USER MOD reduce.3.24.130724 H: found=0, std=0, add=1275, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1275 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 157 HIS : no HD1:sc= -0.428 X(o=-0.43,f=0) USER MOD Set 1.2: A 160 HIS : no HD1:sc= 0 X(o=-0.43,f=-0.2) USER MOD Set 2.1: A 14 SER OG : rot 110:sc= 0.16 USER MOD Set 2.2: A 151 GLN : amide:sc= -0.423 K(o=-0.26,f=0.56) USER MOD Set 3.1: A 95 LYS NZ :NH3+ -178:sc= 0.599 (180deg=0.0402) USER MOD Set 3.2: A 147 TYR OH : rot 13:sc= 0.583 USER MOD Set 4.1: A 15 LYS NZ :NH3+ -174:sc= 0.346 (180deg=-0.324) USER MOD Set 4.2: A 24 TYR OH : rot 130:sc= 0.168 USER MOD Set 4.3: A 36 SER OG : rot -114:sc= 0.813 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -177:sc= 0 (180deg=-0.0104) USER MOD Single : A 8 LYS NZ :NH3+ 145:sc= 1.16 (180deg=0.357) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 30:sc= -0.165 USER MOD Single : A 16 GLN : amide:sc=-0.00947 X(o=-0.0095,f=-0.0095) USER MOD Single : A 18 THR OG1 : rot -5:sc= 0.275 USER MOD Single : A 20 MET CE :methyl 154:sc= -1.1 (180deg=-3.2!) USER MOD Single : A 26 ASN : amide:sc= -0.036 K(o=-0.036,f=-8.5!) USER MOD Single : A 27 SER OG : rot -13:sc= 0.116 USER MOD Single : A 28 LYS NZ :NH3+ -171:sc= 0.208 (180deg=0.0305) USER MOD Single : A 34 ASN : amide:sc= -1.08 K(o=-1.1,f=-2.2!) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -1.04 K(o=-1,f=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -1.35 K(o=-1.3,f=-1.9!) USER MOD Single : A 52 LYS NZ :NH3+ -166:sc= 0.574 (180deg=0.299) USER MOD Single : A 55 TYR OH : rot 180:sc= -0.344 USER MOD Single : A 58 MET CE :methyl -122:sc= -1.74 (180deg=-2.33) USER MOD Single : A 62 THR OG1 : rot 75:sc= 0.17 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 HIS : no HD1:sc= -0.0741 X(o=-0.074,f=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.684 USER MOD Single : A 81 LYS NZ :NH3+ 141:sc= -0.311 (180deg=-2.11!) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 86 ASN : amide:sc= -2.27! K(o=-2.3!,f=-1.1) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ -175:sc=-0.00508 (180deg=-0.0672) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc=-0.00189 USER MOD Single : A 104 GLN : amide:sc= 0.103 X(o=0.1,f=0) USER MOD Single : A 114 GLN : amide:sc= -0.136 X(o=-0.14,f=-0.068) USER MOD Single : A 115 THR OG1 : rot 72:sc= 1.2 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 ASN : amide:sc= -0.0603 X(o=-0.06,f=-0.48) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc=-0.00236 X(o=-0.0024,f=-0.32) USER MOD Single : A 122 TYR OH : rot -73:sc= 0.135 USER MOD Single : A 124 GLN : amide:sc= -0.942 K(o=-0.94,f=-0.19) USER MOD Single : A 127 HIS : no HD1:sc= -0.0138 X(o=-0.014,f=0) USER MOD Single : A 129 HIS : no HD1:sc= -0.808 K(o=-0.81,f=-0.14) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 HIS : no HD1:sc= -0.185 K(o=-0.19,f=-0.86) USER MOD Single : A 140 GLN : amide:sc= -2.18! C(o=-2.2!,f=-5.2!) USER MOD Single : A 145 THR OG1 : rot 5:sc= 0.24 USER MOD Single : A 155 HIS : no HD1:sc= -0.0135 X(o=-0.013,f=0) USER MOD Single : A 156 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 158 HIS : no HD1:sc= -0.0671 X(o=-0.067,f=-0.2) USER MOD Single : A 159 HIS : no HD1:sc= -0.0343 K(o=-0.034,f=-0.56) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -19.794 20.243 -21.919 1.00 11.12 N ATOM 2 CA MET A 1 -20.422 18.963 -21.501 1.00 44.24 C ATOM 3 C MET A 1 -19.328 17.923 -21.227 1.00 3.24 C ATOM 4 O MET A 1 -18.716 17.411 -22.173 1.00 23.32 O ATOM 5 CB MET A 1 -21.400 18.438 -22.597 1.00 62.31 C ATOM 6 CG MET A 1 -22.631 19.315 -22.845 1.00 1.45 C ATOM 7 SD MET A 1 -23.725 19.404 -21.410 1.00 25.00 S ATOM 8 CE MET A 1 -25.145 20.251 -22.101 1.00 40.53 C ATOM 0 H1 MET A 1 -20.532 20.963 -22.056 1.00 11.12 H new ATOM 0 H2 MET A 1 -19.132 20.561 -21.183 1.00 11.12 H new ATOM 0 H3 MET A 1 -19.279 20.102 -22.811 1.00 11.12 H new ATOM 0 HA MET A 1 -20.997 19.136 -20.591 1.00 44.24 H new ATOM 0 HB2 MET A 1 -20.851 18.337 -23.533 1.00 62.31 H new ATOM 0 HB3 MET A 1 -21.735 17.440 -22.315 1.00 62.31 H new ATOM 0 HG2 MET A 1 -22.307 20.321 -23.113 1.00 1.45 H new ATOM 0 HG3 MET A 1 -23.187 18.922 -23.696 1.00 1.45 H new ATOM 0 HE1 MET A 1 -25.904 20.377 -21.329 1.00 40.53 H new ATOM 0 HE2 MET A 1 -24.840 21.229 -22.473 1.00 40.53 H new ATOM 0 HE3 MET A 1 -25.556 19.663 -22.922 1.00 40.53 H new ATOM 20 N VAL A 2 -19.048 17.649 -19.938 1.00 0.43 N ATOM 21 CA VAL A 2 -18.125 16.578 -19.530 1.00 21.34 C ATOM 22 C VAL A 2 -18.820 15.208 -19.626 1.00 70.21 C ATOM 23 O VAL A 2 -20.059 15.110 -19.666 1.00 41.43 O ATOM 24 CB VAL A 2 -17.541 16.797 -18.071 1.00 51.42 C ATOM 25 CG1 VAL A 2 -16.793 18.155 -17.967 1.00 51.04 C ATOM 26 CG2 VAL A 2 -18.644 16.668 -16.990 1.00 21.32 C ATOM 0 H VAL A 2 -19.454 18.162 -19.156 1.00 0.43 H new ATOM 0 HA VAL A 2 -17.281 16.607 -20.219 1.00 21.34 H new ATOM 0 HB VAL A 2 -16.815 16.006 -17.883 1.00 51.42 H new ATOM 0 HG11 VAL A 2 -16.403 18.279 -16.957 1.00 51.04 H new ATOM 0 HG12 VAL A 2 -15.968 18.171 -18.679 1.00 51.04 H new ATOM 0 HG13 VAL A 2 -17.483 18.968 -18.192 1.00 51.04 H new ATOM 0 HG21 VAL A 2 -18.207 16.824 -16.004 1.00 21.32 H new ATOM 0 HG22 VAL A 2 -19.416 17.416 -17.167 1.00 21.32 H new ATOM 0 HG23 VAL A 2 -19.086 15.673 -17.038 1.00 21.32 H new ATOM 36 N GLU A 3 -17.999 14.160 -19.682 1.00 14.03 N ATOM 37 CA GLU A 3 -18.455 12.763 -19.717 1.00 31.43 C ATOM 38 C GLU A 3 -18.742 12.284 -18.264 1.00 51.42 C ATOM 39 O GLU A 3 -18.227 12.889 -17.321 1.00 3.01 O ATOM 40 CB GLU A 3 -17.390 11.873 -20.449 1.00 52.11 C ATOM 41 CG GLU A 3 -17.322 12.046 -21.983 1.00 25.21 C ATOM 42 CD GLU A 3 -16.951 13.471 -22.437 1.00 55.23 C ATOM 43 OE1 GLU A 3 -15.763 13.859 -22.306 1.00 13.21 O ATOM 44 OE2 GLU A 3 -17.835 14.207 -22.928 1.00 72.02 O ATOM 0 H GLU A 3 -16.984 14.254 -19.705 1.00 14.03 H new ATOM 0 HA GLU A 3 -19.383 12.676 -20.283 1.00 31.43 H new ATOM 0 HB2 GLU A 3 -16.408 12.095 -20.032 1.00 52.11 H new ATOM 0 HB3 GLU A 3 -17.602 10.827 -20.228 1.00 52.11 H new ATOM 0 HG2 GLU A 3 -16.590 11.345 -22.385 1.00 25.21 H new ATOM 0 HG3 GLU A 3 -18.288 11.779 -22.412 1.00 25.21 H new ATOM 51 N PRO A 4 -19.561 11.195 -18.055 1.00 44.14 N ATOM 52 CA PRO A 4 -20.038 10.775 -16.699 1.00 52.11 C ATOM 53 C PRO A 4 -18.990 10.030 -15.818 1.00 63.42 C ATOM 54 O PRO A 4 -19.356 9.145 -15.028 1.00 35.11 O ATOM 55 CB PRO A 4 -21.235 9.855 -17.064 1.00 32.24 C ATOM 56 CG PRO A 4 -20.827 9.210 -18.346 1.00 2.43 C ATOM 57 CD PRO A 4 -20.117 10.297 -19.117 1.00 31.25 C ATOM 0 HA PRO A 4 -20.278 11.635 -16.073 1.00 52.11 H new ATOM 0 HB2 PRO A 4 -21.418 9.113 -16.286 1.00 32.24 H new ATOM 0 HB3 PRO A 4 -22.155 10.427 -17.182 1.00 32.24 H new ATOM 0 HG2 PRO A 4 -20.171 8.358 -18.169 1.00 2.43 H new ATOM 0 HG3 PRO A 4 -21.692 8.837 -18.894 1.00 2.43 H new ATOM 0 HD2 PRO A 4 -19.327 9.888 -19.747 1.00 31.25 H new ATOM 0 HD3 PRO A 4 -20.803 10.833 -19.773 1.00 31.25 H new ATOM 65 N GLY A 5 -17.703 10.401 -15.924 1.00 24.32 N ATOM 66 CA GLY A 5 -16.658 9.850 -15.050 1.00 45.32 C ATOM 67 C GLY A 5 -15.960 8.652 -15.676 1.00 53.13 C ATOM 68 O GLY A 5 -14.783 8.738 -16.024 1.00 33.21 O ATOM 0 H GLY A 5 -17.363 11.079 -16.606 1.00 24.32 H new ATOM 0 HA2 GLY A 5 -15.922 10.625 -14.833 1.00 45.32 H new ATOM 0 HA3 GLY A 5 -17.100 9.555 -14.099 1.00 45.32 H new ATOM 72 N VAL A 6 -16.723 7.549 -15.833 1.00 73.01 N ATOM 73 CA VAL A 6 -16.264 6.263 -16.441 1.00 11.13 C ATOM 74 C VAL A 6 -15.235 5.538 -15.535 1.00 61.02 C ATOM 75 O VAL A 6 -15.464 4.402 -15.097 1.00 71.15 O ATOM 76 CB VAL A 6 -15.695 6.437 -17.907 1.00 42.22 C ATOM 77 CG1 VAL A 6 -15.226 5.091 -18.513 1.00 1.10 C ATOM 78 CG2 VAL A 6 -16.727 7.139 -18.829 1.00 74.34 C ATOM 0 H VAL A 6 -17.699 7.518 -15.537 1.00 73.01 H new ATOM 0 HA VAL A 6 -17.154 5.638 -16.521 1.00 11.13 H new ATOM 0 HB VAL A 6 -14.816 7.078 -17.835 1.00 42.22 H new ATOM 0 HG11 VAL A 6 -14.843 5.259 -19.520 1.00 1.10 H new ATOM 0 HG12 VAL A 6 -14.438 4.667 -17.891 1.00 1.10 H new ATOM 0 HG13 VAL A 6 -16.067 4.398 -18.555 1.00 1.10 H new ATOM 0 HG21 VAL A 6 -16.308 7.245 -19.830 1.00 74.34 H new ATOM 0 HG22 VAL A 6 -17.637 6.541 -18.878 1.00 74.34 H new ATOM 0 HG23 VAL A 6 -16.962 8.125 -18.428 1.00 74.34 H new ATOM 88 N ALA A 7 -14.087 6.183 -15.292 1.00 3.44 N ATOM 89 CA ALA A 7 -13.108 5.755 -14.280 1.00 44.32 C ATOM 90 C ALA A 7 -13.516 6.340 -12.913 1.00 22.12 C ATOM 91 O ALA A 7 -13.393 7.544 -12.695 1.00 34.33 O ATOM 92 CB ALA A 7 -11.691 6.215 -14.681 1.00 61.51 C ATOM 0 H ALA A 7 -13.807 7.025 -15.796 1.00 3.44 H new ATOM 0 HA ALA A 7 -13.095 4.667 -14.211 1.00 44.32 H new ATOM 0 HB1 ALA A 7 -10.976 5.892 -13.924 1.00 61.51 H new ATOM 0 HB2 ALA A 7 -11.425 5.776 -15.643 1.00 61.51 H new ATOM 0 HB3 ALA A 7 -11.670 7.302 -14.760 1.00 61.51 H new ATOM 98 N LYS A 8 -14.069 5.492 -12.029 1.00 63.24 N ATOM 99 CA LYS A 8 -14.418 5.867 -10.632 1.00 11.12 C ATOM 100 C LYS A 8 -13.194 5.602 -9.740 1.00 21.22 C ATOM 101 O LYS A 8 -12.762 6.457 -8.971 1.00 72.44 O ATOM 102 CB LYS A 8 -15.660 5.069 -10.105 1.00 32.24 C ATOM 103 CG LYS A 8 -16.990 5.280 -10.889 1.00 44.21 C ATOM 104 CD LYS A 8 -17.027 4.572 -12.266 1.00 21.10 C ATOM 105 CE LYS A 8 -16.873 3.044 -12.156 1.00 53.34 C ATOM 106 NZ LYS A 8 -16.640 2.397 -13.474 1.00 60.12 N ATOM 0 H LYS A 8 -14.290 4.523 -12.256 1.00 63.24 H new ATOM 0 HA LYS A 8 -14.688 6.923 -10.607 1.00 11.12 H new ATOM 0 HB2 LYS A 8 -15.417 4.006 -10.120 1.00 32.24 H new ATOM 0 HB3 LYS A 8 -15.828 5.343 -9.063 1.00 32.24 H new ATOM 0 HG2 LYS A 8 -17.819 4.916 -10.282 1.00 44.21 H new ATOM 0 HG3 LYS A 8 -17.148 6.348 -11.037 1.00 44.21 H new ATOM 0 HD2 LYS A 8 -17.969 4.803 -12.763 1.00 21.10 H new ATOM 0 HD3 LYS A 8 -16.230 4.969 -12.895 1.00 21.10 H new ATOM 0 HE2 LYS A 8 -16.042 2.813 -11.490 1.00 53.34 H new ATOM 0 HE3 LYS A 8 -17.771 2.624 -11.703 1.00 53.34 H new ATOM 0 HZ1 LYS A 8 -15.996 1.589 -13.355 1.00 60.12 H new ATOM 0 HZ2 LYS A 8 -17.546 2.064 -13.862 1.00 60.12 H new ATOM 0 HZ3 LYS A 8 -16.215 3.085 -14.128 1.00 60.12 H new ATOM 120 N LEU A 9 -12.660 4.385 -9.870 1.00 1.51 N ATOM 121 CA LEU A 9 -11.390 3.978 -9.256 1.00 12.20 C ATOM 122 C LEU A 9 -10.876 2.748 -10.009 1.00 74.44 C ATOM 123 O LEU A 9 -11.559 1.718 -10.075 1.00 2.25 O ATOM 124 CB LEU A 9 -11.530 3.683 -7.736 1.00 51.11 C ATOM 125 CG LEU A 9 -10.192 3.388 -6.981 1.00 35.01 C ATOM 126 CD1 LEU A 9 -9.197 4.573 -7.100 1.00 20.31 C ATOM 127 CD2 LEU A 9 -10.457 3.018 -5.504 1.00 62.04 C ATOM 0 H LEU A 9 -13.103 3.643 -10.412 1.00 1.51 H new ATOM 0 HA LEU A 9 -10.679 4.800 -9.334 1.00 12.20 H new ATOM 0 HB2 LEU A 9 -12.014 4.536 -7.261 1.00 51.11 H new ATOM 0 HB3 LEU A 9 -12.194 2.828 -7.609 1.00 51.11 H new ATOM 0 HG LEU A 9 -9.726 2.527 -7.460 1.00 35.01 H new ATOM 0 HD11 LEU A 9 -8.279 4.333 -6.564 1.00 20.31 H new ATOM 0 HD12 LEU A 9 -8.967 4.751 -8.151 1.00 20.31 H new ATOM 0 HD13 LEU A 9 -9.645 5.469 -6.670 1.00 20.31 H new ATOM 0 HD21 LEU A 9 -9.510 2.818 -5.003 1.00 62.04 H new ATOM 0 HD22 LEU A 9 -10.963 3.846 -5.007 1.00 62.04 H new ATOM 0 HD23 LEU A 9 -11.086 2.129 -5.459 1.00 62.04 H new ATOM 139 N THR A 10 -9.678 2.880 -10.578 1.00 43.53 N ATOM 140 CA THR A 10 -9.065 1.872 -11.450 1.00 61.50 C ATOM 141 C THR A 10 -7.564 1.754 -11.090 1.00 33.15 C ATOM 142 O THR A 10 -6.993 2.688 -10.496 1.00 53.14 O ATOM 143 CB THR A 10 -9.282 2.280 -12.957 1.00 3.14 C ATOM 144 OG1 THR A 10 -10.683 2.449 -13.209 1.00 55.13 O ATOM 145 CG2 THR A 10 -8.739 1.254 -13.964 1.00 23.21 C ATOM 0 H THR A 10 -9.093 3.705 -10.445 1.00 43.53 H new ATOM 0 HA THR A 10 -9.529 0.897 -11.305 1.00 61.50 H new ATOM 0 HB THR A 10 -8.725 3.206 -13.100 1.00 3.14 H new ATOM 0 HG1 THR A 10 -10.818 2.704 -14.145 1.00 55.13 H new ATOM 0 HG21 THR A 10 -8.926 1.606 -14.979 1.00 23.21 H new ATOM 0 HG22 THR A 10 -7.666 1.130 -13.815 1.00 23.21 H new ATOM 0 HG23 THR A 10 -9.239 0.297 -13.814 1.00 23.21 H new ATOM 153 N THR A 11 -6.950 0.608 -11.443 1.00 3.33 N ATOM 154 CA THR A 11 -5.555 0.252 -11.096 1.00 71.01 C ATOM 155 C THR A 11 -4.478 1.299 -11.481 1.00 50.42 C ATOM 156 O THR A 11 -3.382 1.219 -10.949 1.00 34.21 O ATOM 157 CB THR A 11 -5.158 -1.156 -11.666 1.00 11.13 C ATOM 158 OG1 THR A 11 -5.533 -1.253 -13.051 1.00 63.24 O ATOM 159 CG2 THR A 11 -5.809 -2.311 -10.880 1.00 53.35 C ATOM 0 H THR A 11 -7.419 -0.114 -11.990 1.00 3.33 H new ATOM 0 HA THR A 11 -5.562 0.228 -10.006 1.00 71.01 H new ATOM 0 HB THR A 11 -4.077 -1.248 -11.562 1.00 11.13 H new ATOM 0 HG1 THR A 11 -5.280 -2.134 -13.398 1.00 63.24 H new ATOM 0 HG21 THR A 11 -5.503 -3.263 -11.313 1.00 53.35 H new ATOM 0 HG22 THR A 11 -5.491 -2.267 -9.838 1.00 53.35 H new ATOM 0 HG23 THR A 11 -6.894 -2.220 -10.932 1.00 53.35 H new ATOM 167 N TYR A 12 -4.768 2.249 -12.405 1.00 12.02 N ATOM 168 CA TYR A 12 -3.800 3.322 -12.793 1.00 34.22 C ATOM 169 C TYR A 12 -3.300 4.118 -11.556 1.00 31.11 C ATOM 170 O TYR A 12 -2.122 4.470 -11.465 1.00 32.53 O ATOM 171 CB TYR A 12 -4.413 4.293 -13.850 1.00 21.23 C ATOM 172 CG TYR A 12 -5.472 5.297 -13.321 1.00 34.44 C ATOM 173 CD1 TYR A 12 -6.800 4.922 -13.119 1.00 34.33 C ATOM 174 CD2 TYR A 12 -5.130 6.630 -13.022 1.00 73.01 C ATOM 175 CE1 TYR A 12 -7.744 5.823 -12.648 1.00 42.42 C ATOM 176 CE2 TYR A 12 -6.072 7.526 -12.550 1.00 10.15 C ATOM 177 CZ TYR A 12 -7.372 7.122 -12.367 1.00 23.35 C ATOM 178 OH TYR A 12 -8.309 8.027 -11.915 1.00 52.14 O ATOM 0 H TYR A 12 -5.660 2.299 -12.897 1.00 12.02 H new ATOM 0 HA TYR A 12 -2.942 2.823 -13.245 1.00 34.22 H new ATOM 0 HB2 TYR A 12 -3.602 4.859 -14.307 1.00 21.23 H new ATOM 0 HB3 TYR A 12 -4.870 3.697 -14.640 1.00 21.23 H new ATOM 0 HD1 TYR A 12 -7.100 3.907 -13.334 1.00 34.33 H new ATOM 0 HD2 TYR A 12 -4.111 6.959 -13.164 1.00 73.01 H new ATOM 0 HE1 TYR A 12 -8.767 5.509 -12.502 1.00 42.42 H new ATOM 0 HE2 TYR A 12 -5.786 8.543 -12.325 1.00 10.15 H new ATOM 0 HH TYR A 12 -9.003 7.555 -11.409 1.00 52.14 H new ATOM 188 N ALA A 13 -4.224 4.355 -10.605 1.00 11.51 N ATOM 189 CA ALA A 13 -3.930 5.034 -9.328 1.00 53.12 C ATOM 190 C ALA A 13 -2.946 4.199 -8.479 1.00 72.54 C ATOM 191 O ALA A 13 -2.023 4.735 -7.851 1.00 52.11 O ATOM 192 CB ALA A 13 -5.248 5.272 -8.568 1.00 54.44 C ATOM 0 H ALA A 13 -5.201 4.079 -10.702 1.00 11.51 H new ATOM 0 HA ALA A 13 -3.455 5.994 -9.530 1.00 53.12 H new ATOM 0 HB1 ALA A 13 -5.038 5.773 -7.623 1.00 54.44 H new ATOM 0 HB2 ALA A 13 -5.908 5.896 -9.171 1.00 54.44 H new ATOM 0 HB3 ALA A 13 -5.732 4.316 -8.371 1.00 54.44 H new ATOM 198 N SER A 14 -3.151 2.872 -8.518 1.00 63.42 N ATOM 199 CA SER A 14 -2.350 1.889 -7.773 1.00 71.51 C ATOM 200 C SER A 14 -0.989 1.621 -8.455 1.00 31.50 C ATOM 201 O SER A 14 -0.004 1.284 -7.785 1.00 71.54 O ATOM 202 CB SER A 14 -3.160 0.582 -7.649 1.00 53.01 C ATOM 203 OG SER A 14 -4.472 0.865 -7.200 1.00 2.24 O ATOM 0 H SER A 14 -3.890 2.446 -9.077 1.00 63.42 H new ATOM 0 HA SER A 14 -2.134 2.291 -6.783 1.00 71.51 H new ATOM 0 HB2 SER A 14 -3.198 0.076 -8.614 1.00 53.01 H new ATOM 0 HB3 SER A 14 -2.667 -0.096 -6.952 1.00 53.01 H new ATOM 0 HG SER A 14 -5.108 0.709 -7.929 1.00 2.24 H new ATOM 209 N LYS A 15 -0.959 1.796 -9.789 1.00 75.52 N ATOM 210 CA LYS A 15 0.227 1.543 -10.633 1.00 40.12 C ATOM 211 C LYS A 15 1.294 2.611 -10.421 1.00 35.54 C ATOM 212 O LYS A 15 2.468 2.301 -10.242 1.00 53.13 O ATOM 213 CB LYS A 15 -0.167 1.486 -12.142 1.00 71.45 C ATOM 214 CG LYS A 15 -0.779 0.146 -12.585 1.00 13.45 C ATOM 215 CD LYS A 15 0.225 -1.020 -12.494 1.00 21.51 C ATOM 216 CE LYS A 15 -0.354 -2.344 -13.004 1.00 34.10 C ATOM 217 NZ LYS A 15 0.681 -3.402 -12.990 1.00 11.25 N ATOM 0 H LYS A 15 -1.767 2.121 -10.319 1.00 75.52 H new ATOM 0 HA LYS A 15 0.638 0.578 -10.336 1.00 40.12 H new ATOM 0 HB2 LYS A 15 -0.880 2.284 -12.350 1.00 71.45 H new ATOM 0 HB3 LYS A 15 0.719 1.685 -12.745 1.00 71.45 H new ATOM 0 HG2 LYS A 15 -1.647 -0.077 -11.964 1.00 13.45 H new ATOM 0 HG3 LYS A 15 -1.136 0.235 -13.611 1.00 13.45 H new ATOM 0 HD2 LYS A 15 1.116 -0.772 -13.071 1.00 21.51 H new ATOM 0 HD3 LYS A 15 0.540 -1.142 -11.458 1.00 21.51 H new ATOM 0 HE2 LYS A 15 -1.197 -2.643 -12.381 1.00 34.10 H new ATOM 0 HE3 LYS A 15 -0.736 -2.214 -14.016 1.00 34.10 H new ATOM 0 HZ1 LYS A 15 0.302 -4.264 -13.432 1.00 11.25 H new ATOM 0 HZ2 LYS A 15 1.515 -3.079 -13.520 1.00 11.25 H new ATOM 0 HZ3 LYS A 15 0.953 -3.608 -12.008 1.00 11.25 H new ATOM 231 N GLN A 16 0.863 3.879 -10.467 1.00 65.51 N ATOM 232 CA GLN A 16 1.761 5.031 -10.282 1.00 24.40 C ATOM 233 C GLN A 16 2.222 5.128 -8.820 1.00 75.32 C ATOM 234 O GLN A 16 3.255 5.725 -8.541 1.00 25.01 O ATOM 235 CB GLN A 16 1.077 6.346 -10.730 1.00 62.14 C ATOM 236 CG GLN A 16 0.502 6.332 -12.165 1.00 70.34 C ATOM 237 CD GLN A 16 1.526 5.991 -13.240 1.00 24.33 C ATOM 238 OE1 GLN A 16 2.195 6.868 -13.787 1.00 13.45 O ATOM 239 NE2 GLN A 16 1.648 4.711 -13.560 1.00 15.11 N ATOM 0 H GLN A 16 -0.110 4.136 -10.632 1.00 65.51 H new ATOM 0 HA GLN A 16 2.639 4.879 -10.909 1.00 24.40 H new ATOM 0 HB2 GLN A 16 0.269 6.572 -10.034 1.00 62.14 H new ATOM 0 HB3 GLN A 16 1.800 7.158 -10.653 1.00 62.14 H new ATOM 0 HG2 GLN A 16 -0.313 5.610 -12.212 1.00 70.34 H new ATOM 0 HG3 GLN A 16 0.074 7.310 -12.383 1.00 70.34 H new ATOM 0 HE21 GLN A 16 1.078 4.010 -13.086 1.00 15.11 H new ATOM 0 HE22 GLN A 16 2.312 4.426 -14.280 1.00 15.11 H new ATOM 248 N ALA A 17 1.434 4.524 -7.906 1.00 31.01 N ATOM 249 CA ALA A 17 1.751 4.466 -6.473 1.00 62.02 C ATOM 250 C ALA A 17 2.871 3.452 -6.196 1.00 25.01 C ATOM 251 O ALA A 17 3.792 3.743 -5.433 1.00 54.24 O ATOM 252 CB ALA A 17 0.500 4.125 -5.661 1.00 32.40 C ATOM 0 H ALA A 17 0.557 4.062 -8.148 1.00 31.01 H new ATOM 0 HA ALA A 17 2.106 5.449 -6.165 1.00 62.02 H new ATOM 0 HB1 ALA A 17 0.753 4.086 -4.602 1.00 32.40 H new ATOM 0 HB2 ALA A 17 -0.260 4.889 -5.825 1.00 32.40 H new ATOM 0 HB3 ALA A 17 0.114 3.156 -5.977 1.00 32.40 H new ATOM 258 N THR A 18 2.782 2.257 -6.816 1.00 63.54 N ATOM 259 CA THR A 18 3.827 1.217 -6.693 1.00 12.52 C ATOM 260 C THR A 18 5.114 1.652 -7.408 1.00 4.05 C ATOM 261 O THR A 18 6.222 1.457 -6.890 1.00 20.04 O ATOM 262 CB THR A 18 3.344 -0.156 -7.250 1.00 55.53 C ATOM 263 OG1 THR A 18 2.821 0.002 -8.579 1.00 1.41 O ATOM 264 CG2 THR A 18 2.280 -0.792 -6.355 1.00 10.41 C ATOM 0 H THR A 18 1.996 1.987 -7.408 1.00 63.54 H new ATOM 0 HA THR A 18 4.036 1.094 -5.630 1.00 12.52 H new ATOM 0 HB THR A 18 4.209 -0.819 -7.271 1.00 55.53 H new ATOM 0 HG1 THR A 18 2.807 0.953 -8.814 1.00 1.41 H new ATOM 0 HG21 THR A 18 1.971 -1.747 -6.780 1.00 10.41 H new ATOM 0 HG22 THR A 18 2.692 -0.954 -5.359 1.00 10.41 H new ATOM 0 HG23 THR A 18 1.418 -0.129 -6.288 1.00 10.41 H new ATOM 272 N ASP A 19 4.928 2.273 -8.586 1.00 24.14 N ATOM 273 CA ASP A 19 6.009 2.858 -9.407 1.00 11.53 C ATOM 274 C ASP A 19 6.727 3.980 -8.630 