 -7.663 25.429 1.00 43.44 H new ATOM 0 HD11 ILE A 79 -9.007 -5.824 24.583 1.00 64.44 H new ATOM 0 HD12 ILE A 79 -10.443 -6.380 25.476 1.00 64.44 H new ATOM 0 HD13 ILE A 79 -9.352 -7.565 24.719 1.00 64.44 H new ATOM 1224 N PHE A 80 -12.883 -10.371 22.150 1.00 0.15 N ATOM 1225 CA PHE A 80 -13.983 -11.328 22.136 1.00 20.24 C ATOM 1226 C PHE A 80 -13.504 -12.713 22.562 1.00 72.12 C ATOM 1227 O PHE A 80 -14.072 -13.329 23.464 1.00 2.43 O ATOM 1228 CB PHE A 80 -14.608 -11.398 20.742 1.00 72.44 C ATOM 1229 CG PHE A 80 -16.022 -11.906 20.743 1.00 23.12 C ATOM 1230 CD1 PHE A 80 -16.284 -13.265 20.811 1.00 3.12 C ATOM 1231 CD2 PHE A 80 -17.089 -11.024 20.676 1.00 25.50 C ATOM 1232 CE1 PHE A 80 -17.583 -13.736 20.813 1.00 14.52 C ATOM 1233 CE2 PHE A 80 -18.390 -11.489 20.678 1.00 31.11 C ATOM 1234 CZ PHE A 80 -18.638 -12.846 20.746 1.00 61.35 C ATOM 0 H PHE A 80 -12.586 -10.055 21.226 1.00 0.15 H new ATOM 0 HA PHE A 80 -14.736 -10.989 22.847 1.00 20.24 H new ATOM 0 HB2 PHE A 80 -14.588 -10.405 20.293 1.00 72.44 H new ATOM 0 HB3 PHE A 80 -13.998 -12.045 20.111 1.00 72.44 H new ATOM 0 HD1 PHE A 80 -15.463 -13.965 20.863 1.00 3.12 H new ATOM 0 HD2 PHE A 80 -16.901 -9.962 20.622 1.00 25.50 H new ATOM 0 HE1 PHE A 80 -17.773 -14.798 20.867 1.00 14.52 H new ATOM 0 HE2 PHE A 80 -19.213 -10.791 20.626 1.00 31.11 H new ATOM 0 HZ PHE A 80 -19.655 -13.211 20.747 1.00 61.35 H new ATOM 1244 N VAL A 81 -12.456 -13.198 21.904 1.00 24.02 N ATOM 1245 CA VAL A 81 -11.899 -14.510 22.213 1.00 11.33 C ATOM 1246 C VAL A 81 -11.353 -14.553 23.636 1.00 64.41 C ATOM 1247 O VAL A 81 -11.351 -15.603 24.281 1.00 41.41 O ATOM 1248 CB VAL A 81 -10.775 -14.888 21.231 1.00 5.02 C ATOM 1249 CG1 VAL A 81 -11.305 -14.940 19.807 1.00 61.45 C ATOM 1250 CG2 VAL A 81 -9.618 -13.906 21.343 1.00 61.15 C ATOM 0 H VAL A 81 -11.975 -12.702 21.153 1.00 24.02 H new ATOM 0 HA VAL A 81 -12.712 -15.230 22.117 1.00 11.33 H new ATOM 0 HB VAL A 81 -10.406 -15.880 21.492 1.00 5.02 H new ATOM 0 HG11 VAL A 81 -10.496 -15.209 19.127 1.00 61.45 H new ATOM 0 HG12 VAL A 81 -12.097 -15.685 19.741 1.00 61.45 H new ATOM 0 HG13 VAL A 81 -11.702 -13.963 19.531 1.00 61.45 H new ATOM 0 HG21 VAL A 81 -8.832 -14.188 20.642 1.00 61.15 H new ATOM 0 HG22 VAL A 81 -9.970 -12.901 21.109 1.00 61.15 H new ATOM 0 HG23 VAL A 81 -9.222 -13.924 22.358 1.00 61.15 H new ATOM 1260 N THR A 82 -10.889 -13.406 24.121 1.00 24.04 N ATOM 1261 CA THR A 82 -10.339 -13.313 25.468 1.00 44.52 C ATOM 1262 C THR A 82 -11.364 -13.741 26.511 1.00 25.54 C ATOM 1263 O THR A 82 -11.126 -14.671 27.284 1.00 14.01 O ATOM 1264 CB THR A 82 -9.869 -11.880 25.785 1.00 62.25 C ATOM 1265 OG1 THR A 82 -8.633 -11.610 25.114 1.00 24.51 O ATOM 1266 CG2 THR A 82 -9.691 -11.688 27.283 1.00 14.21 C ATOM 0 H THR A 82 -10.883 -12.528 23.601 1.00 24.04 H new ATOM 0 HA THR A 82 -9.482 -13.986 25.507 1.00 44.52 H new ATOM 0 HB THR A 82 -10.632 -11.185 25.434 1.00 62.25 H new ATOM 0 HG1 THR A 82 -8.810 -11.408 24.172 1.00 24.51 H new ATOM 0 HG21 THR A 82 -9.359 -10.669 27.482 1.00 14.21 H new ATOM 0 HG22 THR A 82 -10.641 -11.865 27.788 1.00 14.21 H new ATOM 0 HG23 THR A 82 -8.946 -12.392 27.654 1.00 14.21 H new ATOM 1274 N LEU A 83 -12.504 -13.060 26.529 1.00 43.10 N ATOM 1275 CA LEU A 83 -13.567 -13.371 27.478 1.00 24.33 C ATOM 1276 C LEU A 83 -14.131 -14.766 27.225 1.00 13.55 C ATOM 1277 O LEU A 83 -14.670 -15.402 28.131 1.00 3.24 O ATOM 1278 CB LEU A 83 -14.684 -12.331 27.382 1.00 1.04 C ATOM 1279 CG LEU A 83 -15.777 -12.613 26.351 1.00 43.24 C ATOM 1280 CD1 LEU A 83 -16.937 -13.359 26.992 1.00 44.33 C ATOM 1281 CD2 LEU A 83 -16.259 -11.316 25.717 1.00 71.10 C ATOM 0 H LEU A 83 -12.716 -12.288 25.897 1.00 43.10 H new ATOM 0 HA LEU A 83 -13.143 -13.347 28.482 1.00 24.33 H new ATOM 0 HB2 LEU A 83 -15.152 -12.238 28.362 1.00 1.04 H new ATOM 0 HB3 LEU A 83 -14.235 -11.365 27.151 1.00 1.04 H new ATOM 0 HG LEU A 83 -15.357 -13.243 25.567 1.00 43.24 H new ATOM 0 HD11 LEU A 83 -17.705 -13.551 26.243 1.00 44.33 H new ATOM 0 HD12 LEU A 83 -16.581 -14.306 27.397 1.00 44.33 H new ATOM 0 HD13 LEU A 83 -17.358 -12.756 27.796 1.00 44.33 H new ATOM 0 HD21 LEU A 83 -17.037 -11.536 24.986 1.00 71.10 H new ATOM 0 HD22 LEU A 83 -16.662 -10.661 26.490 1.00 71.10 H new ATOM 0 HD23 LEU A 83 -15.424 -10.821 25.221 1.00 71.10 H new ATOM 1293 N SER A 84 -14.003 -15.235 25.989 1.00 63.23 N ATOM 1294 CA SER A 84 -14.502 -16.554 25.616 1.00 5.20 C ATOM 1295 C SER A 84 -13.731 -17.652 26.344 1.00 54.53 C ATOM 1296 O SER A 84 -14.325 -18.534 26.964 1.00 20.03 O ATOM 1297 CB SER A 84 -14.392 -16.755 24.103 1.00 1.04 C ATOM 1298 OG SER A 84 -15.665 -16.682 23.486 1.00 51.55 O ATOM 0 H SER A 84 -13.558 -14.722 25.228 1.00 63.23 H new ATOM 0 HA SER A 84 -15.550 -16.615 25.908 1.00 5.20 H new ATOM 0 HB2 SER A 84 -13.735 -15.996 23.679 1.00 1.04 H new ATOM 0 HB3 SER A 84 -13.938 -17.723 23.894 1.00 1.04 H new ATOM 0 HG SER A 84 -15.809 -17.481 22.937 1.00 51.55 H new ATOM 1304 N ILE A 85 -12.407 -17.590 26.262 1.00 3.42 N ATOM 1305 CA ILE A 85 -11.555 -18.577 26.913 1.00 22.02 C ATOM 1306 C ILE A 85 -11.691 -18.506 28.430 1.00 11.13 C ATOM 1307 O ILE A 85 -11.433 -19.483 29.134 1.00 14.52 O ATOM 1308 CB ILE A 85 -10.075 -18.383 26.532 1.00 12.33 C ATOM 1309 CG1 ILE A 85 -9.898 -18.487 25.016 1.00 33.41 C ATOM 1310 CG2 ILE A 85 -9.206 -19.408 27.245 1.00 61.15 C ATOM 1311 CD1 ILE A 85 -9.020 -17.402 24.434 1.00 55.12 C ATOM 0 H ILE A 85 -11.901 -16.867 25.751 1.00 3.42 H new ATOM 0 HA ILE A 85 -11.886 -19.556 26.566 1.00 22.02 H new ATOM 0 HB ILE A 85 -9.761 -17.388 26.847 1.00 12.33 H new ATOM 0 HG12 ILE A 85 -9.468 -19.459 24.774 1.00 33.41 H new ATOM 0 HG13 ILE A 85 -10.878 -18.444 24.540 1.00 33.41 H new ATOM 0 HG21 ILE A 85 -8.163 -19.258 26.966 1.00 61.15 H new ATOM 0 HG22 ILE A 85 -9.314 -19.289 28.323 1.00 61.15 H new ATOM 0 HG23 ILE A 85 -9.518 -20.412 26.958 1.00 61.15 H new ATOM 0 HD11 ILE A 85 -8.939 -17.539 23.356 1.00 55.12 H new ATOM 0 HD12 ILE A 85 -9.459 -16.427 24.644 1.00 55.12 H new ATOM 0 HD13 ILE A 85 -8.028 -17.457 24.882 1.00 55.12 H new ATOM 1323 N VAL A 86 -12.100 -17.343 28.928 1.00 22.24 N ATOM 1324 CA VAL A 86 -12.274 -17.145 30.362 1.00 2.44 C ATOM 1325 C VAL A 86 -13.621 -17.681 30.832 1.00 55.21 C ATOM 1326 O VAL A 86 -13.701 -18.405 31.825 1.00 40.50 O ATOM 1327 CB VAL A 86 -12.167 -15.655 30.740 1.00 65.22 C ATOM 1328 CG1 VAL A 86 -13.110 -15.325 31.886 1.00 34.31 C ATOM 1329 CG2 VAL A 86 -10.732 -15.299 31.100 1.00 31.32 C ATOM 0 H VAL A 86 -12.317 -16.524 28.360 1.00 22.24 H new ATOM 0 HA VAL A 86 -11.474 -17.697 30.856 1.00 2.44 H new ATOM 0 HB VAL A 86 -12.460 -15.057 29.877 1.00 65.22 H new ATOM 0 HG11 VAL A 86 -13.020 -14.268 32.139 1.00 34.31 H new ATOM 0 HG12 VAL A 86 -14.136 -15.540 31.587 1.00 34.31 H new ATOM 0 HG13 VAL A 86 -12.851 -15.929 32.756 1.00 34.31 H new ATOM 0 HG21 VAL A 86 -10.674 -14.243 31.364 1.00 31.32 H new ATOM 0 HG22 VAL A 86 -10.409 -15.903 31.948 1.00 31.32 H new ATOM 0 HG23 VAL A 86 -10.083 -15.495 30.246 1.00 31.32 H new ATOM 1339 N ILE A 87 -14.678 -17.321 30.111 1.00 35.54 N ATOM 1340 CA ILE A 87 -16.023 -17.768 30.454 1.00 51.04 C ATOM 1341 C ILE A 87 -16.204 -19.251 30.148 1.00 55.13 C ATOM 1342 O ILE A 87 -17.015 -19.932 30.777 1.00 40.01 O ATOM 1343 CB ILE A 87 -17.094 -16.964 29.693 1.00 40.20 C ATOM 1344 CG1 ILE A 87 -17.065 -15.497 30.127 1.00 14.11 C ATOM 1345 CG2 ILE A 87 -18.472 -17.564 29.926 1.00 33.12 C ATOM 1346 CD1 ILE A 87 -17.366 -15.295 31.596 1.00 62.51 C ATOM 0 H ILE A 87 -14.629 -16.722 29.287 1.00 35.54 H new ATOM 0 HA ILE A 87 -16.148 -17.602 31.524 1.00 51.04 H new ATOM 0 HB ILE A 87 -16.874 -17.012 28.626 1.00 40.20 H new ATOM 0 HG12 ILE A 87 -16.083 -15.080 29.905 1.00 14.11 H new ATOM 0 HG13 ILE A 87 -17.790 -14.937 29.536 1.00 14.11 H new ATOM 0 HG21 ILE A 87 -19.218 -16.985 29.382 1.00 33.12 H new ATOM 0 HG22 ILE A 87 -18.484 -18.595 29.572 1.00 33.12 H new ATOM 0 HG23 ILE A 87 -18.703 -17.543 30.991 1.00 33.12 H new ATOM 0 HD11 ILE A 87 -17.328 -14.232 31.832 1.00 62.51 H new ATOM 0 HD12 ILE A 87 -18.360 -15.681 31.820 1.00 62.51 H new ATOM 0 HD13 ILE A 87 -16.627 -15.826 32.195 1.00 62.51 H new ATOM 1358 N THR A 88 -15.443 -19.747 29.178 1.00 43.04 N ATOM 1359 CA THR A 88 -15.518 -21.149 28.788 1.00 32.31 C ATOM 1360 C THR A 88 -14.859 -22.046 29.830 1.00 45.42 C ATOM 1361 O THR A 88 -15.440 -23.038 30.268 1.00 75.25 O ATOM 1362 CB THR A 88 -14.848 -21.390 27.422 1.00 11.11 C ATOM 1363 OG1 THR A 88 -15.598 -20.743 26.388 1.00 71.22 O ATOM 1364 CG2 THR A 88 -14.744 -22.878 27.125 1.00 22.21 C ATOM 0 H THR A 88 -14.767 -19.198 28.647 1.00 43.04 H new ATOM 0 HA THR A 88 -16.576 -21.399 28.714 1.00 32.31 H new ATOM 0 HB THR A 88 -13.842 -20.972 27.457 1.00 11.11 H new ATOM 0 HG1 THR A 88 -15.190 -19.876 26.181 1.00 71.22 H new ATOM 0 HG21 THR A 88 -14.268 -23.023 26.155 1.00 22.21 H new ATOM 0 HG22 THR A 88 -14.148 -23.363 27.898 1.00 22.21 H new ATOM 0 HG23 THR A 88 -15.742 -23.316 27.108 1.00 22.21 H new ATOM 1372 N VAL A 89 -13.640 -21.689 30.224 1.00 31.12 N ATOM 1373 CA VAL A 89 -12.902 -22.461 31.217 1.00 44.42 C ATOM 1374 C VAL A 89 -13.576 -22.388 32.582 1.00 33.51 C ATOM 1375 O VAL A 89 -13.401 -23.273 33.421 1.00 42.52 O ATOM 1376 CB