USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 896 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 103 THR OG1 : rot -109:sc= 0.995 USER MOD Set 1.2: A 127 CYS SG : rot 132:sc= -0.903! USER MOD Set 2.1: A 105 THR OG1 : rot -112:sc= 1.01 USER MOD Set 2.2: A 108 THR OG1 : rot 77:sc= -1.42! USER MOD Set 3.1: A 24 TYR OH : rot 30:sc= 0.771 USER MOD Set 3.2: A 104 LYS NZ :NH3+ 166:sc= 0.287 (180deg=-1.24!) USER MOD Set 4.1: A 6 TYR OH : rot 150:sc= -3.81! USER MOD Set 4.2: A 133 HIS : no HD1:sc= -7.62! C(o=-11!,f=-12!) USER MOD Single : A 4 ASN : amide:sc= -0.523 X(o=-0.52,f=-0.099) USER MOD Single : A 9 ASN : amide:sc= -8.28! C(o=-8.3!,f=-10!) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot 81:sc= 0.0852 USER MOD Single : A 16 CYS SG : rot -103:sc= -4.69! USER MOD Single : A 17 GLN : amide:sc= -1.66 K(o=-1.7,f=-3.8) USER MOD Single : A 25 LYS NZ :NH3+ -125:sc= 0.71 (180deg=-0.986) USER MOD Single : A 27 SER OG : rot 40:sc= 0.257 USER MOD Single : A 29 SER OG : rot 86:sc= 0.0521 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot 47:sc= 1.15 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 43 THR OG1 : rot -110:sc= -1.31 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -5.21! C(o=-5.2!,f=-8.6!) USER MOD Single : A 64 THR OG1 : rot 180:sc= -1.57 USER MOD Single : A 68 GLN : amide:sc= -6.81! K(o=-6.8!,f=-3.1) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 CYS SG : rot -59:sc= -3.13! USER MOD Single : A 71 SER OG : rot -12:sc= -4.88! USER MOD Single : A 76 SER OG : rot 140:sc= -2.35! USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 MET CE :methyl 142:sc= -8.83! (180deg=-11.4!) USER MOD Single : A 89 THR OG1 : rot -12:sc= 1.03 USER MOD Single : A 90 LYS NZ :NH3+ 133:sc= -0.568 (180deg=-2.17!) USER MOD Single : A 99 ASN : amide:sc= -1.16 K(o=-1.2,f=-2!) USER MOD Single : A 101 THR OG1 : rot -110:sc= -0.306 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 MET CE :methyl -147:sc= -2.59 (180deg=-6.55!) USER MOD Single : A 124 ASN : amide:sc= -0.84 X(o=-0.84,f=-0.45) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ 175:sc=-0.00214 (180deg=-0.0107) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 MET CE :methyl -145:sc= -4.89 (180deg=-9.14!) USER MOD Single : A 132 SER OG : rot -40:sc= 0.893 USER MOD Single : A 137 SER OG : rot -40:sc= -0.775 USER MOD Single : A 138 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N TRP A 3 -17.485 14.214 0.983 1.00 0.00 N ATOM 21 CA TRP A 3 -17.121 13.059 0.086 1.00 0.00 C ATOM 22 C TRP A 3 -17.597 13.307 -1.367 1.00 0.00 C ATOM 23 O TRP A 3 -16.847 13.107 -2.317 1.00 0.00 O ATOM 24 CB TRP A 3 -17.779 11.829 0.602 1.00 0.00 C ATOM 25 CG TRP A 3 -16.910 11.107 1.610 1.00 0.00 C ATOM 26 CD1 TRP A 3 -17.256 9.933 2.141 1.00 0.00 C ATOM 27 CD2 TRP A 3 -15.584 11.449 2.208 1.00 0.00 C ATOM 28 NE1 TRP A 3 -16.290 9.518 3.037 1.00 0.00 N ATOM 29 CE2 TRP A 3 -15.240 10.404 3.111 1.00 0.00 C ATOM 30 CE3 TRP A 3 -14.651 12.535 2.081 1.00 0.00 C ATOM 31 CZ2 TRP A 3 -14.059 10.420 3.842 1.00 0.00 C ATOM 32 CZ3 TRP A 3 -13.464 12.527 2.823 1.00 0.00 C ATOM 33 CH2 TRP A 3 -13.174 11.476 3.699 1.00 0.00 C ATOM 0 HA TRP A 3 -16.036 12.950 0.082 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -18.730 12.092 1.065 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -18.003 11.161 -0.229 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -18.158 9.388 1.905 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -16.348 8.656 3.580 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -14.866 13.357 1.414 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -13.831 9.611 4.520 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -12.764 13.342 2.718 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -12.255 11.488 4.267 1.00 0.00 H new ATOM 44 N ASN A 4 -18.853 13.714 -1.536 1.00 0.00 N ATOM 45 CA ASN A 4 -19.417 13.952 -2.923 1.00 0.00 C ATOM 46 C ASN A 4 -18.593 14.996 -3.667 1.00 0.00 C ATOM 47 O ASN A 4 -18.539 14.982 -4.873 1.00 0.00 O ATOM 48 CB ASN A 4 -20.882 14.414 -2.836 1.00 0.00 C ATOM 49 CG ASN A 4 -21.045 15.465 -1.729 1.00 0.00 C ATOM 50 OD1 ASN A 4 -20.828 16.639 -1.953 1.00 0.00 O ATOM 51 ND2 ASN A 4 -21.423 15.087 -0.536 1.00 0.00 N ATOM 0 H ASN A 4 -19.507 13.890 -0.774 1.00 0.00 H new ATOM 0 HA ASN A 4 -19.372 13.011 -3.472 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -21.196 14.832 -3.793 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -21.528 13.560 -2.634 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -21.536 15.778 0.206 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -21.605 14.101 -0.347 1.00 0.00 H new ATOM 58 N ALA A 5 -17.953 15.887 -2.944 1.00 0.00 N ATOM 59 CA ALA A 5 -17.079 16.957 -3.588 1.00 0.00 C ATOM 60 C ALA A 5 -15.818 16.270 -4.140 1.00 0.00 C ATOM 61 O ALA A 5 -15.334 16.582 -5.235 1.00 0.00 O ATOM 62 CB ALA A 5 -16.678 17.999 -2.538 1.00 0.00 C ATOM 0 H ALA A 5 -17.991 15.929 -1.926 1.00 0.00 H new ATOM 0 HA ALA A 5 -17.622 17.458 -4.389 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -16.053 18.762 -3.003 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -17.574 18.464 -2.127 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -16.121 17.513 -1.737 1.00 0.00 H new ATOM 68 N TYR A 6 -15.306 15.295 -3.409 1.00 0.00 N ATOM 69 CA TYR A 6 -14.097 14.521 -3.906 1.00 0.00 C ATOM 70 C TYR A 6 -14.571 13.572 -5.020 1.00 0.00 C ATOM 71 O TYR A 6 -13.790 13.062 -5.792 1.00 0.00 O ATOM 72 CB TYR A 6 -13.416 13.823 -2.736 1.00 0.00 C ATOM 73 CG TYR A 6 -13.321 14.863 -1.673 1.00 0.00 C ATOM 74 CD1 TYR A 6 -12.500 15.979 -1.847 1.00 0.00 C ATOM 75 CD2 TYR A 6 -14.143 14.772 -0.596 1.00 0.00 C ATOM 76 CE1 TYR A 6 -12.530 17.009 -0.910 1.00 0.00 C ATOM 77 CE2 TYR A 6 -14.163 15.780 0.362 1.00 0.00 C ATOM 78 CZ TYR A 6 -13.363 16.906 0.200 1.00 0.00 C ATOM 79 OH TYR A 6 -13.428 17.934 1.108 1.00 0.00 O ATOM 0 H TYR A 6 -15.664 15.001 -2.500 1.00 0.00 H new ATOM 0 HA TYR A 6 -13.338 15.175 -4.335 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -13.995 12.964 -2.397 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -12.430 13.453 -3.016 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -11.845 16.043 -2.704 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -14.785 13.911 -0.483 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -11.910 17.883 -1.044 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -14.799 15.688 1.230 1.00 0.00 H new ATOM 0 HH TYR A 6 -14.319 17.955 1.515 1.00 0.00 H new ATOM 89 N ILE A 7 -15.887 13.442 -5.156 1.00 0.00 N ATOM 90 CA ILE A 7 -16.482 12.690 -6.293 1.00 0.00 C ATOM 91 C ILE A 7 -16.706 13.782 -7.431 1.00 0.00 C ATOM 92 O ILE A 7 -16.658 13.516 -8.650 1.00 0.00 O ATOM 93 CB ILE A 7 -17.781 12.018 -5.852 1.00 0.00 C ATOM 94 CG1 ILE A 7 -17.399 10.775 -5.014 1.00 0.00 C ATOM 95 CG2 ILE A 7 -18.620 11.606 -7.071 1.00 0.00 C ATOM 96 CD1 ILE A 7 -16.882 9.637 -5.911 1.00 0.00 C ATOM 0 H ILE A 7 -16.569 13.837 -4.509 1.00 0.00 H new ATOM 0 HA ILE A 7 -15.847 11.883 -6.657 1.00 0.00 H new ATOM 0 HB ILE A 7 -18.383 12.708 -5.261 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -16.633 11.045 -4.287 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -18.267 10.432 -4.451 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -19.541 11.129 -6.735 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -18.863 12.490 -7.661 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -18.052 10.906 -7.684 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -16.621 8.777 -5.294 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -17.658 9.352 -6.621 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -15.999 9.974 -6.454 1.00 0.00 H new ATOM 108 N ASP A 8 -16.870 15.042 -6.996 1.00 0.00 N ATOM 109 CA ASP A 8 -17.002 16.173 -7.926 1.00 0.00 C ATOM 110 C ASP A 8 -15.639 16.390 -8.610 1.00 0.00 C ATOM 111 O ASP A 8 -15.552 17.054 -9.589 1.00 0.00 O ATOM 112 CB ASP A 8 -17.455 17.405 -7.161 1.00 0.00 C ATOM 113 CG ASP A 8 -18.985 17.465 -7.151 1.00 0.00 C ATOM 114 OD1 ASP A 8 -19.549 17.944 -8.123 1.00 0.00 O ATOM 115 OD2 ASP A 8 -19.569 17.029 -6.170 1.00 0.00 O ATOM 0 H ASP A 8 -16.914 15.301 -6.011 1.00 0.00 H new ATOM 0 HA ASP A 8 -17.751 15.971 -8.692 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -17.075 17.372 -6.140 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -17.048 18.304 -7.624 1.00 0.00 H new ATOM 120 N ASN A 9 -14.579 15.758 -8.072 1.00 0.00 N ATOM 121 CA ASN A 9 -13.206 15.801 -8.658 1.00 0.00 C ATOM 122 C ASN A 9 -13.309 15.272 -10.063 1.00 0.00 C ATOM 123 O ASN A 9 -12.957 15.906 -11.027 1.00 0.00 O ATOM 124 CB ASN A 9 -12.346 14.848 -7.712 1.00 0.00 C ATOM 125 CG ASN A 9 -11.484 13.698 -8.445 1.00 0.00 C ATOM 126 OD1 ASN A 9 -10.654 13.991 -9.282 1.00 0.00 O ATOM 127 ND2 ASN A 9 -11.670 12.360 -8.091 1.00 0.00 N ATOM 0 H ASN A 9 -14.640 15.201 -7.220 1.00 0.00 H new ATOM 0 HA ASN A 9 -12.752 16.791 -8.711 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -11.664 15.469 -7.131 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -13.022 14.369 -7.004 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -11.110 11.632 -8.535 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -12.366 12.110 -7.388 1.00 0.00 H new ATOM 134 N LEU A 10 -13.842 14.130 -10.118 1.00 0.00 N ATOM 135 CA LEU A 10 -14.115 13.375 -11.374 1.00 0.00 C ATOM 136 C LEU A 10 -14.881 14.155 -12.311 1.00 0.00 C ATOM 137 O LEU A 10 -14.695 14.105 -13.528 1.00 0.00 O ATOM 138 CB LEU A 10 -15.018 12.217 -11.012 1.00 0.00 C ATOM 139 CG LEU A 10 -14.336 11.218 -10.116 1.00 0.00 C ATOM 140 CD1 LEU A 10 -12.783 11.190 -10.301 1.00 0.00 C ATOM 141 CD2 LEU A 10 -14.707 11.503 -8.615 1.00 0.00 C ATOM 0 H LEU A 10 -14.134 13.625 -9.281 1.00 0.00 H new ATOM 0 HA LEU A 10 -13.158 13.089 -11.810 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -15.911 12.597 -10.515 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -15.348 11.718 -11.923 1.00 0.00 H new ATOM 0 HG LEU A 10 -14.698 10.231 -10.404 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -12.350 10.450 -9.628 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -12.544 10.927 -11.331 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -12.372 12.173 -10.073 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -14.210 10.776 -7.973 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -14.383 12.508 -8.345 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -15.786 11.423 -8.485 1.00 0.00 H new ATOM 153 N MET A 11 -15.793 14.814 -11.789 1.00 0.00 N ATOM 154 CA MET A 11 -16.678 15.565 -12.611 1.00 0.00 C ATOM 155 C MET A 11 -15.912 16.853 -13.071 1.00 0.00 C ATOM 156 O MET A 11 -16.045 17.307 -14.194 1.00 0.00 O ATOM 157 CB MET A 11 -17.942 15.763 -11.762 1.00 0.00 C ATOM 158 CG MET A 11 -18.433 14.301 -11.234 1.00 0.00 C ATOM 159 SD MET A 11 -19.405 13.506 -12.537 1.00 0.00 S ATOM 160 CE MET A 11 -18.192 12.234 -12.967 1.00 0.00 C ATOM 0 H MET A 11 -15.974 14.870 -10.787 1.00 0.00 H new ATOM 0 HA MET A 11 -16.998 15.096 -13.541 1.00 0.00 H new ATOM 0 HB2 MET A 11 -17.735 16.422 -10.919 1.00 0.00 H new ATOM 0 HB3 MET A 11 -18.726 16.237 -12.352 1.00 0.00 H new ATOM 0 HG2 MET A 11 -17.572 13.684 -10.976 1.00 0.00 H new ATOM 0 HG3 MET A 11 -19.031 14.408 -10.329 1.00 0.00 H new ATOM 0 HE1 MET A 11 -18.587 11.611 -13.769 1.00 0.00 H new ATOM 0 HE2 MET A 11 -17.268 12.709 -13.298 1.00 0.00 H new ATOM 0 HE3 MET A 11 -17.989 11.615 -12.093 1.00 0.00 H new ATOM 170 N ALA A 12 -15.071 17.375 -12.200 1.00 0.00 N ATOM 171 CA ALA A 12 -14.197 18.571 -12.498 1.00 0.00 C ATOM 172 C ALA A 12 -12.845 18.205 -13.228 1.00 0.00 C ATOM 173 O ALA A 12 -12.061 19.098 -13.521 1.00 0.00 O ATOM 174 CB ALA A 12 -13.875 19.282 -11.171 1.00 0.00 C ATOM 0 H ALA A 12 -14.949 17.007 -11.257 1.00 0.00 H new ATOM 0 HA ALA A 12 -14.754 19.213 -13.181 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -13.244 20.149 -11.367 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -14.802 19.607 -10.698 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.351 18.594 -10.508 1.00 0.00 H new ATOM 180 N ASP A 13 -12.523 16.911 -13.437 1.00 0.00 N ATOM 181 CA ASP A 13 -11.128 16.544 -14.055 1.00 0.00 C ATOM 182 C ASP A 13 -11.151 16.229 -15.547 1.00 0.00 C ATOM 183 O ASP A 13 -10.095 16.010 -16.107 1.00 0.00 O ATOM 184 CB ASP A 13 -10.492 15.315 -13.311 1.00 0.00 C ATOM 185 CG ASP A 13 -11.513 14.406 -12.778 1.00 0.00 C ATOM 186 OD1 ASP A 13 -12.356 14.025 -13.536 1.00 0.00 O ATOM 187 OD2 ASP A 13 -11.421 14.071 -11.617 1.00 0.00 O ATOM 0 H ASP A 13 -13.127 16.117 -13.222 1.00 0.00 H new ATOM 0 HA ASP A 13 -10.531 17.446 -13.922 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -9.845 14.770 -13.999 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -9.862 15.671 -12.496 1.00 0.00 H new ATOM 192 N GLY A 14 -12.310 16.246 -16.210 1.00 0.00 N ATOM 193 CA GLY A 14 -12.378 15.960 -17.737 1.00 0.00 C ATOM 194 C GLY A 14 -11.265 14.948 -18.199 1.00 0.00 C ATOM 195 O GLY A 14 -10.727 15.053 -19.287 1.00 0.00 O ATOM 0 H GLY A 14 -13.212 16.442 -15.777 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -13.360 15.558 -17.987 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -12.268 16.895 -18.286 1.00 0.00 H new ATOM 199 N THR A 15 -10.934 14.008 -17.343 1.00 0.00 N ATOM 200 CA THR A 15 -9.873 12.984 -17.615 1.00 0.00 C ATOM 201 C THR A 15 -10.302 11.672 -16.974 1.00 0.00 C ATOM 202 O THR A 15 -10.043 10.595 -17.499 1.00 0.00 O ATOM 203 CB THR A 15 -8.556 13.453 -16.996 1.00 0.00 C ATOM 204 OG1 THR A 15 -8.027 14.525 -17.760 1.00 0.00 O ATOM 205 CG2 THR A 15 -7.585 12.301 -16.995 1.00 0.00 C ATOM 0 H THR A 15 -11.376 13.906 -16.429 1.00 0.00 H new ATOM 0 HA THR A 15 -9.737 12.848 -18.688 1.00 0.00 H new ATOM 0 HB THR A 15 -8.725 13.795 -15.975 1.00 0.00 H new ATOM 