USER MOD reduce.3.24.130724 H: found=0, std=0, add=867, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 865 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 94 HIS : no HD1:sc= -3.18! K(o=-7.9!,f=-5.1) USER MOD Set 1.2: A 103 GLN : amide:sc= -4.5! C(o=-7.9!,f=-5.1!) USER MOD Set 1.3: A 107 TYR OH : rot -157:sc= -0.219 USER MOD Set 2.1: A 91 ASN : amide:sc= -5.7! C(o=-5.4!,f=-4.7!) USER MOD Set 2.2: A 92 TYR OH : rot 104:sc= 0.304 USER MOD Single : A 44 SER OG : rot 68:sc= 1.16 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.471 USER MOD Single : A 63 ASN : amide:sc= -4.15! C(o=-4.2!,f=-6.4!) USER MOD Single : A 67 CYS SG : rot 180:sc= -1.48 USER MOD Single : A 69 THR OG1 : rot 160:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -160:sc= -0.0481 (180deg=-0.662) USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 74 SER OG : rot 115:sc= 0.1! USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 ASN : amide:sc= -2.55 K(o=-2.5,f=-12!) USER MOD Single : A 80 GLN : amide:sc= -0.41 X(o=-0.41,f=-0.69) USER MOD Single : A 82 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 162:sc= -0.0198 (180deg=-0.548) USER MOD Single : A 95 ASN : amide:sc= -6.69! K(o=-6.7!,f=-1.2) USER MOD Single : A 96 ASN : amide:sc= -0.139 K(o=-0.14,f=-2.3!) USER MOD Single : A 97 MET CE :methyl -131:sc= -0.179 (180deg=-2.13!) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= -2.62! K(o=-2.6!,f=-0.72) USER MOD Single : A 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 HIS : no HD1:sc= -1.33 K(o=-1.3,f=-0.55) USER MOD Single : A 111 LYS NZ :NH3+ -131:sc= -1.09 (180deg=-3.53!) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 56:sc= 0.162 USER MOD Single : A 117 ASN : amide:sc= -0.514 K(o=-0.51,f=-3.2!) USER MOD Single : A 130 SER OG : rot 180:sc= -0.506 USER MOD Single : A 131 HIS : no HE2:sc= -4.14 K(o=-4.1,f=-5.9!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 ASN : amide:sc= -0.378 K(o=-0.38,f=-3!) USER MOD Single : A 138 SER OG : rot -29:sc= 0.206 USER MOD Single : A 144 GLN : amide:sc= -1.38 K(o=-1.4,f=-0.36) USER MOD Single : A 146 LYS NZ :NH3+ -127:sc= -0.159 (180deg=-1.06) USER MOD Single : A 148 LYS NZ :NH3+ 154:sc= -0.232 (180deg=-1.26!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 43 17.054 0.590 -3.991 1.00 0.00 N ATOM 2 CA GLY A 43 18.134 -0.436 -4.054 1.00 0.00 C ATOM 3 C GLY A 43 19.443 0.170 -3.546 1.00 0.00 C ATOM 4 O GLY A 43 20.440 0.189 -4.240 1.00 0.00 O ATOM 0 HA2 GLY A 43 17.863 -1.302 -3.450 1.00 0.00 H new ATOM 0 HA3 GLY A 43 18.257 -0.788 -5.078 1.00 0.00 H new ATOM 8 N SER A 44 19.449 0.665 -2.338 1.00 0.00 N ATOM 9 CA SER A 44 20.694 1.269 -1.786 1.00 0.00 C ATOM 10 C SER A 44 20.602 1.325 -0.260 1.00 0.00 C ATOM 11 O SER A 44 20.400 2.373 0.320 1.00 0.00 O ATOM 12 CB SER A 44 20.863 2.684 -2.339 1.00 0.00 C ATOM 13 OG SER A 44 19.881 3.533 -1.761 1.00 0.00 O ATOM 0 H SER A 44 18.645 0.677 -1.710 1.00 0.00 H new ATOM 0 HA SER A 44 21.551 0.661 -2.076 1.00 0.00 H new ATOM 0 HB2 SER A 44 21.862 3.058 -2.114 1.00 0.00 H new ATOM 0 HB3 SER A 44 20.762 2.677 -3.424 1.00 0.00 H new ATOM 0 HG SER A 44 20.069 3.647 -0.806 1.00 0.00 H new ATOM 19 N GLY A 45 20.748 0.206 0.395 1.00 0.00 N ATOM 20 CA GLY A 45 20.669 0.198 1.883 1.00 0.00 C ATOM 21 C GLY A 45 19.202 0.226 2.320 1.00 0.00 C ATOM 22 O GLY A 45 18.895 0.237 3.495 1.00 0.00 O ATOM 0 H GLY A 45 20.919 -0.703 -0.036 1.00 0.00 H new ATOM 0 HA2 GLY A 45 21.160 -0.691 2.278 1.00 0.00 H new ATOM 0 HA3 GLY A 45 21.197 1.061 2.290 1.00 0.00 H new ATOM 26 N VAL A 46 18.294 0.238 1.382 1.00 0.00 N ATOM 27 CA VAL A 46 16.849 0.265 1.744 1.00 0.00 C ATOM 28 C VAL A 46 16.414 -1.164 2.150 1.00 0.00 C ATOM 29 O VAL A 46 16.756 -2.101 1.457 1.00 0.00 O ATOM 30 CB VAL A 46 16.044 0.716 0.519 1.00 0.00 C ATOM 31 CG1 VAL A 46 14.564 0.863 0.884 1.00 0.00 C ATOM 32 CG2 VAL A 46 16.580 2.062 0.028 1.00 0.00 C ATOM 0 H VAL A 46 18.491 0.230 0.381 1.00 0.00 H new ATOM 0 HA VAL A 46 16.675 0.952 2.572 1.00 0.00 H new ATOM 0 HB VAL A 46 16.144 -0.032 -0.267 1.00 0.00 H new ATOM 0 HG11 VAL A 46 14.003 1.184 0.006 1.00 0.00 H new ATOM 0 HG12 VAL A 46 14.178 -0.095 1.231 1.00 0.00 H new ATOM 0 HG13 VAL A 46 14.456 1.606 1.675 1.00 0.00 H new ATOM 0 HG21 VAL A 46 16.010 2.385 -0.843 1.00 0.00 H new ATOM 0 HG22 VAL A 46 16.483 2.804 0.821 1.00 0.00 H new ATOM 0 HG23 VAL A 46 17.630 1.958 -0.244 1.00 0.00 H new ATOM 42 N PRO A 47 15.677 -1.323 3.243 1.00 0.00 N ATOM 43 CA PRO A 47 15.238 -2.669 3.661 1.00 0.00 C ATOM 44 C PRO A 47 14.434 -3.327 2.531 1.00 0.00 C ATOM 45 O PRO A 47 14.122 -2.707 1.533 1.00 0.00 O ATOM 46 CB PRO A 47 14.364 -2.437 4.919 1.00 0.00 C ATOM 47 CG PRO A 47 14.320 -0.903 5.180 1.00 0.00 C ATOM 48 CD PRO A 47 15.228 -0.225 4.130 1.00 0.00 C ATOM 0 HA PRO A 47 16.072 -3.336 3.880 1.00 0.00 H new ATOM 0 HB2 PRO A 47 13.359 -2.829 4.765 1.00 0.00 H new ATOM 0 HB3 PRO A 47 14.782 -2.961 5.779 1.00 0.00 H new ATOM 0 HG2 PRO A 47 13.299 -0.530 5.101 1.00 0.00 H new ATOM 0 HG3 PRO A 47 14.665 -0.676 6.189 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.684 0.536 3.571 1.00 0.00 H new ATOM 0 HD3 PRO A 47 16.075 0.271 4.603 1.00 0.00 H new ATOM 56 N ALA A 48 14.099 -4.580 2.679 1.00 0.00 N ATOM 57 CA ALA A 48 13.319 -5.278 1.617 1.00 0.00 C ATOM 58 C ALA A 48 11.833 -4.942 1.768 1.00 0.00 C ATOM 59 O ALA A 48 11.108 -4.835 0.799 1.00 0.00 O ATOM 60 CB ALA A 48 13.514 -6.789 1.751 1.00 0.00 C ATOM 0 H ALA A 48 14.332 -5.151 3.491 1.00 0.00 H new ATOM 0 HA ALA A 48 13.668 -4.951 0.638 1.00 0.00 H new ATOM 0 HB1 ALA A 48 12.944 -7.300 0.975 1.00 0.00 H new ATOM 0 HB2 ALA A 48 14.571 -7.030 1.643 1.00 0.00 H new ATOM 0 HB3 ALA A 48 13.166 -7.115 2.731 1.00 0.00 H new ATOM 66 N PHE A 49 11.375 -4.778 2.978 1.00 0.00 N ATOM 67 CA PHE A 49 9.936 -4.453 3.197 1.00 0.00 C ATOM 68 C PHE A 49 9.505 -3.329 2.250 1.00 0.00 C ATOM 69 O PHE A 49 8.549 -3.459 1.508 1.00 0.00 O ATOM 70 CB PHE A 49 9.734 -4.003 4.646 1.00 0.00 C ATOM 71 CG PHE A 49 8.263 -4.018 4.983 1.00 0.00 C ATOM 72 CD1 PHE A 49 7.668 -5.193 5.481 1.00 0.00 C ATOM 73 CD2 PHE A 49 7.487 -2.858 4.801 1.00 0.00 C ATOM 74 CE1 PHE A 49 6.296 -5.207 5.797 1.00 0.00 C ATOM 75 CE2 PHE A 49 6.115 -2.872 5.117 1.00 0.00 C ATOM 76 CZ PHE A 49 5.519 -4.047 5.615 1.00 0.00 C ATOM 0 H PHE A 49 11.936 -4.855 3.827 1.00 0.00 H new ATOM 0 HA PHE A 49 9.333 -5.339 2.998 1.00 0.00 H new ATOM 0 HB2 PHE A 49 10.278 -4.663 5.321 1.00 0.00 H new ATOM 0 HB3 PHE A 49 10.139 -3.001 4.785 1.00 0.00 H new ATOM 0 HD1 PHE A 49 8.264 -6.083 5.621 1.00 0.00 H new ATOM 0 HD2 PHE A 49 7.944 -1.957 4.419 1.00 0.00 H new ATOM 0 HE1 PHE A 49 5.839 -6.108 6.179 1.00 0.00 H new ATOM 0 HE2 PHE A 49 5.520 -1.982 4.978 1.00 0.00 H new ATOM 0 HZ PHE A 49 4.467 -4.058 5.857 1.00 0.00 H new ATOM 86 N LEU A 50 10.198 -2.225 2.270 1.00 0.00 N ATOM 87 CA LEU A 50 9.819 -1.097 1.375 1.00 0.00 C ATOM 88 C LEU A 50 10.260 -1.404 -0.058 1.00 0.00 C ATOM 89 O LEU A 50 9.474 -1.344 -0.982 1.00 0.00 O ATOM 90 CB LEU A 50 10.500 0.188 1.856 1.00 0.00 C ATOM 91 CG LEU A 50 9.913 0.615 3.215 1.00 0.00 C ATOM 92 CD1 LEU A 50 10.898 1.548 3.925 1.00 0.00 C ATOM 93 CD2 LEU A 50 8.580 1.355 3.018 1.00 0.00 C ATOM 0 H LEU A 50 11.008 -2.055 2.866 1.00 0.00 H new ATOM 0 HA LEU A 50 8.737 -0.966 1.398 1.00 0.00 H new ATOM 0 HB2 LEU A 50 11.574 0.028 1.948 1.00 0.00 H new ATOM 0 HB3 LEU A 50 10.358 0.982 1.123 1.00 0.00 H new ATOM 0 HG LEU A 50 9.740 -0.278 3.815 1.00 0.00 H new ATOM 0 HD11 LEU A 50 10.484 1.851 4.887 1.00 0.00 H new ATOM 0 HD12 LEU A 50 11.842 1.027 4.084 1.00 0.00 H new ATOM 0 HD13 LEU A 50 11.070 2.431 3.310 1.00 0.00 H new ATOM 0 HD21 LEU A 50 8.180 1.649 3.988 1.00 0.00 H new ATOM 0 HD22 LEU A 50 8.744 2.244 2.409 1.00 0.00 H new ATOM 0 HD23 LEU A 50 7.869 0.698 2.517 1.00 0.00 H new ATOM 105 N ALA A 51 11.507 -1.733 -0.252 1.00 0.00 N ATOM 106 CA ALA A 51 11.982 -2.041 -1.630 1.00 0.00 C ATOM 107 C ALA A 51 11.034 -3.052 -2.279 1.00 0.00 C ATOM 108 O ALA A 51 10.999 -3.199 -3.485 1.00 0.00 O ATOM 109 CB ALA A 51 13.397 -2.623 -1.566 1.00 0.00 C ATOM 0 H ALA A 51 12.214 -1.802 0.480 1.00 0.00 H new ATOM 0 HA ALA A 51 11.998 -1.128 -2.224 1.00 0.00 H new ATOM 0 HB1 ALA A 51 13.744 -2.848 -2.575 1.00 0.00 H new ATOM 0 HB2 ALA A 51 14.068 -1.898 -1.105 1.00 0.00 H new ATOM 0 HB3 ALA A 51 13.388 -3.538 -0.973 1.00 0.00 H new ATOM 115 N LYS A 52 10.260 -3.748 -1.489 1.00 0.00 N ATOM 116 CA LYS A 52 9.313 -4.744 -2.065 1.00 0.00 C ATOM 117 C LYS A 52 8.087 -4.009 -2.618 1.00 0.00 C ATOM 118 O LYS A 52 7.711 -4.190 -3.759 1.00 0.00 O ATOM 119 CB LYS A 52 8.882 -5.739 -0.974 1.00 0.00 C ATOM 120 CG LYS A 52 9.961 -6.825 -0.789 1.00 0.00 C ATOM 121 CD LYS A 52 9.738 -7.971 -1.785 1.00 0.00 C ATOM 122 CE LYS A 52 10.765 -9.076 -1.529 1.00 0.00 C ATOM 123 NZ LYS A 52 10.543 -10.192 -2.492 1.00 0.00 N ATOM 0 H LYS A 52 10.243 -3.669 -0.472 1.00 0.00 H new ATOM 0 HA LYS A 52 9.800 -5.293 -2.871 1.00 0.00 H new ATOM 0 HB2 LYS A 52 8.721 -5.212 -0.034 1.00 0.00 H new ATOM 0 HB3 LYS A 52 7.933 -6.201 -1.247 1.00 0.00 H new ATOM 0 HG2 LYS A 52 10.951 -6.393 -0.937 1.00 0.00 H new ATOM 0 HG3 LYS A 52 9.930 -7.209 0.231 1.00 0.00 H new ATOM 0 HD2 LYS A 52 8.728 -8.367 -1.680 1.00 0.00 H new ATOM 0 HD3 LYS A 52 9.831 -7.603 -2.807 1.00 0.00 H new ATOM 0 HE2 LYS A 52 11.775 -8.681 -1.639 1.00 0.00 H new ATOM 0 HE3 LYS A 52 10.675 -9.441 -0.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 11.241 -10.944 -2.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 9.584 -10.574 -2.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 10.649 -9.838 -3.464 1.00 0.00 H new ATOM 137 N LEU A 53 7.464 -3.171 -1.827 1.00 0.00 N ATOM 138 CA LEU A 53 6.270 -2.429 -2.333 1.00 0.00 C ATOM 139 C LEU A 53 6.608 -1.811 -3.692 1.00 0.00 C ATOM 140 O LEU A 53 5.745 -1.584 -4.516 1.00 0.00 O ATOM 141 CB LEU A 53 5.886 -1.314 -1.351 1.00 0.00 C ATOM 142 CG LEU A 53 5.441 -1.918 -0.006 1.00 0.00 C ATOM 143 CD1 LEU A 53 5.516 -0.850 1.090 1.00 0.00 C ATOM 144 CD2 LEU A 53 3.995 -2.426 -0.101 1.00 0.00 C ATOM 0 H LEU A 53 7.728 -2.970 -0.862 1.00 0.00 H new ATOM 0 HA LEU A 53 5.432 -3.119 -2.432 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.735 -0.648 -1.196 1.00 0.00 H new ATOM 0 HB3 LEU A 53 5.081 -0.711 -1.771 1.00 0.00 H new ATOM 0 HG LEU A 53 6.103 -2.750 0.235 1.00 0.00 H new ATOM 0 HD11 LEU A 53 5.200 -1.281 2.040 1.00 0.00 H new ATOM 0 HD12 LEU A 53 6.541 -0.490 1.178 1.00 0.00 H new ATOM 0 HD13 LEU A 53 4.860 -0.018 0.833 1.00 0.00 H new ATOM 0 HD21 LEU A 53 3.695 -2.850 0.857 1.00 0.00 H new ATOM 0 HD22 LEU A 53 3.334 -1.597 -0.354 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.928 -3.192 -0.874 1.00 0.00 H new ATOM 156 N TRP A 54 7.864 -1.548 -3.932 1.00 0.00 N ATOM 157 CA TRP A 54 8.268 -0.955 -5.237 1.00 0.00 C ATOM 158 C TRP A 54 8.185 -2.041 -6.317 1.00 0.00 C ATOM 159 O TRP A 54 7.632 -1.832 -7.378 1.00 0.00 O ATOM 160 CB TRP A 54 9.706 -0.421 -5.123 1.00 0.00 C ATOM 161 CG TRP A 54 10.281 -0.164 -6.482 1.00 0.00 C ATOM 162 CD1 TRP A 54 11.380 -0.777 -6.984 1.00 0.00 C ATOM 163 CD2 TRP A 54 9.814 0.752 -7.516 1.00 0.00 C ATOM 164 NE1 TRP A 54 11.618 -0.299 -8.260 1.00 0.00 N ATOM 165 CE2 TRP A 54 10.684 0.644 -8.637 1.00 0.00 C ATOM 166 CE3 TRP A 54 8.731 1.659 -7.595 1.00 0.00 C ATOM 167 CZ2 TRP A 54 10.486 1.409 -9.795 1.00 0.00 C ATOM 168 CZ3 TRP A 54 8.529 2.430 -8.760 1.00 0.00 C ATOM 169 CH2 TRP A 54 9.405 2.304 -9.857 1.00 0.00 C ATOM 0 H TRP A 54 8.628 -1.719 -3.279 1.00 0.00 H new ATOM 0 HA TRP A 54 7.606 -0.131 -5.504 1.00 0.00 H new ATOM 0 HB2 TRP A 54 9.713 0.499 -4.539 1.00 0.00 H new ATOM 0 HB3 TRP A 54 10.326 -1.141 -4.590 1.00 0.00 H new ATOM 0 HD1 TRP A 54 11.974 -1.519 -6.471 1.00 0.00 H new ATOM 0 HE1 TRP A 54 12.391 -0.606 -8.851 1.00 0.00 H new ATOM 0 HE3 TRP A 54 8.055 1.762 -6.759 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 11.160 1.311 -10.633 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 7.699 3.120 -8.811 1.00 0.00 H new ATOM 0 HH2 TRP A 54 9.245 2.896 -10.746 1.00 0.00 H new ATOM 180 N ARG A 55 8.729 -3.198 -6.051 1.00 0.00 N ATOM 181 CA ARG A 55 8.678 -4.297 -7.058 1.00 0.00 C ATOM 182 C ARG A 55 7.341 -5.032 -6.937 1.00 0.00 C ATOM 183 O ARG A 55 7.055 -5.949 -7.681 1.00 0.00 O ATOM 184 CB ARG A 55 9.829 -5.275 -6.804 1.00 0.00 C ATOM 185 CG ARG A 55 11.141 -4.657 -7.299 1.00 0.00 C ATOM 186 CD ARG A 55 12.282 -5.664 -7.138 1.00 0.00 C ATOM 187 NE ARG A 55 12.718 -5.696 -5.713 1.00 0.00 N ATOM 188 CZ ARG A 55 13.470 -6.672 -5.282 1.00 0.00 C ATOM 189 NH1 ARG A 55 13.837 -7.622 -6.099 1.00 0.00 N ATOM 190 NH2 ARG A 55 13.852 -6.699 -4.035 1.00 0.00 N ATOM 0 H ARG A 55 9.207 -3.430 -5.180 1.00 0.00 H new ATOM 0 HA ARG A 55 8.774 -3.881 -8.061 1.00 0.00 H new ATOM 0 HB2 ARG A 55 9.900 -5.502 -5.740 1.00 0.00 H new ATOM 0 HB3 ARG A 55 9.641 -6.217 -7.319 1.00 0.00 H new ATOM 0 HG2 ARG A 55 11.045 -4.367 -8.345 1.00 0.00 H new ATOM 0 HG3 ARG A 55 11.362 -3.750 -6.736 1.00 0.00 H new ATOM 0 HD2 ARG A 