USER MOD reduce.3.24.130724 H: found=0, std=0, add=1588, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1592 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: B 55 LYS NZ :NH3+ -148:sc= -2.75! (180deg=0) USER MOD Set 1.2: Y 105 HIS : no HE2:sc= -7.62! C(o=-10!,f=-19!) USER MOD Set 2.1: A 55 LYS NZ :NH3+ -156:sc= -2.37! (180deg=0) USER MOD Set 2.2: X 105 HIS : no HE2:sc= -6.79! C(o=-9.2!,f=-19!) USER MOD Set 3.1: A 78 SER OG : rot 84:sc= -0.881! USER MOD Set 3.2: B 78 SER OG : rot -108:sc= 2.31 USER MOD Set 4.1: A 81 THR OG1 : rot 80:sc= 0.116 USER MOD Set 4.2: B 7 MET CE :methyl 157:sc=-0.000187 (180deg=-0.402) USER MOD Set 5.1: A 7 MET CE :methyl 160:sc= 0 (180deg=-0.304) USER MOD Set 5.2: B 81 THR OG1 : rot 79:sc= 0.039 USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 0 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot -38:sc= 1.15 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 HIS : no HD1:sc= -0.0193 X(o=-0.019,f=-0.069) USER MOD Single : A 16 GLN : amide:sc= -0.44 X(o=-0.44,f=-0.22) USER MOD Single : A 17 TYR OH : rot -30:sc= -0.813 USER MOD Single : A 18 SER OG : rot -155:sc= 0.605 USER MOD Single : A 24 LYS NZ :NH3+ 157:sc= -0.401 (180deg=-1.15) USER MOD Single : A 25 HIS : no HD1:sc=-0.00588 X(o=-0.0059,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 149:sc= -0.155 (180deg=-0.953) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ -141:sc= -0.496 (180deg=-2.84!) USER MOD Single : A 37 ASN : amide:sc= -5.75! K(o=-5.7!,f=-2.6) USER MOD Single : A 38 ASN : amide:sc= -2.36! K(o=-2.4!,f=-0.69) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= -0.0503 X(o=-0.05,f=-0.05) USER MOD Single : A 48 LYS NZ :NH3+ -167:sc= -0.157 (180deg=-0.389) USER MOD Single : A 50 GLN : amide:sc= -7.37! C(o=-7.4!,f=-2.9!) USER MOD Single : A 57 MET CE :methyl -114:sc= -3.2 (180deg=-7.92!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 CYS SG : rot 26:sc= -1.13 USER MOD Single : A 71 GLN : amide:sc= -0.0592 K(o=-0.059,f=-2.3!) USER MOD Single : A 74 MET CE :methyl -156:sc= -2.81 (180deg=-6.15!) USER MOD Single : A 79 MET CE :methyl -162:sc= -0.347 (180deg=-1.28!) USER MOD Single : A 82 THR OG1 : rot 180:sc=-0.00479 USER MOD Single : A 84 CYS SG : rot -25:sc= -2.83! USER MOD Single : A 85 HIS : no HD1:sc= -2.42! C(o=-2.4!,f=-4.3!) USER MOD Single : B 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 0 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 SER OG : rot -48:sc= 1.15 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 HIS : no HD1:sc=-0.00281 X(o=-0.0028,f=-0.02) USER MOD Single : B 16 GLN : amide:sc= -0.445 X(o=-0.44,f=-0.17) USER MOD Single : B 17 TYR OH : rot -15:sc= -0.897 USER MOD Single : B 18 SER OG : rot -148:sc= 0.613 USER MOD Single : B 24 LYS NZ :NH3+ 156:sc= -0.314 (180deg=-0.967) USER MOD Single : B 25 HIS : no HD1:sc=-0.00654 X(o=-0.0065,f=0) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ 149:sc= -0.175 (180deg=-1.12) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ -135:sc= -0.459 (180deg=-2.79!) USER MOD Single : B 37 ASN : amide:sc= -6.05! K(o=-6.1!,f=-2.6) USER MOD Single : B 38 ASN : amide:sc= -2.43! K(o=-2.4!,f=-0.6) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= -0.0853 X(o=-0.085,f=-0.085) USER MOD Single : B 48 LYS NZ :NH3+ -168:sc= -0.123 (180deg=-0.318) USER MOD Single : B 50 GLN : amide:sc= -7.95! C(o=-8!,f=-2.9!) USER MOD Single : B 57 MET CE :methyl -111:sc= -3.25 (180deg=-8.05!) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 CYS SG : rot 26:sc= -0.918 USER MOD Single : B 71 GLN : amide:sc= -0.0685 K(o=-0.069,f=-2.2!) USER MOD Single : B 74 MET CE :methyl -154:sc= -2.94 (180deg=-6!) USER MOD Single : B 79 MET CE :methyl -166:sc= -0.526 (180deg=-1.25) USER MOD Single : B 82 THR OG1 : rot 180:sc= -0.011 USER MOD Single : B 84 CYS SG : rot -26:sc= -3.07! USER MOD Single : B 85 HIS : no HD1:sc= -2.29! C(o=-2.3!,f=-4.7!) USER MOD Single : X 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : X 111 LYS NZ :NH3+ 159:sc= -12! (180deg=-12.7!) USER MOD Single : X 112 THR OG1 : rot -25:sc= 0.0827 USER MOD Single : Y 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : Y 111 LYS NZ :NH3+ 162:sc= -12.5! (180deg=-12.9!) USER MOD Single : Y 112 THR OG1 : rot -25:sc= 0.0207 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 2.138 -1.843 -14.917 1.00 0.00 N ATOM 2 CA MET A 0 1.350 -2.128 -16.149 1.00 0.00 C ATOM 3 C MET A 0 0.133 -1.202 -16.204 1.00 0.00 C ATOM 4 O MET A 0 -0.931 -1.529 -15.716 1.00 0.00 O ATOM 5 CB MET A 0 0.881 -3.585 -16.132 1.00 0.00 C ATOM 6 CG MET A 0 0.154 -3.906 -17.441 1.00 0.00 C ATOM 7 SD MET A 0 -0.374 -5.638 -17.434 1.00 0.00 S ATOM 8 CE MET A 0 -1.970 -5.392 -16.616 1.00 0.00 C ATOM 0 H1 MET A 0 2.965 -2.473 -14.880 1.00 0.00 H new ATOM 0 H2 MET A 0 2.457 -0.853 -14.930 1.00 0.00 H new ATOM 0 H3 MET A 0 1.543 -2.004 -14.079 1.00 0.00 H new ATOM 0 HA MET A 0 1.976 -1.958 -17.025 1.00 0.00 H new ATOM 0 HB2 MET A 0 1.735 -4.251 -16.006 1.00 0.00 H new ATOM 0 HB3 MET A 0 0.217 -3.754 -15.284 1.00 0.00 H new ATOM 0 HG2 MET A 0 -0.710 -3.252 -17.558 1.00 0.00 H new ATOM 0 HG3 MET A 0 0.812 -3.719 -18.290 1.00 0.00 H new ATOM 0 HE1 MET A 0 -2.475 -6.352 -16.508 1.00 0.00 H new ATOM 0 HE2 MET A 0 -1.810 -4.953 -15.631 1.00 0.00 H new ATOM 0 HE3 MET A 0 -2.587 -4.723 -17.216 1.00 0.00 H new ATOM 20 N SER A 1 0.281 -0.051 -16.797 1.00 0.00 N ATOM 21 CA SER A 1 -0.868 0.898 -16.889 1.00 0.00 C ATOM 22 C SER A 1 -1.510 1.079 -15.513 1.00 0.00 C ATOM 23 O SER A 1 -2.609 1.581 -15.391 1.00 0.00 O ATOM 24 CB SER A 1 -1.909 0.354 -17.869 1.00 0.00 C ATOM 25 OG SER A 1 -2.998 1.266 -17.948 1.00 0.00 O ATOM 0 H SER A 1 1.148 0.276 -17.223 1.00 0.00 H new ATOM 0 HA SER A 1 -0.503 1.862 -17.243 1.00 0.00 H new ATOM 0 HB2 SER A 1 -1.462 0.216 -18.854 1.00 0.00 H new ATOM 0 HB3 SER A 1 -2.261 -0.624 -17.539 1.00 0.00 H new ATOM 0 HG SER A 1 -3.175 1.641 -17.060 1.00 0.00 H new ATOM 31 N GLU A 2 -0.820 0.705 -14.474 1.00 0.00 N ATOM 32 CA GLU A 2 -1.370 0.887 -13.103 1.00 0.00 C ATOM 33 C GLU A 2 -1.276 2.368 -12.750 1.00 0.00 C ATOM 34 O GLU A 2 -1.310 2.752 -11.598 1.00 0.00 O ATOM 35 CB GLU A 2 -0.560 0.049 -12.108 1.00 0.00 C ATOM 36 CG GLU A 2 0.907 0.486 -12.121 1.00 0.00 C ATOM 37 CD GLU A 2 1.695 -0.363 -11.124 1.00 0.00 C ATOM 38 OE1 GLU A 2 1.068 -1.075 -10.357 1.00 0.00 O ATOM 39 OE2 GLU A 2 2.912 -0.289 -11.145 1.00 0.00 O ATOM 0 H GLU A 2 0.106 0.279 -14.515 1.00 0.00 H new ATOM 0 HA GLU A 2 -2.409 0.560 -13.059 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -0.972 0.163 -11.105 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -0.635 -1.008 -12.365 1.00 0.00 H new ATOM 0 HG2 GLU A 2 1.323 0.373 -13.122 1.00 0.00 H new ATOM 0 HG3 GLU A 2 0.986 1.541 -11.860 1.00 0.00 H new ATOM 46 N LEU A 3 -1.142 3.203 -13.746 1.00 0.00 N ATOM 47 CA LEU A 3 -1.028 4.658 -13.496 1.00 0.00 C ATOM 48 C LEU A 3 -2.279 5.145 -12.779 1.00 0.00 C ATOM 49 O LEU A 3 -2.214 6.008 -11.942 1.00 0.00 O ATOM 50 CB LEU A 3 -0.859 5.401 -14.827 1.00 0.00 C ATOM 51 CG LEU A 3 -0.740 6.915 -14.585 1.00 0.00 C ATOM 52 CD1 LEU A 3 0.468 7.217 -13.681 1.00 0.00 C ATOM 53 CD2 LEU A 3 -0.559 7.621 -15.935 1.00 0.00 C ATOM 0 H LEU A 3 -1.107 2.931 -14.728 1.00 0.00 H new ATOM 0 HA LEU A 3 -0.157 4.855 -12.871 1.00 0.00 H new ATOM 0 HB2 LEU A 3 0.030 5.038 -15.343 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -1.710 5.196 -15.476 1.00 0.00 H new ATOM 0 HG LEU A 3 -1.644 7.274 -14.093 1.00 0.00 H new ATOM 0 HD11 LEU A 3 0.541 8.292 -13.518 1.00 0.00 H new ATOM 0 HD12 LEU A 3 0.341 6.712 -12.723 1.00 0.00 H new ATOM 0 HD13 LEU A 3 1.380 6.861 -14.161 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -0.474 8.696 -15.775 1.00 0.00 H new ATOM 0 HD22 LEU A 3 0.345 7.253 -16.420 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -1.420 7.416 -16.571 1.00 0.00 H new ATOM 65 N GLU A 4 -3.415 4.604 -13.102 1.00 0.00 N ATOM 66 CA GLU A 4 -4.665 5.057 -12.425 1.00 0.00 C ATOM 67 C GLU A 4 -4.546 4.812 -10.921 1.00 0.00 C ATOM 68 O GLU A 4 -4.984 5.608 -10.116 1.00 0.00 O ATOM 69 CB GLU A 4 -5.865 4.282 -12.988 1.00 0.00 C ATOM 70 CG GLU A 4 -5.736 2.793 -12.649 1.00 0.00 C ATOM 71 CD GLU A 4 -6.855 2.012 -13.341 1.00 0.00 C ATOM 72 OE1 GLU A 4 -7.847 2.627 -13.700 1.00 0.00 O ATOM 73 OE2 GLU A 4 -6.704 0.812 -13.495 1.00 0.00 O ATOM 0 H GLU A 4 -3.537 3.871 -13.801 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.812 6.122 -12.605 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -6.791 4.679 -12.572 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -5.918 4.414 -14.069 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -4.764 2.419 -12.971 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.791 2.649 -11.570 1.00 0.00 H new ATOM 80 N LYS A 5 -3.955 3.719 -10.540 1.00 0.00 N ATOM 81 CA LYS A 5 -3.800 3.416 -9.090 1.00 0.00 C ATOM 82 C LYS A 5 -2.907 4.467 -8.438 1.00 0.00 C ATOM 83 O LYS A 5 -3.141 4.882 -7.325 1.00 0.00 O ATOM 84 CB LYS A 5 -3.152 2.037 -8.938 1.00 0.00 C ATOM 85 CG LYS A 5 -3.006 1.684 -7.456 1.00 0.00 C ATOM 86 CD LYS A 5 -2.347 0.305 -7.327 1.00 0.00 C ATOM 87 CE LYS A 5 -0.858 0.386 -7.706 1.00 0.00 C ATOM 88 NZ LYS A 5 -0.122 -0.729 -7.046 1.00 0.00 N ATOM 0 H LYS A 5 -3.570 3.017 -11.172 1.00 0.00 H new ATOM 0 HA LYS A 5 -4.777 3.425 -8.607 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -3.759 1.284 -9.441 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -2.174 2.031 -9.419 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -2.403 2.437 -6.948 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -3.983 1.680 -6.973 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -2.450 -0.060 -6.305 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -2.855 -0.410 -7.974 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -0.742 0.324 -8.788 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -0.443 1.345 -7.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 0.885 -0.678 -7.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -0.224 -0.649 -6.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -0.513 -1.639 -7.363 1.00 0.00 H new ATOM 102 N ALA A 6 -1.870 4.878 -9.109 1.00 0.00 N ATOM 103 CA ALA A 6 -0.952 5.884 -8.505 1.00 0.00 C ATOM 104 C ALA A 6 -1.646 7.237 -8.367 1.00 0.00 C ATOM 105 O ALA A 6 -1.471 7.931 -7.389 1.00 0.00 O ATOM 106 CB ALA A 6 0.293 6.034 -9.381 1.00 0.00 C ATOM 0 H ALA A 6 -1.618 4.563 -10.046 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.665 5.538 -7.512 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.963 6.770 -8.938 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.805 5.074 -9.453 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.001 6.364 -10.377 1.00 0.00 H new ATOM 112 N MET A 7 -2.417 7.626 -9.335 1.00 0.00 N ATOM 113 CA MET A 7 -3.103 8.941 -9.251 1.00 0.00 C ATOM 114 C MET A 7 -4.052 8.941 -8.059 1.00 0.00 C ATOM 115 O MET A 7 -4.178 9.915 -7.342 1.00 0.00 O ATOM 116 CB MET A 7 -3.903 9.187 -10.535 1.00 0.00 C ATOM 117 CG MET A 7 -2.955 9.284 -11.734 1.00 0.00 C ATOM 118 SD MET A 7 -3.876 9.878 -13.177 1.00 0.00 S ATOM 119 CE MET A 7 -2.457 10.445 -14.146 1.00 0.00 C ATOM 0 H MET A 7 -2.604 7.091 -10.183 1.00 0.00 H new ATOM 0 HA MET A 7 -2.360 9.729 -9.129 1.00 0.00 H new ATOM 0 HB2 MET A 7 -4.616 8.377 -10.690 1.00 0.00 H new ATOM 0 HB3 MET A 7 -4.481 10.107 -10.443 1.00 0.00 H new ATOM 0 HG2 MET A 7 -2.133 9.963 -11.508 1.00 0.00 H new ATOM 0 HG3 MET A 7 -2.515 8.309 -11.945 1.00 0.00 H new ATOM 0 HE1 MET A 7 -2.740 10.521 -15.196 1.00 0.00 H new ATOM 0 HE2 MET A 7 -2.137 11.423 -13.785 1.00 0.00 H new ATOM 0 HE3 MET A 7 -1.638 9.734 -14.042 1.00 0.00 H new ATOM 129 N VAL A 8 -4.720 7.851 -7.849 1.00 0.00 N ATOM 130 CA VAL A 8 -5.672 7.757 -6.714 1.00 0.00 C ATOM 131 C VAL A 8 -4.901 7.845 -5.401 1.00 0.00 C ATOM 132 O VAL A 8 -5.344 8.446 -4.447 1.00 0.00 O ATOM 133 CB VAL A 8 -6.414 6.419 -6.790 1.00 0.00 C ATOM 134 CG1 VAL A 8 -7.218 6.191 -5.504 1.00 0.00 C ATOM 135 CG2 VAL A 8 -7.358 6.438 -7.992 1.00 0.00 C ATOM 0 H VAL A 8 -4.648 7.009 -8.421 1.00 0.00 H new ATOM 0 HA VAL A 8 -6.392 8.574 -6.765 1.00 0.00 H new ATOM 0 HB VAL A 8 -5.692 5.610 -6.902 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -7.742 5.237 -5.567 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -6.541 6.177 -4.649 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -7.943 6.996 -5.380 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -7.890 5.488 -8.052 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.077 7.249 -7.877 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -6.782 6.590 -8.905 1.00 0.00 H new ATOM 145 N ALA A 9 -3.766 7.216 -5.344 1.00 0.00 N ATOM 146 CA ALA A 9 -2.963 7.219 -4.087 1.00 0.00 C ATOM 147 C ALA A 9 -2.507 8.629 -3.716 1.00 0.00 C ATOM 148 O ALA A 9 -2.502 8.994 -2.562 1.00 0.00 O ATOM 149 CB ALA A 9 -1.738 6.338 -4.262 1.00 0.00 C ATOM 0 H ALA A 9 -3.353 6.695 -6.118 1.00 0.00 H new ATOM 0 HA ALA A 9 -3.597 6.837 -3.287 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -1.153 6.342 -3.342 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.052 5.319 -4.488 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -1.129 6.720 -5.081 1.00 0.00 H new ATOM 155 N LEU A 10 -2.111 9.424 -4.666 1.00 0.00 N ATOM 156 CA LEU A 10 -1.651 10.801 -4.318 1.00 0.00 C ATOM 157 C LEU A 10 -2.802 11.535 -3.637 1.00 0.00 C ATOM 158 O LEU A 10 -2.618 12.285 -2.700 1.00 0.00 O ATOM 159 CB LEU A 10 -1.250 11.564 -5.598 1.00 0.00 C ATOM 160 CG LEU A 10 0.239 11.382 -5.906 1.00 0.00 C ATOM 161 CD1 LEU A 10 0.503 9.944 -6.351 1.00 0.00 C ATOM 162 CD2 LEU A 10 0.625 12.350 -7.027 1.00 0.00 C ATOM 0 H LEU A 10 -2.084 9.188 -5.658 1.00 0.00 H new ATOM 0 HA LEU A 10 -0.788 10.744 -3.655 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -1.845 11.207 -6.439 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -1.472 12.624 -5.478 1.00 0.00 H new ATOM 0 HG LEU A 10 0.832 11.587 -5.015 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.564 9.820 -6.569 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.213 9.258 -5.555 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -0.079 9.728 -7.247 1.00 0.00 H new ATOM 0 HD21 LEU A 10 1.684 12.234 -7.260 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.032 12.133 -7.916 1.00 0.00 H new ATOM 0 HD23 LEU A 10 0.434 13.374 -6.705 1.00 0.00 H new ATOM 174 N ILE A 11 -3.980 11.337 -4.132 1.00 0.00 N ATOM 175 CA ILE A 11 -5.165 12.022 -3.562 1.00 0.00 C ATOM 176 C ILE A 11 -5.482 11.503 -2.147 1.00 0.00 C ATOM 177 O ILE A 11 -5.891 12.259 -1.288 1.00 0.00 O ATOM 178 CB ILE A 11 -6.350 11.808 -4.510 1.00 0.00 C ATOM 179 CG1 ILE A 11 -6.091 12.600 -5.800 1.00 0.00 C ATOM 180 CG2 ILE A 11 -7.636 12.308 -3.855 1.00 0.00 C ATOM 181 CD1 ILE A 11 -7.108 12.213 -6.880 1.00 0.00 C ATOM 0 H ILE A 11 -4.179 10.720 -4.920 1.00 0.00 H new ATOM 0 HA ILE A 11 -4.961 13.088 -3.466 1.00 0.00 H new ATOM 0 HB ILE A 11 -6.458 10.747 -4.734 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.156 13.669 -5.597 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.080 12.404 -6.157 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.474 12.153 -4.534 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -7.811 11.758 -2.931 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -7.541 13.371 -3.632 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -6.910 12.784 -7.787 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.023 11.148 -7.095 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.115 12.432 -6.526 1.00 0.00 H new ATOM 193 N ASP A 12 -5.330 10.227 -1.895 1.00 0.00 N ATOM 194 CA ASP A 12 -5.664 9.695 -0.533 1.00 0.00 C ATOM 195 C ASP A 12 -4.677 10.199 0.530 1.00 0.00 C ATOM 196 O ASP A 12 -5.054 10.505 1.644 1.00 0.00 O ATOM 197 CB ASP A 12 -5.599 8.167 -0.567 1.00 0.00 C ATOM 198 CG ASP A 12 -6.764 7.618 -1.392 1.00 0.00 C ATOM 199 OD1 ASP A 12 -7.796 8.267 -1.429 1.00 0.00 O ATOM 200 OD2 ASP A 12 -6.603 6.558 -1.975 1.00 0.00 O ATOM 0 H ASP A 12 -4.993 9.535 -2.564 1.00 0.00 H new ATOM 0 HA ASP A 12 -6.663 10.043 -0.271 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -4.652 7.844 -0.998 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.640 7.769 0.447 1.00 0.00 H new ATOM 205 N VAL A 13 -3.420 10.260 0.203 1.00 0.00 N ATOM 206 CA VAL A 13 -2.395 10.711 1.193 1.00 0.00 C ATOM 207 C VAL A 13 -2.559 12.217 1.462 1.00 0.00 C ATOM 208 O VAL A 13 -2.436 12.689 2.586 1.00 0.00 O ATOM 209 CB VAL A 13 -0.987 10.346 0.630 1.00 0.00 C ATOM 210 CG1 VAL A 13 -0.204 11.583 0.167 1.00 0.00 C ATOM 211 CG2 VAL A 13 -0.164 9.610 1.694 1.00 0.00 C ATOM 0 H VAL A 13 -3.050 10.015 -0.716 1.00 0.00 H new ATOM 0 HA VAL A 13 -2.520 10.210 2.153 1.00 0.00 H new ATOM 0 HB VAL A 13 -1.152 9.704 -0.235 1.00 0.00 H new ATOM 0 HG11 VAL A 13 0.769 11.275 -0.216 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -0.760 12.092 -0.621 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -0.064 12.261 1.009 1.00 0.00 H new ATOM 0 HG21 VAL A 13 0.816 9.361 1.288 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -0.043 10.250 2.568 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -0.680 8.694 1.984 1.00 0.00 H new ATOM 221 N PHE A 14 -2.843 12.967 0.438 1.00 0.00 N ATOM 222 CA PHE A 14 -3.020 14.430 0.606 1.00 0.00 C ATOM 223 C PHE A 14 -4.150 14.683 1.595 1.00 0.00 C ATOM 224 O PHE A 14 -4.101 15.600 2.374 1.00 0.00 O ATOM 225 CB PHE A 14 -3.379 15.053 -0.748 1.00 0.00 C ATOM 226 CG PHE A 14 -3.755 16.507 -0.570 1.00 0.00 C ATOM 227 CD1 PHE A 14 -5.077 16.851 -0.259 1.00 0.00 C ATOM 228 CD2 PHE A 14 -2.790 17.510 -0.719 1.00 0.00 C ATOM 229 CE1 PHE A 14 -5.433 18.194 -0.097 1.00 0.00 C ATOM 230 CE2 PHE A 14 -3.148 18.853 -0.558 1.00 0.00 C ATOM 231 CZ PHE A 14 -4.468 19.196 -0.247 1.00 0.00 C ATOM 0 H PHE A 14 -2.961 12.625 -0.516 1.00 0.00 H new ATOM 0 HA PHE A 14 -2.098 14.875 0.979 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -2.533 14.969 -1.431 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -4.208 14.508 -1.199 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -5.822 16.078 -0.144 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -1.770 17.247 -0.958 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -6.452 18.457 0.144 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -2.403 19.627 -0.674 1.00 0.00 H new ATOM 0 HZ PHE A 14 -4.742 20.233 -0.123 1.00 0.00 H new ATOM 241 N HIS A 15 -5.176 13.889 1.552 1.00 0.00 N ATOM 242 CA HIS A 15 -6.317 14.100 2.483 1.00 0.00 C ATOM 243 C HIS A 15 -5.908 13.776 3.922 1.00 0.00 C ATOM 244 O HIS A 15 -6.479 14.291 4.861 1.00 0.00 O ATOM 245 CB HIS A 15 -7.476 13.195 2.070 1.00 0.00 C ATOM 246 CG HIS A 15 -8.667 13.471 2.946 1.00 0.00 C ATOM 247 ND1 HIS A 15 -9.251 14.728 3.028 1.00 0.00 N ATOM 248 CD2 HIS A 15 -9.400 12.661 3.777 1.00 0.00 C ATOM 249 CE1 HIS A 15 -10.289 14.638 3.880 1.00 0.00 C ATOM 250 NE2 HIS A 15 -10.420 13.401 4.363 1.00 0.00 N ATOM 0 H HIS A 15 -5.277 13.101 0.912 1.00 0.00 H new ATOM 0 HA HIS A 15 -6.621 15.146 2.434 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -7.732 13.369 1.025 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -7.183 12.149 2.156 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -9.213 11.611 3.949 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -10.935 15.464 4.140 1.00 0.00 H new ATOM 0 HE2 HIS A 15 -11.122 13.068 5.024 1.00 0.00 H new ATOM 259 N GLN A 16 -4.950 12.916 4.116 1.00 0.00 N