0 HG1 THR A 15 -8.472 15.360 -17.505 1.00 0.00 H new ATOM 0 HG21 THR A 15 -6.640 12.622 -16.556 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.997 11.479 -16.410 1.00 0.00 H new ATOM 0 HG23 THR A 15 -7.415 11.968 -18.019 1.00 0.00 H new ATOM 213 N CYS A 16 -10.918 11.774 -15.837 1.00 0.00 N ATOM 214 CA CYS A 16 -11.350 10.602 -15.096 1.00 0.00 C ATOM 215 C CYS A 16 -12.508 9.920 -15.881 1.00 0.00 C ATOM 216 O CYS A 16 -12.881 10.338 -16.970 1.00 0.00 O ATOM 217 CB CYS A 16 -11.874 11.124 -13.711 1.00 0.00 C ATOM 218 SG CYS A 16 -13.664 11.461 -13.805 1.00 0.00 S ATOM 0 H CYS A 16 -11.141 12.662 -15.388 1.00 0.00 H new ATOM 0 HA CYS A 16 -10.546 9.879 -14.959 1.00 0.00 H new ATOM 0 HB2 CYS A 16 -11.676 10.384 -12.936 1.00 0.00 H new ATOM 0 HB3 CYS A 16 -11.339 12.031 -13.430 1.00 0.00 H new ATOM 0 HG CYS A 16 -13.860 12.743 -13.896 1.00 0.00 H new ATOM 224 N GLN A 17 -13.108 8.956 -15.255 1.00 0.00 N ATOM 225 CA GLN A 17 -14.296 8.272 -15.794 1.00 0.00 C ATOM 226 C GLN A 17 -15.096 7.807 -14.583 1.00 0.00 C ATOM 227 O GLN A 17 -16.302 7.998 -14.504 1.00 0.00 O ATOM 228 CB GLN A 17 -13.948 7.105 -16.681 1.00 0.00 C ATOM 229 CG GLN A 17 -15.096 6.901 -17.696 1.00 0.00 C ATOM 230 CD GLN A 17 -16.383 6.512 -16.960 1.00 0.00 C ATOM 231 OE1 GLN A 17 -16.356 5.714 -16.046 1.00 0.00 O ATOM 232 NE2 GLN A 17 -17.517 7.052 -17.322 1.00 0.00 N ATOM 0 H GLN A 17 -12.804 8.602 -14.348 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.864 8.954 -16.427 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -13.010 7.293 -17.203 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -13.806 6.204 -16.084 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -15.256 7.816 -18.266 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -14.827 6.123 -18.411 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -17.540 7.723 -18.090 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -18.379 6.803 -16.836 1.00 0.00 H new ATOM 241 N ASP A 18 -14.388 7.232 -13.595 1.00 0.00 N ATOM 242 CA ASP A 18 -15.044 6.790 -12.334 1.00 0.00 C ATOM 243 C ASP A 18 -14.229 7.323 -11.145 1.00 0.00 C ATOM 244 O ASP A 18 -13.332 8.148 -11.322 1.00 0.00 O ATOM 245 CB ASP A 18 -15.180 5.258 -12.305 1.00 0.00 C ATOM 246 CG ASP A 18 -16.421 4.853 -11.494 1.00 0.00 C ATOM 247 OD1 ASP A 18 -17.456 5.468 -11.679 1.00 0.00 O ATOM 248 OD2 ASP A 18 -16.310 3.931 -10.702 1.00 0.00 O ATOM 0 H ASP A 18 -13.383 7.061 -13.634 1.00 0.00 H new ATOM 0 HA ASP A 18 -16.055 7.193 -12.271 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -15.259 4.873 -13.322 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -14.287 4.814 -11.864 1.00 0.00 H new ATOM 253 N ALA A 19 -14.553 6.905 -9.949 1.00 0.00 N ATOM 254 CA ALA A 19 -13.844 7.414 -8.736 1.00 0.00 C ATOM 255 C ALA A 19 -14.258 6.618 -7.552 1.00 0.00 C ATOM 256 O ALA A 19 -15.448 6.410 -7.381 1.00 0.00 O ATOM 257 CB ALA A 19 -14.294 8.784 -8.531 1.00 0.00 C ATOM 0 H ALA A 19 -15.288 6.224 -9.758 1.00 0.00 H new ATOM 0 HA ALA A 19 -12.764 7.349 -8.864 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -13.802 9.201 -7.652 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -14.044 9.384 -9.406 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -15.374 8.794 -8.381 1.00 0.00 H new ATOM 263 N ALA A 20 -13.346 6.173 -6.700 1.00 0.00 N ATOM 264 CA ALA A 20 -13.849 5.408 -5.493 1.00 0.00 C ATOM 265 C ALA A 20 -13.130 5.690 -4.203 1.00 0.00 C ATOM 266 O ALA A 20 -12.055 5.174 -3.937 1.00 0.00 O ATOM 267 CB ALA A 20 -13.825 3.933 -5.729 1.00 0.00 C ATOM 0 H ALA A 20 -12.336 6.295 -6.776 1.00 0.00 H new ATOM 0 HA ALA A 20 -14.869 5.772 -5.374 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -14.192 3.417 -4.842 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -14.461 3.690 -6.580 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -12.804 3.614 -5.937 1.00 0.00 H new ATOM 273 N ILE A 21 -13.814 6.384 -3.332 1.00 0.00 N ATOM 274 CA ILE A 21 -13.301 6.583 -1.963 1.00 0.00 C ATOM 275 C ILE A 21 -13.867 5.365 -1.241 1.00 0.00 C ATOM 276 O ILE A 21 -15.056 5.082 -1.380 1.00 0.00 O ATOM 277 CB ILE A 21 -13.827 7.876 -1.367 1.00 0.00 C ATOM 278 CG1 ILE A 21 -13.431 9.025 -2.317 1.00 0.00 C ATOM 279 CG2 ILE A 21 -13.206 8.075 0.046 1.00 0.00 C ATOM 280 CD1 ILE A 21 -13.623 10.373 -1.644 1.00 0.00 C ATOM 0 H ILE A 21 -14.715 6.823 -3.522 1.00 0.00 H new ATOM 0 HA ILE A 21 -12.216 6.666 -1.900 1.00 0.00 H new ATOM 0 HB ILE A 21 -14.911 7.853 -1.258 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -12.390 8.910 -2.620 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -14.034 8.977 -3.224 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -13.580 9.002 0.480 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -13.482 7.237 0.686 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -12.120 8.125 -0.037 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -13.337 11.168 -2.333 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -14.669 10.494 -1.364 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -13.000 10.426 -0.751 1.00 0.00 H new ATOM 292 N VAL A 22 -13.055 4.575 -0.574 1.00 0.00 N ATOM 293 CA VAL A 22 -13.604 3.307 0.017 1.00 0.00 C ATOM 294 C VAL A 22 -13.138 3.063 1.462 1.00 0.00 C ATOM 295 O VAL A 22 -11.987 2.773 1.679 1.00 0.00 O ATOM 296 CB VAL A 22 -13.098 2.129 -0.853 1.00 0.00 C ATOM 297 CG1 VAL A 22 -13.780 0.827 -0.420 1.00 0.00 C ATOM 298 CG2 VAL A 22 -13.403 2.397 -2.343 1.00 0.00 C ATOM 0 H VAL A 22 -12.062 4.745 -0.415 1.00 0.00 H new ATOM 0 HA VAL A 22 -14.691 3.389 0.033 1.00 0.00 H new ATOM 0 HB VAL A 22 -12.020 2.035 -0.719 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.418 0.004 -1.037 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -13.548 0.625 0.626 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.859 0.924 -0.541 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -13.043 1.562 -2.944 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.479 2.505 -2.480 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -12.903 3.313 -2.658 1.00 0.00 H new ATOM 308 N GLY A 23 -14.056 3.114 2.450 1.00 0.00 N ATOM 309 CA GLY A 23 -13.661 2.798 3.884 1.00 0.00 C ATOM 310 C GLY A 23 -13.246 1.314 3.907 1.00 0.00 C ATOM 311 O GLY A 23 -14.055 0.438 4.106 1.00 0.00 O ATOM 0 H GLY A 23 -15.038 3.357 2.317 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -12.839 3.436 4.209 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.493 2.979 4.564 1.00 0.00 H new ATOM 315 N TYR A 24 -11.989 1.065 3.629 1.00 0.00 N ATOM 316 CA TYR A 24 -11.425 -0.325 3.522 1.00 0.00 C ATOM 317 C TYR A 24 -10.940 -0.886 4.891 1.00 0.00 C ATOM 318 O TYR A 24 -9.964 -1.637 4.940 1.00 0.00 O ATOM 319 CB TYR A 24 -10.236 -0.248 2.511 1.00 0.00 C ATOM 320 CG TYR A 24 -8.947 0.229 3.194 1.00 0.00 C ATOM 321 CD1 TYR A 24 -8.962 1.225 4.191 1.00 0.00 C ATOM 322 CD2 TYR A 24 -7.759 -0.348 2.828 1.00 0.00 C ATOM 323 CE1 TYR A 24 -7.771 1.615 4.798 1.00 0.00 C ATOM 324 CE2 TYR A 24 -6.569 0.039 3.424 1.00 0.00 C ATOM 325 CZ TYR A 24 -6.570 1.025 4.411 1.00 0.00 C ATOM 326 OH TYR A 24 -5.392 1.403 5.009 1.00 0.00 O ATOM 0 H TYR A 24 -11.300 1.799 3.465 1.00 0.00 H new ATOM 0 HA TYR A 24 -12.203 -1.009 3.183 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -10.071 -1.229 2.066 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -10.491 0.432 1.698 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -9.895 1.684 4.483 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -7.750 -1.113 2.066 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -7.778 2.373 5.567 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -5.640 -0.423 3.124 1.00 0.00 H new ATOM 0 HH TYR A 24 -5.569 1.686 5.930 1.00 0.00 H new ATOM 336 N LYS A 25 -11.604 -0.550 5.983 1.00 0.00 N ATOM 337 CA LYS A 25 -11.179 -1.079 7.309 1.00 0.00 C ATOM 338 C LYS A 25 -11.418 -2.590 7.307 1.00 0.00 C ATOM 339 O LYS A 25 -11.438 -3.206 6.250 1.00 0.00 O ATOM 340 CB LYS A 25 -11.969 -0.377 8.404 1.00 0.00 C ATOM 341 CG LYS A 25 -11.428 1.048 8.566 1.00 0.00 C ATOM 342 CD LYS A 25 -11.938 1.906 7.432 1.00 0.00 C ATOM 343 CE LYS A 25 -12.012 3.358 7.891 1.00 0.00 C ATOM 344 NZ LYS A 25 -13.113 3.503 8.895 1.00 0.00 N ATOM 0 H LYS A 25 -12.417 0.066 6.002 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.122 -0.891 7.498 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.028 -0.352 8.148 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.881 -0.923 9.343 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.745 1.463 9.523 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.338 1.038 8.568 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.277 1.819 6.569 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.923 1.562 7.115 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.062 3.662 8.330 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.193 4.012 7.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.771 4.245 8.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.624 2.601 8.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.709 3.763 9.818 1.00 0.00 H new ATOM 358 N ASP A 26 -11.601 -3.195 8.467 1.00 0.00 N ATOM 359 CA ASP A 26 -11.859 -4.711 8.550 1.00 0.00 C ATOM 360 C ASP A 26 -12.862 -5.108 7.462 1.00 0.00 C ATOM 361 O ASP A 26 -12.558 -5.890 6.569 1.00 0.00 O ATOM 362 CB ASP A 26 -12.428 -5.103 9.923 1.00 0.00 C ATOM 363 CG ASP A 26 -13.283 -3.972 10.530 1.00 0.00 C ATOM 364 OD1 ASP A 26 -12.710 -3.076 11.131 1.00 0.00 O ATOM 365 OD2 ASP A 26 -14.495 -4.034 10.396 1.00 0.00 O ATOM 0 H ASP A 26 -11.586 -2.718 9.369 1.00 0.00 H new ATOM 0 HA ASP A 26 -10.912 -5.231 8.407 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -13.034 -6.003 9.822 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -11.609 -5.344 10.601 1.00 0.00 H new ATOM 370 N SER A 27 -14.026 -4.511 7.515 1.00 0.00 N ATOM 371 CA SER A 27 -15.063 -4.733 6.502 1.00 0.00 C ATOM 372 C SER A 27 -15.050 -3.474 5.625 1.00 0.00 C ATOM 373 O SER A 27 -15.239 -2.385 6.147 1.00 0.00 O ATOM 374 CB SER A 27 -16.407 -4.887 7.187 1.00 0.00 C ATOM 375 OG SER A 27 -16.530 -3.926 8.234 1.00 0.00 O ATOM 0 H SER A 27 -14.294 -3.858 8.252 1.00 0.00 H new ATOM 0 HA SER A 27 -14.887 -5.632 5.912 1.00 0.00 H new ATOM 0 HB2 SER A 27 -17.211 -4.755 6.463 1.00 0.00 H new ATOM 0 HB3 SER A 27 -16.505 -5.894 7.592 1.00 0.00 H new ATOM 0 HG SER A 27 -16.153 -3.071 7.939 1.00 0.00 H new ATOM 381 N PRO A 28 -14.762 -3.629 4.323 1.00 0.00 N ATOM 382 CA PRO A 28 -14.649 -2.498 3.432 1.00 0.00 C ATOM 383 C PRO A 28 -16.002 -2.017 2.979 1.00 0.00 C ATOM 384 O PRO A 28 -17.003 -2.715 3.106 1.00 0.00 O ATOM 385 CB PRO A 28 -13.824 -3.022 2.271 1.00 0.00 C ATOM 386 CG PRO A 28 -13.968 -4.554 2.302 1.00 0.00 C ATOM 387 CD PRO A 28 -14.550 -4.922 3.657 1.00 0.00 C ATOM 0 HA PRO A 28 -14.187 -1.635 3.911 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -14.181 -2.616 1.325 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.780 -2.727 2.371 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -14.619 -4.896 1.498 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -13.001 -5.035 2.155 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -15.484 -5.474 3.552 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -13.868 -5.555 4.225 1.00 0.00 H new ATOM 395 N SER A 29 -16.038 -0.815 2.444 1.00 0.00 N ATOM 396 CA SER A 29 -17.296 -0.231 1.961 1.00 0.00 C ATOM 397 C SER A 29 -16.973 0.976 1.112 1.00 0.00 C ATOM 398 O SER A 29 -15.933 1.594 1.272 1.00 0.00 O ATOM 399 CB SER A 29 -18.163 0.178 3.148 1.00 0.00 C ATOM 400 OG SER A 29 -17.429 1.067 3.979 1.00 0.00 O ATOM 0 H SER A 29 -15.221 -0.216 2.328 1.00 0.00 H new ATOM 0 HA SER A 29 -17.844 -0.962 1.366 1.00 0.00 H new ATOM 0 HB2 SER A 29 -19.076 0.659 2.798 1.00 0.00 H new ATOM 0 HB3 SER A 29 -18.464 -0.703 3.714 1.00 0.00 H new ATOM 0 HG SER A 29 -17.531 1.984 3.648 1.00 0.00 H new ATOM 406 N VAL A 30 -17.847 1.301 0.202 1.00 0.00 N ATOM 407 CA VAL A 30 -17.631 2.445 -0.690 1.00 0.00 C ATOM 408 C VAL A 30 -18.146 3.711 -0.004 1.00 0.00 C ATOM 409 O VAL A 30 -19.344 3.966 0.049 1.00 0.00 O ATOM 410 CB VAL A 30 -18.370 2.147 -1.986 1.00 0.00 C ATOM 411 CG1 VAL A 30 -18.408 3.385 -2.887 1.00 0.00 C ATOM 412 CG2 VAL A 30 -17.634 0.996 -2.703 1.00 0.00 C ATOM 0 H VAL A 30 -18.722 0.800 0.045 1.00 0.00 H new ATOM 0 HA VAL A 30 -16.576 2.606 -0.913 1.00 0.00 H new ATOM 0 HB VAL A 30 -19.399 1.864 -1.765 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -18.941 3.149 -3.808 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -18.920 4.196 -2.369 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -17.390 3.692 -3.126 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -18.145 0.763 -3.637 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -16.608 1.297 -2.916 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -17.628 0.114 -2.063 1.00 0.00 H new ATOM 422 N TRP A 31 -17.229 4.491 0.526 1.00 0.00 N ATOM 423 CA TRP A 31 -17.585 5.744 1.229 1.00 0.00 C ATOM 424 C TRP A 31 -18.085 6.779 0.231 1.00 0.00 C ATOM 425 O TRP A 31 -18.860 7.660 0.583 1.00 0.00 O ATOM 426 CB TRP A 31 -16.338 6.252 1.979 1.00 0.00 C ATOM 427 CG TRP A 31 -16.243 5.575 3.339 1.00 0.00 C ATOM 428 CD1 TRP A 31 -17.055 4.570 3.778 1.00 0.00 C ATOM 429 CD2 TRP A 31 -15.305 5.829 4.429 1.00 0.00 C ATOM 430 NE1 TRP A 31 -16.695 4.223 5.040 1.00 0.00 N ATOM 431 CE2 TRP A 31 -15.621 4.962 5.499 1.00 0.00 C ATOM 432 CE3 TRP A 31 -14.226 6.717 4.599 1.00 0.00 C ATOM 433 CZ2 TRP A 31 -14.905 4.981 6.691 1.00 0.00 C ATOM 434 CZ3 TRP A 31 -13.503 6.733 5.802 1.00 0.00 C ATOM 435 CH2 TRP A 31 -13.844 5.871 6.842 1.00 0.00 C ATOM 0 H TRP A 31 -16.228 4.296 0.493 1.00 0.00 H new ATOM 0 HA TRP A 31 -18.387 5.563 1.945 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -15.441 6.044 1.395 