USER MOD reduce.3.24.130724 H: found=0, std=0, add=1462, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1460 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: C 79 TYR OH : rot -91:sc= 2.05 USER MOD Set 1.2: C 83 TYR OH : rot 150:sc= 0.63 USER MOD Set 2.1: C 35 HIS : no HD1:sc= -16.2! C(o=-18!,f=-26!) USER MOD Set 2.2: C 78 THR OG1 : rot -85:sc= -2! USER MOD Set 3.1: C 27 HIS : no HD1:sc= -4.01! C(o=-4.2!,f=-6.5!) USER MOD Set 3.2: C 67 SER OG : rot 124:sc= -0.203 USER MOD Set 4.1: B 6 MET CE :methyl -128:sc= -0.382 (180deg=-1.3) USER MOD Set 4.2: B 74 THR OG1 : rot 140:sc= -0.0686 USER MOD Single : A 1 VAL N :NH3+ 156:sc= -0.192 (180deg=-1) USER MOD Single : A 3 THR OG1 : rot -168:sc= 0.535 USER MOD Single : A 5 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.003) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 CYS SG : rot -46:sc= -4.32! USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 130:sc= -4! USER MOD Single : A 13 ASN : amide:sc= -8.18! C(o=-8.2!,f=-15!) USER MOD Single : A 15 HIS : no HE2:sc= 1.12 K(o=1.1,f=-3.4!) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 HIS : no HD1:sc= -6.49! C(o=-6.5!,f=-9.1!) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot 71:sc= 0.493! USER MOD Single : B 13 THR OG1 : rot 112:sc= 0.273! USER MOD Single : B 16 THR OG1 : rot -90:sc= -3.39! USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 21 SER OG : rot 180:sc= 0.107 USER MOD Single : B 22 SER OG : rot -150:sc= -0.624 USER MOD Single : B 23 THR OG1 : rot -86:sc= -3.58! USER MOD Single : B 28 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.195) USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 42 GLN : amide:sc= -8.98! C(o=-9!,f=-12!) USER MOD Single : B 45 TYR OH : rot 180:sc= 0 USER MOD Single : B 46 LYS NZ :NH3+ 142:sc= -0.272 (180deg=-1.84!) USER MOD Single : B 49 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : B 55 LYS NZ :NH3+ -147:sc= -0.0503 (180deg=-0.811) USER MOD Single : B 56 THR OG1 : rot -92:sc= -0.608 USER MOD Single : B 60 CYS SG : rot 106:sc= -1.36! USER MOD Single : B 63 THR OG1 : rot -49:sc= 0.308! USER MOD Single : B 64 SER OG : rot 60:sc= 1.1 USER MOD Single : B 65 GLN : amide:sc=-0.00445 X(o=-0.0044,f=-0.31) USER MOD Single : B 66 THR OG1 : rot -110:sc= -1.94! USER MOD Single : B 70 GLN : amide:sc= -0.884 K(o=-0.88,f=-0.21) USER MOD Single : B 89 CYS SG : rot 180:sc= -0.0537 USER MOD Single : C 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 18 TYR OH : rot 7:sc= 0.431 USER MOD Single : C 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 23 SER OG : rot -45:sc= -1.58 USER MOD Single : C 24 SER OG : rot 180:sc= 0 USER MOD Single : C 32 LYS NZ :NH3+ -152:sc= -0.0186 (180deg=-0.522) USER MOD Single : C 38 THR OG1 : rot 81:sc= -5.89! USER MOD Single : C 39 SER OG : rot 90:sc= -4.13! USER MOD Single : C 41 THR OG1 : rot -52:sc= -1.61 USER MOD Single : C 43 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.452) USER MOD Single : C 45 MET CE :methyl 147:sc= 0 (180deg=-0.012) USER MOD Single : C 58 ASN : amide:sc= -1.2! C(o=-1.2!,f=-3.6!) USER MOD Single : C 61 ASN : amide:sc= -0.422 X(o=-0.42,f=-0.47) USER MOD Single : C 68 HIS : no HE2:sc= -7.62! C(o=-7.6!,f=-7.4!) USER MOD Single : C 71 SER OG : rot 180:sc= 0 USER MOD Single : C 72 LYS NZ :NH3+ -154:sc= -1.19! (180deg=-1.76!) USER MOD Single : C 74 CYS SG : rot 93:sc= -2.65! USER MOD Single : C 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 76 TYR OH : rot 180:sc= 0 USER MOD Single : C 80 LYS NZ :NH3+ -158:sc= -0.0854 (180deg=-1.04) USER MOD Single : C 105 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 108 ASN : amide:sc= -0.173 K(o=-0.17,f=-1.1) USER MOD Single : C 112 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 14.096 4.248 18.542 1.00 0.00 N ATOM 2 CA VAL A 1 13.818 4.424 17.088 1.00 0.00 C ATOM 3 C VAL A 1 12.848 5.552 16.845 1.00 0.00 C ATOM 4 O VAL A 1 11.897 5.779 17.566 1.00 0.00 O ATOM 5 CB VAL A 1 13.236 3.143 16.558 1.00 0.00 C ATOM 6 CG1 VAL A 1 11.951 2.839 17.308 1.00 0.00 C ATOM 7 CG2 VAL A 1 12.927 3.327 15.071 1.00 0.00 C ATOM 0 H1 VAL A 1 14.410 3.273 18.720 1.00 0.00 H new ATOM 0 H2 VAL A 1 14.842 4.911 18.836 1.00 0.00 H new ATOM 0 H3 VAL A 1 13.230 4.438 19.086 1.00 0.00 H new ATOM 0 HA VAL A 1 14.750 4.669 16.578 1.00 0.00 H new ATOM 0 HB VAL A 1 13.940 2.321 16.692 1.00 0.00 H new ATOM 0 HG11 VAL A 1 11.520 1.911 16.931 1.00 0.00 H new ATOM 0 HG12 VAL A 1 12.167 2.733 18.371 1.00 0.00 H new ATOM 0 HG13 VAL A 1 11.242 3.654 17.161 1.00 0.00 H new ATOM 0 HG21 VAL A 1 12.504 2.406 14.671 1.00 0.00 H new ATOM 0 HG22 VAL A 1 12.211 4.140 14.946 1.00 0.00 H new ATOM 0 HG23 VAL A 1 13.846 3.567 14.535 1.00 0.00 H new ATOM 19 N ALA A 2 13.129 6.256 15.823 1.00 0.00 N ATOM 20 CA ALA A 2 12.301 7.425 15.431 1.00 0.00 C ATOM 21 C ALA A 2 11.621 7.183 14.084 1.00 0.00 C ATOM 22 O ALA A 2 12.056 6.369 13.295 1.00 0.00 O ATOM 23 CB ALA A 2 13.311 8.554 15.303 1.00 0.00 C ATOM 0 H ALA A 2 13.924 6.077 15.209 1.00 0.00 H new ATOM 0 HA ALA A 2 11.507 7.632 16.148 1.00 0.00 H new ATOM 0 HB1 ALA A 2 12.797 9.471 15.014 1.00 0.00 H new ATOM 0 HB2 ALA A 2 13.812 8.704 16.259 1.00 0.00 H new ATOM 0 HB3 ALA A 2 14.049 8.297 14.543 1.00 0.00 H new ATOM 29 N THR A 3 10.570 7.901 13.804 1.00 0.00 N ATOM 30 CA THR A 3 9.886 7.727 12.495 1.00 0.00 C ATOM 31 C THR A 3 10.710 8.419 11.407 1.00 0.00 C ATOM 32 O THR A 3 11.883 8.682 11.583 1.00 0.00 O ATOM 33 CB THR A 3 8.526 8.408 12.658 1.00 0.00 C ATOM 34 OG1 THR A 3 8.563 9.275 13.783 1.00 0.00 O ATOM 35 CG2 THR A 3 7.444 7.347 12.865 1.00 0.00 C ATOM 0 H THR A 3 10.157 8.598 14.423 1.00 0.00 H new ATOM 0 HA THR A 3 9.773 6.681 12.211 1.00 0.00 H new ATOM 0 HB THR A 3 8.299 8.985 11.762 1.00 0.00 H new ATOM 0 HG1 THR A 3 7.653 9.567 14.001 1.00 0.00 H new ATOM 0 HG21 THR A 3 6.475 7.833 12.981 1.00 0.00 H new ATOM 0 HG22 THR A 3 7.416 6.683 12.001 1.00 0.00 H new ATOM 0 HG23 THR A 3 7.669 6.768 13.761 1.00 0.00 H new ATOM 43 N LEU A 4 10.115 8.723 10.290 1.00 0.00 N ATOM 44 CA LEU A 4 10.884 9.403 9.210 1.00 0.00 C ATOM 45 C LEU A 4 10.952 10.910 9.477 1.00 0.00 C ATOM 46 O LEU A 4 11.713 11.627 8.859 1.00 0.00 O ATOM 47 CB LEU A 4 10.103 9.121 7.928 1.00 0.00 C ATOM 48 CG LEU A 4 11.065 9.130 6.741 1.00 0.00 C ATOM 49 CD1 LEU A 4 10.314 8.734 5.470 1.00 0.00 C ATOM 50 CD2 LEU A 4 11.646 10.534 6.572 1.00 0.00 C ATOM 0 H LEU A 4 9.136 8.532 10.077 1.00 0.00 H new ATOM 0 HA LEU A 4 11.912 9.045 9.148 1.00 0.00 H new ATOM 0 HB2 LEU A 4 9.602 8.155 7.998 1.00 0.00 H new ATOM 0 HB3 LEU A 4 9.327 9.873 7.788 1.00 0.00 H new ATOM 0 HG LEU A 4 11.871 8.419 6.921 1.00 0.00 H new ATOM 0 HD11 LEU A 4 11.001 8.741 4.624 1.00 0.00 H new ATOM 0 HD12 LEU A 4 9.897 7.734 5.590 1.00 0.00 H new ATOM 0 HD13 LEU A 4 9.507 9.444 5.288 1.00 0.00 H new ATOM 0 HD21 LEU A 4 12.333 10.544 5.726 1.00 0.00 H new ATOM 0 HD22 LEU A 4 10.838 11.243 6.392 1.00 0.00 H new ATOM 0 HD23 LEU A 4 12.182 10.817 7.478 1.00 0.00 H new ATOM 62 N GLN A 5 10.154 11.395 10.388 1.00 0.00 N ATOM 63 CA GLN A 5 10.162 12.859 10.688 1.00 0.00 C ATOM 64 C GLN A 5 11.514 13.284 11.272 1.00 0.00 C ATOM 65 O GLN A 5 11.978 14.385 11.047 1.00 0.00 O ATOM 66 CB GLN A 5 9.048 13.066 11.717 1.00 0.00 C ATOM 67 CG GLN A 5 9.094 11.950 12.762 1.00 0.00 C ATOM 68 CD GLN A 5 9.046 12.559 14.163 1.00 0.00 C ATOM 69 OE1 GLN A 5 10.067 12.741 14.795 1.00 0.00 O ATOM 70 NE2 GLN A 5 7.892 12.886 14.680 1.00 0.00 N ATOM 0 H GLN A 5 9.496 10.843 10.939 1.00 0.00 H new ATOM 0 HA GLN A 5 10.005 13.456 9.790 1.00 0.00 H new ATOM 0 HB2 GLN A 5 9.164 14.035 12.202 1.00 0.00 H new ATOM 0 HB3 GLN A 5 8.078 13.072 11.220 1.00 0.00 H new ATOM 0 HG2 GLN A 5 8.254 11.270 12.621 1.00 0.00 H new ATOM 0 HG3 GLN A 5 10.004 11.362 12.641 1.00 0.00 H new ATOM 0 HE21 GLN A 5 7.034 12.733 14.150 1.00 0.00 H new ATOM 0 HE22 GLN A 5 7.849 13.294 15.614 1.00 0.00 H new ATOM 79 N HIS A 6 12.146 12.428 12.026 1.00 0.00 N ATOM 80 CA HIS A 6 13.462 12.795 12.627 1.00 0.00 C ATOM 81 C HIS A 6 14.565 12.762 11.566 1.00 0.00 C ATOM 82 O HIS A 6 15.367 13.669 11.464 1.00 0.00 O ATOM 83 CB HIS A 6 13.715 11.734 13.699 1.00 0.00 C ATOM 84 CG HIS A 6 15.136 11.836 14.178 1.00 0.00 C ATOM 85 ND1 HIS A 6 15.586 12.904 14.940 1.00 0.00 N ATOM 86 CD2 HIS A 6 16.221 11.010 14.015 1.00 0.00 C ATOM 87 CE1 HIS A 6 16.888 12.694 15.203 1.00 0.00 C ATOM 88 NE2 HIS A 6 17.326 11.555 14.663 1.00 0.00 N ATOM 0 H HIS A 6 11.810 11.492 12.253 1.00 0.00 H new ATOM 0 HA HIS A 6 13.458 13.803 13.041 1.00 0.00 H new ATOM 0 HB2 HIS A 6 13.028 11.873 14.533 1.00 0.00 H new ATOM 0 HB3 HIS A 6 13.527 10.740 13.294 1.00 0.00 H new ATOM 0 HD2 HIS A 6 16.218 10.079 13.467 1.00 0.00 H new ATOM 0 HE1 HIS A 6 17.505 13.366 15.781 1.00 0.00 H new ATOM 0 HE2 HIS A 6 18.268 11.167 14.714 1.00 0.00 H new ATOM 96 N LEU A 7 14.618 11.722 10.781 1.00 0.00 N ATOM 97 CA LEU A 7 15.677 11.630 9.735 1.00 0.00 C ATOM 98 C LEU A 7 15.440 12.665 8.632 1.00 0.00 C ATOM 99 O LEU A 7 16.367 13.249 8.106 1.00 0.00 O ATOM 100 CB LEU A 7 15.557 10.214 9.174 1.00 0.00 C ATOM 101 CG LEU A 7 16.773 9.393 9.604 1.00 0.00 C ATOM 102 CD1 LEU A 7 16.450 7.904 9.490 1.00 0.00 C ATOM 103 CD2 LEU A 7 17.959 9.728 8.695 1.00 0.00 C ATOM 0 H LEU A 7 13.974 10.932 10.818 1.00 0.00 H new ATOM 0 HA LEU A 7 16.669 11.829 10.141 1.00 0.00 H new ATOM 0 HB2 LEU A 7 14.642 9.745 9.534 1.00 0.00 H new ATOM 0 HB3 LEU A 7 15.492 10.246 8.086 1.00 0.00 H new ATOM 0 HG LEU A 7 17.026 9.631 10.637 1.00 0.00 H new ATOM 0 HD11 LEU A 7 17.317 7.319 9.797 1.00 0.00 H new ATOM 0 HD12 LEU A 7 15.604 7.665 10.135 1.00 0.00 H new ATOM 0 HD13 LEU A 7 16.198 7.664 8.457 1.00 0.00 H new ATOM 0 HD21 LEU A 7 18.827 9.144 9.000 1.00 0.00 H new ATOM 0 HD22 LEU A 7 17.705 9.489 7.662 1.00 0.00 H new ATOM 0 HD23 LEU A 7 18.190 10.790 8.775 1.00 0.00 H new ATOM 115 N CYS A 8 14.207 12.898 8.271 1.00 0.00 N ATOM 116 CA CYS A 8 13.919 13.888 7.201 1.00 0.00 C ATOM 117 C CYS A 8 14.465 15.267 7.589 1.00 0.00 C ATOM 118 O CYS A 8 14.928 16.020 6.754 1.00 0.00 O ATOM 119 CB CYS A 8 12.392 13.908 7.099 1.00 0.00 C ATOM 120 SG CYS A 8 11.699 14.961 8.400 1.00 0.00 S ATOM 0 H CYS A 8 13.387 12.443 8.673 1.00 0.00 H new ATOM 0 HA CYS A 8 14.388 13.630 6.251 1.00 0.00 H new ATOM 0 HB2 CYS A 8 12.089 14.279 6.120 1.00 0.00 H new ATOM 0 HB3 CYS A 8 12.000 12.895 7.192 1.00 0.00 H new ATOM 0 HG CYS A 8 12.278 14.690 9.532 1.00 0.00 H new ATOM 126 N ARG A 9 14.417 15.602 8.849 1.00 0.00 N ATOM 127 CA ARG A 9 14.935 16.929 9.289 1.00 0.00 C ATOM 128 C ARG A 9 16.467 16.931 9.268 1.00 0.00 C ATOM 129 O ARG A 9 17.094 17.959 9.111 1.00 0.00 O ATOM 130 CB ARG A 9 14.416 17.104 10.716 1.00 0.00 C ATOM 131 CG ARG A 9 13.549 18.362 10.793 1.00 0.00 C ATOM 132 CD ARG A 9 13.861 19.121 12.085 1.00 0.00 C ATOM 133 NE ARG A 9 13.337 20.496 11.860 1.00 0.00 N ATOM 134 CZ ARG A 9 13.938 21.295 11.020 1.00 0.00 C ATOM 135 NH1 ARG A 9 14.999 20.890 10.377 1.00 0.00 N ATOM 136 NH2 ARG A 9 13.478 22.500 10.824 1.00 0.00 N ATOM 0 H ARG A 9 14.041 15.014 9.593 1.00 0.00 H new ATOM 0 HA ARG A 9 14.608 17.738 8.636 1.00 0.00 H new ATOM 0 HB2 ARG A 9 13.835 16.231 11.013 1.00 0.00 H new ATOM 0 HB3 ARG A 9 15.252 17.182 11.411 1.00 0.00 H new ATOM 0 HG2 ARG A 9 13.738 19.000 9.930 1.00 0.00 H new ATOM 0 HG3 ARG A 9 12.494 18.091 10.764 1.00 0.00 H new ATOM 0 HD2 ARG A 9 13.382 18.652 12.944 1.00 0.00 H new ATOM 0 HD3 ARG A 9 14.932 19.135 12.286 1.00 0.00 H new ATOM 0 HE ARG A 9 12.508 20.814 12.362 1.00 0.00 H new ATOM 0 HH11 ARG A 9 15.360 19.948 10.530 1.00 0.00 H new ATOM 0 HH12 ARG A 9 15.467 21.515 9.721 1.00 0.00 H new ATOM 0 HH21 ARG A 9 12.649 22.818 11.327 1.00 0.00 H new ATOM 0 HH22 ARG A 9 13.947 23.125 10.168 1.00 0.00 H new ATOM 150 N LYS A 10 17.073 15.785 9.428 1.00 0.00 N ATOM 151 CA LYS A 10 18.563 15.720 9.420 1.00 0.00 C ATOM 152 C LYS A 10 19.112 16.240 8.089 1.00 0.00 C ATOM 153 O LYS A 10 20.082 16.972 8.050 1.00 0.00 O ATOM 154 CB LYS A 10 18.894 14.238 9.592 1.00 0.00 C ATOM 155 CG LYS A 10 20.300 14.095 10.180 1.00 0.00 C ATOM 156 CD LYS A 10 20.201 13.840 11.685 1.00 0.00 C ATOM 157 CE LYS A 10 21.571 14.051 12.330 1.00 0.00 C ATOM 158 NZ LYS A 10 21.366 15.146 13.318 1.00 0.00 N ATOM 0 H LYS A 10 16.601 14.891 9.564 1.00 0.00 H new ATOM 0 HA LYS A 10 19.006 16.333 10.205 1.00 0.00 H new ATOM 0 HB2 LYS A 10 18.164 13.765 10.248 1.00 0.00 H new ATOM 0 HB3 LYS A 10 18.836 13.727 8.631 1.00 0.00 H new ATOM 0 HG2 LYS A 10 20.826 13.273 9.695 1.00 0.00 H new ATOM 0 HG3 LYS A 10 20.878 14.999 9.991 1.00 0.00 H new ATOM 0 HD2 LYS A 10 19.470 14.514 12.131 1.00 0.00 H new ATOM 0 HD3 LYS A 10 19.853 12.824 11.870 1.00 0.00 H new ATOM 0 HE2 LYS A 10 21.923 13.141 12.816 1.00 0.00 H new ATOM 0 HE3 LYS A 10 22.320 14.325 11.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 22.264 15.349 13.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 21.038 16.001 12.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 20.653 14.854 14.017 1.00 0.00 H new ATOM 172 N THR A 11 18.504 15.866 6.996 1.00 0.00 N ATOM 173 CA THR A 11 18.996 16.339 5.671 1.00 0.00 C ATOM 174 C THR A 11 18.974 17.868 5.612 1.00 0.00 C ATOM 175 O THR A 11 19.960 18.500 5.286 1.00 0.00 O ATOM 176 CB THR A 11 18.018 15.750 4.652 1.00 0.00 C ATOM 177 OG1 THR A 11 17.355 14.633 5.228 1.00 0.00 O ATOM 178 CG2 THR A 11 18.784 15.306 3.404 1.00 0.00 C ATOM 0 H THR A 11 17.689 15.254 6.963 1.00 0.00 H new ATOM 0 HA THR A 11 20.023 16.029 5.478 1.00 0.00 H new ATOM 0 HB THR A 11 17.283 16.505 4.373 1.00 0.00 H new ATOM 0 HG1 THR A 11 16.388 14.725 5.101 1.00 0.00 H new ATOM 0 HG21 THR A 11 18.086 14.887 2.679 1.00 0.00 H new ATOM 0 HG22 THR A 11 19.292 16.164 2.964 1.00 0.00 H new ATOM 0 HG23 THR A 11 19.520 14.550 3.678 1.00 0.00 H new ATOM 186 N VAL A 12 17.859 18.466 5.928 1.00 0.00 N ATOM 187 CA VAL A 12 17.776 19.954 5.891 1.00 0.00 C ATOM 188 C VAL A 12 18.756 20.563 6.898 1.00 0.00 C ATOM 189 O VAL A 12 19.384 21.570 6.637 1.00 0.00 O ATOM 190 CB VAL A 12 16.334 20.279 6.281 1.00 0.00 C ATOM 191 CG1 VAL A 12 16.178 21.792 6.447 1.00 0.00 C ATOM 192 CG2 VAL A 12 15.388 19.788 5.183 1.00 0.00 C ATOM 0 H VAL A 12 17.002 17.990 6.210 1.00 0.00 H new ATOM 0 HA VAL A 12 18.034 20.359 4.913 1.00 0.00 H new ATOM 0 HB VAL A 12 16.091 19.784 7.221 1.00 0.00 H new ATOM 0 HG11 VAL A 12 15.150 22.023 6.725 1.00 0.00 H new ATOM 0 HG12 VAL A 12 16.853 22.144 7.227 1.00 0.00 H new ATOM 0 HG13 VAL A 12 16.420 22.288 5.507 1.00 0.00 H new ATOM 0 HG21 VAL A 12 14.359 20.019 5.459 1.00 0.00 H new ATOM 0 HG22 VAL A 12 15.632 20.285 4.244 1.00 0.00 H new ATOM 0 HG23 VAL A 12 15.498 18.710 5.063 1.00 0.00 H new ATOM 202 N ASN A 13 18.891 19.962 8.049 1.00 0.00 N ATOM 203 CA ASN A 13 19.830 20.508 9.071 1.00 0.00 C ATOM 204 C ASN A 13 21.277 20.361 8.592 1.00 0.00 C ATOM 205 O ASN A 13 22.037 21.309 8.582 1.00 0.00 O ATOM 206 CB ASN A 13 19.591 19.662 10.321 1.00 0.00 C ATOM 207 CG ASN A 13 18.110 19.716 10.701 1.00 0.00 C ATOM 208 OD1 ASN A 13 17.426 20.672 10.390 1.00 0.00 O ATOM 209 ND2 ASN A 13 17.582 18.724 11.364 1.00 0.00 N ATOM 0 H ASN A 13 18.392 19.117 8.326 1.00 0.00 H new ATOM 0 HA ASN A 13 19.664 21.569 9.259 1.00 0.00 H new ATOM 0 HB2 ASN A 13 19.893 18.631 10.138 1.00 0.00 H new ATOM 0 HB3 ASN A 13 20.202 20.031 11.145 1.00 0.00 H new ATOM 0 HD21 ASN A 13 16.595 18.750 11.621 1.00 0.00 H new ATOM 0 HD22 ASN A 13 18.156 17.922 11.625 1.00 0.00 H new ATOM 216 N GLY A 14 21.664 19.179 8.197 1.00 0.00 N ATOM 217 CA GLY A 14 23.061 18.971 7.721 1.00 0.00 C ATOM 218 C GLY A 14 23.394 20.004 6.643 1.00 0.00 C ATOM 219 O GLY A 14 24.545 20.313 6.401 1.00 0.00 O ATOM 0 H GLY A 14 21.073 18.348 8.183 1.00 0.00 H new ATOM 0 HA2 GLY A 14 23.757 19.063 8.554 1.00 0.00 H new ATOM 0 HA3 GLY A 14 23.174 17.963 7.321 1.00 0.00 H new ATOM 223 N HIS A 15 22.399 20.539 5.991 1.00 0.00 N ATOM 224 CA HIS A 15 22.662 21.551 4.928 1.00 0.00 C ATOM 225 C HIS A 15 22.484 22.966 5.489 1.00 0.00 C ATOM 226 O HIS A 15 21.564 23.238 6.232 1.00 0.00 O ATOM 227 CB HIS A 15 21.618 21.269 3.847 1.00 0.00 C ATOM 228 CG HIS A 15 22.081 20.121 2.993 1.00 0.00 C ATOM 229 ND1 HIS A 15 21.481 18.873 3.042 1.00 0.00 N ATOM 230 CD2 HIS A 15 23.087 20.016 2.062 1.00 0.00 C ATOM 231 CE1 HIS A 15 22.124 18.078 2.166 1.00 0.00 C ATOM 232 NE2 HIS A 15 23.112 18.726 1.543 1.00 0.00 N ATOM 0 H HIS A 15 21.415 20.320 6.148 1.00 0.00 H new ATOM 0 HA HIS A 15 23.679 21.488 4.540 1.00 0.00 H new ATOM 0 HB2 HIS A 15 20.658 21.031 4.306 1.00 0.00 H new ATOM 0 HB3 HIS A 15 21.466 22.156 3.232 1.00 0.00 H new ATOM 0 HD1 HIS A 15 20.695 18.605 3.634 1.00 0.00 H new ATOM 0 HD2 HIS A 15 23.756 20.814 1.777 1.00 0.00 H new ATOM 0 HE1 HIS A 15 21.872 17.043 1.989 1.00 0.00 H new ATOM 241 N MET B 1 14.097 -16.156 12.454 1.00 0.00 N ATOM 242 CA MET B 1 13.175 -15.765 13.560 1.00 0.00 C ATOM 243 C MET B 1 11.877 -15.188 12.988 1.00 0.00 C ATOM 244 O MET B 1 10.819 -15.771 13.113 1.00 0.00 O ATOM 245 CB MET B 1 13.934 -14.699 14.350 1.00 0.00 C ATOM 246 CG MET B 1 13.213 -14.431 15.672 1.00 0.00 C ATOM 247 SD MET B 1 14.396 -13.801 16.888 1.00 0.00 S ATOM 248 CE MET B 1 14.019 -12.043 16.681 1.00 0.00 C ATOM 0 H1 MET B 1 14.974 -16.546 12.855 1.00 0.00 H new ATOM 0 H2 MET B 1 13.639 -16.875 11.858 1.00 0.00 H new ATOM 0 H3 MET B 1 14.322 -15.320 11.877 1.00 0.00 H new ATOM 0 HA MET B 1 12.896 -16.614 14.185 1.00 0.00 H new ATOM 0 HB2 MET B 1 14.954 -15.031 14.541 1.00 0.00 H new ATOM 0 HB3 MET B 1 14.002 -13.780 13.768 1.00 0.00 H new ATOM 0 HG2 MET B 1 12.411 -13.708 15.521 1.00 0.00 H new ATOM 0 HG3 MET B 1 12.751 -15.348 16.039 1.00 0.00 H new ATOM 0 HE1 MET B 1 14.647 -11.455 17.350 1.00 0.00 H new ATOM 0 HE2 MET B 1 14.212 -11.748 15.649 1.00 0.00 H new ATOM 0 HE3 MET B 1 12.970 -11.865 16.919 1.00 0.00 H new ATOM 260 N ASP B 2 11.952 -14.045 12.361 1.00 0.00 N ATOM 261 CA ASP B 2 10.722 -13.432 11.782 1.00 0.00 C ATOM 262 C ASP B 2 10.969 -13.026 10.326 1.00 0.00 C ATOM 263 O ASP B 2 12.071 -12.684 9.945 1.00 0.00 O ATOM 264 CB ASP B 2 10.451 -12.200 12.645 1.00 0.00 C ATOM 265 CG ASP B 2 9.330 -12.510 13.640 1.00 0.00 C ATOM 266 OD1 ASP B 2 9.614 -13.142 14.643 1.00 0.00 O ATOM 267 OD2 ASP B 2 8.208 -12.109 13.380 1.00 0.00 O ATOM 0 H ASP B 2 12.810 -13.510 12.225 1.00 0.00 H new ATOM 0 HA ASP B 2 9.878 -14.121 11.780 1.00 0.00 H new ATOM 0 HB2 ASP B 2 11.356 -11.911 13.179 1.00 0.00 H new ATOM 0 HB3 ASP B 2 10.169 -11.356 12.015 1.00 0.00 H new ATOM 272 N VAL B 3 9.950 -13.058 9.511 1.00 0.00 N ATOM 273 CA VAL B 3 10.125 -12.673 8.081 1.00 0.00 C ATOM 274 C VAL B 3 9.099 -11.600 7.699 1.00 0.00 C ATOM 275 O VAL B 3 8.067 -11.465 8.324 1.00 0.00 O ATOM 276 CB VAL B 3 9.891 -13.970 7.296 1.00 0.00 C ATOM 277 CG1 VAL B 3 8.923 -13.719 6.138 1.00 0.00 C ATOM 278 CG2 VAL B 3 11.225 -14.473 6.742 1.00 0.00 C ATOM 0 H VAL B 3 9.004 -13.334 9.773 1.00 0.00 H new ATOM 0 HA VAL B 3 11.108 -12.250 7.874 1.00 0.00 H new ATOM 0 HB VAL B 3 9.461 -14.717 7.963 1.00 0.00 H new ATOM 0 HG11 VAL B 3 8.765 -14.647 5.588 1.00 0.00 H new ATOM 0 HG12 VAL B 3 7.971 -13.363 6.531 1.00 0.00 H new ATOM 0 HG13 VAL B 3 9.343 -12.968 5.469 1.00 0.00 H new ATOM 0 HG21 VAL B 3 11.063 -15.395 6.183 1.00 0.00 H new ATOM 0 HG22 VAL B 3 11.652 -13.719 6.081 1.00 0.00 H new ATOM 0 HG23 VAL B 3 11.912 -14.664 7.566 1.00 0.00 H new ATOM 288 N PHE B 4 9.377 -10.833 6.679 1.00 0.00 N ATOM 289 CA PHE B 4 8.418 -9.769 6.264 1.00 0.00 C ATOM 290 C PHE B 4 7.775 -10.124 4.921 1.00 0.00 C ATOM 291 O PHE B 4 8.418 -10.643 4.029 1.00 0.00 O ATOM 292 CB PHE B 4 9.265 -8.502 6.133 1.00 0.00 C ATOM 293 CG PHE B 4 8.383 -7.288 6.297 1.00 0.00 C ATOM 294 CD1 PHE B 4 7.414 -6.992 5.331 1.00 0.00 C ATOM 295 CD2 PHE B 4 8.535 -6.457 7.413 1.00 0.00 C ATOM 296 CE1 PHE B 4 6.597 -5.866 5.481 1.00 0.00 C ATOM 297 CE2 PHE B 4 7.717 -5.331 7.563 1.00 0.00 C ATOM 298 CZ PHE B 4 6.748 -5.035 6.598 1.00 0.00 C ATOM 0 H PHE B 4 10.225 -10.897 6.116 1.00 0.00 H new ATOM 0 HA PHE B 4 7.606 -9.647 6.980 1.00 0.00 H new ATOM 0 HB2 PHE B 4 10.052 -8.498 6.888 1.00 0.00 H new ATOM 0 HB3 PHE B 4 9.756 -8.479 5.160 1.00 0.00 H new ATOM 0 HD1 PHE B 4 7.297 -7.633 4.470 1.00 0.00 H new ATOM 0 HD2 PHE B 4 9.283 -6.684 8.158 1.00 0.00 H new ATOM 0 HE1 PHE B 4 5.850 -5.638 4.735 1.00 0.00 H new ATOM 0 HE2 PHE B 4 7.834 -4.690 8.424 1.00 0.00 H new ATOM 0 HZ PHE B 4 6.117 -4.166 6.715 1.00 0.00 H new ATOM 308 N LEU B 5 6.508 -9.848 4.770 1.00 0.00 N ATOM 309 CA LEU B 5 5.818 -10.165 3.486 1.00 0.00 C ATOM 310 C LEU B 5 5.028 -8.949 2.998 1.00 0.00 C ATOM 311 O LEU B 5 4.669 -8.078 3.764 1.00 0.00 O ATOM 312 CB LEU B 5 4.868 -11.317 3.821 1.00 0.00 C ATOM 313 CG LEU B 5 5.601 -12.652 3.671 1.00 0.00 C ATOM 314 CD1 LEU B 5 6.281 -12.714 2.302 1.00 0.00 C ATOM 315 