ATOM 260 CA GLN A 16 -4.556 12.572 5.508 1.00 0.00 C ATOM 261 C GLN A 16 -4.083 13.825 6.246 1.00 0.00 C ATOM 262 O GLN A 16 -4.409 14.034 7.398 1.00 0.00 O ATOM 263 CB GLN A 16 -3.422 11.546 5.479 1.00 0.00 C ATOM 264 CG GLN A 16 -3.959 10.202 4.981 1.00 0.00 C ATOM 265 CD GLN A 16 -4.903 9.604 6.025 1.00 0.00 C ATOM 266 OE1 GLN A 16 -6.007 9.208 5.706 1.00 0.00 O ATOM 267 NE2 GLN A 16 -4.514 9.521 7.266 1.00 0.00 N ATOM 0 H GLN A 16 -4.428 12.441 3.380 1.00 0.00 H new ATOM 0 HA GLN A 16 -5.419 12.155 6.027 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.620 11.893 4.827 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -2.995 11.432 6.476 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -4.485 10.338 4.036 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -3.132 9.518 4.790 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -3.587 9.853 7.533 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -5.136 9.124 7.970 1.00 0.00 H new ATOM 276 N TYR A 17 -3.300 14.656 5.608 1.00 0.00 N ATOM 277 CA TYR A 17 -2.795 15.889 6.307 1.00 0.00 C ATOM 278 C TYR A 17 -3.717 17.095 6.084 1.00 0.00 C ATOM 279 O TYR A 17 -3.935 17.890 6.976 1.00 0.00 O ATOM 280 CB TYR A 17 -1.404 16.217 5.765 1.00 0.00 C ATOM 281 CG TYR A 17 -0.417 15.237 6.336 1.00 0.00 C ATOM 282 CD1 TYR A 17 -0.224 14.000 5.718 1.00 0.00 C ATOM 283 CD2 TYR A 17 0.286 15.564 7.497 1.00 0.00 C ATOM 284 CE1 TYR A 17 0.679 13.085 6.260 1.00 0.00 C ATOM 285 CE2 TYR A 17 1.188 14.653 8.047 1.00 0.00 C ATOM 286 CZ TYR A 17 1.388 13.408 7.429 1.00 0.00 C ATOM 287 OH TYR A 17 2.277 12.501 7.971 1.00 0.00 O ATOM 0 H TYR A 17 -2.988 14.542 4.644 1.00 0.00 H new ATOM 0 HA TYR A 17 -2.766 15.688 7.378 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -1.401 16.164 4.676 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -1.124 17.235 6.035 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -0.773 13.752 4.822 1.00 0.00 H new ATOM 0 HD2 TYR A 17 0.131 16.523 7.970 1.00 0.00 H new ATOM 0 HE1 TYR A 17 0.833 12.129 5.781 1.00 0.00 H new ATOM 0 HE2 TYR A 17 1.731 14.905 8.946 1.00 0.00 H new ATOM 0 HH TYR A 17 1.979 11.590 7.769 1.00 0.00 H new ATOM 297 N SER A 18 -4.222 17.260 4.901 1.00 0.00 N ATOM 298 CA SER A 18 -5.088 18.442 4.609 1.00 0.00 C ATOM 299 C SER A 18 -6.329 18.455 5.508 1.00 0.00 C ATOM 300 O SER A 18 -6.757 19.492 5.972 1.00 0.00 O ATOM 301 CB SER A 18 -5.523 18.399 3.144 1.00 0.00 C ATOM 302 OG SER A 18 -6.043 19.669 2.772 1.00 0.00 O ATOM 0 H SER A 18 -4.075 16.627 4.115 1.00 0.00 H new ATOM 0 HA SER A 18 -4.513 19.347 4.806 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.676 18.139 2.509 1.00 0.00 H new ATOM 0 HB3 SER A 18 -6.279 17.627 2.999 1.00 0.00 H new ATOM 0 HG SER A 18 -6.667 19.561 2.024 1.00 0.00 H new ATOM 308 N GLY A 19 -6.920 17.321 5.743 1.00 0.00 N ATOM 309 CA GLY A 19 -8.145 17.281 6.593 1.00 0.00 C ATOM 310 C GLY A 19 -7.794 17.578 8.054 1.00 0.00 C ATOM 311 O GLY A 19 -8.666 17.751 8.882 1.00 0.00 O ATOM 0 H GLY A 19 -6.610 16.418 5.385 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -8.870 18.011 6.231 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -8.615 16.300 6.518 1.00 0.00 H new ATOM 315 N ARG A 20 -6.534 17.636 8.385 1.00 0.00 N ATOM 316 CA ARG A 20 -6.155 17.918 9.798 1.00 0.00 C ATOM 317 C ARG A 20 -6.495 19.365 10.156 1.00 0.00 C ATOM 318 O ARG A 20 -6.996 19.650 11.226 1.00 0.00 O ATOM 319 CB ARG A 20 -4.656 17.715 9.957 1.00 0.00 C ATOM 320 CG ARG A 20 -4.284 17.813 11.435 1.00 0.00 C ATOM 321 CD ARG A 20 -2.772 17.694 11.580 1.00 0.00 C ATOM 322 NE ARG A 20 -2.371 16.269 11.401 1.00 0.00 N ATOM 323 CZ ARG A 20 -1.117 15.962 11.227 1.00 0.00 C ATOM 324 NH1 ARG A 20 -0.214 16.902 11.210 1.00 0.00 N ATOM 325 NH2 ARG A 20 -0.763 14.716 11.074 1.00 0.00 N ATOM 0 H ARG A 20 -5.754 17.501 7.742 1.00 0.00 H new ATOM 0 HA ARG A 20 -6.704 17.245 10.456 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -4.366 16.742 9.562 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -4.113 18.467 9.384 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -4.627 18.762 11.847 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -4.779 17.023 12.000 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -2.274 18.320 10.840 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -2.460 18.051 12.561 1.00 0.00 H new ATOM 0 HE ARG A 20 -3.079 15.535 11.415 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -0.490 17.876 11.333 1.00 0.00 H new ATOM 0 HH12 ARG A 20 0.768 16.663 11.074 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -1.469 13.980 11.090 1.00 0.00 H new ATOM 0 HH22 ARG A 20 0.219 14.478 10.938 1.00 0.00 H new ATOM 339 N GLU A 21 -6.205 20.281 9.269 1.00 0.00 N ATOM 340 CA GLU A 21 -6.479 21.732 9.535 1.00 0.00 C ATOM 341 C GLU A 21 -7.561 22.238 8.576 1.00 0.00 C ATOM 342 O GLU A 21 -7.741 21.719 7.492 1.00 0.00 O ATOM 343 CB GLU A 21 -5.186 22.524 9.320 1.00 0.00 C ATOM 344 CG GLU A 21 -5.409 23.996 9.676 1.00 0.00 C ATOM 345 CD GLU A 21 -4.071 24.738 9.619 1.00 0.00 C ATOM 346 OE1 GLU A 21 -3.063 24.086 9.407 1.00 0.00 O ATOM 347 OE2 GLU A 21 -4.078 25.946 9.789 1.00 0.00 O ATOM 0 H GLU A 21 -5.785 20.087 8.360 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.827 21.862 10.560 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -4.389 22.109 9.936 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -4.865 22.437 8.282 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.118 24.447 8.981 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -5.842 24.080 10.673 1.00 0.00 H new ATOM 354 N GLY A 22 -8.292 23.241 8.985 1.00 0.00 N ATOM 355 CA GLY A 22 -9.383 23.797 8.131 1.00 0.00 C ATOM 356 C GLY A 22 -8.938 23.893 6.670 1.00 0.00 C ATOM 357 O GLY A 22 -9.754 23.989 5.774 1.00 0.00 O ATOM 0 H GLY A 22 -8.178 23.705 9.886 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -10.267 23.164 8.205 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -9.667 24.785 8.494 1.00 0.00 H new ATOM 361 N ASP A 23 -7.661 23.881 6.411 1.00 0.00 N ATOM 362 CA ASP A 23 -7.199 23.983 5.002 1.00 0.00 C ATOM 363 C ASP A 23 -7.454 22.647 4.288 1.00 0.00 C ATOM 364 O ASP A 23 -6.550 22.013 3.788 1.00 0.00 O ATOM 365 CB ASP A 23 -5.702 24.319 4.993 1.00 0.00 C ATOM 366 CG ASP A 23 -5.386 25.243 6.172 1.00 0.00 C ATOM 367 OD1 ASP A 23 -6.100 26.217 6.342 1.00 0.00 O ATOM 368 OD2 ASP A 23 -4.438 24.959 6.886 1.00 0.00 O ATOM 0 H ASP A 23 -6.922 23.805 7.110 1.00 0.00 H new ATOM 0 HA ASP A 23 -7.744 24.769 4.480 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -5.112 23.405 5.063 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -5.431 24.802 4.054 1.00 0.00 H new ATOM 373 N LYS A 24 -8.684 22.212 4.248 1.00 0.00 N ATOM 374 CA LYS A 24 -9.004 20.916 3.579 1.00 0.00 C ATOM 375 C LYS A 24 -8.621 20.982 2.097 1.00 0.00 C ATOM 376 O LYS A 24 -8.109 20.035 1.535 1.00 0.00 O ATOM 377 CB LYS A 24 -10.510 20.665 3.673 1.00 0.00 C ATOM 378 CG LYS A 24 -10.902 20.362 5.121 1.00 0.00 C ATOM 379 CD LYS A 24 -12.423 20.486 5.274 1.00 0.00 C ATOM 380 CE LYS A 24 -13.126 19.492 4.345 1.00 0.00 C ATOM 381 NZ LYS A 24 -12.454 18.166 4.433 1.00 0.00 N ATOM 0 H LYS A 24 -9.485 22.699 4.651 1.00 0.00 H new ATOM 0 HA LYS A 24 -8.447 20.117 4.069 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -11.055 21.538 3.315 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -10.788 19.830 3.030 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -10.579 19.358 5.394 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -10.400 21.054 5.798 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -12.709 20.295 6.308 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -12.739 21.502 5.038 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -14.176 19.398 4.623 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -13.100 19.857 3.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.117 17.421 4.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -11.623 18.156 3.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -12.153 17.994 5.413 1.00 0.00 H new ATOM 395 N HIS A 25 -8.883 22.093 1.454 1.00 0.00 N ATOM 396 CA HIS A 25 -8.557 22.224 -0.002 1.00 0.00 C ATOM 397 C HIS A 25 -7.240 22.985 -0.179 1.00 0.00 C ATOM 398 O HIS A 25 -6.795 23.213 -1.287 1.00 0.00 O ATOM 399 CB HIS A 25 -9.675 23.007 -0.698 1.00 0.00 C ATOM 400 CG HIS A 25 -10.976 22.254 -0.600 1.00 0.00 C ATOM 401 ND1 HIS A 25 -12.201 22.906 -0.548 1.00 0.00 N ATOM 402 CD2 HIS A 25 -11.265 20.911 -0.556 1.00 0.00 C ATOM 403 CE1 HIS A 25 -13.161 21.965 -0.477 1.00 0.00 C ATOM 404 NE2 HIS A 25 -12.643 20.736 -0.479 1.00 0.00 N ATOM 0 H HIS A 25 -9.310 22.918 1.875 1.00 0.00 H new ATOM 0 HA HIS A 25 -8.463 21.229 -0.437 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -9.780 23.990 -0.240 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -9.418 23.169 -1.745 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -10.535 20.115 -0.578 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -14.218 22.179 -0.425 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -13.151 19.853 -0.434 1.00 0.00 H new ATOM 413 N LYS A 26 -6.614 23.393 0.898 1.00 0.00 N ATOM 414 CA LYS A 26 -5.327 24.154 0.783 1.00 0.00 C ATOM 415 C LYS A 26 -4.357 23.732 1.877 1.00 0.00 C ATOM 416 O LYS A 26 -4.703 23.025 2.798 1.00 0.00 O ATOM 417 CB LYS A 26 -5.594 25.655 0.890 1.00 0.00 C ATOM 418 CG LYS A 26 -6.322 26.108 -0.369 1.00 0.00 C ATOM 419 CD LYS A 26 -6.608 27.610 -0.298 1.00 0.00 C ATOM 420 CE LYS A 26 -7.337 28.049 -1.570 1.00 0.00 C ATOM 421 NZ LYS A 26 -7.508 29.530 -1.563 1.00 0.00 N ATOM 0 H LYS A 26 -6.937 23.233 1.852 1.00 0.00 H new ATOM 0 HA LYS A 26 -4.883 23.933 -0.188 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -6.195 25.871 1.773 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -4.656 26.199 1.002 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -5.717 25.886 -1.248 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.256 25.557 -0.477 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -7.216 27.835 0.579 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -5.676 28.164 -0.190 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -6.771 27.742 -2.450 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -8.310 27.561 -1.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -8.003 29.826 -2.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -8.065 29.811 -0.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -6.575 29.987 -1.525 1.00 0.00 H new ATOM 435 N LEU A 27 -3.128 24.152 1.761 1.00 0.00 N ATOM 436 CA LEU A 27 -2.096 23.783 2.771 1.00 0.00 C ATOM 437 C LEU A 27 -1.258 24.997 3.136 1.00 0.00 C ATOM 438 O LEU A 27 -0.837 25.750 2.286 1.00 0.00 O ATOM 439 CB LEU A 27 -1.166 22.722 2.177 1.00 0.00 C ATOM 440 CG LEU A 27 -1.893 21.379 2.048 1.00 0.00 C ATOM 441 CD1 LEU A 27 -0.928 20.360 1.439 1.00 0.00 C ATOM 442 CD2 LEU A 27 -2.367 20.890 3.434 1.00 0.00 C ATOM 0 H LEU A 27 -2.791 24.742 1.001 1.00 0.00 H new ATOM 0 HA LEU A 27 -2.599 23.402 3.660 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -0.814 23.046 1.198 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -0.286 22.606 2.810 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.768 21.496 1.408 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -1.430 19.398 1.340 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.608 20.705 0.456 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.058 20.251 2.087 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -2.882 19.935 3.327 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.506 20.766 4.090 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -3.049 21.623 3.865 1.00 0.00 H new ATOM 454 N LYS A 28 -0.978 25.167 4.398 1.00 0.00 N ATOM 455 CA LYS A 28 -0.125 26.303 4.830 1.00 0.00 C ATOM 456 C LYS A 28 1.277 25.740 5.058 1.00 0.00 C ATOM 457 O LYS A 28 1.430 24.573 5.361 1.00 0.00 O ATOM 458 CB LYS A 28 -0.655 26.869 6.153 1.00 0.00 C ATOM 459 CG LYS A 28 -2.164 27.113 6.061 1.00 0.00 C ATOM 460 CD LYS A 28 -2.460 28.181 5.008 1.00 0.00 C ATOM 461 CE LYS A 28 -3.886 28.705 5.198 1.00 0.00 C ATOM 462 NZ LYS A 28 -3.987 29.400 6.513 1.00 0.00 N ATOM 0 H LYS A 28 -1.307 24.563 5.151 1.00 0.00 H new ATOM 0 HA LYS A 28 -0.122 27.096 4.082 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -0.441 26.174 6.965 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -0.143 27.802 6.388 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -2.675 26.185 5.803 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -2.549 27.430 7.030 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -1.746 29.000 5.095 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -2.345 27.762 4.008 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -4.144 29.391 4.391 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -4.597 27.880 5.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -4.690 30.164 6.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -4.281 28.720 7.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -3.061 29.801 6.766 1.00 0.00 H new ATOM 476 N LYS A 29 2.303 26.537 4.929 1.00 0.00 N ATOM 477 CA LYS A 29 3.679 26.014 5.159 1.00 0.00 C ATOM 478 C LYS A 29 3.690 25.214 6.459 1.00 0.00 C ATOM 479 O LYS A 29 4.525 24.358 6.679 1.00 0.00 O ATOM 480 CB LYS A 29 4.655 27.196 5.266 1.00 0.00 C ATOM 481 CG LYS A 29 4.414 27.970 6.571 1.00 0.00 C ATOM 482 CD LYS A 29 5.214 29.274 6.545 1.00 0.00 C ATOM 483 CE LYS A 29 5.176 29.923 7.930 1.00 0.00 C ATOM 484 NZ LYS A 29 5.757 31.294 7.853 1.00 0.00 N ATOM 0 H LYS A 29 2.248 27.523 4.675 1.00 0.00 H new ATOM 0 HA LYS A 29 3.982 25.371 4.332 1.00 0.00 H new ATOM 0 HB2 LYS A 29 5.682 26.832 5.235 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.527 27.861 4.412 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.352 28.185 6.688 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.713 27.364 7.426 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.245 29.075 6.253 1.00 0.00 H new ATOM 0 HD3 LYS A 29 4.798 29.954 5.801 1.00 0.00 H new ATOM 0 HE2 LYS A 29 4.149 29.972 8.292 1.00 0.00 H new ATOM 0 HE3 LYS A 29 5.737 29.318 8.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 5.731 31.735 8.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 6.742 31.236 7.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 5.203 31.869 7.186 1.00 0.00 H new ATOM 498 N SER A 30 2.760 25.503 7.318 1.00 0.00 N ATOM 499 CA SER A 30 2.690 24.780 8.621 1.00 0.00 C ATOM 500 C SER A 30 2.150 23.361 8.425 1.00 0.00 C ATOM 501 O SER A 30 2.779 22.396 8.808 1.00 0.00 O ATOM 502 CB SER A 30 1.774 25.540 9.578 1.00 0.00 C ATOM 503 OG SER A 30 1.712 24.845 10.817 1.00 0.00 O ATOM 0 H SER A 30 2.040 26.211 7.177 1.00 0.00 H new ATOM 0 HA SER A 30 3.696 24.719 9.037 1.00 0.00 H new ATOM 0 HB2 SER A 30 2.149 26.552 9.733 1.00 0.00 H new ATOM 0 HB3 SER A 30 0.776 25.632 9.149 1.00 0.00 H new ATOM 0 HG SER A 30 1.126 25.330 11.435 1.00 0.00 H new ATOM 509 N GLU A 31 0.996 23.214 7.829 1.00 0.00 N ATOM 510 CA GLU A 31 0.449 21.851 7.625 1.00 0.00 C ATOM 511 C GLU A 31 1.325 21.139 6.603 1.00 0.00 C ATOM 512 O GLU A 31 1.477 19.935 6.627 1.00 0.00 O ATOM 513 CB GLU A 31 -0.998 21.943 7.132 1.00 0.00 C ATOM 514 CG GLU A 31 -1.619 20.547 7.090 1.00 0.00 C ATOM 515 CD GLU A 31 -3.130 20.672 6.890 1.00 0.00 C ATOM 516 OE1 GLU A 31 -3.532 21.309 5.931 1.00 0.00 O ATOM 517 OE2 GLU A 31 -3.861 20.136 7.706 1.00 0.00 O ATOM 0 H GLU A 31 0.416 23.976 7.479 1.00 0.00 H new ATOM 0 HA GLU A 31 0.450 21.291 8.560 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.577 22.589 7.792 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.026 22.394 6.140 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -1.180 19.965 6.279 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -1.406 20.014 8.016 1.00 0.00 H new ATOM 524 N LEU A 32 1.914 21.885 5.709 1.00 0.00 N ATOM 525 CA LEU A 32 2.796 21.266 4.691 1.00 0.00 C ATOM 526 C LEU A 32 3.965 20.587 5.408 1.00 0.00 C ATOM 527 O LEU A 32 4.380 19.511 5.045 1.00 0.00 O ATOM 528 CB LEU A 32 3.316 22.364 3.753 1.00 0.00 C ATOM 529 CG LEU A 32 4.163 21.751 2.600 1.00 0.00 C ATOM 530 CD1 LEU A 32 3.833 22.456 1.276 1.00 0.00 C ATOM 531 CD2 LEU A 32 5.660 21.932 2.891 1.00 0.00 C ATOM 0 H LEU A 32 1.820 22.898 5.643 1.00 0.00 H new ATOM 0 HA LEU A 32 2.250 20.525 4.106 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.476 22.921 3.337 1.00 0.00 H new ATOM 0 HB3 LEU A 32 3.921 23.074 4.317 1.00 0.00 H new ATOM 0 HG LEU A 32 3.927 20.689 2.525 1.00 0.00 H new ATOM 0 HD11 LEU A 32 4.430 22.022 0.474 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.774 22.329 1.050 1.00 0.00 H new ATOM 0 HD13 LEU A 32 4.061 23.518 1.363 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.244 21.500 2.078 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.888 22.994 2.976 1.00 0.00 H new ATOM 0 HD23 LEU A 32 5.912 21.431 3.825 1.00 0.00 H new ATOM 543 N LYS A 33 4.495 21.213 6.429 1.00 0.00 N ATOM 544 CA LYS A 33 5.638 20.602 7.179 1.00 0.00 C ATOM 545 C LYS A 33 5.241 19.251 7.788 1.00 0.00 C ATOM 546 O LYS A 33 6.022 18.319 7.798 1.00 0.00 O ATOM 547 CB LYS A 33 6.073 21.548 8.305 1.00 0.00 C ATOM 548 CG LYS A 33 7.230 20.922 9.099 1.00 0.00 C ATOM 549 CD LYS A 33 7.667 21.881 10.206 1.00 0.00 C ATOM 550 CE LYS A 33 8.819 21.263 11.007 1.00 0.00 C ATOM 551 NZ LYS A 33 8.879 21.897 12.354 1.00 0.00 N ATOM 0 H LYS A 33 4.186 22.121 6.776 1.00 0.00 H new ATOM 0 HA LYS A 33 6.458 20.442 6.479 1.00 0.00 H new ATOM 0 HB2 LYS A 33 6.384 22.505 7.887 1.00 0.00 H new ATOM 0 HB3 LYS A 33 5.232 21.748 8.969 1.00 0.00 H new ATOM 0 HG2 LYS A 33 6.917 19.971 9.530 1.00 0.00 H new ATOM 0 HG3 LYS A 33 8.068 20.710 8.435 1.00 0.00 H new ATOM 0 HD2 LYS A 33 7.982 22.831 9.773 1.00 0.00 H new ATOM 0 HD3 LYS A 33 6.827 22.095 10.867 1.00 0.00 H new ATOM 0 HE2 LYS A 33 8.673 20.187 11.105 1.00 0.00 H new ATOM 0 HE3 LYS A 33 9.762 21.410 10.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 9.872 22.036 12.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 8.395 22.817 12.