USER MOD reduce.3.24.130724 H: found=0, std=0, add=1101, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1096 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 105 LYS NZ :NH3+ 152:sc= 0.0177 (180deg=0) USER MOD Set 1.2: A 106 GLN : amide:sc= 0.0151 K(o=0.033,f=-0.83) USER MOD Set 2.1: A 70 TYR OH : rot -117:sc= 0.0981 USER MOD Set 2.2: A 115 HIS : no HD1:sc= -1.59! C(o=-1.5!,f=-3.7!) USER MOD Set 3.1: A 44 THR OG1 : rot -74:sc= 0.012 USER MOD Set 3.2: A 61 GLN : amide:sc= -0.286 K(o=-0.27,f=-2!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 MET CE :methyl 168:sc= 0 (180deg=-0.066) USER MOD Single : A 8 CYS SG : rot 130:sc= -0.959 USER MOD Single : A 9 ASN : amide:sc= -0.214 K(o=-0.21,f=-2.6!) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0.00068) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl 173:sc= -1.45 (180deg=-1.53) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= -0.185 K(o=-0.19,f=-0.8) USER MOD Single : A 28 SER OG : rot -28:sc= 1.18 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 81:sc= 0.223 USER MOD Single : A 40 THR OG1 : rot -6:sc= 1.24 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 35:sc= 0.204 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=-0.083) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 HIS : no HE2:sc= -0.546 X(o=-0.55,f=-0.28) USER MOD Single : A 73 ASN : amide:sc= -0.017 K(o=-0.017,f=-0.58) USER MOD Single : A 74 THR OG1 : rot 180:sc= -0.773 USER MOD Single : A 76 THR OG1 : rot -60:sc= -0.647 USER MOD Single : A 78 CYS SG : rot 170:sc= -4.02! USER MOD Single : A 83 GLN :FLIP amide:sc= -0.565 F(o=-1.4,f=-0.56) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 56:sc= 0.052 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 16:sc= 0.863 USER MOD Single : A 112 ASN : amide:sc= -4.01! C(o=-4!,f=-17!) USER MOD Single : A 114 CYS SG : rot 107:sc= -2.37! USER MOD Single : A 124 GLN : amide:sc= -0.594 K(o=-0.59,f=-1.9!) USER MOD Single : A 131 ASN : amide:sc= -0.035 K(o=-0.035,f=-0.56) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 137 MET CE :methyl -142:sc= -0.0427 (180deg=-0.181) USER MOD Single : A 140 SER OG : rot 180:sc= -0.0538 USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=-0.044) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 5.098 -9.762 -21.492 1.00 0.00 N ATOM 2 CA GLY A 1 4.574 -10.840 -20.622 1.00 0.00 C ATOM 3 C GLY A 1 3.840 -10.313 -19.374 1.00 0.00 C ATOM 4 O GLY A 1 4.255 -10.537 -18.239 1.00 0.00 O ATOM 0 H1 GLY A 1 5.580 -10.182 -22.313 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.311 -9.167 -21.820 1.00 0.00 H new ATOM 0 H3 GLY A 1 5.772 -9.179 -20.955 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.892 -11.464 -21.199 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.400 -11.477 -20.307 1.00 0.00 H new ATOM 9 N SER A 2 2.770 -9.572 -19.640 1.00 0.00 N ATOM 10 CA SER A 2 1.967 -8.925 -18.587 1.00 0.00 C ATOM 11 C SER A 2 0.492 -9.306 -18.770 1.00 0.00 C ATOM 12 O SER A 2 0.121 -9.918 -19.772 1.00 0.00 O ATOM 13 CB SER A 2 2.160 -7.406 -18.657 1.00 0.00 C ATOM 14 OG SER A 2 1.826 -6.824 -17.394 1.00 0.00 O ATOM 0 H SER A 2 2.429 -9.398 -20.585 1.00 0.00 H new ATOM 0 HA SER A 2 2.292 -9.265 -17.604 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.193 -7.171 -18.916 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.531 -6.985 -19.441 1.00 0.00 H new ATOM 0 HG SER A 2 1.951 -5.853 -17.438 1.00 0.00 H new ATOM 20 N HIS A 3 -0.306 -8.967 -17.768 1.00 0.00 N ATOM 21 CA HIS A 3 -1.755 -9.253 -17.797 1.00 0.00 C ATOM 22 C HIS A 3 -2.564 -7.971 -18.006 1.00 0.00 C ATOM 23 O HIS A 3 -3.212 -7.831 -19.039 1.00 0.00 O ATOM 24 CB HIS A 3 -2.211 -9.988 -16.535 1.00 0.00 C ATOM 25 CG HIS A 3 -2.644 -11.424 -16.866 1.00 0.00 C ATOM 26 ND1 HIS A 3 -1.860 -12.489 -16.834 1.00 0.00 N ATOM 27 CD2 HIS A 3 -3.868 -11.808 -17.202 1.00 0.00 C ATOM 28 CE1 HIS A 3 -2.608 -13.553 -17.147 1.00 0.00 C ATOM 29 NE2 HIS A 3 -3.844 -13.130 -17.370 1.00 0.00 N ATOM 0 H HIS A 3 0.013 -8.495 -16.922 1.00 0.00 H new ATOM 0 HA HIS A 3 -1.940 -9.913 -18.645 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -1.400 -10.007 -15.807 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -3.040 -9.450 -16.075 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -4.728 -11.166 -17.318 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -2.265 -14.575 -17.207 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -4.639 -13.715 -17.626 1.00 0.00 H new ATOM 37 N MET A 4 -2.351 -7.008 -17.101 1.00 0.00 N ATOM 38 CA MET A 4 -3.035 -5.696 -17.084 1.00 0.00 C ATOM 39 C MET A 4 -4.560 -5.881 -16.939 1.00 0.00 C ATOM 40 O MET A 4 -5.127 -6.908 -17.303 1.00 0.00 O ATOM 41 CB MET A 4 -2.653 -4.898 -18.344 1.00 0.00 C ATOM 42 CG MET A 4 -3.264 -3.495 -18.419 1.00 0.00 C ATOM 43 SD MET A 4 -4.030 -3.139 -20.044 1.00 0.00 S ATOM 44 CE MET A 4 -5.439 -4.230 -20.019 1.00 0.00 C ATOM 0 H MET A 4 -1.682 -7.116 -16.338 1.00 0.00 H new ATOM 0 HA MET A 4 -2.708 -5.121 -16.218 1.00 0.00 H new ATOM 0 HB2 MET A 4 -1.567 -4.810 -18.387 1.00 0.00 H new ATOM 0 HB3 MET A 4 -2.963 -5.463 -19.224 1.00 0.00 H new ATOM 0 HG2 MET A 4 -4.016 -3.389 -17.637 1.00 0.00 H new ATOM 0 HG3 MET A 4 -2.489 -2.755 -18.218 1.00 0.00 H new ATOM 0 HE1 MET A 4 -6.112 -3.974 -20.837 1.00 0.00 H new ATOM 0 HE2 MET A 4 -5.103 -5.261 -20.134 1.00 0.00 H new ATOM 0 HE3 MET A 4 -5.965 -4.123 -19.070 1.00 0.00 H new ATOM 54 N GLY A 5 -5.159 -4.947 -16.198 1.00 0.00 N ATOM 55 CA GLY A 5 -6.621 -4.965 -15.974 1.00 0.00 C ATOM 56 C GLY A 5 -7.058 -3.982 -14.886 1.00 0.00 C ATOM 57 O GLY A 5 -8.082 -3.315 -15.004 1.00 0.00 O ATOM 0 H GLY A 5 -4.670 -4.175 -15.745 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -7.131 -4.721 -16.906 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -6.930 -5.972 -15.695 1.00 0.00 H new ATOM 61 N ALA A 6 -6.232 -3.899 -13.850 1.00 0.00 N ATOM 62 CA ALA A 6 -6.418 -2.918 -12.772 1.00 0.00 C ATOM 63 C ALA A 6 -5.435 -1.753 -12.931 1.00 0.00 C ATOM 64 O ALA A 6 -4.459 -1.861 -13.672 1.00 0.00 O ATOM 65 CB ALA A 6 -6.222 -3.621 -11.434 1.00 0.00 C ATOM 0 H ALA A 6 -5.418 -4.502 -13.728 1.00 0.00 H new ATOM 0 HA ALA A 6 -7.425 -2.504 -12.817 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -6.357 -2.905 -10.623 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -6.953 -4.424 -11.334 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -5.216 -4.038 -11.386 1.00 0.00 H new ATOM 71 N ALA A 7 -5.774 -0.655 -12.257 1.00 0.00 N ATOM 72 CA ALA A 7 -5.067 0.646 -12.273 1.00 0.00 C ATOM 73 C ALA A 7 -5.881 1.684 -11.485 1.00 0.00 C ATOM 74 O ALA A 7 -6.874 2.229 -11.963 1.00 0.00 O ATOM 75 CB ALA A 7 -4.812 1.187 -13.690 1.00 0.00 C ATOM 0 H ALA A 7 -6.593 -0.638 -11.649 1.00 0.00 H new ATOM 0 HA ALA A 7 -4.094 0.474 -11.813 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -4.291 2.142 -13.626 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -4.201 0.476 -14.246 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -5.764 1.326 -14.203 1.00 0.00 H new ATOM 81 N CYS A 8 -5.567 1.766 -10.200 1.00 0.00 N ATOM 82 CA CYS A 8 -6.174 2.779 -9.315 1.00 0.00 C ATOM 83 C CYS A 8 -5.133 3.784 -8.812 1.00 0.00 C ATOM 84 O CYS A 8 -3.941 3.601 -9.024 1.00 0.00 O ATOM 85 CB CYS A 8 -6.920 2.099 -8.167 1.00 0.00 C ATOM 86 SG CYS A 8 -8.425 1.241 -8.752 1.00 0.00 S ATOM 0 H CYS A 8 -4.898 1.150 -9.738 1.00 0.00 H new ATOM 0 HA CYS A 8 -6.900 3.351 -9.893 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -6.260 1.383 -7.678 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -7.193 2.843 -7.419 1.00 0.00 H new ATOM 0 HG CYS A 8 -8.437 0.024 -8.294 1.00 0.00 H new ATOM 92 N ASN A 9 -5.597 4.843 -8.174 1.00 0.00 N ATOM 93 CA ASN A 9 -4.743 5.962 -7.738 1.00 0.00 C ATOM 94 C ASN A 9 -4.679 5.959 -6.212 1.00 0.00 C ATOM 95 O ASN A 9 -5.682 6.056 -5.499 1.00 0.00 O ATOM 96 CB ASN A 9 -5.282 7.321 -8.201 1.00 0.00 C ATOM 97 CG ASN A 9 -5.733 7.412 -9.662 1.00 0.00 C ATOM 98 OD1 ASN A 9 -6.275 6.505 -10.290 1.00 0.00 O ATOM 99 ND2 ASN A 9 -5.601 8.586 -10.220 1.00 0.00 N ATOM 0 H ASN A 9 -6.582 4.963 -7.936 1.00 0.00 H new ATOM 0 HA ASN A 9 -3.758 5.824 -8.183 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -6.126 7.588 -7.565 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -4.508 8.070 -8.035 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -5.946 8.742 -11.167 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -5.153 9.346 -9.709 1.00 0.00 H new ATOM 106 N VAL A 10 -3.476 5.665 -5.752 1.00 0.00 N ATOM 107 CA VAL A 10 -3.191 5.560 -4.313 1.00 0.00 C ATOM 108 C VAL A 10 -2.073 6.562 -3.994 1.00 0.00 C ATOM 109 O VAL A 10 -1.204 6.850 -4.818 1.00 0.00 O ATOM 110 CB VAL A 10 -2.889 4.108 -3.854 1.00 0.00 C ATOM 111 CG1 VAL A 10 -3.804 3.069 -4.517 1.00 0.00 C ATOM 112 CG2 VAL A 10 -1.429 3.663 -3.968 1.00 0.00 C ATOM 0 H VAL A 10 -2.669 5.492 -6.351 1.00 0.00 H new ATOM 0 HA VAL A 10 -4.079 5.817 -3.735 1.00 0.00 H new ATOM 0 HB VAL A 10 -3.106 4.151 -2.787 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.545 2.073 -4.157 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -4.842 3.286 -4.267 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.675 3.108 -5.599 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -1.334 2.634 -3.621 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -1.110 3.726 -5.008 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -0.802 4.312 -3.356 1.00 0.00 H new ATOM 122 N LEU A 11 -2.159 7.144 -2.819 1.00 0.00 N ATOM 123 CA LEU A 11 -1.133 8.072 -2.347 1.00 0.00 C ATOM 124 C LEU A 11 0.020 7.247 -1.769 1.00 0.00 C ATOM 125 O LEU A 11 -0.127 6.533 -0.779 1.00 0.00 O ATOM 126 CB LEU A 11 -1.795 9.015 -1.337 1.00 0.00 C ATOM 127 CG LEU A 11 -1.034 10.291 -0.979 1.00 0.00 C ATOM 128 CD1 LEU A 11 0.236 9.958 -0.211 1.00 0.00 C ATOM 129 CD2 LEU A 11 -0.764 11.158 -2.211 1.00 0.00 C ATOM 0 H LEU A 11 -2.927 6.996 -2.165 1.00 0.00 H new ATOM 0 HA LEU A 11 -0.711 8.691 -3.139 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -2.771 9.301 -1.729 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -1.972 8.457 -0.418 1.00 0.00 H new ATOM 0 HG LEU A 11 -1.665 10.890 -0.322 1.00 0.00 H new ATOM 0 HD11 LEU A 11 0.764 10.879 0.035 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -0.022 9.431 0.708 1.00 0.00 H new ATOM 0 HD13 LEU A 11 0.877 9.325 -0.825 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -0.221 12.055 -1.913 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -0.168 10.595 -2.929 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -1.711 11.443 -2.670 1.00 0.00 H new ATOM 141 N PHE A 12 1.157 7.421 -2.416 1.00 0.00 N ATOM 142 CA PHE A 12 2.436 6.788 -2.084 1.00 0.00 C ATOM 143 C PHE A 12 2.957 7.437 -0.808 1.00 0.00 C ATOM 144 O PHE A 12 3.097 8.661 -0.725 1.00 0.00 O ATOM 145 CB PHE A 12 3.439 7.087 -3.200 1.00 0.00 C ATOM 146 CG PHE A 12 4.751 6.338 -3.044 1.00 0.00 C ATOM 147 CD1 PHE A 12 5.733 6.829 -2.181 1.00 0.00 C ATOM 148 CD2 PHE A 12 4.993 5.177 -3.779 1.00 0.00 C ATOM 149 CE1 PHE A 12 6.927 6.164 -2.042 1.00 0.00 C ATOM 150 CE2 PHE A 12 6.194 4.518 -3.649 1.00 0.00 C ATOM 151 CZ PHE A 12 7.172 5.002 -2.776 1.00 0.00 C ATOM 0 H PHE A 12 1.226 8.035 -3.227 1.00 0.00 H new ATOM 0 HA PHE A 12 2.309 5.712 -1.963 1.00 0.00 H new ATOM 0 HB2 PHE A 12 2.992 6.828 -4.160 1.00 0.00 H new ATOM 0 HB3 PHE A 12 3.640 8.158 -3.221 1.00 0.00 H new ATOM 0 HD1 PHE A 12 5.553 7.735 -1.621 1.00 0.00 H new ATOM 0 HD2 PHE A 12 4.238 4.795 -4.450 1.00 0.00 H new ATOM 0 HE1 PHE A 12 7.678 6.541 -1.363 1.00 0.00 H new ATOM 0 HE2 PHE A 12 6.382 3.623 -4.224 1.00 0.00 H new ATOM 0 HZ PHE A 12 8.112 4.480 -2.670 1.00 0.00 H new ATOM 161 N ILE A 13 3.374 6.558 0.083 1.00 0.00 N ATOM 162 CA ILE A 13 3.975 7.017 1.335 1.00 0.00 C ATOM 163 C ILE A 13 5.468 6.647 1.320 1.00 0.00 C ATOM 164 O ILE A 13 6.288 7.491 0.971 1.00 0.00 O ATOM 165 CB ILE A 13 3.205 6.487 2.554 1.00 0.00 C ATOM 166 CG1 ILE A 13 1.677 6.701 2.530 1.00 0.00 C ATOM 167 CG2 ILE A 13 3.821 7.133 3.784 1.00 0.00 C ATOM 168 CD1 ILE A 13 1.128 8.127 2.602 1.00 0.00 C ATOM 0 H ILE A 13 3.314 5.546 -0.025 1.00 0.00 H new ATOM 0 HA ILE A 13 3.905 8.101 1.422 1.00 0.00 H new ATOM 0 HB ILE A 13 3.305 5.402 2.554 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.295 6.247 1.616 1.00 0.00 H new ATOM 0 HG13 ILE A 13 1.253 6.142 3.364 1.00 0.00 H new ATOM 0 HG21 ILE A 13 3.303 6.783 4.677 1.00 0.00 H new ATOM 0 HG22 ILE A 13 4.875 6.863 3.847 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.728 8.217 3.711 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.039 8.099 2.574 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.455 8.597 3.530 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.498 8.703 1.754 1.00 0.00 H new ATOM 180 N ASN A 14 5.780 5.411 1.718 1.00 0.00 N ATOM 181 CA ASN A 14 7.155 4.880 1.807 1.00 0.00 C ATOM 182 C ASN A 14 7.158 3.432 2.316 1.00 0.00 C ATOM 183 O ASN A 14 6.150 2.932 2.824 1.00 0.00 O ATOM 184 CB ASN A 14 8.003 5.738 2.755 1.00 0.00 C ATOM 185 CG ASN A 14 9.348 6.054 2.109 1.00 0.00 C ATOM 186 OD1 ASN A 14 9.469 6.785 1.134 1.00 0.00 O ATOM 187 ND2 ASN A 14 10.388 5.412 2.586 1.00 0.00 N ATOM 0 H ASN A 14 5.072 4.731 1.995 1.00 0.00 H new ATOM 0 HA ASN A 14 7.580 4.908 0.804 1.00 0.00 H new ATOM 0 HB2 ASN A 14 7.477 6.663 2.990 1.00 0.00 H new ATOM 0 HB3 ASN A 14 8.157 5.211 3.696 1.00 0.00 H new ATOM 0 HD21 ASN A 14 11.301 5.521 2.145 1.00 0.00 H new ATOM 0 HD22 ASN A 14 10.283 4.804 3.398 1.00 0.00 H new ATOM 194 N SER A 15 8.320 2.798 2.178 1.00 0.00 N ATOM 195 CA SER A 15 8.535 1.406 2.611 1.00 0.00 C ATOM 196 C SER A 15 9.349 1.394 3.900 1.00 0.00 C ATOM 197 O SER A 15 10.337 2.111 4.057 1.00 0.00 O ATOM 198 CB SER A 15 9.274 0.579 1.558 1.00 0.00 C ATOM 199 OG SER A 15 10.564 1.112 1.255 1.00 0.00 O ATOM 0 H SER A 15 9.145 3.230 1.763 1.00 0.00 H new ATOM 0 HA SER A 15 7.553 0.959 2.765 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.382 -0.446 1.914 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.677 0.539 0.647 1.00 0.00 H new ATOM 0 HG SER A 15 10.999 0.551 0.580 1.00 0.00 H new ATOM 205 N VAL A 16 8.783 0.686 4.864 1.00 0.00 N ATOM 206 CA VAL A 16 9.398 0.589 6.196 1.00 0.00 C ATOM 207 C VAL A 16 9.563 -0.877 6.597 1.00 0.00 C ATOM 208 O VAL A 16 8.600 -1.645 6.696 1.00 0.00 O ATOM 209 CB VAL A 16 8.674 1.469 7.232 1.00 0.00 C ATOM 210 CG1 VAL A 16 8.742 2.948 6.835 1.00 0.00 C ATOM 211 CG2 VAL A 16 7.211 1.088 7.398 1.00 0.00 C ATOM 0 H VAL A 16 7.908 0.172 4.760 1.00 0.00 H new ATOM 0 HA VAL A 16 10.405 1.004 6.158 1.00 0.00 H new ATOM 0 HB VAL A 16 9.189 1.305 8.179 1.00 0.00 H new ATOM 0 HG11 VAL A 16 8.224 3.549 7.582 1.00 0.00 H new ATOM 0 HG12 VAL A 16 9.784 3.261 6.776 1.00 0.00 H new ATOM 0 HG13 VAL A 16 8.266 3.086 5.864 1.00 0.00 H new ATOM 0 HG21 VAL A 16 6.747 1.739 8.139 1.00 0.00 H new ATOM 0 HG22 VAL A 16 6.695 1.200 6.444 1.00 0.00 H new ATOM 0 HG23 VAL A 16 7.140 0.052 7.730 1.00 0.00 H new ATOM 221 N GLU A 17 10.815 -1.290 6.438 1.00 0.00 N ATOM 222 CA GLU A 17 11.225 -2.671 6.749 1.00 0.00 C ATOM 223 C GLU A 17 10.909 -3.006 8.206 1.00 0.00 C ATOM 224 O GLU A 17 11.282 -2.281 9.124 1.00 0.00 O ATOM 225 CB GLU A 17 12.694 -3.000 6.435 1.00 0.00 C ATOM 226 CG GLU A 17 13.748 -2.038 7.002 1.00 0.00 C ATOM 227 CD GLU A 17 14.078 -0.886 6.044 1.00 0.00 C ATOM 228 OE1 GLU A 17 14.114 -1.140 4.819 1.00 0.00 O ATOM 229 OE2 GLU A 17 14.246 0.240 6.554 1.00 0.00 O ATOM 0 H GLU A 17 11.570 -0.695 6.096 1.00 0.00 H new ATOM 0 HA GLU A 17 10.639 -3.299 6.078 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.908 -4.000 6.812 1.00 0.00 H new ATOM 0 HB3 GLU A 17 12.812 -3.035 5.352 1.00 0.00 H new ATOM 0 HG2 GLU A 17 13.389 -1.628 7.946 1.00 0.00 H new ATOM 0 HG3 GLU A 17 14.659 -2.594 7.222 1.00 0.00 H new ATOM 236 N MET A 18 10.126 -4.063 8.353 1.00 0.00 N ATOM 237 CA MET A 18 9.725 -4.525 9.693 1.00 0.00 C ATOM 238 C MET A 18 10.621 -5.651 10.219 1.00 0.00 C ATOM 239 O MET A 18 10.468 -6.078 11.361 1.00 0.00 O ATOM 240 CB MET A 18 8.265 -4.970 9.689 1.00 0.00 C ATOM 241 CG MET A 18 7.637 -4.714 11.059 1.00 0.00 C ATOM 242 SD MET A 18 7.604 -2.945 11.525 1.00 0.00 S ATOM 243 CE MET A 18 6.605 -2.316 10.196 1.00 0.00 C ATOM 0 H MET A 18 9.755 -4.617 7.581 1.00 0.00 H new ATOM 0 HA MET A 18 9.843 -3.678 10.369 1.00 0.00 H new ATOM 0 HB2 MET A 18 7.713 -4.429 8.920 1.00 0.00 H