1.00 72.20 C ATOM 275 O ASP A 19 7.926 4.210 -8.808 1.00 43.43 O ATOM 276 CB ASP A 19 5.413 3.392 -10.735 1.00 62.21 C ATOM 277 CG ASP A 19 6.470 3.930 -11.709 1.00 52.41 C ATOM 278 OD1 ASP A 19 7.128 3.118 -12.398 1.00 23.34 O ATOM 279 OD2 ASP A 19 6.650 5.163 -11.791 1.00 22.30 O ATOM 0 H ASP A 19 4.005 2.386 -9.004 1.00 24.14 H new ATOM 0 HA ASP A 19 6.747 2.090 -9.637 1.00 11.53 H new ATOM 0 HB2 ASP A 19 4.856 2.591 -11.222 1.00 62.21 H new ATOM 0 HB3 ASP A 19 4.700 4.185 -10.511 1.00 62.21 H new ATOM 284 N MET A 20 5.961 4.658 -7.758 1.00 4.20 N ATOM 285 CA MET A 20 6.475 5.710 -6.859 1.00 53.41 C ATOM 286 C MET A 20 7.203 5.070 -5.663 1.00 34.21 C ATOM 287 O MET A 20 8.220 5.577 -5.197 1.00 53.01 O ATOM 288 CB MET A 20 5.287 6.566 -6.338 1.00 75.53 C ATOM 289 CG MET A 20 5.655 7.944 -5.777 1.00 50.11 C ATOM 290 SD MET A 20 6.143 9.098 -7.071 1.00 5.23 S ATOM 291 CE MET A 20 4.724 9.005 -8.169 1.00 50.40 C ATOM 0 H MET A 20 4.960 4.491 -7.655 1.00 4.20 H new ATOM 0 HA MET A 20 7.174 6.341 -7.408 1.00 53.41 H new ATOM 0 HB2 MET A 20 4.578 6.704 -7.154 1.00 75.53 H new ATOM 0 HB3 MET A 20 4.772 6.003 -5.560 1.00 75.53 H new ATOM 0 HG2 MET A 20 4.804 8.351 -5.232 1.00 50.11 H new ATOM 0 HG3 MET A 20 6.470 7.837 -5.062 1.00 50.11 H new ATOM 0 HE1 MET A 20 4.637 9.935 -8.731 1.00 50.40 H new ATOM 0 HE2 MET A 20 4.854 8.173 -8.861 1.00 50.40 H new ATOM 0 HE3 MET A 20 3.819 8.851 -7.582 1.00 50.40 H new ATOM 301 N GLY A 21 6.639 3.945 -5.184 1.00 72.43 N ATOM 302 CA GLY A 21 7.121 3.235 -3.999 1.00 71.54 C ATOM 303 C GLY A 21 5.958 2.846 -3.086 1.00 62.21 C ATOM 304 O GLY A 21 5.599 3.603 -2.181 1.00 4.24 O ATOM 0 H GLY A 21 5.828 3.504 -5.618 1.00 72.43 H new ATOM 0 HA2 GLY A 21 7.665 2.341 -4.302 1.00 71.54 H new ATOM 0 HA3 GLY A 21 7.823 3.865 -3.453 1.00 71.54 H new ATOM 308 N ALA A 22 5.345 1.676 -3.365 1.00 41.34 N ATOM 309 CA ALA A 22 4.241 1.111 -2.556 1.00 52.12 C ATOM 310 C ALA A 22 4.179 -0.417 -2.721 1.00 23.53 C ATOM 311 O ALA A 22 4.637 -0.956 -3.739 1.00 31.10 O ATOM 312 CB ALA A 22 2.892 1.761 -2.917 1.00 54.20 C ATOM 0 H ALA A 22 5.602 1.093 -4.161 1.00 41.34 H new ATOM 0 HA ALA A 22 4.442 1.335 -1.508 1.00 52.12 H new ATOM 0 HB1 ALA A 22 2.102 1.324 -2.306 1.00 54.20 H new ATOM 0 HB2 ALA A 22 2.944 2.834 -2.731 1.00 54.20 H new ATOM 0 HB3 ALA A 22 2.674 1.586 -3.970 1.00 54.20 H new ATOM 318 N ILE A 23 3.613 -1.102 -1.704 1.00 54.35 N ATOM 319 CA ILE A 23 3.509 -2.579 -1.653 1.00 71.35 C ATOM 320 C ILE A 23 2.039 -3.019 -1.536 1.00 23.01 C ATOM 321 O ILE A 23 1.224 -2.324 -0.919 1.00 42.52 O ATOM 322 CB ILE A 23 4.326 -3.179 -0.434 1.00 32.32 C ATOM 323 CG1 ILE A 23 3.837 -2.558 0.927 1.00 71.32 C ATOM 324 CG2 ILE A 23 5.851 -2.975 -0.627 1.00 23.41 C ATOM 325 CD1 ILE A 23 4.474 -3.135 2.185 1.00 61.21 C ATOM 0 H ILE A 23 3.211 -0.642 -0.887 1.00 54.35 H new ATOM 0 HA ILE A 23 3.933 -2.960 -2.582 1.00 71.35 H new ATOM 0 HB ILE A 23 4.139 -4.252 -0.400 1.00 32.32 H new ATOM 0 HG12 ILE A 23 4.028 -1.485 0.905 1.00 71.32 H new ATOM 0 HG13 ILE A 23 2.757 -2.688 0.997 1.00 71.32 H new ATOM 0 HG21 ILE A 23 6.385 -3.397 0.225 1.00 23.41 H new ATOM 0 HG22 ILE A 23 6.172 -3.475 -1.541 1.00 23.41 H new ATOM 0 HG23 ILE A 23 6.069 -1.910 -0.701 1.00 23.41 H new ATOM 0 HD11 ILE A 23 4.064 -2.635 3.063 1.00 61.21 H new ATOM 0 HD12 ILE A 23 4.262 -4.202 2.244 1.00 61.21 H new ATOM 0 HD13 ILE A 23 5.553 -2.981 2.150 1.00 61.21 H new ATOM 337 N TYR A 24 1.704 -4.191 -2.107 1.00 20.31 N ATOM 338 CA TYR A 24 0.375 -4.799 -1.944 1.00 4.32 C ATOM 339 C TYR A 24 0.463 -5.850 -0.836 1.00 74.31 C ATOM 340 O TYR A 24 1.265 -6.794 -0.917 1.00 34.41 O ATOM 341 CB TYR A 24 -0.124 -5.491 -3.239 1.00 21.35 C ATOM 342 CG TYR A 24 -0.297 -4.578 -4.463 1.00 61.30 C ATOM 343 CD1 TYR A 24 -1.399 -3.723 -4.580 1.00 33.11 C ATOM 344 CD2 TYR A 24 0.621 -4.601 -5.516 1.00 64.25 C ATOM 345 CE1 TYR A 24 -1.568 -2.923 -5.700 1.00 51.15 C ATOM 346 CE2 TYR A 24 0.453 -3.802 -6.627 1.00 54.05 C ATOM 347 CZ TYR A 24 -0.638 -2.969 -6.720 1.00 42.51 C ATOM 348 OH TYR A 24 -0.797 -2.182 -7.845 1.00 4.05 O ATOM 0 H TYR A 24 2.341 -4.736 -2.688 1.00 20.31 H new ATOM 0 HA TYR A 24 -0.330 -4.005 -1.700 1.00 4.32 H new ATOM 0 HB2 TYR A 24 0.577 -6.284 -3.498 1.00 21.35 H new ATOM 0 HB3 TYR A 24 -1.081 -5.968 -3.028 1.00 21.35 H new ATOM 0 HD1 TYR A 24 -2.129 -3.686 -3.785 1.00 33.11 H new ATOM 0 HD2 TYR A 24 1.478 -5.256 -5.459 1.00 64.25 H new ATOM 0 HE1 TYR A 24 -2.423 -2.267 -5.774 1.00 51.15 H new ATOM 0 HE2 TYR A 24 1.179 -3.830 -7.426 1.00 54.05 H new ATOM 0 HH TYR A 24 0.035 -1.697 -8.025 1.00 4.05 H new ATOM 358 N VAL A 25 -0.347 -5.657 0.201 1.00 25.31 N ATOM 359 CA VAL A 25 -0.525 -6.605 1.304 1.00 12.15 C ATOM 360 C VAL A 25 -1.965 -7.157 1.256 1.00 51.11 C ATOM 361 O VAL A 25 -2.776 -6.701 0.447 1.00 11.25 O ATOM 362 CB VAL A 25 -0.215 -5.923 2.698 1.00 70.01 C ATOM 363 CG1 VAL A 25 1.238 -5.380 2.746 1.00 75.14 C ATOM 364 CG2 VAL A 25 -1.232 -4.814 3.067 1.00 42.21 C ATOM 0 H VAL A 25 -0.914 -4.815 0.303 1.00 25.31 H new ATOM 0 HA VAL A 25 0.180 -7.429 1.193 1.00 12.15 H new ATOM 0 HB VAL A 25 -0.318 -6.704 3.451 1.00 70.01 H new ATOM 0 HG11 VAL A 25 1.422 -4.917 3.716 1.00 75.14 H new ATOM 0 HG12 VAL A 25 1.939 -6.202 2.598 1.00 75.14 H new ATOM 0 HG13 VAL A 25 1.376 -4.639 1.958 1.00 75.14 H new ATOM 0 HG21 VAL A 25 -0.967 -4.384 4.033 1.00 42.21 H new ATOM 0 HG22 VAL A 25 -1.213 -4.035 2.305 1.00 42.21 H new ATOM 0 HG23 VAL A 25 -2.233 -5.242 3.123 1.00 42.21 H new ATOM 374 N ASN A 26 -2.266 -8.165 2.085 1.00 22.02 N ATOM 375 CA ASN A 26 -3.633 -8.736 2.190 1.00 54.53 C ATOM 376 C ASN A 26 -4.338 -8.186 3.439 1.00 33.13 C ATOM 377 O ASN A 26 -3.814 -7.294 4.117 1.00 72.24 O ATOM 378 CB ASN A 26 -3.589 -10.296 2.209 1.00 2.42 C ATOM 379 CG ASN A 26 -2.766 -10.906 3.346 1.00 11.32 C ATOM 380 OD1 ASN A 26 -1.808 -10.322 3.847 1.00 2.25 O ATOM 381 ND2 ASN A 26 -3.133 -12.098 3.759 1.00 70.21 N ATOM 0 H ASN A 26 -1.584 -8.610 2.699 1.00 22.02 H new ATOM 0 HA ASN A 26 -4.204 -8.437 1.311 1.00 54.53 H new ATOM 0 HB2 ASN A 26 -4.610 -10.672 2.277 1.00 2.42 H new ATOM 0 HB3 ASN A 26 -3.183 -10.645 1.259 1.00 2.42 H new ATOM 0 HD21 ASN A 26 -2.619 -12.558 4.511 1.00 70.21 H new ATOM 0 HD22 ASN A 26 -3.932 -12.564 3.328 1.00 70.21 H new ATOM 388 N SER A 27 -5.540 -8.724 3.719 1.00 4.21 N ATOM 389 CA SER A 27 -6.330 -8.378 4.916 1.00 42.21 C ATOM 390 C SER A 27 -5.638 -8.861 6.219 1.00 73.51 C ATOM 391 O SER A 27 -5.998 -8.415 7.313 1.00 25.23 O ATOM 392 CB SER A 27 -7.770 -8.933 4.773 1.00 73.44 C ATOM 393 OG SER A 27 -8.578 -8.643 5.903 1.00 3.51 O ATOM 0 H SER A 27 -5.992 -9.414 3.119 1.00 4.21 H new ATOM 0 HA SER A 27 -6.393 -7.293 4.993 1.00 42.21 H new ATOM 0 HB2 SER A 27 -8.232 -8.510 3.881 1.00 73.44 H new ATOM 0 HB3 SER A 27 -7.727 -10.012 4.628 1.00 73.44 H new ATOM 0 HG SER A 27 -8.011 -8.332 6.639 1.00 3.51 H new ATOM 399 N LYS A 28 -4.644 -9.765 6.102 1.00 73.22 N ATOM 400 CA LYS A 28 -3.713 -10.051 7.214 1.00 10.43 C ATOM 401 C LYS A 28 -2.692 -8.907 7.337 1.00 41.33 C ATOM 402 O LYS A 28 -2.492 -8.366 8.408 1.00 51.52 O ATOM 403 CB LYS A 28 -2.996 -11.410 7.023 1.00 73.50 C ATOM 404 CG LYS A 28 -3.954 -12.614 6.931 1.00 65.34 C ATOM 405 CD LYS A 28 -4.907 -12.716 8.148 1.00 62.30 C ATOM 406 CE LYS A 28 -5.888 -13.884 8.020 1.00 13.14 C ATOM 407 NZ LYS A 28 -6.712 -13.790 6.792 1.00 23.23 N ATOM 0 H LYS A 28 -4.466 -10.306 5.256 1.00 73.22 H new ATOM 0 HA LYS A 28 -4.289 -10.120 8.137 1.00 10.43 H new ATOM 0 HB2 LYS A 28 -2.393 -11.367 6.116 1.00 73.50 H new ATOM 0 HB3 LYS A 28 -2.309 -11.567 7.855 1.00 73.50 H new ATOM 0 HG2 LYS A 28 -4.545 -12.534 6.018 1.00 65.34 H new ATOM 0 HG3 LYS A 28 -3.371 -13.532 6.854 1.00 65.34 H new ATOM 0 HD2 LYS A 28 -4.319 -12.836 9.058 1.00 62.30 H new ATOM 0 HD3 LYS A 28 -5.465 -11.785 8.249 1.00 62.30 H new ATOM 0 HE2 LYS A 28 -5.334 -14.823 8.013 1.00 13.14 H new ATOM 0 HE3 LYS A 28 -6.541 -13.906 8.893 1.00 13.14 H new ATOM 0 HZ1 LYS A 28 -7.461 -14.510 6.821 1.00 23.23 H new ATOM 0 HZ2 LYS A 28 -7.142 -12.845 6.734 1.00 23.23 H new ATOM 0 HZ3 LYS A 28 -6.111 -13.948 5.958 1.00 23.23 H new ATOM 421 N GLY A 29 -2.085 -8.520 6.207 1.00 15.04 N ATOM 422 CA GLY A 29 -1.112 -7.415 6.172 1.00 73.40 C ATOM 423 C GLY A 29 0.265 -7.854 5.723 1.00 41.42 C ATOM 424 O GLY A 29 1.191 -7.044 5.693 1.00 4.21 O ATOM 0 H GLY A 29 -2.250 -8.957 5.300 1.00 15.04 H new ATOM 0 HA2 GLY A 29 -1.477 -6.638 5.500 1.00 73.40 H new ATOM 0 HA3 GLY A 29 -1.040 -6.970 7.164 1.00 73.40 H new ATOM 428 N ASP A 30 0.402 -9.134 5.364 1.00 13.22 N ATOM 429 CA ASP A 30 1.636 -9.671 4.768 1.00 71.40 C ATOM 430 C ASP A 30 1.684 -9.302 3.278 1.00 31.13 C ATOM 431 O ASP A 30 0.646 -9.332 2.599 1.00 4.23 O ATOM 432 CB ASP A 30 1.706 -11.210 4.951 1.00 61.12 C ATOM 433 CG ASP A 30 2.862 -11.868 4.166 1.00 63.42 C ATOM 434 OD1 ASP A 30 4.041 -11.588 4.463 1.00 55.12 O ATOM 435 OD2 ASP A 30 2.597 -12.674 3.253 1.00 65.55 O ATOM 0 H ASP A 30 -0.336 -9.829 5.477 1.00 13.22 H new ATOM 0 HA ASP A 30 2.497 -9.234 5.273 1.00 71.40 H new ATOM 0 HB2 ASP A 30 1.820 -11.438 6.011 1.00 61.12 H new ATOM 0 HB3 ASP A 30 0.762 -11.650 4.630 1.00 61.12 H new ATOM 440 N ARG A 31 2.893 -8.952 2.783 1.00 71.14 N ATOM 441 CA ARG A 31 3.110 -8.585 1.368 1.00 72.51 C ATOM 442 C ARG A 31 2.780 -9.768 0.426 1.00 0.43 C ATOM 443 O ARG A 31 3.464 -10.783 0.410 1.00 31.14 O ATOM 444 CB ARG A 31 4.552 -7.984 1.131 1.00 3.02 C ATOM 445 CG ARG A 31 5.737 -8.516 2.005 1.00 52.34 C ATOM 446 CD ARG A 31 6.389 -9.841 1.535 1.00 1.02 C ATOM 447 NE ARG A 31 5.633 -11.047 1.916 1.00 55.33 N ATOM 448 CZ ARG A 31 5.956 -12.313 1.571 1.00 44.20 C ATOM 449 NH1 ARG A 31 7.030 -12.577 0.829 1.00 14.13 N ATOM 450 NH2 ARG A 31 5.177 -13.312 1.965 1.00 75.13 N ATOM 0 H ARG A 31 3.740 -8.917 3.351 1.00 71.14 H new ATOM 0 HA ARG A 31 2.412 -7.786 1.117 1.00 72.51 H new ATOM 0 HB2 ARG A 31 4.812 -8.149 0.085 1.00 3.02 H new ATOM 0 HB3 ARG A 31 4.490 -6.906 1.278 1.00 3.02 H new ATOM 0 HG2 ARG A 31 6.509 -7.747 2.041 1.00 52.34 H new ATOM 0 HG3 ARG A 31 5.377 -8.654 3.024 1.00 52.34 H new ATOM 0 HD2 ARG A 31 6.494 -9.818 0.450 1.00 1.02 H new ATOM 0 HD3 ARG A 31 7.394 -9.908 1.951 1.00 1.02 H new ATOM 0 HE ARG A 31 4.798 -10.916 2.487 1.00 55.33 H new ATOM 0 HH11 ARG A 31 7.628 -11.816 0.509 1.00 14.13 H new ATOM 0 HH12 ARG A 31 7.254 -13.541 0.581 1.00 14.13 H new ATOM 0 HH21 ARG A 31 4.344 -13.120 2.522 1.00 75.13 H new ATOM 0 HH22 ARG A 31 5.411 -14.272 1.711 1.00 75.13 H new ATOM 464 N ILE A 32 1.671 -9.628 -0.312 1.00 42.35 N ATOM 465 CA ILE A 32 1.217 -10.645 -1.276 1.00 3.33 C ATOM 466 C ILE A 32 2.018 -10.532 -2.578 1.00 20.12 C ATOM 467 O ILE A 32 2.336 -11.535 -3.211 1.00 72.32 O ATOM 468 CB ILE A 32 -0.327 -10.532 -1.546 1.00 74.03 C ATOM 469 CG1 ILE A 32 -0.712 -9.215 -2.294 1.00 71.02 C ATOM 470 CG2 ILE A 32 -1.087 -10.633 -0.212 1.00 51.03 C ATOM 471 CD1 ILE A 32 -2.177 -9.088 -2.661 1.00 52.32 C ATOM 0 H ILE A 32 1.063 -8.810 -0.260 1.00 42.35 H new ATOM 0 HA ILE A 32 1.396 -11.630 -0.844 1.00 3.33 H new ATOM 0 HB ILE A 32 -0.610 -11.356 -2.201 1.00 74.03 H new ATOM 0 HG12 ILE A 32 -0.435 -8.366 -1.668 1.00 71.02 H new ATOM 0 HG13 ILE A 32 -0.118 -9.146 -3.205 1.00 71.02 H new ATOM 0 HG21 ILE A 32 -2.158 -10.555 -0.397 1.00 51.03 H new ATOM 0 HG22 ILE A 32 -0.869 -11.591 0.259 1.00 51.03 H new ATOM 0 HG23 ILE A 32 -0.773 -9.824 0.448 1.00 51.03 H new ATOM 0 HD11 ILE A 32 -2.342 -8.141 -3.176 1.00 52.32 H new ATOM 0 HD12 ILE A 32 -2.461 -9.912 -3.316 1.00 52.32 H new ATOM 0 HD13 ILE A 32 -2.783 -9.119 -1.756 1.00 52.32 H new ATOM 483 N VAL A 33 2.354 -9.286 -2.933 1.00 74.21 N ATOM 484 CA VAL A 33 3.220 -8.947 -4.065 1.00 11.01 C ATOM 485 C VAL A 33 3.705 -7.500 -3.858 1.00 71.14 C ATOM 486 O VAL A 33 2.919 -6.643 -3.435 1.00 55.00 O ATOM 487 CB VAL A 33 2.495 -9.151 -5.462 1.00 12.42 C ATOM 488 CG1 VAL A 33 1.263 -8.229 -5.644 1.00 44.34 C ATOM 489 CG2 VAL A 33 3.489 -9.030 -6.643 1.00 51.34 C ATOM 0 H VAL A 33 2.022 -8.465 -2.427 1.00 74.21 H new ATOM 0 HA VAL A 33 4.075 -9.623 -4.096 1.00 11.01 H new ATOM 0 HB VAL A 33 2.109 -10.170 -5.462 1.00 12.42 H new ATOM 0 HG11 VAL A 33 0.810 -8.415 -6.618 1.00 44.34 H new ATOM 0 HG12 VAL A 33 0.535 -8.436 -4.860 1.00 44.34 H new ATOM 0 HG13 VAL A 33 1.576 -7.187 -5.583 1.00 44.34 H new ATOM 0 HG21 VAL A 33 2.957 -9.175 -7.583 1.00 51.34 H new ATOM 0 HG22 VAL A 33 3.946 -8.040 -6.634 1.00 51.34 H new ATOM 0 HG23 VAL A 33 4.265 -9.789 -6.544 1.00 51.34 H new ATOM 499 N ASN A 34 5.008 -7.250 -4.084 1.00 32.44 N ATOM 500 CA ASN A 34 5.623 -5.923 -3.839 1.00 31.45 C ATOM 501 C ASN A 34 5.035 -4.902 -4.832 1.00 13.22 C ATOM 502 O ASN A 34 4.560 -3.828 -4.454 1.00 62.11 O ATOM 503 CB ASN A 34 7.176 -6.024 -3.959 1.00 40.20 C ATOM 504 CG ASN A 34 7.952 -4.784 -3.469 1.00 62.42 C ATOM 505 OD1 ASN A 34 7.508 -3.646 -3.587 1.00 64.43 O ATOM 506 ND2 ASN A 34 9.141 -4.999 -2.919 1.00 4.22 N ATOM 0 H ASN A 34 5.661 -7.949 -4.437 1.00 32.44 H new ATOM 0 HA ASN A 34 5.396 -5.584 -2.828 1.00 31.45 H new ATOM 0 HB2 ASN A 34 7.513 -6.892 -3.392 1.00 40.20 H new ATOM 0 HB3 ASN A 34 7.433 -6.205 -5.003 1.00 40.20 H new ATOM 0 HD21 ASN A 34 9.699 -4.212 -2.587 1.00 4.22 H new ATOM 0 HD22 ASN A 34 9.496 -5.951 -2.828 1.00 4.22 H new ATOM 513 N GLU A 35 5.024 -5.297 -6.102 1.00 42.13 N ATOM 514 CA GLU A 35 4.443 -4.512 -7.200 1.00 50.12 C ATOM 515 C GLU A 35 3.837 -5.470 -8.233 1.00 71.43 C ATOM 516 O GLU A 35 4.404 -6.538 -8.509 1.00 24.41 O ATOM 517 CB GLU A 35 5.524 -3.614 -7.854 1.00 23.32 C ATOM 518 CG GLU A 35 5.077 -2.848 -9.125 1.00 54.24 C ATOM 519 CD GLU A 35 6.175 -1.943 -9.708 1.00 74.13 C ATOM 520 OE1 GLU A 35 7.199 -2.476 -10.181 1.00 71.43 O ATOM 521 OE2 GLU A 35 6.020 -0.698 -9.698 1.00 22.02 O ATOM 0 H GLU A 35 5.423 -6.184 -6.408 1.00 42.13 H new ATOM 0 HA GLU A 35 3.660 -3.862 -6.809 1.00 50.12 H new ATOM 0 HB2 GLU A 35 5.864 -2.889 -7.115 1.00 23.32 H new ATOM 0 HB3 GLU A 35 6.382 -4.236 -8.109 1.00 23.32 H new ATOM 0 HG2 GLU A 35 4.767 -3.567 -9.884 1.00 54.24 H new ATOM 0 HG3 GLU A 35 4.204 -2.241 -8.886 1.00 54.24 H new ATOM 528 N SER A 36 2.682 -5.076 -8.790 1.00 54.43 N ATOM 529 CA SER A 36 1.989 -5.824 -9.833 1.00 52.25 C ATOM 530 C SER A 36 2.791 -5.737 -11.146 1.00 55.31 C ATOM 531 O SER A 36 2.678 -4.770 -11.894 1.00 34.44 O ATOM 532 CB SER A 36 0.542 -5.283 -9.988 1.00 23.20 C ATOM 533 OG SER A 36 0.520 -3.869 -10.143 1.00 43.42 O ATOM 0 H SER A 36 2.202 -4.217 -8.521 1.00 54.43 H new ATOM 0 HA SER A 36 1.916 -6.877 -9.561 1.00 52.25 H new ATOM 0 HB2 SER A 36 0.070 -5.751 -10.852 1.00 23.20 H new ATOM 0 HB3 SER A 36 -0.046 -5.562 -9.114 1.00 23.20 H new ATOM 0 HG SER A 36 0.085 -3.461 -9.365 1.00 43.42 H new ATOM 539 N ASN A 37 3.678 -6.726 -11.346 1.00 54.22 N ATOM 540 CA ASN A 37 4.487 -6.866 -12.579 1.00 41.22 C ATOM 541 C ASN A 37 3.566 -7.124 -13.785 1.00 64.12 C ATOM 542 O ASN A 37 3.725 -6.532 -14.854 1.00 42.05 O ATOM 543 CB ASN A 37 5.506 -8.029 -12.401 1.00 51.41 C ATOM 544 CG ASN A 37 6.454 -8.227 -13.588 1.00 54.10 C ATOM 545 OD1 ASN A 37 6.832 -7.273 -14.267 1.00 4.05 O ATOM 546 ND2 ASN A 37 6.830 -9.468 -13.855 1.00 64.25 N ATOM 0 H ASN A 37 3.858 -7.456 -10.657 1.00 54.22 H new ATOM 0 HA ASN A 37 5.038 -5.943 -12.763 1.00 41.22 H new ATOM 0 HB2 ASN A 37 6.099 -7.843 -11.505 1.00 51.41 H new ATOM 0 HB3 ASN A 37 4.956 -8.955 -12.232 1.00 51.41 H new ATOM 0 HD21 ASN A 37 7.451 -9.655 -14.643 1.00 64.25 H new ATOM 0 HD22 ASN A 37 6.499 -10.238 -13.273 1.00 64.25 H new ATOM 553 N VAL A 38 2.595 -8.013 -13.563 1.00 21.04 N ATOM 554 CA VAL A 38 1.558 -8.382 -14.539 1.00 12.22 C ATOM 555 C VAL A 38 0.267 -8.736 -13.762 1.00 50.03 C ATOM 556 O VAL A 38 0.352 -9.204 -12.615 1.00 62.13 O ATOM 557 CB VAL A 38 2.044 -9.577 -15.454 1.00 2.32 C ATOM 558 CG1 VAL A 38 2.539 -10.780 -14.619 1.00 54.52 C ATOM 559 CG2 VAL A 38 0.961 -10.001 -16.481 1.00 13.30 C ATOM 0 H VAL A 38 2.503 -8.511 -12.678 1.00 21.04 H new ATOM 0 HA VAL A 38 1.355 -7.546 -15.208 1.00 12.22 H new ATOM 0 HB VAL A 38 2.897 -9.208 -16.023 1.00 2.32 H new ATOM 0 HG11 VAL A 38 2.863 -11.578 -15.287 1.00 54.52 H new ATOM 0 HG12 VAL A 38 3.375 -10.469 -13.993 1.00 54.52 H new ATOM 0 HG13 VAL A 38 1.728 -11.143 -13.987 1.00 54.52 H new ATOM 0 HG21 VAL A 38 1.338 -10.824 -17.088 1.00 13.30 H new ATOM 0 HG22 VAL A 38 0.063 -10.321 -15.952 1.00 13.30 H new ATOM 0 HG23 VAL A 38 0.720 -9.156 -17.126 1.00 13.30 H new ATOM 569 N TYR A 39 -0.916 -8.494 -14.383 1.00 31.35 N ATOM 570 CA TYR A 39 -2.242 -8.704 -13.744 1.00 3.35 C ATOM 571 C TYR A 39 -2.439 -10.164 -13.272 1.00 54.25 C ATOM 572 O TYR A 39 -3.189 -10.411 -12.332 1.00 44.43 O ATOM 573 CB TYR A 39 -3.395 -8.303 -14.715 1.00 62.13 C ATOM 574 CG TYR A 39 -3.623 -9.266 -15.908 1.00 0.24 C ATOM 575 CD1 TYR A 39 -2.757 -9.291 -17.008 1.00 64.02 C ATOM 576 CD2 TYR A 39 -4.715 -10.152 -15.937 1.00 62.01 C ATOM 577 CE1 TYR A 39 -2.964 -10.148 -18.072 1.00 10.35 C ATOM 578 CE2 TYR A 39 -4.918 -11.011 -17.006 1.00 52.45 C ATOM 579 CZ TYR A 39 -4.038 -11.001 -18.069 1.00 32.53 C ATOM 580 OH TYR A 39 -4.225 -11.857 -19.130 1.00 63.50 O ATOM 0 H TYR A 39 -0.978 -8.148 -15.340 1.00 31.35 H new ATOM 0 HA TYR A 39 -2.272 -8.062 -12.864 1.00 3.35 H new ATOM 0 HB2 TYR A 39 -4.321 -8.233 -14.144 1.00 62.13 H new ATOM 0 HB3 TYR A 39 -3.187 -7.308 -15.108 1.00 62.13 H new ATOM 0 HD1 TYR A 39 -1.907 -8.625 -17.025 1.00 64.02 H new ATOM 0 HD2 TYR A 39 -5.409 -10.163 -15.110 1.00 62.01 H new ATOM 0 HE1 TYR A 39 -2.279 -10.146 -18.907 1.00 10.35 H new ATOM 0 HE2 TYR A 39 -5.762 -11.685 -17.007 1.00 52.45 H new ATOM 0 HH TYR A 39 -5.029 -12.397 -18.977 1.00 63.50 H new ATOM 590 N THR A 40 -1.763 -11.114 -13.950 1.00 64.55 N ATOM 591 CA THR A 40 -1.848 -12.550 -13.631 1.00 10.44 C ATOM 592 C THR A 40 -1.199 -12.853 -12.265 1.00 22.14 C ATOM 593 O THR A 40 -1.828 -13.459 -11.405 1.00 22.11 O ATOM 594 CB THR A 40 -1.180 -13.410 -14.756 1.00 62.44 C ATOM 595 OG1 THR A 40 0.158 -12.943 -14.988 1.00 53.03 O ATOM 596 CG2 THR A 40 -1.963 -13.347 -16.077 1.00 24.35 C ATOM 0 H THR A 40 -1.144 -10.905 -14.733 1.00 64.55 H new ATOM 0 HA THR A 40 -2.903 -12.817 -13.573 1.00 10.44 H new ATOM 0 HB THR A 40 -1.175 -14.445 -14.414 1.00 62.44 H new ATOM 0 HG1 THR A 40 0.576 -13.483 -15.691 1.00 53.03 H new ATOM 0 HG21 THR A 40 -1.461 -13.959 -16.827 1.00 24.35 H new ATOM 0 HG22 THR A 40 -2.974 -13.723 -15.919 1.00 24.35 H new ATOM 0 HG23 THR A 40 -2.010 -12.315 -16.423 1.00 24.35 H new ATOM 604 N THR A 41 0.053 -12.388 -12.076 1.00 31.51 N ATOM 605 CA THR A 41 0.809 -12.567 -10.813 1.00 50.04 C ATOM 606 C THR A 41 0.150 -11.791 -9.648 1.00 63.33 C ATOM 607 O THR A 41 0.149 -12.254 -8.500 1.00 63.54 O ATOM 608 CB THR A 41 2.292 -12.101 -11.002 1.00 2.11 C ATOM 609 OG1 THR A 41 2.879 -12.840 -12.084 1.00 43.05 O ATOM 610 CG2 THR A 41 3.158 -12.278 -9.732 1.00 62.44 C ATOM 0 H THR A 41 0.570 -11.878 -12.792 1.00 31.51 H new ATOM 0 HA THR A 41 0.796 -13.627 -10.560 1.00 50.04 H new ATOM 0 HB THR A 41 2.267 -11.033 -11.219 1.00 2.11 H new ATOM 0 HG1 THR A 41 3.808 -12.553 -12.210 1.00 43.05 H new ATOM 0 HG21 THR A 41 4.173 -11.936 -9.933 1.00 62.44 H new ATOM 0 HG22 THR A 41 2.732 -11.693 -8.917 1.00 62.44 H new ATOM 0 HG23 THR A 41 3.179 -13.331 -9.450 1.00 62.44 H new ATOM 618 N PHE A 42 -0.413 -10.611 -9.978 1.00 14.21 N ATOM 619 CA PHE A 42 -1.151 -9.758 -9.024 1.00 63.15 C ATOM 620 C PHE A 42 -2.415 -10.478 -8.513 1.00 62.51 C ATOM 621 O PHE A 42 -2.659 -10.545 -7.303 1.00 34.00 O ATOM 622 CB PHE A 42 -1.530 -8.409 -9.697 1.00 4.41 C ATOM 623 CG PHE A 42 -2.430 -7.505 -8.850 1.00 51.54 C ATOM 624 CD1 PHE A 42 -1.985 -7.001 -7.627 1.00 72.35 C ATOM 625 CD2 PHE A 42 -3.720 -7.169 -9.271 1.00 42.32 C ATOM 626 CE1 PHE A 42 -2.799 -6.196 -6.856 1.00 52.03 C ATOM 627 CE2 PHE A 42 -4.532 -6.359 -8.500 1.00 15.33 C ATOM 628 CZ PHE A 42 -4.071 -5.874 -7.290 1.00 40.24 C ATOM 0 H PHE A 42 -0.368 -10.221 -10.919 1.00 14.21 H new ATOM 0 HA PHE A 42 -0.506 -9.556 -8.169 1.00 63.15 H new ATOM 0 HB2 PHE A 42 -0.615 -7.867 -9.936 1.00 4.41 H new ATOM 0 HB3 PHE A 42 -2.033 -8.618 -10.641 1.00 4.41 H new ATOM 0 HD1 PHE A 42 -0.992 -7.244 -7.280 1.00 72.35 H new ATOM 0 HD2 PHE A 42 -4.088 -7.548 -10.213 1.00 42.32 H new ATOM 0 HE1 PHE A 42 -2.441 -5.816 -5.910 1.00 52.03 H new ATOM 0 HE2 PHE A 42 -5.525 -6.105 -8.842 1.00 15.33 H new ATOM 0 HZ PHE A 42 -4.705 -5.244 -6.684 1.00 40.24 H new ATOM 638 N ARG A 43 -3.199 -11.021 -9.464 1.00 51.14 N ATOM 639 CA ARG A 43 -4.439 -11.759 -9.168 1.00 32.53 C ATOM 640 C ARG A 43 -4.112 -13.025 -8.360 1.00 3.04 C ATOM 641 O ARG A 43 -4.772 -13.312 -7.369 1.00 50.43 O ATOM 642 CB ARG A 43 -5.183 -12.136 -10.481 1.00 41.24 C ATOM 643 CG ARG A 43 -6.475 -12.952 -10.274 1.00 21.25 C ATOM 644 CD ARG A 43 -7.150 -13.358 -11.598 1.00 34.23 C ATOM 645 NE ARG A 43 -8.285 -14.278 -11.387 1.00 51.11 N ATOM 646 CZ ARG A 43 -8.648 -15.271 -12.220 1.00 23.12 C ATOM 647 NH1 ARG A 43 -7.969 -15.504 -13.341 1.00 2.43 N ATOM 648 NH2 ARG A 43 -9.693 -16.032 -11.916 1.00 70.31 N ATOM 0 H ARG A 43 -2.989 -10.959 -10.460 1.00 51.14 H new ATOM 0 HA ARG A 43 -5.093 -11.117 -8.578 1.00 32.53 H new ATOM 0 HB2 ARG A 43 -5.429 -11.221 -11.019 1.00 41.24 H new ATOM 0 HB3 ARG A 43 -4.506 -12.707 -11.116 1.00 41.24 H new ATOM 0 HG2 ARG A 43 -6.243 -13.850 -9.701 1.00 21.25 H new ATOM 0 HG3 ARG A 43 -7.176 -12.367 -9.680 1.00 21.25 H new ATOM 0 HD2 ARG A 43 -7.500 -12.464 -12.114 1.00 34.23 H new ATOM 0 HD3 ARG A 43 -6.415 -13.834 -12.247 1.00 34.23 H new ATOM 0 HE ARG A 43 -8.840 -14.151 -10.541 1.00 51.11 H new ATOM 0 HH11 ARG A 43 -7.162 -14.927 -13.578 1.00 2.43 H new ATOM 0 HH12 ARG A 43 -8.255 -16.260 -13.963 1.00 2.43 H new ATOM 0 HH21 ARG A 43 -10.215 -15.862 -11.056 1.00 70.31 H new ATOM 0 HH22 ARG A 43 -9.974 -16.786 -12.542 1.00 70.31 H new ATOM 662 N ASN A 44 -3.047 -13.739 -8.784 1.00 71.51 N ATOM 663 CA ASN A 44 -2.590 -14.999 -8.145 1.00 50.13 C ATOM 664 C ASN A 44 -2.040 -14.747 -6.740 1.00 2.52 C ATOM 665 O ASN A 44 -2.087 -15.635 -5.893 1.00 2.11 O ATOM 666 CB ASN A 44 -1.530 -15.723 -9.025 1.00 13.43 C ATOM 667 CG ASN A 44 -2.117 -16.455 -10.251 1.00 42.20 C ATOM 668 OD1 ASN A 44 -1.614 -17.503 -10.651 1.00 31.13 O ATOM 669 ND2 ASN A 44 -3.172 -15.913 -10.864 1.00 2.13 N ATOM 0 H ASN A 44 -2.476 -13.459 -9.582 1.00 71.51 H new ATOM 0 HA ASN A 44 -3.460 -15.650 -8.053 1.00 50.13 H new ATOM 0 HB2 ASN A 44 -0.799 -14.991 -9.369 1.00 13.43 H new ATOM 0 HB3 ASN A 44 -0.994 -16.444 -8.408 1.00 13.43 H new ATOM 0 HD21 ASN A 44 -3.577 -16.369 -11.682 1.00 2.13 H new ATOM 0 HD22 ASN A 44 -3.573 -15.043 -10.515 1.00 2.13 H new ATOM 676 N ALA A 45 -1.533 -13.528 -6.505 1.00 1.12 N ATOM 677 CA ALA A 45 -1.098 -13.083 -5.171 1.00 61.10 C ATOM 678 C ALA A 45 -2.307 -12.952 -4.223 1.00 35.53 C ATOM 679 O ALA A 45 -2.208 -13.263 -3.042 1.00 24.12 O ATOM 680 CB ALA A 45 -0.340 -11.752 -5.272 1.00 24.34 C ATOM 0 H ALA A 45 -1.413 -12.823 -7.232 1.00 1.12 H new ATOM 0 HA ALA A 45 -0.422 -13.832 -4.759 1.00 61.10 H new ATOM 0 HB1 ALA A 45 -0.025 -11.436 -4.277 1.00 24.34 H new ATOM 0 HB2 ALA A 45 0.537 -11.880 -5.907 1.00 24.34 H new ATOM 0 HB3 ALA A 45 -0.993 -10.993 -5.704 1.00 24.34 H new ATOM 686 N ILE A 46 -3.446 -12.493 -4.784 1.00 32.10 N ATOM 687 CA ILE A 46 -4.743 -12.377 -4.071 1.00 72.20 C ATOM 688 C ILE A 46 -5.422 -13.775 -3.948 1.00 23.00 C ATOM 689 O ILE A 46 -6.177 -14.041 -3.008 1.00 11.40 O ATOM 690 CB ILE A 46 -5.694 -11.352 -4.824 1.00 64.42 C ATOM 691 CG1 ILE A 46 -4.971 -9.972 -5.010 1.00 34.41 C ATOM 692 CG2 ILE A 46 -7.046 -11.166 -4.087 1.00 51.34 C ATOM 693 CD1 ILE A 46 -5.755 -8.933 -5.794 1.00 31.43 C ATOM 0 H ILE A 46 -3.495 -12.188 -5.756 1.00 32.10 H new ATOM 0 HA ILE A 46 -4.558 -11.999 -3.066 1.00 72.20 H new ATOM 0 HB ILE A 46 -5.916 -11.770 -5.806 1.00 64.42 H new ATOM 0 HG12 ILE A 46 -4.741 -9.564 -4.026 1.00 34.41 H new ATOM 0 HG13 ILE A 46 -4.020 -10.143 -5.514 1.00 34.41 H new ATOM 0 HG21 ILE A 46 -7.665 -10.457 -4.636 1.00 51.34 H new ATOM 0 HG22 ILE A 46 -7.561 -12.125 -4.024 1.00 51.34 H new ATOM 0 HG23 ILE A 46 -6.863 -10.785 -3.082 1.00 51.34 H new ATOM 0 HD11 ILE A 46 -5.171 -8.016 -5.867 1.00 31.43 H new ATOM 0 HD12 ILE A 46 -5.962 -9.312 -6.795 1.00 31.43 H new ATOM 0 HD13 ILE A 46 -6.695 -8.725 -5.283 1.00 31.43 H new ATOM 705 N LEU A 47 -5.117 -14.677 -4.904 1.00 73.33 N ATOM 706 CA LEU A 47 -5.640 -16.064 -4.909 1.00 72.01 C ATOM 707 C LEU A 47 -4.797 -16.983 -4.003 1.00 5.42 C ATOM 708 O LEU A 47 -5.279 -18.033 -3.574 1.00 11.11 O ATOM 709 CB LEU A 47 -5.673 -16.641 -6.359 1.00 44.42 C ATOM 710 CG LEU A 47 -6.580 -15.889 -7.389 1.00 74.44 C ATOM 711 CD1 LEU A 47 -6.532 -16.560 -8.785 1.00 2.34 C ATOM 712 CD2 LEU A 47 -8.030 -15.735 -6.876 1.00 10.31 C ATOM 0 H LEU A 47 -4.504 -14.468 -5.692 1.00 73.33 H new ATOM 0 HA LEU A 47 -6.657 -16.029 -4.518 1.00 72.01 H new ATOM 0 HB2 LEU A 47 -4.654 -16.651 -6.745 1.00 44.42 H new ATOM 0 HB3 LEU A 47 -6.004 -17.678 -6.306 1.00 44.42 H new ATOM 0 HG LEU A 47 -6.175 -14.883 -7.499 1.00 74.44 H new ATOM 0 HD11 LEU A 47 -7.173 -16.011 -9.475 1.00 2.34 H new ATOM 0 HD12 LEU A 47 -5.508 -16.552 -9.158 1.00 2.34 H new ATOM 0 HD13 LEU A 47 -6.881 -17.590 -8.706 1.00 2.34 H new ATOM 0 HD21 LEU A 47 -8.626 -15.208 -7.621 1.00 10.31 H new ATOM 0 HD22 LEU A 47 -8.460 -16.721 -6.699 1.00 10.31 H new ATOM 0 HD23 LEU A 47 -8.028 -15.168 -5.945 1.00 10.31 H new ATOM 724 N LYS A 48 -3.547 -16.567 -3.725 1.00 54.01 N ATOM 725 CA LYS A 48 -2.530 -17.398 -3.037 1.00 44.14 C ATOM 726 C LYS A 48 -2.928 -17.770 -1.592 1.00 60.04 C ATOM 727 O LYS A 48 -2.630 -18.879 -1.118 1.00 3.41 O ATOM 728 CB LYS A 48 -1.170 -16.653 -3.042 1.00 12.42 C ATOM 729 CG LYS A 48 0.025 -17.478 -2.514 1.00 44.54 C ATOM 730 CD LYS A 48 1.381 -16.761 -2.697 1.00 2.33 C ATOM 731 CE LYS A 48 1.689 -16.441 -4.170 1.00 62.04 C ATOM 732 NZ LYS A 48 3.065 -15.904 -4.341 1.00 31.15 N ATOM 0 H LYS A 48 -3.208 -15.637 -3.972 1.00 54.01 H new ATOM 0 HA LYS A 48 -2.452 -18.336 -3.586 1.00 44.14 H new ATOM 0 HB2 LYS A 48 -0.951 -16.334 -4.061 1.00 12.42 H new ATOM 0 HB3 LYS A 48 -1.264 -15.750 -2.439 1.00 12.42 H new ATOM 0 HG2 LYS A 48 -0.127 -17.691 -1.456 1.00 44.54 H new ATOM 0 HG3 LYS A 48 0.054 -18.437 -3.032 1.00 44.54 H new ATOM 0 HD2 LYS A 48 1.379 -15.836 -2.121 1.00 2.33 H new ATOM 0 HD3 LYS A 48 2.176 -17.387 -2.291 1.00 2.33 H new ATOM 0 HE2 LYS A 48 1.574 -17.344 -4.770 1.00 62.04 H new ATOM 0 HE3 LYS A 48 0.966 -15.715 -4.543 1.00 62.04 H new ATOM 0 HZ1 LYS A 48 3.236 -15.700 -5.346 1.00 31.15 H new ATOM 0 HZ2 LYS A 48 3.167 -15.029 -3.788 1.00 31.15 H new ATOM 0 HZ3 LYS A 48 3.756 -16.607 -4.008 1.00 31.15 H new ATOM 746 N GLN A 49 -3.597 -16.831 -0.908 1.00 63.35 N ATOM 747 CA GLN A 49 -4.095 -17.011 0.474 1.00 35.22 C ATOM 748 C GLN A 49 -5.624 -16.859 0.476 1.00 2.14 C ATOM 749 O GLN A 49 -6.226 -16.658 -0.583 1.00 54.13 O ATOM 750 CB GLN A 49 -3.407 -16.025 1.482 1.00 13.31 C ATOM 751 CG GLN A 49 -3.714 -14.515 1.321 1.00 53.00 C ATOM 752 CD GLN A 49 -3.297 -13.937 -0.021 1.00 35.41 C ATOM 753 OE1 GLN A 49 -4.096 -13.855 -0.946 1.00 24.21 O ATOM 754 NE2 GLN A 49 -2.022 -13.617 -0.157 1.00 3.21 N ATOM 0 H GLN A 49 -3.813 -15.913 -1.298 1.00 63.35 H new ATOM 0 HA GLN A 49 -3.835 -18.013 0.816 1.00 35.22 H new ATOM 0 HB2 GLN A 49 -3.692 -16.321 2.491 1.00 13.31 H new ATOM 0 HB3 GLN A 49 -2.328 -16.160 1.403 1.00 13.31 H new ATOM 0 HG2 GLN A 49 -4.784 -14.356 1.456 1.00 53.00 H new ATOM 0 HG3 GLN A 49 -3.207 -13.966 2.114 1.00 53.00 H new ATOM 0 HE21 GLN A 49 -1.388 -13.699 0.638 1.00 3.21 H new ATOM 0 HE22 GLN A 49 -1.672 -13.288 -1.057 1.00 3.21 H new ATOM 763 N ALA A 50 -6.233 -16.980 1.665 1.00 41.22 N ATOM 764 CA ALA A 50 -7.699 -16.961 1.852 1.00 51.41 C ATOM 765 C ALA A 50 -8.324 -15.615 1.430 1.00 32.33 C ATOM 766 O ALA A 50 -9.402 -15.585 0.818 1.00 1.02 O ATOM 767 CB ALA A 50 -8.032 -17.268 3.323 1.00 23.41 C ATOM 0 H ALA A 50 -5.718 -17.096 2.538 1.00 41.22 H new ATOM 0 HA ALA A 50 -8.129 -17.727 1.207 1.00 51.41 H new ATOM 0 HB1 ALA A 50 -9.113 -17.254 3.462 1.00 23.41 H new ATOM 0 HB2 ALA A 50 -7.645 -18.252 3.586 1.00 23.41 H new ATOM 0 HB3 ALA A 50 -7.574 -16.515 3.964 1.00 23.41 H new ATOM 773 N ASP A 51 -7.598 -14.532 1.738 1.00 41.12 N ATOM 774 CA ASP A 51 -8.061 -13.141 1.574 1.00 35.14 C ATOM 775 C ASP A 51 -8.219 -12.786 0.082 1.00 54.32 C ATOM 776 O ASP A 51 -7.269 -12.901 -0.693 1.00 21.22 O ATOM 777 CB ASP A 51 -7.050 -12.180 2.256 1.00 43.41 C ATOM 778 CG ASP A 51 -6.774 -12.560 3.721 1.00 71.41 C ATOM 779 OD1 ASP A 51 -7.539 -12.153 4.615 1.00 35.41 O ATOM 780 OD2 ASP A 51 -5.800 -13.300 3.980 1.00 3.53 O ATOM 0 H ASP A 51 -6.653 -14.596 2.116 1.00 41.12 H new ATOM 0 HA ASP A 51 -9.038 -13.035 2.046 1.00 35.14 H new ATOM 0 HB2 ASP A 51 -6.113 -12.188 1.699 1.00 43.41 H new ATOM 0 HB3 ASP A 51 -7.437 -11.162 2.215 1.00 43.41 H new ATOM 785 N LYS A 52 -9.444 -12.365 -0.291 1.00 63.25 N ATOM 786 CA LYS A 52 -9.812 -11.952 -1.675 1.00 52.13 C ATOM 787 C LYS A 52 -9.979 -10.427 -1.764 1.00 51.42 C ATOM 788 O LYS A 52 -10.759 -9.915 -2.575 1.00 5.44 O ATOM 789 CB LYS A 52 -11.098 -12.706 -2.143 1.00 35.12 C ATOM 790 CG LYS A 52 -10.867 -14.220 -2.308 1.00 2.24 C ATOM 791 CD LYS A 52 -9.844 -14.545 -3.443 1.00 32.35 C ATOM 792 CE LYS A 52 -9.102 -15.865 -3.202 1.00 32.00 C ATOM 793 NZ LYS A 52 -8.266 -15.783 -1.984 1.00 54.25 N ATOM 0 H LYS A 52 -10.222 -12.299 0.365 1.00 63.25 H new ATOM 0 HA LYS A 52 -9.002 -12.227 -2.351 1.00 52.13 H new ATOM 0 HB2 LYS A 52 -11.896 -12.540 -1.419 1.00 35.12 H new ATOM 0 HB3 LYS A 52 -11.436 -12.288 -3.091 1.00 35.12 H new ATOM 0 HG2 LYS A 52 -10.506 -14.635 -1.367 1.00 2.24 H new ATOM 0 HG3 LYS A 52 -11.817 -14.708 -2.527 1.00 2.24 H new ATOM 0 HD2 LYS A 52 -10.368 -14.595 -4.397 1.00 32.35 H new ATOM 0 HD3 LYS A 52 -9.120 -13.733 -3.519 1.00 32.35 H new ATOM 0 HE2 LYS A 52 -9.821 -16.678 -3.101 1.00 32.00 H new ATOM 0 HE3 LYS A 52 -8.476 -16.098 -4.063 1.00 32.00 H new ATOM 0 HZ1 LYS A 52 -7.600 -16.581 -1.966 1.00 54.25 H new ATOM 0 HZ2 LYS A 52 -7.735 -14.889 -1.987 1.00 54.25 H new ATOM 0 HZ3 LYS A 52 -8.875 -15.821 -1.142 1.00 54.25 H new ATOM 807 N VAL A 53 -9.200 -9.719 -0.941 1.00 31.42 N ATOM 808 CA VAL A 53 -9.071 -8.258 -0.981 1.00 3.03 C ATOM 809 C VAL A 53 -7.643 -7.880 -0.548 1.00 62.25 C ATOM 810 O VAL A 53 -7.116 -8.409 0.446 1.00 43.34 O ATOM 811 CB VAL A 53 -10.164 -7.529 -0.097 1.00 23.32 C ATOM 812 CG1 VAL A 53 -10.198 -8.062 1.354 1.00 61.32 C ATOM 813 CG2 VAL A 53 -9.998 -5.984 -0.139 1.00 53.43 C ATOM 0 H VAL A 53 -8.630 -10.153 -0.214 1.00 31.42 H new ATOM 0 HA VAL A 53 -9.247 -7.917 -2.001 1.00 3.03 H new ATOM 0 HB VAL A 53 -11.132 -7.765 -0.538 1.00 23.32 H new ATOM 0 HG11 VAL A 53 -10.964 -7.530 1.919 1.00 61.32 H new ATOM 0 HG12 VAL A 53 -10.428 -9.127 1.345 1.00 61.32 H new ATOM 0 HG13 VAL A 53 -9.226 -7.905 1.822 1.00 61.32 H new ATOM 0 HG21 VAL A 53 -10.766 -5.519 0.479 1.00 53.43 H new ATOM 0 HG22 VAL A 53 -9.013 -5.713 0.241 1.00 53.43 H new ATOM 0 HG23 VAL A 53 -10.099 -5.635 -1.167 1.00 53.43 H new ATOM 823 N ALA A 54 -7.023 -6.985 -1.326 1.00 54.41 N ATOM 824 CA ALA A 54 -5.661 -6.504 -1.103 1.00 51.43 C ATOM 825 C ALA A 54 -5.718 -5.076 -0.546 1.00 40.34 C ATOM 826 O ALA A 54 -6.791 -4.460 -0.495 1.00 3.44 O ATOM 827 CB ALA A 54 -4.880 -6.547 -2.429 1.00 75.50 C ATOM 0 H ALA A 54 -7.466 -6.568 -2.145 1.00 54.41 H new ATOM 0 HA ALA A 54 -5.149 -7.140 -0.381 1.00 51.43 H new ATOM 0 HB1 ALA A 54 -3.864 -6.189 -2.265 1.00 75.50 H new ATOM 0 HB2 ALA A 54 -4.848 -7.572 -2.799 1.00 75.50 H new ATOM 0 HB3 ALA A 54 -5.375 -5.911 -3.163 1.00 75.50 H new ATOM 833 N TYR A 55 -4.565 -4.567 -0.105 1.00 51.12 N ATOM 834 CA TYR A 55 -4.426 -3.216 0.466 1.00 55.33 C ATOM 835 C TYR A 55 -3.060 -2.651 0.068 1.00 25.32 C ATOM 836 O TYR A 55 -2.035 -3.288 0.295 1.00 21.40 O ATOM 837 CB TYR A 55 -4.567 -3.250 2.014 1.00 60.25 C ATOM 838 CG TYR A 55 -5.968 -3.640 2.510 1.00 30.33 C ATOM 839 CD1 TYR A 55 -6.977 -2.682 2.643 1.00 54.15 C ATOM 840 CD2 TYR A 55 -6.291 -4.966 2.825 1.00 2.32 C ATOM 841 CE1 TYR A 55 -8.244 -3.030 3.063 1.00 72.34 C ATOM 842 CE2 TYR A 55 -7.559 -5.308 3.248 1.00 3.32 C ATOM 843 CZ TYR A 55 -8.526 -4.340 3.361 1.00 73.44 C ATOM 844 OH TYR A 55 -9.787 -4.686 3.776 1.00 61.34 O ATOM 0 H TYR A 55 -3.687 -5.085 -0.133 1.00 51.12 H new ATOM 0 HA TYR A 55 -5.219 -2.577 0.076 1.00 55.33 H new ATOM 0 HB2 TYR A 55 -3.841 -3.955 2.418 1.00 60.25 H new ATOM 0 HB3 TYR A 55 -4.313 -2.268 2.413 1.00 60.25 H new ATOM 0 HD1 TYR A 55 -6.760 -1.649 2.412 1.00 54.15 H new ATOM 0 HD2 TYR A 55 -5.536 -5.733 2.735 1.00 2.32 H new ATOM 0 HE1 TYR A 55 -9.011 -2.275 3.157 1.00 72.34 H new ATOM 0 HE2 TYR A 55 -7.790 -6.335 3.490 1.00 3.32 H new ATOM 0 HH TYR A 55 -9.822 -5.651 3.945 1.00 61.34 H new ATOM 854 N LEU A 56 -3.053 -1.461 -0.535 1.00 21.51 N ATOM 855 CA LEU A 56 -1.828 -0.816 -1.016 1.00 44.22 C ATOM 856 C LEU A 56 -1.309 0.156 0.056 1.00 64.31 C ATOM 857 O LEU A 56 -1.969 1.152 0.365 1.00 1.32 O ATOM 858 CB LEU A 56 -2.117 -0.091 -2.357 1.00 24.44 C ATOM 859 CG LEU A 56 -0.883 0.488 -3.111 1.00 61.52 C ATOM 860 CD1 LEU A 56 0.146 -0.597 -3.457 1.00 73.22 C ATOM 861 CD2 LEU A 56 -1.325 1.255 -4.369 1.00 14.22 C ATOM 0 H LEU A 56 -3.898 -0.915 -0.704 1.00 21.51 H new ATOM 0 HA LEU A 56 -1.054 -1.562 -1.198 1.00 44.22 H new ATOM 0 HB2 LEU A 56 -2.626 -0.790 -3.021 1.00 24.44 H new ATOM 0 HB3 LEU A 56 -2.812 0.726 -2.161 1.00 24.44 H new ATOM 0 HG LEU A 56 -0.389 1.188 -2.436 1.00 61.52 H new ATOM 0 HD11 LEU A 56 0.988 -0.146 -3.982 1.00 73.22 H new ATOM 0 HD12 LEU A 56 0.500 -1.068 -2.540 1.00 73.22 H new ATOM 0 HD13 LEU A 56 -0.318 -1.349 -4.095 1.00 73.22 H new ATOM 0 HD21 LEU A 56 -0.448 1.651 -4.881 1.00 14.22 H new ATOM 0 HD22 LEU A 56 -1.861 0.581 -5.037 1.00 14.22 H new ATOM 0 HD23 LEU A 56 -1.980 2.078 -4.082 1.00 14.22 H new ATOM 873 N VAL A 57 -0.142 -0.165 0.632 1.00 12.45 N ATOM 874 CA VAL A 57 0.483 0.628 1.709 1.00 30.23 C ATOM 875 C VAL A 57 1.574 1.537 1.113 1.00 13.32 C ATOM 876 O VAL A 57 2.505 1.042 0.461 1.00 40.04 O ATOM 877 CB VAL A 57 1.110 -0.299 2.825 1.00 32.21 C ATOM 878 CG1 VAL A 57 1.749 0.530 3.976 1.00 4.41 C ATOM 879 CG2 VAL A 57 0.056 -1.291 3.366 1.00 64.41 C ATOM 0 H VAL A 57 0.401 -0.986 0.365 1.00 12.45 H new ATOM 0 HA VAL A 57 -0.293 1.235 2.176 1.00 30.23 H new ATOM 0 HB VAL A 57 1.913 -0.873 2.363 1.00 32.21 H new ATOM 0 HG11 VAL A 57 2.168 -0.146 4.722 1.00 4.41 H new ATOM 0 HG12 VAL A 57 2.540 1.162 3.573 1.00 4.41 H new ATOM 0 HG13 VAL A 57 0.987 1.155 4.441 1.00 4.41 H new ATOM 0 HG21 VAL A 57 0.508 -1.920 4.133 1.00 64.41 H new ATOM 0 HG22 VAL A 57 -0.778 -0.737 3.796 1.00 64.41 H new ATOM 0 HG23 VAL A 57 -0.306 -1.917 2.551 1.00 64.41 H new ATOM 889 N MET A 58 1.437 2.858 1.328 1.00 55.14 N ATOM 890 CA MET A 58 2.423 3.873 0.909 1.00 51.51 C ATOM 891 C MET A 58 2.476 4.996 1.966 1.00 14.22 C ATOM 892 O MET A 58 1.866 4.884 3.036 1.00 71.42 O ATOM 893 CB MET A 58 2.054 4.458 -0.495 1.00 32.21 C ATOM 894 CG MET A 58 0.851 5.431 -0.517 1.00 41.40 C ATOM 895 SD MET A 58 -0.730 4.669 -0.121 1.00 64.01 S ATOM 896 CE MET A 58 -0.960 3.651 -1.560 1.00 64.35 C ATOM 0 H MET A 58 0.628 3.257 1.804 1.00 55.14 H new ATOM 0 HA MET A 58 3.405 3.406 0.828 1.00 51.51 H new ATOM 0 HB2 MET A 58 2.926 4.977 -0.893 1.00 32.21 H new ATOM 0 HB3 MET A 58 1.841 3.629 -1.170 1.00 32.21 H new ATOM 0 HG2 MET A 58 1.039 6.238 0.191 1.00 41.40 H new ATOM 0 HG3 MET A 58 0.784 5.884 -1.506 1.00 41.40 H new ATOM 0 HE1 MET A 58 -1.896 3.920 -2.050 1.00 64.35 H new ATOM 0 HE2 MET A 58 -0.131 3.805 -2.251 1.00 64.35 H new ATOM 0 HE3 MET A 58 -0.994 2.603 -1.263 1.00 64.35 H new ATOM 906 N ASP A 59 3.226 6.062 1.661 1.00 22.14 N ATOM 907 CA ASP A 59 3.253 7.306 2.452 1.00 32.20 C ATOM 908 C ASP A 59 2.407 8.401 1.759 1.00 4.42 C ATOM 909 O ASP A 59 1.917 8.216 0.636 1.00 3.01 O ATOM 910 CB ASP A 59 4.726 7.766 2.672 1.00 73.31 C ATOM 911 CG ASP A 59 5.565 7.863 1.381 1.00 43.14 C ATOM 912 OD1 ASP A 59 5.200 8.629 0.461 1.00 72.10 O ATOM 913 OD2 ASP A 59 6.612 7.192 1.288 1.00 73.43 O ATOM 0 H ASP A 59 3.841 6.089 0.847 1.00 22.14 H new ATOM 0 HA ASP A 59 2.812 7.121 3.431 1.00 32.20 H new ATOM 0 HB2 ASP A 59 4.720 8.740 3.161 1.00 73.31 H new ATOM 0 HB3 ASP A 59 5.213 7.070 3.355 1.00 73.31 H new ATOM 918 N GLU A 60 2.267 9.549 2.437 1.00 23.13 N ATOM 919 CA GLU A 60 1.409 10.665 1.985 1.00 1.34 C ATOM 920 C GLU A 60 1.982 11.382 0.743 1.00 5.03 C ATOM 921 O GLU A 60 1.216 11.943 -0.039 1.00 4.41 O ATOM 922 CB GLU A 60 1.164 11.663 3.156 1.00 42.41 C ATOM 923 CG GLU A 60 0.208 12.833 2.827 1.00 44.42 C ATOM 924 CD GLU A 60 -0.245 13.627 4.062 1.00 55.01 C ATOM 925 OE1 GLU A 60 0.508 14.523 4.507 1.00 45.23 O ATOM 926 OE2 GLU A 60 -1.367 13.373 4.576 1.00 74.10 O ATOM 0 H GLU A 60 2.746 9.735 3.318 1.00 23.13 H new ATOM 0 HA GLU A 60 0.451 10.243 1.680 1.00 1.34 H new ATOM 0 HB2 GLU A 60 0.761 11.112 4.005 1.00 42.41 H new ATOM 0 HB3 GLU A 60 2.123 12.074 3.470 1.00 42.41 H new ATOM 0 HG2 GLU A 60 0.704 13.511 2.132 1.00 44.42 H new ATOM 0 HG3 GLU A 60 -0.671 12.440 2.316 1.00 44.42 H new ATOM 933 N ARG A 61 3.319 11.322 0.550 1.00 22.21 N ATOM 934 CA ARG A 61 3.997 11.936 -0.626 1.00 12.02 C ATOM 935 C ARG A 61 3.505 11.255 -1.922 1.00 4.23 C ATOM 936 O ARG A 61 3.146 11.914 -2.906 1.00 20.33 O ATOM 937 CB ARG A 61 5.533 11.762 -0.527 1.00 21.21 C ATOM 938 CG ARG A 61 6.170 12.132 0.828 1.00 13.03 C ATOM 