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -16.393 7.333 2.104 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -17.857 4.122 3.211 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -17.163 3.500 5.587 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -13.953 7.390 3.799 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -15.170 4.310 7.495 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -12.677 7.418 5.922 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -13.285 5.893 7.766 1.00 0.00 H new ATOM 446 N ALA A 32 -17.674 6.662 -1.023 1.00 0.00 N ATOM 447 CA ALA A 32 -18.154 7.629 -2.077 1.00 0.00 C ATOM 448 C ALA A 32 -17.553 7.290 -3.450 1.00 0.00 C ATOM 449 O ALA A 32 -16.535 7.850 -3.855 1.00 0.00 O ATOM 450 CB ALA A 32 -17.773 9.071 -1.686 1.00 0.00 C ATOM 0 H ALA A 32 -17.032 5.943 -1.357 1.00 0.00 H new ATOM 0 HA ALA A 32 -19.239 7.545 -2.144 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -18.124 9.761 -2.453 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -18.236 9.324 -0.732 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -16.690 9.149 -1.596 1.00 0.00 H new ATOM 456 N ALA A 33 -18.204 6.401 -4.188 1.00 0.00 N ATOM 457 CA ALA A 33 -17.718 6.042 -5.545 1.00 0.00 C ATOM 458 C ALA A 33 -18.795 6.398 -6.546 1.00 0.00 C ATOM 459 O ALA A 33 -19.962 6.083 -6.345 1.00 0.00 O ATOM 460 CB ALA A 33 -17.423 4.542 -5.650 1.00 0.00 C ATOM 0 H ALA A 33 -19.052 5.916 -3.894 1.00 0.00 H new ATOM 0 HA ALA A 33 -16.796 6.588 -5.745 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -17.069 4.310 -6.655 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -16.657 4.270 -4.924 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -18.333 3.977 -5.446 1.00 0.00 H new ATOM 466 N VAL A 34 -18.418 7.043 -7.634 1.00 0.00 N ATOM 467 CA VAL A 34 -19.426 7.428 -8.704 1.00 0.00 C ATOM 468 C VAL A 34 -20.284 6.155 -9.050 1.00 0.00 C ATOM 469 O VAL A 34 -19.737 5.172 -9.523 1.00 0.00 O ATOM 470 CB VAL A 34 -18.682 7.929 -9.955 1.00 0.00 C ATOM 471 CG1 VAL A 34 -19.694 8.375 -11.009 1.00 0.00 C ATOM 472 CG2 VAL A 34 -17.792 9.126 -9.586 1.00 0.00 C ATOM 0 H VAL A 34 -17.457 7.322 -7.833 1.00 0.00 H new ATOM 0 HA VAL A 34 -20.078 8.226 -8.348 1.00 0.00 H new ATOM 0 HB VAL A 34 -18.067 7.120 -10.349 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -19.165 8.729 -11.894 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -20.332 7.534 -11.280 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -20.308 9.181 -10.606 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -17.267 9.477 -10.475 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -18.411 9.930 -9.188 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -17.066 8.821 -8.833 1.00 0.00 H new ATOM 482 N PRO A 35 -21.605 6.190 -8.743 1.00 0.00 N ATOM 483 CA PRO A 35 -22.495 5.026 -8.955 1.00 0.00 C ATOM 484 C PRO A 35 -22.833 4.808 -10.430 1.00 0.00 C ATOM 485 O PRO A 35 -22.851 5.738 -11.222 1.00 0.00 O ATOM 486 CB PRO A 35 -23.759 5.376 -8.153 1.00 0.00 C ATOM 487 CG PRO A 35 -23.762 6.923 -7.996 1.00 0.00 C ATOM 488 CD PRO A 35 -22.299 7.380 -8.186 1.00 0.00 C ATOM 0 HA PRO A 35 -22.023 4.097 -8.635 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -24.655 5.036 -8.672 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -23.750 4.886 -7.179 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -24.414 7.388 -8.736 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -24.136 7.214 -7.014 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -22.234 8.231 -8.864 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -21.855 7.692 -7.241 1.00 0.00 H new ATOM 496 N GLY A 36 -23.123 3.558 -10.789 1.00 0.00 N ATOM 497 CA GLY A 36 -23.490 3.218 -12.202 1.00 0.00 C ATOM 498 C GLY A 36 -22.287 2.635 -12.958 1.00 0.00 C ATOM 499 O GLY A 36 -22.458 2.032 -14.012 1.00 0.00 O ATOM 0 H GLY A 36 -23.117 2.763 -10.150 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -24.309 2.499 -12.206 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -23.847 4.112 -12.714 1.00 0.00 H new ATOM 503 N LYS A 37 -21.067 2.837 -12.457 1.00 0.00 N ATOM 504 CA LYS A 37 -19.850 2.324 -13.177 1.00 0.00 C ATOM 505 C LYS A 37 -19.445 0.898 -12.729 1.00 0.00 C ATOM 506 O LYS A 37 -19.743 -0.073 -13.414 1.00 0.00 O ATOM 507 CB LYS A 37 -18.697 3.291 -12.930 1.00 0.00 C ATOM 508 CG LYS A 37 -18.816 4.470 -13.903 1.00 0.00 C ATOM 509 CD LYS A 37 -20.100 5.259 -13.616 1.00 0.00 C ATOM 510 CE LYS A 37 -19.925 6.706 -14.077 1.00 0.00 C ATOM 511 NZ LYS A 37 -21.244 7.401 -14.037 1.00 0.00 N ATOM 0 H LYS A 37 -20.875 3.333 -11.586 1.00 0.00 H new ATOM 0 HA LYS A 37 -20.088 2.262 -14.239 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -18.720 3.649 -11.901 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -17.743 2.783 -13.070 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -17.949 5.123 -13.804 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -18.825 4.105 -14.930 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -20.944 4.801 -14.133 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -20.326 5.231 -12.550 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -19.211 7.220 -13.434 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -19.519 6.731 -15.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -21.127 8.386 -14.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -21.912 6.914 -14.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -21.614 7.389 -13.065 1.00 0.00 H new ATOM 525 N THR A 38 -18.719 0.771 -11.613 1.00 0.00 N ATOM 526 CA THR A 38 -18.234 -0.599 -11.158 1.00 0.00 C ATOM 527 C THR A 38 -17.514 -0.506 -9.790 1.00 0.00 C ATOM 528 O THR A 38 -17.589 -1.416 -8.971 1.00 0.00 O ATOM 529 CB THR A 38 -17.263 -1.128 -12.274 1.00 0.00 C ATOM 530 OG1 THR A 38 -18.007 -1.879 -13.221 1.00 0.00 O ATOM 531 CG2 THR A 38 -16.087 -1.998 -11.718 1.00 0.00 C ATOM 0 H THR A 38 -18.447 1.546 -11.009 1.00 0.00 H new ATOM 0 HA THR A 38 -19.072 -1.282 -11.020 1.00 0.00 H new ATOM 0 HB THR A 38 -16.807 -0.254 -12.739 1.00 0.00 H new ATOM 0 HG1 THR A 38 -18.818 -1.386 -13.465 1.00 0.00 H new ATOM 0 HG21 THR A 38 -15.457 -2.329 -12.544 1.00 0.00 H new ATOM 0 HG22 THR A 38 -15.492 -1.405 -11.023 1.00 0.00 H new ATOM 0 HG23 THR A 38 -16.491 -2.867 -11.199 1.00 0.00 H new ATOM 539 N PHE A 39 -16.788 0.558 -9.588 1.00 0.00 N ATOM 540 CA PHE A 39 -15.987 0.753 -8.341 1.00 0.00 C ATOM 541 C PHE A 39 -16.848 0.731 -7.094 1.00 0.00 C ATOM 542 O PHE A 39 -16.463 0.176 -6.092 1.00 0.00 O ATOM 543 CB PHE A 39 -15.338 2.103 -8.407 1.00 0.00 C ATOM 544 CG PHE A 39 -14.119 2.107 -9.323 1.00 0.00 C ATOM 545 CD1 PHE A 39 -14.027 1.241 -10.433 1.00 0.00 C ATOM 546 CD2 PHE A 39 -13.073 2.998 -9.053 1.00 0.00 C ATOM 547 CE1 PHE A 39 -12.912 1.270 -11.244 1.00 0.00 C ATOM 548 CE2 PHE A 39 -11.951 3.020 -9.872 1.00 0.00 C ATOM 549 CZ PHE A 39 -11.876 2.143 -10.974 1.00 0.00 C ATOM 0 H PHE A 39 -16.713 1.326 -10.255 1.00 0.00 H new ATOM 0 HA PHE A 39 -15.264 -0.061 -8.281 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -16.062 2.836 -8.763 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -15.039 2.411 -7.405 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -14.832 0.554 -10.648 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -13.138 3.668 -8.208 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -12.848 0.607 -12.094 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -11.141 3.704 -9.666 1.00 0.00 H new ATOM 0 HZ PHE A 39 -11.004 2.154 -11.610 1.00 0.00 H new ATOM 559 N VAL A 40 -17.980 1.383 -7.147 1.00 0.00 N ATOM 560 CA VAL A 40 -18.902 1.477 -5.962 1.00 0.00 C ATOM 561 C VAL A 40 -19.239 0.065 -5.458 1.00 0.00 C ATOM 562 O VAL A 40 -19.578 -0.118 -4.293 1.00 0.00 O ATOM 563 CB VAL A 40 -20.190 2.257 -6.356 1.00 0.00 C ATOM 564 CG1 VAL A 40 -20.682 1.782 -7.714 1.00 0.00 C ATOM 565 CG2 VAL A 40 -21.289 2.037 -5.296 1.00 0.00 C ATOM 0 H VAL A 40 -18.317 1.867 -7.979 1.00 0.00 H new ATOM 0 HA VAL A 40 -18.411 2.021 -5.155 1.00 0.00 H new ATOM 0 HB VAL A 40 -19.958 3.321 -6.408 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.584 2.330 -7.986 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -19.910 1.958 -8.463 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.906 0.716 -7.668 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -22.185 2.587 -5.582 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -21.522 0.974 -5.228 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -20.937 2.394 -4.328 1.00 0.00 H new ATOM 575 N ASN A 41 -19.125 -0.932 -6.319 1.00 0.00 N ATOM 576 CA ASN A 41 -19.408 -2.322 -5.906 1.00 0.00 C ATOM 577 C ASN A 41 -18.112 -2.959 -5.355 1.00 0.00 C ATOM 578 O ASN A 41 -17.925 -4.172 -5.426 1.00 0.00 O ATOM 579 CB ASN A 41 -19.907 -3.100 -7.107 1.00 0.00 C ATOM 580 CG ASN A 41 -21.428 -2.968 -7.204 1.00 0.00 C ATOM 581 OD1 ASN A 41 -22.144 -3.414 -6.332 1.00 0.00 O ATOM 582 ND2 ASN A 41 -21.958 -2.370 -8.237 1.00 0.00 N ATOM 0 H ASN A 41 -18.845 -0.823 -7.294 1.00 0.00 H new ATOM 0 HA ASN A 41 -20.171 -2.339 -5.127 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -19.440 -2.724 -8.017 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -19.627 -4.150 -7.016 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -22.971 -2.279 -8.309 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -21.359 -1.994 -8.972 1.00 0.00 H new ATOM 589 N ILE A 42 -17.200 -2.135 -4.811 1.00 0.00 N ATOM 590 CA ILE A 42 -15.918 -2.663 -4.273 1.00 0.00 C ATOM 591 C ILE A 42 -16.168 -3.432 -2.927 1.00 0.00 C ATOM 592 O ILE A 42 -16.646 -2.886 -1.948 1.00 0.00 O ATOM 593 CB ILE A 42 -14.923 -1.465 -4.086 1.00 0.00 C ATOM 594 CG1 ILE A 42 -14.143 -1.265 -5.390 1.00 0.00 C ATOM 595 CG2 ILE A 42 -13.921 -1.722 -2.939 1.00 0.00 C ATOM 596 CD1 ILE A 42 -13.552 0.148 -5.425 1.00 0.00 C ATOM 0 H ILE A 42 -17.314 -1.125 -4.729 1.00 0.00 H new ATOM 0 HA ILE A 42 -15.479 -3.377 -4.970 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.504 -0.578 -3.834 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -13.346 -2.005 -5.466 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -14.801 -1.416 -6.246 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -13.250 -0.868 -2.844 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -14.465 -1.862 -2.005 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -13.339 -2.617 -3.158 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -12.998 0.288 -6.353 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -14.357 0.881 -5.369 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -12.880 0.282 -4.577 1.00 0.00 H new ATOM 608 N THR A 43 -15.806 -4.680 -2.929 1.00 0.00 N ATOM 609 CA THR A 43 -15.927 -5.598 -1.738 1.00 0.00 C ATOM 610 C THR A 43 -14.495 -5.805 -1.153 1.00 0.00 C ATOM 611 O THR A 43 -13.549 -5.291 -1.722 1.00 0.00 O ATOM 612 CB THR A 43 -16.480 -6.945 -2.283 1.00 0.00 C ATOM 613 OG1 THR A 43 -15.875 -7.245 -3.539 1.00 0.00 O ATOM 614 CG2 THR A 43 -17.989 -6.836 -2.467 1.00 0.00 C ATOM 0 H THR A 43 -15.407 -5.136 -3.750 1.00 0.00 H new ATOM 0 HA THR A 43 -16.580 -5.201 -0.960 1.00 0.00 H new ATOM 0 HB THR A 43 -16.251 -7.739 -1.572 1.00 0.00 H new ATOM 0 HG1 THR A 43 -16.541 -7.156 -4.252 1.00 0.00 H new ATOM 0 HG21 THR A 43 -18.378 -7.780 -2.849 1.00 0.00 H new ATOM 0 HG22 THR A 43 -18.457 -6.612 -1.508 1.00 0.00 H new ATOM 0 HG23 THR A 43 -18.212 -6.038 -3.175 1.00 0.00 H new ATOM 622 N PRO A 44 -14.341 -6.594 -0.053 1.00 0.00 N ATOM 623 CA PRO A 44 -12.994 -6.874 0.517 1.00 0.00 C ATOM 624 C PRO A 44 -12.152 -7.776 -0.399 1.00 0.00 C ATOM 625 O PRO A 44 -11.005 -8.083 -0.093 1.00 0.00 O ATOM 626 CB PRO A 44 -13.275 -7.546 1.843 1.00 0.00 C ATOM 627 CG PRO A 44 -14.724 -8.095 1.769 1.00 0.00 C ATOM 628 CD PRO A 44 -15.451 -7.245 0.701 1.00 0.00 C ATOM 0 HA PRO A 44 -12.407 -5.962 0.628 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -12.565 -8.353 2.026 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -13.171 -6.838 2.665 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -14.727 -9.150 1.496 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -15.221 -8.014 2.736 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -16.068 -7.864 0.049 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -16.111 -6.507 1.158 1.00 0.00 H new ATOM 636 N ALA A 45 -12.701 -8.166 -1.515 1.00 0.00 N ATOM 637 CA ALA A 45 -11.965 -9.017 -2.498 1.00 0.00 C ATOM 638 C ALA A 45 -11.117 -8.095 -3.357 1.00 0.00 C ATOM 639 O ALA A 45 -9.873 -8.133 -3.347 1.00 0.00 O ATOM 640 CB ALA A 45 -12.987 -9.741 -3.372 1.00 0.00 C ATOM 0 H ALA A 45 -13.652 -7.926 -1.795 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.334 -9.751 -1.997 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -12.467 -10.368 -4.097 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -13.625 -10.364 -2.745 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.599 -9.009 -3.899 1.00 0.00 H new ATOM 646 N GLU A 46 -11.795 -7.246 -4.076 1.00 0.00 N ATOM 647 CA GLU A 46 -11.102 -6.235 -4.961 1.00 0.00 C ATOM 648 C GLU A 46 -10.241 -5.329 -4.084 1.00 0.00 C ATOM 649 O GLU A 46 -9.151 -4.926 -4.470 1.00 0.00 O ATOM 650 CB GLU A 46 -12.123 -5.389 -5.788 1.00 0.00 C ATOM 651 CG GLU A 46 -13.451 -5.225 -5.074 1.00 0.00 C ATOM 652 CD GLU A 46 -14.479 -6.207 -5.663 1.00 0.00 C ATOM 653 OE1 GLU A 46 -14.174 -7.386 -5.731 1.00 0.00 O ATOM 654 OE2 GLU A 46 -15.550 -5.757 -6.037 1.00 0.00 O ATOM 0 H GLU A 46 -12.814 -7.199 -4.097 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.478 -6.766 -5.680 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.698 -4.406 -5.989 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -12.289 -5.867 -6.753 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -13.327 -5.410 -4.007 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -13.809 -4.201 -5.181 1.00 0.00 H new