new ATOM 0 HB3 MET A 18 8.200 -6.030 9.442 1.00 0.00 H new ATOM 0 HG2 MET A 18 6.618 -5.102 11.061 1.00 0.00 H new ATOM 0 HG3 MET A 18 8.192 -5.271 11.814 1.00 0.00 H new ATOM 0 HE1 MET A 18 6.373 -1.267 10.380 1.00 0.00 H new ATOM 0 HE2 MET A 18 7.150 -2.407 9.256 1.00 0.00 H new ATOM 0 HE3 MET A 18 5.679 -2.887 10.135 1.00 0.00 H new ATOM 253 N GLU A 19 11.470 -6.169 9.325 1.00 0.00 N ATOM 254 CA GLU A 19 12.398 -7.287 9.591 1.00 0.00 C ATOM 255 C GLU A 19 11.640 -8.609 9.829 1.00 0.00 C ATOM 256 O GLU A 19 12.000 -9.418 10.678 1.00 0.00 O ATOM 257 CB GLU A 19 13.289 -6.953 10.794 1.00 0.00 C ATOM 258 CG GLU A 19 14.774 -6.914 10.448 1.00 0.00 C ATOM 259 CD GLU A 19 15.627 -7.528 11.566 1.00 0.00 C ATOM 260 OE1 GLU A 19 15.246 -7.420 12.754 1.00 0.00 O ATOM 261 OE2 GLU A 19 16.696 -8.058 11.195 1.00 0.00 O ATOM 0 H GLU A 19 11.537 -5.817 8.370 1.00 0.00 H new ATOM 0 HA GLU A 19 13.024 -7.424 8.709 1.00 0.00 H new ATOM 0 HB2 GLU A 19 12.992 -5.987 11.201 1.00 0.00 H new ATOM 0 HB3 GLU A 19 13.124 -7.693 11.577 1.00 0.00 H new ATOM 0 HG2 GLU A 19 14.947 -7.456 9.518 1.00 0.00 H new ATOM 0 HG3 GLU A 19 15.082 -5.882 10.278 1.00 0.00 H new ATOM 268 N SER A 20 10.553 -8.768 9.070 1.00 0.00 N ATOM 269 CA SER A 20 9.652 -9.945 9.097 1.00 0.00 C ATOM 270 C SER A 20 9.015 -10.087 10.479 1.00 0.00 C ATOM 271 O SER A 20 9.527 -10.728 11.391 1.00 0.00 O ATOM 272 CB SER A 20 10.370 -11.227 8.684 1.00 0.00 C ATOM 273 OG SER A 20 9.565 -12.401 8.721 1.00 0.00 O ATOM 0 H SER A 20 10.258 -8.063 8.394 1.00 0.00 H new ATOM 0 HA SER A 20 8.863 -9.779 8.363 1.00 0.00 H new ATOM 0 HB2 SER A 20 10.757 -11.100 7.673 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.230 -11.372 9.338 1.00 0.00 H new ATOM 0 HG SER A 20 10.100 -13.173 8.442 1.00 0.00 H new ATOM 279 N LEU A 21 7.975 -9.279 10.641 1.00 0.00 N ATOM 280 CA LEU A 21 7.208 -9.275 11.894 1.00 0.00 C ATOM 281 C LEU A 21 6.305 -10.516 11.977 1.00 0.00 C ATOM 282 O LEU A 21 6.582 -11.448 12.722 1.00 0.00 O ATOM 283 CB LEU A 21 6.443 -7.953 12.028 1.00 0.00 C ATOM 284 CG LEU A 21 6.033 -7.624 13.467 1.00 0.00 C ATOM 285 CD1 LEU A 21 7.244 -7.440 14.389 1.00 0.00 C ATOM 286 CD2 LEU A 21 5.235 -6.327 13.458 1.00 0.00 C ATOM 0 H LEU A 21 7.641 -8.623 9.934 1.00 0.00 H new ATOM 0 HA LEU A 21 7.884 -9.337 12.747 1.00 0.00 H new ATOM 0 HB2 LEU A 21 7.063 -7.144 11.642 1.00 0.00 H new ATOM 0 HB3 LEU A 21 5.549 -7.995 11.405 1.00 0.00 H new ATOM 0 HG LEU A 21 5.444 -8.459 13.846 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.902 -7.208 15.398 1.00 0.00 H new ATOM 0 HD12 LEU A 21 7.831 -8.359 14.407 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.862 -6.622 14.019 1.00 0.00 H new ATOM 0 HD21 LEU A 21 4.935 -6.078 14.476 1.00 0.00 H new ATOM 0 HD22 LEU A 21 5.851 -5.524 13.054 1.00 0.00 H new ATOM 0 HD23 LEU A 21 4.347 -6.450 12.838 1.00 0.00 H new ATOM 298 N THR A 22 5.262 -10.516 11.147 1.00 0.00 N ATOM 299 CA THR A 22 4.208 -11.559 11.124 1.00 0.00 C ATOM 300 C THR A 22 3.244 -11.367 9.940 1.00 0.00 C ATOM 301 O THR A 22 3.178 -12.187 9.029 1.00 0.00 O ATOM 302 CB THR A 22 3.461 -11.697 12.478 1.00 0.00 C ATOM 303 OG1 THR A 22 2.262 -12.456 12.314 1.00 0.00 O ATOM 304 CG2 THR A 22 3.126 -10.377 13.184 1.00 0.00 C ATOM 0 H THR A 22 5.113 -9.782 10.454 1.00 0.00 H new ATOM 0 HA THR A 22 4.719 -12.510 10.972 1.00 0.00 H new ATOM 0 HB THR A 22 4.171 -12.211 13.126 1.00 0.00 H new ATOM 0 HG1 THR A 22 1.804 -12.535 13.177 1.00 0.00 H new ATOM 0 HG21 THR A 22 2.606 -10.586 14.119 1.00 0.00 H new ATOM 0 HG22 THR A 22 4.047 -9.833 13.395 1.00 0.00 H new ATOM 0 HG23 THR A 22 2.487 -9.772 12.541 1.00 0.00 H new ATOM 312 N GLY A 23 2.566 -10.214 9.960 1.00 0.00 N ATOM 313 CA GLY A 23 1.608 -9.829 8.906 1.00 0.00 C ATOM 314 C GLY A 23 0.641 -8.765 9.447 1.00 0.00 C ATOM 315 O GLY A 23 0.996 -7.583 9.355 1.00 0.00 O ATOM 0 H GLY A 23 2.662 -9.521 10.702 1.00 0.00 H new ATOM 0 HA2 GLY A 23 2.143 -9.441 8.039 1.00 0.00 H new ATOM 0 HA3 GLY A 23 1.051 -10.704 8.571 1.00 0.00 H new ATOM 319 N PRO A 24 -0.420 -9.173 10.171 1.00 0.00 N ATOM 320 CA PRO A 24 -1.410 -8.251 10.771 1.00 0.00 C ATOM 321 C PRO A 24 -0.893 -7.516 12.025 1.00 0.00 C ATOM 322 O PRO A 24 -1.494 -7.526 13.092 1.00 0.00 O ATOM 323 CB PRO A 24 -2.627 -9.139 11.041 1.00 0.00 C ATOM 324 CG PRO A 24 -2.003 -10.487 11.397 1.00 0.00 C ATOM 325 CD PRO A 24 -0.799 -10.576 10.459 1.00 0.00 C ATOM 0 HA PRO A 24 -1.648 -7.422 10.105 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -3.237 -8.750 11.856 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -3.274 -9.213 10.167 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -1.701 -10.527 12.444 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -2.701 -11.309 11.235 1.00 0.00 H new ATOM 0 HD2 PRO A 24 0.024 -11.117 10.926 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -1.053 -11.110 9.543 1.00 0.00 H new ATOM 333 N GLN A 25 0.271 -6.900 11.848 1.00 0.00 N ATOM 334 CA GLN A 25 0.976 -6.118 12.880 1.00 0.00 C ATOM 335 C GLN A 25 1.930 -5.089 12.261 1.00 0.00 C ATOM 336 O GLN A 25 1.788 -3.897 12.531 1.00 0.00 O ATOM 337 CB GLN A 25 1.745 -7.068 13.802 1.00 0.00 C ATOM 338 CG GLN A 25 2.047 -6.440 15.167 1.00 0.00 C ATOM 339 CD GLN A 25 0.793 -6.189 16.010 1.00 0.00 C ATOM 340 OE1 GLN A 25 -0.339 -6.504 15.665 1.00 0.00 O ATOM 341 NE2 GLN A 25 0.983 -5.607 17.165 1.00 0.00 N ATOM 0 H GLN A 25 0.772 -6.926 10.960 1.00 0.00 H new ATOM 0 HA GLN A 25 0.233 -5.566 13.456 1.00 0.00 H new ATOM 0 HB2 GLN A 25 1.165 -7.980 13.945 1.00 0.00 H new ATOM 0 HB3 GLN A 25 2.681 -7.357 13.323 1.00 0.00 H new ATOM 0 HG2 GLN A 25 2.722 -7.094 15.719 1.00 0.00 H new ATOM 0 HG3 GLN A 25 2.570 -5.496 15.017 1.00 0.00 H new ATOM 0 HE21 GLN A 25 1.925 -5.344 17.455 1.00 0.00 H new ATOM 0 HE22 GLN A 25 0.189 -5.416 17.777 1.00 0.00 H new ATOM 350 N ALA A 26 2.654 -5.521 11.225 1.00 0.00 N ATOM 351 CA ALA A 26 3.562 -4.663 10.442 1.00 0.00 C ATOM 352 C ALA A 26 2.796 -3.545 9.725 1.00 0.00 C ATOM 353 O ALA A 26 3.205 -2.407 9.810 1.00 0.00 O ATOM 354 CB ALA A 26 4.333 -5.498 9.418 1.00 0.00 C ATOM 0 H ALA A 26 2.629 -6.487 10.899 1.00 0.00 H new ATOM 0 HA ALA A 26 4.265 -4.205 11.138 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.999 -4.850 8.848 1.00 0.00 H new ATOM 0 HB2 ALA A 26 4.920 -6.257 9.935 1.00 0.00 H new ATOM 0 HB3 ALA A 26 3.630 -5.982 8.740 1.00 0.00 H new ATOM 360 N ILE A 27 1.544 -3.817 9.367 1.00 0.00 N ATOM 361 CA ILE A 27 0.636 -2.857 8.700 1.00 0.00 C ATOM 362 C ILE A 27 0.416 -1.598 9.573 1.00 0.00 C ATOM 363 O ILE A 27 0.539 -0.463 9.115 1.00 0.00 O ATOM 364 CB ILE A 27 -0.674 -3.613 8.407 1.00 0.00 C ATOM 365 CG1 ILE A 27 -0.412 -4.884 7.584 1.00 0.00 C ATOM 366 CG2 ILE A 27 -1.629 -2.742 7.599 1.00 0.00 C ATOM 367 CD1 ILE A 27 -1.483 -5.953 7.815 1.00 0.00 C ATOM 0 H ILE A 27 1.113 -4.727 9.531 1.00 0.00 H new ATOM 0 HA ILE A 27 1.064 -2.489 7.768 1.00 0.00 H new ATOM 0 HB ILE A 27 -1.109 -3.872 9.372 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -0.378 -4.629 6.525 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.566 -5.289 7.845 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.548 -3.295 7.403 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -1.862 -1.838 8.162 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -1.161 -2.469 6.653 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.255 -6.832 7.212 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.499 -6.230 8.869 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -2.458 -5.559 7.528 1.00 0.00 H new ATOM 379 N SER A 28 0.359 -1.852 10.876 1.00 0.00 N ATOM 380 CA SER A 28 0.177 -0.830 11.917 1.00 0.00 C ATOM 381 C SER A 28 1.500 -0.339 12.509 1.00 0.00 C ATOM 382 O SER A 28 1.741 0.856 12.459 1.00 0.00 O ATOM 383 CB SER A 28 -0.736 -1.375 13.010 1.00 0.00 C ATOM 384 OG SER A 28 -0.199 -2.482 13.738 1.00 0.00 O ATOM 0 H SER A 28 0.439 -2.796 11.254 1.00 0.00 H new ATOM 0 HA SER A 28 -0.285 0.038 11.448 1.00 0.00 H new ATOM 0 HB2 SER A 28 -0.961 -0.571 13.711 1.00 0.00 H new ATOM 0 HB3 SER A 28 -1.681 -1.678 12.558 1.00 0.00 H new ATOM 0 HG SER A 28 0.422 -2.979 13.166 1.00 0.00 H new ATOM 390 N LYS A 29 2.432 -1.251 12.784 1.00 0.00 N ATOM 391 CA LYS A 29 3.793 -0.920 13.240 1.00 0.00 C ATOM 392 C LYS A 29 4.551 -0.057 12.213 1.00 0.00 C ATOM 393 O LYS A 29 5.378 0.762 12.588 1.00 0.00 O ATOM 394 CB LYS A 29 4.521 -2.227 13.560 1.00 0.00 C ATOM 395 CG LYS A 29 5.715 -1.952 14.472 1.00 0.00 C ATOM 396 CD LYS A 29 5.858 -3.039 15.534 1.00 0.00 C ATOM 397 CE LYS A 29 5.942 -2.378 16.909 1.00 0.00 C ATOM 398 NZ LYS A 29 7.097 -2.885 17.659 1.00 0.00 N ATOM 0 H LYS A 29 2.267 -2.254 12.697 1.00 0.00 H new ATOM 0 HA LYS A 29 3.741 -0.310 14.142 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.837 -2.925 14.043 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.859 -2.700 12.638 1.00 0.00 H new ATOM 0 HG2 LYS A 29 6.627 -1.899 13.877 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.592 -0.982 14.954 1.00 0.00 H new ATOM 0 HD2 LYS A 29 5.007 -3.720 15.494 1.00 0.00 H new ATOM 0 HD3 LYS A 29 6.752 -3.634 15.346 1.00 0.00 H new ATOM 0 HE2 LYS A 29 6.023 -1.297 16.794 1.00 0.00 H new ATOM 0 HE3 LYS A 29 5.026 -2.571 17.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 7.136 -2.423 18.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 7.004 -3.913 17.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 7.970 -2.678 17.133 1.00 0.00 H new ATOM 412 N ALA A 30 4.154 -0.187 10.949 1.00 0.00 N ATOM 413 CA ALA A 30 4.584 0.634 9.810 1.00 0.00 C ATOM 414 C ALA A 30 3.856 1.970 9.778 1.00 0.00 C ATOM 415 O ALA A 30 4.498 2.982 9.972 1.00 0.00 O ATOM 416 CB ALA A 30 4.272 -0.085 8.509 1.00 0.00 C ATOM 0 H ALA A 30 3.486 -0.907 10.672 1.00 0.00 H new ATOM 0 HA ALA A 30 5.655 0.804 9.922 1.00 0.00 H new ATOM 0 HB1 ALA A 30 4.593 0.529 7.668 1.00 0.00 H new ATOM 0 HB2 ALA A 30 4.800 -1.038 8.485 1.00 0.00 H new ATOM 0 HB3 ALA A 30 3.199 -0.262 8.440 1.00 0.00 H new ATOM 422 N VAL A 31 2.526 1.940 9.857 1.00 0.00 N ATOM 423 CA VAL A 31 1.720 3.174 9.842 1.00 0.00 C ATOM 424 C VAL A 31 2.009 4.095 11.041 1.00 0.00 C ATOM 425 O VAL A 31 2.200 5.299 10.888 1.00 0.00 O ATOM 426 CB VAL A 31 0.245 2.800 9.654 1.00 0.00 C ATOM 427 CG1 VAL A 31 -0.688 2.882 10.872 1.00 0.00 C ATOM 428 CG2 VAL A 31 -0.250 3.684 8.526 1.00 0.00 C ATOM 0 H VAL A 31 1.980 1.082 9.932 1.00 0.00 H new ATOM 0 HA VAL A 31 2.010 3.790 8.991 1.00 0.00 H new ATOM 0 HB VAL A 31 0.211 1.731 9.446 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -1.696 2.587 10.579 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -0.327 2.213 11.653 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -0.704 3.904 11.250 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.302 3.473 8.333 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -0.136 4.731 8.807 1.00 0.00 H new ATOM 0 HG23 VAL A 31 0.331 3.485 7.626 1.00 0.00 H new ATOM 438 N ALA A 32 2.232 3.437 12.171 1.00 0.00 N ATOM 439 CA ALA A 32 2.598 4.025 13.465 1.00 0.00 C ATOM 440 C ALA A 32 4.030 4.567 13.465 1.00 0.00 C ATOM 441 O ALA A 32 4.314 5.523 14.170 1.00 0.00 O ATOM 442 CB ALA A 32 2.425 2.987 14.578 1.00 0.00 C ATOM 0 H ALA A 32 2.160 2.421 12.218 1.00 0.00 H new ATOM 0 HA ALA A 32 1.931 4.868 13.645 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.699 3.431 15.535 1.00 0.00 H new ATOM 0 HB2 ALA A 32 1.385 2.661 14.613 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.068 2.129 14.379 1.00 0.00 H new ATOM 448 N GLU A 33 4.876 4.011 12.597 1.00 0.00 N ATOM 449 CA GLU A 33 6.248 4.513 12.399 1.00 0.00 C ATOM 450 C GLU A 33 6.419 5.294 11.082 1.00 0.00 C ATOM 451 O GLU A 33 7.529 5.669 10.731 1.00 0.00 O ATOM 452 CB GLU A 33 7.247 3.345 12.508 1.00 0.00 C ATOM 453 CG GLU A 33 7.404 2.468 11.259 1.00 0.00 C ATOM 454 CD GLU A 33 8.765 2.687 10.605 1.00 0.00 C ATOM 455 OE1 GLU A 33 8.852 3.599 9.758 1.00 0.00 O ATOM 456 OE2 GLU A 33 9.684 1.911 10.940 1.00 0.00 O ATOM 0 H GLU A 33 4.639 3.208 12.014 1.00 0.00 H new ATOM 0 HA GLU A 33 6.456 5.233 13.190 1.00 0.00 H new ATOM 0 HB2 GLU A 33 8.224 3.753 12.765 1.00 0.00 H new ATOM 0 HB3 GLU A 33 6.940 2.708 13.337 1.00 0.00 H new ATOM 0 HG2 GLU A 33 7.292 1.418 11.531 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.612 2.699 10.546 1.00 0.00 H new ATOM 463 N THR A 34 5.322 5.526 10.367 1.00 0.00 N ATOM 464 CA THR A 34 5.331 6.180 9.045 1.00 0.00 C ATOM 465 C THR A 34 4.584 7.519 9.052 1.00 0.00 C ATOM 466 O THR A 34 5.061 8.487 8.470 1.00 0.00 O ATOM 467 CB THR A 34 4.807 5.176 8.010 1.00 0.00 C ATOM 468 OG1 THR A 34 5.815 4.198 7.767 1.00 0.00 O ATOM 469 CG2 THR A 34 4.411 5.792 6.685 1.00 0.00 C ATOM 0 H THR A 34 4.388 5.266 10.685 1.00 0.00 H new ATOM 0 HA THR A 34 6.349 6.454 8.769 1.00 0.00 H new ATOM 0 HB THR A 34 3.902 4.745 8.437 1.00 0.00 H new ATOM 0 HG1 THR A 34 5.795 3.524 8.478 1.00 0.00 H new ATOM 0 HG21 THR A 34 4.052 5.012 6.014 1.00 0.00 H new ATOM 0 HG22 THR A 34 3.620 6.524 6.846 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.276 6.285 6.240 1.00 0.00 H new ATOM 477 N LEU A 35 3.483 7.574 9.796 1.00 0.00 N ATOM 478 CA LEU A 35 2.749 8.832 10.034 1.00 0.00 C ATOM 479 C LEU A 35 3.574 9.838 10.844 1.00 0.00 C ATOM 480 O LEU A 35 3.436 11.045 10.683 1.00 0.00 O ATOM 481 CB LEU A 35 1.458 8.529 10.785 1.00 0.00 C ATOM 482 CG LEU A 35 0.374 8.059 9.823 1.00 0.00 C ATOM 483 CD1 LEU A 35 -0.599 7.188 10.602 1.00 0.00 C ATOM 484 CD2 LEU A 35 -0.365 9.270 9.246 1.00 0.00 C ATOM 0 H LEU A 35 3.070 6.760 10.251 1.00 0.00 H new ATOM 0 HA LEU A 35 2.536 9.278 9.062 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.641 7.762 11.538 1.00 0.00 H new ATOM 0 HB3 LEU A 35 1.121 9.421 11.313 1.00 0.00 H new ATOM 0 HG LEU A 35 0.814 7.495 9.001 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -1.387 6.837 9.936 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -0.068 6.332 11.018 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -1.040 7.770 11.411 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.139 8.930 8.558 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -0.823 9.837 10.057 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.341 9.906 8.712 1.00 0.00 H new ATOM 496 N VAL A 36 4.409 9.274 11.710 1.00 0.00 N ATOM 497 CA VAL A 36 5.338 10.033 12.568 1.00 0.00 C ATOM 498 C VAL A 36 6.805 9.884 12.128 1.00 0.00 C ATOM 499 O VAL A 36 7.669 10.541 12.706 1.00 0.00 O ATOM 500 CB VAL A 36 5.168 9.686 14.063 1.00 0.00 C ATOM 501 CG1 VAL A 36 3.756 10.009 14.564 1.00 0.00 C ATOM 502 CG2 VAL A 36 5.545 8.240 14.397 1.00 0.00 C ATOM 0 H VAL A 36 4.467 8.265 11.844 1.00 0.00 H new ATOM 0 HA VAL A 36 5.070 11.082 12.442 1.00 0.00 H new ATOM 0 HB VAL A 36 5.876 10.323 14.593 1.00 0.00 H new ATOM 0 HG11 VAL A 36 3.677 9.751 15.620 1.00 0.00 H new ATOM 0 HG12 VAL A 36 3.559 11.073 14.435 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.027 9.433 13.994 1.00 0.00 H new ATOM 0 HG21 VAL A 36 5.402 8.064 15.463 1.00 0.00 H new ATOM 0 HG22 VAL A 36 4.912 7.558 13.829 1.00 0.00 H new ATOM 0 HG23 VAL A 36 6.589 8.067 14.137 1.00 0.00 H new ATOM 512 N ALA A 37 7.066 8.967 11.180 1.00 0.00 N ATOM 513 CA ALA A 37 8.396 8.697 10.586 1.00 0.00 C ATOM 514 C ALA A 37 9.153 10.011 10.418 1.00 0.00 C ATOM 515 O ALA A 37 8.600 10.944 9.862 1.00 0.00 O ATOM 516 CB ALA A 37 8.266 8.097 9.182 1.00 0.00 C ATOM 0 H ALA A 37 6.336 8.371 10.790 1.00 0.00 H new ATOM 0 HA ALA A 37 8.913 8.004 11.250 1.00 0.00 H new ATOM 0 HB1 ALA A 37 9.259 7.910 8.773 1.00 0.00 H new ATOM 0 HB2 ALA A 37 7.714 7.159 9.237 1.00 0.00 H new ATOM 0 HB3 ALA A 37 7.733 8.795 8.536 1.00 0.00 H new ATOM 522 N ASP A 38 10.217 10.158 11.199 1.00 0.00 N ATOM 523 CA ASP A 38 10.993 11.404 11.185 1.00 0.00 C ATOM 524 C ASP A 38 12.347 11.160 10.500 1.00 0.00 C ATOM 525 O ASP A 38 13.136 10.369 11.019 1.00 0.00 O ATOM 526 CB ASP A 38 11.132 11.984 12.602 1.00 0.00 C ATOM 527 CG ASP A 38 11.990 13.256 12.685 1.00 0.00 C ATOM 528 OD1 ASP A 38 12.143 13.938 11.645 1.00 0.00 O ATOM 529 OD2 ASP A 38 12.495 13.518 13.796 1.00 0.00 O ATOM 0 H ASP A 38 10.562 9.446 11.842 1.00 0.00 H new ATOM 0 HA ASP A 38 10.463 12.159 10.604 1.00 0.00 H new ATOM 0 HB2 ASP A 38 10.138 12.205 12.990 1.00 0.00 H new ATOM 0 HB3 ASP A 38 11.566 11.224 13.252 1.00 0.00 H new ATOM 534 N PRO A 39 12.561 11.834 9.363 1.00 0.00 N ATOM 535 CA PRO A 39 11.608 12.760 8.706 1.00 0.00 C