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 8.411 21.281 13.049 1.00 0.00 H new ATOM 565 N GLU A 34 4.052 19.134 8.311 1.00 0.00 N ATOM 566 CA GLU A 34 3.640 17.849 8.930 1.00 0.00 C ATOM 567 C GLU A 34 3.501 16.806 7.835 1.00 0.00 C ATOM 568 O GLU A 34 3.769 15.642 8.030 1.00 0.00 O ATOM 569 CB GLU A 34 2.307 18.035 9.681 1.00 0.00 C ATOM 570 CG GLU A 34 2.567 18.494 11.124 1.00 0.00 C ATOM 571 CD GLU A 34 3.260 19.857 11.127 1.00 0.00 C ATOM 572 OE1 GLU A 34 3.250 20.507 10.098 1.00 0.00 O ATOM 573 OE2 GLU A 34 3.790 20.227 12.161 1.00 0.00 O ATOM 0 H GLU A 34 3.350 19.874 8.335 1.00 0.00 H new ATOM 0 HA GLU A 34 4.390 17.518 9.649 1.00 0.00 H new ATOM 0 HB2 GLU A 34 1.690 18.770 9.164 1.00 0.00 H new ATOM 0 HB3 GLU A 34 1.750 17.098 9.685 1.00 0.00 H new ATOM 0 HG2 GLU A 34 1.625 18.555 11.669 1.00 0.00 H new ATOM 0 HG3 GLU A 34 3.187 17.761 11.640 1.00 0.00 H new ATOM 580 N LEU A 35 3.090 17.209 6.679 1.00 0.00 N ATOM 581 CA LEU A 35 2.965 16.231 5.583 1.00 0.00 C ATOM 582 C LEU A 35 4.350 15.669 5.282 1.00 0.00 C ATOM 583 O LEU A 35 4.545 14.484 5.218 1.00 0.00 O ATOM 584 CB LEU A 35 2.412 16.936 4.343 1.00 0.00 C ATOM 585 CG LEU A 35 2.206 15.920 3.206 1.00 0.00 C ATOM 586 CD1 LEU A 35 1.276 16.535 2.155 1.00 0.00 C ATOM 587 CD2 LEU A 35 3.557 15.521 2.555 1.00 0.00 C ATOM 0 H LEU A 35 2.836 18.169 6.445 1.00 0.00 H new ATOM 0 HA LEU A 35 2.290 15.423 5.866 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.466 17.422 4.583 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.100 17.718 4.022 1.00 0.00 H new ATOM 0 HG LEU A 35 1.759 15.015 3.618 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.123 15.823 1.344 1.00 0.00 H new ATOM 0 HD12 LEU A 35 0.317 16.775 2.614 1.00 0.00 H new ATOM 0 HD13 LEU A 35 1.726 17.445 1.759 1.00 0.00 H new ATOM 0 HD21 LEU A 35 3.377 14.802 1.755 1.00 0.00 H new ATOM 0 HD22 LEU A 35 4.039 16.408 2.144 1.00 0.00 H new ATOM 0 HD23 LEU A 35 4.205 15.072 3.308 1.00 0.00 H new ATOM 599 N ILE A 36 5.313 16.521 5.087 1.00 0.00 N ATOM 600 CA ILE A 36 6.687 16.041 4.762 1.00 0.00 C ATOM 601 C ILE A 36 7.412 15.500 6.004 1.00 0.00 C ATOM 602 O ILE A 36 8.044 14.463 5.965 1.00 0.00 O ATOM 603 CB ILE A 36 7.502 17.204 4.191 1.00 0.00 C ATOM 604 CG1 ILE A 36 6.828 17.739 2.924 1.00 0.00 C ATOM 605 CG2 ILE A 36 8.906 16.709 3.836 1.00 0.00 C ATOM 606 CD1 ILE A 36 7.546 19.008 2.458 1.00 0.00 C ATOM 0 H ILE A 36 5.210 17.535 5.138 1.00 0.00 H new ATOM 0 HA ILE A 36 6.595 15.232 4.038 1.00 0.00 H new ATOM 0 HB ILE A 36 7.562 17.999 4.934 1.00 0.00 H new ATOM 0 HG12 ILE A 36 6.856 16.984 2.138 1.00 0.00 H new ATOM 0 HG13 ILE A 36 5.778 17.955 3.122 1.00 0.00 H new ATOM 0 HG21 ILE A 36 9.491 17.534 3.429 1.00 0.00 H new ATOM 0 HG22 ILE A 36 9.394 16.326 4.732 1.00 0.00 H new ATOM 0 HG23 ILE A 36 8.835 15.914 3.094 1.00 0.00 H new ATOM 0 HD11 ILE A 36 7.065 19.388 1.556 1.00 0.00 H new ATOM 0 HD12 ILE A 36 7.495 19.764 3.242 1.00 0.00 H new ATOM 0 HD13 ILE A 36 8.590 18.778 2.243 1.00 0.00 H new ATOM 618 N ASN A 37 7.376 16.231 7.084 1.00 0.00 N ATOM 619 CA ASN A 37 8.116 15.813 8.314 1.00 0.00 C ATOM 620 C ASN A 37 7.571 14.516 8.920 1.00 0.00 C ATOM 621 O ASN A 37 8.319 13.695 9.413 1.00 0.00 O ATOM 622 CB ASN A 37 8.012 16.933 9.353 1.00 0.00 C ATOM 623 CG ASN A 37 8.801 16.552 10.607 1.00 0.00 C ATOM 624 OD1 ASN A 37 8.718 17.222 11.617 1.00 0.00 O ATOM 625 ND2 ASN A 37 9.562 15.495 10.585 1.00 0.00 N ATOM 0 H ASN A 37 6.862 17.108 7.170 1.00 0.00 H new ATOM 0 HA ASN A 37 9.152 15.628 8.030 1.00 0.00 H new ATOM 0 HB2 ASN A 37 8.399 17.864 8.938 1.00 0.00 H new ATOM 0 HB3 ASN A 37 6.967 17.108 9.609 1.00 0.00 H new ATOM 0 HD21 ASN A 37 10.089 15.229 11.417 1.00 0.00 H new ATOM 0 HD22 ASN A 37 9.631 14.934 9.736 1.00 0.00 H new ATOM 632 N ASN A 38 6.281 14.346 8.938 1.00 0.00 N ATOM 633 CA ASN A 38 5.687 13.121 9.573 1.00 0.00 C ATOM 634 C ASN A 38 5.369 12.027 8.552 1.00 0.00 C ATOM 635 O ASN A 38 5.518 10.855 8.837 1.00 0.00 O ATOM 636 CB ASN A 38 4.395 13.509 10.293 1.00 0.00 C ATOM 637 CG ASN A 38 3.899 12.321 11.121 1.00 0.00 C ATOM 638 OD1 ASN A 38 2.820 12.362 11.678 1.00 0.00 O ATOM 639 ND2 ASN A 38 4.640 11.251 11.214 1.00 0.00 N ATOM 0 H ASN A 38 5.604 14.999 8.542 1.00 0.00 H new ATOM 0 HA ASN A 38 6.426 12.723 10.269 1.00 0.00 H new ATOM 0 HB2 ASN A 38 4.570 14.369 10.939 1.00 0.00 H new ATOM 0 HB3 ASN A 38 3.636 13.804 9.568 1.00 0.00 H new ATOM 0 HD21 ASN A 38 4.313 10.450 11.754 1.00 0.00 H new ATOM 0 HD22 ASN A 38 5.546 11.216 10.747 1.00 0.00 H new ATOM 646 N GLU A 39 4.907 12.372 7.384 1.00 0.00 N ATOM 647 CA GLU A 39 4.565 11.302 6.405 1.00 0.00 C ATOM 648 C GLU A 39 5.845 10.610 5.953 1.00 0.00 C ATOM 649 O GLU A 39 5.890 9.407 5.791 1.00 0.00 O ATOM 650 CB GLU A 39 3.868 11.905 5.179 1.00 0.00 C ATOM 651 CG GLU A 39 3.202 10.796 4.374 1.00 0.00 C ATOM 652 CD GLU A 39 2.547 11.408 3.137 1.00 0.00 C ATOM 653 OE1 GLU A 39 2.301 12.603 3.150 1.00 0.00 O ATOM 654 OE2 GLU A 39 2.331 10.679 2.187 1.00 0.00 O ATOM 0 H GLU A 39 4.753 13.329 7.068 1.00 0.00 H new ATOM 0 HA GLU A 39 3.895 10.587 6.883 1.00 0.00 H new ATOM 0 HB2 GLU A 39 3.124 12.637 5.494 1.00 0.00 H new ATOM 0 HB3 GLU A 39 4.592 12.433 4.559 1.00 0.00 H new ATOM 0 HG2 GLU A 39 3.939 10.049 4.080 1.00 0.00 H new ATOM 0 HG3 GLU A 39 2.456 10.285 4.982 1.00 0.00 H new ATOM 661 N LEU A 40 6.887 11.372 5.734 1.00 0.00 N ATOM 662 CA LEU A 40 8.177 10.780 5.270 1.00 0.00 C ATOM 663 C LEU A 40 9.159 10.721 6.446 1.00 0.00 C ATOM 664 O LEU A 40 10.188 11.368 6.444 1.00 0.00 O ATOM 665 CB LEU A 40 8.759 11.655 4.147 1.00 0.00 C ATOM 666 CG LEU A 40 7.633 12.198 3.252 1.00 0.00 C ATOM 667 CD1 LEU A 40 8.247 12.984 2.090 1.00 0.00 C ATOM 668 CD2 LEU A 40 6.797 11.042 2.686 1.00 0.00 C ATOM 0 H LEU A 40 6.899 12.384 5.858 1.00 0.00 H new ATOM 0 HA LEU A 40 8.008 9.772 4.892 1.00 0.00 H new ATOM 0 HB2 LEU A 40 9.321 12.484 4.577 1.00 0.00 H new ATOM 0 HB3 LEU A 40 9.459 11.072 3.548 1.00 0.00 H new ATOM 0 HG LEU A 40 6.990 12.846 3.848 1.00 0.00 H new ATOM 0 HD11 LEU A 40 7.452 13.371 1.452 1.00 0.00 H new ATOM 0 HD12 LEU A 40 8.834 13.814 2.482 1.00 0.00 H new ATOM 0 HD13 LEU A 40 8.892 12.327 1.507 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.004 11.442 2.054 1.00 0.00 H new ATOM 0 HD22 LEU A 40 7.436 10.386 2.095 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.357 10.476 3.507 1.00 0.00 H new ATOM 680 N SER A 41 8.845 9.954 7.453 1.00 0.00 N ATOM 681 CA SER A 41 9.757 9.858 8.628 1.00 0.00 C ATOM 682 C SER A 41 11.128 9.330 8.189 1.00 0.00 C ATOM 683 O SER A 41 12.151 9.782 8.665 1.00 0.00 O ATOM 684 CB SER A 41 9.159 8.902 9.661 1.00 0.00 C ATOM 685 OG SER A 41 9.899 8.997 10.872 1.00 0.00 O ATOM 0 H SER A 41 7.997 9.390 7.514 1.00 0.00 H new ATOM 0 HA SER A 41 9.876 10.849 9.065 1.00 0.00 H new ATOM 0 HB2 SER A 41 8.113 9.150 9.840 1.00 0.00 H new ATOM 0 HB3 SER A 41 9.185 7.879 9.285 1.00 0.00 H new ATOM 0 HG SER A 41 9.518 8.387 11.537 1.00 0.00 H new ATOM 691 N HIS A 42 11.160 8.367 7.296 1.00 0.00 N ATOM 692 CA HIS A 42 12.473 7.798 6.838 1.00 0.00 C ATOM 693 C HIS A 42 12.479 7.615 5.314 1.00 0.00 C ATOM 694 O HIS A 42 13.523 7.490 4.705 1.00 0.00 O ATOM 695 CB HIS A 42 12.687 6.442 7.516 1.00 0.00 C ATOM 696 CG HIS A 42 13.975 5.830 7.037 1.00 0.00 C ATOM 697 ND1 HIS A 42 15.214 6.373 7.349 1.00 0.00 N ATOM 698 CD2 HIS A 42 14.233 4.716 6.278 1.00 0.00 C ATOM 699 CE1 HIS A 42 16.153 5.590 6.785 1.00 0.00 C ATOM 700 NE2 HIS A 42 15.606 4.568 6.123 1.00 0.00 N ATOM 0 H HIS A 42 10.335 7.950 6.864 1.00 0.00 H new ATOM 0 HA HIS A 42 13.275 8.486 7.107 1.00 0.00 H new ATOM 0 HB2 HIS A 42 12.713 6.567 8.599 1.00 0.00 H new ATOM 0 HB3 HIS A 42 11.853 5.777 7.292 1.00 0.00 H new ATOM 0 HD2 HIS A 42 13.484 4.056 5.865 1.00 0.00 H new ATOM 0 HE1 HIS A 42 17.216 5.767 6.859 1.00 0.00 H new ATOM 0 HE2 HIS A 42 16.093 3.833 5.611 1.00 0.00 H new ATOM 709 N PHE A 43 11.332 7.594 4.690 1.00 0.00 N ATOM 710 CA PHE A 43 11.295 7.417 3.207 1.00 0.00 C ATOM 711 C PHE A 43 12.038 8.571 2.523 1.00 0.00 C ATOM 712 O PHE A 43 12.754 8.370 1.562 1.00 0.00 O ATOM 713 CB PHE A 43 9.838 7.359 2.727 1.00 0.00 C ATOM 714 CG PHE A 43 9.792 7.198 1.217 1.00 0.00 C ATOM 715 CD1 PHE A 43 10.385 6.082 0.603 1.00 0.00 C ATOM 716 CD2 PHE A 43 9.159 8.169 0.428 1.00 0.00 C ATOM 717 CE1 PHE A 43 10.346 5.948 -0.792 1.00 0.00 C ATOM 718 CE2 PHE A 43 9.119 8.030 -0.963 1.00 0.00 C ATOM 719 CZ PHE A 43 9.715 6.922 -1.573 1.00 0.00 C ATOM 0 H PHE A 43 10.422 7.691 5.140 1.00 0.00 H new ATOM 0 HA PHE A 43 11.789 6.481 2.944 1.00 0.00 H new ATOM 0 HB2 PHE A 43 9.322 6.526 3.205 1.00 0.00 H new ATOM 0 HB3 PHE A 43 9.314 8.269 3.020 1.00 0.00 H new ATOM 0 HD1 PHE A 43 10.870 5.328 1.205 1.00 0.00 H new ATOM 0 HD2 PHE A 43 8.701 9.027 0.896 1.00 0.00 H new ATOM 0 HE1 PHE A 43 10.804 5.091 -1.264 1.00 0.00 H new ATOM 0 HE2 PHE A 43 8.628 8.779 -1.566 1.00 0.00 H new ATOM 0 HZ PHE A 43 9.688 6.818 -2.648 1.00 0.00 H new ATOM 729 N LEU A 44 11.880 9.777 3.014 1.00 0.00 N ATOM 730 CA LEU A 44 12.580 10.956 2.405 1.00 0.00 C ATOM 731 C LEU A 44 13.323 11.685 3.519 1.00 0.00 C ATOM 732 O LEU A 44 13.009 11.527 4.683 1.00 0.00 O ATOM 733 CB LEU A 44 11.544 11.900 1.785 1.00 0.00 C ATOM 734 CG LEU A 44 12.230 12.924 0.863 1.00 0.00 C ATOM 735 CD1 LEU A 44 12.795 12.234 -0.399 1.00 0.00 C ATOM 736 CD2 LEU A 44 11.203 13.992 0.464 1.00 0.00 C ATOM 0 H LEU A 44 11.291 9.998 3.817 1.00 0.00 H new ATOM 0 HA LEU A 44 13.274 10.630 1.630 1.00 0.00 H new ATOM 0 HB2 LEU A 44 10.812 11.324 1.218 1.00 0.00 H new ATOM 0 HB3 LEU A 44 10.999 12.420 2.573 1.00 0.00 H new ATOM 0 HG LEU A 44 13.063 13.386 1.394 1.00 0.00 H new ATOM 0 HD11 LEU A 44 13.275 12.977 -1.036 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.526 11.481 -0.105 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.983 11.757 -0.947 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.676 14.725 -0.190 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.372 13.520 -0.061 1.00 0.00 H new ATOM 0 HD23 LEU A 44 10.831 14.491 1.359 1.00 0.00 H new ATOM 748 N GLU A 45 14.303 12.478 3.195 1.00 0.00 N ATOM 749 CA GLU A 45 15.031 13.187 4.275 1.00 0.00 C ATOM 750 C GLU A 45 14.019 13.948 5.137 1.00 0.00 C ATOM 751 O GLU A 45 13.371 14.877 4.698 1.00 0.00 O ATOM 752 CB GLU A 45 16.065 14.150 3.667 1.00 0.00 C ATOM 753 CG GLU A 45 15.382 15.413 3.120 1.00 0.00 C ATOM 754 CD GLU A 45 16.313 16.115 2.128 1.00 0.00 C ATOM 755 OE1 GLU A 45 17.516 16.001 2.293 1.00 0.00 O ATOM 756 OE2 GLU A 45 15.806 16.757 1.223 1.00 0.00 O ATOM 0 H GLU A 45 14.626 12.663 2.245 1.00 0.00 H new ATOM 0 HA GLU A 45 15.564 12.470 4.899 1.00 0.00 H new ATOM 0 HB2 GLU A 45 16.799 14.427 4.424 1.00 0.00 H new ATOM 0 HB3 GLU A 45 16.608 13.649 2.865 1.00 0.00 H new ATOM 0 HG2 GLU A 45 14.445 15.148 2.629 1.00 0.00 H new ATOM 0 HG3 GLU A 45 15.133 16.087 3.939 1.00 0.00 H new ATOM 763 N GLU A 46 13.867 13.536 6.357 1.00 0.00 N ATOM 764 CA GLU A 46 12.896 14.205 7.265 1.00 0.00 C ATOM 765 C GLU A 46 13.368 15.638 7.555 1.00 0.00 C ATOM 766 O GLU A 46 14.548 15.925 7.547 1.00 0.00 O ATOM 767 CB GLU A 46 12.802 13.404 8.565 1.00 0.00 C ATOM 768 CG GLU A 46 11.719 14.004 9.456 1.00 0.00 C ATOM 769 CD GLU A 46 11.626 13.200 10.755 1.00 0.00 C ATOM 770 OE1 GLU A 46 12.306 12.193 10.854 1.00 0.00 O ATOM 771 OE2 GLU A 46 10.871 13.603 11.624 1.00 0.00 O ATOM 0 H GLU A 46 14.377 12.757 6.772 1.00 0.00 H new ATOM 0 HA GLU A 46 11.913 14.249 6.796 1.00 0.00 H new ATOM 0 HB2 GLU A 46 12.571 12.361 8.346 1.00 0.00 H new ATOM 0 HB3 GLU A 46 13.761 13.416 9.082 1.00 0.00 H new ATOM 0 HG2 GLU A 46 11.950 15.046 9.676 1.00 0.00 H new ATOM 0 HG3 GLU A 46 10.760 13.993 8.939 1.00 0.00 H new ATOM 778 N ILE A 47 12.452 16.545 7.794 1.00 0.00 N ATOM 779 CA ILE A 47 12.844 17.966 8.065 1.00 0.00 C ATOM 780 C ILE A 47 13.108 18.161 9.560 1.00 0.00 C ATOM 781 O ILE A 47 12.398 17.635 10.394 1.00 0.00 O ATOM 782 CB ILE A 47 11.700 18.893 7.643 1.00 0.00 C ATOM 783 CG1 ILE A 47 11.187 18.444 6.272 1.00 0.00 C ATOM 784 CG2 ILE A 47 12.181 20.369 7.572 1.00 0.00 C ATOM 785 CD1 ILE A 47 10.168 19.458 5.766 1.00 0.00 C ATOM 0 H ILE A 47 11.448 16.363 7.813 1.00 0.00 H new ATOM 0 HA ILE A 47 13.748 18.199 7.502 1.00 0.00 H new ATOM 0 HB ILE A 47 10.900 18.836 8.381 1.00 0.00 H new ATOM 0 HG12 ILE A 47 12.016 18.361 5.569 1.00 0.00 H new ATOM 0 HG13 ILE A 47 10.731 17.457 6.346 1.00 0.00 H new ATOM 0 HG21 ILE A 47 11.351 21.008 7.270 1.00 0.00 H new ATOM 0 HG22 ILE A 47 12.542 20.682 8.552 1.00 0.00 H new ATOM 0 HG23 ILE A 47 12.988 20.454 6.844 1.00 0.00 H new ATOM 0 HD11 ILE A 47 9.798 19.145 4.790 1.00 0.00 H new ATOM 0 HD12 ILE A 47 9.336 19.519 6.467 1.00 0.00 H new ATOM 0 HD13 ILE A 47 10.641 20.436 5.679 1.00 0.00 H new ATOM 797 N LYS A 48 14.124 18.917 9.902 1.00 0.00 N ATOM 798 CA LYS A 48 14.450 19.159 11.345 1.00 0.00 C ATOM 799 C LYS A 48 14.245 20.644 11.670 1.00 0.00 C ATOM 800 O LYS A 48 14.229 21.035 12.821 1.00 0.00 O ATOM 801 CB LYS A 48 15.920 18.777 11.616 1.00 0.00 C ATOM 802 CG LYS A 48 16.291 17.467 10.896 1.00 0.00 C ATOM 803 CD LYS A 48 15.626 16.257 11.580 1.00 0.00 C ATOM 804 CE LYS A 48 15.492 15.111 10.575 1.00 0.00 C ATOM 805 NZ LYS A 48 15.061 13.872 11.285 1.00 0.00 N ATOM 0 H LYS A 48 14.746 19.380 9.239 1.00 0.00 H new ATOM 0 HA LYS A 48 13.796 18.551 11.970 1.00 0.00 H new ATOM 0 HB2 LYS A 48 16.576 19.580 11.279 1.00 0.00 H new ATOM 0 HB3 LYS A 48 16.079 18.664 12.689 1.00 0.00 H new ATOM 0 HG2 LYS A 48 15.977 17.519 9.854 1.00 0.00 H new ATOM 0 HG3 LYS A 48 17.374 17.341 10.897 1.00 0.00 H new ATOM 0 HD2 LYS A 48 16.221 15.937 12.435 1.00 0.00 H new ATOM 0 HD3 LYS A 48 14.644 16.536 11.962 1.00 0.00 H new ATOM 0 HE2 LYS A 48 14.766 15.372 9.805 1.00 0.00 H new ATOM 0 HE3 LYS A 48 16.444 14.942 10.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 15.181 13.052 10.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 15.640 13.742 12.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 14.060 13.957 11.555 1.00 0.00 H new ATOM 819 N GLU A 49 14.098 21.477 10.667 1.00 0.00 N ATOM 820 CA GLU A 49 13.906 22.941 10.918 1.00 0.00 C ATOM 821 C GLU A 49 12.827 23.490 9.970 1.00 0.00 C ATOM 822 O GLU A 49 12.794 23.174 8.797 1.00 0.00 O ATOM 823 CB GLU A 49 15.238 23.657 10.679 1.00 0.00 C ATOM 824 CG GLU A 49 15.146 25.109 11.160 1.00 0.00 C ATOM 825 CD GLU A 49 15.044 25.140 12.686 1.00 0.00 C ATOM 826 OE1 GLU A 49 15.413 24.156 13.306 1.00 0.00 O ATOM 827 OE2 GLU A 49 14.597 26.148 13.209 1.00 0.00 O ATOM 0 H GLU A 49 14.103 21.206 9.684 1.00 0.00 H new ATOM 0 HA GLU A 49 13.582 23.108 11.945 1.00 0.00 H new ATOM 0 HB2 GLU A 49 16.038 23.140 11.208 1.00 0.00 H new ATOM 0 HB3 GLU A 49 15.489 23.632 9.619 1.00 0.00 H new ATOM 0 HG2 GLU A 49 16.023 25.667 10.833 1.00 0.00 H new ATOM 0 HG3 GLU A 49 14.276 25.595 10.718 1.00 0.00 H new ATOM 834 N GLN A 50 11.932 24.294 10.485 1.00 0.00 N ATOM 835 CA GLN A 50 10.829 24.856 9.640 1.00 0.00 C ATOM 836 C GLN A 50 11.402 25.758 8.533 1.00 0.00 C ATOM 837 O GLN A 50 10.760 26.002 7.536 1.00 0.00 O ATOM 838 CB GLN A 50 9.860 25.675 10.525 1.00 0.00 C ATOM 839 CG GLN A 50 9.897 25.157 11.974 1.00 0.00 C ATOM 840 CD GLN A 50 11.051 25.830 12.724 1.00 0.00 C ATOM 841 OE1 GLN A 50 11.000 25.996 13.927 1.00 0.00 O ATOM 842 NE2 GLN A 50 12.098 26.225 12.050 1.00 0.00 N ATOM 0 H GLN A 50 11.916 24.589 11.461 1.00 0.00 H new ATOM 0 HA GLN A 50 10.291 24.030 9.175 1.00 0.00 H new ATOM 0 HB2 GLN A 50 10.137 26.729 10.501 1.00 0.00 H new ATOM 0 HB3 GLN A 50 8.846 25.602 10.131 1.00 0.00 H new ATOM 0 HG2 GLN A 50 8.951 25.370 12.472 1.00 0.00 H new ATOM 0 HG3 GLN A 50 10.025 24.075 11.982 1.00 0.00 H new ATOM 0 HE21 GLN A 50 12.138 26.084 11.041 1.00 0.00 H new ATOM 0 HE22 GLN A 50 12.876 26.674 12.533 1.00 0.00 H new ATOM 851 N GLU A 51 12.588 26.269 8.702 1.00 0.00 N ATOM 852 CA GLU A 51 13.170 27.164 7.653 1.00 0.00 C ATOM 853 C GLU A 51 13.282 26.407 6.338 1.00 0.00 C ATOM 854 O GLU A 51 13.037 26.949 5.283 1.00 0.00 O ATOM 855 CB GLU A 51 14.559 27.645 8.095 1.00 0.00 C ATOM 856 CG GLU A 51 15.552 26.479 8.041 1.00 0.00 C ATOM 857 CD GLU A 51 16.868 26.894 8.699 1.00 0.00 C ATOM 858 OE1 GLU A 51 17.063 28.083 8.892 1.00 0.00 O ATOM 859 OE2 GLU A 51 17.661 26.016 8.996 1.00 0.00 O ATOM 0 H GLU A 51 13.181 26.109 9.516 1.00 0.00 H new ATOM 0 HA GLU A 51 12.519 28.027 7.516 1.00 0.00 H new ATOM 0 HB2 GLU A 51 14.897 28.454 7.447 1.00 0.00 H new ATOM 0 HB3 GLU A 51 14.510 28.047 9.107 1.00 0.00 H new ATOM 0 HG2 GLU A 51 15.136 25.611 8.552 1.00 0.00 H new ATOM 0 HG3 GLU A 51 15.728 26.186 7.006 1.00 0.00 H new ATOM 866 N VAL A 52 13.649 25.161 6.386 1.00 0.00 N ATOM 867 CA VAL A 52 13.767 24.389 5.130 1.00 0.00 C ATOM 868 C VAL A 52 12.416 24.379 4.461 1.00 0.00 C ATOM 869 O VAL A 52 12.304 24.489 3.264 1.00 0.00 O ATOM 870 CB VAL A 52 14.182 22.958 5.452 1.00 0.00 C ATOM 871 CG1 VAL A 52 14.108 22.094 4.189 1.00 0.00 C ATOM 872 CG2 VAL A 52 15.602 22.945 6.011 1.00 0.00 C ATOM 0 H VAL A 52 13.871 24.648 7.239 1.00 0.00 H new ATOM 0 HA VAL A 52 14.514 24.838 4.475 1.00 0.00 H new ATOM 0 HB VAL A 52 13.501 22.549 6.199 1.00 0.00 H new ATOM 0 HG11 VAL A 52 14.406 21.073 4.428 1.00 0.00 H new ATOM 0 HG12 VAL A 52 13.087 22.094 3.808 1.00 0.00 H new ATOM 0 HG13 VAL A 52 14.778 22.499 3.431 1.00 0.00 H new ATOM 0 HG21 VAL A 52 15.894 21.920 6.239 1.00 0.00 H new ATOM 0 HG22 VAL A 52 16.287 23.361 5.273 1.00 0.00 H new ATOM 0 HG23 VAL A 52 15.640 23.544 6.921 1.00 0.00 H new ATOM 882 N VAL A 53 11.392 24.237 5.231 1.00 0.00 N ATOM 883 CA VAL A 53 10.037 24.211 4.647 1.00 0.00 C ATOM 884 C VAL A 53 9.764 25.537 3.953 1.00 0.00 C ATOM 885 O VAL A 53 9.182 25.568 2.905 1.00 0.00 O ATOM 886 CB VAL A 53 9.027 23.968 5.767 1.00 0.00 C ATOM 887 CG1 VAL A 53 7.605 23.933 5.206 1.00 0.00 C ATOM 888 CG2 VAL A 53 9.343 22.627 6.438 1.00 0.00 C ATOM 0 H VAL A 53 11.433 24.137 6.245 1.00 0.00 H new ATOM 0 HA VAL A 53 9.952 23.412 3.911 1.00 0.00 H new ATOM 0 HB VAL A 53 9.096 24.778 6.493 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.898 23.759 6.017 1.00 0.00 H new ATOM 0 HG12 VAL A 53 7.380 24.885 4.726 1.00 0.00 H new ATOM 0 HG13 VAL A 53 7.522 23.130 4.474 1.00 0.00 H new ATOM 0 HG21 VAL A 53 8.627 22.444 7.240 1.00 0.00 H new ATOM 0 HG22 VAL A 53 9.275 21.827 5.701 1.00 0.00 H new ATOM 0 HG23 VAL A 53 10.351 22.656 6.851 1.00 0.00 H new ATOM 898 N ASP A 54 10.179 26.628 4.528 1.00 0.00 N ATOM 899 CA ASP A 54 9.933 27.953 3.886 1.00 0.00 C ATOM 900 C ASP A 54 10.624 28.004 2.525 1.00 0.00 C ATOM 901 O ASP A 54 10.103 28.530 1.563 1.00 0.00 O ATOM 902 CB ASP A 54 10.477 29.073 4.778 1.00 0.00 C ATOM 903 CG ASP A 54 10.173 30.429 4.138 1.00 0.00 C ATOM 904 OD1 ASP A 54 9.627 30.439 3.048 1.00 0.00 O ATOM 905 OD2 ASP A 54 10.483 31.436 4.755 1.00 0.00 O ATOM 0 H ASP A 54 10.679 26.663 5.416 1.00 0.00 H new ATOM 0 HA ASP A 54 8.860 28.089 3.752 1.00 0.00 H new ATOM 0 HB2 ASP A 54 10.024 29.016 5.768 1.00 0.00 H new ATOM 0 HB3 ASP A 54 11.552 28.955 4.912 1.00 0.00 H new ATOM 910 N LYS A 55 11.800 27.467 2.448 1.00 0.00 N ATOM 911 CA LYS A 55 12.547 27.480 1.157 1.00 0.00 C ATOM 912 C LYS A 55 11.780 26.642 0.142 1.00 0.00 C ATOM 913 O LYS A 55 11.646 26.996 -1.017 1.00 0.00 O ATOM 914 CB LYS A 55 13.949 26.899 1.365 1.00 0.00 C ATOM 915 CG LYS A 55 14.756 27.041 0.069 1.00 0.00 C ATOM 916 CD LYS A 55 16.216 26.620 0.302 1.00 0.00 C ATOM 917 CE LYS A 55 17.004 27.751 0.981 1.00 0.00 C ATOM 918 NZ LYS A 55 18.464 27.475 0.864 1.00 0.00 N ATOM 0 H LYS A 55 12.284 27.016 3.224 1.00 0.00 H new ATOM 0 HA LYS A 55 12.644 28.502 0.792 1.00 0.00 H new ATOM 0 HB2 LYS A 55 14.453 27.419 2.179 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.881 25.849 1.651 1.00 0.00 H new ATOM 0 HG2 LYS A 55 14.313 26.424 -0.713 1.00 0.00 H new ATOM 0 HG3 LYS A 55 14.719 28.073 -0.279 1.00 0.00 H new ATOM 0 HD2 LYS A 55 16.247 25.725 0.923 1.00 0.00 H new ATOM 0 HD3 LYS A 55 16.683 26.365 -0.649 1.00 0.00 H new ATOM 0 HE2 LYS A 55 16.765 28.707 0.515 1.00 0.00 H new ATOM 0 HE3 LYS A 55 16.720 27.828 2.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 18.973 27.968 1.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 18.631 26.451 0.