939 CD ARG A 61 7.648 11.724 0.875 1.00 24.10 C ATOM 940 NE ARG A 61 7.821 10.272 0.620 1.00 1.40 N ATOM 941 CZ ARG A 61 8.483 9.720 -0.413 1.00 71.45 C ATOM 942 NH1 ARG A 61 9.083 10.472 -1.337 1.00 42.41 N ATOM 943 NH2 ARG A 61 8.515 8.407 -0.521 1.00 44.42 N ATOM 0 H ARG A 61 3.957 10.854 1.194 1.00 22.21 H new ATOM 0 HA ARG A 61 3.757 12.999 -0.642 1.00 12.02 H new ATOM 0 HB2 ARG A 61 5.776 10.723 -0.748 1.00 21.21 H new ATOM 0 HB3 ARG A 61 5.998 12.370 -1.303 1.00 21.21 H new ATOM 0 HG2 ARG A 61 6.081 13.206 0.994 1.00 13.03 H new ATOM 0 HG3 ARG A 61 5.628 11.639 1.635 1.00 13.03 H new ATOM 0 HD2 ARG A 61 8.207 12.294 0.133 1.00 24.10 H new ATOM 0 HD3 ARG A 61 8.065 11.975 1.850 1.00 24.10 H new ATOM 0 HE ARG A 61 7.398 9.632 1.292 1.00 1.40 H new ATOM 0 HH11 ARG A 61 9.046 11.489 -1.270 1.00 42.41 H new ATOM 0 HH12 ARG A 61 9.579 10.030 -2.111 1.00 42.41 H new ATOM 0 HH21 ARG A 61 8.043 7.827 0.172 1.00 44.42 H new ATOM 0 HH22 ARG A 61 9.012 7.971 -1.298 1.00 44.42 H new ATOM 957 N THR A 62 3.508 9.913 -1.872 1.00 74.31 N ATOM 958 CA THR A 62 2.982 9.039 -2.925 1.00 62.20 C ATOM 959 C THR A 62 1.475 9.289 -3.148 1.00 21.24 C ATOM 960 O THR A 62 0.999 9.278 -4.291 1.00 62.45 O ATOM 961 CB THR A 62 3.240 7.543 -2.545 1.00 43.30 C ATOM 962 OG1 THR A 62 4.646 7.339 -2.356 1.00 71.21 O ATOM 963 CG2 THR A 62 2.711 6.550 -3.599 1.00 12.42 C ATOM 0 H THR A 62 3.886 9.397 -1.078 1.00 74.31 H new ATOM 0 HA THR A 62 3.499 9.265 -3.858 1.00 62.20 H new ATOM 0 HB THR A 62 2.692 7.346 -1.624 1.00 43.30 H new ATOM 0 HG1 THR A 62 4.921 7.729 -1.500 1.00 71.21 H new ATOM 0 HG21 THR A 62 2.921 5.530 -3.276 1.00 12.42 H new ATOM 0 HG22 THR A 62 1.635 6.680 -3.713 1.00 12.42 H new ATOM 0 HG23 THR A 62 3.203 6.737 -4.554 1.00 12.42 H new ATOM 971 N TRP A 63 0.738 9.549 -2.044 1.00 73.01 N ATOM 972 CA TRP A 63 -0.703 9.855 -2.107 1.00 74.04 C ATOM 973 C TRP A 63 -0.974 11.193 -2.826 1.00 1.43 C ATOM 974 O TRP A 63 -1.963 11.298 -3.545 1.00 33.31 O ATOM 975 CB TRP A 63 -1.367 9.860 -0.707 1.00 64.33 C ATOM 976 CG TRP A 63 -2.825 10.298 -0.745 1.00 42.04 C ATOM 977 CD1 TRP A 63 -3.341 11.496 -0.326 1.00 2.21 C ATOM 978 CD2 TRP A 63 -3.933 9.566 -1.301 1.00 41.31 C ATOM 979 NE1 TRP A 63 -4.687 11.531 -0.552 1.00 11.11 N ATOM 980 CE2 TRP A 63 -5.073 10.370 -1.153 1.00 73.32 C ATOM 981 CE3 TRP A 63 -4.076 8.310 -1.906 1.00 24.34 C ATOM 982 CZ2 TRP A 63 -6.332 9.968 -1.576 1.00 15.23 C ATOM 983 CZ3 TRP A 63 -5.330 7.913 -2.329 1.00 52.14 C ATOM 984 CH2 TRP A 63 -6.442 8.744 -2.165 1.00 73.53 C ATOM 0 H TRP A 63 1.122 9.552 -1.099 1.00 73.01 H new ATOM 0 HA TRP A 63 -1.155 9.052 -2.689 1.00 74.04 H new ATOM 0 HB2 TRP A 63 -1.304 8.860 -0.277 1.00 64.33 H new ATOM 0 HB3 TRP A 63 -0.810 10.526 -0.048 1.00 64.33 H new ATOM 0 HD1 TRP A 63 -2.767 12.296 0.118 1.00 2.21 H new ATOM 0 HE1 TRP A 63 -5.306 12.304 -0.309 1.00 11.11 H new ATOM 0 HE3 TRP A 63 -3.221 7.664 -2.039 1.00 24.34 H new ATOM 0 HZ2 TRP A 63 -7.195 10.603 -1.443 1.00 15.23 H new ATOM 0 HZ3 TRP A 63 -5.453 6.946 -2.793 1.00 52.14 H new ATOM 0 HH2 TRP A 63 -7.408 8.409 -2.512 1.00 73.53 H new ATOM 995 N LYS A 64 -0.101 12.211 -2.634 1.00 21.31 N ATOM 996 CA LYS A 64 -0.227 13.519 -3.331 1.00 23.25 C ATOM 997 C LYS A 64 -0.304 13.331 -4.859 1.00 35.30 C ATOM 998 O LYS A 64 -0.925 14.125 -5.567 1.00 35.24 O ATOM 999 CB LYS A 64 0.963 14.452 -2.991 1.00 30.01 C ATOM 1000 CG LYS A 64 1.132 14.773 -1.499 1.00 72.14 C ATOM 1001 CD LYS A 64 -0.146 15.358 -0.853 1.00 53.42 C ATOM 1002 CE LYS A 64 0.106 15.882 0.565 1.00 51.32 C ATOM 1003 NZ LYS A 64 -1.118 16.479 1.168 1.00 24.14 N ATOM 0 H LYS A 64 0.698 12.154 -2.003 1.00 21.31 H new ATOM 0 HA LYS A 64 -1.151 13.979 -2.982 1.00 23.25 H new ATOM 0 HB2 LYS A 64 1.882 13.991 -3.354 1.00 30.01 H new ATOM 0 HB3 LYS A 64 0.839 15.388 -3.536 1.00 30.01 H new ATOM 0 HG2 LYS A 64 1.416 13.864 -0.968 1.00 72.14 H new ATOM 0 HG3 LYS A 64 1.950 15.483 -1.377 1.00 72.14 H new ATOM 0 HD2 LYS A 64 -0.526 16.168 -1.475 1.00 53.42 H new ATOM 0 HD3 LYS A 64 -0.919 14.590 -0.822 1.00 53.42 H new ATOM 0 HE2 LYS A 64 0.459 15.066 1.195 1.00 51.32 H new ATOM 0 HE3 LYS A 64 0.898 16.630 0.539 1.00 51.32 H new ATOM 0 HZ1 LYS A 64 -0.902 16.820 2.126 1.00 24.14 H new ATOM 0 HZ2 LYS A 64 -1.441 17.275 0.582 1.00 24.14 H new ATOM 0 HZ3 LYS A 64 -1.867 15.759 1.218 1.00 24.14 H new ATOM 1017 N LYS A 65 0.333 12.250 -5.331 1.00 52.34 N ATOM 1018 CA LYS A 65 0.340 11.867 -6.741 1.00 11.31 C ATOM 1019 C LYS A 65 -0.957 11.115 -7.106 1.00 31.40 C ATOM 1020 O LYS A 65 -1.597 11.455 -8.091 1.00 72.30 O ATOM 1021 CB LYS A 65 1.605 11.017 -7.039 1.00 40.44 C ATOM 1022 CG LYS A 65 2.925 11.676 -6.565 1.00 42.42 C ATOM 1023 CD LYS A 65 3.181 13.077 -7.168 1.00 1.14 C ATOM 1024 CE LYS A 65 3.305 13.058 -8.697 1.00 13.20 C ATOM 1025 NZ LYS A 65 3.516 14.421 -9.255 1.00 75.31 N ATOM 0 H LYS A 65 0.862 11.614 -4.735 1.00 52.34 H new ATOM 0 HA LYS A 65 0.376 12.762 -7.362 1.00 11.31 H new ATOM 0 HB2 LYS A 65 1.501 10.045 -6.556 1.00 40.44 H new ATOM 0 HB3 LYS A 65 1.665 10.835 -8.112 1.00 40.44 H new ATOM 0 HG2 LYS A 65 2.909 11.757 -5.478 1.00 42.42 H new ATOM 0 HG3 LYS A 65 3.758 11.023 -6.823 1.00 42.42 H new ATOM 0 HD2 LYS A 65 2.367 13.743 -6.883 1.00 1.14 H new ATOM 0 HD3 LYS A 65 4.095 13.489 -6.740 1.00 1.14 H new ATOM 0 HE2 LYS A 65 4.137 12.415 -8.986 1.00 13.20 H new ATOM 0 HE3 LYS A 65 2.403 12.625 -9.129 1.00 13.20 H new ATOM 0 HZ1 LYS A 65 3.595 14.364 -10.290 1.00 75.31 H new ATOM 0 HZ2 LYS A 65 2.711 15.028 -9.002 1.00 75.31 H new ATOM 0 HZ3 LYS A 65 4.391 14.825 -8.863 1.00 75.31 H new ATOM 1039 N VAL A 66 -1.350 10.126 -6.272 1.00 5.23 N ATOM 1040 CA VAL A 66 -2.550 9.273 -6.509 1.00 4.23 C ATOM 1041 C VAL A 66 -3.856 10.117 -6.519 1.00 14.13 C ATOM 1042 O VAL A 66 -4.638 10.076 -7.488 1.00 41.54 O ATOM 1043 CB VAL A 66 -2.656 8.133 -5.425 1.00 1.10 C ATOM 1044 CG1 VAL A 66 -3.906 7.248 -5.648 1.00 75.33 C ATOM 1045 CG2 VAL A 66 -1.369 7.281 -5.393 1.00 34.34 C ATOM 0 H VAL A 66 -0.849 9.892 -5.415 1.00 5.23 H new ATOM 0 HA VAL A 66 -2.430 8.815 -7.491 1.00 4.23 H new ATOM 0 HB VAL A 66 -2.768 8.613 -4.453 1.00 1.10 H new ATOM 0 HG11 VAL A 66 -3.945 6.474 -4.882 1.00 75.33 H new ATOM 0 HG12 VAL A 66 -4.803 7.864 -5.588 1.00 75.33 H new ATOM 0 HG13 VAL A 66 -3.851 6.782 -6.632 1.00 75.33 H new ATOM 0 HG21 VAL A 66 -1.467 6.502 -4.637 1.00 34.34 H new ATOM 0 HG22 VAL A 66 -1.212 6.822 -6.369 1.00 34.34 H new ATOM 0 HG23 VAL A 66 -0.518 7.917 -5.150 1.00 34.34 H new ATOM 1055 N TYR A 67 -4.054 10.869 -5.416 1.00 65.34 N ATOM 1056 CA TYR A 67 -5.149 11.860 -5.234 1.00 15.15 C ATOM 1057 C TYR A 67 -5.279 12.791 -6.455 1.00 25.41 C ATOM 1058 O TYR A 67 -6.392 13.044 -6.953 1.00 23.32 O ATOM 1059 CB TYR A 67 -4.856 12.697 -3.952 1.00 14.21 C ATOM 1060 CG TYR A 67 -5.881 13.805 -3.632 1.00 73.03 C ATOM 1061 CD1 TYR A 67 -7.041 13.531 -2.907 1.00 53.41 C ATOM 1062 CD2 TYR A 67 -5.689 15.123 -4.068 1.00 4.14 C ATOM 1063 CE1 TYR A 67 -7.970 14.521 -2.636 1.00 32.42 C ATOM 1064 CE2 TYR A 67 -6.610 16.108 -3.792 1.00 60.15 C ATOM 1065 CZ TYR A 67 -7.747 15.803 -3.082 1.00 71.35 C ATOM 1066 OH TYR A 67 -8.666 16.791 -2.826 1.00 42.04 O ATOM 0 H TYR A 67 -3.443 10.806 -4.602 1.00 65.34 H new ATOM 0 HA TYR A 67 -6.093 11.326 -5.130 1.00 15.15 H new ATOM 0 HB2 TYR A 67 -4.803 12.018 -3.101 1.00 14.21 H new ATOM 0 HB3 TYR A 67 -3.872 13.155 -4.056 1.00 14.21 H new ATOM 0 HD1 TYR A 67 -7.218 12.527 -2.550 1.00 53.41 H new ATOM 0 HD2 TYR A 67 -4.801 15.371 -4.631 1.00 4.14 H new ATOM 0 HE1 TYR A 67 -8.865 14.288 -2.078 1.00 32.42 H new ATOM 0 HE2 TYR A 67 -6.440 17.119 -4.133 1.00 60.15 H new ATOM 0 HH TYR A 67 -8.353 17.636 -3.210 1.00 42.04 H new ATOM 1076 N ASP A 68 -4.110 13.287 -6.913 1.00 34.32 N ATOM 1077 CA ASP A 68 -4.000 14.151 -8.098 1.00 21.15 C ATOM 1078 C ASP A 68 -4.550 13.431 -9.335 1.00 11.12 C ATOM 1079 O ASP A 68 -5.430 13.957 -9.991 1.00 11.20 O ATOM 1080 CB ASP A 68 -2.524 14.583 -8.332 1.00 42.51 C ATOM 1081 CG ASP A 68 -2.314 15.348 -9.658 1.00 62.52 C ATOM 1082 OD1 ASP A 68 -2.523 16.578 -9.687 1.00 53.33 O ATOM 1083 OD2 ASP A 68 -1.948 14.716 -10.682 1.00 22.22 O ATOM 0 H ASP A 68 -3.214 13.096 -6.466 1.00 34.32 H new ATOM 0 HA ASP A 68 -4.593 15.049 -7.924 1.00 21.15 H new ATOM 0 HB2 ASP A 68 -2.201 15.212 -7.503 1.00 42.51 H new ATOM 0 HB3 ASP A 68 -1.888 13.698 -8.327 1.00 42.51 H new ATOM 1088 N LEU A 69 -4.058 12.191 -9.585 1.00 70.02 N ATOM 1089 CA LEU A 69 -4.399 11.384 -10.787 1.00 62.21 C ATOM 1090 C LEU A 69 -5.904 11.132 -10.921 1.00 1.34 C ATOM 1091 O LEU A 69 -6.428 11.057 -12.032 1.00 21.03 O ATOM 1092 CB LEU A 69 -3.669 10.023 -10.737 1.00 74.44 C ATOM 1093 CG LEU A 69 -2.122 10.094 -10.806 1.00 31.54 C ATOM 1094 CD1 LEU A 69 -1.490 8.756 -10.389 1.00 23.35 C ATOM 1095 CD2 LEU A 69 -1.645 10.551 -12.203 1.00 21.13 C ATOM 0 H LEU A 69 -3.409 11.719 -8.955 1.00 70.02 H new ATOM 0 HA LEU A 69 -4.076 11.962 -11.653 1.00 62.21 H new ATOM 0 HB2 LEU A 69 -3.951 9.512 -9.816 1.00 74.44 H new ATOM 0 HB3 LEU A 69 -4.025 9.409 -11.564 1.00 74.44 H new ATOM 0 HG LEU A 69 -1.785 10.846 -10.093 1.00 31.54 H new ATOM 0 HD11 LEU A 69 -0.404 8.833 -10.446 1.00 23.35 H new ATOM 0 HD12 LEU A 69 -1.783 8.518 -9.367 1.00 23.35 H new ATOM 0 HD13 LEU A 69 -1.834 7.967 -11.058 1.00 23.35 H new ATOM 0 HD21 LEU A 69 -0.556 10.591 -12.220 1.00 21.13 H new ATOM 0 HD22 LEU A 69 -1.994 9.844 -12.956 1.00 21.13 H new ATOM 0 HD23 LEU A 69 -2.048 11.540 -12.419 1.00 21.13 H new ATOM 1107 N LEU A 70 -6.576 10.972 -9.778 1.00 13.24 N ATOM 1108 CA LEU A 70 -8.036 10.808 -9.730 1.00 23.40 C ATOM 1109 C LEU A 70 -8.735 12.057 -10.314 1.00 60.41 C ATOM 1110 O LEU A 70 -9.508 11.958 -11.273 1.00 33.34 O ATOM 1111 CB LEU A 70 -8.485 10.512 -8.274 1.00 65.33 C ATOM 1112 CG LEU A 70 -7.880 9.214 -7.646 1.00 4.32 C ATOM 1113 CD1 LEU A 70 -8.331 9.031 -6.180 1.00 41.35 C ATOM 1114 CD2 LEU A 70 -8.212 7.967 -8.506 1.00 14.35 C ATOM 0 H LEU A 70 -6.128 10.952 -8.862 1.00 13.24 H new ATOM 0 HA LEU A 70 -8.330 9.958 -10.346 1.00 23.40 H new ATOM 0 HB2 LEU A 70 -8.214 11.361 -7.647 1.00 65.33 H new ATOM 0 HB3 LEU A 70 -9.572 10.435 -8.254 1.00 65.33 H new ATOM 0 HG LEU A 70 -6.796 9.326 -7.637 1.00 4.32 H new ATOM 0 HD11 LEU A 70 -7.892 8.119 -5.775 1.00 41.35 H new ATOM 0 HD12 LEU A 70 -8.002 9.886 -5.589 1.00 41.35 H new ATOM 0 HD13 LEU A 70 -9.418 8.959 -6.140 1.00 41.35 H new ATOM 0 HD21 LEU A 70 -7.778 7.080 -8.044 1.00 14.35 H new ATOM 0 HD22 LEU A 70 -9.293 7.849 -8.573 1.00 14.35 H new ATOM 0 HD23 LEU A 70 -7.798 8.094 -9.506 1.00 14.35 H new ATOM 1126 N ILE A 71 -8.361 13.240 -9.791 1.00 53.40 N ATOM 1127 CA ILE A 71 -8.913 14.547 -10.235 1.00 54.34 C ATOM 1128 C ILE A 71 -8.350 14.946 -11.622 1.00 33.32 C ATOM 1129 O ILE A 71 -8.961 15.730 -12.356 1.00 43.54 O ATOM 1130 CB ILE A 71 -8.590 15.674 -9.175 1.00 14.02 C ATOM 1131 CG1 ILE A 71 -9.005 15.200 -7.746 1.00 33.10 C ATOM 1132 CG2 ILE A 71 -9.281 17.022 -9.537 1.00 14.11 C ATOM 1133 CD1 ILE A 71 -8.705 16.181 -6.638 1.00 74.11 C ATOM 0 H ILE A 71 -7.667 13.323 -9.048 1.00 53.40 H new ATOM 0 HA ILE A 71 -9.995 14.442 -10.320 1.00 54.34 H new ATOM 0 HB ILE A 71 -7.515 15.852 -9.189 1.00 14.02 H new ATOM 0 HG12 ILE A 71 -10.074 14.990 -7.745 1.00 33.10 H new ATOM 0 HG13 ILE A 71 -8.495 14.261 -7.528 1.00 33.10 H new ATOM 0 HG21 ILE A 71 -9.034 17.771 -8.784 1.00 14.11 H new ATOM 0 HG22 ILE A 71 -8.932 17.359 -10.513 1.00 14.11 H new ATOM 0 HG23 ILE A 71 -10.361 16.880 -9.568 1.00 14.11 H new ATOM 0 HD11 ILE A 71 -9.029 15.763 -5.685 1.00 74.11 H new ATOM 0 HD12 ILE A 71 -7.633 16.375 -6.604 1.00 74.11 H new ATOM 0 HD13 ILE A 71 -9.237 17.114 -6.824 1.00 74.11 H new ATOM 1145 N LEU A 72 -7.194 14.369 -11.971 1.00 51.21 N ATOM 1146 CA LEU A 72 -6.471 14.672 -13.214 1.00 41.30 C ATOM 1147 C LEU A 72 -7.161 13.950 -14.375 1.00 71.22 C ATOM 1148 O LEU A 72 -7.345 14.528 -15.455 1.00 42.52 O ATOM 1149 CB LEU A 72 -4.966 14.260 -13.053 1.00 45.11 C ATOM 1150 CG LEU A 72 -3.917 14.810 -14.086 1.00 12.33 C ATOM 1151 CD1 LEU A 72 -3.981 14.088 -15.454 1.00 2.13 C ATOM 1152 CD2 LEU A 72 -4.037 16.354 -14.238 1.00 53.44 C ATOM 0 H LEU A 72 -6.728 13.670 -11.392 1.00 51.21 H new ATOM 0 HA LEU A 72 -6.490 15.740 -13.430 1.00 41.30 H new ATOM 0 HB2 LEU A 72 -4.644 14.569 -12.059 1.00 45.11 H new ATOM 0 HB3 LEU A 72 -4.917 13.171 -13.080 1.00 45.11 H new ATOM 0 HG LEU A 72 -2.930 14.589 -13.679 1.00 12.33 H new ATOM 0 HD11 LEU A 72 -3.233 14.512 -16.124 1.00 2.13 H new ATOM 0 HD12 LEU A 72 -3.782 13.025 -15.314 1.00 2.13 H new ATOM 0 HD13 LEU A 72 -4.972 14.218 -15.888 1.00 2.13 H new ATOM 0 HD21 LEU A 72 -3.299 16.707 -14.959 1.00 53.44 H new ATOM 0 HD22 LEU A 72 -5.037 16.608 -14.588 1.00 53.44 H new ATOM 0 HD23 LEU A 72 -3.858 16.830 -13.274 1.00 53.44 H new ATOM 1164 N HIS A 73 -7.569 12.687 -14.137 1.00 73.43 N ATOM 1165 CA HIS A 73 -8.245 11.883 -15.159 1.00 41.41 C ATOM 1166 C HIS A 73 -9.752 12.204 -15.151 1.00 43.41 C ATOM 1167 O HIS A 73 -10.191 12.980 -15.995 1.00 32.05 O ATOM 1168 CB HIS A 73 -7.970 10.367 -14.929 1.00 33.52 C ATOM 1169 CG HIS A 73 -6.547 9.949 -15.213 1.00 44.43 C ATOM 1170 ND1 HIS A 73 -6.224 8.865 -16.000 1.00 63.53 N ATOM 1171 CD2 HIS A 73 -5.358 10.466 -14.805 1.00 21.53 C ATOM 1172 CE1 HIS A 73 -4.917 8.740 -16.064 1.00 44.30 C ATOM 1173 NE2 HIS A 73 -4.368 9.694 -15.347 1.00 64.41 N ATOM 0 H HIS A 73 -7.440 12.208 -13.246 1.00 73.43 H new ATOM 0 HA HIS A 73 -7.851 12.133 -16.144 1.00 41.41 H new ATOM 0 HB2 HIS A 73 -8.211 10.118 -13.896 1.00 33.52 H new ATOM 0 HB3 HIS A 73 -8.641 9.787 -15.562 1.00 33.52 H new ATOM 0 HD2 HIS A 73 -5.220 11.328 -14.169 1.00 21.53 H new ATOM 0 HE1 HIS A 73 -4.383 7.979 -16.615 1.00 44.30 H new ATOM 0 HE2 HIS A 73 -3.366 9.836 -15.216 1.00 64.41 H new ATOM 1182 N ASP A 74 -10.478 11.781 -14.087 1.00 23.53 N ATOM 1183 CA ASP A 74 -11.967 11.929 -13.968 1.00 40.23 C ATOM 1184 C ASP A 74 -12.434 11.405 -12.598 1.00 44.13 C ATOM 1185 O ASP A 74 -12.824 10.237 -12.494 1.00 51.41 O ATOM 1186 CB ASP A 74 -12.776 11.156 -15.085 1.00 3.33 C ATOM 1187 CG ASP A 74 -12.842 11.848 -16.451 1.00 65.34 C ATOM 1188 OD1 ASP A 74 -13.588 12.843 -16.589 1.00 45.14 O ATOM 1189 OD2 ASP A 74 -12.176 11.376 -17.403 1.00 15.50 O ATOM 0 H ASP A 74 -10.054 11.325 -13.279 1.00 23.53 H new ATOM 0 HA ASP A 74 -12.170 12.993 -14.088 1.00 40.23 H new ATOM 0 HB2 ASP A 74 -12.328 10.171 -15.218 1.00 3.33 H new ATOM 0 HB3 ASP A 74 -13.794 10.998 -14.728 1.00 3.33 H new ATOM 1194 N PHE A 75 -12.367 12.250 -11.556 1.00 52.53 N ATOM 1195 CA PHE A 75 -12.880 11.907 -10.207 1.00 53.11 C ATOM 1196 C PHE A 75 -12.754 13.141 -9.302 1.00 3.52 C ATOM 1197 O PHE A 75 -11.645 13.530 -8.938 1.00 23.31 O ATOM 1198 CB PHE A 75 -12.106 10.688 -9.593 1.00 12.50 C ATOM 1199 CG PHE A 75 -12.876 9.885 -8.550 1.00 52.42 C ATOM 1200 CD1 PHE A 75 -14.187 9.477 -8.806 1.00 3.41 C ATOM 1201 CD2 PHE A 75 -12.291 9.509 -7.339 1.00 62.53 C ATOM 1202 CE1 PHE A 75 -14.887 8.729 -7.886 1.00 2.31 C ATOM 1203 CE2 PHE A 75 -12.994 8.755 -6.420 1.00 3.42 C ATOM 1204 CZ PHE A 75 -14.293 8.367 -6.697 1.00 11.22 C ATOM 0 H PHE A 75 -11.961 13.184 -11.617 1.00 52.53 H new ATOM 0 HA PHE A 75 -13.927 11.614 -10.288 1.00 53.11 H new ATOM 0 HB2 PHE A 75 -11.816 10.018 -10.402 1.00 12.50 H new ATOM 0 HB3 PHE A 75 -11.186 11.055 -9.138 1.00 12.50 H new ATOM 0 HD1 PHE A 75 -14.658 9.752 -9.738 1.00 3.41 H new ATOM 0 HD2 PHE A 75 -11.278 9.811 -7.119 1.00 62.53 H new ATOM 0 HE1 PHE A 75 -15.902 8.426 -8.097 1.00 2.31 H new ATOM 0 HE2 PHE A 75 -12.531 8.469 -5.487 1.00 3.42 H new ATOM 0 HZ PHE A 75 -14.843 7.778 -5.978 1.00 11.22 H new ATOM 1214 N THR A 76 -13.903 13.756 -8.959 1.00 31.04 N ATOM 1215 CA THR A 76 -13.955 15.024 -8.203 1.00 23.53 C ATOM 1216 C THR A 76 -13.349 14.842 -6.779 1.00 52.51 C ATOM 1217 O THR A 76 -13.448 13.742 -6.209 1.00 35.42 O ATOM 1218 CB THR A 76 -15.440 15.579 -8.135 1.00 63.22 C ATOM 1219 OG1 THR A 76 -15.451 16.978 -7.831 1.00 63.13 O ATOM 1220 CG2 THR A 76 -16.308 14.852 -7.103 1.00 10.34 C ATOM 0 H THR A 76 -14.823 13.387 -9.199 1.00 31.04 H new ATOM 0 HA THR A 76 -13.350 15.763 -8.729 1.00 23.53 H new ATOM 0 HB THR A 76 -15.864 15.400 -9.123 1.00 63.22 H new ATOM 0 HG1 THR A 76 -16.377 17.298 -7.796 1.00 63.13 H new ATOM 0 HG21 THR A 76 -17.311 15.279 -7.106 1.00 10.34 H new ATOM 0 HG22 THR A 76 -16.363 13.793 -7.355 1.00 10.34 H new ATOM 0 HG23 THR A 76 -15.868 14.966 -6.112 1.00 10.34 H new ATOM 1228 N PRO A 77 -12.691 15.904 -6.193 1.00 40.23 N ATOM 1229 CA PRO A 77 -12.104 15.852 -4.825 1.00 55.41 C ATOM 1230 C PRO A 77 -13.132 15.447 -3.755 1.00 75.54 C ATOM 1231 O PRO A 77 -12.802 14.715 -2.822 1.00 71.23 O ATOM 1232 CB PRO A 77 -11.580 17.303 -4.591 1.00 65.20 C ATOM 1233 CG PRO A 77 -12.271 18.134 -5.627 1.00 12.14 C ATOM 1234 CD PRO A 77 -12.433 17.228 -6.819 1.00 31.30 C ATOM 0 HA PRO A 77 -11.322 15.097 -4.747 1.00 55.41 H new ATOM 0 HB2 PRO A 77 -11.815 17.650 -3.585 1.00 65.20 H new ATOM 0 HB3 PRO A 77 -10.497 17.354 -4.701 1.00 65.20 H new ATOM 0 HG2 PRO A 77 -13.237 18.488 -5.267 1.00 12.14 H new ATOM 0 HG3 PRO A 77 -11.683 19.016 -5.880 1.00 12.14 H new ATOM 0 HD2 PRO A 77 -13.259 17.542 -7.457 1.00 31.30 H new ATOM 0 HD3 PRO A 77 -11.538 17.214 -7.441 1.00 31.30 H new ATOM 1242 N GLU A 78 -14.391 15.896 -3.966 1.00 75.22 N ATOM 1243 CA GLU A 78 -15.526 15.695 -3.042 1.00 72.34 C ATOM 1244 C GLU A 78 -15.847 14.202 -2.822 1.00 61.12 C ATOM 1245 O GLU A 78 -16.313 13.814 -1.748 1.00 51.22 O ATOM 1246 CB GLU A 78 -16.773 16.439 -3.582 1.00 21.12 C ATOM 1247 CG GLU A 78 -16.547 17.939 -3.865 1.00 31.31 C ATOM 1248 CD GLU A 78 -17.781 18.630 -4.469 1.00 54.23 C ATOM 1249 OE1 GLU A 78 -17.954 18.579 -5.712 1.00 53.20 O ATOM 1250 OE2 GLU A 78 -18.588 19.204 -3.708 1.00 25.23 O ATOM 0 H GLU A 78 -14.649 16.419 -4.803 1.00 75.22 H new ATOM 0 HA GLU A 78 -15.241 16.105 -2.073 1.00 72.34 H new ATOM 0 HB2 GLU A 78 -17.101 15.954 -4.501 1.00 21.12 H new ATOM 0 HB3 GLU A 78 -17.583 16.336 -2.860 1.00 21.12 H new ATOM 0 HG2 GLU A 78 -16.275 18.441 -2.937 1.00 31.31 H new ATOM 0 HG3 GLU A 78 -15.704 18.051 -4.547 1.00 31.31 H new ATOM 1257 N GLU A 79 -15.593 13.376 -3.854 1.00 45.40 N ATOM 1258 CA GLU A 79 -15.742 11.911 -3.765 1.00 30.32 C ATOM 1259 C GLU A 79 -14.639 11.301 -2.885 1.00 22.34 C ATOM 1260 O GLU A 79 -14.922 10.549 -1.944 1.00 34.42 O ATOM 1261 CB GLU A 79 -15.685 11.276 -5.179 1.00 73.35 C ATOM 1262 CG GLU A 79 -16.944 11.478 -6.032 1.00 41.33 C ATOM 1263 CD GLU A 79 -18.158 10.705 -5.494 1.00 42.12 C ATOM 1264 OE1 GLU A 79 -18.240 9.482 -5.737 1.00 74.45 O ATOM 1265 OE2 GLU A 79 -19.031 11.310 -4.832 1.00 73.40 O ATOM 0 H GLU A 79 -15.280 13.703 -4.768 1.00 45.40 H new ATOM 0 HA