USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 884 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 22 SER OG : rot 140:sc= 0.0553 USER MOD Set 1.2: A 121 CYS SG : rot 82:sc= 0.771 USER MOD Set 2.1: A 18 CYS SG : rot 160:sc= 0.166 USER MOD Set 2.2: A 73 TYR OH : rot 167:sc= 0.179 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= 0.277 X(o=0.28,f=0) USER MOD Single : A 23 CYS SG : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= -0.993 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+ -173:sc= 0 (180deg=-0.0213) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 CYS SG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot -29:sc= 1.17 USER MOD Single : A 69 SER OG : rot 130:sc= 0.88 USER MOD Single : A 77 THR OG1 : rot -172:sc= 1.25 USER MOD Single : A 78 MET CE :methyl -120:sc= -0.985 (180deg=-4.94!) USER MOD Single : A 82 THR OG1 : rot 84:sc= 0.411 USER MOD Single : A 84 SER OG : rot 79:sc= 0.0172 USER MOD Single : A 88 THR OG1 : rot 87:sc= 0.414 USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 MET CE :methyl 161:sc= -3.03 (180deg=-4.6!) USER MOD Single : A 125 THR OG1 : rot 97:sc= 0.793 USER MOD ----------------------------------------------------------------- ATOM 64 N LEU A 8 -6.409 -5.953 -1.909 1.00 41.30 N ATOM 65 CA LEU A 8 -7.497 -6.788 -1.414 1.00 34.14 C ATOM 66 C LEU A 8 -7.056 -8.243 -1.295 1.00 73.41 C ATOM 67 O LEU A 8 -7.475 -8.958 -0.384 1.00 54.12 O ATOM 68 CB LEU A 8 -8.709 -6.684 -2.341 1.00 71.45 C ATOM 69 CG LEU A 8 -10.071 -6.955 -1.700 1.00 65.54 C ATOM 70 CD1 LEU A 8 -10.170 -8.405 -1.251 1.00 70.03 C ATOM 71 CD2 LEU A 8 -10.305 -6.015 -0.527 1.00 45.45 C ATOM 0 HA LEU A 8 -7.775 -6.430 -0.423 1.00 34.14 H new ATOM 0 HB2 LEU A 8 -8.726 -5.683 -2.773 1.00 71.45 H new ATOM 0 HB3 LEU A 8 -8.572 -7.384 -3.165 1.00 71.45 H new ATOM 0 HG LEU A 8 -10.845 -6.773 -2.446 1.00 65.54 H new ATOM 0 HD11 LEU A 8 -11.146 -8.580 -0.797 1.00 70.03 H new ATOM 0 HD12 LEU A 8 -10.048 -9.062 -2.112 1.00 70.03 H new ATOM 0 HD13 LEU A 8 -9.388 -8.614 -0.521 1.00 70.03 H new ATOM 0 HD21 LEU A 8 -11.279 -6.222 -0.083 1.00 45.45 H new ATOM 0 HD22 LEU A 8 -9.526 -6.165 0.221 1.00 45.45 H new ATOM 0 HD23 LEU A 8 -10.278 -4.983 -0.877 1.00 45.45 H new ATOM 83 N PHE A 9 -6.206 -8.676 -2.221 1.00 13.15 N ATOM 84 CA PHE A 9 -5.707 -10.046 -2.219 1.00 41.03 C ATOM 85 C PHE A 9 -5.144 -10.419 -0.851 1.00 13.42 C ATOM 86 O PHE A 9 -5.200 -11.578 -0.439 1.00 51.31 O ATOM 87 CB PHE A 9 -4.629 -10.219 -3.291 1.00 25.11 C ATOM 88 CG PHE A 9 -3.517 -11.142 -2.879 1.00 41.52 C ATOM 89 CD1 PHE A 9 -3.616 -12.507 -3.095 1.00 44.52 C ATOM 90 CD2 PHE A 9 -2.373 -10.644 -2.276 1.00 15.55 C ATOM 91 CE1 PHE A 9 -2.594 -13.358 -2.718 1.00 34.11 C ATOM 92 CE2 PHE A 9 -1.349 -11.490 -1.896 1.00 61.15 C ATOM 93 CZ PHE A 9 -1.460 -12.849 -2.117 1.00 20.13 C ATOM 0 H PHE A 9 -5.849 -8.098 -2.982 1.00 13.15 H new ATOM 0 HA PHE A 9 -6.542 -10.711 -2.441 1.00 41.03 H new ATOM 0 HB2 PHE A 9 -5.091 -10.603 -4.201 1.00 25.11 H new ATOM 0 HB3 PHE A 9 -4.209 -9.243 -3.534 1.00 25.11 H new ATOM 0 HD1 PHE A 9 -4.502 -12.911 -3.563 1.00 44.52 H new ATOM 0 HD2 PHE A 9 -2.281 -9.582 -2.101 1.00 15.55 H new ATOM 0 HE1 PHE A 9 -2.682 -14.420 -2.893 1.00 34.11 H new ATOM 0 HE2 PHE A 9 -0.463 -11.089 -1.427 1.00 61.15 H new ATOM 0 HZ PHE A 9 -0.661 -13.512 -1.820 1.00 20.13 H new ATOM 103 N TYR A 10 -4.602 -9.428 -0.151 1.00 73.02 N ATOM 104 CA TYR A 10 -4.027 -9.651 1.170 1.00 65.13 C ATOM 105 C TYR A 10 -5.120 -9.782 2.226 1.00 41.43 C ATOM 106 O TYR A 10 -4.990 -10.548 3.181 1.00 3.42 O ATOM 107 CB TYR A 10 -3.081 -8.506 1.537 1.00 13.11 C ATOM 108 CG TYR A 10 -2.133 -8.842 2.666 1.00 40.03 C ATOM 109 CD1 TYR A 10 -1.444 -10.048 2.685 1.00 61.22 C ATOM 110 CD2 TYR A 10 -1.925 -7.952 3.713 1.00 73.33 C ATOM 111 CE1 TYR A 10 -0.577 -10.360 3.714 1.00 12.43 C ATOM 112 CE2 TYR A 10 -1.059 -8.255 4.746 1.00 52.42 C ATOM 113 CZ TYR A 10 -0.388 -9.460 4.742 1.00 0.43 C ATOM 114 OH TYR A 10 0.476 -9.765 5.769 1.00 33.40 O ATOM 0 H TYR A 10 -4.549 -8.463 -0.477 1.00 73.02 H new ATOM 0 HA TYR A 10 -3.464 -10.584 1.140 1.00 65.13 H new ATOM 0 HB2 TYR A 10 -2.501 -8.229 0.657 1.00 13.11 H new ATOM 0 HB3 TYR A 10 -3.671 -7.634 1.817 1.00 13.11 H new ATOM 0 HD1 TYR A 10 -1.589 -10.754 1.881 1.00 61.22 H new ATOM 0 HD2 TYR A 10 -2.449 -7.008 3.719 1.00 73.33 H new ATOM 0 HE1 TYR A 10 -0.050 -11.303 3.714 1.00 12.43 H new ATOM 0 HE2 TYR A 10 -0.908 -7.552 5.552 1.00 52.42 H new ATOM 0 HH TYR A 10 0.496 -9.025 6.411 1.00 33.40 H new ATOM 124 N THR A 11 -6.200 -9.027 2.046 1.00 31.51 N ATOM 125 CA THR A 11 -7.317 -9.057 2.982 1.00 40.01 C ATOM 126 C THR A 11 -8.009 -10.415 2.969 1.00 54.00 C ATOM 127 O THR A 11 -8.537 -10.863 3.988 1.00 41.34 O ATOM 128 CB THR A 11 -8.351 -7.963 2.657 1.00 54.13 C ATOM 129 OG1 THR A 11 -7.950 -6.720 3.243 1.00 51.42 O ATOM 130 CG2 THR A 11 -9.729 -8.351 3.172 1.00 53.34 C ATOM 0 H THR A 11 -6.324 -8.388 1.261 1.00 31.51 H new ATOM 0 HA THR A 11 -6.904 -8.873 3.974 1.00 40.01 H new ATOM 0 HB THR A 11 -8.403 -7.853 1.574 1.00 54.13 H new ATOM 0 HG1 THR A 11 -8.612 -6.029 3.030 1.00 51.42 H new ATOM 0 HG21 THR A 11 -10.443 -7.563 2.931 1.00 53.34 H new ATOM 0 HG22 THR A 11 -10.044 -9.282 2.702 1.00 53.34 H new ATOM 0 HG23 THR A 11 -9.689 -8.486 4.253 1.00 53.34 H new ATOM 138 N ILE A 12 -8.003 -11.066 1.811 1.00 54.13 N ATOM 139 CA ILE A 12 -8.630 -12.374 1.667 1.00 62.21 C ATOM 140 C ILE A 12 -7.711 -13.482 2.171 1.00 41.11 C ATOM 141 O ILE A 12 -8.173 -14.537 2.603 1.00 71.03 O ATOM 142 CB ILE A 12 -9.005 -12.661 0.201 1.00 44.11 C ATOM 143 CG1 ILE A 12 -9.732 -11.460 -0.406 1.00 54.24 C ATOM 144 CG2 ILE A 12 -9.867 -13.911 0.109 1.00 24.25 C ATOM 145 CD1 ILE A 12 -11.052 -11.150 0.266 1.00 43.34 C ATOM 0 H ILE A 12 -7.571 -10.709 0.959 1.00 54.13 H new ATOM 0 HA ILE A 12 -9.539 -12.356 2.269 1.00 62.21 H new ATOM 0 HB ILE A 12 -8.090 -12.833 -0.366 1.00 44.11 H new ATOM 0 HG12 ILE A 12 -9.086 -10.584 -0.342 1.00 54.24 H new ATOM 0 HG13 ILE A 12 -9.908 -11.649 -1.465 1.00 54.24 H new ATOM 0 HG21 ILE A 12 -10.124 -14.100 -0.933 1.00 24.25 H new ATOM 0 HG22 ILE A 12 -9.316 -14.763 0.508 1.00 24.25 H new ATOM 0 HG23 ILE A 12 -10.780 -13.767 0.687 1.00 24.25 H new ATOM 0 HD11 ILE A 12 -11.512 -10.287 -0.216 1.00 43.34 H new ATOM 0 HD12 ILE A 12 -11.715 -12.010 0.179 1.00 43.34 H new ATOM 0 HD13 ILE A 12 -10.881 -10.929 1.320 1.00 43.34 H new ATOM 157 N ASN A 13 -6.407 -13.233 2.114 1.00 4.11 N ATOM 158 CA ASN A 13 -5.422 -14.209 2.566 1.00 3.01 C ATOM 159 C ASN A 13 -5.232 -14.130 4.078 1.00 72.51 C ATOM 160 O ASN A 13 -4.738 -15.070 4.702 1.00 23.04 O ATOM 161 CB ASN A 13 -4.084 -13.979 1.860 1.00 2.25 C ATOM 162 CG ASN A 13 -3.289 -15.260 1.697 1.00 45.41 C ATOM 163 OD1 ASN A 13 -3.127 -15.766 0.586 1.00 1.43 O ATOM 164 ND2 ASN A 13 -2.788 -15.790 2.806 1.00 25.53 N ATOM 0 H ASN A 13 -6.008 -12.364 1.759 1.00 4.11 H new ATOM 0 HA ASN A 13 -5.791 -15.203 2.315 1.00 3.01 H new ATOM 0 HB2 ASN A 13 -4.265 -13.539 0.879 1.00 2.25 H new ATOM 0 HB3 ASN A 13 -3.495 -13.259 2.428 1.00 2.25 H new ATOM 0 HD21 ASN A 13 -2.243 -16.651 2.759 1.00 25.53 H new ATOM 0 HD22 ASN A 13 -2.947 -15.336 3.705 1.00 25.53 H new ATOM 171 N LEU A 14 -5.629 -13.005 4.661 1.00 50.45 N ATOM 172 CA LEU A 14 -5.504 -12.803 6.100 1.00 40.41 C ATOM 173 C LEU A 14 -6.778 -13.229 6.822 1.00 21.13 C ATOM 174 O LEU A 14 -6.737 -13.645 7.981 1.00 44.13 O ATOM 175 CB LEU A 14 -5.199 -11.335 6.404 1.00 5.02 C ATOM 176 CG LEU A 14 -3.805 -10.844 6.011 1.00 40.24 C ATOM 177 CD1 LEU A 14 -3.698 -9.338 6.195 1.00 22.13 C ATOM 178 CD2 LEU A 14 -2.737 -11.560 6.825 1.00 74.22 C ATOM 0 H LEU A 14 -6.041 -12.218 4.159 1.00 50.45 H new ATOM 0 HA LEU A 14 -4.681 -13.421 6.459 1.00 40.41 H new ATOM 0 HB2 LEU A 14 -5.937 -10.718 5.892 1.00 5.02 H new ATOM 0 HB3 LEU A 14 -5.332 -11.171 7.473 1.00 5.02 H new ATOM 0 HG LEU A 14 -3.644 -11.073 4.958 1.00 40.24 H new ATOM 0 HD11 LEU A 14 -2.699 -9.007 5.910 1.00 22.13 H new ATOM 0 HD12 LEU A 14 -4.438 -8.841 5.567 1.00 22.13 H new ATOM 0 HD13 LEU A 14 -3.880 -9.085 7.240 1.00 22.13 H new ATOM 0 HD21 LEU A 14 -1.752 -11.198 6.531 1.00 74.22 H new ATOM 0 HD22 LEU A 14 -2.895 -11.363 7.885 1.00 74.22 H new ATOM 0 HD23 LEU A 14 -2.798 -12.633 6.642 1.00 74.22 H new ATOM 190 N ILE A 15 -7.907 -13.125 6.130 1.00 34.13 N ATOM 191 CA ILE A 15 -9.192 -13.503 6.705 1.00 74.20 C ATOM 192 C ILE A 15 -9.362 -15.019 6.724 1.00 43.43 C ATOM 193 O ILE A 15 -9.977 -15.573 7.635 1.00 24.20 O ATOM 194 CB ILE A 15 -10.364 -12.877 5.926 1.00 42.42 C ATOM 195 CG1 ILE A 15 -11.690 -13.180 6.625 1.00 34.40 C ATOM 196 CG2 ILE A 15 -10.383 -13.391 4.494 1.00 33.33 C ATOM 197 CD1 ILE A 15 -11.836 -12.498 7.967 1.00 20.54 C ATOM 0 H ILE A 15 -7.958 -12.782 5.171 1.00 34.13 H new ATOM 0 HA ILE A 15 -9.203 -13.125 7.727 1.00 74.20 H new ATOM 0 HB ILE A 15 -10.228 -11.796 5.901 1.00 42.42 H new ATOM 0 HG12 ILE A 15 -12.511 -12.871 5.978 1.00 34.40 H new ATOM 0 HG13 ILE A 15 -11.781 -14.257 6.762 1.00 34.40 H new ATOM 0 HG21 ILE A 15 -11.217 -12.940 3.956 1.00 33.33 H new ATOM 0 HG22 ILE A 15 -9.448 -13.127 4.000 1.00 33.33 H new ATOM 0 HG23 ILE A 15 -10.498 -14.475 4.498 1.00 33.33 H new ATOM 0 HD11 ILE A 15 -12.800 -12.758 8.404 1.00 20.54 H new ATOM 0 HD12 ILE A 15 -11.036 -12.826 8.631 1.00 20.54 H new ATOM 0 HD13 ILE A 15 -11.778 -11.418 7.834 1.00 20.54 H new ATOM 209 N ILE A 16 -8.811 -15.682 5.713 1.00 70.40 N ATOM 210 CA ILE A 16 -8.899 -17.134 5.615 1.00 24.00 C ATOM 211 C ILE A 16 -8.444 -17.801 6.909 1.00 13.31 C ATOM 212 O ILE A 16 -9.184 -18.556 7.540 1.00 22.22 O ATOM 213 CB ILE A 16 -8.050 -17.672 4.448 1.00 4.21 C ATOM 214 CG1 ILE A 16 -8.877 -17.709 3.162 1.00 60.34 C ATOM 215 CG2 ILE A 16 -7.511 -19.056 4.779 1.00 53.14 C ATOM 216 CD1 ILE A 16 -9.833 -18.879 3.092 1.00 33.21 C ATOM 0 H ILE A 16 -8.299 -15.238 4.951 1.00 70.40 H new ATOM 0 HA ILE A 16 -9.946 -17.375 5.433 1.00 24.00 H new ATOM 0 HB ILE A 16 -7.204 -17.002 4.294 1.00 4.21 H new ATOM 0 HG12 ILE A 16 -9.444 -16.782 3.077 1.00 60.34 H new ATOM 0 HG13 ILE A 16 -8.202 -17.750 2.307 1.00 60.34 H new ATOM 0 HG21 ILE A 16 -6.913 -19.423 3.945 1.00 53.14 H new ATOM 0 HG22 ILE A 16 -6.890 -19.000 5.673 1.00 53.14 H new ATOM 0 HG23 ILE A 16 -8.343 -19.738 4.956 1.00 53.14 H new ATOM 0 HD11 ILE A 16 -10.386 -18.841 2.154 1.00 33.21 H new ATOM 0 HD12 ILE A 16 -9.271 -19.812 3.145 1.00 33.21 H new ATOM 0 HD13 ILE A 16 -10.532 -18.828 3.927 1.00 33.21 H new ATOM 228 N PRO A 17 -7.199 -17.515 7.316 1.00 2.44 N ATOM 229 CA PRO A 17 -6.618 -18.074 8.540 1.00 31.35 C ATOM 230 C PRO A 17 -7.265 -17.509 9.800 1.00 10.22 C ATOM 231 O PRO A 17 -7.306 -18.170 10.839 1.00 53.25 O ATOM 232 CB PRO A 17 -5.148 -17.655 8.460 1.00 52.22 C ATOM 233 CG PRO A 17 -5.149 -16.433 7.607 1.00 12.04 C ATOM 234 CD PRO A 17 -6.262 -16.622 6.614 1.00 63.34 C ATOM 0 HA PRO A 17 -6.765 -19.152 8.604 1.00 31.35 H new ATOM 0 HB2 PRO A 17 -4.741 -17.447 9.450 1.00 52.22 H new ATOM 0 HB3 PRO A 17 -4.535 -18.443 8.022 1.00 52.22 H new ATOM 0 HG2 PRO A 17 -5.310 -15.538 8.208 1.00 12.04 H new ATOM 0 HG3 PRO A 17 -4.191 -16.309 7.101 1.00 12.04 H new ATOM 0 HD2 PRO A 17 -6.731 -15.674 6.351 1.00 63.34 H new ATOM 0 HD3 PRO A 17 -5.902 -17.067 5.687 1.00 63.34 H new ATOM 242 N CYS A 18 -7.769 -16.284 9.702 1.00 50.33 N ATOM 243 CA CYS A 18 -8.414 -15.629 10.834 1.00 33.13 C ATOM 244 C CYS A 18 -9.487 -16.527 11.442 1.00 11.31 C ATOM 245 O CYS A 18 -9.631 -16.602 12.663 1.00 3.52 O ATOM 246 CB CYS A 18 -9.032 -14.300 10.398 1.00 44.33 C ATOM 247 SG CYS A 18 -8.850 -12.969 11.608 1.00 51.31 S ATOM 0 H CYS A 18 -7.743 -15.724 8.850 1.00 50.33 H new ATOM 0 HA CYS A 18 -7.654 -15.436 11.591 1.00 33.13 H new ATOM 0 HB2 CYS A 18 -8.573 -13.989 9.460 1.00 44.33 H new ATOM 0 HB3 CYS A 18 -10.093 -14.453 10.199 1.00 44.33 H new ATOM 0 HG CYS A 18 -9.003 -11.821 11.017 1.00 51.31 H new ATOM 253 N LEU A 19 -10.240 -17.205 10.583 1.00 64.20 N ATOM 254 CA LEU A 19 -11.302 -18.097 11.035 1.00 63.32 C ATOM 255 C LEU A 19 -10.735 -19.450 11.454 1.00 71.12 C ATOM 256 O LEU A 19 -11.099 -19.991 12.499 1.00 75.23 O ATOM 257 CB LEU A 19 -12.340 -18.287 9.928 1.00 74.41 C ATOM 258 CG LEU A 19 -12.548 -17.097 8.990 1.00 25.44 C ATOM 259 CD1 LEU A 19 -13.679 -17.378 8.014 1.00 15.42 C ATOM 260 CD2 LEU A 19 -12.830 -15.833 9.788 1.00 4.42 C ATOM 0 H LEU A 19 -10.135 -17.154 9.570 1.00 64.20 H new