USER MOD reduce.3.24.130724 H: found=0, std=0, add=1187, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1185 hydrogens (30 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: C 48 GLN : amide:sc= 0.49 K(o=1.9,f=-5.9!) USER MOD Set 1.2: C 53 LYS NZ :NH3+ -164:sc= 1.46 (180deg=0.249) USER MOD Set 2.1: B 1 FME CE :methyl -148:sc= -0.435 (180deg=0) USER MOD Set 2.2: C 42 THR OG1 : rot 68:sc= 0.566 USER MOD Set 3.1: B 48 GLN : amide:sc= 0.63 K(o=2.1,f=-6.1!) USER MOD Set 3.2: B 53 LYS NZ :NH3+ -154:sc= 1.45 (180deg=0.0316) USER MOD Set 4.1: B 32 LYS NZ :NH3+ 172:sc= 1.29 (180deg=1.2) USER MOD Set 4.2: C 50 HIS : +bothHN:sc= -3.14! C(o=-1.8!,f=-6.4!) USER MOD Set 5.1: B 15 CYS SG : rot 105:sc= -3.83! USER MOD Set 5.2: B 29 CYS SG : rot -38:sc= -3.66! USER MOD Set 6.1: A 50 HIS : +bothHN:sc= -2.5! C(o=-1.3!,f=-5.8!) USER MOD Set 6.2: C 32 LYS NZ :NH3+ 172:sc= 1.22 (180deg=1.08) USER MOD Set 7.1: A 48 GLN : amide:sc= 0.551 K(o=2.3,f=-5.7!) USER MOD Set 7.2: A 53 LYS NZ :NH3+ -154:sc= 1.77 (180deg=0.163) USER MOD Set 8.1: A 42 THR OG1 : rot 71:sc= 0.634 USER MOD Set 8.2: C 1 FME CE :methyl -149:sc= -0.317 (180deg=0) USER MOD Set 9.1: A 32 LYS NZ :NH3+ 174:sc= 1.25 (180deg=1.21) USER MOD Set 9.2: B 50 HIS : +bothHN:sc= -2.42! C(o=-1.2!,f=-5.3!) USER MOD Set10.1: A 1 FME CE :methyl -151:sc= -0.287 (180deg=0) USER MOD Set10.2: B 42 THR OG1 : rot 70:sc= 0.716 USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.259 USER MOD Single : A 14 LYS NZ :NH3+ -136:sc= 0.429 (180deg=-0.114) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot -55:sc= 0.00702 USER MOD Single : A 37 THR OG1 : rot -165:sc= -0.367 USER MOD Single : A 39 GLN : amide:sc= -0.194 K(o=-0.19,f=-0.94) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -172:sc= 1.3 (180deg=1.11) USER MOD Single : A 52 ASN : amide:sc= -0.62 X(o=-0.62,f=-0.75) USER MOD Single : B 5 THR OG1 : rot 180:sc= -0.714 USER MOD Single : B 14 LYS NZ :NH3+ -133:sc= 0.305 (180deg=-0.106) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0 USER MOD Single : B 30 SER OG : rot -57:sc= 0.0085 USER MOD Single : B 37 THR OG1 : rot -166:sc= -0.452 USER MOD Single : B 39 GLN : amide:sc= -0.319 K(o=-0.32,f=-1.1) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 49 LYS NZ :NH3+ 168:sc= 1.29 (180deg=1.14) USER MOD Single : B 52 ASN : amide:sc= -0.609 X(o=-0.61,f=-0.86) USER MOD Single : C 5 THR OG1 : rot 180:sc= -0.345 USER MOD Single : C 14 LYS NZ :NH3+ -140:sc= 0.634 (180deg=-0.0923) USER MOD Single : C 24 THR OG1 : rot 180:sc= 0 USER MOD Single : C 30 SER OG : rot -59:sc= 0.0337 USER MOD Single : C 37 THR OG1 : rot -162:sc= -0.558 USER MOD Single : C 39 GLN : amide:sc= -0.378 K(o=-0.38,f=-1.1) USER MOD Single : C 41 TYR OH : rot 180:sc= 0 USER MOD Single : C 49 LYS NZ :NH3+ -174:sc= 1.32 (180deg=1.23) USER MOD Single : C 52 ASN : amide:sc= -0.821 X(o=-0.82,f=-1) USER MOD ----------------------------------------------------------------- HETATM 1 N FME A 1 1.921 -11.195 13.301 1.00 0.00 N HETATM 2 CN FME A 1 3.142 -10.759 13.040 1.00 0.00 C HETATM 3 O1 FME A 1 4.136 -11.211 13.610 1.00 0.00 O HETATM 4 CA FME A 1 0.769 -10.676 12.580 1.00 0.00 C HETATM 5 CB FME A 1 -0.024 -11.829 11.961 1.00 0.00 C HETATM 6 CG FME A 1 -1.016 -11.395 10.893 1.00 0.00 C HETATM 7 SD FME A 1 -1.811 -12.798 10.081 1.00 0.00 S HETATM 8 CE FME A 1 -2.663 -11.972 8.740 1.00 0.00 C HETATM 9 C FME A 1 -0.121 -9.868 13.517 1.00 0.00 C HETATM 10 O FME A 1 -0.913 -10.429 14.271 1.00 0.00 O HETATM 0 HG3 FME A 1 -1.778 -10.761 11.345 1.00 0.00 H new HETATM 0 HG2 FME A 1 -0.501 -10.791 10.146 1.00 0.00 H new HETATM 0 HE3 FME A 1 -3.558 -12.536 8.475 1.00 0.00 H new HETATM 0 HE2 FME A 1 -2.947 -10.967 9.053 1.00 0.00 H new HETATM 0 HE1 FME A 1 -2.004 -11.909 7.874 1.00 0.00 H new HETATM 0 HCN FME A 1 3.273 -9.974 12.296 1.00 0.00 H new HETATM 0 HB3 FME A 1 0.674 -12.543 11.525 1.00 0.00 H new HETATM 0 HB2 FME A 1 -0.563 -12.352 12.752 1.00 0.00 H new HETATM 0 HA FME A 1 1.120 -10.021 11.783 1.00 0.00 H new HETATM 0 H FME A 1 1.785 -11.906 14.019 1.00 0.00 H new ATOM 21 N VAL A 2 0.007 -8.553 13.460 1.00 0.00 N ATOM 22 CA VAL A 2 -0.749 -7.676 14.345 1.00 0.00 C ATOM 23 C VAL A 2 -1.888 -7.006 13.573 1.00 0.00 C ATOM 24 O VAL A 2 -2.659 -6.215 14.118 1.00 0.00 O ATOM 25 CB VAL A 2 0.173 -6.605 14.979 1.00 0.00 C ATOM 26 CG1 VAL A 2 0.651 -5.604 13.935 1.00 0.00 C ATOM 27 CG2 VAL A 2 -0.513 -5.897 16.140 1.00 0.00 C ATOM 0 H VAL A 2 0.626 -8.067 12.811 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.172 -8.279 15.148 1.00 0.00 H new ATOM 0 HB VAL A 2 1.048 -7.120 15.376 1.00 0.00 H new ATOM 0 HG11 VAL A 2 1.296 -4.864 14.409 1.00 0.00 H new ATOM 0 HG12 VAL A 2 1.208 -6.127 13.158 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -0.209 -5.103 13.490 1.00 0.00 H new ATOM 0 HG21 VAL A 2 0.162 -5.152 16.562 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.418 -5.406 15.783 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -0.774 -6.626 16.907 1.00 0.00 H new ATOM 37 N ILE A 3 -2.003 -7.355 12.302 1.00 0.00 N ATOM 38 CA ILE A 3 -3.035 -6.791 11.452 1.00 0.00 C ATOM 39 C ILE A 3 -3.699 -7.890 10.629 1.00 0.00 C ATOM 40 O ILE A 3 -3.029 -8.790 10.123 1.00 0.00 O ATOM 41 CB ILE A 3 -2.459 -5.703 10.515 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.582 -5.017 9.733 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.428 -6.301 9.563 1.00 0.00 C ATOM 44 CD1 ILE A 3 -3.109 -3.860 8.879 1.00 0.00 C ATOM 0 H ILE A 3 -1.393 -8.027 11.837 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.781 -6.324 12.096 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.960 -4.953 11.129 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -4.070 -5.753 9.094 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -4.334 -4.656 10.435 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.036 -5.519 8.913 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.612 -6.738 10.138 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.899 -7.075 8.956 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.959 -3.423 8.355 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.647 -3.104 9.514 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.380 -4.218 8.152 1.00 0.00 H new ATOM 56 N ALA A 4 -5.017 -7.845 10.550 1.00 0.00 N ATOM 57 CA ALA A 4 -5.763 -8.757 9.704 1.00 0.00 C ATOM 58 C ALA A 4 -6.599 -7.973 8.704 1.00 0.00 C ATOM 59 O ALA A 4 -7.014 -6.846 8.975 1.00 0.00 O ATOM 60 CB ALA A 4 -6.644 -9.661 10.550 1.00 0.00 C ATOM 0 H ALA A 4 -5.595 -7.181 11.066 1.00 0.00 H new ATOM 0 HA ALA A 4 -5.061 -9.384 9.154 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -7.198 -10.340 9.901 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -6.022 -10.239 11.234 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.345 -9.054 11.123 1.00 0.00 H new ATOM 66 N THR A 5 -6.840 -8.578 7.548 1.00 0.00 N ATOM 67 CA THR A 5 -7.561 -7.922 6.465 1.00 0.00 C ATOM 68 C THR A 5 -9.028 -7.696 6.839 1.00 0.00 C ATOM 69 O THR A 5 -9.719 -6.896 6.217 1.00 0.00 O ATOM 70 CB THR A 5 -7.473 -8.758 5.168 1.00 0.00 C ATOM 71 OG1 THR A 5 -6.111 -9.149 4.935 1.00 0.00 O ATOM 72 CG2 THR A 5 -7.978 -7.971 3.964 1.00 0.00 C ATOM 0 H THR A 5 -6.544 -9.531 7.335 1.00 0.00 H new ATOM 0 HA THR A 5 -7.093 -6.952 6.294 1.00 0.00 H new ATOM 0 HB THR A 5 -8.102 -9.639 5.295 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.059 -9.680 4.113 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.902 -8.588 3.068 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.019 -7.689 4.124 1.00 0.00 H new ATOM 0 HG23 THR A 5 -7.374 -7.072 3.838 1.00 0.00 H new ATOM 80 N ASP A 6 -9.473 -8.361 7.900 1.00 0.00 N ATOM 81 CA ASP A 6 -10.868 -8.284 8.327 1.00 0.00 C ATOM 82 C ASP A 6 -11.125 -7.021 9.137 1.00 0.00 C ATOM 83 O ASP A 6 -12.265 -6.732 9.499 1.00 0.00 O ATOM 84 CB ASP A 6 -11.240 -9.494 9.190 1.00 0.00 C ATOM 85 CG ASP A 6 -11.057 -10.822 8.485 1.00 0.00 C ATOM 86 OD1 ASP A 6 -9.934 -11.370 8.533 1.00 0.00 O ATOM 87 OD2 ASP A 6 -12.037 -11.346 7.924 1.00 0.00 O ATOM 0 H ASP A 6 -8.888 -8.961 8.482 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.479 -8.270 7.424 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.631 -9.485 10.094 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.279 -9.399 9.504 1.00 0.00 H new ATOM 92 N ASP A 7 -10.068 -6.279 9.443 1.00 0.00 N ATOM 93 CA ASP A 7 -10.209 -5.038 10.197 1.00 0.00 C ATOM 94 C ASP A 7 -10.076 -3.829 9.282 1.00 0.00 C ATOM 95 O ASP A 7 -10.391 -2.704 9.671 1.00 0.00 O ATOM 96 CB ASP A 7 -9.140 -4.958 11.292 1.00 0.00 C ATOM 97 CG ASP A 7 -9.217 -6.104 12.276 1.00 0.00 C ATOM 98 OD1 ASP A 7 -9.997 -6.010 13.241 1.00 0.00 O ATOM 99 OD2 ASP A 7 -8.493 -7.105 12.093 1.00 0.00 O ATOM 0 H ASP A 7 -9.110 -6.512 9.183 1.00 0.00 H new ATOM 0 HA ASP A 7 -11.200 -5.033 10.651 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -8.153 -4.949 10.829 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -9.248 -4.016 11.830 1.00 0.00 H new ATOM 104 N LEU A 8 -9.610 -4.059 8.065 1.00 0.00 N ATOM 105 CA LEU A 8 -9.444 -2.976 7.104 1.00 0.00 C ATOM 106 C LEU A 8 -10.399 -3.147 5.939 1.00 0.00 C ATOM 107 O LEU A 8 -10.674 -2.200 5.200 1.00 0.00 O ATOM 108 CB LEU A 8 -8.002 -2.892 6.607 1.00 0.00 C ATOM 109 CG LEU A 8 -7.006 -2.322 7.618 1.00 0.00 C ATOM 110 CD1 LEU A 8 -6.678 -3.335 8.702 1.00 0.00 C ATOM 111 CD2 LEU A 8 -5.743 -1.862 6.916 1.00 0.00 C ATOM 0 H LEU A 8 -9.341 -4.980 7.719 1.00 0.00 H new ATOM 0 HA LEU A 8 -9.678 -2.040 7.612 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.674 -3.890 6.318 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.978 -2.276 5.708 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.471 -1.461 8.098 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.968 -2.899 9.405 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -7.590 -3.609 9.232 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.240 -4.224 8.249 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.045 -1.459 7.650 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.283 -2.707 6.404 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -5.992 -1.089 6.189 1.00 0.00 H new ATOM 123 N GLU A 9 -10.904 -4.360 5.796 1.00 0.00 N ATOM 124 CA GLU A 9 -11.924 -4.660 4.814 1.00 0.00 C ATOM 125 C GLU A 9 -12.978 -5.556 5.446 1.00 0.00 C ATOM 126 O GLU A 9 -12.663 -6.491 6.179 1.00 0.00 O ATOM 127 CB GLU A 9 -11.340 -5.311 3.550 1.00 0.00 C ATOM 128 CG GLU A 9 -10.458 -4.376 2.728 1.00 0.00 C ATOM 129 CD GLU A 9 -10.337 -4.794 1.272 1.00 0.00 C ATOM 130 OE1 GLU A 9 -9.642 -5.790 0.984 1.00 0.00 O ATOM 131 OE2 GLU A 9 -10.939 -4.116 0.402 1.00 0.00 O ATOM 0 H GLU A 9 -10.617 -5.162 6.358 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.380 -3.722 4.498 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.757 -6.185 3.839 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -12.159 -5.667 2.924 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -10.865 -3.366 2.777 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.464 -4.340 3.173 1.00 0.00 H new ATOM 138 N VAL A 10 -14.224 -5.247 5.170 1.00 0.00 N ATOM 139 CA VAL A 10 -15.347 -5.964 5.732 1.00 0.00 C ATOM 140 C VAL A 10 -16.278 -6.359 4.600 1.00 0.00 C ATOM 141 O VAL A 10 -16.403 -5.634 3.615 1.00 0.00 O ATOM 142 CB VAL A 10 -16.095 -5.097 6.783 1.00 0.00 C ATOM 143 CG1 VAL A 10 -16.582 -3.790 6.175 1.00 0.00 C ATOM 144 CG2 VAL A 10 -17.256 -5.862 7.403 1.00 0.00 C ATOM 0 H VAL A 10 -14.489 -4.486 4.545 1.00 0.00 H new ATOM 0 HA VAL A 10 -14.990 -6.856 6.247 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.384 -4.859 7.574 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -17.101 -3.206 6.935 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -15.730 -3.223 5.801 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -17.265 -4.003 5.353 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -17.760 -5.229 8.134 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -17.962 -6.147 6.623 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -16.879 -6.758 7.897 1.00 0.00 H new ATOM 154 N ALA A 11 -16.906 -7.513 4.715 1.00 0.00 N ATOM 155 CA ALA A 11 -17.778 -8.003 3.663 1.00 0.00 C ATOM 156 C ALA A 11 -18.972 -7.076 3.471 1.00 0.00 C ATOM 157 O ALA A 11 -19.633 -6.682 4.432 1.00 0.00 O ATOM 158 CB ALA A 11 -18.225 -9.415 4.005 1.00 0.00 C ATOM 0 H ALA A 11 -16.830 -8.129 5.525 1.00 0.00 H new ATOM 0 HA ALA A 11 -17.232 -8.022 2.720 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -18.881 -9.790 3.219 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -17.352 -10.063 4.089 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -18.763 -9.407 4.953 1.00 0.00 H new ATOM 164 N CYS A 12 -19.222 -6.728 2.208 1.00 0.00 N ATOM 165 CA CYS A 12 -20.200 -5.724 1.815 1.00 0.00 C ATOM 166 C CYS A 12 -21.640 -6.088 2.213 1.00 0.00 C ATOM 167 O CYS A 12 -21.897 -7.205 2.643 1.00 0.00 O ATOM 168 CB CYS A 12 -20.131 -5.599 0.303 1.00 0.00 C ATOM 169 SG CYS A 12 -20.027 -3.914 -0.298 1.00 0.00 S ATOM 0 H CYS A 12 -18.737 -7.148 1.415 1.00 0.00 H new ATOM 0 HA CYS A 12 -19.958 -4.794 2.329 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -19.264 -6.154 -0.056 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -21.013 -6.072 -0.129 1.00 0.00 H new ATOM 174 N PRO A 13 -22.603 -5.148 2.063 1.00 0.00 N ATOM 175 CA PRO A 13 -24.035 -5.415 2.284 1.00 0.00 C ATOM 176 C PRO A 13 -24.559 -6.688 1.596 1.00 0.00 C ATOM 177 O PRO A 13 -25.316 -7.460 2.188 1.00 0.00 O ATOM 178 CB PRO A 13 -24.694 -4.188 1.648 1.00 0.00 C ATOM 179 CG PRO A 13 -23.729 -3.083 1.884 1.00 0.00 C ATOM 180 CD PRO A 13 -22.368 -3.717 1.745 1.00 0.00 C ATOM 0 HA PRO A 13 -24.245 -5.577 3.341 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.871 -4.340 0.583 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -25.661 -3.975 2.105 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.865 -2.279 1.161 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -23.862 -2.647 2.874 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.971 -3.592 0.738 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -21.648 -3.269 2.430 1.00 0.00 H new ATOM 188 N LYS A 14 -24.126 -6.916 0.356 1.00 0.00 N ATOM 189 CA LYS A 14 -24.788 -7.907 -0.501 1.00 0.00 C ATOM 190 C LYS A 14 -23.839 -8.642 -1.454 1.00 0.00 C ATOM 191 O LYS A 14 -24.115 -9.768 -1.860 1.00 0.00 O ATOM 192 CB LYS A 14 -25.904 -7.224 -1.312 1.00 0.00 C ATOM 193 CG LYS A 14 -26.475 -8.104 -2.415 1.00 0.00 C ATOM 194 CD LYS A 14 -27.635 -7.436 -3.146 1.00 0.00 C ATOM 195 CE LYS A 14 -28.052 -8.265 -4.355 1.00 0.00 C ATOM 196 NZ LYS A 14 -29.329 -7.792 -4.950 1.00 0.00 N ATOM 0 H LYS A 14 -23.334 -6.439 -0.074 1.00 0.00 H new ATOM 0 HA LYS A 14 -25.197 -8.664 0.168 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -26.708 -6.934 -0.636 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -25.513 -6.308 -1.754 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -25.688 -8.344 -3.130 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -26.814 -9.047 -1.986 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -28.481 -7.319 -2.468 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -27.343 -6.436 -3.467 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -27.266 -8.225 -5.109 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -28.156 -9.309 -4.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -29.933 -8.609 -5.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -29.818 -7.171 -4.