CD2 LEU B 5 6.658 -12.780 4.771 1.00 0.00 C ATOM 0 H LEU B 5 5.919 -9.416 5.482 1.00 0.00 H new ATOM 0 HA LEU B 5 6.520 -10.430 2.695 1.00 0.00 H new ATOM 0 HB2 LEU B 5 4.495 -11.209 4.839 1.00 0.00 H new ATOM 0 HB3 LEU B 5 4.002 -11.291 3.160 1.00 0.00 H new ATOM 0 HG LEU B 5 4.885 -13.469 3.757 1.00 0.00 H new ATOM 0 HD11 LEU B 5 6.802 -13.666 2.197 1.00 0.00 H new ATOM 0 HD12 LEU B 5 5.529 -12.624 1.518 1.00 0.00 H new ATOM 0 HD13 LEU B 5 6.997 -11.897 2.214 1.00 0.00 H new ATOM 0 HD21 LEU B 5 7.180 -13.731 4.665 1.00 0.00 H new ATOM 0 HD22 LEU B 5 7.373 -11.962 4.686 1.00 0.00 H new ATOM 0 HD23 LEU B 5 6.174 -12.739 5.747 1.00 0.00 H new ATOM 327 N MET B 6 4.753 -8.885 1.727 1.00 0.00 N ATOM 328 CA MET B 6 3.980 -7.729 1.188 1.00 0.00 C ATOM 329 C MET B 6 3.059 -8.207 0.064 1.00 0.00 C ATOM 330 O MET B 6 3.439 -9.026 -0.748 1.00 0.00 O ATOM 331 CB MET B 6 5.034 -6.762 0.648 1.00 0.00 C ATOM 332 CG MET B 6 5.110 -5.531 1.554 1.00 0.00 C ATOM 333 SD MET B 6 5.257 -4.041 0.538 1.00 0.00 S ATOM 334 CE MET B 6 6.809 -4.478 -0.283 1.00 0.00 C ATOM 0 H MET B 6 5.029 -9.583 1.036 1.00 0.00 H new ATOM 0 HA MET B 6 3.351 -7.256 1.942 1.00 0.00 H new ATOM 0 HB2 MET B 6 6.005 -7.254 0.603 1.00 0.00 H new ATOM 0 HB3 MET B 6 4.781 -6.463 -0.369 1.00 0.00 H new ATOM 0 HG2 MET B 6 4.219 -5.471 2.179 1.00 0.00 H new ATOM 0 HG3 MET B 6 5.965 -5.612 2.225 1.00 0.00 H new ATOM 0 HE1 MET B 6 7.520 -3.659 -0.177 1.00 0.00 H new ATOM 0 HE2 MET B 6 7.222 -5.378 0.174 1.00 0.00 H new ATOM 0 HE3 MET B 6 6.622 -4.662 -1.341 1.00 0.00 H new ATOM 344 N ILE B 7 1.859 -7.699 -0.002 1.00 0.00 N ATOM 345 CA ILE B 7 0.938 -8.132 -1.084 1.00 0.00 C ATOM 346 C ILE B 7 0.914 -7.060 -2.164 1.00 0.00 C ATOM 347 O ILE B 7 0.988 -5.881 -1.877 1.00 0.00 O ATOM 348 CB ILE B 7 -0.428 -8.287 -0.415 1.00 0.00 C ATOM 349 CG1 ILE B 7 -0.615 -9.755 -0.005 1.00 0.00 C ATOM 350 CG2 ILE B 7 -1.535 -7.861 -1.385 1.00 0.00 C ATOM 351 CD1 ILE B 7 -1.877 -10.328 -0.652 1.00 0.00 C ATOM 0 H ILE B 7 1.480 -7.007 0.644 1.00 0.00 H new ATOM 0 HA ILE B 7 1.240 -9.065 -1.560 1.00 0.00 H new ATOM 0 HB ILE B 7 -0.482 -7.652 0.470 1.00 0.00 H new ATOM 0 HG12 ILE B 7 0.255 -10.338 -0.308 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -0.687 -9.831 1.080 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -2.505 -7.974 -0.902 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -1.390 -6.818 -1.668 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -1.498 -8.487 -2.276 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -1.998 -11.369 -0.353 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -2.745 -9.754 -0.327 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -1.788 -10.270 -1.737 1.00 0.00 H new ATOM 363 N ARG B 8 0.830 -7.448 -3.402 1.00 0.00 N ATOM 364 CA ARG B 8 0.830 -6.422 -4.470 1.00 0.00 C ATOM 365 C ARG B 8 -0.508 -6.374 -5.203 1.00 0.00 C ATOM 366 O ARG B 8 -1.093 -7.383 -5.561 1.00 0.00 O ATOM 367 CB ARG B 8 1.950 -6.849 -5.415 1.00 0.00 C ATOM 368 CG ARG B 8 3.114 -5.866 -5.299 1.00 0.00 C ATOM 369 CD ARG B 8 3.968 -5.931 -6.566 1.00 0.00 C ATOM 370 NE ARG B 8 4.619 -4.595 -6.658 1.00 0.00 N ATOM 371 CZ ARG B 8 5.550 -4.258 -5.807 1.00 0.00 C ATOM 372 NH1 ARG B 8 5.924 -5.094 -4.877 1.00 0.00 N ATOM 373 NH2 ARG B 8 6.109 -3.082 -5.885 1.00 0.00 N ATOM 0 H ARG B 8 0.762 -8.416 -3.716 1.00 0.00 H new ATOM 0 HA ARG B 8 0.982 -5.420 -4.068 1.00 0.00 H new ATOM 0 HB2 ARG B 8 2.285 -7.857 -5.168 1.00 0.00 H new ATOM 0 HB3 ARG B 8 1.584 -6.877 -6.441 1.00 0.00 H new ATOM 0 HG2 ARG B 8 2.736 -4.854 -5.155 1.00 0.00 H new ATOM 0 HG3 ARG B 8 3.721 -6.107 -4.426 1.00 0.00 H new ATOM 0 HD2 ARG B 8 4.709 -6.728 -6.503 1.00 0.00 H new ATOM 0 HD3 ARG B 8 3.356 -6.134 -7.445 1.00 0.00 H new ATOM 0 HE ARG B 8 4.337 -3.941 -7.388 1.00 0.00 H new ATOM 0 HH11 ARG B 8 5.489 -6.014 -4.813 1.00 0.00 H new ATOM 0 HH12 ARG B 8 6.652 -4.827 -4.214 1.00 0.00 H new ATOM 0 HH21 ARG B 8 5.819 -2.426 -6.610 1.00 0.00 H new ATOM 0 HH22 ARG B 8 6.836 -2.818 -5.220 1.00 0.00 H new ATOM 387 N ARG B 9 -0.970 -5.182 -5.431 1.00 0.00 N ATOM 388 CA ARG B 9 -2.249 -4.958 -6.145 1.00 0.00 C ATOM 389 C ARG B 9 -2.152 -3.611 -6.859 1.00 0.00 C ATOM 390 O ARG B 9 -1.465 -2.718 -6.403 1.00 0.00 O ATOM 391 CB ARG B 9 -3.326 -4.928 -5.061 1.00 0.00 C ATOM 392 CG ARG B 9 -4.477 -5.853 -5.459 1.00 0.00 C ATOM 393 CD ARG B 9 -5.674 -5.010 -5.907 1.00 0.00 C ATOM 394 NE ARG B 9 -6.685 -5.995 -6.382 1.00 0.00 N ATOM 395 CZ ARG B 9 -7.831 -5.580 -6.849 1.00 0.00 C ATOM 396 NH1 ARG B 9 -8.091 -4.302 -6.900 1.00 0.00 N ATOM 397 NH2 ARG B 9 -8.717 -6.442 -7.266 1.00 0.00 N ATOM 0 H ARG B 9 -0.497 -4.326 -5.142 1.00 0.00 H new ATOM 0 HA ARG B 9 -2.476 -5.725 -6.885 1.00 0.00 H new ATOM 0 HB2 ARG B 9 -2.905 -5.244 -4.107 1.00 0.00 H new ATOM 0 HB3 ARG B 9 -3.693 -3.911 -4.926 1.00 0.00 H new ATOM 0 HG2 ARG B 9 -4.163 -6.516 -6.265 1.00 0.00 H new ATOM 0 HG3 ARG B 9 -4.758 -6.485 -4.617 1.00 0.00 H new ATOM 0 HD2 ARG B 9 -6.064 -4.410 -5.085 1.00 0.00 H new ATOM 0 HD3 ARG B 9 -5.394 -4.318 -6.701 1.00 0.00 H new ATOM 0 HE ARG B 9 -6.482 -6.994 -6.342 1.00 0.00 H new ATOM 0 HH11 ARG B 9 -7.399 -3.627 -6.575 1.00 0.00 H new ATOM 0 HH12 ARG B 9 -8.987 -3.978 -7.265 1.00 0.00 H new ATOM 0 HH21 ARG B 9 -8.514 -7.441 -7.227 1.00 0.00 H new ATOM 0 HH22 ARG B 9 -9.612 -6.117 -7.631 1.00 0.00 H new ATOM 411 N HIS B 10 -2.806 -3.433 -7.964 1.00 0.00 N ATOM 412 CA HIS B 10 -2.682 -2.121 -8.648 1.00 0.00 C ATOM 413 C HIS B 10 -3.016 -1.017 -7.693 1.00 0.00 C ATOM 414 O HIS B 10 -3.882 -1.143 -6.856 1.00 0.00 O ATOM 415 CB HIS B 10 -3.754 -2.047 -9.669 1.00 0.00 C ATOM 416 CG HIS B 10 -3.454 -2.920 -10.855 1.00 0.00 C ATOM 417 ND1 HIS B 10 -2.686 -2.479 -11.921 1.00 0.00 N ATOM 418 CD2 HIS B 10 -3.827 -4.203 -11.167 1.00 0.00 C ATOM 419 CE1 HIS B 10 -2.623 -3.481 -12.817 1.00 0.00 C ATOM 420 NE2 HIS B 10 -3.302 -4.555 -12.407 1.00 0.00 N ATOM 0 H HIS B 10 -3.409 -4.120 -8.417 1.00 0.00 H new ATOM 0 HA HIS B 10 -1.673 -2.026 -9.049 1.00 0.00 H new ATOM 0 HB2 HIS B 10 -4.702 -2.351 -9.224 1.00 0.00 H new ATOM 0 HB3 HIS B 10 -3.873 -1.015 -9.998 1.00 0.00 H new ATOM 0 HD2 HIS B 10 -4.436 -4.843 -10.545 1.00 0.00 H new ATOM 0 HE1 HIS B 10 -2.088 -3.423 -13.754 1.00 0.00 H new ATOM 0 HE2 HIS B 10 -3.412 -5.443 -12.897 1.00 0.00 H new ATOM 428 N LYS B 11 -2.347 0.059 -7.834 1.00 0.00 N ATOM 429 CA LYS B 11 -2.596 1.224 -6.945 1.00 0.00 C ATOM 430 C LYS B 11 -2.785 0.739 -5.506 1.00 0.00 C ATOM 431 O LYS B 11 -2.618 1.485 -4.562 1.00 0.00 O ATOM 432 CB LYS B 11 -3.882 1.860 -7.476 1.00 0.00 C ATOM 433 CG LYS B 11 -4.465 2.802 -6.420 1.00 0.00 C ATOM 434 CD LYS B 11 -5.819 2.268 -5.949 1.00 0.00 C ATOM 435 CE LYS B 11 -6.805 2.272 -7.119 1.00 0.00 C ATOM 436 NZ LYS B 11 -7.886 1.331 -6.713 1.00 0.00 N ATOM 0 H LYS B 11 -1.621 0.201 -8.536 1.00 0.00 H new ATOM 0 HA LYS B 11 -1.770 1.935 -6.940 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -3.675 2.410 -8.394 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -4.606 1.085 -7.726 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -3.781 2.885 -5.575 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -4.582 3.803 -6.835 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -5.707 1.257 -5.558 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -6.202 2.884 -5.135 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -7.199 3.272 -7.300 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -6.324 1.947 -8.042 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -8.602 1.279 -7.465 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -7.482 0.386 -6.554 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -8.330 1.670 -5.836 1.00 0.00 H new ATOM 450 N THR B 12 -3.146 -0.506 -5.332 1.00 0.00 N ATOM 451 CA THR B 12 -3.357 -1.021 -3.938 1.00 0.00 C ATOM 452 C THR B 12 -2.226 -1.956 -3.484 1.00 0.00 C ATOM 453 O THR B 12 -1.999 -3.007 -4.049 1.00 0.00 O ATOM 454 CB THR B 12 -4.675 -1.787 -3.980 1.00 0.00 C ATOM 455 OG1 THR B 12 -5.373 -1.480 -5.177 1.00 0.00 O ATOM 456 CG2 THR B 12 -5.526 -1.396 -2.772 1.00 0.00 C ATOM 0 H THR B 12 -3.303 -1.182 -6.079 1.00 0.00 H new ATOM 0 HA THR B 12 -3.371 -0.195 -3.227 1.00 0.00 H new ATOM 0 HB THR B 12 -4.472 -2.858 -3.952 1.00 0.00 H new ATOM 0 HG1 THR B 12 -4.912 -1.889 -5.939 1.00 0.00 H new ATOM 0 HG21 THR B 12 -6.469 -1.942 -2.799 1.00 0.00 H new ATOM 0 HG22 THR B 12 -4.991 -1.642 -1.855 1.00 0.00 H new ATOM 0 HG23 THR B 12 -5.726 -0.325 -2.799 1.00 0.00 H new ATOM 464 N THR B 13 -1.539 -1.577 -2.439 1.00 0.00 N ATOM 465 CA THR B 13 -0.435 -2.422 -1.881 1.00 0.00 C ATOM 466 C THR B 13 -0.620 -2.555 -0.366 1.00 0.00 C ATOM 467 O THR B 13 -0.816 -1.576 0.326 1.00 0.00 O ATOM 468 CB THR B 13 0.853 -1.663 -2.204 1.00 0.00 C ATOM 469 OG1 THR B 13 0.593 -0.266 -2.193 1.00 0.00 O ATOM 470 CG2 THR B 13 1.360 -2.080 -3.585 1.00 0.00 C ATOM 0 H THR B 13 -1.697 -0.703 -1.938 1.00 0.00 H new ATOM 0 HA THR B 13 -0.419 -3.428 -2.300 1.00 0.00 H new ATOM 0 HB THR B 13 1.611 -1.897 -1.456 1.00 0.00 H new ATOM 0 HG1 THR B 13 1.053 0.146 -1.432 1.00 0.00 H new ATOM 0 HG21 THR B 13 2.278 -1.539 -3.814 1.00 0.00 H new ATOM 0 HG22 THR B 13 1.560 -3.152 -3.591 1.00 0.00 H new ATOM 0 HG23 THR B 13 0.604 -1.847 -4.335 1.00 0.00 H new ATOM 478 N ILE B 14 -0.567 -3.748 0.164 1.00 0.00 N ATOM 479 CA ILE B 14 -0.753 -3.902 1.639 1.00 0.00 C ATOM 480 C ILE B 14 0.544 -4.344 2.311 1.00 0.00 C ATOM 481 O ILE B 14 1.188 -5.282 1.886 1.00 0.00 O ATOM 482 CB ILE B 14 -1.834 -4.983 1.811 1.00 0.00 C ATOM 483 CG1 ILE B 14 -2.807 -4.568 2.915 1.00 0.00 C ATOM 484 CG2 ILE B 14 -1.190 -6.314 2.211 1.00 0.00 C ATOM 485 CD1 ILE B 14 -2.051 -4.444 4.241 1.00 0.00 C ATOM 0 H ILE B 14 -0.405 -4.613 -0.351 1.00 0.00 H new ATOM 0 HA ILE B 14 -1.041 -2.958 2.101 1.00 0.00 H new ATOM 0 HB ILE B 14 -2.363 -5.097 0.865 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -3.277 -3.618 2.662 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -3.605 -5.304 3.007 1.00 0.00 H new ATOM 0 HG21 ILE B 14 -1.964 -7.072 2.330 1.00 0.00 H new ATOM 0 HG22 ILE B 14 -0.491 -6.628 1.435 1.00 0.00 H new ATOM 0 HG23 ILE B 14 -0.655 -6.191 3.153 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -2.744 -4.148 5.029 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -1.602 -5.404 4.495 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -1.268 -3.691 4.145 1.00 0.00 H new ATOM 497 N PHE B 15 0.913 -3.703 3.382 1.00 0.00 N ATOM 498 CA PHE B 15 2.139 -4.137 4.095 1.00 0.00 C ATOM 499 C PHE B 15 1.730 -5.261 5.041 1.00 0.00 C ATOM 500 O PHE B 15 0.966 -5.059 5.964 1.00 0.00 O ATOM 501 CB PHE B 15 2.616 -2.909 4.874 1.00 0.00 C ATOM 502 CG PHE B 15 3.693 -2.203 4.087 1.00 0.00 C ATOM 503 CD1 PHE B 15 4.826 -2.906 3.662 1.00 0.00 C ATOM 504 CD2 PHE B 15 3.561 -0.842 3.785 1.00 0.00 C ATOM 505 CE1 PHE B 15 5.825 -2.251 2.933 1.00 0.00 C ATOM 506 CE2 PHE B 15 4.560 -0.186 3.056 1.00 0.00 C ATOM 507 CZ PHE B 15 5.692 -0.891 2.630 1.00 0.00 C ATOM 0 H PHE B 15 0.424 -2.906 3.790 1.00 0.00 H new ATOM 0 HA PHE B 15 2.931 -4.499 3.439 1.00 0.00 H new ATOM 0 HB2 PHE B 15 1.781 -2.233 5.056 1.00 0.00 H new ATOM 0 HB3 PHE B 15 3.000 -3.210 5.849 1.00 0.00 H new ATOM 0 HD1 PHE B 15 4.930 -3.955 3.897 1.00 0.00 H new ATOM 0 HD2 PHE B 15 2.688 -0.298 4.115 1.00 0.00 H new ATOM 0 HE1 PHE B 15 6.698 -2.795 2.604 1.00 0.00 H new ATOM 0 HE2 PHE B 15 4.457 0.863 2.822 1.00 0.00 H new ATOM 0 HZ PHE B 15 6.463 -0.385 2.067 1.00 0.00 H new ATOM 517 N THR B 16 2.195 -6.451 4.801 1.00 0.00 N ATOM 518 CA THR B 16 1.784 -7.585 5.670 1.00 0.00 C ATOM 519 C THR B 16 2.980 -8.160 6.430 1.00 0.00 C ATOM 520 O THR B 16 4.079 -8.234 5.919 1.00 0.00 O ATOM 521 CB THR B 16 1.208 -8.627 4.709 1.00 0.00 C ATOM 522 OG1 THR B 16 0.457 -9.579 5.447 1.00 0.00 O ATOM 523 CG2 THR B 16 2.343 -9.335 3.970 1.00 0.00 C ATOM 0 H THR B 16 2.838 -6.688 4.046 1.00 0.00 H new ATOM 0 HA THR B 16 1.063 -7.274 6.426 1.00 0.00 H new ATOM 0 HB THR B 16 0.563 -8.132 3.983 1.00 0.00 H new ATOM 0 HG1 THR B 16 1.042 -10.316 5.721 1.00 0.00 H new ATOM 0 HG21 THR B 16 1.926 -10.076 3.287 1.00 0.00 H new ATOM 0 HG22 THR B 16 2.920 -8.604 3.404 1.00 0.00 H new ATOM 0 HG23 THR B 16 2.993 -9.831 4.691 1.00 0.00 H new ATOM 531 N ASP B 17 2.772 -8.586 7.644 1.00 0.00 N ATOM 532 CA ASP B 17 3.894 -9.176 8.427 1.00 0.00 C ATOM 533 C ASP B 17 3.515 -10.595 8.854 1.00 0.00 C ATOM 534 O ASP B 17 2.374 -10.873 9.164 1.00 0.00 O ATOM 535 CB ASP B 17 4.053 -8.268 9.645 1.00 0.00 C ATOM 536 CG ASP B 17 5.209 -8.775 10.512 1.00 0.00 C ATOM 537 OD1 ASP B 17 6.346 -8.604 10.106 1.00 0.00 O ATOM 538 OD2 ASP B 17 4.935 -9.325 11.566 1.00 0.00 O ATOM 0 H ASP B 17 1.875 -8.552 8.128 1.00 0.00 H new ATOM 0 HA ASP B 17 4.821 -9.241 7.857 1.00 0.00 H new ATOM 0 HB2 ASP B 17 4.246 -7.244 9.326 1.00 0.00 H new ATOM 0 HB3 ASP B 17 3.130 -8.253 10.224 1.00 0.00 H new ATOM 543 N ALA B 18 4.455 -11.499 8.862 1.00 0.00 N ATOM 544 CA ALA B 18 4.126 -12.898 9.257 1.00 0.00 C ATOM 545 C ALA B 18 5.392 -13.667 9.640 1.00 0.00 C ATOM 546 O ALA B 18 6.497 -13.190 9.474 1.00 0.00 O ATOM 547 CB ALA B 18 3.487 -13.510 8.012 1.00 0.00 C ATOM 0 H ALA B 18 5.430 -11.332 8.614 1.00 0.00 H new ATOM 0 HA ALA B 18 3.467 -12.935 10.125 1.00 0.00 H new ATOM 0 HB1 ALA B 18 3.213 -14.545 8.215 1.00 0.00 H new ATOM 0 HB2 ALA B 18 2.595 -12.944 7.745 1.00 0.00 H new ATOM 0 HB3 ALA B 18 4.197 -13.479 7.186 1.00 0.00 H new ATOM 553 N LYS B 19 5.235 -14.859 10.146 1.00 0.00 N ATOM 554 CA LYS B 19 6.424 -15.671 10.533 1.00 0.00 C ATOM 555 C LYS B 19 6.875 -16.533 9.351 1.00 0.00 C ATOM 556 O LYS B 19 6.138 -16.747 8.409 1.00 0.00 O ATOM 557 CB LYS B 19 5.944 -16.551 11.689 1.00 0.00 C ATOM 558 CG LYS B 19 6.776 -16.251 12.937 1.00 0.00 C ATOM 559 CD LYS B 19 7.525 -17.514 13.369 1.00 0.00 C ATOM 560 CE LYS B 19 6.648 -18.326 14.325 1.00 0.00 C ATOM 561 NZ LYS B 19 7.429 -19.564 14.604 1.00 0.00 N ATOM 0 H LYS B 19 4.333 -15.307 10.309 1.00 0.00 H new ATOM 0 HA LYS B 19 7.274 -15.053 10.821 1.00 0.00 H new ATOM 0 HB2 LYS B 19 4.889 -16.364 11.889 1.00 0.00 H new ATOM 0 HB3 LYS B 19 6.036 -17.604 11.422 1.00 0.00 H new ATOM 0 HG2 LYS B 19 7.484 -15.449 12.730 1.00 0.00 H new ATOM 0 HG3 LYS B 19 6.129 -15.906 13.743 1.00 0.00 H new ATOM 0 HD2 LYS B 19 7.782 -18.114 12.496 1.00 0.00 H new ATOM 0 HD3 LYS B 19 8.462 -17.245 13.857 1.00 0.00 H new ATOM 0 HE2 LYS B 19 6.445 -17.772 15.242 1.00 0.00 H new ATOM 0 HE3 LYS B 19 5.684 -18.560 13.874 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 6.893 -20.174 15.254 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 7.601 -20.074 13.714 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 8.339 -19.310 15.039 1.00 0.00 H new ATOM 575 N GLU B 20 8.082 -17.024 9.391 1.00 0.00 N ATOM 576 CA GLU B 20 8.586 -17.869 8.271 1.00 0.00 C ATOM 577 C GLU B 20 7.558 -18.946 7.925 1.00 0.00 C ATOM 578 O GLU B 20 7.528 -19.464 6.827 1.00 0.00 O ATOM 579 CB GLU B 20 9.880 -18.498 8.795 1.00 0.00 C ATOM 580 CG GLU B 20 9.567 -19.821 9.497 1.00 0.00 C ATOM 581 CD GLU B 20 10.865 -20.460 9.991 1.00 0.00 C ATOM 582 OE1 GLU B 20 11.890 -19.802 9.918 1.00 0.00 O ATOM 583 OE2 GLU B 20 10.814 -21.595 10.434 1.00 0.00 O ATOM 0 H GLU B 20 8.744 -16.876 10.153 1.00 0.00 H new ATOM 0 HA GLU B 20 8.760 -17.294 7.362 1.00 0.00 H new ATOM 0 HB2 GLU B 20 10.572 -18.668 7.970 1.00 0.00 H new ATOM 0 HB3 GLU B 20 10.372 -17.816 9.488 1.00 0.00 H new ATOM 0 HG2 GLU B 20 8.893 -19.648 10.336 1.00 0.00 H new ATOM 0 HG3 GLU B 20 9.056 -20.496 8.811 1.00 0.00 H new ATOM 590 N SER B 21 6.711 -19.285 8.855 1.00 0.00 N ATOM 591 CA SER B 21 5.683 -20.323 8.575 1.00 0.00 C ATOM 592 C SER B 21 4.341 -19.654 8.281 1.00 0.00 C ATOM 593 O SER B 21 3.327 -20.306 8.134 1.00 0.00 O ATOM 594 CB SER B 21 5.603 -21.160 9.851 1.00 0.00 C ATOM 595 OG SER B 21 5.835 -20.324 10.976 1.00 0.00 O ATOM 0 H SER B 21 6.686 -18.889 9.795 1.00 0.00 H new ATOM 0 HA SER B 21 5.933 -20.936 7.709 1.00 0.00 H new ATOM 0 HB2 SER B 21 4.623 -21.631 9.930 1.00 0.00 H new ATOM 0 HB3 SER B 21 6.341 -21.962 9.821 1.00 0.00 H new ATOM 0 HG SER B 21 5.783 -20.858 11.796 1.00 0.00 H new ATOM 601 N SER B 22 4.330 -18.353 8.197 1.00 0.00 N ATOM 602 CA SER B 22 3.052 -17.637 7.914 1.00 0.00 C ATOM 603 C SER B 22 3.175 -16.802 6.636 1.00 0.00 C ATOM 604 O SER B 22 3.041 -15.596 6.659 1.00 0.00 O ATOM 605 CB SER B 22 2.830 -16.733 9.125 1.00 0.00 C ATOM 606 OG SER B 22 3.525 -17.267 10.245 1.00 0.00 O ATOM 0 H SER B 22 5.148 -17.754 8.312 1.00 0.00 H new ATOM 0 HA SER B 22 2.222 -18.326 7.759 1.00 0.00 H new ATOM 0 HB2 SER B 22 3.184 -15.725 8.910 1.00 0.00 H new ATOM 0 HB3 SER B 22 1.765 -16.657 9.346 1.00 0.00 H new ATOM 0 HG SER B 22 3.051 -17.027 11.069 1.00 0.00 H new ATOM 612 N THR B 23 3.423 -17.431 5.521 1.00 0.00 N ATOM 613 CA THR B 23 3.546 -16.666 4.247 1.00 0.00 C ATOM 614 C THR B 23 2.581 -17.232 3.201 1.00 0.00 C ATOM 615 O THR B 23 2.455 -16.712 2.109 1.00 0.00 O ATOM 616 CB THR B 23 5.006 -16.848 3.811 1.00 0.00 C ATOM 617 OG1 THR B 23 5.601 -15.571 3.629 1.00 0.00 O ATOM 618 CG2 THR B 23 5.073 -17.633 2.498 1.00 0.00 C ATOM 0 H THR B 23 3.546 -18.440 5.436 1.00 0.00 H new ATOM 0 HA THR B 23 3.295 -15.612 4.366 1.00 0.00 H new ATOM 0 HB THR B 23 5.543 -17.402 4.581 1.00 0.00 H new ATOM 0 HG1 THR B 23 5.420 -15.252 2.720 1.00 0.00 H new ATOM 0 HG21 THR B 23 6.114 -17.755 2.200 1.00 0.00 H new ATOM 0 HG22 THR B 23 4.618 -18.614 2.637 1.00 0.00 H new ATOM 0 HG23 THR B 23 4.535 -17.090 1.721 1.00 0.00 H new ATOM 626 N VAL B 24 1.899 -18.292 3.530 1.00 0.00 N ATOM 627 CA VAL B 24 0.940 -18.895 2.561 1.00 0.00 C ATOM 628 C VAL B 24 -0.460 -18.947 3.180 1.00 0.00 C ATOM 629 O VAL B 24 -1.243 -18.028 3.040 1.00 0.00 O ATOM 630 CB VAL B 24 1.472 -20.305 2.289 1.00 0.00 C ATOM 631 CG1 VAL B 24 2.386 -20.272 1.063 1.00 0.00 C ATOM 632 CG2 VAL B 24 2.272 -20.807 3.497 1.00 0.00 C ATOM 0 H VAL B 24 1.963 -18.769 4.429 1.00 0.00 H new ATOM 0 HA VAL B 24 0.859 -18.317 1.640 1.00 0.00 H new ATOM 0 HB VAL B 24 0.631 -20.975 2.110 1.00 0.00 H new ATOM 0 HG11 VAL B 24 2.767 -21.274 0.866 1.00 0.00 H new ATOM 0 HG12 VAL B 24 1.822 -19.922 0.198 1.00 0.00 H new ATOM 0 HG13 VAL B 24 3.221 -19.597 1.250 1.00 0.00 H new ATOM 0 HG21 VAL B 24 2.646 -21.810 3.294 1.00 0.00 H new ATOM 0 HG22 VAL B 24 3.112 -20.137 3.681 1.00 0.00 H new ATOM 0 HG23 VAL B 24 1.627 -20.831 4.376 1.00 0.00 H new ATOM 642 N PHE B 25 -0.781 -20.007 3.869 1.00 0.00 N ATOM 643 CA PHE B 25 -2.128 -20.098 4.499 1.00 0.00 C ATOM 644 C PHE B 25 -2.373 -18.865 5.371 1.00 0.00 C ATOM 645 O PHE B 25 -3.416 -18.245 5.311 1.00 0.00 O ATOM 646 CB PHE B 25 -2.081 -21.363 5.357 1.00 0.00 C ATOM 647 CG PHE B 25 -3.445 -22.010 5.375 1.00 0.00 C ATOM 648 CD1 PHE B 25 -3.963 -22.584 4.208 1.00 0.00 C ATOM 649 CD2 PHE B 25 -4.191 -22.037 6.560 1.00 0.00 C ATOM 650 CE1 PHE B 25 -5.229 -23.183 4.226 1.00 0.00 C ATOM 651 CE2 PHE B 25 -5.456 -22.636 6.577 1.00 0.00 C ATOM 652 CZ PHE B 25 -5.975 -23.210 5.410 1.00 0.00 C ATOM 0 H PHE B 25 -0.172 -20.811 4.023 1.00 0.00 H new ATOM 0 HA PHE B 25 -2.932 -20.139 3.764 1.00 0.00 H new ATOM 0 HB2 PHE B 25 -1.342 -22.058 4.958 1.00 0.00 H new ATOM 0 HB3 PHE B 25 -1.771 -21.115 6.372 1.00 0.00 H new ATOM 0 HD1 PHE B 25 -3.387 -22.565 3.295 1.00 0.00 H new ATOM 0 HD2 PHE B 25 -3.790 -21.596 7.461 1.00 0.00 H new ATOM 0 HE1 PHE B 25 -5.630 -23.624 3.326 1.00 0.00 H new ATOM 0 HE2 PHE B 25 -6.032 -22.655 7.490 1.00 0.00 H new ATOM 0 HZ PHE B 25 -6.950 -23.673 5.423 1.00 0.00 H new ATOM 662 N GLU B 26 -1.413 -18.500 6.177 1.00 0.00 N ATOM 663 CA GLU B 26 -1.585 -17.301 7.046 1.00 0.00 C ATOM 664 C GLU B 26 -1.708 -16.043 6.182 1.00 0.00 C ATOM 665 O GLU B 26 -2.479 -15.151 6.472 1.00 0.00 O ATOM 666 CB GLU B 26 -0.318 -17.245 7.901 1.00 0.00 C ATOM 667 CG GLU B 26 -0.448 -18.223 9.071 1.00 0.00 C ATOM 668 CD GLU B 26 -0.366 -17.454 10.391 1.00 0.00 C ATOM 669 OE1 GLU B 26 -0.557 -16.250 10.364 1.00 0.00 O ATOM 670 OE2 GLU B 26 -0.113 -18.084 11.404 1.00 0.00 O ATOM 0 H GLU B 26 -0.518 -18.980 6.271 1.00 0.00 H new ATOM 0 HA GLU B 26 -2.485 -17.357 7.659 1.00 0.00 H new ATOM 0 HB2 GLU B 26 0.553 -17.498 7.296 1.00 0.00 H new ATOM 0 HB3 GLU B 26 -0.163 -16.233 8.275 1.00 0.00 H new ATOM 0 HG2 GLU B 26 -1.396 -18.758 9.008 1.00 0.00 H new ATOM 0 HG3 GLU B 26 0.344 -18.971 9.024 1.00 0.00 H new ATOM 677 N LEU B 27 -0.954 -15.970 5.118 1.00 0.00 N ATOM 678 CA LEU B 27 -1.027 -14.773 4.231 1.00 0.00 C ATOM 679 C LEU B 27 -2.456 -14.603 3.704 1.00 0.00 C ATOM 680 O LEU B 27 -2.927 -13.501 3.501 1.00 0.00 O ATOM 681 CB LEU B 27 -0.047 -15.071 3.092 1.00 0.00 C ATOM 682 CG LEU B 27 -0.415 -14.262 1.844 1.00 0.00 C ATOM 683 CD1 LEU B 27 -1.592 -14.931 1.133 1.00 0.00 C ATOM 684 CD2 LEU B 27 -0.800 -12.835 2.243 1.00 0.00 C ATOM 0 H LEU B 