ATOM 0 HA LEU A 19 -11.782 -17.641 11.901 1.00 63.32 H new ATOM 0 HB2 LEU A 19 -12.049 -19.150 9.329 1.00 74.41 H new ATOM 0 HB3 LEU A 19 -13.296 -18.530 10.392 1.00 74.41 H new ATOM 0 HG LEU A 19 -11.633 -16.945 8.418 1.00 25.44 H new ATOM 0 HD11 LEU A 19 -13.812 -16.520 7.355 1.00 15.42 H new ATOM 0 HD12 LEU A 19 -13.436 -18.258 7.419 1.00 15.42 H new ATOM 0 HD13 LEU A 19 -14.601 -17.557 8.567 1.00 15.42 H new ATOM 0 HD21 LEU A 19 -12.975 -14.996 9.105 1.00 4.42 H new ATOM 0 HD22 LEU A 19 -13.730 -15.974 10.386 1.00 4.42 H new ATOM 0 HD23 LEU A 19 -11.987 -15.622 10.446 1.00 4.42 H new ATOM 272 N LEU A 20 -9.841 -19.991 10.634 1.00 44.52 N ATOM 273 CA LEU A 20 -9.221 -21.280 10.920 1.00 2.32 C ATOM 274 C LEU A 20 -8.631 -21.300 12.327 1.00 44.25 C ATOM 275 O LEU A 20 -8.819 -22.259 13.076 1.00 54.33 O ATOM 276 CB LEU A 20 -8.129 -21.583 9.892 1.00 12.42 C ATOM 277 CG LEU A 20 -8.574 -22.352 8.648 1.00 41.11 C ATOM 278 CD1 LEU A 20 -8.266 -21.556 7.389 1.00 4.44 C ATOM 279 CD2 LEU A 20 -7.902 -23.716 8.596 1.00 61.21 C ATOM 0 H LEU A 20 -9.529 -19.557 9.765 1.00 44.52 H new ATOM 0 HA LEU A 20 -9.992 -22.048 10.858 1.00 2.32 H new ATOM 0 HB2 LEU A 20 -7.687 -20.639 9.573 1.00 12.42 H new ATOM 0 HB3 LEU A 20 -7.342 -22.153 10.385 1.00 12.42 H new ATOM 0 HG LEU A 20 -9.652 -22.502 8.703 1.00 41.11 H new ATOM 0 HD11 LEU A 20 -8.590 -22.119 6.514 1.00 4.44 H new ATOM 0 HD12 LEU A 20 -8.794 -20.603 7.423 1.00 4.44 H new ATOM 0 HD13 LEU A 20 -7.193 -21.374 7.327 1.00 4.44 H new ATOM 0 HD21 LEU A 20 -8.230 -24.250 7.704 1.00 61.21 H new ATOM 0 HD22 LEU A 20 -6.820 -23.588 8.564 1.00 61.21 H new ATOM 0 HD23 LEU A 20 -8.174 -24.289 9.482 1.00 61.21 H new ATOM 291 N ILE A 21 -7.918 -20.235 12.679 1.00 63.34 N ATOM 292 CA ILE A 21 -7.303 -20.130 13.996 1.00 12.21 C ATOM 293 C ILE A 21 -8.350 -19.857 15.071 1.00 71.32 C ATOM 294 O ILE A 21 -8.202 -20.280 16.217 1.00 31.04 O ATOM 295 CB ILE A 21 -6.242 -19.014 14.035 1.00 70.24 C ATOM 296 CG1 ILE A 21 -6.895 -17.651 13.796 1.00 23.04 C ATOM 297 CG2 ILE A 21 -5.159 -19.277 12.999 1.00 72.32 C ATOM 298 CD1 ILE A 21 -5.933 -16.602 13.285 1.00 41.34 C ATOM 0 H ILE A 21 -7.752 -19.433 12.071 1.00 63.34 H new ATOM 0 HA ILE A 21 -6.820 -21.087 14.196 1.00 12.21 H new ATOM 0 HB ILE A 21 -5.780 -19.006 15.022 1.00 70.24 H new ATOM 0 HG12 ILE A 21 -7.708 -17.767 13.079 1.00 23.04 H new ATOM 0 HG13 ILE A 21 -7.340 -17.302 14.728 1.00 23.04 H new ATOM 0 HG21 ILE A 21 -4.416 -18.480 13.038 1.00 72.32 H new ATOM 0 HG22 ILE A 21 -4.678 -20.232 13.210 1.00 72.32 H new ATOM 0 HG23 ILE A 21 -5.606 -19.308 12.005 1.00 72.32 H new ATOM 0 HD11 ILE A 21 -6.464 -15.662 13.138 1.00 41.34 H new ATOM 0 HD12 ILE A 21 -5.133 -16.457 14.011 1.00 41.34 H new ATOM 0 HD13 ILE A 21 -5.507 -16.930 12.337 1.00 41.34 H new ATOM 310 N SER A 22 -9.409 -19.150 14.691 1.00 15.24 N ATOM 311 CA SER A 22 -10.481 -18.819 15.623 1.00 33.01 C ATOM 312 C SER A 22 -11.252 -20.071 16.031 1.00 11.11 C ATOM 313 O SER A 22 -11.311 -20.420 17.211 1.00 62.23 O ATOM 314 CB SER A 22 -11.435 -17.801 14.995 1.00 12.14 C ATOM 315 OG SER A 22 -12.619 -17.670 15.763 1.00 31.42 O ATOM 0 H SER A 22 -9.548 -18.795 13.745 1.00 15.24 H new ATOM 0 HA SER A 22 -10.032 -18.383 16.515 1.00 33.01 H new ATOM 0 HB2 SER A 22 -10.939 -16.833 14.917 1.00 12.14 H new ATOM 0 HB3 SER A 22 -11.688 -18.112 13.981 1.00 12.14 H new ATOM 0 HG SER A 22 -12.883 -16.727 15.799 1.00 31.42 H new ATOM 321 N CYS A 23 -11.842 -20.741 15.048 1.00 64.54 N ATOM 322 CA CYS A 23 -12.610 -21.955 15.303 1.00 51.32 C ATOM 323 C CYS A 23 -11.767 -22.986 16.045 1.00 31.25 C ATOM 324 O CYS A 23 -12.268 -23.708 16.908 1.00 32.35 O ATOM 325 CB CYS A 23 -13.120 -22.546 13.988 1.00 72.21 C ATOM 326 SG CYS A 23 -14.800 -23.209 14.079 1.00 10.21 S ATOM 0 H CYS A 23 -11.804 -20.465 14.067 1.00 64.54 H new ATOM 0 HA CYS A 23 -13.462 -21.691 15.929 1.00 51.32 H new ATOM 0 HB2 CYS A 23 -13.086 -21.775 13.218 1.00 72.21 H new ATOM 0 HB3 CYS A 23 -12.444 -23.341 13.673 1.00 72.21 H new ATOM 0 HG CYS A 23 -15.143 -23.684 12.918 1.00 10.21 H new ATOM 332 N LEU A 24 -10.485 -23.051 15.704 1.00 71.43 N ATOM 333 CA LEU A 24 -9.572 -23.996 16.337 1.00 65.11 C ATOM 334 C LEU A 24 -9.640 -23.884 17.857 1.00 65.14 C ATOM 335 O LEU A 24 -9.895 -24.868 18.552 1.00 13.32 O ATOM 336 CB LEU A 24 -8.139 -23.749 15.859 1.00 34.15 C ATOM 337 CG LEU A 24 -7.059 -24.621 16.500 1.00 63.04 C ATOM 338 CD1 LEU A 24 -6.905 -25.927 15.736 1.00 32.43 C ATOM 339 CD2 LEU A 24 -5.734 -23.874 16.554 1.00 21.21 C ATOM 0 H LEU A 24 -10.054 -22.461 14.993 1.00 71.43 H new ATOM 0 HA LEU A 24 -9.875 -25.003 16.052 1.00 65.11 H new ATOM 0 HB2 LEU A 24 -8.106 -23.899 14.780 1.00 34.15 H new ATOM 0 HB3 LEU A 24 -7.891 -22.704 16.043 1.00 34.15 H new ATOM 0 HG LEU A 24 -7.365 -24.854 17.520 1.00 63.04 H new ATOM 0 HD11 LEU A 24 -6.132 -26.535 16.206 1.00 32.43 H new ATOM 0 HD12 LEU A 24 -7.850 -26.469 15.748 1.00 32.43 H new ATOM 0 HD13 LEU A 24 -6.622 -25.714 14.705 1.00 32.43 H new ATOM 0 HD21 LEU A 24 -4.977 -24.509 17.013 1.00 21.21 H new ATOM 0 HD22 LEU A 24 -5.423 -23.611 15.543 1.00 21.21 H new ATOM 0 HD23 LEU A 24 -5.852 -22.966 17.145 1.00 21.21 H new ATOM 351 N THR A 25 -9.411 -22.678 18.367 1.00 42.01 N ATOM 352 CA THR A 25 -9.447 -22.437 19.804 1.00 42.43 C ATOM 353 C THR A 25 -10.756 -22.927 20.411 1.00 54.31 C ATOM 354 O THR A 25 -10.767 -23.532 21.483 1.00 13.40 O ATOM 355 CB THR A 25 -9.273 -20.941 20.127 1.00 44.44 C ATOM 356 OG1 THR A 25 -7.976 -20.498 19.712 1.00 44.34 O ATOM 357 CG2 THR A 25 -9.449 -20.684 21.616 1.00 73.24 C ATOM 0 H THR A 25 -9.199 -21.853 17.806 1.00 42.01 H new ATOM 0 HA THR A 25 -8.617 -22.994 20.239 1.00 42.43 H new ATOM 0 HB THR A 25 -10.038 -20.384 19.586 1.00 44.44 H new ATOM 0 HG1 THR A 25 -7.874 -19.546 19.919 1.00 44.34 H new ATOM 0 HG21 THR A 25 -9.322 -19.621 21.819 1.00 73.24 H new ATOM 0 HG22 THR A 25 -10.447 -20.995 21.923 1.00 73.24 H new ATOM 0 HG23 THR A 25 -8.704 -21.252 22.174 1.00 73.24 H new ATOM 365 N VAL A 26 -11.860 -22.662 19.718 1.00 21.54 N ATOM 366 CA VAL A 26 -13.176 -23.079 20.189 1.00 43.32 C ATOM 367 C VAL A 26 -13.308 -24.597 20.179 1.00 24.45 C ATOM 368 O VAL A 26 -13.962 -25.180 21.045 1.00 23.33 O ATOM 369 CB VAL A 26 -14.298 -22.472 19.326 1.00 10.53 C ATOM 370 CG1 VAL A 26 -15.661 -22.931 19.822 1.00 24.00 C ATOM 371 CG2 VAL A 26 -14.206 -20.953 19.325 1.00 32.11 C ATOM 0 H VAL A 26 -11.869 -22.161 18.830 1.00 21.54 H new ATOM 0 HA VAL A 26 -13.276 -22.716 21.212 1.00 43.32 H new ATOM 0 HB VAL A 26 -14.174 -22.822 18.301 1.00 10.53 H new ATOM 0 HG11 VAL A 26 -16.441 -22.492 19.200 1.00 24.00 H new ATOM 0 HG12 VAL A 26 -15.721 -24.018 19.766 1.00 24.00 H new ATOM 0 HG13 VAL A 26 -15.798 -22.612 20.855 1.00 24.00 H new ATOM 0 HG21 VAL A 26 -15.006 -20.540 18.710 1.00 32.11 H new ATOM 0 HG22 VAL A 26 -14.304 -20.582 20.345 1.00 32.11 H new ATOM 0 HG23 VAL A 26 -13.242 -20.647 18.919 1.00 32.11 H new ATOM 381 N LEU A 27 -12.682 -25.234 19.195 1.00 0.15 N ATOM 382 CA LEU A 27 -12.728 -26.687 19.073 1.00 54.22 C ATOM 383 C LEU A 27 -12.219 -27.357 20.344 1.00 25.34 C ATOM 384 O LEU A 27 -12.952 -28.089 21.010 1.00 65.02 O ATOM 385 CB LEU A 27 -11.897 -27.144 17.873 1.00 41.21 C ATOM 386 CG LEU A 27 -12.573 -28.137 16.927 1.00 40.11 C ATOM 387 CD1 LEU A 27 -12.922 -29.422 17.662 1.00 2.41 C ATOM 388 CD2 LEU A 27 -13.818 -27.520 16.307 1.00 13.22 C ATOM 0 H LEU A 27 -12.137 -24.767 18.470 1.00 0.15 H new ATOM 0 HA LEU A 27 -13.766 -26.981 18.921 1.00 54.22 H new ATOM 0 HB2 LEU A 27 -11.610 -26.263 17.298 1.00 41.21 H new ATOM 0 HB3 LEU A 27 -10.977 -27.595 18.244 1.00 41.21 H new ATOM 0 HG LEU A 27 -11.875 -28.379 16.126 1.00 40.11 H new ATOM 0 HD11 LEU A 27 -13.402 -30.116 16.973 1.00 2.41 H new ATOM 0 HD12 LEU A 27 -12.012 -29.874 18.057 1.00 2.41 H new ATOM 0 HD13 LEU A 27 -13.602 -29.198 18.484 1.00 2.41 H new ATOM 0 HD21 LEU A 27 -14.286 -28.241 15.637 1.00 13.22 H new ATOM 0 HD22 LEU A 27 -14.520 -27.248 17.095 1.00 13.22 H new ATOM 0 HD23 LEU A 27 -13.541 -26.628 15.745 1.00 13.22 H new ATOM 400 N VAL A 28 -10.957 -27.101 20.678 1.00 55.23 N ATOM 401 CA VAL A 28 -10.350 -27.677 21.871 1.00 0.34 C ATOM 402 C VAL A 28 -11.130 -27.294 23.124 1.00 32.21 C ATOM 403 O VAL A 28 -11.119 -28.018 24.120 1.00 12.54 O ATOM 404 CB VAL A 28 -8.887 -27.222 22.032 1.00 13.31 C ATOM 405 CG1 VAL A 28 -8.020 -27.814 20.932 1.00 24.43 C ATOM 406 CG2 VAL A 28 -8.799 -25.703 22.032 1.00 51.02 C ATOM 0 H VAL A 28 -10.336 -26.498 20.138 1.00 55.23 H new ATOM 0 HA VAL A 28 -10.375 -28.760 21.747 1.00 0.34 H new ATOM 0 HB VAL A 28 -8.515 -27.585 22.990 1.00 13.31 H new ATOM 0 HG11 VAL A 28 -6.990 -27.482 21.062 1.00 24.43 H new ATOM 0 HG12 VAL A 28 -8.059 -28.902 20.984 1.00 24.43 H new ATOM 0 HG13 VAL A 28 -8.388 -27.483 19.961 1.00 24.43 H new ATOM 0 HG21 VAL A 28 -7.759 -25.399 22.147 1.00 51.02 H new ATOM 0 HG22 VAL A 28 -9.189 -25.316 21.090 1.00 51.02 H new ATOM 0 HG23 VAL A 28 -9.387 -25.304 22.859 1.00 51.02 H new ATOM 416 N PHE A 29 -11.808 -26.152 23.067 1.00 63.40 N ATOM 417 CA PHE A 29 -12.594 -25.673 24.197 1.00 10.45 C ATOM 418 C PHE A 29 -13.925 -26.414 24.288 1.00 25.12 C ATOM 419 O PHE A 29 -14.613 -26.354 25.307 1.00 12.41 O ATOM 420 CB PHE A 29 -12.843 -24.168 24.071 1.00 72.32 C ATOM 421 CG PHE A 29 -11.945 -23.337 24.941 1.00 13.44 C ATOM 422 CD1 PHE A 29 -10.595 -23.218 24.653 1.00 13.43 C ATOM 423 CD2 PHE A 29 -12.451 -22.674 26.048 1.00 33.01 C ATOM 424 CE1 PHE A 29 -9.766 -22.453 25.452 1.00 12.32 C ATOM 425 CE2 PHE A 29 -11.627 -21.907 26.850 1.00 33.43 C ATOM 426 CZ PHE A 29 -10.283 -21.798 26.553 1.00 41.43 C ATOM 0 H PHE A 29 -11.828 -25.542 22.250 1.00 63.40 H new ATOM 0 HA PHE A 29 -12.028 -25.866 25.108 1.00 10.45 H new ATOM 0 HB2 PHE A 29 -12.705 -23.871 23.031 1.00 72.32 H new ATOM 0 HB3 PHE A 29 -13.881 -23.957 24.328 1.00 72.32 H new ATOM 0 HD1 PHE A 29 -10.186 -23.729 23.794 1.00 13.43 H new ATOM 0 HD2 PHE A 29 -13.501 -22.758 26.287 1.00 33.01 H new ATOM 0 HE1 PHE A 29 -8.716 -22.367 25.216 1.00 12.32 H new ATOM 0 HE2 PHE A 29 -12.034 -21.393 27.708 1.00 33.43 H new ATOM 0 HZ PHE A 29 -9.637 -21.202 27.180 1.00 41.43 H new ATOM 436 N TYR A 30 -14.280 -27.113 23.216 1.00 42.43 N ATOM 437 CA TYR A 30 -15.529 -27.864 23.172 1.00 42.41 C ATOM 438 C TYR A 30 -15.323 -29.293 23.665 1.00 41.41 C ATOM 439 O TYR A 30 -16.196 -29.870 24.315 1.00 5.31 O ATOM 440 CB TYR A 30 -16.089 -27.879 21.749 1.00 54.02 C ATOM 441 CG TYR A 30 -17.065 -29.006 21.495 1.00 54.54 C ATOM 442 CD1 TYR A 30 -18.370 -28.940 21.968 1.00 72.30 C ATOM 443 CD2 TYR A 30 -16.683 -30.135 20.782 1.00 22.22 C ATOM 444 CE1 TYR A 30 -19.265 -29.967 21.739 1.00 73.42 C ATOM 445 CE2 TYR A 30 -17.571 -31.166 20.547 1.00 35.31 C ATOM 446 CZ TYR A 30 -18.861 -31.078 21.027 1.00 14.15 C ATOM 447 OH TYR A 30 -19.749 -32.104 20.797 1.00 52.44 O ATOM 0 H TYR A 30 -13.720 -27.175 22.366 1.00 42.43 H new ATOM 0 HA TYR A 30 -16.244 -27.371 23.831 1.00 42.41 H new ATOM 0 HB2 TYR A 30 -16.585 -26.929 21.553 1.00 54.02 H new ATOM 0 HB3 TYR A 30 -15.262 -27.959 21.043 1.00 54.02 H new ATOM 0 HD1 TYR A 30 -18.690 -28.071 22.524 1.00 72.30 H new ATOM 0 HD2 TYR A 30 -15.674 -30.208 20.405 1.00 22.22 H new ATOM 0 HE1 TYR A 30 -20.275 -29.901 22.115 1.00 73.42 H new ATOM 0 HE2 TYR A 30 -17.257 -32.037 19.990 1.00 35.31 H new ATOM 0 HH TYR A 30 -19.307 -32.810 20.281 1.00 52.44 H new ATOM 457 N LEU A 31 -14.162 -29.858 23.351 1.00 14.03 N ATOM 458 CA LEU A 31 -13.839 -31.220 23.762 1.00 11.11 C ATOM 459 C LEU A 31 -12.403 -31.310 24.268 1.00 10.42 C ATOM 460 O LEU A 31 -11.517 -31.847 23.603 1.00 1.33 O ATOM 461 CB LEU A 31 -14.042 -32.187 22.595 1.00 61.43 C ATOM 462 CG LEU A 31 -13.798 -33.666 22.898 1.00 22.13 C ATOM 463 CD1 LEU A 31 -14.908 -34.221 23.778 1.00 43.24 C ATOM 464 CD2 LEU A 31 -13.688 -34.464 21.607 1.00 31.55 C ATOM 0 H LEU A 31 -13.429 -29.394 22.814 1.00 14.03 H new ATOM 0 HA LEU A 31 -14.509 -31.496 24.576 1.00 11.11 H new ATOM 0 HB2 LEU A 31 -15.063 -32.075 22.230 1.00 61.43 H new ATOM 0 HB3 LEU A 31 -13.379 -31.889 21.783 1.00 61.43 H new ATOM 0 HG LEU A 31 -12.855 -33.756 23.438 1.00 22.13 H new ATOM 0 HD11 LEU A 31 -14.717 -35.274 23.983 1.00 43.24 H new ATOM 0 HD12 LEU A 31 -14.939 -33.668 24.717 1.00 43.24 H new ATOM 0 HD13 LEU A 31 -15.864 -34.118 23.265 1.00 43.24 H new ATOM 0 HD21 LEU A 31 -13.514 -35.514 21.842 1.00 31.55 H new ATOM 0 