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -29.130 -7.264 -5.824 1.00 0.00 H new ATOM 210 N CYS A 15 -22.722 -8.042 -1.820 1.00 0.00 N ATOM 211 CA CYS A 15 -21.940 -8.623 -2.911 1.00 0.00 C ATOM 212 C CYS A 15 -20.566 -9.130 -2.512 1.00 0.00 C ATOM 213 O CYS A 15 -19.626 -9.039 -3.303 1.00 0.00 O ATOM 214 CB CYS A 15 -21.741 -7.531 -3.949 1.00 0.00 C ATOM 215 SG CYS A 15 -20.918 -6.057 -3.299 1.00 0.00 S ATOM 0 H CYS A 15 -22.343 -7.191 -1.405 1.00 0.00 H new ATOM 0 HA CYS A 15 -22.495 -9.489 -3.272 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -21.154 -7.930 -4.776 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -22.711 -7.246 -4.355 1.00 0.00 H new ATOM 220 N GLU A 16 -20.477 -9.771 -1.364 1.00 0.00 N ATOM 221 CA GLU A 16 -19.204 -10.278 -0.864 1.00 0.00 C ATOM 222 C GLU A 16 -18.972 -11.703 -1.338 1.00 0.00 C ATOM 223 O GLU A 16 -18.410 -12.528 -0.612 1.00 0.00 O ATOM 224 CB GLU A 16 -19.196 -10.274 0.673 1.00 0.00 C ATOM 225 CG GLU A 16 -20.304 -9.448 1.312 1.00 0.00 C ATOM 226 CD GLU A 16 -21.595 -10.219 1.464 1.00 0.00 C ATOM 227 OE1 GLU A 16 -21.681 -11.102 2.342 1.00 0.00 O ATOM 228 OE2 GLU A 16 -22.530 -9.957 0.691 1.00 0.00 O ATOM 0 H GLU A 16 -21.273 -9.956 -0.753 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.415 -9.630 -1.245 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -19.278 -11.302 1.026 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -18.234 -9.895 1.017 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -19.975 -9.103 2.292 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.485 -8.560 0.706 1.00 0.00 H new ATOM 235 N ARG A 17 -19.407 -12.000 -2.554 1.00 0.00 N ATOM 236 CA ARG A 17 -19.339 -13.338 -3.097 1.00 0.00 C ATOM 237 C ARG A 17 -19.169 -13.222 -4.613 1.00 0.00 C ATOM 238 O ARG A 17 -18.665 -14.127 -5.268 1.00 0.00 O ATOM 239 CB ARG A 17 -20.602 -14.132 -2.756 1.00 0.00 C ATOM 240 CG ARG A 17 -21.893 -13.441 -3.165 1.00 0.00 C ATOM 241 CD ARG A 17 -23.092 -14.079 -2.482 1.00 0.00 C ATOM 242 NE ARG A 17 -22.850 -14.248 -1.051 1.00 0.00 N ATOM 243 CZ ARG A 17 -22.926 -13.260 -0.165 1.00 0.00 C ATOM 244 NH1 ARG A 17 -23.423 -12.086 -0.521 1.00 0.00 N ATOM 245 NH2 ARG A 17 -22.540 -13.454 1.087 1.00 0.00 N ATOM 0 H ARG A 17 -19.817 -11.315 -3.189 1.00 0.00 H new ATOM 0 HA ARG A 17 -18.495 -13.873 -2.662 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -20.551 -15.105 -3.245 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -20.625 -14.316 -1.682 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -21.842 -12.384 -2.905 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -22.013 -13.498 -4.247 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -23.975 -13.458 -2.634 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -23.301 -15.048 -2.936 1.00 0.00 H new ATOM 0 HE ARG A 17 -22.608 -15.179 -0.712 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -23.748 -11.938 -1.476 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -23.481 -11.329 0.160 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -22.182 -14.365 1.375 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -22.600 -12.693 1.763 1.00 0.00 H new ATOM 259 N ALA A 18 -19.608 -12.073 -5.168 1.00 0.00 N ATOM 260 CA ALA A 18 -19.688 -11.921 -6.621 1.00 0.00 C ATOM 261 C ALA A 18 -19.054 -10.628 -7.126 1.00 0.00 C ATOM 262 O ALA A 18 -18.570 -10.567 -8.257 1.00 0.00 O ATOM 263 CB ALA A 18 -21.138 -11.999 -7.067 1.00 0.00 C ATOM 0 H ALA A 18 -19.906 -11.255 -4.636 1.00 0.00 H new ATOM 0 HA ALA A 18 -19.115 -12.739 -7.057 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -21.192 -11.885 -8.150 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -21.555 -12.965 -6.782 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -21.709 -11.203 -6.589 1.00 0.00 H new ATOM 269 N GLY A 19 -19.065 -9.596 -6.290 1.00 0.00 N ATOM 270 CA GLY A 19 -18.482 -8.325 -6.684 1.00 0.00 C ATOM 271 C GLY A 19 -19.429 -7.456 -7.497 1.00 0.00 C ATOM 272 O GLY A 19 -18.986 -6.571 -8.222 1.00 0.00 O ATOM 0 H GLY A 19 -19.464 -9.615 -5.352 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -18.177 -7.780 -5.790 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.580 -8.512 -7.267 1.00 0.00 H new ATOM 276 N GLU A 20 -20.728 -7.668 -7.336 1.00 0.00 N ATOM 277 CA GLU A 20 -21.724 -6.942 -8.117 1.00 0.00 C ATOM 278 C GLU A 20 -23.004 -6.742 -7.320 1.00 0.00 C ATOM 279 O GLU A 20 -23.314 -7.510 -6.409 1.00 0.00 O ATOM 280 CB GLU A 20 -22.056 -7.677 -9.420 1.00 0.00 C ATOM 281 CG GLU A 20 -22.349 -9.152 -9.214 1.00 0.00 C ATOM 282 CD GLU A 20 -23.125 -9.766 -10.360 1.00 0.00 C ATOM 283 OE1 GLU A 20 -22.496 -10.218 -11.337 1.00 0.00 O ATOM 284 OE2 GLU A 20 -24.374 -9.824 -10.278 1.00 0.00 O ATOM 0 H GLU A 20 -21.118 -8.337 -6.672 1.00 0.00 H new ATOM 0 HA GLU A 20 -21.292 -5.970 -8.357 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -22.919 -7.203 -9.888 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -21.221 -7.572 -10.112 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -21.409 -9.690 -9.089 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -22.914 -9.279 -8.290 1.00 0.00 H new ATOM 291 N ILE A 21 -23.748 -5.721 -7.692 1.00 0.00 N ATOM 292 CA ILE A 21 -25.040 -5.438 -7.104 1.00 0.00 C ATOM 293 C ILE A 21 -26.037 -5.405 -8.226 1.00 0.00 C ATOM 294 O ILE A 21 -26.080 -4.448 -8.993 1.00 0.00 O ATOM 295 CB ILE A 21 -25.073 -4.088 -6.354 1.00 0.00 C ATOM 296 CG1 ILE A 21 -24.158 -4.134 -5.123 1.00 0.00 C ATOM 297 CG2 ILE A 21 -26.492 -3.708 -5.938 1.00 0.00 C ATOM 298 CD1 ILE A 21 -24.616 -5.108 -4.048 1.00 0.00 C ATOM 0 H ILE A 21 -23.470 -5.059 -8.417 1.00 0.00 H new ATOM 0 HA ILE A 21 -25.268 -6.209 -6.368 1.00 0.00 H new ATOM 0 HB ILE A 21 -24.709 -3.324 -7.041 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -23.152 -4.407 -5.441 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -24.096 -3.135 -4.691 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -26.474 -2.753 -5.413 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -27.121 -3.623 -6.824 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -26.896 -4.476 -5.279 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -23.917 -5.082 -3.212 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -25.609 -4.825 -3.700 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -24.650 -6.116 -4.461 1.00 0.00 H new ATOM 310 N GLU A 22 -26.802 -6.471 -8.334 1.00 0.00 N ATOM 311 CA GLU A 22 -27.796 -6.583 -9.380 1.00 0.00 C ATOM 312 C GLU A 22 -27.151 -6.606 -10.773 1.00 0.00 C ATOM 313 O GLU A 22 -27.560 -5.862 -11.659 1.00 0.00 O ATOM 314 CB GLU A 22 -28.741 -5.392 -9.242 1.00 0.00 C ATOM 315 CG GLU A 22 -30.200 -5.770 -9.255 1.00 0.00 C ATOM 316 CD GLU A 22 -30.516 -6.694 -8.094 1.00 0.00 C ATOM 317 OE1 GLU A 22 -30.397 -6.251 -6.931 1.00 0.00 O ATOM 318 OE2 GLU A 22 -30.819 -7.885 -8.329 1.00 0.00 O ATOM 0 H GLU A 22 -26.754 -7.275 -7.708 1.00 0.00 H new ATOM 0 HA GLU A 22 -28.340 -7.522 -9.275 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -28.519 -4.869 -8.312 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -28.549 -4.692 -10.055 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -30.816 -4.873 -9.192 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -30.447 -6.261 -10.196 1.00 0.00 H new ATOM 325 N GLY A 23 -26.123 -7.442 -10.966 1.00 0.00 N ATOM 326 CA GLY A 23 -25.419 -7.480 -12.249 1.00 0.00 C ATOM 327 C GLY A 23 -24.766 -6.160 -12.597 1.00 0.00 C ATOM 328 O GLY A 23 -24.287 -5.950 -13.712 1.00 0.00 O ATOM 0 H GLY A 23 -25.767 -8.089 -10.263 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -24.658 -8.260 -12.218 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -26.122 -7.752 -13.036 1.00 0.00 H new ATOM 332 N THR A 24 -24.763 -5.288 -11.626 1.00 0.00 N ATOM 333 CA THR A 24 -24.371 -3.913 -11.793 1.00 0.00 C ATOM 334 C THR A 24 -23.221 -3.559 -10.844 1.00 0.00 C ATOM 335 O THR A 24 -23.137 -4.102 -9.742 1.00 0.00 O ATOM 336 CB THR A 24 -25.641 -3.087 -11.523 1.00 0.00 C ATOM 337 OG1 THR A 24 -26.338 -2.857 -12.752 1.00 0.00 O ATOM 338 CG2 THR A 24 -25.385 -1.772 -10.802 1.00 0.00 C ATOM 0 H THR A 24 -25.040 -5.519 -10.672 1.00 0.00 H new ATOM 0 HA THR A 24 -23.990 -3.707 -12.793 1.00 0.00 H new ATOM 0 HB THR A 24 -26.255 -3.679 -10.844 1.00 0.00 H new ATOM 0 HG1 THR A 24 -27.147 -2.332 -12.576 1.00 0.00 H new ATOM 0 HG21 THR A 24 -26.330 -1.251 -10.650 1.00 0.00 H new ATOM 0 HG22 THR A 24 -24.921 -1.971 -9.836 1.00 0.00 H new ATOM 0 HG23 THR A 24 -24.721 -1.151 -11.403 1.00 0.00 H new ATOM 346 N PRO A 25 -22.297 -2.674 -11.277 1.00 0.00 N ATOM 347 CA PRO A 25 -21.123 -2.293 -10.481 1.00 0.00 C ATOM 348 C PRO A 25 -21.515 -1.741 -9.113 1.00 0.00 C ATOM 349 O PRO A 25 -22.442 -0.940 -8.993 1.00 0.00 O ATOM 350 CB PRO A 25 -20.428 -1.222 -11.332 1.00 0.00 C ATOM 351 CG PRO A 25 -21.470 -0.756 -12.292 1.00 0.00 C ATOM 352 CD PRO A 25 -22.329 -1.958 -12.566 1.00 0.00 C ATOM 0 HA PRO A 25 -20.480 -3.147 -10.267 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -20.065 -0.401 -10.714 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -19.565 -1.633 -11.855 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -22.058 0.058 -11.868 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -21.018 -0.379 -13.209 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -23.343 -1.676 -12.848 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -21.929 -2.566 -13.378 1.00 0.00 H new ATOM 360 N CYS A 26 -20.815 -2.193 -8.081 1.00 0.00 N ATOM 361 CA CYS A 26 -21.194 -1.890 -6.714 1.00 0.00 C ATOM 362 C CYS A 26 -20.541 -0.615 -6.159 1.00 0.00 C ATOM 363 O CYS A 26 -19.341 -0.399 -6.321 1.00 0.00 O ATOM 364 CB CYS A 26 -20.845 -3.080 -5.839 1.00 0.00 C ATOM 365 SG CYS A 26 -21.342 -2.876 -4.110 1.00 0.00 S ATOM 0 H CYS A 26 -19.980 -2.772 -8.169 1.00 0.00 H new ATOM 0 HA CYS A 26 -22.267 -1.699 -6.709 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -21.324 -3.971 -6.244 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -19.769 -3.249 -5.882 1.00 0.00 H new ATOM 370 N PRO A 27 -21.355 0.200 -5.439 1.00 0.00 N ATOM 371 CA PRO A 27 -20.985 1.505 -4.853 1.00 0.00 C ATOM 372 C PRO A 27 -19.524 1.666 -4.408 1.00 0.00 C ATOM 373 O PRO A 27 -18.802 2.525 -4.911 1.00 0.00 O ATOM 374 CB PRO A 27 -21.888 1.559 -3.622 1.00 0.00 C ATOM 375 CG PRO A 27 -23.135 0.832 -3.998 1.00 0.00 C ATOM 376 CD PRO A 27 -22.780 -0.091 -5.153 1.00 0.00 C ATOM 0 HA PRO A 27 -21.102 2.294 -5.596 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -21.407 1.091 -2.764 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -22.106 2.590 -3.342 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -23.519 0.261 -3.152 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -23.917 1.533 -4.291 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -22.925 -1.137 -4.883 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -23.407 0.104 -6.023 1.00 0.00 H new ATOM 384 N ALA A 28 -19.096 0.824 -3.478 1.00 0.00 N ATOM 385 CA ALA A 28 -17.829 1.038 -2.774 1.00 0.00 C ATOM 386 C ALA A 28 -16.879 -0.139 -2.969 1.00 0.00 C ATOM 387 O ALA A 28 -15.729 -0.114 -2.533 1.00 0.00 O ATOM 388 CB ALA A 28 -18.086 1.275 -1.290 1.00 0.00 C ATOM 0 H ALA A 28 -19.603 -0.013 -3.190 1.00 0.00 H new ATOM 0 HA ALA A 28 -17.353 1.922 -3.197 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.137 1.433 -0.777 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.716 2.156 -1.166 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -18.588 0.406 -0.864 1.00 0.00 H new ATOM 394 N CYS A 29 -17.383 -1.182 -3.599 1.00 0.00 N ATOM 395 CA CYS A 29 -16.581 -2.359 -3.880 1.00 0.00 C ATOM 396 C CYS A 29 -16.732 -2.747 -5.347 1.00 0.00 C ATOM 397 O CYS A 29 -17.610 -3.536 -5.698 1.00 0.00 O ATOM 398 CB CYS A 29 -17.018 -3.512 -2.960 1.00 0.00 C ATOM 399 SG CYS A 29 -18.723 -4.052 -3.206 1.00 0.00 S ATOM 0 H CYS A 29 -18.347 -1.239 -3.927 1.00 0.00 H new ATOM 0 HA CYS A 29 -15.530 -2.142 -3.689 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -16.353 -4.361 -3.120 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -16.894 -3.201 -1.923 1.00 0.00 H new ATOM 404 N SER A 30 -15.891 -2.188 -6.210 1.00 0.00 N ATOM 405 CA SER A 30 -16.001 -2.417 -7.646 1.00 0.00 C ATOM 406 C SER A 30 -15.481 -3.807 -8.034 1.00 0.00 C ATOM 407 O SER A 30 -14.591 -3.944 -8.871 1.00 0.00 O ATOM 408 CB SER A 30 -15.223 -1.325 -8.391 1.00 0.00 C ATOM 409 OG SER A 30 -15.564 -1.279 -9.767 1.00 0.00 O ATOM 0 H SER A 30 -15.124 -1.572 -5.940 1.00 0.00 H new ATOM 0 HA SER A 30 -17.053 -2.375 -7.927 1.00 0.00 H new ATOM 0 HB2 SER A 30 -15.428 -0.357 -7.934 1.00 0.00 H new ATOM 0 HB3 SER A 30 -14.153 -1.507 -8.288 1.00 0.00 H new ATOM 0 HG SER A 30 -15.439 -2.166 -10.165 1.00 0.00 H new ATOM 415 N GLY A 31 -16.036 -4.832 -7.404 1.00 0.00 N ATOM 416 CA GLY A 31 -15.718 -6.189 -7.776 1.00 0.00 C ATOM 417 C GLY A 31 -14.650 -6.813 -6.905 1.00 0.00 C ATOM 418 O GLY A 31 -13.719 -7.436 -7.415 1.00 0.00 O ATOM 0 H GLY A 31 -16.704 -4.744 -6.638 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.622 -6.795 -7.721 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.386 -6.206 -8.814 1.00 0.00 H new ATOM 422 N LYS A 32 -14.768 -6.656 -5.589 1.00 0.00 N ATOM 423 CA LYS A 32 -13.855 -7.306 -4.657 1.00 0.00 C ATOM 424 C LYS A 32 -14.635 -8.272 -3.769 1.00 0.00 C ATOM 425 O LYS A 32 -14.205 -9.395 -3.509 1.00 0.00 O ATOM 426 CB LYS A 32 -13.184 -6.275 -3.749 1.00 0.00 C ATOM 427 CG LYS A 32 -12.485 -5.142 -4.479 1.00 0.00 C ATOM 428 CD LYS A 32 -11.828 -4.186 -3.494 1.00 0.00 C ATOM 429 CE LYS A 32 -12.851 -3.532 -2.576 1.00 0.00 C ATOM 430 NZ LYS A 32 -12.210 -2.747 -1.488 1.00 0.00 N ATOM 0 H LYS A 32 -15.487 -6.084 -5.146 1.00 0.00 H new ATOM 0 HA LYS A 32 -13.099 -7.834 -5.238 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -13.938 -5.851 -3.086 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.456 -6.786 -3.119 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.732 -5.549 -5.154 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -13.205 -4.600 -5.093 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -11.095 -4.727 -2.895 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -11.285 -3.415 -4.042 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -13.496 -2.878 -3.162 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -13.489 -4.301 -2.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -12.941 -2.238 -0.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -11.697 -3.390 -0.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -11.544 -2.063 -1.900 1.00 0.00 H new ATOM 444 N GLY A 33 -15.790 -7.801 -3.296 1.00 0.00 N ATOM 445 CA GLY A 33 -16.585 -8.542 -2.351 1.00 0.00 C ATOM 446 C GLY A 33 -16.671 -7.805 -1.031 1.00 0.00 C ATOM 447 O GLY A 33 -17.728 -7.740 -0.407 1.00 0.00 O ATOM 0 H GLY A 33 -16.187 -6.900 -3.563 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -17.586 -8.697 -2.753 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -16.148 -9.528 -2.195 1.00 0.00 H new ATOM 451 N VAL A 34 -15.566 -7.185 -0.642 1.00 0.00 N ATOM 452 CA VAL A 34 -15.486 -6.484 0.634 1.00 0.00 C ATOM 453 C VAL A 34 -15.350 -4.971 0.444 1.00 0.00 C ATOM 454 O VAL A 34 -15.043 -4.495 -0.653 1.00 0.00 O ATOM 455 CB VAL A 34 -14.289 -6.998 1.463 1.00 0.00 C ATOM 456 CG1 VAL A 34 -14.495 -8.447 1.877 1.00 0.00 C ATOM 457 CG2 VAL A 34 -12.996 -6.851 0.678 1.00 0.00 C ATOM 0 H VAL A 34 -14.709 -7.153 -1.194 1.00 0.00 H new ATOM 0 HA VAL A 34 -16.416 -6.685 1.166 1.00 0.00 H new ATOM 0 HB VAL A 34 -14.220 -6.393 2.367 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -13.638 -8.784 2.460 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -15.399 -8.528 2.481 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -14.596 -9.069 0.987 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -12.163 -7.218 1.277 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -13.062 -7.429 -0.244 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.834 -5.800 0.437 1.00 0.00 H new ATOM 467 N ILE A 35 -15.605 -4.234 1.518 1.00 0.00 N ATOM 468 CA ILE A 35 -15.435 -2.783 1.544 1.00 0.00 C ATOM 469 C ILE A 35 -14.500 -2.372 2.674 1.00 0.00 C ATOM 470 O ILE A 35 -14.297 -3.123 3.619 1.00 0.00 O ATOM 471 CB ILE A 35 -16.780 -2.047 1.708 1.00 0.00 C ATOM 472 CG1 ILE A 35 -17.629 -2.711 2.797 1.00 0.00 C ATOM 473 CG2 ILE A 35 -17.518 -2.004 0.384 1.00 0.00 C ATOM 474 CD1 ILE A 35 -18.927 -1.988 3.094 1.00 0.00 C ATOM 0 H ILE A 35 -15.937 -4.625 2.400 1.00 0.00 H new ATOM 0 HA ILE A 35 -15.002 -2.499 0.585 1.00 0.00 H new ATOM 0 HB ILE A 35 -16.584 -1.021 2.020 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -17.856 -3.733 2.494 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -17.042 -2.773 3.713 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -18.466 -1.482 0.513 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -16.912 -1.478 -0.354 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -17.708 -3.021 0.040 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -19.470 -2.521 3.875 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -18.710 -0.974 3.430 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -19.536 -1.949 2.191 1.00 0.00 H new ATOM 486 N LEU A 36 -13.939 -1.176 2.571 1.00 0.00 N ATOM 487 CA LEU A 36 -12.890 -0.748 3.490 1.00 0.00 C ATOM 488 C LEU A 36 -13.436 -0.101 4.757 1.00 0.00 C ATOM 489 O LEU A 36 -14.590 0.329 4.822 1.00 0.00 O ATOM 490 CB LEU A 36 -11.942 0.239 2.800 1.00 0.00 C ATOM 491 CG LEU A 36 -11.294 -0.268 1.512 1.00 0.00 C ATOM 492 CD1 LEU A 36 -12.106 0.151 0.295 1.00 0.00 C ATOM 493 CD2 LEU A 36 -9.869 0.232 1.411 1.00 0.00 C ATOM 0 H LEU A 36 -14.190 -0.486 1.863 1.00 0.00 H new ATOM 0 HA LEU A 36 -12.355 -1.652 3.780 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.495 1.151 2.574 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -11.153 0.510 3.502 1.00 0.00 H new ATOM 0 HG LEU A 36 -11.275 -1.357 1.540 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.625 -0.221 -0.609 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -13.111 -0.264 0.368 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -12.164 1.239 0.253 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.419 -0.136 0.489 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.865 1.322 1.407 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -9.295 -0.129 2.265 1.00 0.00 H new ATOM 505 N THR A 37 -12.569 -0.044 5.759 1.00 0.00 N ATOM 506 CA THR A 37 -12.840 0.658 7.000 1.00 0.00 C ATOM 507 C THR A 37 -12.026 1.943 7.010 1.00 0.00 C ATOM 508 O THR A 37 -11.224 2.148 6.106 1.00 0.00 O ATOM 509 CB THR A 37 -12.439 -0.200 8.218 1.00 0.00 C ATOM 510 OG1 THR A 37 -11.021 -0.422 8.213 1.00 0.00 O ATOM 511 CG2 THR A 37 -13.152 -1.541 8.203 1.00 0.00 C ATOM 0 H THR A 37 -11.651 -0.488 5.730 1.00 0.00 H new ATOM 0 HA THR A 37 -13.907 0.870 7.064 1.00 0.00 H new ATOM 0 HB THR A 37 -12.729 0.340 9.119 1.00 0.00 H new ATOM 0 HG1 THR A 37 -10.802 -1.149 8.832 1.00 0.00 H new ATOM 0 HG21 THR A 37 -12.850 -2.124 9.073 1.00 0.00 H new ATOM 0 HG22 THR A 37 -14.230 -1.380 8.231 1.00 0.00 H new ATOM 0 HG23 THR A 37 -12.889 -2.083 7.294 1.00 0.00 H new ATOM 519 N ALA A 38 -12.200 2.795 8.012 1.00 0.00 N ATOM 520 CA ALA A 38 -11.485 4.071 8.049 1.00 0.00 C ATOM 521 C ALA A 38 -9.974 3.865 7.983 1.00 0.00 C ATOM 522 O ALA A 38 -9.273 4.580 7.262 1.00 0.00 O ATOM 523 CB ALA A 38 -11.862 4.865 9.285 1.00 0.00 C ATOM 0 H ALA A 38 -12.822 2.632 8.804 