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 18.808 27.813 -0.057 1.00 0.00 H new ATOM 932 N VAL A 56 11.246 25.542 0.585 1.00 0.00 N ATOM 933 CA VAL A 56 10.456 24.682 -0.328 1.00 0.00 C ATOM 934 C VAL A 56 9.208 25.461 -0.721 1.00 0.00 C ATOM 935 O VAL A 56 8.680 25.315 -1.805 1.00 0.00 O ATOM 936 CB VAL A 56 10.077 23.376 0.393 1.00 0.00 C ATOM 937 CG1 VAL A 56 8.886 22.708 -0.305 1.00 0.00 C ATOM 938 CG2 VAL A 56 11.273 22.421 0.370 1.00 0.00 C ATOM 0 H VAL A 56 11.324 25.202 1.543 1.00 0.00 H new ATOM 0 HA VAL A 56 11.029 24.420 -1.217 1.00 0.00 H new ATOM 0 HB VAL A 56 9.802 23.607 1.422 1.00 0.00 H new ATOM 0 HG11 VAL A 56 8.629 21.786 0.216 1.00 0.00 H new ATOM 0 HG12 VAL A 56 8.030 23.383 -0.290 1.00 0.00 H new ATOM 0 HG13 VAL A 56 9.151 22.480 -1.338 1.00 0.00 H new ATOM 0 HG21 VAL A 56 11.009 21.495 0.880 1.00 0.00 H new ATOM 0 HG22 VAL A 56 11.544 22.202 -0.663 1.00 0.00 H new ATOM 0 HG23 VAL A 56 12.119 22.885 0.877 1.00 0.00 H new ATOM 948 N MET A 57 8.742 26.299 0.160 1.00 0.00 N ATOM 949 CA MET A 57 7.534 27.101 -0.156 1.00 0.00 C ATOM 950 C MET A 57 7.887 28.129 -1.217 1.00 0.00 C ATOM 951 O MET A 57 7.063 28.531 -1.994 1.00 0.00 O ATOM 952 CB MET A 57 6.994 27.782 1.100 1.00 0.00 C ATOM 953 CG MET A 57 6.392 26.718 2.021 1.00 0.00 C ATOM 954 SD MET A 57 4.858 26.084 1.299 1.00 0.00 S ATOM 955 CE MET A 57 3.758 27.418 1.833 1.00 0.00 C ATOM 0 H MET A 57 9.145 26.462 1.083 1.00 0.00 H new ATOM 0 HA MET A 57 6.752 26.444 -0.536 1.00 0.00 H new ATOM 0 HB2 MET A 57 7.794 28.316 1.613 1.00 0.00 H new ATOM 0 HB3 MET A 57 6.238 28.521 0.833 1.00 0.00 H new ATOM 0 HG2 MET A 57 7.102 25.903 2.164 1.00 0.00 H new ATOM 0 HG3 MET A 57 6.194 27.144 3.004 1.00 0.00 H new ATOM 0 HE1 MET A 57 3.034 27.028 2.549 1.00 0.00 H new ATOM 0 HE2 MET A 57 4.345 28.207 2.303 1.00 0.00 H new ATOM 0 HE3 MET A 57 3.232 27.823 0.969 1.00 0.00 H new ATOM 965 N GLU A 58 9.113 28.541 -1.298 1.00 0.00 N ATOM 966 CA GLU A 58 9.457 29.516 -2.359 1.00 0.00 C ATOM 967 C GLU A 58 9.128 28.838 -3.688 1.00 0.00 C ATOM 968 O GLU A 58 8.593 29.440 -4.599 1.00 0.00 O ATOM 969 CB GLU A 58 10.950 29.853 -2.286 1.00 0.00 C ATOM 970 CG GLU A 58 11.303 30.893 -3.351 1.00 0.00 C ATOM 971 CD GLU A 58 12.768 31.303 -3.189 1.00 0.00 C ATOM 972 OE1 GLU A 58 13.387 30.850 -2.239 1.00 0.00 O ATOM 973 OE2 GLU A 58 13.245 32.065 -4.012 1.00 0.00 O ATOM 0 H GLU A 58 9.879 28.253 -0.689 1.00 0.00 H new ATOM 0 HA GLU A 58 8.901 30.447 -2.247 1.00 0.00 H new ATOM 0 HB2 GLU A 58 11.197 30.236 -1.296 1.00 0.00 H new ATOM 0 HB3 GLU A 58 11.543 28.951 -2.436 1.00 0.00 H new ATOM 0 HG2 GLU A 58 11.136 30.482 -4.347 1.00 0.00 H new ATOM 0 HG3 GLU A 58 10.656 31.765 -3.253 1.00 0.00 H new ATOM 980 N THR A 59 9.426 27.571 -3.783 1.00 0.00 N ATOM 981 CA THR A 59 9.118 26.809 -5.027 1.00 0.00 C ATOM 982 C THR A 59 7.624 26.440 -5.098 1.00 0.00 C ATOM 983 O THR A 59 7.017 26.500 -6.148 1.00 0.00 O ATOM 984 CB THR A 59 9.958 25.528 -5.040 1.00 0.00 C ATOM 985 OG1 THR A 59 11.337 25.868 -5.046 1.00 0.00 O ATOM 986 CG2 THR A 59 9.631 24.693 -6.278 1.00 0.00 C ATOM 0 H THR A 59 9.874 27.026 -3.046 1.00 0.00 H new ATOM 0 HA THR A 59 9.355 27.433 -5.889 1.00 0.00 H new ATOM 0 HB THR A 59 9.727 24.943 -4.150 1.00 0.00 H new ATOM 0 HG1 THR A 59 11.876 25.049 -5.053 1.00 0.00 H new ATOM 0 HG21 THR A 59 10.235 23.786 -6.275 1.00 0.00 H new ATOM 0 HG22 THR A 59 8.574 24.426 -6.268 1.00 0.00 H new ATOM 0 HG23 THR A 59 9.850 25.272 -7.175 1.00 0.00 H new ATOM 994 N LEU A 60 7.030 26.030 -4.000 1.00 0.00 N ATOM 995 CA LEU A 60 5.584 25.629 -4.029 1.00 0.00 C ATOM 996 C LEU A 60 4.676 26.834 -3.786 1.00 0.00 C ATOM 997 O LEU A 60 3.498 26.795 -4.084 1.00 0.00 O ATOM 998 CB LEU A 60 5.318 24.571 -2.941 1.00 0.00 C ATOM 999 CG LEU A 60 5.730 23.179 -3.443 1.00 0.00 C ATOM 1000 CD1 LEU A 60 5.662 22.187 -2.272 1.00 0.00 C ATOM 1001 CD2 LEU A 60 4.792 22.721 -4.592 1.00 0.00 C ATOM 0 H LEU A 60 7.482 25.956 -3.088 1.00 0.00 H new ATOM 0 HA LEU A 60 5.365 25.218 -5.014 1.00 0.00 H new ATOM 0 HB2 LEU A 60 5.875 24.820 -2.038 1.00 0.00 H new ATOM 0 HB3 LEU A 60 4.261 24.571 -2.674 1.00 0.00 H new ATOM 0 HG LEU A 60 6.748 23.217 -3.830 1.00 0.00 H new ATOM 0 HD11 LEU A 60 5.953 21.195 -2.618 1.00 0.00 H new ATOM 0 HD12 LEU A 60 6.341 22.509 -1.482 1.00 0.00 H new ATOM 0 HD13 LEU A 60 4.644 22.152 -1.884 1.00 0.00 H new ATOM 0 HD21 LEU A 60 5.096 21.733 -4.938 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.765 22.678 -4.228 1.00 0.00 H new ATOM 0 HD23 LEU A 60 4.855 23.430 -5.418 1.00 0.00 H new ATOM 1013 N ASP A 61 5.192 27.902 -3.258 1.00 0.00 N ATOM 1014 CA ASP A 61 4.319 29.086 -3.022 1.00 0.00 C ATOM 1015 C ASP A 61 4.188 29.829 -4.336 1.00 0.00 C ATOM 1016 O ASP A 61 4.534 30.987 -4.457 1.00 0.00 O ATOM 1017 CB ASP A 61 4.919 30.009 -1.962 1.00 0.00 C ATOM 1018 CG ASP A 61 3.894 31.078 -1.592 1.00 0.00 C ATOM 1019 OD1 ASP A 61 2.817 31.062 -2.168 1.00 0.00 O ATOM 1020 OD2 ASP A 61 4.204 31.899 -0.746 1.00 0.00 O ATOM 0 H ASP A 61 6.168 28.010 -2.981 1.00 0.00 H new ATOM 0 HA ASP A 61 3.345 28.759 -2.659 1.00 0.00 H new ATOM 0 HB2 ASP A 61 5.199 29.435 -1.079 1.00 0.00 H new ATOM 0 HB3 ASP A 61 5.829 30.475 -2.341 1.00 0.00 H new ATOM 1025 N GLU A 62 3.695 29.154 -5.326 1.00 0.00 N ATOM 1026 CA GLU A 62 3.537 29.786 -6.655 1.00 0.00 C ATOM 1027 C GLU A 62 2.608 30.986 -6.511 1.00 0.00 C ATOM 1028 O GLU A 62 2.753 31.986 -7.185 1.00 0.00 O ATOM 1029 CB GLU A 62 2.924 28.773 -7.613 1.00 0.00 C ATOM 1030 CG GLU A 62 3.720 27.465 -7.544 1.00 0.00 C ATOM 1031 CD GLU A 62 3.160 26.471 -8.563 1.00 0.00 C ATOM 1032 OE1 GLU A 62 2.109 26.749 -9.117 1.00 0.00 O ATOM 1033 OE2 GLU A 62 3.791 25.448 -8.773 1.00 0.00 O ATOM 0 H GLU A 62 3.392 28.182 -5.271 1.00 0.00 H new ATOM 0 HA GLU A 62 4.502 30.111 -7.043 1.00 0.00 H new ATOM 0 HB2 GLU A 62 1.882 28.592 -7.351 1.00 0.00 H new ATOM 0 HB3 GLU A 62 2.934 29.165 -8.630 1.00 0.00 H new ATOM 0 HG2 GLU A 62 4.773 27.657 -7.749 1.00 0.00 H new ATOM 0 HG3 GLU A 62 3.662 27.044 -6.540 1.00 0.00 H new ATOM 1040 N ASP A 63 1.660 30.895 -5.623 1.00 0.00 N ATOM 1041 CA ASP A 63 0.726 32.031 -5.416 1.00 0.00 C ATOM 1042 C ASP A 63 1.424 33.087 -4.558 1.00 0.00 C ATOM 1043 O ASP A 63 0.937 34.186 -4.385 1.00 0.00 O ATOM 1044 CB ASP A 63 -0.526 31.532 -4.694 1.00 0.00 C ATOM 1045 CG ASP A 63 -1.212 30.461 -5.542 1.00 0.00 C ATOM 1046 OD1 ASP A 63 -1.410 30.704 -6.721 1.00 0.00 O ATOM 1047 OD2 ASP A 63 -1.528 29.416 -4.998 1.00 0.00 O ATOM 0 H ASP A 63 1.492 30.081 -5.031 1.00 0.00 H new ATOM 0 HA ASP A 63 0.440 32.461 -6.376 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -0.258 31.123 -3.720 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -1.210 32.362 -4.514 1.00 0.00 H new ATOM 1052 N GLY A 64 2.573 32.758 -4.027 1.00 0.00 N ATOM 1053 CA GLY A 64 3.319 33.742 -3.184 1.00 0.00 C ATOM 1054 C GLY A 64 2.475 34.130 -1.965 1.00 0.00 C ATOM 1055 O GLY A 64 2.544 35.247 -1.490 1.00 0.00 O ATOM 0 H GLY A 64 3.027 31.852 -4.140 1.00 0.00 H new ATOM 0 HA2 GLY A 64 4.266 33.311 -2.859 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.557 34.630 -3.770 1.00 0.00 H new ATOM 1059 N ASP A 65 1.670 33.224 -1.460 1.00 0.00 N ATOM 1060 CA ASP A 65 0.804 33.541 -0.275 1.00 0.00 C ATOM 1061 C ASP A 65 1.332 32.834 0.978 1.00 0.00 C ATOM 1062 O ASP A 65 0.734 32.900 2.034 1.00 0.00 O ATOM 1063 CB ASP A 65 -0.625 33.079 -0.570 1.00 0.00 C ATOM 1064 CG ASP A 65 -0.593 31.696 -1.222 1.00 0.00 C ATOM 1065 OD1 ASP A 65 0.482 31.125 -1.306 1.00 0.00 O ATOM 1066 OD2 ASP A 65 -1.646 31.230 -1.625 1.00 0.00 O ATOM 0 H ASP A 65 1.574 32.274 -1.819 1.00 0.00 H new ATOM 0 HA ASP A 65 0.818 34.616 -0.094 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -1.204 33.044 0.353 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -1.119 33.792 -1.230 1.00 0.00 H new ATOM 1071 N GLY A 66 2.439 32.155 0.873 1.00 0.00 N ATOM 1072 CA GLY A 66 2.991 31.442 2.063 1.00 0.00 C ATOM 1073 C GLY A 66 2.240 30.121 2.252 1.00 0.00 C ATOM 1074 O GLY A 66 2.457 29.397 3.203 1.00 0.00 O ATOM 0 H GLY A 66 2.986 32.061 0.017 1.00 0.00 H new ATOM 0 HA2 GLY A 66 4.056 31.252 1.927 1.00 0.00 H new ATOM 0 HA3 GLY A 66 2.889 32.063 2.953 1.00 0.00 H new ATOM 1078 N GLU A 67 1.358 29.809 1.341 1.00 0.00 N ATOM 1079 CA GLU A 67 0.572 28.543 1.423 1.00 0.00 C ATOM 1080 C GLU A 67 0.453 27.947 0.016 1.00 0.00 C ATOM 1081 O GLU A 67 0.269 28.662 -0.949 1.00 0.00 O ATOM 1082 CB GLU A 67 -0.824 28.852 1.969 1.00 0.00 C ATOM 1083 CG GLU A 67 -1.449 29.989 1.164 1.00 0.00 C ATOM 1084 CD GLU A 67 -2.830 30.316 1.734 1.00 0.00 C ATOM 1085 OE1 GLU A 67 -3.737 29.527 1.524 1.00 0.00 O ATOM 1086 OE2 GLU A 67 -2.956 31.348 2.371 1.00 0.00 O ATOM 0 H GLU A 67 1.145 30.388 0.529 1.00 0.00 H new ATOM 0 HA GLU A 67 1.069 27.833 2.084 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.453 27.964 1.911 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -0.761 29.130 3.021 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.809 30.871 1.203 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.535 29.703 0.116 1.00 0.00 H new ATOM 1093 N CYS A 68 0.553 26.645 -0.107 1.00 0.00 N ATOM 1094 CA CYS A 68 0.441 25.991 -1.457 1.00 0.00 C ATOM 1095 C CYS A 68 -0.876 25.219 -1.529 1.00 0.00 C ATOM 1096 O CYS A 68 -1.291 24.574 -0.590 1.00 0.00 O ATOM 1097 CB CYS A 68 1.631 25.051 -1.686 1.00 0.00 C ATOM 1098 SG CYS A 68 1.378 23.506 -0.777 1.00 0.00 S ATOM 0 H CYS A 68 0.708 26.002 0.670 1.00 0.00 H new ATOM 0 HA CYS A 68 0.454 26.752 -2.238 1.00 0.00 H new ATOM 0 HB2 CYS A 68 1.742 24.843 -2.750 1.00 0.00 H new ATOM 0 HB3 CYS A 68 2.553 25.530 -1.357 1.00 0.00 H new ATOM 0 HG CYS A 68 0.105 23.309 -0.602 1.00 0.00 H new ATOM 1104 N ASP A 69 -1.533 25.307 -2.644 1.00 0.00 N ATOM 1105 CA ASP A 69 -2.840 24.620 -2.824 1.00 0.00 C ATOM 1106 C ASP A 69 -2.614 23.155 -3.177 1.00 0.00 C ATOM 1107 O ASP A 69 -1.510 22.737 -3.467 1.00 0.00 O ATOM 1108 CB ASP A 69 -3.605 25.305 -3.960 1.00 0.00 C ATOM 1109 CG ASP A 69 -5.079 24.897 -3.916 1.00 0.00 C ATOM 1110 OD1 ASP A 69 -5.408 24.006 -3.151 1.00 0.00 O ATOM 1111 OD2 ASP A 69 -5.858 25.490 -4.644 1.00 0.00 O ATOM 0 H ASP A 69 -1.215 25.836 -3.456 1.00 0.00 H new ATOM 0 HA ASP A 69 -3.413 24.677 -1.898 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -3.516 26.388 -3.869 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -3.171 25.029 -4.921 1.00 0.00 H new ATOM 1116 N PHE A 70 -3.657 22.373 -3.174 1.00 0.00 N ATOM 1117 CA PHE A 70 -3.512 20.950 -3.526 1.00 0.00 C ATOM 1118 C PHE A 70 -2.824 20.876 -4.885 1.00 0.00 C ATOM 1119 O PHE A 70 -1.970 20.060 -5.107 1.00 0.00 O ATOM 1120 CB PHE A 70 -4.914 20.323 -3.586 1.00 0.00 C ATOM 1121 CG PHE A 70 -4.888 19.000 -4.319 1.00 0.00 C ATOM 1122 CD1 PHE A 70 -3.954 18.020 -3.969 1.00 0.00 C ATOM 1123 CD2 PHE A 70 -5.809 18.750 -5.347 1.00 0.00 C ATOM 1124 CE1 PHE A 70 -3.938 16.797 -4.642 1.00 0.00 C ATOM 1125 CE2 PHE A 70 -5.792 17.526 -6.016 1.00 0.00 C ATOM 1126 CZ PHE A 70 -4.857 16.547 -5.666 1.00 0.00 C ATOM 0 H PHE A 70 -4.605 22.668 -2.940 1.00 0.00 H new ATOM 0 HA PHE A 70 -2.917 20.408 -2.791 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -5.293 20.175 -2.575 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -5.600 21.006 -4.087 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -3.244 18.209 -3.177 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.531 19.505 -5.621 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.214 16.042 -4.371 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -6.503 17.334 -6.806 1.00 0.00 H new ATOM 0 HZ PHE A 70 -4.845 15.600 -6.185 1.00 0.00 H new ATOM 1136 N GLN A 71 -3.178 21.746 -5.783 1.00 0.00 N ATOM 1137 CA GLN A 71 -2.533 21.746 -7.126 1.00 0.00 C ATOM 1138 C GLN A 71 -1.019 21.980 -7.007 1.00 0.00 C ATOM 1139 O GLN A 71 -0.226 21.260 -7.578 1.00 0.00 O ATOM 1140 CB GLN A 71 -3.169 22.871 -7.962 1.00 0.00 C ATOM 1141 CG GLN A 71 -2.255 23.263 -9.130 1.00 0.00 C ATOM 1142 CD GLN A 71 -3.049 24.085 -10.150 1.00 0.00 C ATOM 1143 OE1 GLN A 71 -4.263 24.114 -10.107 1.00 0.00 O ATOM 1144 NE2 GLN A 71 -2.414 24.756 -11.072 1.00 0.00 N ATOM 0 H GLN A 71 -3.891 22.463 -5.646 1.00 0.00 H new ATOM 0 HA GLN A 71 -2.686 20.778 -7.604 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -4.136 22.544 -8.344 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -3.353 23.740 -7.331 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -1.407 23.841 -8.763 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -1.850 22.369 -9.604 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -1.395 24.733 -11.109 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -2.937 25.304 -11.755 1.00 0.00 H new ATOM 1153 N GLU A 72 -0.616 22.997 -6.301 1.00 0.00 N ATOM 1154 CA GLU A 72 0.838 23.292 -6.185 1.00 0.00 C ATOM 1155 C GLU A 72 1.580 22.129 -5.520 1.00 0.00 C ATOM 1156 O GLU A 72 2.669 21.756 -5.922 1.00 0.00 O ATOM 1157 CB GLU A 72 0.989 24.559 -5.351 1.00 0.00 C ATOM 1158 CG GLU A 72 0.508 25.769 -6.155 1.00 0.00 C ATOM 1159 CD GLU A 72 0.523 27.011 -5.261 1.00 0.00 C ATOM 1160 OE1 GLU A 72 1.556 27.657 -5.197 1.00 0.00 O ATOM 1161 OE2 GLU A 72 -0.495 27.293 -4.652 1.00 0.00 O ATOM 0 H GLU A 72 -1.231 23.637 -5.799 1.00 0.00 H new ATOM 0 HA GLU A 72 1.270 23.431 -7.176 1.00 0.00 H new ATOM 0 HB2 GLU A 72 0.412 24.470 -4.430 1.00 0.00 H new ATOM 0 HB3 GLU A 72 2.032 24.693 -5.063 1.00 0.00 H new ATOM 0 HG2 GLU A 72 1.151 25.923 -7.021 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -0.499 25.592 -6.533 1.00 0.00 H new ATOM 1168 N PHE A 73 0.991 21.545 -4.522 1.00 0.00 N ATOM 1169 CA PHE A 73 1.640 20.399 -3.830 1.00 0.00 C ATOM 1170 C PHE A 73 1.788 19.230 -4.799 1.00 0.00 C ATOM 1171 O PHE A 73 2.747 18.490 -4.752 1.00 0.00 O ATOM 1172 CB PHE A 73 0.787 19.975 -2.628 1.00 0.00 C ATOM 1173 CG PHE A 73 1.308 18.667 -2.079 1.00 0.00 C ATOM 1174 CD1 PHE A 73 2.310 18.658 -1.104 1.00 0.00 C ATOM 1175 CD2 PHE A 73 0.795 17.459 -2.568 1.00 0.00 C ATOM 1176 CE1 PHE A 73 2.798 17.440 -0.614 1.00 0.00 C ATOM 1177 CE2 PHE A 73 1.284 16.243 -2.081 1.00 0.00 C ATOM 1178 CZ PHE A 73 2.284 16.233 -1.103 1.00 0.00 C ATOM 0 H PHE A 73 0.080 21.813 -4.150 1.00 0.00 H new ATOM 0 HA PHE A 73 2.628 20.700 -3.481 1.00 0.00 H new ATOM 0 HB2 PHE A 73 0.818 20.744 -1.856 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -0.255 19.867 -2.928 1.00 0.00 H new ATOM 0 HD1 PHE A 73 2.707 19.590 -0.729 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.021 17.467 -3.322 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.570 17.432 0.141 1.00 0.00 H new ATOM 0 HE2 PHE A 73 0.890 15.312 -2.460 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.660 15.294 -0.725 1.00 0.00 H new ATOM 1188 N MET A 74 0.827 19.051 -5.652 1.00 0.00 N ATOM 1189 CA MET A 74 0.866 17.919 -6.613 1.00 0.00 C ATOM 1190 C MET A 74 2.099 18.006 -7.514 1.00 0.00 C ATOM 1191 O MET A 74 2.699 17.003 -7.866 1.00 0.00 O ATOM 1192 CB MET A 74 -0.413 17.922 -7.462 1.00 0.00 C ATOM 1193 CG MET A 74 -1.591 17.345 -6.650 1.00 0.00 C ATOM 1194 SD MET A 74 -1.288 15.608 -6.222 1.00 0.00 S ATOM 1195 CE MET A 74 -1.184 14.967 -7.905 1.00 0.00 C ATOM 0 H MET A 74 0.004 19.648 -5.727 1.00 0.00 H new ATOM 0 HA MET A 74 0.927 16.987 -6.051 1.00 0.00 H new ATOM 0 HB2 MET A 74 -0.644 18.938 -7.781 1.00 0.00 H new ATOM 0 HB3 MET A 74 -0.260 17.331 -8.365 1.00 0.00 H new ATOM 0 HG2 MET A 74 -1.733 17.929 -5.741 1.00 0.00 H new ATOM 0 HG3 MET A 74 -2.512 17.427 -7.228 1.00 0.00 H new ATOM 0 HE1 MET A 74 -1.424 13.904 -7.905 1.00 0.00 H new ATOM 0 HE2 MET A 74 -1.892 15.499 -8.541 1.00 0.00 H new ATOM 0 HE3 MET A 74 -0.173 15.111 -8.287 1.00 0.00 H new ATOM 1205 N ALA A 75 2.471 19.177 -7.927 1.00 0.00 N ATOM 1206 CA ALA A 75 3.646 19.275 -8.835 1.00 0.00 C ATOM 1207 C ALA A 75 4.939 18.888 -8.112 1.00 0.00 C ATOM 1208 O ALA A 75 5.847 18.336 -8.702 1.00 0.00 O ATOM 1209 CB ALA A 75 3.762 20.701 -9.380 1.00 0.00 C ATOM 0 H ALA A 75 2.024 20.060 -7.683 1.00 0.00 H new ATOM 0 HA ALA A 75 3.497 18.579 -9.660 1.00 0.00 H new ATOM 0 HB1 ALA A 75 4.624 20.768 -10.044 1.00 0.00 H new ATOM 0 HB2 ALA A 75 2.857 20.954 -9.933 1.00 0.00 H new ATOM 0 HB3 ALA A 75 3.888 21.398 -8.551 1.00 0.00 H new ATOM 1215 N PHE A 76 5.035 19.173 -6.851 1.00 0.00 N ATOM 1216 CA PHE A 76 6.281 18.825 -6.095 1.00 0.00 C ATOM 1217 C PHE A 76 6.442 17.310 -6.000 1.00 0.00 C ATOM 1218 O PHE A 76 7.536 16.795 -5.934 1.00 0.00 O ATOM 1219 CB PHE A 76 6.197 19.460 -4.707 1.00 0.00 C ATOM 1220 CG PHE A 76 7.283 18.940 -3.801 1.00 0.00 C ATOM 1221 CD1 PHE A 76 8.529 19.574 -3.769 1.00 0.00 C ATOM 1222 CD2 PHE A 76 7.035 17.836 -2.978 1.00 0.00 C ATOM 1223 CE1 PHE A 76 9.531 19.102 -2.915 1.00 0.00 C ATOM 1224 CE2 PHE A 76 8.035 17.366 -2.121 1.00 0.00 C ATOM 1225 CZ PHE A 76 9.284 17.998 -2.090 1.00 0.00 C ATOM 0 H PHE A 76 4.309 19.633 -6.302 1.00 0.00 H new ATOM 0 HA PHE A 76 7.156 19.211 -6.617 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.281 20.543 -4.795 1.00 0.00 H new ATOM 0 HB3 PHE A 76 5.222 19.250 -4.267 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.717 20.428 -4.403 1.00 0.00 H new ATOM 0 HD2 PHE A 76 6.072 17.347 -3.005 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.495 19.589 -2.892 1.00 0.00 H new ATOM 0 HE2 PHE A 76 7.844 16.516 -1.483 1.00 0.00 H new ATOM 0 HZ PHE A 76 10.057 17.634 -1.430 1.00 0.00 H new ATOM 1235 N VAL A 77 5.364 16.601 -5.994 1.00 0.00 N ATOM 1236 CA VAL A 77 5.436 15.113 -5.905 1.00 0.00 C ATOM 1237 C VAL A 77 6.079 14.558 -7.175 1.00 0.00 C ATOM 1238 O VAL A 77 6.831 13.610 -7.138 1.00 0.00 O ATOM 1239 CB VAL A 77 4.017 14.533 -5.757 1.00 0.00 C ATOM 1240 CG1 VAL A 77 4.058 13.211 -4.982 1.00 0.00 C ATOM 1241 CG2 VAL A 77 3.149 15.540 -5.016 1.00 0.00 C ATOM 0 H VAL A 77 4.420 16.984 -6.047 1.00 0.00 H new ATOM 0 HA VAL A 77 6.034 14.833 -5.038 1.00 0.00 H new ATOM 0 HB VAL A 77 3.600 14.339 -6.745 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.047 12.814 -4.886 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.680 12.494 -5.518 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.476 13.384 -3.990 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.141 15.140 -4.905 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.574 15.731 -4.031 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.109 16.471 -5.581 1.00 0.00 H new ATOM 1251 N SER A 78 5.762 15.129 -8.302 1.00 0.00 N ATOM 1252 CA SER A 78 6.338 14.616 -9.579 1.00 0.00 C ATOM 1253 C SER A 78 7.857 14.776 -9.578 1.00 0.00 C ATOM 1254 O SER A 78 8.579 13.924 -10.054 1.00 0.00 O ATOM 1255 CB SER A 78 5.746 15.396 -10.762 1.00 0.00 C ATOM 1256 OG SER A 78 4.481 14.848 -11.101 1.00 0.00 O ATOM 0 H SER A 78 5.132 15.926 -8.396 1.00 0.00 H new ATOM 0 HA SER A 78 6.092 13.559 -9.674 1.00 0.00 H new ATOM 0 HB2 SER A 78 5.641 16.449 -10.501 1.00 0.00 H new ATOM 0 HB3 SER A 78 6.418 15.345 -11.619 1.00 0.00 H new ATOM 0 HG SER A 78 3.792 15.231 -10.519 1.00 0.00 H new ATOM 1262 N MET A 79 8.347 15.873 -9.083 1.00 0.00 N ATOM 1263 CA MET A 79 9.819 16.086 -9.101 1.00 0.00 C ATOM 1264 C MET A 79 10.533 15.159 -8.107 1.00 0.00 C ATOM 1265 O MET A 79 11.587 14.630 -8.398 1.00 0.00 O ATOM 1266 CB MET A 79 10.126 17.548 -8.758 1.00 0.00 C ATOM 1267 CG MET A 79 9.073 18.471 -9.374 1.00 0.00 C ATOM 1268 SD MET A 79 9.740 20.155 -9.473 1.00 0.00 S ATOM 1269 CE MET A 79 10.442 20.248 -7.802 1.00 0.00 C ATOM 0 H MET A 79 7.799 16.627 -8.669 1.00 0.00 H new ATOM 0 HA MET A 79 10.186 15.852 -10.100 1.00 0.00 H new ATOM 0 HB2 MET A 79 10.145 17.678 -7.676 1.00 0.00 H new ATOM 0 HB3 MET A 79 11.115 17.815 -9.129 1.00 0.00 H new ATOM 0 HG2 MET A 79 8.798 18.117 -10.368 1.00 0.00 H new ATOM 0 HG3 MET A 79 8.166 18.461 -8.770 1.00 0.00 H new ATOM 0 HE1 MET A 79 10.617 21.291 -7.539 1.00 0.00 H new ATOM 0 HE2 MET A 79 9.745 19.806 -7.090 1.00 0.00 H new ATOM 0 HE3 MET A 79 11.386 19.703 -7.773 1.00 0.00 H new ATOM 1279 N VAL A 80 9.990 14.966 -6.937 1.00 0.00 N ATOM 1280 CA VAL A 80 10.683 14.078 -5.946 1.00 0.00 C ATOM 1281 C VAL A 80 10.710 12.644 -6.463 1.00 0.00 C ATOM 1282 O VAL A 80 11.676 11.926 -6.294 1.00 0.00 O ATOM 1283 CB VAL A 80 9.976 14.120 -4.593 1.00 0.00 C ATOM 1284 CG1 VAL A 80 10.708 13.195 -3.616 1.00 0.00 C ATOM 1285 CG2 VAL A 80 10.007 15.546 -4.048 1.00 0.00 C ATOM 0 H VAL A 80 9.110 15.375 -6.622 1.00 0.00 H new ATOM 0 HA VAL A 80 11.703 14.439 -5.818 1.00 0.00 H new ATOM 0 HB VAL A 80 8.942 13.795 -4.710 1.00 0.00 H new ATOM 0 HG11 VAL A 80 10.208 13.220 -2.648 1.00 0.00 H new ATOM 0 HG12 VAL A 80 10.698 12.176 -4.003 1.00 0.00 H new ATOM 0 HG13 VAL A 80 11.739 13.530 -3.501 1.00 0.00 H new ATOM 0 HG21 VAL A 80 9.503 15.577 -3.082 1.00 0.00 H new ATOM 0 HG22 VAL A 80 11.042 15.867 -3.928 1.00 0.00 H new ATOM 0 HG23 VAL A 80 9.499 16.213 -4.745 1.00 0.00 H new ATOM 1295 N THR A 81 9.661 12.224 -7.094 1.00 0.00 N ATOM 1296 CA THR A 81 9.614 10.839 -7.629 1.00 0.00 C ATOM 1297 C THR A 81 10.750 10.670 -8.623 1.00 0.00 C ATOM 1298 O THR A 81 11.381 9.635 -8.706 1.00 0.00 O ATOM 1299 CB THR A 81 8.283 10.616 -8.338 1.00 0.00 C ATOM 1300 OG1 THR A 81 7.222 10.750 -7.410 1.00 0.00 O ATOM 1301 CG2 THR A 81 8.250 9.223 -8.976 1.00 0.00 C ATOM 0 H THR A 81 8.825 12.782 -7.266 1.00 0.00 H new ATOM 0 HA THR A 81 9.714 10.118 -6.818 1.00 0.00 H new ATOM 0 HB THR A 81 8.169 11.362 -9.124 1.00 0.00 H new ATOM 0 HG1 THR A 81 7.032 11.700 -7.265 1.00 0.00 H new ATOM 0 HG21 THR A 81 7.294 9.076 -9.479 1.00 0.00 H new ATOM 0 HG22 THR A 81 9.059 9.136 -9.701 1.00 0.00 H new ATOM 0 HG23 THR A 81 8.373 8.465 -8.202 1.00 0.00 H new ATOM 1309 N THR A 82 11.002 11.687 -9.384 1.00 0.00 N ATOM 1310 CA THR A 82 12.081 11.614 -10.388 1.00 0.00 C ATOM 1311 C THR A 82 13.401 11.304 -9.676 1.00 0.00 C ATOM 1312 O THR A 82 14.198 10.517 -10.145 1.00 0.00 O ATOM 1313 CB THR A 82 12.174 12.961 -11.106 1.00 0.00 C ATOM 1314 OG1 THR A 82 10.871 13.370 -11.497 1.00 0.00 O ATOM 1315 CG2 THR A 82 13.042 12.811 -12.348 1.00 0.00 C ATOM 0 H THR A 82 10.500 12.575 -9.352 1.00 0.00 H new ATOM 0 HA THR A 82 11.875 10.830 -11.116 1.00 0.00 H new ATOM 0 HB THR A 82 12.612 13.703 -10.439 1.00 0.00 H new ATOM 0 HG1 THR A 82 10.923 14.234 -11.956 1.00 0.00 H new ATOM 0 HG21 THR A 82 13.110 13.770 -12.862 1.00 0.00 H new ATOM 0 HG22 THR A 82 14.040 12.483 -12.057 1.00 0.00 H new ATOM 0 HG23 THR A 82 12.598 12.072 -13.015 1.00 0.00 H new ATOM 1323 N ALA A 83 13.627 11.893 -8.533 1.00 0.00 N ATOM 1324 CA ALA A 83 14.882 11.599 -7.783 1.00 0.00 C ATOM 1325 C ALA A 83 14.913 10.102 -7.464 1.00 0.00 C ATOM 1326 O ALA A 83 15.942 9.459 -7.512 1.00 0.00 O ATOM 1327 CB ALA A 83 14.916 12.413 -6.480 1.00 0.00 C ATOM 0 H ALA A 83 13.000 12.563 -8.087 1.00 0.00 H new ATOM 0 HA ALA A 83 15.750 11.872 -8.384 1.00 0.00 H new ATOM 0 HB1 ALA A 83 15.835 12.193 -5.937 1.00 0.00 H new ATOM 0 HB2 ALA A 83 14.879 13.477 -6.714 1.00 0.00 H new ATOM 0 HB3 ALA A 83 14.058 12.147 -5.862 1.00 0.00 H new ATOM 1333 N CYS A 84 13.776 9.554 -7.128 1.00 0.00 N ATOM 1334 CA CYS A 84 13.694 8.105 -6.787 1.00 0.00 C ATOM 1335 C CYS A 84 14.148 7.253 -7.977 1.00 0.00 C ATOM 1336 O CYS A 84 14.795 6.240 -7.809 1.00 0.00 O ATOM 1337 CB CYS A 84 12.245 7.756 -6.438 1.00 0.00 C ATOM 1338 SG CYS A 84 12.205 6.200 -5.516 1.00 0.00 S ATOM 0 H CYS A 84 12.890 10.056 -7.075 1.00 0.00 H new ATOM 0 HA CYS A 84 14.345 7.900 -5.937 1.00 0.00 H new ATOM 0 HB2 CYS A 84 11.800 8.555 -5.844 1.00 0.00 H new ATOM 0 HB3 CYS A 84 11.652 7.667 -7.348 1.00 0.00 H new ATOM 0 HG CYS A 84 13.259 5.497 -5.805 1.00 0.00 H new ATOM 1344 N HIS A 85 13.817 7.649 -9.176 1.00 0.00 N ATOM 1345 CA HIS A 85 14.233 6.847 -10.361 1.00 0.00 C ATOM 1346 C HIS A 85 15.756 6.763 -10.389 1.00 0.00 C ATOM 1347 O HIS A 85 16.330 5.733 -10.682 1.00 0.00 O ATOM 1348 CB HIS A 85 13.747 7.553 -11.626 1.00 0.00 C ATOM 1349 CG HIS A 85 14.151 6.769 -12.845 1.00 0.00 C ATOM 1350 ND1 HIS A 85 15.475 6.457 -13.117 1.00 0.00 N ATOM 1351 CD2 HIS A 85 13.422 6.254 -13.889 1.00 0.00 C ATOM 1352 CE1 HIS A 85 15.503 5.787 -14.285 1.00 0.00 C ATOM 1353 NE2 HIS A 85 14.279 5.637 -14.793 1.00 0.00 N ATOM 0 H HIS A 85 13.279 8.490 -9.386 1.00 0.00 H new ATOM 0 HA HIS A 85 13.808 5.845 -10.307 1.00 0.00 H new ATOM 0 HB2 HIS A 85 12.663 7.662 -11.597 1.00 0.00 H new ATOM 0 HB3 HIS A 85 14.167 8.558 -11.675 1.00 0.00 H new ATOM 0 HD2 HIS A 85 12.349 6.318 -13.992 1.00 0.00 H new ATOM 0 HE1 HIS A 85 16.404 5.417 -14.752 1.00 0.00 H new ATOM 0 HE2 HIS A 85 14.025 5.168 -15.662 1.00 0.00 H new ATOM 1362 N GLU A 86 16.410 7.837 -10.071 1.00 0.00 N ATOM 1363 CA GLU A 86 17.895 7.833 -10.056 1.00 0.00 C ATOM 1364 C GLU A 86 18.388 6.902 -8.942 1.00 0.00 C ATOM 1365 O GLU A 86 19.425 6.278 -9.052 1.00 0.00 O ATOM 1366 CB GLU A 86 18.396 9.259 -9.801 1.00 0.00 C ATOM 1367 CG GLU A 86 19.926 9.300 -9.861 1.00 0.00 C ATOM 1368 CD GLU A 86 20.391 8.960 -11.277 1.00 0.00 C ATOM 1369 OE1 GLU A 86 19.582 9.059 -12.184 1.00 0.00 O ATOM 1370 OE2 GLU A 86 21.549 8.608 -11.431 1.00 0.00 O ATOM 0 H GLU A 86 15.978 8.726 -9.818 1.00 0.00 H new ATOM 0 HA GLU A 86 18.276 7.479 -11.014 1.00 0.00 H new ATOM 0 HB2 GLU A 86 17.977 9.938 -10.544 1.00 0.00 H new ATOM 0 HB3 GLU A 86 18.054 9.604 -8.825 1.00 0.00 H new ATOM 0 HG2 GLU A 86 20.285 10.289 -9.577 1.00 0.00 H new ATOM 0 HG3 GLU A 86 20.347 8.591 -9.148 1.00 0.00 H new ATOM 1377 N PHE A 87 17.666 6.836 -7.852 1.00 0.00 N ATOM 1378 CA PHE A 87 18.099 5.979 -6.701 1.00 0.00 C ATOM 1379 C PHE A 87 17.481 4.573 -6.791 1.00 0.00 C ATOM 1380 O PHE A 87 17.998 3.630 -6.225 1.00 0.00 O ATOM 1381 CB PHE A 87 17.648 6.647 -5.398 1.00 0.00 C ATOM 1382 CG PHE A 87 18.349 6.011 -4.218 1.00 0.00 C ATOM 1383 CD1 PHE A 87 17.838 4.842 -3.642 1.00 0.00 C ATOM 1384 CD2 PHE A 87 19.509 6.597 -3.694 1.00 0.00 C ATOM 1385 CE1 PHE A 87 18.483 4.259 -2.546 1.00 0.00 C ATOM 1386 CE2 PHE A 87 20.154 6.013 -2.597 1.00 0.00 C ATOM 1387 CZ PHE A 87 19.641 4.844 -2.023 1.00 0.00 C ATOM 0 H PHE A 87 16.791 7.340 -7.707 1.00 0.00 H new ATOM 0 HA PHE A 87 19.184 5.876 -6.727 1.00 0.00 H new ATOM 0 HB2 PHE A 87 17.870 7.714 -5.431 1.00 0.00 H new ATOM 0 HB3 PHE A 87 16.568 6.550 -5.285 1.00 0.00 H new ATOM 0 HD1 PHE A 87 16.944 4.389 -4.045 1.00 0.00 H new ATOM 0 HD2 PHE A 87 19.905 7.499 -4.136 1.00 0.00 H new ATOM 0 HE1 PHE A 87 18.087 3.357 -2.104 1.00 0.00 H new ATOM 0 HE2 PHE A 87 21.048 6.465 -2.193 1.00 0.00 H new ATOM 0 HZ PHE A 87 20.139 4.394 -1.177 1.00 0.00 H new ATOM 1397 N PHE A 88 16.374 4.419 -7.477 1.00 0.00 N ATOM 1398 CA PHE A 88 15.728 3.065 -7.569 1.00 0.00 C ATOM 1399 C PHE A 88 16.222 2.361 -8.827 1.00 0.00 C ATOM 1400 O PHE A 88 15.584 1.468 -9.349 1.00 0.00 O ATOM 1401 CB PHE A 88 14.193 3.212 -7.620 1.00 0.00 C ATOM 1402 CG PHE A 88 13.641 3.318 -6.213 1.00 0.00 C ATOM 1403 CD1 PHE A 88 14.301 4.097 -5.258 1.00 0.00 C ATOM 1404 CD2 PHE A 88 12.477 2.622 -5.863 1.00 0.00 C ATOM 1405 CE1 PHE A 88 13.802 4.181 -3.953 1.00 0.00 C ATOM 1406 CE2 PHE A 88 11.974 2.709 -4.559 1.00 0.00 C ATOM 1407 CZ PHE A 88 12.638 3.487 -3.603 1.00 0.00 C ATOM 0 H PHE A 88 15.890 5.166 -7.976 1.00 0.00 H new ATOM 0 HA PHE A 88 15.993 2.477 -6.691 1.00 0.00 H new ATOM 0 HB2 PHE A 88 13.922 4.098 -8.195 1.00 0.00 H new ATOM 0 HB3 PHE A 88 13.753 2.355 -8.130 1.00 0.00 H new ATOM 0 HD1 PHE A 88 15.198 4.635 -5.528 1.00 0.00 H new ATOM 0 HD2 PHE A 88 11.967 2.018 -6.599 1.00 0.00 H new ATOM 0 HE1 PHE A 88 14.315 4.781 -3.216 1.00 0.00 H new ATOM 0 HE2 PHE A 88 11.074 2.176 -4.291 1.00 0.00 H new ATOM 0 HZ PHE A 88 12.252 3.552 -2.596 1.00 0.00 H new ATOM 1464 N MET B 0 -2.388 6.048 3.397 1.00 0.00 N ATOM 1465 CA MET B 0 -1.632 6.235 4.668 1.00 0.00 C ATOM 1466 C MET B 0 -0.134 6.312 4.366 1.00 0.00 C ATOM 1467 O MET B 0 0.561 5.316 4.362 1.00 0.00 O ATOM 1468 CB MET B 0 -1.903 5.055 5.605 1.00 0.00 C ATOM 1469 CG MET B 0 -1.198 5.293 6.944 1.00 0.00 C ATOM 1470 SD MET B 0 -1.548 3.918 8.068 1.00 0.00 S ATOM 1471 CE MET B 0 -0.181 2.846 7.558 1.00 0.00 C ATOM 0 H1 MET B 0 -3.406 5.996 3.603 1.00 0.00 H new ATOM 0 H2 MET B 0 -2.204 6.851 2.762 1.00 0.00 H new ATOM 0 H3 MET B 0 -2.082 5.167 2.938 1.00 0.00 H new ATOM 0 HA MET B 0 -1.954 7.160 5.147 1.00 0.00 H new ATOM 0 HB2 MET B 0 -2.976 4.941 5.762 1.00 0.00 H new ATOM 0 HB3 MET B 0 -1.546 4.129 5.154 1.00 0.00 H new ATOM 0 HG2 MET B 0 -0.123 5.385 6.789 1.00 0.00 H new ATOM 0 HG3 MET B 0 -1.538 6.231 7.384 1.00 0.00 H new ATOM 0 HE1 MET B 0 -0.207 1.923 8.137 1.00 0.00 H new ATOM 0 HE2 MET B 0 -0.278 2.613 6.498 1.00 0.00 H new ATOM 0 HE3 MET B 0 0.766 3.356 7.732 1.00 0.00 H new ATOM 1483 N SER B 1 0.368 7.489 4.117 1.00 0.00 N ATOM 1484 CA SER B 1 1.823 7.637 3.821 1.00 0.00 C ATOM 1485 C SER B 1 2.240 6.635 2.744 1.00 0.00 C ATOM 1486 O SER B 1 3.410 6.381 2.538 1.00 0.00 O ATOM 1487 CB SER B 1 2.635 7.391 5.092 1.00 0.00 C ATOM 1488 OG SER B 1 4.019 7.534 4.800 1.00 0.00 O ATOM 0 H SER B 1 -0.167 8.358 4.105 1.00 0.00 H new ATOM 0 HA SER B 1 2.012 8.648 3.461 1.00 0.00 H new ATOM 0 HB2 SER B 1 2.340 8.097 5.868 1.00 0.00 H new ATOM 0 HB3 SER B 1 2.434 6.392 5.478 1.00 0.00 H new ATOM 0 HG SER B 1 4.236 7.027 3.990 1.00 0.00 H new ATOM 1494 N GLU B 2 1.297 6.089 2.034 1.00 0.00 N ATOM 1495 CA GLU B 2 1.637 5.134 0.946 1.00 0.00 C ATOM 1496 C GLU B 2 2.184 5.937 -0.230 1.00 0.00 C ATOM 1497 O GLU B 2 2.198 5.485 -1.358 1.00 0.00 O ATOM 1498 CB GLU B 2 0.381 4.361 0.528 1.00 0.00 C ATOM 1499 CG GLU B 2 -0.693 5.333 0.030 1.00 0.00 C ATOM 1500 CD GLU B 2 -1.941 4.547 -0.377 1.00 0.00 C ATOM 1501 OE1 GLU B 2 -1.854 3.333 -0.455 1.00 0.00 O ATOM 1502 OE2 GLU B 2 -2.963 5.174 -0.603 1.00 0.00 O ATOM 0 H GLU B 2 0.300 6.264 2.161 1.00 0.00 H new ATOM 0 HA GLU B 2 2.383 4.415 1.284 1.00 0.00 H new ATOM 0 HB2 GLU B 2 0.629 3.647 -0.257 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -0.000 3.787 1.373 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -0.941 6.050 0.812 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -0.317 5.904 -0.819 1.00 0.00 H new ATOM 1509 N LEU B 3 2.620 7.142 0.031 1.00 0.00 N ATOM 1510 CA LEU B 3 3.149 7.999 -1.054 1.00 0.00 C ATOM 1511 C LEU B 3 4.343 7.308 -1.696 1.00 0.00 C ATOM 1512 O LEU B 3 4.548 7.399 -2.879 1.00 0.00 O ATOM 1513 CB LEU B 3 3.569 9.360 -0.484 1.00 0.00 C ATOM 1514 CG LEU B 3 4.117 10.257 -1.604 1.00 0.00 C ATOM 1515 CD1 LEU B 3 3.032 10.477 -2.677 1.00 0.00 C ATOM 1516 CD2 LEU B 3 4.530 11.607 -1.002 1.00 0.00 C ATOM 0 H LEU B 3 2.629 7.566 0.959 1.00 0.00 H new ATOM 0 HA LEU B 3 2.377 8.160 -1.806 1.00 0.00 H new ATOM 0 HB2 LEU B 3 2.716 9.842 -0.007 1.00 0.00 H new ATOM 0 HB3 LEU B 3 4.328 9.222 0.286 1.00 0.00 H new ATOM 0 HG LEU B 3 4.980 9.779 -2.068 1.00 0.00 H new ATOM 0 HD11 LEU B 3 3.427 11.114 -3.468 1.00 0.00 H new ATOM 0 HD12 LEU B 3 2.737 9.516 -3.098 1.00 0.00 H new ATOM 0 HD13 LEU B 3 2.164 10.957 -2.224 1.00 0.00 H new ATOM 0 HD21 LEU B 3 4.921 12.252 -1.789 1.00 0.00 H new ATOM 0 HD22 LEU B 3 3.663 12.081 -0.542 1.00 0.00 H new ATOM 0 HD23 LEU B 3 5.300 11.448 -0.247 1.00 0.00 H new ATOM 1528 N GLU B 4 5.135 6.622 -0.926 1.00 0.00 N ATOM 1529 CA GLU B 4 6.321 5.934 -1.513 1.00 0.00 C ATOM 1530 C GLU B 4 5.855 4.929 -2.564 1.00 0.00 C ATOM 1531 O GLU B 4 6.469 4.770 -3.599 1.00 0.00 O ATOM 1532 CB GLU B 4 7.097 5.213 -0.402 1.00 0.00 C ATOM 1533 CG GLU B 4 6.249 4.080 0.187 1.00 0.00 C ATOM 1534 CD GLU B 4 6.969 3.482 1.397 1.00 0.00 C ATOM 1535 OE1 GLU B 4 8.175 3.644 1.484 1.00 0.00 O ATOM 1536 OE2 GLU B 4 6.304 2.866 2.214 1.00 0.00 O ATOM 0 H GLU B 4 5.016 6.506 0.080 1.00 0.00 H new ATOM 0 HA GLU B 4 6.975 6.667 -1.985 1.00 0.00 H new ATOM 0 HB2 GLU B 4 8.028 4.810 -0.801 1.00 0.00 H new ATOM 0 HB3 GLU B 4 7.366 5.921 0.382 1.00 0.00 H new ATOM 0 HG2 GLU B 4 5.271 4.459 0.483 1.00 0.00 H new ATOM 0 HG3 GLU B 4 6.078 3.310 -0.565 1.00 0.00 H new ATOM 1543 N LYS B 5 4.776 4.254 -2.310 1.00 0.00 N ATOM 1544 CA LYS B 5 4.262 3.261 -3.293 1.00 0.00 C ATOM 1545 C LYS B 5 3.863 3.972 -4.584 1.00 0.00 C ATOM 1546 O LYS B 5 4.080 3.471 -5.665 1.00 0.00 O ATOM 1547 CB LYS B 5 3.037 2.563 -2.697 1.00 0.00 C ATOM 1548 CG LYS B 5 2.503 1.514 -3.674 1.00 0.00 C ATOM 1549 CD LYS B 5 1.270 0.838 -3.062 1.00 0.00 C ATOM 1550 CE LYS B 5 0.076 1.810 -3.050 1.00 0.00 C ATOM 1551 NZ LYS B 5 -1.192 1.029 -3.082 1.00 0.00 N ATOM 0 H LYS B 5 4.222 4.346 -1.459 1.00 0.00 H new ATOM 0 HA LYS B 5 5.038 2.528 -3.514 1.00 0.00 H new ATOM 0 HB2 LYS B 5 3.303 2.089 -1.752 1.00 0.00 H new ATOM 0 HB3 LYS B 5 2.261 3.297 -2.479 1.00 0.00 H new ATOM 0 HG2 LYS B 5 2.242 1.983 -4.623 1.00 0.00 H new ATOM 0 HG3 LYS B 5 3.272 0.772 -3.886 1.00 0.00 H new ATOM 0 HD2 LYS B 5 1.015 -0.054 -3.634 1.00 0.00 H new ATOM 0 HD3 LYS B 5 1.493 0.513 -2.046 1.00 0.00 H new ATOM 0 HE2 LYS B 5 0.110 2.435 -2.158 1.00 0.00 H new ATOM 0 HE3 LYS B 5 0.127 2.478 -3.910 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -2.002 1.681 -3.074 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -1.222 0.451 -3.946 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -1.239 0.409 -2.248 1.00 0.00 H new ATOM 1565 N ALA B 6 3.260 5.120 -4.482 1.00 0.00 N ATOM 1566 CA ALA B 6 2.829 5.840 -5.714 1.00 0.00 C ATOM 1567 C ALA B 6 4.041 6.321 -6.512 1.00 0.00 C ATOM 1568 O ALA B 6 4.052 6.271 -7.723 1.00 0.00 O ATOM 1569 CB ALA B 6 1.959 7.038 -5.334 1.00 0.00 C ATOM 0 H ALA B 6 3.046 5.592 -3.603 1.00 0.00 H new ATOM 0 HA ALA B 6 2.255 5.151 -6.333 1.00 0.00 H new ATOM 0 HB1 ALA B 6 1.646 7.562 -6.237 1.00 0.00 H new ATOM 0 HB2 ALA B 6 1.079 6.691 -4.792 1.00 0.00 H new ATOM 0 HB3 ALA B 6 2.531 7.717 -4.701 1.00 0.00 H new ATOM 1575 N MET B 7 5.051 6.800 -5.851 1.00 0.00 N ATOM 1576 CA MET B 7 6.248 7.295 -6.582 1.00 0.00 C ATOM 1577 C MET B 7 6.879 6.145 -7.360 1.00 0.00 C ATOM 1578 O MET B 7 7.324 6.298 -8.481 1.00 0.00 O ATOM 1579 CB MET B 7 7.268 7.849 -5.580 1.00 0.00 C ATOM 1580 CG MET B 7 6.688 9.069 -4.860 1.00 0.00 C ATOM 1581 SD MET B 7 8.004 9.903 -3.938 1.00 0.00 S ATOM 1582 CE MET B 7 7.178 11.502 -3.743 1.00 0.00 C ATOM 0 H MET B 7 5.102 6.871 -4.835 1.00 0.00 H new ATOM 0 HA MET B 7 5.950 8.084 -7.272 1.00 0.00 H new ATOM 0 HB2 MET B 7 7.531 7.080 -4.854 1.00 0.00 H new ATOM 0 HB3 MET B 7 8.186 8.125 -6.099 1.00 0.00 H new ATOM 0 HG2 MET B 7 6.244 9.754 -5.582 1.00 0.00 H new ATOM 0 HG3 MET B 7 5.892 8.761 -4.182 1.00 0.00 H new ATOM 0 HE1 MET B 7 7.600 12.027 -2.886 1.00 0.00 H new ATOM 0 HE2 MET B 7 7.324 12.099 -4.643 1.00 0.00 H new ATOM 0 HE3 MET B 7 6.112 11.343 -3.582 1.00 0.00 H new ATOM 1592 N VAL B 8 6.917 4.996 -6.762 1.00 0.00 N ATOM 1593 CA VAL B 8 7.514 3.814 -7.434 1.00 0.00 C ATOM 1594 C VAL B 8 6.666 3.442 -8.647 1.00 0.00 C ATOM 1595 O VAL B 8 7.173 3.055 -9.677 1.00 0.00 O ATOM 1596 CB VAL B 8 7.554 2.639 -6.450 1.00 0.00 C ATOM 1597 CG1 VAL B 8 7.953 1.355 -7.182 1.00 0.00 C ATOM 1598 CG2 VAL B 8 8.578 2.933 -5.351 1.00 0.00 C ATOM 0 H VAL B 8 6.556 4.820 -5.824 1.00 0.00 H new ATOM 0 HA VAL B 8 8.528 4.047 -7.760 1.00 0.00 H new ATOM 0 HB VAL B 8 6.565 2.508 -6.010 1.00 0.00 H new ATOM 0 HG11 VAL B 8 7.979 0.526 -6.475 1.00 0.00 H new ATOM 0 HG12 VAL B 8 7.225 1.142 -7.965 1.00 0.00 H new ATOM 0 HG13 VAL B 8 8.939 1.482 -7.628 1.00 0.00 H new ATOM 0 HG21 VAL B 8 8.609 2.099 -4.650 1.00 0.00 H new ATOM 0 HG22 VAL B 8 9.563 3.068 -5.798 1.00 0.00 H new ATOM 0 HG23 VAL B 8 8.293 3.842 -4.822 1.00 0.00 H new ATOM 1608 N ALA B 9 5.376 3.523 -8.510 1.00 0.00 N ATOM 1609 CA ALA B 9 4.471 3.141 -9.635 1.00 0.00 C ATOM 1610 C ALA B 9 4.668 4.051 -10.847 1.00 0.00 C ATOM 1611 O ALA B 9 4.645 3.601 -11.970 1.00 0.00 O ATOM 1612 CB ALA B 9 3.024 3.234 -9.181 1.00 0.00 C ATOM 0 H ALA B 9 4.902 3.839 -7.664 1.00 0.00 H new ATOM 0 HA ALA B 9 4.715 2.119 -9.925 1.00 0.00 H new ATOM 0 HB1 ALA B 9 2.366 2.955 -10.004 1.00 0.00 H new ATOM 0 HB2 ALA B 9 2.862 2.558 -8.341 1.00 0.00 H new ATOM 0 HB3 ALA B 9 2.805 4.256 -8.872 1.00 0.00 H new ATOM 1618 N LEU B 10 4.849 5.322 -10.644 1.00 0.00 N ATOM 1619 CA LEU B 10 5.032 6.229 -11.814 1.00 0.00 C ATOM 1620 C LEU B 10 6.263 5.772 -12.589 1.00 0.00 C ATOM 1621 O LEU B 10 6.298 5.789 -13.803 1.00 0.00 O ATOM 1622 CB LEU B 10 5.250 7.676 -11.322 1.00 0.00 C ATOM 1623 CG LEU B 10 3.925 8.441 -11.247 1.00 0.00 C ATOM 1624 CD1 LEU B 10 3.086 7.907 -10.086 1.00 0.00 C ATOM 1625 CD2 LEU B 10 4.230 9.926 -11.029 1.00 0.00 C ATOM 0 H LEU B 10 4.879 5.773 -9.729 1.00 0.00 H new ATOM 0 HA LEU B 10 4.148 6.197 -12.451 1.00 0.00 H new ATOM 0 HB2 LEU B 10 5.721 7.662 -10.339 1.00 0.00 H new ATOM 0 HB3 LEU B 10 5.934 8.193 -11.995 1.00 0.00 H new ATOM 0 HG LEU B 10 3.365 8.310 -12.173 1.00 0.00 H new ATOM 0 HD11 LEU B 10 2.144 8.454 -10.036 1.00 0.00 H new ATOM 0 HD12 LEU B 10 2.883 6.847 -10.241 1.00 0.00 H new ATOM 0 HD13 LEU B 10 3.632 8.039 -9.152 1.00 0.00 H new ATOM 0 HD21 LEU B 10 3.296 10.485 -10.973 1.00 0.00 H new ATOM 0 HD22 LEU B 10 4.784 10.051 -10.098 1.00 0.00 H new ATOM 0 HD23 LEU B 10 4.828 10.300 -11.860 1.00 0.00 H new ATOM 1637 N ILE B 11 7.277 5.391 -11.883 1.00 0.00 N ATOM 1638 CA ILE B 11 8.533 4.952 -12.537 1.00 0.00 C ATOM 1639 C ILE B 11 8.335 3.618 -13.283 1.00 0.00 C ATOM 1640 O ILE B 11 8.898 3.411 -14.340 1.00 0.00 O ATOM 1641 CB ILE B 11 9.622 4.834 -11.466 1.00 0.00 C ATOM 1642 CG1 ILE B 11 9.975 6.248 -10.975 1.00 0.00 C ATOM 1643 CG2 ILE B 11 10.868 4.172 -12.059 1.00 0.00 C ATOM 1644 CD1 ILE B 11 10.861 6.178 -9.727 1.00 0.00 C ATOM 0 H ILE B 11 7.292 5.364 -10.863 1.00 0.00 H new ATOM 0 HA ILE B 11 8.834 5.687 -13.283 1.00 0.00 H new ATOM 0 HB ILE B 11 9.262 4.225 -10.637 1.00 0.00 H new ATOM 0 HG12 ILE B 11 10.491 6.795 -11.764 1.00 0.00 H new ATOM 0 HG13 ILE B 11 9.062 6.799 -10.750 1.00 0.00 H new ATOM 0 HG21 ILE B 11 11.638 4.092 -11.291 1.00 0.00 H new ATOM 0 HG22 ILE B 11 10.613 3.177 -12.423 1.00 0.00 H new ATOM 0 HG23 ILE B 11 11.242 4.776 -12.886 1.00 0.00 H new ATOM 0 HD11 ILE B 11 11.101 7.188 -9.394 1.00 0.00 H new ATOM 0 HD12 ILE B 11 10.331 5.650 -8.934 1.00 0.00 H new ATOM 0 HD13 ILE B 11 11.782 5.646 -9.964 1.00 0.00 H new ATOM 1656 N ASP B 12 7.570 2.703 -12.743 1.00 0.00 N ATOM 1657 CA ASP B 12 7.386 1.386 -13.436 1.00 0.00 C ATOM 1658 C ASP B 12 6.587 1.538 -14.738 1.00 0.00 C ATOM 1659 O ASP B 12 6.870 0.894 -15.729 1.00 0.00 O ATOM 1660 CB ASP B 12 6.627 0.438 -12.508 1.00 0.00 C ATOM 1661 CG ASP B 12 7.525 0.036 -11.337 1.00 0.00 C ATOM 1662 OD1 ASP B 12 8.730 0.006 -11.523 1.00 0.00 O ATOM 1663 OD2 ASP B 12 6.992 -0.234 -10.273 1.00 0.00 O ATOM 0 H ASP B 12 7.068 2.806 -11.861 1.00 0.00 H new ATOM 0 HA ASP B 12 8.373 0.992 -13.680 1.00 0.00 H new ATOM 0 HB2 ASP B 12 5.724 0.922 -12.137 1.00 0.00 H new ATOM 0 HB3 ASP B 12 6.310 -0.449 -13.057 1.00 0.00 H new ATOM 1668 N VAL B 13 5.577 2.356 -14.731 1.00 0.00 N ATOM 1669 CA VAL B 13 4.731 2.531 -15.950 1.00 0.00 C ATOM 1670 C VAL B 13 5.531 3.277 -17.033 1.00 0.00 C ATOM 1671 O VAL B 13 5.463 2.966 -18.216 1.00 0.00 O ATOM 1672 CB VAL B 13 3.431 3.283 -15.532 1.00 0.00 C ATOM 1673 CG1 VAL B 13 3.412 4.732 -16.041 1.00 0.00 C ATOM 1674 CG2 VAL B 13 2.195 2.547 -16.066 1.00 0.00 C ATOM 0 H VAL B 13 5.295 2.918 -13.928 1.00 0.00 H new ATOM 0 HA VAL B 13 4.446 1.571 -16.380 1.00 0.00 H new ATOM 0 HB VAL B 13 3.413 3.304 -14.442 1.00 0.00 H new ATOM 0 HG11 VAL B 13 2.488 5.216 -15.726 1.00 0.00 H new ATOM 0 HG12 VAL B 13 4.264 5.273 -15.630 1.00 0.00 H new ATOM 0 HG13 VAL B 13 3.471 4.736 -17.129 1.00 0.00 H new ATOM 0 HG21 VAL B 13 1.295 3.083 -15.767 1.00 0.00 H new ATOM 0 HG22 VAL B 13 2.243 2.497 -17.154 1.00 0.00 H new ATOM 0 HG23 VAL B 13 2.168 1.537 -15.657 1.00 0.00 H new ATOM 1684 N PHE B 14 6.290 4.253 -16.631 