HD22 LEU A 31 -14.614 -34.367 21.040 1.00 31.55 H new ATOM 0 HD23 LEU A 31 -12.857 -34.083 21.013 1.00 31.55 H new ATOM 476 N PRO A 32 -12.166 -30.773 25.475 1.00 61.44 N ATOM 477 CA PRO A 32 -10.839 -30.783 26.098 1.00 13.22 C ATOM 478 C PRO A 32 -10.410 -32.182 26.527 1.00 13.32 C ATOM 479 O PRO A 32 -11.247 -33.032 26.831 1.00 60.13 O ATOM 480 CB PRO A 32 -11.016 -29.879 27.321 1.00 63.00 C ATOM 481 CG PRO A 32 -12.469 -29.954 27.641 1.00 41.44 C ATOM 482 CD PRO A 32 -13.175 -30.117 26.323 1.00 22.10 C ATOM 0 HA PRO A 32 -10.063 -30.447 25.410 1.00 13.22 H new ATOM 0 HB2 PRO A 32 -10.408 -30.222 28.158 1.00 63.00 H new ATOM 0 HB3 PRO A 32 -10.711 -28.855 27.104 1.00 63.00 H new ATOM 0 HG2 PRO A 32 -12.680 -30.794 28.303 1.00 41.44 H new ATOM 0 HG3 PRO A 32 -12.803 -29.052 28.154 1.00 41.44 H new ATOM 0 HD2 PRO A 32 -14.074 -30.725 26.421 1.00 22.10 H new ATOM 0 HD3 PRO A 32 -13.483 -29.156 25.911 1.00 22.10 H new ATOM 490 N SER A 33 -9.102 -32.413 26.551 1.00 63.45 N ATOM 491 CA SER A 33 -8.562 -33.711 26.940 1.00 41.14 C ATOM 492 C SER A 33 -7.832 -33.617 28.276 1.00 34.23 C ATOM 493 O SER A 33 -7.645 -34.620 28.964 1.00 14.14 O ATOM 494 CB SER A 33 -7.611 -34.235 25.862 1.00 24.02 C ATOM 495 OG SER A 33 -6.671 -33.244 25.485 1.00 2.54 O ATOM 0 H SER A 33 -8.396 -31.719 26.306 1.00 63.45 H new ATOM 0 HA SER A 33 -9.395 -34.406 27.049 1.00 41.14 H new ATOM 0 HB2 SER A 33 -7.087 -35.116 26.232 1.00 24.02 H new ATOM 0 HB3 SER A 33 -8.183 -34.548 24.989 1.00 24.02 H new ATOM 0 HG SER A 33 -6.074 -33.604 24.796 1.00 2.54 H new ATOM 501 N GLU A 34 -7.423 -32.405 28.636 1.00 2.31 N ATOM 502 CA GLU A 34 -6.713 -32.180 29.890 1.00 51.42 C ATOM 503 C GLU A 34 -7.094 -30.832 30.496 1.00 20.13 C ATOM 504 O GLU A 34 -7.681 -29.982 29.826 1.00 14.25 O ATOM 505 CB GLU A 34 -5.201 -32.240 29.664 1.00 70.43 C ATOM 506 CG GLU A 34 -4.414 -32.612 30.909 1.00 22.00 C ATOM 507 CD GLU A 34 -3.287 -33.585 30.618 1.00 14.35 C ATOM 508 OE1 GLU A 34 -2.198 -33.128 30.213 1.00 31.23 O ATOM 509 OE2 GLU A 34 -3.496 -34.803 30.797 1.00 62.21 O ATOM 0 H GLU A 34 -7.571 -31.564 28.078 1.00 2.31 H new ATOM 0 HA GLU A 34 -7.000 -32.967 30.587 1.00 51.42 H new ATOM 0 HB2 GLU A 34 -4.988 -32.966 28.879 1.00 70.43 H new ATOM 0 HB3 GLU A 34 -4.857 -31.271 29.303 1.00 70.43 H new ATOM 0 HG2 GLU A 34 -4.002 -31.708 31.357 1.00 22.00 H new ATOM 0 HG3 GLU A 34 -5.089 -33.053 31.643 1.00 22.00 H new ATOM 516 N CYS A 35 -6.756 -30.646 31.767 1.00 10.43 N ATOM 517 CA CYS A 35 -7.063 -29.402 32.466 1.00 73.43 C ATOM 518 C CYS A 35 -5.896 -28.425 32.375 1.00 21.12 C ATOM 519 O CYS A 35 -6.004 -27.273 32.793 1.00 42.14 O ATOM 520 CB CYS A 35 -7.395 -29.685 33.932 1.00 71.34 C ATOM 521 SG CYS A 35 -8.823 -30.768 34.170 1.00 72.44 S ATOM 0 H CYS A 35 -6.270 -31.340 32.335 1.00 10.43 H new ATOM 0 HA CYS A 35 -7.930 -28.949 31.986 1.00 73.43 H new ATOM 0 HB2 CYS A 35 -6.526 -30.138 34.409 1.00 71.34 H new ATOM 0 HB3 CYS A 35 -7.581 -28.739 34.440 1.00 71.34 H new ATOM 0 HG CYS A 35 -9.023 -30.950 35.442 1.00 72.44 H new ATOM 527 N GLY A 36 -4.779 -28.895 31.828 1.00 43.50 N ATOM 528 CA GLY A 36 -3.606 -28.050 31.694 1.00 13.34 C ATOM 529 C GLY A 36 -3.297 -27.711 30.250 1.00 55.33 C ATOM 530 O GLY A 36 -3.001 -26.561 29.925 1.00 22.45 O ATOM 0 H GLY A 36 -4.665 -29.845 31.475 1.00 43.50 H new ATOM 0 HA2 GLY A 36 -3.760 -27.128 32.255 1.00 13.34 H new ATOM 0 HA3 GLY A 36 -2.747 -28.553 32.137 1.00 13.34 H new ATOM 534 N GLU A 37 -3.366 -28.714 29.380 1.00 23.13 N ATOM 535 CA GLU A 37 -3.088 -28.516 27.963 1.00 52.24 C ATOM 536 C GLU A 37 -3.921 -27.367 27.401 1.00 71.24 C ATOM 537 O GLU A 37 -3.490 -26.660 26.489 1.00 33.14 O ATOM 538 CB GLU A 37 -3.375 -29.799 27.180 1.00 41.24 C ATOM 539 CG GLU A 37 -2.765 -29.812 25.788 1.00 53.41 C ATOM 540 CD GLU A 37 -1.667 -30.847 25.642 1.00 51.04 C ATOM 541 OE1 GLU A 37 -0.867 -31.000 26.589 1.00 73.34 O ATOM 542 OE2 GLU A 37 -1.607 -31.503 24.581 1.00 31.31 O ATOM 0 H GLU A 37 -3.612 -29.671 29.632 1.00 23.13 H new ATOM 0 HA GLU A 37 -2.033 -28.263 27.858 1.00 52.24 H new ATOM 0 HB2 GLU A 37 -2.994 -30.651 27.743 1.00 41.24 H new ATOM 0 HB3 GLU A 37 -4.454 -29.930 27.096 1.00 41.24 H new ATOM 0 HG2 GLU A 37 -3.547 -30.011 25.055 1.00 53.41 H new ATOM 0 HG3 GLU A 37 -2.361 -28.825 25.563 1.00 53.41 H new ATOM 549 N LYS A 38 -5.117 -27.187 27.950 1.00 33.54 N ATOM 550 CA LYS A 38 -6.012 -26.125 27.506 1.00 32.44 C ATOM 551 C LYS A 38 -5.351 -24.759 27.657 1.00 55.12 C ATOM 552 O LYS A 38 -5.258 -23.995 26.695 1.00 20.33 O ATOM 553 CB LYS A 38 -7.317 -26.163 28.305 1.00 74.24 C ATOM 554 CG LYS A 38 -8.539 -26.476 27.458 1.00 31.52 C ATOM 555 CD LYS A 38 -9.398 -25.242 27.240 1.00 43.01 C ATOM 556 CE LYS A 38 -10.078 -24.801 28.527 1.00 23.31 C ATOM 557 NZ LYS A 38 -11.207 -25.700 28.894 1.00 60.24 N ATOM 0 H LYS A 38 -5.490 -27.764 28.704 1.00 33.54 H new ATOM 0 HA LYS A 38 -6.234 -26.287 26.451 1.00 32.44 H new ATOM 0 HB2 LYS A 38 -7.230 -26.911 29.093 1.00 74.24 H new ATOM 0 HB3 LYS A 38 -7.462 -25.200 28.795 1.00 74.24 H new ATOM 0 HG2 LYS A 38 -8.222 -26.875 26.494 1.00 31.52 H new ATOM 0 HG3 LYS A 38 -9.131 -27.251 27.945 1.00 31.52 H new ATOM 0 HD2 LYS A 38 -8.780 -24.430 26.857 1.00 43.01 H new ATOM 0 HD3 LYS A 38 -10.153 -25.452 26.482 1.00 43.01 H new ATOM 0 HE2 LYS A 38 -9.348 -24.786 29.336 1.00 23.31 H new ATOM 0 HE3 LYS A 38 -10.448 -23.782 28.412 1.00 23.31 H new ATOM 0 HZ1 LYS A 38 -11.718 -25.301 29.707 1.00 60.24 H new ATOM 0 HZ2 LYS A 38 -11.857 -25.789 28.087 1.00 60.24 H new ATOM 0 HZ3 LYS A 38 -10.836 -26.639 29.145 1.00 60.24 H new ATOM 571 N ILE A 39 -4.894 -24.458 28.867 1.00 21.04 N ATOM 572 CA ILE A 39 -4.240 -23.185 29.142 1.00 42.44 C ATOM 573 C ILE A 39 -3.026 -22.985 28.240 1.00 11.23 C ATOM 574 O ILE A 39 -2.778 -21.883 27.748 1.00 21.44 O ATOM 575 CB ILE A 39 -3.795 -23.086 30.613 1.00 44.44 C ATOM 576 CG1 ILE A 39 -5.000 -23.228 31.544 1.00 73.42 C ATOM 577 CG2 ILE A 39 -3.079 -21.766 30.862 1.00 73.31 C ATOM 578 CD1 ILE A 39 -5.083 -24.578 32.222 1.00 13.23 C ATOM 0 H ILE A 39 -4.965 -25.079 29.673 1.00 21.04 H new ATOM 0 HA ILE A 39 -4.973 -22.404 28.940 1.00 42.44 H new ATOM 0 HB ILE A 39 -3.100 -23.899 30.822 1.00 44.44 H new ATOM 0 HG12 ILE A 39 -4.954 -22.450 32.306 1.00 73.42 H new ATOM 0 HG13 ILE A 39 -5.913 -23.061 30.972 1.00 73.42 H new ATOM 0 HG21 ILE A 39 -2.771 -21.711 31.906 1.00 73.31 H new ATOM 0 HG22 ILE A 39 -2.200 -21.702 30.220 1.00 73.31 H new ATOM 0 HG23 ILE A 39 -3.753 -20.939 30.638 1.00 73.31 H new ATOM 0 HD11 ILE A 39 -5.961 -24.608 32.867 1.00 13.23 H new ATOM 0 HD12 ILE A 39 -5.160 -25.360 31.467 1.00 13.23 H new ATOM 0 HD13 ILE A 39 -4.187 -24.740 32.821 1.00 13.23 H new ATOM 590 N THR A 40 -2.272 -24.058 28.026 1.00 61.54 N ATOM 591 CA THR A 40 -1.084 -24.002 27.183 1.00 72.21 C ATOM 592 C THR A 40 -1.444 -23.624 25.751 1.00 63.14 C ATOM 593 O THR A 40 -0.869 -22.696 25.180 1.00 55.12 O ATOM 594 CB THR A 40 -0.337 -25.349 27.174 1.00 32.22 C ATOM 595 OG1 THR A 40 0.241 -25.597 28.461 1.00 74.33 O ATOM 596 CG2 THR A 40 0.753 -25.357 26.113 1.00 10.42 C ATOM 0 H THR A 40 -2.463 -24.977 28.425 1.00 61.54 H new ATOM 0 HA THR A 40 -0.433 -23.237 27.605 1.00 72.21 H new ATOM 0 HB THR A 40 -1.055 -26.136 26.940 1.00 32.22 H new ATOM 0 HG1 THR A 40 0.713 -26.456 28.448 1.00 74.33 H new ATOM 0 HG21 THR A 40 1.266 -26.318 26.126 1.00 10.42 H new ATOM 0 HG22 THR A 40 0.307 -25.197 25.132 1.00 10.42 H new ATOM 0 HG23 THR A 40 1.468 -24.561 26.320 1.00 10.42 H new ATOM 604 N LEU A 41 -2.397 -24.348 25.174 1.00 13.44 N ATOM 605 CA LEU A 41 -2.835 -24.087 23.807 1.00 25.32 C ATOM 606 C LEU A 41 -3.420 -22.684 23.680 1.00 25.44 C ATOM 607 O LEU A 41 -3.222 -22.008 22.670 1.00 11.34 O ATOM 608 CB LEU A 41 -3.872 -25.126 23.376 1.00 1.32 C ATOM 609 CG LEU A 41 -3.351 -26.548 23.166 1.00 2.22 C ATOM 610 CD1 LEU A 41 -4.507 -27.530 23.063 1.00 72.12 C ATOM 611 CD2 LEU A 41 -2.477 -26.617 21.922 1.00 22.34 C ATOM 0 H LEU A 41 -2.881 -25.120 25.631 1.00 13.44 H new ATOM 0 HA LEU A 41 -1.965 -24.158 23.154 1.00 25.32 H new ATOM 0 HB2 LEU A 41 -4.660 -25.157 24.128 1.00 1.32 H new ATOM 0 HB3 LEU A 41 -4.331 -24.788 22.447 1.00 1.32 H new ATOM 0 HG LEU A 41 -2.744 -26.823 24.028 1.00 2.22 H new ATOM 0 HD11 LEU A 41 -4.117 -28.537 22.914 1.00 72.12 H new ATOM 0 HD12 LEU A 41 -5.093 -27.500 23.982 1.00 72.12 H new ATOM 0 HD13 LEU A 41 -5.141 -27.258 22.219 1.00 72.12 H new ATOM 0 HD21 LEU A 41 -2.115 -27.636 21.788 1.00 22.34 H new ATOM 0 HD22 LEU A 41 -3.061 -26.322 21.050 1.00 22.34 H new ATOM 0 HD23 LEU A 41 -1.628 -25.942 22.036 1.00 22.34 H new ATOM 623 N CYS A 42 -4.138 -22.253 24.711 1.00 24.24 N ATOM 624 CA CYS A 42 -4.750 -20.929 24.716 1.00 32.42 C ATOM 625 C CYS A 42 -3.706 -19.846 24.469 1.00 44.02 C ATOM 626 O CYS A 42 -3.902 -18.959 23.638 1.00 14.51 O ATOM 627 CB CYS A 42 -5.459 -20.677 26.048 1.00 64.31 C ATOM 628 SG CYS A 42 -5.937 -18.954 26.315 1.00 72.31 S ATOM 0 H CYS A 42 -4.311 -22.801 25.554 1.00 24.24 H new ATOM 0 HA CYS A 42 -5.483 -20.892 23.910 1.00 32.42 H new ATOM 0 HB2 CYS A 42 -6.351 -21.302 26.097 1.00 64.31 H new ATOM 0 HB3 CYS A 42 -4.805 -20.992 26.861 1.00 64.31 H new ATOM 0 HG CYS A 42 -6.531 -18.842 27.466 1.00 72.31 H new ATOM 634 N ILE A 43 -2.596 -19.924 25.196 1.00 73.01 N ATOM 635 CA ILE A 43 -1.521 -18.950 25.056 1.00 53.35 C ATOM 636 C ILE A 43 -0.789 -19.126 23.729 1.00 34.04 C ATOM 637 O ILE A 43 -0.213 -18.178 23.196 1.00 72.11 O ATOM 638 CB ILE A 43 -0.506 -19.062 26.208 1.00 10.52 C ATOM 639 CG1 ILE A 43 -1.188 -18.771 27.547 1.00 25.20 C ATOM 640 CG2 ILE A 43 0.658 -18.109 25.983 1.00 44.33 C ATOM 641 CD1 ILE A 43 -0.414 -19.282 28.742 1.00 3.02 C ATOM 0 H ILE A 43 -2.418 -20.652 25.888 1.00 73.01 H new ATOM 0 HA ILE A 43 -1.983 -17.963 25.085 1.00 53.35 H new ATOM 0 HB ILE A 43 -0.117 -20.080 26.233 1.00 10.52 H new ATOM 0 HG12 ILE A 43 -1.328 -17.695 27.648 1.00 25.20 H new ATOM 0 HG13 ILE A 43 -2.180 -19.223 27.546 1.00 25.20 H new ATOM 0 HG21 ILE A 43 1.367 -18.200 26.806 1.00 44.33 H new ATOM 0 HG22 ILE A 43 1.156 -18.358 25.046 1.00 44.33 H new ATOM 0 HG23 ILE A 43 0.286 -17.085 25.936 1.00 44.33 H new ATOM 0 HD11 ILE A 43 -0.956 -19.041 29.657 1.00 3.02 H new ATOM 0 HD12 ILE A 43 -0.296 -20.363 28.664 1.00 3.02 H new ATOM 0 HD13 ILE A 43 0.569 -18.811 28.768 1.00 3.02 H new ATOM 653 N SER A 44 -0.818 -20.346 23.202 1.00 41.44 N ATOM 654 CA SER A 44 -0.155 -20.647 21.938 1.00 34.30 C ATOM 655 C SER A 44 -0.878 -19.979 20.772 1.00 35.25 C ATOM 656 O SER A 44 -0.318 -19.124 20.087 1.00 10.54 O ATOM 657 CB SER A 44 -0.097 -22.160 21.717 1.00 21.01 C ATOM 658 OG SER A 44 1.222 -22.580 21.413 1.00 32.41 O ATOM 0 H SER A 44 -1.293 -21.141 23.630 1.00 41.44 H new ATOM 0 HA SER A 44 0.861 -20.254 21.986 1.00 34.30 H new ATOM 0 HB2 SER A 44 -0.449 -22.675 22.611 1.00 21.01 H new ATOM 0 HB3 SER A 44 -0.767 -22.438 20.904 1.00 21.01 H new ATOM 0 HG SER A 44 1.233 -23.551 21.278 1.00 32.41 H new ATOM 664 N VAL A 45 -2.128 -20.377 20.553 1.00 2.22 N ATOM 665 CA VAL A 45 -2.930 -19.817 19.472 1.00 64.03 C ATOM 666 C VAL A 45 -2.946 -18.294 19.531 1.00 4.32 C ATOM 667 O VAL A 45 -2.718 -17.620 18.526 1.00 42.34 O ATOM 668 CB VAL A 45 -4.379 -20.337 19.520 1.00 4.01 C ATOM 669 CG1 VAL A 45 -5.179 -19.799 18.344 1.00 42.22 C ATOM 670 CG2 VAL A 45 -4.398 -21.858 19.538 1.00 51.04 C ATOM 0 H VAL A 45 -2.606 -21.085 21.110 1.00 2.22 H new ATOM 0 HA VAL A 45 -2.468 -20.136 18.538 1.00 64.03 H new ATOM 0 HB VAL A 45 -4.845 -19.980 20.438 1.00 4.01 H new ATOM 0 HG11 VAL A 45 -6.200 -20.177 18.395 1.00 42.22 H new ATOM 0 HG12 VAL A 45 -5.193 -18.710 18.382 1.00 42.22 H new ATOM 0 HG13 VAL A 45 -4.718 -20.124 17.411 1.00 42.22 H new ATOM 0 HG21 VAL A 45 -5.430 -22.209 19.572 1.00 51.04 H new ATOM 0 HG22 VAL A 45 -3.915 -22.239 18.638 1.00 51.04 H new ATOM 0 HG23 VAL A 45 -3.863 -22.218 20.417 1.00 51.04 H new ATOM 680 N LEU A 46 -3.216 -17.756 20.716 1.00 64.34 N ATOM 681 CA LEU A 46 -3.261 -16.311 20.908 1.00 42.14 C ATOM 682 C LEU A 46 -1.986 -15.653 20.390 1.00 41.40 C ATOM 683 O LEU A 46 -2.031 -14.590 19.769 1.00 52.20 O ATOM 684 CB LEU A 46 -3.455 -15.979 22.388 1.00 23.12 C ATOM 685 CG LEU A 46 -3.672 -14.503 22.722 1.00 4.25 C ATOM 686 CD1 LEU A 46 -5.124 -14.248 23.095 1.00 41.44 C ATOM 687 CD2 LEU A 46 -2.746 -14.070 23.850 1.00 11.21 C ATOM 0 H LEU A 46 -3.407 -18.299 21.558 1.00 64.34 H new ATOM 0 HA