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.783 4.641 7.169 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.318 5.810 9.291 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -12.934 5.064 9.277 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -11.606 4.293 10.177 1.00 0.00 H new ATOM 529 N GLN A 39 -9.474 2.884 8.727 1.00 0.00 N ATOM 530 CA GLN A 39 -8.056 2.542 8.667 1.00 0.00 C ATOM 531 C GLN A 39 -7.662 2.110 7.256 1.00 0.00 C ATOM 532 O GLN A 39 -6.618 2.516 6.740 1.00 0.00 O ATOM 533 CB GLN A 39 -7.719 1.436 9.667 1.00 0.00 C ATOM 534 CG GLN A 39 -6.254 1.037 9.640 1.00 0.00 C ATOM 535 CD GLN A 39 -5.891 0.043 10.719 1.00 0.00 C ATOM 536 OE1 GLN A 39 -6.490 0.026 11.792 1.00 0.00 O ATOM 537 NE2 GLN A 39 -4.900 -0.785 10.441 1.00 0.00 N ATOM 0 H GLN A 39 -10.023 2.316 9.373 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.487 3.433 8.931 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -7.980 1.770 10.671 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.332 0.561 9.452 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -6.018 0.609 8.666 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -5.638 1.929 9.754 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -4.432 -0.734 9.536 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -4.603 -1.475 11.131 1.00 0.00 H new ATOM 546 N GLY A 40 -8.511 1.307 6.626 1.00 0.00 N ATOM 547 CA GLY A 40 -8.253 0.857 5.277 1.00 0.00 C ATOM 548 C GLY A 40 -8.379 1.985 4.277 1.00 0.00 C ATOM 549 O GLY A 40 -7.701 1.995 3.254 1.00 0.00 O ATOM 0 H GLY A 40 -9.380 0.959 7.032 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -7.251 0.431 5.221 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.952 0.062 5.019 1.00 0.00 H new ATOM 553 N TYR A 41 -9.241 2.943 4.586 1.00 0.00 N ATOM 554 CA TYR A 41 -9.409 4.124 3.755 1.00 0.00 C ATOM 555 C TYR A 41 -8.188 5.020 3.824 1.00 0.00 C ATOM 556 O TYR A 41 -7.823 5.652 2.834 1.00 0.00 O ATOM 557 CB TYR A 41 -10.646 4.901 4.211 1.00 0.00 C ATOM 558 CG TYR A 41 -11.933 4.468 3.542 1.00 0.00 C ATOM 559 CD1 TYR A 41 -12.232 4.854 2.240 1.00 0.00 C ATOM 560 CD2 TYR A 41 -12.844 3.667 4.209 1.00 0.00 C ATOM 561 CE1 TYR A 41 -13.408 4.456 1.631 1.00 0.00 C ATOM 562 CE2 TYR A 41 -14.018 3.266 3.609 1.00 0.00 C ATOM 563 CZ TYR A 41 -14.296 3.657 2.321 1.00 0.00 C ATOM 564 OH TYR A 41 -15.469 3.251 1.726 1.00 0.00 O ATOM 0 H TYR A 41 -9.838 2.924 5.413 1.00 0.00 H new ATOM 0 HA TYR A 41 -9.536 3.801 2.722 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -10.755 4.788 5.290 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -10.487 5.962 4.016 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -11.535 5.474 1.696 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -12.631 3.350 5.219 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -13.630 4.769 0.621 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -14.718 2.646 4.150 1.00 0.00 H new ATOM 0 HH TYR A 41 -15.977 2.693 2.351 1.00 0.00 H new ATOM 574 N THR A 42 -7.536 5.049 4.970 1.00 0.00 N ATOM 575 CA THR A 42 -6.303 5.801 5.113 1.00 0.00 C ATOM 576 C THR A 42 -5.178 5.137 4.321 1.00 0.00 C ATOM 577 O THR A 42 -4.299 5.807 3.768 1.00 0.00 O ATOM 578 CB THR A 42 -5.899 5.887 6.594 1.00 0.00 C ATOM 579 OG1 THR A 42 -7.015 6.333 7.368 1.00 0.00 O ATOM 580 CG2 THR A 42 -4.728 6.837 6.789 1.00 0.00 C ATOM 0 H THR A 42 -7.838 4.562 5.814 1.00 0.00 H new ATOM 0 HA THR A 42 -6.471 6.806 4.725 1.00 0.00 H new ATOM 0 HB THR A 42 -5.591 4.895 6.925 1.00 0.00 H new ATOM 0 HG1 THR A 42 -7.686 5.620 7.416 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.464 6.878 7.846 1.00 0.00 H new ATOM 0 HG22 THR A 42 -3.872 6.482 6.215 1.00 0.00 H new ATOM 0 HG23 THR A 42 -5.007 7.833 6.446 1.00 0.00 H new ATOM 588 N LEU A 43 -5.246 3.818 4.228 1.00 0.00 N ATOM 589 CA LEU A 43 -4.205 3.046 3.579 1.00 0.00 C ATOM 590 C LEU A 43 -4.462 2.927 2.085 1.00 0.00 C ATOM 591 O LEU A 43 -3.549 2.618 1.328 1.00 0.00 O ATOM 592 CB LEU A 43 -4.096 1.649 4.208 1.00 0.00 C ATOM 593 CG LEU A 43 -2.974 1.470 5.242 1.00 0.00 C ATOM 594 CD1 LEU A 43 -3.138 2.449 6.393 1.00 0.00 C ATOM 595 CD2 LEU A 43 -2.956 0.042 5.759 1.00 0.00 C ATOM 0 H LEU A 43 -6.016 3.260 4.597 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.261 3.572 3.724 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.046 1.410 4.685 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.949 0.922 3.410 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.022 1.677 4.753 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.332 2.303 7.112 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.103 3.469 6.011 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.097 2.278 6.883 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.156 -0.070 6.491 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.912 -0.187 6.229 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.787 -0.643 4.929 1.00 0.00 H new ATOM 607 N LEU A 44 -5.683 3.199 1.636 1.00 0.00 N ATOM 608 CA LEU A 44 -5.987 3.053 0.222 1.00 0.00 C ATOM 609 C LEU A 44 -5.543 4.298 -0.537 1.00 0.00 C ATOM 610 O LEU A 44 -4.909 4.201 -1.581 1.00 0.00 O ATOM 611 CB LEU A 44 -7.490 2.741 -0.004 1.00 0.00 C ATOM 612 CG LEU A 44 -8.455 3.932 -0.182 1.00 0.00 C ATOM 613 CD1 LEU A 44 -8.390 4.499 -1.598 1.00 0.00 C ATOM 614 CD2 LEU A 44 -9.882 3.513 0.117 1.00 0.00 C ATOM 0 H LEU A 44 -6.460 3.514 2.217 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.430 2.202 -0.169 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.571 2.109 -0.889 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.840 2.150 0.843 1.00 0.00 H new ATOM 0 HG LEU A 44 -8.143 4.705 0.521 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.083 5.336 -1.687 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.377 4.843 -1.806 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.664 3.724 -2.313 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.547 4.367 -0.014 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -10.177 2.715 -0.564 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -9.949 3.156 1.145 1.00 0.00 H new ATOM 626 N ASP A 45 -5.860 5.473 -0.004 1.00 0.00 N ATOM 627 CA ASP A 45 -5.545 6.717 -0.691 1.00 0.00 C ATOM 628 C ASP A 45 -4.055 7.004 -0.618 1.00 0.00 C ATOM 629 O ASP A 45 -3.504 7.719 -1.456 1.00 0.00 O ATOM 630 CB ASP A 45 -6.346 7.879 -0.102 1.00 0.00 C ATOM 631 CG ASP A 45 -6.314 9.103 -0.996 1.00 0.00 C ATOM 632 OD1 ASP A 45 -6.745 8.994 -2.163 1.00 0.00 O ATOM 633 OD2 ASP A 45 -5.857 10.172 -0.540 1.00 0.00 O ATOM 0 H ASP A 45 -6.331 5.589 0.894 1.00 0.00 H new ATOM 0 HA ASP A 45 -5.824 6.608 -1.739 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.380 7.567 0.048 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -5.945 8.136 0.878 1.00 0.00 H new ATOM 638 N PHE A 46 -3.394 6.403 0.361 1.00 0.00 N ATOM 639 CA PHE A 46 -1.949 6.515 0.487 1.00 0.00 C ATOM 640 C PHE A 46 -1.255 5.669 -0.563 1.00 0.00 C ATOM 641 O PHE A 46 -0.274 6.104 -1.171 1.00 0.00 O ATOM 642 CB PHE A 46 -1.552 6.025 1.879 1.00 0.00 C ATOM 643 CG PHE A 46 -0.093 6.149 2.212 1.00 0.00 C ATOM 644 CD1 PHE A 46 0.402 7.306 2.790 1.00 0.00 C ATOM 645 CD2 PHE A 46 0.778 5.098 1.968 1.00 0.00 C ATOM 646 CE1 PHE A 46 1.739 7.415 3.113 1.00 0.00 C ATOM 647 CE2 PHE A 46 2.113 5.201 2.291 1.00 0.00 C ATOM 648 CZ PHE A 46 2.595 6.360 2.864 1.00 0.00 C ATOM 0 H PHE A 46 -3.837 5.832 1.081 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.649 7.553 0.344 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.125 6.583 2.619 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.842 4.978 1.974 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -0.265 8.131 2.990 1.00 0.00 H new ATOM 0 HD2 PHE A 46 0.406 4.189 1.520 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.115 8.323 3.560 1.00 0.00 H new ATOM 0 HE2 PHE A 46 2.782 4.376 2.096 1.00 0.00 H new ATOM 0 HZ PHE A 46 3.642 6.442 3.118 1.00 0.00 H new ATOM 658 N ILE A 47 -1.777 4.481 -0.812 1.00 0.00 N ATOM 659 CA ILE A 47 -1.158 3.619 -1.795 1.00 0.00 C ATOM 660 C ILE A 47 -1.519 4.081 -3.196 1.00 0.00 C ATOM 661 O ILE A 47 -0.717 3.958 -4.121 1.00 0.00 O ATOM 662 CB ILE A 47 -1.540 2.135 -1.613 1.00 0.00 C ATOM 663 CG1 ILE A 47 -3.040 1.919 -1.852 1.00 0.00 C ATOM 664 CG2 ILE A 47 -1.148 1.674 -0.219 1.00 0.00 C ATOM 665 CD1 ILE A 47 -3.487 0.482 -1.716 1.00 0.00 C ATOM 0 H ILE A 47 -2.608 4.100 -0.358 1.00 0.00 H new ATOM 0 HA ILE A 47 -0.080 3.692 -1.648 1.00 0.00 H new ATOM 0 HB ILE A 47 -0.999 1.542 -2.350 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.601 2.531 -1.146 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.292 2.273 -2.851 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.419 0.626 -0.093 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.072 1.789 -0.087 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.671 2.276 0.524 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.559 0.416 -1.900 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -2.955 -0.135 -2.441 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.269 0.127 -0.709 1.00 0.00 H new ATOM 677 N GLN A 48 -2.710 4.656 -3.327 1.00 0.00 N ATOM 678 CA GLN A 48 -3.112 5.319 -4.553 1.00 0.00 C ATOM 679 C GLN A 48 -2.051 6.330 -4.943 1.00 0.00 C ATOM 680 O GLN A 48 -1.384 6.190 -5.948 1.00 0.00 O ATOM 681 CB GLN A 48 -4.441 6.050 -4.355 1.00 0.00 C ATOM 682 CG GLN A 48 -5.664 5.148 -4.311 1.00 0.00 C ATOM 683 CD GLN A 48 -6.424 5.153 -5.622 1.00 0.00 C ATOM 684 OE1 GLN A 48 -6.418 6.153 -6.341 1.00 0.00 O ATOM 685 NE2 GLN A 48 -7.085 4.051 -5.939 1.00 0.00 N ATOM 0 H GLN A 48 -3.415 4.674 -2.590 1.00 0.00 H new ATOM 0 HA GLN A 48 -3.230 4.569 -5.335 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.392 6.618 -3.426 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.567 6.771 -5.163 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.354 4.130 -4.076 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.325 5.474 -3.508 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -7.063 3.245 -5.314 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.617 4.007 -6.808 1.00 0.00 H new ATOM 694 N LYS A 49 -1.812 7.245 -4.033 1.00 0.00 N ATOM 695 CA LYS A 49 -1.091 8.481 -4.300 1.00 0.00 C ATOM 696 C LYS A 49 0.423 8.265 -4.373 1.00 0.00 C ATOM 697 O LYS A 49 1.187 9.218 -4.523 1.00 0.00 O ATOM 698 CB LYS A 49 -1.452 9.460 -3.181 1.00 0.00 C ATOM 699 CG LYS A 49 -1.154 10.922 -3.456 1.00 0.00 C ATOM 700 CD LYS A 49 -1.185 11.727 -2.162 1.00 0.00 C ATOM 701 CE LYS A 49 -2.451 11.461 -1.357 1.00 0.00 C ATOM 702 NZ LYS A 49 -2.387 12.066 0.001 1.00 0.00 N ATOM 0 H LYS A 49 -2.117 7.155 -3.064 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.380 8.875 -5.274 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.516 9.360 -2.967 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -0.917 9.164 -2.279 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.176 11.017 -3.927 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.886 11.322 -4.158 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.312 11.478 -1.559 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.119 12.790 -2.394 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.312 11.862 -1.892 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -2.604 10.386 -1.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.204 11.749 0.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.509 11.769 0.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.403 13.103 -0.080 1.00 0.00 H new ATOM 716 N HIS A 50 0.880 7.021 -4.207 1.00 0.00 N ATOM 717 CA HIS A 50 2.287 6.764 -4.534 1.00 0.00 C ATOM 718 C HIS A 50 2.494 5.818 -5.716 1.00 0.00 C ATOM 719 O HIS A 50 3.616 5.713 -6.210 1.00 0.00 O ATOM 720 CB HIS A 50 2.996 6.178 -3.311 1.00 0.00 C ATOM 721 CG HIS A 50 2.798 6.989 -2.071 1.00 0.00 C ATOM 722 ND1 HIS A 50 2.680 8.360 -2.083 1.00 0.00 N ATOM 723 CD2 HIS A 50 2.640 6.611 -0.785 1.00 0.00 C ATOM 724 CE1 HIS A 50 2.454 8.790 -0.860 1.00 0.00 C ATOM 725 NE2 HIS A 50 2.424 7.750 -0.054 1.00 0.00 N ATOM 0 H HIS A 50 0.340 6.223 -3.871 1.00 0.00 H new ATOM 0 HA HIS A 50 2.707 7.727 -4.824 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.631 5.166 -3.138 1.00 0.00 H new ATOM 0 HB3 HIS A 50 4.063 6.100 -3.520 1.00 0.00 H new ATOM 0 HD1 HIS A 50 2.756 8.951 -2.911 1.00 0.00 H new ATOM 0 HD2 HIS A 50 2.677 5.601 -0.404 1.00 0.00 H new ATOM 0 HE1 HIS A 50 2.317 9.821 -0.568 1.00 0.00 H new ATOM 0 HE2 HIS A 50 2.265 7.786 0.953 1.00 0.00 H new ATOM 734 N LEU A 51 1.452 5.146 -6.197 1.00 0.00 N ATOM 735 CA LEU A 51 1.629 4.241 -7.340 1.00 0.00 C ATOM 736 C LEU A 51 0.632 4.538 -8.463 1.00 0.00 C ATOM 737 O LEU A 51 0.999 4.549 -9.639 1.00 0.00 O ATOM 738 CB LEU A 51 1.508 2.763 -6.931 1.00 0.00 C ATOM 739 CG LEU A 51 2.519 2.254 -5.890 1.00 0.00 C ATOM 740 CD1 LEU A 51 2.523 0.733 -5.842 1.00 0.00 C ATOM 741 CD2 LEU A 51 3.918 2.755 -6.182 1.00 0.00 C ATOM 0 H LEU A 51 0.502 5.203 -5.830 1.00 0.00 H new ATOM 0 HA LEU A 51 2.639 4.420 -7.709 1.00 0.00 H new ATOM 0 HB2 LEU A 51 0.504 2.598 -6.540 1.00 0.00 H new ATOM 0 HB3 LEU A 51 1.605 2.152 -7.828 1.00 0.00 H new ATOM 0 HG LEU A 51 2.208 2.644 -4.921 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.245 0.394 -5.099 1.00 0.00 H new ATOM 0 HD12 LEU A 51 1.530 0.375 -5.572 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.797 0.339 -6.821 1.00 0.00 H new ATOM 0 HD21 LEU A 51 4.606 2.376 -5.426 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.232 2.406 -7.166 1.00 0.00 H new ATOM 0 HD23 LEU A 51 3.925 3.845 -6.165 1.00 0.00 H new ATOM 753 N ASN A 52 -0.617 4.794 -8.100 1.00 0.00 N ATOM 754 CA ASN A 52 -1.688 4.963 -9.084 1.00 0.00 C ATOM 755 C ASN A 52 -2.102 6.421 -9.229 1.00 0.00 C ATOM 756 O ASN A 52 -2.615 6.833 -10.268 1.00 0.00 O ATOM 757 CB ASN A 52 -2.901 4.119 -8.688 1.00 0.00 C ATOM 758 CG ASN A 52 -2.911 2.765 -9.368 1.00 0.00 C ATOM 759 OD1 ASN A 52 -1.866 2.172 -9.617 1.00 0.00 O ATOM 760 ND2 ASN A 52 -4.098 2.274 -9.689 1.00 0.00 N ATOM 0 H ASN A 52 -0.918 4.890 -7.130 1.00 0.00 H new ATOM 0 HA ASN A 52 -1.304 4.628 -10.047 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -2.905 3.979 -7.607 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -3.814 4.657 -8.944 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -4.166 1.372 -10.160 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -4.944 2.798 -9.465 1.00 0.00 H new ATOM 767 N LYS A 53 -1.876 7.187 -8.184 1.00 0.00 N ATOM 768 CA LYS A 53 -2.144 8.606 -8.177 1.00 0.00 C ATOM 769 C LYS A 53 -0.823 9.360 -8.200 1.00 0.00 C ATOM 770 O LYS A 53 -0.411 9.798 -9.296 1.00 0.00 O ATOM 771 CB LYS A 53 -2.910 8.985 -6.913 1.00 0.00 C ATOM 772 CG LYS A 53 -4.364 9.351 -7.136 1.00 0.00 C ATOM 773 CD LYS A 53 -4.864 10.187 -5.968 1.00 0.00 C ATOM 774 CE LYS A 53 -5.217 9.346 -4.757 1.00 0.00 C ATOM 775 NZ LYS A 53 -6.535 8.671 -4.901 1.00 0.00 N ATOM 776 OXT LYS A 53 -0.191 9.487 -7.137 1.00 0.00 O ATOM 0 H LYS A 53 -1.496 6.836 -7.305 1.00 0.00 H new ATOM 0 HA LYS A 53 -2.741 8.864 -9.052 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -2.863 8.151 -6.213 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -2.407 9.828 -6.439 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -4.471 9.908 -8.067 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -4.966 8.448 -7.234 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -4.099 10.912 -5.691 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -5.741 10.753 -6.281 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -4.442 8.595 -4.601 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -5.231 9.979 -3.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -6.937 8.489 -3.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -7.181 9.282 -5.