ATOM 536 C PRO A 39 10.469 12.039 7.963 1.00 0.00 C ATOM 537 O PRO A 39 10.568 10.845 7.680 1.00 0.00 O ATOM 538 CB PRO A 39 12.481 13.608 7.782 1.00 0.00 C ATOM 539 CG PRO A 39 13.619 12.663 7.397 1.00 0.00 C ATOM 540 CD PRO A 39 13.856 11.828 8.656 1.00 0.00 C ATOM 0 HA PRO A 39 11.072 13.368 9.434 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.927 13.947 6.906 1.00 0.00 H new ATOM 0 HB3 PRO A 39 12.853 14.499 8.288 1.00 0.00 H new ATOM 0 HG2 PRO A 39 13.346 12.036 6.549 1.00 0.00 H new ATOM 0 HG3 PRO A 39 14.515 13.214 7.110 1.00 0.00 H new ATOM 0 HD2 PRO A 39 14.165 10.813 8.405 1.00 0.00 H new ATOM 0 HD3 PRO A 39 14.645 12.258 9.273 1.00 0.00 H new ATOM 548 N THR A 40 9.336 12.731 7.846 1.00 0.00 N ATOM 549 CA THR A 40 8.127 12.178 7.192 1.00 0.00 C ATOM 550 C THR A 40 8.265 12.195 5.661 1.00 0.00 C ATOM 551 O THR A 40 8.742 13.189 5.108 1.00 0.00 O ATOM 552 CB THR A 40 6.841 12.844 7.730 1.00 0.00 C ATOM 553 OG1 THR A 40 6.578 12.290 9.019 1.00 0.00 O ATOM 554 CG2 THR A 40 5.571 12.692 6.880 1.00 0.00 C ATOM 0 H THR A 40 9.220 13.682 8.195 1.00 0.00 H new ATOM 0 HA THR A 40 8.032 11.125 7.458 1.00 0.00 H new ATOM 0 HB THR A 40 7.049 13.914 7.728 1.00 0.00 H new ATOM 0 HG1 THR A 40 7.212 11.564 9.199 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.742 13.204 7.369 1.00 0.00 H new ATOM 0 HG22 THR A 40 5.738 13.129 5.895 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.330 11.634 6.772 1.00 0.00 H new ATOM 562 N PRO A 41 7.918 11.079 5.007 1.00 0.00 N ATOM 563 CA PRO A 41 7.915 11.000 3.538 1.00 0.00 C ATOM 564 C PRO A 41 6.805 11.867 2.935 1.00 0.00 C ATOM 565 O PRO A 41 5.786 12.157 3.565 1.00 0.00 O ATOM 566 CB PRO A 41 7.742 9.515 3.223 1.00 0.00 C ATOM 567 CG PRO A 41 6.960 8.983 4.422 1.00 0.00 C ATOM 568 CD PRO A 41 7.512 9.786 5.600 1.00 0.00 C ATOM 0 HA PRO A 41 8.834 11.388 3.099 1.00 0.00 H new ATOM 0 HB2 PRO A 41 7.198 9.364 2.290 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.704 9.013 3.117 1.00 0.00 H new ATOM 0 HG2 PRO A 41 5.888 9.136 4.301 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.116 7.913 4.559 1.00 0.00 H new ATOM 0 HD2 PRO A 41 6.758 9.924 6.375 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.358 9.279 6.065 1.00 0.00 H new ATOM 576 N THR A 42 7.086 12.317 1.721 1.00 0.00 N ATOM 577 CA THR A 42 6.153 13.165 0.959 1.00 0.00 C ATOM 578 C THR A 42 5.040 12.318 0.331 1.00 0.00 C ATOM 579 O THR A 42 5.257 11.235 -0.208 1.00 0.00 O ATOM 580 CB THR A 42 6.861 14.037 -0.095 1.00 0.00 C ATOM 581 OG1 THR A 42 5.895 14.900 -0.704 1.00 0.00 O ATOM 582 CG2 THR A 42 7.635 13.244 -1.157 1.00 0.00 C ATOM 0 H THR A 42 7.957 12.112 1.231 1.00 0.00 H new ATOM 0 HA THR A 42 5.701 13.857 1.669 1.00 0.00 H new ATOM 0 HB THR A 42 7.622 14.616 0.428 1.00 0.00 H new ATOM 0 HG1 THR A 42 6.335 15.461 -1.376 1.00 0.00 H new ATOM 0 HG21 THR A 42 8.102 13.935 -1.858 1.00 0.00 H new ATOM 0 HG22 THR A 42 8.405 12.643 -0.673 1.00 0.00 H new ATOM 0 HG23 THR A 42 6.949 12.590 -1.695 1.00 0.00 H new ATOM 590 N ALA A 43 3.846 12.868 0.464 1.00 0.00 N ATOM 591 CA ALA A 43 2.612 12.326 -0.110 1.00 0.00 C ATOM 592 C ALA A 43 2.569 12.487 -1.643 1.00 0.00 C ATOM 593 O ALA A 43 2.374 13.588 -2.162 1.00 0.00 O ATOM 594 CB ALA A 43 1.474 13.067 0.597 1.00 0.00 C ATOM 0 H ALA A 43 3.696 13.730 0.989 1.00 0.00 H new ATOM 0 HA ALA A 43 2.532 11.250 0.048 1.00 0.00 H new ATOM 0 HB1 ALA A 43 0.517 12.711 0.216 1.00 0.00 H new ATOM 0 HB2 ALA A 43 1.530 12.881 1.670 1.00 0.00 H new ATOM 0 HB3 ALA A 43 1.564 14.137 0.409 1.00 0.00 H new ATOM 600 N THR A 44 2.859 11.407 -2.368 1.00 0.00 N ATOM 601 CA THR A 44 2.864 11.442 -3.851 1.00 0.00 C ATOM 602 C THR A 44 1.774 10.552 -4.468 1.00 0.00 C ATOM 603 O THR A 44 1.557 9.428 -4.047 1.00 0.00 O ATOM 604 CB THR A 44 4.284 11.127 -4.359 1.00 0.00 C ATOM 605 OG1 THR A 44 5.107 12.233 -3.986 1.00 0.00 O ATOM 606 CG2 THR A 44 4.413 10.908 -5.870 1.00 0.00 C ATOM 0 H THR A 44 3.093 10.499 -1.967 1.00 0.00 H new ATOM 0 HA THR A 44 2.604 12.446 -4.185 1.00 0.00 H new ATOM 0 HB THR A 44 4.580 10.179 -3.911 1.00 0.00 H new ATOM 0 HG1 THR A 44 4.903 13.001 -4.560 1.00 0.00 H new ATOM 0 HG21 THR A 44 5.452 10.693 -6.119 1.00 0.00 H new ATOM 0 HG22 THR A 44 3.787 10.068 -6.171 1.00 0.00 H new ATOM 0 HG23 THR A 44 4.092 11.807 -6.397 1.00 0.00 H new ATOM 614 N ILE A 45 1.109 11.062 -5.498 1.00 0.00 N ATOM 615 CA ILE A 45 0.017 10.329 -6.175 1.00 0.00 C ATOM 616 C ILE A 45 0.626 9.307 -7.150 1.00 0.00 C ATOM 617 O ILE A 45 1.405 9.655 -8.046 1.00 0.00 O ATOM 618 CB ILE A 45 -0.959 11.284 -6.890 1.00 0.00 C ATOM 619 CG1 ILE A 45 -1.424 12.401 -5.940 1.00 0.00 C ATOM 620 CG2 ILE A 45 -2.181 10.497 -7.395 1.00 0.00 C ATOM 621 CD1 ILE A 45 -1.909 13.657 -6.671 1.00 0.00 C ATOM 0 H ILE A 45 1.299 11.983 -5.893 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.571 9.800 -5.424 1.00 0.00 H new ATOM 0 HB ILE A 45 -0.440 11.738 -7.734 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -2.229 12.021 -5.311 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -0.602 12.670 -5.277 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -2.868 11.176 -7.900 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.854 9.726 -8.093 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -2.688 10.030 -6.550 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -2.222 14.404 -5.942 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -1.099 14.060 -7.279 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -2.752 13.402 -7.313 1.00 0.00 H new ATOM 633 N VAL A 46 0.358 8.048 -6.833 1.00 0.00 N ATOM 634 CA VAL A 46 0.803 6.893 -7.637 1.00 0.00 C ATOM 635 C VAL A 46 -0.373 6.036 -8.118 1.00 0.00 C ATOM 636 O VAL A 46 -1.465 6.066 -7.554 1.00 0.00 O ATOM 637 CB VAL A 46 1.848 6.012 -6.921 1.00 0.00 C ATOM 638 CG1 VAL A 46 3.120 6.807 -6.667 1.00 0.00 C ATOM 639 CG2 VAL A 46 1.370 5.376 -5.615 1.00 0.00 C ATOM 0 H VAL A 46 -0.178 7.786 -6.006 1.00 0.00 H new ATOM 0 HA VAL A 46 1.294 7.328 -8.508 1.00 0.00 H new ATOM 0 HB VAL A 46 2.036 5.183 -7.603 1.00 0.00 H new ATOM 0 HG11 VAL A 46 3.850 6.174 -6.161 1.00 0.00 H new ATOM 0 HG12 VAL A 46 3.532 7.148 -7.617 1.00 0.00 H new ATOM 0 HG13 VAL A 46 2.891 7.669 -6.041 1.00 0.00 H new ATOM 0 HG21 VAL A 46 2.173 4.776 -5.187 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.087 6.159 -4.911 1.00 0.00 H new ATOM 0 HG23 VAL A 46 0.509 4.739 -5.815 1.00 0.00 H new ATOM 649 N HIS A 47 -0.079 5.215 -9.113 1.00 0.00 N ATOM 650 CA HIS A 47 -1.061 4.269 -9.666 1.00 0.00 C ATOM 651 C HIS A 47 -0.712 2.833 -9.263 1.00 0.00 C ATOM 652 O HIS A 47 0.447 2.425 -9.322 1.00 0.00 O ATOM 653 CB HIS A 47 -1.165 4.421 -11.186 1.00 0.00 C ATOM 654 CG HIS A 47 -1.990 5.655 -11.604 1.00 0.00 C ATOM 655 ND1 HIS A 47 -3.130 5.614 -12.277 1.00 0.00 N ATOM 656 CD2 HIS A 47 -1.661 6.927 -11.421 1.00 0.00 C ATOM 657 CE1 HIS A 47 -3.509 6.875 -12.517 1.00 0.00 C ATOM 658 NE2 HIS A 47 -2.599 7.683 -11.990 1.00 0.00 N ATOM 0 H HIS A 47 0.835 5.178 -9.563 1.00 0.00 H new ATOM 0 HA HIS A 47 -2.040 4.500 -9.247 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -0.163 4.498 -11.609 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.621 3.525 -11.607 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -0.785 7.287 -10.901 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.399 7.181 -13.047 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -2.614 8.703 -12.016 1.00 0.00 H new ATOM 666 N PHE A 48 -1.746 2.157 -8.784 1.00 0.00 N ATOM 667 CA PHE A 48 -1.727 0.774 -8.281 1.00 0.00 C ATOM 668 C PHE A 48 -2.258 -0.169 -9.367 1.00 0.00 C ATOM 669 O PHE A 48 -3.463 -0.303 -9.598 1.00 0.00 O ATOM 670 CB PHE A 48 -2.628 0.684 -7.048 1.00 0.00 C ATOM 671 CG PHE A 48 -2.169 -0.410 -6.092 1.00 0.00 C ATOM 672 CD1 PHE A 48 -2.519 -1.746 -6.280 1.00 0.00 C ATOM 673 CD2 PHE A 48 -1.385 -0.050 -4.999 1.00 0.00 C ATOM 674 CE1 PHE A 48 -2.093 -2.703 -5.379 1.00 0.00 C ATOM 675 CE2 PHE A 48 -0.958 -1.004 -4.099 1.00 0.00 C ATOM 676 CZ PHE A 48 -1.310 -2.337 -4.279 1.00 0.00 C ATOM 0 H PHE A 48 -2.676 2.573 -8.729 1.00 0.00 H new ATOM 0 HA PHE A 48 -0.708 0.488 -8.019 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -2.631 1.643 -6.529 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -3.654 0.487 -7.360 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -3.122 -2.033 -7.129 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -1.109 0.984 -4.855 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -2.366 -3.738 -5.525 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -0.350 -0.715 -3.254 1.00 0.00 H new ATOM 0 HZ PHE A 48 -0.981 -3.086 -3.574 1.00 0.00 H new ATOM 686 N LYS A 49 -1.302 -0.770 -10.053 1.00 0.00 N ATOM 687 CA LYS A 49 -1.590 -1.678 -11.172 1.00 0.00 C ATOM 688 C LYS A 49 -1.354 -3.129 -10.733 1.00 0.00 C ATOM 689 O LYS A 49 -0.233 -3.527 -10.441 1.00 0.00 O ATOM 690 CB LYS A 49 -0.709 -1.235 -12.342 1.00 0.00 C ATOM 691 CG LYS A 49 -1.487 -1.288 -13.652 1.00 0.00 C ATOM 692 CD LYS A 49 -0.908 -0.330 -14.693 1.00 0.00 C ATOM 693 CE LYS A 49 -0.956 -0.997 -16.067 1.00 0.00 C ATOM 694 NZ LYS A 49 -1.427 -0.076 -17.108 1.00 0.00 N ATOM 0 H LYS A 49 -0.308 -0.650 -9.860 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.632 -1.635 -11.490 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.348 -0.221 -12.168 1.00 0.00 H new ATOM 0 HB3 LYS A 49 0.168 -1.879 -12.408 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.470 -2.305 -14.044 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.531 -1.035 -13.466 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -1.477 0.600 -14.706 1.00 0.00 H new ATOM 0 HD3 LYS A 49 0.119 -0.071 -14.436 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.037 -1.362 -16.328 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.614 -1.865 -16.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -1.445 -0.568 -18.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.385 0.253 -16.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -0.785 0.740 -17.166 1.00 0.00 H new ATOM 708 N VAL A 50 -2.462 -3.790 -10.416 1.00 0.00 N ATOM 709 CA VAL A 50 -2.468 -5.205 -9.983 1.00 0.00 C ATOM 710 C VAL A 50 -2.948 -6.105 -11.128 1.00 0.00 C ATOM 711 O VAL A 50 -3.991 -5.889 -11.744 1.00 0.00 O ATOM 712 CB VAL A 50 -3.215 -5.431 -8.644 1.00 0.00 C ATOM 713 CG1 VAL A 50 -4.583 -4.767 -8.595 1.00 0.00 C ATOM 714 CG2 VAL A 50 -3.393 -6.911 -8.275 1.00 0.00 C ATOM 0 H VAL A 50 -3.390 -3.369 -10.448 1.00 0.00 H new ATOM 0 HA VAL A 50 -1.442 -5.495 -9.756 1.00 0.00 H new ATOM 0 HB VAL A 50 -2.557 -4.960 -7.914 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -5.050 -4.966 -7.630 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -4.470 -3.691 -8.729 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.211 -5.168 -9.391 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.924 -6.988 -7.326 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.967 -7.414 -9.054 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -2.415 -7.383 -8.183 1.00 0.00 H new ATOM 724 N SER A 51 -2.074 -7.048 -11.437 1.00 0.00 N ATOM 725 CA SER A 51 -2.284 -8.000 -12.543 1.00 0.00 C ATOM 726 C SER A 51 -1.686 -9.362 -12.209 1.00 0.00 C ATOM 727 O SER A 51 -0.489 -9.436 -11.941 1.00 0.00 O ATOM 728 CB SER A 51 -1.686 -7.442 -13.840 1.00 0.00 C ATOM 729 OG SER A 51 -0.293 -7.131 -13.726 1.00 0.00 O ATOM 0 H SER A 51 -1.196 -7.185 -10.936 1.00 0.00 H new ATOM 0 HA SER A 51 -3.356 -8.135 -12.686 1.00 0.00 H new ATOM 0 HB2 SER A 51 -1.826 -8.169 -14.640 1.00 0.00 H new ATOM 0 HB3 SER A 51 -2.231 -6.543 -14.127 1.00 0.00 H new ATOM 0 HG SER A 51 0.140 -7.782 -13.135 1.00 0.00 H new ATOM 735 N ALA A 52 -2.576 -10.341 -12.025 1.00 0.00 N ATOM 736 CA ALA A 52 -2.260 -11.734 -11.633 1.00 0.00 C ATOM 737 C ALA A 52 -1.559 -11.782 -10.259 1.00 0.00 C ATOM 738 O ALA A 52 -2.227 -11.763 -9.229 1.00 0.00 O ATOM 739 CB ALA A 52 -1.506 -12.473 -12.756 1.00 0.00 C ATOM 0 H ALA A 52 -3.577 -10.188 -12.148 1.00 0.00 H new ATOM 0 HA ALA A 52 -3.192 -12.283 -11.502 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -1.288 -13.493 -12.438 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -2.123 -12.497 -13.654 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -0.573 -11.953 -12.971 1.00 0.00 H new ATOM 745 N GLN A 53 -0.240 -11.609 -10.270 1.00 0.00 N ATOM 746 CA GLN A 53 0.610 -11.504 -9.070 1.00 0.00 C ATOM 747 C GLN A 53 1.735 -10.456 -9.232 1.00 0.00 C ATOM 748 O GLN A 53 2.864 -10.692 -8.822 1.00 0.00 O ATOM 749 CB GLN A 53 1.144 -12.909 -8.753 1.00 0.00 C ATOM 750 CG GLN A 53 2.007 -13.462 -9.893 1.00 0.00 C ATOM 751 CD GLN A 53 2.034 -14.983 -9.898 1.00 0.00 C ATOM 752 OE1 GLN A 53 1.018 -15.662 -9.961 1.00 0.00 O ATOM 753 NE2 GLN A 53 3.218 -15.536 -9.982 1.00 0.00 N ATOM 0 H GLN A 53 0.291 -11.535 -11.138 1.00 0.00 H new ATOM 0 HA GLN A 53 0.021 -11.140 -8.228 1.00 0.00 H new ATOM 0 HB2 GLN A 53 1.732 -12.876 -7.836 1.00 0.00 H new ATOM 0 HB3 GLN A 53 0.307 -13.583 -8.571 1.00 0.00 H new ATOM 0 HG2 GLN A 53 1.622 -13.103 -10.847 1.00 0.00 H new ATOM 0 HG3 GLN A 53 3.024 -13.081 -9.796 1.00 0.00 H new ATOM 0 HE21 GLN A 53 4.056 -14.957 -9.928 1.00 0.00 H new ATOM 0 HE22 GLN A 53 3.302 -16.545 -10.102 1.00 0.00 H new ATOM 762 N GLY A 54 1.427 -9.337 -9.897 1.00 0.00 N ATOM 763 CA GLY A 54 2.392 -8.243 -10.145 1.00 0.00 C ATOM 764 C GLY A 54 1.745 -6.874 -9.917 1.00 0.00 C ATOM 765 O GLY A 54 0.751 -6.554 -10.578 1.00 0.00 O ATOM 0 H GLY A 54 0.500 -9.157 -10.283 1.00 0.00 H new ATOM 0 HA2 GLY A 54 3.252 -8.356 -9.485 1.00 0.00 H new ATOM 0 HA3 GLY A 54 2.764 -8.307 -11.168 1.00 0.00 H new ATOM 769 N ILE A 55 2.182 -6.234 -8.838 1.00 0.00 N ATOM 770 CA ILE A 55 1.743 -4.878 -8.444 1.00 0.00 C ATOM 771 C ILE A 55 2.771 -3.883 -9.003 1.00 0.00 C ATOM 772 O ILE A 55 3.976 -4.041 -8.834 1.00 0.00 O ATOM 773 CB ILE A 55 1.665 -4.710 -6.908 1.00 0.00 C ATOM 774 CG1 ILE A 55 0.968 -5.854 -6.146 1.00 0.00 C ATOM 775 CG2 ILE A 55 1.080 -3.346 -6.516 1.00 0.00 C ATOM 776 CD1 ILE A 55 -0.436 -6.242 -6.603 1.00 0.00 C ATOM 0 H ILE A 55 2.862 -6.639 -8.195 1.00 0.00 H new ATOM 0 HA ILE A 55 0.743 -4.703 -8.840 1.00 0.00 H new ATOM 0 HB ILE A 55 2.705 -4.760 -6.585 1.00 0.00 H new ATOM 0 HG12 ILE A 55 1.601 -6.739 -6.212 1.00 0.00 H new ATOM 0 HG13 ILE A 55 0.916 -5.576 -5.093 1.00 0.00 H new ATOM 0 HG21 ILE A 55 1.041 -3.265 -5.430 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.710 -2.551 -6.917 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.073 -3.251 -6.923 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -0.808 -7.058 -5.983 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -1.100 -5.383 -6.509 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -0.404 -6.563 -7.644 1.00 0.00 H new ATOM 788 N THR A 56 2.246 -2.807 -9.555 1.00 0.00 N ATOM 789 CA THR A 56 3.059 -1.763 -10.201 1.00 0.00 C ATOM 790 C THR A 56 2.630 -0.407 -9.640 1.00 0.00 C ATOM 791 O THR A 56 1.440 -0.156 -9.450 1.00 0.00 O ATOM 792 CB THR A 56 2.882 -1.830 -11.727 1.00 0.00 C ATOM 793 OG1 THR A 56 2.955 -3.197 -12.151 1.00 0.00 O ATOM 794 CG2 THR A 56 3.969 -1.035 -12.457 1.00 0.00 C ATOM 0 H THR A 56 1.244 -2.620 -9.575 1.00 0.00 H new ATOM 0 HA THR A 56 4.118 -1.913 -9.992 1.00 0.00 H new ATOM 0 HB THR A 56 1.912 -1.397 -11.971 1.00 0.00 H new ATOM 0 HG1 THR A 56 2.841 -3.244 -13.123 1.00 0.00 H new ATOM 0 HG21 THR A 56 3.811 -1.106 -13.533 1.00 0.00 H new ATOM 0 HG22 THR A 56 3.923 0.010 -12.151 1.00 0.00 H new ATOM 0 HG23 THR A 56 4.948 -1.443 -12.207 1.00 0.00 H new ATOM 802 N LEU A 57 3.646 0.345 -9.233 1.00 0.00 N ATOM 803 CA LEU A 57 3.489 1.685 -8.637 1.00 0.00 C ATOM 804 C LEU A 57 4.359 2.718 -9.350 1.00 0.00 C ATOM 805 O LEU A 57 5.587 2.633 -9.348 1.00 0.00 O ATOM 806 CB LEU A 57 3.793 1.648 -7.137 1.00 0.00 C ATOM 807 CG LEU A 57 2.712 0.868 -6.385 1.00 0.00 C ATOM 808 CD1 LEU A 57 3.276 0.361 -5.062 1.00 0.00 C ATOM 809 CD2 LEU A 57 1.483 1.744 -6.133 1.00 0.00 C ATOM 0 H LEU A 57 4.618 0.046 -9.305 1.00 0.00 H new ATOM 0 HA LEU A 57 2.450 1.989 -8.766 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.765 1.185 -6.969 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.852 2.664 -6.748 1.00 0.00 H new ATOM 0 HG LEU A 57 2.403 0.020 -6.997 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.506 -0.194 -4.527 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.126 -0.293 -5.256 1.00 0.00 