VAL A 89 -11.450 -21.964 31.347 1.00 4.31 C ATOM 1377 CG1 VAL A 89 -11.371 -20.792 32.314 1.00 23.10 C ATOM 1378 CG2 VAL A 89 -10.537 -23.096 31.793 1.00 34.34 C ATOM 0 H VAL A 89 -13.143 -20.871 29.871 1.00 31.12 H new ATOM 0 HA VAL A 89 -12.896 -23.495 30.873 1.00 44.42 H new ATOM 0 HB VAL A 89 -11.113 -21.620 30.369 1.00 4.31 H new ATOM 0 HG11 VAL A 89 -10.338 -20.454 32.393 1.00 23.10 H new ATOM 0 HG12 VAL A 89 -11.993 -19.975 31.947 1.00 23.10 H new ATOM 0 HG13 VAL A 89 -11.726 -21.106 33.296 1.00 23.10 H new ATOM 0 HG21 VAL A 89 -9.515 -22.727 31.880 1.00 34.34 H new ATOM 0 HG22 VAL A 89 -10.870 -23.472 32.760 1.00 34.34 H new ATOM 0 HG23 VAL A 89 -10.571 -23.901 31.059 1.00 34.34 H new ATOM 1388 N PHE A 90 -14.350 -21.330 32.799 1.00 43.35 N ATOM 1389 CA PHE A 90 -15.051 -21.141 34.063 1.00 75.31 C ATOM 1390 C PHE A 90 -16.178 -22.159 34.216 1.00 14.42 C ATOM 1391 O PHE A 90 -16.195 -22.945 35.163 1.00 34.12 O ATOM 1392 CB PHE A 90 -15.615 -19.722 34.151 1.00 54.41 C ATOM 1393 CG PHE A 90 -14.784 -18.797 34.994 1.00 63.45 C ATOM 1394 CD1 PHE A 90 -13.403 -18.786 34.877 1.00 31.31 C ATOM 1395 CD2 PHE A 90 -15.383 -17.940 35.903 1.00 65.14 C ATOM 1396 CE1 PHE A 90 -12.635 -17.937 35.651 1.00 42.23 C ATOM 1397 CE2 PHE A 90 -14.619 -17.088 36.679 1.00 75.25 C ATOM 1398 CZ PHE A 90 -13.244 -17.087 36.553 1.00 21.44 C ATOM 0 H PHE A 90 -14.508 -20.590 32.115 1.00 43.35 H new ATOM 0 HA PHE A 90 -14.336 -21.291 34.872 1.00 75.31 H new ATOM 0 HB2 PHE A 90 -15.697 -19.309 33.145 1.00 54.41 H new ATOM 0 HB3 PHE A 90 -16.624 -19.766 34.561 1.00 54.41 H new ATOM 0 HD1 PHE A 90 -12.922 -19.448 34.173 1.00 31.31 H new ATOM 0 HD2 PHE A 90 -16.458 -17.937 36.007 1.00 65.14 H new ATOM 0 HE1 PHE A 90 -11.560 -17.938 35.551 1.00 42.23 H new ATOM 0 HE2 PHE A 90 -15.097 -16.424 37.383 1.00 75.25 H new ATOM 0 HZ PHE A 90 -12.646 -16.423 37.159 1.00 21.44 H new ATOM 1408 N VAL A 91 -17.119 -22.137 33.278 1.00 53.44 N ATOM 1409 CA VAL A 91 -18.250 -23.056 33.307 1.00 73.30 C ATOM 1410 C VAL A 91 -17.779 -24.504 33.395 1.00 14.43 C ATOM 1411 O VAL A 91 -18.445 -25.349 33.994 1.00 31.34 O ATOM 1412 CB VAL A 91 -19.140 -22.892 32.060 1.00 24.51 C ATOM 1413 CG1 VAL A 91 -18.303 -22.979 30.792 1.00 34.55 C ATOM 1414 CG2 VAL A 91 -20.244 -23.938 32.053 1.00 71.41 C ATOM 0 H VAL A 91 -17.120 -21.492 32.488 1.00 53.44 H new ATOM 0 HA VAL A 91 -18.833 -22.812 34.195 1.00 73.30 H new ATOM 0 HB VAL A 91 -19.605 -21.907 32.093 1.00 24.51 H new ATOM 0 HG11 VAL A 91 -18.948 -22.861 29.921 1.00 34.55 H new ATOM 0 HG12 VAL A 91 -17.552 -22.189 30.797 1.00 34.55 H new ATOM 0 HG13 VAL A 91 -17.808 -23.949 30.748 1.00 34.55 H new ATOM 0 HG21 VAL A 91 -20.863 -23.808 31.165 1.00 71.41 H new ATOM 0 HG22 VAL A 91 -19.801 -24.934 32.044 1.00 71.41 H new ATOM 0 HG23 VAL A 91 -20.860 -23.823 32.945 1.00 71.41 H new ATOM 1424 N LEU A 92 -16.628 -24.783 32.795 1.00 5.33 N ATOM 1425 CA LEU A 92 -16.066 -26.129 32.806 1.00 4.12 C ATOM 1426 C LEU A 92 -15.261 -26.373 34.079 1.00 40.12 C ATOM 1427 O LEU A 92 -15.060 -27.515 34.488 1.00 24.40 O ATOM 1428 CB LEU A 92 -15.178 -26.342 31.579 1.00 63.20 C ATOM 1429 CG LEU A 92 -14.527 -27.720 31.453 1.00 43.02 C ATOM 1430 CD1 LEU A 92 -14.560 -28.196 30.009 1.00 52.02 C ATOM 1431 CD2 LEU A 92 -13.096 -27.684 31.971 1.00 14.52 C ATOM 0 H LEU A 92 -16.065 -24.095 32.294 1.00 5.33 H new ATOM 0 HA LEU A 92 -16.891 -26.841 32.778 1.00 4.12 H new ATOM 0 HB2 LEU A 92 -15.777 -26.162 30.686 1.00 63.20 H new ATOM 0 HB3 LEU A 92 -14.390 -25.589 31.591 1.00 63.20 H new ATOM 0 HG LEU A 92 -15.095 -28.425 32.060 1.00 43.02 H new ATOM 0 HD11 LEU A 92 -14.092 -29.178 29.939 1.00 52.02 H new ATOM 0 HD12 LEU A 92 -15.594 -28.262 29.671 1.00 52.02 H new ATOM 0 HD13 LEU A 92 -14.017 -27.490 29.381 1.00 52.02 H new ATOM 0 HD21 LEU A 92 -12.649 -28.673 31.873 1.00 14.52 H new ATOM 0 HD22 LEU A 92 -12.517 -26.965 31.391 1.00 14.52 H new ATOM 0 HD23 LEU A 92 -13.096 -27.388 33.020 1.00 14.52 H new ATOM 1443 N ASN A 93 -14.805 -25.291 34.701 1.00 11.41 N ATOM 1444 CA ASN A 93 -14.024 -25.387 35.929 1.00 62.02 C ATOM 1445 C ASN A 93 -14.912 -25.762 37.111 1.00 12.11 C ATOM 1446 O ASN A 93 -14.585 -26.659 37.888 1.00 62.34 O ATOM 1447 CB ASN A 93 -13.313 -24.062 36.211 1.00 43.12 C ATOM 1448 CG ASN A 93 -13.160 -23.792 37.695 1.00 23.43 C ATOM 1449 OD1 ASN A 93 -12.413 -24.483 38.389 1.00 0.21 O ATOM 1450 ND2 ASN A 93 -13.869 -22.784 38.190 1.00 63.34 N ATOM 0 H ASN A 93 -14.963 -24.337 34.375 1.00 11.41 H new ATOM 0 HA ASN A 93 -13.278 -26.171 35.795 1.00 62.02 H new ATOM 0 HB2 ASN A 93 -12.328 -24.075 35.743 1.00 43.12 