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -6.410 7.769 -5.404 1.00 0.00 H new TER 790 LYS A 53 HETATM 791 N FME B 1 8.629 7.010 13.492 1.00 0.00 N HETATM 792 CN FME B 1 7.581 7.802 13.324 1.00 0.00 C HETATM 793 O1 FME B 1 7.459 8.865 13.934 1.00 0.00 O HETATM 794 CA FME B 1 8.762 5.778 12.729 1.00 0.00 C HETATM 795 CB FME B 1 10.156 5.697 12.096 1.00 0.00 C HETATM 796 CG FME B 1 10.279 4.645 11.005 1.00 0.00 C HETATM 797 SD FME B 1 11.876 4.706 10.167 1.00 0.00 S HETATM 798 CE FME B 1 11.605 3.555 8.821 1.00 0.00 C HETATM 799 C FME B 1 8.522 4.578 13.636 1.00 0.00 C HETATM 800 O FME B 1 9.402 4.170 14.391 1.00 0.00 O HETATM 0 HG3 FME B 1 10.138 3.656 11.440 1.00 0.00 H new HETATM 0 HG2 FME B 1 9.483 4.788 10.275 1.00 0.00 H new HETATM 0 HE3 FME B 1 12.542 3.054 8.577 1.00 0.00 H new HETATM 0 HE2 FME B 1 10.864 2.814 9.120 1.00 0.00 H new HETATM 0 HE1 FME B 1 11.245 4.096 7.946 1.00 0.00 H new HETATM 0 HCN FME B 1 6.801 7.504 12.623 1.00 0.00 H new HETATM 0 HB3 FME B 1 10.411 6.671 11.678 1.00 0.00 H new HETATM 0 HB2 FME B 1 10.886 5.484 12.876 1.00 0.00 H new HETATM 0 HA FME B 1 8.018 5.771 11.932 1.00 0.00 H new HETATM 0 H FME B 1 9.352 7.267 14.164 1.00 0.00 H new ATOM 811 N VAL B 2 7.323 4.021 13.563 1.00 0.00 N ATOM 812 CA VAL B 2 6.948 2.903 14.418 1.00 0.00 C ATOM 813 C VAL B 2 6.937 1.604 13.613 1.00 0.00 C ATOM 814 O VAL B 2 6.618 0.531 14.123 1.00 0.00 O ATOM 815 CB VAL B 2 5.561 3.148 15.066 1.00 0.00 C ATOM 816 CG1 VAL B 2 4.451 3.091 14.024 1.00 0.00 C ATOM 817 CG2 VAL B 2 5.297 2.167 16.200 1.00 0.00 C ATOM 0 H VAL B 2 6.592 4.325 12.920 1.00 0.00 H new ATOM 0 HA VAL B 2 7.686 2.816 15.215 1.00 0.00 H new ATOM 0 HB VAL B 2 5.570 4.151 15.493 1.00 0.00 H new ATOM 0 HG11 VAL B 2 3.490 3.266 14.507 1.00 0.00 H new ATOM 0 HG12 VAL B 2 4.622 3.857 13.268 1.00 0.00 H new ATOM 0 HG13 VAL B 2 4.446 2.109 13.551 1.00 0.00 H new ATOM 0 HG21 VAL B 2 4.317 2.366 16.633 1.00 0.00 H new ATOM 0 HG22 VAL B 2 5.323 1.148 15.813 1.00 0.00 H new ATOM 0 HG23 VAL B 2 6.062 2.283 16.967 1.00 0.00 H new ATOM 827 N ILE B 3 7.318 1.705 12.351 1.00 0.00 N ATOM 828 CA ILE B 3 7.347 0.549 11.478 1.00 0.00 C ATOM 829 C ILE B 3 8.626 0.546 10.650 1.00 0.00 C ATOM 830 O ILE B 3 9.057 1.585 10.152 1.00 0.00 O ATOM 831 CB ILE B 3 6.113 0.515 10.543 1.00 0.00 C ATOM 832 CG1 ILE B 3 6.088 -0.786 9.736 1.00 0.00 C ATOM 833 CG2 ILE B 3 6.106 1.726 9.616 1.00 0.00 C ATOM 834 CD1 ILE B 3 4.853 -0.944 8.874 1.00 0.00 C ATOM 0 H ILE B 3 7.611 2.577 11.910 1.00 0.00 H new ATOM 0 HA ILE B 3 7.321 -0.342 12.105 1.00 0.00 H new ATOM 0 HB ILE B 3 5.214 0.554 11.158 1.00 0.00 H new ATOM 0 HG12 ILE B 3 6.972 -0.825 9.100 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.152 -1.630 10.422 1.00 0.00 H new ATOM 0 HG21 ILE B 3 5.231 1.683 8.968 1.00 0.00 H new ATOM 0 HG22 ILE B 3 6.072 2.639 10.210 1.00 0.00 H new ATOM 0 HG23 ILE B 3 7.010 1.723 9.007 1.00 0.00 H new ATOM 0 HD11 ILE B 3 4.906 -1.888 8.332 1.00 0.00 H new ATOM 0 HD12 ILE B 3 3.965 -0.937 9.506 1.00 0.00 H new ATOM 0 HD13 ILE B 3 4.798 -0.120 8.162 1.00 0.00 H new ATOM 846 N ALA B 4 9.253 -0.611 10.554 1.00 0.00 N ATOM 847 CA ALA B 4 10.416 -0.778 9.703 1.00 0.00 C ATOM 848 C ALA B 4 10.155 -1.877 8.684 1.00 0.00 C ATOM 849 O ALA B 4 9.404 -2.818 8.945 1.00 0.00 O ATOM 850 CB ALA B 4 11.643 -1.099 10.545 1.00 0.00 C ATOM 0 H ALA B 4 8.975 -1.453 11.058 1.00 0.00 H new ATOM 0 HA ALA B 4 10.606 0.153 9.169 1.00 0.00 H new ATOM 0 HB1 ALA B 4 12.509 -1.222 9.894 1.00 0.00 H new ATOM 0 HB2 ALA B 4 11.828 -0.284 11.245 1.00 0.00 H new ATOM 0 HB3 ALA B 4 11.472 -2.022 11.100 1.00 0.00 H new ATOM 856 N THR B 5 10.778 -1.746 7.518 1.00 0.00 N ATOM 857 CA THR B 5 10.573 -2.678 6.418 1.00 0.00 C ATOM 858 C THR B 5 11.117 -4.062 6.772 1.00 0.00 C ATOM 859 O THR B 5 10.780 -5.056 6.136 1.00 0.00 O ATOM 860 CB THR B 5 11.258 -2.158 5.133 1.00 0.00 C ATOM 861 OG1 THR B 5 10.912 -0.782 4.922 1.00 0.00 O ATOM 862 CG2 THR B 5 10.844 -2.968 3.911 1.00 0.00 C ATOM 0 H THR B 5 11.436 -0.995 7.310 1.00 0.00 H new ATOM 0 HA THR B 5 9.501 -2.759 6.240 1.00 0.00 H new ATOM 0 HB THR B 5 12.335 -2.261 5.266 1.00 0.00 H new ATOM 0 HG1 THR B 5 11.349 -0.456 4.108 1.00 0.00 H new ATOM 0 HG21 THR B 5 11.345 -2.574 3.027 1.00 0.00 H new ATOM 0 HG22 THR B 5 11.126 -4.011 4.053 1.00 0.00 H new ATOM 0 HG23 THR B 5 9.764 -2.899 3.777 1.00 0.00 H new ATOM 870 N ASP B 6 11.916 -4.120 7.831 1.00 0.00 N ATOM 871 CA ASP B 6 12.571 -5.356 8.239 1.00 0.00 C ATOM 872 C ASP B 6 11.636 -6.235 9.060 1.00 0.00 C ATOM 873 O ASP B 6 11.984 -7.363 9.411 1.00 0.00 O ATOM 874 CB ASP B 6 13.827 -5.050 9.057 1.00 0.00 C ATOM 875 CG ASP B 6 14.872 -4.290 8.267 1.00 0.00 C ATOM 876 OD1 ASP B 6 14.704 -3.066 8.072 1.00 0.00 O ATOM 877 OD2 ASP B 6 15.867 -4.907 7.840 1.00 0.00 O ATOM 0 H ASP B 6 12.127 -3.319 8.426 1.00 0.00 H new ATOM 0 HA ASP B 6 12.848 -5.894 7.333 1.00 0.00 H new ATOM 0 HB2 ASP B 6 13.549 -4.469 9.936 1.00 0.00 H new ATOM 0 HB3 ASP B 6 14.258 -5.985 9.416 1.00 0.00 H new ATOM 882 N ASP B 7 10.456 -5.717 9.381 1.00 0.00 N ATOM 883 CA ASP B 7 9.466 -6.499 10.117 1.00 0.00 C ATOM 884 C ASP B 7 8.362 -6.987 9.188 1.00 0.00 C ATOM 885 O ASP B 7 7.566 -7.852 9.554 1.00 0.00 O ATOM 886 CB ASP B 7 8.839 -5.658 11.236 1.00 0.00 C ATOM 887 CG ASP B 7 9.856 -5.127 12.225 1.00 0.00 C ATOM 888 OD1 ASP B 7 10.236 -5.867 13.154 1.00 0.00 O ATOM 889 OD2 ASP B 7 10.263 -3.951 12.091 1.00 0.00 O ATOM 0 H ASP B 7 10.162 -4.769 9.147 1.00 0.00 H new ATOM 0 HA ASP B 7 9.979 -7.358 10.549 1.00 0.00 H new ATOM 0 HB2 ASP B 7 8.300 -4.820 10.794 1.00 0.00 H new ATOM 0 HB3 ASP B 7 8.105 -6.263 11.769 1.00 0.00 H new ATOM 894 N LEU B 8 8.314 -6.434 7.985 1.00 0.00 N ATOM 895 CA LEU B 8 7.298 -6.825 7.016 1.00 0.00 C ATOM 896 C LEU B 8 7.924 -7.538 5.834 1.00 0.00 C ATOM 897 O LEU B 8 7.243 -8.235 5.081 1.00 0.00 O ATOM 898 CB LEU B 8 6.490 -5.617 6.542 1.00 0.00 C ATOM 899 CG LEU B 8 5.494 -5.070 7.564 1.00 0.00 C ATOM 900 CD1 LEU B 8 6.202 -4.280 8.653 1.00 0.00 C ATOM 901 CD2 LEU B 8 4.445 -4.214 6.877 1.00 0.00 C ATOM 0 H LEU B 8 8.962 -5.718 7.657 1.00 0.00 H new ATOM 0 HA LEU B 8 6.616 -7.514 7.514 1.00 0.00 H new ATOM 0 HB2 LEU B 8 7.181 -4.820 6.267 1.00 0.00 H new ATOM 0 HB3 LEU B 8 5.947 -5.893 5.638 1.00 0.00 H new ATOM 0 HG LEU B 8 4.996 -5.917 8.037 1.00 0.00 H new ATOM 0 HD11 LEU B 8 5.468 -3.903 9.365 1.00 0.00 H new ATOM 0 HD12 LEU B 8 6.910 -4.927 9.170 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.736 -3.442 8.206 1.00 0.00 H new ATOM 0 HD21 LEU B 8 3.744 -3.832 7.619 1.00 0.00 H new ATOM 0 HD22 LEU B 8 4.930 -3.378 6.373 1.00 0.00 H new ATOM 0 HD23 LEU B 8 3.907 -4.816 6.145 1.00 0.00 H new ATOM 913 N GLU B 9 9.225 -7.361 5.687 1.00 0.00 N ATOM 914 CA GLU B 9 9.990 -8.072 4.687 1.00 0.00 C ATOM 915 C GLU B 9 11.300 -8.539 5.300 1.00 0.00 C ATOM 916 O GLU B 9 11.961 -7.808 6.040 1.00 0.00 O ATOM 917 CB GLU B 9 10.246 -7.223 3.432 1.00 0.00 C ATOM 918 CG GLU B 9 8.986 -6.936 2.622 1.00 0.00 C ATOM 919 CD GLU B 9 9.272 -6.611 1.165 1.00 0.00 C ATOM 920 OE1 GLU B 9 9.817 -5.523 0.885 1.00 0.00 O ATOM 921 OE2 GLU B 9 8.943 -7.449 0.287 1.00 0.00 O ATOM 0 H GLU B 9 9.777 -6.721 6.258 1.00 0.00 H new ATOM 0 HA GLU B 9 9.406 -8.933 4.362 1.00 0.00 H new ATOM 0 HB2 GLU B 9 10.700 -6.278 3.729 1.00 0.00 H new ATOM 0 HB3 GLU B 9 10.967 -7.737 2.797 1.00 0.00 H new ATOM 0 HG2 GLU B 9 8.325 -7.801 2.672 1.00 0.00 H new ATOM 0 HG3 GLU B 9 8.452 -6.101 3.076 1.00 0.00 H new ATOM 928 N VAL B 10 11.648 -9.768 5.003 1.00 0.00 N ATOM 929 CA VAL B 10 12.827 -10.397 5.552 1.00 0.00 C ATOM 930 C VAL B 10 13.626 -10.992 4.412 1.00 0.00 C ATOM 931 O VAL B 10 13.059 -11.440 3.418 1.00 0.00 O ATOM 932 CB VAL B 10 12.451 -11.490 6.585 1.00 0.00 C ATOM 933 CG1 VAL B 10 11.572 -12.562 5.959 1.00 0.00 C ATOM 934 CG2 VAL B 10 13.694 -12.115 7.208 1.00 0.00 C ATOM 0 H VAL B 10 11.117 -10.365 4.369 1.00 0.00 H new ATOM 0 HA VAL B 10 13.424 -9.651 6.077 1.00 0.00 H new ATOM 0 HB VAL B 10 11.882 -11.005 7.378 1.00 0.00 H new ATOM 0 HG11 VAL B 10 11.326 -13.314 6.709 1.00 0.00 H new ATOM 0 HG12 VAL B 10 10.654 -12.108 5.585 1.00 0.00 H new ATOM 0 HG13 VAL B 10 12.105 -13.034 5.134 1.00 0.00 H new ATOM 0 HG21 VAL B 10 13.396 -12.877 7.928 1.00 0.00 H new ATOM 0 HG22 VAL B 10 14.302 -12.571 6.427 1.00 0.00 H new ATOM 0 HG23 VAL B 10 14.274 -11.344 7.715 1.00 0.00 H new ATOM 944 N ALA B 11 14.935 -10.968 4.535 1.00 0.00 N ATOM 945 CA ALA B 11 15.799 -11.438 3.473 1.00 0.00 C ATOM 946 C ALA B 11 15.604 -12.931 3.222 1.00 0.00 C ATOM 947 O ALA B 11 15.593 -13.735 4.153 1.00 0.00 O ATOM 948 CB ALA B 11 17.238 -11.117 3.843 1.00 0.00 C ATOM 0 H ALA B 11 15.426 -10.627 5.362 1.00 0.00 H new ATOM 0 HA ALA B 11 15.545 -10.931 2.542 1.00 0.00 H new ATOM 0 HB1 ALA B 11 17.903 -11.465 3.053 1.00 0.00 H new ATOM 0 HB2 ALA B 11 17.351 -10.040 3.964 1.00 0.00 H new ATOM 0 HB3 ALA B 11 17.493 -11.616 4.778 1.00 0.00 H new ATOM 954 N CYS B 12 15.437 -13.277 1.944 1.00 0.00 N ATOM 955 CA CYS B 12 15.074 -14.622 1.499 1.00 0.00 C ATOM 956 C CYS B 12 16.122 -15.691 1.880 1.00 0.00 C ATOM 957 O CYS B 12 17.224 -15.347 2.301 1.00 0.00 O ATOM 958 CB CYS B 12 14.942 -14.551 -0.029 1.00 0.00 C ATOM 959 SG CYS B 12 13.646 -15.584 -0.751 1.00 0.00 S ATOM 0 H CYS B 12 15.553 -12.617 1.175 1.00 0.00 H new ATOM 0 HA CYS B 12 14.148 -14.924 1.988 1.00 0.00 H new ATOM 0 HB2 CYS B 12 14.755 -13.515 -0.312 1.00 0.00 H new ATOM 0 HB3 CYS B 12 15.897 -14.835 -0.472 1.00 0.00 H new ATOM 964 N PRO B 13 15.799 -17.003 1.748 1.00 0.00 N ATOM 965 CA PRO B 13 16.783 -18.079 1.921 1.00 0.00 C ATOM 966 C PRO B 13 18.114 -17.840 1.184 1.00 0.00 C ATOM 967 O PRO B 13 19.174 -18.133 1.719 1.00 0.00 O ATOM 968 CB PRO B 13 16.072 -19.278 1.303 1.00 0.00 C ATOM 969 CG PRO B 13 14.637 -19.051 1.598 1.00 0.00 C ATOM 970 CD PRO B 13 14.447 -17.556 1.483 1.00 0.00 C ATOM 0 HA PRO B 13 17.067 -18.185 2.968 1.00 0.00 H new ATOM 0 HB2 PRO B 13 16.252 -19.336 0.230 1.00 0.00 H new ATOM 0 HB3 PRO B 13 16.423 -20.214 1.737 1.00 0.00 H new ATOM 0 HG2 PRO B 13 14.000 -19.585 0.893 1.00 0.00 H new ATOM 0 HG3 PRO B 13 14.378 -19.406 2.595 1.00 0.00 H new ATOM 0 HD2 PRO B 13 14.087 -17.274 0.494 1.00 0.00 H new ATOM 0 HD3 PRO B 13 13.717 -17.189 2.205 1.00 0.00 H new ATOM 978 N LYS B 14 18.067 -17.297 -0.048 1.00 0.00 N ATOM 979 CA LYS B 14 19.253 -17.346 -0.910 1.00 0.00 C ATOM 980 C LYS B 14 19.427 -16.123 -1.824 1.00 0.00 C ATOM 981 O LYS B 14 20.539 -15.795 -2.245 1.00 0.00 O ATOM 982 CB LYS B 14 19.197 -18.615 -1.760 1.00 0.00 C ATOM 983 CG LYS B 14 20.307 -18.712 -2.798 1.00 0.00 C ATOM 984 CD LYS B 14 20.345 -20.074 -3.487 1.00 0.00 C ATOM 985 CE LYS B 14 21.318 -20.073 -4.658 1.00 0.00 C ATOM 986 NZ LYS B 14 21.503 -21.431 -5.222 1.00 0.00 N ATOM 0 H LYS B 14 17.252 -16.837 -0.453 1.00 0.00 H new ATOM 0 HA LYS B 14 20.117 -17.345 -0.245 1.00 0.00 H new ATOM 0 HB2 LYS B 14 19.250 -19.483 -1.103 1.00 0.00 H new ATOM 0 HB3 LYS B 14 18.233 -18.658 -2.268 1.00 0.00 H new ATOM 0 HG2 LYS B 14 20.168 -17.933 -3.548 1.00 0.00 H new ATOM 0 HG3 LYS B 14 21.267 -18.525 -2.317 1.00 0.00 H new ATOM 0 HD2 LYS B 14 20.638 -20.840 -2.769 1.00 0.00 H new ATOM 0 HD3 LYS B 14 19.347 -20.333 -3.840 1.00 0.00 H new ATOM 0 HE2 LYS B 14 20.950 -19.404 -5.436 1.00 0.00 H new ATOM 0 HE3 LYS B 14 22.281 -19.682 -4.330 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 22.518 -21.617 -5.354 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 21.104 -22.135 -4.569 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 21.017 -21.495 -6.139 1.00 0.00 H new ATOM 1000 N CYS B 15 18.336 -15.436 -2.130 1.00 0.00 N ATOM 1001 CA CYS B 15 18.434 -14.425 -3.203 1.00 0.00 C ATOM 1002 C CYS B 15 18.181 -12.992 -2.740 1.00 0.00 C ATOM 1003 O CYS B 15 17.635 -12.178 -3.479 1.00 0.00 O ATOM 1004 CB CYS B 15 17.409 -14.803 -4.283 1.00 0.00 C ATOM 1005 SG CYS B 15 15.774 -15.117 -3.561 1.00 0.00 S ATOM 0 H CYS B 15 17.421 -15.539 -1.690 1.00 0.00 H new ATOM 0 HA CYS B 15 19.459 -14.434 -3.575 1.00 0.00 H new ATOM 0 HB2 CYS B 15 17.337 -13.999 -5.016 1.00 0.00 H new ATOM 0 HB3 CYS B 15 17.750 -15.691 -4.816 1.00 0.00 H new ATOM 0 HG CYS B 15 14.988 -14.112 -3.813 1.00 0.00 H new ATOM 1010 N GLU B 16 18.717 -12.644 -1.579 1.00 0.00 N ATOM 1011 CA GLU B 16 18.561 -11.303 -1.022 1.00 0.00 C ATOM 1012 C GLU B 16 19.682 -10.403 -1.478 1.00 0.00 C ATOM 1013 O GLU B 16 20.119 -9.500 -0.754 1.00 0.00 O ATOM 1014 CB GLU B 16 18.572 -11.345 0.522 1.00 0.00 C ATOM 1015 CG GLU B 16 18.389 -12.734 1.108 1.00 0.00 C ATOM 1016 CD GLU B 16 19.679 -13.516 1.177 1.00 0.00 C ATOM 1017 OE1 GLU B 16 20.523 -13.235 2.056 1.00 0.00 O ATOM 1018 OE2 GLU B 16 19.854 -14.406 0.338 1.00 0.00 O ATOM 0 H GLU B 16 19.269 -13.276 -0.998 1.00 0.00 H new ATOM 0 HA GLU B 16 17.605 -10.914 -1.374 1.00 0.00 H new ATOM 0 HB2 GLU B 16 19.516 -10.934 0.879 1.00 0.00 H new ATOM 0 HB3 GLU B 16 17.780 -10.697 0.898 1.00 0.00 H new ATOM 0 HG2 GLU B 16 17.968 -12.648 2.110 1.00 0.00 H new ATOM 0 HG3 GLU B 16 17.667 -13.285 0.505 1.00 0.00 H new ATOM 1025 N ARG B 17 20.145 -10.612 -2.708 1.00 0.00 N ATOM 1026 CA ARG B 17 21.278 -9.899 -3.241 1.00 0.00 C ATOM 1027 C ARG B 17 21.089 -9.791 -4.754 1.00 0.00 C ATOM 1028 O ARG B 17 21.595 -8.879 -5.395 1.00 0.00 O ATOM 1029 CB ARG B 17 22.582 -10.626 -2.906 1.00 0.00 C ATOM 1030 CG ARG B 17 22.606 -12.082 -3.344 1.00 0.00 C ATOM 1031 CD ARG B 17 23.757 -12.832 -2.694 1.00 0.00 C ATOM 1032 NE ARG B 17 23.799 -12.576 -1.255 1.00 0.00 N ATOM 1033 CZ ARG B 17 22.962 -13.128 -0.380 1.00 0.00 C ATOM 1034 NH1 ARG B 17 22.169 -14.119 -0.758 1.00 0.00 N ATOM 1035 NH2 ARG B 17 22.942 -12.719 0.880 1.00 0.00 N ATOM 0 H ARG B 17 19.736 -11.285 -3.356 1.00 0.00 H new ATOM 0 HA ARG B 17 21.342 -8.905 -2.798 1.00 0.00 H new ATOM 0 HB2 ARG B 17 23.411 -10.101 -3.380 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.747 -10.578 -1.830 1.00 0.00 H new ATOM 0 HG2 ARG B 17 21.662 -12.559 -3.080 1.00 0.00 H new ATOM 0 HG3 ARG B 17 22.699 -12.137 -4.429 1.00 0.00 H new ATOM 0 HD2 ARG B 17 23.648 -13.901 -2.874 1.00 0.00 H new ATOM 0 HD3 ARG B 17 24.699 -12.527 -3.150 1.00 0.00 H new ATOM 0 HE ARG B 17 24.511 -11.937 -0.901 1.00 0.00 H new ATOM 0 HH11 ARG B 17 22.200 -14.459 -1.719 1.00 0.00 H new ATOM 0 HH12 ARG B 17 21.527 -14.543 -0.088 1.00 0.00 H new ATOM 0 HH21 ARG B 17 23.571 -11.976 1.185 1.00 0.00 H new ATOM 0 HH22 ARG B 17 22.298 -13.147 1.545 1.00 0.00 H new ATOM 1049 N ALA B 18 20.331 -10.753 -5.314 1.00 0.00 N ATOM 1050 CA ALA B 18 20.248 -10.903 -6.767 1.00 0.00 C ATOM 1051 C ALA B 18 18.818 -10.893 -7.308 1.00 0.00 C ATOM 1052 O ALA B 18 18.555 -10.295 -8.348 1.00 0.00 O ATOM 1053 CB ALA B 18 20.961 -12.173 -7.214 1.00 0.00 C ATOM 0 H ALA B 18 19.777 -11.426 -4.785 1.00 0.00 H new ATOM 0 HA ALA B 18 20.744 -10.027 -7.185 1.00 0.00 H new ATOM 0 HB1 ALA B 18 20.889 -12.268 -8.297 1.00 0.00 H new ATOM 0 HB2 ALA B 18 22.010 -12.123 -6.923 1.00 0.00 H new ATOM 0 HB3 ALA B 18 20.494 -13.038 -6.742 1.00 0.00 H new ATOM 1059 N GLY B 19 17.889 -11.533 -6.602 1.00 0.00 N ATOM 1060 CA GLY B 19 16.527 -11.611 -7.111 1.00 0.00 C ATOM 1061 C GLY B 19 16.251 -12.863 -7.928 1.00 0.00 C ATOM 1062 O GLY B 19 15.323 -12.884 -8.730 1.00 0.00 O ATOM 0 H GLY B 19 18.048 -11.991 -5.704 1.00 0.00 H new ATOM 0 HA2 GLY B 19 15.832 -11.575 -6.272 1.00 0.00 H new ATOM 0 HA3 GLY B 19 16.328 -10.734 -7.727 1.00 0.00 H new ATOM 1066 N GLU B 20 17.026 -13.916 -7.702 1.00 0.00 N ATOM 1067 CA GLU B 20 16.873 -15.156 -8.456 1.00 0.00 C ATOM 1068 C GLU B 20 17.346 -16.351 -7.638 1.00 0.00 C ATOM 1069 O GLU B 20 18.117 -16.207 -6.693 1.00 0.00 O ATOM 1070 CB GLU B 20 17.665 -15.101 -9.768 1.00 0.00 C ATOM 1071 CG GLU B 20 19.074 -14.557 -9.598 1.00 0.00 C ATOM 1072 CD GLU B 20 19.984 -14.926 -10.747 1.00 0.00 C ATOM 1073 OE1 GLU B 20 19.948 -14.242 -11.787 1.00 0.00 O ATOM 1074 OE2 GLU B 20 20.752 -15.903 -10.608 1.00 0.00 O ATOM 0 H GLU B 20 17.768 -13.937 -7.002 1.00 0.00 H new ATOM 0 HA GLU B 20 15.813 -15.271 -8.681 1.00 0.00 H new ATOM 0 HB2 GLU B 20 17.719 -16.103 -10.194 1.00 0.00 H new ATOM 0 HB3 GLU B 20 17.127 -14.479 -10.483 1.00 0.00 H new ATOM 0 HG2 GLU B 20 19.032 -13.472 -9.508 1.00 0.00 H new ATOM 0 HG3 GLU B 20 19.497 -14.938 -8.668 1.00 0.00 H new ATOM 1081 N ILE B 21 16.875 -17.521 -8.020 1.00 0.00 N ATOM 1082 CA ILE B 21 17.311 -18.782 -7.440 1.00 0.00 C ATOM 1083 C ILE B 21 17.799 -19.648 -8.571 1.00 0.00 C ATOM 1084 O ILE B 21 16.999 -20.211 -9.316 1.00 0.00 O ATOM 1085 CB ILE B 21 16.183 -19.534 -6.693 1.00 0.00 C ATOM 1086 CG1 ILE B 21 15.731 -18.760 -5.445 1.00 0.00 C ATOM 1087 CG2 ILE B 21 16.612 -20.949 -6.295 1.00 0.00 C ATOM 1088 CD1 ILE B 21 16.793 -18.669 -4.359 1.00 0.00 C ATOM 0 H ILE B 21 16.171 -17.628 -8.750 1.00 0.00 H new ATOM 0 HA ILE B 21 18.087 -18.568 -6.705 1.00 0.00 H new ATOM 0 HB ILE B 21 15.344 -19.611 -7.385 1.00 0.00 H new ATOM 0 HG12 ILE B 21 15.440 -17.752 -5.740 1.00 0.00 H new ATOM 0 HG13 ILE B 21 14.844 -19.241 -5.033 1.00 0.00 H new ATOM 0 HG21 ILE B 21 15.793 -21.444 -5.773 1.00 0.00 H new ATOM 0 HG22 ILE B 21 16.868 -21.517 -7.190 1.00 0.00 H new ATOM 0 HG23 ILE B 21 17.481 -20.895 -5.639 1.00 0.00 H new ATOM 0 HD11 ILE B 21 16.399 -18.108 -3.511 1.00 0.00 H new ATOM 0 HD12 ILE B 21 17.068 -19.672 -4.034 1.00 0.00 H new ATOM 0 HD13 ILE B 21 17.673 -18.161 -4.753 1.00 0.00 H new ATOM 1100 N GLU B 22 19.108 -19.731 -8.693 1.00 0.00 N ATOM 1101 CA GLU B 22 19.726 -20.497 -9.754 1.00 0.00 C ATOM 1102 C GLU B 22 19.396 -19.911 -11.135 1.00 0.00 C ATOM 1103 O GLU B 22 18.961 -20.634 -12.025 1.00 0.00 O ATOM 1104 CB GLU B 22 19.209 -21.929 -9.646 1.00 0.00 C ATOM 1105 CG GLU B 22 20.290 -22.976 -9.695 1.00 0.00 C ATOM 1106 CD GLU B 22 21.254 -22.798 -8.537 1.00 0.00 C ATOM 1107 OE1 GLU B 22 20.882 -23.138 -7.395 1.00 0.00 O ATOM 1108 OE2 GLU B 22 22.368 -22.280 -8.751 1.00 0.00 O ATOM 0 H GLU B 22 19.768 -19.273 -8.065 1.00 0.00 H new ATOM 0 HA GLU B 22 20.810 -20.467 -9.649 1.00 0.00 H new ATOM 0 HB2 GLU B 22 18.657 -22.035 -8.712 1.00 0.00 H new ATOM 0 HB3 GLU B 22 18.503 -22.112 -10.457 1.00 0.00 H new ATOM 0 HG2 GLU B 22 19.844 -23.970 -9.655 1.00 0.00 H new ATOM 0 HG3 GLU B 22 20.830 -22.906 -10.639 1.00 0.00 H new ATOM 1115 N GLY B 23 19.580 -18.598 -11.311 1.00 0.00 N ATOM 1116 CA GLY B 23 19.224 -17.956 -12.581 1.00 0.00 C ATOM 1117 C GLY B 23 17.745 -18.066 -12.902 1.00 0.00 C ATOM 1118 O GLY B 23 17.295 -17.745 -14.001 1.00 0.00 O ATOM 0 H GLY B 23 19.965 -17.970 -10.606 1.00 0.00 H new ATOM 0 HA2 GLY B 23 19.505 -16.904 -12.542 1.00 0.00 H new ATOM 0 HA3 GLY B 23 19.801 -18.410 -13.387 1.00 0.00 H new ATOM 1122 N THR B 24 17.011 -18.517 -11.921 1.00 0.00 N ATOM 1123 CA THR B 24 15.627 -18.898 -12.077 1.00 0.00 C ATOM 1124 C THR B 24 14.743 -18.125 -11.087 1.00 0.00 C ATOM 1125 O THR B 24 15.168 -17.833 -9.972 1.00 0.00 O ATOM 1126 CB THR B 24 15.563 -20.430 -11.873 1.00 0.00 C ATOM 1127 OG1 THR B 24 15.648 -21.102 -13.138 1.00 0.00 O ATOM 1128 CG2 THR B 24 14.326 -20.891 -11.117 1.00 0.00 C ATOM 0 H THR B 24 17.362 -18.633 -10.971 1.00 0.00 H new ATOM 0 HA THR B 24 15.245 -18.648 -13.067 1.00 0.00 H new ATOM 0 HB THR B 24 16.419 -20.693 -11.252 1.00 0.00 H new ATOM 0 HG1 THR B 24 15.608 -22.071 -12.997 1.00 0.00 H new ATOM 0 HG21 THR B 24 14.348 -21.976 -11.011 1.00 0.00 H new ATOM 0 HG22 THR B 24 14.310 -20.430 -10.129 1.00 0.00 H new ATOM 0 HG23 THR B 24 13.432 -20.598 -11.668 1.00 0.00 H new ATOM 1136 N PRO B 25 13.518 -17.749 -11.503 1.00 0.00 N ATOM 1137 CA PRO B 25 12.609 -16.939 -10.677 1.00 0.00 C ATOM 1138 C PRO B 25 12.337 -17.575 -9.313 1.00 0.00 C ATOM 1139 O PRO B 25 12.068 -18.772 -9.210 1.00 0.00 O ATOM 1140 CB PRO B 25 11.326 -16.853 -11.520 1.00 0.00 C ATOM 1141 CG PRO B 25 11.440 -17.968 -12.503 1.00 0.00 C ATOM 1142 CD PRO B 25 12.908 -18.085 -12.799 1.00 0.00 C ATOM 0 HA PRO B 25 13.032 -15.962 -10.443 1.00 0.00 H new ATOM 0 HB2 PRO B 25 10.437 -16.963 -10.899 1.00 0.00 H new ATOM 0 HB3 PRO B 25 11.247 -15.889 -12.023 1.00 0.00 H new ATOM 0 HG2 PRO B 25 11.046 -18.897 -12.091 1.00 0.00 H new ATOM 0 HG3 PRO B 25 10.872 -17.754 -13.408 1.00 0.00 H new ATOM 0 HD2 PRO B 25 13.178 -19.089 -13.127 1.00 0.00 H new ATOM 0 HD3 PRO B 25 13.220 -17.398 -13.586 1.00 0.00 H new ATOM 1150 N CYS B 26 12.411 -16.762 -8.263 1.00 0.00 N ATOM 1151 CA CYS B 26 12.346 -17.264 -6.896 1.00 0.00 C ATOM 1152 C CYS B 26 10.904 -17.341 -6.353 1.00 0.00 C ATOM 1153 O CYS B 26 10.144 -16.385 -6.469 1.00 0.00 O ATOM 1154 CB CYS B 26 13.197 -16.373 -5.996 1.00 0.00 C ATOM 1155 SG CYS B 26 13.163 -16.842 -4.233 1.00 0.00 S ATOM 0 H CYS B 26 12.516 -15.750 -8.334 1.00 0.00 H new ATOM 0 HA CYS B 26 12.732 -18.283 -6.901 1.00 0.00 H new ATOM 0 HB2 CYS B 26 14.228 -16.399 -6.348 1.00 0.00 H new ATOM 0 HB3 CYS B 26 12.853 -15.343 -6.093 1.00 0.00 H new ATOM 1160 N PRO B 27 10.571 -18.485 -5.699 1.00 0.00 N ATOM 1161 CA PRO B 27 9.240 -18.832 -5.146 1.00 0.00 C ATOM 1162 C PRO B 27 8.360 -17.666 -4.682 1.00 0.00 C ATOM 1163 O PRO B 27 7.241 -17.486 -5.159 1.00 0.00 O ATOM 1164 CB PRO B 27 9.633 -19.665 -3.927 1.00 0.00 C ATOM 1165 CG PRO B 27 10.907 -20.354 -4.293 1.00 0.00 C ATOM 1166 CD PRO B 27 11.509 -19.596 -5.464 1.00 0.00 C ATOM 0 HA PRO B 27 8.628 -19.306 -5.913 1.00 0.00 H new ATOM 0 HB2 PRO B 27 9.769 -19.033 -3.050 1.00 0.00 H new ATOM 0 HB3 PRO B 27 8.855 -20.388 -3.681 1.00 0.00 H new ATOM 0 HG2 PRO B 27 11.595 -20.365 -3.448 1.00 0.00 H new ATOM 0 HG3 PRO B 27 10.718 -21.393 -4.564 1.00 0.00 H new ATOM 0 HD2 PRO B 27 12.508 -19.230 -5.229 1.00 0.00 H new ATOM 0 HD3 PRO B 27 11.601 -20.232 -6.344 1.00 0.00 H new ATOM 1174 N ALA B 28 8.880 -16.883 -3.750 1.00 0.00 N ATOM 1175 CA ALA B 28 8.066 -15.901 -3.035 1.00 0.00 C ATOM 1176 C ALA B 28 8.585 -14.485 -3.236 1.00 0.00 C ATOM 1177 O ALA B 28 7.951 -13.513 -2.831 1.00 0.00 O ATOM 1178 CB ALA B 28 8.017 -16.241 -1.555 1.00 0.00 C ATOM 0 H ALA B 28 9.860 -16.905 -3.468 1.00 0.00 H new ATOM 0 HA ALA B 28 7.057 -15.942 -3.446 1.00 0.00 H new ATOM 0 HB1 ALA B 28 7.408 -15.503 -1.032 1.00 0.00 H new ATOM 0 HB2 ALA B 28 7.580 -17.231 -1.423 1.00 0.00 H new ATOM 0 HB3 ALA B 28 9.027 -16.233 -1.146 1.00 0.00 H new ATOM 1184 N CYS B 29 9.745 -14.371 -3.846 1.00 0.00 N ATOM 1185 CA CYS B 29 10.307 -13.065 -4.129 1.00 0.00 C ATOM 1186 C CYS B 29 10.744 -13.007 -5.584 1.00 0.00 C ATOM 1187 O CYS B 29 11.852 -13.421 -5.926 1.00 0.00 O ATOM 1188 CB CYS B 29 11.480 -12.756 -3.181 1.00 0.00 C ATOM 1189 SG CYS B 29 12.966 -13.760 -3.433 1.00 0.00 S ATOM 0 H CYS B 29 10.315 -15.159 -4.154 1.00 0.00 H new ATOM 0 HA CYS B 29 9.546 -12.303 -3.961 1.00 0.00 H new ATOM 0 HB2 CYS B 29 11.748 -11.705 -3.293 1.00 0.00 H new ATOM 0 HB3 CYS B 29 11.141 -12.891 -2.154 1.00 0.00 H new ATOM 0 HG CYS B 29 12.622 -14.978 -3.729 1.00 0.00 H new ATOM 1194 N SER B 30 9.862 -12.521 -6.444 1.00 0.00 N ATOM 1195 CA SER B 30 10.129 -12.475 -7.875 1.00 0.00 C ATOM 1196 C SER B 30 11.024 -11.286 -8.222 1.00 0.00 C ATOM 1197 O SER B 30 10.644 -10.402 -8.992 1.00 0.00 O ATOM 1198 CB SER B 30 8.805 -12.401 -8.651 1.00 0.00 C ATOM 1199 OG SER B 30 8.996 -12.646 -10.035 1.00 0.00 O ATOM 0 H SER B 30 8.950 -12.151 -6.175 1.00 0.00 H new ATOM 0 HA SER B 30 10.655 -13.385 -8.162 1.00 0.00 H new ATOM 0 HB2 SER B 30 8.104 -13.130 -8.245 1.00 0.00 H new ATOM 0 HB3 SER B 30 8.357 -11.417 -8.514 1.00 0.00 H new ATOM 0 HG SER B 30 9.639 -12.001 -10.396 1.00 0.00 H new ATOM 1205 N GLY B 31 12.201 -11.259 -7.615 1.00 0.00 N ATOM 1206 CA GLY B 31 13.202 -10.286 -7.978 1.00 0.00 C ATOM 1207 C GLY B 31 13.203 -9.066 -7.084 1.00 0.00 C ATOM 1208 O GLY B 31 13.248 -7.939 -7.569 1.00 0.00 O ATOM 0 H GLY B 31 12.479 -11.900 -6.872 1.00 0.00 H new ATOM 0 HA2 GLY B 31 14.185 -10.755 -7.941 1.00 0.00 H new ATOM 0 HA3 GLY B 31 13.037 -9.972 -9.009 1.00 0.00 H new ATOM 1212 N LYS B 32 13.152 -9.277 -5.772 1.00 0.00 N ATOM 1213 CA LYS B 32 13.254 -8.181 -4.819 1.00 0.00 C ATOM 1214 C LYS B 32 14.477 -8.398 -3.931 1.00 0.00 C ATOM 1215 O LYS B 32 15.252 -7.484 -3.669 1.00 0.00 O ATOM 1216 CB LYS B 32 12.016 -8.131 -3.922 1.00 0.00 C ATOM 1217 CG LYS B 32 10.693 -8.063 -4.664 1.00 0.00 C ATOM 1218 CD LYS B 32 9.526 -8.008 -3.689 1.00 0.00 C ATOM 1219 CE LYS B 32 9.488 -9.231 -2.784 1.00 0.00 C ATOM 1220 NZ LYS B 32 8.441 -9.120 -1.736 1.00 0.00 N ATOM 0 H LYS B 32 13.041 -10.197 -5.346 1.00 0.00 H new ATOM 0 HA LYS B 32 13.339 -7.247 -5.375 1.00 0.00 H new ATOM 0 HB2 LYS B 32 12.013 -9.014 -3.282 1.00 0.00 H new ATOM 0 HB3 LYS B 32 12.094 -7.263 -3.267 1.00 0.00 H new ATOM 0 HG2 LYS B 32 10.677 -7.183 -5.307 1.00 0.00 H new ATOM 0 HG3 LYS B 32 10.590 -8.933 -5.312 1.00 0.00 H new ATOM 0 HD2 LYS B 32 9.603 -7.107 -3.080 1.00 0.00 H new ATOM 0 HD3 LYS B 32 8.591 -7.938 -4.245 1.00 0.00 H new ATOM 0 HE2 LYS B 32 9.304 -10.121 -3.386 1.00 0.00 H new ATOM 0 HE3 LYS B 32 10.461 -9.361 -2.311 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 8.359 -10.025 -1.230 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 8.701 -8.370 -1.064 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 7.529 -8.887 -2.179 1.00 0.00 H new ATOM 1234 N GLY B 33 14.630 -9.641 -3.469 1.00 0.00 N ATOM 1235 CA GLY B 33 15.671 -9.984 -2.536 1.00 0.00 C ATOM 1236 C GLY B 33 15.077 -10.466 -1.231 1.00 0.00 C ATOM 1237 O GLY B 33 15.543 -11.442 -0.644 1.00 0.00 O ATOM 0 H GLY B 33 14.033 -10.423 -3.737 1.00 0.00 H new ATOM 0 HA2 GLY B 33 16.307 -10.760 -2.961 1.00 0.00 H new ATOM 0 HA3 GLY B 33 16.305 -9.116 -2.355 1.00 0.00 H new ATOM 1241 N VAL B 34 13.993 -9.826 -0.821 1.00 0.00 N ATOM 1242 CA VAL B 34 13.349 -10.133 0.449 1.00 0.00 C ATOM 1243 C VAL B 34 11.974 -10.780 0.250 1.00 0.00 C ATOM 1244 O VAL B 34 11.404 -10.736 -0.845 1.00 0.00 O ATOM 1245 CB VAL B 34 13.191 -8.852 1.297 1.00 0.00 C ATOM 1246 CG1 VAL B 34 14.550 -8.308 1.712 1.00 0.00 C ATOM 1247 CG2 VAL B 34 12.415 -7.794 0.527 1.00 0.00 C ATOM 0 H VAL B 34 13.537 -9.085 -1.353 1.00 0.00 H new ATOM 0 HA VAL B 34 13.990 -10.844 0.970 1.00 0.00 H new ATOM 0 HB VAL B 34 12.633 -9.109 2.197 1.00 0.00 H new ATOM 0 HG11 VAL B 34 14.414 -7.406 2.308 1.00 0.00 H new ATOM 0 HG12 VAL B 34 15.077 -9.057 2.303 1.00 0.00 H new ATOM 0 HG13 VAL B 34 15.134 -8.071 0.823 1.00 0.00 H new ATOM 0 HG21 VAL B 34 12.314 -6.899 1.140 1.00 0.00 H new ATOM 0 HG22 VAL B 34 12.949 -7.547 -0.390 1.00 0.00 H new ATOM 0 HG23 VAL B 34 11.425 -8.177 0.279 1.00 0.00 H new ATOM 1257 N ILE B 35 11.476 -11.402 1.312 1.00 0.00 N ATOM 1258 CA ILE B 35 10.143 -11.999 1.332 1.00 0.00 C ATOM 1259 C ILE B 35 9.321 -11.427 2.483 1.00 0.00 C ATOM 1260 O ILE B 35 9.873 -10.902 3.441 1.00 0.00 O ATOM 1261 CB ILE B 35 10.200 -13.536 1.461 1.00 0.00 C ATOM 1262 CG1 ILE B 35 11.194 -13.944 2.549 1.00 0.00 C ATOM 1263 CG2 ILE B 35 10.571 -14.166 0.128 1.00 0.00 C ATOM 1264 CD1 ILE B 35 11.234 -15.433 2.820 1.00 0.00 C ATOM 0 H ILE B 35 11.987 -11.508 2.189 1.00 0.00 H new ATOM 0 HA ILE B 35 9.669 -11.754 0.381 1.00 0.00 H new ATOM 0 HB ILE B 35 9.213 -13.898 1.748 1.00 0.00 H new ATOM 0 HG12 ILE B 35 12.191 -13.611 2.259 1.00 0.00 H new ATOM 0 HG13 ILE B 35 10.940 -13.424 3.473 1.00 0.00 H new ATOM 0 HG21 ILE B 35 10.607 -15.250 0.235 1.00 0.00 H new ATOM 0 HG22 ILE B 35 9.824 -13.900 -0.620 1.00 0.00 H new ATOM 0 HG23 ILE B 35 11.548 -13.800 -0.188 1.00 0.00 H new ATOM 0 HD11 ILE B 35 11.963 -15.641 3.604 1.00 0.00 H new ATOM 0 HD12 ILE B 35 10.249 -15.771 3.142 1.00 0.00 H new ATOM 0 HD13 ILE B 35 11.519 -15.961 1.910 1.00 0.00 H new ATOM 1276 N LEU B 36 8.005 -11.536 2.380 1.00 0.00 N ATOM 1277 CA LEU B 36 7.106 -10.861 3.311 1.00 0.00 C ATOM 1278 C LEU B 36 6.817 -11.677 4.563 1.00 0.00 C ATOM 1279 O LEU B 36 7.021 -12.892 4.606 1.00 0.00 O ATOM 1280 CB LEU B 36 5.779 -10.532 2.621 1.00 0.00 C ATOM 1281 CG LEU B 36 5.899 -9.688 1.354 1.00 0.00 C ATOM 1282 CD1 LEU B 36 5.934 -10.569 0.113 1.00 0.00 C ATOM 1283 CD2 LEU B 36 4.763 -8.692 1.280 1.00 0.00 C ATOM 0 H LEU B 36 7.533 -12.085 1.661 1.00 0.00 H new ATOM 0 HA LEU B 36 7.618 -9.950 3.620 1.00 0.00 H new ATOM 0 HB2 LEU B 36 5.276 -11.466 2.370 1.00 0.00 H new ATOM 0 HB3 LEU B 36 5.139 -10.006 3.330 1.00 0.00 H new ATOM 0 HG LEU B 36 6.839 -9.137 1.394 1.00 0.00 H new ATOM 0 HD11 LEU B 36 6.020 -9.943 -0.775 1.00 0.00 H new ATOM 0 HD12 LEU B 36 6.791 -11.241 0.168 1.00 0.00 H new ATOM 0 HD13 LEU B 36 5.017 -11.155 0.057 1.00 0.00 H new ATOM 0 HD21 LEU B 36 4.860 -8.096 0.372 1.00 0.00 H new ATOM 0 HD22 LEU B 36 3.812 -9.225 1.265 1.00 0.00 H new ATOM 0 HD23 LEU B 36 4.797 -8.036 2.150 1.00 0.00 H new ATOM 1295 N THR B 37 6.330 -10.974 5.578 1.00 0.00 N ATOM 1296 CA THR B 37 5.855 -11.584 6.805 1.00 0.00 C ATOM 1297 C THR B 37 4.333 -11.530 6.815 1.00 0.00 C ATOM 1298 O THR B 37 3.752 -10.907 5.933 1.00 0.00 O ATOM 1299 CB THR B 37 6.394 -10.834 8.042 1.00 0.00 C ATOM 1300 OG1 THR B 37 5.887 -9.490 8.061 1.00 0.00 O ATOM 1301 CG2 THR B 37 7.915 -10.790 8.036 1.00 0.00 C ATOM 0 H THR B 37 6.255 -9.957 5.569 1.00 0.00 H new ATOM 0 HA THR B 37 6.208 -12.614 6.847 1.00 0.00 H new ATOM 0 HB THR B 37 6.060 -11.371 8.930 1.00 0.00 H new ATOM 0 HG1 THR B 37 6.400 -8.956 8.703 1.00 0.00 H new ATOM 0 HG21 THR B 37 8.267 -10.256 8.919 1.00 0.00 H new ATOM 0 HG22 THR B 37 8.308 -11.806 8.046 1.00 0.00 H new ATOM 0 HG23 THR B 37 8.261 -10.276 7.139 1.00 0.00 H new ATOM 1309 N ALA B 38 3.688 -12.154 7.790 1.00 0.00 N ATOM 1310 CA ALA B 38 2.226 -12.181 7.845 1.00 0.00 C ATOM 1311 C ALA B 38 1.634 -10.773 7.793 1.00 0.00 C ATOM 1312 O ALA B 38 0.656 -10.531 7.079 1.00 0.00 O ATOM 1313 CB ALA B 38 1.762 -12.914 9.088 1.00 0.00 C ATOM 0 H ALA B 38 4.149 -12.648 8.554 1.00 0.00 H new ATOM 0 HA ALA B 38 1.867 -12.717 6.966 1.00 0.00 H new ATOM 0 HB1 ALA B 38 0.672 -12.927 9.117 1.00 0.00 H new ATOM 0 HB2 ALA B 38 2.137 -13.937 9.068 1.00 0.00 H new ATOM 0 HB3 ALA B 38 2.143 -12.405 9.974 1.00 0.00 H new ATOM 1319 N GLN B 39 2.226 -9.847 8.539 1.00 0.00 N ATOM 1320 CA GLN B 39 1.800 -8.453 8.499 1.00 0.00 C ATOM 1321 C GLN B 39 1.950 -7.883 7.093 1.00 0.00 C ATOM 1322 O GLN B 39 1.046 -7.219 6.585 1.00 0.00 O ATOM 1323 CB GLN B 39 2.602 -7.612 9.489 1.00 0.00 C ATOM 1324 CG GLN B 39 2.199 -6.145 9.495 1.00 0.00 C ATOM 1325 CD GLN B 39 2.898 -5.348 10.573 1.00 0.00 C ATOM 1326 OE1 GLN B 39 3.247 -5.880 11.622 1.00 0.00 O ATOM 1327 NE2 GLN B 39 3.095 -4.065 10.322 1.00 0.00 N ATOM 0 H GLN B 39 3.000 -10.035 9.177 1.00 0.00 H new ATOM 0 HA GLN B 39 0.748 -8.417 8.782 1.00 0.00 H new ATOM 0 HB2 GLN B 39 2.473 -8.021 10.491 1.00 0.00 H new ATOM 0 HB3 GLN B 39 3.662 -7.690 9.247 1.00 0.00 H new ATOM 0 HG2 GLN B 39 2.424 -5.707 8.523 1.00 0.00 H new ATOM 0 HG3 GLN B 39 1.121 -6.070 9.636 1.00 0.00 H new ATOM 0 HE21 GLN B 39 2.788 -3.666 9.435 1.00 0.00 H new ATOM 0 HE22 GLN B 39 3.554 -3.474 11.015 1.00 0.00 H new ATOM 1336 N GLY B 40 3.079 -8.172 6.456 1.00 0.00 N ATOM 1337 CA GLY B 40 3.314 -7.679 5.113 1.00 0.00 C ATOM 1338 C GLY B 40 2.424 -8.366 4.102 1.00 0.00 C ATOM 1339 O GLY B 40 2.072 -7.790 3.076 1.00 0.00 O ATOM 0 H GLY B 40 3.834 -8.737 6.845 1.00 0.00 H new ATOM 0 HA2 GLY B 40 3.136 -6.604 5.084 1.00 0.00 H new ATOM 0 HA3 GLY B 40 4.359 -7.837 4.845 1.00 0.00 H new ATOM 1343 N TYR B 41 2.050 -9.601 4.402 1.00 0.00 N ATOM 1344 CA TYR B 41 1.116 -10.342 3.573 1.00 0.00 C ATOM 1345 C TYR B 41 -0.279 -9.750 3.664 1.00 0.00 C ATOM 1346 O TYR B 41 -1.029 -9.758 2.685 1.00 0.00 O ATOM 1347 CB TYR B 41 1.094 -11.812 4.014 1.00 0.00 C ATOM 1348 CG TYR B 41 2.108 -12.688 3.308 1.00 0.00 C ATOM 1349 CD1 TYR B 41 1.904 -13.097 1.998 1.00 0.00 C ATOM 1350 CD2 TYR B 41 3.262 -13.111 3.954 1.00 0.00 C ATOM 1351 CE1 TYR B 41 2.824 -13.899 1.350 1.00 0.00 C ATOM 1352 CE2 TYR B 41 4.186 -13.913 3.314 1.00 0.00 C ATOM 1353 CZ TYR B 41 3.963 -14.305 2.013 1.00 0.00 C ATOM 1354 OH TYR B 41 4.878 -15.108 1.374 1.00 0.00 O ATOM 0 H TYR B 41 2.383 -10.112 5.219 1.00 0.00 H new ATOM 0 HA TYR B 41 1.444 -10.277 2.535 1.00 0.00 H new ATOM 0 HB2 TYR B 41 1.274 -11.860 5.088 1.00 0.00 H new ATOM 0 HB3 TYR B 41 0.097 -12.217 3.840 1.00 0.00 H new ATOM 0 HD1 TYR B 41 1.012 -12.784 1.476 1.00 0.00 H new ATOM 0 HD2 TYR B 41 3.440 -12.807 4.975 1.00 0.00 H new ATOM 0 HE1 TYR B 41 2.652 -14.206 0.329 1.00 0.00 H new ATOM 0 HE2 TYR B 41 5.079 -14.231 3.831 1.00 0.00 H new ATOM 0 HH TYR B 41 5.623 -15.302 1.980 1.00 0.00 H new ATOM 1364 N THR B 42 -0.617 -9.204 4.818 1.00 0.00 N ATOM 1365 CA THR B 42 -1.889 -8.523 4.991 1.00 0.00 C ATOM 1366 C THR B 42 -1.881 -7.204 4.228 1.00 0.00 C ATOM 1367 O THR B 42 -2.904 -6.758 3.700 1.00 0.00 O ATOM 1368 CB THR B 42 -2.161 -8.247 6.482 1.00 0.00 C ATOM 1369 OG1 THR B 42 -1.983 -9.449 7.240 1.00 0.00 O ATOM 1370 CG2 THR B 42 -3.571 -7.718 6.696 1.00 0.00 C ATOM 0 H THR B 42 -0.028 -9.218 5.651 1.00 0.00 H new ATOM 0 HA THR B 42 -2.677 -9.168 4.601 1.00 0.00 H new ATOM 0 HB THR B 42 -1.454 -7.489 6.819 1.00 0.00 H new ATOM 0 HG1 THR B 42 -1.032 -9.687 7.258 1.00 0.00 H new ATOM 0 HG21 THR B 42 -3.733 -7.533 7.758 1.00 0.00 H new ATOM 0 HG22 THR B 42 -3.699 -6.788 6.142 1.00 0.00 H new ATOM 0 HG23 THR B 42 -4.293 -8.454 6.342 1.00 0.00 H new ATOM 1378 N LEU B 43 -0.699 -6.612 4.131 1.00 0.00 N ATOM 1379 CA LEU B 43 -0.552 -5.316 3.500 1.00 0.00 C ATOM 1380 C LEU B 43 -0.349 -5.449 1.995 1.00 0.00 C ATOM 1381 O LEU B 43 -0.597 -4.501 1.261 1.00 0.00 O ATOM 1382 CB LEU B 43 0.615 -4.533 4.123 1.00 0.00 C ATOM 1383 CG LEU B 43 0.230 -3.491 5.189 1.00 0.00 C ATOM 1384 CD1 LEU B 43 -0.557 -4.137 6.317 1.00 0.00 C ATOM 1385 CD2 LEU B 43 1.470 -2.807 5.740 1.00 0.00 C ATOM 0 H LEU B 43 0.171 -7.012 4.483 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.476 -4.764 3.671 1.00 0.00 H new ATOM 0 HB2 LEU B 43 1.307 -5.245 4.572 1.00 0.00 H new ATOM 0 HB3 LEU B 43 1.155 -4.025 3.324 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.401 -2.740 4.714 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -0.818 -3.381 7.058 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.468 -4.582 5.917 1.00 0.00 H new ATOM 0 HD13 LEU B 43 0.049 -4.912 6.787 1.00 0.00 H new ATOM 0 HD21 LEU B 43 1.177 -2.074 6.492 1.00 0.00 H new ATOM 0 HD22 LEU B 43 2.125 -3.551 6.194 1.00 0.00 H new ATOM 0 HD23 LEU B 43 1.999 -2.305 4.930 1.00 0.00 H new ATOM 1397 N LEU B 44 0.070 -6.618 1.509 1.00 0.00 N ATOM 1398 CA LEU B 44 0.327 -6.764 0.084 1.00 0.00 C ATOM 1399 C LEU B 44 -0.977 -6.996 -0.667 1.00 0.00 C ATOM 1400 O LEU B 44 -1.225 -6.370 -1.693 1.00 0.00 O ATOM 1401 CB LEU B 44 1.357 -7.889 -0.193 1.00 0.00 C ATOM 1402 CG LEU B 44 0.831 -9.334 -0.326 1.00 0.00 C ATOM 1403 CD1 LEU B 44 0.254 -9.603 -1.712 1.00 0.00 C ATOM 1404 CD2 LEU B 44 1.943 -10.328 -0.049 1.00 0.00 C ATOM 0 H LEU B 44 0.234 -7.455 2.068 1.00 0.00 H new ATOM 0 HA LEU B 44 0.767 -5.836 -0.282 1.00 0.00 H new ATOM 0 HB2 LEU B 44 1.885 -7.639 -1.113 1.00 0.00 H new ATOM 0 HB3 LEU B 44 2.093 -7.874 0.611 1.00 0.00 H new ATOM 0 HG LEU B 44 0.034 -9.454 0.408 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.105 -10.631 -1.763 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.574 -8.920 -1.900 1.00 0.00 H new ATOM 0 HD13 LEU B 44 1.028 -9.451 -2.464 1.00 0.00 H new ATOM 0 HD21 LEU B 44 1.557 -11.343 -0.147 1.00 0.00 H new ATOM 0 HD22 LEU B 44 2.752 -10.177 -0.764 1.00 0.00 H new ATOM 0 HD23 LEU B 44 2.320 -10.179 0.963 1.00 0.00 H new ATOM 1416 N ASP B 45 -1.824 -7.878 -0.149 1.00 0.00 N ATOM 1417 CA ASP B 45 -3.062 -8.218 -0.837 1.00 0.00 C ATOM 1418 C ASP B 45 -4.063 -7.079 -0.722 1.00 0.00 C ATOM 1419 O ASP B 45 -4.967 -6.945 -1.548 1.00 0.00 O ATOM 1420 CB ASP B 45 -3.659 -9.513 -0.289 1.00 0.00 C ATOM 1421 CG ASP B 45 -4.727 -10.076 -1.206 1.00 0.00 C ATOM 1422 OD1 ASP B 45 -4.376 -10.533 -2.320 1.00 0.00 O ATOM 1423 OD2 ASP B 45 -5.917 -10.056 -0.828 1.00 0.00 O ATOM 0 H ASP B 45 -1.678 -8.365 0.735 1.00 0.00 H new ATOM 0 HA ASP B 45 -2.831 -8.375 -1.891 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -2.867 -10.251 -0.158 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -4.087 -9.327 0.696 1.00 0.00 H new ATOM 1428 N PHE B 46 -3.872 -6.229 0.277 1.00 0.00 N ATOM 1429 CA PHE B 46 -4.698 -5.043 0.432 1.00 0.00 C ATOM 1430 C PHE B 46 -4.329 -3.995 -0.600 1.00 0.00 C ATOM 1431 O PHE B 46 -5.204 -3.361 -1.192 1.00 0.00 O ATOM 1432 CB PHE B 46 -4.467 -4.477 1.834 1.00 0.00 C ATOM 1433 CG PHE B 46 -5.312 -3.290 2.196 1.00 0.00 C ATOM 1434 CD1 PHE B 46 -6.572 -3.462 2.744 1.00 0.00 C ATOM 1435 CD2 PHE B 46 -4.839 -2.002 1.999 1.00 0.00 C ATOM 1436 CE1 PHE B 46 -7.343 -2.371 3.094 1.00 0.00 C ATOM 1437 CE2 PHE B 46 -5.604 -0.911 2.350 1.00 0.00 C ATOM 1438 CZ PHE B 46 -6.858 -1.094 2.893 1.00 0.00 C ATOM 0 H PHE B 46 -3.152 -6.340 0.991 1.00 0.00 H new ATOM 