27 -0.291 -16.687 4.825 1.00 0.00 H new ATOM 0 HA LEU B 27 -0.772 -13.847 4.746 1.00 0.00 H new ATOM 0 HB2 LEU B 27 0.968 -14.827 3.405 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -0.062 -16.136 2.860 1.00 0.00 H new ATOM 0 HG LEU B 27 0.443 -14.225 1.173 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -1.855 -14.356 0.245 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -1.313 -15.943 0.841 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -2.449 -14.971 1.806 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -1.060 -12.265 1.351 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -1.656 -12.864 2.918 1.00 0.00 H new ATOM 0 HD23 LEU B 27 0.042 -12.358 2.745 1.00 0.00 H new ATOM 696 N LYS B 28 -3.151 -15.687 3.488 1.00 0.00 N ATOM 697 CA LYS B 28 -4.550 -15.590 2.980 1.00 0.00 C ATOM 698 C LYS B 28 -5.396 -14.743 3.934 1.00 0.00 C ATOM 699 O LYS B 28 -6.262 -13.999 3.519 1.00 0.00 O ATOM 700 CB LYS B 28 -5.061 -17.030 2.942 1.00 0.00 C ATOM 701 CG LYS B 28 -4.696 -17.667 1.599 1.00 0.00 C ATOM 702 CD LYS B 28 -5.659 -18.817 1.300 1.00 0.00 C ATOM 703 CE LYS B 28 -5.836 -18.954 -0.214 1.00 0.00 C ATOM 704 NZ LYS B 28 -6.194 -20.385 -0.431 1.00 0.00 N ATOM 0 H LYS B 28 -2.810 -16.636 3.641 1.00 0.00 H new ATOM 0 HA LYS B 28 -4.603 -15.116 2.000 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -4.624 -17.604 3.759 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -6.142 -17.047 3.083 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -4.746 -16.921 0.805 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -3.670 -18.035 1.626 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -5.273 -19.747 1.717 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -6.623 -18.631 1.774 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -6.619 -18.291 -0.582 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -4.921 -18.691 -0.744 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -6.560 -20.509 -1.397 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -5.349 -20.978 -0.303 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -6.923 -20.668 0.255 1.00 0.00 H new ATOM 718 N ARG B 29 -5.150 -14.853 5.211 1.00 0.00 N ATOM 719 CA ARG B 29 -5.936 -14.057 6.196 1.00 0.00 C ATOM 720 C ARG B 29 -5.746 -12.560 5.937 1.00 0.00 C ATOM 721 O ARG B 29 -6.665 -11.776 6.071 1.00 0.00 O ATOM 722 CB ARG B 29 -5.366 -14.442 7.561 1.00 0.00 C ATOM 723 CG ARG B 29 -6.247 -13.857 8.667 1.00 0.00 C ATOM 724 CD ARG B 29 -5.588 -12.597 9.231 1.00 0.00 C ATOM 725 NE ARG B 29 -4.409 -13.088 9.995 1.00 0.00 N ATOM 726 CZ ARG B 29 -4.579 -13.723 11.123 1.00 0.00 C ATOM 727 NH1 ARG B 29 -5.782 -13.930 11.583 1.00 0.00 N ATOM 728 NH2 ARG B 29 -3.543 -14.153 11.791 1.00 0.00 N ATOM 0 H ARG B 29 -4.437 -15.461 5.615 1.00 0.00 H new ATOM 0 HA ARG B 29 -7.005 -14.257 6.130 1.00 0.00 H new ATOM 0 HB2 ARG B 29 -5.320 -15.527 7.654 1.00 0.00 H new ATOM 0 HB3 ARG B 29 -4.346 -14.070 7.659 1.00 0.00 H new ATOM 0 HG2 ARG B 29 -7.234 -13.618 8.272 1.00 0.00 H new ATOM 0 HG3 ARG B 29 -6.390 -14.591 9.460 1.00 0.00 H new ATOM 0 HD2 ARG B 29 -5.287 -11.918 8.433 1.00 0.00 H new ATOM 0 HD3 ARG B 29 -6.274 -12.047 9.875 1.00 0.00 H new ATOM 0 HE ARG B 29 -3.467 -12.928 9.637 1.00 0.00 H new ATOM 0 HH11 ARG B 29 -6.592 -13.596 11.061 1.00 0.00 H new ATOM 0 HH12 ARG B 29 -5.913 -14.426 12.464 1.00 0.00 H new ATOM 0 HH21 ARG B 29 -2.602 -13.993 11.432 1.00 0.00 H new ATOM 0 HH22 ARG B 29 -3.675 -14.649 12.672 1.00 0.00 H new ATOM 742 N ILE B 30 -4.561 -12.156 5.572 1.00 0.00 N ATOM 743 CA ILE B 30 -4.310 -10.720 5.310 1.00 0.00 C ATOM 744 C ILE B 30 -5.239 -10.211 4.205 1.00 0.00 C ATOM 745 O ILE B 30 -5.876 -9.187 4.342 1.00 0.00 O ATOM 746 CB ILE B 30 -2.859 -10.684 4.846 1.00 0.00 C ATOM 747 CG1 ILE B 30 -1.939 -10.849 6.054 1.00 0.00 C ATOM 748 CG2 ILE B 30 -2.578 -9.351 4.163 1.00 0.00 C ATOM 749 CD1 ILE B 30 -2.004 -9.589 6.914 1.00 0.00 C ATOM 0 H ILE B 30 -3.754 -12.766 5.444 1.00 0.00 H new ATOM 0 HA ILE B 30 -4.490 -10.091 6.182 1.00 0.00 H new ATOM 0 HB ILE B 30 -2.678 -11.495 4.140 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -2.240 -11.718 6.639 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -0.915 -11.026 5.724 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -1.540 -9.324 3.831 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -3.238 -9.237 3.303 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -2.755 -8.537 4.866 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -1.348 -9.703 7.777 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -1.682 -8.730 6.325 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -3.028 -9.433 7.254 1.00 0.00 H new ATOM 761 N VAL B 31 -5.326 -10.917 3.114 1.00 0.00 N ATOM 762 CA VAL B 31 -6.214 -10.471 2.012 1.00 0.00 C ATOM 763 C VAL B 31 -7.668 -10.429 2.498 1.00 0.00 C ATOM 764 O VAL B 31 -8.384 -9.478 2.260 1.00 0.00 O ATOM 765 CB VAL B 31 -6.026 -11.522 0.920 1.00 0.00 C ATOM 766 CG1 VAL B 31 -6.534 -10.964 -0.402 1.00 0.00 C ATOM 767 CG2 VAL B 31 -4.537 -11.856 0.784 1.00 0.00 C ATOM 0 H VAL B 31 -4.819 -11.785 2.940 1.00 0.00 H new ATOM 0 HA VAL B 31 -5.978 -9.469 1.653 1.00 0.00 H new ATOM 0 HB VAL B 31 -6.581 -12.423 1.181 1.00 0.00 H new ATOM 0 HG11 VAL B 31 -6.403 -11.710 -1.186 1.00 0.00 H new ATOM 0 HG12 VAL B 31 -7.592 -10.717 -0.310 1.00 0.00 H new ATOM 0 HG13 VAL B 31 -5.972 -10.066 -0.658 1.00 0.00 H new ATOM 0 HG21 VAL B 31 -4.402 -12.606 0.005 1.00 0.00 H new ATOM 0 HG22 VAL B 31 -3.985 -10.954 0.519 1.00 0.00 H new ATOM 0 HG23 VAL B 31 -4.163 -12.245 1.731 1.00 0.00 H new ATOM 777 N GLU B 32 -8.103 -11.451 3.186 1.00 0.00 N ATOM 778 CA GLU B 32 -9.505 -11.471 3.701 1.00 0.00 C ATOM 779 C GLU B 32 -9.631 -10.556 4.921 1.00 0.00 C ATOM 780 O GLU B 32 -10.709 -10.342 5.441 1.00 0.00 O ATOM 781 CB GLU B 32 -9.760 -12.927 4.094 1.00 0.00 C ATOM 782 CG GLU B 32 -11.224 -13.095 4.506 1.00 0.00 C ATOM 783 CD GLU B 32 -11.313 -14.051 5.697 1.00 0.00 C ATOM 784 OE1 GLU B 32 -10.474 -14.932 5.788 1.00 0.00 O ATOM 785 OE2 GLU B 32 -12.218 -13.887 6.498 1.00 0.00 O ATOM 0 H GLU B 32 -7.547 -12.275 3.414 1.00 0.00 H new ATOM 0 HA GLU B 32 -10.223 -11.116 2.962 1.00 0.00 H new ATOM 0 HB2 GLU B 32 -9.528 -13.587 3.258 1.00 0.00 H new ATOM 0 HB3 GLU B 32 -9.104 -13.213 4.917 1.00 0.00 H new ATOM 0 HG2 GLU B 32 -11.652 -12.128 4.770 1.00 0.00 H new ATOM 0 HG3 GLU B 32 -11.806 -13.483 3.670 1.00 0.00 H new ATOM 792 N GLY B 33 -8.538 -10.015 5.380 1.00 0.00 N ATOM 793 CA GLY B 33 -8.588 -9.113 6.563 1.00 0.00 C ATOM 794 C GLY B 33 -8.736 -7.666 6.091 1.00 0.00 C ATOM 795 O GLY B 33 -9.378 -6.854 6.728 1.00 0.00 O ATOM 0 H GLY B 33 -7.609 -10.159 4.985 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -9.425 -9.385 7.207 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -7.680 -9.223 7.157 1.00 0.00 H new ATOM 799 N ILE B 34 -8.154 -7.344 4.970 1.00 0.00 N ATOM 800 CA ILE B 34 -8.262 -5.955 4.436 1.00 0.00 C ATOM 801 C ILE B 34 -9.035 -5.982 3.121 1.00 0.00 C ATOM 802 O ILE B 34 -10.012 -5.282 2.942 1.00 0.00 O ATOM 803 CB ILE B 34 -6.813 -5.481 4.224 1.00 0.00 C ATOM 804 CG1 ILE B 34 -6.723 -4.572 2.986 1.00 0.00 C ATOM 805 CG2 ILE B 34 -5.877 -6.682 4.059 1.00 0.00 C ATOM 806 CD1 ILE B 34 -6.070 -5.325 1.820 1.00 0.00 C ATOM 0 H ILE B 34 -7.605 -7.985 4.397 1.00 0.00 H new ATOM 0 HA ILE B 34 -8.794 -5.283 5.109 1.00 0.00 H new ATOM 0 HB ILE B 34 -6.505 -4.913 5.102 1.00 0.00 H new ATOM 0 HG12 ILE B 34 -7.720 -4.237 2.699 1.00 0.00 H new ATOM 0 HG13 ILE B 34 -6.143 -3.680 3.223 1.00 0.00 H new ATOM 0 HG21 ILE B 34 -4.856 -6.330 3.910 1.00 0.00 H new ATOM 0 HG22 ILE B 34 -5.920 -7.302 4.954 1.00 0.00 H new ATOM 0 HG23 ILE B 34 -6.188 -7.270 3.195 1.00 0.00 H new ATOM 0 HD11 ILE B 34 -6.013 -4.670 0.951 1.00 0.00 H new ATOM 0 HD12 ILE B 34 -5.066 -5.638 2.106 1.00 0.00 H new ATOM 0 HD13 ILE B 34 -6.667 -6.203 1.574 1.00 0.00 H new ATOM 818 N LEU B 35 -8.606 -6.798 2.207 1.00 0.00 N ATOM 819 CA LEU B 35 -9.313 -6.895 0.898 1.00 0.00 C ATOM 820 C LEU B 35 -10.506 -7.845 1.027 1.00 0.00 C ATOM 821 O LEU B 35 -11.336 -7.941 0.145 1.00 0.00 O ATOM 822 CB LEU B 35 -8.276 -7.461 -0.074 1.00 0.00 C ATOM 823 CG LEU B 35 -8.157 -6.537 -1.288 1.00 0.00 C ATOM 824 CD1 LEU B 35 -6.776 -5.880 -1.295 1.00 0.00 C ATOM 825 CD2 LEU B 35 -8.337 -7.356 -2.568 1.00 0.00 C ATOM 0 H LEU B 35 -7.793 -7.406 2.306 1.00 0.00 H new ATOM 0 HA LEU B 35 -9.700 -5.934 0.559 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -7.310 -7.554 0.422 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -8.568 -8.462 -0.392 1.00 0.00 H new ATOM 0 HG LEU B 35 -8.926 -5.766 -1.236 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -6.691 -5.222 -2.160 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -6.645 -5.299 -0.382 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -6.007 -6.650 -1.348 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -8.253 -6.700 -3.434 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -7.567 -8.125 -2.619 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -9.320 -7.827 -2.564 1.00 0.00 H new ATOM 837 N LYS B 36 -10.600 -8.541 2.128 1.00 0.00 N ATOM 838 CA LYS B 36 -11.741 -9.482 2.324 1.00 0.00 C ATOM 839 C LYS B 36 -11.828 -10.469 1.160 1.00 0.00 C ATOM 840 O LYS B 36 -12.889 -10.705 0.616 1.00 0.00 O ATOM 841 CB LYS B 36 -12.983 -8.591 2.366 1.00 0.00 C ATOM 842 CG LYS B 36 -14.024 -9.210 3.300 1.00 0.00 C ATOM 843 CD LYS B 36 -14.766 -8.100 4.047 1.00 0.00 C ATOM 844 CE LYS B 36 -14.573 -8.281 5.554 1.00 0.00 C ATOM 845 NZ LYS B 36 -13.583 -7.238 5.943 1.00 0.00 N ATOM 0 H LYS B 36 -9.936 -8.499 2.901 1.00 0.00 H new ATOM 0 HA LYS B 36 -11.632 -10.077 3.231 1.00 0.00 H new ATOM 0 HB2 LYS B 36 -12.716 -7.593 2.713 1.00 0.00 H new ATOM 0 HB3 LYS B 36 -13.398 -8.480 1.364 1.00 0.00 H new ATOM 0 HG2 LYS B 36 -14.730 -9.812 2.727 1.00 0.00 H new ATOM 0 HG3 LYS B 36 -13.538 -9.879 4.010 1.00 0.00 H new ATOM 0 HD2 LYS B 36 -14.391 -7.125 3.736 1.00 0.00 H new ATOM 0 HD3 LYS B 36 -15.827 -8.127 3.800 1.00 0.00 H new ATOM 0 HE2 LYS B 36 -15.513 -8.153 6.091 1.00 0.00 H new ATOM 0 HE3 LYS B 36 -14.206 -9.280 5.788 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 -13.398 -7.298 6.965 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 -12.696 -7.389 5.421 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 -13.962 -6.297 5.715 1.00 0.00 H new ATOM 859 N ARG B 37 -10.726 -11.048 0.766 1.00 0.00 N ATOM 860 CA ARG B 37 -10.767 -12.014 -0.370 1.00 0.00 C ATOM 861 C ARG B 37 -10.901 -13.448 0.153 1.00 0.00 C ATOM 862 O ARG B 37 -10.153 -13.870 1.013 1.00 0.00 O ATOM 863 CB ARG B 37 -9.433 -11.833 -1.088 1.00 0.00 C ATOM 864 CG ARG B 37 -9.280 -12.908 -2.163 1.00 0.00 C ATOM 865 CD ARG B 37 -8.177 -12.496 -3.140 1.00 0.00 C ATOM 866 NE ARG B 37 -7.074 -13.467 -2.907 1.00 0.00 N ATOM 867 CZ ARG B 37 -5.999 -13.422 -3.646 1.00 0.00 C ATOM 868 NH1 ARG B 37 -5.894 -12.533 -4.595 1.00 0.00 N ATOM 869 NH2 ARG B 37 -5.028 -14.269 -3.437 1.00 0.00 N ATOM 0 H ARG B 37 -9.805 -10.896 1.178 1.00 0.00 H new ATOM 0 HA ARG B 37 -11.617 -11.837 -1.030 1.00 0.00 H new ATOM 0 HB2 ARG B 37 -9.383 -10.842 -1.540 1.00 0.00 H new ATOM 0 HB3 ARG B 37 -8.612 -11.899 -0.374 1.00 0.00 H new ATOM 0 HG2 ARG B 37 -9.035 -13.865 -1.703 1.00 0.00 H new ATOM 0 HG3 ARG B 37 -10.222 -13.042 -2.696 1.00 0.00 H new ATOM 0 HD2 ARG B 37 -8.528 -12.537 -4.171 1.00 0.00 H new ATOM 0 HD3 ARG B 37 -7.848 -11.473 -2.956 1.00 0.00 H new ATOM 0 HE ARG B 37 -7.158 -14.167 -2.170 1.00 0.00 H new ATOM 0 HH11 ARG B 37 -6.653 -11.872 -4.760 1.00 0.00 H new ATOM 0 HH12 ARG B 37 -5.053 -12.499 -5.171 1.00 0.00 H new ATOM 0 HH21 ARG B 37 -5.109 -14.966 -2.696 1.00 0.00 H new ATOM 0 HH22 ARG B 37 -4.188 -14.234 -4.014 1.00 0.00 H new ATOM 883 N PRO B 38 -11.855 -14.152 -0.396 1.00 0.00 N ATOM 884 CA PRO B 38 -12.097 -15.555 0.006 1.00 0.00 C ATOM 885 C PRO B 38 -11.112 -16.489 -0.704 1.00 0.00 C ATOM 886 O PRO B 38 -10.783 -16.283 -1.855 1.00 0.00 O ATOM 887 CB PRO B 38 -13.521 -15.819 -0.466 1.00 0.00 C ATOM 888 CG PRO B 38 -13.754 -14.858 -1.594 1.00 0.00 C ATOM 889 CD PRO B 38 -12.793 -13.704 -1.429 1.00 0.00 C ATOM 0 HA PRO B 38 -11.966 -15.724 1.075 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -13.639 -16.850 -0.798 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -14.237 -15.659 0.340 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -13.597 -15.351 -2.553 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -14.784 -14.501 -1.584 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -12.278 -13.480 -2.363 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -13.313 -12.795 -1.126 1.00 0.00 H new ATOM 897 N PRO B 39 -10.677 -17.490 0.009 1.00 0.00 N ATOM 898 CA PRO B 39 -9.721 -18.470 -0.561 1.00 0.00 C ATOM 899 C PRO B 39 -10.433 -19.398 -1.550 1.00 0.00 C ATOM 900 O PRO B 39 -10.837 -20.491 -1.207 1.00 0.00 O ATOM 901 CB PRO B 39 -9.236 -19.247 0.659 1.00 0.00 C ATOM 902 CG PRO B 39 -10.333 -19.112 1.668 1.00 0.00 C ATOM 903 CD PRO B 39 -11.027 -17.802 1.398 1.00 0.00 C ATOM 0 HA PRO B 39 -8.907 -18.003 -1.115 1.00 0.00 H new ATOM 0 HB2 PRO B 39 -9.053 -20.293 0.413 1.00 0.00 H new ATOM 0 HB3 PRO B 39 -8.299 -18.840 1.039 1.00 0.00 H new ATOM 0 HG2 PRO B 39 -11.034 -19.943 1.588 1.00 0.00 H new ATOM 0 HG3 PRO B 39 -9.929 -19.132 2.680 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -12.106 -17.889 1.527 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -10.686 -17.023 2.079 1.00 0.00 H new ATOM 911 N ASP B 40 -10.593 -18.970 -2.773 1.00 0.00 N ATOM 912 CA ASP B 40 -11.282 -19.832 -3.777 1.00 0.00 C ATOM 913 C ASP B 40 -10.977 -19.348 -5.198 1.00 0.00 C ATOM 914 O ASP B 40 -10.248 -19.981 -5.936 1.00 0.00 O ATOM 915 CB ASP B 40 -12.773 -19.682 -3.469 1.00 0.00 C ATOM 916 CG ASP B 40 -13.278 -20.945 -2.768 1.00 0.00 C ATOM 917 OD1 ASP B 40 -13.005 -22.024 -3.267 1.00 0.00 O ATOM 918 OD2 ASP B 40 -13.929 -20.811 -1.745 1.00 0.00 O ATOM 0 H ASP B 40 -10.278 -18.064 -3.120 1.00 0.00 H new ATOM 0 HA ASP B 40 -10.954 -20.870 -3.721 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -12.939 -18.811 -2.836 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -13.331 -19.517 -4.391 1.00 0.00 H new ATOM 923 N GLU B 41 -11.531 -18.233 -5.591 1.00 0.00 N ATOM 924 CA GLU B 41 -11.273 -17.715 -6.965 1.00 0.00 C ATOM 925 C GLU B 41 -10.167 -16.658 -6.936 1.00 0.00 C ATOM 926 O GLU B 41 -10.266 -15.624 -7.566 1.00 0.00 O ATOM 927 CB GLU B 41 -12.598 -17.094 -7.410 1.00 0.00 C ATOM 928 CG GLU B 41 -13.719 -18.126 -7.269 1.00 0.00 C ATOM 929 CD GLU B 41 -14.729 -17.644 -6.227 1.00 0.00 C ATOM 930 OE1 GLU B 41 -14.306 -17.313 -5.130 1.00 0.00 O ATOM 931 OE2 GLU B 41 -15.906 -17.614 -6.541 1.00 0.00 O ATOM 0 H GLU B 41 -12.151 -17.659 -5.020 1.00 0.00 H new ATOM 0 HA GLU B 41 -10.942 -18.500 -7.645 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -12.821 -16.215 -6.806 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -12.525 -16.759 -8.445 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -14.214 -18.274 -8.229 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -13.305 -19.089 -6.971 1.00 0.00 H new ATOM 938 N GLN B 42 -9.113 -16.909 -6.209 1.00 0.00 N ATOM 939 CA GLN B 42 -7.999 -15.919 -6.140 1.00 0.00 C ATOM 940 C GLN B 42 -6.650 -16.635 -6.231 1.00 0.00 C ATOM 941 O GLN B 42 -6.504 -17.765 -5.810 1.00 0.00 O ATOM 942 CB GLN B 42 -8.140 -15.220 -4.781 1.00 0.00 C ATOM 943 CG GLN B 42 -9.288 -15.836 -3.977 1.00 0.00 C ATOM 944 CD GLN B 42 -10.624 -15.327 -4.520 1.00 0.00 C ATOM 945 OE1 GLN B 42 -10.656 -14.494 -5.403 1.00 0.00 O ATOM 946 NE2 GLN B 42 -11.738 -15.796 -4.027 1.00 0.00 N ATOM 0 H GLN B 42 -8.974 -17.757 -5.659 1.00 0.00 H new ATOM 0 HA GLN B 42 -8.045 -15.206 -6.963 1.00 0.00 H new ATOM 0 HB2 GLN B 42 -7.208 -15.308 -4.222 1.00 0.00 H new ATOM 0 HB3 GLN B 42 -8.323 -14.156 -4.930 1.00 0.00 H new ATOM 0 HG2 GLN B 42 -9.248 -16.923 -4.041 1.00 0.00 H new ATOM 0 HG3 GLN B 42 -9.189 -15.575 -2.923 1.00 0.00 H new ATOM 0 HE21 GLN B 42 -11.713 -16.496 -3.285 1.00 0.00 H new ATOM 0 HE22 GLN B 42 -12.634 -15.463 -4.384 1.00 0.00 H new ATOM 955 N ARG B 43 -5.663 -15.982 -6.779 1.00 0.00 N ATOM 956 CA ARG B 43 -4.321 -16.616 -6.900 1.00 0.00 C ATOM 957 C ARG B 43 -3.242 -15.661 -6.383 1.00 0.00 C ATOM 958 O ARG B 43 -3.387 -14.456 -6.441 1.00 0.00 O ATOM 959 CB ARG B 43 -4.136 -16.877 -8.395 1.00 0.00 C ATOM 960 CG ARG B 43 -3.649 -18.312 -8.607 1.00 0.00 C ATOM 961 CD ARG B 43 -4.114 -18.813 -9.976 1.00 0.00 C ATOM 962 NE ARG B 43 -4.517 -20.229 -9.750 1.00 0.00 N ATOM 963 CZ ARG B 43 -5.660 -20.501 -9.181 1.00 0.00 C ATOM 964 NH1 ARG B 43 -6.454 -19.533 -8.810 1.00 0.00 N ATOM 965 NH2 ARG B 43 -6.010 -21.743 -8.983 1.00 0.00 N ATOM 0 H ARG B 43 -5.729 -15.034 -7.149 1.00 0.00 H new ATOM 0 HA ARG B 43 -4.242 -17.533 -6.317 1.00 0.00 H new ATOM 0 HB2 ARG B 43 -5.077 -16.720 -8.921 1.00 0.00 H new ATOM 0 HB3 ARG B 43 -3.416 -16.172 -8.812 1.00 0.00 H new ATOM 0 HG2 ARG B 43 -2.562 -18.351 -8.544 1.00 0.00 H new ATOM 0 HG3 ARG B 43 -4.037 -18.959 -7.820 1.00 0.00 H new ATOM 0 HD2 ARG B 43 -4.948 -18.220 -10.351 1.00 0.00 H new ATOM 0 HD3 ARG B 43 -3.315 -18.743 -10.714 1.00 0.00 H new ATOM 0 HE ARG B 43 -3.899 -20.987 -10.040 1.00 0.00 H new ATOM 0 HH11 ARG B 43 -6.182 -18.562 -8.965 1.00 0.00 H new ATOM 0 HH12 ARG B 43 -7.347 -19.748 -8.366 1.00 0.00 H new ATOM 0 HH21 ARG B 43 -5.391 -22.500 -9.273 1.00 0.00 H new ATOM 0 HH22 ARG B 43 -6.903 -21.957 -8.538 1.00 0.00 H new ATOM 979 N LEU B 44 -2.162 -16.187 -5.875 1.00 0.00 N ATOM 980 CA LEU B 44 -1.079 -15.306 -5.354 1.00 0.00 C ATOM 981 C LEU B 44 0.206 -15.526 -6.154 1.00 0.00 C ATOM 982 O LEU B 44 0.468 -16.610 -6.637 1.00 0.00 O ATOM 983 CB LEU B 44 -0.883 -15.734 -3.900 1.00 0.00 C ATOM 984 CG LEU B 44 -2.164 -15.459 -3.111 1.00 0.00 C ATOM 985 CD1 LEU B 44 -2.210 -16.370 -1.883 1.00 0.00 C ATOM 986 CD2 LEU B 44 -2.181 -13.997 -2.661 1.00 0.00 C ATOM 0 H LEU B 44 -1.982 -17.188 -5.798 1.00 0.00 H new ATOM 0 HA LEU B 44 -1.331 -14.249 -5.436 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -0.634 -16.794 -3.852 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -0.048 -15.190 -3.459 1.00 0.00 H new ATOM 0 HG LEU B 44 -3.030 -15.655 -3.743 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -3.122 -16.175 -1.319 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -2.196 -17.412 -2.202 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -1.344 -16.173 -1.251 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -3.094 -13.800 -2.099 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -1.315 -13.801 -2.028 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -2.146 -13.347 -3.535 1.00 0.00 H new ATOM 998 N TYR B 45 1.009 -14.509 -6.298 1.00 0.00 N ATOM 999 CA TYR B 45 2.273 -14.668 -7.067 1.00 0.00 C ATOM 1000 C TYR B 45 3.446 -14.103 -6.267 1.00 0.00 C ATOM 1001 O TYR B 45 3.385 -13.011 -5.739 1.00 0.00 O ATOM 1002 CB TYR B 45 2.061 -13.863 -8.349 1.00 0.00 C ATOM 1003 CG TYR B 45 1.395 -14.732 -9.389 1.00 0.00 C ATOM 1004 CD1 TYR B 45 0.081 -15.174 -9.196 1.00 0.00 C ATOM 1005 CD2 TYR B 45 2.093 -15.095 -10.548 1.00 0.00 C ATOM 1006 CE1 TYR B 45 -0.535 -15.980 -10.162 1.00 0.00 C ATOM 1007 CE2 TYR B 45 1.477 -15.901 -11.513 1.00 0.00 C ATOM 1008 CZ TYR B 45 0.163 -16.343 -11.319 1.00 0.00 C ATOM 1009 OH TYR B 45 -0.445 -17.137 -12.271 1.00 0.00 O ATOM 0 H TYR B 45 0.845 -13.577 -5.917 1.00 0.00 H new ATOM 0 HA TYR B 45 2.503 -15.713 -7.277 1.00 0.00 H new ATOM 0 HB2 TYR B 45 1.445 -12.988 -8.143 1.00 0.00 H new ATOM 0 HB3 TYR B 45 3.017 -13.498 -8.724 1.00 0.00 H new ATOM 0 HD1 TYR B 45 -0.458 -14.894 -8.303 1.00 0.00 H new ATOM 0 HD2 TYR B 45 3.107 -14.753 -10.697 1.00 0.00 H new ATOM 0 HE1 TYR B 45 -1.549 -16.321 -10.014 1.00 0.00 H new ATOM 0 HE2 TYR B 45 2.015 -16.181 -12.406 1.00 0.00 H new ATOM 0 HH TYR B 45 0.177 -17.294 -13.012 1.00 0.00 H new ATOM 1019 N LYS B 46 4.514 -14.841 -6.176 1.00 0.00 N ATOM 1020 CA LYS B 46 5.699 -14.355 -5.411 1.00 0.00 C ATOM 1021 C LYS B 46 6.870 -14.083 -6.361 1.00 0.00 C ATOM 1022 O LYS B 46 7.246 -14.924 -7.153 1.00 0.00 O ATOM 1023 CB LYS B 46 6.042 -15.492 -4.448 1.00 0.00 C ATOM 1024 CG LYS B 46 6.684 -16.642 -5.226 1.00 0.00 C ATOM 1025 CD LYS B 46 6.859 -17.850 -4.303 1.00 0.00 C ATOM 1026 CE LYS B 46 7.913 -18.792 -4.887 1.00 0.00 C ATOM 1027 NZ LYS B 46 9.178 -18.007 -4.880 1.00 0.00 N ATOM 0 H LYS B 46 4.620 -15.763 -6.599 1.00 0.00 H new ATOM 0 HA LYS B 46 5.496 -13.422 -4.885 1.00 0.00 H new ATOM 0 HB2 LYS B 46 6.724 -15.136 -3.676 1.00 0.00 H new ATOM 0 HB3 LYS B 46 5.141 -15.839 -3.942 1.00 0.00 H new ATOM 0 HG2 LYS B 46 6.061 -16.910 -6.079 1.00 0.00 H new ATOM 0 HG3 LYS B 46 7.651 -16.331 -5.623 1.00 0.00 H new ATOM 0 HD2 LYS B 46 7.162 -17.520 -3.309 1.00 0.00 H new ATOM 0 HD3 LYS B 46 5.910 -18.375 -4.190 1.00 0.00 H new ATOM 0 HE2 LYS B 46 8.008 -19.698 -4.288 1.00 0.00 H new ATOM 0 HE3 LYS B 46 7.647 -19.104 -5.897 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 9.972 -18.631 -4.631 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 9.340 -17.601 -5.824 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 9.107 -17.240 -4.181 1.00 0.00 H new ATOM 1041 N ASP B 47 7.449 -12.916 -6.285 1.00 0.00 N ATOM 1042 CA ASP B 47 8.596 -12.592 -7.180 1.00 0.00 C ATOM 1043 C ASP B 47 8.294 -13.037 -8.614 1.00 0.00 C ATOM 1044 O ASP B 47 8.803 -14.035 -9.084 1.00 0.00 O ATOM 1045 CB ASP B 47 9.776 -13.380 -6.612 1.00 0.00 C ATOM 1046 CG ASP B 47 11.073 -12.900 -7.266 1.00 0.00 C ATOM 1047 OD1 ASP B 47 11.089 -11.782 -7.755 1.00 0.00 O ATOM 1048 OD2 ASP B 47 12.029 -13.658 -7.267 1.00 0.00 O ATOM 0 H ASP B 47 7.177 -12.173 -5.642 1.00 0.00 H new ATOM 0 HA ASP B 47 8.800 -11.522 -7.217 1.00 0.00 H new ATOM 0 HB2 ASP B 47 9.830 -13.246 -5.532 1.00 0.00 H new ATOM 0 HB3 ASP B 47 9.637 -14.446 -6.795 1.00 0.00 H new ATOM 1053 N ASP B 48 7.471 -12.304 -9.312 1.00 0.00 N ATOM 1054 CA ASP B 48 7.138 -12.684 -10.716 1.00 0.00 C ATOM 1055 C ASP B 48 6.928 -14.197 -10.821 1.00 0.00 C ATOM 1056 O ASP B 48 7.495 -14.855 -11.670 1.00 0.00 O ATOM 1057 CB ASP B 48 8.350 -12.252 -11.542 1.00 0.00 C ATOM 1058 CG ASP B 48 8.195 -12.752 -12.978 1.00 0.00 C ATOM 1059 OD1 ASP B 48 7.455 -12.132 -13.724 1.00 0.00 O ATOM 1060 OD2 ASP B 48 8.819 -13.747 -13.309 1.00 0.00 O ATOM 0 H ASP B 48 7.014 -11.458 -8.972 1.00 0.00 H new ATOM 0 HA ASP B 48 6.219 -12.212 -11.063 1.00 0.00 H new ATOM 0 HB2 ASP B 48 8.441 -11.166 -11.532 1.00 0.00 H new ATOM 0 HB3 ASP B 48 9.264 -12.653 -11.103 1.00 0.00 H new ATOM 1065 N GLN B 49 6.117 -14.753 -9.963 1.00 0.00 N ATOM 1066 CA GLN B 49 5.872 -16.224 -10.014 1.00 0.00 C ATOM 1067 C GLN B 49 4.594 -16.572 -9.248 1.00 0.00 C ATOM 1068 O GLN B 49 3.870 -15.703 -8.804 1.00 0.00 O ATOM 1069 CB GLN B 49 7.091 -16.851 -9.336 1.00 0.00 C ATOM 1070 CG GLN B 49 7.811 -17.767 -10.327 1.00 0.00 C ATOM 1071 CD GLN B 49 8.736 -18.718 -9.565 1.00 0.00 C ATOM 1072 OE1 GLN B 49 9.144 -18.430 -8.458 1.00 0.00 O ATOM 1073 NE2 GLN B 49 9.085 -19.849 -10.116 1.00 0.00 N ATOM 0 H GLN B 49 5.614 -14.254 -9.230 1.00 0.00 H new ATOM 0 HA GLN B 49 5.741 -16.587 -11.033 1.00 0.00 H new ATOM 0 HB2 GLN B 49 7.768 -16.071 -8.988 1.00 0.00 H new ATOM 0 HB3 GLN B 49 6.781 -17.419 -8.459 1.00 0.00 H new ATOM 0 HG2 GLN B 49 7.084 -18.336 -10.906 1.00 0.00 H new ATOM 0 HG3 GLN B 49 8.387 -17.172 -11.035 1.00 0.00 H new ATOM 0 HE21 GLN B 49 8.742 -20.091 -11.046 1.00 0.00 H new ATOM 0 HE22 GLN B 49 9.701 -20.491 -9.617 1.00 0.00 H new ATOM 1082 N LEU B 50 4.313 -17.836 -9.088 1.00 0.00 N ATOM 1083 CA LEU B 50 3.081 -18.238 -8.350 1.00 0.00 C ATOM 1084 C LEU B 50 3.442 -18.691 -6.933 1.00 0.00 C ATOM 1085 O LEU B 50 4.372 -19.448 -6.731 1.00 0.00 O ATOM 1086 CB LEU B 50 2.499 -19.401 -9.154 1.00 0.00 C ATOM 1087 CG LEU B 50 1.121 -19.766 -8.600 1.00 0.00 C ATOM 1088 CD1 LEU B 50 0.181 -18.565 -8.733 1.00 0.00 C ATOM 1089 CD2 LEU B 50 0.551 -20.947 -9.390 1.00 0.00 C ATOM 0 H LEU B 50 4.882 -18.608 -9.436 1.00 0.00 H new ATOM 0 HA LEU B 50 2.371 -17.417 -8.251 1.00 0.00 H new ATOM 0 HB2 LEU B 50 2.418 -19.126 -10.206 1.00 0.00 H new ATOM 0 HB3 LEU B 50 3.164 -20.263 -9.100 1.00 0.00 H new ATOM 0 HG LEU B 50 1.214 -20.040 -7.549 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -0.801 -18.826 -8.338 1.00 0.00 H new ATOM 0 HD12 LEU B 50 0.586 -17.722 -8.172 1.00 0.00 H new ATOM 0 HD13 LEU B 50 0.088 -18.290 -9.784 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -0.431 -21.208 -8.996 1.00 0.00 H new ATOM 0 HD22 LEU B 50 0.459 -20.672 -10.441 1.00 0.00 H new ATOM 0 HD23 LEU B 50 1.219 -21.803 -9.297 1.00 0.00 H new ATOM 1101 N LEU B 51 2.717 -18.234 -5.950 1.00 0.00 N ATOM 1102 CA LEU B 51 3.022 -18.636 -4.548 1.00 0.00 C ATOM 1103 C LEU B 51 2.293 -19.936 -4.196 1.00 0.00 C ATOM 1104 O LEU B 51 1.080 -20.004 -4.220 1.00 0.00 O ATOM 1105 CB LEU B 51 2.509 -17.482 -3.685 1.00 0.00 C ATOM 1106 CG LEU B 51 2.623 -17.858 -2.206 1.00 0.00 C ATOM 1107 CD1 LEU B 51 3.937 -17.319 -1.641 1.00 0.00 C ATOM 1108 CD2 LEU B 51 1.449 -17.250 -1.436 1.00 0.00 C ATOM 0 H LEU B 51 1.926 -17.599 -6.057 1.00 0.00 H new ATOM 0 HA LEU B 51 4.085 -18.820 -4.394 1.00 0.00 H new ATOM 0 HB2 LEU B 51 3.086 -16.579 -3.887 1.00 0.00 H new ATOM 0 HB3 LEU B 51 1.472 -17.260 -3.936 1.00 0.00 H new ATOM 0 HG LEU B 51 2.604 -18.943 -2.104 1.00 0.00 H new ATOM 0 HD11 LEU B 51 4.017 -17.587 -0.588 1.00 0.00 H new ATOM 0 HD12 LEU B 51 4.774 -17.751 -2.190 1.00 0.00 H new ATOM 0 HD13 LEU B 51 3.958 -16.234 -1.742 1.00 0.00 H new ATOM 0 HD21 LEU B 51 1.528 -17.517 -0.382 1.00 0.00 H new ATOM 0 HD22 LEU B 51 1.470 -16.165 -1.538 1.00 0.00 H new ATOM 0 HD23 LEU B 51 0.512 -17.635 -1.838 1.00 0.00 H new ATOM 1120 N ASP B 52 3.024 -20.968 -3.867 1.00 0.00 N ATOM 1121 CA ASP B 52 2.369 -22.261 -3.513 1.00 0.00 C ATOM 1122 C ASP B 52 1.946 -22.248 -2.041 1.00 0.00 C ATOM 1123 O ASP B 52 2.769 -22.244 -1.148 1.00 0.00 O ATOM 1124 CB ASP B 52 3.440 -23.327 -3.754 1.00 0.00 C ATOM 1125 CG ASP B 52 4.663 -23.027 -2.886 1.00 0.00 C ATOM 1126 OD1 ASP B 52 4.740 -21.927 -2.362 1.00 0.00 O ATOM 1127 OD2 ASP B 52 5.504 -23.903 -2.759 1.00 0.00 O ATOM 0 H ASP B 52 4.043 -20.972 -3.828 1.00 0.00 H new ATOM 0 HA ASP B 52 1.471 -22.447 -4.102 1.00 0.00 H new ATOM 0 HB2 ASP B 52 3.045 -24.315 -3.516 1.00 0.00 H new ATOM 0 HB3 ASP B 52 3.723 -23.342 -4.807 1.00 0.00 H new ATOM 1132 N ASP B 53 0.666 -22.239 -1.784 1.00 0.00 N ATOM 1133 CA ASP B 53 0.188 -22.220 -0.370 1.00 0.00 C ATOM 1134 C ASP B 53 0.579 -23.514 0.351 1.00 0.00 C ATOM 1135 O ASP B 53 0.392 -23.650 1.543 1.00 0.00 O ATOM 1136 CB ASP B 53 -1.333 -22.102 -0.467 1.00 0.00 C ATOM 1137 CG ASP B 53 -1.860 -23.094 -1.505 1.00 0.00 C ATOM 1138 OD1 ASP B 53 -1.661 -22.849 -2.683 1.00 0.00 O ATOM 1139 OD2 ASP B 53 -2.455 -24.080 -1.105 1.00 0.00 O ATOM 0 H ASP B 53 -0.069 -22.244 -2.491 1.00 0.00 H new ATOM 0 HA ASP B 53 0.629 -21.400 0.197 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -1.786 -22.302 0.504 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -1.612 -21.086 -0.746 1.00 0.00 H new ATOM 1144 N GLY B 54 1.115 -24.467 -0.361 1.00 0.00 N ATOM 1145 CA GLY B 54 1.509 -25.748 0.291 1.00 0.00 C ATOM 1146 C GLY B 54 2.871 -25.585 0.969 1.00 0.00 C ATOM 1147 O GLY B 54 3.333 -26.463 1.669 1.00 0.00 O ATOM 0 H GLY B 54 1.297 -24.415 -1.363 1.00 0.00 H new ATOM 0 HA2 GLY B 54 0.759 -26.039 1.026 1.00 0.00 H new ATOM 0 HA3 GLY B 54 1.554 -26.546 -0.451 1.00 0.00 H new ATOM 1151 N LYS B 55 3.514 -24.465 0.779 1.00 0.00 N ATOM 1152 CA LYS B 55 4.818 -24.239 1.413 1.00 0.00 C ATOM 1153 C LYS B 55 4.875 -22.805 1.921 1.00 0.00 C ATOM 1154 O LYS B 55 4.339 -21.890 1.328 1.00 0.00 O ATOM 1155 CB LYS B 55 5.849 -24.463 0.305 1.00 0.00 C ATOM 1156 CG LYS B 55 6.592 -25.776 0.560 1.00 0.00 C ATOM 1157 CD LYS B 55 6.243 -26.783 -0.538 1.00 0.00 C ATOM 1158 CE LYS B 55 5.627 -28.034 0.093 1.00 0.00 C ATOM 1159 NZ LYS B 55 6.709 -28.608 0.941 1.00 0.00 N ATOM 0 H LYS B 55 3.176 -23.695 0.202 1.00 0.00 H new ATOM 0 HA LYS B 55 5.001 -24.900 2.260 1.00 0.00 H new ATOM 0 HB2 LYS B 55 5.355 -24.495 -0.666 1.00 0.00 H new ATOM 0 HB3 LYS B 55 6.555 -23.633 0.276 1.00 0.00 H new ATOM 0 HG2 LYS B 55 7.668 -25.600 0.578 1.00 0.00 H new ATOM 0 HG3 LYS B 55 6.319 -26.177 1.536 1.00 0.00 H new ATOM 0 HD2 LYS B 55 5.544 -26.338 -1.246 1.00 0.00 H new ATOM 0 HD3 LYS B 55 7.138 -27.049 -1.100 1.00 0.00 H new ATOM 0 HE2 LYS B 55 4.749 -27.785 0.688 1.00 0.00 H new ATOM 0 HE3 LYS B 55 5.304 -28.743 -0.669 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 6.629 -29.645 0.951 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 7.635 -28.336 0.554 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 6.619 -28.245 1.911 1.00 0.00 H new ATOM 1173 N THR B 56 5.528 -22.618 3.006 1.00 0.00 N ATOM 1174 CA THR B 56 5.663 -21.261 3.597 1.00 0.00 C ATOM 1175 C THR B 56 6.881 -20.559 2.999 1.00 0.00 C ATOM 1176 O THR B 56 7.646 -21.146 2.261 1.00 0.00 O ATOM 1177 CB THR B 56 5.859 -21.496 5.096 1.00 0.00 C ATOM 1178 OG1 THR B 56 6.470 -22.762 5.298 1.00 0.00 O ATOM 1179 CG2 THR B 56 4.502 -21.463 5.802 1.00 0.00 C ATOM 0 H THR B 56 5.991 -23.359 3.532 1.00 0.00 H new ATOM 0 HA THR B 56 4.796 -20.630 3.399 1.00 0.00 H new ATOM 0 HB THR B 56 6.498 -20.714 5.507 1.00 0.00 H new ATOM 0 HG1 THR B 56 5.777 -23.443 5.425 1.00 0.00 H new ATOM 0 HG21 THR B 56 4.643 -21.631 6.870 1.00 0.00 H new ATOM 0 HG22 THR B 56 4.034 -20.491 5.646 1.00 0.00 H new ATOM 0 HG23 THR B 56 3.860 -22.244 5.394 1.00 0.00 H new ATOM 1187 N LEU B 57 7.070 -19.310 3.309 1.00 0.00 N ATOM 1188 CA LEU B 57 8.244 -18.578 2.751 1.00 0.00 C ATOM 1189 C LEU B 57 9.530 -19.338 3.085 1.00 0.00 C ATOM 1190 O LEU B 57 10.461 -19.379 2.304 1.00 0.00 O ATOM 1191 CB LEU B 57 8.223 -17.203 3.422 1.00 0.00 C ATOM 1192 CG LEU B 57 8.370 -17.359 4.934 1.00 0.00 C ATOM 1193 CD1 LEU B 57 9.835 -17.158 5.328 1.00 0.00 C ATOM 1194 CD2 LEU B 57 7.507 -16.310 5.638 1.00 0.00 C ATOM 0 H LEU B 57 6.466 -18.763 3.922 1.00 0.00 H new ATOM 0 HA LEU B 57 8.202 -18.485 1.666 1.00 0.00 H new ATOM 0 HB2 LEU B 57 9.032 -16.586 3.031 1.00 0.00 H new ATOM 0 HB3 LEU B 57 7.290 -16.690 3.190 1.00 0.00 H new ATOM 0 HG LEU B 57 8.047 -18.357 5.230 1.00 0.00 H new ATOM 0 HD11 LEU B 57 9.940 -17.269 6.407 1.00 0.00 H new ATOM 0 HD12 LEU B 57 10.453 -17.902 4.825 1.00 0.00 H new ATOM 0 HD13 LEU B 57 10.157 -16.159 5.033 1.00 0.00 H new ATOM 0 HD21 LEU B 57 7.610 -16.419 6.718 1.00 0.00 H new ATOM 0 HD22 LEU B 57 7.832 -15.313 5.341 1.00 0.00 H new ATOM 0 HD23 LEU B 57 6.463 -16.450 5.357 1.00 0.00 H new ATOM 1206 N GLY B 58 9.580 -19.957 4.232 1.00 0.00 N ATOM 1207 CA GLY B 58 10.792 -20.734 4.612 1.00 0.00 C ATOM 1208 C GLY B 58 10.827 -22.016 3.783 1.00 0.00 C ATOM 1209 O GLY B 58 11.865 -22.438 3.313 1.00 0.00 O ATOM 0 H GLY B 58 8.831 -19.958 4.924 1.00 0.00 H new ATOM 0 HA2 GLY B 58 11.691 -20.144 4.435 1.00 0.00 H new ATOM 0 HA3 GLY B 58 10.771 -20.971 5.676 1.00 0.00 H new ATOM 1213 N GLU B 59 9.692 -22.633 3.593 1.00 0.00 N ATOM 1214 CA GLU B 59 9.649 -23.884 2.784 1.00 0.00 C ATOM 1215 C GLU B 59 9.673 -23.533 1.300 1.00 0.00 C ATOM 1216 O GLU B 59 9.595 -24.388 0.440 1.00 0.00 O ATOM 1217 CB GLU B 59 8.333 -24.561 3.161 1.00 0.00 C ATOM 1218 CG GLU B 59 8.618 -25.951 3.733 1.00 0.00 C ATOM 1219 CD GLU B 59 9.448 -25.816 5.012 1.00 0.00 C ATOM 1220 OE1 GLU B 59 8.920 -25.307 5.987 1.00 0.00 O ATOM 1221 OE2 GLU B 59 10.598 -26.223 4.994 1.00 0.00 O ATOM 0 H GLU B 59 8.793 -22.325 3.963 1.00 0.00 H new ATOM 0 HA GLU B 59 10.501 -24.537 2.975 1.00 0.00 H new ATOM 0 HB2 GLU B 59 7.799 -23.957 3.894 1.00 0.00 H new ATOM 0 HB3 GLU B 59 7.690 -24.642 2.285 1.00 0.00 H new ATOM 0 HG2 GLU B 59 7.682 -26.467 3.947 1.00 0.00 H new ATOM 0 HG3 GLU B 59 9.154 -26.554 3.001 1.00 0.00 H new ATOM 1228 N CYS B 60 9.794 -22.275 1.002 1.00 0.00 N ATOM 1229 CA CYS B 60 9.840 -21.837 -0.421 1.00 0.00 C ATOM 1230 C CYS B 60 11.239 -21.313 -0.739 1.00 0.00 C ATOM 1231 O CYS B 60 11.760 -21.520 -1.818 1.00 0.00 O ATOM 1232 CB CYS B 60 8.804 -20.718 -0.534 1.00 0.00 C ATOM 1233 SG CYS B 60 7.861 -20.925 -2.065 1.00 0.00 S ATOM 0 H CYS B 60 9.864 -21.522 1.687 1.00 0.00 H new ATOM 0 HA CYS B 60 9.625 -22.646 -1.119 1.00 0.00 H new ATOM 0 HB2 CYS B 60 8.133 -20.740 0.325 1.00 0.00 H new ATOM 0 HB3 CYS B 60 9.299 -19.747 -0.527 1.00 0.00 H new ATOM 0 HG CYS B 60 6.668 -21.359 -1.785 1.00 0.00 H new ATOM 1239 N GLY B 61 11.859 -20.645 0.197 1.00 0.00 N ATOM 1240 CA GLY B 61 13.232 -20.126 -0.054 1.00 0.00 C ATOM 1241 C GLY B 61 13.302 -18.630 0.262 1.00 0.00 C ATOM 1242 O GLY B 61 14.159 -17.925 -0.229 1.00 0.00 O ATOM 0 H GLY B 61 11.476 -20.438 1.119 1.00 0.00 H new ATOM 0 HA2 GLY B 61 13.951 -20.668 0.560 1.00 0.00 H new ATOM 0 HA3 GLY B 61 13.508 -20.298 -1.094 1.00 0.00 H new ATOM 1246 N PHE B 62 12.416 -18.140 1.082 1.00 0.00 N ATOM 1247 CA PHE B 62 12.449 -16.690 1.426 1.00 0.00 C ATOM 1248 C PHE B 62 13.523 -16.429 2.487 1.00 0.00 C ATOM 1249 O PHE B 62 14.228 -15.441 2.440 1.00 0.00 O ATOM 1250 CB PHE B 62 11.058 -16.379 1.978 1.00 0.00 C ATOM 1251 CG PHE B 62 10.080 -16.252 0.834 1.00 0.00 C ATOM 1252 CD1 PHE B 62 9.595 -17.401 0.199 1.00 0.00 C ATOM 1253 CD2 PHE B 62 9.659 -14.986 0.408 1.00 0.00 C ATOM 1254 CE1 PHE B 62 8.688 -17.285 -0.861 1.00 0.00 C ATOM 1255 CE2 PHE B 62 8.753 -14.870 -0.654 1.00 0.00 C ATOM 1256 CZ PHE B 62 8.267 -16.020 -1.288 1.00 0.00 C ATOM 0 H PHE B 62 11.673 -18.677 1.528 1.00 0.00 H new ATOM 0 HA PHE B 62 12.690 -16.064 0.567 1.00 0.00 H new ATOM 0 HB2 PHE B 62 10.739 -17.170 2.657 1.00 0.00 H new ATOM 0 HB3 PHE B 62 11.082 -15.454 2.554 1.00 0.00 H new ATOM 0 HD1 PHE B 62 9.920 -18.377 0.527 1.00 0.00 H new ATOM 0 HD2 PHE B 62 10.033 -14.099 0.898 1.00 0.00 H new ATOM 0 HE1 PHE B 62 8.313 -18.172 -1.350 1.00 0.00 H new ATOM 0 HE2 PHE B 62 8.429 -13.894 -0.984 1.00 0.00 H new ATOM 0 HZ PHE B 62 7.568 -15.931 -2.106 1.00 0.00 H new ATOM 1266 N THR B 63 13.653 -17.312 3.439 1.00 0.00 N ATOM 1267 CA THR B 63 14.685 -17.120 4.500 1.00 0.00 C ATOM 1268 C THR B 63 14.650 -15.678 5.018 1.00 0.00 C ATOM 1269 O THR B 63 13.647 -15.216 5.524 1.00 0.00 O ATOM 1270 CB THR B 63 16.021 -17.417 3.809 1.00 0.00 C ATOM 1271 OG1 THR B 63 16.447 -16.271 3.086 1.00 0.00 O ATOM 1272 CG2 THR B 63 15.851 -18.590 2.843 1.00 0.00 C ATOM 0 H THR B 63 13.090 -18.158 3.529 1.00 0.00 H new ATOM 0 HA THR B 63 14.521 -17.767 5.362 1.00 0.00 H new ATOM 0 HB THR B 63 16.766 -17.672 4.562 1.00 0.00 H new ATOM 0 HG1 THR B 63 15.709 -15.941 2.531 1.00 0.00 H new ATOM 0 HG21 THR B 63 16.802 -18.799 2.353 1.00 0.00 H new ATOM 0 HG22 THR B 63 15.526 -19.472 3.395 1.00 0.00 H new ATOM 0 HG23 THR B 63 15.104 -18.337 2.091 1.00 0.00 H new ATOM 1280 N SER B 64 15.734 -14.962 4.891 1.00 0.00 N ATOM 1281 CA SER B 64 15.759 -13.553 5.368 1.00 0.00 C ATOM 1282 C SER B 64 16.348 -12.661 4.280 1.00 0.00 C ATOM 1283 O SER B 64 16.862 -11.590 4.540 1.00 0.00 O ATOM 1284 CB SER B 64 16.648 -13.560 6.610 1.00 0.00 C ATOM 1285 OG SER B 64 17.893 -12.946 6.302 1.00 0.00 O ATOM 0 H SER B 64 16.605 -15.294 4.476 1.00 0.00 H new ATOM 0 HA SER B 64 14.765 -13.170 5.599 1.00 0.00 H new ATOM 0 HB2 SER B 64 16.158 -13.026 7.425 1.00 0.00 H new ATOM 0 HB3 SER B 64 16.809 -14.583 6.950 1.00 0.00 H new ATOM 0 HG SER B 64 17.739 -12.023 6.012 1.00 0.00 H new ATOM 1291 N GLN B 65 16.266 -13.101 3.061 1.00 0.00 N ATOM 1292 CA GLN B 65 16.806 -12.296 1.930 1.00 0.00 C ATOM 1293 C GLN B 65 15.647 -11.688 1.139 1.00 0.00 C ATOM 1294 O GLN B 65 15.819 -10.757 0.377 1.00 0.00 O ATOM 1295 CB GLN B 65 17.584 -13.290 1.069 1.00 0.00 C ATOM 1296 CG GLN B 65 18.083 -12.589 -0.197 1.00 0.00 C ATOM 1297 CD GLN B 65 18.653 -13.628 -1.165 1.00 0.00 C ATOM 1298 OE1 GLN B 65 18.017 -14.624 -1.450 1.00 0.00 O ATOM 1299 NE2 GLN B 65 19.834 -13.438 -1.686 1.00 0.00 N ATOM 0 H GLN B 65 15.845 -13.991 2.794 1.00 0.00 H new ATOM 0 HA GLN B 65 17.439 -11.474 2.263 1.00 0.00 H new ATOM 0 HB2 GLN B 65 18.427 -13.692 1.631 1.00 0.00 H new ATOM 0 HB3 GLN B 65 16.947 -14.133 0.803 1.00 0.00 H new ATOM 0 HG2 GLN B 65 17.266 -12.045 -0.671 1.00 0.00 H new ATOM 0 HG3 GLN B 65 18.848 -11.856 0.058 1.00 0.00 H new ATOM 0 HE21 GLN B 65 20.368 -12.603 -1.447 1.00 0.00 H new ATOM 0 HE22 GLN B 65 20.223 -14.125 -2.332 1.00 0.00 H new ATOM 1308 N THR B 66 14.466 -12.210 1.322 1.00 0.00 N ATOM 1309 CA THR B 66 13.285 -11.669 0.591 1.00 0.00 C ATOM 1310 C THR B 66 12.150 -11.378 1.577 1.00 0.00 C ATOM 1311 O THR B 66 10.987 -11.410 1.229 1.00 0.00 O ATOM 1312 CB THR B 66 12.880 -12.774 -0.386 1.00 0.00 C ATOM 1313 OG1 THR B 66 13.086 -14.041 0.222 1.00 0.00 O ATOM 1314 CG2 THR B 66 13.729 -12.670 -1.655 1.00 0.00 C ATOM 0 H THR B 66 14.267 -12.990 1.948 1.00 0.00 H new ATOM 0 HA THR B 66 13.508 -10.735 0.074 1.00 0.00 H new ATOM 0 HB THR B 66 11.827 -12.663 -0.645 1.00 0.00 H new ATOM 0 HG1 THR B 66 13.837 -14.495 -0.215 1.00 0.00 H new ATOM 0 HG21 THR B 66 13.441 -13.457 -2.351 1.00 0.00 H new ATOM 0 HG22 THR B 66 13.570 -11.697 -2.121 1.00 0.00 H new ATOM 0 HG23 THR B 66 14.782 -12.781 -1.398 1.00 0.00 H new ATOM 1322 N ALA B 67 12.485 -11.097 2.805 1.00 0.00 N ATOM 1323 CA ALA B 67 11.435 -10.806 3.823 1.00 0.00 C ATOM 1324 C ALA B 67 12.063 -10.106 5.031 1.00 0.00 C ATOM 1325 O ALA B 67 12.684 -10.731 5.867 1.00 0.00 O ATOM 1326 CB ALA B 67 10.880 -12.170 4.217 1.00 0.00 C ATOM 0 H ALA B 67 13.444 -11.056 3.150 1.00 0.00 H new ATOM 0 HA ALA B 67 10.654 -10.147 3.443 1.00 0.00 H new ATOM 0 HB1 ALA B 67 10.099 -12.042 4.966 1.00 0.00 H new ATOM 0 HB2 ALA B 67 10.463 -12.661 3.338 1.00 0.00 H new ATOM 0 HB3 ALA B 67 11.681 -12.783 4.629 1.00 0.00 H new ATOM 1332 N ARG B 68 11.913 -8.812 5.126 1.00 0.00 N ATOM 1333 CA ARG B 68 12.514 -8.079 6.279 1.00 0.00 C ATOM 1334 C ARG B 68 12.342 -6.567 6.087 1.00 0.00 C ATOM 1335 O ARG B 68 11.692 -6.135 5.157 1.00 0.00 O ATOM 1336 CB ARG B 68 13.994 -8.465 6.245 1.00 0.00 C ATOM 1337 CG ARG B 68 14.358 -9.211 7.530 1.00 0.00 C ATOM 1338 CD ARG B 68 15.880 -9.307 7.651 1.00 0.00 C ATOM 1339 NE ARG B 68 16.243 -8.329 8.713 1.00 0.00 N ATOM 1340 CZ ARG B 68 15.912 -8.561 9.955 1.00 0.00 C ATOM 1341 NH1 ARG B 68 15.264 -9.650 10.266 1.00 0.00 N ATOM 1342 NH2 ARG B 68 16.230 -7.702 10.885 1.00 0.00 N ATOM 0 H ARG B 68 11.403 -8.233 4.459 1.00 0.00 H new ATOM 0 HA ARG B 68 12.046 -8.330 7.231 1.00 0.00 H new ATOM 0 HB2 ARG B 68 14.197 -9.093 5.378 1.00 0.00 H new ATOM 0 HB3 ARG B 68 14.611 -7.572 6.143 1.00 0.00 H new ATOM 0 HG2 ARG B 68 13.946 -8.690 8.394 1.00 0.00 H new ATOM 0 HG3 ARG B 68 13.920 -10.209 7.520 1.00 0.00 H new ATOM 0 HD2 ARG B 68 16.192 -10.316 7.920 1.00 0.00 H new ATOM 0 HD3 ARG B 68 16.367 -9.064 6.707 1.00 0.00 H new ATOM 0 HE ARG B 68 16.750 -7.478 8.471 1.00 0.00 H new ATOM 0 HH11 ARG B 68 15.016 -10.321 9.539 1.00 0.00 H new ATOM 0 HH12 ARG B 68 15.006 -9.830 11.236 1.00 0.00 H new ATOM 0 HH21 ARG B 68 16.736 -6.851 10.641 1.00 0.00 H new ATOM 0 HH22 ARG B 68 15.972 -7.882 11.855 1.00 0.00 H new ATOM 1356 N PRO B 69 12.936 -5.808 6.975 1.00 0.00 N ATOM 1357 CA PRO B 69 12.842 -4.329 6.886 1.00 0.00 C ATOM 1358 C PRO B 69 13.636 -3.825 5.680 1.00 0.00 C ATOM 1359 O PRO B 69 13.424 -2.730 5.196 1.00 0.00 O ATOM 1360 CB PRO B 69 13.458 -3.850 8.200 1.00 0.00 C ATOM 1361 CG PRO B 69 14.358 -4.961 8.630 1.00 0.00 C ATOM 1362 CD PRO B 69 13.742 -6.240 8.124 1.00 0.00 C ATOM 0 HA PRO B 69 11.824 -3.964 6.750 1.00 0.00 H new ATOM 0 HB2 PRO B 69 14.014 -2.923 8.061 1.00 0.00 H new ATOM 0 HB3 PRO B 69 12.690 -3.652 8.947 1.00 0.00 H new ATOM 0 HG2 PRO B 69 15.360 -4.827 8.222 1.00 0.00 H new ATOM 0 HG3 PRO B 69 14.455 -4.982 9.715 1.00 0.00 H new ATOM 0 HD2 PRO B 69 14.504 -6.962 7.830 1.00 0.00 H new ATOM 0 HD3 PRO B 69 13.128 -6.718 8.887 1.00 0.00 H new ATOM 1370 N GLN B 70 14.539 -4.624 5.181 1.00 0.00 N ATOM 1371 CA GLN B 70 15.334 -4.204 3.992 1.00 0.00 C ATOM 1372 C GLN B 70 14.638 -4.703 2.725 1.00 0.00 C ATOM 1373 O GLN B 70 13.879 -3.988 2.100 1.00 0.00 O ATOM 1374 CB GLN B 70 16.697 -4.877 4.163 1.00 0.00 C ATOM 1375 CG GLN B 70 17.470 -4.185 5.287 1.00 0.00 C ATOM 1376 CD GLN B 70 18.140 -5.240 6.170 1.00 0.00 C ATOM 1377 OE1 GLN B 70 19.290 -5.100 6.537 1.00 0.00 O ATOM 1378 NE2 GLN B 70 17.464 -6.297 6.528 1.00 0.00 N ATOM 0 H GLN B 70 14.761 -5.550 5.546 1.00 0.00 H new ATOM 0 HA GLN B 70 15.435 -3.122 3.908 1.00 0.00 H new ATOM 0 HB2 GLN B 70 16.566 -5.934 4.394 1.00 0.00 H new ATOM 0 HB3 GLN B 70 17.261 -4.822 3.232 1.00 0.00 H new ATOM 0 HG2 GLN B 70 18.221 -3.516 4.868 1.00 0.00 H new ATOM 0 HG3 GLN B 70 16.794 -3.572 5.883 1.00 0.00 H new ATOM 0 HE21 GLN B 70 16.499 -6.414 6.220 1.00 0.00 H new ATOM 0 HE22 GLN B 70 17.901 -7.007 7.116 1.00 0.00 H new ATOM 1387 N ALA B 71 14.870 -5.932 2.356 1.00 0.00 N ATOM 1388 CA ALA B 71 14.195 -6.480 1.147 1.00 0.00 C ATOM 1389 C ALA B 71 13.156 -7.515 1.583 1.00 0.00 C ATOM 1390 O ALA B 71 13.497 -8.617 1.965 1.00 0.00 O ATOM 1391 CB ALA B 71 15.308 -7.142 0.334 1.00 0.00 C ATOM 0 H ALA B 71 15.495 -6.578 2.837 1.00 0.00 H new ATOM 0 HA ALA B 71 13.678 -5.717 0.565 1.00 0.00 H new ATOM 0 HB1 ALA B 71 14.888 -7.571 -0.576 1.00 0.00 H new ATOM 0 HB2 ALA B 71 16.059 -6.397 0.071 1.00 0.00 H new ATOM 0 HB3 ALA B 71 15.772 -7.931 0.927 1.00 0.00 H new ATOM 1397 N PRO B 72 11.918 -7.113 1.525 1.00 0.00 N ATOM 1398 CA PRO B 72 10.808 -7.998 1.932 1.00 0.00 C ATOM 1399 C PRO B 72 10.344 -8.873 0.767 1.00 0.00 C ATOM 1400 O PRO B 72 10.906 -8.852 -0.309 1.00 0.00 O ATOM 1401 CB PRO B 72 9.713 -7.015 2.330 1.00 0.00 C