55 11.954 -6.655 -7.452 1.00 0.00 H new ATOM 0 HD3 ARG A 55 13.119 -5.388 -7.780 1.00 0.00 H new ATOM 0 HE ARG A 55 12.429 -4.955 -5.074 1.00 0.00 H new ATOM 0 HH11 ARG A 55 13.536 -7.601 -7.073 1.00 0.00 H new ATOM 0 HH12 ARG A 55 14.425 -8.385 -5.763 1.00 0.00 H new ATOM 0 HH21 ARG A 55 13.563 -5.958 -3.397 1.00 0.00 H new ATOM 0 HH22 ARG A 55 14.440 -7.462 -3.698 1.00 0.00 H new ATOM 204 N LEU A 56 6.515 -4.629 -6.006 1.00 0.00 N ATOM 205 CA LEU A 56 5.188 -5.294 -5.835 1.00 0.00 C ATOM 206 C LEU A 56 4.162 -4.595 -6.734 1.00 0.00 C ATOM 207 O LEU A 56 3.525 -5.212 -7.564 1.00 0.00 O ATOM 208 CB LEU A 56 4.756 -5.183 -4.362 1.00 0.00 C ATOM 209 CG LEU A 56 3.748 -6.287 -4.013 1.00 0.00 C ATOM 210 CD1 LEU A 56 3.444 -6.240 -2.513 1.00 0.00 C ATOM 211 CD2 LEU A 56 2.449 -6.081 -4.805 1.00 0.00 C ATOM 0 H LEU A 56 6.703 -3.866 -5.355 1.00 0.00 H new ATOM 0 HA LEU A 56 5.255 -6.346 -6.112 1.00 0.00 H new ATOM 0 HB2 LEU A 56 5.629 -5.261 -3.714 1.00 0.00 H new ATOM 0 HB3 LEU A 56 4.311 -4.205 -4.180 1.00 0.00 H new ATOM 0 HG LEU A 56 4.174 -7.256 -4.272 1.00 0.00 H new ATOM 0 HD11 LEU A 56 2.728 -7.023 -2.262 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.364 -6.396 -1.950 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.023 -5.268 -2.257 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.739 -6.869 -4.551 1.00 0.00 H new ATOM 0 HD22 LEU A 56 2.020 -5.111 -4.554 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.664 -6.117 -5.873 1.00 0.00 H new ATOM 223 N VAL A 57 4.003 -3.310 -6.574 1.00 0.00 N ATOM 224 CA VAL A 57 3.025 -2.565 -7.416 1.00 0.00 C ATOM 225 C VAL A 57 3.582 -2.402 -8.832 1.00 0.00 C ATOM 226 O VAL A 57 3.864 -1.307 -9.276 1.00 0.00 O ATOM 227 CB VAL A 57 2.781 -1.183 -6.804 1.00 0.00 C ATOM 228 CG1 VAL A 57 1.589 -0.518 -7.494 1.00 0.00 C ATOM 229 CG2 VAL A 57 2.487 -1.333 -5.309 1.00 0.00 C ATOM 0 H VAL A 57 4.510 -2.742 -5.895 1.00 0.00 H new ATOM 0 HA VAL A 57 2.088 -3.119 -7.459 1.00 0.00 H new ATOM 0 HB VAL A 57 3.668 -0.565 -6.941 1.00 0.00 H new ATOM 0 HG11 VAL A 57 1.418 0.465 -7.056 1.00 0.00 H new ATOM 0 HG12 VAL A 57 1.798 -0.410 -8.558 1.00 0.00 H new ATOM 0 HG13 VAL A 57 0.700 -1.135 -7.360 1.00 0.00 H new ATOM 0 HG21 VAL A 57 2.313 -0.350 -4.872 1.00 0.00 H new ATOM 0 HG22 VAL A 57 1.601 -1.953 -5.173 1.00 0.00 H new ATOM 0 HG23 VAL A 57 3.338 -1.804 -4.816 1.00 0.00 H new ATOM 239 N ASP A 58 3.740 -3.483 -9.549 1.00 0.00 N ATOM 240 CA ASP A 58 4.276 -3.385 -10.937 1.00 0.00 C ATOM 241 C ASP A 58 4.208 -4.758 -11.611 1.00 0.00 C ATOM 242 O ASP A 58 5.211 -5.308 -12.022 1.00 0.00 O ATOM 243 CB ASP A 58 5.730 -2.913 -10.892 1.00 0.00 C ATOM 244 CG ASP A 58 6.532 -3.821 -9.959 1.00 0.00 C ATOM 245 OD1 ASP A 58 5.936 -4.381 -9.054 1.00 0.00 O ATOM 246 OD2 ASP A 58 7.728 -3.940 -10.165 1.00 0.00 O ATOM 0 H ASP A 58 3.521 -4.428 -9.234 1.00 0.00 H new ATOM 0 HA ASP A 58 3.679 -2.671 -11.505 1.00 0.00 H new ATOM 0 HB2 ASP A 58 6.161 -2.931 -11.893 1.00 0.00 H new ATOM 0 HB3 ASP A 58 5.778 -1.882 -10.543 1.00 0.00 H new ATOM 251 N ASP A 59 3.034 -5.315 -11.730 1.00 0.00 N ATOM 252 CA ASP A 59 2.905 -6.650 -12.380 1.00 0.00 C ATOM 253 C ASP A 59 1.457 -6.853 -12.835 1.00 0.00 C ATOM 254 O ASP A 59 0.593 -6.045 -12.563 1.00 0.00 O ATOM 255 CB ASP A 59 3.291 -7.746 -11.384 1.00 0.00 C ATOM 256 CG ASP A 59 3.522 -9.060 -12.131 1.00 0.00 C ATOM 257 OD1 ASP A 59 4.620 -9.252 -12.628 1.00 0.00 O ATOM 258 OD2 ASP A 59 2.598 -9.854 -12.194 1.00 0.00 O ATOM 0 H ASP A 59 2.159 -4.904 -11.405 1.00 0.00 H new ATOM 0 HA ASP A 59 3.568 -6.701 -13.243 1.00 0.00 H new ATOM 0 HB2 ASP A 59 4.194 -7.459 -10.844 1.00 0.00 H new ATOM 0 HB3 ASP A 59 2.502 -7.872 -10.642 1.00 0.00 H new ATOM 263 N ALA A 60 1.187 -7.926 -13.530 1.00 0.00 N ATOM 264 CA ALA A 60 -0.205 -8.181 -14.009 1.00 0.00 C ATOM 265 C ALA A 60 -0.994 -8.934 -12.937 1.00 0.00 C ATOM 266 O ALA A 60 -2.001 -8.463 -12.446 1.00 0.00 O ATOM 267 CB ALA A 60 -0.155 -9.024 -15.284 1.00 0.00 C ATOM 0 H ALA A 60 1.870 -8.638 -13.787 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.694 -7.229 -14.214 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -1.169 -9.212 -15.636 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.403 -8.489 -16.053 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.338 -9.973 -15.073 1.00 0.00 H new ATOM 273 N ASP A 61 -0.549 -10.104 -12.576 1.00 0.00 N ATOM 274 CA ASP A 61 -1.275 -10.895 -11.542 1.00 0.00 C ATOM 275 C ASP A 61 -1.527 -10.030 -10.304 1.00 0.00 C ATOM 276 O ASP A 61 -2.347 -10.355 -9.469 1.00 0.00 O ATOM 277 CB ASP A 61 -0.432 -12.111 -11.149 1.00 0.00 C ATOM 278 CG ASP A 61 -1.299 -13.105 -10.374 1.00 0.00 C ATOM 279 OD1 ASP A 61 -1.716 -12.768 -9.279 1.00 0.00 O ATOM 280 OD2 ASP A 61 -1.530 -14.187 -10.890 1.00 0.00 O ATOM 0 H ASP A 61 0.288 -10.549 -12.953 1.00 0.00 H new ATOM 0 HA ASP A 61 -2.231 -11.225 -11.949 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -0.023 -12.587 -12.040 1.00 0.00 H new ATOM 0 HB3 ASP A 61 0.415 -11.798 -10.538 1.00 0.00 H new ATOM 285 N THR A 62 -0.828 -8.931 -10.177 1.00 0.00 N ATOM 286 CA THR A 62 -1.023 -8.040 -8.989 1.00 0.00 C ATOM 287 C THR A 62 -1.923 -6.861 -9.370 1.00 0.00 C ATOM 288 O THR A 62 -2.493 -6.208 -8.523 1.00 0.00 O ATOM 289 CB THR A 62 0.335 -7.504 -8.529 1.00 0.00 C ATOM 290 OG1 THR A 62 0.860 -6.637 -9.523 1.00 0.00 O ATOM 291 CG2 THR A 62 1.299 -8.671 -8.302 1.00 0.00 C ATOM 0 H THR A 62 -0.128 -8.610 -10.846 1.00 0.00 H new ATOM 0 HA THR A 62 -1.489 -8.610 -8.185 1.00 0.00 H new ATOM 0 HB THR A 62 0.212 -6.954 -7.596 1.00 0.00 H new ATOM 0 HG1 THR A 62 1.729 -6.291 -9.230 1.00 0.00 H new ATOM 0 HG21 THR A 62 2.265 -8.287 -7.975 1.00 0.00 H new ATOM 0 HG22 THR A 62 0.894 -9.334 -7.537 1.00 0.00 H new ATOM 0 HG23 THR A 62 1.425 -9.225 -9.232 1.00 0.00 H new ATOM 299 N ASN A 63 -2.050 -6.580 -10.640 1.00 0.00 N ATOM 300 CA ASN A 63 -2.909 -5.437 -11.072 1.00 0.00 C ATOM 301 C ASN A 63 -4.330 -5.618 -10.529 1.00 0.00 C ATOM 302 O ASN A 63 -5.100 -4.681 -10.453 1.00 0.00 O ATOM 303 CB ASN A 63 -2.950 -5.383 -12.604 1.00 0.00 C ATOM 304 CG ASN A 63 -1.642 -4.792 -13.134 1.00 0.00 C ATOM 305 OD1 ASN A 63 -0.884 -4.200 -12.390 1.00 0.00 O ATOM 306 ND2 ASN A 63 -1.344 -4.926 -14.397 1.00 0.00 N ATOM 0 H ASN A 63 -1.597 -7.092 -11.397 1.00 0.00 H new ATOM 0 HA ASN A 63 -2.493 -4.508 -10.683 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -3.099 -6.384 -13.009 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -3.794 -4.777 -12.934 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -0.475 -4.534 -14.760 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -1.980 -5.423 -15.021 1.00 0.00 H new ATOM 313 N ARG A 64 -4.687 -6.816 -10.157 1.00 0.00 N ATOM 314 CA ARG A 64 -6.060 -7.063 -9.625 1.00 0.00 C ATOM 315 C ARG A 64 -6.097 -6.735 -8.130 1.00 0.00 C ATOM 316 O ARG A 64 -6.944 -5.998 -7.664 1.00 0.00 O ATOM 317 CB ARG A 64 -6.419 -8.550 -9.857 1.00 0.00 C ATOM 318 CG ARG A 64 -7.427 -9.057 -8.799 1.00 0.00 C ATOM 319 CD ARG A 64 -8.225 -10.236 -9.363 1.00 0.00 C ATOM 320 NE ARG A 64 -7.296 -11.353 -9.696 1.00 0.00 N ATOM 321 CZ ARG A 64 -7.767 -12.550 -9.912 1.00 0.00 C ATOM 322 NH1 ARG A 64 -9.050 -12.771 -9.833 1.00 0.00 N ATOM 323 NH2 ARG A 64 -6.953 -13.527 -10.207 1.00 0.00 N ATOM 0 H ARG A 64 -4.086 -7.639 -10.198 1.00 0.00 H new ATOM 0 HA ARG A 64 -6.783 -6.429 -10.138 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.842 -8.673 -10.854 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -5.513 -9.155 -9.819 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -6.897 -9.363 -7.897 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -8.104 -8.252 -8.513 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -8.965 -10.569 -8.635 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -8.771 -9.926 -10.254 1.00 0.00 H new ATOM 0 HE ARG A 64 -6.292 -11.181 -9.755 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -9.686 -12.007 -9.602 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -9.418 -13.707 -10.002 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -5.950 -13.354 -10.268 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.320 -14.463 -10.376 1.00 0.00 H new ATOM 337 N LEU A 65 -5.217 -7.315 -7.374 1.00 0.00 N ATOM 338 CA LEU A 65 -5.225 -7.086 -5.906 1.00 0.00 C ATOM 339 C LEU A 65 -4.572 -5.740 -5.573 1.00 0.00 C ATOM 340 O LEU A 65 -4.749 -5.209 -4.494 1.00 0.00 O ATOM 341 CB LEU A 65 -4.454 -8.218 -5.215 1.00 0.00 C ATOM 342 CG LEU A 65 -4.835 -9.590 -5.799 1.00 0.00 C ATOM 343 CD1 LEU A 65 -3.811 -10.633 -5.351 1.00 0.00 C ATOM 344 CD2 LEU A 65 -6.220 -10.012 -5.296 1.00 0.00 C ATOM 0 H LEU A 65 -4.486 -7.943 -7.710 1.00 0.00 H new ATOM 0 HA LEU A 65 -6.256 -7.071 -5.552 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.383 -8.055 -5.332 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -4.664 -8.204 -4.146 1.00 0.00 H new ATOM 0 HG LEU A 65 -4.850 -9.518 -6.887 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.078 -11.606 -5.763 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -2.821 -10.348 -5.707 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -3.802 -10.690 -4.263 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -6.479 -10.984 -5.716 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -6.207 -10.078 -4.208 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -6.960 -9.274 -5.606 1.00 0.00 H new ATOM 356 N ILE A 66 -3.822 -5.180 -6.480 1.00 0.00 N ATOM 357 CA ILE A 66 -3.171 -3.867 -6.197 1.00 0.00 C ATOM 358 C ILE A 66 -2.765 -3.200 -7.513 1.00 0.00 C ATOM 359 O ILE A 66 -2.330 -3.851 -8.441 1.00 0.00 O ATOM 360 CB ILE A 66 -1.930 -4.092 -5.326 1.00 0.00 C ATOM 361 CG1 ILE A 66 -1.243 -2.738 -5.046 1.00 0.00 C ATOM 362 CG2 ILE A 66 -0.964 -5.031 -6.058 1.00 0.00 C ATOM 363 CD1 ILE A 66 -0.380 -2.841 -3.781 1.00 0.00 C ATOM 0 H ILE A 66 -3.631 -5.571 -7.402 1.00 0.00 H new ATOM 0 HA ILE A 66 -3.871 -3.220 -5.669 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.221 -4.543 -4.378 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -0.624 -2.452 -5.896 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.994 -1.958 -4.922 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -0.079 -5.194 -5.443 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.456 -5.985 -6.246 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -0.669 -4.582 -7.006 1.00 0.00 H new ATOM 0 HD11 ILE A 66 0.101 -1.882 -3.590 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -1.010 -3.107 -2.932 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.382 -3.608 -3.922 1.00 0.00 H new ATOM 375 N CYS A 67 -2.901 -1.903 -7.602 1.00 0.00 N ATOM 376 CA CYS A 67 -2.522 -1.194 -8.861 1.00 0.00 C ATOM 377 C CYS A 67 -2.152 0.257 -8.542 1.00 0.00 C ATOM 378 O CYS A 67 -2.303 0.715 -7.427 1.00 0.00 O ATOM 379 CB CYS A 67 -3.703 -1.215 -9.832 1.00 0.00 C ATOM 380 SG CYS A 67 -5.084 -0.283 -9.124 1.00 0.00 S ATOM 0 H CYS A 67 -3.258 -1.304 -6.858 1.00 0.00 H new ATOM 0 HA CYS A 67 -1.667 -1.695 -9.315 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -3.409 -0.781 -10.788 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -4.007 -2.243 -10.029 1.00 0.00 H new ATOM 0 HG CYS A 67 -6.087 -0.299 -9.951 1.00 0.00 H new ATOM 386 N TRP A 68 -1.665 0.981 -9.513 1.00 0.00 N ATOM 387 CA TRP A 68 -1.282 2.402 -9.267 1.00 0.00 C ATOM 388 C TRP A 68 -2.527 3.289 -9.337 1.00 0.00 C ATOM 389 O TRP A 68 -3.466 3.005 -10.053 1.00 0.00 O ATOM 390 CB TRP A 68 -0.279 2.851 -10.333 1.00 0.00 C ATOM 391 CG TRP A 68 1.049 2.217 -10.071 1.00 0.00 C ATOM 392 CD1 TRP A 68 1.497 1.081 -10.655 1.00 0.00 C ATOM 393 CD2 TRP A 68 2.106 2.661 -9.172 1.00 0.00 C ATOM 394 NE1 TRP A 68 2.763 0.797 -10.172 1.00 0.00 N ATOM 395 CE2 TRP A 68 3.185 1.739 -9.255 1.00 0.00 C ATOM 396 CE3 TRP A 68 2.236 3.765 -8.297 1.00 0.00 C ATOM 397 CZ2 TRP A 68 4.353 1.907 -8.497 1.00 0.00 C ATOM 398 CZ3 TRP A 68 3.409 3.937 -7.533 1.00 0.00 C ATOM 399 CH2 TRP A 68 4.466 3.009 -7.633 1.00 0.00 C ATOM 0 H TRP A 68 -1.516 0.650 -10.466 1.00 0.00 H new ATOM 0 HA TRP A 68 -0.830 2.489 -8.279 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -0.637 2.572 -11.324 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -0.183 3.937 -10.322 1.00 0.00 H new ATOM 0 HD1 TRP A 68 0.955 0.492 -11.380 1.00 0.00 H new ATOM 0 HE1 TRP A 68 3.317 -0.010 -10.459 1.00 0.00 H new ATOM 0 HE3 TRP A 68 1.432 4.481 -8.213 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 5.160 1.194 -8.577 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 3.498 4.783 -6.868 1.00 0.00 H new ATOM 0 HH2 TRP A 68 5.362 3.145 -7.046 1.00 0.00 H new ATOM 410 N THR A 69 -2.540 4.367 -8.595 1.00 0.00 N ATOM 411 CA THR A 69 -3.720 5.284 -8.608 1.00 0.00 C ATOM 412 C THR A 69 -3.445 6.457 -9.551 1.00 0.00 C ATOM 413 O THR A 69 -2.320 6.887 -9.712 1.00 0.00 O ATOM 414 CB THR A 69 -3.961 5.818 -7.193 1.00 0.00 C ATOM 415 OG1 THR A 69 -3.032 6.859 -6.919 1.00 0.00 O ATOM 416 CG2 THR A 69 -3.776 4.688 -6.180 1.00 0.00 C ATOM 0 H THR A 69 -1.780 4.653 -7.978 1.00 0.00 H new ATOM 0 HA THR A 69 -4.600 4.740 -8.951 1.00 0.00 H new ATOM 0 HB THR A 69 -4.977 6.206 -7.118 1.00 0.00 H new ATOM 0 HG1 THR A 69 -3.366 7.410 -6.181 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.948 5.070 -5.174 1.00 0.00 H new ATOM 0 HG22 THR A 69 -4.487 3.890 -6.392 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.761 4.298 -6.252 1.00 0.00 H new ATOM 424 N LYS A 70 -4.466 6.983 -10.172 1.00 0.00 N ATOM 425 CA LYS A 70 -4.266 8.131 -11.101 1.00 0.00 C ATOM 426 C LYS A 70 -3.105 7.829 -12.052 1.00 0.00 C ATOM 427 O LYS A 70 -3.012 6.754 -12.611 1.00 0.00 O ATOM 428 CB LYS A 70 -3.948 9.392 -10.293 1.00 0.00 C ATOM 429 CG LYS A 70 -4.920 9.501 -9.116 1.00 0.00 C ATOM 430 CD LYS A 70 -4.812 10.894 -8.491 1.00 0.00 C ATOM 431 CE LYS A 70 -5.513 10.899 -7.131 1.00 0.00 C ATOM 432 NZ LYS A 70 -6.805 10.164 -7.234 1.00 0.00 N ATOM 0 H LYS A 70 -5.431 6.667 -10.076 1.00 0.00 H new ATOM 0 HA LYS A 70 -5.176 8.288 -11.680 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -2.921 9.354 -9.929 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -4.029 10.274 -10.928 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -5.940 9.321 -9.455 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.693 8.738 -8.371 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -3.764 11.171 -8.373 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -5.266 11.635 -9.149 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.876 10.432 -6.380 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -5.691 11.924 -6.