H new ATOM 0 HD13 LEU A 57 3.600 1.207 -4.456 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.729 1.167 -5.597 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.770 2.610 -5.536 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.074 2.080 -7.086 1.00 0.00 H new ATOM 821 N THR A 58 3.662 3.548 -10.111 1.00 0.00 N ATOM 822 CA THR A 58 4.283 4.575 -10.969 1.00 0.00 C ATOM 823 C THR A 58 3.931 5.973 -10.442 1.00 0.00 C ATOM 824 O THR A 58 2.822 6.207 -9.962 1.00 0.00 O ATOM 825 CB THR A 58 3.805 4.439 -12.428 1.00 0.00 C ATOM 826 OG1 THR A 58 2.396 4.670 -12.514 1.00 0.00 O ATOM 827 CG2 THR A 58 4.106 3.063 -13.029 1.00 0.00 C ATOM 0 H THR A 58 2.643 3.537 -10.159 1.00 0.00 H new ATOM 0 HA THR A 58 5.363 4.433 -10.945 1.00 0.00 H new ATOM 0 HB THR A 58 4.357 5.187 -12.998 1.00 0.00 H new ATOM 0 HG1 THR A 58 2.106 4.582 -13.446 1.00 0.00 H new ATOM 0 HG21 THR A 58 3.746 3.028 -14.057 1.00 0.00 H new ATOM 0 HG22 THR A 58 5.182 2.887 -13.015 1.00 0.00 H new ATOM 0 HG23 THR A 58 3.605 2.293 -12.443 1.00 0.00 H new ATOM 835 N ASP A 59 4.924 6.858 -10.476 1.00 0.00 N ATOM 836 CA ASP A 59 4.734 8.272 -10.098 1.00 0.00 C ATOM 837 C ASP A 59 4.083 9.086 -11.220 1.00 0.00 C ATOM 838 O ASP A 59 4.712 9.353 -12.242 1.00 0.00 O ATOM 839 CB ASP A 59 6.043 8.942 -9.663 1.00 0.00 C ATOM 840 CG ASP A 59 6.292 8.903 -8.148 1.00 0.00 C ATOM 841 OD1 ASP A 59 5.424 8.399 -7.419 1.00 0.00 O ATOM 842 OD2 ASP A 59 7.351 9.410 -7.743 1.00 0.00 O ATOM 0 H ASP A 59 5.876 6.628 -10.762 1.00 0.00 H new ATOM 0 HA ASP A 59 4.058 8.259 -9.243 1.00 0.00 H new ATOM 0 HB2 ASP A 59 6.875 8.454 -10.170 1.00 0.00 H new ATOM 0 HB3 ASP A 59 6.034 9.981 -9.993 1.00 0.00 H new ATOM 847 N ASN A 60 2.831 9.455 -10.976 1.00 0.00 N ATOM 848 CA ASN A 60 2.078 10.323 -11.904 1.00 0.00 C ATOM 849 C ASN A 60 1.870 11.745 -11.358 1.00 0.00 C ATOM 850 O ASN A 60 1.488 12.644 -12.098 1.00 0.00 O ATOM 851 CB ASN A 60 0.726 9.686 -12.233 1.00 0.00 C ATOM 852 CG ASN A 60 0.231 10.162 -13.601 1.00 0.00 C ATOM 853 OD1 ASN A 60 -0.465 11.152 -13.764 1.00 0.00 O ATOM 854 ND2 ASN A 60 0.630 9.452 -14.633 1.00 0.00 N ATOM 0 H ASN A 60 2.307 9.173 -10.147 1.00 0.00 H new ATOM 0 HA ASN A 60 2.678 10.416 -12.809 1.00 0.00 H new ATOM 0 HB2 ASN A 60 0.818 8.600 -12.230 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -0.002 9.946 -11.465 1.00 0.00 H new ATOM 0 HD21 ASN A 60 0.358 9.727 -15.577 1.00 0.00 H new ATOM 0 HD22 ASN A 60 1.211 8.626 -14.490 1.00 0.00 H new ATOM 861 N GLN A 61 2.192 11.939 -10.077 1.00 0.00 N ATOM 862 CA GLN A 61 2.057 13.243 -9.409 1.00 0.00 C ATOM 863 C GLN A 61 2.876 14.335 -10.127 1.00 0.00 C ATOM 864 O GLN A 61 2.297 15.209 -10.761 1.00 0.00 O ATOM 865 CB GLN A 61 2.456 13.102 -7.939 1.00 0.00 C ATOM 866 CG GLN A 61 1.894 14.272 -7.130 1.00 0.00 C ATOM 867 CD GLN A 61 2.893 14.900 -6.158 1.00 0.00 C ATOM 868 OE1 GLN A 61 4.074 14.576 -6.082 1.00 0.00 O ATOM 869 NE2 GLN A 61 2.398 15.836 -5.387 1.00 0.00 N ATOM 0 H GLN A 61 2.553 11.201 -9.472 1.00 0.00 H new ATOM 0 HA GLN A 61 1.016 13.562 -9.458 1.00 0.00 H new ATOM 0 HB2 GLN A 61 2.080 12.160 -7.540 1.00 0.00 H new ATOM 0 HB3 GLN A 61 3.542 13.075 -7.849 1.00 0.00 H new ATOM 0 HG2 GLN A 61 1.543 15.040 -7.819 1.00 0.00 H new ATOM 0 HG3 GLN A 61 1.026 13.927 -6.568 1.00 0.00 H new ATOM 0 HE21 GLN A 61 1.414 16.093 -5.464 1.00 0.00 H new ATOM 0 HE22 GLN A 61 2.997 16.308 -4.710 1.00 0.00 H new ATOM 878 N ARG A 62 4.204 14.245 -10.007 1.00 0.00 N ATOM 879 CA ARG A 62 5.173 15.205 -10.597 1.00 0.00 C ATOM 880 C ARG A 62 6.652 14.816 -10.367 1.00 0.00 C ATOM 881 O ARG A 62 7.544 15.656 -10.265 1.00 0.00 O ATOM 882 CB ARG A 62 4.928 16.625 -10.054 1.00 0.00 C ATOM 883 CG ARG A 62 5.151 16.704 -8.543 1.00 0.00 C ATOM 884 CD ARG A 62 5.463 18.139 -8.150 1.00 0.00 C ATOM 885 NE ARG A 62 6.313 18.114 -6.951 1.00 0.00 N ATOM 886 CZ ARG A 62 6.693 19.187 -6.256 1.00 0.00 C ATOM 887 NH1 ARG A 62 6.301 20.404 -6.607 1.00 0.00 N ATOM 888 NH2 ARG A 62 7.479 19.056 -5.201 1.00 0.00 N ATOM 0 H ARG A 62 4.656 13.492 -9.489 1.00 0.00 H new ATOM 0 HA ARG A 62 4.999 15.175 -11.673 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.595 17.326 -10.556 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.908 16.932 -10.287 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.263 16.356 -8.015 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.972 16.049 -8.251 1.00 0.00 H new ATOM 0 HD2 ARG A 62 5.971 18.654 -8.965 1.00 0.00 H new ATOM 0 HD3 ARG A 62 4.542 18.687 -7.951 1.00 0.00 H new ATOM 0 HE ARG A 62 6.638 17.204 -6.625 1.00 0.00 H new ATOM 0 HH11 ARG A 62 5.699 20.531 -7.420 1.00 0.00 H new ATOM 0 HH12 ARG A 62 6.602 21.213 -6.064 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.798 18.131 -4.915 1.00 0.00 H new ATOM 0 HH22 ARG A 62 7.766 19.880 -4.674 1.00 0.00 H new ATOM 902 N LYS A 63 6.899 13.514 -10.262 1.00 0.00 N ATOM 903 CA LYS A 63 8.266 13.023 -10.026 1.00 0.00 C ATOM 904 C LYS A 63 8.891 12.542 -11.340 1.00 0.00 C ATOM 905 O LYS A 63 9.867 13.128 -11.794 1.00 0.00 O ATOM 906 CB LYS A 63 8.276 11.927 -8.961 1.00 0.00 C ATOM 907 CG LYS A 63 9.689 11.664 -8.426 1.00 0.00 C ATOM 908 CD LYS A 63 9.992 12.528 -7.202 1.00 0.00 C ATOM 909 CE LYS A 63 9.513 11.835 -5.925 1.00 0.00 C ATOM 910 NZ LYS A 63 9.334 12.808 -4.841 1.00 0.00 N ATOM 0 H LYS A 63 6.189 12.785 -10.334 1.00 0.00 H new ATOM 0 HA LYS A 63 8.873 13.845 -9.648 1.00 0.00 H new ATOM 0 HB2 LYS A 63 7.623 12.215 -8.137 1.00 0.00 H new ATOM 0 HB3 LYS A 63 7.870 11.007 -9.382 1.00 0.00 H new ATOM 0 HG2 LYS A 63 9.790 10.611 -8.164 1.00 0.00 H new ATOM 0 HG3 LYS A 63 10.420 11.869 -9.208 1.00 0.00 H new ATOM 0 HD2 LYS A 63 11.064 12.718 -7.140 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.502 13.496 -7.303 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.572 11.320 -6.116 1.00 0.00 H new ATOM 0 HE3 LYS A 63 10.236 11.077 -5.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 9.009 12.317 -3.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 10.239 13.281 -4.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 8.627 13.516 -5.124 1.00 0.00 H new ATOM 924 N LEU A 64 8.317 11.479 -11.918 1.00 0.00 N ATOM 925 CA LEU A 64 8.780 10.872 -13.186 1.00 0.00 C ATOM 926 C LEU A 64 10.261 10.469 -13.087 1.00 0.00 C ATOM 927 O LEU A 64 11.173 11.136 -13.570 1.00 0.00 O ATOM 928 CB LEU A 64 8.533 11.810 -14.381 1.00 0.00 C ATOM 929 CG LEU A 64 7.053 11.998 -14.727 1.00 0.00 C ATOM 930 CD1 LEU A 64 6.898 13.217 -15.636 1.00 0.00 C ATOM 931 CD2 LEU A 64 6.504 10.759 -15.441 1.00 0.00 C ATOM 0 H LEU A 64 7.507 11.006 -11.518 1.00 0.00 H new ATOM 0 HA LEU A 64 8.196 9.968 -13.359 1.00 0.00 H new ATOM 0 HB2 LEU A 64 8.971 12.784 -14.163 1.00 0.00 H new ATOM 0 HB3 LEU A 64 9.053 11.415 -15.254 1.00 0.00 H new ATOM 0 HG LEU A 64 6.493 12.146 -13.804 1.00 0.00 H new ATOM 0 HD11 LEU A 64 5.846 13.354 -15.885 1.00 0.00 H new ATOM 0 HD12 LEU A 64 7.268 14.104 -15.122 1.00 0.00 H new ATOM 0 HD13 LEU A 64 7.470 13.064 -16.551 1.00 0.00 H new ATOM 0 HD21 LEU A 64 5.451 10.912 -15.678 1.00 0.00 H new ATOM 0 HD22 LEU A 64 7.063 10.592 -16.362 1.00 0.00 H new ATOM 0 HD23 LEU A 64 6.607 9.890 -14.792 1.00 0.00 H new ATOM 943 N PHE A 65 10.454 9.412 -12.309 1.00 0.00 N ATOM 944 CA PHE A 65 11.794 8.864 -12.034 1.00 0.00 C ATOM 945 C PHE A 65 11.909 7.408 -12.509 1.00 0.00 C ATOM 946 O PHE A 65 12.827 7.049 -13.242 1.00 0.00 O ATOM 947 CB PHE A 65 12.116 9.012 -10.533 1.00 0.00 C ATOM 948 CG PHE A 65 11.372 8.042 -9.610 1.00 0.00 C ATOM 949 CD1 PHE A 65 10.027 8.222 -9.294 1.00 0.00 C ATOM 950 CD2 PHE A 65 12.021 6.887 -9.170 1.00 0.00 C ATOM 951 CE1 PHE A 65 9.360 7.259 -8.554 1.00 0.00 C ATOM 952 CE2 PHE A 65 11.351 5.931 -8.438 1.00 0.00 C ATOM 953 CZ PHE A 65 10.005 6.116 -8.117 1.00 0.00 C ATOM 0 H PHE A 65 9.697 8.906 -11.849 1.00 0.00 H new ATOM 0 HA PHE A 65 12.534 9.432 -12.598 1.00 0.00 H new ATOM 0 HB2 PHE A 65 13.188 8.873 -10.392 1.00 0.00 H new ATOM 0 HB3 PHE A 65 11.883 10.032 -10.226 1.00 0.00 H new ATOM 0 HD1 PHE A 65 9.506 9.109 -9.625 1.00 0.00 H new ATOM 0 HD2 PHE A 65 13.064 6.740 -9.407 1.00 0.00 H new ATOM 0 HE1 PHE A 65 8.317 7.403 -8.314 1.00 0.00 H new ATOM 0 HE2 PHE A 65 11.867 5.039 -8.113 1.00 0.00 H new ATOM 0 HZ PHE A 65 9.474 5.377 -7.535 1.00 0.00 H new ATOM 963 N PHE A 66 10.947 6.598 -12.056 1.00 0.00 N ATOM 964 CA PHE A 66 10.898 5.150 -12.292 1.00 0.00 C ATOM 965 C PHE A 66 9.614 4.564 -11.683 1.00 0.00 C ATOM 966 O PHE A 66 8.866 5.238 -10.968 1.00 0.00 O ATOM 967 CB PHE A 66 12.119 4.514 -11.615 1.00 0.00 C ATOM 968 CG PHE A 66 12.559 3.245 -12.320 1.00 0.00 C ATOM 969 CD1 PHE A 66 12.934 3.270 -13.662 1.00 0.00 C ATOM 970 CD2 PHE A 66 12.632 2.062 -11.593 1.00 0.00 C ATOM 971 CE1 PHE A 66 13.372 2.115 -14.274 1.00 0.00 C ATOM 972 CE2 PHE A 66 13.073 0.909 -12.206 1.00 0.00 C ATOM 973 CZ PHE A 66 13.442 0.924 -13.548 1.00 0.00 C ATOM 0 H PHE A 66 10.161 6.938 -11.502 1.00 0.00 H new ATOM 0 HA PHE A 66 10.904 4.946 -13.363 1.00 0.00 H new ATOM 0 HB2 PHE A 66 12.942 5.228 -11.606 1.00 0.00 H new ATOM 0 HB3 PHE A 66 11.881 4.288 -10.575 1.00 0.00 H new ATOM 0 HD1 PHE A 66 12.882 4.192 -14.221 1.00 0.00 H new ATOM 0 HD2 PHE A 66 12.344 2.047 -10.552 1.00 0.00 H new ATOM 0 HE1 PHE A 66 13.661 2.131 -15.315 1.00 0.00 H new ATOM 0 HE2 PHE A 66 13.133 -0.010 -11.642 1.00 0.00 H new ATOM 0 HZ PHE A 66 13.781 0.017 -14.026 1.00 0.00 H new ATOM 983 N ARG A 67 9.375 3.312 -12.044 1.00 0.00 N ATOM 984 CA ARG A 67 8.233 2.521 -11.559 1.00 0.00 C ATOM 985 C ARG A 67 8.715 1.367 -10.672 1.00 0.00 C ATOM 986 O ARG A 67 9.850 0.901 -10.777 1.00 0.00 O ATOM 987 CB ARG A 67 7.422 1.973 -12.740 1.00 0.00 C ATOM 988 CG ARG A 67 8.221 1.051 -13.665 1.00 0.00 C ATOM 989 CD ARG A 67 8.208 1.564 -15.103 1.00 0.00 C ATOM 990 NE ARG A 67 6.899 1.309 -15.727 1.00 0.00 N ATOM 991 CZ ARG A 67 6.622 1.449 -17.026 1.00 0.00 C ATOM 992 NH1 ARG A 67 7.537 1.879 -17.884 1.00 0.00 N ATOM 993 NH2 ARG A 67 5.420 1.149 -17.489 1.00 0.00 N ATOM 0 H ARG A 67 9.974 2.801 -12.692 1.00 0.00 H new ATOM 0 HA ARG A 67 7.593 3.173 -10.965 1.00 0.00 H new ATOM 0 HB2 ARG A 67 6.561 1.427 -12.355 1.00 0.00 H new ATOM 0 HB3 ARG A 67 7.035 2.809 -13.322 1.00 0.00 H new ATOM 0 HG2 ARG A 67 9.249 0.979 -13.311 1.00 0.00 H new ATOM 0 HG3 ARG A 67 7.801 0.046 -13.631 1.00 0.00 H new ATOM 0 HD2 ARG A 67 8.422 2.633 -15.117 1.00 0.00 H new ATOM 0 HD3 ARG A 67 8.994 1.074 -15.678 1.00 0.00 H new ATOM 0 HE ARG A 67 6.142 1.000 -15.117 1.00 0.00 H new ATOM 0 HH11 ARG A 67 8.475 2.110 -17.556 1.00 0.00 H new ATOM 0 HH12 ARG A 67 7.303 1.978 -18.872 1.00 0.00 H new ATOM 0 HH21 ARG A 67 4.699 0.809 -16.853 1.00 0.00 H new ATOM 0 HH22 ARG A 67 5.214 1.258 -18.482 1.00 0.00 H new ATOM 1007 N ARG A 68 7.802 0.927 -9.821 1.00 0.00 N ATOM 1008 CA ARG A 68 8.035 -0.224 -8.931 1.00 0.00 C ATOM 1009 C ARG A 68 7.193 -1.433 -9.344 1.00 0.00 C ATOM 1010 O ARG A 68 6.108 -1.286 -9.903 1.00 0.00 O ATOM 1011 CB ARG A 68 7.740 0.146 -7.476 1.00 0.00 C ATOM 1012 CG ARG A 68 8.681 1.258 -7.018 1.00 0.00 C ATOM 1013 CD ARG A 68 8.776 1.340 -5.495 1.00 0.00 C ATOM 1014 NE ARG A 68 9.805 2.333 -5.139 1.00 0.00 N ATOM 1015 CZ ARG A 68 11.134 2.213 -5.268 1.00 0.00 C ATOM 1016 NH1 ARG A 68 11.718 1.120 -5.745 1.00 0.00 N ATOM 1017 NH2 ARG A 68 11.914 3.221 -4.918 1.00 0.00 N ATOM 0 H ARG A 68 6.879 1.348 -9.720 1.00 0.00 H new ATOM 0 HA ARG A 68 9.087 -0.496 -9.021 1.00 0.00 H new ATOM 0 HB2 ARG A 68 6.704 0.472 -7.378 1.00 0.00 H new ATOM 0 HB3 ARG A 68 7.861 -0.729 -6.838 1.00 0.00 H new ATOM 0 HG2 ARG A 68 9.674 1.086 -7.434 1.00 0.00 H new ATOM 0 HG3 ARG A 68 8.331 2.213 -7.411 1.00 0.00 H new ATOM 0 HD2 ARG A 68 7.813 1.625 -5.071 1.00 0.00 H new ATOM 0 HD3 ARG A 68 9.031 0.365 -5.079 1.00 0.00 H new ATOM 0 HE ARG A 68 9.467 3.213 -4.750 1.00 0.00 H new ATOM 0 HH11 ARG A 68 11.151 0.323 -6.033 1.00 0.00 H new ATOM 0 HH12 ARG A 68 12.734 1.078 -5.824 1.00 0.00 H new ATOM 0 HH21 ARG A 68 11.504 4.081 -4.553 1.00 0.00 H new ATOM 0 HH22 ARG A 68 12.926 3.139 -5.012 1.00 0.00 H new ATOM 1031 N HIS A 69 7.745 -2.598 -9.026 1.00 0.00 N ATOM 1032 CA HIS A 69 7.133 -3.913 -9.281 1.00 0.00 C ATOM 1033 C HIS A 69 7.209 -4.764 -8.007 1.00 0.00 C ATOM 1034 O HIS A 69 8.275 -5.205 -7.580 1.00 0.00 O ATOM 1035 CB HIS A 69 7.816 -4.569 -10.490 1.00 0.00 C ATOM 1036 CG HIS A 69 7.601 -6.087 -10.688 1.00 0.00 C ATOM 1037 ND1 HIS A 69 8.550 -6.887 -11.146 1.00 0.00 N ATOM 1038 CD2 HIS A 69 6.588 -6.843 -10.281 1.00 0.00 C ATOM 1039 CE1 HIS A 69 8.141 -8.151 -10.980 1.00 0.00 C ATOM 1040 NE2 HIS A 69 6.930 -8.123 -10.440 1.00 0.00 N ATOM 0 H HIS A 69 8.655 -2.665 -8.571 1.00 0.00 H new ATOM 0 HA HIS A 69 6.077 -3.810 -9.532 1.00 0.00 H new ATOM 0 HB2 HIS A 69 7.471 -4.059 -11.390 1.00 0.00 H new ATOM 0 HB3 HIS A 69 8.888 -4.387 -10.412 1.00 0.00 H new ATOM 0 HD1 HIS A 69 9.437 -6.593 -11.554 1.00 0.00 H new ATOM 0 HD2 HIS A 69 5.648 -6.483 -9.889 1.00 0.00 H new ATOM 0 HE1 HIS A 69 8.699 -9.038 -11.240 1.00 0.00 H new ATOM 1048 N TYR A 70 6.029 -4.978 -7.455 1.00 0.00 N ATOM 1049 CA TYR A 70 5.802 -5.778 -6.244 1.00 0.00 C ATOM 1050 C TYR A 70 4.927 -6.999 -6.558 1.00 0.00 C ATOM 1051 O TYR A 70 3.706 -6.880 -6.612 1.00 0.00 O ATOM 1052 CB TYR A 70 5.165 -4.912 -5.151 1.00 0.00 C ATOM 1053 CG TYR A 70 6.198 -3.991 -4.520 1.00 0.00 C ATOM 1054 CD1 TYR A 70 7.247 -4.547 -3.791 1.00 0.00 C ATOM 1055 CD2 TYR A 70 6.059 -2.606 -4.586 1.00 0.00 C ATOM 1056 CE1 TYR A 70 8.142 -3.736 -3.128 1.00 0.00 C ATOM 1057 CE2 TYR A 70 6.955 -1.791 -3.924 1.00 0.00 C ATOM 1058 CZ TYR A 70 8.006 -2.349 -3.197 1.00 0.00 C ATOM 1059 OH TYR A 70 8.821 -1.548 -2.477 1.00 0.00 O ATOM 0 H TYR A 70 5.168 -4.592 -7.842 1.00 0.00 H new ATOM 0 HA TYR A 70 6.763 -6.141 -5.879 1.00 0.00 H new ATOM 0 HB2 TYR A 70 4.355 -4.320 -5.576 1.00 0.00 H new ATOM 0 HB3 TYR A 70 4.725 -5.551 -4.385 1.00 0.00 H new ATOM 0 HD1 TYR A 70 7.359 -5.620 -3.745 1.00 0.00 H new ATOM 0 HD2 TYR A 70 5.251 -2.171 -5.155 1.00 0.00 H new ATOM 0 HE1 TYR A 70 8.947 -4.173 -2.556 1.00 0.00 H new ATOM 0 HE2 TYR A 70 6.842 -0.718 -3.969 1.00 0.00 H new ATOM 0 HH TYR A 70 8.290 -1.034 -1.834 1.00 0.00 H new ATOM 1069 N PRO A 71 5.518 -8.153 -6.862 1.00 0.00 N ATOM 1070 CA PRO A 71 4.715 -9.349 -7.165 1.00 0.00 C ATOM 1071 C PRO A 71 3.934 -9.788 -5.917 1.00 0.00 C ATOM 1072 O PRO A 71 4.532 -9.936 -4.865 1.00 0.00 O ATOM 1073 CB PRO A 71 5.734 -10.383 -7.652 1.00 0.00 C ATOM 1074 CG PRO A 71 7.049 -9.970 -6.989 1.00 0.00 C ATOM 1075 CD PRO A 71 6.964 -8.446 -6.888 1.00 0.00 C ATOM 0 HA PRO A 71 3.951 -9.188 -7.926 1.00 0.00 H new ATOM 0 HB2 PRO A 71 5.444 -11.393 -7.362 1.00 0.00 H new ATOM 0 HB3 PRO A 71 5.818 -10.375 -8.739 1.00 0.00 H new ATOM 0 HG2 PRO A 71 7.159 -10.428 -6.006 1.00 0.00 H new ATOM 0 HG3 PRO A 71 7.908 -10.281 -7.583 1.00 0.00 H new ATOM 0 HD2 PRO A 71 7.458 -8.080 -5.988 1.00 0.00 H new ATOM 0 HD3 PRO A 71 7.450 -7.965 -7.737 1.00 0.00 H new ATOM 1083 N LEU A 72 2.631 -10.052 -6.030 1.00 0.00 N ATOM 1084 CA LEU A 72 1.794 -10.493 -4.887 1.00 0.00 C ATOM 1085 C LEU A 72 2.353 -11.721 -4.135 1.00 0.00 C ATOM 1086 O LEU A 72 2.182 -11.827 -2.928 1.00 0.00 O ATOM 1087 CB LEU A 72 0.350 -10.721 -5.347 1.00 0.00 C ATOM 1088 CG LEU A 72 -0.620 -10.865 -4.168 1.00 0.00 C ATOM 1089 CD1 LEU A 72 -1.880 -10.039 -4.430 1.00 0.00 C ATOM 1090 CD2 LEU A 72 -0.983 -12.337 -3.953 1.00 0.00 C ATOM 0 H LEU A 72 2.118 -9.970 -6.908 1.00 0.00 H new ATOM 0 HA LEU A 72 1.814 -9.684 -4.157 1.00 0.00 H new ATOM 0 HB2 LEU A 72 0.035 -9.887 -5.974 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.305 -11.619 -5.964 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.136 -10.495 -3.264 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.566 -10.145 -3.589 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.609 -8.990 -4.548 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -2.364 -10.393 -5.340 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.672 -12.423 -3.113 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -1.457 -12.730 -4.853 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.079 -12.907 -3.740 1.00 0.00 H new ATOM 1102 N ASN A 73 3.250 -12.442 -4.811 1.00 0.00 N ATOM 1103 CA ASN A 73 4.077 -13.525 -4.243 1.00 0.00 C ATOM 1104 C ASN A 73 4.848 -13.078 -2.979 1.00 0.00 C ATOM 1105 O ASN A 73 5.192 -13.897 -2.131 1.00 0.00 O ATOM 1106 CB ASN A 73 5.069 -13.956 -5.329 1.00 0.00 C ATOM 1107 CG ASN A 73 5.422 -15.439 -5.208 1.00 0.00 C ATOM 1108 OD1 ASN A 73 4.586 -16.297 -4.969 1.00 0.00 O ATOM 1109 ND2 ASN A 73 6.653 -15.794 -5.495 1.00 0.00 N ATOM 0 H ASN A 73 3.432 -12.288 -5.803 1.00 0.00 H new ATOM 0 HA ASN A 73 3.429 -14.346 -3.937 1.00 0.00 H new ATOM 0 HB2 ASN A 73 4.641 -13.762 -6.312 1.00 0.00 H new ATOM 0 HB3 ASN A 73 5.977 -13.357 -5.253 1.00 0.00 H new ATOM 0 HD21 ASN A 73 6.907 -16.782 -5.518 1.00 0.00 H new ATOM 0 HD22 ASN A 73 7.355 -15.082 -5.695 1.00 0.00 H new ATOM 1116 N THR A 74 5.192 -11.789 -2.947 1.00 0.00 N ATOM 1117 CA THR A 74 5.796 -11.091 -1.795 1.00 0.00 C ATOM 1118 C THR A 74 4.739 -10.481 -0.854 1.00 0.00 C ATOM 1119 O THR A 74 4.860 -10.596 0.361 1.00 0.00 O ATOM 1120 CB THR A 74 6.845 -10.049 -2.255 1.00 0.00 C ATOM 1121 OG1 THR A 74 7.511 -9.518 -1.124 1.00 0.00 O ATOM 1122 CG2 THR A 74 6.351 -8.812 -3.004 1.00 0.00 C ATOM 0 H THR A 74 5.055 -11.174 -3.749 1.00 0.00 H new ATOM 0 HA THR A 74 6.323 -11.842 -1.206 1.00 0.00 H new ATOM 0 HB THR A 74 7.451 -10.634 -2.947 1.00 0.00 H new ATOM 0 HG1 THR A 74 8.176 -8.860 -1.415 1.00 0.00 H new ATOM 0 HG21 THR A 74 7.200 -8.178 -3.259 1.00 0.00 H new ATOM 0 HG22 THR A 74 5.840 -9.119 -3.917 1.00 0.00 H new ATOM 0 HG23 THR A 74 5.660 -8.255 -2.371 1.00 0.00 H new ATOM 1130 N VAL A 75 3.670 -9.932 -1.430 1.00 0.00 N ATOM 1131 CA VAL A 75 2.568 -9.260 -0.704 1.00 0.00 C ATOM 1132 C VAL A 75 1.725 -10.328 0.028 1.00 0.00 C ATOM 1133 O VAL A 75 0.688 -10.787 -0.446 1.00 0.00 O ATOM 1134 CB VAL A 75 1.718 -8.423 -1.689 1.00 0.00 C ATOM 1135 CG1 VAL A 75 0.617 -7.642 -0.968 1.00 0.00 C ATOM 1136 CG2 VAL A 75 2.555 -7.436 -2.513 1.00 0.00 C ATOM 0 H VAL A 75 3.533 -9.937 -2.441 1.00 0.00 H new ATOM 0 HA VAL A 75 2.968 -8.572 0.040 1.00 0.00 H new ATOM 0 HB VAL A 75 1.272 -9.151 -2.367 1.00 0.00 H new ATOM 0 HG11 VAL A 75 0.043 -7.067 -1.695 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.044 -8.338 -0.452 1.00 0.00 H new ATOM 0 HG13 VAL A 75 1.067 -6.964 -0.243 1.00 0.00 H new ATOM 0 HG21 VAL A 75 1.903 -6.878 -3.185 1.00 0.00 H new ATOM 0 HG22 VAL A 75 3.064 -6.743 -1.843 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.294 -7.985 -3.097 1.00 0.00 H new ATOM 1146 N THR A 76 2.216 -10.676 1.211 1.00 0.00 N ATOM 1147 CA THR A 76 1.631 -11.668 2.141 1.00 0.00 C ATOM 1148 C THR A 76 0.259 -11.214 2.655 1.00 0.00 C ATOM 1149 O THR A 76 -0.696 -11.982 2.717 1.00 0.00 O ATOM 1150 CB THR A 76 2.556 -11.933 3.346 1.00 0.00 C ATOM 1151 OG1 THR A 76 2.745 -10.757 4.145 1.00 0.00 O ATOM 1152 CG2 THR A 76 3.914 -12.487 2.909 1.00 0.00 C ATOM 0 H THR A 76 3.073 -10.262 1.577 1.00 0.00 H new ATOM 0 HA THR A 76 1.514 -12.591 1.573 1.00 0.00 H new ATOM 0 HB THR A 76 2.055 -12.685 3.955 1.00 0.00 H new ATOM 0 HG1 THR A 76 3.149 -10.051 3.598 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.536 -12.660 3.787 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.769 -13.427 2.376 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.405 -11.769 2.252 1.00 0.00 H new ATOM 1160 N PHE A 77 0.206 -9.937 3.013 1.00 0.00 N ATOM 1161 CA PHE A 77 -0.988 -9.285 3.570 1.00 0.00 C ATOM 1162 C PHE A 77 -1.100 -7.886 2.978 1.00 0.00 C ATOM 1163 O PHE A 77 -0.091 -7.193 2.927 1.00 0.00 O ATOM 1164 CB PHE A 77 -0.799 -9.157 5.083 1.00 0.00 C ATOM 1165 CG PHE A 77 -2.020 -9.697 5.804 1.00 0.00 C ATOM 1166 CD1 PHE A 77 -2.081 -11.054 6.107 1.00 0.00 C ATOM 1167 CD2 PHE A 77 -3.078 -8.856 6.152 1.00 0.00 C ATOM 1168 CE1 PHE A 77 -3.183 -11.567 6.757 1.00 0.00 C ATOM 1169 CE2 PHE A 77 -4.179 -9.370 6.799 1.00 0.00 C ATOM 1170 CZ PHE A 77 -4.241 -10.732 7.110 1.00 0.00 C ATOM 0 H PHE A 77 1.004 -9.307 2.925 1.00 0.00 H new ATOM 0 HA PHE A 77 -1.882 -9.864 3.341 1.00 0.00 H new ATOM 0 HB2 PHE A 77 0.090 -9.705 5.395 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -0.640 -8.113 5.351 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.264 -11.705 5.833 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -3.033 -7.803 5.914 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -3.226 -12.620 6.993 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -4.998 -8.719 7.067 1.00 0.00 H new ATOM 0 HZ PHE A 77 -5.104 -11.134 7.621 1.00 0.00 H new ATOM 1180 N CYS A 78 -2.323 -7.472 2.666 1.00 0.00 N ATOM 1181 CA CYS A 78 -2.597 -6.114 2.158 1.00 0.00 C ATOM 1182 C CYS A 78 -3.961 -5.637 2.663 1.00 0.00 C ATOM 1183 O CYS A 78 -5.017 -5.911 2.096 1.00 0.00 O ATOM 1184 CB CYS A 78 -2.522 -6.057 0.630 1.00 0.00 C ATOM 1185 SG CYS A 78 -2.578 -4.341 -0.013 1.00 0.00 S ATOM 0 H CYS A 78 -3.154 -8.057 2.754 1.00 0.00 H new ATOM 0 HA CYS A 78 -1.827 -5.443 2.538 1.00 0.00 H new ATOM 0 HB2 CYS A 78 -1.602 -6.536 0.297 1.00 0.00 H new ATOM 0 HB3 CYS A 78 -3.349 -6.627 0.207 1.00 0.00 H new ATOM 0 HG CYS A 78 -2.298 -4.344 -1.282 1.00 0.00 H new ATOM 1191 N ASP A 79 -3.885 -5.076 3.859 1.00 0.00 N ATOM 1192 CA ASP A 79 -5.060 -4.543 4.559 1.00 0.00 C ATOM 1193 C ASP A 79 -4.835 -3.091 4.996 1.00 0.00 C ATOM 1194 O ASP A 79 -3.724 -2.565 4.931 1.00 0.00 O ATOM 1195 CB ASP A 79 -5.436 -5.454 5.734 1.00 0.00 C ATOM 1196 CG ASP A 79 -6.871 -5.968 5.572 1.00 0.00 C ATOM 1197 OD1 ASP A 79 -7.781 -5.159 5.862 1.00 0.00 O ATOM 1198 OD2 ASP A 79 -7.021 -7.122 5.116 1.00 0.00 O ATOM 0 H ASP A 79 -3.013 -4.974 4.377 1.00 0.00 H new ATOM 0 HA ASP A 79 -5.904 -4.531 3.869 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -4.745 -6.295 5.786 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -5.343 -4.906 6.672 1.00 0.00 H new ATOM 1203 N LEU A 80 -5.932 -2.452 5.389 1.00 0.00 N ATOM 1204 CA LEU A 80 -5.891 -1.100 5.977 1.00 0.00 C ATOM 1205 C LEU A 80 -4.996 -1.094 7.222 1.00 0.00 C ATOM 1206 O LEU A 80 -4.653 -2.140 7.770 1.00 0.00 O ATOM 1207 CB LEU A 80 -7.294 -0.637 6.401 1.00 0.00 C ATOM 1208 CG LEU A 80 -8.237 -0.090 5.321 1.00 0.00 C ATOM 1209 CD1 LEU A 80 -7.601 1.045 4.524 1.00 0.00 C ATOM 1210 CD2 LEU A 80 -8.795 -1.187 4.422 1.00 0.00 C ATOM 0 H LEU A 80 -6.871 -2.844 5.314 1.00 0.00 H new ATOM 0 HA LEU A 80 -5.497 -0.425 5.217 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -7.791 -1.480 6.881 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -7.174 0.136 7.160 1.00 0.00 H new ATOM 0 HG LEU A 80 -9.092 0.337 5.846 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -8.305 1.400 3.772 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -7.345 1.863 5.197 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -6.697 0.683 4.033 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.456 -0.745 3.676 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -7.974 -1.700 3.921 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -9.355 -1.902 5.025 1.00 0.00 H new ATOM 1222 N ASP A 81 -4.711 0.106 7.710 1.00 0.00 N ATOM 1223 CA ASP A 81 -3.927 0.246 8.950 1.00 0.00 C ATOM 1224 C ASP A 81 -4.632 1.130 10.001 1.00 0.00 C ATOM 1225 O ASP A 81 -4.046 2.120 10.449 1.00 0.00 O ATOM 1226 CB ASP A 81 -2.482 0.688 8.665 1.00 0.00 C ATOM 1227 CG ASP A 81 -2.140 0.952 7.198 1.00 0.00 C ATOM 1228 OD1 ASP A 81 -1.928 -0.043 6.490 1.00 0.00 O ATOM 1229 OD2 ASP A 81 -2.210 2.118 6.776 1.00 0.00 O ATOM 0 H ASP A 81 -5.000 0.986 7.283 1.00 0.00 H new ATOM 0 HA ASP A 81 -3.864 -0.746 9.398 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -2.282 1.596 9.234 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -1.807 -0.080 9.043 1.00 0.00 H new ATOM 1234 N PRO A 82 -5.858 0.766 10.423 1.00 0.00 N ATOM 1235 CA PRO A 82 -6.642 1.579 11.369 1.00 0.00 C ATOM 1236 C PRO A 82 -6.158 1.350 12.812 1.00 0.00 C ATOM 1237 O PRO A 82 -6.808 0.716 13.637 1.00 0.00 O ATOM 1238 CB PRO A 82 -8.090 1.156 11.105 1.00 0.00 C ATOM 1239 CG PRO A 82 -7.984 -0.324 10.733 1.00 0.00 C ATOM 1240 CD PRO A 82 -6.623 -0.442 10.044 1.00 0.00 C ATOM 0 HA PRO A 82 -6.533 2.655 11.233 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -8.715 1.302 11.986 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -8.535 1.739 10.299 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -8.040 -0.961 11.615 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -8.794 -0.627 10.069 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -6.104 -1.346 10.362 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -6.739 -0.505 8.962 1.00 0.00 H new ATOM 1248 N GLN A 83 -4.908 1.755 13.014 1.00 0.00 N ATOM 1249 CA GLN A 83 -4.232 1.665 14.314 1.00 0.00 C ATOM 1250 C GLN A 83 -3.738 3.031 14.792 1.00 0.00 C ATOM 1251 O GLN A 83 -4.190 3.496 15.832 1.00 0.00 O ATOM 1252 CB GLN A 83 -3.081 0.658 14.263 1.00 0.00 C ATOM 1253 CG GLN A 83 -2.533 0.327 15.658 1.00 0.00 C ATOM 1254 CD GLN A 83 -3.560 -0.468 16.464 1.00 0.00 C ATOM 1255 OE1 GLN A 83 -4.519 0.221 17.038 1.00 0.00 O flip ATOM 1256 NE2 GLN A 83 -3.523 -1.688 16.548 1.00 0.00 N flip ATOM 0 H GLN A 83 -4.328 2.158 12.279 1.00 0.00 H new ATOM 0 HA GLN A 83 -4.966 1.311 15.038 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -3.424 -0.259 13.783 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -2.277 1.059 13.645 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -1.611 -0.247 15.566 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -2.283 1.248 16.185 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -2.771 -2.208 16.096 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -4.244 -2.185 17.070 1.00 0.00 H new ATOM 1265 N GLU A 84 -2.747 3.581 14.087 1.00 0.00 N ATOM 1266 CA GLU A 84 -2.215 4.908 14.430 1.00 0.00 C ATOM 1267 C GLU A 84 -3.281 5.992 14.204 1.00 0.00 C ATOM 1268 O GLU A 84 -3.604 6.708 15.146 1.00 0.00 O ATOM 1269 CB GLU A 84 -0.923 5.199 13.656 1.00 0.00 C ATOM 1270 CG GLU A 84 -0.191 6.465 14.128 1.00 0.00 C ATOM 1271 CD GLU A 84 0.384 6.330 15.540 1.00 0.00 C ATOM 1272 OE1 GLU A 84 -0.363 6.628 16.493 1.00 0.00 O ATOM 1273 OE2 GLU A 84 1.553 5.903 15.630 1.00 0.00 O ATOM 0 H GLU A 84 -2.299 3.138 13.285 1.00 0.00 H new ATOM 0 HA GLU A 84 -1.960 4.917 15.490 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -0.252 4.345 13.752 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -1.160 5.301 12.597 1.00 0.00 H new ATOM 0 HG2 GLU A 84 0.617 6.692 13.432 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -0.881 7.309 14.101 1.00 0.00 H new ATOM 1280 N ARG A 85 -3.824 6.049 12.981 1.00 0.00 N ATOM 1281 CA ARG A 85 -4.798 7.062 12.498 1.00 0.00 C ATOM 1282 C ARG A 85 -4.938 6.975 10.966 1.00 0.00 C ATOM 1283 O ARG A 85 -4.526 5.981 10.377 1.00 0.00 O ATOM 1284 CB ARG A 85 -4.409 8.488 12.940 1.00 0.00 C ATOM 1285 CG ARG A 85 -2.967 8.815 12.549 1.00 0.00 C ATOM 1286 CD ARG A 85 -2.318 9.732 13.571 1.00 0.00 C ATOM 1287 NE ARG A 85 -2.358 11.087 13.018 1.00 0.00 N ATOM 1288 CZ ARG A 85 -1.971 12.192 13.650 1.00 0.00 C ATOM 1289 NH1 ARG A 85 -1.562 12.168 14.912 1.00 0.00 N ATOM 1290 NH2 ARG A 85 -2.017 13.348 13.014 1.00 0.00 N ATOM 0 H ARG A 85 -3.592 5.364 12.262 1.00 0.00 H new ATOM 0 HA ARG A 85 -5.765 6.842 12.951 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -5.085 9.210 12.483 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -4.526 8.581 14.020 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -2.392 7.893 12.466 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -2.952 9.290 11.568 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -2.850 9.688 14.521 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -1.290 9.426 13.766 1.00 0.00 H new ATOM 0 HE ARG A 85 -2.713 11.193 12.068 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -1.538 11.286 15.424 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -1.271 13.032 15.370 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -2.346 13.387 12.049 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -1.723 14.202 13.487 1.00 0.00 H new ATOM 1304 N LYS A 86 -5.411 8.053 10.346 1.00 0.00 N ATOM 1305 CA LYS A 86 -5.592 8.182 8.889 1.00 0.00 C ATOM 1306 C LYS A 86 -4.666 9.306 8.407 1.00 0.00 C ATOM 1307 O LYS A 86 -4.523 10.323 9.086 1.00 0.00 O ATOM 1308 CB LYS A 86 -7.057 8.538 8.612 1.00 0.00 C ATOM 1309 CG LYS A 86 -7.987 7.407 9.064 1.00 0.00 C ATOM 1310 CD LYS A 86 -9.442 7.861 9.168 1.00 0.00 C ATOM 1311 CE LYS A 86 -10.307 6.695 9.649 1.00 0.00 C ATOM 1312 NZ LYS A 86 -11.324 7.161 10.603 1.00 0.00 N ATOM 0 H LYS A 86 -5.690 8.892 10.854 1.00 0.00 H new ATOM 0 HA LYS A 86 -5.350 7.256 8.368 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -7.317 9.459 9.134 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -7.195 8.725 7.547 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -7.917 6.578 8.360 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -7.655 7.032 10.032 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -9.524 8.699 9.861 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -9.794 8.213 8.199 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -10.792 6.220 8.796 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -9.678 5.940 10.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -11.901 6.355 10.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -10.856 7.594 11.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -11.935 7.865 10.142 1.00 0.00 H new ATOM 1326 N TRP A 87 -4.033 9.079 7.258 1.00 0.00 N ATOM 1327 CA TRP A 87 -3.084 10.044 6.671 1.00 0.00 C ATOM 1328 C TRP A 87 -3.895 11.252 6.197 1.00 0.00 C ATOM 1329 O TRP A 87 -4.829 11.121 5.403 1.00 0.00 O ATOM 1330 CB TRP A 87 -2.326 9.415 5.499 1.00 0.00 C ATOM 1331 CG TRP A 87 -1.062 10.205 5.128 1.00 0.00 C ATOM 1332 CD1 TRP A 87 -1.007 11.364 4.466 1.00 0.00 C ATOM 1333 CD2 TRP A 87 0.231 9.862 5.456 1.00 0.00 C ATOM 1334 NE1 TRP A 87 0.264 11.750 4.360 1.00 0.00 N ATOM 1335 CE2 TRP A 87 1.056 10.870 4.950 1.00 0.00 C ATOM 1336 CE3 TRP A 87 0.787 8.785 6.129 1.00 0.00 C ATOM 1337 CZ2 TRP A 87 2.431 10.790 5.131 1.00 0.00 C ATOM 1338 CZ3 TRP A 87 2.157 8.707 6.301 1.00 0.00 C ATOM 1339 CH2 TRP A 87 2.985 9.709 5.800 1.00 0.00 C ATOM 0 H TRP A 87 -4.157 8.231 6.706 1.00 0.00 H new ATOM 0 HA TRP A 87 -2.343 10.345 7.411 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -2.050 8.392 5.755 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -2.984 9.360 4.632 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -1.858 11.903 4.078 1.00 0.00 H new ATOM 0 HE1 TRP A 87 0.580 12.600 3.892 1.00 0.00 H new ATOM 0 HE3 TRP A 87 0.149 8.006 6.520 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 3.071 11.572 4.749 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 2.586 7.866 6.826 1.00 0.00 H new ATOM 0 HH2 TRP A 87 4.055 9.644 5.932 1.00 0.00 H new ATOM 1350 N THR A 88 -3.719 12.335 6.937 1.00 0.00 N ATOM 1351 CA THR A 88 -4.433 13.613 6.737 1.00 0.00 C ATOM 1352 C THR A 88 -4.010 14.278 5.416 1.00 0.00 C ATOM 1353 O THR A 88 -3.296 15.277 5.368 1.00 0.00 O ATOM 1354 CB THR A 88 -4.184 14.527 7.948 1.00 0.00 C ATOM 1355 OG1 THR A 88 -2.779 14.607 8.205 1.00 0.00 O ATOM 1356 CG2 THR A 88 -4.903 14.013 9.201 1.00 0.00 C ATOM 0 H THR A 88 -3.062 12.364 7.716 1.00 0.00 H new ATOM 0 HA THR A 88 -5.504 13.425 6.662 1.00 0.00 H new ATOM 0 HB THR A 88 -4.581 15.514 7.712 1.00 0.00 H new ATOM 0 HG1 THR A 88 -2.315 14.910 7.396 1.00 0.00 H new ATOM 0 HG21 THR A 88 -4.704 14.685 10.036 1.00 0.00 H new ATOM 0 HG22 THR A 88 -5.976 13.974 9.015 1.00 0.00 H new ATOM 0 HG23 THR A 88 -4.541 13.014 9.444 1.00 0.00 H new ATOM 1364 N LYS A 89 -4.371 13.589 4.339 1.00 0.00 N ATOM 1365 CA LYS A 89 -4.091 14.026 2.965 1.00 0.00 C ATOM 1366 C LYS A 89 -5.147 15.041 2.509 1.00 0.00 C ATOM 1367 O LYS A 89 -5.825 15.635 3.347 1.00 0.00 O ATOM 1368 CB LYS A 89 -4.029 12.786 2.067 1.00 0.00 C ATOM 1369 CG LYS A 89 -2.624 12.550 1.502 1.00 0.00 C ATOM 1370 CD LYS A 89 -2.258 13.412 0.287 1.00 0.00 C ATOM 1371 CE LYS A 89 -1.809 14.846 0.585 1.00 0.00 C ATOM 1372 NZ LYS A 89 -1.198 15.433 -0.616 1.00 0.00 N ATOM 0 H LYS A 89 -4.872 12.702 4.390 1.00 0.00 H new ATOM 0 HA LYS A 89 -3.130 14.536 2.905 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -4.341 11.911 2.637 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -4.735 12.899 1.244 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -1.896 12.735 2.292 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -2.533 11.500 1.224 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -1.460 12.910 -0.261 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -3.122 13.454 -0.376 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -2.662 15.446 0.901 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -1.094 14.850 1.