GLU A 79 -16.711 11.699 -3.312 1.00 30.32 H new ATOM 0 HB2 GLU A 79 -14.831 11.693 -5.714 1.00 73.35 H new ATOM 0 HB3 GLU A 79 -15.504 10.206 -5.073 1.00 73.35 H new ATOM 0 HG2 GLU A 79 -17.184 12.541 -6.071 1.00 41.33 H new ATOM 0 HG3 GLU A 79 -16.740 11.159 -7.054 1.00 41.33 H new ATOM 1272 N ILE A 80 -13.390 11.670 -3.214 1.00 21.02 N ATOM 1273 CA ILE A 80 -12.166 11.104 -2.614 1.00 55.43 C ATOM 1274 C ILE A 80 -12.150 11.324 -1.089 1.00 72.14 C ATOM 1275 O ILE A 80 -11.988 10.378 -0.305 1.00 61.42 O ATOM 1276 CB ILE A 80 -10.873 11.758 -3.250 1.00 4.30 C ATOM 1277 CG1 ILE A 80 -10.944 11.758 -4.812 1.00 52.34 C ATOM 1278 CG2 ILE A 80 -9.596 11.036 -2.755 1.00 64.32 C ATOM 1279 CD1 ILE A 80 -9.808 12.505 -5.489 1.00 64.41 C ATOM 0 H ILE A 80 -13.197 12.383 -3.917 1.00 21.02 H new ATOM 0 HA ILE A 80 -12.164 10.034 -2.820 1.00 55.43 H new ATOM 0 HB ILE A 80 -10.828 12.797 -2.923 1.00 4.30 H new ATOM 0 HG12 ILE A 80 -10.946 10.726 -5.164 1.00 52.34 H new ATOM 0 HG13 ILE A 80 -11.890 12.202 -5.121 1.00 52.34 H new ATOM 0 HG21 ILE A 80 -8.718 11.501 -3.204 1.00 64.32 H new ATOM 0 HG22 ILE A 80 -9.532 11.113 -1.670 1.00 64.32 H new ATOM 0 HG23 ILE A 80 -9.637 9.985 -3.043 1.00 64.32 H new ATOM 0 HD11 ILE A 80 -9.934 12.456 -6.571 1.00 64.41 H new ATOM 0 HD12 ILE A 80 -9.816 13.547 -5.170 1.00 64.41 H new ATOM 0 HD13 ILE A 80 -8.857 12.049 -5.213 1.00 64.41 H new ATOM 1291 N LYS A 81 -12.372 12.590 -0.696 1.00 14.52 N ATOM 1292 CA LYS A 81 -12.333 13.032 0.714 1.00 0.45 C ATOM 1293 C LYS A 81 -13.516 12.459 1.530 1.00 44.51 C ATOM 1294 O LYS A 81 -13.433 12.343 2.758 1.00 73.11 O ATOM 1295 CB LYS A 81 -12.299 14.583 0.778 1.00 14.12 C ATOM 1296 CG LYS A 81 -13.540 15.294 0.179 1.00 20.31 C ATOM 1297 CD LYS A 81 -13.342 16.818 -0.108 1.00 42.35 C ATOM 1298 CE LYS A 81 -13.226 17.709 1.150 1.00 2.21 C ATOM 1299 NZ LYS A 81 -11.986 17.468 1.935 1.00 10.24 N ATOM 0 H LYS A 81 -12.585 13.343 -1.350 1.00 14.52 H new ATOM 0 HA LYS A 81 -11.423 12.642 1.170 1.00 0.45 H new ATOM 0 HB2 LYS A 81 -12.194 14.886 1.820 1.00 14.12 H new ATOM 0 HB3 LYS A 81 -11.410 14.933 0.253 1.00 14.12 H new ATOM 0 HG2 LYS A 81 -13.814 14.795 -0.751 1.00 20.31 H new ATOM 0 HG3 LYS A 81 -14.378 15.173 0.865 1.00 20.31 H new ATOM 0 HD2 LYS A 81 -12.442 16.945 -0.709 1.00 42.35 H new ATOM 0 HD3 LYS A 81 -14.180 17.171 -0.709 1.00 42.35 H new ATOM 0 HE2 LYS A 81 -13.258 18.756 0.848 1.00 2.21 H new ATOM 0 HE3 LYS A 81 -14.091 17.535 1.790 1.00 2.21 H new ATOM 0 HZ1 LYS A 81 -11.617 18.374 2.288 1.00 10.24 H new ATOM 0 HZ2 LYS A 81 -12.200 16.844 2.739 1.00 10.24 H new ATOM 0 HZ3 LYS A 81 -11.273 17.017 1.327 1.00 10.24 H new ATOM 1313 N SER A 82 -14.600 12.081 0.821 1.00 35.24 N ATOM 1314 CA SER A 82 -15.795 11.460 1.419 1.00 70.31 C ATOM 1315 C SER A 82 -15.536 9.974 1.764 1.00 70.54 C ATOM 1316 O SER A 82 -16.213 9.411 2.628 1.00 62.54 O ATOM 1317 CB SER A 82 -17.000 11.602 0.458 1.00 53.23 C ATOM 1318 OG SER A 82 -18.189 11.070 1.020 1.00 70.54 O ATOM 0 H SER A 82 -14.669 12.200 -0.190 1.00 35.24 H new ATOM 0 HA SER A 82 -16.026 11.978 2.350 1.00 70.31 H new ATOM 0 HB2 SER A 82 -17.151 12.654 0.218 1.00 53.23 H new ATOM 0 HB3 SER A 82 -16.780 11.090 -0.479 1.00 53.23 H new ATOM 0 HG SER A 82 -18.928 11.179 0.386 1.00 70.54 H new ATOM 1324 N PHE A 83 -14.548 9.341 1.084 1.00 31.50 N ATOM 1325 CA PHE A 83 -14.119 7.957 1.406 1.00 31.24 C ATOM 1326 C PHE A 83 -13.298 7.898 2.700 1.00 0.23 C ATOM 1327 O PHE A 83 -13.200 6.845 3.304 1.00 14.34 O ATOM 1328 CB PHE A 83 -13.334 7.297 0.244 1.00 10.24 C ATOM 1329 CG PHE A 83 -14.198 7.014 -0.987 1.00 22.53 C ATOM 1330 CD1 PHE A 83 -15.286 6.135 -0.907 1.00 65.11 C ATOM 1331 CD2 PHE A 83 -13.942 7.624 -2.210 1.00 73.14 C ATOM 1332 CE1 PHE A 83 -16.081 5.883 -2.015 1.00 51.04 C ATOM 1333 CE2 PHE A 83 -14.737 7.374 -3.310 1.00 31.45 C ATOM 1334 CZ PHE A 83 -15.806 6.504 -3.215 1.00 61.33 C ATOM 0 H PHE A 83 -14.035 9.765 0.311 1.00 31.50 H new ATOM 0 HA PHE A 83 -15.036 7.387 1.556 1.00 31.24 H new ATOM 0 HB2 PHE A 83 -12.508 7.948 -0.043 1.00 10.24 H new ATOM 0 HB3 PHE A 83 -12.897 6.362 0.595 1.00 10.24 H new ATOM 0 HD1 PHE A 83 -15.509 5.647 0.030 1.00 65.11 H new ATOM 0 HD2 PHE A 83 -13.108 8.304 -2.301 1.00 73.14 H new ATOM 0 HE1 PHE A 83 -16.915 5.201 -1.938 1.00 51.04 H new ATOM 0 HE2 PHE A 83 -14.522 7.861 -4.250 1.00 31.45 H new ATOM 0 HZ PHE A 83 -16.425 6.311 -4.079 1.00 61.33 H new ATOM 1344 N PHE A 84 -12.717 9.030 3.117 1.00 10.23 N ATOM 1345 CA PHE A 84 -12.064 9.145 4.450 1.00 71.11 C ATOM 1346 C PHE A 84 -13.138 9.274 5.551 1.00 30.42 C ATOM 1347 O PHE A 84 -12.921 8.891 6.703 1.00 34.41 O ATOM 1348 CB PHE A 84 -11.114 10.367 4.496 1.00 5.21 C ATOM 1349 CG PHE A 84 -9.921 10.280 3.538 1.00 4.31 C ATOM 1350 CD1 PHE A 84 -10.030 10.704 2.215 1.00 31.23 C ATOM 1351 CD2 PHE A 84 -8.689 9.789 3.967 1.00 40.12 C ATOM 1352 CE1 PHE A 84 -8.954 10.641 1.353 1.00 63.13 C ATOM 1353 CE2 PHE A 84 -7.614 9.724 3.104 1.00 14.32 C ATOM 1354 CZ PHE A 84 -7.746 10.150 1.798 1.00 71.02 C ATOM 0 H PHE A 84 -12.680 9.884 2.560 1.00 10.23 H new ATOM 0 HA PHE A 84 -11.474 8.245 4.622 1.00 71.11 H new ATOM 0 HB2 PHE A 84 -11.686 11.265 4.263 1.00 5.21 H new ATOM 0 HB3 PHE A 84 -10.740 10.482 5.513 1.00 5.21 H new ATOM 0 HD1 PHE A 84 -10.974 11.089 1.858 1.00 31.23 H new ATOM 0 HD2 PHE A 84 -8.574 9.455 4.988 1.00 40.12 H new ATOM 0 HE1 PHE A 84 -9.059 10.976 0.332 1.00 63.13 H new ATOM 0 HE2 PHE A 84 -6.667 9.339 3.452 1.00 14.32 H new ATOM 0 HZ PHE A 84 -6.903 10.099 1.125 1.00 71.02 H new ATOM 1364 N GLU A 85 -14.299 9.821 5.153 1.00 31.41 N ATOM 1365 CA GLU A 85 -15.464 10.037 6.036 1.00 75.13 C ATOM 1366 C GLU A 85 -16.513 8.923 5.862 1.00 22.50 C ATOM 1367 O GLU A 85 -17.643 9.041 6.358 1.00 51.15 O ATOM 1368 CB GLU A 85 -16.081 11.421 5.708 1.00 43.40 C ATOM 1369 CG GLU A 85 -15.079 12.583 5.797 1.00 3.22 C ATOM 1370 CD GLU A 85 -15.733 13.953 5.598 1.00 34.31 C ATOM 1371 OE1 GLU A 85 -16.133 14.264 4.459 1.00 21.13 O ATOM 1372 OE2 GLU A 85 -15.841 14.725 6.578 1.00 74.14 O ATOM 0 H GLU A 85 -14.460 10.131 4.195 1.00 31.41 H new ATOM 0 HA GLU A 85 -15.136 10.011 7.075 1.00 75.13 H new ATOM 0 HB2 GLU A 85 -16.501 11.392 4.703 1.00 43.40 H new ATOM 0 HB3 GLU A 85 -16.907 11.612 6.393 1.00 43.40 H new ATOM 0 HG2 GLU A 85 -14.588 12.559 6.770 1.00 3.22 H new ATOM 0 HG3 GLU A 85 -14.302 12.444 5.045 1.00 3.22 H new ATOM 1379 N ASN A 86 -16.121 7.839 5.169 1.00 54.21 N ATOM 1380 CA ASN A 86 -17.018 6.725 4.834 1.00 4.31 C ATOM 1381 C ASN A 86 -17.292 5.858 6.081 1.00 5.12 C ATOM 1382 O ASN A 86 -16.446 5.072 6.507 1.00 30.20 O ATOM 1383 CB ASN A 86 -16.418 5.895 3.666 1.00 40.22 C ATOM 1384 CG ASN A 86 -17.347 4.818 3.114 1.00 3.15 C ATOM 1385 OD1 ASN A 86 -18.566 4.866 3.292 1.00 70.53 O ATOM 1386 ND2 ASN A 86 -16.787 3.860 2.399 1.00 44.52 N ATOM 0 H ASN A 86 -15.169 7.713 4.825 1.00 54.21 H new ATOM 0 HA ASN A 86 -17.978 7.121 4.501 1.00 4.31 H new ATOM 0 HB2 ASN A 86 -16.147 6.573 2.857 1.00 40.22 H new ATOM 0 HB3 ASN A 86 -15.497 5.423 4.008 1.00 40.22 H new ATOM 0 HD21 ASN A 86 -17.366 3.134 1.977 1.00 44.52 H new ATOM 0 HD22 ASN A 86 -15.775 3.846 2.269 1.00 44.52 H new ATOM 1393 N LYS A 87 -18.477 6.079 6.676 1.00 1.32 N ATOM 1394 CA LYS A 87 -18.948 5.362 7.874 1.00 35.54 C ATOM 1395 C LYS A 87 -19.755 4.111 7.476 1.00 4.44 C ATOM 1396 O LYS A 87 -19.561 3.033 8.051 1.00 3.52 O ATOM 1397 CB LYS A 87 -19.829 6.310 8.731 1.00 1.12 C ATOM 1398 CG LYS A 87 -19.088 7.536 9.317 1.00 14.20 C ATOM 1399 CD LYS A 87 -20.055 8.573 9.954 1.00 34.43 C ATOM 1400 CE LYS A 87 -20.937 7.986 11.073 1.00 64.32 C ATOM 1401 NZ LYS A 87 -21.914 8.983 11.597 1.00 55.42 N ATOM 0 H LYS A 87 -19.144 6.770 6.333 1.00 1.32 H new ATOM 0 HA LYS A 87 -18.083 5.042 8.456 1.00 35.54 H new ATOM 0 HB2 LYS A 87 -20.659 6.664 8.119 1.00 1.12 H new ATOM 0 HB3 LYS A 87 -20.260 5.738 9.552 1.00 1.12 H new ATOM 0 HG2 LYS A 87 -18.376 7.199 10.070 1.00 14.20 H new ATOM 0 HG3 LYS A 87 -18.512 8.019 8.527 1.00 14.20 H new ATOM 0 HD2 LYS A 87 -19.472 9.401 10.358 1.00 34.43 H new ATOM 0 HD3 LYS A 87 -20.697 8.985 9.175 1.00 34.43 H new ATOM 0 HE2 LYS A 87 -21.475 7.117 10.693 1.00 64.32 H new ATOM 0 HE3 LYS A 87 -20.303 7.637 11.888 1.00 64.32 H new ATOM 0 HZ1 LYS A 87 -22.487 8.547 12.348 1.00 55.42 H new ATOM 0 HZ2 LYS A 87 -21.401 9.801 11.984 1.00 55.42 H new ATOM 0 HZ3 LYS A 87 -22.536 9.298 10.826 1.00 55.42 H new ATOM 1415 N GLY A 88 -20.661 4.281 6.486 1.00 21.50 N ATOM 1416 CA GLY A 88 -21.591 3.220 6.064 1.00 70.42 C ATOM 1417 C GLY A 88 -20.888 1.987 5.511 1.00 61.13 C ATOM 1418 O GLY A 88 -21.373 0.857 5.656 1.00 54.04 O ATOM 0 H GLY A 88 -20.764 5.151 5.964 1.00 21.50 H new ATOM 0 HA2 GLY A 88 -22.207 2.928 6.914 1.00 70.42 H new ATOM 0 HA3 GLY A 88 -22.264 3.617 5.304 1.00 70.42 H new ATOM 1422 N LYS A 89 -19.742 2.221 4.868 1.00 61.23 N ATOM 1423 CA LYS A 89 -18.829 1.170 4.384 1.00 24.12 C ATOM 1424 C LYS A 89 -17.432 1.426 4.946 1.00 13.33 C ATOM 1425 O LYS A 89 -17.242 2.371 5.723 1.00 3.03 O ATOM 1426 CB LYS A 89 -18.808 1.156 2.832 1.00 35.30 C ATOM 1427 CG LYS A 89 -20.135 0.712 2.173 1.00 3.34 C ATOM 1428 CD LYS A 89 -20.524 -0.747 2.519 1.00 72.33 C ATOM 1429 CE LYS A 89 -19.458 -1.772 2.095 1.00 21.50 C ATOM 1430 NZ LYS A 89 -19.166 -1.698 0.646 1.00 44.43 N ATOM 0 H LYS A 89 -19.411 3.164 4.662 1.00 61.23 H new ATOM 0 HA LYS A 89 -19.175 0.194 4.724 1.00 24.12 H new ATOM 0 HB2 LYS A 89 -18.558 2.155 2.476 1.00 35.30 H new ATOM 0 HB3 LYS A 89 -18.012 0.490 2.499 1.00 35.30 H new ATOM 0 HG2 LYS A 89 -20.934 1.381 2.492 1.00 3.34 H new ATOM 0 HG3 LYS A 89 -20.048 0.812 1.091 1.00 3.34 H new ATOM 0 HD2 LYS A 89 -20.690 -0.828 3.593 1.00 72.33 H new ATOM 0 HD3 LYS A 89 -21.468 -0.991 2.031 1.00 72.33 H new ATOM 0 HE2 LYS A 89 -18.542 -1.597 2.659 1.00 21.50 H new ATOM 0 HE3 LYS A 89 -19.800 -2.776 2.345 1.00 21.50 H new ATOM 0 HZ1 LYS A 89 -18.507 -2.459 0.385 1.00 44.43 H new ATOM 0 HZ2 LYS A 89 -20.049 -1.806 0.108 1.00 44.43 H new ATOM 0 HZ3 LYS A 89 -18.736 -0.777 0.425 1.00 44.43 H new ATOM 1444 N ARG A 90 -16.455 0.579 4.578 1.00 50.13 N ATOM 1445 CA ARG A 90 -15.059 0.792 4.972 1.00 32.03 C ATOM 1446 C ARG A 90 -14.477 1.966 4.175 1.00 60.31 C ATOM 1447 O ARG A 90 -14.734 2.058 2.963 1.00 21.12 O ATOM 1448 CB ARG A 90 -14.193 -0.484 4.764 1.00 42.31 C ATOM 1449 CG ARG A 90 -12.677 -0.265 5.029 1.00 60.23 C ATOM 1450 CD ARG A 90 -11.895 -1.570 5.146 1.00 13.22 C ATOM 1451 NE ARG A 90 -12.340 -2.352 6.312 1.00 71.43 N ATOM 1452 CZ ARG A 90 -12.348 -3.686 6.386 1.00 61.34 C ATOM 1453 NH1 ARG A 90 -11.942 -4.424 5.357 1.00 40.24 N ATOM 1454 NH2 ARG A 90 -12.762 -4.275 7.497 1.00 3.21 N ATOM 0 H ARG A 90 -16.609 -0.255 4.011 1.00 50.13 H new ATOM 0 HA ARG A 90 -15.040 1.023 6.037 1.00 32.03 H new ATOM 0 HB2 ARG A 90 -14.558 -1.271 5.425 1.00 42.31 H new ATOM 0 HB3 ARG A 90 -14.326 -0.839 3.742 1.00 42.31 H new ATOM 0 HG2 ARG A 90 -12.256 0.333 4.221 1.00 60.23 H new ATOM 0 HG3 ARG A 90 -12.554 0.309 5.947 1.00 60.23 H new ATOM 0 HD2 ARG A 90 -12.026 -2.159 4.238 1.00 13.22 H new ATOM 0 HD3 ARG A 90 -10.830 -1.353 5.235 1.00 13.22 H new ATOM 0 HE ARG A 90 -12.668 -1.834 7.127 1.00 71.43 H new ATOM 0 HH11 ARG A 90 -11.620 -3.972 4.501 1.00 40.24 H new ATOM 0 HH12 ARG A 90 -11.952 -5.442 5.424 1.00 40.24 H new ATOM 0 HH21 ARG A 90 -13.072 -3.711 8.288 1.00 3.21 H new ATOM 0 HH22 ARG A 90 -12.771 -5.293 7.562 1.00 3.21 H new ATOM 1468 N PRO A 91 -13.732 2.909 4.844 1.00 62.32 N ATOM 1469 CA PRO A 91 -12.930 3.917 4.138 1.00 63.51 C ATOM 1470 C PRO A 91 -12.016 3.270 3.073 1.00 4.33 C ATOM 1471 O PRO A 91 -11.111 2.502 3.402 1.00 20.45 O ATOM 1472 CB PRO A 91 -12.119 4.595 5.279 1.00 22.11 C ATOM 1473 CG PRO A 91 -12.969 4.426 6.499 1.00 23.12 C ATOM 1474 CD PRO A 91 -13.651 3.086 6.330 1.00 40.01 C ATOM 0 HA PRO A 91 -13.535 4.630 3.578 1.00 63.51 H new ATOM 0 HB2 PRO A 91 -11.144 4.124 5.407 1.00 22.11 H new ATOM 0 HB3 PRO A 91 -11.938 5.648 5.065 1.00 22.11 H new ATOM 0 HG2 PRO A 91 -12.364 4.448 7.406 1.00 23.12 H new ATOM 0 HG3 PRO A 91 -13.699 5.231 6.584 1.00 23.12 H new ATOM 0 HD2 PRO A 91 -13.079 2.285 6.797 1.00 40.01 H new ATOM 0 HD3 PRO A 91 -14.640 3.080 6.788 1.00 40.01 H new ATOM 1482 N VAL A 92 -12.339 3.527 1.794 1.00 33.04 N ATOM 1483 CA VAL A 92 -11.570 3.010 0.640 1.00 21.11 C ATOM 1484 C VAL A 92 -10.166 3.651 0.608 1.00 1.21 C ATOM 1485 O VAL A 92 -9.194 3.051 0.144 1.00 31.12 O ATOM 1486 CB VAL A 92 -12.338 3.266 -0.716 1.00 35.55 C ATOM 1487 CG1 VAL A 92 -11.579 2.673 -1.932 1.00 22.41 C ATOM 1488 CG2 VAL A 92 -13.789 2.719 -0.637 1.00 71.14 C ATOM 0 H VAL A 92 -13.140 4.099 1.527 1.00 33.04 H new ATOM 0 HA VAL A 92 -11.458 1.932 0.756 1.00 21.11 H new ATOM 0 HB VAL A 92 -12.387 4.344 -0.867 1.00 35.55 H new ATOM 0 HG11 VAL A 92 -12.142 2.871 -2.844 1.00 22.41 H new ATOM 0 HG12 VAL A 92 -10.594 3.134 -2.006 1.00 22.41 H new ATOM 0 HG13 VAL A 92 -11.467 1.597 -1.802 1.00 22.41 H new ATOM 0 HG21 VAL A 92 -14.300 2.906 -1.581 1.00 71.14 H new ATOM 0 HG22 VAL A 92 -13.764 1.647 -0.444 1.00 71.14 H new ATOM 0 HG23 VAL A 92 -14.323 3.220 0.170 1.00 71.14 H new ATOM 1498 N PHE A 93 -10.090 4.885 1.121 1.00 23.31 N ATOM 1499 CA PHE A 93 -8.835 5.618 1.299 1.00 32.42 C ATOM 1500 C PHE A 93 -8.642 5.868 2.804 1.00 41.51 C ATOM 1501 O PHE A 93 -9.386 6.657 3.406 1.00 1.22 O ATOM 1502 CB PHE A 93 -8.878 6.952 0.505 1.00 3.34 C ATOM 1503 CG PHE A 93 -9.226 6.794 -0.984 1.00 12.33 C ATOM 1504 CD1 PHE A 93 -8.570 5.852 -1.782 1.00 53.33 C ATOM 1505 CD2 PHE A 93 -10.198 7.591 -1.589 1.00 21.11 C ATOM 1506 CE1 PHE A 93 -8.877 5.709 -3.125 1.00 41.20 C ATOM 1507 CE2 PHE A 93 -10.503 7.446 -2.933 1.00 64.51 C ATOM 1508 CZ PHE A 93 -9.842 6.509 -3.700 1.00 4.13 C ATOM 0 H PHE A 93 -10.911 5.408 1.428 1.00 23.31 H new ATOM 0 HA PHE A 93 -7.994 5.041 0.916 1.00 32.42 H new ATOM 0 HB2 PHE A 93 -9.610 7.613 0.969 1.00 3.34 H new ATOM 0 HB3 PHE A 93 -7.908 7.442 0.589 1.00 3.34 H new ATOM 0 HD1 PHE A 93 -7.809 5.224 -1.343 1.00 53.33 H new ATOM 0 HD2 PHE A 93 -10.720 8.332 -1.002 1.00 21.11 H new ATOM 0 HE1 PHE A 93 -8.361 4.971 -3.722 1.00 41.20 H new ATOM 0 HE2 PHE A 93 -11.262 8.070 -3.382 1.00 64.51 H new ATOM 0 HZ PHE A 93 -10.080 6.402 -4.748 1.00 4.13 H new ATOM 1518 N VAL A 94 -7.678 5.154 3.410 1.00 71.14 N ATOM 1519 CA VAL A 94 -7.386 5.240 4.860 1.00 5.53 C ATOM 1520 C VAL A 94 -6.025 5.930 5.060 1.00 24.42 C ATOM 1521 O VAL A 94 -5.134 5.780 4.223 1.00 72.52 O ATOM 1522 CB VAL A 94 -7.353 3.811 5.537 1.00 70.53 C ATOM 1523 CG1 VAL A 94 -7.162 3.914 7.059 1.00 55.11 C ATOM 1524 CG2 VAL A 94 -8.619 2.995 5.208 1.00 12.21 C ATOM 0 H VAL A 94 -7.076 4.499 2.912 1.00 71.14 H new ATOM 0 HA VAL A 94 -8.181 5.816 5.332 1.00 5.53 H new ATOM 0 HB VAL A 94 -6.495 3.284 5.120 1.00 70.53 H new ATOM 0 HG11 VAL A 94 -7.144 2.914 7.492 1.00 55.11 H new ATOM 0 HG12 VAL A 94 -6.221 4.420 7.274 1.00 55.11 H new ATOM 0 HG13 VAL A 94 -7.986 4.482 7.491 1.00 55.11 H new ATOM 0 HG21 VAL A 94 -8.559 2.020 5.691 1.00 12.21 H new ATOM 0 HG22 VAL A 94 -9.499 3.526 5.571 1.00 12.21 H new ATOM 0 HG23 VAL A 94 -8.696 2.861 4.129 1.00 12.21 H new ATOM 1534 N LYS A 95 -5.877 6.687 6.171 1.00 33.30 N ATOM 1535 CA LYS A 95 -4.631 7.396 6.511 1.00 34.53 C ATOM 1536 C LYS A 95 -4.408 7.466 8.031 1.00 4.13 C ATOM 1537 O LYS A 95 -5.244 7.018 8.824 1.00 12.41 O ATOM 1538 CB LYS A 95 -4.643 8.826 5.922 1.00 33.00 C ATOM 1539 CG LYS A 95 -5.712 9.779 6.511 1.00 63.41 C ATOM 1540 CD LYS A 95 -5.587 11.218 5.958 1.00 3.32 C ATOM 1541 CE LYS A 95 -4.256 11.885 6.341 1.00 31.10 C ATOM 1542 NZ LYS A 95 -4.056 13.191 5.661 1.00 53.04 N ATOM 0 H LYS A 95 -6.622 6.821 6.855 1.00 33.30 H new ATOM 0 HA LYS A 95 -3.809 6.829 6.074 1.00 34.53 H new ATOM 0 HB2 LYS A 95 -3.660 9.272 6.075 1.00 33.00 H new ATOM 0 HB3 LYS A 95 -4.797 8.756 4.845 1.00 33.00 H new ATOM 0 HG2 LYS A 95 -6.705 9.391 6.285 1.00 63.41 H new ATOM 0 HG3 LYS A 95 -5.617 9.800 7.597 1.00 63.41 H new ATOM 0 HD2 LYS A 95 -5.678 11.195 4.872 1.00 3.32 H new ATOM 0 HD3 LYS A 95 -6.413 11.821 6.335 1.00 3.32 H new ATOM 0 HE2 LYS A 95 -4.225 12.033 7.420 1.00 31.10 H new ATOM 0 HE3 LYS A 95 -3.433 11.217 6.087 1.00 31.10 H new ATOM 0 HZ1 LYS A 95 -3.130 13.583 5.927 1.00 53.04 H new ATOM 0 HZ2 LYS A 95 -4.092 13.055 4.631 1.00 53.04 H new ATOM 0 HZ3 LYS A 95 -4.806 13.851 5.949 1.00 53.04 H new ATOM 1556 N GLY A 96 -3.248 8.030 8.396 1.00 5.13 N ATOM 1557 CA GLY A 96 -2.849 8.250 9.779 1.00 20.04 C ATOM 1558 C GLY A 96 -1.414 7.811 9.967 1.00 1.15 C ATOM 1559 O GLY A 96 -0.583 8.028 9.080 1.00 24.34 O ATOM 0 H GLY A 96 -2.554 8.349 7.721 1.00 5.13 H new ATOM 0 HA2 GLY A 96 -2.954 9.304 10.036 1.00 20.04 H new ATOM 0 HA3 GLY A 96 -3.502 7.692 10.450 1.00 20.04 H new ATOM 1563 N SER A 97 -1.102 7.213 11.120 1.00 11.14 N ATOM 1564 CA SER A 97 0.163 6.476 11.304 1.00 72.13 C ATOM 1565 C SER A 97 0.005 5.066 10.694 1.00 33.32 C ATOM 1566 O SER A 97 -1.094 4.708 10.246 1.00 32.50 O ATOM 1567 CB SER A 97 0.520 6.417 12.806 1.00 1.15 C ATOM 1568 OG SER A 97 1.844 5.948 13.014 1.00 4.24 O ATOM 0 H SER A 97 -1.704 7.222 11.943 1.00 11.14 H new ATOM 0 HA SER A 97 0.982 6.984 10.795 1.00 72.13 H new ATOM 0 HB2 SER A 97 0.412 7.409 13.245 1.00 1.15 H new ATOM 0 HB3 SER A 97 -0.183 5.763 13.322 1.00 1.15 H new ATOM 0 HG SER A 97 2.036 5.925 13.975 1.00 4.24 H new ATOM 1574 N LEU A 98 1.092 4.276 10.673 1.00 31.42 N ATOM 1575 CA LEU A 98 1.085 2.906 10.111 1.00 30.43 C ATOM 1576 C LEU A 98 0.031 2.011 10.812 1.00 41.10 C ATOM 1577 O LEU A 98 -0.819 1.388 10.156 1.00 52.31 O ATOM 1578 CB LEU A 98 2.500 2.274 10.234 1.00 1.13 C ATOM 1579 CG LEU A 98 2.653 0.816 9.687 1.00 2.02 C ATOM 1580 CD1 LEU A 98 2.341 0.736 8.171 1.00 41.23 C ATOM 1581 CD2 LEU A 98 4.050 0.240 10.015 1.00 55.54 C ATOM 0 H LEU A 98 1.998 4.563 11.042 1.00 31.42 H new ATOM 0 HA LEU A 98 0.813 2.974 9.058 1.00 30.43 H new ATOM 0 HB2 LEU A 98 3.208 2.914 9.708 1.00 1.13 H new ATOM 0 HB3 LEU A 98 2.787 2.278 11.285 1.00 1.13 H new ATOM 0 HG LEU A 98 1.915 0.196 10.196 1.00 2.02 H new ATOM 0 HD11 LEU A 98 2.458 -0.292 7.829 1.00 41.23 H new ATOM 0 HD12 LEU A 98 1.317 1.063 7.993 1.00 41.23 H new ATOM 0 HD13 LEU A 98 3.028 1.381 7.624 1.00 41.23 H new ATOM 0 HD21 LEU A 98 4.127 -0.774 9.623 1.00 55.54 H new ATOM 0 HD22 LEU A 98 4.818 0.865 9.558 1.00 55.54 H new ATOM 0 HD23 LEU A 98 4.192 0.222 11.096 1.00 55.54 H new ATOM 1593 N GLU A 99 0.092 2.007 12.153 1.00 2.01 N ATOM 1594 CA GLU A 99 -0.809 1.217 13.016 1.00 10.32 C ATOM 1595 C GLU A 99 -2.234 1.794 13.025 1.00 1.13 C ATOM 1596 O GLU A 99 -3.197 1.045 13.055 1.00 63.30 O ATOM 1597 CB GLU A 99 -0.241 1.146 14.454 1.00 41.30 C ATOM 1598 CG GLU A 99 1.121 0.432 14.543 1.00 32.34 C ATOM 1599 CD