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -7.427 10.443 -6.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -7.265 10.395 -8.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -6.627 9.140 -7.188 1.00 0.00 H new ATOM 446 N ASP A 71 -2.220 8.770 -12.241 1.00 0.00 N ATOM 447 CA ASP A 71 -1.066 8.540 -13.158 1.00 0.00 C ATOM 448 C ASP A 71 0.028 7.761 -12.423 1.00 0.00 C ATOM 449 O ASP A 71 0.691 6.918 -12.994 1.00 0.00 O ATOM 450 CB ASP A 71 -0.508 9.886 -13.622 1.00 0.00 C ATOM 451 CG ASP A 71 -1.497 10.547 -14.584 1.00 0.00 C ATOM 452 OD1 ASP A 71 -1.827 9.926 -15.581 1.00 0.00 O ATOM 453 OD2 ASP A 71 -1.908 11.661 -14.308 1.00 0.00 O ATOM 0 H ASP A 71 -2.246 9.689 -11.800 1.00 0.00 H new ATOM 0 HA ASP A 71 -1.400 7.966 -14.022 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.332 10.534 -12.763 1.00 0.00 H new ATOM 0 HB3 ASP A 71 0.453 9.742 -14.115 1.00 0.00 H new ATOM 458 N GLY A 72 0.223 8.037 -11.162 1.00 0.00 N ATOM 459 CA GLY A 72 1.277 7.313 -10.395 1.00 0.00 C ATOM 460 C GLY A 72 1.678 8.140 -9.174 1.00 0.00 C ATOM 461 O GLY A 72 2.696 8.804 -9.169 1.00 0.00 O ATOM 0 H GLY A 72 -0.301 8.732 -10.630 1.00 0.00 H new ATOM 0 HA2 GLY A 72 0.907 6.337 -10.081 1.00 0.00 H new ATOM 0 HA3 GLY A 72 2.146 7.136 -11.029 1.00 0.00 H new ATOM 465 N GLN A 73 0.883 8.109 -8.137 1.00 0.00 N ATOM 466 CA GLN A 73 1.210 8.895 -6.908 1.00 0.00 C ATOM 467 C GLN A 73 0.793 8.098 -5.671 1.00 0.00 C ATOM 468 O GLN A 73 0.756 8.615 -4.573 1.00 0.00 O ATOM 469 CB GLN A 73 0.445 10.221 -6.938 1.00 0.00 C ATOM 470 CG GLN A 73 0.923 11.061 -8.124 1.00 0.00 C ATOM 471 CD GLN A 73 0.226 12.422 -8.101 1.00 0.00 C ATOM 472 OE1 GLN A 73 -0.468 12.746 -7.157 1.00 0.00 O ATOM 473 NE2 GLN A 73 0.380 13.238 -9.107 1.00 0.00 N ATOM 0 H GLN A 73 0.018 7.571 -8.087 1.00 0.00 H new ATOM 0 HA GLN A 73 2.282 9.091 -6.872 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -0.626 10.033 -7.020 1.00 0.00 H new ATOM 0 HB3 GLN A 73 0.603 10.765 -6.007 1.00 0.00 H new ATOM 0 HG2 GLN A 73 2.004 11.194 -8.077 1.00 0.00 H new ATOM 0 HG3 GLN A 73 0.706 10.545 -9.059 1.00 0.00 H new ATOM 0 HE21 GLN A 73 0.962 12.967 -9.899 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -0.082 14.147 -9.101 1.00 0.00 H new ATOM 482 N SER A 74 0.479 6.842 -5.840 1.00 0.00 N ATOM 483 CA SER A 74 0.062 6.010 -4.676 1.00 0.00 C ATOM 484 C SER A 74 -0.365 4.626 -5.172 1.00 0.00 C ATOM 485 O SER A 74 -0.209 4.304 -6.334 1.00 0.00 O ATOM 486 CB SER A 74 -1.108 6.696 -3.964 1.00 0.00 C ATOM 487 OG SER A 74 -1.912 5.721 -3.314 1.00 0.00 O ATOM 0 H SER A 74 0.493 6.356 -6.736 1.00 0.00 H new ATOM 0 HA SER A 74 0.893 5.899 -3.979 1.00 0.00 H new ATOM 0 HB2 SER A 74 -0.732 7.415 -3.236 1.00 0.00 H new ATOM 0 HB3 SER A 74 -1.707 7.254 -4.683 1.00 0.00 H new ATOM 0 HG SER A 74 -1.866 5.853 -2.344 1.00 0.00 H new ATOM 493 N PHE A 75 -0.897 3.799 -4.305 1.00 0.00 N ATOM 494 CA PHE A 75 -1.327 2.430 -4.735 1.00 0.00 C ATOM 495 C PHE A 75 -2.633 2.056 -4.031 1.00 0.00 C ATOM 496 O PHE A 75 -2.745 2.138 -2.824 1.00 0.00 O ATOM 497 CB PHE A 75 -0.243 1.417 -4.362 1.00 0.00 C ATOM 498 CG PHE A 75 0.010 1.477 -2.876 1.00 0.00 C ATOM 499 CD1 PHE A 75 0.873 2.456 -2.348 1.00 0.00 C ATOM 500 CD2 PHE A 75 -0.615 0.554 -2.016 1.00 0.00 C ATOM 501 CE1 PHE A 75 1.109 2.513 -0.960 1.00 0.00 C ATOM 502 CE2 PHE A 75 -0.379 0.610 -0.630 1.00 0.00 C ATOM 503 CZ PHE A 75 0.483 1.589 -0.102 1.00 0.00 C ATOM 0 H PHE A 75 -1.052 4.012 -3.320 1.00 0.00 H new ATOM 0 HA PHE A 75 -1.482 2.422 -5.814 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -0.555 0.413 -4.649 1.00 0.00 H new ATOM 0 HB3 PHE A 75 0.676 1.634 -4.907 1.00 0.00 H new ATOM 0 HD1 PHE A 75 1.354 3.164 -3.007 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -1.276 -0.198 -2.421 1.00 0.00 H new ATOM 0 HE1 PHE A 75 1.770 3.265 -0.555 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -0.859 -0.098 0.029 1.00 0.00 H new ATOM 0 HZ PHE A 75 0.664 1.632 0.962 1.00 0.00 H new ATOM 513 N VAL A 76 -3.624 1.640 -4.781 1.00 0.00 N ATOM 514 CA VAL A 76 -4.933 1.251 -4.169 1.00 0.00 C ATOM 515 C VAL A 76 -5.020 -0.270 -4.070 1.00 0.00 C ATOM 516 O VAL A 76 -4.263 -0.990 -4.691 1.00 0.00 O ATOM 517 CB VAL A 76 -6.083 1.767 -5.039 1.00 0.00 C ATOM 518 CG1 VAL A 76 -5.893 1.295 -6.483 1.00 0.00 C ATOM 519 CG2 VAL A 76 -7.420 1.237 -4.503 1.00 0.00 C ATOM 0 H VAL A 76 -3.582 1.553 -5.796 1.00 0.00 H new ATOM 0 HA VAL A 76 -5.006 1.687 -3.173 1.00 0.00 H new ATOM 0 HB VAL A 76 -6.087 2.857 -5.011 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -6.714 1.665 -7.098 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -4.949 1.678 -6.870 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -5.881 0.205 -6.511 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -8.234 1.607 -5.126 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -7.414 0.147 -4.524 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -7.563 1.579 -3.478 1.00 0.00 H new ATOM 529 N ILE A 77 -5.946 -0.756 -3.291 1.00 0.00 N ATOM 530 CA ILE A 77 -6.124 -2.234 -3.124 1.00 0.00 C ATOM 531 C ILE A 77 -7.606 -2.570 -3.304 1.00 0.00 C ATOM 532 O ILE A 77 -8.369 -2.591 -2.358 1.00 0.00 O ATOM 533 CB ILE A 77 -5.674 -2.647 -1.714 1.00 0.00 C ATOM 534 CG1 ILE A 77 -4.159 -2.375 -1.539 1.00 0.00 C ATOM 535 CG2 ILE A 77 -5.960 -4.141 -1.508 1.00 0.00 C ATOM 536 CD1 ILE A 77 -3.844 -2.095 -0.064 1.00 0.00 C ATOM 0 H ILE A 77 -6.599 -0.186 -2.753 1.00 0.00 H new ATOM 0 HA ILE A 77 -5.527 -2.769 -3.863 1.00 0.00 H new ATOM 0 HB ILE A 77 -6.224 -2.064 -0.975 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.584 -3.234 -1.886 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.861 -1.524 -2.151 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -5.642 -4.438 -0.509 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -7.029 -4.326 -1.619 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.413 -4.722 -2.250 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.777 -1.905 0.050 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -4.406 -1.222 0.269 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -4.125 -2.959 0.538 1.00 0.00 H new ATOM 548 N GLN A 78 -8.022 -2.818 -4.516 1.00 0.00 N ATOM 549 CA GLN A 78 -9.457 -3.136 -4.766 1.00 0.00 C ATOM 550 C GLN A 78 -9.859 -4.396 -3.997 1.00 0.00 C ATOM 551 O GLN A 78 -10.849 -4.415 -3.293 1.00 0.00 O ATOM 552 CB GLN A 78 -9.671 -3.364 -6.264 1.00 0.00 C ATOM 553 CG GLN A 78 -9.065 -2.199 -7.050 1.00 0.00 C ATOM 554 CD GLN A 78 -9.275 -2.429 -8.548 1.00 0.00 C ATOM 555 OE1 GLN A 78 -10.094 -1.777 -9.164 1.00 0.00 O ATOM 556 NE2 GLN A 78 -8.565 -3.335 -9.163 1.00 0.00 N ATOM 0 H GLN A 78 -7.429 -2.814 -5.346 1.00 0.00 H new ATOM 0 HA GLN A 78 -10.072 -2.302 -4.427 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -9.208 -4.302 -6.569 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -10.736 -3.448 -6.481 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -9.530 -1.261 -6.747 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -8.001 -2.113 -6.830 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -7.877 -3.882 -8.645 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -8.698 -3.496 -10.161 1.00 0.00 H new ATOM 565 N ASN A 79 -9.108 -5.451 -4.134 1.00 0.00 N ATOM 566 CA ASN A 79 -9.457 -6.712 -3.419 1.00 0.00 C ATOM 567 C ASN A 79 -9.002 -6.633 -1.961 1.00 0.00 C ATOM 568 O ASN A 79 -7.824 -6.588 -1.671 1.00 0.00 O ATOM 569 CB ASN A 79 -8.759 -7.890 -4.103 1.00 0.00 C ATOM 570 CG ASN A 79 -9.376 -9.202 -3.617 1.00 0.00 C ATOM 571 OD1 ASN A 79 -8.670 -10.151 -3.337 1.00 0.00 O ATOM 572 ND2 ASN A 79 -10.672 -9.298 -3.503 1.00 0.00 N ATOM 0 H ASN A 79 -8.267 -5.496 -4.710 1.00 0.00 H new ATOM 0 HA ASN A 79 -10.538 -6.852 -3.448 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -8.860 -7.807 -5.185 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -7.692 -7.873 -3.880 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -11.092 -10.169 -3.179 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -11.265 -8.502 -3.738 1.00 0.00 H new ATOM 579 N GLN A 80 -9.931 -6.631 -1.038 1.00 0.00 N ATOM 580 CA GLN A 80 -9.567 -6.574 0.413 1.00 0.00 C ATOM 581 C GLN A 80 -9.688 -7.983 1.002 1.00 0.00 C ATOM 582 O GLN A 80 -10.166 -8.173 2.103 1.00 0.00 O ATOM 583 CB GLN A 80 -10.522 -5.621 1.143 1.00 0.00 C ATOM 584 CG GLN A 80 -9.921 -5.216 2.492 1.00 0.00 C ATOM 585 CD GLN A 80 -10.991 -4.530 3.342 1.00 0.00 C ATOM 586 OE1 GLN A 80 -11.750 -5.184 4.029 1.00 0.00 O ATOM 587 NE2 GLN A 80 -11.085 -3.228 3.326 1.00 0.00 N ATOM 0 H GLN A 80 -10.933 -6.667 -1.228 1.00 0.00 H new ATOM 0 HA GLN A 80 -8.546 -6.210 0.531 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -10.702 -4.735 0.534 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -11.487 -6.105 1.295 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -9.538 -6.095 3.010 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -9.077 -4.544 2.339 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -10.448 -2.678 2.750 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -11.795 -2.761 3.890 1.00 0.00 H new ATOM 596 N ALA A 81 -9.258 -8.974 0.266 1.00 0.00 N ATOM 597 CA ALA A 81 -9.338 -10.379 0.759 1.00 0.00 C ATOM 598 C ALA A 81 -8.196 -11.185 0.148 1.00 0.00 C ATOM 599 O ALA A 81 -7.235 -11.523 0.810 1.00 0.00 O ATOM 600 CB ALA A 81 -10.671 -10.999 0.334 1.00 0.00 C ATOM 0 H ALA A 81 -8.851 -8.868 -0.663 1.00 0.00 H new ATOM 0 HA ALA A 81 -9.264 -10.388 1.846 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -10.726 -12.026 0.696 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -11.493 -10.420 0.757 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -10.745 -10.993 -0.753 1.00 0.00 H new ATOM 606 N GLN A 82 -8.294 -11.492 -1.114 1.00 0.00 N ATOM 607 CA GLN A 82 -7.213 -12.274 -1.773 1.00 0.00 C ATOM 608 C GLN A 82 -5.971 -11.385 -1.894 1.00 0.00 C ATOM 609 O GLN A 82 -4.988 -11.749 -2.506 1.00 0.00 O ATOM 610 CB GLN A 82 -7.701 -12.747 -3.163 1.00 0.00 C ATOM 611 CG GLN A 82 -7.483 -14.257 -3.315 1.00 0.00 C ATOM 612 CD GLN A 82 -7.661 -14.662 -4.778 1.00 0.00 C ATOM 613 OE1 GLN A 82 -8.038 -13.854 -5.604 1.00 0.00 O ATOM 614 NE2 GLN A 82 -7.402 -15.890 -5.138 1.00 0.00 N ATOM 0 H GLN A 82 -9.075 -11.235 -1.717 1.00 0.00 H new ATOM 0 HA GLN A 82 -6.958 -13.155 -1.184 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -8.758 -12.511 -3.285 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -7.163 -12.214 -3.946 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -6.483 -14.525 -2.973 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -8.191 -14.801 -2.689 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -7.086 -16.569 -4.445 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -7.516 -16.171 -6.112 1.00 0.00 H new ATOM 623 N PHE A 83 -6.016 -10.224 -1.301 1.00 0.00 N ATOM 624 CA PHE A 83 -4.848 -9.299 -1.358 1.00 0.00 C ATOM 625 C PHE A 83 -3.922 -9.604 -0.178 1.00 0.00 C ATOM 626 O PHE A 83 -2.921 -8.946 0.023 1.00 0.00 O ATOM 627 CB PHE A 83 -5.361 -7.848 -1.282 1.00 0.00 C ATOM 628 CG PHE A 83 -4.241 -6.902 -0.903 1.00 0.00 C ATOM 629 CD1 PHE A 83 -3.304 -6.481 -1.869 1.00 0.00 C ATOM 630 CD2 PHE A 83 -4.132 -6.453 0.424 1.00 0.00 C ATOM 631 CE1 PHE A 83 -2.259 -5.612 -1.502 1.00 0.00 C ATOM 632 CE2 PHE A 83 -3.089 -5.581 0.791 1.00 0.00 C ATOM 633 CZ PHE A 83 -2.152 -5.162 -0.171 1.00 0.00 C ATOM 0 H PHE A 83 -6.817 -9.874 -0.776 1.00 0.00 H new ATOM 0 HA PHE A 83 -4.294 -9.431 -2.288 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -5.781 -7.555 -2.244 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -6.165 -7.779 -0.549 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -3.388 -6.825 -2.889 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -4.849 -6.777 1.164 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -1.540 -5.290 -2.240 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -3.008 -5.234 1.811 1.00 0.00 H new ATOM 0 HZ PHE A 83 -1.350 -4.495 0.111 1.00 0.00 H new ATOM 643 N ALA A 84 -4.252 -10.606 0.600 1.00 0.00 N ATOM 644 CA ALA A 84 -3.401 -10.972 1.775 1.00 0.00 C ATOM 645 C ALA A 84 -2.953 -12.426 1.654 1.00 0.00 C ATOM 646 O ALA A 84 -1.779 -12.723 1.685 1.00 0.00 O ATOM 647 CB ALA A 84 -4.212 -10.793 3.061 1.00 0.00 C ATOM 0 H ALA A 84 -5.079 -11.189 0.471 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.523 -10.327 1.802 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.596 -11.059 3.920 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -4.529 -9.754 3.149 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -5.090 -11.439 3.031 1.00 0.00 H new ATOM 653 N LYS A 85 -3.871 -13.337 1.526 1.00 0.00 N ATOM 654 CA LYS A 85 -3.484 -14.769 1.419 1.00 0.00 C ATOM 655 C LYS A 85 -2.724 -15.026 0.111 1.00 0.00 C ATOM 656 O LYS A 85 -2.715 -16.132 -0.392 1.00 0.00 O ATOM 657 CB LYS A 85 -4.749 -15.640 1.449 1.00 0.00 C ATOM 658 CG LYS A 85 -4.383 -17.100 1.814 1.00 0.00 C ATOM 659 CD LYS A 85 -5.306 -18.087 1.071 1.00 0.00 C ATOM 660 CE LYS A 85 -4.759 -18.353 -0.335 1.00 0.00 C ATOM 661 NZ LYS A 85 -5.627 -19.347 -1.026 1.00 0.00 N ATOM 0 H LYS A 85 -4.874 -13.153 1.491 1.00 0.00 H new ATOM 0 HA LYS A 85 -2.835 -15.021 2.258 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -5.457 -15.242 2.176 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -5.242 -15.613 0.477 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -3.343 -17.297 1.553 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -4.474 -17.246 2.890 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.376 -19.022 1.627 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.314 -17.678 1.007 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -4.726 -17.425 -0.905 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -3.737 -18.727 -0.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -5.256 -19.528 -1.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -5.637 -20.235 -0.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -6.595 -18.973 -1.096 1.00 0.00 H new ATOM 675 N GLU A 86 -2.089 -14.031 -0.457 1.00 0.00 N ATOM 676 CA GLU A 86 -1.355 -14.278 -1.730 1.00 0.00 C ATOM 677 C GLU A 86 -0.309 -13.180 -1.995 1.00 0.00 C ATOM 678 O GLU A 86 0.308 -13.160 -3.040 1.00 0.00 O ATOM 679 CB GLU A 86 -2.370 -14.314 -2.882 1.00 0.00 C ATOM 680 CG GLU A 86 -1.807 -15.132 -4.044 1.00 0.00 C ATOM 681 CD GLU A 86 -2.799 -15.121 -5.208 1.00 0.00 C ATOM 682 OE1 GLU A 86 -3.793 -15.824 -5.121 1.00 0.00 O ATOM 683 OE2 GLU A 86 -2.549 -14.410 -6.167 1.00 0.00 O ATOM 0 H GLU A 86 -2.048 -13.076 -0.100 1.00 0.00 H new ATOM 0 HA GLU A 86 -0.828 -15.229 -1.654 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -3.308 -14.751 -2.539 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -2.593 -13.300 -3.214 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -0.851 -14.718 -4.364 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -1.619 -16.157 -3.723 1.00 0.00 H new ATOM 690 N LEU A 87 -0.099 -12.262 -1.078 1.00 0.00 N ATOM 691 CA LEU A 87 0.914 -11.180 -1.331 1.00 0.00 C ATOM 692 C LEU A 87 1.659 -10.809 -0.041 1.00 0.00 C ATOM 693 O LEU A 87 2.551 -9.985 -0.068 1.00 0.00 O ATOM 694 CB LEU A 87 0.208 -9.930 -1.871 1.00 0.00 C ATOM 695 CG LEU A 87 -0.271 -10.156 -3.314 1.00 0.00 C ATOM 696 CD1 LEU A 87 -1.108 -8.950 -3.748 1.00 0.00 C ATOM 697 CD2 LEU A 87 0.935 -10.325 -4.267 1.00 0.00 C ATOM 0 H LEU A 87 -0.576 -12.213 -0.178 1.00 0.00 H new ATOM 0 HA LEU A 87 1.634 -11.554 -2.059 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -0.642 -9.683 -1.235 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.888 -9.079 -1.838 1.00 0.00 H new ATOM 0 HG LEU A 87 -0.871 -11.065 -3.357 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.455 -9.097 -4.771 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -1.967 -8.846 -3.085 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -0.499 -8.047 -3.697 1.00 0.00 H new ATOM 0 HD21 LEU A 87 0.576 -10.484 -5.284 1.00 0.00 H new ATOM 0 HD22 LEU A 87 1.552 -9.427 -4.236 1.00 0.00 H new ATOM 0 HD23 LEU A 87 1.529 -11.184 -3.954 1.00 0.00 H new ATOM 709 N LEU A 88 1.306 -11.391 1.083 1.00 0.00 N ATOM 710 CA LEU A 88 2.006 -11.050 2.373 1.00 0.00 C ATOM 711 C LEU A 88 2.832 -12.236 2.934 1.00 0.00 C ATOM 712 O LEU A 88 3.844 -11.996 3.562 1.00 0.00 O ATOM 713 CB LEU A 88 0.978 -10.614 3.427 1.00 0.00 C ATOM 714 CG LEU A 88 0.055 -9.528 2.854 1.00 0.00 C ATOM 715 CD1 LEU A 88 -1.148 -9.345 3.783 1.00 0.00 C ATOM 716 CD2 LEU A 88 0.808 -8.195 2.735 1.00 0.00 C ATOM 0 H LEU A 88 0.565 -12.087 1.166 1.00 0.00 H new ATOM 0 HA LEU A 88 2.697 -10.237 2.152 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.387 -11.473 3.745 1.00 0.00 H new ATOM 0 HB3 LEU A 88 1.491 -10.235 4.311 1.00 0.00 H new ATOM 0 HG LEU A 88 -0.280 -9.836 1.864 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -1.805 -8.575 3.380 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.695 -10.285 3.860 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -0.802 -9.045 4.772 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.141 -7.435 2.328 1.00 0.00 H new ATOM 0 HD22 LEU A 88 1.154 -7.883 3.721 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.665 -8.319 2.072 1.00 0.00 H new ATOM 728 N PRO A 89 2.406 -13.476 2.738 1.00 0.00 N ATOM 729 CA PRO A 89 3.155 -14.626 3.286 1.00 0.00 C ATOM 730 C PRO A 89 4.507 -14.774 2.574 1.00 0.00 C ATOM 731 O PRO A 89 5.540 -14.405 3.100 1.00 0.00 O ATOM 732 CB PRO A 89 2.245 -15.853 3.036 1.00 0.00 C ATOM 733 CG PRO A 89 0.991 -15.352 2.265 1.00 0.00 C ATOM 734 CD PRO A 89 1.188 -13.844 1.989 1.00 0.00 C ATOM 0 HA PRO A 89 3.383 -14.508 4.345 1.00 0.00 H new ATOM 0 HB2 PRO A 89 2.773 -16.611 2.458 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.956 -16.315 3.980 1.00 0.00 H new ATOM 0 HG2 PRO A 89 0.871 -15.900 1.331 1.00 0.00 H new ATOM 0 HG3 PRO A 89 0.088 -15.520 2.852 1.00 0.00 H new ATOM 0 HD2 PRO A 89 1.306 -13.650 0.923 1.00 0.00 H new ATOM 0 HD3 PRO A 89 0.328 -13.265 2.325 1.00 0.00 H new ATOM 742 N LEU A 90 4.510 -15.323 1.392 1.00 0.00 N ATOM 743 CA LEU A 90 5.790 -15.509 0.660 1.00 0.00 C ATOM 744 C LEU A 90 6.419 -14.150 0.346 1.00 0.00 C ATOM 745 O LEU A 90 7.539 -14.067 -0.117 1.00 0.00 O ATOM 746 CB LEU A 90 5.536 -16.311 -0.627 1.00 0.00 C ATOM 747 CG LEU A 90 4.859 -15.443 -1.692 1.00 0.00 C ATOM 748 CD1 LEU A 90 4.613 -16.287 -2.944 1.00 0.00 C ATOM 749 CD2 LEU A 90 3.520 -14.912 -1.166 1.00 0.00 C ATOM 0 H LEU A 90 3.678 -15.651 0.901 1.00 0.00 H new ATOM 0 HA LEU A 90 6.488 -16.067 1.284 1.00 0.00 H new ATOM 0 HB2 LEU A 90 6.481 -16.695 -1.013 1.00 0.00 H new ATOM 0 HB3 LEU A 90 4.909 -17.174 -0.404 1.00 0.00 H new ATOM 0 HG LEU A 90 5.506 -14.599 -1.932 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.131 -15.675 -3.706 1.00 0.00 H new ATOM 0 HD12 LEU A 90 5.564 -16.659 -3.325 1.00 0.00 H new ATOM 0 HD13 LEU A 90 3.968 -17.129 -2.694 1.00 0.00 H new ATOM 0 HD21 LEU A 90 3.047 -14.296 -1.931 1.00 0.00 H new ATOM 0 HD22 LEU A 90 2.868 -15.750 -0.920 1.00 0.00 H new ATOM 0 HD23 LEU A 90 3.692 -14.312 -0.272 1.00 0.00 H new ATOM 761 N ASN A 91 5.713 -13.082 0.601 1.00 0.00 N ATOM 762 CA ASN A 91 6.279 -11.729 0.324 1.00 0.00 C ATOM 763 C ASN A 91 7.027 -11.245 1.567 1.00 0.00 C ATOM 764 O ASN A 91 7.933 -10.439 1.486 1.00 0.00 O ATOM 765 CB ASN A 91 5.141 -10.758 -0.004 1.00 0.00 C ATOM 766 CG ASN A 91 5.712 -9.502 -0.665 1.00 0.00 C ATOM 767 OD1 ASN A 91 5.300 -8.400 -0.360 1.00 0.00 O ATOM 768 ND2 ASN A 91 6.648 -9.621 -1.567 1.00 0.00 N ATOM 0 H ASN A 91 4.770 -13.087 0.989 1.00 0.00 H new ATOM 0 HA ASN A 91 6.963 -11.777 -0.523 1.00 0.00 H new ATOM 0 HB2 ASN A 91 4.422 -11.236 -0.669 1.00 0.00 H new ATOM 0 HB3 ASN A 91 4.604 -10.490 0.906 1.00 0.00 H new ATOM 0 HD21 ASN A 91 7.033 -8.790 -2.015 1.00 0.00 H new ATOM 0 HD22 ASN A 91 6.994 -10.545 -1.824 1.00 0.00 H new ATOM 775 N TYR A 92 6.654 -11.742 2.716 1.00 0.00 N ATOM 776 CA TYR A 92 7.335 -11.329 3.980 1.00 0.00 C ATOM 777 C TYR A 92 7.372 -12.520 4.940 1.00 0.00 C ATOM 778 O TYR A 92 8.427 -12.961 5.338 1.00 0.00 O ATOM 779 CB TYR A 92 6.561 -10.181 4.631 1.00 0.00 C ATOM 780 CG TYR A 92 6.354 -9.070 3.626 1.00 0.00 C ATOM 781 CD1 TYR A 92 7.468 -8.410 3.071 1.00 0.00 C ATOM 782 CD2 TYR A 92 5.051 -8.694 3.243 1.00 0.00 C ATOM 783 CE1 TYR A 92 7.279 -7.376 2.135 1.00 0.00 C ATOM 784 CE2 TYR A 92 4.863 -7.659 2.308 1.00 0.00 C ATOM 785 CZ TYR A 92 5.977 -6.999 1.753 1.00 0.00 C ATOM 786 OH TYR A 92 5.793 -5.985 0.836 1.00 0.00 O ATOM 0 H TYR A 92 5.902 -12.421 2.835 1.00 0.00 H new ATOM 0 HA TYR A 92 8.350 -11.000 3.756 1.00 0.00 H new ATOM 0 HB2 TYR A 92 5.598 -10.539 4.995 1.00 0.00 H new ATOM 0 HB3 TYR A 92 7.108 -9.805 5.495 1.00 0.00 H new ATOM 0 HD1 TYR A 92 8.467 -8.697 3.364 1.00 0.00 H new ATOM 0 HD2 TYR A 92 4.196 -9.200 3.667 1.00 0.00 H new ATOM 0 HE1 TYR A 92 8.133 -6.871 1.709 1.00 0.00 H new ATOM 0 HE2 TYR A 92 3.864 -7.371 2.016 1.00 0.00 H new ATOM 0 HH TYR A 92 5.546 -6.369 -0.031 1.00 0.00 H new ATOM 796 N LYS A 93 6.215 -13.033 5.296 1.00 0.00 N ATOM 797 CA LYS A 93 6.117 -14.204 6.231 1.00 0.00 C ATOM 798 C LYS A 93 4.720 -14.184 6.867 1.00 0.00 C ATOM 799 O LYS A 93 3.937 -15.099 6.705 1.00 0.00 O ATOM 800 CB LYS A 93 7.207 -14.120 7.329 1.00 0.00 C ATOM 801 CG LYS A 93 6.842 -14.970 8.561 1.00 0.00 C ATOM 802 CD LYS A 93 6.556 -16.415 8.131 1.00 0.00 C ATOM 803 CE LYS A 93 6.643 -17.340 9.348 1.00 0.00 C ATOM 804 NZ LYS A 93 5.966 -16.698 10.509 1.00 0.00 N ATOM 0 H LYS A 93 5.315 -12.681 4.970 1.00 0.00 H new ATOM 0 HA LYS A 93 6.272 -15.133 5.682 1.00 0.00 H new ATOM 0 HB2 LYS A 93 8.160 -14.459 6.922 1.00 0.00 H new ATOM 0 HB3 LYS A 93 7.341 -13.081 7.630 1.00 0.00 H new ATOM 0 HG2 LYS A 93 7.659 -14.951 9.282 1.00 0.00 H new ATOM 0 HG3 LYS A 93 5.968 -14.549 9.058 1.00 0.00 H new ATOM 0 HD2 LYS A 93 5.566 -16.482 7.681 1.00 0.00 H new ATOM 0 HD3 LYS A 93 7.273 -16.728 7.372 1.00 0.00 H new ATOM 0 HE2 LYS A 93 6.174 -18.298 9.124 1.00 0.00 H new ATOM 0 HE3 LYS A 93 7.686 -17.544 9.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 5.753 -17.418 11.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 6.591 -15.974 10.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 5.081 -16.253 10.192 1.00 0.00 H new ATOM 818 N HIS A 94 4.409 -13.146 7.597 1.00 0.00 N ATOM 819 CA HIS A 94 3.075 -13.059 8.258 1.00 0.00 C ATOM 820 C HIS A 94 1.963 -13.100 7.206 1.00 0.00 C ATOM 821 O HIS A 94 2.209 -13.263 6.028 1.00 0.00 O ATOM 822 CB HIS A 94 2.982 -11.749 9.043 1.00 0.00 C ATOM 823 CG HIS A 94 3.336 -10.599 8.141 1.00 0.00 C ATOM 824 ND1 HIS A 94 2.377 -9.740 7.628 1.00 0.00 N ATOM 825 CD2 HIS A 94 4.539 -10.154 7.652 1.00 0.00 C ATOM 826 CE1 HIS A 94 3.014 -8.830 6.868 1.00 0.00 C ATOM 827 NE2 HIS A 94 4.333 -9.036 6.847 1.00 0.00 N ATOM 0 H HIS A 94 5.025 -12.351 7.764 1.00 0.00 H new ATOM 0 HA HIS A 94 2.957 -13.905 8.935 1.00 0.00 H new ATOM 0 HB2 HIS A 94 1.974 -11.619 9.437 1.00 0.00 H new ATOM 0 HB3 HIS A 94 3.657 -11.776 9.898 1.00 0.00 H new ATOM 0 HD2 HIS A 94 5.499 -10.603 7.860 1.00 0.00 H new ATOM 0 HE1 HIS A 94 2.518 -8.030 6.339 1.00 0.00 H new ATOM 0 HE2 HIS A 94 5.038 -8.492 6.349 1.00 0.00 H new ATOM 835 N ASN A 95 0.734 -12.952 7.632 1.00 0.00 N ATOM 836 CA ASN A 95 -0.411 -12.982 6.673 1.00 0.00 C ATOM 837 C ASN A 95 -1.544 -12.101 7.214 1.00 0.00 C ATOM 838 O ASN A 95 -1.322 -11.215 8.014 1.00 0.00 O ATOM 839 CB ASN A 95 -0.905 -14.422 6.520 1.00 0.00 C ATOM 840 CG ASN A 95 -1.229 -15.001 7.899 1.00 0.00 C ATOM 841 OD1 ASN A 95 -0.710 -16.033 8.275 1.00 0.00 O ATOM 842 ND2 ASN A 95 -2.072 -14.375 8.674 1.00 0.00 N ATOM 0 H ASN A 95 0.474 -12.811 8.608 1.00 0.00 H new ATOM 0 HA ASN A 95 -0.091 -12.606 5.702 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -1.791 -14.448 5.886 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -0.144 -15.028 6.029 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -2.295 -14.752 9.595 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -2.508 -13.508 8.359 1.00 0.00 H new ATOM 849 N ASN A 96 -2.756 -12.341 6.786 1.00 0.00 N ATOM 850 CA ASN A 96 -3.904 -11.521 7.277 1.00 0.00 C ATOM 851 C ASN A 96 -3.660 -10.043 6.956 1.00 0.00 C ATOM 852 O ASN A 96 -2.540 -9.615 6.762 1.00 0.00 O ATOM 853 CB ASN A 96 -4.053 -11.698 8.791 1.00 0.00 C ATOM 854 CG ASN A 96 -5.426 -11.190 9.234 1.00 0.00 C ATOM 855 OD1 ASN A 96 -6.381 -11.254 8.485 1.00 0.00 O ATOM 856 