1.00 0.00 N ATOM 1685 CA PHE B 14 7.099 5.027 -17.606 1.00 0.00 C ATOM 1686 C PHE B 14 8.037 4.077 -18.339 1.00 0.00 C ATOM 1687 O PHE B 14 8.291 4.233 -19.507 1.00 0.00 O ATOM 1688 CB PHE B 14 7.927 6.074 -16.852 1.00 0.00 C ATOM 1689 CG PHE B 14 8.897 6.749 -17.796 1.00 0.00 C ATOM 1690 CD1 PHE B 14 10.160 6.185 -18.018 1.00 0.00 C ATOM 1691 CD2 PHE B 14 8.539 7.936 -18.445 1.00 0.00 C ATOM 1692 CE1 PHE B 14 11.063 6.807 -18.888 1.00 0.00 C ATOM 1693 CE2 PHE B 14 9.443 8.557 -19.314 1.00 0.00 C ATOM 1694 CZ PHE B 14 10.704 7.993 -19.536 1.00 0.00 C ATOM 0 H PHE B 14 6.385 4.550 -15.660 1.00 0.00 H new ATOM 0 HA PHE B 14 6.443 5.523 -18.322 1.00 0.00 H new ATOM 0 HB2 PHE B 14 7.267 6.817 -16.404 1.00 0.00 H new ATOM 0 HB3 PHE B 14 8.472 5.599 -16.036 1.00 0.00 H new ATOM 0 HD1 PHE B 14 10.437 5.269 -17.517 1.00 0.00 H new ATOM 0 HD2 PHE B 14 7.566 8.372 -18.275 1.00 0.00 H new ATOM 0 HE1 PHE B 14 12.036 6.371 -19.059 1.00 0.00 H new ATOM 0 HE2 PHE B 14 9.167 9.473 -19.814 1.00 0.00 H new ATOM 0 HZ PHE B 14 11.400 8.474 -20.208 1.00 0.00 H new ATOM 1704 N HIS B 15 8.569 3.110 -17.657 1.00 0.00 N ATOM 1705 CA HIS B 15 9.506 2.162 -18.318 1.00 0.00 C ATOM 1706 C HIS B 15 8.762 1.279 -19.322 1.00 0.00 C ATOM 1707 O HIS B 15 9.343 0.790 -20.270 1.00 0.00 O ATOM 1708 CB HIS B 15 10.161 1.279 -17.257 1.00 0.00 C ATOM 1709 CG HIS B 15 11.184 0.387 -17.904 1.00 0.00 C ATOM 1710 ND1 HIS B 15 12.259 0.893 -18.621 1.00 0.00 N ATOM 1711 CD2 HIS B 15 11.314 -0.980 -17.948 1.00 0.00 C ATOM 1712 CE1 HIS B 15 12.981 -0.153 -19.063 1.00 0.00 C ATOM 1713 NE2 HIS B 15 12.447 -1.314 -18.680 1.00 0.00 N ATOM 0 H HIS B 15 8.397 2.932 -16.667 1.00 0.00 H new ATOM 0 HA HIS B 15 10.265 2.734 -18.851 1.00 0.00 H new ATOM 0 HB2 HIS B 15 10.634 1.899 -16.495 1.00 0.00 H new ATOM 0 HB3 HIS B 15 9.405 0.677 -16.754 1.00 0.00 H new ATOM 0 HD2 HIS B 15 10.640 -1.686 -17.485 1.00 0.00 H new ATOM 0 HE1 HIS B 15 13.881 -0.064 -19.654 1.00 0.00 H new ATOM 0 HE2 HIS B 15 12.797 -2.251 -18.882 1.00 0.00 H new ATOM 1722 N GLN B 16 7.497 1.041 -19.123 1.00 0.00 N ATOM 1723 CA GLN B 16 6.765 0.165 -20.075 1.00 0.00 C ATOM 1724 C GLN B 16 6.812 0.762 -21.484 1.00 0.00 C ATOM 1725 O GLN B 16 7.001 0.058 -22.456 1.00 0.00 O ATOM 1726 CB GLN B 16 5.309 0.035 -19.627 1.00 0.00 C ATOM 1727 CG GLN B 16 5.238 -0.795 -18.343 1.00 0.00 C ATOM 1728 CD GLN B 16 5.600 -2.249 -18.649 1.00 0.00 C ATOM 1729 OE1 GLN B 16 6.428 -2.834 -17.979 1.00 0.00 O ATOM 1730 NE2 GLN B 16 5.017 -2.857 -19.644 1.00 0.00 N ATOM 0 H GLN B 16 6.943 1.411 -18.350 1.00 0.00 H new ATOM 0 HA GLN B 16 7.237 -0.818 -20.089 1.00 0.00 H new ATOM 0 HB2 GLN B 16 4.881 1.023 -19.457 1.00 0.00 H new ATOM 0 HB3 GLN B 16 4.718 -0.438 -20.411 1.00 0.00 H new ATOM 0 HG2 GLN B 16 5.922 -0.389 -17.598 1.00 0.00 H new ATOM 0 HG3 GLN B 16 4.235 -0.741 -17.919 1.00 0.00 H new ATOM 0 HE21 GLN B 16 4.322 -2.365 -20.206 1.00 0.00 H new ATOM 0 HE22 GLN B 16 5.256 -3.825 -19.861 1.00 0.00 H new ATOM 1739 N TYR B 17 6.624 2.051 -21.613 1.00 0.00 N ATOM 1740 CA TYR B 17 6.641 2.673 -22.983 1.00 0.00 C ATOM 1741 C TYR B 17 8.040 3.170 -23.373 1.00 0.00 C ATOM 1742 O TYR B 17 8.451 3.057 -24.510 1.00 0.00 O ATOM 1743 CB TYR B 17 5.671 3.855 -22.987 1.00 0.00 C ATOM 1744 CG TYR B 17 4.265 3.327 -23.021 1.00 0.00 C ATOM 1745 CD1 TYR B 17 3.625 2.976 -21.832 1.00 0.00 C ATOM 1746 CD2 TYR B 17 3.614 3.172 -24.246 1.00 0.00 C ATOM 1747 CE1 TYR B 17 2.326 2.469 -21.864 1.00 0.00 C ATOM 1748 CE2 TYR B 17 2.316 2.663 -24.287 1.00 0.00 C ATOM 1749 CZ TYR B 17 1.666 2.310 -23.093 1.00 0.00 C ATOM 1750 OH TYR B 17 0.383 1.801 -23.127 1.00 0.00 O ATOM 0 H TYR B 17 6.461 2.698 -20.842 1.00 0.00 H new ATOM 0 HA TYR B 17 6.346 1.915 -23.708 1.00 0.00 H new ATOM 0 HB2 TYR B 17 5.822 4.470 -22.100 1.00 0.00 H new ATOM 0 HB3 TYR B 17 5.856 4.492 -23.852 1.00 0.00 H new ATOM 0 HD1 TYR B 17 4.135 3.097 -20.888 1.00 0.00 H new ATOM 0 HD2 TYR B 17 4.115 3.446 -25.162 1.00 0.00 H new ATOM 0 HE1 TYR B 17 1.828 2.199 -20.944 1.00 0.00 H new ATOM 0 HE2 TYR B 17 1.812 2.541 -25.234 1.00 0.00 H new ATOM 0 HH TYR B 17 0.173 1.385 -22.265 1.00 0.00 H new ATOM 1760 N SER B 18 8.752 3.751 -22.457 1.00 0.00 N ATOM 1761 CA SER B 18 10.102 4.299 -22.786 1.00 0.00 C ATOM 1762 C SER B 18 11.042 3.196 -23.286 1.00 0.00 C ATOM 1763 O SER B 18 11.819 3.400 -24.198 1.00 0.00 O ATOM 1764 CB SER B 18 10.699 4.950 -21.537 1.00 0.00 C ATOM 1765 OG SER B 18 11.816 5.747 -21.910 1.00 0.00 O ATOM 0 H SER B 18 8.461 3.874 -21.487 1.00 0.00 H new ATOM 0 HA SER B 18 9.991 5.037 -23.580 1.00 0.00 H new ATOM 0 HB2 SER B 18 9.949 5.565 -21.040 1.00 0.00 H new ATOM 0 HB3 SER B 18 11.006 4.184 -20.825 1.00 0.00 H new ATOM 0 HG SER B 18 12.477 5.742 -21.187 1.00 0.00 H new ATOM 1771 N GLY B 19 10.993 2.040 -22.693 1.00 0.00 N ATOM 1772 CA GLY B 19 11.901 0.939 -23.128 1.00 0.00 C ATOM 1773 C GLY B 19 11.490 0.420 -24.509 1.00 0.00 C ATOM 1774 O GLY B 19 12.192 -0.366 -25.114 1.00 0.00 O ATOM 0 H GLY B 19 10.364 1.806 -21.925 1.00 0.00 H new ATOM 0 HA2 GLY B 19 12.929 1.299 -23.159 1.00 0.00 H new ATOM 0 HA3 GLY B 19 11.870 0.126 -22.403 1.00 0.00 H new ATOM 1778 N ARG B 20 10.365 0.842 -25.017 1.00 0.00 N ATOM 1779 CA ARG B 20 9.933 0.354 -26.358 1.00 0.00 C ATOM 1780 C ARG B 20 10.842 0.934 -27.445 1.00 0.00 C ATOM 1781 O ARG B 20 11.236 0.250 -28.368 1.00 0.00 O ATOM 1782 CB ARG B 20 8.504 0.812 -26.615 1.00 0.00 C ATOM 1783 CG ARG B 20 7.991 0.187 -27.913 1.00 0.00 C ATOM 1784 CD ARG B 20 6.592 0.718 -28.203 1.00 0.00 C ATOM 1785 NE ARG B 20 5.615 0.066 -27.285 1.00 0.00 N ATOM 1786 CZ ARG B 20 4.408 0.547 -27.170 1.00 0.00 C ATOM 1787 NH1 ARG B 20 4.055 1.591 -27.865 1.00 0.00 N ATOM 1788 NH2 ARG B 20 3.552 -0.019 -26.364 1.00 0.00 N ATOM 0 H ARG B 20 9.729 1.499 -24.565 1.00 0.00 H new ATOM 0 HA ARG B 20 9.993 -0.734 -26.380 1.00 0.00 H new ATOM 0 HB2 ARG B 20 7.863 0.523 -25.782 1.00 0.00 H new ATOM 0 HB3 ARG B 20 8.466 1.899 -26.683 1.00 0.00 H new ATOM 0 HG2 ARG B 20 8.663 0.427 -28.737 1.00 0.00 H new ATOM 0 HG3 ARG B 20 7.970 -0.899 -27.825 1.00 0.00 H new ATOM 0 HD2 ARG B 20 6.567 1.800 -28.070 1.00 0.00 H new ATOM 0 HD3 ARG B 20 6.323 0.518 -29.240 1.00 0.00 H new ATOM 0 HE ARG B 20 5.890 -0.756 -26.747 1.00 0.00 H new ATOM 0 HH11 ARG B 20 4.722 2.031 -28.498 1.00 0.00 H new ATOM 0 HH12 ARG B 20 3.111 1.968 -27.776 1.00 0.00 H new ATOM 0 HH21 ARG B 20 3.826 -0.839 -25.823 1.00 0.00 H new ATOM 0 HH22 ARG B 20 2.609 0.358 -26.275 1.00 0.00 H new ATOM 1802 N GLU B 21 11.160 2.200 -27.343 1.00 0.00 N ATOM 1803 CA GLU B 21 12.030 2.865 -28.371 1.00 0.00 C ATOM 1804 C GLU B 21 13.367 3.263 -27.737 1.00 0.00 C ATOM 1805 O GLU B 21 13.463 3.483 -26.546 1.00 0.00 O ATOM 1806 CB GLU B 21 11.318 4.120 -28.886 1.00 0.00 C ATOM 1807 CG GLU B 21 12.100 4.718 -30.058 1.00 0.00 C ATOM 1808 CD GLU B 21 11.312 5.889 -30.649 1.00 0.00 C ATOM 1809 OE1 GLU B 21 10.170 6.066 -30.257 1.00 0.00 O ATOM 1810 OE2 GLU B 21 11.860 6.585 -31.487 1.00 0.00 O ATOM 0 H GLU B 21 10.853 2.810 -26.585 1.00 0.00 H new ATOM 0 HA GLU B 21 12.215 2.177 -29.196 1.00 0.00 H new ATOM 0 HB2 GLU B 21 10.305 3.870 -29.203 1.00 0.00 H new ATOM 0 HB3 GLU B 21 11.229 4.853 -28.084 1.00 0.00 H new ATOM 0 HG2 GLU B 21 13.079 5.057 -29.721 1.00 0.00 H new ATOM 0 HG3 GLU B 21 12.271 3.958 -30.821 1.00 0.00 H new ATOM 1817 N GLY B 22 14.402 3.338 -28.533 1.00 0.00 N ATOM 1818 CA GLY B 22 15.751 3.703 -28.006 1.00 0.00 C ATOM 1819 C GLY B 22 15.648 4.849 -26.998 1.00 0.00 C ATOM 1820 O GLY B 22 16.550 5.077 -26.217 1.00 0.00 O ATOM 0 H GLY B 22 14.370 3.160 -29.537 1.00 0.00 H new ATOM 0 HA2 GLY B 22 16.208 2.835 -27.531 1.00 0.00 H new ATOM 0 HA3 GLY B 22 16.402 3.995 -28.830 1.00 0.00 H new ATOM 1824 N ASP B 23 14.570 5.582 -27.006 1.00 0.00 N ATOM 1825 CA ASP B 23 14.448 6.708 -26.043 1.00 0.00 C ATOM 1826 C ASP B 23 14.170 6.146 -24.641 1.00 0.00 C ATOM 1827 O ASP B 23 13.177 6.454 -24.020 1.00 0.00 O ATOM 1828 CB ASP B 23 13.301 7.623 -26.492 1.00 0.00 C ATOM 1829 CG ASP B 23 13.262 7.672 -28.022 1.00 0.00 C ATOM 1830 OD1 ASP B 23 14.309 7.871 -28.616 1.00 0.00 O ATOM 1831 OD2 ASP B 23 12.187 7.504 -28.573 1.00 0.00 O ATOM 0 H ASP B 23 13.775 5.451 -27.632 1.00 0.00 H new ATOM 0 HA ASP B 23 15.373 7.284 -26.013 1.00 0.00 H new ATOM 0 HB2 ASP B 23 12.352 7.253 -26.104 1.00 0.00 H new ATOM 0 HB3 ASP B 23 13.441 8.626 -26.088 1.00 0.00 H new ATOM 1836 N LYS B 24 15.045 5.313 -24.144 1.00 0.00 N ATOM 1837 CA LYS B 24 14.837 4.721 -22.789 1.00 0.00 C ATOM 1838 C LYS B 24 14.777 5.829 -21.731 1.00 0.00 C ATOM 1839 O LYS B 24 13.983 5.780 -20.812 1.00 0.00 O ATOM 1840 CB LYS B 24 16.017 3.803 -22.465 1.00 0.00 C ATOM 1841 CG LYS B 24 15.962 2.555 -23.347 1.00 0.00 C ATOM 1842 CD LYS B 24 17.315 1.838 -23.296 1.00 0.00 C ATOM 1843 CE LYS B 24 17.632 1.422 -21.856 1.00 0.00 C ATOM 1844 NZ LYS B 24 16.419 0.827 -21.225 1.00 0.00 N ATOM 0 H LYS B 24 15.897 5.016 -24.619 1.00 0.00 H new ATOM 0 HA LYS B 24 13.901 4.163 -22.783 1.00 0.00 H new ATOM 0 HB2 LYS B 24 16.956 4.332 -22.627 1.00 0.00 H new ATOM 0 HB3 LYS B 24 15.989 3.517 -21.413 1.00 0.00 H new ATOM 0 HG2 LYS B 24 15.171 1.888 -23.004 1.00 0.00 H new ATOM 0 HG3 LYS B 24 15.723 2.832 -24.374 1.00 0.00 H new ATOM 0 HD2 LYS B 24 17.295 0.960 -23.941 1.00 0.00 H new ATOM 0 HD3 LYS B 24 18.098 2.494 -23.675 1.00 0.00 H new ATOM 0 HE2 LYS B 24 18.449 0.700 -21.847 1.00 0.00 H new ATOM 0 HE3 LYS B 24 17.965 2.287 -21.282 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 16.705 0.197 -20.448 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 15.815 1.586 -20.851 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 15.890 0.282 -21.935 1.00 0.00 H new ATOM 1858 N HIS B 25 15.624 6.822 -21.844 1.00 0.00 N ATOM 1859 CA HIS B 25 15.637 7.931 -20.837 1.00 0.00 C ATOM 1860 C HIS B 25 14.872 9.144 -21.376 1.00 0.00 C ATOM 1861 O HIS B 25 14.775 10.162 -20.719 1.00 0.00 O ATOM 1862 CB HIS B 25 17.085 8.345 -20.561 1.00 0.00 C ATOM 1863 CG HIS B 25 17.850 7.191 -19.971 1.00 0.00 C ATOM 1864 ND1 HIS B 25 19.206 7.016 -20.205 1.00 0.00 N ATOM 1865 CD2 HIS B 25 17.476 6.158 -19.144 1.00 0.00 C ATOM 1866 CE1 HIS B 25 19.598 5.919 -19.533 1.00 0.00 C ATOM 1867 NE2 HIS B 25 18.582 5.360 -18.872 1.00 0.00 N ATOM 0 H HIS B 25 16.310 6.914 -22.593 1.00 0.00 H new ATOM 0 HA HIS B 25 15.162 7.581 -19.921 1.00 0.00 H new ATOM 0 HB2 HIS B 25 17.560 8.672 -21.486 1.00 0.00 H new ATOM 0 HB3 HIS B 25 17.105 9.193 -19.876 1.00 0.00 H new ATOM 0 HD2 HIS B 25 16.478 5.992 -18.765 1.00 0.00 H new ATOM 0 HE1 HIS B 25 20.609 5.538 -19.529 1.00 0.00 H new ATOM 0 HE2 HIS B 25 18.611 4.523 -18.290 1.00 0.00 H new ATOM 1876 N LYS B 26 14.342 9.056 -22.569 1.00 0.00 N ATOM 1877 CA LYS B 26 13.593 10.216 -23.157 1.00 0.00 C ATOM 1878 C LYS B 26 12.372 9.733 -23.926 1.00 0.00 C ATOM 1879 O LYS B 26 12.193 8.559 -24.167 1.00 0.00 O ATOM 1880 CB LYS B 26 14.507 11.006 -24.092 1.00 0.00 C ATOM 1881 CG LYS B 26 15.557 11.724 -23.254 1.00 0.00 C ATOM 1882 CD LYS B 26 16.493 12.529 -24.159 1.00 0.00 C ATOM 1883 CE LYS B 26 17.538 13.240 -23.297 1.00 0.00 C ATOM 1884 NZ LYS B 26 18.373 14.132 -24.151 1.00 0.00 N ATOM 0 H LYS B 26 14.394 8.230 -23.165 1.00 0.00 H new ATOM 0 HA LYS B 26 13.262 10.860 -22.342 1.00 0.00 H new ATOM 0 HB2 LYS B 26 14.986 10.337 -24.807 1.00 0.00 H new ATOM 0 HB3 LYS B 26 13.927 11.726 -24.669 1.00 0.00 H new ATOM 0 HG2 LYS B 26 15.071 12.387 -22.539 1.00 0.00 H new ATOM 0 HG3 LYS B 26 16.131 10.999 -22.677 1.00 0.00 H new ATOM 0 HD2 LYS B 26 16.983 11.869 -24.875 1.00 0.00 H new ATOM 0 HD3 LYS B 26 15.923 13.258 -24.736 1.00 0.00 H new ATOM 0 HE2 LYS B 26 17.045 13.823 -22.519 1.00 0.00 H new ATOM 0 HE3 LYS B 26 18.169 12.507 -22.795 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 19.082 14.613 -23.561 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 18.855 13.565 -24.878 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 17.766 14.841 -24.610 1.00 0.00 H new ATOM 1898 N LEU B 27 11.518 10.646 -24.296 1.00 0.00 N ATOM 1899 CA LEU B 27 10.281 10.279 -25.043 1.00 0.00 C ATOM 1900 C LEU B 27 10.056 11.241 -26.198 1.00 0.00 C ATOM 1901 O LEU B 27 10.179 12.437 -26.053 1.00 0.00 O ATOM 1902 CB LEU B 27 9.078 10.371 -24.102 1.00 0.00 C ATOM 1903 CG LEU B 27 9.103 9.232 -23.077 1.00 0.00 C ATOM 1904 CD1 LEU B 27 7.884 9.374 -22.164 1.00 0.00 C ATOM 1905 CD2 LEU B 27 9.068 7.863 -23.791 1.00 0.00 C ATOM 0 H LEU B 27 11.625 11.643 -24.111 1.00 0.00 H new ATOM 0 HA LEU B 27 10.394 9.265 -25.427 1.00 0.00 H new ATOM 0 HB2 LEU B 27 9.086 11.331 -23.586 1.00 0.00 H new ATOM 0 HB3 LEU B 27 8.154 10.327 -24.679 1.00 0.00 H new ATOM 0 HG LEU B 27 10.020 9.287 -22.491 1.00 0.00 H new ATOM 0 HD11 LEU B 27 7.886 8.571 -21.427 1.00 0.00 H new ATOM 0 HD12 LEU B 27 7.923 10.336 -21.652 1.00 0.00 H new ATOM 0 HD13 LEU B 27 6.974 9.317 -22.761 1.00 0.00 H new ATOM 0 HD21 LEU B 27 9.086 7.065 -23.049 1.00 0.00 H new ATOM 0 HD22 LEU B 27 8.157 7.785 -24.385 1.00 0.00 H new ATOM 0 HD23 LEU B 27 9.936 7.771 -24.444 1.00 0.00 H new ATOM 1917 N LYS B 28 9.685 10.725 -27.337 1.00 0.00 N ATOM 1918 CA LYS B 28 9.400 11.604 -28.499 1.00 0.00 C ATOM 1919 C LYS B 28 7.880 11.748 -28.580 1.00 0.00 C ATOM 1920 O LYS B 28 7.156 10.875 -28.144 1.00 0.00 O ATOM 1921 CB LYS B 28 9.903 10.938 -29.788 1.00 0.00 C ATOM 1922 CG LYS B 28 11.345 10.452 -29.610 1.00 0.00 C ATOM 1923 CD LYS B 28 12.272 11.639 -29.346 1.00 0.00 C ATOM 1924 CE LYS B 28 13.723 11.215 -29.582 1.00 0.00 C ATOM 1925 NZ LYS B 28 13.897 10.830 -31.012 1.00 0.00 N ATOM 0 H LYS B 28 9.567 9.727 -27.511 1.00 0.00 H new ATOM 0 HA LYS B 28 9.892 12.570 -28.385 1.00 0.00 H new ATOM 0 HB2 LYS B 28 9.259 10.098 -30.046 1.00 0.00 H new ATOM 0 HB3 LYS B 28 9.851 11.646 -30.615 1.00 0.00 H new ATOM 0 HG2 LYS B 28 11.399 9.747 -28.781 1.00 0.00 H new ATOM 0 HG3 LYS B 28 11.670 9.919 -30.503 1.00 0.00 H new ATOM 0 HD2 LYS B 28 12.013 12.469 -30.003 1.00 0.00 H new ATOM 0 HD3 LYS B 28 12.147 11.991 -28.322 1.00 0.00 H new ATOM 0 HE2 LYS B 28 14.399 12.032 -29.329 1.00 0.00 H new ATOM 0 HE3 LYS B 28 13.979 10.377 -28.934 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 14.868 11.046 -31.314 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 13.719 9.811 -31.121 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 13.225 11.364 -31.599 1.00 0.00 H new ATOM 1939 N LYS B 29 7.379 12.820 -29.130 1.00 0.00 N ATOM 1940 CA LYS B 29 5.900 12.976 -29.230 1.00 0.00 C ATOM 1941 C LYS B 29 5.304 11.679 -29.773 1.00 0.00 C ATOM 1942 O LYS B 29 4.145 11.372 -29.574 1.00 0.00 O ATOM 1943 CB LYS B 29 5.584 14.136 -30.187 1.00 0.00 C ATOM 1944 CG LYS B 29 5.937 13.748 -31.630 1.00 0.00 C ATOM 1945 CD LYS B 29 5.853 14.988 -32.525 1.00 0.00 C ATOM 1946 CE LYS B 29 5.957 14.568 -33.993 1.00 0.00 C ATOM 1947 NZ LYS B 29 6.087 15.780 -34.851 1.00 0.00 N ATOM 0 H LYS B 29 7.926 13.591 -29.513 1.00 0.00 H new ATOM 0 HA LYS B 29 5.474 13.190 -28.250 1.00 0.00 H new ATOM 0 HB2 LYS B 29 4.527 14.393 -30.121 1.00 0.00 H new ATOM 0 HB3 LYS B 29 6.147 15.022 -29.893 1.00 0.00 H new ATOM 0 HG2 LYS B 29 6.941 13.325 -31.669 1.00 0.00 H new ATOM 0 HG3 LYS B 29 5.253 12.979 -31.989 1.00 0.00 H new ATOM 0 HD2 LYS B 29 4.913 15.511 -32.352 1.00 0.00 H new ATOM 0 HD3 LYS B 29 6.655 15.683 -32.277 1.00 0.00 H new ATOM 0 HE2 LYS B 29 6.818 13.915 -34.135 1.00 0.00 H new ATOM 0 HE3 LYS B 29 5.074 13.998 -34.282 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 6.158 15.493 -35.848 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 5.252 16.387 -34.723 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 6.942 16.307 -34.581 1.00 0.00 H new ATOM 1961 N SER B 30 6.105 10.924 -30.462 1.00 0.00 N ATOM 1962 CA SER B 30 5.616 9.638 -31.040 1.00 0.00 C ATOM 1963 C SER B 30 5.459 8.578 -29.946 1.00 0.00 C ATOM 1964 O SER B 30 4.401 8.008 -29.779 1.00 0.00 O ATOM 1965 CB SER B 30 6.609 9.137 -32.086 1.00 0.00 C ATOM 1966 OG SER B 30 6.136 7.913 -32.631 1.00 0.00 O ATOM 0 H SER B 30 7.083 11.139 -30.653 1.00 0.00 H new ATOM 0 HA SER B 30 4.645 9.814 -31.502 1.00 0.00 H new ATOM 0 HB2 SER B 30 6.728 9.879 -32.876 1.00 0.00 H new ATOM 0 HB3 SER B 30 7.590 8.992 -31.634 1.00 0.00 H new ATOM 0 HG SER B 30 6.770 7.588 -33.304 1.00 0.00 H new ATOM 1972 N GLU B 31 6.494 8.306 -29.194 1.00 0.00 N ATOM 1973 CA GLU B 31 6.374 7.284 -28.126 1.00 0.00 C ATOM 1974 C GLU B 31 5.448 7.832 -27.050 1.00 0.00 C ATOM 1975 O GLU B 31 4.752 7.099 -26.377 1.00 0.00 O ATOM 1976 CB GLU B 31 7.758 6.974 -27.547 1.00 0.00 C ATOM 1977 CG GLU B 31 7.655 5.821 -26.548 1.00 0.00 C ATOM 1978 CD GLU B 31 9.060 5.302 -26.231 1.00 0.00 C ATOM 1979 OE1 GLU B 31 9.875 6.093 -25.790 1.00 0.00 O ATOM 1980 OE2 GLU B 31 9.298 4.124 -26.440 1.00 0.00 O ATOM 0 H GLU B 31 7.410 8.747 -29.276 1.00 0.00 H new ATOM 0 HA GLU B 31 5.963 6.357 -28.525 1.00 0.00 H new ATOM 0 HB2 GLU B 31 8.448 6.712 -28.349 1.00 0.00 H new ATOM 0 HB3 GLU B 31 8.163 7.858 -27.055 1.00 0.00 H new ATOM 0 HG2 GLU B 31 7.164 6.158 -25.635 1.00 0.00 H new ATOM 0 HG3 GLU B 31 7.043 5.019 -26.962 1.00 0.00 H new ATOM 1987 N LEU B 32 5.428 9.126 -26.892 1.00 0.00 N ATOM 1988 CA LEU B 32 4.539 9.735 -25.876 1.00 0.00 C ATOM 1989 C LEU B 32 3.090 9.406 -26.237 1.00 0.00 C ATOM 1990 O LEU B 32 2.286 9.113 -25.383 1.00 0.00 O ATOM 1991 CB LEU B 32 4.761 11.253 -25.866 1.00 0.00 C ATOM 1992 CG LEU B 32 3.904 11.929 -24.757 1.00 0.00 C ATOM 1993 CD1 LEU B 32 4.725 13.014 -24.049 1.00 0.00 C ATOM 1994 CD2 LEU B 32 2.665 12.589 -25.372 1.00 0.00 C ATOM 0 H LEU B 32 5.992 9.786 -27.427 1.00 0.00 H new ATOM 0 HA LEU B 32 4.759 9.341 -24.884 1.00 0.00 H new ATOM 0 HB2 LEU B 32 5.816 11.470 -25.699 1.00 0.00 H new ATOM 0 HB3 LEU B 32 4.500 11.670 -26.839 1.00 0.00 H new ATOM 0 HG LEU B 32 3.601 11.161 -24.045 1.00 0.00 H new ATOM 0 HD11 LEU B 32 4.118 13.482 -23.274 1.00 0.00 H new ATOM 0 HD12 LEU B 32 5.608 12.564 -23.595 1.00 0.00 H new ATOM 0 HD13 LEU B 32 5.033 13.768 -24.773 1.00 0.00 H new ATOM 0 HD21 LEU B 32 2.074 13.058 -24.585 1.00 0.00 H new ATOM 0 HD22 LEU B 32 2.976 13.346 -26.093 1.00 0.00 H new ATOM 0 HD23 LEU B 32 2.063 11.833 -25.876 1.00 0.00 H new ATOM 2006 N LYS B 33 2.753 9.449 -27.502 1.00 0.00 N ATOM 2007 CA LYS B 33 1.352 9.129 -27.920 1.00 0.00 C ATOM 2008 C LYS B 33 0.969 7.698 -27.520 1.00 0.00 C ATOM 2009 O LYS B 33 -0.145 7.444 -27.103 1.00 0.00 O ATOM 2010 CB LYS B 33 1.233 9.268 -29.443 1.00 0.00 C ATOM 2011 CG LYS B 33 -0.198 8.928 -29.889 1.00 0.00 C ATOM 2012 CD LYS B 33 -0.314 9.083 -31.406 1.00 0.00 C ATOM 2013 CE LYS B 33 -1.743 8.749 -31.851 1.00 0.00 C ATOM 2014 NZ LYS B 33 -1.743 8.381 -33.295 1.00 0.00 N ATOM 0 H LYS B 33 3.387 9.692 -28.264 1.00 0.00 H new ATOM 0 HA LYS B 33 0.678 9.824 -27.419 1.00 0.00 H new ATOM 0 HB2 LYS B 33 1.486 10.284 -29.745 1.00 0.00 H new ATOM 0 HB3 LYS B 33 1.944 8.604 -29.934 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -0.448 7.908 -29.598 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -0.911 9.585 -29.391 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -0.061 10.102 -31.698 1.00 0.00 H new ATOM 0 HD3 LYS B 33 0.396 8.423 -31.904 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -2.137 7.926 -31.255 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -2.397 9.605 -31.683 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -2.531 8.860 -33.775 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -0.844 8.674 -33.728 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -1.854 