ATOM 661 N VAL A 47 -10.705 -5.071 -2.878 1.00 0.00 N ATOM 662 CA VAL A 47 -9.938 -4.271 -1.897 1.00 0.00 C ATOM 663 C VAL A 47 -8.898 -5.159 -1.201 1.00 0.00 C ATOM 664 O VAL A 47 -7.901 -4.668 -0.707 1.00 0.00 O ATOM 665 CB VAL A 47 -10.943 -3.568 -0.934 1.00 0.00 C ATOM 666 CG1 VAL A 47 -10.423 -3.445 0.457 1.00 0.00 C ATOM 667 CG2 VAL A 47 -11.111 -2.113 -1.388 1.00 0.00 C ATOM 0 H VAL A 47 -11.609 -5.397 -2.537 1.00 0.00 H new ATOM 0 HA VAL A 47 -9.364 -3.480 -2.380 1.00 0.00 H new ATOM 0 HB VAL A 47 -11.854 -4.166 -0.954 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.166 -2.948 1.081 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.218 -4.438 0.858 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -9.504 -2.859 0.451 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.811 -1.604 -0.726 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -10.146 -1.607 -1.354 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -11.495 -2.092 -2.408 1.00 0.00 H new ATOM 677 N GLY A 48 -9.119 -6.457 -1.188 1.00 0.00 N ATOM 678 CA GLY A 48 -8.145 -7.398 -0.557 1.00 0.00 C ATOM 679 C GLY A 48 -6.812 -7.315 -1.287 1.00 0.00 C ATOM 680 O GLY A 48 -5.773 -7.531 -0.702 1.00 0.00 O ATOM 0 H GLY A 48 -9.942 -6.903 -1.593 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.011 -7.148 0.495 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.530 -8.417 -0.596 1.00 0.00 H new ATOM 684 N VAL A 49 -6.848 -7.008 -2.568 1.00 0.00 N ATOM 685 CA VAL A 49 -5.570 -6.892 -3.377 1.00 0.00 C ATOM 686 C VAL A 49 -5.166 -5.422 -3.503 1.00 0.00 C ATOM 687 O VAL A 49 -3.986 -5.098 -3.532 1.00 0.00 O ATOM 688 CB VAL A 49 -5.734 -7.534 -4.772 1.00 0.00 C ATOM 689 CG1 VAL A 49 -6.820 -6.801 -5.581 1.00 0.00 C ATOM 690 CG2 VAL A 49 -4.379 -7.468 -5.529 1.00 0.00 C ATOM 0 H VAL A 49 -7.704 -6.832 -3.094 1.00 0.00 H new ATOM 0 HA VAL A 49 -4.780 -7.433 -2.855 1.00 0.00 H new ATOM 0 HB VAL A 49 -6.038 -8.574 -4.650 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -6.921 -7.268 -6.561 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -7.771 -6.860 -5.051 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -6.538 -5.755 -5.705 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.490 -7.920 -6.514 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -4.074 -6.427 -5.640 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -3.620 -8.010 -4.965 1.00 0.00 H new ATOM 700 N LEU A 50 -6.133 -4.531 -3.520 1.00 0.00 N ATOM 701 CA LEU A 50 -5.851 -3.067 -3.571 1.00 0.00 C ATOM 702 C LEU A 50 -5.225 -2.622 -2.258 1.00 0.00 C ATOM 703 O LEU A 50 -4.747 -1.498 -2.138 1.00 0.00 O ATOM 704 CB LEU A 50 -7.187 -2.334 -3.684 1.00 0.00 C ATOM 705 CG LEU A 50 -7.630 -2.065 -5.109 1.00 0.00 C ATOM 706 CD1 LEU A 50 -9.158 -1.860 -5.101 1.00 0.00 C ATOM 707 CD2 LEU A 50 -6.974 -0.773 -5.600 1.00 0.00 C ATOM 0 H LEU A 50 -7.125 -4.768 -3.500 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.187 -2.854 -4.409 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -7.955 -2.922 -3.182 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -7.114 -1.385 -3.153 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.350 -2.896 -5.757 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -9.504 -1.664 -6.116 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -9.644 -2.758 -4.719 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -9.408 -1.013 -4.463 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.288 -0.572 -6.624 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.277 0.055 -4.959 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.890 -0.880 -5.567 1.00 0.00 H new ATOM 719 N VAL A 51 -5.355 -3.451 -1.237 1.00 0.00 N ATOM 720 CA VAL A 51 -4.913 -3.047 0.129 1.00 0.00 C ATOM 721 C VAL A 51 -4.344 -4.249 0.929 1.00 0.00 C ATOM 722 O VAL A 51 -3.844 -4.068 2.035 1.00 0.00 O ATOM 723 CB VAL A 51 -6.199 -2.418 0.848 1.00 0.00 C ATOM 724 CG1 VAL A 51 -7.142 -1.752 -0.196 1.00 0.00 C ATOM 725 CG2 VAL A 51 -7.034 -3.492 1.600 1.00 0.00 C ATOM 0 H VAL A 51 -5.750 -4.389 -1.301 1.00 0.00 H new ATOM 0 HA VAL A 51 -4.100 -2.323 0.075 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.818 -1.685 1.559 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -8.009 -1.331 0.313 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -6.606 -0.958 -0.716 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -7.472 -2.500 -0.917 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.895 -3.019 2.072 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.377 -4.247 0.893 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.416 -3.964 2.364 1.00 0.00 H new ATOM 735 N GLY A 52 -4.406 -5.464 0.384 1.00 0.00 N ATOM 736 CA GLY A 52 -3.867 -6.652 1.105 1.00 0.00 C ATOM 737 C GLY A 52 -2.408 -6.413 1.456 1.00 0.00 C ATOM 738 O GLY A 52 -1.848 -5.356 1.174 1.00 0.00 O ATOM 0 H GLY A 52 -4.810 -5.665 -0.531 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -4.445 -6.834 2.011 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -3.961 -7.542 0.483 1.00 0.00 H new ATOM 822 N PHE A 58 0.373 -8.893 -7.353 1.00 0.00 N ATOM 823 CA PHE A 58 -0.543 -7.854 -8.016 1.00 0.00 C ATOM 824 C PHE A 58 0.187 -6.645 -8.643 1.00 0.00 C ATOM 825 O PHE A 58 -0.377 -6.003 -9.517 1.00 0.00 O ATOM 826 CB PHE A 58 -1.662 -7.393 -7.045 1.00 0.00 C ATOM 827 CG PHE A 58 -1.184 -6.404 -6.006 1.00 0.00 C ATOM 828 CD1 PHE A 58 -0.899 -5.087 -6.367 1.00 0.00 C ATOM 829 CD2 PHE A 58 -1.086 -6.799 -4.664 1.00 0.00 C ATOM 830 CE1 PHE A 58 -0.524 -4.167 -5.397 1.00 0.00 C ATOM 831 CE2 PHE A 58 -0.697 -5.873 -3.692 1.00 0.00 C ATOM 832 CZ PHE A 58 -0.421 -4.562 -4.058 1.00 0.00 C ATOM 0 HA PHE A 58 -0.993 -8.376 -8.860 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.470 -6.942 -7.621 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -2.078 -8.265 -6.541 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -0.970 -4.783 -7.401 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.311 -7.817 -4.382 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -0.312 -3.145 -5.676 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -0.611 -6.176 -2.659 1.00 0.00 H new ATOM 0 HZ PHE A 58 -0.126 -3.845 -3.307 1.00 0.00 H new ATOM 842 N TYR A 59 1.399 -6.293 -8.222 1.00 0.00 N ATOM 843 CA TYR A 59 2.075 -5.093 -8.859 1.00 0.00 C ATOM 844 C TYR A 59 2.307 -5.269 -10.357 1.00 0.00 C ATOM 845 O TYR A 59 2.697 -4.321 -11.031 1.00 0.00 O ATOM 846 CB TYR A 59 3.418 -4.760 -8.214 1.00 0.00 C ATOM 847 CG TYR A 59 3.321 -4.639 -6.728 1.00 0.00 C ATOM 848 CD1 TYR A 59 2.362 -3.821 -6.159 1.00 0.00 C ATOM 849 CD2 TYR A 59 4.242 -5.305 -5.927 1.00 0.00 C ATOM 850 CE1 TYR A 59 2.316 -3.662 -4.766 1.00 0.00 C ATOM 851 CE2 TYR A 59 4.195 -5.162 -4.541 1.00 0.00 C ATOM 852 CZ TYR A 59 3.232 -4.338 -3.958 1.00 0.00 C ATOM 853 OH TYR A 59 3.191 -4.185 -2.587 1.00 0.00 O ATOM 0 H TYR A 59 1.932 -6.766 -7.492 1.00 0.00 H new ATOM 0 HA TYR A 59 1.376 -4.273 -8.693 1.00 0.00 H new ATOM 0 HB2 TYR A 59 4.141 -5.535 -8.466 1.00 0.00 H new ATOM 0 HB3 TYR A 59 3.795 -3.825 -8.628 1.00 0.00 H new ATOM 0 HD1 TYR A 59 1.650 -3.305 -6.786 1.00 0.00 H new ATOM 0 HD2 TYR A 59 4.995 -5.934 -6.379 1.00 0.00 H new ATOM 0 HE1 TYR A 59 1.573 -3.018 -4.319 1.00 0.00 H new ATOM 0 HE2 TYR A 59 4.904 -5.689 -3.919 1.00 0.00 H new ATOM 0 HH TYR A 59 3.897 -4.726 -2.176 1.00 0.00 H new ATOM 863 N VAL A 60 2.119 -6.450 -10.872 1.00 0.00 N ATOM 864 CA VAL A 60 2.368 -6.707 -12.305 1.00 0.00 C ATOM 865 C VAL A 60 1.122 -7.256 -12.993 1.00 0.00 C ATOM 866 O VAL A 60 0.893 -6.975 -14.167 1.00 0.00 O ATOM 867 CB VAL A 60 3.502 -7.708 -12.436 1.00 0.00 C ATOM 868 CG1 VAL A 60 4.827 -6.981 -12.255 1.00 0.00 C ATOM 869 CG2 VAL A 60 3.385 -8.821 -11.377 1.00 0.00 C ATOM 0 H VAL A 60 1.796 -7.261 -10.344 1.00 0.00 H new ATOM 0 HA VAL A 60 2.633 -5.766 -12.787 1.00 0.00 H new ATOM 0 HB VAL A 60 3.449 -8.167 -13.423 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.648 -7.692 -12.347 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.927 -6.210 -13.019 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.857 -6.519 -11.268 1.00 0.00 H new ATOM 0 HG21 VAL A 60 4.210 -9.523 -11.495 1.00 0.00 H new ATOM 0 HG22 VAL A 60 3.423 -8.381 -10.381 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.439 -9.347 -11.505 1.00 0.00 H new ATOM 879 N ASN A 61 0.309 -8.037 -12.284 1.00 0.00 N ATOM 880 CA ASN A 61 -0.914 -8.594 -12.907 1.00 0.00 C ATOM 881 C ASN A 61 -2.005 -7.546 -12.833 1.00 0.00 C ATOM 882 O ASN A 61 -2.725 -7.316 -13.799 1.00 0.00 O ATOM 883 CB ASN A 61 -1.324 -9.905 -12.221 1.00 0.00 C ATOM 884 CG ASN A 61 -1.614 -9.720 -10.747 1.00 0.00 C ATOM 885 OD1 ASN A 61 -2.511 -8.996 -10.370 1.00 0.00 O ATOM 886 ND2 ASN A 61 -0.900 -10.385 -9.882 1.00 0.00 N ATOM 0 H ASN A 61 0.457 -8.298 -11.309 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.729 -8.838 -13.953 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -2.208 -10.309 -12.714 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -0.528 -10.640 -12.342 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -1.095 -10.297 -8.885 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -0.146 -10.993 -10.203 1.00 0.00 H new ATOM 893 N GLY A 62 -2.093 -6.868 -11.709 1.00 0.00 N ATOM 894 CA GLY A 62 -3.082 -5.773 -11.552 1.00 0.00 C ATOM 895 C GLY A 62 -4.080 -6.058 -10.450 1.00 0.00 C ATOM 896 O GLY A 62 -4.537 -7.179 -10.270 1.00 0.00 O ATOM 0 H GLY A 62 -1.510 -7.037 -10.889 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -2.559 -4.842 -11.334 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -3.613 -5.628 -12.493 1.00 0.00 H new ATOM 900 N LEU A 63 -4.433 -5.010 -9.718 1.00 0.00 N ATOM 901 CA LEU A 63 -5.416 -5.128 -8.620 1.00 0.00 C ATOM 902 C LEU A 63 -6.766 -5.455 -9.237 1.00 0.00 C ATOM 903 O LEU A 63 -6.835 -5.994 -10.336 1.00 0.00 O ATOM 904 CB LEU A 63 -5.507 -3.786 -7.844 1.00 0.00 C ATOM 905 CG LEU A 63 -4.136 -3.311 -7.415 1.00 0.00 C ATOM 906 CD1 LEU A 63 -4.205 -1.798 -7.119 1.00 0.00 C ATOM 907 CD2 LEU A 63 -3.737 -4.073 -6.162 1.00 0.00 C ATOM 0 H LEU A 63 -4.063 -4.069 -9.854 1.00 0.00 H new ATOM 0 HA LEU A 63 -5.113 -5.910 -7.924 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.977 -3.030 -8.473 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -6.143 -3.912 -6.967 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.400 -3.488 -8.199 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -3.222 -1.443 -6.808 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.516 -1.265 -8.018 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.925 -1.616 -6.322 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.750 -3.745 -5.836 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.463 -3.880 -5.372 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.711 -5.141 -6.378 1.00 0.00 H new ATOM 919 N THR A 64 -7.834 -5.116 -8.552 1.00 0.00 N ATOM 920 CA THR A 64 -9.172 -5.372 -9.041 1.00 0.00 C ATOM 921 C THR A 64 -10.070 -4.453 -8.310 1.00 0.00 C ATOM 922 O THR A 64 -10.005 -4.370 -7.103 1.00 0.00 O ATOM 923 CB THR A 64 -9.571 -6.809 -8.745 1.00 0.00 C ATOM 924 OG1 THR A 64 -9.233 -7.128 -7.406 1.00 0.00 O ATOM 925 CG2 THR A 64 -8.828 -7.730 -9.681 1.00 0.00 C ATOM 0 H THR A 64 -7.802 -4.656 -7.642 1.00 0.00 H new ATOM 0 HA THR A 64 -9.229 -5.218 -10.119 1.00 0.00 H new ATOM 0 HB THR A 64 -10.645 -6.928 -8.885 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.492 -8.054 -7.215 1.00 0.00 H new ATOM 0 HG21 THR A 64 -9.109 -8.763 -9.475 1.00 0.00 H new ATOM 0 HG22 THR A 64 -9.083 -7.484 -10.712 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.755 -7.610 -9.534 1.00 0.00 H new ATOM 933 N LEU A 65 -10.867 -3.747 -9.019 1.00 0.00 N ATOM 934 CA LEU A 65 -11.809 -2.783 -8.391 1.00 0.00 C ATOM 935 C LEU A 65 -13.199 -2.936 -8.997 1.00 0.00 C ATOM 936 O LEU A 65 -13.471 -2.522 -10.107 1.00 0.00 O ATOM 937 CB LEU A 65 -11.284 -1.344 -8.492 1.00 0.00 C ATOM 938 CG LEU A 65 -10.390 -1.125 -9.732 1.00 0.00 C ATOM 939 CD1 LEU A 65 -11.215 -1.191 -11.006 1.00 0.00 C ATOM 940 CD2 LEU A 65 -9.723 0.250 -9.621 1.00 0.00 C ATOM 0 H LEU A 65 -10.917 -3.788 -10.037 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.885 -3.010 -7.328 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.128 -0.655 -8.530 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.717 -1.104 -7.593 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.634 -1.909 -9.773 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.566 -1.034 -11.868 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -11.689 -2.169 -11.082 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.982 -0.417 -10.983 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.088 0.418 -10.491 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.490 1.024 -9.577 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.116 0.288 -8.716 1.00 0.00 H new ATOM 952 N GLY A 66 -14.074 -3.576 -8.251 1.00 0.00 N ATOM 953 CA GLY A 66 -15.466 -3.823 -8.715 1.00 0.00 C ATOM 954 C GLY A 66 -15.438 -4.903 -9.798 1.00 0.00 C ATOM 955 O GLY A 66 -16.311 -4.955 -10.654 1.00 0.00 O ATOM 0 H GLY A 66 -13.869 -3.942 -7.321 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -16.092 -4.141 -7.881 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -15.902 -2.905 -9.108 1.00 0.00 H new ATOM 959 N GLY A 67 -14.422 -5.771 -9.764 1.00 0.00 N ATOM 960 CA GLY A 67 -14.302 -6.854 -10.780 1.00 0.00 C ATOM 961 C GLY A 67 -13.478 -6.363 -11.981 1.00 0.00 C ATOM 962 O GLY A 67 -13.421 -7.036 -13.002 1.00 0.00 O ATOM 0 H GLY A 67 -13.679 -5.758 -9.065 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -13.826 -7.729 -10.336 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -15.293 -7.164 -11.111 1.00 0.00 H new ATOM 966 N GLN A 68 -12.830 -5.185 -11.878 1.00 0.00 N ATOM 967 CA GLN A 68 -12.006 -4.671 -13.055 