LEU A 46 -4.106 -15.920 20.341 1.00 42.14 H new ATOM 0 HB2 LEU A 46 -4.311 -16.544 22.757 1.00 23.12 H new ATOM 0 HB3 LEU A 46 -2.581 -16.330 22.936 1.00 23.12 H new ATOM 0 HG LEU A 46 -3.436 -13.912 21.837 1.00 4.25 H new ATOM 0 HD11 LEU A 46 -5.259 -13.192 23.330 1.00 41.44 H new ATOM 0 HD12 LEU A 46 -5.768 -14.519 22.258 1.00 41.44 H new ATOM 0 HD13 LEU A 46 -5.387 -14.850 23.965 1.00 41.44 H new ATOM 0 HD21 LEU A 46 -2.914 -13.017 24.075 1.00 11.21 H new ATOM 0 HD22 LEU A 46 -2.951 -14.668 24.738 1.00 11.21 H new ATOM 0 HD23 LEU A 46 -1.709 -14.215 23.546 1.00 11.21 H new ATOM 699 N LEU A 47 -0.850 -16.291 20.648 1.00 71.45 N ATOM 700 CA LEU A 47 0.438 -15.769 20.206 1.00 65.45 C ATOM 701 C LEU A 47 0.440 -15.527 18.700 1.00 63.35 C ATOM 702 O LEU A 47 0.874 -14.475 18.230 1.00 14.15 O ATOM 703 CB LEU A 47 1.560 -16.741 20.579 1.00 53.22 C ATOM 704 CG LEU A 47 2.779 -16.126 21.268 1.00 74.23 C ATOM 705 CD1 LEU A 47 3.237 -17.002 22.423 1.00 32.33 C ATOM 706 CD2 LEU A 47 3.909 -15.923 20.270 1.00 40.44 C ATOM 0 H LEU A 47 -0.795 -17.171 21.161 1.00 71.45 H new ATOM 0 HA LEU A 47 0.608 -14.817 20.709 1.00 65.45 H new ATOM 0 HB2 LEU A 47 1.146 -17.508 21.233 1.00 53.22 H new ATOM 0 HB3 LEU A 47 1.895 -17.243 19.671 1.00 53.22 H new ATOM 0 HG LEU A 47 2.494 -15.153 21.668 1.00 74.23 H new ATOM 0 HD11 LEU A 47 4.105 -16.549 22.901 1.00 32.33 H new ATOM 0 HD12 LEU A 47 2.430 -17.097 23.150 1.00 32.33 H new ATOM 0 HD13 LEU A 47 3.504 -17.990 22.047 1.00 32.33 H new ATOM 0 HD21 LEU A 47 4.768 -15.485 20.777 1.00 40.44 H new ATOM 0 HD22 LEU A 47 4.192 -16.884 19.841 1.00 40.44 H new ATOM 0 HD23 LEU A 47 3.577 -15.255 19.475 1.00 40.44 H new ATOM 718 N SER A 48 -0.049 -16.508 17.947 1.00 1.21 N ATOM 719 CA SER A 48 -0.102 -16.402 16.494 1.00 73.03 C ATOM 720 C SER A 48 -0.908 -15.178 16.067 1.00 25.33 C ATOM 721 O SER A 48 -0.620 -14.558 15.043 1.00 53.41 O ATOM 722 CB SER A 48 -0.718 -17.667 15.892 1.00 44.35 C ATOM 723 OG SER A 48 -1.401 -17.376 14.684 1.00 23.43 O ATOM 0 H SER A 48 -0.414 -17.385 18.320 1.00 1.21 H new ATOM 0 HA SER A 48 0.918 -16.291 16.125 1.00 73.03 H new ATOM 0 HB2 SER A 48 0.064 -18.402 15.703 1.00 44.35 H new ATOM 0 HB3 SER A 48 -1.410 -18.114 16.606 1.00 44.35 H new ATOM 0 HG SER A 48 -1.784 -18.200 14.318 1.00 23.43 H new ATOM 729 N LEU A 49 -1.917 -14.837 16.860 1.00 12.12 N ATOM 730 CA LEU A 49 -2.766 -13.687 16.566 1.00 23.24 C ATOM 731 C LEU A 49 -2.034 -12.381 16.859 1.00 22.30 C ATOM 732 O LEU A 49 -2.323 -11.346 16.257 1.00 25.25 O ATOM 733 CB LEU A 49 -4.055 -13.757 17.387 1.00 71.25 C ATOM 734 CG LEU A 49 -5.335 -13.339 16.662 1.00 50.01 C ATOM 735 CD1 LEU A 49 -5.214 -11.914 16.144 1.00 62.44 C ATOM 736 CD2 LEU A 49 -5.640 -14.299 15.522 1.00 73.25 C ATOM 0 H LEU A 49 -2.168 -15.340 17.711 1.00 12.12 H new ATOM 0 HA LEU A 49 -3.016 -13.712 15.505 1.00 23.24 H new ATOM 0 HB2 LEU A 49 -4.180 -14.779 17.743 1.00 71.25 H new ATOM 0 HB3 LEU A 49 -3.937 -13.125 18.267 1.00 71.25 H new ATOM 0 HG LEU A 49 -6.161 -13.376 17.372 1.00 50.01 H new ATOM 0 HD11 LEU A 49 -6.134 -11.634 15.631 1.00 62.44 H new ATOM 0 HD12 LEU A 49 -5.044 -11.236 16.980 1.00 62.44 H new ATOM 0 HD13 LEU A 49 -4.377 -11.849 15.449 1.00 62.44 H new ATOM 0 HD21 LEU A 49 -6.554 -13.986 15.017 1.00 73.25 H new ATOM 0 HD22 LEU A 49 -4.813 -14.294 14.811 1.00 73.25 H new ATOM 0 HD23 LEU A 49 -5.771 -15.306 15.919 1.00 73.25 H new ATOM 748 N THR A 50 -1.082 -12.437 17.786 1.00 54.10 N ATOM 749 CA THR A 50 -0.308 -11.260 18.158 1.00 41.32 C ATOM 750 C THR A 50 0.811 -10.999 17.156 1.00 41.20 C ATOM 751 O THR A 50 0.961 -9.885 16.654 1.00 42.22 O ATOM 752 CB THR A 50 0.302 -11.410 19.564 1.00 3.22 C ATOM 753 OG1 THR A 50 -0.558 -12.203 20.389 1.00 21.42 O ATOM 754 CG2 THR A 50 0.518 -10.049 20.209 1.00 53.13 C ATOM 0 H THR A 50 -0.829 -13.285 18.293 1.00 54.10 H new ATOM 0 HA THR A 50 -0.997 -10.415 18.157 1.00 41.32 H new ATOM 0 HB THR A 50 1.268 -11.905 19.465 1.00 3.22 H new ATOM 0 HG1 THR A 50 -0.162 -12.295 21.281 1.00 21.42 H new ATOM 0 HG21 THR A 50 0.950 -10.181 21.201 1.00 53.13 H new ATOM 0 HG22 THR A 50 1.197 -9.458 19.594 1.00 53.13 H new ATOM 0 HG23 THR A 50 -0.437 -9.531 20.295 1.00 53.13 H new ATOM 762 N VAL A 51 1.595 -12.033 16.868 1.00 33.23 N ATOM 763 CA VAL A 51 2.700 -11.916 15.924 1.00 34.12 C ATOM 764 C VAL A 51 2.232 -11.318 14.602 1.00 34.21 C ATOM 765 O VAL A 51 2.925 -10.498 13.999 1.00 33.52 O ATOM 766 CB VAL A 51 3.354 -13.284 15.653 1.00 11.14 C ATOM 767 CG1 VAL A 51 4.106 -13.769 16.883 1.00 4.21 C ATOM 768 CG2 VAL A 51 2.306 -14.300 15.224 1.00 10.34 C ATOM 0 H VAL A 51 1.485 -12.962 17.275 1.00 33.23 H new ATOM 0 HA VAL A 51 3.436 -11.253 16.379 1.00 34.12 H new ATOM 0 HB VAL A 51 4.071 -13.170 14.840 1.00 11.14 H new ATOM 0 HG11 VAL A 51 4.561 -14.737 16.673 1.00 4.21 H new ATOM 0 HG12 VAL A 51 4.884 -13.050 17.141 1.00 4.21 H new ATOM 0 HG13 VAL A 51 3.412 -13.868 17.718 1.00 4.21 H new ATOM 0 HG21 VAL A 51 2.786 -15.261 15.037 1.00 10.34 H new ATOM 0 HG22 VAL A 51 1.564 -14.413 16.014 1.00 10.34 H new ATOM 0 HG23 VAL A 51 1.816 -13.955 14.313 1.00 10.34 H new ATOM 778 N PHE A 52 1.051 -11.733 14.156 1.00 34.54 N ATOM 779 CA PHE A 52 0.489 -11.239 12.905 1.00 60.34 C ATOM 780 C PHE A 52 -0.141 -9.863 13.097 1.00 0.10 C ATOM 781 O PHE A 52 -0.186 -9.053 12.170 1.00 12.01 O ATOM 782 CB PHE A 52 -0.555 -12.220 12.367 1.00 32.02 C ATOM 783 CG PHE A 52 -1.708 -11.549 11.677 1.00 71.25 C ATOM 784 CD1 PHE A 52 -1.541 -10.960 10.434 1.00 44.12 C ATOM 785 CD2 PHE A 52 -2.959 -11.507 12.270 1.00 33.55 C ATOM 786 CE1 PHE A 52 -2.599 -10.342 9.795 1.00 35.14 C ATOM 787 CE2 PHE A 52 -4.022 -10.892 11.637 1.00 42.43 C ATOM 788 CZ PHE A 52 -3.841 -10.307 10.398 1.00 35.12 C ATOM 0 H PHE A 52 0.464 -12.411 14.643 1.00 34.54 H new ATOM 0 HA PHE A 52 1.300 -11.150 12.182 1.00 60.34 H new ATOM 0 HB2 PHE A 52 -0.073 -12.905 11.669 1.00 32.02 H new ATOM 0 HB3 PHE A 52 -0.936 -12.822 13.192 1.00 32.02 H new ATOM 0 HD1 PHE A 52 -0.572 -10.984 9.958 1.00 44.12 H new ATOM 0 HD2 PHE A 52 -3.105 -11.961 13.239 1.00 33.55 H new ATOM 0 HE1 PHE A 52 -2.455 -9.887 8.826 1.00 35.14 H new ATOM 0 HE2 PHE A 52 -4.993 -10.868 12.110 1.00 42.43 H new ATOM 0 HZ PHE A 52 -4.670 -9.823 9.902 1.00 35.12 H new ATOM 798 N LEU A 53 -0.627 -9.605 14.306 1.00 22.33 N ATOM 799 CA LEU A 53 -1.255 -8.327 14.622 1.00 33.20 C ATOM 800 C LEU A 53 -0.242 -7.190 14.550 1.00 2.43 C ATOM 801 O LEU A 53 -0.490 -6.161 13.920 1.00 74.02 O ATOM 802 CB LEU A 53 -1.886 -8.377 16.015 1.00 43.21 C ATOM 803 CG LEU A 53 -1.935 -7.052 16.777 1.00 61.11 C ATOM 804 CD1 LEU A 53 -2.728 -6.016 15.996 1.00 50.03 C ATOM 805 CD2 LEU A 53 -2.536 -7.255 18.160 1.00 3.53 C ATOM 0 H LEU A 53 -0.598 -10.264 15.084 1.00 22.33 H new ATOM 0 HA LEU A 53 -2.035 -8.141 13.883 1.00 33.20 H new ATOM 0 HB2 LEU A 53 -2.904 -8.755 15.918 1.00 43.21 H new ATOM 0 HB3 LEU A 53 -1.334 -9.099 16.617 1.00 43.21 H new ATOM 0 HG LEU A 53 -0.916 -6.685 16.896 1.00 61.11 H new ATOM 0 HD11 LEU A 53 -2.752 -5.080 16.554 1.00 50.03 H new ATOM 0 HD12 LEU A 53 -2.255 -5.850 15.028 1.00 50.03 H new ATOM 0 HD13 LEU A 53 -3.746 -6.375 15.845 1.00 50.03 H new ATOM 0 HD21 LEU A 53 -2.563 -6.302 18.688 1.00 3.53 H new ATOM 0 HD22 LEU A 53 -3.549 -7.645 18.063 1.00 3.53 H new ATOM 0 HD23 LEU A 53 -1.927 -7.964 18.721 1.00 3.53 H new ATOM 817 N LEU A 54 0.902 -7.381 15.198 1.00 31.53 N ATOM 818 CA LEU A 54 1.955 -6.372 15.206 1.00 23.34 C ATOM 819 C LEU A 54 2.503 -6.146 13.801 1.00 3.21 C ATOM 820 O LEU A 54 2.661 -5.006 13.361 1.00 64.31 O ATOM 821 CB LEU A 54 3.087 -6.795 16.145 1.00 35.13 C ATOM 822 CG LEU A 54 3.523 -5.758 17.181 1.00 54.24 C ATOM 823 CD1 LEU A 54 2.399 -5.485 18.169 1.00 41.35 C ATOM 824 CD2 LEU A 54 4.774 -6.225 17.909 1.00 22.03 C ATOM 0 H LEU A 54 1.124 -8.226 15.725 1.00 31.53 H new ATOM 0 HA LEU A 54 1.525 -5.436 15.563 1.00 23.34 H new ATOM 0 HB2 LEU A 54 2.777 -7.697 16.672 1.00 35.13 H new ATOM 0 HB3 LEU A 54 3.954 -7.061 15.540 1.00 35.13 H new ATOM 0 HG LEU A 54 3.755 -4.829 16.661 1.00 54.24 H new ATOM 0 HD11 LEU A 54 2.728 -4.745 18.899 1.00 41.35 H new ATOM 0 HD12 LEU A 54 1.528 -5.106 17.634 1.00 41.35 H new ATOM 0 HD13 LEU A 54 2.134 -6.409 18.683 1.00 41.35 H new ATOM 0 HD21 LEU A 54 5.070 -5.475 18.642 1.00 22.03 H new ATOM 0 HD22 LEU A 54 4.569 -7.168 18.417 1.00 22.03 H new ATOM 0 HD23 LEU A 54 5.581 -6.368 17.190 1.00 22.03 H new ATOM 836 N LEU A 55 2.790 -7.237 13.100 1.00 35.54 N ATOM 837 CA LEU A 55 3.318 -7.159 11.743 1.00 52.31 C ATOM 838 C LEU A 55 2.441 -6.268 10.868 1.00 4.34 C ATOM 839 O LEU A 55 2.934 -5.586 9.969 1.00 65.30 O ATOM 840 CB LEU A 55 3.415 -8.557 11.130 1.00 12.03 C ATOM 841 CG LEU A 55 4.819 -9.027 10.749 1.00 1.12 C ATOM 842 CD1 LEU A 55 5.344 -8.234 9.562 1.00 35.02 C ATOM 843 CD2 LEU A 55 5.764 -8.902 11.936 1.00 54.22 C ATOM 0 H LEU A 55 2.666 -8.187 13.450 1.00 35.54 H new ATOM 0 HA LEU A 55 4.315 -6.721 11.793 1.00 52.31 H new ATOM 0 HB2 LEU A 55 2.994 -9.272 11.837 1.00 12.03 H new ATOM 0 HB3 LEU A 55 2.790 -8.585 10.238 1.00 12.03 H new ATOM 0 HG LEU A 55 4.764 -10.077 10.462 1.00 1.12 H new ATOM 0 HD11 LEU A 55 6.344 -8.583 9.305 1.00 35.02 H new ATOM 0 HD12 LEU A 55 4.681 -8.374 8.709 1.00 35.02 H new ATOM 0 HD13 LEU A 55 5.384 -7.176 9.820 1.00 35.02 H new ATOM 0 HD21 LEU A 55 6.759 -9.241 11.646 1.00 54.22 H new ATOM 0 HD22 LEU A 55 5.814 -7.860 12.253 1.00 54.22 H new ATOM 0 HD23 LEU A 55 5.397 -9.515 12.759 1.00 54.22 H new ATOM 855 N ILE A 56 1.141 -6.276 11.140 1.00 32.40 N ATOM 856 CA ILE A 56 0.197 -5.466 10.380 1.00 32.32 C ATOM 857 C ILE A 56 0.242 -4.008 10.824 1.00 32.23 C ATOM 858 O ILE A 56 0.014 -3.097 10.028 1.00 62.14 O ATOM 859 CB ILE A 56 -1.243 -5.992 10.529 1.00 71.24 C ATOM 860 CG1 ILE A 56 -1.407 -7.313 9.774 1.00 72.11 C ATOM 861 CG2 ILE A 56 -2.239 -4.959 10.022 1.00 20.54 C ATOM 862 CD1 ILE A 56 -1.225 -7.181 8.278 1.00 25.11 C ATOM 0 H ILE A 56 0.717 -6.834 11.881 1.00 32.40 H new ATOM 0 HA ILE A 56 0.494 -5.534 9.333 1.00 32.32 H new ATOM 0 HB ILE A 56 -1.441 -6.172 11.586 1.00 71.24 H new ATOM 0 HG12 ILE A 56 -0.684 -8.033 10.158 1.00 72.11 H new ATOM 0 HG13 ILE A 56 -2.399 -7.717 9.977 1.00 72.11 H new ATOM 0 HG21 ILE A 56 -3.252 -5.345 10.134 1.00 20.54 H new ATOM 0 HG22 ILE A 56 -2.135 -4.040 10.599 1.00 20.54 H new ATOM 0 HG23 ILE A 56 -2.044 -4.751 8.970 1.00 20.54 H new ATOM 0 HD11 ILE A 56 -1.355 -8.156 7.808 1.00 25.11 H new ATOM 0 HD12 ILE A 56 -1.965 -6.485 7.881 1.00 25.11 H new ATOM 0 HD13 ILE A 56 -0.224 -6.806 8.065 1.00 25.11 H new ATOM 874 N THR A 57 0.539 -3.793 12.102 1.00 32.22 N ATOM 875 CA THR A 57 0.615 -2.446 12.653 1.00 33.11 C ATOM 876 C THR A 57 1.896 -1.745 12.217 1.00 51.14 C ATOM 877 O THR A 57 2.022 -0.528 12.346 1.00 44.23 O ATOM 878 CB THR A 57 0.551 -2.464 14.192 1.00 24.10 C ATOM 879 OG1 THR A 57 1.784 -2.958 14.727 1.00 22.43 O ATOM 880 CG2 THR A 57 -0.601 -3.331 14.676 1.00 12.22 C ATOM 0 H THR A 57 0.731 -4.535 12.775 1.00 32.22 H new ATOM 0 HA THR A 57 -0.245 -1.898 12.267 1.00 33.11 H new ATOM 0 HB THR A 57 0.387 -1.444 14.539 1.00 24.10 H new ATOM 0 HG1 THR A 57 2.192 -3.579 14.088 1.00 22.43 H new ATOM 0 HG21 THR A 57 -0.626 -3.328 15.766 1.00 12.22 H new ATOM 0 HG22 THR A 57 -1.541 -2.936 14.291 1.00 12.22 H new ATOM 0 HG23 THR A 57 -0.463 -4.352 14.319 1.00 12.22 H new ATOM 888 N GLU A 58 2.843 -2.521 11.699 1.00 21.11 N ATOM 889 CA GLU A 58 4.115 -1.972 11.244 1.00 61.43 C ATOM 890 C GLU A 58 4.032 -1.549 9.780 1.00 61.31 C ATOM 891 O GLU A 58 4.575 -0.515 9.390 1.00 23.13 O ATOM 892 CB GLU A 58 5.234 -3.000 11.426 1.00 32.23 C ATOM 893 CG GLU A 58 5.483 -3.378 12.877 1.00 51.51 C ATOM 894 CD GLU A 58 6.037 -2.225 13.693 1.00 73.45 C ATOM 895 OE1 GLU A 58 7.275 -2.066 13.728 1.00 51.42 O ATOM 896 OE2 GLU A 58 5.233 -1.484 14.295 1.00 32.13 O ATOM 0 H GLU A 58 2.754 -3.531 11.584 1.00 21.11 H new ATOM 0 HA GLU A 58 4.338 -1.092 11.847 1.00 61.43 H new ATOM 0 HB2 GLU A 58 4.985 -3.899 10.863 1.00 32.23 H new ATOM 0 HB3 GLU A 58 6.155 -2.602 11.000 1.00 32.23 H new ATOM 0 HG2 GLU A 58 4.550 -3.720 13.325 1.00 51.51 H new ATOM 0 HG3 GLU A 58 6.181 -4.214 12.916 1.00 51.51 H new ATOM 903 N ILE A 59 3.350 -2.356 8.975 1.00 75.23 N ATOM 904 CA ILE A 59 3.195 -2.066 7.555 1.00 41.33 C ATOM 905 C ILE A 59 2.132 -0.997 7.325 1.00 45.53 C ATOM 906 O ILE A 59 2.165 -0.280 6.323 1.00 33.45 O ATOM 907 CB ILE A 59 2.817 -3.329 