ND2 ASN A 96 -5.568 -10.685 10.429 1.00 0.00 N ATOM 0 H ASN A 96 -3.001 -13.071 6.117 1.00 0.00 H new ATOM 0 HA ASN A 96 -4.817 -11.851 6.782 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -3.939 -12.749 9.057 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -3.266 -11.151 9.311 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -6.480 -10.344 10.734 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -4.767 -10.631 11.058 1.00 0.00 H new ATOM 863 N MET A 97 -4.706 -9.259 6.898 1.00 0.00 N ATOM 864 CA MET A 97 -4.546 -7.806 6.589 1.00 0.00 C ATOM 865 C MET A 97 -4.346 -7.023 7.890 1.00 0.00 C ATOM 866 O MET A 97 -3.377 -6.308 8.048 1.00 0.00 O ATOM 867 CB MET A 97 -5.812 -7.290 5.884 1.00 0.00 C ATOM 868 CG MET A 97 -5.806 -7.692 4.402 1.00 0.00 C ATOM 869 SD MET A 97 -6.977 -6.647 3.494 1.00 0.00 S ATOM 870 CE MET A 97 -5.974 -5.136 3.405 1.00 0.00 C ATOM 0 H MET A 97 -5.667 -9.564 7.052 1.00 0.00 H new ATOM 0 HA MET A 97 -3.680 -7.670 5.941 1.00 0.00 H new ATOM 0 HB2 MET A 97 -6.698 -7.695 6.373 1.00 0.00 H new ATOM 0 HB3 MET A 97 -5.867 -6.205 5.972 1.00 0.00 H new ATOM 0 HG2 MET A 97 -4.804 -7.581 3.987 1.00 0.00 H new ATOM 0 HG3 MET A 97 -6.080 -8.742 4.297 1.00 0.00 H new ATOM 0 HE1 MET A 97 -6.573 -4.282 3.722 1.00 0.00 H new ATOM 0 HE2 MET A 97 -5.108 -5.235 4.060 1.00 0.00 H new ATOM 0 HE3 MET A 97 -5.638 -4.983 2.380 1.00 0.00 H new ATOM 880 N ALA A 98 -5.265 -7.141 8.812 1.00 0.00 N ATOM 881 CA ALA A 98 -5.149 -6.392 10.100 1.00 0.00 C ATOM 882 C ALA A 98 -3.707 -6.439 10.615 1.00 0.00 C ATOM 883 O ALA A 98 -3.293 -5.609 11.401 1.00 0.00 O ATOM 884 CB ALA A 98 -6.081 -7.018 11.139 1.00 0.00 C ATOM 0 H ALA A 98 -6.096 -7.727 8.729 1.00 0.00 H new ATOM 0 HA ALA A 98 -5.430 -5.353 9.930 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -5.997 -6.472 12.079 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.110 -6.969 10.782 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -5.801 -8.059 11.298 1.00 0.00 H new ATOM 890 N SER A 99 -2.932 -7.392 10.169 1.00 0.00 N ATOM 891 CA SER A 99 -1.515 -7.473 10.624 1.00 0.00 C ATOM 892 C SER A 99 -0.672 -6.560 9.738 1.00 0.00 C ATOM 893 O SER A 99 0.073 -5.725 10.211 1.00 0.00 O ATOM 894 CB SER A 99 -1.017 -8.912 10.501 1.00 0.00 C ATOM 895 OG SER A 99 0.206 -9.049 11.213 1.00 0.00 O ATOM 0 H SER A 99 -3.219 -8.116 9.511 1.00 0.00 H new ATOM 0 HA SER A 99 -1.437 -7.161 11.666 1.00 0.00 H new ATOM 0 HB2 SER A 99 -1.762 -9.602 10.898 1.00 0.00 H new ATOM 0 HB3 SER A 99 -0.871 -9.170 9.452 1.00 0.00 H new ATOM 0 HG SER A 99 0.527 -9.972 11.137 1.00 0.00 H new ATOM 901 N PHE A 100 -0.803 -6.703 8.449 1.00 0.00 N ATOM 902 CA PHE A 100 -0.031 -5.838 7.522 1.00 0.00 C ATOM 903 C PHE A 100 -0.454 -4.386 7.746 1.00 0.00 C ATOM 904 O PHE A 100 0.367 -3.505 7.907 1.00 0.00 O ATOM 905 CB PHE A 100 -0.331 -6.264 6.079 1.00 0.00 C ATOM 906 CG PHE A 100 0.127 -5.193 5.107 1.00 0.00 C ATOM 907 CD1 PHE A 100 1.466 -4.757 5.122 1.00 0.00 C ATOM 908 CD2 PHE A 100 -0.786 -4.630 4.193 1.00 0.00 C ATOM 909 CE1 PHE A 100 1.890 -3.758 4.226 1.00 0.00 C ATOM 910 CE2 PHE A 100 -0.360 -3.632 3.296 1.00 0.00 C ATOM 911 CZ PHE A 100 0.980 -3.195 3.314 1.00 0.00 C ATOM 0 H PHE A 100 -1.414 -7.384 7.999 1.00 0.00 H new ATOM 0 HA PHE A 100 1.039 -5.934 7.705 1.00 0.00 H new ATOM 0 HB2 PHE A 100 0.173 -7.205 5.858 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -1.400 -6.440 5.959 1.00 0.00 H new ATOM 0 HD1 PHE A 100 2.167 -5.189 5.821 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -1.813 -4.964 4.181 1.00 0.00 H new ATOM 0 HE1 PHE A 100 2.917 -3.423 4.239 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -1.059 -3.202 2.595 1.00 0.00 H new ATOM 0 HZ PHE A 100 1.307 -2.428 2.628 1.00 0.00 H new ATOM 921 N ILE A 101 -1.732 -4.130 7.760 1.00 0.00 N ATOM 922 CA ILE A 101 -2.206 -2.739 7.977 1.00 0.00 C ATOM 923 C ILE A 101 -1.589 -2.198 9.266 1.00 0.00 C ATOM 924 O ILE A 101 -1.174 -1.057 9.330 1.00 0.00 O ATOM 925 CB ILE A 101 -3.733 -2.727 8.068 1.00 0.00 C ATOM 926 CG1 ILE A 101 -4.304 -3.381 6.803 1.00 0.00 C ATOM 927 CG2 ILE A 101 -4.242 -1.283 8.171 1.00 0.00 C ATOM 928 CD1 ILE A 101 -5.820 -3.187 6.748 1.00 0.00 C ATOM 0 H ILE A 101 -2.467 -4.825 7.630 1.00 0.00 H new ATOM 0 HA ILE A 101 -1.903 -2.106 7.143 1.00 0.00 H new ATOM 0 HB ILE A 101 -4.052 -3.277 8.954 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -3.842 -2.944 5.918 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -4.065 -4.445 6.795 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -5.330 -1.284 8.235 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -3.826 -0.813 9.063 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -3.932 -0.724 7.288 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -6.214 -3.655 5.846 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -6.278 -3.646 7.625 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -6.050 -2.122 6.734 1.00 0.00 H new ATOM 940 N ARG A 102 -1.505 -3.002 10.290 1.00 0.00 N ATOM 941 CA ARG A 102 -0.895 -2.518 11.548 1.00 0.00 C ATOM 942 C ARG A 102 0.490 -1.959 11.232 1.00 0.00 C ATOM 943 O ARG A 102 0.936 -0.997 11.824 1.00 0.00 O ATOM 944 CB ARG A 102 -0.772 -3.686 12.517 1.00 0.00 C ATOM 945 CG ARG A 102 -0.335 -3.177 13.884 1.00 0.00 C ATOM 946 CD ARG A 102 -0.003 -4.378 14.758 1.00 0.00 C ATOM 947 NE ARG A 102 0.281 -3.925 16.148 1.00 0.00 N ATOM 948 CZ ARG A 102 0.297 -4.789 17.125 1.00 0.00 C ATOM 949 NH1 ARG A 102 0.068 -6.051 16.885 1.00 0.00 N ATOM 950 NH2 ARG A 102 0.542 -4.392 18.344 1.00 0.00 N ATOM 0 H ARG A 102 -1.832 -3.968 10.305 1.00 0.00 H new ATOM 0 HA ARG A 102 -1.511 -1.739 11.998 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -1.727 -4.204 12.600 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -0.049 -4.409 12.140 1.00 0.00 H new ATOM 0 HG2 ARG A 102 0.534 -2.526 13.787 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -1.128 -2.584 14.339 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -0.836 -5.081 14.758 1.00 0.00 H new ATOM 0 HD3 ARG A 102 0.861 -4.906 14.354 1.00 0.00 H new ATOM 0 HE ARG A 102 0.463 -2.939 16.336 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -0.124 -6.362 15.933 1.00 0.00 H new ATOM 0 HH12 ARG A 102 0.081 -6.726 17.650 1.00 0.00 H new ATOM 0 HH21 ARG A 102 0.721 -3.406 18.533 1.00 0.00 H new ATOM 0 HH22 ARG A 102 0.554 -5.068 19.108 1.00 0.00 H new ATOM 964 N GLN A 103 1.168 -2.554 10.287 1.00 0.00 N ATOM 965 CA GLN A 103 2.518 -2.062 9.913 1.00 0.00 C ATOM 966 C GLN A 103 2.378 -0.746 9.143 1.00 0.00 C ATOM 967 O GLN A 103 3.249 0.099 9.177 1.00 0.00 O ATOM 968 CB GLN A 103 3.212 -3.104 9.037 1.00 0.00 C ATOM 969 CG GLN A 103 3.206 -4.455 9.755 1.00 0.00 C ATOM 970 CD GLN A 103 3.790 -5.527 8.833 1.00 0.00 C ATOM 971 OE1 GLN A 103 4.514 -5.219 7.908 1.00 0.00 O ATOM 972 NE2 GLN A 103 3.506 -6.782 9.050 1.00 0.00 N ATOM 0 H GLN A 103 0.840 -3.362 9.758 1.00 0.00 H new ATOM 0 HA GLN A 103 3.113 -1.894 10.811 1.00 0.00 H new ATOM 0 HB2 GLN A 103 2.701 -3.187 8.078 1.00 0.00 H new ATOM 0 HB3 GLN A 103 4.236 -2.795 8.827 1.00 0.00 H new ATOM 0 HG2 GLN A 103 3.790 -4.393 10.673 1.00 0.00 H new ATOM 0 HG3 GLN A 103 2.189 -4.722 10.041 1.00 0.00 H new ATOM 0 HE21 GLN A 103 2.898 -7.040 9.827 1.00 0.00 H new ATOM 0 HE22 GLN A 103 3.892 -7.505 8.443 1.00 0.00 H new ATOM 981 N LEU A 104 1.280 -0.557 8.457 1.00 0.00 N ATOM 982 CA LEU A 104 1.094 0.716 7.706 1.00 0.00 C ATOM 983 C LEU A 104 0.920 1.853 8.712 1.00 0.00 C ATOM 984 O LEU A 104 1.521 2.901 8.590 1.00 0.00 O ATOM 985 CB LEU A 104 -0.152 0.630 6.813 1.00 0.00 C ATOM 986 CG LEU A 104 0.046 -0.412 5.699 1.00 0.00 C ATOM 987 CD1 LEU A 104 -1.220 -0.462 4.840 1.00 0.00 C ATOM 988 CD2 LEU A 104 1.254 -0.031 4.814 1.00 0.00 C ATOM 0 H LEU A 104 0.512 -1.224 8.386 1.00 0.00 H new ATOM 0 HA LEU A 104 1.964 0.897 7.075 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.020 0.364 7.416 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -0.357 1.606 6.372 1.00 0.00 H new ATOM 0 HG LEU A 104 0.236 -1.387 6.147 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -1.092 -1.198 4.046 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.070 -0.743 5.461 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -1.400 0.519 4.400 1.00 0.00 H new ATOM 0 HD21 LEU A 104 1.381 -0.778 4.030 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.079 0.945 4.360 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.155 0.010 5.426 1.00 0.00 H new ATOM 1000 N ASN A 105 0.110 1.649 9.716 1.00 0.00 N ATOM 1001 CA ASN A 105 -0.086 2.713 10.737 1.00 0.00 C ATOM 1002 C ASN A 105 1.146 2.759 11.639 1.00 0.00 C ATOM 1003 O ASN A 105 1.341 3.684 12.402 1.00 0.00 O ATOM 1004 CB ASN A 105 -1.327 2.397 11.576 1.00 0.00 C ATOM 1005 CG ASN A 105 -2.482 2.003 10.654 1.00 0.00 C ATOM 1006 OD1 ASN A 105 -3.481 1.478 11.104 1.00 0.00 O ATOM 1007 ND2 ASN A 105 -2.386 2.234 9.373 1.00 0.00 N ATOM 0 H ASN A 105 -0.422 0.793 9.871 1.00 0.00 H new ATOM 0 HA ASN A 105 -0.224 3.677 10.248 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -1.111 1.587 12.272 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -1.605 3.265 12.174 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -3.150 1.974 8.749 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -1.547 2.675 8.996 1.00 0.00 H new ATOM 1014 N MET A 106 1.984 1.760 11.549 1.00 0.00 N ATOM 1015 CA MET A 106 3.212 1.731 12.390 1.00 0.00 C ATOM 1016 C MET A 106 4.221 2.742 11.846 1.00 0.00 C ATOM 1017 O MET A 106 4.964 3.352 12.589 1.00 0.00 O ATOM 1018 CB MET A 106 3.825 0.324 12.342 1.00 0.00 C ATOM 1019 CG MET A 106 5.021 0.210 13.317 1.00 0.00 C ATOM 1020 SD MET A 106 4.509 -0.667 14.821 1.00 0.00 S ATOM 1021 CE MET A 106 5.209 -2.285 14.402 1.00 0.00 C ATOM 0 H MET A 106 1.868 0.961 10.926 1.00 0.00 H new ATOM 0 HA MET A 106 2.959 1.985 13.419 1.00 0.00 H new ATOM 0 HB2 MET A 106 3.068 -0.416 12.601 1.00 0.00 H new ATOM 0 HB3 MET A 106 4.155 0.101 11.327 1.00 0.00 H new ATOM 0 HG2 MET A 106 5.843 -0.321 12.838 1.00 0.00 H new ATOM 0 HG3 MET A 106 5.389 1.204 13.572 1.00 0.00 H new ATOM 0 HE1 MET A 106 5.005 -2.990 15.208 1.00 0.00 H new ATOM 0 HE2 MET A 106 4.758 -2.649 13.479 1.00 0.00 H new ATOM 0 HE3 MET A 106 6.286 -2.191 14.266 1.00 0.00 H new ATOM 1031 N TYR A 107 4.259 2.925 10.553 1.00 0.00 N ATOM 1032 CA TYR A 107 5.224 3.893 9.970 1.00 0.00 C ATOM 1033 C TYR A 107 4.672 5.312 10.131 1.00 0.00 C ATOM 1034 O TYR A 107 5.332 6.193 10.646 1.00 0.00 O ATOM 1035 CB TYR A 107 5.419 3.593 8.479 1.00 0.00 C ATOM 1036 CG TYR A 107 5.584 2.103 8.252 1.00 0.00 C ATOM 1037 CD1 TYR A 107 6.561 1.380 8.963 1.00 0.00 C ATOM 1038 CD2 TYR A 107 4.761 1.439 7.316 1.00 0.00 C ATOM 1039 CE1 TYR A 107 6.715 -0.003 8.743 1.00 0.00 C ATOM 1040 CE2 TYR A 107 4.915 0.057 7.095 1.00 0.00 C ATOM 1041 CZ TYR A 107 5.892 -0.664 7.809 1.00 0.00 C ATOM 1042 OH TYR A 107 6.046 -2.018 7.593 1.00 0.00 O ATOM 0 H TYR A 107 3.663 2.445 9.879 1.00 0.00 H new ATOM 0 HA TYR A 107 6.181 3.807 10.485 1.00 0.00 H new ATOM 0 HB2 TYR A 107 4.562 3.960 7.914 1.00 0.00 H new ATOM 0 HB3 TYR A 107 6.296 4.122 8.108 1.00 0.00 H new ATOM 0 HD1 TYR A 107 7.193 1.886 9.678 1.00 0.00 H new ATOM 0 HD2 TYR A 107 4.012 1.992 6.769 1.00 0.00 H new ATOM 0 HE1 TYR A 107 7.464 -0.557 9.290 1.00 0.00 H new ATOM 0 HE2 TYR A 107 4.285 -0.450 6.379 1.00 0.00 H new ATOM 0 HH TYR A 107 5.698 -2.249 6.707 1.00 0.00 H new ATOM 1052 N GLY A 108 3.462 5.539 9.687 1.00 0.00 N ATOM 1053 CA GLY A 108 2.848 6.898 9.799 1.00 0.00 C ATOM 1054 C GLY A 108 2.089 7.205 8.507 1.00 0.00 C ATOM 1055 O GLY A 108 2.234 8.261 7.924 1.00 0.00 O ATOM 0 H GLY A 108 2.868 4.836 9.248 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.171 6.937 10.652 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.620 7.648 9.970 1.00 0.00 H new ATOM 1059 N PHE A 109 1.288 6.281 8.051 1.00 0.00 N ATOM 1060 CA PHE A 109 0.524 6.504 6.791 1.00 0.00 C ATOM 1061 C PHE A 109 -0.733 7.324 7.102 1.00 0.00 C ATOM 1062 O PHE A 109 -1.036 7.606 8.245 1.00 0.00 O ATOM 1063 CB PHE A 109 0.123 5.141 6.195 1.00 0.00 C ATOM 1064 CG PHE A 109 1.256 4.568 5.361 1.00 0.00 C ATOM 1065 CD1 PHE A 109 2.567 4.524 5.876 1.00 0.00 C ATOM 1066 CD2 PHE A 109 0.995 4.070 4.069 1.00 0.00 C ATOM 1067 CE1 PHE A 109 3.613 3.982 5.102 1.00 0.00 C ATOM 1068 CE2 PHE A 109 2.041 3.530 3.295 1.00 0.00 C ATOM 1069 CZ PHE A 109 3.349 3.485 3.812 1.00 0.00 C ATOM 0 H PHE A 109 1.129 5.378 8.499 1.00 0.00 H new ATOM 0 HA PHE A 109 1.140 7.046 6.073 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -0.132 4.448 6.997 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -0.768 5.256 5.578 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.771 4.906 6.865 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -0.009 4.102 3.671 1.00 0.00 H new ATOM 0 HE1 PHE A 109 4.617 3.948 5.499 1.00 0.00 H new ATOM 0 HE2 PHE A 109 1.839 3.150 2.304 1.00 0.00 H new ATOM 0 HZ PHE A 109 4.150 3.069 3.219 1.00 0.00 H new ATOM 1079 N HIS A 110 -1.466 7.703 