ATOM 1402 CG PRO B 72 10.003 -5.752 1.568 1.00 0.00 C ATOM 1403 CD PRO B 72 11.436 -5.804 1.089 1.00 0.00 C ATOM 0 HA PRO B 72 11.085 -8.688 2.729 1.00 0.00 H new ATOM 0 HB2 PRO B 72 8.727 -7.405 2.080 1.00 0.00 H new ATOM 0 HB3 PRO B 72 9.721 -6.834 3.405 1.00 0.00 H new ATOM 0 HG2 PRO B 72 9.323 -5.655 0.722 1.00 0.00 H new ATOM 0 HG3 PRO B 72 9.847 -4.881 2.204 1.00 0.00 H new ATOM 0 HD2 PRO B 72 11.497 -5.699 0.006 1.00 0.00 H new ATOM 0 HD3 PRO B 72 12.029 -4.998 1.521 1.00 0.00 H new ATOM 1411 N ALA B 73 9.307 -9.634 0.982 1.00 0.00 N ATOM 1412 CA ALA B 73 8.780 -10.509 -0.104 1.00 0.00 C ATOM 1413 C ALA B 73 7.446 -9.953 -0.604 1.00 0.00 C ATOM 1414 O ALA B 73 6.603 -9.549 0.173 1.00 0.00 O ATOM 1415 CB ALA B 73 8.583 -11.879 0.546 1.00 0.00 C ATOM 0 H ALA B 73 8.800 -9.688 1.865 1.00 0.00 H new ATOM 0 HA ALA B 73 9.451 -10.566 -0.961 1.00 0.00 H new ATOM 0 HB1 ALA B 73 8.196 -12.580 -0.193 1.00 0.00 H new ATOM 0 HB2 ALA B 73 9.538 -12.242 0.925 1.00 0.00 H new ATOM 0 HB3 ALA B 73 7.875 -11.792 1.370 1.00 0.00 H new ATOM 1421 N THR B 74 7.250 -9.912 -1.892 1.00 0.00 N ATOM 1422 CA THR B 74 5.975 -9.364 -2.429 1.00 0.00 C ATOM 1423 C THR B 74 5.098 -10.480 -2.994 1.00 0.00 C ATOM 1424 O THR B 74 5.563 -11.375 -3.671 1.00 0.00 O ATOM 1425 CB THR B 74 6.398 -8.405 -3.542 1.00 0.00 C ATOM 1426 OG1 THR B 74 6.663 -7.124 -2.987 1.00 0.00 O ATOM 1427 CG2 THR B 74 5.285 -8.291 -4.586 1.00 0.00 C ATOM 0 H THR B 74 7.916 -10.234 -2.594 1.00 0.00 H new ATOM 0 HA THR B 74 5.388 -8.869 -1.655 1.00 0.00 H new ATOM 0 HB THR B 74 7.298 -8.789 -4.022 1.00 0.00 H new ATOM 0 HG1 THR B 74 7.454 -6.738 -3.418 1.00 0.00 H new ATOM 0 HG21 THR B 74 5.595 -7.606 -5.375 1.00 0.00 H new ATOM 0 HG22 THR B 74 5.087 -9.273 -5.015 1.00 0.00 H new ATOM 0 HG23 THR B 74 4.379 -7.913 -4.112 1.00 0.00 H new ATOM 1435 N VAL B 75 3.826 -10.408 -2.739 1.00 0.00 N ATOM 1436 CA VAL B 75 2.892 -11.436 -3.275 1.00 0.00 C ATOM 1437 C VAL B 75 1.833 -10.733 -4.131 1.00 0.00 C ATOM 1438 O VAL B 75 1.366 -9.666 -3.795 1.00 0.00 O ATOM 1439 CB VAL B 75 2.261 -12.128 -2.050 1.00 0.00 C ATOM 1440 CG1 VAL B 75 2.932 -11.652 -0.756 1.00 0.00 C ATOM 1441 CG2 VAL B 75 0.763 -11.813 -1.988 1.00 0.00 C ATOM 0 H VAL B 75 3.388 -9.677 -2.179 1.00 0.00 H new ATOM 0 HA VAL B 75 3.390 -12.174 -3.903 1.00 0.00 H new ATOM 0 HB VAL B 75 2.407 -13.204 -2.150 1.00 0.00 H new ATOM 0 HG11 VAL B 75 2.473 -12.152 0.097 1.00 0.00 H new ATOM 0 HG12 VAL B 75 3.995 -11.892 -0.788 1.00 0.00 H new ATOM 0 HG13 VAL B 75 2.806 -10.574 -0.656 1.00 0.00 H new ATOM 0 HG21 VAL B 75 0.323 -12.305 -1.120 1.00 0.00 H new ATOM 0 HG22 VAL B 75 0.621 -10.735 -1.905 1.00 0.00 H new ATOM 0 HG23 VAL B 75 0.277 -12.174 -2.895 1.00 0.00 H new ATOM 1451 N GLY B 76 1.459 -11.308 -5.238 1.00 0.00 N ATOM 1452 CA GLY B 76 0.456 -10.666 -6.108 1.00 0.00 C ATOM 1453 C GLY B 76 -0.928 -11.189 -5.764 1.00 0.00 C ATOM 1454 O GLY B 76 -1.093 -12.270 -5.235 1.00 0.00 O ATOM 0 H GLY B 76 1.813 -12.204 -5.574 1.00 0.00 H new ATOM 0 HA2 GLY B 76 0.489 -9.584 -5.980 1.00 0.00 H new ATOM 0 HA3 GLY B 76 0.683 -10.871 -7.154 1.00 0.00 H new ATOM 1458 N LEU B 77 -1.916 -10.420 -6.073 1.00 0.00 N ATOM 1459 CA LEU B 77 -3.316 -10.823 -5.795 1.00 0.00 C ATOM 1460 C LEU B 77 -4.106 -10.861 -7.098 1.00 0.00 C ATOM 1461 O LEU B 77 -4.249 -9.870 -7.783 1.00 0.00 O ATOM 1462 CB LEU B 77 -3.876 -9.731 -4.883 1.00 0.00 C ATOM 1463 CG LEU B 77 -3.337 -9.913 -3.467 1.00 0.00 C ATOM 1464 CD1 LEU B 77 -3.908 -8.820 -2.562 1.00 0.00 C ATOM 1465 CD2 LEU B 77 -3.758 -11.286 -2.934 1.00 0.00 C ATOM 0 H LEU B 77 -1.816 -9.507 -6.517 1.00 0.00 H new ATOM 0 HA LEU B 77 -3.377 -11.810 -5.337 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -3.598 -8.748 -5.264 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.965 -9.774 -4.876 1.00 0.00 H new ATOM 0 HG LEU B 77 -2.249 -9.845 -3.480 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -3.524 -8.948 -1.550 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -3.612 -7.842 -2.941 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -4.996 -8.890 -2.549 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -3.374 -11.417 -1.923 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -4.846 -11.353 -2.920 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -3.355 -12.066 -3.579 1.00 0.00 H new ATOM 1477 N ALA B 78 -4.621 -11.997 -7.433 1.00 0.00 N ATOM 1478 CA ALA B 78 -5.417 -12.124 -8.688 1.00 0.00 C ATOM 1479 C ALA B 78 -6.654 -12.996 -8.449 1.00 0.00 C ATOM 1480 O ALA B 78 -6.652 -13.874 -7.610 1.00 0.00 O ATOM 1481 CB ALA B 78 -4.478 -12.789 -9.691 1.00 0.00 C ATOM 0 H ALA B 78 -4.529 -12.857 -6.892 1.00 0.00 H new ATOM 0 HA ALA B 78 -5.775 -11.159 -9.045 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -4.994 -12.917 -10.643 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -3.598 -12.162 -9.836 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -4.171 -13.763 -9.311 1.00 0.00 H new ATOM 1487 N PHE B 79 -7.709 -12.757 -9.180 1.00 0.00 N ATOM 1488 CA PHE B 79 -8.947 -13.572 -8.997 1.00 0.00 C ATOM 1489 C PHE B 79 -9.299 -14.299 -10.295 1.00 0.00 C ATOM 1490 O PHE B 79 -8.941 -13.871 -11.375 1.00 0.00 O ATOM 1491 CB PHE B 79 -10.040 -12.562 -8.639 1.00 0.00 C ATOM 1492 CG PHE B 79 -9.522 -11.597 -7.599 1.00 0.00 C ATOM 1493 CD1 PHE B 79 -8.610 -10.599 -7.963 1.00 0.00 C ATOM 1494 CD2 PHE B 79 -9.956 -11.699 -6.272 1.00 0.00 C ATOM 1495 CE1 PHE B 79 -8.132 -9.703 -7.000 1.00 0.00 C ATOM 1496 CE2 PHE B 79 -9.477 -10.803 -5.308 1.00 0.00 C ATOM 1497 CZ PHE B 79 -8.565 -9.805 -5.672 1.00 0.00 C ATOM 0 H PHE B 79 -7.768 -12.033 -9.896 1.00 0.00 H new ATOM 0 HA PHE B 79 -8.827 -14.334 -8.227 1.00 0.00 H new ATOM 0 HB2 PHE B 79 -10.352 -12.018 -9.531 1.00 0.00 H new ATOM 0 HB3 PHE B 79 -10.919 -13.083 -8.260 1.00 0.00 H new ATOM 0 HD1 PHE B 79 -8.275 -10.521 -8.987 1.00 0.00 H new ATOM 0 HD2 PHE B 79 -10.660 -12.468 -5.992 1.00 0.00 H new ATOM 0 HE1 PHE B 79 -7.429 -8.933 -7.281 1.00 0.00 H new ATOM 0 HE2 PHE B 79 -9.811 -10.882 -4.284 1.00 0.00 H new ATOM 0 HZ PHE B 79 -8.195 -9.114 -4.929 1.00 0.00 H new ATOM 1507 N ARG B 80 -10.002 -15.394 -10.201 1.00 0.00 N ATOM 1508 CA ARG B 80 -10.382 -16.146 -11.430 1.00 0.00 C ATOM 1509 C ARG B 80 -11.898 -16.355 -11.471 1.00 0.00 C ATOM 1510 O ARG B 80 -12.447 -17.139 -10.723 1.00 0.00 O ATOM 1511 CB ARG B 80 -9.658 -17.488 -11.314 1.00 0.00 C ATOM 1512 CG ARG B 80 -8.544 -17.559 -12.360 1.00 0.00 C ATOM 1513 CD ARG B 80 -8.150 -19.020 -12.585 1.00 0.00 C ATOM 1514 NE ARG B 80 -7.133 -18.981 -13.672 1.00 0.00 N ATOM 1515 CZ ARG B 80 -6.489 -20.068 -14.004 1.00 0.00 C ATOM 1516 NH1 ARG B 80 -6.736 -21.189 -13.385 1.00 0.00 N ATOM 1517 NH2 ARG B 80 -5.599 -20.032 -14.958 1.00 0.00 N ATOM 0 H ARG B 80 -10.330 -15.801 -9.325 1.00 0.00 H new ATOM 0 HA ARG B 80 -10.109 -15.615 -12.342 1.00 0.00 H new ATOM 0 HB2 ARG B 80 -9.240 -17.603 -10.314 1.00 0.00 H new ATOM 0 HB3 ARG B 80 -10.362 -18.307 -11.461 1.00 0.00 H new ATOM 0 HG2 ARG B 80 -8.880 -17.113 -13.296 1.00 0.00 H new ATOM 0 HG3 ARG B 80 -7.680 -16.985 -12.026 1.00 0.00 H new ATOM 0 HD2 ARG B 80 -7.741 -19.463 -11.677 1.00 0.00 H new ATOM 0 HD3 ARG B 80 -9.012 -19.622 -12.872 1.00 0.00 H new ATOM 0 HE ARG B 80 -6.939 -18.105 -14.158 1.00 0.00 H new ATOM 0 HH11 ARG B 80 -7.433 -21.218 -12.641 1.00 0.00 H new ATOM 0 HH12 ARG B 80 -6.232 -22.037 -13.645 1.00 0.00 H new ATOM 0 HH21 ARG B 80 -5.407 -19.156 -15.443 1.00 0.00 H new ATOM 0 HH22 ARG B 80 -5.096 -20.880 -15.218 1.00 0.00 H new ATOM 1599 N GLU B 86 -7.771 -12.086 -13.676 1.00 0.00 N ATOM 1600 CA GLU B 86 -7.671 -10.612 -13.478 1.00 0.00 C ATOM 1601 C GLU B 86 -6.704 -10.293 -12.333 1.00 0.00 C ATOM 1602 O GLU B 86 -6.368 -11.146 -11.537 1.00 0.00 O ATOM 1603 CB GLU B 86 -9.089 -10.164 -13.122 1.00 0.00 C ATOM 1604 CG GLU B 86 -9.502 -10.787 -11.786 1.00 0.00 C ATOM 1605 CD GLU B 86 -10.411 -9.817 -11.029 1.00 0.00 C ATOM 1606 OE1 GLU B 86 -11.339 -9.310 -11.638 1.00 0.00 O ATOM 1607 OE2 GLU B 86 -10.163 -9.597 -9.856 1.00 0.00 O ATOM 0 HA GLU B 86 -7.291 -10.102 -14.363 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -9.133 -9.077 -13.057 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -9.784 -10.465 -13.906 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -10.021 -11.730 -11.958 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -8.618 -11.014 -11.190 1.00 0.00 H new ATOM 1614 N ALA B 87 -6.257 -9.071 -12.246 1.00 0.00 N ATOM 1615 CA ALA B 87 -5.314 -8.696 -11.153 1.00 0.00 C ATOM 1616 C ALA B 87 -4.083 -9.609 -11.180 1.00 0.00 C ATOM 1617 O ALA B 87 -3.857 -10.394 -10.282 1.00 0.00 O ATOM 1618 CB ALA B 87 -6.110 -8.892 -9.862 1.00 0.00 C ATOM 0 H ALA B 87 -6.504 -8.315 -12.884 1.00 0.00 H new ATOM 0 HA ALA B 87 -4.948 -7.674 -11.251 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -5.485 -8.636 -9.007 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -6.989 -8.247 -9.875 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -6.425 -9.933 -9.783 1.00 0.00 H new ATOM 1624 N LEU B 88 -3.279 -9.495 -12.202 1.00 0.00 N ATOM 1625 CA LEU B 88 -2.054 -10.334 -12.303 1.00 0.00 C ATOM 1626 C LEU B 88 -0.844 -9.430 -12.517 1.00 0.00 C ATOM 1627 O LEU B 88 0.289 -9.846 -12.385 1.00 0.00 O ATOM 1628 CB LEU B 88 -2.271 -11.230 -13.522 1.00 0.00 C ATOM 1629 CG LEU B 88 -2.002 -12.682 -13.133 1.00 0.00 C ATOM 1630 CD1 LEU B 88 -0.661 -12.776 -12.401 1.00 0.00 C ATOM 1631 CD2 LEU B 88 -3.119 -13.165 -12.211 1.00 0.00 C ATOM 0 H LEU B 88 -3.421 -8.849 -12.979 1.00 0.00 H new ATOM 0 HA LEU B 88 -1.876 -10.923 -11.404 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -3.291 -11.123 -13.890 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -1.607 -10.929 -14.332 1.00 0.00 H new ATOM 0 HG LEU B 88 -1.968 -13.302 -14.029 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -0.470 -13.813 -12.124 1.00 0.00 H new ATOM 0 HD12 LEU B 88 0.136 -12.422 -13.055 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -0.693 -12.160 -11.502 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -2.935 -14.201 -11.928 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -3.146 -12.544 -11.316 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -4.075 -13.095 -12.730 1.00 0.00 H new ATOM 1643 N CYS B 89 -1.082 -8.184 -12.822 1.00 0.00 N ATOM 1644 CA CYS B 89 0.030 -7.242 -13.013 1.00 0.00 C ATOM 1645 C CYS B 89 -0.153 -6.136 -11.999 1.00 0.00 C ATOM 1646 O CYS B 89 -1.066 -5.342 -12.087 1.00 0.00 O ATOM 1647 CB CYS B 89 -0.120 -6.711 -14.439 1.00 0.00 C ATOM 1648 SG CYS B 89 -0.428 -8.091 -15.570 1.00 0.00 S ATOM 0 H CYS B 89 -2.012 -7.785 -12.946 1.00 0.00 H new ATOM 0 HA CYS B 89 1.017 -7.685 -12.880 1.00 0.00 H new ATOM 0 HB2 CYS B 89 -0.942 -5.997 -14.488 1.00 0.00 H new ATOM 0 HB3 CYS B 89 0.783 -6.178 -14.737 1.00 0.00 H new ATOM 0 HG CYS B 89 -0.558 -7.638 -16.782 1.00 0.00 H new ATOM 1654 N ILE B 90 0.683 -6.088 -11.023 1.00 0.00 N ATOM 1655 CA ILE B 90 0.520 -5.043 -9.990 1.00 0.00 C ATOM 1656 C ILE B 90 1.295 -3.805 -10.392 1.00 0.00 C ATOM 1657 O ILE B 90 2.509 -3.781 -10.388 1.00 0.00 O ATOM 1658 CB ILE B 90 1.102 -5.637 -8.713 1.00 0.00 C ATOM 1659 CG1 ILE B 90 0.406 -6.962 -8.404 1.00 0.00 C ATOM 1660 CG2 ILE B 90 0.888 -4.659 -7.556 1.00 0.00 C ATOM 1661 CD1 ILE B 90 1.451 -8.075 -8.341 1.00 0.00 C ATOM 0 H ILE B 90 1.471 -6.721 -10.890 1.00 0.00 H new ATOM 0 HA ILE B 90 -0.522 -4.753 -9.859 1.00 0.00 H new ATOM 0 HB ILE B 90 2.169 -5.814 -8.845 1.00 0.00 H new ATOM 0 HG12 ILE B 90 -0.128 -6.894 -7.456 1.00 0.00 H new ATOM 0 HG13 ILE B 90 -0.335 -7.185 -9.172 1.00 0.00 H new ATOM 0 HG21 ILE B 90 1.303 -5.081 -6.641 1.00 0.00 H new ATOM 0 HG22 ILE B 90 1.387 -3.716 -7.780 1.00 0.00 H new ATOM 0 HG23 ILE B 90 -0.179 -4.482 -7.422 1.00 0.00 H new ATOM 0 HD11 ILE B 90 0.960 -9.023 -8.121 1.00 0.00 H new ATOM 0 HD12 ILE B 90 1.965 -8.146 -9.300 1.00 0.00 H new ATOM 0 HD13 ILE B 90 2.175 -7.851 -7.557 1.00 0.00 H new ATOM 1673 N GLU B 91 0.590 -2.775 -10.745 1.00 0.00 N ATOM 1674 CA GLU B 91 1.273 -1.518 -11.161 1.00 0.00 C ATOM 1675 C GLU B 91 1.836 -0.813 -9.925 1.00 0.00 C ATOM 1676 O GLU B 91 1.099 -0.303 -9.106 1.00 0.00 O ATOM 1677 CB GLU B 91 0.183 -0.670 -11.816 1.00 0.00 C ATOM 1678 CG GLU B 91 -0.030 -1.134 -13.258 1.00 0.00 C ATOM 1679 CD GLU B 91 -0.088 0.081 -14.184 1.00 0.00 C ATOM 1680 OE1 GLU B 91 -0.797 1.018 -13.854 1.00 0.00 O ATOM 1681 OE2 GLU B 91 0.577 0.056 -15.205 1.00 0.00 O ATOM 0 H GLU B 91 -0.429 -2.744 -10.765 1.00 0.00 H new ATOM 0 HA GLU B 91 2.105 -1.696 -11.843 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -0.747 -0.757 -11.254 1.00 0.00 H new ATOM 0 HB3 GLU B 91 0.468 0.382 -11.800 1.00 0.00 H new ATOM 0 HG2 GLU B 91 0.781 -1.797 -13.561 1.00 0.00 H new ATOM 0 HG3 GLU B 91 -0.955 -1.706 -13.334 1.00 0.00 H new ATOM 1688 N PRO B 92 3.140 -0.833 -9.828 1.00 0.00 N ATOM 1689 CA PRO B 92 3.832 -0.214 -8.671 1.00 0.00 C ATOM 1690 C PRO B 92 3.795 1.312 -8.766 1.00 0.00 C ATOM 1691 O PRO B 92 2.980 1.886 -9.461 1.00 0.00 O ATOM 1692 CB PRO B 92 5.264 -0.725 -8.795 1.00 0.00 C ATOM 1693 CG PRO B 92 5.439 -1.045 -10.245 1.00 0.00 C ATOM 1694 CD PRO B 92 4.084 -1.428 -10.781 1.00 0.00 C ATOM 0 HA PRO B 92 3.369 -0.468 -7.717 1.00 0.00 H new ATOM 0 HB2 PRO B 92 5.981 0.028 -8.468 1.00 0.00 H new ATOM 0 HB3 PRO B 92 5.423 -1.607 -8.175 1.00 0.00 H new ATOM 0 HG2 PRO B 92 5.837 -0.185 -10.784 1.00 0.00 H new ATOM 0 HG3 PRO B 92 6.150 -1.861 -10.376 1.00 0.00 H new ATOM 0 HD2 PRO B 92 3.930 -1.041 -11.788 1.00 0.00 H new ATOM 0 HD3 PRO B 92 3.968 -2.510 -10.834 1.00 0.00 H new ATOM 1702 N PHE B 93 4.675 1.971 -8.065 1.00 0.00 N ATOM 1703 CA PHE B 93 4.699 3.462 -8.103 1.00 0.00 C ATOM 1704 C PHE B 93 6.132 3.961 -8.315 1.00 0.00 C ATOM 1705 O PHE B 93 6.483 4.432 -9.379 1.00 0.00 O ATOM 1706 CB PHE B 93 4.168 3.910 -6.737 1.00 0.00 C ATOM 1707 CG PHE B 93 3.231 2.861 -6.184 1.00 0.00 C ATOM 1708 CD1 PHE B 93 3.741 1.787 -5.445 1.00 0.00 C ATOM 1709 CD2 PHE B 93 1.853 2.962 -6.412 1.00 0.00 C ATOM 1710 CE1 PHE B 93 2.875 0.814 -4.934 1.00 0.00 C ATOM 1711 CE2 PHE B 93 0.987 1.988 -5.901 1.00 0.00 C ATOM 1712 CZ PHE B 93 1.497 0.914 -5.161 1.00 0.00 C ATOM 0 H PHE B 93 5.380 1.542 -7.466 1.00 0.00 H new ATOM 0 HA PHE B 93 4.098 3.862 -8.920 1.00 0.00 H new ATOM 0 HB2 PHE B 93 4.998 4.069 -6.048 1.00 0.00 H new ATOM 0 HB3 PHE B 93 3.647 4.862 -6.834 1.00 0.00 H new ATOM 0 HD1 PHE B 93 4.804 1.709 -5.269 1.00 0.00 H new ATOM 0 HD2 PHE B 93 1.459 3.791 -6.982 1.00 0.00 H new ATOM 0 HE1 PHE B 93 3.270 -0.014 -4.364 1.00 0.00 H new ATOM 0 HE2 PHE B 93 -0.076 2.065 -6.078 1.00 0.00 H new ATOM 0 HZ PHE B 93 0.828 0.164 -4.766 1.00 0.00 H new ATOM 2071 N MET C 17 -5.653 -4.822 14.053 1.00 0.00 N ATOM 2072 CA MET C 17 -6.352 -3.759 13.272 1.00 0.00 C ATOM 2073 C MET C 17 -5.528 -3.381 12.037 1.00 0.00 C ATOM 2074 O MET C 17 -4.341 -3.628 11.970 1.00 0.00 O ATOM 2075 CB MET C 17 -6.461 -2.572 14.228 1.00 0.00 C ATOM 2076 CG MET C 17 -7.809 -2.619 14.950 1.00 0.00 C ATOM 2077 SD MET C 17 -8.157 -1.001 15.685 1.00 0.00 S ATOM 2078 CE MET C 17 -9.267 -1.581 16.991 1.00 0.00 C ATOM 0 HA MET C 17 -7.329 -4.084 12.914 1.00 0.00 H new ATOM 0 HB2 MET C 17 -5.647 -2.600 14.953 1.00 0.00 H new ATOM 0 HB3 MET C 17 -6.365 -1.637 13.676 1.00 0.00 H new ATOM 0 HG2 MET C 17 -8.599 -2.890 14.250 1.00 0.00 H new ATOM 0 HG3 MET C 17 -7.792 -3.386 15.724 1.00 0.00 H new ATOM 0 HE1 MET C 17 -9.610 -0.731 17.581 1.00 0.00 H new ATOM 0 HE2 MET C 17 -10.125 -2.082 16.543 1.00 0.00 H new ATOM 0 HE3 MET C 17 -8.735 -2.280 17.637 1.00 0.00 H new ATOM 2088 N TYR C 18 -6.151 -2.782 11.059 1.00 0.00 N ATOM 2089 CA TYR C 18 -5.407 -2.388 9.829 1.00 0.00 C ATOM 2090 C TYR C 18 -5.786 -0.962 9.417 1.00 0.00 C ATOM 2091 O TYR C 18 -6.896 -0.520 9.633 1.00 0.00 O ATOM 2092 CB TYR C 18 -5.856 -3.388 8.761 1.00 0.00 C ATOM 2093 CG TYR C 18 -4.653 -4.107 8.195 1.00 0.00 C ATOM 2094 CD1 TYR C 18 -3.423 -3.447 8.098 1.00 0.00 C ATOM 2095 CD2 TYR C 18 -4.770 -5.435 7.768 1.00 0.00 C ATOM 2096 CE1 TYR C 18 -2.309 -4.115 7.573 1.00 0.00 C ATOM 2097 CE2 TYR C 18 -3.658 -6.103 7.243 1.00 0.00 C ATOM 2098 CZ TYR C 18 -2.427 -5.443 7.146 1.00 0.00 C ATOM 2099 OH TYR C 18 -1.330 -6.101 6.629 1.00 0.00 O ATOM 0 H TYR C 18 -7.144 -2.548 11.059 1.00 0.00 H new ATOM 0 HA TYR C 18 -4.327 -2.402 9.976 1.00 0.00 H new ATOM 0 HB2 TYR C 18 -6.551 -4.108 9.193 1.00 0.00 H new ATOM 0 HB3 TYR C 18 -6.389 -2.869 7.964 1.00 0.00 H new ATOM 0 HD1 TYR C 18 -3.332 -2.423 8.428 1.00 0.00 H new ATOM 0 HD2 TYR C 18 -5.719 -5.944 7.844 1.00 0.00 H new ATOM 0 HE1 TYR C 18 -1.360 -3.606 7.498 1.00 0.00 H new ATOM 0 HE2 TYR C 18 -3.749 -7.127 6.913 1.00 0.00 H new ATOM 0 HH TYR C 18 -0.532 -5.543 6.739 1.00 0.00 H new ATOM 2109 N VAL C 19 -4.874 -0.240 8.822 1.00 0.00 N ATOM 2110 CA VAL C 19 -5.195 1.154 8.395 1.00 0.00 C ATOM 2111 C VAL C 19 -4.712 1.392 6.961 1.00 0.00 C ATOM 2112 O VAL C 19 -3.671 0.911 6.556 1.00 0.00 O ATOM 2113 CB VAL C 19 -4.451 2.063 9.381 1.00 0.00 C ATOM 2114 CG1 VAL C 19 -2.951 2.062 9.071 1.00 0.00 C ATOM 2115 CG2 VAL C 19 -4.992 3.489 9.260 1.00 0.00 C ATOM 0 H VAL C 19 -3.926 -0.553 8.614 1.00 0.00 H new ATOM 0 HA VAL C 19 -6.267 1.350 8.403 1.00 0.00 H new ATOM 0 HB VAL C 19 -4.605 1.692 10.394 1.00 0.00 H new ATOM 0 HG11 VAL C 19 -2.433 2.711 9.777 1.00 0.00 H new ATOM 0 HG12 VAL C 19 -2.562 1.047 9.158 1.00 0.00 H new ATOM 0 HG13 VAL C 19 -2.789 2.427 8.057 1.00 0.00 H new ATOM 0 HG21 VAL C 19 -4.466 4.138 9.959 1.00 0.00 H new ATOM 0 HG22 VAL C 19 -4.839 3.851 8.243 1.00 0.00 H new ATOM 0 HG23 VAL C 19 -6.057 3.495 9.491 1.00 0.00 H new ATOM 2125 N LYS C 20 -5.466 2.124 6.186 1.00 0.00 N ATOM 2126 CA LYS C 20 -5.066 2.389 4.781 1.00 0.00 C ATOM 2127 C LYS C 20 -4.523 3.813 4.642 1.00 0.00 C ATOM 2128 O LYS C 20 -5.062 4.749 5.197 1.00 0.00 O ATOM 2129 CB LYS C 20 -6.351 2.223 3.969 1.00 0.00 C ATOM 2130 CG LYS C 20 -7.562 2.689 4.781 1.00 0.00 C ATOM 2131 CD LYS C 20 -8.791 2.756 3.874 1.00 0.00 C ATOM 2132 CE LYS C 20 -9.776 1.653 4.268 1.00 0.00 C ATOM 2133 NZ LYS C 20 -11.069 2.052 3.649 1.00 0.00 N ATOM 0 H LYS C 20 -6.347 2.551 6.471 1.00 0.00 H new ATOM 0 HA LYS C 20 -4.278 1.717 4.442 1.00 0.00 H new ATOM 0 HB2 LYS C 20 -6.282 2.798 3.046 1.00 0.00 H new ATOM 0 HB3 LYS C 20 -6.476 1.178 3.685 1.00 0.00 H new ATOM 0 HG2 LYS C 20 -7.744 2.003 5.608 1.00 0.00 H new ATOM 0 HG3 LYS C 20 -7.365 3.668 5.217 1.00 0.00 H new ATOM 0 HD2 LYS C 20 -9.268 3.732 3.961 1.00 0.00 H new ATOM 0 HD3 LYS C 20 -8.494 2.638 2.832 1.00 0.00 H new ATOM 0 HE2 LYS C 20 -9.447 0.681 3.902 1.00 0.00 H new ATOM 0 HE3 LYS C 20 -9.865 1.572 5.351 1.00 0.00 H new ATOM 0 HZ1 LYS C 20 -11.796 1.343 3.875 1.00 0.00 H new ATOM 0 HZ2 LYS C 20 -11.361 2.978 4.021 1.00 0.00 H new ATOM 0 HZ3 LYS C 20 -10.955 2.114 2.617 1.00 0.00 H new ATOM 2147 N LEU C 21 -3.461 3.990 3.901 1.00 0.00 N ATOM 2148 CA LEU C 21 -2.895 5.357 3.727 1.00 0.00 C ATOM 2149 C LEU C 21 -3.012 5.777 2.262 1.00 0.00 C ATOM 2150 O LEU C 21 -2.729 5.012 1.361 1.00 0.00 O ATOM 2151 CB LEU C 21 -1.418 5.264 4.138 1.00 0.00 C ATOM 2152 CG LEU C 21 -1.195 4.070 5.073 1.00 0.00 C ATOM 2153 CD1 LEU C 21 0.296 3.956 5.398 1.00 0.00 C ATOM 2154 CD2 LEU C 21 -1.980 4.273 6.369 1.00 0.00 C ATOM 0 H LEU C 21 -2.963 3.248 3.410 1.00 0.00 H new ATOM 0 HA LEU C 21 -3.425 6.095 4.329 1.00 0.00 H new ATOM 0 HB2 LEU C 21 -0.793 5.160 3.251 1.00 0.00 H new ATOM 0 HB3 LEU C 21 -1.114 6.185 4.636 1.00 0.00 H new ATOM 0 HG LEU C 21 -1.538 3.159 4.583 1.00 0.00 H new ATOM 0 HD11 LEU C 21 0.460 3.108 6.063 1.00 0.00 H new ATOM 0 HD12 LEU C 21 0.859 3.808 4.476 1.00 0.00 H new ATOM 0 HD13 LEU C 21 0.633 4.870 5.886 1.00 0.00 H new ATOM 0 HD21 LEU C 21 -1.818 3.421 7.030 1.00 0.00 H new ATOM 0 HD22 LEU C 21 -1.640 5.184 6.861 1.00 0.00 H new ATOM 0 HD23 LEU C 21 -3.043 4.358 6.141 1.00 0.00 H new ATOM 2166 N ILE C 22 -3.428 6.986 2.015 1.00 0.00 N ATOM 2167 CA ILE C 22 -3.567 7.452 0.610 1.00 0.00 C ATOM 2168 C ILE C 22 -2.496 8.497 0.297 1.00 0.00 C ATOM 2169 O ILE C 22 -2.156 9.322 1.120 1.00 0.00 O ATOM 2170 CB ILE C 22 -4.964 8.069 0.536 1.00 0.00 C ATOM 2171 CG1 ILE C 22 -5.976 6.985 0.165 1.00 0.00 C ATOM 2172 CG2 ILE C 22 -4.988 9.170 -0.526 1.00 0.00 C ATOM 2173 CD1 ILE C 22 -5.658 6.455 -1.232 1.00 0.00 C ATOM 0 H ILE C 22 -3.678 7.672 2.727 1.00 0.00 H new ATOM 0 HA ILE C 22 -3.442 6.645 -0.112 1.00 0.00 H new ATOM 0 HB ILE C 22 -5.221 8.497 1.505 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -5.940 6.173 0.892 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -6.987 7.391 0.191 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -5.986 9.607 -0.575 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -4.266 9.943 -0.265 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -4.730 