H new ATOM 0 HB3 ASN A 93 -13.873 -23.247 35.752 1.00 43.12 H new ATOM 0 HD21 ASN A 93 -13.807 -22.556 39.182 1.00 63.34 H new ATOM 0 HD22 ASN A 93 -14.475 -22.238 37.578 1.00 63.34 H new ATOM 1457 N VAL A 94 -16.039 -25.069 37.241 1.00 41.50 N ATOM 1458 CA VAL A 94 -16.976 -25.329 38.327 1.00 71.30 C ATOM 1459 C VAL A 94 -17.455 -26.776 38.304 1.00 72.41 C ATOM 1460 O VAL A 94 -17.677 -27.351 37.238 1.00 73.33 O ATOM 1461 CB VAL A 94 -18.198 -24.394 38.251 1.00 63.33 C ATOM 1462 CG1 VAL A 94 -19.094 -24.781 37.084 1.00 12.23 C ATOM 1463 CG2 VAL A 94 -18.971 -24.421 39.560 1.00 34.32 C ATOM 0 H VAL A 94 -16.325 -24.323 36.607 1.00 41.50 H new ATOM 0 HA VAL A 94 -16.442 -25.140 39.258 1.00 71.30 H new ATOM 0 HB VAL A 94 -17.846 -23.376 38.085 1.00 63.33 H new ATOM 0 HG11 VAL A 94 -19.952 -24.110 37.046 1.00 12.23 H new ATOM 0 HG12 VAL A 94 -18.532 -24.705 36.153 1.00 12.23 H new ATOM 0 HG13 VAL A 94 -19.441 -25.806 37.216 1.00 12.23 H new ATOM 0 HG21 VAL A 94 -19.831 -23.755 39.489 1.00 34.32 H new ATOM 0 HG22 VAL A 94 -19.314 -25.436 39.759 1.00 34.32 H new ATOM 0 HG23 VAL A 94 -18.323 -24.091 40.372 1.00 34.32 H new ATOM 1644 N GLY A 108 -26.923 -30.208 24.292 1.00 54.13 N ATOM 1645 CA GLY A 108 -26.719 -29.453 23.069 1.00 1.24 C ATOM 1646 C GLY A 108 -25.941 -28.173 23.302 1.00 42.12 C ATOM 1647 O GLY A 108 -25.959 -27.267 22.468 1.00 75.45 O ATOM 0 HA2 GLY A 108 -26.186 -30.072 22.348 1.00 1.24 H new ATOM 0 HA3 GLY A 108 -27.686 -29.212 22.629 1.00 1.24 H new ATOM 1651 N ILE A 109 -25.257 -28.096 24.438 1.00 24.42 N ATOM 1652 CA ILE A 109 -24.469 -26.917 24.777 1.00 35.55 C ATOM 1653 C ILE A 109 -23.163 -26.884 23.991 1.00 13.43 C ATOM 1654 O ILE A 109 -22.602 -25.816 23.745 1.00 15.42 O ATOM 1655 CB ILE A 109 -24.151 -26.868 26.283 1.00 4.24 C ATOM 1656 CG1 ILE A 109 -25.423 -27.087 27.104 1.00 72.50 C ATOM 1657 CG2 ILE A 109 -23.504 -25.539 26.644 1.00 1.23 C ATOM 1658 CD1 ILE A 109 -25.184 -27.102 28.598 1.00 52.45 C ATOM 0 H ILE A 109 -25.232 -28.836 25.140 1.00 24.42 H new ATOM 0 HA ILE A 109 -25.071 -26.048 24.512 1.00 35.55 H new ATOM 0 HB ILE A 109 -23.449 -27.668 26.517 1.00 4.24 H new ATOM 0 HG12 ILE A 109 -26.139 -26.300 26.867 1.00 72.50 H new ATOM 0 HG13 ILE A 109 -25.879 -28.032 26.808 1.00 72.50 H new ATOM 0 HG21 ILE A 109 -23.285 -25.519 27.712 1.00 1.23 H new ATOM 0 HG22 ILE A 109 -22.578 -25.420 26.081 1.00 1.23 H new ATOM 0 HG23 ILE A 109 -24.185 -24.724 26.398 1.00 1.23 H new ATOM 0 HD11 ILE A 109 -26.130 -27.262 29.116 1.00 52.45 H new ATOM 0 HD12 ILE A 109 -24.493 -27.907 28.848 1.00 52.45 H new ATOM 0 HD13 ILE A 109 -24.757 -26.148 28.908 1.00 52.45 H new ATOM 1670 N ASP A 110 -22.685 -28.059 23.598 1.00 33.13 N ATOM 1671 CA ASP A 110 -21.446 -28.165 22.837 1.00 51.43 C ATOM 1672 C ASP A 110 -21.666 -27.761 21.382 1.00 74.40 C ATOM 1673 O ASP A 110 -20.910 -26.964 20.827 1.00 11.24 O ATOM 1674 CB ASP A 110 -20.900 -29.591 22.906 1.00 24.43 C ATOM 1675 CG ASP A 110 -19.588 -29.673 23.662 1.00 44.44 C ATOM 1676 OD1 ASP A 110 -19.582 -29.377 24.875 1.00 2.40 O ATOM 1677 OD2 ASP A 110 -18.567 -30.033 23.040 1.00 62.05 O ATOM 0 H ASP A 110 -23.137 -28.952 23.794 1.00 33.13 H new ATOM 0 HA ASP A 110 -20.718 -27.484 23.279 1.00 51.43 H new ATOM 0 HB2 ASP A 110 -21.635 -30.235 23.389 1.00 24.43 H new ATOM 0 HB3 ASP A 110 -20.758 -29.972 21.895 1.00 24.43 H new ATOM 1682 N ARG A 111 -22.706 -28.319 20.770 1.00 41.33 N ATOM 1683 CA ARG A 111 -23.024 -28.019 19.379 1.00 51.01 C ATOM 1684 C ARG A 111 -23.306 -26.531 19.194 1.00 2.32 C ATOM 1685 O ARG A 111 -22.851 -25.918 18.227 1.00 34.52 O ATOM 1686 CB ARG A 111 -24.233 -28.838 18.922 1.00 64.20 C ATOM 1687 CG ARG A 111 -25.460 -28.653 19.799 1.00 75.15 C ATOM 1688 CD ARG A 111 -26.530 -29.688 19.486 1.00 65.34 C ATOM 1689 NE ARG A 111 -27.877 -29.143 19.624 1.00 51.41 N ATOM 1690 CZ ARG A 111 -28.971 -29.893 19.691 1.00 63.50 C ATOM 1691 NH1 ARG A 111 -28.876 -31.215 19.633 1.00 13.33 N ATOM 1692 NH2 ARG A 111 -30.162 -29.323 19.817 1.00 51.13 N ATOM 0 H ARG A 111 -23.342 -28.981 21.215 1.00 41.33 H new ATOM 0 HA ARG A 111 -22.161 -28.286 18.770 1.00 51.01 H new ATOM 0 HB2 ARG A 111 -24.483 -28.560 17.898 1.00 64.20 H new ATOM 0 HB3 ARG A 111 -23.962 -29.894 18.909 1.00 64.20 H new ATOM 0 HG2 ARG A 111 -25.174 -28.730 20.848 1.00 75.15 H new ATOM 0 HG3 ARG A 111 -25.866 -27.652 19.652 1.00 75.15 H new ATOM 0 HD2 ARG A 111 -26.391 -30.057 18.470 1.00 65.34 H new ATOM 0 HD3 ARG A 111 -26.414 -30.542 20.154 1.00 65.34 H new ATOM 0 HE ARG A 111 -27.984 -28.130 19.672 1.00 51.41 H new ATOM 0 HH11 ARG A 111 -27.962 -31.657 