1.00 0.00 C ATOM 968 C GLN A 68 -10.506 -4.750 -12.728 1.00 0.00 C ATOM 969 O GLN A 68 -9.983 -3.980 -11.945 1.00 0.00 O ATOM 970 CB GLN A 68 -12.431 -3.241 -13.386 1.00 0.00 C ATOM 971 CG GLN A 68 -11.330 -2.446 -14.170 1.00 0.00 C ATOM 972 CD GLN A 68 -10.839 -3.253 -15.388 1.00 0.00 C ATOM 973 OE1 GLN A 68 -11.606 -3.960 -16.011 1.00 0.00 O ATOM 974 NE2 GLN A 68 -9.575 -3.173 -15.752 1.00 0.00 N ATOM 0 H GLN A 68 -12.840 -4.582 -11.055 1.00 0.00 H new ATOM 0 HA GLN A 68 -12.186 -5.295 -13.930 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -13.345 -3.267 -13.979 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -12.665 -2.713 -12.461 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -11.732 -1.488 -14.500 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -10.491 -2.229 -13.509 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -8.930 -2.580 -15.230 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.241 -3.704 -16.556 1.00 0.00 H new ATOM 983 N LYS A 69 -9.834 -5.676 -13.347 1.00 0.00 N ATOM 984 CA LYS A 69 -8.365 -5.858 -13.123 1.00 0.00 C ATOM 985 C LYS A 69 -7.582 -4.669 -13.707 1.00 0.00 C ATOM 986 O LYS A 69 -7.508 -4.507 -14.918 1.00 0.00 O ATOM 987 CB LYS A 69 -7.908 -7.155 -13.819 1.00 0.00 C ATOM 988 CG LYS A 69 -7.150 -8.046 -12.825 1.00 0.00 C ATOM 989 CD LYS A 69 -7.586 -9.500 -13.009 1.00 0.00 C ATOM 990 CE LYS A 69 -6.423 -10.436 -12.659 1.00 0.00 C ATOM 991 NZ LYS A 69 -6.453 -10.738 -11.202 1.00 0.00 N ATOM 0 H LYS A 69 -10.244 -6.330 -14.013 1.00 0.00 H new ATOM 0 HA LYS A 69 -8.173 -5.916 -12.052 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -8.772 -7.690 -14.213 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -7.267 -6.916 -14.667 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -6.076 -7.954 -12.984 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -7.350 -7.722 -11.804 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -8.444 -9.716 -12.372 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -7.903 -9.667 -14.038 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -6.498 -11.359 -13.234 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.474 -9.971 -12.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -5.665 -11.373 -10.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -6.361 -9.854 -10.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -7.354 -11.199 -10.961 1.00 0.00 H new ATOM 1005 N CYS A 70 -6.955 -3.861 -12.849 1.00 0.00 N ATOM 1006 CA CYS A 70 -6.126 -2.711 -13.343 1.00 0.00 C ATOM 1007 C CYS A 70 -4.711 -2.997 -12.934 1.00 0.00 C ATOM 1008 O CYS A 70 -4.477 -3.473 -11.854 1.00 0.00 O ATOM 1009 CB CYS A 70 -6.595 -1.420 -12.738 1.00 0.00 C ATOM 1010 SG CYS A 70 -6.937 -1.609 -10.962 1.00 0.00 S ATOM 0 H CYS A 70 -6.990 -3.959 -11.834 1.00 0.00 H new ATOM 0 HA CYS A 70 -6.210 -2.607 -14.425 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -5.837 -0.651 -12.885 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -7.496 -1.082 -13.250 1.00 0.00 H new ATOM 0 HG CYS A 70 -7.849 -2.519 -10.790 1.00 0.00 H new ATOM 1016 N SER A 71 -3.781 -2.776 -13.814 1.00 0.00 N ATOM 1017 CA SER A 71 -2.333 -3.130 -13.505 1.00 0.00 C ATOM 1018 C SER A 71 -1.546 -1.968 -12.949 1.00 0.00 C ATOM 1019 O SER A 71 -1.265 -1.004 -13.636 1.00 0.00 O ATOM 1020 CB SER A 71 -1.660 -3.663 -14.752 1.00 0.00 C ATOM 1021 OG SER A 71 -1.029 -2.631 -15.485 1.00 0.00 O ATOM 0 H SER A 71 -3.939 -2.368 -14.735 1.00 0.00 H new ATOM 0 HA SER A 71 -2.350 -3.896 -12.730 1.00 0.00 H new ATOM 0 HB2 SER A 71 -0.923 -4.416 -14.474 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.399 -4.158 -15.382 1.00 0.00 H new ATOM 0 HG SER A 71 -1.317 -1.761 -15.139 1.00 0.00 H new ATOM 1027 N VAL A 72 -1.135 -2.097 -11.714 1.00 0.00 N ATOM 1028 CA VAL A 72 -0.309 -1.048 -11.052 1.00 0.00 C ATOM 1029 C VAL A 72 0.851 -0.661 -11.935 1.00 0.00 C ATOM 1030 O VAL A 72 1.527 -1.502 -12.516 1.00 0.00 O ATOM 1031 CB VAL A 72 0.281 -1.541 -9.732 1.00 0.00 C ATOM 1032 CG1 VAL A 72 0.681 -0.330 -8.877 1.00 0.00 C ATOM 1033 CG2 VAL A 72 -0.721 -2.405 -8.960 1.00 0.00 C ATOM 0 H VAL A 72 -1.343 -2.904 -11.126 1.00 0.00 H new ATOM 0 HA VAL A 72 -0.970 -0.201 -10.870 1.00 0.00 H new ATOM 0 HB VAL A 72 1.155 -2.154 -9.952 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.103 -0.675 -7.933 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.423 0.263 -9.411 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -0.199 0.282 -8.679 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -0.269 -2.739 -8.026 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -1.614 -1.819 -8.742 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -0.993 -3.272 -9.562 1.00 0.00 H new ATOM 1043 N ILE A 73 1.089 0.599 -11.991 1.00 0.00 N ATOM 1044 CA ILE A 73 2.195 1.147 -12.759 1.00 0.00 C ATOM 1045 C ILE A 73 2.948 2.107 -11.807 1.00 0.00 C ATOM 1046 O ILE A 73 2.812 3.304 -11.823 1.00 0.00 O ATOM 1047 CB ILE A 73 1.694 1.819 -14.057 1.00 0.00 C ATOM 1048 CG1 ILE A 73 1.528 0.727 -15.170 1.00 0.00 C ATOM 1049 CG2 ILE A 73 2.679 2.900 -14.554 1.00 0.00 C ATOM 1050 CD1 ILE A 73 0.087 0.713 -15.721 1.00 0.00 C ATOM 0 H ILE A 73 0.529 1.301 -11.508 1.00 0.00 H new ATOM 0 HA ILE A 73 2.879 0.372 -13.106 1.00 0.00 H new ATOM 0 HB ILE A 73 0.739 2.300 -13.843 1.00 0.00 H new ATOM 0 HG12 ILE A 73 2.229 0.920 -15.982 1.00 0.00 H new ATOM 0 HG13 ILE A 73 1.775 -0.253 -14.762 1.00 0.00 H new ATOM 0 HG21 ILE A 73 2.294 3.351 -15.469 1.00 0.00 H new ATOM 0 HG22 ILE A 73 2.791 3.669 -13.790 1.00 0.00 H new ATOM 0 HG23 ILE A 73 3.648 2.444 -14.755 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -0.001 -0.053 -16.491 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.610 0.495 -14.912 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -0.148 1.687 -16.150 1.00 0.00 H new ATOM 1062 N ARG A 74 3.663 1.500 -10.949 1.00 0.00 N ATOM 1063 CA ARG A 74 4.489 2.173 -9.873 1.00 0.00 C ATOM 1064 C ARG A 74 3.621 2.337 -8.655 1.00 0.00 C ATOM 1065 O ARG A 74 2.959 3.353 -8.469 1.00 0.00 O ATOM 1066 CB ARG A 74 5.069 3.539 -10.342 1.00 0.00 C ATOM 1067 CG ARG A 74 6.585 3.575 -10.087 1.00 0.00 C ATOM 1068 CD ARG A 74 6.871 4.124 -8.688 1.00 0.00 C ATOM 1069 NE ARG A 74 7.959 3.324 -8.058 1.00 0.00 N ATOM 1070 CZ ARG A 74 9.131 3.862 -7.855 1.00 0.00 C ATOM 1071 NH1 ARG A 74 9.287 4.741 -6.905 1.00 0.00 N ATOM 1072 NH2 ARG A 74 10.145 3.522 -8.603 1.00 0.00 N ATOM 0 H ARG A 74 3.734 0.483 -10.923 1.00 0.00 H new ATOM 0 HA ARG A 74 5.352 1.549 -9.640 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.866 3.686 -11.403 1.00 0.00 H new ATOM 0 HB3 ARG A 74 4.581 4.354 -9.808 1.00 0.00 H new ATOM 0 HG2 ARG A 74 7.002 2.573 -10.185 1.00 0.00 H new ATOM 0 HG3 ARG A 74 7.073 4.198 -10.837 1.00 0.00 H new ATOM 0 HD2 ARG A 74 7.163 5.172 -8.749 1.00 0.00 H new ATOM 0 HD3 ARG A 74 5.970 4.079 -8.076 1.00 0.00 H new ATOM 0 HE ARG A 74 7.788 2.356 -7.785 1.00 0.00 H new ATOM 0 HH11 ARG A 74 8.494 5.007 -6.322 1.00 0.00 H new ATOM 0 HH12 ARG A 74 10.202 5.162 -6.745 1.00 0.00 H new ATOM 0 HH21 ARG A 74 10.022 2.835 -9.347 1.00 0.00 H new ATOM 0 HH22 ARG A 74 11.060 3.943 -8.443 1.00 0.00 H new ATOM 1086 N ASP A 75 3.600 1.306 -7.825 1.00 0.00 N ATOM 1087 CA ASP A 75 2.763 1.326 -6.610 1.00 0.00 C ATOM 1088 C ASP A 75 3.409 2.179 -5.537 1.00 0.00 C ATOM 1089 O ASP A 75 4.382 1.784 -4.903 1.00 0.00 O ATOM 1090 CB ASP A 75 2.544 -0.118 -6.105 1.00 0.00 C ATOM 1091 CG ASP A 75 1.887 -0.133 -4.708 1.00 0.00 C ATOM 1092 OD1 ASP A 75 0.814 0.426 -4.573 1.00 0.00 O ATOM 1093 OD2 ASP A 75 2.477 -0.705 -3.806 1.00 0.00 O ATOM 0 H ASP A 75 4.140 0.451 -7.957 1.00 0.00 H new ATOM 0 HA ASP A 75 1.794 1.764 -6.850 1.00 0.00 H new ATOM 0 HB2 ASP A 75 1.914 -0.660 -6.811 1.00 0.00 H new ATOM 0 HB3 ASP A 75 3.500 -0.640 -6.065 1.00 0.00 H new ATOM 1098 N SER A 76 2.813 3.317 -5.286 1.00 0.00 N ATOM 1099 CA SER A 76 3.303 4.215 -4.190 1.00 0.00 C ATOM 1100 C SER A 76 2.166 4.359 -3.138 1.00 0.00 C ATOM 1101 O SER A 76 2.329 5.012 -2.129 1.00 0.00 O ATOM 1102 CB SER A 76 3.724 5.592 -4.730 1.00 0.00 C ATOM 1103 OG SER A 76 4.921 5.994 -4.076 1.00 0.00 O ATOM 0 H SER A 76 2.002 3.667 -5.796 1.00 0.00 H new ATOM 0 HA SER A 76 4.189 3.775 -3.731 1.00 0.00 H new ATOM 0 HB2 SER A 76 3.881 5.543 -5.808 1.00 0.00 H new ATOM 0 HB3 SER A 76 2.935 6.323 -4.556 1.00 0.00 H new ATOM 0 HG SER A 76 5.519 6.422 -4.723 1.00 0.00 H new ATOM 1109 N LEU A 77 1.010 3.690 -3.387 1.00 0.00 N ATOM 1110 CA LEU A 77 -0.187 3.688 -2.449 1.00 0.00 C ATOM 1111 C LEU A 77 0.242 3.680 -1.020 1.00 0.00 C ATOM 1112 O LEU A 77 -0.440 4.250 -0.174 1.00 0.00 O ATOM 1113 CB LEU A 77 -0.967 2.400 -2.747 1.00 0.00 C ATOM 1114 CG LEU A 77 -2.376 2.471 -2.191 1.00 0.00 C ATOM 1115 CD1 LEU A 77 -3.168 3.483 -2.998 1.00 0.00 C ATOM 1116 CD2 LEU A 77 -3.044 1.078 -2.308 1.00 0.00 C ATOM 0 H LEU A 77 0.863 3.136 -4.231 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.789 4.583 -2.605 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.006 2.236 -3.824 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.445 1.547 -2.314 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.350 2.771 -1.143 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.184 3.544 -2.608 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.692 4.461 -2.924 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -3.198 3.172 -4.042 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -4.057 1.126 -1.909 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.080 0.779 -3.355 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.465 0.348 -1.742 1.00 0.00 H new ATOM 1128 N LEU A 78 1.362 3.077 -0.720 1.00 0.00 N ATOM 1129 CA LEU A 78 1.824 3.077 0.663 1.00 0.00 C ATOM 1130 C LEU A 78 2.839 4.202 0.848 1.00 0.00 C ATOM 1131 O LEU A 78 3.725 4.382 0.058 1.00 0.00 O ATOM 1132 CB LEU A 78 2.319 1.712 1.023 1.00 0.00 C ATOM 1133 CG LEU A 78 1.098 0.748 0.941 1.00 0.00 C ATOM 1134 CD1 LEU A 78 1.526 -0.729 0.961 1.00 0.00 C ATOM 1135 CD2 LEU A 78 0.163 1.013 2.121 1.00 0.00 C ATOM 0 H LEU A 78 1.963 2.590 -1.385 1.00 0.00 H new ATOM 0 HA LEU A 78 1.015 3.286 1.362 1.00 0.00 H new ATOM 0 HB2 LEU A 78 3.107 1.395 0.340 1.00 0.00 H new ATOM 0 HB3 LEU A 78 2.746 1.709 2.026 1.00 0.00 H new ATOM 0 HG LEU A 78 0.590 0.938 -0.004 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.643 -1.365 0.902 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.176 -0.931 0.110 1.00 0.00 H new ATOM 0 HD13 LEU A 78 2.063 -0.940 1.886 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.692 0.340 2.066 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.699 0.843 3.055 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.185 2.045 2.085 1.00 0.00 H new ATOM 1183 N GLU A 82 4.314 9.301 -0.901 1.00 0.00 N ATOM 1184 CA GLU A 82 3.495 9.330 -2.134 1.00 0.00 C ATOM 1185 C GLU A 82 2.009 8.861 -1.975 1.00 0.00 C ATOM 1186 O GLU A 82 1.097 9.549 -2.406 1.00 0.00 O ATOM 1187 CB GLU A 82 4.142 8.378 -3.102 1.00 0.00 C ATOM 1188 CG GLU A 82 5.171 9.079 -3.982 1.00 0.00 C ATOM 1189 CD GLU A 82 6.572 8.960 -3.356 1.00 0.00 C ATOM 1190 OE1 GLU A 82 6.910 7.880 -2.888 1.00 0.00 O ATOM 1191 OE2 GLU A 82 7.287 9.954 -3.359 1.00 0.00 O ATOM 0 HA GLU A 82 3.457 10.372 -2.452 1.00 0.00 H new ATOM 0 HB2 GLU A 82 4.624 7.571 -2.551 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.377 7.922 -3.730 1.00 0.00 H new ATOM 0 HG2 GLU A 82 5.171 8.637 -4.978 1.00 0.00 H new ATOM 0 HG3 GLU A 82 4.905 10.129 -4.100 1.00 0.00 H new ATOM 1198 N PHE A 83 1.794 7.639 -1.485 1.00 0.00 N ATOM 1199 CA PHE A 83 0.388 7.024 -1.440 1.00 0.00 C ATOM 1200 C PHE A 83 -0.359 7.292 -2.793 1.00 0.00 C ATOM 1201 O PHE A 83 -1.482 7.800 -2.828 1.00 0.00 O ATOM 1202 CB PHE A 83 -0.482 7.479 -0.282 1.00 0.00 C ATOM 1203 CG PHE A 83 -0.041 8.785 0.307 1.00 0.00 C ATOM 1204 CD1 PHE A 83 0.942 8.808 1.294 1.00 0.00 C ATOM 1205 CD2 PHE A 83 -0.628 9.976 -0.134 1.00 0.00 C ATOM 1206 CE1 PHE A 83 1.349 10.027 1.848 1.00 0.00 C ATOM 1207 CE2 PHE A 83 -0.227 11.197 0.420 1.00 0.00 C ATOM 1208 CZ PHE A 83 0.764 11.224 1.411 1.00 0.00 C ATOM 0 H PHE A 83 2.529 7.037 -1.113 1.00 0.00 H new ATOM 0 HA PHE A 83 0.551 5.958 -1.282 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -1.513 7.571 -0.624 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -0.471 6.715 0.495 1.00 0.00 H new ATOM 0 HD1 PHE A 83 1.390 7.885 1.632 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -1.389 9.953 -0.900 1.00 0.00 H new ATOM 0 HE1 PHE A 83 2.113 10.046 2.611 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -0.681 12.118 0.084 1.00 0.00 H new ATOM 0 HZ PHE A 83 1.077 12.166 1.837 1.00 0.00 H new ATOM 1218 N SER A 84 0.279 6.931 -3.886 1.00 0.00 N ATOM 1219 CA SER A 84 -0.314 7.097 -5.265 1.00 0.00 C ATOM 1220 C SER A 84 0.198 5.925 -6.092 1.00 0.00 C ATOM 1221 O SER A 84 1.365 5.600 -6.072 1.00 0.00 O ATOM 1222 CB SER A 84 0.089 8.442 -5.859 1.00 0.00 C ATOM 1223 OG SER A 84 1.490 8.628 -5.712 1.00 0.00 O ATOM 0 H SER A 84 1.211 6.517 -3.883 1.00 0.00 H new ATOM 0 HA SER A 84 -1.404 7.094 -5.244 1.00 0.00 H new ATOM 0 HB2 SER A 84 -0.185 8.482 -6.913 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.449 9.247 -5.359 1.00 0.00 H new ATOM 0 HG SER A 84 1.747 9.492 -6.096 1.00 0.00 H new ATOM 1229 N MET A 85 -0.710 5.246 -6.720 1.00 0.00 N ATOM 1230 CA MET A 85 -0.423 3.997 -7.467 1.00 0.00 C ATOM 1231 C MET A 85 -0.996 4.137 -8.870 1.00 0.00 C ATOM 1232 O MET A 85 -2.099 4.590 -9.010 1.00 0.00 O ATOM 1233 CB MET A 85 -1.232 3.003 -6.657 1.00 0.00 C ATOM 1234 CG MET A 85 -0.854 1.567 -6.797 1.00 0.00 C ATOM 1235 SD MET A 85 -1.988 0.668 -5.713 1.00 0.00 S ATOM 1236 CE MET A 85 -1.313 -0.943 -5.945 1.00 0.00 C ATOM 0 H MET A 85 -1.692 5.521 -6.747 1.00 0.00 H new ATOM 0 HA MET A 85 0.628 3.732 -7.578 1.00 0.00 H new ATOM 0 HB2 MET A 85 -1.153 3.276 -5.605 1.00 0.00 H new ATOM 0 HB3 MET A 85 -2.280 3.109 -6.936 1.00 0.00 H new ATOM 0 HG2 MET A 85 -0.950 1.234 -7.830 1.00 0.00 H new ATOM 0 HG3 MET A 85 0.183 1.403 -6.504 1.00 0.00 H new ATOM 0 HE1 MET A 85 -1.337 -1.487 -5.001 1.00 0.00 H new ATOM 0 HE2 MET A 85 -1.902 -1.481 -6.688 1.00 0.00 H new ATOM 0 HE3 MET A 85 -0.282 -0.859 -6.290 1.00 0.00 H new ATOM 1246 N ASP A 86 -0.274 3.775 -9.923 1.00 0.00 N ATOM 1247 CA ASP A 86 -0.882 3.946 -11.306 1.00 0.00 C ATOM 1248 C ASP A 86 -1.450 2.605 -11.804 1.00 0.00 C ATOM 1249 O ASP A 86 -0.907 1.990 -12.707 1.00 0.00 O ATOM 1250 CB ASP A 86 0.180 4.420 -12.253 1.00 0.00 C ATOM 1251 CG ASP A 86 0.378 5.932 -12.108 1.00 0.00 C ATOM 1252 OD1 ASP A 86 0.586 6.377 -10.991 1.00 0.00 O ATOM 1253 OD2 ASP A 86 0.317 6.617 -13.115 1.00 0.00 O ATOM 0 H ASP A 86 0.668 3.385 -9.893 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.690 4.676 -11.256 1.00 0.00 H new ATOM 0 HB2 ASP A 86 1.117 3.902 -12.050 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -0.102 4.179 -13.278 1.00 0.00 H new ATOM 1258 N LEU A 87 -2.577 2.165 -11.291 1.00 0.00 N ATOM 1259 CA LEU A 87 -3.130 0.877 -11.797 1.00 0.00 C ATOM 1260 C LEU A 87 -4.059 1.196 -12.915 1.00 0.00 C ATOM 1261 O LEU A 87 -5.081 1.832 -12.734 1.00 0.00 O ATOM 1262 CB LEU A 87 -3.760 -0.059 -10.698 1.00 0.00 C ATOM 1263 CG LEU A 87 -4.455 0.647 -9.503 1.00 0.00 C ATOM 1264 CD1 LEU A 87 -3.497 1.533 -8.720 1.00 0.00 C ATOM 1265 CD2 LEU A 87 -5.646 1.443 -9.995 1.00 0.00 C ATOM 0 H LEU A 87 -3.121 2.630 -10.564 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.304 0.265 -12.159 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.489 -0.709 -11.181 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.972 -0.701 -10.304 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.799 -0.126 -8.816 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.030 2.005 -7.895 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.681 0.927 -8.326 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -3.093 2.302 -9.378 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.128 1.935 -9.151 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.311 2.194 -10.710 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.357 0.773 -10.479 1.00 0.00 H new ATOM 1277 N ARG A 88 -3.663 0.804 -14.118 1.00 0.00 N ATOM 1278 CA ARG A 88 -4.500 1.147 -15.334 1.00 0.00 C ATOM 1279 C ARG A 88 -4.997 -0.096 -16.027 1.00 0.00 C ATOM 1280 O ARG A 88 -4.227 -0.969 -16.361 1.00 0.00 O ATOM 1281 CB ARG A 88 -3.663 2.057 -16.349 1.00 0.00 C ATOM 1282 CG ARG A 88 -2.866 1.250 -17.412 1.00 0.00 C ATOM 1283 CD ARG A 88 -2.368 2.212 -18.485 1.00 0.00 C ATOM 1284 NE ARG A 88 -1.065 1.727 -19.012 1.00 0.00 N ATOM 1285 CZ ARG A 88 -0.418 2.434 -19.890 1.00 0.00 C ATOM 1286 NH1 ARG A 88 -0.890 2.565 -21.100 1.00 0.00 N ATOM 1287 NH2 ARG A 88 0.705 3.004 -19.559 1.00 0.00 N ATOM 0 H ARG A 88 -2.814 0.272 -14.309 1.00 0.00 H new ATOM 0 HA ARG A 88 -5.370 1.709 -14.994 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.346 2.736 -16.860 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -2.968 2.673 -15.779 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -2.025 0.737 -16.945 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -3.500 0.483 -17.857 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -3.096 2.283 -19.293 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -2.255 3.213 -18.069 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.680 0.841 -18.685 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -1.767 2.112 -21.357 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -0.382 3.120 -21.788 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.073 2.895 -18.614 1.00 0.00 H new ATOM 0 HH22 ARG A 88 1.216 3.560 -20.245 1.00 0.00 H new ATOM 1301 N THR A 89 -6.296 -0.146 -16.315 1.00 0.00 N ATOM 1302 CA THR A 89 -6.879 -1.310 -17.083 1.00 0.00 C ATOM 1303 C THR A 89 -6.042 -1.415 -18.361 1.00 0.00 C ATOM 1304 O THR A 89 -6.130 -0.559 -19.226 1.00 0.00 O ATOM 1305 CB THR A 89 -8.381 -1.038 -17.429 1.00 0.00 C ATOM 1306 OG1 THR A 89 -8.497 -0.226 -18.586 1.00 0.00 O ATOM 1307 CG2 THR A 89 -9.092 -0.337 -16.263 1.00 0.00 C ATOM 0 H THR A 89 -6.971 0.571 -16.049 1.00 0.00 H new ATOM 0 HA THR A 89 -6.850 -2.234 -16.505 1.00 0.00 H new ATOM 0 HB THR A 89 -8.850 -2.004 -17.615 1.00 0.00 H new ATOM 0 HG1 THR A 89 -7.620 0.149 -18.812 1.00 0.00 H new ATOM 0 HG21 THR A 89 -10.134 -0.158 -16.527 1.00 0.00 H new ATOM 0 HG22 THR A 89 -9.045 -0.969 -15.376 1.00 0.00 H new ATOM 0 HG23 THR A 89 -8.602 0.615 -16.057 1.00 0.00 H new ATOM 1315 N LYS A 90 -5.172 -2.387 -18.445 1.00 0.00 N ATOM 1316 CA LYS A 90 -4.284 -2.456 -19.589 1.00 0.00 C ATOM 1317 C LYS A 90 -4.914 -3.220 -20.731 1.00 0.00 C ATOM 1318 O LYS A 90 -5.957 -3.842 -20.600 1.00 0.00 O ATOM 1319 CB LYS A 90 -2.928 -3.083 -19.219 1.00 0.00 C ATOM 1320 CG LYS A 90 -2.523 -2.835 -17.757 1.00 0.00 C ATOM 1321 CD LYS A 90 -1.769 -1.513 -17.708 1.00 0.00 C ATOM 1322 CE LYS A 90 -0.280 -1.765 -17.973 1.00 0.00 C ATOM 1323 NZ LYS A 90 0.013 -1.562 -19.423 1.00 0.00 N ATOM 0 H LYS A 90 -5.055 -3.129 -17.755 1.00 0.00 H new ATOM 0 HA LYS A 90 -4.108 -1.430 -19.914 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.971 -4.157 -19.400 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.157 -2.679 -19.876 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.404 -2.798 -17.116 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -1.896 -3.648 -17.390 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -2.171 -0.825 -18.452 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.902 -1.042 -16.734 1.00 0.00 H new ATOM 0 HE2 LYS A 90 0.326 -1.088 -17.371 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -0.014 -2.780 -17.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 0.863 -0.972 -19.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 0.174 -2.484 -19.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -0.794 -1.089 -19.877 1.00 0.00 H new ATOM 1434 N ASN A 99 -7.032 4.378 -17.404 1.00 0.00 N ATOM 1435 CA ASN A 99 -6.041 4.503 -16.261 1.00 0.00 C ATOM 1436 C ASN A 99 -6.673 5.004 -14.990 1.00 0.00 C ATOM 1437 O ASN A 99 -7.549 5.847 -14.992 1.00 0.00 O ATOM 1438 CB ASN A 99 -4.856 5.413 -16.663 1.00 0.00 C ATOM 1439 CG ASN A 99 -4.417 5.146 -18.122 1.00 0.00 C ATOM 1440 OD1 ASN A 99 -4.812 4.169 -18.738 1.00 0.00 O ATOM 1441 ND2 ASN A 99 -3.602 5.986 -18.693 1.00 0.00 N ATOM 0 HA ASN A 99 -5.673 3.497 -16.059 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -5.143 6.459 -16.552 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -4.016 5.240 -15.990 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -3.295 5.827 -19.653 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -3.270 6.803 -18.181 1.00 0.00 H new ATOM 1448 N VAL A 100 -6.192 4.459 -13.881 1.00 0.00 N ATOM 1449 CA VAL A 100 -6.689 4.824 -12.544 1.00 0.00 C ATOM 1450 C VAL A 100 -5.509 5.108 -11.637 1.00 0.00 C ATOM 1451 O VAL A 100 -4.540 4.346 -11.617 1.00 0.00 O ATOM 1452 CB VAL A 100 -7.426 3.636 -11.903 1.00 0.00 C ATOM 1453 CG1 VAL A 100 -8.144 4.109 -10.646 1.00 0.00 C ATOM 1454 CG2 VAL A 100 -8.446 3.050 -12.873 1.00 0.00 C ATOM 0 H VAL A 100 -5.453 3.757 -13.872 1.00 0.00 H new ATOM 0 HA VAL A 100 -7.348 5.685 -12.655 1.00 0.00 H new ATOM 0 HB VAL A 100 -6.697 2.866 -11.652 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -8.668 3.270 -10.189 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -7.416 4.511 -9.941 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.862 4.886 -10.908 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.957 2.211 -12.401 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -9.175 3.815 -13.140 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.936 2.705 -13.772 1.00 0.00 H new ATOM 1464 N THR A 101 -5.615 6.119 -10.823 1.00 0.00 N ATOM 1465 CA THR A 101 -4.568 6.392 -9.831 1.00 0.00 C ATOM 1466 C THR A 101 -5.239 6.123 -8.528 1.00 0.00 C ATOM 1467 O THR A 101 -6.303 6.652 -8.269 1.00 0.00 O ATOM 1468 CB THR A 101 -4.073 7.840 -9.891 1.00 0.00 C ATOM 1469 OG1 THR A 101 -3.398 8.058 -11.124 1.00 0.00 O ATOM 1470 CG2 THR A 101 -3.104 8.104 -8.718 1.00 0.00 C ATOM 0 H THR A 101 -6.399 6.772 -10.811 1.00 0.00 H new ATOM 0 HA THR A 101 -3.681 5.781 -9.999 1.00 0.00 H new ATOM 0 HB THR A 101 -4.923 8.518 -9.817 1.00 0.00 H new ATOM 0 HG1 THR A 101 -2.439 8.169 -10.957 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.752 9.135 -8.762 1.00 0.00 H new ATOM 0 HG22 THR A 101 -3.622 7.937 -7.774 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.253 7.427 -8.790 1.00 0.00 H new ATOM 1478 N VAL A 102 -4.668 5.288 -7.734 1.00 0.00 N ATOM 1479 CA VAL A 102 -5.287 4.924 -6.458 1.00 0.00 C ATOM 1480 C VAL A 102 -4.395 5.405 -5.337 1.00 0.00 C ATOM 1481 O VAL A 102 -3.234 5.056 -5.260 1.00 0.00 O ATOM 1482 CB VAL A 102 -5.502 3.396 -6.490 1.00 0.00 C ATOM 1483 CG1 VAL A 102 -5.661 2.805 -5.074 1.00 0.00 C ATOM 1484 CG2 VAL A 102 -6.762 3.128 -7.287 1.00 0.00 C ATOM 0 H VAL A 102 -3.775 4.832 -7.922 1.00 0.00 H new ATOM 0 HA VAL A 102 -6.256 5.393 -6.291 1.00 0.00 H new ATOM 0 HB VAL A 102 -4.630 2.924 -6.942 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -5.810 1.728 -5.144 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -4.763 3.010 -4.491 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -6.523 3.259 -4.585 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -6.944 2.054 -7.330 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -7.608 3.621 -6.807 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -6.642 3.516 -8.299 1.00 0.00 H new ATOM 1494 N THR A 103 -4.943 6.237 -4.483 1.00 0.00 N ATOM 1495 CA THR A 103 -4.153 6.804 -3.354 1.00 0.00 C ATOM 1496 C THR A 103 -4.606 6.186 -2.040 1.00 0.00 C ATOM 1497 O THR A 103 -5.580 5.434 -1.985 1.00 0.00 O ATOM 1498 CB THR A 103 -4.338 8.328 -3.289 1.00 0.00 C ATOM 1499 OG1 THR A 103 -5.708 8.659 -3.439 1.00 0.00 O ATOM 1500 CG2 THR A 103 -3.533 8.996 -4.405 1.00 0.00 C ATOM 0 H THR A 103 -5.914 6.548 -4.524 1.00 0.00 H new ATOM 0 HA THR A 103 -3.100 6.576 -3.519 1.00 0.00 H new ATOM 0 HB THR A 103 -3.985 8.683 -2.321 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.850 9.074 -4.315 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.668 10.076 -4.354 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.476 8.756 -4.285 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.880 8.632 -5.372 1.00 0.00 H new ATOM 1508 N LYS A 104 -3.899 6.502 -0.983 1.00 0.00 N ATOM 1509 CA LYS A 104 -4.232 5.955 0.374 1.00 0.00 C ATOM 1510 C LYS A 104 -4.099 7.052 1.436 1.00 0.00 C ATOM 1511 O LYS A 104 -3.271 7.949 1.328 1.00 0.00 O ATOM 1512 CB LYS A 104 -3.254 4.812 0.697 1.00 0.00 C ATOM 1513 CG LYS A 104 -3.529 4.230 2.097 1.00 0.00 C ATOM 1514 CD LYS A 104 -4.801 3.388 2.058 1.00 0.00 C ATOM 1515 CE LYS A 104 -4.432 1.928 1.778 1.00 0.00 C ATOM 1516 NZ LYS A 104 -3.565 1.395 2.880 1.00 0.00 N ATOM 0 H LYS A 104 -3.092 7.126 -1.001 1.00 0.00 H new ATOM 0 HA LYS A 104 -5.258 5.588 0.376 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -3.347 4.026 -0.052 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -2.229 5.180 0.647 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -2.686 3.619 2.421 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -3.636 5.036 2.823 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -5.332 3.466 3.007 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -5.474 3.760 1.285 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -5.337 1.326 1.693 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -3.909 1.853 0.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -3.515 0.358 2.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -2.609 1.794 2.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -3.970 1.662 3.800 1.00 0.00 H new ATOM 1530 N THR A 105 -4.902 6.950 2.477 1.00 0.00 N ATOM 1531 CA THR A 105 -4.857 7.923 3.605 1.00 0.00 C ATOM 1532 C THR A 105 -4.476 7.132 4.886 1.00 0.00 C ATOM 1533 O THR A 105 -3.658 6.220 4.818 1.00 0.00 O ATOM 1534 CB THR A 105 -6.238 8.590 3.760 1.00 0.00 C ATOM 1535 OG1 THR A 105 -7.174 7.625 4.195 1.00 0.00 O ATOM 1536 CG2 THR A 105 -6.690 9.190 2.415 1.00 0.00 C ATOM 0 H THR A 105 -5.599 6.213 2.586 1.00 0.00 H new ATOM 0 HA THR A 105 -4.124 8.709 3.423 1.00 0.00 H new ATOM 0 HB THR A 105 -6.172 9.392 4.495 1.00 0.00 H new ATOM 0 HG1 THR A 105 -7.824 7.455 3.482 1.00 0.00 H new ATOM 0 HG21 THR A 105 -7.667 9.659 2.536 1.00 0.00 H new ATOM 0 HG22 THR A 105 -5.967 9.937 2.089 1.00 0.00 H new ATOM 0 HG23 THR A 105 -6.757 8.399 1.668 1.00 0.00 H new ATOM 1544 N ASP A 106 -5.058 7.461 6.043 1.00 0.00 N ATOM 1545 CA ASP A 106 -4.723 6.717 7.300 1.00 0.00 C ATOM 1546 C ASP A 106 -5.676 5.525 7.481 1.00 0.00 C ATOM 1547 O ASP A 106 -5.303 4.516 8.065 1.00 0.00 O ATOM 1548 CB ASP A 106 -4.835 7.647 8.495 1.00 0.00 C ATOM 1549 CG ASP A 106 -3.904 7.160 9.602 1.00 0.00 C ATOM 1550 OD1 ASP A 106 -2.708 7.129 9.371 1.00 0.00 O ATOM 1551 OD2 ASP A 106 -4.403 6.823 10.663 1.00 0.00 O ATOM 0 H ASP A 106 -5.743 8.209 6.154 1.00 0.00 H new ATOM 0 HA ASP A 106 -3.701 6.346 7.226 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -4.572 8.664 8.205 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -5.864 7.674 8.855 1.00 0.00 H new ATOM 1556 N LYS A 107 -6.916 5.631 6.980 1.00 0.00 N ATOM 1557 CA LYS A 107 -7.905 4.485 7.125 1.00 0.00 C ATOM 1558 C LYS A 107 -8.934 4.509 5.964 1.00 0.00 C ATOM 1559 O LYS A 107 -10.026 3.959 6.086 1.00 0.00 O ATOM 1560 CB LYS A 107 -8.668 4.567 8.479 1.00 0.00 C ATOM 1561 CG LYS A 107 -7.783 5.178 9.575 1.00 0.00 C ATOM 1562 CD LYS A 107 -8.634 5.455 10.813 1.00 0.00 C ATOM 1563 CE LYS A 107 -7.743 5.956 11.945 1.00 0.00 C ATOM 1564 NZ LYS A 107 -8.585 6.264 13.133 1.00 0.00 N ATOM 0 H LYS A 107 -7.273 6.449 6.487 1.00 0.00 H new ATOM 0 HA LYS A 107 -7.336 3.556 7.095 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -9.569 5.169 8.357 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -8.989 3.570 8.780 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -6.969 4.497 9.824 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -7.328 6.102 9.218 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -9.398 6.197 10.583 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -9.153 4.547 11.120 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -6.998 5.202 12.198 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -7.200 6.847 11.