GLU A 99 1.669 0.320 15.972 1.00 13.35 C ATOM 1600 OE1 GLU A 99 0.932 -0.167 16.850 1.00 42.12 O ATOM 1601 OE2 GLU A 99 2.825 0.736 16.227 1.00 4.20 O ATOM 0 H GLU A 99 0.774 2.556 12.676 1.00 2.01 H new ATOM 0 HA GLU A 99 -0.868 0.208 12.607 1.00 10.32 H new ATOM 0 HB2 GLU A 99 -0.138 2.158 14.846 1.00 41.30 H new ATOM 0 HB3 GLU A 99 -0.956 0.628 15.093 1.00 41.30 H new ATOM 0 HG2 GLU A 99 1.025 -0.568 14.121 1.00 32.34 H new ATOM 0 HG3 GLU A 99 1.843 0.969 13.928 1.00 32.34 H new ATOM 1608 N SER A 100 -2.341 3.133 12.956 1.00 4.33 N ATOM 1609 CA SER A 100 -3.639 3.850 12.944 1.00 41.22 C ATOM 1610 C SER A 100 -4.467 3.478 11.700 1.00 23.41 C ATOM 1611 O SER A 100 -5.652 3.098 11.797 1.00 4.21 O ATOM 1612 CB SER A 100 -3.385 5.377 12.976 1.00 15.23 C ATOM 1613 OG SER A 100 -2.621 5.737 14.108 1.00 3.52 O ATOM 0 H SER A 100 -1.533 3.753 12.907 1.00 4.33 H new ATOM 0 HA SER A 100 -4.207 3.554 13.826 1.00 41.22 H new ATOM 0 HB2 SER A 100 -2.864 5.682 12.069 1.00 15.23 H new ATOM 0 HB3 SER A 100 -4.337 5.908 12.991 1.00 15.23 H new ATOM 0 HG SER A 100 -2.471 6.705 14.107 1.00 3.52 H new ATOM 1619 N ALA A 101 -3.801 3.565 10.535 1.00 44.43 N ATOM 1620 CA ALA A 101 -4.378 3.227 9.227 1.00 21.41 C ATOM 1621 C ALA A 101 -4.724 1.728 9.143 1.00 35.22 C ATOM 1622 O ALA A 101 -5.639 1.335 8.419 1.00 54.22 O ATOM 1623 CB ALA A 101 -3.401 3.637 8.104 1.00 15.11 C ATOM 0 H ALA A 101 -2.832 3.877 10.478 1.00 44.43 H new ATOM 0 HA ALA A 101 -5.308 3.781 9.101 1.00 21.41 H new ATOM 0 HB1 ALA A 101 -3.833 3.384 7.136 1.00 15.11 H new ATOM 0 HB2 ALA A 101 -3.221 4.711 8.152 1.00 15.11 H new ATOM 0 HB3 ALA A 101 -2.458 3.105 8.230 1.00 15.11 H new ATOM 1629 N ALA A 102 -3.989 0.910 9.914 1.00 22.22 N ATOM 1630 CA ALA A 102 -4.215 -0.540 10.014 1.00 1.30 C ATOM 1631 C ALA A 102 -5.555 -0.847 10.703 1.00 44.41 C ATOM 1632 O ALA A 102 -6.377 -1.610 10.181 1.00 72.31 O ATOM 1633 CB ALA A 102 -3.064 -1.176 10.792 1.00 23.15 C ATOM 0 H ALA A 102 -3.215 1.240 10.490 1.00 22.22 H new ATOM 0 HA ALA A 102 -4.255 -0.958 9.008 1.00 1.30 H new ATOM 0 HB1 ALA A 102 -3.227 -2.251 10.869 1.00 23.15 H new ATOM 0 HB2 ALA A 102 -2.125 -0.988 10.271 1.00 23.15 H new ATOM 0 HB3 ALA A 102 -3.018 -0.744 11.792 1.00 23.15 H new ATOM 1639 N GLU A 103 -5.759 -0.209 11.875 1.00 62.04 N ATOM 1640 CA GLU A 103 -6.960 -0.396 12.715 1.00 73.12 C ATOM 1641 C GLU A 103 -8.234 0.043 11.960 1.00 21.24 C ATOM 1642 O GLU A 103 -9.264 -0.639 12.003 1.00 42.03 O ATOM 1643 CB GLU A 103 -6.822 0.403 14.042 1.00 5.34 C ATOM 1644 CG GLU A 103 -5.555 0.084 14.850 1.00 11.25 C ATOM 1645 CD GLU A 103 -5.448 0.887 16.152 1.00 24.54 C ATOM 1646 OE1 GLU A 103 -5.198 2.113 16.082 1.00 40.34 O ATOM 1647 OE2 GLU A 103 -5.623 0.307 17.249 1.00 14.23 O ATOM 0 H GLU A 103 -5.091 0.454 12.267 1.00 62.04 H new ATOM 0 HA GLU A 103 -7.048 -1.457 12.949 1.00 73.12 H new ATOM 0 HB2 GLU A 103 -6.832 1.468 13.812 1.00 5.34 H new ATOM 0 HB3 GLU A 103 -7.694 0.203 14.664 1.00 5.34 H new ATOM 0 HG2 GLU A 103 -5.541 -0.980 15.085 1.00 11.25 H new ATOM 0 HG3 GLU A 103 -4.679 0.286 14.234 1.00 11.25 H new ATOM 1654 N GLN A 104 -8.127 1.182 11.251 1.00 53.53 N ATOM 1655 CA GLN A 104 -9.245 1.772 10.478 1.00 14.44 C ATOM 1656 C GLN A 104 -9.580 0.933 9.222 1.00 13.23 C ATOM 1657 O GLN A 104 -10.749 0.831 8.833 1.00 54.51 O ATOM 1658 CB GLN A 104 -8.904 3.224 10.078 1.00 52.15 C ATOM 1659 CG GLN A 104 -8.683 4.177 11.259 1.00 23.14 C ATOM 1660 CD GLN A 104 -8.260 5.575 10.805 1.00 33.10 C ATOM 1661 OE1 GLN A 104 -9.096 6.454 10.588 1.00 31.14 O ATOM 1662 NE2 GLN A 104 -6.962 5.786 10.646 1.00 4.14 N ATOM 0 H GLN A 104 -7.264 1.723 11.195 1.00 53.53 H new ATOM 0 HA GLN A 104 -10.128 1.772 11.117 1.00 14.44 H new ATOM 0 HB2 GLN A 104 -8.005 3.215 9.462 1.00 52.15 H new ATOM 0 HB3 GLN A 104 -9.711 3.615 9.459 1.00 52.15 H new ATOM 0 HG2 GLN A 104 -9.601 4.249 11.842 1.00 23.14 H new ATOM 0 HG3 GLN A 104 -7.919 3.765 11.918 1.00 23.14 H new ATOM 0 HE21 GLN A 104 -6.297 5.036 10.835 1.00 4.14 H new ATOM 0 HE22 GLN A 104 -6.628 6.698 10.335 1.00 4.14 H new ATOM 1671 N ALA A 105 -8.545 0.338 8.597 1.00 11.13 N ATOM 1672 CA ALA A 105 -8.719 -0.575 7.441 1.00 62.54 C ATOM 1673 C ALA A 105 -9.057 -2.013 7.905 1.00 34.33 C ATOM 1674 O ALA A 105 -9.345 -2.884 7.077 1.00 32.55 O ATOM 1675 CB ALA A 105 -7.459 -0.557 6.558 1.00 52.21 C ATOM 0 H ALA A 105 -7.572 0.472 8.873 1.00 11.13 H new ATOM 0 HA ALA A 105 -9.562 -0.221 6.848 1.00 62.54 H new ATOM 0 HB1 ALA A 105 -7.598 -1.231 5.712 1.00 52.21 H new ATOM 0 HB2 ALA A 105 -7.286 0.455 6.191 1.00 52.21 H new ATOM 0 HB3 ALA A 105 -6.599 -0.882 7.144 1.00 52.21 H new ATOM 1681 N GLY A 106 -8.976 -2.249 9.235 1.00 23.11 N ATOM 1682 CA GLY A 106 -9.418 -3.511 9.853 1.00 70.13 C ATOM 1683 C GLY A 106 -8.454 -4.675 9.631 1.00 73.10 C ATOM 1684 O GLY A 106 -8.841 -5.841 9.756 1.00 44.45 O ATOM 0 H GLY A 106 -8.605 -1.572 9.902 1.00 23.11 H new ATOM 0 HA2 GLY A 106 -9.545 -3.355 10.924 1.00 70.13 H new ATOM 0 HA3 GLY A 106 -10.395 -3.779 9.452 1.00 70.13 H new ATOM 1688 N ILE A 107 -7.193 -4.345 9.322 1.00 22.51 N ATOM 1689 CA ILE A 107 -6.130 -5.319 8.985 1.00 11.34 C ATOM 1690 C ILE A 107 -5.347 -5.695 10.261 1.00 21.32 C ATOM 1691 O ILE A 107 -5.316 -4.895 11.209 1.00 62.42 O ATOM 1692 CB ILE A 107 -5.129 -4.683 7.945 1.00 22.21 C ATOM 1693 CG1 ILE A 107 -5.875 -3.980 6.780 1.00 23.34 C ATOM 1694 CG2 ILE A 107 -4.151 -5.731 7.374 1.00 44.44 C ATOM 1695 CD1 ILE A 107 -4.955 -3.246 5.830 1.00 15.33 C ATOM 0 H ILE A 107 -6.871 -3.378 9.297 1.00 22.51 H new ATOM 0 HA ILE A 107 -6.591 -6.208 8.555 1.00 11.34 H new ATOM 0 HB ILE A 107 -4.557 -3.935 8.494 1.00 22.21 H new ATOM 0 HG12 ILE A 107 -6.443 -4.724 6.221 1.00 23.34 H new ATOM 0 HG13 ILE A 107 -6.595 -3.274 7.194 1.00 23.34 H new ATOM 0 HG21 ILE A 107 -3.479 -5.252 6.662 1.00 44.44 H new ATOM 0 HG22 ILE A 107 -3.569 -6.166 8.186 1.00 44.44 H new ATOM 0 HG23 ILE A 107 -4.713 -6.517 6.870 1.00 44.44 H new ATOM 0 HD11 ILE A 107 -5.544 -2.779 5.041 1.00 15.33 H new ATOM 0 HD12 ILE A 107 -4.406 -2.479 6.376 1.00 15.33 H new ATOM 0 HD13 ILE A 107 -4.251 -3.951 5.388 1.00 15.33 H new ATOM 1707 N VAL A 108 -4.695 -6.887 10.282 1.00 33.21 N ATOM 1708 CA VAL A 108 -3.836 -7.284 11.408 1.00 22.23 C ATOM 1709 C VAL A 108 -2.621 -6.339 11.460 1.00 25.35 C ATOM 1710 O VAL A 108 -1.713 -6.398 10.595 1.00 63.41 O ATOM 1711 CB VAL A 108 -3.351 -8.775 11.327 1.00 54.21 C ATOM 1712 CG1 VAL A 108 -2.497 -9.155 12.561 1.00 4.20 C ATOM 1713 CG2 VAL A 108 -4.537 -9.741 11.129 1.00 44.35 C ATOM 0 H VAL A 108 -4.753 -7.578 9.534 1.00 33.21 H new ATOM 0 HA VAL A 108 -4.432 -7.207 12.317 1.00 22.23 H new ATOM 0 HB VAL A 108 -2.710 -8.870 10.450 1.00 54.21 H new ATOM 0 HG11 VAL A 108 -2.176 -10.193 12.476 1.00 4.20 H new ATOM 0 HG12 VAL A 108 -1.622 -8.508 12.611 1.00 4.20 H new ATOM 0 HG13 VAL A 108 -3.091 -9.032 13.466 1.00 4.20 H new ATOM 0 HG21 VAL A 108 -4.167 -10.765 11.077 1.00 44.35 H new ATOM 0 HG22 VAL A 108 -5.227 -9.647 11.967 1.00 44.35 H new ATOM 0 HG23 VAL A 108 -5.056 -9.495 10.203 1.00 44.35 H new ATOM 1723 N VAL A 109 -2.669 -5.455 12.466 1.00 44.02 N ATOM 1724 CA VAL A 109 -1.658 -4.427 12.734 1.00 3.32 C ATOM 1725 C VAL A 109 -0.247 -5.037 12.783 1.00 1.41 C ATOM 1726 O VAL A 109 0.630 -4.614 12.034 1.00 21.43 O ATOM 1727 CB VAL A 109 -1.984 -3.663 14.081 1.00 51.52 C ATOM 1728 CG1 VAL A 109 -0.872 -2.660 14.472 1.00 54.22 C ATOM 1729 CG2 VAL A 109 -3.364 -2.957 13.988 1.00 64.23 C ATOM 0 H VAL A 109 -3.438 -5.436 13.136 1.00 44.02 H new ATOM 0 HA VAL A 109 -1.684 -3.708 11.915 1.00 3.32 H new ATOM 0 HB VAL A 109 -2.027 -4.410 14.874 1.00 51.52 H new ATOM 0 HG11 VAL A 109 -1.143 -2.161 15.403 1.00 54.22 H new ATOM 0 HG12 VAL A 109 0.069 -3.194 14.607 1.00 54.22 H new ATOM 0 HG13 VAL A 109 -0.758 -1.917 13.682 1.00 54.22 H new ATOM 0 HG21 VAL A 109 -3.571 -2.437 14.924 1.00 64.23 H new ATOM 0 HG22 VAL A 109 -3.350 -2.238 13.169 1.00 64.23 H new ATOM 0 HG23 VAL A 109 -4.141 -3.699 13.806 1.00 64.23 H new ATOM 1739 N ASP A 110 -0.088 -6.087 13.618 1.00 1.44 N ATOM 1740 CA ASP A 110 1.209 -6.768 13.835 1.00 70.14 C ATOM 1741 C ASP A 110 1.825 -7.227 12.507 1.00 50.00 C ATOM 1742 O ASP A 110 2.982 -6.919 12.231 1.00 4.43 O ATOM 1743 CB ASP A 110 1.063 -7.972 14.808 1.00 43.40 C ATOM 1744 CG ASP A 110 2.405 -8.693 15.058 1.00 20.23 C ATOM 1745 OD1 ASP A 110 3.223 -8.191 15.865 1.00 41.31 O ATOM 1746 OD2 ASP A 110 2.660 -9.747 14.429 1.00 51.54 O ATOM 0 H ASP A 110 -0.854 -6.487 14.160 1.00 1.44 H new ATOM 0 HA ASP A 110 1.881 -6.042 14.292 1.00 70.14 H new ATOM 0 HB2 ASP A 110 0.660 -7.621 15.758 1.00 43.40 H new ATOM 0 HB3 ASP A 110 0.343 -8.681 14.399 1.00 43.40 H new ATOM 1751 N GLU A 111 1.008 -7.907 11.672 1.00 73.24 N ATOM 1752 CA GLU A 111 1.450 -8.439 10.370 1.00 75.33 C ATOM 1753 C GLU A 111 2.042 -7.338 9.472 1.00 61.33 C ATOM 1754 O GLU A 111 3.183 -7.469 9.022 1.00 30.33 O ATOM 1755 CB GLU A 111 0.288 -9.155 9.637 1.00 74.12 C ATOM 1756 CG GLU A 111 -0.120 -10.519 10.221 1.00 1.14 C ATOM 1757 CD GLU A 111 0.908 -11.630 9.948 1.00 53.43 C ATOM 1758 OE1 GLU A 111 1.842 -11.816 10.759 1.00 55.01 O ATOM 1759 OE2 GLU A 111 0.779 -12.322 8.917 1.00 61.21 O ATOM 0 H GLU A 111 0.029 -8.100 11.883 1.00 73.24 H new ATOM 0 HA GLU A 111 2.237 -9.165 10.575 1.00 75.33 H new ATOM 0 HB2 GLU A 111 -0.583 -8.500 9.646 1.00 74.12 H new ATOM 0 HB3 GLU A 111 0.571 -9.295 8.594 1.00 74.12 H new ATOM 0 HG2 GLU A 111 -0.259 -10.419 11.297 1.00 1.14 H new ATOM 0 HG3 GLU A 111 -1.082 -10.813 9.802 1.00 1.14 H new ATOM 1766 N LEU A 112 1.281 -6.243 9.239 1.00 63.42 N ATOM 1767 CA LEU A 112 1.737 -5.151 8.335 1.00 23.41 C ATOM 1768 C LEU A 112 2.869 -4.301 8.941 1.00 42.24 C ATOM 1769 O LEU A 112 3.641 -3.683 8.206 1.00 10.12 O ATOM 1770 CB LEU A 112 0.552 -4.272 7.849 1.00 71.20 C ATOM 1771 CG LEU A 112 -0.354 -3.591 8.938 1.00 73.22 C ATOM 1772 CD1 LEU A 112 0.276 -2.318 9.568 1.00 61.02 C ATOM 1773 CD2 LEU A 112 -1.746 -3.280 8.363 1.00 43.41 C ATOM 0 H LEU A 112 0.362 -6.089 9.655 1.00 63.42 H new ATOM 0 HA LEU A 112 2.162 -5.641 7.459 1.00 23.41 H new ATOM 0 HB2 LEU A 112 0.958 -3.486 7.213 1.00 71.20 H new ATOM 0 HB3 LEU A 112 -0.088 -4.892 7.221 1.00 71.20 H new ATOM 0 HG LEU A 112 -0.448 -4.313 9.749 1.00 73.22 H new ATOM 0 HD11 LEU A 112 -0.406 -1.903 10.310 1.00 61.02 H new ATOM 0 HD12 LEU A 112 1.219 -2.578 10.048 1.00 61.02 H new ATOM 0 HD13 LEU A 112 0.458 -1.578 8.789 1.00 61.02 H new ATOM 0 HD21 LEU A 112 -2.360 -2.809 9.131 1.00 43.41 H new ATOM 0 HD22 LEU A 112 -1.646 -2.605 7.513 1.00 43.41 H new ATOM 0 HD23 LEU A 112 -2.220 -4.206 8.037 1.00 43.41 H new ATOM 1785 N VAL A 113 2.949 -4.277 10.277 1.00 32.43 N ATOM 1786 CA VAL A 113 4.026 -3.578 11.009 1.00 34.22 C ATOM 1787 C VAL A 113 5.342 -4.323 10.778 1.00 43.14 C ATOM 1788 O VAL A 113 6.361 -3.699 10.504 1.00 3.30 O ATOM 1789 CB VAL A 113 3.720 -3.424 12.557 1.00 22.23 C ATOM 1790 CG1 VAL A 113 4.976 -3.016 13.373 1.00 12.32 C ATOM 1791 CG2 VAL A 113 2.592 -2.390 12.776 1.00 73.42 C ATOM 0 H VAL A 113 2.273 -4.739 10.885 1.00 32.43 H new ATOM 0 HA VAL A 113 4.098 -2.562 10.620 1.00 34.22 H new ATOM 0 HB VAL A 113 3.401 -4.401 12.919 1.00 22.23 H new ATOM 0 HG11 VAL A 113 4.711 -2.924 14.426 1.00 12.32 H new ATOM 0 HG12 VAL A 113 5.748 -3.777 13.258 1.00 12.32 H new ATOM 0 HG13 VAL A 113 5.352 -2.060 13.009 1.00 12.32 H new ATOM 0 HG21 VAL A 113 2.390 -2.292 13.843 1.00 73.42 H new ATOM 0 HG22 VAL A 113 2.901 -1.425 12.375 1.00 73.42 H new ATOM 0 HG23 VAL A 113 1.689 -2.723 12.265 1.00 73.42 H new ATOM 1801 N GLN A 114 5.276 -5.669 10.828 1.00 45.05 N ATOM 1802 CA GLN A 114 6.443 -6.536 10.556 1.00 55.34 C ATOM 1803 C GLN A 114 6.831 -6.403 9.087 1.00 44.22 C ATOM 1804 O GLN A 114 7.997 -6.285 8.747 1.00 71.31 O ATOM 1805 CB GLN A 114 6.144 -8.027 10.881 1.00 14.54 C ATOM 1806 CG GLN A 114 5.769 -8.320 12.350 1.00 72.41 C ATOM 1807 CD GLN A 114 6.804 -7.844 13.375 1.00 34.20 C ATOM 1808 OE1 GLN A 114 7.737 -8.569 13.721 1.00 23.11 O ATOM 1809 NE2 GLN A 114 6.647 -6.621 13.861 1.00 60.44 N ATOM 0 H GLN A 114 4.424 -6.182 11.055 1.00 45.05 H new ATOM 0 HA GLN A 114 7.262 -6.214 11.199 1.00 55.34 H new ATOM 0 HB2 GLN A 114 5.329 -8.365 10.241 1.00 14.54 H new ATOM 0 HB3 GLN A 114 7.020 -8.621 10.622 1.00 14.54 H new ATOM 0 HG2 GLN A 114 4.813 -7.845 12.570 1.00 72.41 H new ATOM 0 HG3 GLN A 114 5.626 -9.394 12.468 1.00 72.41 H new ATOM 0 HE21 GLN A 114 5.863 -6.047 13.553 1.00 60.44 H new ATOM 0 HE22 GLN A 114 7.311 -6.254 14.543 1.00 60.44 H new ATOM 1818 N THR A 115 5.801 -6.376 8.242 1.00 43.25 N ATOM 1819 CA THR A 115 5.931 -6.254 6.795 1.00 73.12 C ATOM 1820 C THR A 115 6.711 -4.983 6.397 1.00 44.20 C ATOM 1821 O THR A 115 7.648 -5.053 5.603 1.00 44.14 O ATOM 1822 CB THR A 115 4.504 -6.247 6.159 1.00 60.34 C ATOM 1823 OG1 THR A 115 3.859 -7.497 6.409 1.00 53.20 O ATOM 1824 CG2 THR A 115 4.502 -5.975 4.662 1.00 44.14 C ATOM 0 H THR A 115 4.832 -6.440 8.554 1.00 43.25 H new ATOM 0 HA THR A 115 6.500 -7.105 6.420 1.00 73.12 H new ATOM 0 HB THR A 115 3.964 -5.426 6.630 1.00 60.34 H new ATOM 0 HG1 THR A 115 3.605 -7.551 7.354 1.00 53.20 H new ATOM 0 HG21 THR A 115 3.477 -5.986 4.292 1.00 44.14 H new ATOM 0 HG22 THR A 115 4.947 -4.999 4.469 1.00 44.14 H new ATOM 0 HG23 THR A 115 5.080 -6.745 4.151 1.00 44.14 H new ATOM 1832 N VAL A 116 6.333 -3.843 7.002 1.00 72.45 N ATOM 1833 CA VAL A 116 6.900 -2.520 6.678 1.00 71.24 C ATOM 1834 C VAL A 116 8.242 -2.281 7.407 1.00 23.21 C ATOM 1835 O VAL A 116 9.153 -1.705 6.820 1.00 2.34 O ATOM 1836 CB VAL A 116 5.865 -1.362 6.986 1.00 24.34 C ATOM 1837 CG1 VAL A 116 6.490 0.054 6.845 1.00 63.44 C ATOM 1838 CG2 VAL A 116 4.611 -1.500 6.079 1.00 32.05 C ATOM 0 H VAL A 116 5.622 -3.812 7.733 1.00 72.45 H new ATOM 0 HA VAL A 116 7.105 -2.507 5.608 1.00 71.24 H new ATOM 0 HB VAL A 116 5.567 -1.471 8.029 1.00 24.34 H new ATOM 0 HG11 VAL A 116 5.736 0.809 7.068 1.00 63.44 H new ATOM 0 HG12 VAL A 116 7.322 0.156 7.542 1.00 63.44 H new ATOM 0 HG13 VAL A 116 6.852 0.192 5.826 1.00 63.44 H new ATOM 0 HG21 VAL A 116 3.910 -0.696 6.303 1.00 32.05 H new ATOM 0 HG22 VAL A 116 4.910 -1.439 5.033 1.00 32.05 H new ATOM 0 HG23 VAL A 116 4.132 -2.462 6.264 1.00 32.05 H new ATOM 1848 N LYS A 117 8.390 -2.743 8.664 1.00 10.53 N ATOM 1849 CA LYS A 117 9.639 -2.502 9.440 1.00 53.32 C ATOM 1850 C LYS A 117 10.786 -3.398 8.932 1.00 10.23 C ATOM 1851 O LYS A 117 11.957 -2.998 8.961 1.00 51.44 O ATOM 1852 CB LYS A 117 9.429 -2.700 10.971 1.00 11.10 C ATOM 1853 CG LYS A 117 9.314 -4.170 11.460 1.00 32.05 C ATOM 1854 CD LYS A 117 8.943 -4.289 12.960 1.00 4.25 C ATOM 1855 CE LYS A 117 9.961 -3.610 13.888 1.00 62.41 C ATOM 1856 NZ LYS A 117 9.545 -3.688 15.319 1.00 12.42 N ATOM 0 H LYS A 117 7.679 -3.277 9.163 1.00 10.53 H new ATOM 0 HA LYS A 117 9.913 -1.459 9.281 1.00 53.32 H new ATOM 0 HB2 LYS A 117 10.260 -2.228 11.495 1.00 11.10 H new ATOM 0 HB3 LYS A 117 8.524 -2.169 11.265 1.00 11.10 H new ATOM 0 HG2 LYS A 117 8.561 -4.686 10.864 1.00 32.05 H new ATOM 0 HG3 LYS A 117 10.262 -4.679 11.286 1.00 32.05 H new ATOM 0 HD2 LYS A 117 7.961 -3.845 13.121 1.00 4.25 H new ATOM 0 HD3 LYS A 117 8.864 -5.343 13.226 1.00 4.25 H new ATOM 0 HE2 LYS A 117 10.935 -4.083 13.767 1.00 62.41 H new ATOM 0 HE3 LYS A 117 10.076 -2.565 13.599 1.00 62.41 H new ATOM 0 HZ1 LYS A 117 10.258 -3.219 15.914 1.00 12.42 H new ATOM 0 HZ2 LYS A 117 8.627 -3.215 15.440 1.00 12.42 H new ATOM 0 HZ3 LYS A 117 9.460 -4.685 15.602 1.00 12.42 H new ATOM 1870 N ASN A 118 10.427 -4.614 8.466 1.00 2.15 N ATOM 1871 CA ASN A 118 11.387 -5.572 7.872 1.00 75.21 C ATOM 1872 C ASN A 118 11.623 -5.216 6.406 1.00 31.21 C ATOM 1873 O ASN A 118 12.703 -5.504 5.886 1.00 63.10 O ATOM 1874 CB ASN A 118 10.909 -7.046 8.016 1.00 13.43 C ATOM 1875 CG ASN A 118 10.704 -7.470 9.481 1.00 24.01 C ATOM 1876 OD1 ASN A 118 11.375 -6.979 10.390 1.00 5.43 O ATOM 1877 ND2 ASN A 118 9.762 -8.375 9.721 1.00 75.32 N ATOM 0 H ASN A 118 9.467 -4.959 8.490 1.00 2.15 H new ATOM 0 HA ASN A 118 12.327 -5.493 8.419 1.00 75.21 H new ATOM 0 HB2 ASN A 118 9.973 -7.174 7.472 1.00 13.43 H new ATOM 0 HB3 ASN A 118 11.641 -7.707 7.551 1.00 13.43 H new ATOM 0 HD21 ASN A 118 9.579 -8.680 10.677 1.00 75.32 H new ATOM 0 HD22 ASN A 118 9.221 -8.765 8.949 1.00 75.32 H new ATOM 1884 N TYR A 119 10.607 -4.576 5.753 1.00 35.33 N ATOM 1885 CA TYR A 119 10.778 -3.938 4.424 1.00 2.35 C ATOM 1886 C TYR A 119 11.930 -2.942 4.522 1.00 54.04 C ATOM 1887 O TYR A 119 13.003 -3.156 3.956 1.00 41.43 O ATOM 1888 CB TYR A 119 9.474 -3.224 3.937 1.00 75.01 C ATOM 1889 CG TYR A 119 9.583 -2.478 2.591 1.00 75.01 C ATOM 1890 CD1 TYR A 119 9.421 -3.153 1.382 1.00 1.41 C ATOM 1891 CD2 TYR A 119 9.848 -1.101 2.530 1.00 34.51 C ATOM 1892 CE1 TYR A 119 9.520 -2.493 0.168 1.00 33.11 C ATOM 1893 CE2 TYR A 119 9.944 -0.438 1.319 1.00 50.24 C ATOM 1894 CZ TYR A 119 9.783 -1.137 0.140 1.00 24.42 C ATOM 1895 OH TYR A 119 9.887 -0.481 -1.071 1.00 61.25 O ATOM 0 H TYR A 119 9.664 -4.492 6.131 1.00 35.33 H new ATOM 0 HA TYR A 119 10.998 -4.710 3.687 1.00 2.35 H new ATOM 0 HB2 TYR A 119 8.683 -3.969 3.856 1.00 75.01 H new ATOM 0 HB3 TYR A 119 9.164 -2.512 4.702 1.00 75.01 H new ATOM 0 HD1 TYR A 119 9.214 -4.213 1.392 1.00 1.41 H new ATOM 0 HD2 TYR A 119 9.980 -0.547 3.448 1.00 34.51 H new ATOM 0 HE1 TYR A 119 9.392 -3.038 -0.756 1.00 33.11 H new ATOM 0 HE2 TYR A 119 10.144 0.623 1.297 1.00 50.24 H new ATOM 0 HH TYR A 119 10.073 0.468 -0.914 1.00 61.25 H new ATOM 1905 N GLN A 120 11.705 -1.924 5.370 1.00 53.25 N ATOM 1906 CA GLN A 120 12.659 -0.844 5.649 1.00 73.10 C ATOM 1907 C GLN A 120 13.989 -1.386 6.202 1.00 25.54 C ATOM 1908 O GLN A 120 15.045 -0.796 5.952 1.00 24.11 O ATOM 1909 CB GLN A 120 12.025 0.157 6.647 1.00 40.45 C ATOM 1910 CG GLN A 120 10.778 0.889 6.100 1.00 2.34 C ATOM 1911 CD GLN A 120 10.197 1.926 7.066 1.00 14.15 C ATOM 1912 OE1 GLN A 120 10.265 1.753 8.282 1.00 4.33 O ATOM 1913 NE2 GLN A 120 9.651 3.017 6.530 1.00 64.14 N ATOM 0 H GLN A 120 10.833 -1.830 5.891 1.00 53.25 H new ATOM 0 HA GLN A 120 12.884 -0.335 4.712 1.00 73.10 H new ATOM 0 HB2 GLN A 120 11.750 -0.378 7.556 1.00 40.45 H new ATOM 0 HB3 GLN A 120 12.774 0.898 6.927 1.00 40.45 H new ATOM 0 HG2 GLN A 120 11.040 1.384 5.165 1.00 2.34 H new ATOM 0 HG3 GLN A 120 10.009 0.153 5.867 1.00 2.34 H new ATOM 0 HE21 GLN A 120 9.614 3.123 5.516 1.00 64.14 H new ATOM 0 HE22 GLN A 120 9.270 3.746 7.133 1.00 64.14 H new ATOM 1922 N GLY A 121 13.901 -2.529 6.920 1.00 1.43 N ATOM 1923 CA GLY A 121 15.061 -3.235 7.458 1.00 43.24 C ATOM 1924 C GLY A 121 15.999 -3.724 6.364 1.00 42.11 C ATOM 1925 O GLY A 121 17.195 -3.429 6.397 1.00 0.34 O ATOM 0 H GLY A 121 13.013 -2.981 7.137 1.00 1.43 H new ATOM 0 HA2 GLY A 121 15.606 -2.573 8.131 1.00 43.24 H new ATOM 0 HA3 GLY A 121 14.723 -4.085 8.051 1.00 43.24 H new ATOM 1929 N TYR A 122 15.446 -4.426 5.347 1.00 71.22 N ATOM 1930 CA TYR A 122 16.260 -4.973 4.245 1.00 74.24 C ATOM 1931 C TYR A 122 16.632 -3.892 3.200 1.00 14.51 C ATOM 1932 O TYR A 122 17.592 -4.069 2.427 1.00 34.24 O ATOM 1933 CB TYR A 122 15.613 -6.236 3.594 1.00 33.31 C ATOM 1934 CG TYR A 122 14.334 -6.065 2.743 1.00 72.02 C ATOM 1935 CD1 TYR A 122 14.363 -5.415 1.514 1.00 54.43 C ATOM 1936 CD2 TYR A 122 13.102 -6.592 3.146 1.00 21.45 C ATOM 1937 CE1 TYR A 122 13.235 -5.282 0.747 1.00 21.20 C ATOM 1938 CE2 TYR A 122 11.969 -6.454 2.364 1.00 73.23 C ATOM 1939 CZ TYR A 122 12.049 -5.796 1.171 1.00 22.41 C ATOM 1940 OH TYR A 122 10.933 -5.631 0.398 1.00 74.13 O ATOM 0 H TYR A 122 14.448 -4.624 5.270 1.00 71.22 H new ATOM 0 HA TYR A 122 17.197 -5.308 4.690 1.00 74.24 H new ATOM 0 HB2 TYR A 122 16.368 -6.705 2.963 1.00 33.31 H new ATOM 0 HB3 TYR A 122 15.385 -6.939 4.395 1.00 33.31 H new ATOM 0 HD1 TYR A 122 15.296 -5.006 1.156 1.00 54.43 H new ATOM 0 HD2 TYR A 122 13.034 -7.117 4.087 1.00 21.45 H new ATOM 0 HE1 TYR A 122 13.288 -4.766 -0.200 1.00 21.20 H new ATOM 0 HE2 TYR A 122 11.027 -6.865 2.696 1.00 73.23 H new ATOM 0 HH TYR A 122 10.630 -4.701 0.456 1.00 74.13 H new ATOM 1950 N VAL A 123 15.865 -2.781 3.182 1.00 34.02 N ATOM 1951 CA VAL A 123 16.148 -1.619 2.314 1.00 1.31 C ATOM 1952 C VAL A 123 17.473 -0.950 2.744 1.00 33.40 C ATOM 1953 O VAL A 123 18.373 -0.749 1.916 1.00 32.40 O ATOM 1954 CB VAL A 123 14.976 -0.558 2.329 1.00 22.25 C ATOM 1955 CG1 VAL A 123 15.374 0.730 1.575 1.00 31.41 C ATOM 1956 CG2 VAL A 123 13.675 -1.141 1.730 1.00 22.42 C ATOM 0 H VAL A 123 15.037 -2.665 3.766 1.00 34.02 H new ATOM 0 HA VAL A 123 16.236 -1.990 1.293 1.00 1.31 H new ATOM 0 HB VAL A 123 14.790 -0.305 3.373 1.00 22.25 H new ATOM 0 HG11 VAL A 123 14.547 1.439 1.604 1.00 31.41 H new ATOM 0 HG12 VAL A 123 16.249 1.174 2.050 1.00 31.41 H new ATOM 0 HG13 VAL A 123 15.608 0.487 0.538 1.00 31.41 H new ATOM 0 HG21 VAL A 123 12.891 -0.384 1.757 1.00 22.42 H new ATOM 0 HG22 VAL A 123 13.853 -1.443 0.698 1.00 22.42 H new ATOM 0 HG23 VAL A 123 13.363 -2.008 2.313 1.00 22.42 H new ATOM 1966 N GLN A 124 17.586 -0.634 4.051 1.00 61.22 N ATOM 1967 CA GLN A 124 18.811 -0.023 4.629 1.00 53.50 C ATOM 1968 C GLN A 124 19.936 -1.070 4.789 1.00 74.45 C ATOM 1969 O GLN A 124 21.103 -0.698 4.944 1.00 13.35 O ATOM 1970 CB GLN A 124 18.510 0.679 5.988 1.00 74.43 C ATOM 1971 CG GLN A 124 17.908 -0.237 7.059 1.00 73.04 C ATOM 1972 CD GLN A 124 17.478 0.488 8.337 1.00 64.43 C ATOM 1973 OE1 GLN A 124 18.055 1.507 8.726 1.00 15.32 O ATOM 1974 NE2 GLN A 124 16.468 -0.039 9.008 1.00 32.14 N ATOM 0 H GLN A 124 16.843 -0.791 4.732 1.00 61.22 H new ATOM 0 HA GLN A 124 19.156 0.739 3.930 1.00 53.50 H new ATOM 0 HB2 GLN A 124 19.435 1.108 6.373 1.00 74.43 H new ATOM 0 HB3 GLN A 124 17.825 1.508 5.810 1.00 74.43 H new ATOM 0 HG2 GLN A 124 17.044 -0.750 6.638 1.00 73.04 H new ATOM 0 HG3 GLN A 124 18.639 -1.003 7.318 1.00 73.04 H new ATOM 0 HE21 GLN A 124 16.010 -0.882 8.662 1.00 32.14 H new ATOM 0 HE22 GLN A 124 16.146 0.398 9.872 1.00 32.14 H new ATOM 1983 N ASP A 125 19.566 -2.370 4.751 1.00 40.13 N ATOM 1984 CA ASP A 125 20.543 -3.482 4.708 1.00 42.42 C ATOM 1985 C ASP A 125 21.217 -3.540 3.317 1.00 13.32 C ATOM 1986 O ASP A 125 22.382 -3.918 3.198 1.00 61.14 O ATOM 1987 CB ASP A 125 19.807 -4.820 4.999 1.00 22.11 C ATOM 1988 CG ASP A 125 20.720 -6.057 5.029 1.00 22.32 C ATOM 1989 OD1 ASP A 125 21.272 -6.380 6.106 1.00 15.34 O ATOM 1990 OD2 ASP A 125 20.888 -6.717 3.980 1.00 63.31 O ATOM 0 H ASP A 125 18.593 -2.676 4.749 1.00 40.13 H new ATOM 0 HA ASP A 125 21.313 -3.319 5.462 1.00 42.42 H new ATOM 0 HB2 ASP A 125 19.296 -4.738 5.958 1.00 22.11 H new ATOM 0 HB3 ASP A 125 19.039 -4.970 4.241 1.00 22.11 H new ATOM 1995 N GLY A 126 20.481 -3.072 2.283 1.00 24.23 N ATOM 1996 CA GLY A 126 20.952 -3.095 0.897 1.00 45.24 C ATOM 1997 C GLY A 126 20.902 -4.491 0.276 1.00 14.20 C ATOM 1998 O GLY A 126 21.806 -4.868 -0.478 1.00 40.44 O ATOM 0 H GLY A 126 19.550 -2.672 2.395 1.00 24.23 H new ATOM 0 HA2 GLY A 126 20.344 -2.415 0.300 1.00 45.24 H new ATOM 0 HA3 GLY A 126 21.976 -2.723 0.860 1.00 45.24 H new ATOM 2002 N HIS A 127 19.854 -5.268 0.608 1.00 74.13 N ATOM 2003 CA HIS A 127 19.623 -6.608 0.017 1.00 2.42 C ATOM 2004 C HIS A 127 18.131 -6.957 0.092 1.00 4.42 C ATOM 2005 O HIS A 127 17.509 -6.747 1.126 1.00 11.31 O ATOM 2006 CB HIS A 127 20.478 -7.675 0.751 1.00 35.04 C ATOM 2007 CG HIS A 127 20.383 -9.077 0.198 1.00 62.15 C ATOM 2008 ND1 HIS A 127 21.078 -9.495 -0.912 1.00 64.15 N ATOM 2009 CD2 HIS A 127 19.680 -10.159 0.619 1.00 54.54 C ATOM 2010 CE1 HIS A 127 20.810 -10.759 -1.153 1.00 11.12 C ATOM 2011 NE2 HIS A 127 19.968 -11.189 -0.239 1.00 54.21 N ATOM 0 H HIS A 127 19.146 -4.991 1.288 1.00 74.13 H new ATOM 0 HA HIS A 127 19.925 -6.595 -1.030 1.00 2.42 H new ATOM 0 HB2 HIS A 127 21.522 -7.362 0.722 1.00 35.04 H new ATOM 0 HB3 HIS A 127 20.180 -7.696 1.799 1.00 35.04 H new ATOM 0 HD2 HIS A 127 19.017 -10.201 1.471 1.00 54.54 H new ATOM 0 HE1 HIS A 127 21.213 -11.346 -1.965 1.00 11.12 H new ATOM 0 HE2 HIS A 127 19.591 -12.135 -0.178 1.00 54.21 H new ATOM 2020 N ASP A 128 17.582 -7.514 -1.007 1.00 32.31 N ATOM 2021 CA ASP A 128 16.151 -7.894 -1.112 1.00 51.11 C ATOM 2022 C ASP A 128 15.818 -9.099 -0.214 1.00 3.53 C ATOM 2023 O ASP A 128 16.676 -9.947 0.036 1.00 41.53 O ATOM 2024 CB ASP A 128 15.798 -8.225 -2.583 1.00 33.01 C ATOM 2025 CG ASP A 128 16.576 -9.419 -3.161 1.00 22.32 C ATOM 2026 OD1 ASP A 128 17.719 -9.230 -3.623 1.00 61.53 O ATOM 2027 OD2 ASP A 128 16.051 -10.550 -3.154 1.00 40.51 O ATOM 0 H ASP A 128 18.117 -7.715 -1.852 1.00 32.31 H new ATOM 0 HA ASP A 128 15.556 -7.046 -0.773 1.00 51.11 H new ATOM 0 HB2 ASP A 128 14.730 -8.433 -2.651 1.00 33.01 H new ATOM 0 HB3 ASP A 128 15.991 -7.346 -3.199 1.00 33.01 H new ATOM 2032 N HIS A 129 14.560 -9.183 0.244 1.00 24.31 N ATOM 2033 CA HIS A 129 14.083 -10.279 1.141 1.00 12.21 C ATOM 2034 C HIS A 129 12.597 -10.590 0.886 1.00 13.43 C ATOM 2035 O HIS A 129 12.148 -11.699 1.166 1.00 42.34 O ATOM 2036 CB HIS A 129 14.309 -9.948 2.656 1.00 42.42 C ATOM 2037 CG HIS A 129 15.718 -10.180 3.176 1.00 23.41 C ATOM 2038 ND1 HIS A 129 16.087 -11.321 3.855 1.00 63.03 N ATOM 2039 CD2 HIS A 129 16.842 -9.418 3.122 1.00 51.31 C ATOM 2040 CE1 HIS A 129 17.358 -11.251 4.186 1.00 11.14 C ATOM 2041 NE2 HIS A 129 17.842 -10.105 3.755 1.00 30.05 N ATOM 0 H HIS A 129 13.837 -8.502 0.012 1.00 24.31 H new ATOM 0 HA HIS A 129 14.679 -11.160 0.903 1.00 12.21 H new ATOM 0 HB2 HIS A 129 14.046 -8.904 2.824 1.00 42.42 H new ATOM 0 HB3 HIS A 129 13.619 -10.550 3.248 1.00 42.42 H new ATOM 0 HD2 HIS A 129 16.930 -8.445 2.662 1.00 51.31 H new ATOM 0 HE1 HIS A 129 17.912 -12.007 4.722 1.00 11.14 H new ATOM 0 HE2 HIS A 129 18.803 -9.783 3.873 1.00 30.05 H new ATOM 2050 N ASP A 130 11.846 -9.589 0.386 1.00 43.52 N ATOM 2051 CA ASP A 130 10.412 -9.719 0.033 1.00 24.02 C ATOM 2052 C ASP A 130 10.159 -10.887 -0.950 1.00 41.41 C ATOM 2053 O ASP A 130 9.442 -11.839 -0.633 1.00 53.13 O ATOM 2054 CB ASP A 130 9.894 -8.376 -0.594 1.00 63.45 C ATOM 2055 CG ASP A 130 10.693 -7.905 -1.850 1.00 22.00 C ATOM 2056 OD1 ASP A 130 11.892 -7.564 -1.710 1.00 64.24 O ATOM 2057 OD2 ASP A 130 10.151 -7.924 -2.977 1.00 54.22 O ATOM 0 H ASP A 130 12.219 -8.656 0.213 1.00 43.52 H new ATOM 0 HA ASP A 130 9.866 -9.936 0.951 1.00 24.02 H new ATOM 0 HB2 ASP A 130 8.846 -8.497 -0.868 1.00 63.45 H new ATOM 0 HB3 ASP A 130 9.937 -7.594 0.164 1.00 63.45 H new ATOM 2062 N PHE A 131 10.793 -10.790 -2.126 1.00 13.41 N ATOM 2063 CA PHE A 131 10.544 -11.636 -3.303 1.00 61.01 C ATOM 2064 C PHE A 131 11.824 -11.631 -4.154 1.00 33.14 C ATOM 2065 O PHE A 131 12.362 -12.689 -4.493 1.00 4.14 O ATOM 2066 CB PHE A 131 9.328 -11.116 -4.157 1.00 3.25 C ATOM 2067 CG PHE A 131 7.963 -11.181 -3.453 1.00 3.31 C ATOM 2068 CD1 PHE A 131 7.280 -12.393 -3.321 1.00 73.41 C ATOM 2069 CD2 PHE A 131 7.374 -10.034 -2.907 1.00 64.51 C ATOM 2070 CE1 PHE A 131 6.060 -12.454 -2.665 1.00 22.35 C ATOM 2071 CE2 PHE A 131 6.158 -10.101 -2.257 1.00 72.32 C ATOM 2072 CZ PHE A 131 5.502 -11.310 -2.136 1.00 13.24 C ATOM 0 H PHE A 131 11.521 -10.095 -2.291 1.00 13.41 H new ATOM 0 HA PHE A 131 10.289 -12.644 -2.975 1.00 61.01 H new ATOM 0 HB2 PHE A 131 9.522 -10.083 -4.446 1.00 3.25 H new ATOM 0 HB3 PHE A 131 9.274 -11.699 -5.076 1.00 3.25 H new ATOM 0 HD1 PHE A 131 7.708 -13.294 -3.735 1.00 73.41 H new ATOM 0 HD2 PHE A 131 7.878 -9.083 -2.996 1.00 64.51 H new ATOM 0 HE1 PHE A 131 5.546 -13.399 -2.568 1.00 22.35 H new ATOM 0 HE2 PHE A 131 5.719 -9.206 -1.842 1.00 72.32 H new ATOM 0 HZ PHE A 131 4.551 -11.359 -1.627 1.00 13.24 H new ATOM 2082 N GLY A 132 12.329 -10.412 -4.447 1.00 50.03 N ATOM 2083 CA GLY A 132 13.490 -10.247 -5.327 1.00 71.32 C ATOM 2084 C GLY A 132 13.667 -8.827 -5.857 1.00 44.00 C ATOM 2085 O GLY A 132 14.283 -8.643 -6.912 1.00 14.45 O ATOM 0 H GLY A 132 11.948 -9.537 -4.086 1.00 50.03 H new ATOM 0 HA2 GLY A 132 14.390 -10.536 -4.784 1.00 71.32 H new ATOM 0 HA3 GLY A 132 13.394 -10.930 -6.171 1.00 71.32 H new ATOM 2089 N ARG A 133 13.149 -7.808 -5.134 1.00 55.02 N ATOM 2090 CA ARG A 133 13.310 -6.397 -5.543 1.00 72.31 C ATOM 2091 C ARG A 133 14.682 -5.872 -5.079 1.00 3.22 C ATOM 2092 O ARG A 133 14.876 -5.596 -3.893 1.00 13.10 O ATOM 2093 CB ARG A 133 12.155 -5.526 -4.992 1.00 63.24 C ATOM 2094 CG ARG A 133 12.341 -4.007 -5.237 1.00 1.03 C ATOM 2095 CD ARG A 133 11.078 -3.186 -4.955 1.00 4.43 C ATOM 2096 NE ARG A 133 10.018 -3.502 -5.923 1.00 73.42 N ATOM 2097 CZ ARG A 133 9.643 -2.725 -6.949 1.00 24.12 C ATOM 2098 NH1 ARG A 133 10.226 -1.550 -7.166 1.00 63.54 N ATOM 2099 NH2 ARG A 133 8.726 -3.159 -7.788 1.00 34.30 N ATOM 0 H ARG A 133 12.620 -7.936 -4.271 1.00 55.02 H new ATOM 0 HA ARG A 133 13.269 -6.337 -6.631 1.00 72.31 H new ATOM 0 HB2 ARG A 133 11.220 -5.846 -5.452 1.00 63.24 H new ATOM 0 HB3 ARG A 133 12.060 -5.702 -3.921 1.00 63.24 H new ATOM 0 HG2 ARG A 133 13.151 -3.641 -4.606 1.00 1.03 H new ATOM 0 HG3 ARG A 133 12.645 -3.848 -6.271 1.00 1.03 H new ATOM 0 HD2 ARG A 133 10.725 -3.390 -3.944 1.00 4.43 H new ATOM 0 HD3 ARG A 133 11.313 -2.123 -5.002 1.00 4.43 H new ATOM 0 HE ARG A 133 9.526 -4.388 -5.804 1.00 73.42 H new ATOM 0 HH11 ARG A 133 10.970 -1.228 -6.547 1.00 63.54 H new ATOM 0 HH12 ARG A 133 9.929 -0.971 -7.951 1.00 63.54 H new ATOM 0 HH21 ARG A 133 8.307 -4.079 -7.654 1.00 34.30 H new ATOM 0 HH22 ARG A 133 8.434 -2.575 -8.572 1.00 34.30 H new ATOM 2113 N ASP A 134 15.613 -5.750 -6.049 1.00 31.03 N ATOM 2114 CA ASP A 134 17.026 -5.355 -5.827 1.00 71.53 C ATOM 2115 C ASP A 134 17.147 -4.013 -5.033 1.00 12.31 C ATOM 2116 O ASP A 134 16.305 -3.130 -5.210 1.00 75.24 O ATOM 2117 CB ASP A 134 17.740 -5.234 -7.215 1.00 62.12 C ATOM 2118 CG ASP A 134 19.271 -5.052 -7.136 1.00 12.40 C ATOM 2119 OD1 ASP A 134 19.736 -3.932 -6.839 1.00 64.31 O ATOM 2120 OD2 ASP A 134 20.023 -6.022 -7.377 1.00 13.33 O ATOM 0 H ASP A 134 15.401 -5.927 -7.031 1.00 31.03 H new ATOM 0 HA ASP A 134 17.507 -6.123 -5.221 1.00 71.53 H new ATOM 0 HB2 ASP A 134 17.523 -6.128 -7.800 1.00 62.12 H new ATOM 0 HB3 ASP A 134 17.314 -4.389 -7.756 1.00 62.12 H new ATOM 2125 N PRO A 135 18.173 -3.870 -4.108 1.00 44.13 N ATOM 2126 CA PRO A 135 18.503 -2.617 -3.353 1.00 50.51 C ATOM 2127 C PRO A 135 18.355 -1.291 -4.139 1.00 14.42 C ATOM 2128 O PRO A 135 17.950 -0.278 -3.560 1.00 53.44 O ATOM 2129 CB PRO A 135 19.982 -2.852 -2.904 1.00 1.52 C ATOM 2130 CG PRO A 135 20.361 -4.211 -3.435 1.00 75.35 C ATOM 2131 CD PRO A 135 19.065 -4.948 -3.638 1.00 30.21 C ATOM 0 HA PRO A 135 17.794 -2.471 -2.538 1.00 50.51 H new ATOM 0 HB2 PRO A 135 20.639 -2.079 -3.303 1.00 1.52 H new ATOM 0 HB3 PRO A 135 20.071 -2.818 -1.818 1.00 1.52 H new ATOM 0 HG2 PRO A 135 20.913 -4.125 -4.371 1.00 75.35 H new ATOM 0 HG3 PRO A 135 21.005 -4.739 -2.733 1.00 75.35 H new ATOM 0 HD2 PRO A 135 19.161 -5.748 -4.372 1.00 30.21 H new ATOM 0 HD3 PRO A 135 18.705 -5.403 -2.715 1.00 30.21 H new ATOM 2139 N LYS A 136 18.661 -1.313 -5.449 1.00 1.22 N ATOM 2140 CA LYS A 136 18.613 -0.104 -6.307 1.00 70.52 C ATOM 2141 C LYS A 136 17.169 0.457 -6.452 1.00 60.11 C ATOM 2142 O LYS A 136 16.985 1.661 -6.643 1.00 33.41 O ATOM 2143 CB LYS A 136 19.240 -0.404 -7.701 1.00 54.51 C ATOM 2144 CG LYS A 136 18.426 -1.367 -8.595 1.00 22.12 C ATOM 2145 CD LYS A 136 19.135 -1.730 -9.928 1.00 71.11 C ATOM 2146 CE LYS A 136 20.360 -2.635 -9.734 1.00 41.15 C ATOM 2147 NZ LYS A 136 21.001 -2.996 -11.026 1.00 51.44 N ATOM 0 H LYS A 136 18.946 -2.158 -5.944 1.00 1.22 H new ATOM 0 HA LYS A 136 19.203 0.670 -5.817 1.00 70.52 H new ATOM 0 HB2 LYS A 136 19.370 0.538 -8.234 1.00 54.51 H new ATOM 0 HB3 LYS A 136 20.234 -0.825 -7.551 1.00 54.51 H new ATOM 0 HG2 LYS A 136 18.226 -2.283 -8.039 1.00 22.12 H new ATOM 0 HG3 LYS A 136 17.461 -0.913 -8.819 1.00 22.12 H new ATOM 0 HD2 LYS A 136 18.424 -2.228 -10.586 1.00 71.11 H new ATOM 0 HD3 LYS A 136 19.445 -0.813 -10.429 1.00 71.11 H new ATOM 0 HE2 LYS A 136 21.087 -2.129 -9.099 1.00 41.15 H new ATOM 0 HE3 LYS A 136 20.059 -3.544 -9.213 1.00 41.15 H new ATOM 0 HZ1 LYS A 136 21.823 -3.607 -10.847 1.00 51.44 H new ATOM 0 HZ2 LYS A 136 20.317 -3.502 -11.624 1.00 51.44 H new ATOM 0 HZ3 LYS A 136 21.312 -2.131 -11.513 1.00 51.44 H new ATOM 2161 N TYR A 137 16.162 -0.435 -6.348 1.00 12.13 N ATOM 2162 CA TYR A 137 14.724 -0.068 -6.423 1.00 2.12 C ATOM 2163 C TYR A 137 14.133 0.196 -5.023 1.00 44.20 C ATOM 2164 O TYR A 137 13.042 0.758 -4.896 1.00 10.04 O ATOM 2165 CB TYR A 137 13.918 -1.205 -7.114 1.00 33.45 C ATOM 2166 CG TYR A 137 14.482 -1.643 -8.471 1.00 65.21 C ATOM 2167 CD1 TYR A 137 14.493 -0.765 -9.557 1.00 31.13 C ATOM 2168 CD2 TYR A 137 15.032 -2.917 -8.661 1.00 43.22 C ATOM 2169 CE1 TYR A 137 15.022 -1.141 -10.774 1.00 44.25 C ATOM 2170 CE2 TYR A 137 15.566 -3.290 -9.877 1.00 42.11 C ATOM 2171 CZ TYR A 137 15.556 -2.399 -10.927 1.00 44.31 C ATOM 2172 OH TYR A 137 16.093 -2.771 -12.137 1.00 12.35 O ATOM 0 H TYR A 137 16.319 -1.433 -6.209 1.00 12.13 H new ATOM 0 HA TYR A 137 14.649 0.849 -7.007 1.00 2.12 H new ATOM 0 HB2 TYR A 137 13.889 -2.069 -6.450 1.00 33.45 H new ATOM 0 HB3 TYR A 137 12.889 -0.873 -7.251 1.00 33.45 H new ATOM 0 HD1 TYR A 137 14.080 0.226 -9.442 1.00 31.13 H new ATOM 0 HD2 TYR A 137 15.038 -3.620 -7.841 1.00 43.22 H new ATOM 0 HE1 TYR A 137 15.017 -0.450 -11.604 1.00 44.25 H new ATOM 0 HE2 TYR A 137 15.990 -4.275 -10.005 1.00 42.11 H new ATOM 0 HH TYR A 137 16.429 -3.690 -12.077 1.00 12.35 H new ATOM 2182 N LEU A 138 14.855 -0.251 -3.986 1.00 1.23 N ATOM 2183 CA LEU A 138 14.405 -0.171 -2.585 1.00 42.33 C ATOM 2184 C LEU A 138 14.571 1.244 -1.995 1.00 14.50 C ATOM 2185 O LEU A 138 15.655 1.835 -2.063 1.00 3.33 O ATOM 2186 CB LEU A 138 15.185 -1.200 -1.726 1.00 41.11 C ATOM 2187 CG LEU A 138 14.908 -2.699 -2.042 1.00 30.43 C ATOM 2188 CD1 LEU A 138 15.778 -3.637 -1.164 1.00 70.32 C ATOM 2189 CD2 LEU A 138 13.399 -3.016 -1.903 1.00 74.43 C ATOM 0 H LEU A 138 15.774 -0.681 -4.094 1.00 1.23 H new ATOM 0 HA LEU A 138 13.340 -0.403 -2.569 1.00 42.33 H new ATOM 0 HB2 LEU A 138 16.252 -1.014 -1.850 1.00 41.11 H new ATOM 0 HB3 LEU A 138 14.950 -1.021 -0.677 1.00 41.11 H new ATOM 0 HG LEU A 138 15.193 -2.884 -3.078 1.00 30.43 H new ATOM 0 HD11 LEU A 138 15.558 -4.675 -1.412 1.00 70.32 H new ATOM 0 HD12 LEU A 138 16.833 -3.435 -1.351 1.00 70.32 H new ATOM 0 HD13 LEU A 138 15.555 -3.460 -0.112 1.00 70.32 H new ATOM 0 HD21 LEU A 138 13.226 -4.068 -2.128 1.00 74.43 H new ATOM 0 HD22 LEU A 138 13.075 -2.805 -0.884 1.00 74.43 H new ATOM 0 HD23 LEU A 138 12.832 -2.398 -2.599 1.00 74.43 H new ATOM 2201 N HIS A 139 13.480 1.769 -1.417 1.00 0.32 N ATOM 2202 CA HIS A 139 13.500 2.987 -0.598 1.00 65.25 C ATOM 2203 C HIS A 139 12.428 2.855 0.494 1.00 32.22 C ATOM 2204 O HIS A 139 11.334 2.344 0.223 1.00 32.32 O ATOM 2205 CB HIS A 139 13.266 4.252 -1.460 1.00 1.41 C ATOM 2206 CG HIS A 139 13.477 5.543 -0.711 1.00 1.35 C ATOM 2207 ND1 HIS A 139 12.454 6.258 -0.130 1.00 32.02 N ATOM 2208 CD2 HIS A 139 14.609 6.238 -0.443 1.00 34.23 C ATOM 2209 CE1 HIS A 139 12.943 7.329 0.455 1.00 50.10 C ATOM 2210 NE2 HIS A 139 14.249 7.346 0.279 1.00 31.24 N ATOM 0 H HIS A 139 12.552 1.355 -1.507 1.00 0.32 H new ATOM 0 HA HIS A 139 14.482 3.099 -0.139 1.00 65.25 H new ATOM 0 HB2 HIS A 139 13.938 4.226 -2.318 1.00 1.41 H new ATOM 0 HB3 HIS A 139 12.249 4.231 -1.851 1.00 1.41 H new ATOM 0 HD2 HIS A 139 15.611 5.968 -0.743 1.00 34.23 H new ATOM 0 HE1 HIS A 139 12.370 8.071 0.991 1.00 50.10 H new ATOM 0 HE2 HIS A 139 14.886 8.064 0.623 1.00 31.24 H new ATOM 2219 N GLN A 140 12.754 3.298 1.722 1.00 42.35 N ATOM 2220 CA GLN A 140 11.814 3.292 2.861 1.00 73.35 C ATOM 2221 C GLN A 140 10.687 4.311 2.636 1.00 3.31 C ATOM 2222 O GLN A 140 10.926 5.386 2.072 1.00 70.34 O ATOM 2223 CB GLN A 140 12.538 3.617 4.209 1.00 4.45 C ATOM 2224 CG GLN A 140 13.651 2.614 4.624 1.00 5.45 C ATOM 2225 CD GLN A 140 15.074 2.976 4.197 1.00 71.51 C ATOM 2226 OE1 GLN A 140 15.297 3.662 3.200 1.00 10.02 O ATOM 2227 NE2 GLN A 140 16.043 2.460 4.937 1.00 52.22 N ATOM 0 H GLN A 140 13.675 3.670 1.954 1.00 42.35 H new ATOM 0 HA GLN A 140 11.395 2.288 2.925 1.00 73.35 H new ATOM 0 HB2 GLN A 140 12.977 4.612 4.136 1.00 4.45 H new ATOM 0 HB3 GLN A 140 11.792 3.656 5.003 1.00 4.45 H new ATOM 0 HG2 GLN A 140 13.634 2.511 5.709 1.00 5.45 H new ATOM 0 HG3 GLN A 140 13.406 1.637 4.208 1.00 5.45 H new ATOM 0 HE21 GLN A 140 15.814 1.897 5.756 1.00 52.22 H new ATOM 0 HE22 GLN A 140 17.018 2.626 4.688 1.00 52.22 H new ATOM 2236 N PHE A 141 9.466 3.962 3.076 1.00 31.24 N ATOM 2237 CA PHE A 141 8.332 4.894 3.078 1.00 51.41 C ATOM 2238 C PHE A 141 8.629 6.020 4.074 1.00 70.14 C ATOM 2239 O PHE A 141 8.797 5.751 5.274 1.00 14.22 O ATOM 2240 CB PHE A 141 7.013 4.182 3.484 1.00 70.01 C ATOM 2241 CG PHE A 141 6.677 2.930 2.686 1.00 4.44 C ATOM 2242 CD1 PHE A 141 6.235 3.025 1.373 1.00 53.32 C ATOM 2243 CD2 PHE A 141 6.795 1.657 3.257 1.00 32.33 C ATOM 2244 CE1 PHE A 141 5.917 1.893 0.654 1.00 50.24 C ATOM 2245 CE2 PHE A 141 6.476 0.524 2.535 1.00 63.03 C ATOM 2246 CZ PHE A 141 6.040 0.642 1.229 1.00 21.14 C ATOM 0 H PHE A 141 9.241 3.035 3.436 1.00 31.24 H new ATOM 0 HA PHE A 141 8.203 5.291 2.071 1.00 51.41 H new ATOM 0 HB2 PHE A 141 7.074 3.915 4.539 1.00 70.01 H new ATOM 0 HB3 PHE A 141 6.191 4.890 3.381 1.00 70.01 H new ATOM 0 HD1 PHE A 141 6.139 3.996 0.910 1.00 53.32 H new ATOM 0 HD2 PHE A 141 7.140 1.560 4.276 1.00 32.33 H new ATOM 0 HE1 PHE A 141 5.570 1.984 -0.365 1.00 50.24 H new ATOM 0 HE2 PHE A 141 6.567 -0.451 2.990 1.00 63.03 H new ATOM 0 HZ PHE A 141 5.796 -0.242 0.658 1.00 21.14 H new ATOM 2256 