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -0.894 16.406 -0.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -0.374 14.865 -0.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -1.893 15.443 -1.389 1.00 0.00 H new ATOM 1386 N THR A 90 -5.172 15.299 1.201 1.00 0.00 N ATOM 1387 CA THR A 90 -6.134 16.201 0.531 1.00 0.00 C ATOM 1388 C THR A 90 -5.807 17.660 0.888 1.00 0.00 C ATOM 1389 O THR A 90 -5.172 18.340 0.085 1.00 0.00 O ATOM 1390 CB THR A 90 -7.585 15.777 0.852 1.00 0.00 C ATOM 1391 OG1 THR A 90 -7.742 14.393 0.517 1.00 0.00 O ATOM 1392 CG2 THR A 90 -8.635 16.598 0.099 1.00 0.00 C ATOM 0 H THR A 90 -4.507 14.878 0.552 1.00 0.00 H new ATOM 0 HA THR A 90 -6.042 16.122 -0.552 1.00 0.00 H new ATOM 0 HB THR A 90 -7.748 15.954 1.915 1.00 0.00 H new ATOM 0 HG1 THR A 90 -8.659 14.110 0.717 1.00 0.00 H new ATOM 0 HG21 THR A 90 -9.632 16.250 0.369 1.00 0.00 H new ATOM 0 HG22 THR A 90 -8.534 17.650 0.365 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.488 16.480 -0.975 1.00 0.00 H new ATOM 1400 N ASP A 91 -6.097 18.041 2.132 1.00 0.00 N ATOM 1401 CA ASP A 91 -5.868 19.350 2.783 1.00 0.00 C ATOM 1402 C ASP A 91 -6.637 19.453 4.110 1.00 0.00 C ATOM 1403 O ASP A 91 -7.307 18.503 4.518 1.00 0.00 O ATOM 1404 CB ASP A 91 -6.193 20.560 1.888 1.00 0.00 C ATOM 1405 CG ASP A 91 -5.008 20.975 1.003 1.00 0.00 C ATOM 1406 OD1 ASP A 91 -3.853 20.749 1.433 1.00 0.00 O ATOM 1407 OD2 ASP A 91 -5.283 21.623 -0.030 1.00 0.00 O ATOM 0 H ASP A 91 -6.540 17.387 2.777 1.00 0.00 H new ATOM 0 HA ASP A 91 -4.796 19.389 2.978 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -7.048 20.320 1.255 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -6.486 21.402 2.514 1.00 0.00 H new ATOM 1412 N GLY A 92 -6.407 20.573 4.818 1.00 0.00 N ATOM 1413 CA GLY A 92 -7.135 20.944 6.053 1.00 0.00 C ATOM 1414 C GLY A 92 -8.632 20.617 5.941 1.00 0.00 C ATOM 1415 O GLY A 92 -9.300 21.072 5.017 1.00 0.00 O ATOM 0 H GLY A 92 -5.701 21.258 4.548 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -6.707 20.412 6.903 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -7.007 22.009 6.246 1.00 0.00 H new ATOM 1419 N SER A 93 -9.016 19.624 6.744 1.00 0.00 N ATOM 1420 CA SER A 93 -10.357 18.988 6.741 1.00 0.00 C ATOM 1421 C SER A 93 -10.574 18.122 5.491 1.00 0.00 C ATOM 1422 O SER A 93 -11.283 18.476 4.549 1.00 0.00 O ATOM 1423 CB SER A 93 -11.517 19.991 6.863 1.00 0.00 C ATOM 1424 OG SER A 93 -11.951 20.141 8.213 1.00 0.00 O ATOM 0 H SER A 93 -8.391 19.219 7.441 1.00 0.00 H new ATOM 0 HA SER A 93 -10.367 18.360 7.632 1.00 0.00 H new ATOM 0 HB2 SER A 93 -11.202 20.959 6.473 1.00 0.00 H new ATOM 0 HB3 SER A 93 -12.352 19.656 6.248 1.00 0.00 H new ATOM 0 HG SER A 93 -12.687 20.787 8.250 1.00 0.00 H new ATOM 1430 N GLY A 94 -9.910 16.961 5.520 1.00 0.00 N ATOM 1431 CA GLY A 94 -10.041 15.948 4.455 1.00 0.00 C ATOM 1432 C GLY A 94 -9.075 14.766 4.641 1.00 0.00 C ATOM 1433 O GLY A 94 -8.255 14.538 3.752 1.00 0.00 O ATOM 0 H GLY A 94 -9.273 16.695 6.271 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -11.065 15.576 4.437 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -9.855 16.416 3.488 1.00 0.00 H new ATOM 1437 N PRO A 95 -9.174 14.001 5.740 1.00 0.00 N ATOM 1438 CA PRO A 95 -8.269 12.862 5.974 1.00 0.00 C ATOM 1439 C PRO A 95 -8.568 11.725 4.990 1.00 0.00 C ATOM 1440 O PRO A 95 -9.702 11.526 4.553 1.00 0.00 O ATOM 1441 CB PRO A 95 -8.500 12.468 7.433 1.00 0.00 C ATOM 1442 CG PRO A 95 -9.963 12.839 7.681 1.00 0.00 C ATOM 1443 CD PRO A 95 -10.183 14.084 6.820 1.00 0.00 C ATOM 0 HA PRO A 95 -7.221 13.109 5.806 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -8.324 11.404 7.593 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -7.831 13.007 8.104 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -10.634 12.030 7.391 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -10.149 13.045 8.735 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -11.194 14.106 6.412 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -10.056 14.994 7.406 1.00 0.00 H new ATOM 1451 N ALA A 96 -7.512 11.009 4.644 1.00 0.00 N ATOM 1452 CA ALA A 96 -7.576 9.885 3.701 1.00 0.00 C ATOM 1453 C ALA A 96 -6.948 8.670 4.378 1.00 0.00 C ATOM 1454 O ALA A 96 -5.782 8.680 4.773 1.00 0.00 O ATOM 1455 CB ALA A 96 -6.834 10.232 2.408 1.00 0.00 C ATOM 0 H ALA A 96 -6.575 11.186 5.007 1.00 0.00 H new ATOM 0 HA ALA A 96 -8.611 9.669 3.436 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -6.890 9.389 1.719 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -7.293 11.107 1.949 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -5.790 10.447 2.634 1.00 0.00 H new ATOM 1461 N LYS A 97 -7.818 7.726 4.725 1.00 0.00 N ATOM 1462 CA LYS A 97 -7.390 6.447 5.320 1.00 0.00 C ATOM 1463 C LYS A 97 -6.148 5.896 4.600 1.00 0.00 C ATOM 1464 O LYS A 97 -5.935 6.085 3.400 1.00 0.00 O ATOM 1465 CB LYS A 97 -8.536 5.425 5.279 1.00 0.00 C ATOM 1466 CG LYS A 97 -8.788 4.899 3.859 1.00 0.00 C ATOM 1467 CD LYS A 97 -10.132 4.211 3.657 1.00 0.00 C ATOM 1468 CE LYS A 97 -11.245 5.252 3.606 1.00 0.00 C ATOM 1469 NZ LYS A 97 -12.096 5.100 4.788 1.00 0.00 N ATOM 0 H LYS A 97 -8.827 7.815 4.607 1.00 0.00 H new ATOM 0 HA LYS A 97 -7.125 6.628 6.362 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -8.300 4.590 5.938 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -9.447 5.886 5.662 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -8.715 5.733 3.161 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -7.995 4.197 3.602 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -10.120 3.634 2.733 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -10.316 3.508 4.469 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -10.820 6.255 3.575 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -11.836 5.127 2.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -12.858 5.807 4.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -12.509 4.146 4.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -11.526 5.239 5.647 1.00 0.00 H new ATOM 1483 N LEU A 98 -5.395 5.159 5.381 1.00 0.00 N ATOM 1484 CA LEU A 98 -4.137 4.552 4.936 1.00 0.00 C ATOM 1485 C LEU A 98 -4.219 3.027 4.966 1.00 0.00 C ATOM 1486 O LEU A 98 -4.963 2.422 5.745 1.00 0.00 O ATOM 1487 CB LEU A 98 -2.972 5.089 5.776 1.00 0.00 C ATOM 1488 CG LEU A 98 -3.380 5.506 7.193 1.00 0.00 C ATOM 1489 CD1 LEU A 98 -3.787 4.332 8.087 1.00 0.00 C ATOM 1490 CD2 LEU A 98 -2.268 6.352 7.777 1.00 0.00 C ATOM 0 H LEU A 98 -5.629 4.955 6.353 1.00 0.00 H new ATOM 0 HA LEU A 98 -3.956 4.831 3.898 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -2.198 4.324 5.840 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -2.532 5.946 5.266 1.00 0.00 H new ATOM 0 HG LEU A 98 -4.291 6.102 7.137 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -4.063 4.704 9.074 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.638 3.815 7.644 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -2.951 3.639 8.181 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -2.538 6.660 8.787 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -1.347 5.770 7.809 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -2.118 7.235 7.156 1.00 0.00 H new ATOM 1502 N PHE A 99 -3.439 2.454 4.070 1.00 0.00 N ATOM 1503 CA PHE A 99 -3.351 1.009 3.857 1.00 0.00 C ATOM 1504 C PHE A 99 -1.939 0.642 3.397 1.00 0.00 C ATOM 1505 O PHE A 99 -1.291 1.375 2.653 1.00 0.00 O ATOM 1506 CB PHE A 99 -4.406 0.567 2.833 1.00 0.00 C ATOM 1507 CG PHE A 99 -4.023 0.812 1.378 1.00 0.00 C ATOM 1508 CD1 PHE A 99 -4.327 1.996 0.714 1.00 0.00 C ATOM 1509 CD2 PHE A 99 -3.304 -0.190 0.723 1.00 0.00 C ATOM 1510 CE1 PHE A 99 -3.937 2.162 -0.602 1.00 0.00 C ATOM 1511 CE2 PHE A 99 -2.902 -0.018 -0.578 1.00 0.00 C ATOM 1512 CZ PHE A 99 -3.221 1.159 -1.256 1.00 0.00 C ATOM 0 H PHE A 99 -2.830 2.988 3.450 1.00 0.00 H new ATOM 0 HA PHE A 99 -3.551 0.486 4.792 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.601 -0.497 2.969 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -5.338 1.092 3.042 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -4.865 2.782 1.224 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.063 -1.105 1.243 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -4.188 3.072 -1.126 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -2.339 -0.793 -1.077 1.00 0.00 H new ATOM 0 HZ PHE A 99 -2.915 1.293 -2.283 1.00 0.00 H new ATOM 1522 N GLY A 100 -1.525 -0.524 3.873 1.00 0.00 N ATOM 1523 CA GLY A 100 -0.209 -1.077 3.574 1.00 0.00 C ATOM 1524 C GLY A 100 -0.243 -2.594 3.507 1.00 0.00 C ATOM 1525 O GLY A 100 -1.142 -3.271 4.014 1.00 0.00 O ATOM 0 H GLY A 100 -2.093 -1.116 4.479 1.00 0.00 H new ATOM 0 HA2 GLY A 100 0.147 -0.678 2.624 1.00 0.00 H new ATOM 0 HA3 GLY A 100 0.501 -0.762 4.338 1.00 0.00 H new ATOM 1529 N PHE A 101 0.809 -3.078 2.880 1.00 0.00 N ATOM 1530 CA PHE A 101 1.016 -4.514 2.701 1.00 0.00 C ATOM 1531 C PHE A 101 2.391 -4.965 3.193 1.00 0.00 C ATOM 1532 O PHE A 101 3.350 -4.195 3.208 1.00 0.00 O ATOM 1533 CB PHE A 101 0.778 -4.898 1.236 1.00 0.00 C ATOM 1534 CG PHE A 101 1.639 -4.165 0.233 1.00 0.00 C ATOM 1535 CD1 PHE A 101 3.006 -4.437 0.161 1.00 0.00 C ATOM 1536 CD2 PHE A 101 1.068 -3.216 -0.616 1.00 0.00 C ATOM 1537 CE1 PHE A 101 3.797 -3.745 -0.718 1.00 0.00 C ATOM 1538 CE2 PHE A 101 1.857 -2.542 -1.509 1.00 0.00 C ATOM 1539 CZ PHE A 101 3.236 -2.788 -1.564 1.00 0.00 C ATOM 0 H PHE A 101 1.545 -2.497 2.479 1.00 0.00 H new ATOM 0 HA PHE A 101 0.288 -5.041 3.318 1.00 0.00 H new ATOM 0 HB2 PHE A 101 0.949 -5.969 1.125 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -0.269 -4.716 0.994 1.00 0.00 H new ATOM 0 HD1 PHE A 101 3.440 -5.193 0.798 1.00 0.00 H new ATOM 0 HD2 PHE A 101 0.008 -3.014 -0.569 1.00 0.00 H new ATOM 0 HE1 PHE A 101 4.858 -3.941 -0.756 1.00 0.00 H new ATOM 0 HE2 PHE A 101 1.414 -1.816 -2.175 1.00 0.00 H new ATOM 0 HZ PHE A 101 3.859 -2.241 -2.256 1.00 0.00 H new ATOM 1549 N VAL A 102 2.457 -6.250 3.504 1.00 0.00 N ATOM 1550 CA VAL A 102 3.692 -6.902 3.972 1.00 0.00 C ATOM 1551 C VAL A 102 4.294 -7.685 2.795 1.00 0.00 C ATOM 1552 O VAL A 102 3.728 -8.659 2.317 1.00 0.00 O ATOM 1553 CB VAL A 102 3.418 -7.814 5.184 1.00 0.00 C ATOM 1554 CG1 VAL A 102 4.720 -8.380 5.759 1.00 0.00 C ATOM 1555 CG2 VAL A 102 2.665 -7.086 6.302 1.00 0.00 C ATOM 0 H VAL A 102 1.658 -6.881 3.442 1.00 0.00 H new ATOM 0 HA VAL A 102 4.405 -6.150 4.311 1.00 0.00 H new ATOM 0 HB VAL A 102 2.793 -8.626 4.813 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.493 -9.019 6.612 1.00 0.00 H new ATOM 0 HG12 VAL A 102 5.232 -8.964 4.994 1.00 0.00 H new ATOM 0 HG13 VAL A 102 5.363 -7.560 6.080 1.00 0.00 H new ATOM 0 HG21 VAL A 102 2.496 -7.771 7.133 1.00 0.00 H new ATOM 0 HG22 VAL A 102 3.256 -6.237 6.646 1.00 0.00 H new ATOM 0 HG23 VAL A 102 1.706 -6.731 5.924 1.00 0.00 H new ATOM 1565 N ALA A 103 5.392 -7.146 2.282 1.00 0.00 N ATOM 1566 CA ALA A 103 6.128 -7.749 1.160 1.00 0.00 C ATOM 1567 C ALA A 103 7.303 -8.591 1.677 1.00 0.00 C ATOM 1568 O ALA A 103 8.236 -8.058 2.284 1.00 0.00 O ATOM 1569 CB ALA A 103 6.597 -6.638 0.215 1.00 0.00 C ATOM 0 H ALA A 103 5.804 -6.279 2.626 1.00 0.00 H new ATOM 0 HA ALA A 103 5.473 -8.422 0.606 1.00 0.00 H new ATOM 0 HB1 ALA A 103 7.144 -7.077 -0.620 1.00 0.00 H new ATOM 0 HB2 ALA A 103 5.732 -6.093 -0.164 1.00 0.00 H new ATOM 0 HB3 ALA A 103 7.249 -5.952 0.755 1.00 0.00 H new ATOM 1575 N ARG A 104 7.108 -9.902 1.599 1.00 0.00 N ATOM 1576 CA ARG A 104 8.099 -10.935 1.934 1.00 0.00 C ATOM 1577 C ARG A 104 8.465 -11.770 0.686 1.00 0.00 C ATOM 1578 O ARG A 104 7.936 -12.847 0.416 1.00 0.00 O ATOM 1579 CB ARG A 104 7.458 -11.767 3.046 1.00 0.00 C ATOM 1580 CG ARG A 104 8.457 -12.599 3.841 1.00 0.00 C ATOM 1581 CD ARG A 104 8.779 -13.967 3.227 1.00 0.00 C ATOM 1582 NE ARG A 104 8.751 -14.979 4.299 1.00 0.00 N ATOM 1583 CZ ARG A 104 9.503 -15.001 5.407 1.00 0.00 C ATOM 1584 NH1 ARG A 104 10.433 -14.083 5.642 1.00 0.00 N ATOM 1585 NH2 ARG A 104 9.306 -15.936 6.317 1.00 0.00 N ATOM 0 H ARG A 104 6.221 -10.298 1.288 1.00 0.00 H new ATOM 0 HA ARG A 104 9.045 -10.514 2.275 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.929 -11.101 3.728 1.00 0.00 H new ATOM 0 HB3 ARG A 104 6.713 -12.431 2.608 1.00 0.00 H new ATOM 0 HG2 ARG A 104 9.383 -12.033 3.941 1.00 0.00 H new ATOM 0 HG3 ARG A 104 8.065 -12.750 4.847 1.00 0.00 H new ATOM 0 HD2 ARG A 104 8.053 -14.215 2.453 1.00 0.00 H new ATOM 0 HD3 ARG A 104 9.759 -13.947 2.750 1.00 0.00 H new ATOM 0 HE ARG A 104 8.087 -15.745 4.184 1.00 0.00 H new ATOM 0 HH11 ARG A 104 10.591 -13.333 4.969 1.00 0.00 H new ATOM 0 HH12 ARG A 104 10.989 -14.128 6.496 1.00 0.00 H new ATOM 0 HH21 ARG A 104 8.582 -16.640 6.176 1.00 0.00 H new ATOM 0 HH22 ARG A 104 9.878 -15.954 7.161 1.00 0.00 H new ATOM 1599 N LYS A 105 9.454 -11.257 -0.039 1.00 0.00 N ATOM 1600 CA LYS A 105 9.991 -11.918 -1.246 1.00 0.00 C ATOM 1601 C LYS A 105 11.227 -12.693 -0.790 1.00 0.00 C ATOM 1602 O LYS A 105 12.015 -12.120 -0.041 1.00 0.00 O ATOM 1603 CB LYS A 105 10.317 -10.902 -2.364 1.00 0.00 C ATOM 1604 CG LYS A 105 11.534 -9.977 -2.182 1.00 0.00 C ATOM 1605 CD LYS A 105 12.830 -10.636 -2.678 1.00 0.00 C ATOM 1606 CE LYS A 105 13.293 -10.053 -4.012 1.00 0.00 C ATOM 1607 NZ LYS A 105 14.306 -10.916 -4.635 1.00 0.00 N ATOM 0 H LYS A 105 9.912 -10.373 0.185 1.00 0.00 H new ATOM 0 HA LYS A 105 9.254 -12.590 -1.686 1.00 0.00 H new ATOM 0 HB2 LYS A 105 10.460 -11.461 -3.289 1.00 0.00 H new ATOM 0 HB3 LYS A 105 9.439 -10.271 -2.506 1.00 0.00 H new ATOM 0 HG2 LYS A 105 11.368 -9.047 -2.725 1.00 0.00 H new ATOM 0 HG3 LYS A 105 11.639 -9.717 -1.129 1.00 0.00 H new ATOM 0 HD2 LYS A 105 13.613 -10.502 -1.932 1.00 0.00 H new ATOM 0 HD3 LYS A 105 12.673 -11.709 -2.786 1.00 0.00 H new ATOM 0 HE2 LYS A 105 12.440 -9.944 -4.682 1.00 0.00 H new ATOM 0 HE3 LYS A 105 13.705 -9.056 -3.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 14.267 -10.807 -5.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 15.250 -10.645 -4.