6.760 1.00 73.25 C ATOM 908 CG1 ILE A 59 1.426 -3.819 7.170 1.00 64.02 C ATOM 909 CG2 ILE A 59 3.854 -4.421 6.975 1.00 31.10 C ATOM 910 CD1 ILE A 59 1.164 -5.264 6.808 1.00 54.05 C ATOM 0 H ILE A 59 2.896 -3.216 9.282 1.00 75.23 H new ATOM 0 HA ILE A 59 4.159 -1.699 7.201 1.00 41.33 H new ATOM 0 HB ILE A 59 2.796 -3.080 5.699 1.00 73.25 H new ATOM 0 HG12 ILE A 59 1.309 -3.696 8.247 1.00 64.02 H new ATOM 0 HG13 ILE A 59 0.673 -3.191 6.693 1.00 64.02 H new ATOM 0 HG21 ILE A 59 3.572 -5.307 6.406 1.00 31.10 H new ATOM 0 HG22 ILE A 59 4.829 -4.068 6.638 1.00 31.10 H new ATOM 0 HG23 ILE A 59 3.905 -4.671 8.035 1.00 31.10 H new ATOM 0 HD11 ILE A 59 0.160 -5.543 7.128 1.00 54.05 H new ATOM 0 HD12 ILE A 59 1.249 -5.390 5.729 1.00 54.05 H new ATOM 0 HD13 ILE A 59 1.894 -5.902 7.306 1.00 54.05 H new ATOM 922 N ILE A 60 1.193 -0.893 8.259 1.00 61.32 N ATOM 923 CA ILE A 60 0.122 0.091 8.159 1.00 25.22 C ATOM 924 C ILE A 60 -0.638 -0.055 6.846 1.00 60.25 C ATOM 925 O ILE A 60 -0.497 0.750 5.925 1.00 64.11 O ATOM 926 CB ILE A 60 0.667 1.528 8.268 1.00 75.55 C ATOM 927 CG1 ILE A 60 1.581 1.659 9.487 1.00 44.12 C ATOM 928 CG2 ILE A 60 -0.481 2.523 8.349 1.00 4.53 C ATOM 929 CD1 ILE A 60 3.028 1.924 9.131 1.00 33.43 C ATOM 0 H ILE A 60 1.152 -1.478 9.094 1.00 61.32 H new ATOM 0 HA ILE A 60 -0.557 -0.095 8.991 1.00 25.22 H new ATOM 0 HB ILE A 60 1.252 1.749 7.375 1.00 75.55 H new ATOM 0 HG12 ILE A 60 1.216 2.469 10.119 1.00 44.12 H new ATOM 0 HG13 ILE A 60 1.522 0.744 10.076 1.00 44.12 H new ATOM 0 HG21 ILE A 60 -0.081 3.534 8.426 1.00 4.53 H new ATOM 0 HG22 ILE A 60 -1.096 2.443 7.453 1.00 4.53 H new ATOM 0 HG23 ILE A 60 -1.089 2.306 9.227 1.00 4.53 H new ATOM 0 HD11 ILE A 60 3.618 2.005 10.044 1.00 33.43 H new ATOM 0 HD12 ILE A 60 3.410 1.103 8.524 1.00 33.43 H new ATOM 0 HD13 ILE A 60 3.100 2.855 8.568 1.00 33.43 H new ATOM 941 N PRO A 61 -1.466 -1.106 6.755 1.00 33.20 N ATOM 942 CA PRO A 61 -2.268 -1.382 5.559 1.00 10.31 C ATOM 943 C PRO A 61 -3.383 -0.361 5.361 1.00 14.11 C ATOM 944 O PRO A 61 -4.043 -0.342 4.322 1.00 33.02 O ATOM 945 CB PRO A 61 -2.855 -2.768 5.837 1.00 42.12 C ATOM 946 CG PRO A 61 -2.878 -2.879 7.322 1.00 5.13 C ATOM 947 CD PRO A 61 -1.685 -2.106 7.814 1.00 64.44 C ATOM 0 HA PRO A 61 -1.672 -1.332 4.648 1.00 10.31 H new ATOM 0 HB2 PRO A 61 -3.856 -2.865 5.417 1.00 42.12 H new ATOM 0 HB3 PRO A 61 -2.245 -3.553 5.391 1.00 42.12 H new ATOM 0 HG2 PRO A 61 -3.803 -2.470 7.730 1.00 5.13 H new ATOM 0 HG3 PRO A 61 -2.824 -3.921 7.636 1.00 5.13 H new ATOM 0 HD2 PRO A 61 -1.881 -1.635 8.777 1.00 64.44 H new ATOM 0 HD3 PRO A 61 -0.815 -2.750 7.945 1.00 64.44 H new ATOM 1043 N SER A 69 -9.466 -0.113 7.167 1.00 42.33 N ATOM 1044 CA SER A 69 -8.425 -1.130 7.264 1.00 52.41 C ATOM 1045 C SER A 69 -8.748 -2.133 8.367 1.00 5.12 C ATOM 1046 O SER A 69 -9.730 -1.979 9.093 1.00 32.10 O ATOM 1047 CB SER A 69 -7.068 -0.477 7.533 1.00 11.43 C ATOM 1048 OG SER A 69 -6.627 -0.742 8.854 1.00 73.54 O ATOM 0 HA SER A 69 -8.381 -1.663 6.314 1.00 52.41 H new ATOM 0 HB2 SER A 69 -6.333 -0.850 6.819 1.00 11.43 H new ATOM 0 HB3 SER A 69 -7.142 0.600 7.380 1.00 11.43 H new ATOM 0 HG SER A 69 -5.706 -1.075 8.831 1.00 73.54 H new ATOM 1054 N ILE A 70 -7.913 -3.160 8.486 1.00 2.24 N ATOM 1055 CA ILE A 70 -8.108 -4.188 9.501 1.00 4.01 C ATOM 1056 C ILE A 70 -7.685 -3.688 10.878 1.00 23.33 C ATOM 1057 O ILE A 70 -8.007 -4.298 11.897 1.00 4.23 O ATOM 1058 CB ILE A 70 -7.317 -5.466 9.166 1.00 22.42 C ATOM 1059 CG1 ILE A 70 -7.873 -6.657 9.950 1.00 13.32 C ATOM 1060 CG2 ILE A 70 -5.839 -5.270 9.469 1.00 1.24 C ATOM 1061 CD1 ILE A 70 -7.160 -7.958 9.659 1.00 20.55 C ATOM 0 H ILE A 70 -7.096 -3.302 7.893 1.00 2.24 H new ATOM 0 HA ILE A 70 -9.173 -4.422 9.513 1.00 4.01 H new ATOM 0 HB ILE A 70 -7.425 -5.673 8.101 1.00 22.42 H new ATOM 0 HG12 ILE A 70 -7.802 -6.444 11.017 1.00 13.32 H new ATOM 0 HG13 ILE A 70 -8.932 -6.772 9.717 1.00 13.32 H new ATOM 0 HG21 ILE A 70 -5.294 -6.182 9.227 1.00 1.24 H new ATOM 0 HG22 ILE A 70 -5.451 -4.446 8.870 1.00 1.24 H new ATOM 0 HG23 ILE A 70 -5.712 -5.041 10.527 1.00 1.24 H new ATOM 0 HD11 ILE A 70 -7.607 -8.758 10.249 1.00 20.55 H new ATOM 0 HD12 ILE A 70 -7.252 -8.194 8.599 1.00 20.55 H new ATOM 0 HD13 ILE A 70 -6.106 -7.861 9.919 1.00 20.55 H new ATOM 1073 N GLY A 71 -6.962 -2.572 10.901 1.00 61.40 N ATOM 1074 CA GLY A 71 -6.508 -2.008 12.158 1.00 10.15 C ATOM 1075 C GLY A 71 -7.638 -1.819 13.151 1.00 72.51 C ATOM 1076 O GLY A 71 -7.421 -1.854 14.362 1.00 72.55 O ATOM 0 H GLY A 71 -6.683 -2.049 10.071 1.00 61.40 H new ATOM 0 HA2 GLY A 71 -5.751 -2.661 12.593 1.00 10.15 H new ATOM 0 HA3 GLY A 71 -6.030 -1.047 11.970 1.00 10.15 H new ATOM 1080 N GLU A 72 -8.848 -1.618 12.637 1.00 45.50 N ATOM 1081 CA GLU A 72 -10.015 -1.420 13.488 1.00 71.11 C ATOM 1082 C GLU A 72 -10.600 -2.759 13.929 1.00 44.01 C ATOM 1083 O GLU A 72 -11.183 -2.869 15.007 1.00 14.24 O ATOM 1084 CB GLU A 72 -11.079 -0.605 12.750 1.00 13.33 C ATOM 1085 CG GLU A 72 -10.588 0.754 12.281 1.00 41.31 C ATOM 1086 CD GLU A 72 -10.784 1.838 13.323 1.00 33.35 C ATOM 1087 OE1 GLU A 72 -9.956 1.924 14.254 1.00 61.12 O ATOM 1088 OE2 GLU A 72 -11.767 2.600 13.208 1.00 31.23 O ATOM 0 H GLU A 72 -9.045 -1.588 11.637 1.00 45.50 H new ATOM 0 HA GLU A 72 -9.698 -0.872 14.375 1.00 71.11 H new ATOM 0 HB2 GLU A 72 -11.427 -1.174 11.888 1.00 13.33 H new ATOM 0 HB3 GLU A 72 -11.938 -0.465 13.407 1.00 13.33 H new ATOM 0 HG2 GLU A 72 -9.530 0.686 12.028 1.00 41.31 H new ATOM 0 HG3 GLU A 72 -11.117 1.032 11.369 1.00 41.31 H new ATOM 1095 N TYR A 73 -10.439 -3.774 13.087 1.00 2.20 N ATOM 1096 CA TYR A 73 -10.953 -5.105 13.387 1.00 3.24 C ATOM 1097 C TYR A 73 -10.046 -5.828 14.378 1.00 23.22 C ATOM 1098 O TYR A 73 -10.513 -6.394 15.367 1.00 32.33 O ATOM 1099 CB TYR A 73 -11.082 -5.926 12.104 1.00 61.24 C ATOM 1100 CG TYR A 73 -11.263 -7.407 12.348 1.00 64.40 C ATOM 1101 CD1 TYR A 73 -12.484 -7.918 12.770 1.00 63.21 C ATOM 1102 CD2 TYR A 73 -10.212 -8.296 12.156 1.00 61.22 C ATOM 1103 CE1 TYR A 73 -12.653 -9.271 12.995 1.00 2.42 C ATOM 1104 CE2 TYR A 73 -10.372 -9.650 12.377 1.00 33.42 C ATOM 1105 CZ TYR A 73 -11.594 -10.133 12.797 1.00 14.42 C ATOM 1106 OH TYR A 73 -11.759 -11.481 13.019 1.00 13.41 O ATOM 0 H TYR A 73 -9.957 -3.700 12.191 1.00 2.20 H new ATOM 0 HA TYR A 73 -11.939 -4.993 13.839 1.00 3.24 H new ATOM 0 HB2 TYR A 73 -11.930 -5.555 11.529 1.00 61.24 H new ATOM 0 HB3 TYR A 73 -10.192 -5.773 11.494 1.00 61.24 H new ATOM 0 HD1 TYR A 73 -13.315 -7.246 12.925 1.00 63.21 H new ATOM 0 HD2 TYR A 73 -9.253 -7.922 11.828 1.00 61.22 H new ATOM 0 HE1 TYR A 73 -13.609 -9.652 13.324 1.00 2.42 H new ATOM 0 HE2 TYR A 73 -9.545 -10.327 12.222 1.00 33.42 H new ATOM 0 HH TYR A 73 -10.999 -11.970 12.641 1.00 13.41 H new ATOM 1116 N LEU A 74 -8.746 -5.805 14.106 1.00 42.41 N ATOM 1117 CA LEU A 74 -7.771 -6.457 14.973 1.00 64.12 C ATOM 1118 C LEU A 74 -7.793 -5.849 16.372 1.00 61.53 C ATOM 1119 O LEU A 74 -7.443 -6.508 17.352 1.00 33.21 O ATOM 1120 CB LEU A 74 -6.368 -6.338 14.375 1.00 25.41 C ATOM 1121 CG LEU A 74 -5.813 -7.598 13.709 1.00 61.10 C ATOM 1122 CD1 LEU A 74 -4.746 -7.236 12.688 1.00 62.23 C ATOM 1123 CD2 LEU A 74 -5.252 -8.551 14.754 1.00 20.23 C ATOM 0 H LEU A 74 -8.343 -5.342 13.292 1.00 42.41 H new ATOM 0 HA LEU A 74 -8.038 -7.511 15.051 1.00 64.12 H new ATOM 0 HB2 LEU A 74 -6.376 -5.535 13.638 1.00 25.41 H new ATOM 0 HB3 LEU A 74 -5.682 -6.037 15.167 1.00 25.41 H new ATOM 0 HG LEU A 74 -6.629 -8.100 13.189 1.00 61.10 H new ATOM 0 HD11 LEU A 74 -4.363 -8.145 12.224 1.00 62.23 H new ATOM 0 HD12 LEU A 74 -5.179 -6.593 11.922 1.00 62.23 H new ATOM 0 HD13 LEU A 74 -3.930 -6.710 13.185 1.00 62.23 H new ATOM 0 HD21 LEU A 74 -4.862 -9.442 14.262 1.00 20.23 H new ATOM 0 HD22 LEU A 74 -4.449 -8.058 15.302 1.00 20.23 H new ATOM 0 HD23 LEU A 74 -6.043 -8.837 15.448 1.00 20.23 H new ATOM 1135 N LEU A 75 -8.208 -4.590 16.457 1.00 22.54 N ATOM 1136 CA LEU A 75 -8.278 -3.894 17.737 1.00 14.32 C ATOM 1137 C LEU A 75 -9.476 -4.372 18.552 1.00 1.41 C ATOM 1138 O LEU A 75 -9.321 -4.890 19.658 1.00 4.52 O ATOM 1139 CB LEU A 75 -8.369 -2.383 17.513 1.00 33.24 C ATOM 1140 CG LEU A 75 -7.222 -1.550 18.085 1.00 11.44 C ATOM 1141 CD1 LEU A 75 -7.090 -1.779 19.583 1.00 74.30 C ATOM 1142 CD2 LEU A 75 -5.917 -1.881 17.376 1.00 10.14 C ATOM 0 H LEU A 75 -8.501 -4.031 15.656 1.00 22.54 H new ATOM 0 HA LEU A 75 -7.369 -4.119 18.296 1.00 14.32 H new ATOM 0 HB2 LEU A 75 -8.426 -2.198 16.440 1.00 33.24 H new ATOM 0 HB3 LEU A 75 -9.303 -2.027 17.948 1.00 33.24 H new ATOM 0 HG LEU A 75 -7.446 -0.496 17.918 1.00 11.44 H new ATOM 0 HD11 LEU A 75 -6.268 -1.178 19.972 1.00 74.30 H new ATOM 0 HD12 LEU A 75 -8.017 -1.490 20.078 1.00 74.30 H new ATOM 0 HD13 LEU A 75 -6.890 -2.833 19.774 1.00 74.30 H new ATOM 0 HD21 LEU A 75 -5.112 -1.279 17.796 1.00 10.14 H new ATOM 0 HD22 LEU A 75 -5.688 -2.938 17.511 1.00 10.14 H new ATOM 0 HD23 LEU A 75 -6.016 -1.664 16.312 1.00 10.14 H new ATOM 1154 N PHE A 76 -10.671 -4.196 17.997 1.00 24.02 N ATOM 1155 CA PHE A 76 -11.895 -4.610 18.672 1.00 72.42 C ATOM 1156 C PHE A 76 -11.873 -6.107 18.968 1.00 10.05 C ATOM 1157 O PHE A 76 -12.178 -6.536 20.082 1.00 63.21 O ATOM 1158 CB PHE A 76 -13.116 -4.267 17.815 1.00 2.24 C ATOM 1159 CG PHE A 76 -13.805 -3.000 18.235 1.00 32.10 C ATOM 1160 CD1 PHE A 76 -13.088 -1.825 18.394 1.00 30.41 C ATOM 1161 CD2 PHE A 76 -15.170 -2.984 18.471 1.00 75.30 C ATOM 1162 CE1 PHE A 76 -13.719 -0.658 18.780 1.00 54.21 C ATOM 1163 CE2 PHE A 76 -15.807 -1.820 18.856 1.00 13.14 C ATOM 1164 CZ PHE A 76 -15.081 -0.656 19.012 1.00 3.53 C ATOM 0 H PHE A 76 -10.817 -3.770 17.082 1.00 24.02 H new ATOM 0 HA PHE A 76 -11.959 -4.071 19.617 1.00 72.42 H new ATOM 0 HB2 PHE A 76 -12.805 -4.175 16.774 1.00 2.24 H new ATOM 0 HB3 PHE A 76 -13.827 -5.091 17.863 1.00 2.24 H new ATOM 0 HD1 PHE A 76 -12.023 -1.821 18.214 1.00 30.41 H new ATOM 0 HD2 PHE A 76 -15.743 -3.892 18.353 1.00 75.30 H new ATOM 0 HE1 PHE A 76 -13.149 0.251 18.900 1.00 54.21 H new ATOM 0 HE2 PHE A 76 -16.872 -1.821 19.035 1.00 13.14 H new ATOM 0 HZ PHE A 76 -15.577 0.254 19.315 1.00 3.53 H new ATOM 1174 N THR A 77 -11.511 -6.898 17.963 1.00 24.25 N ATOM 1175 CA THR A 77 -11.450 -8.347 18.115 1.00 41.55 C ATOM 1176 C THR A 77 -10.481 -8.744 19.222 1.00 4.30 C ATOM 1177 O THR A 77 -10.759 -9.649 20.007 1.00 24.35 O ATOM 1178 CB THR A 77 -11.021 -9.031 16.803 1.00 40.32 C ATOM 1179 OG1 THR A 77 -11.918 -8.670 15.746 1.00 23.02 O ATOM 1180 CG2 THR A 77 -11.000 -10.543 16.963 1.00 33.31 C ATOM 0 H THR A 77 -11.256 -6.560 17.035 1.00 24.25 H new ATOM 0 HA THR A 77 -12.454 -8.680 18.379 1.00 41.55 H new ATOM 0 HB THR A 77 -10.014 -8.694 16.556 1.00 40.32 H new ATOM 0 HG1 THR A 77 -11.712 -9.199 14.947 1.00 23.02 H new ATOM 0 HG21 THR A 77 -10.694 -11.004 16.024 1.00 33.31 H new ATOM 0 HG22 THR A 77 -10.295 -10.816 17.748 1.00 33.31 H new ATOM 0 HG23 THR A 77 -11.996 -10.894 17.232 1.00 33.31 H new ATOM 1188 N MET A 78 -9.342 -8.060 19.279 1.00 14.12 N ATOM 1189 CA MET A 78 -8.333 -8.341 20.293 1.00 24.10 C ATOM 1190 C MET A 78 -8.944 -8.320 21.690 1.00 33.32 C ATOM 1191 O MET A 78 -8.792 -9.270 22.459 1.00 60.55 O ATOM 1192 CB MET A 78 -7.195 -7.322 20.207 1.00 62.14 C ATOM 1193 CG MET A 78 -5.952 -7.856 19.513 1.00 21.34 C ATOM 1194 SD MET A 78 -5.079 -9.085 20.503 1.00 60.33 S ATOM 1195 CE MET A 78 -4.304 -10.065 19.219 1.00 32.10 C ATOM 0 H MET A 78 -9.096 -7.308 18.635 1.00 14.12 H new ATOM 0 HA MET A 78 -7.934 -9.338 20.105 1.00 24.10 H new ATOM 0 HB2 MET A 78 -7.548 -6.439 19.674 1.00 62.14 H new ATOM 0 HB3 MET A 78 -6.929 -7.001 21.214 1.00 62.14 H new ATOM 0 HG2 MET A 78 -6.235 -8.299 18.558 1.00 21.34 H new ATOM 0 HG3 MET A 78 -5.279 -7.027 19.293 1.00 21.34 H new ATOM 0 HE1 MET A 78 -4.651 -11.096 19.289 1.00 32.10 H new ATOM 0 HE2 MET A 78 -4.568 -9.659 18.242 1.00 32.10 H new ATOM 0 HE3 MET A 78 -3.221 -10.037 19.343 1.00 32.10 H new ATOM 1205 N ILE A 79 -9.636 -7.232 22.012 1.00 24.34 N ATOM 1206 CA ILE A 79 -10.270 -7.090 23.317 1.00 54.43 C ATOM 1207 C ILE A 79 -11.473 -8.018 23.447 1.00 12.33 C ATOM 1208 O ILE A 79 -11.892 -8.357 24.554 1.00 24.43 O ATOM 1209 CB ILE A 79 -10.726 -5.640 23.566 1.00 43.54 C ATOM 1210 CG1 ILE A 79 -9.537 -4.683 23.457 1.00 43.33 C ATOM 1211 CG2 ILE A 79 -11.386 -5.519 24.931 1.00 54.33 C ATOM 1212 CD1 ILE A 79 -8.604 -4.740 24.646 1.00 11.23 C ATOM 0 H ILE A 79 -9.772 -6.437 21.388 1.00 24.34 H new ATOM 0 HA ILE A 79 -9.522 -7.361 24.063 1.00 54.43 H new ATOM 0 HB ILE A 79 -11.458 -5.369 22.805 1.00 43.54 H new ATOM 0 HG12 ILE A 79 -8.975 -4.917 22.553 1.00 43.33 H new ATOM 0 HG13 ILE A 79 -9.910 -3.665 23.346 1.00 43.33 H new ATOM 0 HG21 ILE A 79 -11.703 -4.489 25.092 1.00 54.33 H new ATOM 0 HG22 ILE A 79 -12.254 -6.176 24.975 1.00 54.33 H new ATOM 0 HG23 ILE A 79 -10.675 -5.805 25.706 1.00 54.33 H new ATOM 0 HD11 ILE A 79 -7.785 -4.036 24.500 1.00 11.23 H new ATOM 0 HD12 ILE A 79 -9.152 -4.477 25.551 1.00 11.23 H new ATOM 0 HD13 ILE A 79 -8.202 -5.748 24.745 1.00 11.23 H new ATOM 1224 N PHE A 80 -12.024 -8.427 22.309 1.00 14.53 N ATOM 1225 CA PHE A 80 -13.179 -9.317 22.296 1.00 52.12 C ATOM 1226 C PHE A 80 -12.781 -10.730 22.712 1.00 15.13 C ATOM 1227 O PHE A 80 -13.337 -11.291 23.657 1.00 55.42 O ATOM 1228 CB PHE A 80 -13.813 -9.343 20.904 1.00 55.14 C ATOM 1229 CG PHE A 80 -15.260 -9.748 20.911 1.00 1.23 C ATOM 1230 CD1 PHE A 80 -15.619 -11.086 20.883 1.00 3.31 C ATOM 1231 CD2 PHE A 80 -16.261 -8.790 20.946 1.00 23.22 C ATOM 1232 CE1 PHE A 80 -16.949 -11.462 20.890 1.00 2.24 C ATOM 1233 CE2 PHE A 80 -17.592 -9.160 20.954 1.00 33.21 C ATOM 1234 CZ PHE A 80 -17.937 -10.497 20.925 1.00 62.50 C ATOM 0 H PHE A 80 -11.689 -8.156 21.384 1.00 14.53 H new ATOM 0 HA PHE A 80 -13.907 -8.937 23.013 1.00 52.12 H new ATOM 0 HB2 PHE A 80 -13.723 -8.354 20.454 1.00 55.14 H new ATOM 0 HB3 PHE A 80 -13.254 -10.033 20.272 1.00 55.14 H new ATOM 0 HD1 PHE A 80 -14.850 -11.844 20.855 1.00 3.31 H new ATOM 0 HD2 PHE A 80 -15.998 -7.743 20.967 1.00 23.22 H new ATOM 0 HE1 PHE A 80 -17.215 -12.508 20.868 1.00 2.24 H new ATOM 0 HE2 PHE A 80 -18.363 -8.404 20.983 1.00 33.21 H new ATOM 0 HZ PHE A 80 -18.977 -10.788 20.930 1.00 62.50 H new ATOM 1244 N VAL A 81 -11.815 -11.300 22.000 1.00 71.51 N ATOM 1245 CA VAL A 81 -11.342 -12.648 22.295 1.00 44.43 C ATOM 1246 C VAL A 81 -10.808 -12.743 23.720 1.00 61.15 C ATOM 1247 O VAL A 81 -10.879 -13.797 24.352 1.00 25.32 O ATOM 1248 CB VAL A 81 -10.236 -13.081 21.314 1.00 61.11 C ATOM 1249 CG1 VAL A 81 -10.775 -13.138 19.893 1.00 41.24 C ATOM 1250 CG2 VAL A 81 -9.045 -12.139 21.404 1.00 10.11 C ATOM 0 H VAL A 81 -11.344 -10.850 21.215 1.00 71.51 H new ATOM 0 HA VAL A 81 -12.197 -13.315 22.185 1.00 44.43 H new ATOM 0 HB VAL A 81 -9.901 -14.081 21.590 1.00 61.11 H new ATOM 0 HG11 VAL A 81 -9.980 -13.446 19.214 1.00 41.24 H new ATOM 0 HG12 VAL A 81 -11.593 -13.857 19.843 1.00 41.24 H new ATOM 0 HG13 VAL A 81 -11.139 -12.153 19.602 1.00 41.24 H new ATOM 0 HG21 VAL A 81 -8.273 -12.460 20.704 1.00 10.11 H new ATOM 0 HG22 VAL A 81 -9.362 -11.126 21.155 1.00 10.11 H new ATOM 0 HG23 VAL A 81 -8.645 -12.155 22.418 1.00 10.11 H new ATOM 1260 N THR A 82 -10.273 -11.634 24.221 1.00 13.10 N ATOM 1261 CA THR A 82 -9.727 -11.592 25.571 1.00 3.24 C ATOM 1262 C THR A 82 -10.823 -11.777 26.614 1.00 21.53 C ATOM 1263 O THR A 82 -10.740 -12.663 27.466 1.00 2.05 O ATOM 1264 CB THR A 82 -8.997 -10.262 25.841 1.00 72.20 C ATOM 1265 OG1 THR A 82 -7.763 -10.225 25.117 1.00 65.23 O ATOM 1266 CG2 THR A 82 -8.725 -10.086 27.327 1.00 23.12 C ATOM 0 H THR A 82 -10.206 -10.753 23.711 1.00 13.10 H new ATOM 0 HA THR A 82 -9.013 -12.412 25.648 1.00 3.24 H new ATOM 0 HB THR A 82 -9.638 -9.447 25.506 1.00 72.20 H new ATOM 0 HG1 THR A 82 -7.931 -9.925 24.199 1.00 65.23 H new ATOM 0 HG21 THR A 82 -8.209 -9.140 27.493 1.00 23.12 H new ATOM 0 HG22 THR A 82 -9.669 -10.085 27.872 1.00 23.12 H new ATOM 0 HG23 THR A 82 -8.102 -10.907 27.682 1.00 23.12 H new ATOM 1274 N LEU A 83 -11.850 -10.938 26.542 1.00 71.33 N ATOM 1275 CA LEU A 83 -12.965 -11.011 27.480 1.00 42.50 C ATOM 1276 C LEU A 83 -13.669 -12.361 27.387 1.00 44.45 C ATOM 1277 O LEU A 83 -14.276 -12.823 28.352 1.00 31.20 O ATOM 1278 CB LEU A 83 -13.962 -9.883 27.206 1.00 5.11 C ATOM 1279 CG LEU A 83 -13.432 -8.460 27.387 1.00 65.12 C ATOM 1280 CD1 LEU A 83 -14.246 -7.478 26.559 1.00 64.03 C ATOM 1281 CD2 LEU A 83 -13.452 -8.066 28.857 1.00 65.15 C ATOM 0 H LEU A 83 -11.934 -10.199 25.844 1.00 71.33 H new ATOM 0 HA LEU A 83 -12.567 -10.899 28.488 1.00 42.50 H new ATOM 0 HB2 LEU A 83 -14.325 -9.987 26.184 1.00 5.11 H new ATOM 0 HB3 LEU A 83 -14.820 -10.016 27.864 1.00 5.11 H new ATOM 0 HG LEU A 83 -12.400 -8.430 27.038 1.00 65.12 H new ATOM 0 HD11 LEU A 83 -13.854 -6.471 26.700 1.00 64.03 H new ATOM 0 HD12 LEU A 83 -14.180 -7.748 25.505 1.00 64.03 H new ATOM 0 HD13 LEU A 83 -15.288 -7.510 26.877 1.00 64.03 H new ATOM 0 HD21 LEU A 83 -13.071 -7.050 28.967 1.00 65.15 H new ATOM 0 HD22 LEU A 83 -14.474 -8.113 29.232 1.00 65.15 H new ATOM 0 HD23 LEU A 83 -12.825 -8.752 29.426 1.00 65.15 H new ATOM 1293 N SER A 84 -13.581 -12.989 26.218 1.00 5.54 N ATOM 1294 CA SER A 84 -14.210 -14.285 25.998 1.00 32.21 C ATOM 1295 C SER A 84 -13.549 -15.362 26.853 1.00 61.33 C ATOM 1296 O SER A 84 -14.224 -16.101 27.570 1.00 25.43 O ATOM 1297 CB SER A 84 -14.130 -14.670 24.520 1.00 63.43 C ATOM 1298 OG SER A 84 -15.119 -13.995 23.762 1.00 20.23 O ATOM 0 H SER A 84 -13.080 -12.621 25.409 1.00 5.54 H new ATOM 0 HA SER A 84 -15.257 -14.207 26.289 1.00 32.21 H new ATOM 0 HB2 SER A 84 -13.141 -14.428 24.131 1.00 63.43 H new ATOM 0 HB3 SER A 84 -14.259 -15.747 24.414 1.00 63.43 H new ATOM 0 HG SER A 84 -14.827 -13.076 23.587 1.00 20.23 H new ATOM 1304 N ILE A 85 -12.225 -15.445 26.770 1.00 54.43 N ATOM 1305 CA ILE A 85 -11.472 -16.430 27.536 1.00 53.05 C ATOM 1306 C ILE A 85 -11.590 -16.169 29.033 1.00 4.23 C ATOM 1307 O ILE A 85 -11.424 -17.077 29.848 1.00 71.13 O ATOM 1308 CB ILE A 85 -9.984 -16.431 27.141 1.00 25.42 C ATOM 1309 CG1 ILE A 85 -9.827 -16.761 25.655 1.00 14.02 C ATOM 1310 CG2 ILE A 85 -9.211 -17.426 27.994 1.00 24.30 C ATOM 1311 CD1 ILE A 85 -8.788 -15.914 24.954 1.00 32.24 C ATOM 0 H ILE A 85 -11.652 -14.842 26.180 1.00 54.43 H new ATOM 0 HA ILE A 85 -11.901 -17.405 27.306 1.00 53.05 H new ATOM 0 HB ILE A 85 -9.576 -15.436 27.317 1.00 25.42 H new ATOM 0 HG12 ILE A 85 -9.557 -17.812 25.551 1.00 14.02 H new ATOM 0 HG13 ILE A 85 -10.788 -16.628 25.158 1.00 14.02 H new ATOM 0 HG21 ILE A 85 -8.161 -17.416 27.703 1.00 24.30 H new ATOM 0 HG22 ILE A 85 -9.299 -17.150 29.045 1.00 24.30 H new ATOM 0 HG23 ILE A 85 -9.619 -18.426 27.846 1.00 24.30 H new ATOM 0 HD11 ILE A 85 -8.731 -16.203 23.905 1.00 32.24 H new ATOM 0 HD12 ILE A 85 -9.067 -14.863 25.026 1.00 32.24 H new ATOM 0 HD13 ILE A 85 -7.817 -16.065 25.425 1.00 32.24 H new ATOM 1323 N VAL A 86 -11.878 -14.921 29.390 1.00 32.31 N ATOM 1324 CA VAL A 86 -12.021 -14.540 30.790 1.00 31.22 C ATOM 1325 C VAL A 86 -13.412 -14.882 31.314 1.00 65.34 C ATOM 1326 O VAL A 86 -13.554 -15.500 32.370 1.00 44.44 O ATOM 1327 CB VAL A 86 -11.765 -13.035 30.991 1.00 0.21 C ATOM 1328 CG1 VAL A 86 -12.663 -12.482 32.087 1.00 11.31 C ATOM 1329 CG2 VAL A 86 -10.300 -12.782 31.313 1.00 22.40 C ATOM 0 H VAL A 86 -12.017 -14.157 28.729 1.00 32.31 H new ATOM 0 HA VAL A 86 -11.276 -15.106 31.349 1.00 31.22 H new ATOM 0 HB VAL A 86 -12.004 -12.517 30.062 1.00 0.21 H new ATOM 0 HG11 VAL A 86 -12.468 -11.417 32.215 1.00 11.31 H new ATOM 0 HG12 VAL A 86 -13.707 -12.629 31.811 1.00 11.31 H new ATOM 0 HG13 VAL A 86 -12.459 -13.003 33.022 1.00 11.31 H new ATOM 0 HG21 VAL A 86 -10.137 -11.713 31.452 1.00 22.40 H new ATOM 0 HG22 VAL A 86 -10.032 -13.312 32.227 1.00 22.40 H new ATOM 0 HG23 VAL A 86 -9.680 -13.140 30.491 1.00 22.40 H new ATOM 1339 N ILE A 87 -14.434 -14.478 30.568 1.00 13.32 N ATOM 1340 CA ILE A 87 -15.814 -14.743 30.957 1.00 40.14 C ATOM 1341 C ILE A 87 -16.150 -16.224 30.816 1.00 41.44 C ATOM 1342 O ILE A 87 -17.011 -16.747 31.524 1.00 61.24 O ATOM 1343 CB ILE A 87 -16.805 -13.921 30.112 1.00 43.55 C ATOM 1344 CG1 ILE A 87 -16.608 -12.425 30.367 1.00 2.11 C ATOM 1345 CG2 ILE A 87 -18.236 -14.333 30.423 1.00 43.32 C ATOM 1346 CD1 ILE A 87 -16.855 -12.019 31.803 1.00 35.52 C ATOM 0 H ILE A 87 -14.333 -13.966 29.691 1.00 13.32 H new ATOM 0 HA ILE A 87 -15.909 -14.449 32.002 1.00 40.14 H new ATOM 0 HB ILE A 87 -16.612 -14.119 29.058 1.00 43.55 H new ATOM 0 HG12 ILE A 87 -15.591 -12.148 30.090 1.00 2.11 H new ATOM 0 HG13 ILE A 87 -17.280 -11.863 29.718 1.00 2.11 H new ATOM 0 HG21 ILE A 87 -18.924 -13.743 29.818 1.00 43.32 H new ATOM 0 HG22 ILE A 87 -18.368 -15.391 30.195 1.00 43.32 H new ATOM 0 HG23 ILE A 87 -18.443 -14.161 31.479 1.00 43.32 H new ATOM 0 HD11 ILE A 87 -16.697 -10.946 31.910 1.00 35.52 H new ATOM 0 HD12 ILE A 87 -17.881 -12.264 32.079 1.00 35.52 H new ATOM 0 HD13 ILE A 87 -16.166 -12.554 32.456 1.00 35.52 H new ATOM 1358 N THR A 88 -15.463 -16.896 29.897 1.00 1.11 N ATOM 1359 CA THR A 88 -15.687 -18.317 29.663 1.00 11.20 C ATOM 1360 C THR A 88 -15.168 -19.154 30.826 1.00 34.24 C ATOM 1361 O THR A 88 -15.882 -20.004 31.360 1.00 50.14 O ATOM 1362 CB THR A 88 -15.006 -18.786 28.364 1.00 74.45 C ATOM 1363 OG1 THR A 88 -15.805 -18.422 27.233 1.00 52.55 O ATOM 1364 CG2 THR A 88 -14.795 -20.293 28.377 1.00 15.10 C ATOM 0 H THR A 88 -14.747 -16.479 29.303 1.00 1.11 H new ATOM 0 HA THR A 88 -16.764 -18.456 29.571 1.00 11.20 H new ATOM 0 HB THR A 88 -14.033 -18.299 28.294 1.00 74.45 H new ATOM 0 HG1 THR A 88 -15.577 -17.512 26.951 1.00 52.55 H new ATOM 0 HG21 THR A 88 -14.313 -20.601 27.449 1.00 15.10 H new ATOM 0 HG22 THR A 88 -14.163 -20.565 29.222 1.00 15.10 H new ATOM 0 HG23 THR A 88 -15.758 -20.795 28.469 1.00 15.10 H new ATOM 1372 N VAL A 89 -13.922 -18.909 31.217 1.00 44.15 N ATOM 1373 CA VAL A 89 -13.308 -19.639 32.319 1.00 64.52 C ATOM 1374 C VAL A 89 -14.019 -19.348 33.635 1.00 11.12 C ATOM 1375 O VAL A 89 -13.978 -20.152 34.567 1.00 51.21 O ATOM 1376 CB VAL A 89 -11.816 -19.286 32.465 1.00 43.51 C ATOM 1377 CG1 VAL A 89 -11.638 -18.092 33.391 1.00 31.21 C ATOM 1378 CG2 VAL A 89 -11.031 -20.486 32.972 1.00 60.00 C ATOM 0 H VAL A 89 -13.317 -18.210 30.786 1.00 44.15 H new ATOM 0 HA VAL A 89 -13.401 -20.700 32.086 1.00 64.52 H new ATOM 0 HB VAL A 89 -11.427 -19.016 31.483 1.00 43.51 H new ATOM 0 HG11 VAL A 89 -10.578 -17.857 33.482 1.00 31.21 H new ATOM 0 HG12 VAL A 89 -12.166 -17.231 32.981 1.00 31.21 H new ATOM 0 HG13 VAL A 89 -12.043 -18.331 34.375 1.00 31.21 H new ATOM 0 HG21 VAL A 89 -9.979 -20.218 33.069 1.00 60.00 H new ATOM 0 HG22 VAL A 89 -11.419 -20.790 33.944 1.00 60.00 H new ATOM 0 HG23 VAL A 89 -11.132 -21.311 32.267 1.00 60.00 H new ATOM 1388 N PHE A 90 -14.672 -18.193 33.705 1.00 1.53 N ATOM 1389 CA PHE A 90 -15.393 -17.794 34.908 1.00 11.34 C ATOM 1390 C PHE A 90 -16.625 -18.669 35.119 1.00 55.52 C ATOM 1391 O PHE A 90 -16.737 -19.372 36.123 1.00 71.33 O ATOM 1392 CB PHE A 90 -15.807 -16.324 34.817 1.00 51.54 C ATOM 1393 CG PHE A 90 -14.929 -15.403 35.615 1.00 13.31 C ATOM 1394 CD1 PHE A 90 -13.559 -15.381 35.412 1.00 60.03 C ATOM 1395 CD2 PHE A 90 -15.475 -14.559 36.569 1.00 24.05 C ATOM 1396 CE1 PHE A 90 -12.748 -14.535 36.144 1.00 13.45 C ATOM 1397 CE2 PHE A 90 -14.669 -13.710 37.305 1.00 71.21 C ATOM 1398 CZ PHE A 90 -13.304 -13.699 37.093 1.00 13.21 C ATOM 0 H PHE A 90 -14.717 -17.517 32.943 1.00 1.53 H new ATOM 0 HA PHE A 90 -14.726 -17.924 35.760 1.00 11.34 H new ATOM 0 HB2 PHE A 90 -15.790 -16.014 33.772 1.00 51.54 H new ATOM 0 HB3 PHE A 90 -16.836 -16.223 35.163 1.00 51.54 H new ATOM 0 HD1 PHE A 90 -13.119 -16.033 34.672 1.00 60.03 H new ATOM 0 HD2 PHE A 90 -16.541 -14.564 36.739 1.00 24.05 H new ATOM 0 HE1 PHE A 90 -11.681 -14.527 35.975 1.00 13.45 H new ATOM 0 HE2 PHE A 90 -15.106 -13.056 38.045 1.00 71.21 H new ATOM 0 HZ PHE A 90 -12.673 -13.038 37.668 1.00 13.21 H new ATOM 1408 N VAL A 91 -17.550 -18.618 34.165 1.00 65.45 N ATOM 1409 CA VAL A 91 -18.774 -19.406 34.244 1.00 51.31 C ATOM 1410 C VAL A 91 -18.466 -20.875 34.510 1.00 15.13 C ATOM 1411 O VAL A 91 -19.204 -21.556 35.224 1.00 13.30 O ATOM 1412 CB VAL A 91 -19.599 -19.292 32.948 1.00 34.04 C ATOM 1413 CG1 VAL A 91 -18.735 -19.601 31.736 1.00 70.24 C ATOM 1414 CG2 VAL A 91 -20.806 -20.217 33.003 1.00 11.31 C ATOM 0 H VAL A 91 -17.474 -18.039 33.329 1.00 65.45 H new ATOM 0 HA VAL A 91 -19.356 -19.004 35.073 1.00 51.31 H new ATOM 0 HB VAL A 91 -19.959 -18.267 32.855 1.00 34.04 H new ATOM 0 HG11 VAL A 91 -19.335 -19.515 30.830 1.00 70.24 H new ATOM 0 HG12 VAL A 91 -17.906 -18.895 31.690 1.00 70.24 H new ATOM 0 HG13 VAL A 91 -18.343 -20.615 31.817 1.00 70.24 H new ATOM 0 HG21 VAL A 91 -21.378 -20.124 32.080 1.00 11.31 H new ATOM 0 HG22 VAL A 91 -20.470 -21.247 33.119 1.00 11.31 H new ATOM 0 HG23 VAL A 91 -21.436 -19.943 33.849 1.00 11.31 H new ATOM 1424 N LEU A 