19.537 1.00 13.33 H new ATOM 0 HH12 ARG A 111 -29.717 -31.790 19.685 1.00 13.33 H new ATOM 0 HH21 ARG A 111 -30.239 -28.307 19.863 1.00 51.13 H new ATOM 0 HH22 ARG A 111 -31.001 -29.901 19.868 1.00 51.13 H new ATOM 1706 N ILE A 112 -24.058 -25.956 20.127 1.00 63.02 N ATOM 1707 CA ILE A 112 -24.399 -24.540 20.067 1.00 71.23 C ATOM 1708 C ILE A 112 -23.193 -23.669 20.403 1.00 34.31 C ATOM 1709 O ILE A 112 -23.044 -22.567 19.876 1.00 41.23 O ATOM 1710 CB ILE A 112 -25.551 -24.197 21.030 1.00 23.42 C ATOM 1711 CG1 ILE A 112 -26.829 -24.928 20.612 1.00 3.44 C ATOM 1712 CG2 ILE A 112 -25.781 -22.694 21.067 1.00 60.04 C ATOM 1713 CD1 ILE A 112 -27.307 -24.563 19.225 1.00 40.45 C ATOM 0 H ILE A 112 -24.442 -26.449 20.933 1.00 63.02 H new ATOM 0 HA ILE A 112 -24.718 -24.335 19.045 1.00 71.23 H new ATOM 0 HB ILE A 112 -25.278 -24.527 22.032 1.00 23.42 H new ATOM 0 HG12 ILE A 112 -26.654 -26.003 20.656 1.00 3.44 H new ATOM 0 HG13 ILE A 112 -27.618 -24.704 21.330 1.00 3.44 H new ATOM 0 HG21 ILE A 112 -26.598 -22.468 21.752 1.00 60.04 H new ATOM 0 HG22 ILE A 112 -24.874 -22.195 21.407 1.00 60.04 H new ATOM 0 HG23 ILE A 112 -26.036 -22.340 20.068 1.00 60.04 H new ATOM 0 HD11 ILE A 112 -28.216 -25.118 18.996 1.00 40.45 H new ATOM 0 HD12 ILE A 112 -27.514 -23.494 19.181 1.00 40.45 H new ATOM 0 HD13 ILE A 112 -26.536 -24.813 18.497 1.00 40.45 H new ATOM 1725 N PHE A 113 -22.334 -24.172 21.283 1.00 33.24 N ATOM 1726 CA PHE A 113 -21.140 -23.441 21.690 1.00 12.41 C ATOM 1727 C PHE A 113 -20.300 -23.054 20.477 1.00 64.03 C ATOM 1728 O PHE A 113 -20.060 -21.873 20.224 1.00 40.51 O ATOM 1729 CB PHE A 113 -20.305 -24.283 22.656 1.00 5.01 C ATOM 1730 CG PHE A 113 -18.925 -23.736 22.889 1.00 70.42 C ATOM 1731 CD1 PHE A 113 -17.868 -24.118 22.078 1.00 54.22 C ATOM 1732 CD2 PHE A 113 -18.685 -22.841 23.919 1.00 21.40 C ATOM 1733 CE1 PHE A 113 -16.598 -23.616 22.289 1.00 23.40 C ATOM 1734 CE2 PHE A 113 -17.417 -22.336 24.135 1.00 64.43 C ATOM 1735 CZ PHE A 113 -16.372 -22.725 23.320 1.00 65.34 C ATOM 0 H PHE A 113 -22.443 -25.083 21.728 1.00 33.24 H new ATOM 0 HA PHE A 113 -21.457 -22.529 22.196 1.00 12.41 H new ATOM 0 HB2 PHE A 113 -20.826 -24.350 23.611 1.00 5.01 H new ATOM 0 HB3 PHE A 113 -20.224 -25.297 22.265 1.00 5.01 H new ATOM 0 HD1 PHE A 113 -18.039 -24.816 21.272 1.00 54.22 H new ATOM 0 HD2 PHE A 113 -19.498 -22.535 24.560 1.00 21.40 H new ATOM 0 HE1 PHE A 113 -15.783 -23.920 21.649 1.00 23.40 H new ATOM 0 HE2 PHE A 113 -17.243 -21.638 24.940 1.00 64.43 H new ATOM 0 HZ PHE A 113 -15.380 -22.333 23.489 1.00 65.34 H new ATOM 1745 N LEU A 114 -19.854 -24.058 19.729 1.00 10.24 N ATOM 1746 CA LEU A 114 -19.039 -23.825 18.542 1.00 52.40 C ATOM 1747 C LEU A 114 -19.836 -23.086 17.471 1.00 30.51 C ATOM 1748 O LEU A 114 -19.266 -22.403 16.621 1.00 53.52 O ATOM 1749 CB LEU A 114 -18.523 -25.152 17.985 1.00 24.40 C ATOM 1750 CG LEU A 114 -19.456 -25.884 17.020 1.00 32.12 C ATOM 1751 CD1 LEU A 114 -19.146 -25.499 15.582 1.00 63.40 C ATOM 1752 CD2 LEU A 114 -19.343 -27.390 17.208 1.00 70.04 C ATOM 0 H LEU A 114 -20.043 -25.041 19.924 1.00 10.24 H new ATOM 0 HA LEU A 114 -18.190 -23.205 18.830 1.00 52.40 H new ATOM 0 HB2 LEU A 114 -17.578 -24.966 17.474 1.00 24.40 H new ATOM 0 HB3 LEU A 114 -18.307 -25.815 18.823 1.00 24.40 H new ATOM 0 HG LEU A 114 -20.481 -25.587 17.240 1.00 32.12 H new ATOM 0 HD11 LEU A 114 -19.820 -26.030 14.910 1.00 63.40 H new ATOM 0 HD12 LEU A 114 -19.280 -24.425 15.456 1.00 63.40 H new ATOM 0 HD13 LEU A 114 -18.116 -25.766 15.348 1.00 63.40 H new ATOM 0 HD21 LEU A 114 -20.014 -27.895 16.513 1.00 70.04 H new ATOM 0 HD22 LEU A 114 -18.317 -27.705 17.015 1.00 70.04 H new ATOM 0 HD23 LEU A 114 -19.617 -27.651 18.230 1.00 70.04 H new ATOM 1764 N TRP A 115 -21.156 -23.228 17.520 1.00 25.24 N ATOM 1765 CA TRP A 115 -22.031 -22.573 16.555 1.00 10.34 C ATOM 1766 C TRP A 115 -22.016 -21.060 16.746 1.00 21.14 C ATOM 1767 O TRP A 115 -22.253 -20.304 15.805 1.00 61.23 O ATOM 1768 CB TRP A 115 -23.460 -23.102 16.690 1.00 3.02 C ATOM 1769 CG TRP A 115 -23.907 -23.911 15.511 1.00 72.14 C ATOM 1770 CD1 TRP A 115 -24.336 -25.208 15.521 1.00 14.53 C ATOM 1771 CD2 TRP A 115 -23.967 -23.478 14.147 1.00 15.44 C ATOM 1772 NE1 TRP A 115 -24.660 -25.606 14.247 1.00 61.22 N ATOM 1773 CE2 TRP A 115 -24.443 -24.563 13.386 1.00 72.02 C ATOM 1774 CE3 TRP A 115 -23.668 -22.278 13.496 1.00 30.12 C ATOM 1775 CZ2 TRP A 115 -24.624 -24.482 12.008 1.00 60.53 C ATOM 1776 CZ3 TRP A 115 -23.848 -22.200 12.128 1.00 3.23 C ATOM 1777 CH2 TRP A 115 -24.323 -23.296 11.396 1.00 3.00 C ATOM 0 H TRP A 115 -21.643 -23.791 18.217 1.00 25.24 H new