0 HA PHE B 46 -5.745 -5.310 0.291 1.00 0.00 H new ATOM 0 HB2 PHE B 46 -4.650 -5.268 2.561 1.00 0.00 H new ATOM 0 HB3 PHE B 46 -3.418 -4.196 1.926 1.00 0.00 H new ATOM 0 HD1 PHE B 46 -6.956 -4.460 2.899 1.00 0.00 H new ATOM 0 HD2 PHE B 46 -3.861 -1.852 1.566 1.00 0.00 H new ATOM 0 HE1 PHE B 46 -8.323 -2.516 3.524 1.00 0.00 H new ATOM 0 HE2 PHE B 46 -5.221 0.088 2.200 1.00 0.00 H new ATOM 0 HZ PHE B 46 -7.461 -0.239 3.161 1.00 0.00 H new ATOM 1448 N ILE B 47 -3.043 -3.838 -0.853 1.00 0.00 N ATOM 1449 CA ILE B 47 -2.618 -2.848 -1.817 1.00 0.00 C ATOM 1450 C ILE B 47 -2.841 -3.368 -3.229 1.00 0.00 C ATOM 1451 O ILE B 47 -3.155 -2.600 -4.137 1.00 0.00 O ATOM 1452 CB ILE B 47 -1.143 -2.427 -1.625 1.00 0.00 C ATOM 1453 CG1 ILE B 47 -0.195 -3.599 -1.908 1.00 0.00 C ATOM 1454 CG2 ILE B 47 -0.940 -1.902 -0.213 1.00 0.00 C ATOM 1455 CD1 ILE B 47 1.268 -3.257 -1.758 1.00 0.00 C ATOM 0 H ILE B 47 -2.292 -4.371 -0.415 1.00 0.00 H new ATOM 0 HA ILE B 47 -3.225 -1.957 -1.655 1.00 0.00 H new ATOM 0 HB ILE B 47 -0.911 -1.634 -2.336 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -0.437 -4.419 -1.232 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -0.371 -3.959 -2.922 1.00 0.00 H new ATOM 0 HG21 ILE B 47 0.101 -1.606 -0.081 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -1.586 -1.040 -0.049 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -1.189 -2.683 0.505 1.00 0.00 H new ATOM 0 HD11 ILE B 47 1.872 -4.138 -1.975 1.00 0.00 H new ATOM 0 HD12 ILE B 47 1.528 -2.459 -2.453 1.00 0.00 H new ATOM 0 HD13 ILE B 47 1.462 -2.927 -0.737 1.00 0.00 H new ATOM 1467 N GLN B 48 -2.729 -4.684 -3.388 1.00 0.00 N ATOM 1468 CA GLN B 48 -3.106 -5.345 -4.625 1.00 0.00 C ATOM 1469 C GLN B 48 -4.517 -4.936 -5.002 1.00 0.00 C ATOM 1470 O GLN B 48 -4.737 -4.269 -5.993 1.00 0.00 O ATOM 1471 CB GLN B 48 -3.064 -6.865 -4.457 1.00 0.00 C ATOM 1472 CG GLN B 48 -1.668 -7.463 -4.416 1.00 0.00 C ATOM 1473 CD GLN B 48 -1.272 -8.074 -5.743 1.00 0.00 C ATOM 1474 OE1 GLN B 48 -2.125 -8.552 -6.488 1.00 0.00 O ATOM 1475 NE2 GLN B 48 0.015 -8.069 -6.046 1.00 0.00 N ATOM 0 H GLN B 48 -2.377 -5.314 -2.667 1.00 0.00 H new ATOM 0 HA GLN B 48 -2.403 -5.051 -5.404 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -3.584 -7.129 -3.536 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -3.616 -7.323 -5.278 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -0.950 -6.689 -4.145 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -1.623 -8.225 -3.638 1.00 0.00 H new ATOM 0 HE21 GLN B 48 0.690 -7.662 -5.399 1.00 0.00 H new ATOM 0 HE22 GLN B 48 0.333 -8.472 -6.927 1.00 0.00 H new ATOM 1484 N LYS B 49 -5.425 -5.216 -4.098 1.00 0.00 N ATOM 1485 CA LYS B 49 -6.855 -5.209 -4.364 1.00 0.00 C ATOM 1486 C LYS B 49 -7.432 -3.790 -4.406 1.00 0.00 C ATOM 1487 O LYS B 49 -8.640 -3.611 -4.551 1.00 0.00 O ATOM 1488 CB LYS B 49 -7.514 -6.036 -3.261 1.00 0.00 C ATOM 1489 CG LYS B 49 -8.925 -6.515 -3.544 1.00 0.00 C ATOM 1490 CD LYS B 49 -9.600 -6.977 -2.256 1.00 0.00 C ATOM 1491 CE LYS B 49 -8.718 -7.936 -1.464 1.00 0.00 C ATOM 1492 NZ LYS B 49 -9.272 -8.210 -0.113 1.00 0.00 N ATOM 0 H LYS B 49 -5.192 -5.461 -3.136 1.00 0.00 H new ATOM 0 HA LYS B 49 -7.052 -5.635 -5.348 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -6.888 -6.907 -3.064 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -7.530 -5.441 -2.348 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -9.505 -5.711 -3.997 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -8.900 -7.334 -4.263 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -9.838 -6.110 -1.640 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -10.544 -7.466 -2.496 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -8.617 -8.873 -2.012 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -7.718 -7.514 -1.368 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -8.765 -9.011 0.314 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -9.157 -7.368 0.487 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -10.282 -8.443 -0.193 1.00 0.00 H new ATOM 1506 N HIS B 50 -6.589 -2.770 -4.220 1.00 0.00 N ATOM 1507 CA HIS B 50 -7.077 -1.420 -4.521 1.00 0.00 C ATOM 1508 C HIS B 50 -6.363 -0.746 -5.690 1.00 0.00 C ATOM 1509 O HIS B 50 -6.822 0.297 -6.150 1.00 0.00 O ATOM 1510 CB HIS B 50 -6.924 -0.534 -3.282 1.00 0.00 C ATOM 1511 CG HIS B 50 -7.522 -1.136 -2.054 1.00 0.00 C ATOM 1512 ND1 HIS B 50 -8.640 -1.936 -2.083 1.00 0.00 N ATOM 1513 CD2 HIS B 50 -7.115 -1.109 -0.768 1.00 0.00 C ATOM 1514 CE1 HIS B 50 -8.895 -2.376 -0.871 1.00 0.00 C ATOM 1515 NE2 HIS B 50 -7.985 -1.891 -0.052 1.00 0.00 N ATOM 0 H HIS B 50 -5.628 -2.839 -3.885 1.00 0.00 H new ATOM 0 HA HIS B 50 -8.122 -1.536 -4.810 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -5.865 -0.344 -3.107 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -7.394 0.431 -3.472 1.00 0.00 H new ATOM 0 HD1 HIS B 50 -9.187 -2.154 -2.916 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -6.264 -0.572 -0.376 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -9.712 -3.025 -0.594 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -7.935 -2.068 0.951 1.00 0.00 H new ATOM 1524 N LEU B 51 -5.275 -1.318 -6.198 1.00 0.00 N ATOM 1525 CA LEU B 51 -4.581 -0.695 -7.330 1.00 0.00 C ATOM 1526 C LEU B 51 -4.336 -1.690 -8.466 1.00 0.00 C ATOM 1527 O LEU B 51 -4.535 -1.364 -9.636 1.00 0.00 O ATOM 1528 CB LEU B 51 -3.242 -0.068 -6.908 1.00 0.00 C ATOM 1529 CG LEU B 51 -3.307 1.036 -5.838 1.00 0.00 C ATOM 1530 CD1 LEU B 51 -1.976 1.764 -5.737 1.00 0.00 C ATOM 1531 CD2 LEU B 51 -4.411 2.033 -6.138 1.00 0.00 C ATOM 0 H LEU B 51 -4.861 -2.186 -5.859 1.00 0.00 H new ATOM 0 HA LEU B 51 -5.241 0.095 -7.689 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -2.594 -0.863 -6.539 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -2.764 0.346 -7.796 1.00 0.00 H new ATOM 0 HG LEU B 51 -3.526 0.554 -4.885 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -2.043 2.541 -4.975 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -1.193 1.056 -5.465 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -1.736 2.219 -6.698 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -4.430 2.799 -5.363 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -4.227 2.500 -7.106 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -5.371 1.517 -6.161 1.00 0.00 H new ATOM 1543 N ASN B 52 -3.919 -2.899 -8.120 1.00 0.00 N ATOM 1544 CA ASN B 52 -3.522 -3.894 -9.120 1.00 0.00 C ATOM 1545 C ASN B 52 -4.565 -4.996 -9.271 1.00 0.00 C ATOM 1546 O ASN B 52 -4.634 -5.665 -10.300 1.00 0.00 O ATOM 1547 CB ASN B 52 -2.173 -4.503 -8.744 1.00 0.00 C ATOM 1548 CG ASN B 52 -1.013 -3.783 -9.404 1.00 0.00 C ATOM 1549 OD1 ASN B 52 -1.065 -2.577 -9.633 1.00 0.00 O ATOM 1550 ND2 ASN B 52 0.037 -4.520 -9.726 1.00 0.00 N ATOM 0 H ASN B 52 -3.845 -3.220 -7.155 1.00 0.00 H new ATOM 0 HA ASN B 52 -3.439 -3.382 -10.079 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -2.050 -4.469 -7.661 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -2.158 -5.554 -9.034 1.00 0.00 H new ATOM 0 HD21 ASN B 52 0.842 -4.090 -10.181 1.00 0.00 H new ATOM 0 HD22 ASN B 52 0.042 -5.519 -9.519 1.00 0.00 H new ATOM 1557 N LYS B 53 -5.356 -5.181 -8.239 1.00 0.00 N ATOM 1558 CA LYS B 53 -6.457 -6.114 -8.248 1.00 0.00 C ATOM 1559 C LYS B 53 -7.769 -5.340 -8.273 1.00 0.00 C ATOM 1560 O LYS B 53 -8.352 -5.191 -9.369 1.00 0.00 O ATOM 1561 CB LYS B 53 -6.407 -6.987 -6.996 1.00 0.00 C ATOM 1562 CG LYS B 53 -5.983 -8.421 -7.236 1.00 0.00 C ATOM 1563 CD LYS B 53 -6.430 -9.291 -6.067 1.00 0.00 C ATOM 1564 CE LYS B 53 -5.475 -9.222 -4.891 1.00 0.00 C ATOM 1565 NZ LYS B 53 -4.213 -9.970 -5.138 1.00 0.00 N ATOM 1566 OXT LYS B 53 -8.190 -4.849 -7.212 1.00 0.00 O ATOM 0 H LYS B 53 -5.250 -4.680 -7.357 1.00 0.00 H new ATOM 0 HA LYS B 53 -6.386 -6.749 -9.131 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -5.719 -6.534 -6.282 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -7.393 -6.988 -6.531 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -6.420 -8.789 -8.164 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -4.900 -8.476 -7.350 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -7.422 -8.977 -5.744 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -6.516 -10.325 -6.400 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -5.240 -8.179 -4.679 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -5.965 -9.625 -4.005 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -3.805 -10.272 -4.230 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -4.414 -10.806 -5.723 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -3.536 -9.355 -5.634 1.00 0.00 H new TER 1580 LYS B 53 HETATM 1581 N FME C 1 -10.250 3.810 13.647 1.00 0.00 N HETATM 1582 CN FME C 1 -10.375 2.505 13.492 1.00 0.00 C HETATM 1583 O1 FME C 1 -11.213 1.852 14.105 1.00 0.00 O HETATM 1584 CA FME C 1 -9.258 4.552 12.888 1.00 0.00 C HETATM 1585 CB FME C 1 -9.885 5.806 12.277 1.00 0.00 C HETATM 1586 CG FME C 1 -9.050 6.431 11.170 1.00 0.00 C HETATM 1587 SD FME C 1 -9.905 7.794 10.354 1.00 0.00 S HETATM 1588 CE FME C 1 -8.800 8.122 8.981 1.00 0.00 C HETATM 1589 C FME C 1 -8.089 4.920 13.793 1.00 0.00 C HETATM 1590 O FME C 1 -8.165 5.869 14.573 1.00 0.00 O HETATM 0 HG3 FME C 1 -8.110 6.792 11.587 1.00 0.00 H new HETATM 0 HG2 FME C 1 -8.799 5.669 10.432 1.00 0.00 H new HETATM 0 HE3 FME C 1 -8.840 9.181 8.727 1.00 0.00 H new HETATM 0 HE2 FME C 1 -7.781 7.855 9.262 1.00 0.00 H new HETATM 0 HE1 FME C 1 -9.106 7.530 8.118 1.00 0.00 H new HETATM 0 HCN FME C 1 -9.712 1.991 12.796 1.00 0.00 H new HETATM 0 HB3 FME C 1 -10.868 5.553 11.880 1.00 0.00 H new HETATM 0 HB2 FME C 1 -10.040 6.544 13.064 1.00 0.00 H new HETATM 0 HA FME C 1 -8.889 3.927 12.075 1.00 0.00 H new HETATM 0 H FME C 1 -10.855 4.301 14.305 1.00 0.00 H new ATOM 1601 N VAL C 2 -7.016 4.150 13.697 1.00 0.00 N ATOM 1602 CA VAL C 2 -5.848 4.356 14.545 1.00 0.00 C ATOM 1603 C VAL C 2 -4.718 4.991 13.735 1.00 0.00 C ATOM 1604 O VAL C 2 -3.611 5.215 14.229 1.00 0.00 O ATOM 1605 CB VAL C 2 -5.375 3.015 15.164 1.00 0.00 C ATOM 1606 CG1 VAL C 2 -4.790 2.095 14.101 1.00 0.00 C ATOM 1607 CG2 VAL C 2 -4.380 3.246 16.293 1.00 0.00 C ATOM 0 H VAL C 2 -6.928 3.375 13.040 1.00 0.00 H new ATOM 0 HA VAL C 2 -6.125 5.029 15.357 1.00 0.00 H new ATOM 0 HB VAL C 2 -6.250 2.523 15.589 1.00 0.00 H new ATOM 0 HG11 VAL C 2 -4.467 1.163 14.564 1.00 0.00 H new ATOM 0 HG12 VAL C 2 -5.548 1.882 13.347 1.00 0.00 H new ATOM 0 HG13 VAL C 2 -3.936 2.581 13.629 1.00 0.00 H new ATOM 0 HG21 VAL C 2 -4.068 2.286 16.705 1.00 0.00 H new ATOM 0 HG22 VAL C 2 -3.509 3.776 15.907 1.00 0.00 H new ATOM 0 HG23 VAL C 2 -4.850 3.842 17.076 1.00 0.00 H new ATOM 1617 N ILE C 3 -5.012 5.292 12.480 1.00 0.00 N ATOM 1618 CA ILE C 3 -4.040 5.906 11.600 1.00 0.00 C ATOM 1619 C ILE C 3 -4.691 7.022 10.791 1.00 0.00 C ATOM 1620 O ILE C 3 -5.810 6.875 10.300 1.00 0.00 O ATOM 1621 CB ILE C 3 -3.404 4.863 10.648 1.00 0.00 C ATOM 1622 CG1 ILE C 3 -2.274 5.498 9.832 1.00 0.00 C ATOM 1623 CG2 ILE C 3 -4.458 4.258 9.725 1.00 0.00 C ATOM 1624 CD1 ILE C 3 -1.536 4.514 8.950 1.00 0.00 C ATOM 0 H ILE C 3 -5.921 5.119 12.050 1.00 0.00 H new ATOM 0 HA ILE C 3 -3.248 6.327 12.219 1.00 0.00 H new ATOM 0 HB ILE C 3 -2.982 4.061 11.254 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -2.688 6.291 9.210 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.564 5.966 10.514 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -3.988 3.528 9.065 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -5.226 3.766 10.322 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -4.914 5.047 9.127 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -0.750 5.034 8.402 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -1.092 3.734 9.568 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -2.234 4.064 8.244 1.00 0.00 H new ATOM 1636 N ALA C 4 -4.013 8.150 10.708 1.00 0.00 N ATOM 1637 CA ALA C 4 -4.461 9.249 9.874 1.00 0.00 C ATOM 1638 C ALA C 4 -3.380 9.602 8.863 1.00 0.00 C ATOM 1639 O ALA C 4 -2.188 9.443 9.129 1.00 0.00 O ATOM 1640 CB ALA C 4 -4.811 10.452 10.735 1.00 0.00 C ATOM 0 H ALA C 4 -3.144 8.330 11.211 1.00 0.00 H new ATOM 0 HA ALA C 4 -5.357 8.947 9.332 1.00 0.00 H new ATOM 0 HB1 ALA C 4 -5.146 11.270 10.098 1.00 0.00 H new ATOM 0 HB2 ALA C 4 -5.607 10.183 11.429 1.00 0.00 H new ATOM 0 HB3 ALA C 4 -3.931 10.766 11.296 1.00 0.00 H new ATOM 1646 N THR C 5 -3.808 10.079 7.700 1.00 0.00 N ATOM 1647 CA THR C 5 -2.900 10.394 6.604 1.00 0.00 C ATOM 1648 C THR C 5 -1.967 11.549 6.972 1.00 0.00 C ATOM 1649 O THR C 5 -0.944 11.760 6.330 1.00 0.00 O ATOM 1650 CB THR C 5 -3.697 10.755 5.332 1.00 0.00 C ATOM 1651 OG1 THR C 5 -4.746 9.794 5.131 1.00 0.00 O ATOM 1652 CG2 THR C 5 -2.798 10.781 4.103 1.00 0.00 C ATOM 0 H THR C 5 -4.790 10.258 7.491 1.00 0.00 H new ATOM 0 HA THR C 5 -2.294 9.509 6.411 1.00 0.00 H new ATOM 0 HB THR C 5 -4.120 11.750 5.470 1.00 0.00 H new ATOM 0 HG1 THR C 5 -5.252 10.026 4.324 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.390 11.038 3.225 1.00 0.00 H new ATOM 0 HG22 THR C 5 -2.013 11.524 4.242 1.00 0.00 H new ATOM 0 HG23 THR C 5 -2.347 9.799 3.961 1.00 0.00 H new ATOM 1660 N ASP C 6 -2.307 12.257 8.043 1.00 0.00 N ATOM 1661 CA ASP C 6 -1.554 13.435 8.461 1.00 0.00 C ATOM 1662 C ASP C 6 -0.314 13.046 9.257 1.00 0.00 C ATOM 1663 O ASP C 6 0.500 13.899 9.607 1.00 0.00 O ATOM 1664 CB ASP C 6 -2.436 14.356 9.311 1.00 0.00 C ATOM 1665 CG ASP C 6 -3.674 14.833 8.576 1.00 0.00 C ATOM 1666 OD1 ASP C 6 -4.673 14.082 8.541 1.00 0.00 O ATOM 1667 OD2 ASP C 6 -3.657 15.958 8.034 1.00 0.00 O ATOM 0 H ASP C 6 -3.103 12.035 8.641 1.00 0.00 H new ATOM 0 HA ASP C 6 -1.237 13.961 7.560 1.00 0.00 H new ATOM 0 HB2 ASP C 6 -2.738 13.828 10.216 1.00 0.00 H new ATOM 0 HB3 ASP C 6 -1.852 15.220 9.626 1.00 0.00 H new ATOM 1672 N ASP C 7 -0.173 11.758 9.559 1.00 0.00 N ATOM 1673 CA ASP C 7 1.004 11.279 10.279 1.00 0.00 C ATOM 1674 C ASP C 7 1.964 10.568 9.334 1.00 0.00 C ATOM 1675 O ASP C 7 3.105 10.274 9.695 1.00 0.00 O ATOM 1676 CB ASP C 7 0.597 10.314 11.398 1.00 0.00 C ATOM 1677 CG ASP C 7 -0.361 10.931 12.396 1.00 0.00 C ATOM 1678 OD1 ASP C 7 0.093 11.682 13.283 1.00 0.00 O ATOM 1679 OD2 ASP C 7 -1.576 10.653 12.312 1.00 0.00 O ATOM 0 H ASP C 7 -0.851 11.034 9.320 1.00 0.00 H new ATOM 0 HA ASP C 7 1.502 12.147 10.712 1.00 0.00 H new ATOM 0 HB2 ASP C 7 0.134 9.431 10.957 1.00 0.00 H new ATOM 0 HB3 ASP C 7 1.491 9.977 11.922 1.00 0.00 H new ATOM 1684 N LEU C 8 1.504 10.284 8.124 1.00 0.00 N ATOM 1685 CA LEU C 8 2.339 9.606 7.138 1.00 0.00 C ATOM 1686 C LEU C 8 2.629 10.518 5.959 1.00 0.00 C ATOM 1687 O LEU C 8 3.562 10.280 5.190 1.00 0.00 O ATOM 1688 CB LEU C 8 1.694 8.306 6.659 1.00 0.00 C ATOM 1689 CG LEU C 8 1.723 7.162 7.672 1.00 0.00 C ATOM 1690 CD1 LEU C 8 0.695 7.375 8.771 1.00 0.00 C ATOM 1691 CD2 LEU C 8 1.496 5.831 6.976 1.00 0.00 C ATOM 0 H LEU C 8 0.563 10.510 7.801 1.00 0.00 H new ATOM 0 HA LEU C 8 3.282 9.354 7.624 1.00 0.00 H new ATOM 0 HB2 LEU C 8 0.657 8.509 6.392 1.00 0.00 H new ATOM 0 HB3 LEU C 8 2.200 7.980 5.750 1.00 0.00 H new ATOM 0 HG LEU C 8 2.709 7.147 8.136 1.00 0.00 H new ATOM 0 HD11 LEU C 8 0.739 6.545 9.476 1.00 0.00 H new ATOM 0 HD12 LEU C 8 0.909 8.307 9.294 1.00 0.00 H new ATOM 0 HD13 LEU C 8 -0.302 7.425 8.332 1.00 0.00 H new ATOM 0 HD21 LEU C 8 1.520 5.027 7.712 1.00 0.00 H new ATOM 0 HD22 LEU C 8 0.525 5.841 6.480 1.00 0.00 H new ATOM 0 HD23 LEU C 8 2.280 5.669 6.236 1.00 0.00 H new ATOM 1703 N GLU C 9 1.825 11.556 5.838 1.00 0.00 N ATOM 1704 CA GLU C 9 2.046 12.588 4.846 1.00 0.00 C ATOM 1705 C GLU C 9 1.799 13.948 5.481 1.00 0.00 C ATOM 1706 O GLU C 9 0.828 14.145 6.212 1.00 0.00 O ATOM 1707 CB GLU C 9 1.168 12.396 3.599 1.00 0.00 C ATOM 1708 CG GLU C 9 1.537 11.170 2.770 1.00 0.00 C ATOM 1709 CD GLU C 9 1.088 11.267 1.322 1.00 0.00 C ATOM 1710 OE1 GLU C 9 -0.125 11.141 1.056 1.00 0.00 O ATOM 1711 OE2 GLU C 9 1.956 11.466 0.436 1.00 0.00 O ATOM 0 H GLU C 9 1.003 11.707 6.423 1.00 0.00 H new ATOM 0 HA GLU C 9 3.080 12.522 4.506 1.00 0.00 H new ATOM 0 HB2 GLU C 9 0.126 12.314 3.909 1.00 0.00 H new ATOM 0 HB3 GLU C 9 1.245 13.284 2.972 1.00 0.00 H new ATOM 0 HG2 GLU C 9 2.618 11.032 2.800 1.00 0.00 H new ATOM 0 HG3 GLU C 9 1.090 10.285 3.223 1.00 0.00 H new ATOM 1718 N VAL C 10 2.694 14.868 5.204 1.00 0.00 N ATOM 1719 CA VAL C 10 2.658 16.193 5.783 1.00 0.00 C ATOM 1720 C VAL C 10 2.754 17.210 4.659 1.00 0.00 C ATOM 1721 O VAL C 10 3.423 16.967 3.655 1.00 0.00 O ATOM 1722 CB VAL C 10 3.816 16.388 6.797 1.00 0.00 C ATOM 1723 CG1 VAL C 10 5.171 16.176 6.136 1.00 0.00 C ATOM 1724 CG2 VAL C 10 3.752 17.761 7.448 1.00 0.00 C ATOM 0 H VAL C 10 3.475 14.717 4.565 1.00 0.00 H new ATOM 0 HA VAL C 10 1.724 16.328 6.328 1.00 0.00 H new ATOM 0 HB VAL C 10 3.696 15.635 7.576 1.00 0.00 H new ATOM 0 HG11 VAL C 10 5.962 16.320 6.873 1.00 0.00 H new ATOM 0 HG12 VAL C 10 5.227 15.163 5.737 1.00 0.00 H new ATOM 0 HG13 VAL C 10 5.296 16.893 5.325 1.00 0.00 H new ATOM 0 HG21 VAL C 10 4.576 17.868 8.153 1.00 0.00 H new ATOM 0 HG22 VAL C 10 3.829 18.531 6.681 1.00 0.00 H new ATOM 0 HG23 VAL C 10 2.805 17.869 7.977 1.00 0.00 H new ATOM 1734 N ALA C 11 2.064 18.326 4.802 1.00 0.00 N ATOM 1735 CA ALA C 11 2.029 19.326 3.754 1.00 0.00 C ATOM 1736 C ALA C 11 3.410 19.921 3.517 1.00 0.00 C ATOM 1737 O ALA C 11 4.112 20.308 4.453 1.00 0.00 O ATOM 1738 CB ALA C 11 1.018 20.400 4.127 1.00 0.00 C ATOM 0 H ALA C 11 1.521 18.562 5.633 1.00 0.00 H new ATOM 0 HA ALA C 11 1.722 18.858 2.819 1.00 