8.745 -1.496 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -6.378 5.682 -1.500 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -5.716 7.271 -1.953 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -4.653 6.034 -1.241 1.00 0.00 H new ATOM 2185 N SER C 23 -1.968 8.464 -0.891 1.00 0.00 N ATOM 2186 CA SER C 23 -0.919 9.451 -1.274 1.00 0.00 C ATOM 2187 C SER C 23 -1.486 10.459 -2.278 1.00 0.00 C ATOM 2188 O SER C 23 -2.406 10.165 -3.015 1.00 0.00 O ATOM 2189 CB SER C 23 0.192 8.621 -1.917 1.00 0.00 C ATOM 2190 OG SER C 23 1.421 8.891 -1.256 1.00 0.00 O ATOM 0 H SER C 23 -2.217 7.794 -1.618 1.00 0.00 H new ATOM 0 HA SER C 23 -0.557 10.022 -0.419 1.00 0.00 H new ATOM 0 HB2 SER C 23 -0.045 7.559 -1.849 1.00 0.00 H new ATOM 0 HB3 SER C 23 0.275 8.862 -2.977 1.00 0.00 H new ATOM 0 HG SER C 23 1.519 9.858 -1.130 1.00 0.00 H new ATOM 2196 N SER C 24 -0.944 11.646 -2.313 1.00 0.00 N ATOM 2197 CA SER C 24 -1.453 12.671 -3.268 1.00 0.00 C ATOM 2198 C SER C 24 -1.379 12.143 -4.704 1.00 0.00 C ATOM 2199 O SER C 24 -1.986 12.686 -5.606 1.00 0.00 O ATOM 2200 CB SER C 24 -0.525 13.871 -3.090 1.00 0.00 C ATOM 2201 OG SER C 24 -1.288 15.068 -3.165 1.00 0.00 O ATOM 0 H SER C 24 -0.171 11.950 -1.721 1.00 0.00 H new ATOM 0 HA SER C 24 -2.495 12.929 -3.080 1.00 0.00 H new ATOM 0 HB2 SER C 24 -0.014 13.811 -2.129 1.00 0.00 H new ATOM 0 HB3 SER C 24 0.245 13.868 -3.861 1.00 0.00 H new ATOM 0 HG SER C 24 -0.696 15.841 -3.050 1.00 0.00 H new ATOM 2207 N ASP C 25 -0.641 11.089 -4.923 1.00 0.00 N ATOM 2208 CA ASP C 25 -0.532 10.530 -6.301 1.00 0.00 C ATOM 2209 C ASP C 25 -1.825 9.805 -6.681 1.00 0.00 C ATOM 2210 O ASP C 25 -2.231 9.798 -7.826 1.00 0.00 O ATOM 2211 CB ASP C 25 0.636 9.547 -6.239 1.00 0.00 C ATOM 2212 CG ASP C 25 1.819 10.108 -7.029 1.00 0.00 C ATOM 2213 OD1 ASP C 25 1.831 11.305 -7.271 1.00 0.00 O ATOM 2214 OD2 ASP C 25 2.694 9.334 -7.380 1.00 0.00 O ATOM 0 H ASP C 25 -0.110 10.591 -4.209 1.00 0.00 H new ATOM 0 HA ASP C 25 -0.372 11.306 -7.050 1.00 0.00 H new ATOM 0 HB2 ASP C 25 0.926 9.376 -5.202 1.00 0.00 H new ATOM 0 HB3 ASP C 25 0.336 8.583 -6.649 1.00 0.00 H new ATOM 2219 N GLY C 26 -2.476 9.194 -5.729 1.00 0.00 N ATOM 2220 CA GLY C 26 -3.742 8.471 -6.037 1.00 0.00 C ATOM 2221 C GLY C 26 -3.613 7.010 -5.602 1.00 0.00 C ATOM 2222 O GLY C 26 -4.590 6.294 -5.501 1.00 0.00 O ATOM 0 H GLY C 26 -2.186 9.164 -4.752 1.00 0.00 H new ATOM 0 HA2 GLY C 26 -4.578 8.943 -5.521 1.00 0.00 H new ATOM 0 HA3 GLY C 26 -3.955 8.526 -7.105 1.00 0.00 H new ATOM 2226 N HIS C 27 -2.415 6.562 -5.343 1.00 0.00 N ATOM 2227 CA HIS C 27 -2.226 5.146 -4.913 1.00 0.00 C ATOM 2228 C HIS C 27 -2.618 4.987 -3.441 1.00 0.00 C ATOM 2229 O HIS C 27 -2.930 5.950 -2.767 1.00 0.00 O ATOM 2230 CB HIS C 27 -0.734 4.867 -5.104 1.00 0.00 C ATOM 2231 CG HIS C 27 -0.262 5.500 -6.385 1.00 0.00 C ATOM 2232 ND1 HIS C 27 1.053 5.893 -6.575 1.00 0.00 N ATOM 2233 CD2 HIS C 27 -0.919 5.815 -7.548 1.00 0.00 C ATOM 2234 CE1 HIS C 27 1.145 6.418 -7.811 1.00 0.00 C ATOM 2235 NE2 HIS C 27 -0.029 6.394 -8.447 1.00 0.00 N ATOM 0 H HIS C 27 -1.560 7.114 -5.410 1.00 0.00 H new ATOM 0 HA HIS C 27 -2.844 4.454 -5.485 1.00 0.00 H new ATOM 0 HB2 HIS C 27 -0.169 5.264 -4.261 1.00 0.00 H new ATOM 0 HB3 HIS C 27 -0.555 3.792 -5.130 1.00 0.00 H new ATOM 0 HD2 HIS C 27 -1.968 5.640 -7.737 1.00 0.00 H new ATOM 0 HE1 HIS C 27 2.057 6.811 -8.236 1.00 0.00 H new ATOM 0 HE2 HIS C 27 -0.230 6.728 -9.389 1.00 0.00 H new ATOM 2243 N GLU C 28 -2.609 3.784 -2.936 1.00 0.00 N ATOM 2244 CA GLU C 28 -2.984 3.577 -1.508 1.00 0.00 C ATOM 2245 C GLU C 28 -2.115 2.496 -0.872 1.00 0.00 C ATOM 2246 O GLU C 28 -1.582 1.627 -1.534 1.00 0.00 O ATOM 2247 CB GLU C 28 -4.445 3.131 -1.533 1.00 0.00 C ATOM 2248 CG GLU C 28 -4.813 2.511 -0.185 1.00 0.00 C ATOM 2249 CD GLU C 28 -6.326 2.602 0.024 1.00 0.00 C ATOM 2250 OE1 GLU C 28 -6.781 3.643 0.469 1.00 0.00 O ATOM 2251 OE2 GLU C 28 -7.004 1.630 -0.264 1.00 0.00 O ATOM 0 H GLU C 28 -2.359 2.938 -3.448 1.00 0.00 H new ATOM 0 HA GLU C 28 -2.842 4.484 -0.921 1.00 0.00 H new ATOM 0 HB2 GLU C 28 -5.093 3.982 -1.742 1.00 0.00 H new ATOM 0 HB3 GLU C 28 -4.602 2.407 -2.333 1.00 0.00 H new ATOM 0 HG2 GLU C 28 -4.493 1.470 -0.152 1.00 0.00 H new ATOM 0 HG3 GLU C 28 -4.292 3.030 0.620 1.00 0.00 H new ATOM 2258 N PHE C 29 -1.983 2.552 0.418 1.00 0.00 N ATOM 2259 CA PHE C 29 -1.163 1.542 1.145 1.00 0.00 C ATOM 2260 C PHE C 29 -1.822 1.229 2.487 1.00 0.00 C ATOM 2261 O PHE C 29 -2.297 2.111 3.168 1.00 0.00 O ATOM 2262 CB PHE C 29 0.197 2.207 1.353 1.00 0.00 C ATOM 2263 CG PHE C 29 1.120 1.830 0.220 1.00 0.00 C ATOM 2264 CD1 PHE C 29 0.980 2.442 -1.032 1.00 0.00 C ATOM 2265 CD2 PHE C 29 2.117 0.867 0.421 1.00 0.00 C ATOM 2266 CE1 PHE C 29 1.836 2.092 -2.082 1.00 0.00 C ATOM 2267 CE2 PHE C 29 2.973 0.516 -0.631 1.00 0.00 C ATOM 2268 CZ PHE C 29 2.832 1.129 -1.881 1.00 0.00 C ATOM 0 H PHE C 29 -2.412 3.262 1.011 1.00 0.00 H new ATOM 0 HA PHE C 29 -1.068 0.603 0.600 1.00 0.00 H new ATOM 0 HB2 PHE C 29 0.081 3.290 1.397 1.00 0.00 H new ATOM 0 HB3 PHE C 29 0.625 1.893 2.305 1.00 0.00 H new ATOM 0 HD1 PHE C 29 0.211 3.184 -1.187 1.00 0.00 H new ATOM 0 HD2 PHE C 29 2.226 0.395 1.386 1.00 0.00 H new ATOM 0 HE1 PHE C 29 1.728 2.565 -3.047 1.00 0.00 H new ATOM 0 HE2 PHE C 29 3.741 -0.227 -0.477 1.00 0.00 H new ATOM 0 HZ PHE C 29 3.492 0.859 -2.692 1.00 0.00 H new ATOM 2278 N ILE C 30 -1.872 -0.012 2.873 1.00 0.00 N ATOM 2279 CA ILE C 30 -2.520 -0.346 4.172 1.00 0.00 C ATOM 2280 C ILE C 30 -1.496 -0.915 5.156 1.00 0.00 C ATOM 2281 O ILE C 30 -0.795 -1.862 4.859 1.00 0.00 O ATOM 2282 CB ILE C 30 -3.578 -1.398 3.833 1.00 0.00 C ATOM 2283 CG1 ILE C 30 -4.205 -1.080 2.471 1.00 0.00 C ATOM 2284 CG2 ILE C 30 -4.667 -1.389 4.906 1.00 0.00 C ATOM 2285 CD1 ILE C 30 -3.518 -1.908 1.381 1.00 0.00 C ATOM 0 H ILE C 30 -1.497 -0.805 2.352 1.00 0.00 H new ATOM 0 HA ILE C 30 -2.955 0.534 4.646 1.00 0.00 H new ATOM 0 HB ILE C 30 -3.109 -2.381 3.795 1.00 0.00 H new ATOM 0 HG12 ILE C 30 -5.272 -1.301 2.491 1.00 0.00 H new ATOM 0 HG13 ILE C 30 -4.103 -0.017 2.252 1.00 0.00 H new ATOM 0 HG21 ILE C 30 -5.421 -2.138 4.665 1.00 0.00 H new ATOM 0 HG22 ILE C 30 -4.224 -1.618 5.875 1.00 0.00 H new ATOM 0 HG23 ILE C 30 -5.133 -0.404 4.943 1.00 0.00 H new ATOM 0 HD11 ILE C 30 -3.966 -1.680 0.414 1.00 0.00 H new ATOM 0 HD12 ILE C 30 -2.456 -1.665 1.355 1.00 0.00 H new ATOM 0 HD13 ILE C 30 -3.643 -2.969 1.597 1.00 0.00 H new ATOM 2297 N VAL C 31 -1.409 -0.351 6.329 1.00 0.00 N ATOM 2298 CA VAL C 31 -0.436 -0.872 7.331 1.00 0.00 C ATOM 2299 C VAL C 31 -1.181 -1.298 8.600 1.00 0.00 C ATOM 2300 O VAL C 31 -2.212 -0.755 8.938 1.00 0.00 O ATOM 2301 CB VAL C 31 0.510 0.294 7.620 1.00 0.00 C ATOM 2302 CG1 VAL C 31 1.175 0.745 6.319 1.00 0.00 C ATOM 2303 CG2 VAL C 31 -0.281 1.459 8.216 1.00 0.00 C ATOM 0 H VAL C 31 -1.967 0.445 6.637 1.00 0.00 H new ATOM 0 HA VAL C 31 0.108 -1.745 6.970 1.00 0.00 H new ATOM 0 HB VAL C 31 1.274 -0.027 8.328 1.00 0.00 H new ATOM 0 HG11 VAL C 31 1.850 1.576 6.524 1.00 0.00 H new ATOM 0 HG12 VAL C 31 1.740 -0.084 5.893 1.00 0.00 H new ATOM 0 HG13 VAL C 31 0.410 1.065 5.611 1.00 0.00 H new ATOM 0 HG21 VAL C 31 0.394 2.290 8.422 1.00 0.00 H new ATOM 0 HG22 VAL C 31 -1.046 1.779 7.508 1.00 0.00 H new ATOM 0 HG23 VAL C 31 -0.756 1.139 9.143 1.00 0.00 H new ATOM 2313 N LYS C 32 -0.672 -2.276 9.297 1.00 0.00 N ATOM 2314 CA LYS C 32 -1.358 -2.747 10.535 1.00 0.00 C ATOM 2315 C LYS C 32 -1.388 -1.638 11.587 1.00 0.00 C ATOM 2316 O LYS C 32 -0.467 -0.854 11.700 1.00 0.00 O ATOM 2317 CB LYS C 32 -0.518 -3.928 11.025 1.00 0.00 C ATOM 2318 CG LYS C 32 -1.442 -5.056 11.488 1.00 0.00 C ATOM 2319 CD LYS C 32 -1.528 -6.125 10.396 1.00 0.00 C ATOM 2320 CE LYS C 32 -2.998 -6.407 10.073 1.00 0.00 C ATOM 2321 NZ LYS C 32 -3.564 -6.984 11.324 1.00 0.00 N ATOM 0 H LYS C 32 0.189 -2.770 9.064 1.00 0.00 H new ATOM 0 HA LYS C 32 -2.394 -3.029 10.348 1.00 0.00 H new ATOM 0 HB2 LYS C 32 0.132 -4.282 10.225 1.00 0.00 H new ATOM 0 HB3 LYS C 32 0.128 -3.613 11.845 1.00 0.00 H new ATOM 0 HG2 LYS C 32 -1.064 -5.494 12.412 1.00 0.00 H new ATOM 0 HG3 LYS C 32 -2.435 -4.662 11.705 1.00 0.00 H new ATOM 0 HD2 LYS C 32 -1.006 -5.788 9.500 1.00 0.00 H new ATOM 0 HD3 LYS C 32 -1.035 -7.039 10.727 1.00 0.00 H new ATOM 0 HE2 LYS C 32 -3.521 -5.495 9.787 1.00 0.00 H new ATOM 0 HE3 LYS C 32 -3.092 -7.103 9.239 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 -4.355 -7.616 11.088 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 -2.827 -7.523 11.822 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 -3.905 -6.216 11.937 1.00 0.00 H new ATOM 2335 N ARG C 33 -2.440 -1.570 12.360 1.00 0.00 N ATOM 2336 CA ARG C 33 -2.531 -0.515 13.411 1.00 0.00 C ATOM 2337 C ARG C 33 -1.149 -0.260 14.015 1.00 0.00 C ATOM 2338 O ARG C 33 -0.599 0.817 13.899 1.00 0.00 O ATOM 2339 CB ARG C 33 -3.481 -1.085 14.464 1.00 0.00 C ATOM 2340 CG ARG C 33 -3.375 -0.261 15.749 1.00 0.00 C ATOM 2341 CD ARG C 33 -4.295 -0.857 16.816 1.00 0.00 C ATOM 2342 NE ARG C 33 -3.700 -0.438 18.115 1.00 0.00 N ATOM 2343 CZ ARG C 33 -3.794 0.803 18.508 1.00 0.00 C ATOM 2344 NH1 ARG C 33 -4.415 1.679 17.765 1.00 0.00 N ATOM 2345 NH2 ARG C 33 -3.269 1.168 19.645 1.00 0.00 N ATOM 0 H ARG C 33 -3.240 -2.200 12.309 1.00 0.00 H new ATOM 0 HA ARG C 33 -2.888 0.436 13.016 1.00 0.00 H new ATOM 0 HB2 ARG C 33 -4.505 -1.068 14.092 1.00 0.00 H new ATOM 0 HB3 ARG C 33 -3.233 -2.127 14.666 1.00 0.00 H new ATOM 0 HG2 ARG C 33 -2.345 -0.254 16.105 1.00 0.00 H new ATOM 0 HG3 ARG C 33 -3.652 0.775 15.553 1.00 0.00 H new ATOM 0 HD2 ARG C 33 -5.314 -0.485 16.711 1.00 0.00 H new ATOM 0 HD3 ARG C 33 -4.342 -1.943 16.735 1.00 0.00 H new ATOM 0 HE ARG C 33 -3.218 -1.122 18.699 1.00 0.00 H new ATOM 0 HH11 ARG C 33 -4.827 1.394 16.877 1.00 0.00 H new ATOM 0 HH12 ARG C 33 -4.488 2.649 18.073 1.00 0.00 H new ATOM 0 HH21 ARG C 33 -2.785 0.484 20.226 1.00 0.00 H new ATOM 0 HH22 ARG C 33 -3.342 2.138 19.953 1.00 0.00 H new ATOM 2359 N GLU C 34 -0.575 -1.248 14.647 1.00 0.00 N ATOM 2360 CA GLU C 34 0.779 -1.059 15.240 1.00 0.00 C ATOM 2361 C GLU C 34 1.706 -0.448 14.190 1.00 0.00 C ATOM 2362 O GLU C 34 2.403 0.514 14.445 1.00 0.00 O ATOM 2363 CB GLU C 34 1.248 -2.463 15.624 1.00 0.00 C ATOM 2364 CG GLU C 34 2.072 -2.392 16.910 1.00 0.00 C ATOM 2365 CD GLU C 34 1.213 -2.844 18.093 1.00 0.00 C ATOM 2366 OE1 GLU C 34 0.401 -3.735 17.904 1.00 0.00 O ATOM 2367 OE2 GLU C 34 1.382 -2.291 19.168 1.00 0.00 O ATOM 0 H GLU C 34 -0.983 -2.174 14.778 1.00 0.00 H new ATOM 0 HA GLU C 34 0.774 -0.392 16.102 1.00 0.00 H new ATOM 0 HB2 GLU C 34 0.389 -3.119 15.766 1.00 0.00 H new ATOM 0 HB3 GLU C 34 1.846 -2.891 14.819 1.00 0.00 H new ATOM 0 HG2 GLU C 34 2.954 -3.026 16.824 1.00 0.00 H new ATOM 0 HG3 GLU C 34 2.426 -1.374 17.072 1.00 0.00 H new ATOM 2374 N HIS C 35 1.704 -0.991 13.003 1.00 0.00 N ATOM 2375 CA HIS C 35 2.569 -0.432 11.928 1.00 0.00 C ATOM 2376 C HIS C 35 2.259 1.054 11.755 1.00 0.00 C ATOM 2377 O HIS C 35 3.139 1.865 11.555 1.00 0.00 O ATOM 2378 CB HIS C 35 2.192 -1.215 10.670 1.00 0.00 C ATOM 2379 CG HIS C 35 3.100 -0.820 9.537 1.00 0.00 C ATOM 2380 ND1 HIS C 35 3.227 0.494 9.114 1.00 0.00 N ATOM 2381 CD2 HIS C 35 3.928 -1.556 8.727 1.00 0.00 C ATOM 2382 CE1 HIS C 35 4.101 0.508 8.092 1.00 0.00 C ATOM 2383 NE2 HIS C 35 4.559 -0.716 7.815 1.00 0.00 N ATOM 0 H HIS C 35 1.141 -1.797 12.732 1.00 0.00 H new ATOM 0 HA HIS C 35 3.633 -0.520 12.149 1.00 0.00 H new ATOM 0 HB2 HIS C 35 2.273 -2.286 10.858 1.00 0.00 H new ATOM 0 HB3 HIS C 35 1.154 -1.016 10.403 1.00 0.00 H new ATOM 0 HD2 HIS C 35 4.068 -2.625 8.788 1.00 0.00 H new ATOM 0 HE1 HIS C 35 4.397 1.400 7.560 1.00 0.00 H new ATOM 0 HE2 HIS C 35 5.228 -0.978 7.091 1.00 0.00 H new ATOM 2391 N ALA C 36 1.008 1.416 11.838 1.00 0.00 N ATOM 2392 CA ALA C 36 0.631 2.851 11.690 1.00 0.00 C ATOM 2393 C ALA C 36 0.737 3.559 13.039 1.00 0.00 C ATOM 2394 O ALA C 36 0.819 4.769 13.109 1.00 0.00 O ATOM 2395 CB ALA C 36 -0.817 2.828 11.200 1.00 0.00 C ATOM 0 H ALA C 36 0.229 0.779 12.002 1.00 0.00 H new ATOM 0 HA ALA C 36 1.283 3.387 11.000 1.00 0.00 H new ATOM 0 HB1 ALA C 36 -1.172 3.850 11.065 1.00 0.00 H new ATOM 0 HB2 ALA C 36 -0.871 2.297 10.250 1.00 0.00 H new ATOM 0 HB3 ALA C 36 -1.442 2.321 11.935 1.00 0.00 H new ATOM 2401 N LEU C 37 0.754 2.817 14.111 1.00 0.00 N ATOM 2402 CA LEU C 37 0.874 3.460 15.447 1.00 0.00 C ATOM 2403 C LEU C 37 2.222 4.178 15.548 1.00 0.00 C ATOM 2404 O LEU C 37 2.478 4.915 16.481 1.00 0.00 O ATOM 2405 CB LEU C 37 0.798 2.312 16.455 1.00 0.00 C ATOM 2406 CG LEU C 37 0.658 2.880 17.867 1.00 0.00 C ATOM 2407 CD1 LEU C 37 -0.804 2.800 18.308 1.00 0.00 C ATOM 2408 CD2 LEU C 37 1.526 2.069 18.831 1.00 0.00 C ATOM 0 H LEU C 37 0.690 1.799 14.119 1.00 0.00 H new ATOM 0 HA LEU C 37 0.095 4.201 15.627 1.00 0.00 H new ATOM 0 HB2 LEU C 37 -0.051 1.668 16.225 1.00 0.00 H new ATOM 0 HB3 LEU C 37 1.694 1.695 16.387 1.00 0.00 H new ATOM 0 HG LEU C 37 0.982 3.921 17.873 1.00 0.00 H new ATOM 0 HD11 LEU C 37 -0.903 3.205 19.315 1.00 0.00 H new ATOM 0 HD12 LEU C 37 -1.423 3.378 17.622 1.00 0.00 H new ATOM 0 HD13 LEU C 37 -1.129 1.760 18.302 1.00 0.00 H new ATOM 0 HD21 LEU C 37 1.427 2.474 19.838 1.00 0.00 H new ATOM 0 HD22 LEU C 37 1.202 1.028 18.824 1.00 0.00 H new ATOM 0 HD23 LEU C 37 2.569 2.127 18.518 1.00 0.00 H new ATOM 2420 N THR C 38 3.085 3.970 14.588 1.00 0.00 N ATOM 2421 CA THR C 38 4.414 4.641 14.620 1.00 0.00 C ATOM 2422 C THR C 38 4.273 6.115 14.248 1.00 0.00 C ATOM 2423 O THR C 38 5.240 6.846 14.178 1.00 0.00 O ATOM 2424 CB THR C 38 5.264 3.891 13.601 1.00 0.00 C ATOM 2425 OG1 THR C 38 4.425 3.380 12.576 1.00 0.00 O ATOM 2426 CG2 THR C 38 5.990 2.736 14.291 1.00 0.00 C ATOM 0 H THR C 38 2.925 3.364 13.784 1.00 0.00 H new ATOM 0 HA THR C 38 4.867 4.617 15.611 1.00 0.00 H new ATOM 0 HB THR C 38 5.998 4.570 13.167 1.00 0.00 H new ATOM 0 HG1 THR C 38 4.221 4.092 11.935 1.00 0.00 H new ATOM 0 HG21 THR C 38 6.597 2.200 13.561 1.00 0.00 H new ATOM 0 HG22 THR C 38 6.632 3.129 15.079 1.00 0.00 H new ATOM 0 HG23 THR C 38 5.259 2.054 14.725 1.00 0.00 H new ATOM 2434 N SER C 39 3.071 6.556 14.033 1.00 0.00 N ATOM 2435 CA SER C 39 2.847 7.980 13.691 1.00 0.00 C ATOM 2436 C SER C 39 1.846 8.577 14.676 1.00 0.00 C ATOM 2437 O SER C 39 0.677 8.249 14.665 1.00 0.00 O ATOM 2438 CB SER C 39 2.273 7.971 12.277 1.00 0.00 C ATOM 2439 OG SER C 39 1.049 8.693 12.259 1.00 0.00 O ATOM 0 H SER C 39 2.227 5.985 14.080 1.00 0.00 H new ATOM 0 HA SER C 39 3.758 8.576 13.743 1.00 0.00 H new ATOM 0 HB2 SER C 39 2.983 8.420 11.582 1.00 0.00 H new ATOM 0 HB3 SER C 39 2.108 6.946 11.946 1.00 0.00 H new ATOM 0 HG SER C 39 1.229 9.636 12.064 1.00 0.00 H new ATOM 2445 N GLY C 40 2.298 9.445 15.532 1.00 0.00 N ATOM 2446 CA GLY C 40 1.379 10.066 16.528 1.00 0.00 C ATOM 2447 C GLY C 40 0.188 10.709 15.811 1.00 0.00 C ATOM 2448 O GLY C 40 -0.645 11.345 16.427 1.00 0.00 O ATOM 0 H GLY C 40 3.268 9.754 15.587 1.00 0.00 H new ATOM 0 HA2 GLY C 40 1.027 9.311 17.231 1.00 0.00 H new ATOM 0 HA3 GLY C 40 1.913 10.818 17.109 1.00 0.00 H new ATOM 2452 N THR C 41 0.093 10.552 14.517 1.00 0.00 N ATOM 2453 CA THR C 41 -1.051 11.157 13.778 1.00 0.00 C ATOM 2454 C THR C 41 -1.944 10.057 13.203 1.00 0.00 C ATOM 2455 O THR C 41 -3.154 10.127 13.277 1.00 0.00 O ATOM 2456 CB THR C 41 -0.414 11.975 12.655 1.00 0.00 C ATOM 2457 OG1 THR C 41 0.571 12.839 13.204 1.00 0.00 O ATOM 2458 CG2 THR C 41 -1.488 12.805 11.952 1.00 0.00 C ATOM 0 H THR C 41 0.756 10.032 13.942 1.00 0.00 H new ATOM 0 HA THR C 41 -1.679 11.774 14.421 1.00 0.00 H new ATOM 0 HB THR C 41 0.051 11.303 11.934 1.00 0.00 H new ATOM 0 HG1 THR C 41 0.180 13.355 13.939 1.00 0.00 H new ATOM 0 HG21 THR C 41 -1.032 13.388 11.152 1.00 0.00 H new ATOM 0 HG22 THR C 41 -2.244 12.141 11.532 1.00 0.00 H new ATOM 0 HG23 THR C 41 -1.955 13.479 12.670 1.00 0.00 H new ATOM 2466 N ILE C 42 -1.358 9.038 12.637 1.00 0.00 N ATOM 2467 CA ILE C 42 -2.184 7.937 12.072 1.00 0.00 C ATOM 2468 C ILE C 42 -2.928 7.228 13.206 1.00 0.00 C ATOM 2469 O ILE C 42 -4.114 6.977 13.123 1.00 0.00 O ATOM 2470 CB ILE C 42 -1.185 6.999 11.391 1.00 0.00 C ATOM 2471 CG1 ILE C 42 -0.942 7.477 9.956 1.00 0.00 C ATOM 2472 CG2 ILE C 42 -1.748 5.577 11.360 1.00 0.00 C ATOM 2473 CD1 ILE C 42 0.551 7.731 9.746 1.00 0.00 C ATOM 0 H ILE C 42 -0.349 8.921 12.542 1.00 0.00 H new ATOM 0 HA ILE C 42 -2.937 8.288 11.367 1.00 0.00 H new ATOM 0 HB ILE C 42 -0.248 7.004 11.947 1.00 0.00 H new ATOM 0 HG12 ILE C 42 -1.297 6.729 9.248 1.00 0.00 H new ATOM 0 HG13 ILE C 42 -1.507 8.390 9.765 1.00 0.00 H new ATOM 0 HG21 ILE C 42 -1.033 4.913 10.874 1.00 0.00 H new ATOM 0 HG22 ILE C 42 -1.927 5.234 12.379 1.00 0.00 H new ATOM 0 HG23 ILE C 42 -2.686 5.569 10.805 1.00 0.00 H new ATOM 0 HD11 ILE C 42 0.722 8.071 8.725 1.00 0.00 H new ATOM 0 HD12 ILE C 42 0.892 8.495 10.445 1.00 0.00 H new ATOM 0 HD13 ILE C 42 1.105 6.808 9.919 1.00 0.00 H new ATOM 2485 N LYS C 43 -2.242 6.917 14.273 1.00 0.00 N ATOM 2486 CA LYS C 43 -2.914 6.241 15.418 1.00 0.00 C ATOM 2487 C LYS C 43 -4.075 7.107 15.918 1.00 0.00 C ATOM 2488 O LYS C 43 -5.099 6.607 16.338 1.00 0.00 O ATOM 2489 CB LYS C 43 -1.829 6.109 16.491 1.00 0.00 C ATOM 2490 CG LYS C 43 -2.471 6.086 17.881 1.00 0.00 C ATOM 2491 CD LYS C 43 -3.381 4.862 18.005 1.00 0.00 C ATOM 2492 CE LYS C 43 -3.701 4.610 19.480 1.00 0.00 C ATOM 2493 NZ LYS C 43 -4.511 5.785 19.907 1.00 0.00 N ATOM 0 H LYS C 43 -1.247 7.102 14.400 1.00 0.00 H new ATOM 0 HA LYS C 43 -3.332 5.271 15.149 1.00 0.00 H new ATOM 0 HB2 LYS C 43 -1.256 5.196 16.330 1.00 0.00 H new ATOM 0 HB3 LYS C 43 -1.129 6.942 16.418 1.00 0.00 H new ATOM 0 HG2 LYS C 43 -1.698 6.057 18.649 1.00 0.00 H new ATOM 0 HG3 LYS C 43 -3.046 6.998 18.042 1.00 0.00 H new ATOM 0 HD2 LYS C 43 -4.302 5.022 17.445 1.00 0.00 H new ATOM 0 HD3 LYS C 43 -2.893 3.988 17.573 1.00 0.00 H new ATOM 0 HE2 LYS C 43 -4.255 3.681 19.610 1.00 0.00 H new ATOM 0 HE3 LYS C 43 -2.790 4.523 20.072 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 -5.018 5.556 20.785 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 -3.884 6.598 20.071 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 -5.197 6.023 19.163 1.00 0.00 H new ATOM 2507 N ALA C 44 -3.922 8.404 15.871 1.00 0.00 N ATOM 2508 CA ALA C 44 -5.018 9.299 16.341 1.00 0.00 C ATOM 2509 C ALA C 44 -6.091 9.429 15.258 1.00 0.00 C ATOM 2510 O ALA C 44 -7.166 9.944 15.493 1.00 0.00 O ATOM 2511 CB ALA C 44 -4.346 10.649 16.595 1.00 0.00 C ATOM 0 H ALA C 44 -3.088 8.881 15.528 1.00 0.00 H new ATOM 0 HA ALA C 44 -5.511 8.916 17.234 1.00 0.00 H new ATOM 0 HB1 ALA C 44 -5.089 11.365 16.945 1.00 0.00 H new ATOM 0 HB2 ALA C 44 -3.570 10.533 17.352 1.00 0.00 H new ATOM 0 HB3 ALA C 44 -3.899 11.013 15.670 1.00 0.00 H new ATOM 2517 N MET C 45 -5.807 8.962 14.072 1.00 0.00 N ATOM 2518 CA MET C 45 -6.811 9.056 12.974 1.00 0.00 C ATOM 2519 C MET C 45 -7.553 7.725 12.823 1.00 0.00 C ATOM 2520 O MET C 45 -8.677 7.678 12.363 1.00 0.00 O ATOM 2521 CB MET C 45 -5.996 9.359 11.716 1.00 0.00 C ATOM 2522 CG MET C 45 -5.345 10.737 11.850 1.00 0.00 C ATOM 2523 SD MET C 45 -6.425 11.988 11.113 1.00 0.00 S ATOM 2524 CE MET C 45 -5.899 11.761 9.397 1.00 0.00 C ATOM 0 H MET C 45 -4.924 8.520 13.816 1.00 0.00 H new ATOM 0 HA MET C 45 -7.563 9.821 13.166 1.00 0.00 H new ATOM 0 HB2 MET C 45 -5.231 8.596 11.573 1.00 0.00 H new ATOM 0 HB3 MET C 45 -6.640 9.333 10.837 1.00 0.00 H new ATOM 0 HG2 MET C 45 -5.168 10.967 12.901 1.00 0.00 H new ATOM 0 HG3 MET C 45 -4.374 10.742 11.355 1.00 0.00 H new ATOM 0 HE1 MET C 45 -6.742 11.943 8.731 1.00 0.00 H new ATOM 0 HE2 MET C 45 -5.096 12.462 9.167 1.00 0.00 H new ATOM 0 HE3 MET C 45 -5.541 10.741 9.258 1.00 0.00 H new ATOM 2534 N LEU C 46 -6.933 6.644 13.208 1.00 0.00 N ATOM 2535 CA LEU C 46 -7.603 5.317 13.088 1.00 0.00 C ATOM 2536 C LEU C 46 -9.054 5.414 13.564 1.00 0.00 C ATOM 2537 O LEU C 46 -9.963 4.928 12.920 1.00 0.00 O ATOM 2538 CB LEU C 46 -6.800 4.386 13.998 1.00 0.00 C ATOM 2539 CG LEU C 46 -5.879 3.512 13.148 1.00 0.00 C ATOM 2540 CD1 LEU C 46 -4.420 3.844 13.468 1.00 0.00 C ATOM 2541 CD2 LEU C 46 -6.145 2.038 13.462 1.00 0.00 C ATOM 0 H LEU C 46 -5.992 6.621 13.600 1.00 0.00 H new ATOM 0 HA LEU C 46 -7.630 4.958 12.059 1.00 0.00 H new ATOM 0 HB2 LEU C 46 -6.213 4.970 14.706 1.00 0.00 H new ATOM 0 HB3 LEU C 46 -7.475 3.761 14.583 1.00 0.00 H new ATOM 0 HG LEU C 46 -6.071 3.702 12.092 1.00 0.00 H new ATOM 0 HD11 LEU C 46 -3.763 3.220 12.861 1.00 0.00 H new ATOM 0 HD12 LEU C 46 -4.229 4.894 13.247 1.00 0.00 H new ATOM 0 HD13 LEU C 46 -4.227 3.654 14.524 1.00 0.00 H new ATOM 0 HD21 LEU C 46 -5.489 1.413 12.856 1.00 0.00 H new ATOM 0 HD22 LEU C 46 -5.952 1.850 14.518 1.00 0.00 H new ATOM 0 HD23 LEU C 46 -7.184 1.799 13.235 1.00 0.00 H new ATOM 2697 N ASN C 58 -10.574 3.509 10.241 1.00 0.00 N ATOM 2698 CA ASN C 58 -9.115 3.214 10.326 1.00 0.00 C ATOM 