ATOM 0 HA TRP A 115 -21.661 -22.798 15.555 1.00 10.34 H new ATOM 0 HB2 TRP A 115 -23.530 -23.714 17.589 1.00 3.02 H new ATOM 0 HB3 TRP A 115 -24.140 -22.261 16.823 1.00 3.02 H new ATOM 0 HD1 TRP A 115 -24.410 -25.829 16.401 1.00 14.53 H new ATOM 0 HE1 TRP A 115 -25.006 -26.529 13.985 1.00 61.22 H new ATOM 0 HE3 TRP A 115 -23.303 -21.427 14.052 1.00 30.12 H new ATOM 0 HZ2 TRP A 115 -24.989 -25.326 11.442 1.00 60.53 H new ATOM 0 HZ3 TRP A 115 -23.619 -21.278 11.614 1.00 3.23 H new ATOM 0 HH2 TRP A 115 -24.454 -23.203 10.328 1.00 3.00 H new ATOM 1788 N MET A 116 -21.736 -20.625 17.971 1.00 63.33 N ATOM 1789 CA MET A 116 -21.689 -19.202 18.283 1.00 3.35 C ATOM 1790 C MET A 116 -20.381 -18.582 17.801 1.00 22.14 C ATOM 1791 O MET A 116 -20.381 -17.547 17.135 1.00 54.02 O ATOM 1792 CB MET A 116 -21.845 -18.983 19.790 1.00 75.25 C ATOM 1793 CG MET A 116 -22.885 -17.933 20.146 1.00 5.33 C ATOM 1794 SD MET A 116 -22.163 -16.482 20.938 1.00 64.41 S ATOM 1795 CE MET A 116 -20.832 -16.103 19.801 1.00 63.33 C ATOM 0 H MET A 116 -21.539 -21.237 18.762 1.00 63.33 H new ATOM 0 HA MET A 116 -22.515 -18.715 17.764 1.00 3.35 H new ATOM 0 HB2 MET A 116 -22.118 -19.928 20.260 1.00 75.25 H new ATOM 0 HB3 MET A 116 -20.883 -18.686 20.207 1.00 75.25 H new ATOM 0 HG2 MET A 116 -23.410 -17.625 19.241 1.00 5.33 H new ATOM 0 HG3 MET A 116 -23.628 -18.374 20.811 1.00 5.33 H new ATOM 0 HE1 MET A 116 -20.462 -15.096 19.996 1.00 63.33 H new ATOM 0 HE2 MET A 116 -20.022 -16.820 19.937 1.00 63.33 H new ATOM 0 HE3 MET A 116 -21.200 -16.162 18.777 1.00 63.33 H new ATOM 1805 N PHE A 117 -19.267 -19.222 18.143 1.00 51.41 N ATOM 1806 CA PHE A 117 -17.952 -18.732 17.746 1.00 71.12 C ATOM 1807 C PHE A 117 -17.897 -18.478 16.242 1.00 35.22 C ATOM 1808 O PHE A 117 -17.350 -17.472 15.792 1.00 44.35 O ATOM 1809 CB PHE A 117 -16.869 -19.736 18.145 1.00 62.45 C ATOM 1810 CG PHE A 117 -16.470 -19.646 19.590 1.00 52.12 C ATOM 1811 CD1 PHE A 117 -17.361 -19.998 20.591 1.00 2.52 C ATOM 1812 CD2 PHE A 117 -15.205 -19.209 19.947 1.00 2.30 C ATOM 1813 CE1 PHE A 117 -16.997 -19.916 21.922 1.00 11.22 C ATOM 1814 CE2 PHE A 117 -14.835 -19.125 21.276 1.00 33.32 C ATOM 1815 CZ PHE A 117 -15.733 -19.478 22.265 1.00 21.10 C ATOM 0 H PHE A 117 -19.249 -20.080 18.694 1.00 51.41 H new ATOM 0 HA PHE A 117 -17.772 -17.789 18.262 1.00 71.12 H new ATOM 0 HB2 PHE A 117 -17.226 -20.745 17.937 1.00 62.45 H new ATOM 0 HB3 PHE A 117 -15.989 -19.575 17.523 1.00 62.45 H new ATOM 0 HD1 PHE A 117 -18.351 -20.340 20.328 1.00 2.52 H new ATOM 0 HD2 PHE A 117 -14.500 -18.931 19.178 1.00 2.30 H new ATOM 0 HE1 PHE A 117 -17.700 -20.194 22.693 1.00 11.22 H new ATOM 0 HE2 PHE A 117 -13.845 -18.784 21.541 1.00 33.32 H new ATOM 0 HZ PHE A 117 -15.447 -19.412 23.304 1.00 21.10 H new ATOM 1825 N ILE A 118 -18.469 -19.398 15.472 1.00 65.11 N ATOM 1826 CA ILE A 118 -18.486 -19.274 14.020 1.00 64.23 C ATOM 1827 C ILE A 118 -19.562 -18.295 13.564 1.00 33.12 C ATOM 1828 O ILE A 118 -19.492 -17.748 12.463 1.00 10.23 O ATOM 1829 CB ILE A 118 -18.726 -20.636 13.341 1.00 4.23 C ATOM 1830 CG1 ILE A 118 -20.101 -21.186 13.725 1.00 41.23 C ATOM 1831 CG2 ILE A 118 -17.630 -21.619 13.725 1.00 30.21 C ATOM 1832 CD1 ILE A 118 -20.409 -22.530 13.104 1.00 65.43 C ATOM 0 H ILE A 118 -18.926 -20.237 15.829 1.00 65.11 H new ATOM 0 HA ILE A 118 -17.507 -18.897 13.724 1.00 64.23 H new ATOM 0 HB ILE A 118 -18.700 -20.497 12.260 1.00 4.23 H new ATOM 0 HG12 ILE A 118 -20.158 -21.275 14.810 1.00 41.23 H new ATOM 0 HG13 ILE A 118 -20.867 -20.471 13.423 1.00 41.23 H new ATOM 0 HG21 ILE A 118 -17.813 -22.577 13.238 1.00 30.21 H new ATOM 0 HG22 ILE A 118 -16.663 -21.229 13.407 1.00 30.21 H new ATOM 0 HG23 ILE A 118 -17.627 -21.757 14.806 1.00 30.21 H new ATOM 0 HD11 ILE A 118 -21.399 -22.858 13.420 1.00 65.43 H new ATOM 0 HD12 ILE A 118 -20.385 -22.443 12.018 1.00 65.43 H new ATOM 0 HD13 ILE A 118 -19.665 -23.259 13.426 1.00 65.43 H new ATOM 1844 N ILE A 119 -20.556 -18.078 14.419 1.00 54.15 N ATOM 1845 CA ILE A 119 -21.646 -17.162 14.105 1.00 73.31 C ATOM 1846 C ILE A 119 -21.167 -15.715 14.109 1.00 3.22 C ATOM 1847 O ILE A 119 -21.667 -14.881 13.354 1.00 62.44 O ATOM 1848 CB ILE A 119 -22.810 -17.309 15.103 1.00 3.24 C ATOM 1849 CG1 ILE A 119 -24.061 -17.823 14.390 1.00 75.15 C ATOM 1850 CG2 ILE A 119 -23.092 -15.979 15.787 1.00 63.12 C ATOM 1851 CD1 ILE A 119 -24.837 -18.845 15.191 1.00 70.22 C ATOM 0 H ILE A 119 -20.629 -18.524 15.334 1.00 54.15 H new ATOM 0 HA ILE A 119 -21.999 -17.422 13.107 1.00 73.31 H new ATOM 0 HB ILE A 119 -22.526 -18.035 15.865 1.00 3.24 H new ATOM 0 HG12 ILE A 119 -24.713 -16.979 