0.00 H new ATOM 0 HB1 ALA C 11 0.985 21.157 3.343 1.00 0.00 H new ATOM 0 HB2 ALA C 11 0.032 19.949 4.237 1.00 0.00 H new ATOM 0 HB3 ALA C 11 1.311 20.865 5.068 1.00 0.00 H new ATOM 1744 N CYS C 12 3.790 19.971 2.239 1.00 0.00 N ATOM 1745 CA CYS C 12 5.130 20.316 1.798 1.00 0.00 C ATOM 1746 C CYS C 12 5.553 21.743 2.181 1.00 0.00 C ATOM 1747 O CYS C 12 4.733 22.527 2.647 1.00 0.00 O ATOM 1748 CB CYS C 12 5.143 20.200 0.282 1.00 0.00 C ATOM 1749 SG CYS C 12 6.520 19.262 -0.385 1.00 0.00 S ATOM 0 H CYS C 12 3.154 19.767 1.468 1.00 0.00 H new ATOM 0 HA CYS C 12 5.832 19.640 2.286 1.00 0.00 H new ATOM 0 HB2 CYS C 12 4.212 19.734 -0.041 1.00 0.00 H new ATOM 0 HB3 CYS C 12 5.162 21.202 -0.146 1.00 0.00 H new ATOM 1754 N PRO C 13 6.843 22.104 1.974 1.00 0.00 N ATOM 1755 CA PRO C 13 7.329 23.480 2.168 1.00 0.00 C ATOM 1756 C PRO C 13 6.470 24.553 1.489 1.00 0.00 C ATOM 1757 O PRO C 13 6.202 25.605 2.072 1.00 0.00 O ATOM 1758 CB PRO C 13 8.704 23.440 1.501 1.00 0.00 C ATOM 1759 CG PRO C 13 9.186 22.055 1.727 1.00 0.00 C ATOM 1760 CD PRO C 13 7.954 21.190 1.616 1.00 0.00 C ATOM 0 HA PRO C 13 7.320 23.752 3.223 1.00 0.00 H new ATOM 0 HB2 PRO C 13 8.636 23.668 0.437 1.00 0.00 H new ATOM 0 HB3 PRO C 13 9.380 24.173 1.941 1.00 0.00 H new ATOM 0 HG2 PRO C 13 9.935 21.772 0.987 1.00 0.00 H new ATOM 0 HG3 PRO C 13 9.652 21.954 2.707 1.00 0.00 H new ATOM 0 HD2 PRO C 13 7.835 20.792 0.608 1.00 0.00 H new ATOM 0 HD3 PRO C 13 8.003 20.337 2.292 1.00 0.00 H new ATOM 1768 N LYS C 14 6.029 24.279 0.259 1.00 0.00 N ATOM 1769 CA LYS C 14 5.473 25.337 -0.586 1.00 0.00 C ATOM 1770 C LYS C 14 4.319 24.880 -1.490 1.00 0.00 C ATOM 1771 O LYS C 14 3.465 25.686 -1.849 1.00 0.00 O ATOM 1772 CB LYS C 14 6.596 25.944 -1.444 1.00 0.00 C ATOM 1773 CG LYS C 14 6.103 26.929 -2.496 1.00 0.00 C ATOM 1774 CD LYS C 14 7.251 27.614 -3.232 1.00 0.00 C ATOM 1775 CE LYS C 14 6.721 28.422 -4.403 1.00 0.00 C ATOM 1776 NZ LYS C 14 7.768 29.307 -5.004 1.00 0.00 N ATOM 0 H LYS C 14 6.045 23.352 -0.167 1.00 0.00 H new ATOM 0 HA LYS C 14 5.048 26.079 0.089 1.00 0.00 H new ATOM 0 HB2 LYS C 14 7.306 26.450 -0.790 1.00 0.00 H new ATOM 0 HB3 LYS C 14 7.137 25.138 -1.940 1.00 0.00 H new ATOM 0 HG2 LYS C 14 5.475 26.404 -3.216 1.00 0.00 H new ATOM 0 HG3 LYS C 14 5.478 27.684 -2.019 1.00 0.00 H new ATOM 0 HD2 LYS C 14 7.793 28.266 -2.547 1.00 0.00 H new ATOM 0 HD3 LYS C 14 7.960 26.867 -3.589 1.00 0.00 H new ATOM 0 HE2 LYS C 14 6.340 27.744 -5.167 1.00 0.00 H new ATOM 0 HE3 LYS C 14 5.881 29.031 -4.070 1.00 0.00 H new ATOM 0 HZ1 LYS C 14 7.346 30.225 -5.251 1.00 0.00 H new ATOM 0 HZ2 LYS C 14 8.536 29.452 -4.317 1.00 0.00 H new ATOM 0 HZ3 LYS C 14 8.150 28.859 -5.861 1.00 0.00 H new ATOM 1790 N CYS C 15 4.257 23.606 -1.861 1.00 0.00 N ATOM 1791 CA CYS C 15 3.318 23.219 -2.914 1.00 0.00 C ATOM 1792 C CYS C 15 2.211 22.277 -2.439 1.00 0.00 C ATOM 1793 O CYS C 15 1.781 21.391 -3.183 1.00 0.00 O ATOM 1794 CB CYS C 15 4.146 22.513 -3.994 1.00 0.00 C ATOM 1795 SG CYS C 15 4.963 21.014 -3.388 1.00 0.00 S ATOM 0 H CYS C 15 4.819 22.850 -1.470 1.00 0.00 H new ATOM 0 HA CYS C 15 2.812 24.115 -3.274 1.00 0.00 H new ATOM 0 HB2 CYS C 15 3.497 22.254 -4.831 1.00 0.00 H new ATOM 0 HB3 CYS C 15 4.899 23.202 -4.376 1.00 0.00 H new ATOM 1800 N GLU C 16 1.665 22.536 -1.262 1.00 0.00 N ATOM 1801 CA GLU C 16 0.599 21.705 -0.724 1.00 0.00 C ATOM 1802 C GLU C 16 -0.749 22.233 -1.173 1.00 0.00 C ATOM 1803 O GLU C 16 -1.724 22.185 -0.424 1.00 0.00 O ATOM 1804 CB GLU C 16 0.631 21.704 0.810 1.00 0.00 C ATOM 1805 CG GLU C 16 1.911 22.254 1.415 1.00 0.00 C ATOM 1806 CD GLU C 16 1.892 23.760 1.548 1.00 0.00 C ATOM 1807 OE1 GLU C 16 1.137 24.288 2.391 1.00 0.00 O ATOM 1808 OE2 GLU C 16 2.619 24.428 0.791 1.00 0.00 O ATOM 0 H GLU C 16 1.941 23.313 -0.662 1.00 0.00 H new ATOM 0 HA GLU C 16 0.749 20.690 -1.093 1.00 0.00 H new ATOM 0 HB2 GLU C 16 -0.211 22.290 1.178 1.00 0.00 H new ATOM 0 HB3 GLU C 16 0.487 20.683 1.163 1.00 0.00 H new ATOM 0 HG2 GLU C 16 2.065 21.808 2.398 1.00 0.00 H new ATOM 0 HG3 GLU C 16 2.758 21.959 0.795 1.00 0.00 H new ATOM 1815 N ARG C 17 -0.807 22.753 -2.391 1.00 0.00 N ATOM 1816 CA ARG C 17 -2.010 23.356 -2.913 1.00 0.00 C ATOM 1817 C ARG C 17 -2.025 23.145 -4.426 1.00 0.00 C ATOM 1818 O ARG C 17 -3.079 23.105 -5.060 1.00 0.00 O ATOM 1819 CB ARG C 17 -2.068 24.847 -2.579 1.00 0.00 C ATOM 1820 CG ARG C 17 -0.832 25.623 -3.003 1.00 0.00 C ATOM 1821 CD ARG C 17 -0.782 26.979 -2.318 1.00 0.00 C ATOM 1822 NE ARG C 17 -1.012 26.844 -0.880 1.00 0.00 N ATOM 1823 CZ ARG C 17 -0.103 26.377 -0.030 1.00 0.00 C ATOM 1824 NH1 ARG C 17 1.155 26.222 -0.415 1.00 0.00 N ATOM 1825 NH2 ARG C 17 -0.444 26.102 1.223 1.00 0.00 N ATOM 0 H ARG C 17 -0.019 22.765 -3.039 1.00 0.00 H new ATOM 0 HA ARG C 17 -2.883 22.890 -2.457 1.00 0.00 H new ATOM 0 HB2 ARG C 17 -2.942 25.284 -3.062 1.00 0.00 H new ATOM 0 HB3 ARG C 17 -2.207 24.963 -1.504 1.00 0.00 H new ATOM 0 HG2 ARG C 17 0.063 25.053 -2.755 1.00 0.00 H new ATOM 0 HG3 ARG C 17 -0.835 25.757 -4.085 1.00 0.00 H new ATOM 0 HD2 ARG C 17 0.188 27.444 -2.493 1.00 0.00 H new ATOM 0 HD3 ARG C 17 -1.535 27.638 -2.751 1.00 0.00 H new ATOM 0 HE ARG C 17 -1.920 27.124 -0.509 1.00 0.00 H new ATOM 0 HH11 ARG C 17 1.430 26.461 -1.368 1.00 0.00 H new ATOM 0 HH12 ARG C 17 1.849 25.863 0.241 1.00 0.00 H new ATOM 0 HH21 ARG C 17 -1.404 26.249 1.534 1.00 0.00 H new ATOM 0 HH22 ARG C 17 0.254 25.744 1.875 1.00 0.00 H new ATOM 1839 N ALA C 18 -0.819 22.988 -4.999 1.00 0.00 N ATOM 1840 CA ALA C 18 -0.657 23.011 -6.451 1.00 0.00 C ATOM 1841 C ALA C 18 0.100 21.798 -6.987 1.00 0.00 C ATOM 1842 O ALA C 18 -0.179 21.324 -8.086 1.00 0.00 O ATOM 1843 CB ALA C 18 0.043 24.292 -6.881 1.00 0.00 C ATOM 0 H ALA C 18 0.047 22.845 -4.479 1.00 0.00 H new ATOM 0 HA ALA C 18 -1.659 22.973 -6.878 1.00 0.00 H new ATOM 0 HB1 ALA C 18 0.158 24.298 -7.965 1.00 0.00 H new ATOM 0 HB2 ALA C 18 -0.552 25.152 -6.575 1.00 0.00 H new ATOM 0 HB3 ALA C 18 1.025 24.345 -6.412 1.00 0.00 H new ATOM 1849 N GLY C 19 1.051 21.286 -6.211 1.00 0.00 N ATOM 1850 CA GLY C 19 1.831 20.147 -6.664 1.00 0.00 C ATOM 1851 C GLY C 19 3.032 20.536 -7.511 1.00 0.00 C ATOM 1852 O GLY C 19 3.523 19.730 -8.297 1.00 0.00 O ATOM 0 H GLY C 19 1.294 21.636 -5.284 1.00 0.00 H new ATOM 0 HA2 GLY C 19 2.175 19.583 -5.797 1.00 0.00 H new ATOM 0 HA3 GLY C 19 1.188 19.483 -7.242 1.00 0.00 H new ATOM 1856 N GLU C 20 3.535 21.751 -7.318 1.00 0.00 N ATOM 1857 CA GLU C 20 4.650 22.255 -8.120 1.00 0.00 C ATOM 1858 C GLU C 20 5.489 23.259 -7.335 1.00 0.00 C ATOM 1859 O GLU C 20 5.008 23.898 -6.404 1.00 0.00 O ATOM 1860 CB GLU C 20 4.137 22.918 -9.401 1.00 0.00 C ATOM 1861 CG GLU C 20 2.951 23.839 -9.171 1.00 0.00 C ATOM 1862 CD GLU C 20 2.711 24.781 -10.326 1.00 0.00 C ATOM 1863 OE1 GLU C 20 3.318 25.869 -10.343 1.00 0.00 O ATOM 1864 OE2 GLU C 20 1.910 24.443 -11.223 1.00 0.00 O ATOM 0 H GLU C 20 3.191 22.405 -6.615 1.00 0.00 H new ATOM 0 HA GLU C 20 5.276 21.401 -8.378 1.00 0.00 H new ATOM 0 HB2 GLU C 20 4.947 23.488 -9.856 1.00 0.00 H new ATOM 0 HB3 GLU C 20 3.853 22.143 -10.113 1.00 0.00 H new ATOM 0 HG2 GLU C 20 2.057 23.238 -9.006 1.00 0.00 H new ATOM 0 HG3 GLU C 20 3.118 24.419 -8.263 1.00 0.00 H new ATOM 1871 N ILE C 21 6.740 23.401 -7.735 1.00 0.00 N ATOM 1872 CA ILE C 21 7.636 24.389 -7.163 1.00 0.00 C ATOM 1873 C ILE C 21 8.126 25.247 -8.290 1.00 0.00 C ATOM 1874 O ILE C 21 8.983 24.830 -9.063 1.00 0.00 O ATOM 1875 CB ILE C 21 8.852 23.766 -6.440 1.00 0.00 C ATOM 1876 CG1 ILE C 21 8.405 22.991 -5.196 1.00 0.00 C ATOM 1877 CG2 ILE C 21 9.877 24.828 -6.041 1.00 0.00 C ATOM 1878 CD1 ILE C 21 7.775 23.870 -4.129 1.00 0.00 C ATOM 0 H ILE C 21 7.164 22.832 -8.468 1.00 0.00 H new ATOM 0 HA ILE C 21 7.086 24.956 -6.411 1.00 0.00 H new ATOM 0 HB ILE C 21 9.325 23.079 -7.142 1.00 0.00 H new ATOM 0 HG12 ILE C 21 7.690 22.224 -5.493 1.00 0.00 H new ATOM 0 HG13 ILE C 21 9.266 22.476 -4.770 1.00 0.00 H new ATOM 0 HG21 ILE C 21 10.717 24.351 -5.535 1.00 0.00 H new ATOM 0 HG22 ILE C 21 10.235 25.342 -6.933 1.00 0.00 H new ATOM 0 HG23 ILE C 21 9.411 25.549 -5.369 1.00 0.00 H new ATOM 0 HD11 ILE C 21 7.482 23.256 -3.278 1.00 0.00 H new ATOM 0 HD12 ILE C 21 8.495 24.621 -3.804 1.00 0.00 H new ATOM 0 HD13 ILE C 21 6.895 24.365 -4.539 1.00 0.00 H new ATOM 1890 N GLU C 22 7.548 26.424 -8.389 1.00 0.00 N ATOM 1891 CA GLU C 22 7.892 27.349 -9.446 1.00 0.00 C ATOM 1892 C GLU C 22 7.515 26.786 -10.824 1.00 0.00 C ATOM 1893 O GLU C 22 8.343 26.753 -11.726 1.00 0.00 O ATOM 1894 CB GLU C 22 9.395 27.601 -9.368 1.00 0.00 C ATOM 1895 CG GLU C 22 9.780 29.060 -9.399 1.00 0.00 C ATOM 1896 CD GLU C 22 9.221 29.784 -8.189 1.00 0.00 C ATOM 1897 OE1 GLU C 22 9.538 29.379 -7.051 1.00 0.00 O ATOM 1898 OE2 GLU C 22 8.438 30.736 -8.362 1.00 0.00 O ATOM 0 H GLU C 22 6.833 26.764 -7.746 1.00 0.00 H new ATOM 0 HA GLU C 22 7.338 28.279 -9.319 1.00 0.00 H new ATOM 0 HB2 GLU C 22 9.780 27.155 -8.451 1.00 0.00 H new ATOM 0 HB3 GLU C 22 9.881 27.091 -10.199 1.00 0.00 H new ATOM 0 HG2 GLU C 22 10.866 29.155 -9.417 1.00 0.00 H new ATOM 0 HG3 GLU C 22 9.404 29.522 -10.312 1.00 0.00 H new ATOM 1905 N GLY C 23 6.277 26.314 -10.986 1.00 0.00 N ATOM 1906 CA GLY C 23 5.867 25.709 -12.256 1.00 0.00 C ATOM 1907 C GLY C 23 6.692 24.490 -12.617 1.00 0.00 C ATOM 1908 O GLY C 23 6.638 23.979 -13.735 1.00 0.00 O ATOM 0 H GLY C 23 5.552 26.337 -10.269 1.00 0.00 H new ATOM 0 HA2 GLY C 23 4.816 25.427 -12.196 1.00 0.00 H new ATOM 0 HA3 GLY C 23 5.954 26.450 -13.051 1.00 0.00 H new ATOM 1912 N THR C 24 7.440 24.042 -11.649 1.00 0.00 N ATOM 1913 CA THR C 24 8.468 23.046 -11.836 1.00 0.00 C ATOM 1914 C THR C 24 8.254 21.864 -10.879 1.00 0.00 C ATOM 1915 O THR C 24 7.772 22.050 -9.762 1.00 0.00 O ATOM 1916 CB THR C 24 9.813 23.769 -11.611 1.00 0.00 C ATOM 1917 OG1 THR C 24 10.293 24.309 -12.851 1.00 0.00 O ATOM 1918 CG2 THR C 24 10.883 22.901 -10.966 1.00 0.00 C ATOM 0 H THR C 24 7.354 24.363 -10.685 1.00 0.00 H new ATOM 0 HA THR C 24 8.446 22.613 -12.836 1.00 0.00 H new ATOM 0 HB THR C 24 9.611 24.572 -10.902 1.00 0.00 H new ATOM 0 HG1 THR C 24 11.146 24.768 -12.700 1.00 0.00 H new ATOM 0 HG21 THR C 24 11.797 23.482 -10.842 1.00 0.00 H new ATOM 0 HG22 THR C 24 10.535 22.559 -9.991 1.00 0.00 H new ATOM 0 HG23 THR C 24 11.084 22.039 -11.602 1.00 0.00 H new ATOM 1926 N PRO C 25 8.563 20.628 -11.326 1.00 0.00 N ATOM 1927 CA PRO C 25 8.334 19.413 -10.528 1.00 0.00 C ATOM 1928 C PRO C 25 9.050 19.457 -9.179 1.00 0.00 C ATOM 1929 O PRO C 25 10.237 19.781 -9.094 1.00 0.00 O ATOM 1930 CB PRO C 25 8.880 18.285 -11.412 1.00 0.00 C ATOM 1931 CG PRO C 25 9.782 18.961 -12.389 1.00 0.00 C ATOM 1932 CD PRO C 25 9.170 20.311 -12.630 1.00 0.00 C ATOM 0 HA PRO C 25 7.282 19.285 -10.275 1.00 0.00 H new ATOM 0 HB2 PRO C 25 9.422 17.547 -10.820 1.00 0.00 H new ATOM 0 HB3 PRO C 25 8.073 17.756 -11.920 1.00 0.00 H new ATOM 0 HG2 PRO C 25 10.793 19.053 -11.992 1.00 0.00 H new ATOM 0 HG3 PRO C 25 9.855 18.392 -13.316 1.00 0.00 H new ATOM 0 HD2 PRO C 25 9.918 21.049 -12.919 1.00 0.00 H new ATOM 0 HD3 PRO C 25 8.427 20.282 -13.427 1.00 0.00 H new ATOM 1940 N CYS C 26 8.315 19.118 -8.126 1.00 0.00 N ATOM 1941 CA CYS C 26 8.792 19.302 -6.765 1.00 0.00 C ATOM 1942 C CYS C 26 9.571 18.085 -6.233 1.00 0.00 C ATOM 1943 O CYS C 26 9.132 16.949 -6.380 1.00 0.00 O ATOM 1944 CB CYS C 26 7.616 19.618 -5.853 1.00 0.00 C ATOM 1945 SG CYS C 26 8.101 19.896 -4.122 1.00 0.00 S ATOM 0 H CYS C 26 7.382 18.712 -8.192 1.00 0.00 H new ATOM 0 HA CYS C 26 9.493 20.137 -6.775 1.00 0.00 H new ATOM 0 HB2 CYS C 26 7.104 20.505 -6.226 1.00 0.00 H new ATOM 0 HB3 CYS C 26 6.902 18.796 -5.895 1.00 0.00 H new ATOM 1950 N PRO C 27 10.721 18.356 -5.568 1.00 0.00 N ATOM 1951 CA PRO C 27 11.677 17.368 -5.026 1.00 0.00 C ATOM 1952 C PRO C 27 11.099 16.020 -4.574 1.00 0.00 C ATOM 1953 O PRO C 27 11.487 14.963 -5.073 1.00 0.00 O ATOM 1954 CB PRO C 27 12.204 18.107 -3.800 1.00 0.00 C ATOM 1955 CG PRO C 27 12.198 19.555 -4.165 1.00 0.00 C ATOM 1956 CD PRO C 27 11.216 19.722 -5.310 1.00 0.00 C ATOM 0 HA PRO C 27 12.391 17.079 -5.797 1.00 0.00 H new ATOM 0 HB2 PRO C 27 11.574 17.920 -2.930 1.00 0.00 H new ATOM 0 HB3 PRO C 27 13.209 17.772 -3.544 1.00 0.00 H new ATOM 0 HG2 PRO C 27 11.903 20.166 -3.312 1.00 0.00 H new ATOM 0 HG3 PRO C 27 13.195 19.882 -4.461 1.00 0.00 H new ATOM 0 HD2 PRO C 27 10.402 20.396 -5.041 1.00 0.00 H new ATOM 0 HD3 PRO C 27 11.700 20.143 -6.191 1.00 0.00 H new ATOM 1964 N ALA C 28 10.170 16.076 -3.633 1.00 0.00 N ATOM 1965 CA ALA C 28 9.725 14.878 -2.922 1.00 0.00 C ATOM 1966 C ALA C 28 8.230 14.657 -3.095 1.00 0.00 C ATOM 1967 O ALA C 28 7.677 13.647 -2.662 1.00 0.00 O ATOM 1968 CB ALA C 28 10.080 14.983 -1.446 1.00 0.00 C ATOM 0 H ALA C 28 9.707 16.936 -3.341 1.00 0.00 H new ATOM 0 HA ALA C 28 10.240 14.018 -3.350 1.00 0.00 H new ATOM 0 HB1 ALA C 28 9.744 14.086 -0.926 1.00 0.00 H new ATOM 0 HB2 ALA C 28 11.160 15.082 -1.338 1.00 0.00 H new ATOM 0 HB3 ALA C 28 9.590 15.856 -1.015 1.00 0.00 H new ATOM 1974 N CYS C 29 7.575 15.619 -3.710 1.00 0.00 N ATOM 1975 CA CYS C 29 6.154 15.513 -3.968 1.00 0.00 C ATOM 1976 C CYS C 29 5.868 15.850 -5.428 1.00 0.00 C ATOM 1977 O CYS C 29 5.643 17.011 -5.772 1.00 0.00 O ATOM 1978 CB CYS C 29 5.387 16.446 -3.020 1.00 0.00 C ATOM 1979 SG CYS C 29 5.729 18.203 -3.263 1.00 0.00 S ATOM 0 H CYS C 29 8.004 16.483 -4.041 1.00 0.00 H new ATOM 0 HA CYS C 29 5.821 14.491 -3.785 1.00 0.00 H new ATOM 0 HB2 CYS C 29 4.318 16.275 -3.148 1.00 0.00 H new ATOM 0 HB3 CYS C 29 5.631 16.180 -1.992 1.00 0.00 H new ATOM 1984 N SER C 30 5.896 14.842 -6.294 1.00 0.00 N ATOM 1985 CA SER C 30 5.710 15.054 -7.723 1.00 0.00 C ATOM 1986 C SER C 30 4.234 15.281 -8.062 1.00 0.00 C ATOM 1987 O SER C 30 3.643 14.556 -8.861 1.00 0.00 O ATOM 1988 CB SER C 30 6.261 13.844 -8.488 1.00 0.00 C ATOM 1989 OG SER C 30 6.359 14.101 -9.879 1.00 0.00 O ATOM 0 H SER C 30 6.046 13.869 -6.029 1.00 0.00 H new ATOM 0 HA SER C 30 6.254 15.950 -8.021 1.00 0.00 H new ATOM 0 HB2 SER C 30 7.244 13.583 -8.096 1.00 0.00 H new ATOM 0 HB3 SER C 30 5.613 12.983 -8.322 1.00 0.00 H new ATOM 0 HG SER C 30 5.472 14.319 -10.235 1.00 0.00 H new ATOM 1995 N GLY C 31 3.640 16.275 -7.420 1.00 0.00 N ATOM 1996 CA GLY C 31 2.294 16.669 -7.753 1.00 0.00 C ATOM 1997 C GLY C 31 1.254 16.041 -6.854 1.00 0.00 C ATOM 1998 O GLY C 31 0.243 15.535 -7.333 1.00 0.00 O ATOM 0 H GLY C 31 4.072 16.816 -6.671 1.00 0.00 H new ATOM 0 HA2 GLY C 31 2.213 17.754 -7.690 1.00 0.00 H new ATOM 0 HA3 GLY C 31 2.086 16.394 -8.787 1.00 0.00 H new ATOM 2002 N LYS C 32 1.487 16.060 -5.543 1.00 0.00 N ATOM 2003 CA LYS C 32 0.498 15.581 -4.590 1.00 0.00 C ATOM 2004 C LYS C 32 0.069 16.733 -3.688 1.00 0.00 C ATOM 2005 O LYS C 32 -1.110 16.916 -3.398 1.00 0.00 O ATOM 2006 CB LYS C 32 1.084 14.483 -3.702 1.00 0.00 C ATOM 2007 CG LYS C 32 1.715 13.320 -4.450 1.00 0.00 C ATOM 2008 CD LYS C 32 2.244 12.272 -3.480 1.00 0.00 C ATOM 2009 CE LYS C 32 3.328 12.837 -2.572 1.00 0.00 C ATOM 2010 NZ LYS C 32 3.704 11.891 -1.490 1.00 0.00 N ATOM 0 H LYS C 32 2.351 16.402 -5.121 1.00 0.00 H new ATOM 0 HA LYS C 32 -0.349 15.184 -5.150 1.00 0.00 H new ATOM 0 HB2 LYS C 32 1.836 14.927 -3.050 1.00 0.00 H new ATOM 0 HB3 LYS C 32 0.293 14.096 -3.059 1.00 0.00 H new ATOM 0 HG2 LYS C 32 0.979 12.868 -5.114 1.00 0.00 H new ATOM 0 HG3 LYS C 32 2.529 13.684 -5.077 1.00 0.00 H new ATOM 0 HD2 LYS C 32 1.423 11.892 -2.872 1.00 0.00 H new ATOM 0 HD3 LYS C 32 2.644 11.427 -4.041 1.00 0.00 H new ATOM 0 HE2 LYS C 32 4.210 13.075 -3.167 1.00 0.00 H new ATOM 0 HE3 LYS C 32 2.980 13.771 -2.131 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 4.534 12.257 -0.981 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 2.909 11.788 -0.827 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 3.933 10.964 -1.903 1.00 0.00 H new ATOM 2024 N GLY C 33 1.062 17.504 -3.236 1.00 0.00 N ATOM 2025 CA GLY C 33 0.832 18.560 -2.284 1.00 0.00 C ATOM 2026 C GLY C 33 1.547 18.272 -0.982 1.00 0.00 C ATOM 2027 O GLY C 33 2.138 19.162 -0.374 1.00 0.00 O ATOM 0 H GLY C 33 2.035 17.404 -3.525 1.00 0.00 H new ATOM 0 HA2 GLY C 33 1.180 19.508 -2.694 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.237 18.665 -2.102 1.00 0.00 H new ATOM 2031 N VAL C 34 1.552 17.006 -0.592 1.00 0.00 N ATOM 2032 CA VAL C 34 2.146 16.590 0.672 1.00 0.00 C ATOM 2033 C VAL C 34 3.388 15.723 0.456 1.00 0.00 C ATOM 2034 O VAL C 34 3.631 15.224 -0.648 1.00 0.00 O ATOM 2035 CB VAL C 34 1.123 15.803 1.521 1.00 0.00 C ATOM 2036 CG1 VAL C 34 -0.026 16.700 1.955 1.00 0.00 C ATOM 2037 CG2 VAL C 34 0.593 14.610 0.742 1.00 0.00 C ATOM 0 H VAL C 34 1.149 16.243 -1.136 1.00 0.00 H new ATOM 0 HA VAL C 34 2.442 17.497 1.199 1.00 0.00 H new ATOM 0 HB VAL C 34 1.632 15.441 2.415 1.00 0.00 H new ATOM 0 HG11 VAL C 34 -0.733 16.123 2.551 1.00 0.00 H new ATOM 0 HG12 VAL C 34 0.362 17.526 2.551 1.00 0.00 H new ATOM 0 HG13 VAL C 34 -0.532 17.095 1.074 1.00 0.00 H new ATOM 0 HG21 VAL C 34 -0.126 14.066 1.354 1.00 0.00 H new ATOM 0 HG22 VAL C 34 0.105 14.958 -0.169 1.00 0.00 H new ATOM 0 HG23 VAL C 34 1.420 13.949 0.481 1.00 0.00 H new ATOM 2047 N ILE C 35 4.175 15.575 1.515 1.00 0.00 N ATOM 2048 CA ILE C 35 5.349 14.708 1.512 1.00 0.00 C ATOM 2049 C ILE C 35 5.265 13.687 2.640 1.00 0.00 C ATOM 2050 O ILE C 35 4.529 13.876 3.600 1.00 0.00 O ATOM 2051 CB ILE C 35 6.661 15.509 1.647 1.00 0.00 C ATOM 2052 CG1 ILE C 35 6.523 16.583 2.730 1.00 0.00 C ATOM 2053 CG2 ILE C 35 7.044 16.123 0.312 1.00 0.00 C ATOM 2054 CD1 ILE C 35 7.800 17.352 3.002 1.00 0.00 C ATOM 0 H ILE C 35 4.018 16.053 