7.351 -33.391 1.00 0.00 H new ATOM 2028 N GLU B 34 1.864 6.759 -27.656 1.00 0.00 N ATOM 2029 CA GLU B 34 1.524 5.358 -27.302 1.00 0.00 C ATOM 2030 C GLU B 34 1.342 5.269 -25.797 1.00 0.00 C ATOM 2031 O GLU B 34 0.536 4.517 -25.300 1.00 0.00 O ATOM 2032 CB GLU B 34 2.644 4.411 -27.775 1.00 0.00 C ATOM 2033 CG GLU B 34 2.392 3.973 -29.226 1.00 0.00 C ATOM 2034 CD GLU B 34 2.423 5.185 -30.158 1.00 0.00 C ATOM 2035 OE1 GLU B 34 2.905 6.219 -29.737 1.00 0.00 O ATOM 2036 OE2 GLU B 34 1.963 5.055 -31.280 1.00 0.00 O ATOM 0 H GLU B 34 2.814 6.904 -27.997 1.00 0.00 H new ATOM 0 HA GLU B 34 0.599 5.059 -27.795 1.00 0.00 H new ATOM 0 HB2 GLU B 34 3.609 4.912 -27.701 1.00 0.00 H new ATOM 0 HB3 GLU B 34 2.689 3.536 -27.126 1.00 0.00 H new ATOM 0 HG2 GLU B 34 3.149 3.251 -29.532 1.00 0.00 H new ATOM 0 HG3 GLU B 34 1.426 3.473 -29.300 1.00 0.00 H new ATOM 2043 N LEU B 35 2.078 6.035 -25.063 1.00 0.00 N ATOM 2044 CA LEU B 35 1.911 5.993 -23.599 1.00 0.00 C ATOM 2045 C LEU B 35 0.493 6.443 -23.267 1.00 0.00 C ATOM 2046 O LEU B 35 -0.217 5.795 -22.545 1.00 0.00 O ATOM 2047 CB LEU B 35 2.921 6.942 -22.954 1.00 0.00 C ATOM 2048 CG LEU B 35 2.817 6.861 -21.420 1.00 0.00 C ATOM 2049 CD1 LEU B 35 4.080 7.471 -20.807 1.00 0.00 C ATOM 2050 CD2 LEU B 35 1.558 7.606 -20.901 1.00 0.00 C ATOM 0 H LEU B 35 2.784 6.685 -25.410 1.00 0.00 H new ATOM 0 HA LEU B 35 2.078 4.984 -23.222 1.00 0.00 H new ATOM 0 HB2 LEU B 35 3.931 6.682 -23.272 1.00 0.00 H new ATOM 0 HB3 LEU B 35 2.735 7.964 -23.286 1.00 0.00 H new ATOM 0 HG LEU B 35 2.725 5.815 -21.126 1.00 0.00 H new ATOM 0 HD11 LEU B 35 4.018 7.420 -19.720 1.00 0.00 H new ATOM 0 HD12 LEU B 35 4.954 6.916 -21.147 1.00 0.00 H new ATOM 0 HD13 LEU B 35 4.168 8.512 -21.116 1.00 0.00 H new ATOM 0 HD21 LEU B 35 1.513 7.531 -19.815 1.00 0.00 H new ATOM 0 HD22 LEU B 35 1.611 8.656 -21.190 1.00 0.00 H new ATOM 0 HD23 LEU B 35 0.665 7.156 -21.333 1.00 0.00 H new ATOM 2062 N ILE B 36 0.083 7.564 -23.783 1.00 0.00 N ATOM 2063 CA ILE B 36 -1.282 8.078 -23.474 1.00 0.00 C ATOM 2064 C ILE B 36 -2.369 7.316 -24.249 1.00 0.00 C ATOM 2065 O ILE B 36 -3.393 6.952 -23.706 1.00 0.00 O ATOM 2066 CB ILE B 36 -1.358 9.557 -23.860 1.00 0.00 C ATOM 2067 CG1 ILE B 36 -0.318 10.356 -23.068 1.00 0.00 C ATOM 2068 CG2 ILE B 36 -2.754 10.089 -23.532 1.00 0.00 C ATOM 2069 CD1 ILE B 36 -0.265 11.794 -23.590 1.00 0.00 C ATOM 0 H ILE B 36 0.635 8.151 -24.409 1.00 0.00 H new ATOM 0 HA ILE B 36 -1.458 7.939 -22.407 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.158 9.662 -24.926 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -0.573 10.353 -22.008 1.00 0.00 H new ATOM 0 HG13 ILE B 36 0.662 9.889 -23.162 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -2.815 11.143 -23.805 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -3.499 9.525 -24.093 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -2.944 9.979 -22.464 1.00 0.00 H new ATOM 0 HD11 ILE B 36 0.476 12.359 -23.024 1.00 0.00 H new ATOM 0 HD12 ILE B 36 0.011 11.788 -24.645 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -1.244 12.260 -23.473 1.00 0.00 H new ATOM 2081 N ASN B 37 -2.178 7.133 -25.526 1.00 0.00 N ATOM 2082 CA ASN B 37 -3.221 6.464 -26.364 1.00 0.00 C ATOM 2083 C ASN B 37 -3.443 5.000 -25.974 1.00 0.00 C ATOM 2084 O ASN B 37 -4.555 4.512 -25.994 1.00 0.00 O ATOM 2085 CB ASN B 37 -2.789 6.539 -27.832 1.00 0.00 C ATOM 2086 CG ASN B 37 -3.850 5.888 -28.722 1.00 0.00 C ATOM 2087 OD1 ASN B 37 -3.626 5.675 -29.897 1.00 0.00 O ATOM 2088 ND2 ASN B 37 -5.002 5.560 -28.210 1.00 0.00 N ATOM 0 H ASN B 37 -1.339 7.419 -26.031 1.00 0.00 H new ATOM 0 HA ASN B 37 -4.165 6.984 -26.202 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -2.645 7.579 -28.125 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -1.832 6.035 -27.964 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -5.715 5.125 -28.795 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -5.191 5.738 -27.224 1.00 0.00 H new ATOM 2095 N ASN B 38 -2.401 4.283 -25.672 1.00 0.00 N ATOM 2096 CA ASN B 38 -2.558 2.827 -25.338 1.00 0.00 C ATOM 2097 C ASN B 38 -2.623 2.576 -23.829 1.00 0.00 C ATOM 2098 O ASN B 38 -3.350 1.714 -23.377 1.00 0.00 O ATOM 2099 CB ASN B 38 -1.371 2.052 -25.908 1.00 0.00 C ATOM 2100 CG ASN B 38 -1.629 0.550 -25.768 1.00 0.00 C ATOM 2101 OD1 ASN B 38 -0.763 -0.256 -26.045 1.00 0.00 O ATOM 2102 ND2 ASN B 38 -2.789 0.136 -25.335 1.00 0.00 N ATOM 0 H ASN B 38 -1.444 4.634 -25.640 1.00 0.00 H new ATOM 0 HA ASN B 38 -3.499 2.493 -25.775 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -1.224 2.311 -26.957 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -0.457 2.326 -25.381 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -2.967 -0.863 -25.230 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -3.517 0.811 -25.102 1.00 0.00 H new ATOM 2109 N GLU B 39 -1.863 3.282 -23.040 1.00 0.00 N ATOM 2110 CA GLU B 39 -1.905 3.011 -21.576 1.00 0.00 C ATOM 2111 C GLU B 39 -3.265 3.423 -21.027 1.00 0.00 C ATOM 2112 O GLU B 39 -3.835 2.760 -20.184 1.00 0.00 O ATOM 2113 CB GLU B 39 -0.817 3.816 -20.855 1.00 0.00 C ATOM 2114 CG GLU B 39 -0.629 3.272 -19.445 1.00 0.00 C ATOM 2115 CD GLU B 39 0.433 4.105 -18.731 1.00 0.00 C ATOM 2116 OE1 GLU B 39 1.203 4.761 -19.414 1.00 0.00 O ATOM 2117 OE2 GLU B 39 0.439 4.101 -17.515 1.00 0.00 O ATOM 0 H GLU B 39 -1.226 4.021 -23.337 1.00 0.00 H new ATOM 0 HA GLU B 39 -1.736 1.947 -21.410 1.00 0.00 H new ATOM 0 HB2 GLU B 39 0.121 3.755 -21.407 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -1.096 4.869 -20.815 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -1.570 3.312 -18.897 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -0.325 2.226 -19.482 1.00 0.00 H new ATOM 2124 N LEU B 40 -3.782 4.534 -21.491 1.00 0.00 N ATOM 2125 CA LEU B 40 -5.102 5.026 -20.994 1.00 0.00 C ATOM 2126 C LEU B 40 -6.180 4.734 -22.043 1.00 0.00 C ATOM 2127 O LEU B 40 -6.779 5.632 -22.600 1.00 0.00 O ATOM 2128 CB LEU B 40 -5.014 6.542 -20.751 1.00 0.00 C ATOM 2129 CG LEU B 40 -3.640 6.913 -20.171 1.00 0.00 C ATOM 2130 CD1 LEU B 40 -3.615 8.410 -19.840 1.00 0.00 C ATOM 2131 CD2 LEU B 40 -3.368 6.111 -18.892 1.00 0.00 C ATOM 0 H LEU B 40 -3.342 5.124 -22.197 1.00 0.00 H new ATOM 0 HA LEU B 40 -5.359 4.521 -20.063 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -5.177 7.077 -21.687 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -5.802 6.853 -20.065 1.00 0.00 H new ATOM 0 HG LEU B 40 -2.872 6.680 -20.908 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -2.641 8.675 -19.428 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -3.795 8.986 -20.748 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -4.391 8.634 -19.108 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -2.391 6.384 -18.492 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -4.138 6.333 -18.153 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -3.381 5.045 -19.121 1.00 0.00 H new ATOM 2143 N SER B 41 -6.426 3.485 -22.321 1.00 0.00 N ATOM 2144 CA SER B 41 -7.459 3.138 -23.338 1.00 0.00 C ATOM 2145 C SER B 41 -8.826 3.687 -22.913 1.00 0.00 C ATOM 2146 O SER B 41 -9.586 4.168 -23.730 1.00 0.00 O ATOM 2147 CB SER B 41 -7.549 1.618 -23.475 1.00 0.00 C ATOM 2148 OG SER B 41 -8.352 1.296 -24.603 1.00 0.00 O ATOM 0 H SER B 41 -5.957 2.689 -21.889 1.00 0.00 H new ATOM 0 HA SER B 41 -7.176 3.581 -24.293 1.00 0.00 H new ATOM 0 HB2 SER B 41 -6.552 1.192 -23.590 1.00 0.00 H new ATOM 0 HB3 SER B 41 -7.979 1.185 -22.572 1.00 0.00 H new ATOM 0 HG SER B 41 -8.411 0.322 -24.695 1.00 0.00 H new ATOM 2154 N HIS B 42 -9.153 3.609 -21.643 1.00 0.00 N ATOM 2155 CA HIS B 42 -10.486 4.116 -21.167 1.00 0.00 C ATOM 2156 C HIS B 42 -10.323 4.914 -19.866 1.00 0.00 C ATOM 2157 O HIS B 42 -11.188 5.682 -19.493 1.00 0.00 O ATOM 2158 CB HIS B 42 -11.411 2.920 -20.919 1.00 0.00 C ATOM 2159 CG HIS B 42 -12.741 3.401 -20.404 1.00 0.00 C ATOM 2160 ND1 HIS B 42 -13.614 4.151 -21.183 1.00 0.00 N ATOM 2161 CD2 HIS B 42 -13.365 3.241 -19.191 1.00 0.00 C ATOM 2162 CE1 HIS B 42 -14.703 4.410 -20.435 1.00 0.00 C ATOM 2163 NE2 HIS B 42 -14.600 3.878 -19.217 1.00 0.00 N ATOM 0 H HIS B 42 -8.556 3.217 -20.915 1.00 0.00 H new ATOM 0 HA HIS B 42 -10.912 4.771 -21.926 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -11.550 2.359 -21.843 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -10.956 2.240 -20.198 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -12.959 2.703 -18.347 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -15.554 4.978 -20.779 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -15.284 3.928 -18.462 1.00 0.00 H new ATOM 2172 N PHE B 43 -9.232 4.743 -19.170 1.00 0.00 N ATOM 2173 CA PHE B 43 -9.036 5.498 -17.896 1.00 0.00 C ATOM 2174 C PHE B 43 -9.036 7.005 -18.176 1.00 0.00 C ATOM 2175 O PHE B 43 -9.593 7.780 -17.423 1.00 0.00 O ATOM 2176 CB PHE B 43 -7.710 5.082 -17.243 1.00 0.00 C ATOM 2177 CG PHE B 43 -7.504 5.853 -15.950 1.00 0.00 C ATOM 2178 CD1 PHE B 43 -8.437 5.755 -14.905 1.00 0.00 C ATOM 2179 CD2 PHE B 43 -6.376 6.675 -15.797 1.00 0.00 C ATOM 2180 CE1 PHE B 43 -8.241 6.477 -13.721 1.00 0.00 C ATOM 2181 CE2 PHE B 43 -6.184 7.392 -14.612 1.00 0.00 C ATOM 2182 CZ PHE B 43 -7.116 7.295 -13.575 1.00 0.00 C ATOM 0 H PHE B 43 -8.469 4.116 -19.426 1.00 0.00 H new ATOM 0 HA PHE B 43 -9.854 5.267 -17.214 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -7.715 4.011 -17.041 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -6.883 5.274 -17.926 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -9.306 5.123 -15.014 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -5.655 6.754 -16.597 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -8.960 6.402 -12.919 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -5.314 8.022 -14.498 1.00 0.00 H new ATOM 0 HZ PHE B 43 -6.968 7.851 -12.661 1.00 0.00 H new ATOM 2192 N LEU B 44 -8.422 7.427 -19.256 1.00 0.00 N ATOM 2193 CA LEU B 44 -8.385 8.885 -19.602 1.00 0.00 C ATOM 2194 C LEU B 44 -8.878 9.037 -21.036 1.00 0.00 C ATOM 2195 O LEU B 44 -8.868 8.094 -21.801 1.00 0.00 O ATOM 2196 CB LEU B 44 -6.944 9.404 -19.507 1.00 0.00 C ATOM 2197 CG LEU B 44 -6.926 10.944 -19.500 1.00 0.00 C ATOM 2198 CD1 LEU B 44 -7.535 11.492 -18.191 1.00 0.00 C ATOM 2199 CD2 LEU B 44 -5.476 11.427 -19.643 1.00 0.00 C ATOM 0 H LEU B 44 -7.941 6.819 -19.918 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.012 9.452 -18.914 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -6.473 9.025 -18.600 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.360 9.031 -20.349 1.00 0.00 H new ATOM 0 HG LEU B 44 -7.525 11.311 -20.334 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.512 12.582 -18.207 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -8.567 11.152 -18.099 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -6.957 11.130 -17.341 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -5.453 12.517 -19.639 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -4.883 11.049 -18.811 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -5.061 11.059 -20.581 1.00 0.00 H new ATOM 2211 N GLU B 45 -9.309 10.202 -21.421 1.00 0.00 N ATOM 2212 CA GLU B 45 -9.790 10.358 -22.814 1.00 0.00 C ATOM 2213 C GLU B 45 -8.697 9.873 -23.771 1.00 0.00 C ATOM 2214 O GLU B 45 -7.629 10.442 -23.871 1.00 0.00 O ATOM 2215 CB GLU B 45 -10.143 11.830 -23.086 1.00 0.00 C ATOM 2216 CG GLU B 45 -8.872 12.667 -23.297 1.00 0.00 C ATOM 2217 CD GLU B 45 -9.194 14.151 -23.096 1.00 0.00 C ATOM 2218 OE1 GLU B 45 -10.321 14.534 -23.362 1.00 0.00 O ATOM 2219 OE2 GLU B 45 -8.307 14.877 -22.679 1.00 0.00 O ATOM 0 H GLU B 45 -9.349 11.040 -20.841 1.00 0.00 H new ATOM 0 HA GLU B 45 -10.690 9.762 -22.968 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -10.779 11.899 -23.968 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -10.714 12.232 -22.249 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -8.098 12.354 -22.596 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -8.479 12.503 -24.300 1.00 0.00 H new ATOM 2226 N GLU B 46 -8.959 8.803 -24.455 1.00 0.00 N ATOM 2227 CA GLU B 46 -7.955 8.249 -25.400 1.00 0.00 C ATOM 2228 C GLU B 46 -7.748 9.232 -26.564 1.00 0.00 C ATOM 2229 O GLU B 46 -8.642 9.969 -26.929 1.00 0.00 O ATOM 2230 CB GLU B 46 -8.460 6.905 -25.928 1.00 0.00 C ATOM 2231 CG GLU B 46 -7.379 6.257 -26.787 1.00 0.00 C ATOM 2232 CD GLU B 46 -7.884 4.913 -27.315 1.00 0.00 C ATOM 2233 OE1 GLU B 46 -8.966 4.512 -26.918 1.00 0.00 O ATOM 2234 OE2 GLU B 46 -7.180 4.307 -28.106 1.00 0.00 O ATOM 0 H GLU B 46 -9.834 8.281 -24.401 1.00 0.00 H new ATOM 0 HA GLU B 46 -7.003 8.103 -24.890 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -8.720 6.250 -25.096 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -9.367 7.050 -26.515 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -7.119 6.912 -27.619 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -6.472 6.112 -26.200 1.00 0.00 H new ATOM 2241 N ILE B 47 -6.570 9.259 -27.137 1.00 0.00 N ATOM 2242 CA ILE B 47 -6.294 10.207 -28.265 1.00 0.00 C ATOM 2243 C ILE B 47 -6.680 9.560 -29.599 1.00 0.00 C ATOM 2244 O ILE B 47 -6.446 8.388 -29.817 1.00 0.00 O ATOM 2245 CB ILE B 47 -4.799 10.535 -28.294 1.00 0.00 C ATOM 2246 CG1 ILE B 47 -4.330 10.805 -26.861 1.00 0.00 C ATOM 2247 CG2 ILE B 47 -4.522 11.774 -29.190 1.00 0.00 C ATOM 2248 CD1 ILE B 47 -2.895 11.317 -26.893 1.00 0.00 C ATOM 0 H ILE B 47 -5.785 8.664 -26.873 1.00 0.00 H new ATOM 0 HA ILE B 47 -6.878 11.115 -28.117 1.00 0.00 H new ATOM 0 HB ILE B 47 -4.252 9.691 -28.714 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -4.980 11.539 -26.385 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -4.390 9.893 -26.268 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -3.453 11.988 -29.195 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -4.856 11.569 -30.207 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -5.062 12.635 -28.797 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -2.555 11.511 -25.876 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -2.251 10.568 -27.354 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -2.851 12.239 -27.473 1.00 0.00 H new ATOM 2260 N LYS B 48 -7.267 10.319 -30.493 1.00 0.00 N ATOM 2261 CA LYS B 48 -7.674 9.764 -31.824 1.00 0.00 C ATOM 2262 C LYS B 48 -6.859 10.446 -32.931 1.00 0.00 C ATOM 2263 O LYS B 48 -6.854 10.007 -34.063 1.00 0.00 O ATOM 2264 CB LYS B 48 -9.174 10.034 -32.060 1.00 0.00 C ATOM 2265 CG LYS B 48 -9.990 9.776 -30.779 1.00 0.00 C ATOM 2266 CD LYS B 48 -10.078 8.268 -30.478 1.00 0.00 C ATOM 2267 CE LYS B 48 -10.342 8.061 -28.986 1.00 0.00 C ATOM 2268 NZ LYS B 48 -10.666 6.627 -28.733 1.00 0.00 N ATOM 0 H LYS B 48 -7.483 11.306 -30.357 1.00 0.00 H new ATOM 0 HA LYS B 48 -7.490 8.690 -31.839 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -9.315 11.065 -32.384 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -9.540 9.395 -32.864 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -9.527 10.292 -29.938 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -10.993 10.187 -30.893 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -10.876 7.815 -31.066 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -9.150 7.774 -30.766 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -9.467 8.355 -28.407 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -11.167 8.694 -28.660 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -11.041 6.521 -27.769 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -11.378 6.306 -29.419 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -9.804 6.053 -28.834 1.00 0.00 H new ATOM 2282 N GLU B 49 -6.179 11.523 -32.617 1.00 0.00 N ATOM 2283 CA GLU B 49 -5.374 12.243 -33.655 1.00 0.00 C ATOM 2284 C GLU B 49 -4.025 12.673 -33.056 1.00 0.00 C ATOM 2285 O GLU B 49 -3.951 13.156 -31.944 1.00 0.00 O ATOM 2286 CB GLU B 49 -6.163 13.470 -34.118 1.00 0.00 C ATOM 2287 CG GLU B 49 -5.493 14.094 -35.347 1.00 0.00 C ATOM 2288 CD GLU B 49 -5.634 13.153 -36.545 1.00 0.00 C ATOM 2289 OE1 GLU B 49 -6.507 12.302 -36.507 1.00 0.00 O ATOM 2290 OE2 GLU B 49 -4.867 13.301 -37.483 1.00 0.00 O ATOM 0 H GLU B 49 -6.147 11.935 -31.685 1.00 0.00 H new ATOM 0 HA GLU B 49 -5.183 11.588 -34.505 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -7.187 13.184 -34.358 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -6.217 14.202 -33.313 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -5.951 15.057 -35.573 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -4.439 14.282 -35.142 1.00 0.00 H new ATOM 2297 N GLN B 50 -2.956 12.476 -33.786 1.00 0.00 N ATOM 2298 CA GLN B 50 -1.596 12.843 -33.273 1.00 0.00 C ATOM 2299 C GLN B 50 -1.497 14.361 -33.038 1.00 0.00 C ATOM 2300 O GLN B 50 -0.662 14.820 -32.293 1.00 0.00 O ATOM 2301 CB GLN B 50 -0.518 12.412 -34.295 1.00 0.00 C ATOM 2302 CG GLN B 50 -1.020 11.221 -35.129 1.00 0.00 C ATOM 2303 CD GLN B 50 -1.848 11.739 -36.308 1.00 0.00 C ATOM 2304 OE1 GLN B 50 -1.933 11.100 -37.338 1.00 0.00 O ATOM 2305 NE2 GLN B 50 -2.463 12.885 -36.194 1.00 0.00 N ATOM 0 H GLN B 50 -2.965 12.074 -34.723 1.00 0.00 H new ATOM 0 HA GLN B 50 -1.434 12.328 -32.326 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -0.274 13.248 -34.951 1.00 0.00 H new ATOM 0 HB3 GLN B 50 0.399 12.139 -33.773 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -0.175 10.636 -35.493 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -1.624 10.558 -34.510 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -2.390 13.419 -35.328 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -3.017 13.246 -36.971 1.00 0.00 H new ATOM 2314 N GLU B 51 -2.318 15.142 -33.679 1.00 0.00 N ATOM 2315 CA GLU B 51 -2.237 16.623 -33.491 1.00 0.00 C ATOM 2316 C GLU B 51 -2.471 16.966 -32.026 1.00 0.00 C ATOM 2317 O GLU B 51 -1.834 17.841 -31.481 1.00 0.00 O ATOM 2318 CB GLU B 51 -3.297 17.313 -34.361 1.00 0.00 C ATOM 2319 CG GLU B 51 -4.693 17.046 -33.787 1.00 0.00 C ATOM 2320 CD GLU B 51 -5.755 17.530 -34.774 1.00 0.00 C ATOM 2321 OE1 GLU B 51 -5.404 18.282 -35.669 1.00 0.00 O ATOM 2322 OE2 GLU B 51 -6.901 17.144 -34.617 1.00 0.00 O ATOM 0 H GLU B 51 -3.041 14.824 -34.324 1.00 0.00 H new ATOM 0 HA GLU B 51 -1.248 16.971 -33.788 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -3.108 18.386 -34.398 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -3.238 16.943 -35.385 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -4.820 15.981 -33.594 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -4.809 17.559 -32.832 1.00 0.00 H new ATOM 2329 N VAL B 52 -3.376 16.290 -31.383 1.00 0.00 N ATOM 2330 CA VAL B 52 -3.632 16.592 -29.956 1.00 0.00 C ATOM 2331 C VAL B 52 -2.351 16.363 -29.194 1.00 0.00 C ATOM 2332 O VAL B 52 -2.006 17.102 -28.303 1.00 0.00 O ATOM 2333 CB VAL B 52 -4.710 15.653 -29.427 1.00 0.00 C ATOM 2334 CG1 VAL B 52 -4.847 15.814 -27.910 1.00 0.00 C ATOM 2335 CG2 VAL B 52 -6.040 15.966 -30.103 1.00 0.00 C ATOM 0 H VAL B 52 -3.946 15.545 -31.783 1.00 0.00 H new ATOM 0 HA VAL B 52 -3.966 17.623 -29.838 1.00 0.00 H new ATOM 0 HB VAL B 52 -4.427 14.624 -29.649 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -5.619 15.139 -27.541 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -3.897 15.575 -27.431 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -5.122 16.843 -27.677 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -6.809 15.293 -29.723 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -6.323 16.997 -29.890 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -5.941 15.832 -31.180 1.00 