6.091 1.00 0.00 N ATOM 1080 CA HIS A 110 -2.708 8.501 6.313 1.00 0.00 C ATOM 1081 C HIS A 110 -3.705 8.185 5.199 1.00 0.00 C ATOM 1082 O HIS A 110 -3.945 8.989 4.321 1.00 0.00 O ATOM 1083 CB HIS A 110 -2.370 9.993 6.289 1.00 0.00 C ATOM 1084 CG HIS A 110 -3.626 10.795 6.494 1.00 0.00 C ATOM 1085 ND1 HIS A 110 -4.096 11.120 7.758 1.00 0.00 N ATOM 1086 CD2 HIS A 110 -4.520 11.345 5.609 1.00 0.00 C ATOM 1087 CE1 HIS A 110 -5.226 11.834 7.598 1.00 0.00 C ATOM 1088 NE2 HIS A 110 -5.529 12.001 6.308 1.00 0.00 N ATOM 0 H HIS A 110 -1.258 7.494 5.115 1.00 0.00 H new ATOM 0 HA HIS A 110 -3.142 8.248 7.280 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -1.646 10.225 7.070 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -1.908 10.257 5.337 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -4.451 11.279 4.533 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -5.816 12.224 8.414 1.00 0.00 H new ATOM 0 HE2 HIS A 110 -6.328 12.502 5.919 1.00 0.00 H new ATOM 1096 N LYS A 111 -4.281 7.016 5.223 1.00 0.00 N ATOM 1097 CA LYS A 111 -5.253 6.645 4.162 1.00 0.00 C ATOM 1098 C LYS A 111 -6.524 7.485 4.303 1.00 0.00 C ATOM 1099 O LYS A 111 -6.716 8.177 5.284 1.00 0.00 O ATOM 1100 CB LYS A 111 -5.597 5.158 4.287 1.00 0.00 C ATOM 1101 CG LYS A 111 -6.468 4.916 5.529 1.00 0.00 C ATOM 1102 CD LYS A 111 -6.568 3.412 5.813 1.00 0.00 C ATOM 1103 CE LYS A 111 -6.966 2.661 4.542 1.00 0.00 C ATOM 1104 NZ LYS A 111 -7.523 1.332 4.917 1.00 0.00 N ATOM 0 H LYS A 111 -4.119 6.302 5.933 1.00 0.00 H new ATOM 0 HA LYS A 111 -4.811 6.835 3.184 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -6.124 4.823 3.394 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -4.682 4.570 4.356 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -6.040 5.430 6.390 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -7.463 5.332 5.372 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -5.612 3.039 6.180 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -7.303 3.230 6.597 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -7.705 3.234 3.982 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -6.100 2.536 3.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -7.069 0.591 4.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -7.341 1.151 5.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -8.548 1.324 4.744 1.00 0.00 H new ATOM 1118 N ILE A 112 -7.393 7.422 3.323 1.00 0.00 N ATOM 1119 CA ILE A 112 -8.669 8.203 3.369 1.00 0.00 C ATOM 1120 C ILE A 112 -9.841 7.220 3.259 1.00 0.00 C ATOM 1121 O ILE A 112 -10.379 7.001 2.192 1.00 0.00 O ATOM 1122 CB ILE A 112 -8.715 9.213 2.190 1.00 0.00 C ATOM 1123 CG1 ILE A 112 -7.764 8.753 1.054 1.00 0.00 C ATOM 1124 CG2 ILE A 112 -8.341 10.624 2.679 1.00 0.00 C ATOM 1125 CD1 ILE A 112 -6.306 9.180 1.315 1.00 0.00 C ATOM 0 H ILE A 112 -7.271 6.856 2.483 1.00 0.00 H new ATOM 0 HA ILE A 112 -8.733 8.759 4.304 1.00 0.00 H new ATOM 0 HB ILE A 112 -9.730 9.248 1.795 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -7.813 7.668 0.957 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -8.101 9.173 0.106 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -8.378 11.321 1.842 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -9.046 10.942 3.447 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -7.334 10.610 3.095 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -5.674 8.838 0.495 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -6.252 10.266 1.385 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -5.959 8.738 2.249 1.00 0.00 H new ATOM 1137 N THR A 113 -10.242 6.632 4.352 1.00 0.00 N ATOM 1138 CA THR A 113 -11.380 5.674 4.299 1.00 0.00 C ATOM 1139 C THR A 113 -11.974 5.502 5.703 1.00 0.00 C ATOM 1140 O THR A 113 -11.550 6.136 6.649 1.00 0.00 O ATOM 1141 CB THR A 113 -10.885 4.330 3.725 1.00 0.00 C ATOM 1142 OG1 THR A 113 -11.962 3.684 3.061 1.00 0.00 O ATOM 1143 CG2 THR A 113 -10.343 3.407 4.828 1.00 0.00 C ATOM 0 H THR A 113 -9.833 6.773 5.276 1.00 0.00 H new ATOM 0 HA THR A 113 -12.166 6.056 3.648 1.00 0.00 H new ATOM 0 HB THR A 113 -10.072 4.536 3.029 1.00 0.00 H new ATOM 0 HG1 THR A 113 -11.654 2.830 2.692 1.00 0.00 H new ATOM 0 HG21 THR A 113 -10.004 2.471 4.385 1.00 0.00 H new ATOM 0 HG22 THR A 113 -9.508 3.893 5.332 1.00 0.00 H new ATOM 0 HG23 THR A 113 -11.132 3.201 5.551 1.00 0.00 H new ATOM 1151 N SER A 114 -12.950 4.649 5.842 1.00 0.00 N ATOM 1152 CA SER A 114 -13.570 4.435 7.179 1.00 0.00 C ATOM 1153 C SER A 114 -14.680 3.390 7.064 1.00 0.00 C ATOM 1154 O SER A 114 -15.695 3.615 6.435 1.00 0.00 O ATOM 1155 CB SER A 114 -14.159 5.753 7.686 1.00 0.00 C ATOM 1156 OG SER A 114 -15.144 5.476 8.674 1.00 0.00 O ATOM 0 H SER A 114 -13.346 4.090 5.086 1.00 0.00 H new ATOM 0 HA SER A 114 -12.812 4.084 7.879 1.00 0.00 H new ATOM 0 HB2 SER A 114 -13.372 6.379 8.106 1.00 0.00 H new ATOM 0 HB3 SER A 114 -14.602 6.309 6.860 1.00 0.00 H new ATOM 0 HG SER A 114 -14.748 4.933 9.387 1.00 0.00 H new ATOM 1162 N ILE A 115 -14.496 2.246 7.665 1.00 0.00 N ATOM 1163 CA ILE A 115 -15.540 1.185 7.588 1.00 0.00 C ATOM 1164 C ILE A 115 -16.910 1.790 7.909 1.00 0.00 C ATOM 1165 O ILE A 115 -17.938 1.210 7.622 1.00 0.00 O ATOM 1166 CB ILE A 115 -15.216 0.081 8.598 1.00 0.00 C ATOM 1167 CG1 ILE A 115 -16.192 -1.085 8.410 1.00 0.00 C ATOM 1168 CG2 ILE A 115 -15.342 0.631 10.021 1.00 0.00 C ATOM 1169 CD1 ILE A 115 -15.787 -2.249 9.317 1.00 0.00 C ATOM 0 H ILE A 115 -13.667 2.000 8.206 1.00 0.00 H new ATOM 0 HA ILE A 115 -15.559 0.764 6.583 1.00 0.00 H new ATOM 0 HB ILE A 115 -14.196 -0.269 8.437 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -17.207 -0.764 8.646 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -16.193 -1.406 7.368 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -15.111 -0.157 10.738 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -14.645 1.458 10.154 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -16.360 0.984 10.186 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -16.484 -3.076 9.180 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -14.780 -2.577 9.060 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -15.809 -1.924 10.357 1.00 0.00 H new ATOM 1181 N ASP A 116 -16.931 2.953 8.499 1.00 0.00 N ATOM 1182 CA ASP A 116 -18.235 3.594 8.836 1.00 0.00 C ATOM 1183 C ASP A 116 -18.844 4.207 7.573 1.00 0.00 C ATOM 1184 O ASP A 116 -19.885 3.788 7.109 1.00 0.00 O ATOM 1185 CB ASP A 116 -18.009 4.692 9.878 1.00 0.00 C ATOM 1186 CG ASP A 116 -17.198 4.127 11.046 1.00 0.00 C ATOM 1187 OD1 ASP A 116 -17.789 3.478 11.893 1.00 0.00 O ATOM 1188 OD2 ASP A 116 -16.000 4.355 11.075 1.00 0.00 O ATOM 0 H ASP A 116 -16.103 3.487 8.762 1.00 0.00 H new ATOM 0 HA ASP A 116 -18.915 2.844 9.240 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -17.481 5.533 9.428 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -18.966 5.071 10.236 1.00 0.00 H new ATOM 1193 N ASN A 117 -18.205 5.200 7.015 1.00 0.00 N ATOM 1194 CA ASN A 117 -18.751 5.840 5.784 1.00 0.00 C ATOM 1195 C ASN A 117 -17.647 6.634 5.091 1.00 0.00 C ATOM 1196 O ASN A 117 -16.533 6.716 5.568 1.00 0.00 O ATOM 1197 CB ASN A 117 -19.898 6.779 6.163 1.00 0.00 C ATOM 1198 CG ASN A 117 -19.425 7.753 7.244 1.00 0.00 C ATOM 1199 OD1 ASN A 117 -19.104 7.349 8.343 1.00 0.00 O ATOM 1200 ND2 ASN A 117 -19.371 9.029 6.977 1.00 0.00 N ATOM 0 H ASN A 117 -17.329 5.595 7.358 1.00 0.00 H new ATOM 0 HA ASN A 117 -19.122 5.070 5.107 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -20.236 7.330 5.285 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -20.749 6.203 6.525 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -19.059 9.687 7.691 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -19.641 9.369 6.054 1.00 0.00 H new ATOM 1207 N GLY A 118 -17.946 7.220 3.963 1.00 0.00 N ATOM 1208 CA GLY A 118 -16.911 8.008 3.236 1.00 0.00 C ATOM 1209 C GLY A 118 -17.592 9.011 2.303 1.00 0.00 C ATOM 1210 O GLY A 118 -17.773 10.164 2.642 1.00 0.00 O ATOM 0 H GLY A 118 -18.861 7.187 3.514 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -16.273 8.533 3.947 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -16.268 7.341 2.662 1.00 0.00 H new ATOM 1214 N GLY A 119 -17.968 8.583 1.129 1.00 0.00 N ATOM 1215 CA GLY A 119 -18.635 9.514 0.174 1.00 0.00 C ATOM 1216 C GLY A 119 -19.416 8.708 -0.865 1.00 0.00 C ATOM 1217 O GLY A 119 -20.138 7.787 -0.537 1.00 0.00 O ATOM 0 H GLY A 119 -17.842 7.629 0.790 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -19.308 10.182 0.711 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -17.891 10.139 -0.320 1.00 0.00 H new ATOM 1221 N LEU A 120 -19.279 9.047 -2.118 1.00 0.00 N ATOM 1222 CA LEU A 120 -20.016 8.301 -3.178 1.00 0.00 C ATOM 1223 C LEU A 120 -19.820 6.794 -2.985 1.00 0.00 C ATOM 1224 O LEU A 120 -20.482 5.988 -3.611 1.00 0.00 O ATOM 1225 CB LEU A 120 -19.512 8.732 -4.567 1.00 0.00 C ATOM 1226 CG LEU A 120 -18.107 8.172 -4.849 1.00 0.00 C ATOM 1227 CD1 LEU A 120 -17.617 8.714 -6.195 1.00 0.00 C ATOM 1228 CD2 LEU A 120 -17.134 8.605 -3.744 1.00 0.00 C ATOM 0 H LEU A 120 -18.689 9.808 -2.454 1.00 0.00 H new ATOM 0 HA LEU A 120 -21.079 8.529 -3.105 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -20.205 8.383 -5.332 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -19.491 9.820 -4.627 1.00 0.00 H new ATOM 0 HG LEU A 120 -18.151 7.083 -4.876 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -16.621 8.323 -6.404 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -18.302 8.403 -6.984 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -17.578 9.803 -6.157 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -16.143 8.203 -3.954 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -17.084 9.693 -3.709 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -17.483 8.227 -2.783 1.00 0.00 H new ATOM 1240 N ARG A 121 -18.921 6.404 -2.124 1.00 0.00 N ATOM 1241 CA ARG A 121 -18.688 4.951 -1.892 1.00 0.00 C ATOM 1242 C ARG A 121 -18.249 4.287 -3.202 1.00 0.00 C ATOM 1243 O ARG A 121 -18.879 3.366 -3.683 1.00 0.00 O ATOM 1244 CB ARG A 121 -19.984 4.304 -1.384 1.00 0.00 C ATOM 1245 CG ARG A 121 -19.658 3.017 -0.608 1.00 0.00 C ATOM 1246 CD ARG A 121 -20.924 2.144 -0.458 1.00 0.00 C ATOM 1247 NE ARG A 121 -21.061 1.668 0.957 1.00 0.00 N ATOM 1248 CZ ARG A 121 -20.045 1.163 1.608 1.00 0.00 C ATOM 1249 NH1 ARG A 121 -18.903 0.975 1.007 1.00 0.00 N ATOM 1250 NH2 ARG A 121 -20.184 0.819 2.859 1.00 0.00 N ATOM 0 H ARG A 121 -18.337 7.030 -1.570 1.00 0.00 H new ATOM 0 HA ARG A 121 -17.904 4.819 -1.146 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -20.520 5.001 -0.740 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -20.640 4.076 -2.224 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -18.882 2.457 -1.130 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -19.263 3.268 0.376 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -21.806 2.718 -0.743 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -20.867 1.290 -1.133 1.00 0.00 H new ATOM 0 HE ARG A 121 -21.966 1.739 1.422 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -18.798 1.222 0.023 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -18.115 0.581 1.521 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -21.082 0.944 3.326 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -19.394 0.425 3.370 1.00 0.00 H new ATOM 1264 N PHE A 122 -17.174 4.748 -3.781 1.00 0.00 N ATOM 1265 CA PHE A 122 -16.696 4.143 -5.057 1.00 0.00 C ATOM 1266 C PHE A 122 -16.366 2.668 -4.829 1.00 0.00 C ATOM 1267 O PHE A 122 -16.114 2.243 -3.718 1.00 0.00 O ATOM 1268 CB PHE A 122 -15.440 4.879 -5.531 1.00 0.00 C ATOM 1269 CG PHE A 122 -15.139 4.493 -6.962 1.00 0.00 C ATOM 1270 CD1 PHE A 122 -15.964 4.959 -8.004 1.00 0.00 C ATOM 1271 CD2 PHE A 122 -14.035 3.667 -7.254 1.00 0.00 C ATOM 1272 CE1 PHE A 122 -15.686 4.601 -9.336 1.00 0.00 C ATOM 1273 CE2 PHE A 122 -13.758 3.309 -8.588 1.00 0.00 C ATOM 1274 CZ PHE A 122 -14.584 3.776 -9.629 1.00 0.00 C ATOM 0 H PHE A 122 -16.606 5.517 -3.426 1.00 0.00 H new ATOM 0 HA PHE A 122 -17.475 4.228 -5.814 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -15.587 5.956 -5.457 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -14.595 4.628 -4.890 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -16.810 5.591 -7.781 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -13.402 3.309 -6.456 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -16.319 4.960 -10.134 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -12.912 2.676 -8.813 1.00 0.00 H new ATOM 0 HZ PHE A 122 -14.372 3.501 -10.652 1.00 0.00 H new ATOM 1284 N ASP A 123 -16.363 1.880 -5.871 1.00 0.00 N ATOM 1285 CA ASP A 123 -16.048 0.432 -5.709 1.00 0.00 C ATOM 1286 C ASP A 123 -16.888 -0.144 -4.564 1.00 0.00 C ATOM 1287 O ASP A 123 -18.066 -0.404 -4.719 1.00 0.00 O ATOM 1288 CB ASP A 123 -14.558 0.271 -5.400 1.00 0.00 C ATOM 1289 CG ASP A 123 -14.212 -1.215 -5.307 1.00 0.00 C ATOM 1290 OD1 ASP A 123 -15.093 -2.025 -5.546 1.00 0.00 O ATOM 1291 OD2 ASP A 123 -13.071 -1.519 -5.000 1.00 0.00 O ATOM 0 H ASP A 123 -16.565 2.176 -6.826 1.00 0.00 H new ATOM 0 HA ASP A 123 -16.282 -0.104 -6.628 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -13.961 0.746 -6.179 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -14.314 0.771 -4.463 1.00 0.00 H new ATOM 1296 N ARG A 124 -16.302 -0.339 -3.411 1.00 0.00 N ATOM 1297 CA ARG A 124 -17.079 -0.888 -2.263 1.00 0.00 C ATOM 1298 C ARG A 124 -16.376 -0.468 -0.980 1.00 0.00 C ATOM 1299 O ARG A 124 -16.993 -0.143 0.015 1.00 0.00 O ATOM 1300 CB ARG A 124 -17.128 -2.416 -2.350 1.00 0.00 C ATOM 1301 CG ARG A 124 -15.701 -2.976 -2.442 1.00 0.00 C ATOM 1302 CD ARG A 124 -15.733 -4.490 -2.748 1.00 0.00 C ATOM 1303 NE ARG A 124 -14.712 -5.197 -1.912 1.00 0.00 N ATOM 1304 CZ ARG A 124 -13.487 -4.750 -1.811 1.00 0.00 C ATOM 1305 NH1 ARG A 124 -13.085 -3.747 -2.543 1.00 0.00 N ATOM 1306 NH2 ARG A 124 -12.648 -5.335 -1.002 1.00 0.00 N ATOM 0 H ARG A 124 -15.320 -0.142 -3.216 1.00 0.00 H new ATOM 0 HA ARG A 124 -18.100 -0.508 -2.280 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -17.633 -2.824 -1.474 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -17.706 -2.722 -3.222 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -15.148 -2.453 -3.222 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -15.173 -2.799 -1.505 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -16.726 -4.891 -2.543 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -15.532 -4.661 -3.806 1.00 0.00 H new ATOM 0 HE ARG A 124 -14.977 -6.045 -1.411 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -13.728 -3.305 -3.200 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -12.128 -3.405 -2.458 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -12.948 -6.139 -0.450 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -11.692 -4.989 -0.921 1.00 0.00 H new ATOM 1320 N ASP A 125 -15.080 -0.461 -1.018 1.00 0.00 N ATOM 1321 CA ASP A 125 -14.287 -0.052 0.163 1.00 0.00 C ATOM 1322 C ASP A 125 -12.825 0.004 -0.259 1.00 0.00 C ATOM 1323 O ASP A 125 -11.928 -0.295 0.504 1.00 0.00 O ATOM 1324 CB ASP A 125 -14.469 -1.068 1.294 1.00 0.00 C ATOM 1325 CG ASP A 125 -13.635 -0.642 2.503 1.00 0.00 C ATOM 1326 OD1 ASP A 125 -13.771 0.496 2.922 1.00 0.00 O ATOM 1327 OD2 ASP A 125 -12.874 -1.462 2.991 1.00 0.00 O ATOM 0 H ASP A 125 -14.527 -0.726 -1.833 1.00 0.00 H new ATOM 0 HA ASP A 125 -14.616 0.922 0.526 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -15.521 -1.135 1.570 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -14.163 -2.059 0.959 1.00 0.00 H new ATOM 1332 N GLU A 126 -12.589 0.375 -1.485 1.00 0.00 N ATOM 1333 CA GLU A 126 -11.195 0.444 -1.989 1.00 0.00 C ATOM 1334 C GLU A 126 -10.389 1.420 -1.130 1.00 0.00 C ATOM 1335 O GLU A 126 -10.725 2.581 -1.012 1.00 0.00 O ATOM 1336 CB GLU A 126 -11.197 0.908 -3.455 1.00 0.00 C ATOM 1337 CG GLU A 126 -11.873 2.291 -3.587 1.00 0.00 C ATOM 1338 CD GLU A 126 -10.828 3.408 -3.472 1.00 0.00 C ATOM 1339 OE1 GLU A 126 -9.866 3.370 -4.222 1.00 0.00 O ATOM 1340 OE2 GLU A 126 -11.010 4.280 -2.640 1.00 0.00 O ATOM 0 H GLU A 126 -13.307 0.634 -2.162 1.00 0.00 H new ATOM 0 HA GLU A 126 -10.737 -0.544 -1.931 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -10.174 0.960 -3.827 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -11.723 0.180 -4.072 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -12.387 2.362 -4.546 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -12.629 2.409 -2.811 1.00 0.00 H new ATOM 1347 N ILE A 127 -9.330 0.958 -0.516 1.00 0.00 N ATOM 1348 CA ILE A 127 -8.506 1.858 0.339 1.00 0.00 C ATOM 1349 C ILE A 127 -7.376 2.457 -0.500 1.00 0.00 C ATOM 1350 O ILE A 127 -6.701 1.763 -1.234 1.00 0.00 O ATOM 1351 CB ILE A 127 -7.932 1.055 1.505 1.00 0.00 C ATOM 1352 CG1 ILE A 127 -7.034 -0.066 0.975 1.00 0.00 C ATOM 1353 CG2 ILE A 127 -9.083 0.447 2.308 1.00 0.00 C ATOM 1354 CD1 ILE A 127 -6.654 -1.005 2.125 1.00 0.00 C ATOM 0 H ILE A 127 -9.001 -0.006 -0.571 1.00 0.00 H new ATOM 0 HA ILE A 127 -9.121 2.667 0.733 1.00 0.00 H new ATOM 0 HB ILE A 127 -7.341 1.713 2.142 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -7.552 -0.622 0.194 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -6.136 0.356 0.524 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -8.681 -0.128 3.142 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -9.721 1.244 2.690 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -9.669 -0.209 1.664 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -6.015 -1.803 1.747 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -6.119 -0.444 2.891 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -7.557 -1.437 2.556 1.00 0.00 H new ATOM 1366 N GLU A 128 -7.178 3.750 -0.410 1.00 0.00 N ATOM 1367 CA GLU A 128 -6.104 4.420 -1.211 1.00 0.00 C ATOM 1368 C GLU A 128 -4.971 4.876 -0.289 1.00 0.00 C ATOM 1369 O GLU A 128 -4.993 5.969 0.241 1.00 0.00 O ATOM 1370 CB GLU A 128 -6.699 5.642 -1.919 1.00 0.00 C ATOM 1371 CG GLU A 128 -5.586 6.419 -2.628 1.00 0.00 C ATOM 1372 CD GLU A 128 -6.201 7.394 -3.634 1.00 0.00 C ATOM 1373 OE1 GLU A 128 -7.135 8.085 -3.262 1.00 0.00 O ATOM 1374 OE2 GLU A 128 -5.727 7.434 -4.757 1.00 0.00 O ATOM 0 H GLU A 128 -7.718 4.375 0.188 1.00 0.00 H new ATOM 0 HA GLU A 128 -5.708 3.717 -1.944 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -7.452 5.326 -2.641 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -7.201 6.285 -1.196 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -4.987 6.964 -1.898 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -4.915 5.728 -3.139 1.00 0.00 H new ATOM 1381 N PHE A 129 -3.971 4.057 -0.108 1.00 0.00 N ATOM 1382 CA PHE A 129 -2.831 4.459 0.762 1.00 0.00 C ATOM 1383 C PHE A 129 -1.970 5.472 0.001 1.00 0.00 C ATOM 1384 O PHE A 129 -1.444 5.180 -1.059 1.00 0.00 O ATOM 1385 CB PHE A 129 -1.990 3.224 1.116 1.00 0.00 C ATOM 1386 CG PHE A 129 -2.633 2.473 2.264 1.00 0.00 C ATOM 1387 CD1 PHE A 129 -2.725 3.081 3.530 1.00 0.00 C ATOM 1388 CD2 PHE A 129 -3.127 1.168 2.073 1.00 0.00 C ATOM 1389 CE1 PHE A 129 -3.310 2.388 4.604 1.00 0.00 C ATOM 1390 CE2 PHE A 129 -3.712 0.474 3.149 1.00 0.00 C ATOM 1391 CZ PHE A 129 -3.805 1.084 4.414 1.00 0.00 C ATOM 0 H PHE A 129 -3.895 3.129 -0.524 1.00 0.00 H new ATOM 0 HA PHE A 129 -3.204 4.906 1.683 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -1.903 2.572 0.247 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -0.980 3.528 1.389 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -2.346 4.081 3.677 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -3.057 0.700 1.102 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -3.380 2.856 5.575 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -4.090 -0.527 3.004 1.00 0.00 H new ATOM 0 HZ PHE A 129 -4.256 0.552 5.239 1.00 0.00 H new ATOM 1401 N SER A 130 -1.834 6.666 0.521 1.00 0.00 N ATOM 1402 CA SER A 130 -1.021 7.699 -0.187 1.00 0.00 C ATOM 1403 C SER A 130 -0.401 8.679 0.816 1.00 0.00 C ATOM 1404 O SER A 130 -1.077 9.541 1.342 1.00 0.00 O ATOM 1405 CB SER A 130 -1.931 8.477 -1.138 1.00 0.00 C ATOM 1406 OG SER A 130 -1.138 9.319 -1.965 1.00 0.00 O ATOM 0 H SER A 130 -2.250 6.969 1.402 1.00 0.00 H new ATOM 0 HA SER A 130 -0.222 7.203 -0.738 1.00 0.00 H new ATOM 0 HB2 SER A 130 -2.510 7.787 -1.751 1.00 0.00 H new ATOM 0 HB3 SER A 130 -2.644 9.074 -0.570 1.00 0.00 H new ATOM 0 HG SER A 130 -1.719 9.818 -2.577 1.00 0.00 H new ATOM 1412 N HIS A 131 0.889 8.576 1.054 1.00 0.00 N ATOM 1413 CA HIS A 131 1.580 9.527 1.991 1.00 0.00 C ATOM 1414 C HIS A 131 2.746 10.182 1.211 1.00 0.00 C ATOM 1415 O HIS A 131 3.255 9.566 0.299 1.00 0.00 O ATOM 1416 CB HIS A 131 2.085 8.763 3.232 1.00 0.00 C ATOM 1417 CG HIS A 131 3.087 7.701 2.866 1.00 0.00 C ATOM 1418 ND1 HIS A 131 4.328 7.629 3.478 1.00 0.00 N ATOM 1419 CD2 HIS A 131 3.033 6.633 2.006 1.00 0.00 C ATOM 1420 CE1 HIS A 131 4.961 6.550 2.986 1.00 0.00 C ATOM 1421 NE2 HIS A 131 4.217 5.908 2.085 1.00 0.00 N ATOM 0 H HIS A 131 1.496 7.870 0.637 1.00 0.00 H new ATOM 0 HA HIS A 131 0.899 10.301 2.345 1.00 0.00 H new ATOM 0 HB2 HIS A 131 2.539 9.465 3.931 1.00 0.00 H new ATOM 0 HB3 HIS A 131 1.240 8.304 3.745 1.00 0.00 H new ATOM 0 HD1 HIS A 131 4.695 8.277 4.175 1.00 0.00 H new ATOM 0 HD2 HIS A 131 2.198 6.392 1.365 1.00 0.00 H new ATOM 0 HE1 HIS A 131 5.952 6.241 3.284 1.00 0.00 H new ATOM 1429 N PRO A 132 3.116 11.419 1.541 1.00 0.00 N ATOM 1430 CA PRO A 132 4.203 12.130 0.809 1.00 0.00 C ATOM 1431 C PRO A 132 5.577 11.425 0.939 1.00 0.00 C ATOM 1432 O PRO A 132 6.591 12.065 1.134 1.00 0.00 O ATOM 1433 CB PRO A 132 4.240 13.547 1.444 1.00 0.00 C ATOM 1434 CG PRO A 132 3.295 13.531 2.676 1.00 0.00 C ATOM 1435 CD PRO A 132 2.493 12.214 2.629 1.00 0.00 C ATOM 0 HA PRO A 132 4.005 12.151 -0.263 1.00 0.00 H new ATOM 0 HB2 PRO A 132 5.255 13.807 1.743 1.00 0.00 H new ATOM 0 HB3 PRO A 132 3.918 14.299 0.723 1.00 0.00 H new ATOM 0 HG2 PRO A 132 3.869 13.597 3.600 1.00 0.00 H new ATOM 0 HG3 PRO A 132 2.624 14.390 2.655 1.00 0.00 H new ATOM 0 HD2 PRO A 132 2.545 11.687 3.582 1.00 0.00 H new ATOM 0 HD3 PRO A 132 1.439 12.402 2.426 1.00 0.00 H new ATOM 1443 N PHE A 133 5.637 10.126 0.809 1.00 0.00 N ATOM 1444 CA PHE A 133 6.959 9.434 0.902 1.00 0.00 C ATOM 1445 C PHE A 133 6.935 8.154 0.058 1.00 0.00 C ATOM 1446 O PHE A 133 7.696 7.238 0.287 1.00 0.00 O ATOM 1447 CB PHE A 133 7.262 9.095 2.366 1.00 0.00 C ATOM 1448 CG PHE A 133 7.753 10.335 3.080 1.00 0.00 C ATOM 1449 CD1 PHE A 133 9.064 10.800 2.859 1.00 0.00 C ATOM 1450 CD2 PHE A 133 6.901 11.027 3.962 1.00 0.00 C ATOM 1451 CE1 PHE A 133 9.523 11.955 3.520 1.00 0.00 C ATOM 1452 CE2 PHE A 133 7.360 12.183 4.623 1.00 0.00 C ATOM 1453 CZ PHE A 133 8.670 12.647 4.402 1.00 0.00 C ATOM 0 H PHE A 133 4.836 9.517 0.644 1.00 0.00 H new ATOM 0 HA PHE A 133 7.739 10.093 0.522 1.00 0.00 H new ATOM 0 HB2 PHE A 133 6.366 8.712 2.855 1.00 0.00 H new ATOM 0 HB3 PHE A 133 8.015 8.309 2.420 1.00 0.00 H new ATOM 0 HD1 PHE A 133 9.718 10.270 2.182 1.00 0.00 H new ATOM 0 HD2 PHE A 133 5.895 10.671 4.132 1.00 0.00 H new ATOM 0 HE1 PHE A 133 10.529 12.310 3.351 1.00 0.00 H new ATOM 0 HE2 PHE A 133 6.706 12.713 5.300 1.00 0.00 H new ATOM 0 HZ PHE A 133 9.021 13.534 4.909 1.00 0.00 H new ATOM 1463 N PHE A 134 6.069 8.082 -0.920 1.00 0.00 N ATOM 1464 CA PHE A 134 6.004 6.860 -1.780 1.00 0.00 C ATOM 1465 C PHE A 134 5.521 7.249 -3.180 1.00 0.00 C ATOM 1466 O PHE A 134 4.413 6.941 -3.572 1.00 0.00 O ATOM 1467 CB PHE A 134 5.029 5.854 -1.157 1.00 0.00 C ATOM 1468 CG PHE A 134 5.267 4.478 -1.735 1.00 0.00 C ATOM 1469 CD1 PHE A 134 6.329 3.688 -1.254 1.00 0.00 C ATOM 1470 CD2 PHE A 134 4.426 3.983 -2.750 1.00 0.00 C ATOM 1471 CE1 PHE A 134 6.552 2.405 -1.788 1.00 0.00 C ATOM 1472 CE2 PHE A 134 4.648 2.699 -3.285 1.00 0.00 C ATOM 1473 CZ PHE A 134 5.711 1.910 -2.804 1.00 0.00 C ATOM 0 H PHE A 134 5.403 8.816 -1.161 1.00 0.00 H new ATOM 0 HA PHE A 134 6.993 6.408 -1.853 1.00 0.00 H new ATOM 0 HB2 PHE A 134 5.160 5.831 -0.075 1.00 0.00 H new ATOM 0 HB3 PHE A 134 4.002 6.165 -1.347 1.00 0.00 H new ATOM 0 HD1 PHE A 134 6.973 4.067 -0.474 1.00 0.00 H new ATOM 0 HD2 PHE A 134 3.611 4.588 -3.118 1.00 0.00 H new ATOM 0 HE1 PHE A 134 7.367 1.800 -1.419 1.00 0.00 H new ATOM 0 HE2 PHE A 134 4.003 2.320 -4.064 1.00 0.00 H new ATOM 0 HZ PHE A 134 5.881 0.926 -3.214 1.00 0.00 H new ATOM 1483 N LYS A 135 6.343 7.927 -3.939 1.00 0.00 N ATOM 1484 CA LYS A 135 5.933 8.342 -5.316 1.00 0.00 C ATOM 1485 C LYS A 135 7.160 8.368 -6.232 1.00 0.00 C ATOM 1486 O LYS A 135 8.251 8.009 -5.836 1.00 0.00 O ATOM 1487 CB LYS A 135 5.318 9.742 -5.264 1.00 0.00 C ATOM 1488 CG LYS A 135 4.186 9.769 -4.237 1.00 0.00 C ATOM 1489 CD LYS A 135 3.420 11.086 -4.358 1.00 0.00 C ATOM 1490 CE LYS A 135 2.515 11.259 -3.139 1.00 0.00 C ATOM 1491 NZ LYS A 135 1.665 12.471 -3.316 1.00 0.00 N ATOM 0 H LYS A 135 7.283 8.212 -3.665 1.00 0.00 H new ATOM 0 HA LYS A 135 5.202 7.632 -5.703 1.00 0.00 H new ATOM 0 HB2 LYS A 135 6.080 10.475 -4.999 1.00 0.00 H new ATOM 0 HB3 LYS A 135 4.937 10.019 -6.247 1.00 0.00 H new ATOM 0 HG2 LYS A 135 3.512 8.928 -4.400 1.00 0.00 H new ATOM 0 HG3 LYS A 135 4.591 9.663 -3.231 1.00 0.00 H new ATOM 0 HD2 LYS A 135 4.118 11.920 -4.428 1.00 0.00 H new ATOM 0 HD3 LYS A 135 2.824 11.091 -5.271 1.00 0.00 H new ATOM 0 HE2 LYS A 135 1.887 10.377 -3.012 1.00 0.00 H new ATOM 0 HE3 LYS A 135 3.118 11.354 -2.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 1.050 12.588 -2.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 2.272 13.309 -3.