2699 C ASN C 58 -8.443 3.484 8.976 1.00 0.00 C ATOM 2700 O ASN C 58 -7.906 2.594 8.346 1.00 0.00 O ATOM 2701 CB ASN C 58 -9.032 1.727 10.678 1.00 0.00 C ATOM 2702 CG ASN C 58 -9.938 0.929 9.738 1.00 0.00 C ATOM 2703 OD1 ASN C 58 -10.458 1.462 8.778 1.00 0.00 O ATOM 2704 ND2 ASN C 58 -10.150 -0.337 9.975 1.00 0.00 N ATOM 0 HA ASN C 58 -8.609 3.837 11.064 1.00 0.00 H new ATOM 0 HB2 ASN C 58 -8.003 1.379 10.591 1.00 0.00 H new ATOM 0 HB3 ASN C 58 -9.335 1.570 11.713 1.00 0.00 H new ATOM 0 HD21 ASN C 58 -10.752 -0.878 9.354 1.00 0.00 H new ATOM 0 HD22 ASN C 58 -9.714 -0.785 10.781 1.00 0.00 H new ATOM 2711 N GLU C 59 -8.470 4.708 8.525 1.00 0.00 N ATOM 2712 CA GLU C 59 -7.834 5.028 7.216 1.00 0.00 C ATOM 2713 C GLU C 59 -7.034 6.329 7.312 1.00 0.00 C ATOM 2714 O GLU C 59 -7.308 7.183 8.132 1.00 0.00 O ATOM 2715 CB GLU C 59 -8.999 5.184 6.238 1.00 0.00 C ATOM 2716 CG GLU C 59 -10.014 6.178 6.806 1.00 0.00 C ATOM 2717 CD GLU C 59 -11.115 6.429 5.774 1.00 0.00 C ATOM 2718 OE1 GLU C 59 -11.958 5.562 5.612 1.00 0.00 O ATOM 2719 OE2 GLU C 59 -11.097 7.485 5.163 1.00 0.00 O ATOM 0 H GLU C 59 -8.903 5.497 9.004 1.00 0.00 H new ATOM 0 HA GLU C 59 -7.135 4.254 6.899 1.00 0.00 H new ATOM 0 HB2 GLU C 59 -8.633 5.534 5.273 1.00 0.00 H new ATOM 0 HB3 GLU C 59 -9.476 4.219 6.067 1.00 0.00 H new ATOM 0 HG2 GLU C 59 -10.446 5.786 7.727 1.00 0.00 H new ATOM 0 HG3 GLU C 59 -9.518 7.115 7.060 1.00 0.00 H new ATOM 2726 N VAL C 60 -6.048 6.482 6.474 1.00 0.00 N ATOM 2727 CA VAL C 60 -5.221 7.722 6.501 1.00 0.00 C ATOM 2728 C VAL C 60 -5.269 8.402 5.130 1.00 0.00 C ATOM 2729 O VAL C 60 -5.483 7.763 4.120 1.00 0.00 O ATOM 2730 CB VAL C 60 -3.802 7.246 6.819 1.00 0.00 C ATOM 2731 CG1 VAL C 60 -3.019 8.370 7.494 1.00 0.00 C ATOM 2732 CG2 VAL C 60 -3.863 6.039 7.759 1.00 0.00 C ATOM 0 H VAL C 60 -5.777 5.798 5.767 1.00 0.00 H new ATOM 0 HA VAL C 60 -5.575 8.447 7.233 1.00 0.00 H new ATOM 0 HB VAL C 60 -3.305 6.963 5.891 1.00 0.00 H new ATOM 0 HG11 VAL C 60 -2.009 8.026 7.718 1.00 0.00 H new ATOM 0 HG12 VAL C 60 -2.969 9.230 6.827 1.00 0.00 H new ATOM 0 HG13 VAL C 60 -3.519 8.657 8.419 1.00 0.00 H new ATOM 0 HG21 VAL C 60 -2.851 5.702 7.984 1.00 0.00 H new ATOM 0 HG22 VAL C 60 -4.365 6.323 8.684 1.00 0.00 H new ATOM 0 HG23 VAL C 60 -4.416 5.232 7.279 1.00 0.00 H new ATOM 2742 N ASN C 61 -5.074 9.690 5.086 1.00 0.00 N ATOM 2743 CA ASN C 61 -5.112 10.402 3.780 1.00 0.00 C ATOM 2744 C ASN C 61 -3.968 11.414 3.696 1.00 0.00 C ATOM 2745 O ASN C 61 -3.927 12.382 4.429 1.00 0.00 O ATOM 2746 CB ASN C 61 -6.463 11.118 3.756 1.00 0.00 C ATOM 2747 CG ASN C 61 -7.580 10.111 4.036 1.00 0.00 C ATOM 2748 OD1 ASN C 61 -7.816 9.213 3.251 1.00 0.00 O ATOM 2749 ND2 ASN C 61 -8.284 10.222 5.129 1.00 0.00 N ATOM 0 H ASN C 61 -4.890 10.280 5.898 1.00 0.00 H new ATOM 0 HA ASN C 61 -4.997 9.721 2.936 1.00 0.00 H new ATOM 0 HB2 ASN C 61 -6.479 11.912 4.503 1.00 0.00 H new ATOM 0 HB3 ASN C 61 -6.619 11.590 2.786 1.00 0.00 H new ATOM 0 HD21 ASN C 61 -9.031 9.556 5.324 1.00 0.00 H new ATOM 0 HD22 ASN C 61 -8.087 10.975 5.788 1.00 0.00 H new ATOM 2756 N PHE C 62 -3.047 11.201 2.802 1.00 0.00 N ATOM 2757 CA PHE C 62 -1.909 12.158 2.666 1.00 0.00 C ATOM 2758 C PHE C 62 -2.164 13.109 1.492 1.00 0.00 C ATOM 2759 O PHE C 62 -1.900 12.785 0.351 1.00 0.00 O ATOM 2760 CB PHE C 62 -0.680 11.290 2.393 1.00 0.00 C ATOM 2761 CG PHE C 62 -0.539 10.256 3.485 1.00 0.00 C ATOM 2762 CD1 PHE C 62 -0.992 10.538 4.779 1.00 0.00 C ATOM 2763 CD2 PHE C 62 0.047 9.017 3.202 1.00 0.00 C ATOM 2764 CE1 PHE C 62 -0.859 9.579 5.790 1.00 0.00 C ATOM 2765 CE2 PHE C 62 0.181 8.058 4.214 1.00 0.00 C ATOM 2766 CZ PHE C 62 -0.273 8.340 5.508 1.00 0.00 C ATOM 0 H PHE C 62 -3.029 10.409 2.159 1.00 0.00 H new ATOM 0 HA PHE C 62 -1.779 12.772 3.557 1.00 0.00 H new ATOM 0 HB2 PHE C 62 -0.776 10.800 1.424 1.00 0.00 H new ATOM 0 HB3 PHE C 62 0.214 11.911 2.349 1.00 0.00 H new ATOM 0 HD1 PHE C 62 -1.444 11.494 4.997 1.00 0.00 H new ATOM 0 HD2 PHE C 62 0.396 8.800 2.203 1.00 0.00 H new ATOM 0 HE1 PHE C 62 -1.209 9.796 6.789 1.00 0.00 H new ATOM 0 HE2 PHE C 62 0.634 7.102 3.996 1.00 0.00 H new ATOM 0 HZ PHE C 62 -0.171 7.601 6.289 1.00 0.00 H new ATOM 2776 N ARG C 63 -2.674 14.278 1.763 1.00 0.00 N ATOM 2777 CA ARG C 63 -2.944 15.247 0.661 1.00 0.00 C ATOM 2778 C ARG C 63 -1.696 16.090 0.384 1.00 0.00 C ATOM 2779 O ARG C 63 -1.738 17.055 -0.353 1.00 0.00 O ATOM 2780 CB ARG C 63 -4.083 16.126 1.177 1.00 0.00 C ATOM 2781 CG ARG C 63 -5.145 16.278 0.085 1.00 0.00 C ATOM 2782 CD ARG C 63 -5.817 14.927 -0.166 1.00 0.00 C ATOM 2783 NE ARG C 63 -6.696 15.148 -1.347 1.00 0.00 N ATOM 2784 CZ ARG C 63 -7.136 14.129 -2.035 1.00 0.00 C ATOM 2785 NH1 ARG C 63 -6.808 12.915 -1.688 1.00 0.00 N ATOM 2786 NH2 ARG C 63 -7.906 14.325 -3.070 1.00 0.00 N ATOM 0 H ARG C 63 -2.916 14.605 2.698 1.00 0.00 H new ATOM 0 HA ARG C 63 -3.206 14.750 -0.273 1.00 0.00 H new ATOM 0 HB2 ARG C 63 -4.524 15.681 2.069 1.00 0.00 H new ATOM 0 HB3 ARG C 63 -3.699 17.105 1.465 1.00 0.00 H new ATOM 0 HG2 ARG C 63 -5.889 17.015 0.387 1.00 0.00 H new ATOM 0 HG3 ARG C 63 -4.687 16.644 -0.834 1.00 0.00 H new ATOM 0 HD2 ARG C 63 -5.079 14.150 -0.363 1.00 0.00 H new ATOM 0 HD3 ARG C 63 -6.394 14.606 0.701 1.00 0.00 H new ATOM 0 HE ARG C 63 -6.955 16.096 -1.619 1.00 0.00 H new ATOM 0 HH11 ARG C 63 -6.207 12.761 -0.878 1.00 0.00 H new ATOM 0 HH12 ARG C 63 -7.152 12.120 -2.226 1.00 0.00 H new ATOM 0 HH21 ARG C 63 -8.164 15.274 -3.341 1.00 0.00 H new ATOM 0 HH22 ARG C 63 -8.250 13.529 -3.608 1.00 0.00 H new ATOM 2800 N GLU C 64 -0.587 15.731 0.969 1.00 0.00 N ATOM 2801 CA GLU C 64 0.664 16.510 0.740 1.00 0.00 C ATOM 2802 C GLU C 64 1.875 15.574 0.742 1.00 0.00 C ATOM 2803 O GLU C 64 2.956 15.942 1.157 1.00 0.00 O ATOM 2804 CB GLU C 64 0.740 17.489 1.914 1.00 0.00 C ATOM 2805 CG GLU C 64 1.811 18.542 1.630 1.00 0.00 C ATOM 2806 CD GLU C 64 1.308 19.507 0.556 1.00 0.00 C ATOM 2807 OE1 GLU C 64 0.400 20.268 0.848 1.00 0.00 O ATOM 2808 OE2 GLU C 64 1.839 19.469 -0.542 1.00 0.00 O ATOM 0 H GLU C 64 -0.492 14.932 1.596 1.00 0.00 H new ATOM 0 HA GLU C 64 0.662 17.025 -0.221 1.00 0.00 H new ATOM 0 HB2 GLU C 64 -0.227 17.969 2.064 1.00 0.00 H new ATOM 0 HB3 GLU C 64 0.976 16.953 2.834 1.00 0.00 H new ATOM 0 HG2 GLU C 64 2.049 19.089 2.542 1.00 0.00 H new ATOM 0 HG3 GLU C 64 2.731 18.060 1.298 1.00 0.00 H new ATOM 2815 N ILE C 65 1.702 14.364 0.283 1.00 0.00 N ATOM 2816 CA ILE C 65 2.843 13.405 0.259 1.00 0.00 C ATOM 2817 C ILE C 65 2.717 12.462 -0.941 1.00 0.00 C ATOM 2818 O ILE C 65 1.671 11.889 -1.173 1.00 0.00 O ATOM 2819 CB ILE C 65 2.732 12.628 1.571 1.00 0.00 C ATOM 2820 CG1 ILE C 65 2.449 13.600 2.720 1.00 0.00 C ATOM 2821 CG2 ILE C 65 4.045 11.892 1.840 1.00 0.00 C ATOM 2822 CD1 ILE C 65 2.494 12.849 4.052 1.00 0.00 C ATOM 0 H ILE C 65 0.820 13.998 -0.076 1.00 0.00 H new ATOM 0 HA ILE C 65 3.805 13.908 0.164 1.00 0.00 H new ATOM 0 HB ILE C 65 1.918 11.907 1.497 1.00 0.00 H new ATOM 0 HG12 ILE C 65 3.185 14.404 2.719 1.00 0.00 H new ATOM 0 HG13 ILE C 65 1.472 14.063 2.585 1.00 0.00 H new ATOM 0 HG21 ILE C 65 3.966 11.338 2.775 1.00 0.00 H new ATOM 0 HG22 ILE C 65 4.247 11.199 1.023 1.00 0.00 H new ATOM 0 HG23 ILE C 65 4.858 12.614 1.913 1.00 0.00 H new ATOM 0 HD11 ILE C 65 2.292 13.543 4.868 1.00 0.00 H new ATOM 0 HD12 ILE C 65 1.741 12.061 4.051 1.00 0.00 H new ATOM 0 HD13 ILE C 65 3.481 12.407 4.187 1.00 0.00 H new ATOM 2834 N PRO C 66 3.795 12.335 -1.668 1.00 0.00 N ATOM 2835 CA PRO C 66 3.813 11.454 -2.864 1.00 0.00 C ATOM 2836 C PRO C 66 3.828 9.980 -2.447 1.00 0.00 C ATOM 2837 O PRO C 66 4.214 9.640 -1.345 1.00 0.00 O ATOM 2838 CB PRO C 66 5.112 11.834 -3.567 1.00 0.00 C ATOM 2839 CG PRO C 66 5.991 12.387 -2.490 1.00 0.00 C ATOM 2840 CD PRO C 66 5.087 12.993 -1.447 1.00 0.00 C ATOM 0 HA PRO C 66 2.936 11.578 -3.500 1.00 0.00 H new ATOM 0 HB2 PRO C 66 5.570 10.967 -4.044 1.00 0.00 H new ATOM 0 HB3 PRO C 66 4.935 12.572 -4.349 1.00 0.00 H new ATOM 0 HG2 PRO C 66 6.608 11.601 -2.055 1.00 0.00 H new ATOM 0 HG3 PRO C 66 6.670 13.138 -2.895 1.00 0.00 H new ATOM 0 HD2 PRO C 66 5.461 12.809 -0.440 1.00 0.00 H new ATOM 0 HD3 PRO C 66 5.010 14.074 -1.566 1.00 0.00 H new ATOM 2848 N SER C 67 3.415 9.102 -3.322 1.00 0.00 N ATOM 2849 CA SER C 67 3.406 7.651 -2.976 1.00 0.00 C ATOM 2850 C SER C 67 4.819 7.184 -2.616 1.00 0.00 C ATOM 2851 O SER C 67 5.046 6.625 -1.561 1.00 0.00 O ATOM 2852 CB SER C 67 2.914 6.947 -4.239 1.00 0.00 C ATOM 2853 OG SER C 67 3.700 5.785 -4.466 1.00 0.00 O ATOM 0 H SER C 67 3.084 9.327 -4.260 1.00 0.00 H new ATOM 0 HA SER C 67 2.772 7.435 -2.116 1.00 0.00 H new ATOM 0 HB2 SER C 67 1.864 6.674 -4.132 1.00 0.00 H new ATOM 0 HB3 SER C 67 2.983 7.619 -5.094 1.00 0.00 H new ATOM 0 HG SER C 67 3.116 5.000 -4.520 1.00 0.00 H new ATOM 2859 N HIS C 68 5.770 7.413 -3.481 1.00 0.00 N ATOM 2860 CA HIS C 68 7.167 6.985 -3.178 1.00 0.00 C ATOM 2861 C HIS C 68 7.485 7.263 -1.708 1.00 0.00 C ATOM 2862 O HIS C 68 8.129 6.478 -1.039 1.00 0.00 O ATOM 2863 CB HIS C 68 8.048 7.838 -4.091 1.00 0.00 C ATOM 2864 CG HIS C 68 9.485 7.422 -3.936 1.00 0.00 C ATOM 2865 ND1 HIS C 68 10.537 8.279 -4.218 1.00 0.00 N ATOM 2866 CD2 HIS C 68 10.060 6.243 -3.529 1.00 0.00 C ATOM 2867 CE1 HIS C 68 11.680 7.610 -3.980 1.00 0.00 C ATOM 2868 NE2 HIS C 68 11.446 6.364 -3.557 1.00 0.00 N ATOM 0 H HIS C 68 5.642 7.876 -4.381 1.00 0.00 H new ATOM 0 HA HIS C 68 7.325 5.919 -3.345 1.00 0.00 H new ATOM 0 HB2 HIS C 68 7.735 7.721 -5.128 1.00 0.00 H new ATOM 0 HB3 HIS C 68 7.935 8.893 -3.841 1.00 0.00 H new ATOM 0 HD1 HIS C 68 10.459 9.242 -4.546 1.00 0.00 H new ATOM 0 HD2 HIS C 68 9.519 5.357 -3.232 1.00 0.00 H new ATOM 0 HE1 HIS C 68 12.666 8.029 -4.114 1.00 0.00 H new ATOM 2876 N VAL C 69 7.025 8.372 -1.197 1.00 0.00 N ATOM 2877 CA VAL C 69 7.285 8.700 0.228 1.00 0.00 C ATOM 2878 C VAL C 69 6.359 7.872 1.122 1.00 0.00 C ATOM 2879 O VAL C 69 6.752 7.379 2.160 1.00 0.00 O ATOM 2880 CB VAL C 69 6.966 10.190 0.346 1.00 0.00 C ATOM 2881 CG1 VAL C 69 6.545 10.513 1.778 1.00 0.00 C ATOM 2882 CG2 VAL C 69 8.208 11.008 -0.019 1.00 0.00 C ATOM 0 H VAL C 69 6.479 9.065 -1.709 1.00 0.00 H new ATOM 0 HA VAL C 69 8.307 8.480 0.536 1.00 0.00 H new ATOM 0 HB VAL C 69 6.152 10.441 -0.334 1.00 0.00 H new ATOM 0 HG11 VAL C 69 6.318 11.576 1.860 1.00 0.00 H new ATOM 0 HG12 VAL C 69 5.660 9.932 2.037 1.00 0.00 H new ATOM 0 HG13 VAL C 69 7.356 10.262 2.461 1.00 0.00 H new ATOM 0 HG21 VAL C 69 7.981 12.071 0.065 1.00 0.00 H new ATOM 0 HG22 VAL C 69 9.022 10.756 0.660 1.00 0.00 H new ATOM 0 HG23 VAL C 69 8.506 10.780 -1.043 1.00 0.00 H new ATOM 2892 N LEU C 70 5.129 7.714 0.717 1.00 0.00 N ATOM 2893 CA LEU C 70 4.168 6.915 1.528 1.00 0.00 C ATOM 2894 C LEU C 70 4.843 5.628 2.015 1.00 0.00 C ATOM 2895 O LEU C 70 4.566 5.139 3.092 1.00 0.00 O ATOM 2896 CB LEU C 70 3.001 6.632 0.563 1.00 0.00 C ATOM 2897 CG LEU C 70 2.601 5.149 0.581 1.00 0.00 C ATOM 2898 CD1 LEU C 70 3.723 4.299 -0.022 1.00 0.00 C ATOM 2899 CD2 LEU C 70 2.327 4.703 2.020 1.00 0.00 C ATOM 0 H LEU C 70 4.747 8.105 -0.144 1.00 0.00 H new ATOM 0 HA LEU C 70 3.823 7.428 2.426 1.00 0.00 H new ATOM 0 HB2 LEU C 70 2.143 7.245 0.839 1.00 0.00 H new ATOM 0 HB3 LEU C 70 3.286 6.921 -0.449 1.00 0.00 H new ATOM 0 HG LEU C 70 1.696 5.017 -0.013 1.00 0.00 H new ATOM 0 HD11 LEU C 70 3.432 3.249 -0.006 1.00 0.00 H new ATOM 0 HD12 LEU C 70 3.902 4.610 -1.051 1.00 0.00 H new ATOM 0 HD13 LEU C 70 4.634 4.432 0.561 1.00 0.00 H new ATOM 0 HD21 LEU C 70 2.044 3.650 2.027 1.00 0.00 H new ATOM 0 HD22 LEU C 70 3.226 4.841 2.621 1.00 0.00 H new ATOM 0 HD23 LEU C 70 1.516 5.300 2.438 1.00 0.00 H new ATOM 2911 N SER C 71 5.730 5.080 1.232 1.00 0.00 N ATOM 2912 CA SER C 71 6.420 3.828 1.652 1.00 0.00 C ATOM 2913 C SER C 71 7.700 4.184 2.395 1.00 0.00 C ATOM 2914 O SER C 71 8.121 3.497 3.305 1.00 0.00 O ATOM 2915 CB SER C 71 6.737 3.091 0.352 1.00 0.00 C ATOM 2916 OG SER C 71 7.028 1.731 0.643 1.00 0.00 O ATOM 0 H SER C 71 6.007 5.444 0.320 1.00 0.00 H new ATOM 0 HA SER C 71 5.814 3.215 2.320 1.00 0.00 H new ATOM 0 HB2 SER C 71 5.891 3.156 -0.332 1.00 0.00 H new ATOM 0 HB3 SER C 71 7.586 3.558 -0.147 1.00 0.00 H new ATOM 0 HG SER C 71 7.230 1.254 -0.189 1.00 0.00 H new ATOM 2922 N LYS C 72 8.317 5.264 2.016 1.00 0.00 N ATOM 2923 CA LYS C 72 9.572 5.683 2.705 1.00 0.00 C ATOM 2924 C LYS C 72 9.321 5.790 4.209 1.00 0.00 C ATOM 2925 O LYS C 72 9.844 5.025 4.994 1.00 0.00 O ATOM 2926 CB LYS C 72 9.918 7.050 2.114 1.00 0.00 C ATOM 2927 CG LYS C 72 11.412 7.103 1.788 1.00 0.00 C ATOM 2928 CD LYS C 72 11.792 5.896 0.928 1.00 0.00 C ATOM 2929 CE LYS C 72 12.317 6.378 -0.426 1.00 0.00 C ATOM 2930 NZ LYS C 72 13.781 6.103 -0.390 1.00 0.00 N ATOM 0 H LYS C 72 8.010 5.876 1.260 1.00 0.00 H new ATOM 0 HA LYS C 72 10.385 4.970 2.564 1.00 0.00 H new ATOM 0 HB2 LYS C 72 9.332 7.227 1.212 1.00 0.00 H new ATOM 0 HB3 LYS C 72 9.661 7.839 2.821 1.00 0.00 H new ATOM 0 HG2 LYS C 72 11.647 8.027 1.260 1.00 0.00 H new ATOM 0 HG3 LYS C 72 11.996 7.105 2.709 1.00 0.00 H new ATOM 0 HD2 LYS C 72 12.552 5.301 1.434 1.00 0.00 H new ATOM 0 HD3 LYS C 72 10.925 5.251 0.785 1.00 0.00 H new ATOM 0 HE2 LYS C 72 11.836 5.848 -1.248 1.00 0.00 H new ATOM 0 HE3 LYS C 72 12.118 7.440 -0.572 1.00 0.00 H new ATOM 0 HZ1 LYS C 72 14.273 6.760 -1.028 1.00 0.00 H new ATOM 0 HZ2 LYS C 72 14.135 6.232 0.579 1.00 0.00 H new ATOM 0 HZ3 LYS C 72 13.958 5.125 -0.696 1.00 0.00 H new ATOM 2944 N VAL C 73 8.511 6.725 4.609 1.00 0.00 N ATOM 2945 CA VAL C 73 8.208 6.879 6.064 1.00 0.00 C ATOM 2946 C VAL C 73 7.538 5.606 6.582 1.00 0.00 C ATOM 2947 O VAL C 73 7.734 5.202 7.711 1.00 0.00 O ATOM 2948 CB VAL C 73 7.257 8.086 6.203 1.00 0.00 C ATOM 2949 CG1 VAL C 73 6.505 8.357 4.896 1.00 0.00 C ATOM 2950 CG2 VAL C 73 6.235 7.800 7.304 1.00 0.00 C ATOM 0 H VAL C 73 8.043 7.392 3.995 1.00 0.00 H new ATOM 0 HA VAL C 73 9.116 7.042 6.645 1.00 0.00 H new ATOM 0 HB VAL C 73 7.857 8.962 6.450 1.00 0.00 H new ATOM 0 HG11 VAL C 73 5.844 9.213 5.028 1.00 0.00 H new ATOM 0 HG12 VAL C 73 7.221 8.570 4.102 1.00 0.00 H new ATOM 0 HG13 VAL C 73 5.915 7.481 4.627 1.00 0.00 H new ATOM 0 HG21 VAL C 73 5.561 8.651 7.405 1.00 0.00 H new ATOM 0 HG22 VAL C 73 5.660 6.911 7.045 1.00 0.00 H new ATOM 0 HG23 VAL C 73 6.754 7.634 8.248 1.00 0.00 H new ATOM 2960 N CYS C 74 6.740 4.975 5.767 1.00 0.00 N ATOM 2961 CA CYS C 74 6.051 3.735 6.215 1.00 0.00 C ATOM 2962 C CYS C 74 7.084 2.702 6.667 1.00 0.00 C ATOM 2963 O CYS C 74 6.855 1.936 7.583 1.00 0.00 O ATOM 2964 CB CYS C 74 5.289 3.235 4.986 1.00 0.00 C ATOM 2965 SG CYS C 74 3.536 3.655 5.151 1.00 0.00 S ATOM 0 H CYS C 74 6.536 5.265 4.811 1.00 0.00 H new ATOM 0 HA CYS C 74 5.383 3.911 7.058 1.00 0.00 H new ATOM 0 HB2 CYS C 74 5.699 3.686 4.082 1.00 0.00 H new ATOM 0 HB3 CYS C 74 5.408 2.156 4.885 1.00 0.00 H new ATOM 0 HG CYS C 74 3.306 4.794 4.568 1.00 0.00 H new ATOM 2971 N MET C 75 8.227 2.674 6.041 1.00 0.00 N ATOM 2972 CA MET C 75 9.263 1.692 6.456 1.00 0.00 C ATOM 2973 C MET C 75 9.624 1.931 7.920 1.00 0.00 C ATOM 2974 O MET C 75 9.828 1.002 8.677 1.00 0.00 O ATOM 2975 CB MET C 75 10.463 1.960 5.546 1.00 0.00 C ATOM 2976 CG MET C 75 10.295 1.186 4.238 1.00 0.00 C ATOM 2977 SD MET C 75 11.366 -0.273 4.257 1.00 0.00 S ATOM 2978 CE MET C 75 10.064 -1.513 4.051 1.00 0.00 C ATOM 0 H MET C 75 8.486 3.284 5.266 1.00 0.00 H new ATOM 0 HA MET C 75 8.926 0.659 6.368 1.00 0.00 H new ATOM 0 HB2 MET C 75 10.546 3.027 5.341 1.00 0.00 H new ATOM 0 HB3 MET C 75 11.385 1.658 6.044 1.00 0.00 H new ATOM 0 HG2 MET C 75 9.255 0.885 4.112 1.00 0.00 H new ATOM 0 HG3 MET C 75 10.547 1.824 3.391 1.00 0.00 H new ATOM 0 HE1 MET C 75 10.508 -2.508 4.035 1.00 0.00 H new ATOM 0 HE2 MET C 75 9.360 -1.443 4.880 1.00 0.00 H new ATOM 0 HE3 MET C 75 9.538 -1.336 3.113 1.00 0.00 H new ATOM 2988 N TYR C 76 9.682 3.166 8.337 1.00 0.00 N ATOM 2989 CA TYR C 76 10.001 3.439 9.764 1.00 0.00 C ATOM 2990 C TYR C 76 8.791 3.060 10.617 1.00 0.00 C ATOM 2991 O TYR C 76 8.907 2.791 11.796 1.00 0.00 O ATOM 2992 CB TYR C 76 10.288 4.942 9.855 1.00 0.00 C ATOM 2993 CG TYR C 76 11.596 5.169 10.588 1.00 0.00 C ATOM 2994 CD1 TYR C 76 12.094 4.192 11.462 1.00 0.00 C ATOM 2995 CD2 TYR C 76 12.314 6.357 10.390 1.00 0.00 C ATOM 2996 CE1 TYR C 76 13.306 4.401 12.132 1.00 0.00 C ATOM 2997 CE2 TYR C 76 13.525 6.565 11.062 1.00 0.00 C ATOM 2998 CZ TYR C 76 14.021 5.587 11.930 1.00 0.00 C ATOM 2999 OH TYR C 76 15.216 5.792 12.591 1.00 0.00 O ATOM 0 H TYR C 76 9.524 3.990 7.757 1.00 0.00 H new ATOM 0 HA TYR C 76 10.856 2.866 10.121 1.00 0.00 H new ATOM 0 HB2 TYR C 76 10.341 5.373 8.855 1.00 0.00 H new ATOM 0 HB3 TYR C 76 9.475 5.446 10.377 1.00 0.00 H new ATOM 0 HD1 TYR C 76 11.542 3.277 11.619 1.00 0.00 H new ATOM 0 HD2 TYR C 76 11.933 7.112 9.719 1.00 0.00 H new ATOM 0 HE1 TYR C 76 13.689 3.647 12.804 1.00 0.00 H new ATOM 0 HE2 TYR C 76 14.076 7.481 10.910 1.00 0.00 H new ATOM 0 HH TYR C 76 15.584 6.665 12.339 1.00 0.00 H new ATOM 3009 N PHE C 77 7.624 3.017 10.022 1.00 0.00 N ATOM 3010 CA PHE C 77 6.411 2.631 10.800 1.00 0.00 C ATOM 3011 C PHE C 77 6.556 1.176 11.242 1.00 0.00 C ATOM 3012 O PHE C 77 6.132 0.793 12.314 1.00 0.00 O ATOM 3013 CB PHE C 77 5.235 2.760 9.826 1.00 0.00 C ATOM 3014 CG PHE C 77 4.583 4.125 9.922 1.00 0.00 C ATOM 3015 CD1 PHE C 77 5.008 5.068 10.873 1.00 0.00 C ATOM 3016 CD2 PHE C 77 3.547 4.450 9.033 1.00 0.00 C ATOM 3017 CE1 PHE C 77 4.397 6.328 10.926 1.00 0.00 C ATOM 3018 CE2 PHE C 77 2.939 5.706 9.093 1.00 0.00 C ATOM 3019 CZ PHE C 77 3.363 6.646 10.036 1.00 0.00 C ATOM 0 H PHE C 77 7.462 3.231 9.038 1.00 0.00 H new ATOM 0 HA PHE C 77 6.268 3.252 11.684 1.00 0.00 H new ATOM 0 HB2 PHE C 77 5.585 2.593 8.807 1.00 0.00 H new ATOM 0 HB3 PHE C 77 4.497 1.987 10.040 1.00 0.00 H new ATOM 0 HD1 PHE C 77 5.803 4.822 11.561 1.00 0.00 H new ATOM 0 HD2 PHE C 77 3.219 3.727 8.301 1.00 0.00 H new ATOM 0 HE1 PHE C 77 4.724 7.055 11.654 1.00 0.00 H new ATOM 0 HE2 PHE C 77 2.140 5.951 8.409 1.00 0.00 H new ATOM 0 HZ PHE C 77 2.894 7.618 10.079 1.00 0.00 H new ATOM 3029 N THR C 78 7.169 0.366 10.421 1.00 0.00 N ATOM 3030 CA THR C 78 7.362 -1.063 10.792 1.00 0.00 C ATOM 3031 C THR C 78 8.745 -1.237 11.417 1.00 0.00 C ATOM 3032 O THR C 78 8.935 -2.016 12.330 1.00 0.00 O ATOM 3033 CB THR C 78 7.264 -1.839 9.477 1.00 0.00 C ATOM 3034 OG1 THR C 78 6.876 -0.957 8.434 1.00 0.00 O ATOM 3035 CG2 THR C 78 6.227 -2.955 9.618 1.00 0.00 C ATOM 0 H THR C 78 7.544 0.633 9.511 1.00 0.00 H new ATOM 0 HA THR C 78 6.626 -1.413 11.516 1.00 0.00 H new ATOM 0 HB THR C 78 8.234 -2.275 9.240 1.00 0.00 H new ATOM 0 HG1 THR C 78 5.899 -0.880 8.417 1.00 0.00 H new ATOM 0 HG21 THR C 78 6.157 -3.508 8.681 1.00 0.00 H new ATOM 0 HG22 THR C 78 6.528 -3.632 10.417 1.00 0.00 H new ATOM 0 HG23 THR C 78 5.256 -2.521 9.856 1.00 0.00 H new ATOM 3043 N TYR C 79 9.708 -0.502 10.937 1.00 0.00 N ATOM 3044 CA TYR C 79 11.080 -0.604 11.506 1.00 0.00 C ATOM 3045 C TYR C 79 11.064 -0.134 12.961 1.00 0.00 C ATOM 3046 O TYR C 79 11.755 -0.669 13.805 1.00 0.00 O ATOM 3047 CB TYR C 79 11.932 0.329 10.646 1.00 0.00 C ATOM 3048 CG TYR C 79 13.382 -0.083 10.733 1.00 0.00 C ATOM 3049 CD1 TYR C 79 13.862 -1.127 9.932 1.00 0.00 C ATOM 3050 CD2 TYR C 79 14.248 0.580 11.611 1.00 0.00 C ATOM 3051 CE1 TYR C 79 15.207 -1.508 10.009 1.00 0.00 C ATOM 3052 CE2 TYR C 79 15.594 0.200 11.688 1.00 0.00 C ATOM 3053 CZ TYR C 79 16.073 -0.844 10.887 1.00 0.00 C ATOM 3054 OH TYR C 79 17.398 -1.219 10.963 1.00 0.00 O ATOM 0 H TYR C 79 9.604 0.166 10.174 1.00 0.00 H new ATOM 0 HA TYR C 79 11.467 -1.623 11.499 1.00 0.00 H new ATOM 0 HB2 TYR C 79 11.595 0.293 9.610 1.00 0.00 H new ATOM 0 HB3 TYR C 79 11.815 1.359 10.984 1.00 0.00 H new ATOM 0 HD1 TYR C 79 13.194 -1.638 9.255 1.00 0.00 H new ATOM 0 HD2 TYR C 79 13.878 1.385 12.229 1.00 0.00 H new ATOM 0 HE1 TYR C 79 15.577 -2.313 9.392 1.00 0.00 H new ATOM 0 HE2 TYR C 79 16.262 0.712 12.365 1.00 0.00 H new ATOM 0 HH TYR C 79 17.505 -1.904 11.656 1.00 0.00 H new ATOM 3064 N LYS C 80 10.274 0.863 13.261 1.00 0.00 N ATOM 3065 CA LYS C 80 10.210 1.366 14.662 1.00 0.00 C ATOM 3066 C LYS C 80 9.527 0.334 15.563 1.00 0.00 C ATOM 3067 O LYS C 80 9.862 0.191 16.722 1.00 0.00 O ATOM 3068 CB LYS C 80 9.378 2.647 14.585 1.00 0.00 C ATOM 3069 CG LYS C 80 9.552 3.448 15.878 1.00 0.00 C ATOM 3070 CD LYS C 80 8.303 4.296 16.127 1.00 0.00 C ATOM 3071 CE LYS C 80 8.657 5.469 17.044 1.00 0.00 C ATOM 3072 NZ LYS C 80 8.830 6.633 16.129 1.00 0.00 N ATOM 0 H LYS C 80 9.672 1.349 12.597 1.00 0.00 H new ATOM 0 HA LYS C 80 11.199 1.548 15.082 1.00 0.00 H new ATOM 0 HB2 LYS C 80 9.691 3.245 13.729 1.00 0.00 H new ATOM 0 HB3 LYS C 80 8.327 2.402 14.435 1.00 0.00 H new ATOM 0 HG2 LYS C 80 9.719 2.772 16.717 1.00 0.00 H new ATOM 0 HG3 LYS C 80 10.431 4.089 15.806 1.00 0.00 H new ATOM 0 HD2 LYS C 80 7.907 4.666 15.181 1.00 0.00 H new ATOM 0 HD3 LYS C 80 7.522 3.687 16.583 1.00 