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -7.981 6.606 13.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -9.279 6.998 12.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -9.084 5.404 13.437 1.00 0.00 H new ATOM 1578 N THR A 108 -8.582 5.118 4.833 1.00 0.00 N ATOM 1579 CA THR A 108 -9.508 5.159 3.659 1.00 0.00 C ATOM 1580 C THR A 108 -8.707 4.729 2.419 1.00 0.00 C ATOM 1581 O THR A 108 -7.481 4.808 2.397 1.00 0.00 O ATOM 1582 CB THR A 108 -10.107 6.573 3.486 1.00 0.00 C ATOM 1583 OG1 THR A 108 -9.176 7.444 2.869 1.00 0.00 O ATOM 1584 CG2 THR A 108 -10.500 7.121 4.861 1.00 0.00 C ATOM 0 H THR A 108 -7.687 5.585 4.687 1.00 0.00 H new ATOM 0 HA THR A 108 -10.348 4.480 3.808 1.00 0.00 H new ATOM 0 HB THR A 108 -10.987 6.509 2.845 1.00 0.00 H new ATOM 0 HG1 THR A 108 -9.140 7.256 1.908 1.00 0.00 H new ATOM 0 HG21 THR A 108 -10.924 8.119 4.747 1.00 0.00 H new ATOM 0 HG22 THR A 108 -11.239 6.463 5.317 1.00 0.00 H new ATOM 0 HG23 THR A 108 -9.617 7.172 5.498 1.00 0.00 H new ATOM 1592 N LEU A 109 -9.388 4.246 1.428 1.00 0.00 N ATOM 1593 CA LEU A 109 -8.722 3.746 0.176 1.00 0.00 C ATOM 1594 C LEU A 109 -9.307 4.574 -0.980 1.00 0.00 C ATOM 1595 O LEU A 109 -10.369 4.246 -1.486 1.00 0.00 O ATOM 1596 CB LEU A 109 -9.133 2.246 0.047 1.00 0.00 C ATOM 1597 CG LEU A 109 -8.069 1.304 -0.596 1.00 0.00 C ATOM 1598 CD1 LEU A 109 -8.487 0.900 -1.997 1.00 0.00 C ATOM 1599 CD2 LEU A 109 -6.664 1.905 -0.622 1.00 0.00 C ATOM 0 H LEU A 109 -10.405 4.170 1.422 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.636 3.836 0.178 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.373 1.868 1.041 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.047 2.189 -0.545 1.00 0.00 H new ATOM 0 HG LEU A 109 -8.023 0.422 0.042 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -7.731 0.243 -2.427 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.442 0.376 -1.955 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -8.589 1.790 -2.617 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -5.974 1.198 -1.082 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -6.674 2.829 -1.199 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -6.340 2.117 0.397 1.00 0.00 H new ATOM 1611 N VAL A 110 -8.645 5.664 -1.399 1.00 0.00 N ATOM 1612 CA VAL A 110 -9.225 6.499 -2.470 1.00 0.00 C ATOM 1613 C VAL A 110 -8.768 5.950 -3.803 1.00 0.00 C ATOM 1614 O VAL A 110 -7.653 5.480 -3.932 1.00 0.00 O ATOM 1615 CB VAL A 110 -8.771 7.997 -2.268 1.00 0.00 C ATOM 1616 CG1 VAL A 110 -8.768 8.757 -3.602 1.00 0.00 C ATOM 1617 CG2 VAL A 110 -9.757 8.710 -1.318 1.00 0.00 C ATOM 0 H VAL A 110 -7.747 5.981 -1.034 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.314 6.476 -2.439 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.763 7.989 -1.852 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -8.451 9.786 -3.434 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -8.079 8.274 -4.294 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -9.772 8.751 -4.026 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.444 9.745 -1.178 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.758 8.689 -1.750 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.767 8.201 -0.354 1.00 0.00 H new ATOM 1627 N LEU A 111 -9.613 6.062 -4.792 1.00 0.00 N ATOM 1628 CA LEU A 111 -9.257 5.620 -6.156 1.00 0.00 C ATOM 1629 C LEU A 111 -9.685 6.725 -7.109 1.00 0.00 C ATOM 1630 O LEU A 111 -10.581 7.511 -6.816 1.00 0.00 O ATOM 1631 CB LEU A 111 -9.971 4.291 -6.567 1.00 0.00 C ATOM 1632 CG LEU A 111 -10.044 3.277 -5.409 1.00 0.00 C ATOM 1633 CD1 LEU A 111 -10.616 1.945 -5.939 1.00 0.00 C ATOM 1634 CD2 LEU A 111 -8.668 3.022 -4.803 1.00 0.00 C ATOM 0 H LEU A 111 -10.552 6.450 -4.702 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.185 5.427 -6.193 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -10.980 4.516 -6.912 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.440 3.842 -7.406 1.00 0.00 H new ATOM 0 HG LEU A 111 -10.688 3.691 -4.633 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -10.670 1.223 -5.125 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -11.615 2.113 -6.343 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -9.968 1.558 -6.725 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -8.757 2.302 -3.989 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -8.001 2.624 -5.568 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -8.261 3.957 -4.418 1.00 0.00 H new ATOM 1646 N LEU A 112 -9.056 6.792 -8.231 1.00 0.00 N ATOM 1647 CA LEU A 112 -9.392 7.818 -9.248 1.00 0.00 C ATOM 1648 C LEU A 112 -9.462 7.104 -10.565 1.00 0.00 C ATOM 1649 O LEU A 112 -8.453 6.750 -11.115 1.00 0.00 O ATOM 1650 CB LEU A 112 -8.261 8.857 -9.303 1.00 0.00 C ATOM 1651 CG LEU A 112 -8.601 10.180 -10.113 1.00 0.00 C ATOM 1652 CD1 LEU A 112 -9.967 10.151 -10.840 1.00 0.00 C ATOM 1653 CD2 LEU A 112 -8.526 11.381 -9.165 1.00 0.00 C ATOM 0 H LEU A 112 -8.300 6.163 -8.500 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.330 8.322 -9.014 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.992 9.133 -8.283 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -7.382 8.392 -9.750 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.857 10.261 -10.905 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.119 11.093 -11.367 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.981 9.328 -11.555 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.765 10.011 -10.110 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.758 12.293 -9.714 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.245 11.251 -8.356 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.521 11.454 -8.749 1.00 0.00 H new ATOM 1665 N MET A 113 -10.624 6.869 -11.076 1.00 0.00 N ATOM 1666 CA MET A 113 -10.697 6.118 -12.391 1.00 0.00 C ATOM 1667 C MET A 113 -10.650 7.090 -13.507 1.00 0.00 C ATOM 1668 O MET A 113 -11.129 8.195 -13.400 1.00 0.00 O ATOM 1669 CB MET A 113 -11.973 5.250 -12.455 1.00 0.00 C ATOM 1670 CG MET A 113 -12.362 4.810 -13.913 1.00 0.00 C ATOM 1671 SD MET A 113 -11.417 3.346 -14.397 1.00 0.00 S ATOM 1672 CE MET A 113 -12.751 2.141 -14.204 1.00 0.00 C ATOM 0 H MET A 113 -11.518 7.146 -10.671 1.00 0.00 H new ATOM 0 HA MET A 113 -9.844 5.444 -12.474 1.00 0.00 H new ATOM 0 HB2 MET A 113 -11.828 4.360 -11.842 1.00 0.00 H new ATOM 0 HB3 MET A 113 -12.803 5.806 -12.019 1.00 0.00 H new ATOM 0 HG2 MET A 113 -13.430 4.596 -13.963 1.00 0.00 H new ATOM 0 HG3 MET A 113 -12.167 5.625 -14.611 1.00 0.00 H new ATOM 0 HE1 MET A 113 -12.336 1.188 -13.876 1.00 0.00 H new ATOM 0 HE2 MET A 113 -13.463 2.502 -13.461 1.00 0.00 H new ATOM 0 HE3 MET A 113 -13.260 2.006 -15.158 1.00 0.00 H new ATOM 1682 N GLY A 114 -10.060 6.656 -14.585 1.00 0.00 N ATOM 1683 CA GLY A 114 -9.936 7.499 -15.782 1.00 0.00 C ATOM 1684 C GLY A 114 -10.065 6.662 -17.045 1.00 0.00 C ATOM 1685 O GLY A 114 -9.621 5.522 -17.117 1.00 0.00 O ATOM 0 H GLY A 114 -9.651 5.726 -14.678 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -10.706 8.270 -15.771 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -8.973 8.010 -15.775 1.00 0.00 H new ATOM 1773 N GLY A 121 -1.240 10.844 -15.391 1.00 0.00 N ATOM 1774 CA GLY A 121 -0.400 11.775 -14.548 1.00 0.00 C ATOM 1775 C GLY A 121 -1.281 12.884 -13.956 1.00 0.00 C ATOM 1776 O GLY A 121 -1.040 13.354 -12.851 1.00 0.00 O ATOM 0 HA2 GLY A 121 0.084 11.217 -13.747 1.00 0.00 H new ATOM 0 HA3 GLY A 121 0.392 12.213 -15.155 1.00 0.00 H new ATOM 1780 N LEU A 122 -2.316 13.282 -14.678 1.00 0.00 N ATOM 1781 CA LEU A 122 -3.265 14.348 -14.170 1.00 0.00 C ATOM 1782 C LEU A 122 -4.147 13.699 -13.165 1.00 0.00 C ATOM 1783 O LEU A 122 -4.467 14.274 -12.167 1.00 0.00 O ATOM 1784 CB LEU A 122 -4.161 14.905 -15.292 1.00 0.00 C ATOM 1785 CG LEU A 122 -3.391 15.049 -16.613 1.00 0.00 C ATOM 1786 CD1 LEU A 122 -4.290 14.596 -17.763 1.00 0.00 C ATOM 1787 CD2 LEU A 122 -2.994 16.514 -16.801 1.00 0.00 C ATOM 0 H LEU A 122 -2.546 12.914 -15.601 1.00 0.00 H new ATOM 0 HA LEU A 122 -2.683 15.173 -13.759 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -5.015 14.244 -15.438 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.557 15.876 -14.994 1.00 0.00 H new ATOM 0 HG LEU A 122 -2.491 14.434 -16.597 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -3.752 14.695 -18.706 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -4.574 13.554 -17.614 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -5.186 15.216 -17.790 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -2.447 16.625 -17.737 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.891 17.133 -16.829 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -2.361 16.829 -15.971 1.00 0.00 H new ATOM 1799 N ILE A 123 -4.530 12.474 -13.441 1.00 0.00 N ATOM 1800 CA ILE A 123 -5.383 11.685 -12.514 1.00 0.00 C ATOM 1801 C ILE A 123 -4.568 11.443 -11.254 1.00 0.00 C ATOM 1802 O ILE A 123 -5.089 11.470 -10.159 1.00 0.00 O ATOM 1803 CB ILE A 123 -5.709 10.387 -13.235 1.00 0.00 C ATOM 1804 CG1 ILE A 123 -6.764 10.700 -14.328 1.00 0.00 C ATOM 1805 CG2 ILE A 123 -6.239 9.278 -12.272 1.00 0.00 C ATOM 1806 CD1 ILE A 123 -7.234 9.422 -14.983 1.00 0.00 C ATOM 0 H ILE A 123 -4.276 11.981 -14.297 1.00 0.00 H new ATOM 0 HA ILE A 123 -6.311 12.185 -12.235 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.792 9.994 -13.675 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.612 11.223 -13.886 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -6.335 11.365 -15.078 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -6.455 8.374 -12.842 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -5.483 9.059 -11.518 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.149 9.625 -11.783 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -7.974 9.656 -15.748 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -6.385 8.915 -15.442 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -7.682 8.772 -14.232 1.00 0.00 H new ATOM 1818 N ASN A 124 -3.271 11.244 -11.423 1.00 0.00 N ATOM 1819 CA ASN A 124 -2.366 11.051 -10.260 1.00 0.00 C ATOM 1820 C ASN A 124 -2.371 12.355 -9.456 1.00 0.00 C ATOM 1821 O ASN A 124 -2.211 12.355 -8.238 1.00 0.00 O ATOM 1822 CB ASN A 124 -0.942 10.741 -10.776 1.00 0.00 C ATOM 1823 CG ASN A 124 0.048 10.678 -9.603 1.00 0.00 C ATOM 1824 OD1 ASN A 124 0.594 11.686 -9.200 1.00 0.00 O ATOM 1825 ND2 ASN A 124 0.302 9.534 -9.040 1.00 0.00 N ATOM 0 H ASN A 124 -2.810 11.209 -12.332 1.00 0.00 H new ATOM 0 HA ASN A 124 -2.694 10.222 -9.632 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -0.941 9.792 -11.313 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -0.629 11.509 -11.484 1.00 0.00 H new ATOM 0 HD21 ASN A 124 0.959 9.484 -8.261 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -0.155 8.687 -9.377 1.00 0.00 H new ATOM 1832 N LYS A 125 -2.568 13.467 -10.147 1.00 0.00 N ATOM 1833 CA LYS A 125 -2.601 14.811 -9.462 1.00 0.00 C ATOM 1834 C LYS A 125 -3.997 15.030 -8.805 1.00 0.00 C ATOM 1835 O LYS A 125 -4.112 15.659 -7.756 1.00 0.00 O ATOM 1836 CB LYS A 125 -2.351 15.912 -10.516 1.00 0.00 C ATOM 1837 CG LYS A 125 -0.878 15.911 -10.943 1.00 0.00 C ATOM 1838 CD LYS A 125 -0.072 16.825 -10.014 1.00 0.00 C ATOM 1839 CE LYS A 125 1.324 17.058 -10.603 1.00 0.00 C ATOM 1840 NZ LYS A 125 2.171 15.857 -10.365 1.00 0.00 N ATOM 0 H LYS A 125 -2.707 13.499 -11.157 1.00 0.00 H new ATOM 0 HA LYS A 125 -1.832 14.851 -8.690 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -2.989 15.746 -11.384 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -2.618 16.886 -10.106 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -0.479 14.897 -10.907 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -0.788 16.253 -11.974 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -0.588 17.777 -9.888 1.00 0.00 H new ATOM 0 HD3 LYS A 125 0.010 16.373 -9.025 1.00 0.00 H new ATOM 0 HE2 LYS A 125 1.250 17.258 -11.672 1.00 0.00 H new ATOM 0 HE3 LYS A 125 1.782 17.935 -10.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 3.118 16.015 -10.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 2.251 15.686 -9.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 1.736 15.030 -10.822 1.00 0.00 H new ATOM 1854 N LYS A 126 -5.054 14.502 -9.426 1.00 0.00 N ATOM 1855 CA LYS A 126 -6.453 14.655 -8.875 1.00 0.00 C ATOM 1856 C LYS A 126 -6.735 13.576 -7.822 1.00 0.00 C ATOM 1857 O LYS A 126 -7.691 13.678 -7.073 1.00 0.00 O ATOM 1858 CB LYS A 126 -7.468 14.527 -10.016 1.00 0.00 C ATOM 1859 CG LYS A 126 -7.745 15.909 -10.612 1.00 0.00 C ATOM 1860 CD LYS A 126 -6.836 16.152 -11.824 1.00 0.00 C ATOM 1861 CE LYS A 126 -7.245 15.232 -12.990 1.00 0.00 C ATOM 1862 NZ LYS A 126 -7.469 16.051 -14.217 1.00 0.00 N ATOM 0 H LYS A 126 -4.998 13.970 -10.295 1.00 0.00 H new ATOM 0 HA LYS A 126 -6.541 15.636 -8.408 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.083 13.858 -10.786 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -8.394 14.087 -9.645 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -8.791 15.982 -10.911 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -7.575 16.679 -9.860 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -6.902 17.195 -12.134 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -5.797 15.966 -11.552 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -6.467 14.491 -13.172 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -8.153 14.685 -12.