N GLU A 142 8.736 7.263 3.572 1.00 23.22 N ATOM 2257 CA GLU A 142 8.919 8.436 4.435 1.00 35.52 C ATOM 2258 C GLU A 142 7.575 8.728 5.106 1.00 52.42 C ATOM 2259 O GLU A 142 6.712 9.412 4.541 1.00 73.54 O ATOM 2260 CB GLU A 142 9.445 9.655 3.629 1.00 2.33 C ATOM 2261 CG GLU A 142 10.796 9.401 2.943 1.00 62.35 C ATOM 2262 CD GLU A 142 11.353 10.643 2.238 1.00 54.11 C ATOM 2263 OE1 GLU A 142 11.050 10.861 1.057 1.00 45.24 O ATOM 2264 OE2 GLU A 142 12.106 11.413 2.865 1.00 4.21 O ATOM 0 H GLU A 142 8.699 7.478 2.576 1.00 23.22 H new ATOM 0 HA GLU A 142 9.674 8.235 5.195 1.00 35.52 H new ATOM 0 HB2 GLU A 142 8.708 9.926 2.873 1.00 2.33 H new ATOM 0 HB3 GLU A 142 9.542 10.509 4.299 1.00 2.33 H new ATOM 0 HG2 GLU A 142 11.516 9.059 3.686 1.00 62.35 H new ATOM 0 HG3 GLU A 142 10.682 8.597 2.215 1.00 62.35 H new ATOM 2271 N GLY A 143 7.419 8.170 6.318 1.00 73.14 N ATOM 2272 CA GLY A 143 6.135 8.086 7.005 1.00 72.55 C ATOM 2273 C GLY A 143 5.775 9.328 7.792 1.00 22.50 C ATOM 2274 O GLY A 143 5.609 9.267 9.019 1.00 4.41 O ATOM 0 H GLY A 143 8.191 7.764 6.846 1.00 73.14 H new ATOM 0 HA2 GLY A 143 5.353 7.895 6.270 1.00 72.55 H new ATOM 0 HA3 GLY A 143 6.152 7.232 7.682 1.00 72.55 H new ATOM 2278 N GLU A 144 5.658 10.461 7.079 1.00 42.14 N ATOM 2279 CA GLU A 144 5.038 11.687 7.614 1.00 31.15 C ATOM 2280 C GLU A 144 3.580 11.361 7.991 1.00 14.12 C ATOM 2281 O GLU A 144 3.098 11.680 9.084 1.00 61.22 O ATOM 2282 CB GLU A 144 5.099 12.826 6.552 1.00 22.34 C ATOM 2283 CG GLU A 144 6.514 13.121 6.018 1.00 52.42 C ATOM 2284 CD GLU A 144 6.552 14.278 5.008 1.00 50.23 C ATOM 2285 OE1 GLU A 144 6.484 15.456 5.433 1.00 54.43 O ATOM 2286 OE2 GLU A 144 6.630 14.023 3.786 1.00 0.45 O ATOM 0 H GLU A 144 5.989 10.554 6.119 1.00 42.14 H new ATOM 0 HA GLU A 144 5.575 12.032 8.497 1.00 31.15 H new ATOM 0 HB2 GLU A 144 4.455 12.560 5.714 1.00 22.34 H new ATOM 0 HB3 GLU A 144 4.691 13.737 6.990 1.00 22.34 H new ATOM 0 HG2 GLU A 144 7.169 13.358 6.856 1.00 52.42 H new ATOM 0 HG3 GLU A 144 6.912 12.222 5.546 1.00 52.42 H new ATOM 2293 N THR A 145 2.930 10.670 7.048 1.00 64.41 N ATOM 2294 CA THR A 145 1.621 10.037 7.209 1.00 61.35 C ATOM 2295 C THR A 145 1.570 8.803 6.287 1.00 74.30 C ATOM 2296 O THR A 145 1.953 8.895 5.122 1.00 33.32 O ATOM 2297 CB THR A 145 0.467 11.037 6.856 1.00 73.42 C ATOM 2298 OG1 THR A 145 0.443 12.107 7.815 1.00 74.14 O ATOM 2299 CG2 THR A 145 -0.922 10.365 6.803 1.00 31.32 C ATOM 0 H THR A 145 3.319 10.532 6.115 1.00 64.41 H new ATOM 0 HA THR A 145 1.482 9.737 8.247 1.00 61.35 H new ATOM 0 HB THR A 145 0.677 11.420 5.857 1.00 73.42 H new ATOM 0 HG1 THR A 145 1.204 12.016 8.425 1.00 74.14 H new ATOM 0 HG21 THR A 145 -1.677 11.110 6.554 1.00 31.32 H new ATOM 0 HG22 THR A 145 -0.919 9.583 6.043 1.00 31.32 H new ATOM 0 HG23 THR A 145 -1.151 9.926 7.774 1.00 31.32 H new ATOM 2307 N PHE A 146 1.140 7.653 6.828 1.00 41.14 N ATOM 2308 CA PHE A 146 0.920 6.419 6.044 1.00 14.55 C ATOM 2309 C PHE A 146 -0.520 6.377 5.516 1.00 1.45 C ATOM 2310 O PHE A 146 -1.445 6.881 6.160 1.00 13.15 O ATOM 2311 CB PHE A 146 1.214 5.144 6.898 1.00 43.21 C ATOM 2312 CG PHE A 146 2.647 4.621 6.780 1.00 4.05 C ATOM 2313 CD1 PHE A 146 3.666 5.096 7.604 1.00 21.20 C ATOM 2314 CD2 PHE A 146 2.968 3.647 5.831 1.00 23.33 C ATOM 2315 CE1 PHE A 146 4.956 4.608 7.482 1.00 3.03 C ATOM 2316 CE2 PHE A 146 4.255 3.165 5.714 1.00 5.02 C ATOM 2317 CZ PHE A 146 5.248 3.647 6.539 1.00 41.15 C ATOM 0 H PHE A 146 0.934 7.548 7.821 1.00 41.14 H new ATOM 0 HA PHE A 146 1.612 6.429 5.202 1.00 14.55 H new ATOM 0 HB2 PHE A 146 1.006 5.367 7.945 1.00 43.21 H new ATOM 0 HB3 PHE A 146 0.526 4.354 6.598 1.00 43.21 H new ATOM 0 HD1 PHE A 146 3.447 5.851 8.344 1.00 21.20 H new ATOM 0 HD2 PHE A 146 2.196 3.266 5.179 1.00 23.33 H new ATOM 0 HE1 PHE A 146 5.736 4.982 8.128 1.00 3.03 H new ATOM 0 HE2 PHE A 146 4.484 2.410 4.976 1.00 5.02 H new ATOM 0 HZ PHE A 146 6.256 3.271 6.446 1.00 41.15 H new ATOM 2327 N TYR A 147 -0.675 5.778 4.328 1.00 32.44 N ATOM 2328 CA TYR A 147 -1.969 5.519 3.682 1.00 40.13 C ATOM 2329 C TYR A 147 -2.085 4.025 3.373 1.00 30.23 C ATOM 2330 O TYR A 147 -1.113 3.387 2.952 1.00 2.11 O ATOM 2331 CB TYR A 147 -2.122 6.353 2.377 1.00 25.25 C ATOM 2332 CG TYR A 147 -2.544 7.812 2.594 1.00 61.41 C ATOM 2333 CD1 TYR A 147 -1.671 8.748 3.148 1.00 54.04 C ATOM 2334 CD2 TYR A 147 -3.817 8.256 2.231 1.00 23.21 C ATOM 2335 CE1 TYR A 147 -2.053 10.065 3.329 1.00 61.34 C ATOM 2336 CE2 TYR A 147 -4.196 9.569 2.416 1.00 70.35 C ATOM 2337 CZ TYR A 147 -3.309 10.471 2.963 1.00 15.24 C ATOM 2338 OH TYR A 147 -3.679 11.793 3.131 1.00 61.44 O ATOM 0 H TYR A 147 0.117 5.451 3.775 1.00 32.44 H new ATOM 0 HA TYR A 147 -2.768 5.818 4.361 1.00 40.13 H new ATOM 0 HB2 TYR A 147 -1.173 6.339 1.840 1.00 25.25 H new ATOM 0 HB3 TYR A 147 -2.858 5.868 1.736 1.00 25.25 H new ATOM 0 HD1 TYR A 147 -0.679 8.439 3.441 1.00 54.04 H new ATOM 0 HD2 TYR A 147 -4.518 7.558 1.797 1.00 23.21 H new ATOM 0 HE1 TYR A 147 -1.361 10.774 3.759 1.00 61.34 H new ATOM 0 HE2 TYR A 147 -5.187 9.890 2.132 1.00 70.35 H new ATOM 0 HH TYR A 147 -2.884 12.334 3.320 1.00 61.44 H new ATOM 2348 N ILE A 148 -3.278 3.476 3.618 1.00 44.23 N ATOM 2349 CA ILE A 148 -3.641 2.102 3.262 1.00 31.35 C ATOM 2350 C ILE A 148 -4.927 2.166 2.427 1.00 73.12 C ATOM 2351 O ILE A 148 -5.999 2.503 2.937 1.00 41.42 O ATOM 2352 CB ILE A 148 -3.840 1.186 4.532 1.00 61.11 C ATOM 2353 CG1 ILE A 148 -2.495 1.025 5.323 1.00 62.33 C ATOM 2354 CG2 ILE A 148 -4.413 -0.190 4.129 1.00 64.31 C ATOM 2355 CD1 ILE A 148 -2.558 0.103 6.535 1.00 45.34 C ATOM 0 H ILE A 148 -4.033 3.984 4.078 1.00 44.23 H new ATOM 0 HA ILE A 148 -2.830 1.650 2.692 1.00 31.35 H new ATOM 0 HB ILE A 148 -4.559 1.672 5.191 1.00 61.11 H new ATOM 0 HG12 ILE A 148 -1.734 0.648 4.640 1.00 62.33 H new ATOM 0 HG13 ILE A 148 -2.167 2.010 5.654 1.00 62.33 H new ATOM 0 HG21 ILE A 148 -4.542 -0.805 5.019 1.00 64.31 H new ATOM 0 HG22 ILE A 148 -5.377 -0.053 3.639 1.00 64.31 H new ATOM 0 HG23 ILE A 148 -3.725 -0.684 3.443 1.00 64.31 H new ATOM 0 HD11 ILE A 148 -1.578 0.060 7.011 1.00 45.34 H new ATOM 0 HD12 ILE A 148 -3.290 0.486 7.246 1.00 45.34 H new ATOM 0 HD13 ILE A 148 -2.850 -0.897 6.216 1.00 45.34 H new ATOM 2367 N ILE A 149 -4.794 1.889 1.130 1.00 12.30 N ATOM 2368 CA ILE A 149 -5.898 1.980 0.171 1.00 20.21 C ATOM 2369 C ILE A 149 -6.524 0.598 -0.006 1.00 74.30 C ATOM 2370 O ILE A 149 -5.817 -0.361 -0.322 1.00 22.13 O ATOM 2371 CB ILE A 149 -5.389 2.537 -1.212 1.00 21.32 C ATOM 2372 CG1 ILE A 149 -4.561 3.857 -1.013 1.00 75.11 C ATOM 2373 CG2 ILE A 149 -6.559 2.747 -2.207 1.00 21.11 C ATOM 2374 CD1 ILE A 149 -5.255 4.961 -0.218 1.00 34.24 C ATOM 0 H ILE A 149 -3.912 1.593 0.711 1.00 12.30 H new ATOM 0 HA ILE A 149 -6.649 2.671 0.553 1.00 20.21 H new ATOM 0 HB ILE A 149 -4.727 1.789 -1.648 1.00 21.32 H new ATOM 0 HG12 ILE A 149 -3.627 3.606 -0.511 1.00 75.11 H new ATOM 0 HG13 ILE A 149 -4.299 4.251 -1.995 1.00 75.11 H new ATOM 0 HG21 ILE A 149 -6.170 3.132 -3.150 1.00 21.11 H new ATOM 0 HG22 ILE A 149 -7.062 1.796 -2.383 1.00 21.11 H new ATOM 0 HG23 ILE A 149 -7.269 3.461 -1.789 1.00 21.11 H new ATOM 0 HD11 ILE A 149 -4.594 5.825 -0.142 1.00 34.24 H new ATOM 0 HD12 ILE A 149 -6.175 5.251 -0.725 1.00 34.24 H new ATOM 0 HD13 ILE A 149 -5.492 4.596 0.781 1.00 34.24 H new ATOM 2386 N GLU A 150 -7.837 0.507 0.231 1.00 42.21 N ATOM 2387 CA GLU A 150 -8.615 -0.720 0.037 1.00 5.23 C ATOM 2388 C GLU A 150 -8.649 -1.078 -1.465 1.00 65.32 C ATOM 2389 O GLU A 150 -9.302 -0.400 -2.270 1.00 12.03 O ATOM 2390 CB GLU A 150 -10.040 -0.516 0.619 1.00 22.44 C ATOM 2391 CG GLU A 150 -10.961 -1.752 0.562 1.00 2.11 C ATOM 2392 CD GLU A 150 -12.361 -1.506 1.159 1.00 41.13 C ATOM 2393 OE1 GLU A 150 -12.991 -0.470 0.837 1.00 62.31 O ATOM 2394 OE2 GLU A 150 -12.857 -2.366 1.922 1.00 54.41 O ATOM 0 H GLU A 150 -8.395 1.292 0.567 1.00 42.21 H new ATOM 0 HA GLU A 150 -8.152 -1.554 0.564 1.00 5.23 H new ATOM 0 HB2 GLU A 150 -9.948 -0.200 1.658 1.00 22.44 H new ATOM 0 HB3 GLU A 150 -10.521 0.300 0.079 1.00 22.44 H new ATOM 0 HG2 GLU A 150 -11.068 -2.068 -0.476 1.00 2.11 H new ATOM 0 HG3 GLU A 150 -10.486 -2.574 1.098 1.00 2.11 H new ATOM 2401 N GLN A 151 -7.894 -2.127 -1.821 1.00 51.42 N ATOM 2402 CA GLN A 151 -7.721 -2.590 -3.205 1.00 42.40 C ATOM 2403 C GLN A 151 -8.586 -3.825 -3.467 1.00 21.22 C ATOM 2404 O GLN A 151 -8.357 -4.893 -2.894 1.00 72.13 O ATOM 2405 CB GLN A 151 -6.229 -2.942 -3.475 1.00 3.21 C ATOM 2406 CG GLN A 151 -5.252 -1.759 -3.410 1.00 32.02 C ATOM 2407 CD GLN A 151 -5.454 -0.712 -4.515 1.00 53.35 C ATOM 2408 OE1 GLN A 151 -5.196 0.471 -4.309 1.00 61.13 O ATOM 2409 NE2 GLN A 151 -5.879 -1.139 -5.706 1.00 51.32 N ATOM 0 H GLN A 151 -7.377 -2.687 -1.143 1.00 51.42 H new ATOM 0 HA GLN A 151 -8.030 -1.786 -3.873 1.00 42.40 H new ATOM 0 HB2 GLN A 151 -5.913 -3.692 -2.750 1.00 3.21 H new ATOM 0 HB3 GLN A 151 -6.154 -3.400 -4.461 1.00 3.21 H new ATOM 0 HG2 GLN A 151 -5.354 -1.271 -2.440 1.00 32.02 H new ATOM 0 HG3 GLN A 151 -4.233 -2.141 -3.469 1.00 32.02 H new ATOM 0 HE21 GLN A 151 -6.086 -2.127 -5.849 1.00 51.32 H new ATOM 0 HE22 GLN A 151 -5.997 -0.477 -6.473 1.00 51.32 H new ATOM 2418 N ARG A 152 -9.591 -3.661 -4.322 1.00 73.01 N ATOM 2419 CA ARG A 152 -10.351 -4.782 -4.892 1.00 43.23 C ATOM 2420 C ARG A 152 -9.841 -5.048 -6.317 1.00 74.12 C ATOM 2421 O ARG A 152 -8.948 -4.340 -6.817 1.00 34.14 O ATOM 2422 CB ARG A 152 -11.891 -4.493 -4.890 1.00 45.52 C ATOM 2423 CG ARG A 152 -12.609 -4.705 -3.527 1.00 52.21 C ATOM 2424 CD ARG A 152 -12.138 -3.751 -2.420 1.00 54.13 C ATOM 2425 NE ARG A 152 -12.238 -2.331 -2.822 1.00 10.55 N ATOM 2426 CZ ARG A 152 -13.190 -1.467 -2.434 1.00 21.35 C ATOM 2427 NH1 ARG A 152 -14.168 -1.843 -1.617 1.00 10.44 N ATOM 2428 NH2 ARG A 152 -13.136 -0.213 -2.858 1.00 53.41 N ATOM 0 H ARG A 152 -9.907 -2.746 -4.644 1.00 73.01 H new ATOM 0 HA ARG A 152 -10.198 -5.668 -4.276 1.00 43.23 H new ATOM 0 HB2 ARG A 152 -12.050 -3.463 -5.209 1.00 45.52 H new ATOM 0 HB3 ARG A 152 -12.364 -5.134 -5.634 1.00 45.52 H new ATOM 0 HG2 ARG A 152 -13.682 -4.579 -3.669 1.00 52.21 H new ATOM 0 HG3 ARG A 152 -12.450 -5.732 -3.200 1.00 52.21 H new ATOM 0 HD2 ARG A 152 -12.736 -3.915 -1.523 1.00 54.13 H new ATOM 0 HD3 ARG A 152 -11.105 -3.981 -2.161 1.00 54.13 H new ATOM 0 HE ARG A 152 -11.518 -1.976 -3.451 1.00 10.55 H new ATOM 0 HH11 ARG A 152 -14.205 -2.803 -1.273 1.00 10.44 H new ATOM 0 HH12 ARG A 152 -14.882 -1.172 -1.334 1.00 10.44 H new ATOM 0 HH21 ARG A 152 -12.378 0.086 -3.471 1.00 53.41 H new ATOM 0 HH22 ARG A 152 -13.853 0.454 -2.571 1.00 53.41 H new ATOM 2442 N LEU A 153 -10.396 -6.090 -6.951 1.00 2.21 N ATOM 2443 CA LEU A 153 -10.170 -6.368 -8.384 1.00 22.41 C ATOM 2444 C LEU A 153 -10.876 -5.288 -9.245 1.00 14.54 C ATOM 2445 O LEU A 153 -11.745 -4.557 -8.746 1.00 22.30 O ATOM 2446 CB LEU A 153 -10.687 -7.788 -8.744 1.00 52.31 C ATOM 2447 CG LEU A 153 -9.942 -8.988 -8.063 1.00 41.41 C ATOM 2448 CD1 LEU A 153 -10.650 -10.334 -8.351 1.00 62.34 C ATOM 2449 CD2 LEU A 153 -8.452 -9.042 -8.482 1.00 2.24 C ATOM 0 H LEU A 153 -11.011 -6.762 -6.492 1.00 2.21 H new ATOM 0 HA LEU A 153 -9.101 -6.334 -8.592 1.00 22.41 H new ATOM 0 HB2 LEU A 153 -11.743 -7.846 -8.480 1.00 52.31 H new ATOM 0 HB3 LEU A 153 -10.622 -7.913 -9.825 1.00 52.31 H new ATOM 0 HG LEU A 153 -9.978 -8.820 -6.987 1.00 41.41 H new ATOM 0 HD11 LEU A 153 -10.106 -11.143 -7.863 1.00 62.34 H new ATOM 0 HD12 LEU A 153 -11.669 -10.299 -7.966 1.00 62.34 H new ATOM 0 HD13 LEU A 153 -10.674 -10.510 -9.426 1.00 62.34 H new ATOM 0 HD21 LEU A 153 -7.966 -9.886 -7.991 1.00 2.24 H new ATOM 0 HD22 LEU A 153 -8.382 -9.162 -9.563 1.00 2.24 H new ATOM 0 HD23 LEU A 153 -7.957 -8.117 -8.187 1.00 2.24 H new ATOM 2461 N GLU A 154 -10.496 -5.225 -10.535 1.00 24.40 N ATOM 2462 CA GLU A 154 -11.024 -4.241 -11.522 1.00 70.03 C ATOM 2463 C GLU A 154 -12.555 -4.304 -11.693 1.00 45.34 C ATOM 2464 O GLU A 154 -13.183 -3.323 -12.108 1.00 62.35 O ATOM 2465 CB GLU A 154 -10.331 -4.478 -12.894 1.00 25.32 C ATOM 2466 CG GLU A 154 -8.844 -4.067 -12.954 1.00 24.41 C ATOM 2467 CD GLU A 154 -8.620 -2.555 -13.180 1.00 23.24 C ATOM 2468 OE1 GLU A 154 -8.874 -1.750 -12.260 1.00 43.10 O ATOM 2469 OE2 GLU A 154 -8.166 -2.168 -14.286 1.00 12.25 O ATOM 0 H GLU A 154 -9.805 -5.860 -10.934 1.00 24.40 H new ATOM 0 HA GLU A 154 -10.799 -3.247 -11.137 1.00 70.03 H new ATOM 0 HB2 GLU A 154 -10.410 -5.535 -13.146 1.00 25.32 H new ATOM 0 HB3 GLU A 154 -10.876 -3.926 -13.660 1.00 25.32 H new ATOM 0 HG2 GLU A 154 -8.358 -4.361 -12.024 1.00 24.41 H new ATOM 0 HG3 GLU A 154 -8.357 -4.620 -13.757 1.00 24.41 H new ATOM 2476 N HIS A 155 -13.135 -5.471 -11.395 1.00 11.41 N ATOM 2477 CA HIS A 155 -14.577 -5.719 -11.547 1.00 64.35 C ATOM 2478 C HIS A 155 -15.250 -5.717 -10.166 1.00 40.43 C ATOM 2479 O HIS A 155 -15.068 -6.662 -9.389 1.00 43.31 O ATOM 2480 CB HIS A 155 -14.812 -7.072 -12.276 1.00 42.34 C ATOM 2481 CG HIS A 155 -14.164 -7.145 -13.641 1.00 23.24 C ATOM 2482 ND1 HIS A 155 -14.860 -7.014 -14.826 1.00 34.25 N ATOM 2483 CD2 HIS A 155 -12.868 -7.324 -14.003 1.00 23.44 C ATOM 2484 CE1 HIS A 155 -14.025 -7.110 -15.842 1.00 1.44 C ATOM 2485 NE2 HIS A 155 -12.812 -7.297 -15.370 1.00 21.43 N ATOM 0 H HIS A 155 -12.618 -6.275 -11.040 1.00 11.41 H new ATOM 0 HA HIS A 155 -15.019 -4.927 -12.151 1.00 64.35 H new ATOM 0 HB2 HIS A 155 -14.426 -7.881 -11.656 1.00 42.34 H new ATOM 0 HB3 HIS A 155 -15.884 -7.236 -12.383 1.00 42.34 H new ATOM 0 HD2 HIS A 155 -12.032 -7.463 -13.333 1.00 23.44 H new ATOM 0 HE1 HIS A 155 -14.292 -7.046 -16.886 1.00 1.44 H new ATOM 0 HE2 HIS A 155 -11.967 -7.404 -15.931 1.00 21.43 H new ATOM 2494 N HIS A 156 -16.004 -4.639 -9.862 1.00 14.41 N ATOM 2495 CA HIS A 156 -16.752 -4.498 -8.592 1.00 43.31 C ATOM 2496 C HIS A 156 -17.846 -3.414 -8.725 1.00 5.22 C ATOM 2497 O HIS A 156 -18.978 -3.601 -8.261 1.00 1.14 O ATOM 2498 CB HIS A 156 -15.804 -4.171 -7.405 1.00 11.43 C ATOM 2499 CG HIS A 156 -16.503 -4.127 -6.067 1.00 71.43 C ATOM 2500 ND1 HIS A 156 -16.520 -3.013 -5.254 1.00 73.30 N ATOM 2501 CD2 HIS A 156 -17.223 -5.070 -5.412 1.00 14.22 C ATOM 2502 CE1 HIS A 156 -17.217 -3.275 -4.167 1.00 51.23 C ATOM 2503 NE2 HIS A 156 -17.655 -4.514 -4.236 1.00 35.12 N ATOM 0 H HIS A 156 -16.112 -3.842 -10.489 1.00 14.41 H new ATOM 0 HA HIS A 156 -17.230 -5.455 -8.381 1.00 43.31 H new ATOM 0 HB2 HIS A 156 -15.012 -4.919 -7.367 1.00 11.43 H new ATOM 0 HB3 HIS A 156 -15.326 -3.209 -7.587 1.00 11.43 H new ATOM 0 HD2 HIS A 156 -17.420 -6.075 -5.754 1.00 14.22 H new ATOM 0 HE1 HIS A 156 -17.399 -2.587 -3.354 1.00 51.23 H new ATOM 0 HE2 HIS A 156 -18.223 -4.983 -3.530 1.00 35.12 H new ATOM 2512 N HIS A 157 -17.495 -2.285 -9.368 1.00 23.34 N ATOM 2513 CA HIS A 157 -18.421 -1.155 -9.616 1.00 61.10 C ATOM 2514 C HIS A 157 -18.192 -0.637 -11.046 1.00 10.52 C ATOM 2515 O HIS A 157 -17.173 0.005 -11.317 1.00 52.40 O ATOM 2516 CB HIS A 157 -18.204 -0.026 -8.568 1.00 14.02 C ATOM 2517 CG HIS A 157 -19.177 1.140 -8.682 1.00 51.34 C ATOM 2518 ND1 HIS A 157 -20.430 1.132 -8.107 1.00 14.23 N ATOM 2519 CD2 HIS A 157 -19.061 2.363 -9.270 1.00 51.35 C ATOM 2520 CE1 HIS A 157 -21.031 2.281 -8.336 1.00 63.52 C ATOM 2521 NE2 HIS A 157 -20.226 3.051 -9.038 1.00 34.13 N ATOM 0 H HIS A 157 -16.556 -2.126 -9.734 1.00 23.34 H new ATOM 0 HA HIS A 157 -19.452 -1.494 -9.516 1.00 61.10 H new ATOM 0 HB2 HIS A 157 -18.286 -0.455 -7.569 1.00 14.02 H new ATOM 0 HB3 HIS A 157 -17.188 0.355 -8.669 1.00 14.02 H new ATOM 0 HD2 HIS A 157 -18.206 2.726 -9.820 1.00 51.35 H new ATOM 0 HE1 HIS A 157 -22.023 2.548 -8.002 1.00 63.52 H new ATOM 0 HE2 HIS A 157 -20.433 3.998 -9.356 1.00 34.13 H new ATOM 2530 N HIS A 158 -19.133 -0.939 -11.959 1.00 25.30 N ATOM 2531 CA HIS A 158 -18.990 -0.660 -13.405 1.00 35.13 C ATOM 2532 C HIS A 158 -19.831 0.577 -13.819 1.00 63.33 C ATOM 2533 O HIS A 158 -20.190 1.408 -12.971 1.00 53.14 O ATOM 2534 CB HIS A 158 -19.369 -1.949 -14.209 1.00 74.21 C ATOM 2535 CG HIS A 158 -20.782 -2.443 -13.997 1.00 14.31 C ATOM 2536 ND1 HIS A 158 -21.141 -3.295 -12.978 1.00 33.13 N ATOM 2537 CD2 HIS A 158 -21.917 -2.219 -14.700 1.00 72.44 C ATOM 2538 CE1 HIS A 158 -22.431 -3.556 -13.053 1.00 51.44 C ATOM 2539 NE2 HIS A 158 -22.925 -2.915 -14.091 1.00 64.14 N ATOM 0 H HIS A 158 -20.018 -1.385 -11.717 1.00 25.30 H new ATOM 0 HA HIS A 158 -17.955 -0.408 -13.637 1.00 35.13 H new ATOM 0 HB2 HIS A 158 -19.225 -1.752 -15.271 1.00 74.21 H new ATOM 0 HB3 HIS A 158 -18.677 -2.746 -13.936 1.00 74.21 H new ATOM 0 HD2 HIS A 158 -22.010 -1.603 -15.582 1.00 72.44 H new ATOM 0 HE1 HIS A 158 -22.988 -4.188 -12.377 1.00 51.44 H new ATOM 0 HE2 HIS A 158 -23.899 -2.934 -14.392 1.00 64.14 H new ATOM 2548 N HIS A 159 -20.092 0.713 -15.139 1.00 70.05 N ATOM 2549 CA HIS A 159 -20.925 1.795 -15.724 1.00 21.32 C ATOM 2550 C HIS A 159 -22.383 1.724 -15.196 1.00 64.11 C ATOM 2551 O HIS A 159 -22.851 0.663 -14.784 1.00 55.40 O ATOM 2552 CB HIS A 159 -20.881 1.678 -17.279 1.00 70.01 C ATOM 2553 CG HIS A 159 -21.574 2.783 -18.034 1.00 64.13 C ATOM 2554 ND1 HIS A 159 -22.933 2.812 -18.252 1.00 64.54 N ATOM 2555 CD2 HIS A 159 -21.085 3.898 -18.631 1.00 62.10 C ATOM 2556 CE1 HIS A 159 -23.248 3.884 -18.942 1.00 11.20 C ATOM 2557 NE2 HIS A 159 -22.149 4.563 -19.184 1.00 55.22 N ATOM 0 H HIS A 159 -19.727 0.067 -15.839 1.00 70.05 H new ATOM 0 HA HIS A 159 -20.525 2.764 -15.424 1.00 21.32 H new ATOM 0 HB2 HIS A 159 -19.838 1.646 -17.594 1.00 70.01 H new ATOM 0 HB3 HIS A 159 -21.331 0.728 -17.567 1.00 70.01 H new ATOM 0 HD2 HIS A 159 -20.050 4.205 -18.665 1.00 62.10 H new ATOM 0 HE1 HIS A 159 -24.243 4.161 -19.258 1.00 11.20 H new ATOM 0 HE2 HIS A 159 -22.096 5.442 -19.699 1.00 55.22 H new ATOM 2566 N HIS A 160 -23.087 2.867 -15.198 1.00 0.11 N ATOM 2567 CA HIS A 160 -24.482 2.962 -14.722 1.00 32.52 C ATOM 2568 C HIS A 160 -25.440 2.824 -15.924 1.00 12.01 C ATOM 2569 O HIS A 160 -25.949 1.709 -16.157 1.00 51.41 O ATOM 2570 CB HIS A 160 -24.710 4.301 -13.961 1.00 30.35 C ATOM 2571 CG HIS A 160 -23.841 4.454 -12.747 1.00 12.33 C ATOM 2572 ND1 HIS A 160 -22.926 5.463 -12.600 1.00 52.21 N ATOM 2573 CD2 HIS A 160 -23.770 3.724 -11.611 1.00 44.25 C ATOM 2574 CE1 HIS A 160 -22.324 5.346 -11.439 1.00 1.41 C ATOM 2575 NE2 HIS A 160 -22.819 4.300 -10.812 1.00 74.53 N ATOM 2576 OXT HIS A 160 -25.627 3.810 -16.665 1.00 37.55 O ATOM 0 H HIS A 160 -22.707 3.754 -15.529 1.00 0.11 H new ATOM 0 HA HIS A 160 -24.685 2.153 -14.020 1.00 32.52 H new ATOM 0 HB2 HIS A 160 -24.522 5.133 -14.640 1.00 30.35 H new ATOM 0 HB3 HIS A 160 -25.756 4.366 -13.660 1.00 30.35 H new ATOM 0 HD2 HIS A 160 -24.356 2.847 -11.377 1.00 44.25 H new ATOM 0 HE1 HIS A 160 -21.551 5.999 -11.061 1.00 1.41 H new ATOM 0 HE2 HIS A 160 -22.541 3.973 -9.887 1.00 74.53 H new TER 2585 HIS A 160