92 -17.372 -21.359 33.933 1.00 53.42 N ATOM 1425 CA LEU A 92 -16.965 -22.748 34.108 1.00 33.50 C ATOM 1426 C LEU A 92 -16.268 -22.947 35.450 1.00 11.31 C ATOM 1427 O LEU A 92 -16.321 -24.028 36.034 1.00 13.15 O ATOM 1428 CB LEU A 92 -16.037 -23.176 32.970 1.00 42.10 C ATOM 1429 CG LEU A 92 -15.524 -24.615 33.027 1.00 73.44 C ATOM 1430 CD1 LEU A 92 -15.341 -25.172 31.623 1.00 21.34 C ATOM 1431 CD2 LEU A 92 -14.219 -24.687 33.806 1.00 40.45 C ATOM 0 H LEU A 92 -16.751 -20.809 33.340 1.00 53.42 H new ATOM 0 HA LEU A 92 -17.861 -23.368 34.090 1.00 33.50 H new ATOM 0 HB2 LEU A 92 -16.564 -23.037 32.026 1.00 42.10 H new ATOM 0 HB3 LEU A 92 -15.178 -22.505 32.957 1.00 42.10 H new ATOM 0 HG LEU A 92 -16.265 -25.224 33.544 1.00 73.44 H new ATOM 0 HD11 LEU A 92 -14.975 -26.197 31.683 1.00 21.34 H new ATOM 0 HD12 LEU A 92 -16.296 -25.158 31.098 1.00 21.34 H new ATOM 0 HD13 LEU A 92 -14.620 -24.561 31.080 1.00 21.34 H new ATOM 0 HD21 LEU A 92 -13.869 -25.719 33.836 1.00 40.45 H new ATOM 0 HD22 LEU A 92 -13.469 -24.064 33.318 1.00 40.45 H new ATOM 0 HD23 LEU A 92 -14.382 -24.330 34.823 1.00 40.45 H new ATOM 1443 N ASN A 93 -15.616 -21.894 35.934 1.00 73.23 N ATOM 1444 CA ASN A 93 -14.910 -21.952 37.208 1.00 21.13 C ATOM 1445 C ASN A 93 -15.886 -22.158 38.363 1.00 52.35 C ATOM 1446 O ASN A 93 -15.654 -22.982 39.247 1.00 11.10 O ATOM 1447 CB ASN A 93 -14.106 -20.669 37.428 1.00 23.22 C ATOM 1448 CG ASN A 93 -13.717 -20.472 38.881 1.00 63.53 C ATOM 1449 OD1 ASN A 93 -12.941 -21.249 39.438 1.00 60.32 O ATOM 1450 ND2 ASN A 93 -14.256 -19.430 39.501 1.00 2.43 N ATOM 0 H ASN A 93 -15.562 -20.991 35.463 1.00 73.23 H new ATOM 0 HA ASN A 93 -14.227 -22.801 37.178 1.00 21.13 H new ATOM 0 HB2 ASN A 93 -13.206 -20.698 36.814 1.00 23.22 H new ATOM 0 HB3 ASN A 93 -14.693 -19.814 37.093 1.00 23.22 H new ATOM 0 HD21 ASN A 93 -14.032 -19.247 40.479 1.00 2.43 H new ATOM 0 HD22 ASN A 93 -14.894 -18.812 39.000 1.00 2.43 H new ATOM 1457 N VAL A 94 -16.980 -21.403 38.347 1.00 52.33 N ATOM 1458 CA VAL A 94 -17.993 -21.503 39.390 1.00 13.25 C ATOM 1459 C VAL A 94 -18.820 -22.774 39.234 1.00 23.31 C ATOM 1460 O VAL A 94 -19.570 -23.154 40.133 1.00 35.32 O ATOM 1461 CB VAL A 94 -18.937 -20.285 39.375 1.00 23.45 C ATOM 1462 CG1 VAL A 94 -19.986 -20.436 38.285 1.00 33.40 C ATOM 1463 CG2 VAL A 94 -19.592 -20.103 40.736 1.00 10.02 C ATOM 0 H VAL A 94 -17.187 -20.715 37.623 1.00 52.33 H new ATOM 0 HA VAL A 94 -17.464 -21.532 40.342 1.00 13.25 H new ATOM 0 HB VAL A 94 -18.349 -19.393 39.158 1.00 23.45 H new ATOM 0 HG11 VAL A 94 -20.643 -19.567 38.290 1.00 33.40 H new ATOM 0 HG12 VAL A 94 -19.494 -20.514 37.315 1.00 33.40 H new ATOM 0 HG13 VAL A 94 -20.573 -21.336 38.467 1.00 33.40 H new ATOM 0 HG21 VAL A 94 -20.255 -19.239 40.708 1.00 10.02 H new ATOM 0 HG22 VAL A 94 -20.168 -20.994 40.985 1.00 10.02 H new ATOM 0 HG23 VAL A 94 -18.823 -19.945 41.492 1.00 10.02 H new ATOM 1644 N GLY A 108 -27.179 -28.139 26.460 1.00 71.43 N ATOM 1645 CA GLY A 108 -27.303 -27.342 25.253 1.00 23.51 C ATOM 1646 C GLY A 108 -26.436 -26.099 25.288 1.00 61.51 C ATOM 1647 O GLY A 108 -26.468 -25.286 24.364 1.00 72.33 O ATOM 0 HA2 GLY A 108 -27.028 -27.949 24.390 1.00 23.51 H new ATOM 0 HA3 GLY A 108 -28.345 -27.051 25.119 1.00 23.51 H new ATOM 1651 N ILE A 109 -25.661 -25.950 26.357 1.00 64.53 N ATOM 1652 CA ILE A 109 -24.782 -24.797 26.508 1.00 73.12 C ATOM 1653 C ILE A 109 -23.536 -24.938 25.641 1.00 62.13 C ATOM 1654 O ILE A 109 -22.963 -23.945 25.193 1.00 52.53 O ATOM 1655 CB ILE A 109 -24.354 -24.604 27.975 1.00 53.35 C ATOM 1656 CG1 ILE A 109 -25.584 -24.529 28.882 1.00 72.12 C ATOM 1657 CG2 ILE A 109 -23.507 -23.349 28.118 1.00 43.51 C ATOM 1658 CD1 ILE A 109 -25.248 -24.538 30.357 1.00 74.13 C ATOM 0 H ILE A 109 -25.624 -26.613 27.131 1.00 64.53 H new ATOM 0 HA ILE A 109 -25.349 -23.924 26.185 1.00 73.12 H new ATOM 0 HB ILE A 109 -23.753 -25.461 28.279 1.00 53.35 H new ATOM 0 HG12 ILE A 109 -26.142 -23.622 28.650 1.00 72.12 H new ATOM 0 HG13 ILE A 109 -26.240 -25.371 28.662 1.00 72.12 H new ATOM 0 HG21 ILE A 109 -23.212 -23.226 29.160 1.00 43.51 H new ATOM 0 HG22 ILE A 109 -22.616 -23.439 27.497 1.00 43.51 H new ATOM 0 HG23 ILE A 109 -24.085 -22.482 27.800 1.00 43.51 H new ATOM 0 HD11 ILE A 109 -26.167 -24.483 30.940 1.00 74.13 H new ATOM 0 HD12 ILE A 109 -24.717 -25.457 30.604 1.00 74.13 H new ATOM 0 HD13 ILE A 109 -24.617 -23.681 30.592 1.00 74.13 H new ATOM 1670 N ASP A 110 -23.122 -26.178 25.407 1.00 60.54 N ATOM 1671 CA ASP A 110 -21.945 -26.450 24.590 1.00 24.52 C ATOM 1672 C ASP A 110 -22.210 -26.115 23.126 1.00 63.42 C ATOM 1673 O ASP A 110 -21.419 -25.424 22.484 1.00 65.20 O ATOM 1674 CB ASP A 110 -21.533 -27.917 24.724 1.00 24.32 C ATOM 1675 CG ASP A 110 -20.151 -28.078 25.327 1.00 2.20 C ATOM 1676 OD1 ASP A 110 -19.241 -27.316 24.937 1.00 62.42 O ATOM 1677 OD2 ASP A 110 -19.980 -28.964 26.190 1.00 64.14 O ATOM 0 H ASP A 110 -23.584 -27.011 25.771 1.00 60.54 H new ATOM 0 HA ASP A 110 -21.132 -25.818 24.947 1.00 24.52 H new ATOM 0 HB2 ASP A 110 -22.260 -28.440 25.345 1.00 24.32 H new ATOM 0 HB3 ASP A 110 -21.555 -28.389 23.742 1.00 24.32 H new ATOM 1682 N ARG A 111 -23.327 -26.611 22.603 1.00 2.15 N ATOM 1683 CA ARG A 111 -23.695 -26.366 21.214 1.00 2.12 C ATOM 1684 C ARG A 111 -23.876 -24.873 20.955 1.00 71.21 C ATOM 1685 O ARG A 111 -23.420 -24.350 19.938 1.00 64.11 O ATOM 1686 CB ARG A 111 -24.982 -27.115 20.866 1.00 73.13 C ATOM 1687 CG ARG A 111 -26.143 -26.795 21.793 1.00 12.01 C ATOM 1688 CD ARG A 111 -27.334 -27.704 21.530 1.00 65.02 C ATOM 1689 NE ARG A 111 -28.244 -27.140 20.537 1.00 62.02 N ATOM 1690 CZ ARG A 111 -29.274 -27.803 20.024 1.00 60.34 C ATOM 1691 NH1 ARG A 111 -29.524 -29.047 20.408 1.00 24.40 N ATOM 1692 NH2 ARG A 111 -30.057 -27.222 19.124 1.00 13.11 N ATOM 0 H ARG A 111 -23.993 -27.185 23.121 1.00 2.15 H new ATOM 0 HA ARG A 111 -22.887 -26.732 20.580 1.00 2.12 H new ATOM 0 HB2 ARG A 111 -25.268 -26.873 19.843 1.00 73.13 H new ATOM 0 HB3 ARG A 111 -24.788 -28.187 20.897 1.00 73.13 H new ATOM 0 HG2 ARG A 111 -25.823 -26.904 22.829 1.00 12.01 H new ATOM 0 HG3 ARG A 111 -26.441 -25.755 21.659 1.00 12.01 H new ATOM 0 HD2 ARG A 111 -26.979 -28.676 21.186 1.00 65.02 H new ATOM 0 HD3 ARG A 111 -27.874 -27.873 22.462 1.00 65.02 H new ATOM 0 HE ARG A 111 -28.080 -26.185 20.220 1.00 62.02 H new ATOM 0 HH11 ARG A 111 -28.924 -29.498 21.099 1.00 24.40 H new ATOM 0 HH12 ARG A 111 -30.316 -29.554 20.012 1.00 24.40 H new ATOM 0 HH21 ARG A 111 -29.868 -26.265 18.825 1.00 13.11 H new ATOM 0 HH22 ARG A 111 -30.848 -27.732 18.731 1.00 13.11 H new ATOM 1706 N ILE A 112 -24.545 -24.194 21.880 1.00 33.24 N ATOM 1707 CA ILE A 112 -24.786 -22.762 21.752 1.00 72.42 C ATOM 1708 C ILE A 112 -23.505 -21.967 21.980 1.00 15.20 C ATOM 1709 O ILE A 112 -23.311 -20.902 21.394 1.00 1.42 O ATOM 1710 CB ILE A 112 -25.860 -22.281 22.745 1.00 12.20 C ATOM 1711 CG1 ILE A 112 -27.210 -22.927 22.424 1.00 44.45 C ATOM 1712 CG2 ILE A 112 -25.971 -20.764 22.711 1.00 52.13 C ATOM 1713 CD1 ILE A 112 -27.725 -22.593 21.041 1.00 20.00 C ATOM 0 H ILE A 112 -24.930 -24.612 22.727 1.00 33.24 H new ATOM 0 HA ILE A 112 -25.141 -22.591 20.736 1.00 72.42 H new ATOM 0 HB ILE A 112 -25.565 -22.582 23.750 1.00 12.20 H new ATOM 0 HG12 ILE A 112 -27.117 -24.009 22.517 1.00 44.45 H new ATOM 0 HG13 ILE A 112 -27.943 -22.605 23.164 1.00 44.45 H new ATOM 0 HG21 ILE A 112 -26.734 -20.439 23.418 1.00 52.13 H new ATOM 0 HG22 ILE A 112 -25.012 -20.323 22.984 1.00 52.13 H new ATOM 0 HG23 ILE A 112 -26.246 -20.442 21.707 1.00 52.13 H new ATOM 0 HD11 ILE A 112 -28.685 -23.084 20.882 1.00 20.00 H new ATOM 0 HD12 ILE A 112 -27.850 -21.514 20.950 1.00 20.00 H new ATOM 0 HD13 ILE A 112 -27.012 -22.940 20.293 1.00 20.00 H new ATOM 1725 N PHE A 113 -22.633 -22.492 22.834 1.00 34.11 N ATOM 1726 CA PHE A 113 -21.370 -21.832 23.140 1.00 43.45 C ATOM 1727 C PHE A 113 -20.575 -21.562 21.865 1.00 11.21 C ATOM 1728 O PHE A 113 -20.268 -20.413 21.542 1.00 32.34 O ATOM 1729 CB PHE A 113 -20.541 -22.688 24.099 1.00 20.20 C ATOM 1730 CG PHE A 113 -19.116 -22.232 24.232 1.00 51.13 C ATOM 1731 CD1 PHE A 113 -18.136 -22.723 23.385 1.00 42.25 C ATOM 1732 CD2 PHE A 113 -18.757 -21.312 25.204 1.00 60.30 C ATOM 1733 CE1 PHE A 113 -16.824 -22.305 23.504 1.00 43.34 C ATOM 1734 CE2 PHE A 113 -17.447 -20.890 25.327 1.00 23.35 C ATOM 1735 CZ PHE A 113 -16.479 -21.388 24.477 1.00 3.11 C ATOM 0 H PHE A 113 -22.778 -23.373 23.327 1.00 34.11 H new ATOM 0 HA PHE A 113 -21.594 -20.878 23.617 1.00 43.45 H new ATOM 0 HB2 PHE A 113 -21.011 -22.676 25.082 1.00 20.20 H new ATOM 0 HB3 PHE A 113 -20.552 -23.722 23.753 1.00 20.20 H new ATOM 0 HD1 PHE A 113 -18.400 -23.441 22.623 1.00 42.25 H new ATOM 0 HD2 PHE A 113 -19.509 -20.921 25.873 1.00 60.30 H new ATOM 0 HE1 PHE A 113 -16.070 -22.695 22.837 1.00 43.34 H new ATOM 0 HE2 PHE A 113 -17.180 -20.171 26.087 1.00 23.35 H new ATOM 0 HZ PHE A 113 -15.454 -21.061 24.573 1.00 3.11 H new ATOM 1745 N LEU A 114 -20.244 -22.628 21.145 1.00 53.23 N ATOM 1746 CA LEU A 114 -19.485 -22.508 19.905 1.00 4.21 C ATOM 1747 C LEU A 114 -20.288 -21.763 18.844 1.00 1.41 C ATOM 1748 O LEU A 114 -19.721 -21.161 17.932 1.00 55.41 O ATOM 1749 CB LEU A 114 -19.095 -23.893 19.387 1.00 61.14 C ATOM 1750 CG LEU A 114 -20.150 -24.619 18.551 1.00 14.44 C ATOM 1751 CD1 LEU A 114 -19.893 -24.409 17.067 1.00 31.42 C ATOM 1752 CD2 LEU A 114 -20.169 -26.103 18.887 1.00 2.34 C ATOM 0 H LEU A 114 -20.489 -23.585 21.398 1.00 53.23 H new ATOM 0 HA LEU A 114 -18.580 -21.938 20.116 1.00 4.21 H new ATOM 0 HB2 LEU A 114 -18.191 -23.793 18.787 1.00 61.14 H new ATOM 0 HB3 LEU A 114 -18.843 -24.521 20.242 1.00 61.14 H new ATOM 0 HG LEU A 114 -21.127 -24.201 18.792 1.00 14.44 H new ATOM 0 HD11 LEU A 114 -20.654 -24.933 16.488 1.00 31.42 H new ATOM 0 HD12 LEU A 114 -19.932 -23.344 16.838 1.00 31.42 H new ATOM 0 HD13 LEU A 114 -18.908 -24.799 16.809 1.00 31.42 H new ATOM 0 HD21 LEU A 114 -20.926 -26.603 18.283 1.00 2.34 H new ATOM 0 HD22 LEU A 114 -19.191 -26.536 18.676 1.00 2.34 H new ATOM 0 HD23 LEU A 114 -20.404 -26.234 19.943 1.00 2.34 H new ATOM 1764 N TRP A 115 -21.609 -21.806 18.971 1.00 11.13 N ATOM 1765 CA TRP A 115 -22.490 -21.133 18.024 1.00 15.51 C ATOM 1766 C TRP A 115 -22.361 -19.618 18.142 1.00 44.12 C ATOM 1767 O TRP A 115 -22.600 -18.889 17.180 1.00 62.04 O ATOM 1768 CB TRP A 115 -23.942 -21.552 18.260 1.00 73.21 C ATOM 1769 CG TRP A 115 -24.512 -22.374 17.143 1.00 22.25 C ATOM 1770 CD1 TRP A 115 -25.030 -23.635 17.235 1.00 3.54 C ATOM 1771 CD2 TRP A 115 -24.619 -21.994 15.767 1.00 3.34 C ATOM 1772 NE1 TRP A 115 -25.452 -24.060 15.999 1.00 32.41 N ATOM 1773 CE2 TRP A 115 -25.212 -23.072 15.082 1.00 40.21 C ATOM 1774 CE3 TRP A 115 -24.273 -20.847 15.048 1.00 51.41 C ATOM 1775 CZ2 TRP A 115 -25.465 -23.035 13.713 1.00 5.22 C ATOM 1776 CZ3 TRP A 115 -24.524 -20.812 13.690 1.00 51.55 C ATOM 1777 CH2 TRP A 115 -25.116 -21.899 13.034 1.00 62.33 C ATOM 0 H TRP A 115 -22.094 -22.300 19.720 1.00 11.13 H new ATOM 0 HA TRP A 115 -22.193 -21.428 17.018 1.00 15.51 H new ATOM 0 HB2 TRP A 115 -24.002 -22.121 19.188 1.00 73.21 H new ATOM 0 HB3 TRP A 115 -24.553 -20.659 18.393 1.00 73.21 H new ATOM 0 HD1 TRP A 115 -25.098 -24.212 18.145 1.00 3.54 H new ATOM 0 HE1 TRP A 115 -25.876 -24.966 15.797 1.00 32.41 H new ATOM 0 HE3 TRP A 115 -23.818 -20.003 15.545 1.00 51.41 H new ATOM 0 HZ2 TRP A 115 -25.920 -23.873 13.205 1.00 5.22 H new ATOM 0 HZ3 TRP A 115 -24.259 -19.931 13.124 1.00 51.55 H new ATOM 0 HH2 TRP A 115 -25.301 -21.839 11.972 1.00 62.33 H new ATOM 1788 N MET A 116 -21.980 -19.151 19.327 1.00 73.24 N ATOM 1789 CA MET A 116 -21.818 -17.722 19.568 1.00 24.21 C ATOM 1790 C MET A 116 -20.500 -17.219 18.986 1.00 33.03 C ATOM 1791 O MET A 116 -20.469 -16.217 18.272 1.00 65.04 O ATOM 1792 CB MET A 116 -21.872 -17.427 21.068 1.00 24.44 C ATOM 1793 CG MET A 116 -22.813 -16.291 21.431 1.00 54.42 C ATOM 1794 SD MET A 116 -21.948 -14.861 22.109 1.00 72.34 S ATOM 1795 CE MET A 116 -20.663 -14.631 20.882 1.00 11.55 C ATOM 0 H MET A 116 -21.778 -19.741 20.134 1.00 73.24 H new ATOM 0 HA MET A 116 -22.637 -17.200 19.073 1.00 24.21 H new ATOM 0 HB2 MET A 116 -22.183 -18.328 21.596 1.00 24.44 H new ATOM 0 HB3 MET A 116 -20.869 -17.183 21.418 1.00 24.44 H new ATOM 0 HG2 MET A 116 -23.369 -15.987 20.544 1.00 54.42 H new ATOM 0 HG3 MET A 116 -23.543 -16.647 22.158 1.00 54.42 H new ATOM 0 HE1 MET A 116 -20.263 -13.620 20.960 