0.00 H new ATOM 0 HE2 LYS C 80 7.867 5.653 17.772 1.00 0.00 H new ATOM 0 HE3 LYS C 80 9.569 5.270 17.606 1.00 0.00 H new ATOM 0 HZ1 LYS C 80 9.416 7.355 16.593 1.00 0.00 H new ATOM 0 HZ2 LYS C 80 9.295 6.320 15.253 1.00 0.00 H new ATOM 0 HZ3 LYS C 80 7.899 7.037 15.901 1.00 0.00 H new ATOM 3086 N VAL C 81 8.568 -0.381 15.042 1.00 0.00 N ATOM 3087 CA VAL C 81 7.860 -1.398 15.874 1.00 0.00 C ATOM 3088 C VAL C 81 8.837 -2.470 16.363 1.00 0.00 C ATOM 3089 O VAL C 81 8.731 -2.959 17.470 1.00 0.00 O ATOM 3090 CB VAL C 81 6.815 -2.010 14.942 1.00 0.00 C ATOM 3091 CG1 VAL C 81 6.132 -3.186 15.642 1.00 0.00 C ATOM 3092 CG2 VAL C 81 5.768 -0.952 14.587 1.00 0.00 C ATOM 0 H VAL C 81 8.244 -0.306 14.078 1.00 0.00 H new ATOM 0 HA VAL C 81 7.410 -0.958 16.764 1.00 0.00 H new ATOM 0 HB VAL C 81 7.302 -2.362 14.032 1.00 0.00 H new ATOM 0 HG11 VAL C 81 5.387 -3.622 14.977 1.00 0.00 H new ATOM 0 HG12 VAL C 81 6.877 -3.940 15.897 1.00 0.00 H new ATOM 0 HG13 VAL C 81 5.645 -2.835 16.552 1.00 0.00 H new ATOM 0 HG21 VAL C 81 5.022 -1.387 13.922 1.00 0.00 H new ATOM 0 HG22 VAL C 81 5.282 -0.601 15.497 1.00 0.00 H new ATOM 0 HG23 VAL C 81 6.253 -0.113 14.088 1.00 0.00 H new ATOM 3102 N ARG C 82 9.787 -2.843 15.550 1.00 0.00 N ATOM 3103 CA ARG C 82 10.762 -3.887 15.977 1.00 0.00 C ATOM 3104 C ARG C 82 11.977 -3.240 16.641 1.00 0.00 C ATOM 3105 O ARG C 82 12.719 -3.881 17.360 1.00 0.00 O ATOM 3106 CB ARG C 82 11.169 -4.603 14.689 1.00 0.00 C ATOM 3107 CG ARG C 82 11.063 -6.116 14.889 1.00 0.00 C ATOM 3108 CD ARG C 82 10.935 -6.804 13.528 1.00 0.00 C ATOM 3109 NE ARG C 82 11.821 -7.998 13.616 1.00 0.00 N ATOM 3110 CZ ARG C 82 13.118 -7.854 13.583 1.00 0.00 C ATOM 3111 NH1 ARG C 82 13.642 -6.662 13.476 1.00 0.00 N ATOM 3112 NH2 ARG C 82 13.892 -8.902 13.657 1.00 0.00 N ATOM 0 H ARG C 82 9.930 -2.471 14.611 1.00 0.00 H new ATOM 0 HA ARG C 82 10.334 -4.575 16.706 1.00 0.00 H new ATOM 0 HB2 ARG C 82 10.526 -4.288 13.867 1.00 0.00 H new ATOM 0 HB3 ARG C 82 12.189 -4.332 14.417 1.00 0.00 H new ATOM 0 HG2 ARG C 82 11.943 -6.486 15.414 1.00 0.00 H new ATOM 0 HG3 ARG C 82 10.199 -6.352 15.510 1.00 0.00 H new ATOM 0 HD2 ARG C 82 9.903 -7.092 13.327 1.00 0.00 H new ATOM 0 HD3 ARG C 82 11.245 -6.141 12.720 1.00 0.00 H new ATOM 0 HE ARG C 82 11.414 -8.929 13.702 1.00 0.00 H new ATOM 0 HH11 ARG C 82 13.037 -5.842 13.418 1.00 0.00 H new ATOM 0 HH12 ARG C 82 14.656 -6.551 13.450 1.00 0.00 H new ATOM 0 HH21 ARG C 82 13.483 -9.833 13.741 1.00 0.00 H new ATOM 0 HH22 ARG C 82 14.906 -8.790 13.631 1.00 0.00 H new ATOM 3126 N TYR C 83 12.188 -1.974 16.411 1.00 0.00 N ATOM 3127 CA TYR C 83 13.355 -1.292 17.036 1.00 0.00 C ATOM 3128 C TYR C 83 12.909 -0.530 18.286 1.00 0.00 C ATOM 3129 O TYR C 83 13.715 -0.139 19.107 1.00 0.00 O ATOM 3130 CB TYR C 83 13.876 -0.332 15.969 1.00 0.00 C ATOM 3131 CG TYR C 83 14.963 -1.013 15.173 1.00 0.00 C ATOM 3132 CD1 TYR C 83 16.286 -0.993 15.632 1.00 0.00 C ATOM 3133 CD2 TYR C 83 14.647 -1.669 13.977 1.00 0.00 C ATOM 3134 CE1 TYR C 83 17.292 -1.627 14.894 1.00 0.00 C ATOM 3135 CE2 TYR C 83 15.654 -2.304 13.239 1.00 0.00 C ATOM 3136 CZ TYR C 83 16.977 -2.283 13.698 1.00 0.00 C ATOM 3137 OH TYR C 83 17.970 -2.909 12.972 1.00 0.00 O ATOM 0 H TYR C 83 11.604 -1.383 15.819 1.00 0.00 H new ATOM 0 HA TYR C 83 14.126 -1.994 17.353 1.00 0.00 H new ATOM 0 HB2 TYR C 83 13.063 -0.027 15.310 1.00 0.00 H new ATOM 0 HB3 TYR C 83 14.264 0.573 16.436 1.00 0.00 H new ATOM 0 HD1 TYR C 83 16.530 -0.488 16.555 1.00 0.00 H new ATOM 0 HD2 TYR C 83 13.627 -1.685 13.623 1.00 0.00 H new ATOM 0 HE1 TYR C 83 18.312 -1.610 15.247 1.00 0.00 H new ATOM 0 HE2 TYR C 83 15.410 -2.810 12.316 1.00 0.00 H new ATOM 0 HH TYR C 83 17.590 -3.672 12.488 1.00 0.00 H new ATOM 3274 N PHE C 93 17.447 5.354 8.974 1.00 0.00 N ATOM 3275 CA PHE C 93 17.079 5.372 7.529 1.00 0.00 C ATOM 3276 C PHE C 93 18.063 6.240 6.740 1.00 0.00 C ATOM 3277 O PHE C 93 18.490 7.277 7.206 1.00 0.00 O ATOM 3278 CB PHE C 93 15.679 5.985 7.490 1.00 0.00 C ATOM 3279 CG PHE C 93 14.764 5.103 6.678 1.00 0.00 C ATOM 3280 CD1 PHE C 93 14.703 3.730 6.941 1.00 0.00 C ATOM 3281 CD2 PHE C 93 13.977 5.658 5.663 1.00 0.00 C ATOM 3282 CE1 PHE C 93 13.854 2.911 6.188 1.00 0.00 C ATOM 3283 CE2 PHE C 93 13.128 4.839 4.910 1.00 0.00 C ATOM 3284 CZ PHE C 93 13.066 3.465 5.172 1.00 0.00 C ATOM 0 HA PHE C 93 17.106 4.378 7.084 1.00 0.00 H new ATOM 0 HB2 PHE C 93 15.291 6.095 8.503 1.00 0.00 H new ATOM 0 HB3 PHE C 93 15.720 6.983 7.054 1.00 0.00 H new ATOM 0 HD1 PHE C 93 15.311 3.303 7.725 1.00 0.00 H new ATOM 0 HD2 PHE C 93 14.025 6.718 5.461 1.00 0.00 H new ATOM 0 HE1 PHE C 93 13.807 1.851 6.391 1.00 0.00 H new ATOM 0 HE2 PHE C 93 12.520 5.267 4.126 1.00 0.00 H new ATOM 0 HZ PHE C 93 12.411 2.833 4.591 1.00 0.00 H new ATOM 3294 N PRO C 94 18.388 5.781 5.563 1.00 0.00 N ATOM 3295 CA PRO C 94 19.331 6.520 4.689 1.00 0.00 C ATOM 3296 C PRO C 94 18.648 7.751 4.083 1.00 0.00 C ATOM 3297 O PRO C 94 17.451 7.769 3.877 1.00 0.00 O ATOM 3298 CB PRO C 94 19.681 5.506 3.603 1.00 0.00 C ATOM 3299 CG PRO C 94 18.521 4.562 3.562 1.00 0.00 C ATOM 3300 CD PRO C 94 17.913 4.540 4.941 1.00 0.00 C ATOM 0 HA PRO C 94 20.207 6.890 5.221 1.00 0.00 H new ATOM 0 HB2 PRO C 94 19.826 5.995 2.639 1.00 0.00 H new ATOM 0 HB3 PRO C 94 20.608 4.982 3.837 1.00 0.00 H new ATOM 0 HG2 PRO C 94 17.788 4.886 2.824 1.00 0.00 H new ATOM 0 HG3 PRO C 94 18.848 3.564 3.270 1.00 0.00 H new ATOM 0 HD2 PRO C 94 16.824 4.508 4.896 1.00 0.00 H new ATOM 0 HD3 PRO C 94 18.234 3.664 5.504 1.00 0.00 H new ATOM 3308 N ILE C 95 19.400 8.777 3.795 1.00 0.00 N ATOM 3309 CA ILE C 95 18.795 10.005 3.201 1.00 0.00 C ATOM 3310 C ILE C 95 19.632 10.478 2.010 1.00 0.00 C ATOM 3311 O ILE C 95 20.846 10.495 2.059 1.00 0.00 O ATOM 3312 CB ILE C 95 18.819 11.043 4.323 1.00 0.00 C ATOM 3313 CG1 ILE C 95 18.328 10.399 5.622 1.00 0.00 C ATOM 3314 CG2 ILE C 95 17.902 12.211 3.957 1.00 0.00 C ATOM 3315 CD1 ILE C 95 16.923 9.831 5.411 1.00 0.00 C ATOM 0 H ILE C 95 20.408 8.819 3.945 1.00 0.00 H new ATOM 0 HA ILE C 95 17.784 9.833 2.831 1.00 0.00 H new ATOM 0 HB ILE C 95 19.837 11.408 4.459 1.00 0.00 H new ATOM 0 HG12 ILE C 95 19.010 9.606 5.928 1.00 0.00 H new ATOM 0 HG13 ILE C 95 18.317 11.137 6.424 1.00 0.00 H new ATOM 0 HG21 ILE C 95 17.919 12.951 4.757 1.00 0.00 H new ATOM 0 HG22 ILE C 95 18.249 12.669 3.031 1.00 0.00 H new ATOM 0 HG23 ILE C 95 16.884 11.846 3.822 1.00 0.00 H new ATOM 0 HD11 ILE C 95 16.573 9.372 6.336 1.00 0.00 H new ATOM 0 HD12 ILE C 95 16.245 10.635 5.125 1.00 0.00 H new ATOM 0 HD13 ILE C 95 16.949 9.080 4.621 1.00 0.00 H new ATOM 3327 N ALA C 96 18.993 10.856 0.936 1.00 0.00 N ATOM 3328 CA ALA C 96 19.755 11.320 -0.260 1.00 0.00 C ATOM 3329 C ALA C 96 18.944 12.358 -1.040 1.00 0.00 C ATOM 3330 O ALA C 96 17.788 12.590 -0.748 1.00 0.00 O ATOM 3331 CB ALA C 96 19.952 10.061 -1.103 1.00 0.00 C ATOM 0 H ALA C 96 17.978 10.864 0.835 1.00 0.00 H new ATOM 0 HA ALA C 96 20.699 11.793 0.009 1.00 0.00 H new ATOM 0 HB1 ALA C 96 20.507 10.312 -2.007 1.00 0.00 H new ATOM 0 HB2 ALA C 96 20.510 9.322 -0.528 1.00 0.00 H new ATOM 0 HB3 ALA C 96 18.980 9.650 -1.376 1.00 0.00 H new ATOM 3337 N PRO C 97 19.582 12.943 -2.019 1.00 0.00 N ATOM 3338 CA PRO C 97 18.910 13.960 -2.864 1.00 0.00 C ATOM 3339 C PRO C 97 17.902 13.278 -3.790 1.00 0.00 C ATOM 3340 O PRO C 97 18.170 13.036 -4.950 1.00 0.00 O ATOM 3341 CB PRO C 97 20.055 14.583 -3.658 1.00 0.00 C ATOM 3342 CG PRO C 97 21.121 13.533 -3.686 1.00 0.00 C ATOM 3343 CD PRO C 97 20.972 12.715 -2.429 1.00 0.00 C ATOM 0 HA PRO C 97 18.352 14.702 -2.294 1.00 0.00 H new ATOM 0 HB2 PRO C 97 19.737 14.850 -4.666 1.00 0.00 H new ATOM 0 HB3 PRO C 97 20.413 15.497 -3.184 1.00 0.00 H new ATOM 0 HG2 PRO C 97 21.018 12.903 -4.570 1.00 0.00 H new ATOM 0 HG3 PRO C 97 22.110 13.989 -3.733 1.00 0.00 H new ATOM 0 HD2 PRO C 97 21.165 11.658 -2.615 1.00 0.00 H new ATOM 0 HD3 PRO C 97 21.673 13.036 -1.659 1.00 0.00 H new ATOM 3351 N GLU C 98 16.746 12.957 -3.279 1.00 0.00 N ATOM 3352 CA GLU C 98 15.713 12.281 -4.107 1.00 0.00 C ATOM 3353 C GLU C 98 14.569 11.899 -3.185 1.00 0.00 C ATOM 3354 O GLU C 98 13.411 11.911 -3.554 1.00 0.00 O ATOM 3355 CB GLU C 98 16.396 11.036 -4.677 1.00 0.00 C ATOM 3356 CG GLU C 98 16.140 10.959 -6.184 1.00 0.00 C ATOM 3357 CD GLU C 98 17.280 11.652 -6.932 1.00 0.00 C ATOM 3358 OE1 GLU C 98 18.416 11.247 -6.748 1.00 0.00 O ATOM 3359 OE2 GLU C 98 16.998 12.577 -7.676 1.00 0.00 O ATOM 0 H GLU C 98 16.472 13.137 -2.313 1.00 0.00 H new ATOM 0 HA GLU C 98 15.319 12.902 -4.912 1.00 0.00 H new ATOM 0 HB2 GLU C 98 17.468 11.074 -4.481 1.00 0.00 H new ATOM 0 HB3 GLU C 98 16.013 10.141 -4.186 1.00 0.00 H new ATOM 0 HG2 GLU C 98 16.065 9.918 -6.498 1.00 0.00 H new ATOM 0 HG3 GLU C 98 15.190 11.434 -6.427 1.00 0.00 H new ATOM 3366 N ILE C 99 14.902 11.599 -1.964 1.00 0.00 N ATOM 3367 CA ILE C 99 13.869 11.259 -0.965 1.00 0.00 C ATOM 3368 C ILE C 99 14.300 11.833 0.382 1.00 0.00 C ATOM 3369 O ILE C 99 15.454 11.772 0.750 1.00 0.00 O ATOM 3370 CB ILE C 99 13.829 9.728 -0.929 1.00 0.00 C ATOM 3371 CG1 ILE C 99 12.773 9.227 -1.917 1.00 0.00 C ATOM 3372 CG2 ILE C 99 13.473 9.249 0.480 1.00 0.00 C ATOM 3373 CD1 ILE C 99 11.374 9.516 -1.362 1.00 0.00 C ATOM 0 H ILE C 99 15.860 11.576 -1.616 1.00 0.00 H new ATOM 0 HA ILE C 99 12.885 11.664 -1.201 1.00 0.00 H new ATOM 0 HB ILE C 99 14.808 9.336 -1.204 1.00 0.00 H new ATOM 0 HG12 ILE C 99 12.901 9.717 -2.882 1.00 0.00 H new ATOM 0 HG13 ILE C 99 12.895 8.157 -2.084 1.00 0.00 H new ATOM 0 HG21 ILE C 99 13.446 8.159 0.498 1.00 0.00 H new ATOM 0 HG22 ILE C 99 14.223 9.605 1.186 1.00 0.00 H new ATOM 0 HG23 ILE C 99 12.495 9.640 0.761 1.00 0.00 H new ATOM 0 HD11 ILE C 99 10.622 9.159 -2.066 1.00 0.00 H new ATOM 0 HD12 ILE C 99 11.249 9.005 -0.407 1.00 0.00 H new ATOM 0 HD13 ILE C 99 11.255 10.590 -1.217 1.00 0.00 H new ATOM 3385 N ALA C 100 13.368 12.395 1.094 1.00 0.00 N ATOM 3386 CA ALA C 100 13.644 13.018 2.430 1.00 0.00 C ATOM 3387 C ALA C 100 13.117 14.451 2.422 1.00 0.00 C ATOM 3388 O ALA C 100 12.542 14.922 3.384 1.00 0.00 O ATOM 3389 CB ALA C 100 15.164 13.022 2.623 1.00 0.00 C ATOM 0 H ALA C 100 12.393 12.454 0.801 1.00 0.00 H new ATOM 0 HA ALA C 100 13.159 12.468 3.236 1.00 0.00 H new ATOM 0 HB1 ALA C 100 15.407 13.469 3.587 1.00 0.00 H new ATOM 0 HB2 ALA C 100 15.537 11.998 2.593 1.00 0.00 H new ATOM 0 HB3 ALA C 100 15.630 13.602 1.826 1.00 0.00 H new ATOM 3395 N LEU C 101 13.304 15.146 1.332 1.00 0.00 N ATOM 3396 CA LEU C 101 12.808 16.550 1.249 1.00 0.00 C ATOM 3397 C LEU C 101 11.298 16.590 1.504 1.00 0.00 C ATOM 3398 O LEU C 101 10.810 17.392 2.275 1.00 0.00 O ATOM 3399 CB LEU C 101 13.133 17.010 -0.175 1.00 0.00 C ATOM 3400 CG LEU C 101 12.714 15.935 -1.180 1.00 0.00 C ATOM 3401 CD1 LEU C 101 11.474 16.403 -1.943 1.00 0.00 C ATOM 3402 CD2 LEU C 101 13.856 15.695 -2.169 1.00 0.00 C ATOM 0 H LEU C 101 13.778 14.803 0.497 1.00 0.00 H new ATOM 0 HA LEU C 101 13.272 17.197 1.994 1.00 0.00 H new ATOM 0 HB2 LEU C 101 12.615 17.944 -0.392 1.00 0.00 H new ATOM 0 HB3 LEU C 101 14.201 17.209 -0.267 1.00 0.00 H new ATOM 0 HG LEU C 101 12.486 15.010 -0.650 1.00 0.00 H new ATOM 0 HD11 LEU C 101 11.176 15.637 -2.659 1.00 0.00 H new ATOM 0 HD12 LEU C 101 10.660 16.579 -1.240 1.00 0.00 H new ATOM 0 HD13 LEU C 101 11.701 17.327 -2.475 1.00 0.00 H new ATOM 0 HD21 LEU C 101 13.561 14.929 -2.887 1.00 0.00 H new ATOM 0 HD22 LEU C 101 14.080 16.621 -2.698 1.00 0.00 H new ATOM 0 HD23 LEU C 101 14.742 15.363 -1.628 1.00 0.00 H new ATOM 3414 N GLU C 102 10.553 15.727 0.866 1.00 0.00 N ATOM 3415 CA GLU C 102 9.077 15.715 1.078 1.00 0.00 C ATOM 3416 C GLU C 102 8.759 15.208 2.488 1.00 0.00 C ATOM 3417 O GLU C 102 7.825 15.655 3.124 1.00 0.00 O ATOM 3418 CB GLU C 102 8.532 14.751 0.023 1.00 0.00 C ATOM 3419 CG GLU C 102 8.017 15.546 -1.177 1.00 0.00 C ATOM 3420 CD GLU C 102 6.618 16.083 -0.873 1.00 0.00 C ATOM 3421 OE1 GLU C 102 6.361 16.397 0.278 1.00 0.00 O ATOM 3422 OE2 GLU C 102 5.825 16.171 -1.796 1.00 0.00 O ATOM 0 H GLU C 102 10.903 15.031 0.208 1.00 0.00 H new ATOM 0 HA GLU C 102 8.634 16.707 0.986 1.00 0.00 H new ATOM 0 HB2 GLU C 102 9.314 14.061 -0.293 1.00 0.00 H new ATOM 0 HB3 GLU C 102 7.728 14.149 0.446 1.00 0.00 H new ATOM 0 HG2 GLU C 102 8.694 16.371 -1.397 1.00 0.00 H new ATOM 0 HG3 GLU C 102 7.989 14.911 -2.062 1.00 0.00 H new ATOM 3429 N LEU C 103 9.533 14.279 2.977 1.00 0.00 N ATOM 3430 CA LEU C 103 9.286 13.740 4.343 1.00 0.00 C ATOM 3431 C LEU C 103 9.400 14.862 5.378 1.00 0.00 C ATOM 3432 O LEU C 103 8.826 14.795 6.446 1.00 0.00 O ATOM 3433 CB LEU C 103 10.393 12.703 4.555 1.00 0.00 C ATOM 3434 CG LEU C 103 10.074 11.408 3.789 1.00 0.00 C ATOM 3435 CD1 LEU C 103 9.038 11.670 2.693 1.00 0.00 C ATOM 3436 CD2 LEU C 103 11.356 10.874 3.146 1.00 0.00 C ATOM 0 H LEU C 103 10.328 13.869 2.487 1.00 0.00 H new ATOM 0 HA LEU C 103 8.291 13.308 4.449 1.00 0.00 H new ATOM 0 HB2 LEU C 103 11.347 13.107 4.216 1.00 0.00 H new ATOM 0 HB3 LEU C 103 10.498 12.487 5.618 1.00 0.00 H new ATOM 0 HG LEU C 103 9.669 10.678 4.490 1.00 0.00 H new ATOM 0 HD11 LEU C 103 8.826 10.741 2.163 1.00 0.00 H new ATOM 0 HD12 LEU C 103 8.120 12.048 3.143 1.00 0.00 H new ATOM 0 HD13 LEU C 103 9.429 12.407 1.992 1.00 0.00 H new ATOM 0 HD21 LEU C 103 11.135 9.956 2.602 1.00 0.00 H new ATOM 0 HD22 LEU C 103 11.754 11.618 2.456 1.00 0.00 H new ATOM 0 HD23 LEU C 103 12.093 10.667 3.922 1.00 0.00 H new ATOM 3448 N LEU C 104 10.135 15.894 5.068 1.00 0.00 N ATOM 3449 CA LEU C 104 10.281 17.020 6.036 1.00 0.00 C ATOM 3450 C LEU C 104 8.919 17.381 6.633 1.00 0.00 C ATOM 3451 O LEU C 104 8.704 17.272 7.824 1.00 0.00 O ATOM 3452 CB LEU C 104 10.830 18.184 5.209 1.00 0.00 C ATOM 3453 CG LEU C 104 11.316 19.291 6.146 1.00 0.00 C ATOM 3454 CD1 LEU C 104 12.608 19.896 5.595 1.00 0.00 C ATOM 3455 CD2 LEU C 104 10.244 20.381 6.243 1.00 0.00 C ATOM 0 H LEU C 104 10.640 16.007 4.189 1.00 0.00 H new ATOM 0 HA LEU C 104 10.937 16.768 6.869 1.00 0.00 H new ATOM 0 HB2 LEU C 104 11.650 17.841 4.578 1.00 0.00 H new ATOM 0 HB3 LEU C 104 10.056 18.569 4.545 1.00 0.00 H new ATOM 0 HG LEU C 104 11.504 18.874 7.135 1.00 0.00 H new ATOM 0 HD11 LEU C 104 12.954 20.685 6.263 1.00 0.00 H new ATOM 0 HD12 LEU C 104 13.371 19.121 5.523 1.00 0.00 H new ATOM 0 HD13 LEU C 104 12.421 20.314 4.606 1.00 0.00 H new ATOM 0 HD21 LEU C 104 10.588 21.171 6.910 1.00 0.00 H new ATOM 0 HD22 LEU C 104 10.058 20.797 5.253 1.00 0.00 H new ATOM 0 HD23 LEU C 104 9.322 19.951 6.635 1.00 0.00 H new ATOM 3467 N MET C 105 7.998 17.810 5.814 1.00 0.00 N ATOM 3468 CA MET C 105 6.649 18.177 6.334 1.00 0.00 C ATOM 3469 C MET C 105 5.753 16.938 6.406 1.00 0.00 C ATOM 3470 O MET C 105 4.869 16.848 7.236 1.00 0.00 O ATOM 3471 CB MET C 105 6.095 19.181 5.322 1.00 0.00 C ATOM 3472 CG MET C 105 5.722 20.478 6.041 1.00 0.00 C ATOM 3473 SD MET C 105 5.664 21.835 4.845 1.00 0.00 S ATOM 3474 CE MET C 105 4.008 22.435 5.263 1.00 0.00 C ATOM 0 H MET C 105 8.121 17.922 4.808 1.00 0.00 H new ATOM 0 HA MET C 105 6.694 18.594 7.340 1.00 0.00 H new ATOM 0 HB2 MET C 105 6.837 19.382 4.549 1.00 0.00 H new ATOM 0 HB3 MET C 105 5.220 18.765 4.823 1.00 0.00 H new ATOM 0 HG2 MET C 105 4.755 20.369 6.531 1.00 0.00 H new ATOM 0 HG3 MET C 105 6.452 20.697 6.821 1.00 0.00 H new ATOM 0 HE1 MET C 105 3.761 23.289 4.633 1.00 0.00 H new ATOM 0 HE2 MET C 105 3.281 21.640 5.099 1.00 0.00 H new ATOM 0 HE3 MET C 105 3.984 22.738 6.310 1.00 0.00 H new ATOM 3484 N ALA C 106 5.971 15.983 5.543 1.00 0.00 N ATOM 3485 CA ALA C 106 5.127 14.754 5.563 1.00 0.00 C ATOM 3486 C ALA C 106 5.536 13.845 6.724 1.00 0.00 C ATOM 3487 O ALA C 106 4.713 13.424 7.510 1.00 0.00 O ATOM 3488 CB ALA C 106 5.393 14.065 4.226 1.00 0.00 C ATOM 0 H ALA C 106 6.696 16.001 4.826 1.00 0.00 H new ATOM 0 HA ALA C 106 4.071 14.986 5.699 1.00 0.00 H new ATOM 0 HB1 ALA C 106 4.805 13.149 4.165 1.00 0.00 H new ATOM 0 HB2 ALA C 106 5.111 14.731 3.411 1.00 0.00 H new ATOM 0 HB3 ALA C 106 6.453 13.822 4.146 1.00 0.00 H new ATOM 3494 N ALA C 107 6.800 13.538 6.839 1.00 0.00 N ATOM 3495 CA ALA C 107 7.252 12.655 7.951 1.00 0.00 C ATOM 3496 C ALA C 107 6.841 13.254 9.299 1.00 0.00 C ATOM 3497 O ALA C 107 6.311 12.577 10.157 1.00 0.00 O ATOM 3498 CB ALA C 107 8.774 12.616 7.829 1.00 0.00 C ATOM 0 H ALA C 107 7.537 13.860 6.212 1.00 0.00 H new ATOM 0 HA ALA C 107 6.811 11.660 7.895 1.00 0.00 H new ATOM 0 HB1 ALA C 107 9.186 11.984 8.615 1.00 0.00 H new ATOM 0 HB2 ALA C 107 9.051 12.211 6.856 1.00 0.00 H new ATOM 0 HB3 ALA C 107 9.173 13.625 7.929 1.00 0.00 H new ATOM 3504 N ASN C 108 7.087 14.522 9.489 1.00 0.00 N ATOM 3505 CA ASN C 108 6.718 15.177 10.778 1.00 0.00 C ATOM 3506 C ASN C 108 5.196 15.276 10.915 1.00 0.00 C ATOM 3507 O ASN C 108 4.657 15.220 12.002 1.00 0.00 O ATOM 3508 CB ASN C 108 7.342 16.571 10.705 1.00 0.00 C ATOM 3509 CG ASN C 108 7.042 17.334 11.997 1.00 0.00 C ATOM 3510 OD1 ASN C 108 5.934 17.784 12.207 1.00 0.00 O ATOM 3511 ND2 ASN C 108 7.991 17.499 12.877 1.00 0.00 N ATOM 0 H ASN C 108 7.529 15.135 8.805 1.00 0.00 H new ATOM 0 HA ASN C 108 7.073 14.613 11.641 1.00 0.00 H new ATOM 0 HB2 ASN C 108 8.419 16.491 10.559 1.00 0.00 H new ATOM 0 HB3 ASN C 108 6.944 17.115 9.848 1.00 0.00 H new ATOM 0 HD21 ASN C 108 7.802 18.006 13.742 1.00 0.00 H new ATOM 0 HD22 ASN C 108 8.922 17.121 12.700 1.00 0.00 H new ATOM 3518 N PHE C 109 4.499 15.434 9.823 1.00 0.00 N ATOM 3519 CA PHE C 109 3.014 15.548 9.897 1.00 0.00 C ATOM 3520 C PHE C 109 2.412 14.283 10.517 1.00 0.00 C ATOM 3521 O PHE C 109 1.279 14.276 10.954 1.00 0.00 O ATOM 3522 CB PHE C 109 2.558 15.705 8.445 1.00 0.00 C ATOM 3523 CG PHE C 109 1.093 15.356 8.333 1.00 0.00 C ATOM 3524 CD1 PHE C 109 0.140 16.096 9.043 1.00 0.00 C ATOM 3525 CD2 PHE C 109 0.687 14.291 7.519 1.00 0.00 C ATOM 3526 CE1 PHE C 109 -1.218 15.772 8.938 1.00 0.00 C ATOM 3527 CE2 PHE C 109 -0.671 13.967 7.416 1.00 0.00 C ATOM 3528 CZ PHE C 109 -1.623 14.708 8.125 1.00 0.00 C ATOM 0 H PHE C 109 4.893 15.489 8.884 1.00 0.00 H new ATOM 0 HA PHE C 109 2.695 16.385 10.519 1.00 0.00 H new ATOM 0 HB2 PHE C 109 2.725 16.729 8.110 1.00 0.00 H new ATOM 0 HB3 PHE C 109 3.147 15.057 7.796 1.00 0.00 H new ATOM 0 HD1 PHE C 109 0.452 16.917 9.672 1.00 0.00 H new ATOM 0 HD2 PHE C 109 1.422 13.720 6.971 1.00 0.00 H new ATOM 0 HE1 PHE C 109 -1.953 16.344 9.485 1.00 0.00 H new ATOM 0 HE2 PHE C 109 -0.984 13.145 6.789 1.00 0.00 H new ATOM 0 HZ PHE C 109 -2.671 14.458 8.045 1.00 0.00 H new ATOM 3538 N LEU C 110 3.161 13.216 10.563 1.00 0.00 N ATOM 3539 CA LEU C 110 2.624 11.958 11.162 1.00 0.00 C ATOM 3540 C LEU C 110 3.036 11.857 12.633 1.00 0.00 C ATOM 3541 O LEU C 110 2.969 10.804 13.236 1.00 0.00 O ATOM 3542 CB LEU C 110 3.254 10.826 10.350 1.00 0.00 C ATOM 3543 CG LEU C 110 3.300 11.217 8.872 1.00 0.00 C ATOM 3544 CD1 LEU C 110 3.979 10.107 8.071 1.00 0.00 C ATOM 3545 CD2 LEU C 110 1.877 11.420 8.352 1.00 0.00 C ATOM 0 H LEU C 110 4.118 13.159 10.214 1.00 0.00 H new ATOM 0 HA LEU C 110 1.535 11.920 11.132 1.00 0.00 H new ATOM 0 HB2 LEU C 110 4.261 10.621 10.714 1.00 0.00 H new ATOM 0 HB3 LEU C 110 2.677 9.910 10.476 1.00 0.00 H new ATOM 0 HG LEU C 110 3.864 12.143 8.761 1.00 0.00 H new ATOM 0 HD11 LEU C 110 4.012 10.386 7.018 1.00 0.00 H new ATOM 0 HD12 LEU C 110 4.994 9.961 8.439 1.00 0.00 H new ATOM 0 HD13 LEU C 110 3.416 9.180 8.184 1.00 0.00 H new ATOM 0 HD21 LEU C 110 1.911 11.699 7.299 1.00 0.00 H new ATOM 0 HD22 LEU C 110 1.313 10.494 8.465 1.00 0.00 H new ATOM 0 HD23 LEU C 110 1.391 12.212 8.921 1.00 0.00 H new ATOM 3557 N ASP C 111 3.461 12.946 13.215 1.00 0.00 N ATOM 3558 CA ASP C 111 3.876 12.914 14.647 1.00 0.00 C ATOM 3559 C ASP C 111 4.797 11.719 14.906 1.00 0.00 C ATOM 3560 O ASP C 111 5.245 11.058 13.991 1.00 0.00 O ATOM 3561 CB ASP C 111 2.574 12.768 15.434 1.00 0.00 C ATOM 3562 CG ASP C 111 1.899 14.135 15.562 1.00 0.00 C ATOM 3563 OD1 ASP C 111 2.492 15.013 16.167 1.00 0.00 O ATOM 3564 OD2 ASP C 111 0.800 14.281 15.051 1.00 0.00 O ATOM 0 H ASP C 111 3.539 13.856 12.761 1.00 0.00 H new ATOM 0 HA ASP C 111 4.429 13.808 14.936 1.00 0.00 H new ATOM 0 HB2 ASP C 111 1.908 12.068 14.930 1.00 0.00 H new ATOM 0 HB3 ASP C 111 2.778 12.357 16.423 1.00 0.00 H new ATOM 3569 N CYS C 112 5.082 11.437 16.149 1.00 0.00 N ATOM 3570 CA CYS C 112 5.972 10.286 16.467 1.00 0.00 C ATOM 3571 C CYS C 112 5.612 9.081 15.595 1.00 0.00 C ATOM 3572 O CYS C 112 4.719 8.343 15.977 1.00 0.00 O ATOM 3573 CB CYS C 112 5.708 9.978 17.941 1.00 0.00 C ATOM 3574 SG CYS C 112 7.001 10.734 18.958 1.00 0.00 S ATOM 3575 OXT CYS C 112 6.235 8.918 14.559 1.00 0.00 O ATOM 0 H CYS C 112 4.736 11.955 16.957 1.00 0.00 H new ATOM 0 HA CYS C 112 7.022 10.511 16.278 1.00 0.00 H new ATOM 0 HB2 CYS C 112 4.730 10.361 18.234 1.00 0.00 H new ATOM 0 HB3 CYS C 112 5.689 8.900 18.100 1.00 0.00 H new ATOM 0 HG CYS C 112 6.775 10.474 20.211 1.00 0.00 H new