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 1.079 12.363 -4.169 1.00 0.00 H new ATOM 1505 N ARG A 136 6.985 8.795 -7.455 1.00 0.00 N ATOM 1506 CA ARG A 136 8.135 8.853 -8.409 1.00 0.00 C ATOM 1507 C ARG A 136 8.766 10.246 -8.359 1.00 0.00 C ATOM 1508 O ARG A 136 8.572 10.992 -7.419 1.00 0.00 O ATOM 1509 CB ARG A 136 7.630 8.579 -9.828 1.00 0.00 C ATOM 1510 CG ARG A 136 7.130 7.130 -9.928 1.00 0.00 C ATOM 1511 CD ARG A 136 8.306 6.136 -9.778 1.00 0.00 C ATOM 1512 NE ARG A 136 8.202 5.062 -10.817 1.00 0.00 N ATOM 1513 CZ ARG A 136 7.072 4.443 -11.046 1.00 0.00 C ATOM 1514 NH1 ARG A 136 6.028 4.674 -10.299 1.00 0.00 N ATOM 1515 NH2 ARG A 136 6.997 3.565 -12.009 1.00 0.00 N ATOM 0 H ARG A 136 6.092 9.108 -7.837 1.00 0.00 H new ATOM 0 HA ARG A 136 8.877 8.104 -8.132 1.00 0.00 H new ATOM 0 HB2 ARG A 136 6.825 9.270 -10.078 1.00 0.00 H new ATOM 0 HB3 ARG A 136 8.430 8.748 -10.548 1.00 0.00 H new ATOM 0 HG2 ARG A 136 6.387 6.942 -9.153 1.00 0.00 H new ATOM 0 HG3 ARG A 136 6.636 6.975 -10.887 1.00 0.00 H new ATOM 0 HD2 ARG A 136 9.254 6.663 -9.881 1.00 0.00 H new ATOM 0 HD3 ARG A 136 8.294 5.693 -8.782 1.00 0.00 H new ATOM 0 HE ARG A 136 9.029 4.808 -11.357 1.00 0.00 H new ATOM 0 HH11 ARG A 136 6.089 5.341 -9.530 1.00 0.00 H new ATOM 0 HH12 ARG A 136 5.151 4.187 -10.484 1.00 0.00 H new ATOM 0 HH21 ARG A 136 7.818 3.363 -12.580 1.00 0.00 H new ATOM 0 HH22 ARG A 136 6.118 3.081 -12.190 1.00 0.00 H new ATOM 1529 N ASN A 137 9.518 10.603 -9.364 1.00 0.00 N ATOM 1530 CA ASN A 137 10.160 11.949 -9.378 1.00 0.00 C ATOM 1531 C ASN A 137 10.830 12.212 -8.027 1.00 0.00 C ATOM 1532 O ASN A 137 11.029 13.344 -7.631 1.00 0.00 O ATOM 1533 CB ASN A 137 9.096 13.018 -9.636 1.00 0.00 C ATOM 1534 CG ASN A 137 8.333 12.678 -10.919 1.00 0.00 C ATOM 1535 OD1 ASN A 137 8.687 11.752 -11.622 1.00 0.00 O ATOM 1536 ND2 ASN A 137 7.294 13.392 -11.254 1.00 0.00 N ATOM 0 H ASN A 137 9.716 10.020 -10.177 1.00 0.00 H new ATOM 0 HA ASN A 137 10.911 11.984 -10.167 1.00 0.00 H new ATOM 0 HB2 ASN A 137 8.407 13.071 -8.793 1.00 0.00 H new ATOM 0 HB3 ASN A 137 9.564 13.998 -9.727 1.00 0.00 H new ATOM 0 HD21 ASN A 137 6.778 13.173 -12.106 1.00 0.00 H new ATOM 0 HD22 ASN A 137 6.997 14.169 -10.664 1.00 0.00 H new ATOM 1543 N SER A 138 11.177 11.174 -7.316 1.00 0.00 N ATOM 1544 CA SER A 138 11.832 11.364 -5.992 1.00 0.00 C ATOM 1545 C SER A 138 12.459 10.038 -5.537 1.00 0.00 C ATOM 1546 O SER A 138 11.961 9.410 -4.624 1.00 0.00 O ATOM 1547 CB SER A 138 10.783 11.805 -4.972 1.00 0.00 C ATOM 1548 OG SER A 138 10.089 12.940 -5.472 1.00 0.00 O ATOM 0 H SER A 138 11.035 10.203 -7.595 1.00 0.00 H new ATOM 0 HA SER A 138 12.609 12.124 -6.073 1.00 0.00 H new ATOM 0 HB2 SER A 138 10.083 10.992 -4.779 1.00 0.00 H new ATOM 0 HB3 SER A 138 11.261 12.046 -4.023 1.00 0.00 H new ATOM 0 HG SER A 138 10.678 13.447 -6.069 1.00 0.00 H new ATOM 1554 N PRO A 139 13.531 9.639 -6.188 1.00 0.00 N ATOM 1555 CA PRO A 139 14.220 8.378 -5.850 1.00 0.00 C ATOM 1556 C PRO A 139 14.908 8.499 -4.477 1.00 0.00 C ATOM 1557 O PRO A 139 15.943 7.903 -4.247 1.00 0.00 O ATOM 1558 CB PRO A 139 15.257 8.181 -6.984 1.00 0.00 C ATOM 1559 CG PRO A 139 15.227 9.459 -7.873 1.00 0.00 C ATOM 1560 CD PRO A 139 14.132 10.392 -7.311 1.00 0.00 C ATOM 0 HA PRO A 139 13.538 7.531 -5.777 1.00 0.00 H new ATOM 0 HB2 PRO A 139 16.253 8.025 -6.570 1.00 0.00 H new ATOM 0 HB3 PRO A 139 15.016 7.297 -7.575 1.00 0.00 H new ATOM 0 HG2 PRO A 139 16.197 9.956 -7.862 1.00 0.00 H new ATOM 0 HG3 PRO A 139 15.014 9.199 -8.910 1.00 0.00 H new ATOM 0 HD2 PRO A 139 14.555 11.338 -6.971 1.00 0.00 H new ATOM 0 HD3 PRO A 139 13.387 10.630 -8.071 1.00 0.00 H new ATOM 1568 N PHE A 140 14.344 9.260 -3.567 1.00 0.00 N ATOM 1569 CA PHE A 140 14.965 9.418 -2.211 1.00 0.00 C ATOM 1570 C PHE A 140 13.903 9.201 -1.124 1.00 0.00 C ATOM 1571 O PHE A 140 14.206 9.171 0.052 1.00 0.00 O ATOM 1572 CB PHE A 140 15.583 10.823 -2.089 1.00 0.00 C ATOM 1573 CG PHE A 140 14.517 11.858 -1.791 1.00 0.00 C ATOM 1574 CD1 PHE A 140 14.184 12.155 -0.455 1.00 0.00 C ATOM 1575 CD2 PHE A 140 13.864 12.526 -2.845 1.00 0.00 C ATOM 1576 CE1 PHE A 140 13.199 13.120 -0.172 1.00 0.00 C ATOM 1577 CE2 PHE A 140 12.877 13.491 -2.562 1.00 0.00 C ATOM 1578 CZ PHE A 140 12.545 13.788 -1.225 1.00 0.00 C ATOM 0 H PHE A 140 13.478 9.780 -3.706 1.00 0.00 H new ATOM 0 HA PHE A 140 15.752 8.675 -2.081 1.00 0.00 H new ATOM 0 HB2 PHE A 140 16.332 10.828 -1.297 1.00 0.00 H new ATOM 0 HB3 PHE A 140 16.097 11.080 -3.015 1.00 0.00 H new ATOM 0 HD1 PHE A 140 14.685 11.642 0.353 1.00 0.00 H new ATOM 0 HD2 PHE A 140 14.120 12.299 -3.869 1.00 0.00 H new ATOM 0 HE1 PHE A 140 12.945 13.348 0.853 1.00 0.00 H new ATOM 0 HE2 PHE A 140 12.375 14.003 -3.370 1.00 0.00 H new ATOM 0 HZ PHE A 140 11.789 14.528 -1.008 1.00 0.00 H new ATOM 1588 N LEU A 141 12.664 9.041 -1.505 1.00 0.00 N ATOM 1589 CA LEU A 141 11.598 8.818 -0.484 1.00 0.00 C ATOM 1590 C LEU A 141 11.822 7.462 0.185 1.00 0.00 C ATOM 1591 O LEU A 141 11.862 7.355 1.394 1.00 0.00 O ATOM 1592 CB LEU A 141 10.221 8.832 -1.154 1.00 0.00 C ATOM 1593 CG LEU A 141 10.038 10.126 -1.956 1.00 0.00 C ATOM 1594 CD1 LEU A 141 8.644 10.132 -2.592 1.00 0.00 C ATOM 1595 CD2 LEU A 141 10.192 11.343 -1.029 1.00 0.00 C ATOM 0 H LEU A 141 12.344 9.055 -2.474 1.00 0.00 H new ATOM 0 HA LEU A 141 11.640 9.612 0.261 1.00 0.00 H new ATOM 0 HB2 LEU A 141 10.120 7.969 -1.813 1.00 0.00 H new ATOM 0 HB3 LEU A 141 9.440 8.750 -0.399 1.00 0.00 H new ATOM 0 HG LEU A 141 10.796 10.179 -2.737 1.00 0.00 H new ATOM 0 HD11 LEU A 141 8.509 11.050 -3.164 1.00 0.00 H new ATOM 0 HD12 LEU A 141 8.543 9.273 -3.256 1.00 0.00 H new ATOM 0 HD13 LEU A 141 7.887 10.077 -1.810 1.00 0.00 H new ATOM 0 HD21 LEU A 141 10.061 12.259 -1.606 1.00 0.00 H new ATOM 0 HD22 LEU A 141 9.439 11.299 -0.242 1.00 0.00 H new ATOM 0 HD23 LEU A 141 11.186 11.336 -0.581 1.00 0.00 H new ATOM 1607 N LEU A 142 11.972 6.423 -0.593 1.00 0.00 N ATOM 1608 CA LEU A 142 12.198 5.072 -0.006 1.00 0.00 C ATOM 1609 C LEU A 142 13.270 5.158 1.081 1.00 0.00 C ATOM 1610 O LEU A 142 13.093 4.673 2.181 1.00 0.00 O ATOM 1611 CB LEU A 142 12.661 4.118 -1.107 1.00 0.00 C ATOM 1612 CG LEU A 142 11.652 4.123 -2.262 1.00 0.00 C ATOM 1613 CD1 LEU A 142 12.170 3.227 -3.390 1.00 0.00 C ATOM 1614 CD2 LEU A 142 10.290 3.599 -1.772 1.00 0.00 C ATOM 0 H LEU A 142 11.948 6.453 -1.612 1.00 0.00 H new ATOM 0 HA LEU A 142 11.271 4.704 0.433 1.00 0.00 H new ATOM 0 HB2 LEU A 142 13.644 4.418 -1.470 1.00 0.00 H new ATOM 0 HB3 LEU A 142 12.763 3.109 -0.707 1.00 0.00 H new ATOM 0 HG LEU A 142 11.530 5.142 -2.629 1.00 0.00 H new ATOM 0 HD11 LEU A 142 11.455 3.228 -4.213 1.00 0.00 H new ATOM 0 HD12 LEU A 142 13.130 3.604 -3.743 1.00 0.00 H new ATOM 0 HD13 LEU A 142 12.294 2.210 -3.019 1.00 0.00 H new ATOM 0 HD21 LEU A 142 9.579 3.606 -2.598 1.00 0.00 H new ATOM 0 HD22 LEU A 142 10.404 2.581 -1.400 1.00 0.00 H new ATOM 0 HD23 LEU A 142 9.921 4.239 -0.970 1.00 0.00 H new ATOM 1626 N ASP A 143 14.379 5.774 0.783 1.00 0.00 N ATOM 1627 CA ASP A 143 15.460 5.893 1.798 1.00 0.00 C ATOM 1628 C ASP A 143 15.045 6.894 2.880 1.00 0.00 C ATOM 1629 O ASP A 143 15.870 7.570 3.461 1.00 0.00 O ATOM 1630 CB ASP A 143 16.742 6.382 1.119 1.00 0.00 C ATOM 1631 CG ASP A 143 17.127 5.415 -0.001 1.00 0.00 C ATOM 1632 OD1 ASP A 143 16.230 4.902 -0.649 1.00 0.00 O ATOM 1633 OD2 ASP A 143 18.314 5.204 -0.194 1.00 0.00 O ATOM 0 H ASP A 143 14.583 6.200 -0.121 1.00 0.00 H new ATOM 0 HA ASP A 143 15.635 4.919 2.255 1.00 0.00 H new ATOM 0 HB2 ASP A 143 16.593 7.383 0.714 1.00 0.00 H new ATOM 0 HB3 ASP A 143 17.549 6.450 1.848 1.00 0.00 H new ATOM 1638 N GLN A 144 13.770 6.997 3.157 1.00 0.00 N ATOM 1639 CA GLN A 144 13.308 7.954 4.202 1.00 0.00 C ATOM 1640 C GLN A 144 11.966 7.478 4.772 1.00 0.00 C ATOM 1641 O GLN A 144 11.058 8.256 4.983 1.00 0.00 O ATOM 1642 CB GLN A 144 13.143 9.344 3.577 1.00 0.00 C ATOM 1643 CG GLN A 144 13.123 10.402 4.681 1.00 0.00 C ATOM 1644 CD GLN A 144 13.047 11.796 4.055 1.00 0.00 C ATOM 1645 OE1 GLN A 144 12.469 12.700 4.626 1.00 0.00 O ATOM 1646 NE2 GLN A 144 13.609 12.010 2.898 1.00 0.00 N ATOM 0 H GLN A 144 13.031 6.459 2.704 1.00 0.00 H new ATOM 0 HA GLN A 144 14.042 8.004 5.006 1.00 0.00 H new ATOM 0 HB2 GLN A 144 13.961 9.542 2.884 1.00 0.00 H new ATOM 0 HB3 GLN A 144 12.219 9.388 3.000 1.00 0.00 H new ATOM 0 HG2 GLN A 144 12.268 10.240 5.338 1.00 0.00 H new ATOM 0 HG3 GLN A 144 14.019 10.317 5.296 1.00 0.00 H new ATOM 0 HE21 GLN A 144 14.094 11.252 2.419 1.00 0.00 H new ATOM 0 HE22 GLN A 144 13.564 12.936 2.472 1.00 0.00 H new ATOM 1655 N ILE A 145 11.840 6.203 5.029 1.00 0.00 N ATOM 1656 CA ILE A 145 10.564 5.663 5.594 1.00 0.00 C ATOM 1657 C ILE A 145 10.914 4.519 6.554 1.00 0.00 C ATOM 1658 O ILE A 145 11.494 3.527 6.164 1.00 0.00 O ATOM 1659 CB ILE A 145 9.659 5.144 4.452 1.00 0.00 C ATOM 1660 CG1 ILE A 145 9.947 5.937 3.172 1.00 0.00 C ATOM 1661 CG2 ILE A 145 8.182 5.315 4.831 1.00 0.00 C ATOM 1662 CD1 ILE A 145 8.977 5.503 2.070 1.00 0.00 C ATOM 0 H ILE A 145 12.569 5.507 4.872 1.00 0.00 H new ATOM 0 HA ILE A 145 10.025 6.446 6.127 1.00 0.00 H new ATOM 0 HB ILE A 145 9.867 4.087 4.287 1.00 0.00 H new ATOM 0 HG12 ILE A 145 9.842 7.005 3.363 1.00 0.00 H new ATOM 0 HG13 ILE A 145 10.975 5.769 2.852 1.00 0.00 H new ATOM 0 HG21 ILE A 145 7.553 4.947 4.020 1.00 0.00 H new ATOM 0 HG22 ILE A 145 7.972 4.750 5.739 1.00 0.00 H new ATOM 0 HG23 ILE A 145 7.970 6.370 5.003 1.00 0.00 H new ATOM 0 HD11 ILE A 145 9.183 6.068 1.161 1.00 0.00 H new ATOM 0 HD12 ILE A 145 9.103 4.439 1.873 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.953 5.693 2.391 1.00 0.00 H new ATOM 1674 N LYS A 146 10.588 4.663 7.811 1.00 0.00 N ATOM 1675 CA LYS A 146 10.927 3.593 8.799 1.00 0.00 C ATOM 1676 C LYS A 146 9.857 3.544 9.889 1.00 0.00 C ATOM 1677 O LYS A 146 8.973 4.376 9.943 1.00 0.00 O ATOM 1678 CB LYS A 146 12.286 3.911 9.439 1.00 0.00 C ATOM 1679 CG LYS A 146 12.312 5.374 9.945 1.00 0.00 C ATOM 1680 CD LYS A 146 12.867 6.319 8.855 1.00 0.00 C ATOM 1681 CE LYS A 146 14.394 6.407 8.959 1.00 0.00 C ATOM 1682 NZ LYS A 146 14.769 7.011 10.269 1.00 0.00 N ATOM 0 H LYS A 146 10.103 5.473 8.197 1.00 0.00 H new ATOM 0 HA LYS A 146 10.972 2.630 8.291 1.00 0.00 H new ATOM 0 HB2 LYS A 146 12.474 3.229 10.268 1.00 0.00 H new ATOM 0 HB3 LYS A 146 13.083 3.756 8.712 1.00 0.00 H new ATOM 0 HG2 LYS A 146 11.306 5.685 10.225 1.00 0.00 H new ATOM 0 HG3 LYS A 146 12.928 5.443 10.841 1.00 0.00 H new ATOM 0 HD2 LYS A 146 12.583 5.954 7.868 1.00 0.00 H new ATOM 0 HD3 LYS A 146 12.430 7.311 8.966 1.00 0.00 H new ATOM 0 HE2 LYS A 146 14.833 5.414 8.865 1.00 0.00 H new ATOM 0 HE3 LYS A 146 14.791 7.009 8.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 15.408 7.816 10.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 13.912 7.341 10.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 15.249 6.298 10.855 1.00 0.00 H new ATOM 1696 N ARG A 147 9.934 2.576 10.766 1.00 0.00 N ATOM 1697 CA ARG A 147 8.926 2.470 11.863 1.00 0.00 C ATOM 1698 C ARG A 147 9.469 3.134 13.123 1.00 0.00 C ATOM 1699 O ARG A 147 10.664 3.250 13.314 1.00 0.00 O ATOM 1700 CB ARG A 147 8.619 0.990 12.140 1.00 0.00 C ATOM 1701 CG ARG A 147 9.838 0.288 12.787 1.00 0.00 C ATOM 1702 CD ARG A 147 9.771 0.350 14.335 1.00 0.00 C ATOM 1703 NE ARG A 147 11.115 0.716 14.893 1.00 0.00 N ATOM 1704 CZ ARG A 147 12.209 0.130 14.476 1.00 0.00 C ATOM 1705 NH1 ARG A 147 12.150 -0.867 13.636 1.00 0.00 N ATOM 1706 NH2 ARG A 147 13.367 0.524 14.930 1.00 0.00 N ATOM 0 H ARG A 147 10.653 1.853 10.769 1.00 0.00 H new ATOM 0 HA ARG A 147 8.008 2.974 11.562 1.00 0.00 H new ATOM 0 HB2 ARG A 147 7.755 0.910 12.800 1.00 0.00 H new ATOM 0 HB3 ARG A 147 8.356 0.488 11.209 1.00 0.00 H new ATOM 0 HG2 ARG A 147 9.874 -0.753 12.464 1.00 0.00 H new ATOM 0 HG3 ARG A 147 10.757 0.761 12.442 1.00 0.00 H new ATOM 0 HD2 ARG A 147 9.027 1.084 14.646 1.00 0.00 H new ATOM 0 HD3 ARG A 147 9.453 -0.614 14.732 1.00 0.00 H new ATOM 0 HE ARG A 147 11.178 1.436 15.612 1.00 0.00 H new ATOM 0 HH11 ARG A 147 11.246 -1.196 13.298 1.00 0.00 H new ATOM 0 HH12 ARG A 147 13.008 -1.317 13.317 1.00 0.00 H new ATOM 0 HH21 ARG A 147 13.417 1.285 15.607 1.00 0.00 H new ATOM 0 HH22 ARG A 147 14.222 0.071 14.608 1.00 0.00 H new ATOM 1720 N LYS A 148 8.594 3.575 13.983 1.00 0.00 N ATOM 1721 CA LYS A 148 9.040 4.242 15.243 1.00 0.00 C ATOM 1722 C LYS A 148 10.182 3.442 15.878 1.00 0.00 C ATOM 1723 O LYS A 148 11.213 3.984 16.225 1.00 0.00 O ATOM 1724 CB LYS A 148 7.867 4.315 16.219 1.00 0.00 C ATOM 1725 CG LYS A 148 7.162 2.965 16.245 1.00 0.00 C ATOM 1726 CD LYS A 148 6.164 2.923 17.404 1.00 0.00 C ATOM 1727 CE LYS A 148 5.626 1.499 17.561 1.00 0.00 C ATOM 1728 NZ LYS A 148 6.764 0.557 17.757 1.00 0.00 N ATOM 0 H LYS A 148 7.583 3.503 13.869 1.00 0.00 H new ATOM 0 HA LYS A 148 9.391 5.248 15.014 1.00 0.00 H new ATOM 0 HB2 LYS A 148 8.222 4.574 17.216 1.00 0.00 H new ATOM 0 HB3 LYS A 148 7.172 5.098 15.915 1.00 0.00 H new ATOM 0 HG2 LYS A 148 6.644 2.797 15.301 1.00 0.00 H new ATOM 0 HG3 LYS A 148 7.894 2.164 16.354 1.00 0.00 H new ATOM 0 HD2 LYS A 148 6.648 3.244 18.326 1.00 0.00 H new ATOM 0 HD3 LYS A 148 5.343 3.615 17.217 1.00 0.00 H new ATOM 0 HE2 LYS A 148 4.946 1.447 18.412 1.00 0.00 H new ATOM 0 HE3 LYS A 148 5.053 1.216 16.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 6.437 -0.278 18.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 7.133 0.261 16.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 7.518 1.031 18.294 1.00 0.00 H new TER 1742 LYS A 148