14.164 1.00 75.15 H new ATOM 0 HG13 ILE A 119 -23.770 -18.265 13.437 1.00 75.15 H new ATOM 0 HG21 ILE A 119 -23.917 -16.099 16.489 1.00 63.12 H new ATOM 0 HG22 ILE A 119 -22.203 -15.651 16.325 1.00 63.12 H new ATOM 0 HG23 ILE A 119 -23.359 -15.234 15.038 1.00 63.12 H new ATOM 0 HD11 ILE A 119 -25.711 -19.165 14.623 1.00 70.22 H new ATOM 0 HD12 ILE A 119 -24.201 -19.707 15.395 1.00 70.22 H new ATOM 0 HD13 ILE A 119 -25.159 -18.401 16.133 1.00 70.22 H new ATOM 1863 N VAL A 120 -20.192 -15.423 14.965 1.00 51.54 N ATOM 1864 CA VAL A 120 -19.642 -14.076 15.066 1.00 62.13 C ATOM 1865 C VAL A 120 -18.545 -13.851 14.031 1.00 71.51 C ATOM 1866 O VAL A 120 -18.335 -12.730 13.568 1.00 42.22 O ATOM 1867 CB VAL A 120 -19.070 -13.808 16.470 1.00 2.44 C ATOM 1868 CG1 VAL A 120 -20.184 -13.790 17.506 1.00 5.42 C ATOM 1869 CG2 VAL A 120 -18.018 -14.848 16.825 1.00 41.24 C ATOM 0 H VAL A 120 -19.767 -16.101 15.598 1.00 51.54 H new ATOM 0 HA VAL A 120 -20.463 -13.384 14.877 1.00 62.13 H new ATOM 0 HB VAL A 120 -18.592 -12.828 16.467 1.00 2.44 H new ATOM 0 HG11 VAL A 120 -19.761 -13.599 18.492 1.00 5.42 H new ATOM 0 HG12 VAL A 120 -20.898 -13.004 17.259 1.00 5.42 H new ATOM 0 HG13 VAL A 120 -20.693 -14.754 17.510 1.00 5.42 H new ATOM 0 HG21 VAL A 120 -17.625 -14.643 17.821 1.00 41.24 H new ATOM 0 HG22 VAL A 120 -18.468 -15.841 16.810 1.00 41.24 H new ATOM 0 HG23 VAL A 120 -17.206 -14.807 16.099 1.00 41.24 H new ATOM 1879 N CYS A 121 -17.850 -14.925 13.672 1.00 45.30 N ATOM 1880 CA CYS A 121 -16.773 -14.845 12.691 1.00 70.21 C ATOM 1881 C CYS A 121 -17.310 -14.421 11.328 1.00 60.02 C ATOM 1882 O CYS A 121 -16.863 -13.426 10.754 1.00 32.55 O ATOM 1883 CB CYS A 121 -16.060 -16.193 12.575 1.00 72.22 C ATOM 1884 SG CYS A 121 -14.823 -16.487 13.860 1.00 30.12 S ATOM 0 H CYS A 121 -18.013 -15.860 14.045 1.00 45.30 H new ATOM 0 HA CYS A 121 -16.060 -14.093 13.030 1.00 70.21 H new ATOM 0 HB2 CYS A 121 -16.803 -16.989 12.612 1.00 72.22 H new ATOM 0 HB3 CYS A 121 -15.577 -16.253 11.600 1.00 72.22 H new ATOM 0 HG CYS A 121 -15.411 -16.910 14.940 1.00 30.12 H new ATOM 1890 N LEU A 122 -18.269 -15.182 10.813 1.00 54.01 N ATOM 1891 CA LEU A 122 -18.867 -14.886 9.515 1.00 30.34 C ATOM 1892 C LEU A 122 -19.659 -13.584 9.565 1.00 54.11 C ATOM 1893 O LEU A 122 -19.591 -12.768 8.645 1.00 41.40 O ATOM 1894 CB LEU A 122 -19.778 -16.035 9.078 1.00 50.41 C ATOM 1895 CG LEU A 122 -19.120 -17.132 8.241 1.00 23.33 C ATOM 1896 CD1 LEU A 122 -18.960 -16.680 6.798 1.00 32.30 C ATOM 1897 CD2 LEU A 122 -17.772 -17.518 8.833 1.00 30.13 C ATOM 0 H LEU A 122 -18.649 -16.009 11.274 1.00 54.01 H new ATOM 0 HA LEU A 122 -18.062 -14.772 8.789 1.00 30.34 H new ATOM 0 HB2 LEU A 122 -20.205 -16.493 9.970 1.00 50.41 H new ATOM 0 HB3 LEU A 122 -20.607 -15.618 8.506 1.00 50.41 H new ATOM 0 HG LEU A 122 -19.766 -18.010 8.255 1.00 23.33 H new ATOM 0 HD11 LEU A 122 -18.490 -17.474 6.218 1.00 32.30 H new ATOM 0 HD12 LEU A 122 -19.940 -16.454 6.377 1.00 32.30 H new ATOM 0 HD13 LEU A 122 -18.336 -15.787 6.763 1.00 32.30 H new ATOM 0 HD21 LEU A 122 -17.318 -18.300 8.224 1.00 30.13 H new ATOM 0 HD22 LEU A 122 -17.119 -16.646 8.850 1.00 30.13 H new ATOM 0 HD23 LEU A 122 -17.913 -17.885 9.850 1.00 30.13 H new ATOM 1909 N LEU A 123 -20.409 -13.395 10.645 1.00 54.42 N ATOM 1910 CA LEU A 123 -21.214 -12.190 10.816 1.00 3.42 C ATOM 1911 C LEU A 123 -20.332 -10.945 10.839 1.00 30.11 C ATOM 1912 O LEU A 123 -20.493 -10.043 10.019 1.00 50.33 O ATOM 1913 CB LEU A 123 -22.028 -12.276 12.108 1.00 1.43 C ATOM 1914 CG LEU A 123 -22.852 -11.038 12.466 1.00 73.42 C ATOM 1915 CD1 LEU A 123 -22.029 -10.073 13.304 1.00 15.33 C ATOM 1916 CD2 LEU A 123 -23.361 -10.354 11.205 1.00 5.34 C ATOM 0 H LEU A 123 -20.477 -14.060 11.415 1.00 54.42 H new ATOM 0 HA LEU A 123 -21.896 -12.115 9.969 1.00 3.42 H new ATOM 0 HB2 LEU A 123 -22.704 -13.128 12.032 1.00 1.43 H new ATOM 0 HB3 LEU A 123 -21.345 -12.483 12.931 1.00 1.43 H new ATOM 0 HG LEU A 123 -23.712 -11.355 13.056 1.00 73.42 H new ATOM 0 HD11 LEU A 123 -22.632 -9.198 13.549 1.00 15.33 H new ATOM 0 HD12 LEU A 123 -21.715 -10.566 14.224 1.00 15.33 H new ATOM 0 HD13 LEU A 123 -21.149 -9.761 12.741 1.00 15.33 H new ATOM 0 HD21 LEU A 123 -23.945 -9.475 11.478 1.00 5.34 H new ATOM 0 HD22 LEU A 123 -22.515 -10.050 10.589 1.00 5.34 H new ATOM 0 HD23 LEU A 123 -23.988 -11.046 10.643 1.00 5.34 H new ATOM 1928 N GLY A 124 -19.398 -10.905 11.784 1.00 25.32 N ATOM 1929 CA GLY A 124 -18.503 -9.768 11.895 1.00 65.31 C ATOM 1930 C GLY A 124 -17.803 -9.452 10.588 1.00 1.30 C ATOM 1931 O GLY A 124 -17.555 -8.287 10.273 1.00 23.24 O ATOM 0 H GLY A 124 -19.245 -11.640 12.475 1.00 25.32 H new ATOM 0 HA2 GLY A 124 -19.068 -8.895 12.221 1.00 65.31 H new ATOM 0 HA3 GLY A 124 -17.757 -9.970 12.664 1.00 65.31 H new ATOM 1935 N THR A 125 -17.482 -10.491 9.824 1.00 45.14 N ATOM 1936 CA THR A 125 -16.804 -10.319 8.545 1.00 4.40 C ATOM 1937 C THR A 125 -17.718 -9.654 7.523 1.00 54.50 C ATOM 1938 O THR A 125 -17.413 -8.578 7.008 1.00 4.23 O ATOM 1939 CB THR A 125 -16.317 -11.667 7.981 1.00 41.20 C ATOM 1940 OG1 THR A 125 -15.310 -12.221 8.836 1.00 55.23 O ATOM 1941 CG2 THR A 125 -15.759 -11.496 6.576 1.00 4.23 C ATOM 0 H THR A 125 -17.681 -11.461 10.069 1.00 45.14 H new ATOM 0 HA THR A 125 -15.942 -9.678 8.729 1.00 4.40 H new ATOM 0 HB THR A 125 -17.169 -12.346 7.936 1.00 41.20 H new ATOM 0 HG1 THR A 125 -15.732 -12.607 9.632 1.00 55.23 H new ATOM 0 HG21 THR A 125 -15.421 -12.461 6.199 1.00 4.23 H new ATOM 0 HG22 THR A 125 -16.536 -11.102 5.921 1.00 4.23 H new ATOM 0 HG23 THR A 125 -14.919 -10.802 6.600 1.00 4.23 H new ATOM 1949 N VAL A 126 -18.843 -10.300 7.233 1.00 32.02 N ATOM 1950 CA VAL A 126 -19.804 -9.770 6.273 1.00 12.24 C ATOM 1951 C VAL A 126 -20.254 -8.367 6.664 1.00 13.33 C ATOM 1952 O VAL A 126 -20.415 -7.495 5.812 1.00 45.44 O ATOM 1953 CB VAL A 126 -21.041 -10.680 6.156 1.00 31.15 C ATOM 1954 CG1 VAL A 126 -22.117 -10.013 5.314 1.00 74.04 C ATOM 1955 CG2 VAL A 126 -20.655 -12.030 5.572 1.00 71.42 C ATOM 0 H VAL A 126 -19.111 -11.192 7.649 1.00 32.02 H new ATOM 0 HA VAL A 126 -19.299 -9.731 5.308 1.00 12.24 H new ATOM 0 HB VAL A 126 -21.446 -10.844 7.155 1.00 31.15 H new ATOM 0 HG11 VAL A 126 -22.983 -10.671 5.243 1.00 74.04 H new ATOM 0 HG12 VAL A 126 -22.413 -9.073 5.780 1.00 74.04 H new ATOM 0 HG13 VAL A 126 -21.728 -9.816 4.315 1.00 74.04 H new ATOM 0 HG21 VAL A 126 -21.541 -12.660 5.496 1.00 71.42 H new ATOM 0 HG22 VAL A 126 -20.225 -11.888 4.581 1.00 71.42 H new ATOM 0 HG23 VAL A 126 -19.922 -12.511 6.220 1.00 71.42 H new ATOM 1965 N GLY A 127 -20.457 -8.156 7.962 1.00 43.25 N ATOM 1966 CA GLY A 127 -20.886 -6.856 8.444 1.00 72.24 C ATOM 1967 C GLY A 127 -19.804 -5.803 8.312 1.00 14.44 C ATOM 1968 O GLY A 127 -20.091 -4.640 8.022 1.00 60.41 O ATOM 0 H GLY A 127 -20.332 -8.862 8.687 1.00 43.25 H new ATOM 0 HA2 GLY A 127 -21.768 -6.538 7.887 1.00 72.24 H new ATOM 0 HA3 GLY A 127 -21.182 -6.939 9.490 1.00 72.24 H new ATOM 1972 N LEU A 128 -18.558 -6.207 8.528 1.00 24.21 N ATOM 1973 CA LEU A 128 -17.428 -5.289 8.434 1.00 50.20 C ATOM 1974 C LEU A 128 -17.302 -4.724 7.023 1.00 42.22 C ATOM 1975 O LEU A 128 -17.095 -3.524 6.839 1.00 22.13 O ATOM 1976 CB LEU A 128 -16.133 -6.000 8.828 1.00 23.35 C ATOM 1977 CG LEU A 128 -14.849 -5.181 8.691 1.00 24.55 C ATOM 1978 CD1 LEU A 128 -15.074 -3.753 9.161 1.00 50.42 C ATOM 1979 CD2 LEU A 128 -13.716 -5.830 9.475 1.00 55.21 C ATOM 0 H LEU A 128 -18.304 -7.165 8.770 1.00 24.21 H new ATOM 0 HA LEU A 128 -17.605 -4.463 9.122 1.00 50.20 H new ATOM 0 HB2 LEU A 128 -16.223 -6.327 9.864 1.00 23.35 H new ATOM 0 HB3 LEU A 128 -16.035 -6.898 8.217 1.00 23.35 H new ATOM 0 HG LEU A 128 -14.568 -5.155 7.638 1.00 24.55 H new ATOM 0 HD11 LEU A 128 -14.149 -3.185 9.056 1.00 50.42 H new ATOM 0 HD12 LEU A 128 -15.855 -3.290 8.557 1.00 50.42 H new ATOM 0 HD13 LEU A 128 -15.380 -3.758 10.207 1.00 50.42 H new ATOM 0 HD21 LEU A 128 -12.810 -5.234 9.366 1.00 55.21 H new ATOM 0 HD22 LEU A 128 -13.989 -5.887 10.529 1.00 55.21 H new ATOM 0 HD23 LEU A 128 -13.537 -6.835 9.092 1.00 55.21 H new ATOM 1991 N PHE A 129 -17.430 -5.596 6.028 1.00 1.22 N ATOM 1992 CA PHE A 129 -17.331 -5.184 4.633 1.00 54.22 C ATOM 1993 C PHE A 129 -18.496 -4.275 4.251 1.00 41.14 C ATOM 1994 O PHE A 129 -18.302 -3.220 3.644 1.00 34.40 O ATOM 1995 CB PHE A 129 -17.305 -6.410 3.718 1.00 41.23 C ATOM 1996 CG PHE A 129 -15.934 -6.744 3.202 1.00 11.34 C ATOM 1997 CD1 PHE A 129 -15.341 -5.967 2.220 1.00 61.41 C ATOM 1998 CD2 PHE A 129 -15.239 -7.833 3.701 1.00 64.41 C ATOM 1999 CE1 PHE A 129 -14.080 -6.273 1.744 1.00 50.05 C ATOM 2000 CE2 PHE A 129 -13.977 -8.144 3.229 1.00 51.34 C ATOM 2001 CZ PHE A 129 -13.397 -7.362 2.249 1.00 2.44 C ATOM 0 H PHE A 129 -17.603 -6.592 6.162 1.00 1.22 H new ATOM 0 HA PHE A 129 -16.402 -4.627 4.509 1.00 54.22 H new ATOM 0 HB2 PHE A 129 -17.699 -7.268 4.263 1.00 41.23 H new ATOM 0 HB3 PHE A 129 -17.971 -6.237 2.872 1.00 41.23 H new ATOM 0 HD1 PHE A 129 -15.870 -5.113 1.822 1.00 61.41 H new ATOM 0 HD2 PHE A 129 -15.688 -8.447 4.468 1.00 64.41 H new ATOM 0 HE1 PHE A 129 -13.629 -5.661 0.977 1.00 50.05 H new ATOM 0 HE2 PHE A 129 -13.446 -8.997 3.626 1.00 51.34 H new ATOM 0 HZ PHE A 129 -12.411 -7.602 1.878 1.00 2.44 H new