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 14.119 -11.908 -4.385 1.00 0.00 H new ATOM 1621 N GLN A 106 11.199 -14.009 -1.011 1.00 0.00 N ATOM 1622 CA GLN A 106 12.308 -14.930 -0.665 1.00 0.00 C ATOM 1623 C GLN A 106 12.881 -14.627 0.725 1.00 0.00 C ATOM 1624 O GLN A 106 13.745 -13.760 0.858 1.00 0.00 O ATOM 1625 CB GLN A 106 13.430 -14.872 -1.710 1.00 0.00 C ATOM 1626 CG GLN A 106 13.054 -15.659 -2.964 1.00 0.00 C ATOM 1627 CD GLN A 106 13.899 -15.287 -4.184 1.00 0.00 C ATOM 1628 OE1 GLN A 106 14.471 -14.212 -4.325 1.00 0.00 O ATOM 1629 NE2 GLN A 106 13.899 -16.164 -5.160 1.00 0.00 N ATOM 0 H GLN A 106 10.402 -14.480 -1.439 1.00 0.00 H new ATOM 0 HA GLN A 106 11.889 -15.936 -0.655 1.00 0.00 H new ATOM 0 HB2 GLN A 106 13.631 -13.834 -1.975 1.00 0.00 H new ATOM 0 HB3 GLN A 106 14.349 -15.276 -1.285 1.00 0.00 H new ATOM 0 HG2 GLN A 106 13.166 -16.725 -2.764 1.00 0.00 H new ATOM 0 HG3 GLN A 106 12.002 -15.486 -3.192 1.00 0.00 H new ATOM 0 HE21 GLN A 106 13.423 -17.058 -5.042 1.00 0.00 H new ATOM 0 HE22 GLN A 106 14.375 -15.951 -6.037 1.00 0.00 H new ATOM 1638 N GLY A 107 12.285 -15.279 1.733 1.00 0.00 N ATOM 1639 CA GLY A 107 12.617 -15.053 3.156 1.00 0.00 C ATOM 1640 C GLY A 107 14.097 -15.344 3.422 1.00 0.00 C ATOM 1641 O GLY A 107 14.469 -16.456 3.782 1.00 0.00 O ATOM 0 H GLY A 107 11.558 -15.980 1.590 1.00 0.00 H new ATOM 0 HA2 GLY A 107 12.390 -14.022 3.428 1.00 0.00 H new ATOM 0 HA3 GLY A 107 11.997 -15.692 3.785 1.00 0.00 H new ATOM 1645 N SER A 108 14.901 -14.324 3.144 1.00 0.00 N ATOM 1646 CA SER A 108 16.369 -14.425 3.142 1.00 0.00 C ATOM 1647 C SER A 108 16.851 -14.477 4.592 1.00 0.00 C ATOM 1648 O SER A 108 17.180 -15.537 5.114 1.00 0.00 O ATOM 1649 CB SER A 108 16.964 -13.251 2.349 1.00 0.00 C ATOM 1650 OG SER A 108 18.340 -13.501 2.051 1.00 0.00 O ATOM 0 H SER A 108 14.557 -13.393 2.911 1.00 0.00 H new ATOM 0 HA SER A 108 16.706 -15.336 2.647 1.00 0.00 H new ATOM 0 HB2 SER A 108 16.405 -13.107 1.424 1.00 0.00 H new ATOM 0 HB3 SER A 108 16.871 -12.330 2.925 1.00 0.00 H new ATOM 0 HG SER A 108 18.707 -12.747 1.544 1.00 0.00 H new ATOM 1656 N THR A 109 16.647 -13.357 5.273 1.00 0.00 N ATOM 1657 CA THR A 109 17.004 -13.201 6.696 1.00 0.00 C ATOM 1658 C THR A 109 15.857 -12.562 7.486 1.00 0.00 C ATOM 1659 O THR A 109 16.038 -11.582 8.210 1.00 0.00 O ATOM 1660 CB THR A 109 18.269 -12.343 6.799 1.00 0.00 C ATOM 1661 OG1 THR A 109 18.069 -11.126 6.069 1.00 0.00 O ATOM 1662 CG2 THR A 109 19.507 -13.090 6.294 1.00 0.00 C ATOM 0 H THR A 109 16.228 -12.523 4.862 1.00 0.00 H new ATOM 0 HA THR A 109 17.190 -14.185 7.127 1.00 0.00 H new ATOM 0 HB THR A 109 18.451 -12.113 7.849 1.00 0.00 H new ATOM 0 HG1 THR A 109 18.874 -10.571 6.132 1.00 0.00 H new ATOM 0 HG21 THR A 109 20.382 -12.447 6.384 1.00 0.00 H new ATOM 0 HG22 THR A 109 19.656 -13.991 6.889 1.00 0.00 H new ATOM 0 HG23 THR A 109 19.365 -13.365 5.249 1.00 0.00 H new ATOM 1670 N THR A 110 14.642 -13.021 7.180 1.00 0.00 N ATOM 1671 CA THR A 110 13.405 -12.518 7.811 1.00 0.00 C ATOM 1672 C THR A 110 13.333 -10.977 7.666 1.00 0.00 C ATOM 1673 O THR A 110 13.608 -10.218 8.590 1.00 0.00 O ATOM 1674 CB THR A 110 13.289 -12.979 9.289 1.00 0.00 C ATOM 1675 OG1 THR A 110 14.254 -12.335 10.121 1.00 0.00 O ATOM 1676 CG2 THR A 110 13.457 -14.497 9.444 1.00 0.00 C ATOM 0 H THR A 110 14.480 -13.753 6.488 1.00 0.00 H new ATOM 0 HA THR A 110 12.546 -12.946 7.294 1.00 0.00 H new ATOM 0 HB THR A 110 12.284 -12.698 9.603 1.00 0.00 H new ATOM 0 HG1 THR A 110 14.623 -11.557 9.652 1.00 0.00 H new ATOM 0 HG21 THR A 110 13.367 -14.767 10.496 1.00 0.00 H new ATOM 0 HG22 THR A 110 12.684 -15.009 8.871 1.00 0.00 H new ATOM 0 HG23 THR A 110 14.439 -14.794 9.075 1.00 0.00 H new ATOM 1684 N ASP A 111 13.178 -10.517 6.428 1.00 0.00 N ATOM 1685 CA ASP A 111 13.114 -9.069 6.157 1.00 0.00 C ATOM 1686 C ASP A 111 11.947 -8.745 5.220 1.00 0.00 C ATOM 1687 O ASP A 111 11.924 -9.176 4.070 1.00 0.00 O ATOM 1688 CB ASP A 111 14.453 -8.587 5.578 1.00 0.00 C ATOM 1689 CG ASP A 111 14.730 -7.098 5.828 1.00 0.00 C ATOM 1690 OD1 ASP A 111 13.747 -6.337 6.002 1.00 0.00 O ATOM 1691 OD2 ASP A 111 15.927 -6.749 5.864 1.00 0.00 O ATOM 0 H ASP A 111 13.095 -11.109 5.602 1.00 0.00 H new ATOM 0 HA ASP A 111 12.936 -8.538 7.092 1.00 0.00 H new ATOM 0 HB2 ASP A 111 15.260 -9.176 6.013 1.00 0.00 H new ATOM 0 HB3 ASP A 111 14.464 -8.775 4.504 1.00 0.00 H new ATOM 1696 N ASN A 112 10.942 -8.105 5.801 1.00 0.00 N ATOM 1697 CA ASN A 112 9.765 -7.640 5.046 1.00 0.00 C ATOM 1698 C ASN A 112 9.780 -6.110 4.927 1.00 0.00 C ATOM 1699 O ASN A 112 10.276 -5.421 5.820 1.00 0.00 O ATOM 1700 CB ASN A 112 8.455 -8.118 5.702 1.00 0.00 C ATOM 1701 CG ASN A 112 7.992 -7.274 6.899 1.00 0.00 C ATOM 1702 OD1 ASN A 112 8.191 -7.588 8.061 1.00 0.00 O ATOM 1703 ND2 ASN A 112 7.400 -6.133 6.625 1.00 0.00 N ATOM 0 H ASN A 112 10.909 -7.890 6.798 1.00 0.00 H new ATOM 0 HA ASN A 112 9.813 -8.071 4.046 1.00 0.00 H new ATOM 0 HB2 ASN A 112 7.667 -8.119 4.949 1.00 0.00 H new ATOM 0 HB3 ASN A 112 8.584 -9.149 6.030 1.00 0.00 H new ATOM 0 HD21 ASN A 112 7.109 -5.515 7.382 1.00 0.00 H new ATOM 0 HD22 ASN A 112 7.231 -5.866 5.655 1.00 0.00 H new ATOM 1710 N VAL A 113 9.018 -5.632 3.951 1.00 0.00 N ATOM 1711 CA VAL A 113 8.738 -4.195 3.773 1.00 0.00 C ATOM 1712 C VAL A 113 7.223 -3.943 3.832 1.00 0.00 C ATOM 1713 O VAL A 113 6.456 -4.629 3.153 1.00 0.00 O ATOM 1714 CB VAL A 113 9.464 -3.733 2.491 1.00 0.00 C ATOM 1715 CG1 VAL A 113 8.644 -2.924 1.475 1.00 0.00 C ATOM 1716 CG2 VAL A 113 10.697 -2.929 2.908 1.00 0.00 C ATOM 0 H VAL A 113 8.570 -6.225 3.252 1.00 0.00 H new ATOM 0 HA VAL A 113 9.131 -3.579 4.582 1.00 0.00 H new ATOM 0 HB VAL A 113 9.705 -4.650 1.953 1.00 0.00 H new ATOM 0 HG11 VAL A 113 9.273 -2.664 0.624 1.00 0.00 H new ATOM 0 HG12 VAL A 113 7.799 -3.521 1.132 1.00 0.00 H new ATOM 0 HG13 VAL A 113 8.277 -2.012 1.947 1.00 0.00 H new ATOM 0 HG21 VAL A 113 11.228 -2.590 2.019 1.00 0.00 H new ATOM 0 HG22 VAL A 113 10.386 -2.065 3.496 1.00 0.00 H new ATOM 0 HG23 VAL A 113 11.356 -3.558 3.507 1.00 0.00 H new ATOM 1726 N CYS A 114 6.821 -3.077 4.753 1.00 0.00 N ATOM 1727 CA CYS A 114 5.417 -2.641 4.814 1.00 0.00 C ATOM 1728 C CYS A 114 5.300 -1.220 4.249 1.00 0.00 C ATOM 1729 O CYS A 114 5.832 -0.268 4.814 1.00 0.00 O ATOM 1730 CB CYS A 114 4.868 -2.733 6.236 1.00 0.00 C ATOM 1731 SG CYS A 114 3.078 -2.352 6.318 1.00 0.00 S ATOM 0 H CYS A 114 7.429 -2.664 5.460 1.00 0.00 H new ATOM 0 HA CYS A 114 4.810 -3.309 4.203 1.00 0.00 H new ATOM 0 HB2 CYS A 114 5.042 -3.736 6.626 1.00 0.00 H new ATOM 0 HB3 CYS A 114 5.414 -2.042 6.879 1.00 0.00 H new ATOM 0 HG CYS A 114 2.410 -3.449 6.520 1.00 0.00 H new ATOM 1737 N HIS A 115 4.917 -1.199 2.977 1.00 0.00 N ATOM 1738 CA HIS A 115 4.703 0.062 2.243 1.00 0.00 C ATOM 1739 C HIS A 115 3.360 0.657 2.667 1.00 0.00 C ATOM 1740 O HIS A 115 2.380 -0.073 2.770 1.00 0.00 O ATOM 1741 CB HIS A 115 4.653 -0.206 0.740 1.00 0.00 C ATOM 1742 CG HIS A 115 5.597 0.717 -0.047 1.00 0.00 C ATOM 1743 ND1 HIS A 115 6.658 0.292 -0.715 1.00 0.00 N ATOM 1744 CD2 HIS A 115 5.545 2.039 -0.131 1.00 0.00 C ATOM 1745 CE1 HIS A 115 7.288 1.369 -1.202 1.00 0.00 C ATOM 1746 NE2 HIS A 115 6.605 2.440 -0.832 1.00 0.00 N ATOM 0 H HIS A 115 4.746 -2.039 2.424 1.00 0.00 H new ATOM 0 HA HIS A 115 5.521 0.747 2.466 1.00 0.00 H new ATOM 0 HB2 HIS A 115 4.921 -1.245 0.549 1.00 0.00 H new ATOM 0 HB3 HIS A 115 3.633 -0.069 0.382 1.00 0.00 H new ATOM 0 HD2 HIS A 115 4.782 2.676 0.292 1.00 0.00 H new ATOM 0 HE1 HIS A 115 8.193 1.364 -1.792 1.00 0.00 H new ATOM 0 HE2 HIS A 115 6.848 3.407 -1.047 1.00 0.00 H new ATOM 1754 N LEU A 116 3.358 1.956 2.916 1.00 0.00 N ATOM 1755 CA LEU A 116 2.121 2.664 3.288 1.00 0.00 C ATOM 1756 C LEU A 116 1.576 3.468 2.114 1.00 0.00 C ATOM 1757 O LEU A 116 2.318 3.863 1.212 1.00 0.00 O ATOM 1758 CB LEU A 116 2.304 3.553 4.527 1.00 0.00 C ATOM 1759 CG LEU A 116 2.521 2.807 5.853 1.00 0.00 C ATOM 1760 CD1 LEU A 116 1.447 1.745 6.107 1.00 0.00 C ATOM 1761 CD2 LEU A 116 3.926 2.214 5.932 1.00 0.00 C ATOM 0 H LEU A 116 4.187 2.548 2.871 1.00 0.00 H new ATOM 0 HA LEU A 116 1.388 1.901 3.552 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.156 4.211 4.357 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.425 4.190 4.628 1.00 0.00 H new ATOM 0 HG LEU A 116 2.425 3.544 6.650 1.00 0.00 H new ATOM 0 HD11 LEU A 116 1.645 1.247 7.056 1.00 0.00 H new ATOM 0 HD12 LEU A 116 0.467 2.220 6.145 1.00 0.00 H new ATOM 0 HD13 LEU A 116 1.463 1.011 5.301 1.00 0.00 H new ATOM 0 HD21 LEU A 116 4.048 1.693 6.882 1.00 0.00 H new ATOM 0 HD22 LEU A 116 4.071 1.512 5.111 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.663 3.014 5.860 1.00 0.00 H new ATOM 1773 N PHE A 117 0.256 3.596 2.131 1.00 0.00 N ATOM 1774 CA PHE A 117 -0.509 4.284 1.081 1.00 0.00 C ATOM 1775 C PHE A 117 -1.777 4.926 1.644 1.00 0.00 C ATOM 1776 O PHE A 117 -2.496 4.308 2.419 1.00 0.00 O ATOM 1777 CB PHE A 117 -0.905 3.275 -0.001 1.00 0.00 C ATOM 1778 CG PHE A 117 0.298 2.687 -0.725 1.00 0.00 C ATOM 1779 CD1 PHE A 117 0.990 3.496 -1.622 1.00 0.00 C ATOM 1780 CD2 PHE A 117 0.734 1.384 -0.488 1.00 0.00 C ATOM 1781 CE1 PHE A 117 2.103 3.026 -2.278 1.00 0.00 C ATOM 1782 CE2 PHE A 117 1.852 0.915 -1.145 1.00 0.00 C ATOM 1783 CZ PHE A 117 2.548 1.731 -2.037 1.00 0.00 C ATOM 0 H PHE A 117 -0.327 3.223 2.880 1.00 0.00 H new ATOM 0 HA PHE A 117 0.121 5.069 0.663 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -1.480 2.468 0.453 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -1.557 3.763 -0.726 1.00 0.00 H new ATOM 0 HD1 PHE A 117 0.649 4.504 -1.805 1.00 0.00 H new ATOM 0 HD2 PHE A 117 0.201 0.748 0.204 1.00 0.00 H new ATOM 0 HE1 PHE A 117 2.629 3.659 -2.977 1.00 0.00 H new ATOM 0 HE2 PHE A 117 2.192 -0.094 -0.967 1.00 0.00 H new ATOM 0 HZ PHE A 117 3.429 1.358 -2.538 1.00 0.00 H new ATOM 1793 N ALA A 118 -2.064 6.141 1.206 1.00 0.00 N ATOM 1794 CA ALA A 118 -3.310 6.836 1.582 1.00 0.00 C ATOM 1795 C ALA A 118 -4.263 6.868 0.379 1.00 0.00 C ATOM 1796 O ALA A 118 -3.832 6.902 -0.768 1.00 0.00 O ATOM 1797 CB ALA A 118 -2.992 8.254 2.062 1.00 0.00 C ATOM 0 H ALA A 118 -1.456 6.678 0.587 1.00 0.00 H new ATOM 0 HA ALA A 118 -3.795 6.300 2.398 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -3.917 8.761 2.338 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -2.333 8.205 2.928 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -2.500 8.807 1.262 1.00 0.00 H new ATOM 1803 N GLU A 119 -5.552 6.661 0.618 1.00 0.00 N ATOM 1804 CA GLU A 119 -6.558 6.736 -0.466 1.00 0.00 C ATOM 1805 C GLU A 119 -6.436 8.059 -1.253 1.00 0.00 C ATOM 1806 O GLU A 119 -6.437 9.133 -0.661 1.00 0.00 O ATOM 1807 CB GLU A 119 -7.956 6.532 0.138 1.00 0.00 C ATOM 1808 CG GLU A 119 -9.135 6.733 -0.826 1.00 0.00 C ATOM 1809 CD GLU A 119 -9.589 8.197 -0.873 1.00 0.00 C ATOM 1810 OE1 GLU A 119 -10.331 8.576 0.056 1.00 0.00 O ATOM 1811 OE2 GLU A 119 -9.260 8.862 -1.879 1.00 0.00 O ATOM 0 H GLU A 119 -5.935 6.442 1.537 1.00 0.00 H new ATOM 0 HA GLU A 119 -6.379 5.942 -1.191 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.012 5.522 0.545 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.074 7.220 0.975 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.846 6.410 -1.826 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -9.969 6.104 -0.516 1.00 0.00 H new ATOM 1818 N LEU A 120 -6.296 7.926 -2.571 1.00 0.00 N ATOM 1819 CA LEU A 120 -6.251 9.083 -3.493 1.00 0.00 C ATOM 1820 C LEU A 120 -7.151 8.885 -4.728 1.00 0.00 C ATOM 1821 O LEU A 120 -6.856 9.278 -5.854 1.00 0.00 O ATOM 1822 CB LEU A 120 -4.785 9.372 -3.860 1.00 0.00 C ATOM 1823 CG LEU A 120 -4.376 10.857 -3.816 1.00 0.00 C ATOM 1824 CD1 LEU A 120 -5.093 11.706 -4.869 1.00 0.00 C ATOM 1825 CD2 LEU A 120 -4.570 11.463 -2.423 1.00 0.00 C ATOM 0 H LEU A 120 -6.210 7.023 -3.038 1.00 0.00 H new ATOM 0 HA LEU A 120 -6.661 9.958 -2.988 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -4.141 8.814 -3.180 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -4.597 8.990 -4.863 1.00 0.00 H new ATOM 0 HG LEU A 120 -3.313 10.874 -4.055 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -4.763 12.742 -4.788 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -4.858 11.327 -5.864 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -6.170 11.654 -4.707 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -4.270 12.511 -2.437 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -5.619 11.390 -2.137 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.959 10.920 -1.702 1.00 0.00 H new ATOM 1837 N ASP A 121 -8.299 8.274 -4.461 1.00 0.00 N ATOM 1838 CA ASP A 121 -9.336 7.994 -5.464 1.00 0.00 C ATOM 1839 C ASP A 121 -10.702 8.490 -4.969 1.00 0.00 C ATOM 1840 O ASP A 121 -11.256 7.874 -4.051 1.00 0.00 O ATOM 1841 CB ASP A 121 -9.414 6.499 -5.766 1.00 0.00 C ATOM 1842 CG ASP A 121 -8.388 6.010 -6.783 1.00 0.00 C ATOM 1843 OD1 ASP A 121 -8.191 6.723 -7.786 1.00 0.00 O ATOM 1844 OD2 ASP A 121 -7.932 4.862 -6.600 1.00 0.00 O ATOM 0 H ASP A 121 -8.546 7.951 -3.526 1.00 0.00 H new ATOM 0 HA ASP A 121 -9.069 8.522 -6.380 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -9.280 5.945 -4.837 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -10.413 6.266 -6.135 1.00 0.00 H new ATOM 1849 N PRO A 122 -11.234 9.554 -5.582 1.00 0.00 N ATOM 1850 CA PRO A 122 -12.568 10.099 -5.250 1.00 0.00 C ATOM 1851 C PRO A 122 -13.719 9.227 -5.795 1.00 0.00 C ATOM 1852 O PRO A 122 -14.603 9.685 -6.512 1.00 0.00 O ATOM 1853 CB PRO A 122 -12.531 11.520 -5.822 1.00 0.00 C ATOM 1854 CG PRO A 122 -11.636 11.387 -7.055 1.00 0.00 C ATOM 1855 CD PRO A 122 -10.575 10.376 -6.619 1.00 0.00 C ATOM 0 HA PRO A 122 -12.771 10.106 -4.179 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -13.528 11.872 -6.086 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -12.122 12.231 -5.104 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -12.196 11.033 -7.921 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -11.190 12.342 -7.332 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -10.245 9.763 -7.458 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -9.691 10.877 -6.223 1.00 0.00 H new ATOM 1863 N ASP A 123 -13.621 7.934 -5.477 1.00 0.00 N ATOM 1864 CA ASP A 123 -14.547 6.852 -5.881 1.00 0.00 C ATOM 1865 C ASP A 123 -14.109 5.471 -5.370 1.00 0.00 C ATOM 1866 O ASP A 123 -14.945 4.684 -4.938 1.00 0.00 O ATOM 1867 CB ASP A 123 -14.705 6.766 -7.405 1.00 0.00 C ATOM 1868 CG ASP A 123 -16.160 6.953 -7.849 1.00 0.00 C ATOM 1869 OD1 ASP A 123 -16.872 7.773 -7.226 1.00 0.00 O ATOM 1870 OD2 ASP A 123 -16.540 6.235 -8.799 1.00 0.00 O ATOM 0 H ASP A 123 -12.855 7.586 -4.900 1.00 0.00 H new ATOM 0 HA ASP A 123 -15.500 7.116 -5.424 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -14.083 7.527 -7.876 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -14.343 5.798 -7.752 1.00 0.00 H new ATOM 1875 N GLN A 124 -12.793 5.246 -5.342 1.00 0.00 N ATOM 1876 CA GLN A 124 -12.189 3.970 -4.916 1.00 0.00 C ATOM 1877 C GLN A 124 -11.503 4.129 -3.549 1.00 0.00 C ATOM 1878 O GLN A 124 -10.391 4.658 -3.463 1.00 0.00 O ATOM 1879 CB GLN A 124 -11.229 3.420 -5.983 1.00 0.00 C ATOM 1880 CG GLN A 124 -11.917 2.534 -7.032 1.00 0.00 C ATOM 1881 CD GLN A 124 -13.099 3.211 -7.731 1.00 0.00 C ATOM 1882 OE1 GLN A 124 -12.954 4.100 -8.558 1.00 0.00 O ATOM 1883 NE2 GLN A 124 -14.293 2.924 -7.267 1.00 0.00 N ATOM 0 H GLN A 124 -12.106 5.948 -5.616 1.00 0.00 H new ATOM 0 HA GLN A 124 -12.985 3.234 -4.803 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -10.743 4.255 -6.488 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -10.445 2.844 -5.492 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -11.184 2.239 -7.782 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -12.266 1.621 -6.550 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -14.407 2.181 -6.577 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -15.107 3.444 -7.596 1.00 0.00 H new ATOM 1892 N PRO A 125 -12.251 3.851 -2.473 1.00 0.00 N ATOM 1893 CA PRO A 125 -11.713 3.907 -1.104 1.00 0.00 C ATOM 1894 C PRO A 125 -10.669 2.809 -0.908 1.00 0.00 C ATOM 1895 O PRO A 125 -10.679 1.786 -1.595 1.00 0.00 O ATOM 1896 CB PRO A 125 -12.929 3.745 -0.190 1.00 0.00 C ATOM 1897 CG PRO A 125 -13.922 2.939 -1.025 1.00 0.00 C ATOM 1898 CD PRO A 125 -13.664 3.419 -2.453 1.00 0.00 C ATOM 0 HA PRO A 125 -11.197 4.841 -0.883 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -12.668 3.224 0.731 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -13.343 4.712 0.097 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -13.752 1.867 -0.926 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -14.951 3.128 -0.718 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -13.841 2.621 -3.174 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -14.330 4.241 -2.718 1.00 0.00 H new ATOM 1906 N ALA A 126 -9.823 3.001 0.095 1.00 0.00 N ATOM 1907 CA ALA A 126 -8.752 2.029 0.377 1.00 0.00 C ATOM 1908 C ALA A 126 -9.297 0.653 0.790 1.00 0.00 C ATOM 1909 O ALA A 126 -8.819 -0.342 0.270 1.00 0.00 O ATOM 1910 CB ALA A 126 -7.743 2.584 1.377 1.00 0.00 C ATOM 0 H ALA A 126 -9.848 3.804 0.723 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.216 1.866 -0.558 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.967 1.841 1.562 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -7.290 3.489 0.972 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -8.250 2.820 2.313 1.00 0.00 H new ATOM 1916 N ALA A 127 -10.446 0.624 1.476 1.00 0.00 N ATOM 1917 CA ALA A 127 -11.218 -0.617 1.696 1.00 0.00 C ATOM 1918 C ALA A 127 -11.591 -1.340 0.390 1.00 0.00 C ATOM 1919 O ALA A 127 -11.229 -2.493 0.250 1.00 0.00 O ATOM 1920 CB ALA A 127 -12.474 -0.333 2.522 1.00 0.00 C ATOM 0 H ALA A 127 -10.870 1.452 1.894 1.00 0.00 H new ATOM 0 HA ALA A 127 -10.563 -1.289 2.250 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -13.028 -1.260 2.672 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -12.188 0.080 3.489 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -13.103 0.384 1.994 1.00 0.00 H new ATOM 1926 N ALA A 128 -11.992 -0.603 -0.650 1.00 0.00 N ATOM 1927 CA ALA A 128 -12.243 -1.182 -1.993 1.00 0.00 C ATOM 1928 C ALA A 128 -10.968 -1.705 -2.686 1.00 0.00 C ATOM 1929 O ALA A 128 -11.005 -2.720 -3.382 1.00 0.00 O ATOM 1930 CB ALA A 128 -12.951 -0.171 -2.897 1.00 0.00 C ATOM 0 H ALA A 128 -12.153 0.403 -0.597 1.00 0.00 H new ATOM 0 HA ALA A 128 -12.889 -2.045 -1.829 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -13.125 -0.617 -3.876 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.906 0.109 -2.452 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -12.328 0.716 -3.008 1.00 0.00 H new ATOM 1936 N ILE A 129 -9.832 -1.112 -2.327 1.00 0.00 N ATOM 1937 