2.402 1.00 0.00 H new ATOM 0 HA ILE C 35 5.360 14.195 0.551 1.00 0.00 H new ATOM 0 HB ILE C 35 7.458 14.829 1.948 1.00 0.00 H new ATOM 0 HG12 ILE C 35 5.744 17.286 2.433 1.00 0.00 H new ATOM 0 HG13 ILE C 35 6.191 16.111 3.655 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.971 16.685 0.423 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.185 15.332 -0.425 1.00 0.00 H new ATOM 0 HG23 ILE C 35 6.251 16.793 -0.021 1.00 0.00 H new ATOM 0 HD11 ILE C 35 7.620 18.093 3.781 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.577 16.662 3.331 1.00 0.00 H new ATOM 0 HD13 ILE C 35 8.123 17.855 2.090 1.00 0.00 H new ATOM 2066 N LEU C 36 6.023 12.607 2.515 1.00 0.00 N ATOM 2067 CA LEU C 36 5.896 11.479 3.432 1.00 0.00 C ATOM 2068 C LEU C 36 6.758 11.623 4.678 1.00 0.00 C ATOM 2069 O LEU C 36 7.714 12.400 4.719 1.00 0.00 O ATOM 2070 CB LEU C 36 6.271 10.173 2.721 1.00 0.00 C ATOM 2071 CG LEU C 36 5.468 9.871 1.458 1.00 0.00 C ATOM 2072 CD1 LEU C 36 6.207 10.352 0.217 1.00 0.00 C ATOM 2073 CD2 LEU C 36 5.168 8.390 1.371 1.00 0.00 C ATOM 0 H LEU C 36 6.731 12.486 1.791 1.00 0.00 H new ATOM 0 HA LEU C 36 4.853 11.460 3.749 1.00 0.00 H new ATOM 0 HB2 LEU C 36 7.329 10.210 2.461 1.00 0.00 H new ATOM 0 HB3 LEU C 36 6.144 9.347 3.420 1.00 0.00 H new ATOM 0 HG LEU C 36 4.523 10.411 1.511 1.00 0.00 H new ATOM 0 HD11 LEU C 36 5.615 10.126 -0.670 1.00 0.00 H new ATOM 0 HD12 LEU C 36 6.366 11.428 0.282 1.00 0.00 H new ATOM 0 HD13 LEU C 36 7.170 9.847 0.149 1.00 0.00 H new ATOM 0 HD21 LEU C 36 4.595 8.187 0.466 1.00 0.00 H new ATOM 0 HD22 LEU C 36 6.103 7.831 1.341 1.00 0.00 H new ATOM 0 HD23 LEU C 36 4.590 8.084 2.243 1.00 0.00 H new ATOM 2085 N THR C 37 6.398 10.844 5.689 1.00 0.00 N ATOM 2086 CA THR C 37 7.173 10.729 6.909 1.00 0.00 C ATOM 2087 C THR C 37 7.884 9.384 6.895 1.00 0.00 C ATOM 2088 O THR C 37 7.645 8.590 5.990 1.00 0.00 O ATOM 2089 CB THR C 37 6.264 10.808 8.153 1.00 0.00 C ATOM 2090 OG1 THR C 37 5.355 9.696 8.163 1.00 0.00 O ATOM 2091 CG2 THR C 37 5.467 12.103 8.168 1.00 0.00 C ATOM 0 H THR C 37 5.554 10.272 5.682 1.00 0.00 H new ATOM 0 HA THR C 37 7.888 11.550 6.957 1.00 0.00 H new ATOM 0 HB THR C 37 6.900 10.779 9.038 1.00 0.00 H new ATOM 0 HG1 THR C 37 4.611 9.887 8.771 1.00 0.00 H new ATOM 0 HG21 THR C 37 4.835 12.131 9.056 1.00 0.00 H new ATOM 0 HG22 THR C 37 6.151 12.951 8.182 1.00 0.00 H new ATOM 0 HG23 THR C 37 4.842 12.156 7.276 1.00 0.00 H new ATOM 2099 N ALA C 38 8.737 9.111 7.873 1.00 0.00 N ATOM 2100 CA ALA C 38 9.494 7.858 7.888 1.00 0.00 C ATOM 2101 C ALA C 38 8.566 6.643 7.837 1.00 0.00 C ATOM 2102 O ALA C 38 8.833 5.681 7.111 1.00 0.00 O ATOM 2103 CB ALA C 38 10.398 7.794 9.105 1.00 0.00 C ATOM 0 H ALA C 38 8.924 9.731 8.661 1.00 0.00 H new ATOM 0 HA ALA C 38 10.117 7.835 6.994 1.00 0.00 H new ATOM 0 HB1 ALA C 38 10.952 6.855 9.098 1.00 0.00 H new ATOM 0 HB2 ALA C 38 11.098 8.629 9.082 1.00 0.00 H new ATOM 0 HB3 ALA C 38 9.794 7.852 10.010 1.00 0.00 H new ATOM 2109 N GLN C 39 7.477 6.691 8.601 1.00 0.00 N ATOM 2110 CA GLN C 39 6.474 5.633 8.557 1.00 0.00 C ATOM 2111 C GLN C 39 5.895 5.491 7.153 1.00 0.00 C ATOM 2112 O GLN C 39 5.755 4.381 6.642 1.00 0.00 O ATOM 2113 CB GLN C 39 5.350 5.908 9.557 1.00 0.00 C ATOM 2114 CG GLN C 39 4.276 4.831 9.558 1.00 0.00 C ATOM 2115 CD GLN C 39 3.247 5.023 10.649 1.00 0.00 C ATOM 2116 OE1 GLN C 39 3.540 5.574 11.709 1.00 0.00 O ATOM 2117 NE2 GLN C 39 2.036 4.553 10.402 1.00 0.00 N ATOM 0 H GLN C 39 7.268 7.447 9.254 1.00 0.00 H new ATOM 0 HA GLN C 39 6.965 4.699 8.829 1.00 0.00 H new ATOM 0 HB2 GLN C 39 5.774 5.991 10.558 1.00 0.00 H new ATOM 0 HB3 GLN C 39 4.892 6.869 9.324 1.00 0.00 H new ATOM 0 HG2 GLN C 39 3.774 4.825 8.590 1.00 0.00 H new ATOM 0 HG3 GLN C 39 4.748 3.856 9.679 1.00 0.00 H new ATOM 0 HE21 GLN C 39 1.836 4.103 9.509 1.00 0.00 H new ATOM 0 HE22 GLN C 39 1.302 4.641 11.105 1.00 0.00 H new ATOM 2126 N GLY C 40 5.581 6.619 6.525 1.00 0.00 N ATOM 2127 CA GLY C 40 5.038 6.592 5.182 1.00 0.00 C ATOM 2128 C GLY C 40 6.078 6.179 4.162 1.00 0.00 C ATOM 2129 O GLY C 40 5.751 5.606 3.126 1.00 0.00 O ATOM 0 H GLY C 40 5.693 7.551 6.923 1.00 0.00 H new ATOM 0 HA2 GLY C 40 4.197 5.900 5.144 1.00 0.00 H new ATOM 0 HA3 GLY C 40 4.651 7.578 4.927 1.00 0.00 H new ATOM 2133 N TYR C 41 7.338 6.460 4.464 1.00 0.00 N ATOM 2134 CA TYR C 41 8.439 6.035 3.616 1.00 0.00 C ATOM 2135 C TYR C 41 8.617 4.527 3.674 1.00 0.00 C ATOM 2136 O TYR C 41 8.984 3.901 2.678 1.00 0.00 O ATOM 2137 CB TYR C 41 9.732 6.738 4.058 1.00 0.00 C ATOM 2138 CG TYR C 41 9.982 8.064 3.366 1.00 0.00 C ATOM 2139 CD1 TYR C 41 10.428 8.109 2.051 1.00 0.00 C ATOM 2140 CD2 TYR C 41 9.770 9.267 4.024 1.00 0.00 C ATOM 2141 CE1 TYR C 41 10.654 9.316 1.415 1.00 0.00 C ATOM 2142 CE2 TYR C 41 9.993 10.477 3.395 1.00 0.00 C ATOM 2143 CZ TYR C 41 10.435 10.496 2.091 1.00 0.00 C ATOM 2144 OH TYR C 41 10.654 11.697 1.460 1.00 0.00 O ATOM 0 H TYR C 41 7.622 6.982 5.293 1.00 0.00 H new ATOM 0 HA TYR C 41 8.211 6.310 2.586 1.00 0.00 H new ATOM 0 HB2 TYR C 41 9.693 6.904 5.135 1.00 0.00 H new ATOM 0 HB3 TYR C 41 10.577 6.076 3.868 1.00 0.00 H new ATOM 0 HD1 TYR C 41 10.601 7.186 1.517 1.00 0.00 H new ATOM 0 HD2 TYR C 41 9.424 9.258 5.047 1.00 0.00 H new ATOM 0 HE1 TYR C 41 11.001 9.333 0.392 1.00 0.00 H new ATOM 0 HE2 TYR C 41 9.821 11.403 3.923 1.00 0.00 H new ATOM 0 HH TYR C 41 10.451 12.432 2.076 1.00 0.00 H new ATOM 2154 N THR C 42 8.314 3.942 4.819 1.00 0.00 N ATOM 2155 CA THR C 42 8.349 2.498 4.966 1.00 0.00 C ATOM 2156 C THR C 42 7.196 1.868 4.197 1.00 0.00 C ATOM 2157 O THR C 42 7.315 0.772 3.641 1.00 0.00 O ATOM 2158 CB THR C 42 8.239 2.101 6.452 1.00 0.00 C ATOM 2159 OG1 THR C 42 9.199 2.831 7.221 1.00 0.00 O ATOM 2160 CG2 THR C 42 8.466 0.608 6.643 1.00 0.00 C ATOM 0 H THR C 42 8.040 4.446 5.662 1.00 0.00 H new ATOM 0 HA THR C 42 9.298 2.138 4.568 1.00 0.00 H new ATOM 0 HB THR C 42 7.232 2.342 6.792 1.00 0.00 H new ATOM 0 HG1 THR C 42 8.956 3.780 7.232 1.00 0.00 H new ATOM 0 HG21 THR C 42 8.382 0.360 7.701 1.00 0.00 H new ATOM 0 HG22 THR C 42 7.718 0.051 6.079 1.00 0.00 H new ATOM 0 HG23 THR C 42 9.461 0.343 6.286 1.00 0.00 H new ATOM 2168 N LEU C 43 6.092 2.596 4.131 1.00 0.00 N ATOM 2169 CA LEU C 43 4.888 2.089 3.508 1.00 0.00 C ATOM 2170 C LEU C 43 4.878 2.361 2.007 1.00 0.00 C ATOM 2171 O LEU C 43 4.157 1.699 1.272 1.00 0.00 O ATOM 2172 CB LEU C 43 3.637 2.696 4.161 1.00 0.00 C ATOM 2173 CG LEU C 43 2.942 1.820 5.220 1.00 0.00 C ATOM 2174 CD1 LEU C 43 3.906 1.455 6.334 1.00 0.00 C ATOM 2175 CD2 LEU C 43 1.728 2.535 5.792 1.00 0.00 C ATOM 0 H LEU C 43 6.009 3.542 4.504 1.00 0.00 H new ATOM 0 HA LEU C 43 4.875 1.009 3.658 1.00 0.00 H new ATOM 0 HB2 LEU C 43 3.915 3.642 4.625 1.00 0.00 H new ATOM 0 HB3 LEU C 43 2.916 2.926 3.377 1.00 0.00 H new ATOM 0 HG LEU C 43 2.611 0.902 4.734 1.00 0.00 H new ATOM 0 HD11 LEU C 43 3.393 0.836 7.071 1.00 0.00 H new ATOM 0 HD12 LEU C 43 4.749 0.902 5.919 1.00 0.00 H new ATOM 0 HD13 LEU C 43 4.269 2.364 6.813 1.00 0.00 H new ATOM 0 HD21 LEU C 43 1.250 1.900 6.538 1.00 0.00 H new ATOM 0 HD22 LEU C 43 2.042 3.469 6.257 1.00 0.00 H new ATOM 0 HD23 LEU C 43 1.020 2.748 4.991 1.00 0.00 H new ATOM 2187 N LEU C 44 5.686 3.304 1.528 1.00 0.00 N ATOM 2188 CA LEU C 44 5.676 3.617 0.104 1.00 0.00 C ATOM 2189 C LEU C 44 6.519 2.610 -0.666 1.00 0.00 C ATOM 2190 O LEU C 44 6.094 2.102 -1.697 1.00 0.00 O ATOM 2191 CB LEU C 44 6.140 5.071 -0.165 1.00 0.00 C ATOM 2192 CG LEU C 44 7.656 5.333 -0.295 1.00 0.00 C ATOM 2193 CD1 LEU C 44 8.176 4.986 -1.688 1.00 0.00 C ATOM 2194 CD2 LEU C 44 7.969 6.787 0.004 1.00 0.00 C ATOM 0 H LEU C 44 6.339 3.851 2.089 1.00 0.00 H new ATOM 0 HA LEU C 44 4.648 3.543 -0.251 1.00 0.00 H new ATOM 0 HB2 LEU C 44 5.662 5.410 -1.084 1.00 0.00 H new ATOM 0 HB3 LEU C 44 5.760 5.698 0.642 1.00 0.00 H new ATOM 0 HG LEU C 44 8.155 4.689 0.429 1.00 0.00 H new ATOM 0 HD11 LEU C 44 9.247 5.185 -1.737 1.00 0.00 H new ATOM 0 HD12 LEU C 44 7.993 3.931 -1.892 1.00 0.00 H new ATOM 0 HD13 LEU C 44 7.660 5.594 -2.431 1.00 0.00 H new ATOM 0 HD21 LEU C 44 9.042 6.955 -0.092 1.00 0.00 H new ATOM 0 HD22 LEU C 44 7.437 7.426 -0.701 1.00 0.00 H new ATOM 0 HD23 LEU C 44 7.654 7.026 1.020 1.00 0.00 H new ATOM 2206 N ASP C 45 7.706 2.301 -0.157 1.00 0.00 N ATOM 2207 CA ASP C 45 8.609 1.405 -0.864 1.00 0.00 C ATOM 2208 C ASP C 45 8.115 -0.028 -0.773 1.00 0.00 C ATOM 2209 O ASP C 45 8.424 -0.860 -1.628 1.00 0.00 O ATOM 2210 CB ASP C 45 10.032 1.518 -0.321 1.00 0.00 C ATOM 2211 CG ASP C 45 11.041 0.874 -1.248 1.00 0.00 C ATOM 2212 OD1 ASP C 45 11.225 1.389 -2.374 1.00 0.00 O ATOM 2213 OD2 ASP C 45 11.646 -0.148 -0.866 1.00 0.00 O ATOM 0 H ASP C 45 8.061 2.653 0.732 1.00 0.00 H new ATOM 0 HA ASP C 45 8.625 1.701 -1.913 1.00 0.00 H new ATOM 0 HB2 ASP C 45 10.285 2.569 -0.182 1.00 0.00 H new ATOM 0 HB3 ASP C 45 10.085 1.045 0.659 1.00 0.00 H new ATOM 2218 N PHE C 46 7.301 -0.306 0.236 1.00 0.00 N ATOM 2219 CA PHE C 46 6.689 -1.616 0.380 1.00 0.00 C ATOM 2220 C PHE C 46 5.582 -1.802 -0.641 1.00 0.00 C ATOM 2221 O PHE C 46 5.456 -2.872 -1.241 1.00 0.00 O ATOM 2222 CB PHE C 46 6.104 -1.720 1.790 1.00 0.00 C ATOM 2223 CG PHE C 46 5.497 -3.047 2.137 1.00 0.00 C ATOM 2224 CD1 PHE C 46 6.271 -4.056 2.683 1.00 0.00 C ATOM 2225 CD2 PHE C 46 4.147 -3.280 1.930 1.00 0.00 C ATOM 2226 CE1 PHE C 46 5.711 -5.272 3.018 1.00 0.00 C ATOM 2227 CE2 PHE C 46 3.581 -4.492 2.264 1.00 0.00 C ATOM 2228 CZ PHE C 46 4.364 -5.489 2.807 1.00 0.00 C ATOM 0 H PHE C 46 7.050 0.360 0.967 1.00 0.00 H new ATOM 0 HA PHE C 46 7.440 -2.389 0.217 1.00 0.00 H new ATOM 0 HB2 PHE C 46 6.893 -1.501 2.510 1.00 0.00 H new ATOM 0 HB3 PHE C 46 5.342 -0.949 1.907 1.00 0.00 H new ATOM 0 HD1 PHE C 46 7.325 -3.890 2.849 1.00 0.00 H new ATOM 0 HD2 PHE C 46 3.531 -2.503 1.502 1.00 0.00 H new ATOM 0 HE1 PHE C 46 6.325 -6.052 3.444 1.00 0.00 H new ATOM 0 HE2 PHE C 46 2.527 -4.660 2.101 1.00 0.00 H new ATOM 0 HZ PHE C 46 3.923 -6.440 3.067 1.00 0.00 H new ATOM 2238 N ILE C 47 4.807 -0.760 -0.874 1.00 0.00 N ATOM 2239 CA ILE C 47 3.731 -0.867 -1.836 1.00 0.00 C ATOM 2240 C ILE C 47 4.280 -0.780 -3.251 1.00 0.00 C ATOM 2241 O ILE C 47 3.757 -1.417 -4.165 1.00 0.00 O ATOM 2242 CB ILE C 47 2.638 0.201 -1.621 1.00 0.00 C ATOM 2243 CG1 ILE C 47 3.189 1.609 -1.880 1.00 0.00 C ATOM 2244 CG2 ILE C 47 2.087 0.090 -0.207 1.00 0.00 C ATOM 2245 CD1 ILE C 47 2.173 2.711 -1.710 1.00 0.00 C ATOM 0 H ILE C 47 4.899 0.150 -0.422 1.00 0.00 H new ATOM 0 HA ILE C 47 3.263 -1.840 -1.686 1.00 0.00 H new ATOM 0 HB ILE C 47 1.831 0.026 -2.332 1.00 0.00 H new ATOM 0 HG12 ILE C 47 4.023 1.791 -1.202 1.00 0.00 H new ATOM 0 HG13 ILE C 47 3.587 1.650 -2.894 1.00 0.00 H new ATOM 0 HG21 ILE C 47 1.315 0.845 -0.057 1.00 0.00 H new ATOM 0 HG22 ILE C 47 1.658 -0.901 -0.060 1.00 0.00 H new ATOM 0 HG23 ILE C 47 2.892 0.247 0.511 1.00 0.00 H new ATOM 0 HD11 ILE C 47 2.643 3.674 -1.911 1.00 0.00 H new ATOM 0 HD12 ILE C 47 1.349 2.557 -2.407 1.00 0.00 H new ATOM 0 HD13 ILE C 47 1.792 2.700 -0.689 1.00 0.00 H new ATOM 2257 N GLN C 48 5.365 -0.025 -3.407 1.00 0.00 N ATOM 2258 CA GLN C 48 6.124 -0.014 -4.646 1.00 0.00 C ATOM 2259 C GLN C 48 6.439 -1.440 -5.041 1.00 0.00 C ATOM 2260 O GLN C 48 5.945 -1.949 -6.027 1.00 0.00 O ATOM 2261 CB GLN C 48 7.441 0.740 -4.462 1.00 0.00 C ATOM 2262 CG GLN C 48 7.305 2.253 -4.403 1.00 0.00 C ATOM 2263 CD GLN C 48 7.542 2.895 -5.753 1.00 0.00 C ATOM 2264 OE1 GLN C 48 8.302 2.372 -6.568 1.00 0.00 O ATOM 2265 NE2 GLN C 48 6.908 4.028 -5.998 1.00 0.00 N ATOM 0 H GLN C 48 5.737 0.590 -2.683 1.00 0.00 H new ATOM 0 HA GLN C 48 5.532 0.480 -5.416 1.00 0.00 H new ATOM 0 HB2 GLN C 48 7.916 0.396 -3.543 1.00 0.00 H new ATOM 0 HB3 GLN C 48 8.110 0.481 -5.283 1.00 0.00 H new ATOM 0 HG2 GLN C 48 6.308 2.514 -4.047 1.00 0.00 H new ATOM 0 HG3 GLN C 48 8.017 2.653 -3.681 1.00 0.00 H new ATOM 0 HE21 GLN C 48 6.287 4.427 -5.294 1.00 0.00 H new ATOM 0 HE22 GLN C 48 7.040 4.503 -6.891 1.00 0.00 H new ATOM 2274 N LYS C 49 7.126 -2.104 -4.146 1.00 0.00 N ATOM 2275 CA LYS C 49 7.826 -3.346 -4.420 1.00 0.00 C ATOM 2276 C LYS C 49 6.877 -4.546 -4.471 1.00 0.00 C ATOM 2277 O LYS C 49 7.320 -5.685 -4.612 1.00 0.00 O ATOM 2278 CB LYS C 49 8.863 -3.518 -3.310 1.00 0.00 C ATOM 2279 CG LYS C 49 9.984 -4.493 -3.602 1.00 0.00 C ATOM 2280 CD LYS C 49 10.712 -4.869 -2.317 1.00 0.00 C ATOM 2281 CE LYS C 49 11.159 -3.640 -1.536 1.00 0.00 C ATOM 2282 NZ LYS C 49 11.728 -4.004 -0.213 1.00 0.00 N ATOM 0 H LYS C 49 7.220 -1.792 -3.179 1.00 0.00 H new ATOM 0 HA LYS C 49 8.298 -3.300 -5.402 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.301 -2.544 -3.094 1.00 0.00 H new ATOM 0 HB3 LYS C 49 8.349 -3.844 -2.406 1.00 0.00 H new ATOM 0 HG2 LYS C 49 9.581 -5.389 -4.074 1.00 0.00 H new ATOM 0 HG3 LYS C 49 10.686 -4.049 -4.308 1.00 0.00 H new ATOM 0 HD2 LYS C 49 10.057 -5.477 -1.693 1.00 0.00 H new ATOM 0 HD3 LYS C 49 11.581 -5.482 -2.558 1.00 0.00 H new ATOM 0 HE2 LYS C 49 11.904 -3.093 -2.114 1.00 0.00 H new ATOM 0 HE3 LYS C 49 10.310 -2.970 -1.395 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 11.926 -3.139 0.329 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 11.046 -4.591 0.309 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 12.610 -4.537 -0.349 1.00 0.00 H new ATOM 2296 N HIS C 50 5.575 -4.325 -4.282 1.00 0.00 N ATOM 2297 CA HIS C 50 4.651 -5.420 -4.595 1.00 0.00 C ATOM 2298 C HIS C 50 3.708 -5.128 -5.756 1.00 0.00 C ATOM 2299 O HIS C 50 3.037 -6.045 -6.227 1.00 0.00 O ATOM 2300 CB HIS C 50 3.816 -5.754 -3.358 1.00 0.00 C ATOM 2301 CG HIS C 50 4.642 -5.977 -2.137 1.00 0.00 C ATOM 2302 ND1 HIS C 50 5.892 -6.547 -2.176 1.00 0.00 N ATOM 2303 CD2 HIS C 50 4.423 -5.640 -0.850 1.00 0.00 C ATOM 2304 CE1 HIS C 50 6.408 -6.549 -0.966 1.00 0.00 C ATOM 2305 NE2 HIS C 50 5.539 -6.003 -0.141 1.00 0.00 N ATOM 0 H HIS C 50 5.155 -3.461 -3.938 1.00 0.00 H new ATOM 0 HA HIS C 50 5.275 -6.260 -4.899 1.00 0.00 H new ATOM 0 HB2 HIS C 50 3.114 -4.942 -3.171 1.00 0.00 H new ATOM 0 HB3 HIS C 50 3.224 -6.647 -3.557 1.00 0.00 H new ATOM 0 HD1 HIS C 50 6.348 -6.911 -3.012 1.00 0.00 H new ATOM 0 HD2 HIS C 50 3.535 -5.172 -0.452 1.00 0.00 H new ATOM 0 HE1 HIS C 50 7.380 -6.934 -0.695 1.00 0.00 H new ATOM 0 HE2 HIS C 50 5.674 -5.872 0.861 1.00 0.00 H new ATOM 2314 N LEU C 51 3.651 -3.896 -6.244 1.00 0.00 N ATOM 2315 CA LEU C 51 2.764 -3.598 -7.371 1.00 0.00 C ATOM 2316 C LEU C 51 3.506 -2.902 -8.510 1.00 0.00 C ATOM 2317 O LEU C 51 3.335 -3.252 -9.677 1.00 0.00 O ATOM 2318 CB LEU C 51 1.569 -2.735 -6.940 1.00 0.00 C ATOM 2319 CG LEU C 51 0.642 -3.341 -5.876 1.00 0.00 C ATOM 2320 CD1 LEU C 51 -0.646 -2.541 -5.768 1.00 0.00 C ATOM 2321 CD2 LEU C 51 0.321 -4.789 -6.189 1.00 0.00 C ATOM 0 H LEU C 51 4.190 -3.104 -5.893 1.00 0.00 H new ATOM 0 HA LEU C 51 2.394 -4.559 -7.730 1.00 0.00 H new ATOM 0 HB2 LEU C 51 1.950 -1.787 -6.562 1.00 0.00 H new ATOM 0 HB3 LEU C 51 0.973 -2.509 -7.824 1.00 0.00 H new ATOM 0 HG LEU C 51 1.167 -3.301 -4.922 1.00 0.00 H new ATOM 0 HD11 LEU C 51 -1.289 -2.987 -5.009 1.00 0.00 H new ATOM 0 HD12 LEU C 51 -0.414 -1.513 -5.489 1.00 0.00 H new ATOM 0 HD13 LEU C 51 -1.161 -2.548 -6.729 1.00 0.00 H new ATOM 0 HD21 LEU C 51 -0.337 -5.191 -5.418 1.00 0.00 H new ATOM 0 HD22 LEU C 51 -0.175 -4.851 -7.158 1.00 0.00 H new ATOM 0 HD23 LEU C 51 1.244 -5.369 -6.216 1.00 0.00 H new ATOM 2333 N ASN C 52 4.349 -1.943 -8.161 1.00 0.00 N ATOM 2334 CA ASN C 52 5.020 -1.103 -9.152 1.00 0.00 C ATOM 2335 C ASN C 52 6.488 -1.482 -9.306 1.00 0.00 C ATOM 2336 O ASN C 52 7.105 -1.220 -10.340 1.00 0.00 O ATOM 2337 CB ASN C 52 4.899 0.369 -8.752 1.00 0.00 C ATOM 2338 CG ASN C 52 3.674 1.034 -9.350 1.00 0.00 C ATOM 2339 OD1 ASN C 52 2.635 0.403 -9.526 1.00 0.00 O ATOM 2340 ND2 ASN C 52 3.792 2.311 -9.681 1.00 0.00 N ATOM 0 H ASN C 52 4.589 -1.723 -7.194 1.00 0.00 H new ATOM 0 HA ASN C 52 4.532 -1.262 -10.114 1.00 0.00 H new ATOM 0 HB2 ASN C 52 4.856 0.445 -7.665 1.00 0.00 H new ATOM 0 HB3 ASN C 52 5.792 0.904 -9.073 1.00 0.00 H new ATOM 0 HD21 ASN C 52 3.003 2.805 -10.098 1.00 0.00 H new ATOM 0 HD22 ASN C 52 4.672 2.801 -9.519 1.00 0.00 H new ATOM 2347 N LYS C 53 7.041 -2.074 -8.267 1.00 0.00 N ATOM 2348 CA LYS C 53 8.390 -2.587 -8.292 1.00 0.00 C ATOM 2349 C LYS C 53 8.357 -4.113 -8.256 1.00 0.00 C ATOM 2350 O LYS C 53 8.260 -4.728 -9.341 1.00 0.00 O ATOM 2351 CB LYS C 53 9.170 -2.029 -7.099 1.00 0.00 C ATOM 2352 CG LYS C 53 10.065 -0.854 -7.442 1.00 0.00 C ATOM 2353 CD LYS C 53 11.187 -0.715 -6.424 1.00 0.00 C ATOM 2354 CE LYS C 53 10.692 -0.181 -5.094 1.00 0.00 C ATOM 2355 NZ LYS C 53 10.612 1.301 -5.088 1.00 0.00 N ATOM 2356 OXT LYS C 53 8.400 -4.687 -7.156 1.00 0.00 O ATOM 0 H LYS C 53 6.562 -2.212 -7.377 1.00 0.00 H new ATOM 0 HA LYS C 53 8.889 -2.274 -9.209 1.00 0.00 H new ATOM 0 HB2 LYS C 53 8.464 -1.721 -6.328 1.00 0.00 H new ATOM 0 HB3 LYS C 53 9.780 -2.825 -6.673 1.00 0.00 H new ATOM 0 HG2 LYS C 53 10.486 -0.990 -8.438 1.00 0.00 H new ATOM 0 HG3 LYS C 53 9.476 0.063 -7.468 1.00 0.00 H new ATOM 0 HD2 LYS C 53 11.658 -1.686 -6.271 1.00 0.00 H new ATOM 0 HD3 LYS C 53 11.953 -0.048 -6.819 1.00 0.00 H new ATOM 0 HE2 LYS C 53 9.708 -0.599 -4.879 1.00 0.00 H new ATOM 0 HE3 LYS C 53 11.360 -0.512 -4.299 1.00 0.00 H new ATOM 0 HZ1 LYS C 53 10.537 1.641 -4.108 1.00 0.00 H new ATOM 0 HZ2 LYS C 53 11.468 1.697 -5.527 1.00 0.00 H new ATOM 0 HZ3 LYS C 53 9.775 1.606 -5.625 1.00 0.00 H new TER 2370 LYS C 53 HETATM 2371 ZN ZN A 54 -20.717 -4.133 -2.512 1.00 0.00 ZN HETATM 2372 ZN ZN B 54 13.973 -15.371 -3.048 1.00 0.00 ZN HETATM 2373 ZN ZN C 54 6.623 20.000 -2.592 1.00 0.00 ZN