1.00 11.55 H new ATOM 0 HE2 MET A 116 -19.864 -15.352 21.053 1.00 11.55 H new ATOM 0 HE3 MET A 116 -21.080 -14.781 19.886 1.00 11.55 H new ATOM 1805 N PHE A 117 -19.415 -17.920 19.297 1.00 31.22 N ATOM 1806 CA PHE A 117 -18.095 -17.543 18.806 1.00 22.40 C ATOM 1807 C PHE A 117 -18.110 -17.361 17.291 1.00 3.22 C ATOM 1808 O PHE A 117 -17.521 -16.417 16.763 1.00 1.14 O ATOM 1809 CB PHE A 117 -17.062 -18.604 19.193 1.00 4.51 C ATOM 1810 CG PHE A 117 -16.575 -18.478 20.609 1.00 54.04 C ATOM 1811 CD1 PHE A 117 -17.429 -18.722 21.673 1.00 63.15 C ATOM 1812 CD2 PHE A 117 -15.265 -18.115 20.875 1.00 20.23 C ATOM 1813 CE1 PHE A 117 -16.984 -18.608 22.976 1.00 14.24 C ATOM 1814 CE2 PHE A 117 -14.815 -18.000 22.177 1.00 41.20 C ATOM 1815 CZ PHE A 117 -15.676 -18.245 23.229 1.00 61.22 C ATOM 0 H PHE A 117 -19.424 -18.752 19.887 1.00 31.22 H new ATOM 0 HA PHE A 117 -17.821 -16.594 19.266 1.00 22.40 H new ATOM 0 HB2 PHE A 117 -17.499 -19.593 19.054 1.00 4.51 H new ATOM 0 HB3 PHE A 117 -16.210 -18.534 18.517 1.00 4.51 H new ATOM 0 HD1 PHE A 117 -18.454 -19.004 21.481 1.00 63.15 H new ATOM 0 HD2 PHE A 117 -14.588 -17.920 20.057 1.00 20.23 H new ATOM 0 HE1 PHE A 117 -17.659 -18.803 23.796 1.00 14.24 H new ATOM 0 HE2 PHE A 117 -13.791 -17.719 22.372 1.00 41.20 H new ATOM 0 HZ PHE A 117 -15.327 -18.153 24.247 1.00 61.22 H new ATOM 1825 N ILE A 118 -18.786 -18.271 16.598 1.00 11.23 N ATOM 1826 CA ILE A 118 -18.878 -18.210 15.145 1.00 74.31 C ATOM 1827 C ILE A 118 -19.910 -17.178 14.702 1.00 30.30 C ATOM 1828 O ILE A 118 -19.866 -16.687 13.574 1.00 50.40 O ATOM 1829 CB ILE A 118 -19.250 -19.580 14.547 1.00 63.11 C ATOM 1830 CG1 ILE A 118 -20.633 -20.016 15.035 1.00 25.33 C ATOM 1831 CG2 ILE A 118 -18.201 -20.620 14.912 1.00 4.55 C ATOM 1832 CD1 ILE A 118 -21.069 -21.359 14.493 1.00 72.14 C ATOM 0 H ILE A 118 -19.278 -19.059 17.019 1.00 11.23 H new ATOM 0 HA ILE A 118 -17.894 -17.917 14.779 1.00 74.31 H new ATOM 0 HB ILE A 118 -19.281 -19.489 13.461 1.00 63.11 H new ATOM 0 HG12 ILE A 118 -20.629 -20.057 16.124 1.00 25.33 H new ATOM 0 HG13 ILE A 118 -21.365 -19.262 14.747 1.00 25.33 H new ATOM 0 HG21 ILE A 118 -18.478 -21.583 14.482 1.00 4.55 H new ATOM 0 HG22 ILE A 118 -17.232 -20.313 14.519 1.00 4.55 H new ATOM 0 HG23 ILE A 118 -18.141 -20.711 15.997 1.00 4.55 H new ATOM 0 HD11 ILE A 118 -22.058 -21.604 14.880 1.00 72.14 H new ATOM 0 HD12 ILE A 118 -21.106 -21.317 13.404 1.00 72.14 H new ATOM 0 HD13 ILE A 118 -20.358 -22.125 14.803 1.00 72.14 H new ATOM 1844 N ILE A 119 -20.836 -16.854 15.598 1.00 51.42 N ATOM 1845 CA ILE A 119 -21.877 -15.878 15.300 1.00 11.32 C ATOM 1846 C ILE A 119 -21.300 -14.469 15.208 1.00 60.32 C ATOM 1847 O ILE A 119 -21.785 -13.637 14.441 1.00 62.00 O ATOM 1848 CB ILE A 119 -22.988 -15.896 16.367 1.00 62.31 C ATOM 1849 CG1 ILE A 119 -24.311 -16.352 15.749 1.00 71.31 C ATOM 1850 CG2 ILE A 119 -23.138 -14.521 16.999 1.00 52.41 C ATOM 1851 CD1 ILE A 119 -25.106 -17.280 16.640 1.00 34.14 C ATOM 0 H ILE A 119 -20.887 -17.253 16.536 1.00 51.42 H new ATOM 0 HA ILE A 119 -22.304 -16.157 14.337 1.00 11.32 H new ATOM 0 HB ILE A 119 -22.710 -16.604 17.148 1.00 62.31 H new ATOM 0 HG12 ILE A 119 -24.916 -15.475 15.519 1.00 71.31 H new ATOM 0 HG13 ILE A 119 -24.107 -16.855 14.804 1.00 71.31 H new ATOM 0 HG21 ILE A 119 -23.927 -14.550 17.751 1.00 52.41 H new ATOM 0 HG22 ILE A 119 -22.198 -14.233 17.470 1.00 52.41 H new ATOM 0 HG23 ILE A 119 -23.397 -13.793 16.230 1.00 52.41 H new ATOM 0 HD11 ILE A 119 -26.031 -17.563 16.138 1.00 34.14 H new ATOM 0 HD12 ILE A 119 -24.519 -18.174 16.850 1.00 34.14 H new ATOM 0 HD13 ILE A 119 -25.341 -16.773 17.576 1.00 34.14 H new ATOM 1863 N VAL A 120 -20.260 -14.209 15.993 1.00 23.14 N ATOM 1864 CA VAL A 120 -19.614 -12.902 15.999 1.00 64.14 C ATOM 1865 C VAL A 120 -18.566 -12.803 14.896 1.00 41.44 C ATOM 1866 O VAL A 120 -18.307 -11.721 14.367 1.00 53.23 O ATOM 1867 CB VAL A 120 -18.944 -12.612 17.355 1.00 31.31 C ATOM 1868 CG1 VAL A 120 -19.992 -12.467 18.448 1.00 72.41 C ATOM 1869 CG2 VAL A 120 -17.948 -13.709 17.702 1.00 11.51 C ATOM 0 H VAL A 120 -19.846 -14.887 16.634 1.00 23.14 H new ATOM 0 HA VAL A 120 -20.395 -12.162 15.823 1.00 64.14 H new ATOM 0 HB VAL A 120 -18.401 -11.670 17.279 1.00 31.31 H new ATOM 0 HG11 VAL A 120 -19.500 -12.262 19.399 1.00 72.41 H new ATOM 0 HG12 VAL A 120 -20.663 -11.644 18.202 1.00 72.41 H new ATOM 0 HG13 VAL A 120 -20.565 -13.391 18.527 1.00 72.41 H new ATOM 0 HG21 VAL A 120 -17.484 -13.488 18.663 1.00 11.51 H new ATOM 0 HG22 VAL A 120 -18.467 -14.666 17.761 1.00 11.51 H new ATOM 0 HG23 VAL A 120 -17.179 -13.760 16.931 1.00 11.51 H new ATOM 1879 N CYS A 121 -17.966 -13.937 14.553 1.00 74.31 N ATOM 1880 CA CYS A 121 -16.946 -13.979 13.512 1.00 45.42 C ATOM 1881 C CYS A 121 -17.547 -13.658 12.147 1.00 32.44 C ATOM 1882 O CYS A 121 -16.970 -12.903 11.364 1.00 62.31 O ATOM 1883 CB CYS A 121 -16.277 -15.354 13.478 1.00 13.20 C ATOM 1884 SG CYS A 121 -15.151 -15.661 14.859 1.00 61.33 S ATOM 0 H CYS A 121 -18.169 -14.840 14.981 1.00 74.31 H new ATOM 0 HA CYS A 121 -16.195 -13.224 13.744 1.00 45.42 H new ATOM 0 HB2 CYS A 121 -17.050 -16.122 13.476 1.00 13.20 H new ATOM 0 HB3 CYS A 121 -15.725 -15.455 12.544 1.00 13.20 H new ATOM 0 HG CYS A 121 -15.833 -16.042 15.898 1.00 61.33 H new ATOM 1890 N LEU A 122 -18.709 -14.238 11.868 1.00 33.34 N ATOM 1891 CA LEU A 122 -19.390 -14.016 10.597 1.00 25.31 C ATOM 1892 C LEU A 122 -20.062 -12.647 10.571 1.00 63.30 C ATOM 1893 O LEU A 122 -19.963 -11.914 9.586 1.00 11.02 O ATOM 1894 CB LEU A 122 -20.429 -15.112 10.354 1.00 23.10 C ATOM 1895 CG LEU A 122 -20.163 -16.037 9.166 1.00 74.13 C ATOM 1896 CD1 LEU A 122 -20.100 -15.240 7.872 1.00 10.43 C ATOM 1897 CD2 LEU A 122 -18.875 -16.819 9.376 1.00 70.21 C ATOM 0 H LEU A 122 -19.200 -14.866 12.505 1.00 33.34 H new ATOM 0 HA LEU A 122 -18.644 -14.049 9.803 1.00 25.31 H new ATOM 0 HB2 LEU A 122 -20.502 -15.722 11.254 1.00 23.10 H new ATOM 0 HB3 LEU A 122 -21.400 -14.639 10.210 1.00 23.10 H new ATOM 0 HG LEU A 122 -20.987 -16.747 9.092 1.00 74.13 H new ATOM 0 HD11 LEU A 122 -19.910 -15.915 7.038 1.00 10.43 H new ATOM 0 HD12 LEU A 122 -21.048 -14.726 7.714 1.00 10.43 H new ATOM 0 HD13 LEU A 122 -19.296 -14.506 7.935 1.00 10.43 H new ATOM 0 HD21 LEU A 122 -18.702 -17.472 8.520 1.00 70.21 H new ATOM 0 HD22 LEU A 122 -18.041 -16.125 9.477 1.00 70.21 H new ATOM 0 HD23 LEU A 122 -18.958 -17.421 10.281 1.00 70.21 H new ATOM 1909 N LEU A 123 -20.743 -12.308 11.660 1.00 53.15 N ATOM 1910 CA LEU A 123 -21.430 -11.025 11.763 1.00 34.20 C ATOM 1911 C LEU A 123 -20.462 -9.869 11.539 1.00 45.35 C ATOM 1912 O LEU A 123 -20.606 -9.100 10.589 1.00 62.11 O ATOM 1913 CB LEU A 123 -22.095 -10.890 13.134 1.00 13.40 C ATOM 1914 CG LEU A 123 -22.772 -9.549 13.422 1.00 34.30 C ATOM 1915 CD1 LEU A 123 -21.782 -8.571 14.034 1.00 24.33 C ATOM 1916 CD2 LEU A 123 -23.377 -8.973 12.150 1.00 43.21 C ATOM 0 H LEU A 123 -20.834 -12.903 12.484 1.00 53.15 H new ATOM 0 HA LEU A 123 -22.196 -10.988 10.988 1.00 34.20 H new ATOM 0 HB2 LEU A 123 -22.840 -11.679 13.234 1.00 13.40 H new ATOM 0 HB3 LEU A 123 -21.340 -11.065 13.901 1.00 13.40 H new ATOM 0 HG LEU A 123 -23.575 -9.716 14.139 1.00 34.30 H new ATOM 0 HD11 LEU A 123 -22.282 -7.623 14.232 1.00 24.33 H new ATOM 0 HD12 LEU A 123 -21.397 -8.980 14.968 1.00 24.33 H new ATOM 0 HD13 LEU A 123 -20.956 -8.408 13.341 1.00 24.33 H new ATOM 0 HD21 LEU A 123 -23.854 -8.019 12.374 1.00 43.21 H new ATOM 0 HD22 LEU A 123 -22.591 -8.821 11.410 1.00 43.21 H new ATOM 0 HD23 LEU A 123 -24.119 -9.666 11.754 1.00 43.21 H new ATOM 1928 N GLY A 124 -19.472 -9.753 12.419 1.00 43.01 N ATOM 1929 CA GLY A 124 -18.492 -8.689 12.298 1.00 70.21 C ATOM 1930 C GLY A 124 -17.854 -8.642 10.924 1.00 54.34 C ATOM 1931 O GLY A 124 -17.860 -7.602 10.263 1.00 25.14 O ATOM 0 H GLY A 124 -19.331 -10.377 13.214 1.00 43.01 H new ATOM 0 HA2 GLY A 124 -18.971 -7.732 12.505 1.00 70.21 H new ATOM 0 HA3 GLY A 124 -17.716 -8.827 13.051 1.00 70.21 H new ATOM 1935 N THR A 125 -17.301 -9.770 10.490 1.00 33.20 N ATOM 1936 CA THR A 125 -16.654 -9.853 9.187 1.00 51.22 C ATOM 1937 C THR A 125 -17.577 -9.353 8.082 1.00 53.42 C ATOM 1938 O THR A 125 -17.142 -8.664 7.159 1.00 5.21 O ATOM 1939 CB THR A 125 -16.221 -11.296 8.865 1.00 54.42 C ATOM 1940 OG1 THR A 125 -15.119 -11.674 9.697 1.00 41.33 O ATOM 1941 CG2 THR A 125 -15.828 -11.429 7.401 1.00 0.34 C ATOM 0 H THR A 125 -17.288 -10.640 11.023 1.00 33.20 H new ATOM 0 HA THR A 125 -15.769 -9.218 9.233 1.00 51.22 H new ATOM 0 HB THR A 125 -17.065 -11.957 9.059 1.00 54.42 H new ATOM 0 HG1 THR A 125 -15.450 -12.180 10.468 1.00 41.33 H new ATOM 0 HG21 THR A 125 -15.526 -12.456 7.197 1.00 0.34 H new ATOM 0 HG22 THR A 125 -16.679 -11.169 6.771 1.00 0.34 H new ATOM 0 HG23 THR A 125 -14.997 -10.757 7.185 1.00 0.34 H new ATOM 1949 N VAL A 126 -18.856 -9.703 8.181 1.00 2.23 N ATOM 1950 CA VAL A 126 -19.842 -9.288 7.191 1.00 44.54 C ATOM 1951 C VAL A 126 -20.082 -7.783 7.252 1.00 72.32 C ATOM 1952 O VAL A 126 -20.040 -7.095 6.233 1.00 75.42 O ATOM 1953 CB VAL A 126 -21.182 -10.019 7.392 1.00 61.34 C ATOM 1954 CG1 VAL A 126 -22.316 -9.247 6.735 1.00 1.10 C ATOM 1955 CG2 VAL A 126 -21.103 -11.436 6.842 1.00 3.34 C ATOM 0 H VAL A 126 -19.233 -10.273 8.938 1.00 2.23 H new ATOM 0 HA VAL A 126 -19.438 -9.549 6.213 1.00 44.54 H new ATOM 0 HB VAL A 126 -21.386 -10.078 8.461 1.00 61.34 H new ATOM 0 HG11 VAL A 126 -23.255 -9.779 6.888 1.00 1.10 H new ATOM 0 HG12 VAL A 126 -22.385 -8.254 7.179 1.00 1.10 H new ATOM 0 HG13 VAL A 126 -22.122 -9.154 5.667 1.00 1.10 H new ATOM 0 HG21 VAL A 126 -22.059 -11.938 6.992 1.00 3.34 H new ATOM 0 HG22 VAL A 126 -20.875 -11.401 5.777 1.00 3.34 H new ATOM 0 HG23 VAL A 126 -20.319 -11.985 7.363 1.00 3.34 H new ATOM 1965 N GLY A 127 -20.334 -7.278 8.456 1.00 70.22 N ATOM 1966 CA GLY A 127 -20.577 -5.858 8.628 1.00 13.12 C ATOM 1967 C GLY A 127 -19.385 -5.012 8.226 1.00 73.54 C ATOM 1968 O GLY A 127 -19.519 -3.811 7.987 1.00 23.40 O ATOM 0 H GLY A 127 -20.374 -7.827 9.315 1.00 70.22 H new ATOM 0 HA2 GLY A 127 -21.443 -5.566 8.033 1.00 13.12 H new ATOM 0 HA3 GLY A 127 -20.825 -5.659 9.671 1.00 13.12 H new ATOM 1972 N LEU A 128 -18.216 -5.639 8.151 1.00 52.31 N ATOM 1973 CA LEU A 128 -16.994 -4.936 7.776 1.00 52.42 C ATOM 1974 C LEU A 128 -16.875 -4.821 6.259 1.00 34.34 C ATOM 1975 O LEU A 128 -16.508 -3.771 5.732 1.00 13.14 O ATOM 1976 CB LEU A 128 -15.771 -5.660 8.341 1.00 35.14 C ATOM 1977 CG LEU A 128 -14.410 -5.085 7.949 1.00 22.43 C ATOM 1978 CD1 LEU A 128 -14.399 -3.574 8.120 1.00 31.21 C ATOM 1979 CD2 LEU A 128 -13.303 -5.725 8.775 1.00 71.11 C ATOM 0 H LEU A 128 -18.089 -6.632 8.345 1.00 52.31 H new ATOM 0 HA LEU A 128 -17.040 -3.931 8.196 1.00 52.42 H new ATOM 0 HB2 LEU A 128 -15.844 -5.659 9.429 1.00 35.14 H new ATOM 0 HB3 LEU A 128 -15.809 -6.701 8.020 1.00 35.14 H new ATOM 0 HG LEU A 128 -14.230 -5.312 6.898 1.00 22.43 H new ATOM 0 HD11 LEU A 128 -13.422 -3.183 7.836 1.00 31.21 H new ATOM 0 HD12 LEU A 128 -15.166 -3.130 7.485 1.00 31.21 H new ATOM 0 HD13 LEU A 128 -14.601 -3.324 9.162 1.00 31.21 H new ATOM 0 HD21 LEU A 128 -12.341 -5.304 8.483 1.00 71.11 H new ATOM 0 HD22 LEU A 128 -13.479 -5.529 9.833 1.00 71.11 H new ATOM 0 HD23 LEU A 128 -13.296 -6.801 8.602 1.00 71.11 H new ATOM 1991 N PHE A 129 -17.190 -5.908 5.563 1.00 74.22 N ATOM 1992 CA PHE A 129 -17.120 -5.930 4.106 1.00 12.24 C ATOM 1993 C PHE A 129 -18.294 -5.172 3.494 1.00 54.20 C ATOM 1994 O PHE A 129 -18.116 -4.349 2.595 1.00 70.24 O ATOM 1995 CB PHE A 129 -17.108 -7.372 3.597 1.00 73.45 C ATOM 1996 CG PHE A 129 -15.741 -7.862 3.213 1.00 2.44 C ATOM 1997 CD1 PHE A 129 -14.743 -7.986 4.167 1.00 61.15 C ATOM 1998 CD2 PHE A 129 -15.453 -8.196 1.900 1.00 32.30 C ATOM 1999 CE1 PHE A 129 -13.484 -8.436 3.817 1.00 25.35 C ATOM 2000 CE2 PHE A 129 -14.196 -8.647 1.545 1.00 21.41 C ATOM 2001 CZ PHE A 129 -13.210 -8.766 2.505 1.00 64.33 C ATOM 0 H PHE A 129 -17.496 -6.785 5.984 1.00 74.22 H new ATOM 0 HA PHE A 129 -16.196 -5.438 3.804 1.00 12.24 H new ATOM 0 HB2 PHE A 129 -17.515 -8.025 4.369 1.00 73.45 H new ATOM 0 HB3 PHE A 129 -17.769 -7.449 2.733 1.00 73.45 H new ATOM 0 HD1 PHE A 129 -14.952 -7.728 5.195 1.00 61.15 H new ATOM 0 HD2 PHE A 129 -16.220 -8.103 1.145 1.00 32.30 H new ATOM 0 HE1 PHE A 129 -12.715 -8.529 4.570 1.00 25.35 H new ATOM 0 HE2 PHE A 129 -13.985 -8.906 0.518 1.00 21.41 H new ATOM 0 HZ PHE A 129 -12.226 -9.117 2.230 1.00 64.33 H new