CA ILE A 129 -8.482 -1.514 -2.782 1.00 0.00 C ATOM 1938 C ILE A 129 -7.923 -2.698 -1.967 1.00 0.00 C ATOM 1939 O ILE A 129 -7.222 -3.540 -2.515 1.00 0.00 O ATOM 1940 CB ILE A 129 -7.584 -0.253 -2.828 1.00 0.00 C ATOM 1941 CG1 ILE A 129 -7.962 0.636 -4.028 1.00 0.00 C ATOM 1942 CG2 ILE A 129 -6.066 -0.501 -2.762 1.00 0.00 C ATOM 1943 CD1 ILE A 129 -7.807 -0.034 -5.402 1.00 0.00 C ATOM 0 H ILE A 129 -9.813 -0.313 -1.693 1.00 0.00 H new ATOM 0 HA ILE A 129 -8.520 -1.914 -3.795 1.00 0.00 H new ATOM 0 HB ILE A 129 -7.796 0.272 -1.897 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -8.997 0.958 -3.911 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -7.344 1.534 -4.006 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -5.539 0.453 -2.802 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -5.821 -1.012 -1.831 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -5.761 -1.119 -3.606 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -8.096 0.668 -6.184 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -6.768 -0.331 -5.547 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -8.447 -0.915 -5.451 1.00 0.00 H new ATOM 1955 N VAL A 130 -8.360 -2.814 -0.719 1.00 0.00 N ATOM 1956 CA VAL A 130 -7.999 -3.888 0.226 1.00 0.00 C ATOM 1957 C VAL A 130 -8.975 -5.083 0.166 1.00 0.00 C ATOM 1958 O VAL A 130 -8.638 -6.199 0.548 1.00 0.00 O ATOM 1959 CB VAL A 130 -7.837 -3.235 1.612 1.00 0.00 C ATOM 1960 CG1 VAL A 130 -7.921 -4.216 2.783 1.00 0.00 C ATOM 1961 CG2 VAL A 130 -6.480 -2.522 1.666 1.00 0.00 C ATOM 0 H VAL A 130 -9.005 -2.137 -0.311 1.00 0.00 H new ATOM 0 HA VAL A 130 -7.051 -4.352 -0.045 1.00 0.00 H new ATOM 0 HB VAL A 130 -8.672 -2.544 1.726 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.797 -3.675 3.721 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -8.893 -4.710 2.775 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -7.133 -4.963 2.689 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -6.353 -2.055 2.643 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -5.682 -3.246 1.503 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.440 -1.757 0.890 1.00 0.00 H new ATOM 1971 N ASN A 131 -10.155 -4.835 -0.381 1.00 0.00 N ATOM 1972 CA ASN A 131 -11.201 -5.849 -0.564 1.00 0.00 C ATOM 1973 C ASN A 131 -10.959 -6.609 -1.870 1.00 0.00 C ATOM 1974 O ASN A 131 -11.157 -7.813 -1.928 1.00 0.00 O ATOM 1975 CB ASN A 131 -12.575 -5.180 -0.592 1.00 0.00 C ATOM 1976 CG ASN A 131 -13.675 -6.201 -0.313 1.00 0.00 C ATOM 1977 OD1 ASN A 131 -13.588 -7.043 0.570 1.00 0.00 O ATOM 1978 ND2 ASN A 131 -14.770 -6.097 -1.026 1.00 0.00 N ATOM 0 H ASN A 131 -10.424 -3.911 -0.718 1.00 0.00 H new ATOM 0 HA ASN A 131 -11.169 -6.552 0.268 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -12.613 -4.384 0.152 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -12.740 -4.716 -1.564 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -15.557 -6.721 -0.846 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -14.835 -5.392 -1.761 1.00 0.00 H new ATOM 1985 N PHE A 132 -10.443 -5.889 -2.864 1.00 0.00 N ATOM 1986 CA PHE A 132 -10.019 -6.465 -4.142 1.00 0.00 C ATOM 1987 C PHE A 132 -8.637 -7.124 -4.055 1.00 0.00 C ATOM 1988 O PHE A 132 -8.509 -8.282 -4.428 1.00 0.00 O ATOM 1989 CB PHE A 132 -10.067 -5.369 -5.213 1.00 0.00 C ATOM 1990 CG PHE A 132 -9.340 -5.716 -6.506 1.00 0.00 C ATOM 1991 CD1 PHE A 132 -9.283 -7.011 -7.028 1.00 0.00 C ATOM 1992 CD2 PHE A 132 -8.582 -4.709 -7.102 1.00 0.00 C ATOM 1993 CE1 PHE A 132 -8.479 -7.294 -8.108 1.00 0.00 C ATOM 1994 CE2 PHE A 132 -7.802 -4.991 -8.194 1.00 0.00 C ATOM 1995 CZ PHE A 132 -7.722 -6.288 -8.704 1.00 0.00 C ATOM 0 H PHE A 132 -10.305 -4.880 -2.806 1.00 0.00 H new ATOM 0 HA PHE A 132 -10.705 -7.267 -4.415 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -11.109 -5.151 -5.445 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -9.634 -4.457 -4.801 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -9.875 -7.796 -6.580 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -8.609 -3.706 -6.703 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -8.435 -8.301 -8.496 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -7.241 -4.198 -8.666 1.00 0.00 H new ATOM 0 HZ PHE A 132 -7.084 -6.508 -9.547 1.00 0.00 H new ATOM 2005 N VAL A 133 -7.646 -6.443 -3.482 1.00 0.00 N ATOM 2006 CA VAL A 133 -6.277 -7.000 -3.394 1.00 0.00 C ATOM 2007 C VAL A 133 -6.238 -8.324 -2.593 1.00 0.00 C ATOM 2008 O VAL A 133 -5.478 -9.231 -2.917 1.00 0.00 O ATOM 2009 CB VAL A 133 -5.321 -5.918 -2.864 1.00 0.00 C ATOM 2010 CG1 VAL A 133 -5.421 -5.708 -1.350 1.00 0.00 C ATOM 2011 CG2 VAL A 133 -3.886 -6.154 -3.340 1.00 0.00 C ATOM 0 H VAL A 133 -7.752 -5.515 -3.073 1.00 0.00 H new ATOM 0 HA VAL A 133 -5.932 -7.278 -4.390 1.00 0.00 H new ATOM 0 HB VAL A 133 -5.650 -4.974 -3.300 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -4.720 -4.932 -1.043 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -6.435 -5.404 -1.091 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -5.179 -6.639 -0.837 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -3.239 -5.370 -2.946 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.539 -7.124 -2.984 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.856 -6.136 -4.429 1.00 0.00 H new ATOM 2021 N SER A 134 -7.148 -8.416 -1.623 1.00 0.00 N ATOM 2022 CA SER A 134 -7.362 -9.616 -0.793 1.00 0.00 C ATOM 2023 C SER A 134 -8.297 -10.645 -1.452 1.00 0.00 C ATOM 2024 O SER A 134 -8.117 -11.848 -1.289 1.00 0.00 O ATOM 2025 CB SER A 134 -7.908 -9.204 0.574 1.00 0.00 C ATOM 2026 OG SER A 134 -7.181 -9.887 1.595 1.00 0.00 O ATOM 0 H SER A 134 -7.773 -7.646 -1.382 1.00 0.00 H new ATOM 0 HA SER A 134 -6.395 -10.105 -0.679 1.00 0.00 H new ATOM 0 HB2 SER A 134 -7.817 -8.126 0.705 1.00 0.00 H new ATOM 0 HB3 SER A 134 -8.969 -9.445 0.643 1.00 0.00 H new ATOM 0 HG SER A 134 -7.526 -9.625 2.474 1.00 0.00 H new ATOM 2032 N ARG A 135 -9.207 -10.174 -2.307 1.00 0.00 N ATOM 2033 CA ARG A 135 -10.104 -11.045 -3.096 1.00 0.00 C ATOM 2034 C ARG A 135 -9.394 -11.676 -4.308 1.00 0.00 C ATOM 2035 O ARG A 135 -9.684 -12.812 -4.685 1.00 0.00 O ATOM 2036 CB ARG A 135 -11.347 -10.262 -3.539 1.00 0.00 C ATOM 2037 CG ARG A 135 -12.301 -11.136 -4.348 1.00 0.00 C ATOM 2038 CD ARG A 135 -13.758 -10.831 -4.045 1.00 0.00 C ATOM 2039 NE ARG A 135 -14.489 -12.069 -4.351 1.00 0.00 N ATOM 2040 CZ ARG A 135 -15.793 -12.274 -4.177 1.00 0.00 C ATOM 2041 NH1 ARG A 135 -16.580 -11.315 -3.711 1.00 0.00 N ATOM 2042 NH2 ARG A 135 -16.325 -13.452 -4.458 1.00 0.00 N ATOM 0 H ARG A 135 -9.349 -9.178 -2.478 1.00 0.00 H new ATOM 0 HA ARG A 135 -10.411 -11.867 -2.450 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -11.864 -9.872 -2.662 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -11.043 -9.403 -4.137 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -12.114 -10.986 -5.411 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -12.099 -12.185 -4.133 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -13.890 -10.544 -3.002 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -14.120 -10.001 -4.652 1.00 0.00 H new ATOM 0 HE ARG A 135 -13.946 -12.844 -4.732 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -16.189 -10.402 -3.479 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -17.577 -11.490 -3.584 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -15.736 -14.207 -4.809 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -17.324 -13.605 -4.323 1.00 0.00 H new ATOM 2056 N VAL A 136 -8.473 -10.919 -4.896 1.00 0.00 N ATOM 2057 CA VAL A 136 -7.685 -11.342 -6.071 1.00 0.00 C ATOM 2058 C VAL A 136 -6.708 -12.474 -5.709 1.00 0.00 C ATOM 2059 O VAL A 136 -6.452 -13.361 -6.517 1.00 0.00 O ATOM 2060 CB VAL A 136 -6.999 -10.138 -6.754 1.00 0.00 C ATOM 2061 CG1 VAL A 136 -5.751 -9.594 -6.046 1.00 0.00 C ATOM 2062 CG2 VAL A 136 -6.696 -10.462 -8.218 1.00 0.00 C ATOM 0 H VAL A 136 -8.242 -9.980 -4.573 1.00 0.00 H new ATOM 0 HA VAL A 136 -8.370 -11.756 -6.811 1.00 0.00 H new ATOM 0 HB VAL A 136 -7.723 -9.326 -6.686 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -5.351 -8.752 -6.610 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -6.017 -9.264 -5.042 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -4.997 -10.379 -5.983 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -6.213 -9.605 -8.688 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -6.033 -11.326 -8.270 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -7.626 -10.686 -8.741 1.00 0.00 H new ATOM 2072 N MET A 137 -6.322 -12.491 -4.435 1.00 0.00 N ATOM 2073 CA MET A 137 -5.368 -13.471 -3.890 1.00 0.00 C ATOM 2074 C MET A 137 -6.091 -14.631 -3.183 1.00 0.00 C ATOM 2075 O MET A 137 -5.595 -15.187 -2.204 1.00 0.00 O ATOM 2076 CB MET A 137 -4.386 -12.725 -2.972 1.00 0.00 C ATOM 2077 CG MET A 137 -4.980 -12.185 -1.668 1.00 0.00 C ATOM 2078 SD MET A 137 -4.270 -12.988 -0.187 1.00 0.00 S ATOM 2079 CE MET A 137 -3.129 -11.712 0.303 1.00 0.00 C ATOM 0 H MET A 137 -6.661 -11.823 -3.742 1.00 0.00 H new ATOM 0 HA MET A 137 -4.804 -13.938 -4.698 1.00 0.00 H new ATOM 0 HB2 MET A 137 -3.565 -13.398 -2.725 1.00 0.00 H new ATOM 0 HB3 MET A 137 -3.958 -11.891 -3.528 1.00 0.00 H new ATOM 0 HG2 MET A 137 -4.807 -11.110 -1.612 1.00 0.00 H new ATOM 0 HG3 MET A 137 -6.060 -12.334 -1.675 1.00 0.00 H new ATOM 0 HE1 MET A 137 -2.211 -12.168 0.673 1.00 0.00 H new ATOM 0 HE2 MET A 137 -2.900 -11.080 -0.555 1.00 0.00 H new ATOM 0 HE3 MET A 137 -3.577 -11.106 1.091 1.00 0.00 H new ATOM 2089 N LEU A 138 -7.237 -15.029 -3.749 1.00 0.00 N ATOM 2090 CA LEU A 138 -8.126 -16.059 -3.176 1.00 0.00 C ATOM 2091 C LEU A 138 -8.524 -15.703 -1.730 1.00 0.00 C ATOM 2092 O LEU A 138 -7.925 -16.142 -0.748 1.00 0.00 O ATOM 2093 CB LEU A 138 -7.441 -17.433 -3.257 1.00 0.00 C ATOM 2094 CG LEU A 138 -8.181 -18.444 -4.133 1.00 0.00 C ATOM 2095 CD1 LEU A 138 -7.231 -19.595 -4.465 1.00 0.00 C ATOM 2096 CD2 LEU A 138 -9.409 -18.996 -3.404 1.00 0.00 C ATOM 0 H LEU A 138 -7.581 -14.643 -4.628 1.00 0.00 H new ATOM 0 HA LEU A 138 -9.048 -16.100 -3.756 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -6.431 -17.302 -3.645 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -7.346 -17.840 -2.250 1.00 0.00 H new ATOM 0 HG LEU A 138 -8.514 -17.948 -5.045 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -7.747 -20.324 -5.090 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -6.363 -19.208 -5.000 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -6.904 -20.075 -3.542 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -9.921 -19.714 -4.045 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -9.095 -19.490 -2.485 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -10.087 -18.177 -3.162 1.00 0.00 H new ATOM 2108 N GLY A 139 -9.578 -14.886 -1.656 1.00 0.00 N ATOM 2109 CA GLY A 139 -10.092 -14.363 -0.379 1.00 0.00 C ATOM 2110 C GLY A 139 -11.580 -14.683 -0.220 1.00 0.00 C ATOM 2111 O GLY A 139 -12.208 -15.296 -1.084 1.00 0.00 O ATOM 0 H GLY A 139 -10.100 -14.567 -2.473 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -9.532 -14.797 0.449 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -9.941 -13.284 -0.335 1.00 0.00 H new ATOM 2115 N SER A 140 -12.101 -14.267 0.925 1.00 0.00 N ATOM 2116 CA SER A 140 -13.537 -14.392 1.243 1.00 0.00 C ATOM 2117 C SER A 140 -14.117 -13.029 1.651 1.00 0.00 C ATOM 2118 O SER A 140 -13.387 -12.117 2.041 1.00 0.00 O ATOM 2119 CB SER A 140 -13.740 -15.432 2.351 1.00 0.00 C ATOM 2120 OG SER A 140 -15.136 -15.698 2.533 1.00 0.00 O ATOM 0 H SER A 140 -11.551 -13.833 1.666 1.00 0.00 H new ATOM 0 HA SER A 140 -14.070 -14.730 0.354 1.00 0.00 H new ATOM 0 HB2 SER A 140 -13.218 -16.354 2.094 1.00 0.00 H new ATOM 0 HB3 SER A 140 -13.307 -15.069 3.283 1.00 0.00 H new ATOM 0 HG SER A 140 -15.252 -16.365 3.242 1.00 0.00 H new ATOM 2126 N GLY A 141 -15.452 -12.974 1.649 1.00 0.00 N ATOM 2127 CA GLY A 141 -16.212 -11.766 2.009 1.00 0.00 C ATOM 2128 C GLY A 141 -16.995 -12.046 3.293 1.00 0.00 C ATOM 2129 O GLY A 141 -18.055 -12.665 3.245 1.00 0.00 O ATOM 0 H GLY A 141 -16.041 -13.767 1.397 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -15.536 -10.923 2.154 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -16.893 -11.493 1.203 1.00 0.00 H new ATOM 2133 N GLN A 142 -16.397 -11.660 4.423 1.00 0.00 N ATOM 2134 CA GLN A 142 -16.992 -11.820 5.773 1.00 0.00 C ATOM 2135 C GLN A 142 -18.492 -11.453 5.821 1.00 0.00 C ATOM 2136 O GLN A 142 -19.302 -12.181 6.388 1.00 0.00 O ATOM 2137 CB GLN A 142 -16.214 -10.942 6.757 1.00 0.00 C ATOM 2138 CG GLN A 142 -16.085 -11.603 8.132 1.00 0.00 C ATOM 2139 CD GLN A 142 -14.611 -11.814 8.487 1.00 0.00 C ATOM 2140 OE1 GLN A 142 -13.794 -10.901 8.505 1.00 0.00 O ATOM 2141 NE2 GLN A 142 -14.233 -13.038 8.776 1.00 0.00 N ATOM 0 H GLN A 142 -15.476 -11.222 4.438 1.00 0.00 H new ATOM 0 HA GLN A 142 -16.921 -12.873 6.044 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -15.221 -10.740 6.356 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -16.717 -9.981 6.862 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -16.562 -10.980 8.888 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -16.606 -12.560 8.133 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -14.913 -13.799 8.761 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -13.260 -13.228 9.015 1.00 0.00 H new ATOM 2150 N LYS A 143 -18.833 -10.392 5.091 1.00 0.00 N ATOM 2151 CA LYS A 143 -20.216 -9.943 4.850 1.00 0.00 C ATOM 2152 C LYS A 143 -20.629 -10.281 3.407 1.00 0.00 C ATOM 2153 O LYS A 143 -20.067 -9.751 2.452 1.00 0.00 O ATOM 2154 CB LYS A 143 -20.343 -8.434 5.123 1.00 0.00 C ATOM 2155 CG LYS A 143 -19.358 -7.557 4.329 1.00 0.00 C ATOM 2156 CD LYS A 143 -19.513 -6.065 4.624 1.00 0.00 C ATOM 2157 CE LYS A 143 -20.777 -5.465 4.002 1.00 0.00 C ATOM 2158 NZ LYS A 143 -21.437 -4.605 4.992 1.00 0.00 N ATOM 0 H LYS A 143 -18.139 -9.800 4.635 1.00 0.00 H new ATOM 0 HA LYS A 143 -20.887 -10.465 5.532 1.00 0.00 H new ATOM 0 HB2 LYS A 143 -21.360 -8.120 4.889 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -20.191 -8.256 6.188 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -18.338 -7.864 4.562 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -19.506 -7.728 3.263 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -19.538 -5.913 5.703 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -18.640 -5.532 4.247 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -20.521 -4.888 3.113 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -21.453 -6.259 3.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -22.297 -4.194 4.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -21.692 -5.170 5.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -20.790 -3.841 5.275 1.00 0.00 H new ATOM 2172 N ARG A 144 -21.493 -11.286 3.275 1.00 0.00 N ATOM 2173 CA ARG A 144 -22.023 -11.755 1.968 1.00 0.00 C ATOM 2174 C ARG A 144 -20.955 -12.283 0.985 1.00 0.00 C ATOM 2175 O ARG A 144 -20.999 -13.508 0.739 1.00 0.00 O ATOM 2176 CB ARG A 144 -22.910 -10.701 1.280 1.00 0.00 C ATOM 2177 CG ARG A 144 -24.139 -10.343 2.118 1.00 0.00 C ATOM 2178 CD ARG A 144 -25.191 -9.594 1.292 1.00 0.00 C ATOM 2179 NE ARG A 144 -26.449 -9.450 2.052 1.00 0.00 N ATOM 2180 CZ ARG A 144 -27.268 -10.430 2.461 1.00 0.00 C ATOM 2181 NH1 ARG A 144 -27.036 -11.708 2.189 1.00 0.00 N ATOM 2182 NH2 ARG A 144 -28.359 -10.137 3.151 1.00 0.00 N ATOM 2183 OXT ARG A 144 -20.191 -11.471 0.416 1.00 99.99 O ATOM 0 H ARG A 144 -21.856 -11.811 4.071 1.00 0.00 H new ATOM 0 HA ARG A 144 -22.639 -12.614 2.234 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -22.324 -9.801 1.095 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -23.232 -11.077 0.309 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -24.578 -11.253 2.527 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -23.835 -9.727 2.965 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -24.812 -8.610 1.018 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -25.381 -10.132 0.363 1.00 0.00 H new ATOM 0 HE ARG A 144 -26.726 -8.498 2.293 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -26.211 -11.973 1.651 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -27.683 -12.425 2.518 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -28.577 -9.165 3.372 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -28.982 -10.883 3.462 1.00 0.00 H new TER 2197 ARG A 144