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -7.662 15.423 -15.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -8.281 16.684 -14.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -6.620 16.618 -14.416 1.00 0.00 H new ATOM 1876 N CYS A 127 -5.881 12.566 -7.741 1.00 0.00 N ATOM 1877 CA CYS A 127 -6.041 11.483 -6.714 1.00 0.00 C ATOM 1878 C CYS A 127 -5.306 11.945 -5.489 1.00 0.00 C ATOM 1879 O CYS A 127 -5.696 11.671 -4.381 1.00 0.00 O ATOM 1880 CB CYS A 127 -5.425 10.184 -7.202 1.00 0.00 C ATOM 1881 SG CYS A 127 -6.192 8.803 -6.323 1.00 0.00 S ATOM 0 H CYS A 127 -5.073 12.452 -8.353 1.00 0.00 H new ATOM 0 HA CYS A 127 -7.097 11.300 -6.514 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -5.575 10.076 -8.276 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -4.349 10.189 -7.029 1.00 0.00 H new ATOM 0 HG CYS A 127 -6.539 7.885 -7.176 1.00 0.00 H new ATOM 1887 N TYR A 128 -4.238 12.684 -5.711 1.00 0.00 N ATOM 1888 CA TYR A 128 -3.446 13.252 -4.619 1.00 0.00 C ATOM 1889 C TYR A 128 -4.327 14.297 -3.921 1.00 0.00 C ATOM 1890 O TYR A 128 -4.273 14.463 -2.717 1.00 0.00 O ATOM 1891 CB TYR A 128 -2.230 13.940 -5.260 1.00 0.00 C ATOM 1892 CG TYR A 128 -1.004 13.967 -4.369 1.00 0.00 C ATOM 1893 CD1 TYR A 128 -1.036 13.557 -3.022 1.00 0.00 C ATOM 1894 CD2 TYR A 128 0.182 14.435 -4.923 1.00 0.00 C ATOM 1895 CE1 TYR A 128 0.124 13.621 -2.248 1.00 0.00 C ATOM 1896 CE2 TYR A 128 1.346 14.496 -4.145 1.00 0.00 C ATOM 1897 CZ TYR A 128 1.313 14.088 -2.806 1.00 0.00 C ATOM 1898 OH TYR A 128 2.455 14.145 -2.037 1.00 0.00 O ATOM 0 H TYR A 128 -3.890 12.911 -6.642 1.00 0.00 H new ATOM 0 HA TYR A 128 -3.117 12.501 -3.901 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -1.982 13.427 -6.189 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -2.499 14.963 -5.523 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -1.956 13.194 -2.589 1.00 0.00 H new ATOM 0 HD2 TYR A 128 0.206 14.752 -5.955 1.00 0.00 H new ATOM 0 HE1 TYR A 128 0.100 13.308 -1.215 1.00 0.00 H new ATOM 0 HE2 TYR A 128 2.267 14.857 -4.578 1.00 0.00 H new ATOM 0 HH TYR A 128 3.196 14.492 -2.577 1.00 0.00 H new ATOM 1908 N GLU A 129 -5.160 15.001 -4.709 1.00 0.00 N ATOM 1909 CA GLU A 129 -6.083 16.053 -4.129 1.00 0.00 C ATOM 1910 C GLU A 129 -7.321 15.374 -3.505 1.00 0.00 C ATOM 1911 O GLU A 129 -7.833 15.805 -2.476 1.00 0.00 O ATOM 1912 CB GLU A 129 -6.528 17.013 -5.242 1.00 0.00 C ATOM 1913 CG GLU A 129 -5.440 18.067 -5.475 1.00 0.00 C ATOM 1914 CD GLU A 129 -5.959 19.138 -6.436 1.00 0.00 C ATOM 1915 OE1 GLU A 129 -6.621 20.051 -5.973 1.00 0.00 O ATOM 1916 OE2 GLU A 129 -5.688 19.025 -7.622 1.00 0.00 O ATOM 0 H GLU A 129 -5.230 14.884 -5.720 1.00 0.00 H new ATOM 0 HA GLU A 129 -5.554 16.612 -3.357 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -6.715 16.459 -6.162 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -7.465 17.497 -4.966 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -5.153 18.523 -4.528 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -4.547 17.597 -5.887 1.00 0.00 H new ATOM 1923 N MET A 130 -7.779 14.297 -4.110 1.00 0.00 N ATOM 1924 CA MET A 130 -8.966 13.538 -3.573 1.00 0.00 C ATOM 1925 C MET A 130 -8.581 13.038 -2.142 1.00 0.00 C ATOM 1926 O MET A 130 -9.330 13.187 -1.152 1.00 0.00 O ATOM 1927 CB MET A 130 -9.221 12.345 -4.539 1.00 0.00 C ATOM 1928 CG MET A 130 -10.716 11.969 -4.597 1.00 0.00 C ATOM 1929 SD MET A 130 -10.897 10.321 -5.322 1.00 0.00 S ATOM 1930 CE MET A 130 -12.671 10.133 -5.025 1.00 0.00 C ATOM 0 H MET A 130 -7.377 13.906 -4.962 1.00 0.00 H new ATOM 0 HA MET A 130 -9.870 14.144 -3.509 1.00 0.00 H new ATOM 0 HB2 MET A 130 -8.872 12.605 -5.538 1.00 0.00 H new ATOM 0 HB3 MET A 130 -8.641 11.482 -4.213 1.00 0.00 H new ATOM 0 HG2 MET A 130 -11.145 11.986 -3.595 1.00 0.00 H new ATOM 0 HG3 MET A 130 -11.263 12.701 -5.191 1.00 0.00 H new ATOM 0 HE1 MET A 130 -12.893 9.090 -4.798 1.00 0.00 H new ATOM 0 HE2 MET A 130 -12.967 10.759 -4.183 1.00 0.00 H new ATOM 0 HE3 MET A 130 -13.223 10.437 -5.915 1.00 0.00 H new ATOM 1940 N ALA A 131 -7.387 12.493 -2.038 1.00 0.00 N ATOM 1941 CA ALA A 131 -6.853 12.000 -0.736 1.00 0.00 C ATOM 1942 C ALA A 131 -6.288 13.173 0.064 1.00 0.00 C ATOM 1943 O ALA A 131 -6.066 13.043 1.251 1.00 0.00 O ATOM 1944 CB ALA A 131 -5.740 10.980 -0.998 1.00 0.00 C ATOM 0 H ALA A 131 -6.750 12.370 -2.825 1.00 0.00 H new ATOM 0 HA ALA A 131 -7.656 11.529 -0.169 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.347 10.618 -0.048 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -6.141 10.142 -1.568 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.938 11.454 -1.565 1.00 0.00 H new ATOM 1950 N SER A 132 -6.066 14.336 -0.576 1.00 0.00 N ATOM 1951 CA SER A 132 -5.543 15.521 0.183 1.00 0.00 C ATOM 1952 C SER A 132 -6.610 15.910 1.188 1.00 0.00 C ATOM 1953 O SER A 132 -6.297 16.331 2.293 1.00 0.00 O ATOM 1954 CB SER A 132 -5.223 16.707 -0.766 1.00 0.00 C ATOM 1955 OG SER A 132 -6.429 17.332 -1.208 1.00 0.00 O ATOM 0 H SER A 132 -6.227 14.493 -1.571 1.00 0.00 H new ATOM 0 HA SER A 132 -4.609 15.266 0.684 1.00 0.00 H new ATOM 0 HB2 SER A 132 -4.597 17.435 -0.250 1.00 0.00 H new ATOM 0 HB3 SER A 132 -4.655 16.350 -1.625 1.00 0.00 H new ATOM 0 HG SER A 132 -7.104 16.646 -1.393 1.00 0.00 H new ATOM 1961 N HIS A 133 -7.896 15.724 0.825 1.00 0.00 N ATOM 1962 CA HIS A 133 -8.979 16.038 1.802 1.00 0.00 C ATOM 1963 C HIS A 133 -9.062 14.910 2.776 1.00 0.00 C ATOM 1964 O HIS A 133 -9.196 15.142 3.953 1.00 0.00 O ATOM 1965 CB HIS A 133 -10.341 16.226 1.167 1.00 0.00 C ATOM 1966 CG HIS A 133 -11.197 16.926 2.181 1.00 0.00 C ATOM 1967 ND1 HIS A 133 -12.288 16.312 2.776 1.00 0.00 N ATOM 1968 CD2 HIS A 133 -11.132 18.182 2.723 1.00 0.00 C ATOM 1969 CE1 HIS A 133 -12.830 17.196 3.637 1.00 0.00 C ATOM 1970 NE2 HIS A 133 -12.162 18.351 3.642 1.00 0.00 N ATOM 0 H HIS A 133 -8.207 15.378 -0.083 1.00 0.00 H new ATOM 0 HA HIS A 133 -8.721 16.985 2.276 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -10.264 16.815 0.253 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -10.775 15.265 0.891 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -10.392 18.929 2.474 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -13.698 16.994 4.247 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -12.364 19.180 4.200 1.00 0.00 H new ATOM 1978 N LEU A 134 -8.969 13.655 2.299 1.00 0.00 N ATOM 1979 CA LEU A 134 -9.028 12.498 3.259 1.00 0.00 C ATOM 1980 C LEU A 134 -7.824 12.526 4.202 1.00 0.00 C ATOM 1981 O LEU A 134 -7.826 11.874 5.240 1.00 0.00 O ATOM 1982 CB LEU A 134 -9.074 11.198 2.486 1.00 0.00 C ATOM 1983 CG LEU A 134 -10.503 10.998 1.952 1.00 0.00 C ATOM 1984 CD1 LEU A 134 -10.519 11.112 0.430 1.00 0.00 C ATOM 1985 CD2 LEU A 134 -11.021 9.618 2.376 1.00 0.00 C ATOM 0 H LEU A 134 -8.859 13.406 1.316 1.00 0.00 H new ATOM 0 HA LEU A 134 -9.931 12.580 3.863 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -8.361 11.222 1.662 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -8.790 10.365 3.129 1.00 0.00 H new ATOM 0 HG LEU A 134 -11.149 11.771 2.368 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -11.536 10.968 0.065 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -10.164 12.099 0.135 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -9.869 10.350 0.001 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -12.033 9.477 1.997 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -10.370 8.844 1.969 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -11.028 9.550 3.464 1.00 0.00 H new ATOM 1997 N ARG A 135 -6.829 13.314 3.877 1.00 0.00 N ATOM 1998 CA ARG A 135 -5.639 13.465 4.760 1.00 0.00 C ATOM 1999 C ARG A 135 -6.001 14.530 5.768 1.00 0.00 C ATOM 2000 O ARG A 135 -5.755 14.392 6.960 1.00 0.00 O ATOM 2001 CB ARG A 135 -4.431 13.905 3.931 1.00 0.00 C ATOM 2002 CG ARG A 135 -3.761 12.674 3.296 1.00 0.00 C ATOM 2003 CD ARG A 135 -2.469 12.335 4.051 1.00 0.00 C ATOM 2004 NE ARG A 135 -2.749 12.264 5.513 1.00 0.00 N ATOM 2005 CZ ARG A 135 -2.255 11.292 6.224 1.00 0.00 C ATOM 2006 NH1 ARG A 135 -2.510 10.051 5.901 1.00 0.00 N ATOM 2007 NH2 ARG A 135 -1.513 11.560 7.261 1.00 0.00 N ATOM 0 H ARG A 135 -6.794 13.867 3.021 1.00 0.00 H new ATOM 0 HA ARG A 135 -5.377 12.528 5.251 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -4.746 14.601 3.154 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -3.717 14.434 4.563 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -4.442 11.824 3.323 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -3.539 12.871 2.247 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -2.070 11.383 3.700 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -1.710 13.092 3.852 1.00 0.00 H new ATOM 0 HE ARG A 135 -3.328 12.977 5.957 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -3.096 9.845 5.092 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -2.123 9.289 6.458 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -1.321 12.529 7.514 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -1.125 10.800 7.820 1.00 0.00 H new ATOM 2021 N ARG A 136 -6.659 15.578 5.289 1.00 0.00 N ATOM 2022 CA ARG A 136 -7.138 16.663 6.191 1.00 0.00 C ATOM 2023 C ARG A 136 -8.459 16.216 6.850 1.00 0.00 C ATOM 2024 O ARG A 136 -9.026 16.931 7.666 1.00 0.00 O ATOM 2025 CB ARG A 136 -7.386 17.928 5.378 1.00 0.00 C ATOM 2026 CG ARG A 136 -6.049 18.514 4.924 1.00 0.00 C ATOM 2027 CD ARG A 136 -5.336 19.138 6.124 1.00 0.00 C ATOM 2028 NE ARG A 136 -4.086 19.805 5.666 1.00 0.00 N ATOM 2029 CZ ARG A 136 -4.085 21.085 5.416 1.00 0.00 C ATOM 2030 NH1 ARG A 136 -3.938 21.939 6.391 1.00 0.00 N ATOM 2031 NH2 ARG A 136 -4.230 21.512 4.192 1.00 0.00 N ATOM 0 H ARG A 136 -6.879 15.716 4.303 1.00 0.00 H new ATOM 0 HA ARG A 136 -6.388 16.865 6.956 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -8.008 17.700 4.512 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -7.930 18.658 5.978 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -5.428 17.734 4.483 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.212 19.266 4.152 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -5.989 19.861 6.613 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -5.102 18.370 6.861 1.00 0.00 H new ATOM 0 HE ARG A 136 -3.231 19.261 5.548 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -3.824 21.606 7.348 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -3.937 22.940 6.196 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -4.344 20.845 3.429 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -4.229 22.513 3.998 1.00 0.00 H new ATOM 2045 N SER A 137 -8.941 15.024 6.497 1.00 0.00 N ATOM 2046 CA SER A 137 -10.191 14.491 7.071 1.00 0.00 C ATOM 2047 C SER A 137 -9.858 13.785 8.393 1.00 0.00 C ATOM 2048 O SER A 137 -10.716 13.617 9.242 1.00 0.00 O ATOM 2049 CB SER A 137 -10.823 13.493 6.058 1.00 0.00 C ATOM 2050 OG SER A 137 -10.120 12.251 6.085 1.00 0.00 O ATOM 0 H SER A 137 -8.492 14.407 5.820 1.00 0.00 H new ATOM 0 HA SER A 137 -10.904 15.292 7.265 1.00 0.00 H new ATOM 0 HB2 SER A 137 -11.873 13.330 6.303 1.00 0.00 H new ATOM 0 HB3 SER A 137 -10.792 13.915 5.053 1.00 0.00 H new ATOM 0 HG SER A 137 -9.158 12.421 6.159 1.00 0.00 H new ATOM 2056 N GLN A 138 -8.594 13.351 8.556 1.00 0.00 N ATOM 2057 CA GLN A 138 -8.170 12.629 9.808 1.00 0.00 C ATOM 2058 C GLN A 138 -8.772 11.218 9.784 1.00 0.00 C ATOM 2059 O GLN A 138 -9.005 10.605 10.825 1.00 0.00 O ATOM 2060 CB GLN A 138 -8.647 13.392 11.069 1.00 0.00 C ATOM 2061 CG GLN A 138 -8.247 14.872 10.970 1.00 0.00 C ATOM 2062 CD GLN A 138 -6.889 15.078 11.644 1.00 0.00 C ATOM 2063 OE1 GLN A 138 -5.860 14.985 11.002 1.00 0.00 O ATOM 2064 NE2 GLN A 138 -6.838 15.353 12.919 1.00 0.00 N ATOM 0 H GLN A 138 -7.853 13.475 7.866 1.00 0.00 H new ATOM 0 HA GLN A 138 -7.082 12.571 9.844 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -9.729 13.305 11.169 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -8.207 12.947 11.962 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -8.197 15.177 9.925 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -9.001 15.497 11.448 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -7.700 15.431 13.459 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -5.936 15.490 13.376 1.00 0.00 H new ATOM 2073 N TYR A 139 -9.014 10.695 8.587 1.00 0.00 N ATOM 2074 CA TYR A 139 -9.593 9.323 8.440 1.00 0.00 C ATOM 2075 C TYR A 139 -8.512 8.353 7.954 1.00 0.00 C ATOM 2076 O TYR A 139 -8.826 7.194 7.812 1.00 0.00 O ATOM 2077 CB TYR A 139 -10.720 9.353 7.411 1.00 0.00 C ATOM 2078 CG TYR A 139 -12.007 9.756 8.078 1.00 0.00 C ATOM 2079 CD1 TYR A 139 -12.245 11.097 8.400 1.00 0.00 C ATOM 2080 CD2 TYR A 139 -12.961 8.784 8.376 1.00 0.00 C ATOM 2081 CE1 TYR A 139 -13.445 11.463 9.022 1.00 0.00 C ATOM 2082 CE2 TYR A 139 -14.159 9.146 8.996 1.00 0.00 C ATOM 2083 CZ TYR A 139 -14.402 10.485 9.321 1.00 0.00 C ATOM 2084 OH TYR A 139 -15.584 10.838 9.935 1.00 0.00 O ATOM 2085 OXT TYR A 139 -7.394 8.790 7.723 1.00 0.00 O ATOM 0 H TYR A 139 -8.829 11.174 7.706 1.00 0.00 H new ATOM 0 HA TYR A 139 -9.976 8.995 9.406 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -10.478 10.055 6.613 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -10.830 8.372 6.950 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -11.504 11.848 8.169 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -12.773 7.750 8.127 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -13.632 12.497 9.271 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -14.898 8.392 9.225 1.00 0.00 H new ATOM 0 HH TYR A 139 -16.135 10.038 10.069 1.00 0.00 H new