0.00 H new ATOM 2345 N VAL B 53 -1.652 15.336 -29.538 1.00 0.00 N ATOM 2346 CA VAL B 53 -0.387 15.042 -28.837 1.00 0.00 C ATOM 2347 C VAL B 53 0.579 16.197 -29.038 1.00 0.00 C ATOM 2348 O VAL B 53 1.274 16.575 -28.137 1.00 0.00 O ATOM 2349 CB VAL B 53 0.194 13.749 -29.400 1.00 0.00 C ATOM 2350 CG1 VAL B 53 1.506 13.410 -28.697 1.00 0.00 C ATOM 2351 CG2 VAL B 53 -0.812 12.615 -29.182 1.00 0.00 C ATOM 0 H VAL B 53 -1.902 14.681 -30.279 1.00 0.00 H new ATOM 0 HA VAL B 53 -0.562 14.920 -27.768 1.00 0.00 H new ATOM 0 HB VAL B 53 0.389 13.875 -30.465 1.00 0.00 H new ATOM 0 HG11 VAL B 53 1.911 12.485 -29.108 1.00 0.00 H new ATOM 0 HG12 VAL B 53 2.221 14.218 -28.851 1.00 0.00 H new ATOM 0 HG13 VAL B 53 1.325 13.284 -27.630 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -0.405 11.686 -29.582 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -1.003 12.498 -28.115 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -1.745 12.853 -29.694 1.00 0.00 H new ATOM 2361 N ASP B 54 0.629 16.757 -30.211 1.00 0.00 N ATOM 2362 CA ASP B 54 1.562 17.894 -30.456 1.00 0.00 C ATOM 2363 C ASP B 54 1.208 19.060 -29.536 1.00 0.00 C ATOM 2364 O ASP B 54 2.063 19.740 -29.008 1.00 0.00 O ATOM 2365 CB ASP B 54 1.464 18.343 -31.916 1.00 0.00 C ATOM 2366 CG ASP B 54 2.464 19.474 -32.171 1.00 0.00 C ATOM 2367 OD1 ASP B 54 3.126 19.876 -31.228 1.00 0.00 O ATOM 2368 OD2 ASP B 54 2.558 19.911 -33.306 1.00 0.00 O ATOM 0 H ASP B 54 0.064 16.478 -31.013 1.00 0.00 H new ATOM 0 HA ASP B 54 2.581 17.568 -30.249 1.00 0.00 H new ATOM 0 HB2 ASP B 54 1.671 17.504 -32.580 1.00 0.00 H new ATOM 0 HB3 ASP B 54 0.452 18.682 -32.136 1.00 0.00 H new ATOM 2373 N LYS B 55 -0.053 19.300 -29.355 1.00 0.00 N ATOM 2374 CA LYS B 55 -0.483 20.426 -28.477 1.00 0.00 C ATOM 2375 C LYS B 55 -0.034 20.131 -27.051 1.00 0.00 C ATOM 2376 O LYS B 55 0.438 20.996 -26.332 1.00 0.00 O ATOM 2377 CB LYS B 55 -2.007 20.568 -28.527 1.00 0.00 C ATOM 2378 CG LYS B 55 -2.430 21.805 -27.727 1.00 0.00 C ATOM 2379 CD LYS B 55 -3.934 22.074 -27.916 1.00 0.00 C ATOM 2380 CE LYS B 55 -4.188 22.798 -29.247 1.00 0.00 C ATOM 2381 NZ LYS B 55 -5.582 23.322 -29.267 1.00 0.00 N ATOM 0 H LYS B 55 -0.812 18.765 -29.777 1.00 0.00 H new ATOM 0 HA LYS B 55 -0.034 21.358 -28.819 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -2.341 20.658 -29.561 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -2.480 19.676 -28.116 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -2.210 21.656 -26.670 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -1.855 22.672 -28.053 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -4.483 21.133 -27.897 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -4.308 22.678 -27.089 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -3.478 23.616 -29.370 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -4.033 22.114 -30.081 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -5.943 23.311 -30.242 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -6.186 22.724 -28.667 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -5.592 24.297 -28.905 1.00 0.00 H new ATOM 2395 N VAL B 56 -0.152 18.901 -26.650 1.00 0.00 N ATOM 2396 CA VAL B 56 0.289 18.519 -25.287 1.00 0.00 C ATOM 2397 C VAL B 56 1.800 18.688 -25.233 1.00 0.00 C ATOM 2398 O VAL B 56 2.372 18.993 -24.206 1.00 0.00 O ATOM 2399 CB VAL B 56 -0.107 17.060 -25.010 1.00 0.00 C ATOM 2400 CG1 VAL B 56 0.712 16.493 -23.844 1.00 0.00 C ATOM 2401 CG2 VAL B 56 -1.594 17.003 -24.652 1.00 0.00 C ATOM 0 H VAL B 56 -0.537 18.141 -27.211 1.00 0.00 H new ATOM 0 HA VAL B 56 -0.183 19.144 -24.529 1.00 0.00 H new ATOM 0 HB VAL B 56 0.090 16.466 -25.902 1.00 0.00 H new ATOM 0 HG11 VAL B 56 0.418 15.459 -23.662 1.00 0.00 H new ATOM 0 HG12 VAL B 56 1.773 16.531 -24.092 1.00 0.00 H new ATOM 0 HG13 VAL B 56 0.528 17.086 -22.948 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -1.881 15.970 -24.454 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -1.778 17.607 -23.764 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -2.183 17.391 -25.483 1.00 0.00 H new ATOM 2411 N MET B 57 2.448 18.496 -26.346 1.00 0.00 N ATOM 2412 CA MET B 57 3.924 18.651 -26.373 1.00 0.00 C ATOM 2413 C MET B 57 4.271 20.121 -26.211 1.00 0.00 C ATOM 2414 O MET B 57 5.301 20.466 -25.698 1.00 0.00 O ATOM 2415 CB MET B 57 4.501 18.094 -27.672 1.00 0.00 C ATOM 2416 CG MET B 57 4.376 16.568 -27.650 1.00 0.00 C ATOM 2417 SD MET B 57 5.540 15.876 -26.448 1.00 0.00 S ATOM 2418 CE MET B 57 7.026 15.921 -27.479 1.00 0.00 C ATOM 0 H MET B 57 2.019 18.239 -27.235 1.00 0.00 H new ATOM 0 HA MET B 57 4.363 18.086 -25.551 1.00 0.00 H new ATOM 0 HB2 MET B 57 3.967 18.505 -28.529 1.00 0.00 H new ATOM 0 HB3 MET B 57 5.546 18.386 -27.777 1.00 0.00 H new ATOM 0 HG2 MET B 57 3.357 16.281 -27.390 1.00 0.00 H new ATOM 0 HG3 MET B 57 4.579 16.163 -28.641 1.00 0.00 H new ATOM 0 HE1 MET B 57 7.326 14.903 -27.729 1.00 0.00 H new ATOM 0 HE2 MET B 57 6.817 16.473 -28.395 1.00 0.00 H new ATOM 0 HE3 MET B 57 7.832 16.413 -26.935 1.00 0.00 H new ATOM 2428 N GLU B 58 3.411 21.006 -26.604 1.00 0.00 N ATOM 2429 CA GLU B 58 3.736 22.438 -26.412 1.00 0.00 C ATOM 2430 C GLU B 58 3.924 22.639 -24.909 1.00 0.00 C ATOM 2431 O GLU B 58 4.817 23.332 -24.462 1.00 0.00 O ATOM 2432 CB GLU B 58 2.584 23.302 -26.935 1.00 0.00 C ATOM 2433 CG GLU B 58 2.923 24.784 -26.761 1.00 0.00 C ATOM 2434 CD GLU B 58 1.816 25.633 -27.388 1.00 0.00 C ATOM 2435 OE1 GLU B 58 0.913 25.056 -27.972 1.00 0.00 O ATOM 2436 OE2 GLU B 58 1.891 26.846 -27.278 1.00 0.00 O ATOM 0 H GLU B 58 2.512 20.807 -27.043 1.00 0.00 H new ATOM 0 HA GLU B 58 4.636 22.726 -26.956 1.00 0.00 H new ATOM 0 HB2 GLU B 58 2.402 23.083 -27.987 1.00 0.00 H new ATOM 0 HB3 GLU B 58 1.666 23.064 -26.397 1.00 0.00 H new ATOM 0 HG2 GLU B 58 3.025 25.024 -25.703 1.00 0.00 H new ATOM 0 HG3 GLU B 58 3.880 25.008 -27.233 1.00 0.00 H new ATOM 2443 N THR B 59 3.092 22.004 -24.129 1.00 0.00 N ATOM 2444 CA THR B 59 3.211 22.107 -22.646 1.00 0.00 C ATOM 2445 C THR B 59 4.352 21.217 -22.115 1.00 0.00 C ATOM 2446 O THR B 59 5.081 21.604 -21.223 1.00 0.00 O ATOM 2447 CB THR B 59 1.889 21.664 -22.016 1.00 0.00 C ATOM 2448 OG1 THR B 59 0.847 22.528 -22.447 1.00 0.00 O ATOM 2449 CG2 THR B 59 1.991 21.704 -20.490 1.00 0.00 C ATOM 0 H THR B 59 2.328 21.413 -24.458 1.00 0.00 H new ATOM 0 HA THR B 59 3.436 23.141 -22.383 1.00 0.00 H new ATOM 0 HB THR B 59 1.671 20.643 -22.328 1.00 0.00 H new ATOM 0 HG1 THR B 59 -0.001 22.244 -22.045 1.00 0.00 H new ATOM 0 HG21 THR B 59 1.044 21.387 -20.054 1.00 0.00 H new ATOM 0 HG22 THR B 59 2.785 21.034 -20.161 1.00 0.00 H new ATOM 0 HG23 THR B 59 2.217 22.720 -20.167 1.00 0.00 H new ATOM 2457 N LEU B 60 4.499 20.018 -22.631 1.00 0.00 N ATOM 2458 CA LEU B 60 5.576 19.103 -22.123 1.00 0.00 C ATOM 2459 C LEU B 60 6.885 19.328 -22.876 1.00 0.00 C ATOM 2460 O LEU B 60 7.941 18.940 -22.417 1.00 0.00 O ATOM 2461 CB LEU B 60 5.136 17.638 -22.305 1.00 0.00 C ATOM 2462 CG LEU B 60 4.209 17.220 -21.149 1.00 0.00 C ATOM 2463 CD1 LEU B 60 3.585 15.847 -21.456 1.00 0.00 C ATOM 2464 CD2 LEU B 60 5.008 17.160 -19.818 1.00 0.00 C ATOM 0 H LEU B 60 3.922 19.634 -23.379 1.00 0.00 H new ATOM 0 HA LEU B 60 5.738 19.319 -21.067 1.00 0.00 H new ATOM 0 HB2 LEU B 60 4.619 17.520 -23.257 1.00 0.00 H new ATOM 0 HB3 LEU B 60 6.010 16.988 -22.334 1.00 0.00 H new ATOM 0 HG LEU B 60 3.413 17.958 -21.044 1.00 0.00 H new ATOM 0 HD11 LEU B 60 2.929 15.554 -20.636 1.00 0.00 H new ATOM 0 HD12 LEU B 60 3.007 15.908 -22.378 1.00 0.00 H new ATOM 0 HD13 LEU B 60 4.376 15.106 -21.571 1.00 0.00 H new ATOM 0 HD21 LEU B 60 4.343 16.863 -19.007 1.00 0.00 H new ATOM 0 HD22 LEU B 60 5.814 16.432 -19.910 1.00 0.00 H new ATOM 0 HD23 LEU B 60 5.428 18.142 -19.601 1.00 0.00 H new ATOM 2476 N ASP B 61 6.844 19.948 -24.016 1.00 0.00 N ATOM 2477 CA ASP B 61 8.115 20.179 -24.758 1.00 0.00 C ATOM 2478 C ASP B 61 8.787 21.394 -24.150 1.00 0.00 C ATOM 2479 O ASP B 61 9.042 22.384 -24.806 1.00 0.00 O ATOM 2480 CB ASP B 61 7.847 20.422 -26.244 1.00 0.00 C ATOM 2481 CG ASP B 61 9.176 20.431 -26.995 1.00 0.00 C ATOM 2482 OD1 ASP B 61 10.199 20.269 -26.349 1.00 0.00 O ATOM 2483 OD2 ASP B 61 9.149 20.610 -28.201 1.00 0.00 O ATOM 0 H ASP B 61 5.999 20.302 -24.465 1.00 0.00 H new ATOM 0 HA ASP B 61 8.754 19.299 -24.679 1.00 0.00 H new ATOM 0 HB2 ASP B 61 7.196 19.643 -26.641 1.00 0.00 H new ATOM 0 HB3 ASP B 61 7.330 21.371 -26.383 1.00 0.00 H new ATOM 2488 N GLU B 62 9.068 21.316 -22.888 1.00 0.00 N ATOM 2489 CA GLU B 62 9.717 22.451 -22.195 1.00 0.00 C ATOM 2490 C GLU B 62 11.059 22.721 -22.868 1.00 0.00 C ATOM 2491 O GLU B 62 11.505 23.846 -22.966 1.00 0.00 O ATOM 2492 CB GLU B 62 9.937 22.076 -20.735 1.00 0.00 C ATOM 2493 CG GLU B 62 8.628 21.535 -20.147 1.00 0.00 C ATOM 2494 CD GLU B 62 8.819 21.244 -18.658 1.00 0.00 C ATOM 2495 OE1 GLU B 62 9.952 21.286 -18.207 1.00 0.00 O ATOM 2496 OE2 GLU B 62 7.829 20.988 -17.992 1.00 0.00 O ATOM 0 H GLU B 62 8.874 20.505 -22.300 1.00 0.00 H new ATOM 0 HA GLU B 62 9.092 23.343 -22.247 1.00 0.00 H new ATOM 0 HB2 GLU B 62 10.723 21.325 -20.655 1.00 0.00 H new ATOM 0 HB3 GLU B 62 10.270 22.947 -20.170 1.00 0.00 H new ATOM 0 HG2 GLU B 62 7.827 22.261 -20.287 1.00 0.00 H new ATOM 0 HG3 GLU B 62 8.330 20.627 -20.671 1.00 0.00 H new ATOM 2503 N ASP B 63 11.699 21.691 -23.345 1.00 0.00 N ATOM 2504 CA ASP B 63 13.005 21.877 -24.029 1.00 0.00 C ATOM 2505 C ASP B 63 12.744 22.376 -25.452 1.00 0.00 C ATOM 2506 O ASP B 63 13.650 22.765 -26.162 1.00 0.00 O ATOM 2507 CB ASP B 63 13.743 20.539 -24.084 1.00 0.00 C ATOM 2508 CG ASP B 63 13.978 20.028 -22.662 1.00 0.00 C ATOM 2509 OD1 ASP B 63 14.454 20.801 -21.847 1.00 0.00 O ATOM 2510 OD2 ASP B 63 13.679 18.872 -22.413 1.00 0.00 O ATOM 0 H ASP B 63 11.372 20.726 -23.290 1.00 0.00 H new ATOM 0 HA ASP B 63 13.613 22.601 -23.486 1.00 0.00 H new ATOM 0 HB2 ASP B 63 13.160 19.813 -24.651 1.00 0.00 H new ATOM 0 HB3 ASP B 63 14.695 20.658 -24.601 1.00 0.00 H new ATOM 2515 N GLY B 64 11.504 22.375 -25.866 1.00 0.00 N ATOM 2516 CA GLY B 64 11.170 22.858 -27.241 1.00 0.00 C ATOM 2517 C GLY B 64 11.882 21.993 -28.288 1.00 0.00 C ATOM 2518 O GLY B 64 12.258 22.471 -29.340 1.00 0.00 O ATOM 0 H GLY B 64 10.707 22.061 -25.312 1.00 0.00 H new ATOM 0 HA2 GLY B 64 10.092 22.819 -27.397 1.00 0.00 H new ATOM 0 HA3 GLY B 64 11.471 23.900 -27.352 1.00 0.00 H new ATOM 2522 N ASP B 65 12.083 20.727 -28.004 1.00 0.00 N ATOM 2523 CA ASP B 65 12.788 19.825 -28.975 1.00 0.00 C ATOM 2524 C ASP B 65 11.793 18.856 -29.624 1.00 0.00 C ATOM 2525 O ASP B 65 12.170 17.992 -30.390 1.00 0.00 O ATOM 2526 CB ASP B 65 13.865 19.039 -28.223 1.00 0.00 C ATOM 2527 CG ASP B 65 13.302 18.540 -26.891 1.00 0.00 C ATOM 2528 OD1 ASP B 65 12.117 18.721 -26.665 1.00 0.00 O ATOM 2529 OD2 ASP B 65 14.067 17.984 -26.121 1.00 0.00 O ATOM 0 H ASP B 65 11.788 20.277 -27.138 1.00 0.00 H new ATOM 0 HA ASP B 65 13.245 20.425 -29.762 1.00 0.00 H new ATOM 0 HB2 ASP B 65 14.201 18.195 -28.826 1.00 0.00 H new ATOM 0 HB3 ASP B 65 14.735 19.672 -28.047 1.00 0.00 H new ATOM 2534 N GLY B 66 10.531 18.985 -29.324 1.00 0.00 N ATOM 2535 CA GLY B 66 9.524 18.062 -29.925 1.00 0.00 C ATOM 2536 C GLY B 66 9.535 16.738 -29.158 1.00 0.00 C ATOM 2537 O GLY B 66 8.854 15.794 -29.507 1.00 0.00 O ATOM 0 H GLY B 66 10.152 19.688 -28.690 1.00 0.00 H new ATOM 0 HA2 GLY B 66 8.532 18.511 -29.885 1.00 0.00 H new ATOM 0 HA3 GLY B 66 9.753 17.889 -30.976 1.00 0.00 H new ATOM 2541 N GLU B 67 10.307 16.674 -28.108 1.00 0.00 N ATOM 2542 CA GLU B 67 10.391 15.434 -27.283 1.00 0.00 C ATOM 2543 C GLU B 67 10.449 15.831 -25.805 1.00 0.00 C ATOM 2544 O GLU B 67 11.098 16.793 -25.443 1.00 0.00 O ATOM 2545 CB GLU B 67 11.658 14.666 -27.664 1.00 0.00 C ATOM 2546 CG GLU B 67 12.866 15.597 -27.599 1.00 0.00 C ATOM 2547 CD GLU B 67 14.122 14.825 -28.004 1.00 0.00 C ATOM 2548 OE1 GLU B 67 14.573 14.010 -27.216 1.00 0.00 O ATOM 2549 OE2 GLU B 67 14.611 15.061 -29.096 1.00 0.00 O ATOM 0 H GLU B 67 10.893 17.442 -27.781 1.00 0.00 H new ATOM 0 HA GLU B 67 9.521 14.802 -27.458 1.00 0.00 H new ATOM 0 HB2 GLU B 67 11.800 13.823 -26.988 1.00 0.00 H new ATOM 0 HB3 GLU B 67 11.557 14.256 -28.669 1.00 0.00 H new ATOM 0 HG2 GLU B 67 12.719 16.449 -28.263 1.00 0.00 H new ATOM 0 HG3 GLU B 67 12.979 15.995 -26.590 1.00 0.00 H new ATOM 2556 N CYS B 68 9.779 15.098 -24.948 1.00 0.00 N ATOM 2557 CA CYS B 68 9.792 15.425 -23.479 1.00 0.00 C ATOM 2558 C CYS B 68 10.591 14.355 -22.738 1.00 0.00 C ATOM 2559 O CYS B 68 10.499 13.179 -23.020 1.00 0.00 O ATOM 2560 CB CYS B 68 8.357 15.497 -22.940 1.00 0.00 C ATOM 2561 SG CYS B 68 7.706 13.825 -22.695 1.00 0.00 S ATOM 0 H CYS B 68 9.220 14.283 -25.200 1.00 0.00 H new ATOM 0 HA CYS B 68 10.261 16.396 -23.323 1.00 0.00 H new ATOM 0 HB2 CYS B 68 8.340 16.045 -21.998 1.00 0.00 H new ATOM 0 HB3 CYS B 68 7.724 16.044 -23.638 1.00 0.00 H new ATOM 0 HG CYS B 68 8.691 13.000 -22.498 1.00 0.00 H new ATOM 2567 N ASP B 69 11.388 14.775 -21.805 1.00 0.00 N ATOM 2568 CA ASP B 69 12.237 13.829 -21.031 1.00 0.00 C ATOM 2569 C ASP B 69 11.416 13.182 -19.922 1.00 0.00 C ATOM 2570 O ASP B 69 10.307 13.588 -19.636 1.00 0.00 O ATOM 2571 CB ASP B 69 13.404 14.603 -20.409 1.00 0.00 C ATOM 2572 CG ASP B 69 14.494 13.628 -19.958 1.00 0.00 C ATOM 2573 OD1 ASP B 69 14.241 12.435 -19.971 1.00 0.00 O ATOM 2574 OD2 ASP B 69 15.568 14.092 -19.613 1.00 0.00 O ATOM 0 H ASP B 69 11.491 15.754 -21.538 1.00 0.00 H new ATOM 0 HA ASP B 69 12.614 13.052 -21.696 1.00 0.00 H new ATOM 0 HB2 ASP B 69 13.812 15.308 -21.134 1.00 0.00 H new ATOM 0 HB3 ASP B 69 13.052 15.187 -19.559 1.00 0.00 H new ATOM 2579 N PHE B 70 11.961 12.190 -19.277 1.00 0.00 N ATOM 2580 CA PHE B 70 11.231 11.535 -18.178 1.00 0.00 C ATOM 2581 C PHE B 70 10.822 12.619 -17.184 1.00 0.00 C ATOM 2582 O PHE B 70 9.736 12.613 -16.670 1.00 0.00 O ATOM 2583 CB PHE B 70 12.170 10.513 -17.520 1.00 0.00 C ATOM 2584 CG PHE B 70 11.654 10.097 -16.159 1.00 0.00 C ATOM 2585 CD1 PHE B 70 10.330 9.675 -16.006 1.00 0.00 C ATOM 2586 CD2 PHE B 70 12.510 10.125 -15.051 1.00 0.00 C ATOM 2587 CE1 PHE B 70 9.862 9.284 -14.749 1.00 0.00 C ATOM 2588 CE2 PHE B 70 12.043 9.733 -13.798 1.00 0.00 C ATOM 2589 CZ PHE B 70 10.718 9.312 -13.643 1.00 0.00 C ATOM 0 H PHE B 70 12.887 11.808 -19.471 1.00 0.00 H new ATOM 0 HA PHE B 70 10.340 11.016 -18.532 1.00 0.00 H new ATOM 0 HB2 PHE B 70 12.264 9.636 -18.160 1.00 0.00 H new ATOM 0 HB3 PHE B 70 13.167 10.942 -17.419 1.00 0.00 H new ATOM 0 HD1 PHE B 70 9.669 9.651 -16.860 1.00 0.00 H new ATOM 0 HD2 PHE B 70 13.533 10.451 -15.168 1.00 0.00 H new ATOM 0 HE1 PHE B 70 8.839 8.960 -14.631 1.00 0.00 H new ATOM 0 HE2 PHE B 70 12.705 9.754 -12.945 1.00 0.00 H new ATOM 0 HZ PHE B 70 10.357 9.009 -12.671 1.00 0.00 H new ATOM 2599 N GLN B 71 11.683 13.562 -16.935 1.00 0.00 N ATOM 2600 CA GLN B 71 11.341 14.665 -15.992 1.00 0.00 C ATOM 2601 C GLN B 71 10.115 15.448 -16.483 1.00 0.00 C ATOM 2602 O GLN B 71 9.184 15.687 -15.741 1.00 0.00 O ATOM 2603 CB GLN B 71 12.556 15.605 -15.894 1.00 0.00 C ATOM 2604 CG GLN B 71 12.135 16.986 -15.371 1.00 0.00 C ATOM 2605 CD GLN B 71 13.375 17.769 -14.931 1.00 0.00 C ATOM 2606 OE1 GLN B 71 14.439 17.205 -14.773 1.00 0.00 O ATOM 2607 NE2 GLN B 71 13.282 19.055 -14.725 1.00 0.00 N ATOM 0 H GLN B 71 12.615 13.619 -17.345 1.00 0.00 H new ATOM 0 HA GLN B 71 11.099 14.246 -15.015 1.00 0.00 H new ATOM 0 HB2 GLN B 71 13.304 15.172 -15.230 1.00 0.00 H new ATOM 0 HB3 GLN B 71 13.022 15.709 -16.874 1.00 0.00 H new ATOM 0 HG2 GLN B 71 11.604 17.534 -16.149 1.00 0.00 H new ATOM 0 HG3 GLN B 71 11.447 16.874 -14.533 1.00 0.00 H new ATOM 0 HE21 GLN B 71 12.389 19.529 -14.857 1.00 0.00 H new ATOM 0 HE22 GLN B 71 14.103 19.585 -14.432 1.00 0.00 H new ATOM 2616 N GLU B 72 10.121 15.877 -17.711 1.00 0.00 N ATOM 2617 CA GLU B 72 8.976 16.673 -18.225 1.00 0.00 C ATOM 2618 C GLU B 72 7.681 15.856 -18.180 1.00 0.00 C ATOM 2619 O GLU B 72 6.624 16.357 -17.832 1.00 0.00 O ATOM 2620 CB GLU B 72 9.292 17.075 -19.660 1.00 0.00 C ATOM 2621 CG GLU B 72 10.410 18.120 -19.673 1.00 0.00 C ATOM 2622 CD GLU B 72 10.824 18.402 -21.119 1.00 0.00 C ATOM 2623 OE1 GLU B 72 10.214 19.263 -21.731 1.00 0.00 O ATOM 2624 OE2 GLU B 72 11.742 17.751 -21.590 1.00 0.00 O ATOM 0 H GLU B 72 10.871 15.711 -18.382 1.00 0.00 H new ATOM 0 HA GLU B 72 8.831 17.556 -17.603 1.00 0.00 H new ATOM 0 HB2 GLU B 72 9.594 16.199 -20.234 1.00 0.00 H new ATOM 0 HB3 GLU B 72 8.400 17.478 -20.139 1.00 0.00 H new ATOM 0 HG2 GLU B 72 10.070 19.038 -19.195 1.00 0.00 H new ATOM 0 HG3 GLU B 72 11.266 17.761 -19.101 1.00 0.00 H new ATOM 2631 N PHE B 73 7.759 14.604 -18.513 1.00 0.00 N ATOM 2632 CA PHE B 73 6.549 13.740 -18.486 1.00 0.00 C ATOM 2633 C PHE B 73 6.031 13.625 -17.055 1.00 0.00 C ATOM 2634 O PHE B 73 4.845 13.562 -16.817 1.00 0.00 O ATOM 2635 CB PHE B 73 6.898 12.347 -19.024 1.00 0.00 C ATOM 2636 CG PHE B 73 5.745 11.404 -18.766 1.00 0.00 C ATOM 2637 CD1 PHE B 73 4.710 11.276 -19.700 1.00 0.00 C ATOM 2638 CD2 PHE B 73 5.707 10.672 -17.574 1.00 0.00 C ATOM 2639 CE1 PHE B 73 3.639 10.410 -19.440 1.00 0.00 C ATOM 2640 CE2 PHE B 73 4.637 9.810 -17.313 1.00 0.00 C ATOM 2641 CZ PHE B 73 3.603 9.678 -18.246 1.00 0.00 C ATOM 0 H PHE B 73 8.616 14.135 -18.806 1.00 0.00 H new ATOM 0 HA PHE B 73 5.775 14.184 -19.113 1.00 0.00 H new ATOM 0 HB2 PHE B 73 7.106 12.400 -20.093 1.00 0.00 H new ATOM 0 HB3 PHE B 73 7.801 11.975 -18.541 1.00 0.00 H new ATOM 0 HD1 PHE B 73 4.737 11.843 -20.619 1.00 0.00 H new ATOM 0 HD2 PHE B 73 6.506 10.773 -16.854 1.00 0.00 H new ATOM 0 HE1 PHE B 73 2.841 10.307 -20.160 1.00 0.00 H new ATOM 0 HE2 PHE B 73 4.609 9.247 -16.392 1.00 0.00 H new ATOM 0 HZ PHE B 73 2.777 9.012 -18.046 1.00 0.00 H new ATOM 2651 N MET B 74 6.923 13.572 -16.113 1.00 0.00 N ATOM 2652 CA MET B 74 6.522 13.424 -14.691 1.00 0.00 C ATOM 2653 C MET B 74 5.640 14.591 -14.245 1.00 0.00 C ATOM 2654 O MET B 74 4.711 14.424 -13.473 1.00 0.00 O ATOM 2655 CB MET B 74 7.777 13.340 -13.810 1.00 0.00 C ATOM 2656 CG MET B 74 8.399 11.933 -13.910 1.00 0.00 C ATOM 2657 SD MET B 74 7.260 10.682 -13.254 1.00 0.00 S ATOM 2658 CE MET B 74 7.170 11.307 -11.565 1.00 0.00 C ATOM 0 H MET B 74 7.929 13.626 -16.270 1.00 0.00 H new ATOM 0 HA MET B 74 5.942 12.507 -14.586 1.00 0.00 H new ATOM 0 HB2 MET B 74 8.503 14.090 -14.124 1.00 0.00 H new ATOM 0 HB3 MET B 74 7.519 13.560 -12.774 1.00 0.00 H new ATOM 0 HG2 MET B 74 8.636 11.707 -14.950 1.00 0.00 H new ATOM 0 HG3 MET B 74 9.337 11.904 -13.356 1.00 0.00 H new ATOM 0 HE1 MET B 74 6.924 10.490 -10.887 1.00 0.00 H new ATOM 0 HE2 MET B 74 8.132 11.734 -11.283 1.00 0.00 H new ATOM 0 HE3 MET B 74 6.399 12.075 -11.502 1.00 0.00 H new ATOM 2668 N ALA B 75 5.930 15.775 -14.684 1.00 0.00 N ATOM 2669 CA ALA B 75 5.105 16.928 -14.233 1.00 0.00 C ATOM 2670 C ALA B 75 3.680 16.840 -14.789 1.00 0.00 C ATOM 2671 O ALA B 75 2.731 17.254 -14.152 1.00 0.00 O ATOM 2672 CB ALA B 75 5.757 18.237 -14.680 1.00 0.00 C ATOM 0 H ALA B 75 6.690 15.998 -15.326 1.00 0.00 H new ATOM 0 HA ALA B 75 5.047 16.901 -13.145 1.00 0.00 H new ATOM 0 HB1 ALA B 75 5.149 19.078 -14.347 1.00 0.00 H new ATOM 0 HB2 ALA B 75 6.753 18.315 -14.245 1.00 0.00 H new ATOM 0 HB3 ALA B 75 5.834 18.252 -15.767 1.00 0.00 H new ATOM 2678 N PHE B 76 3.520 16.315 -15.963 1.00 0.00 N ATOM 2679 CA PHE B 76 2.150 16.213 -16.560 1.00 0.00 C ATOM 2680 C PHE B 76 1.289 15.240 -15.756 1.00 0.00 C ATOM 2681 O PHE B 76 0.086 15.369 -15.687 1.00 0.00 O ATOM 2682 CB PHE B 76 2.288 15.755 -18.014 1.00 0.00 C ATOM 2683 CG PHE B 76 0.952 15.376 -18.597 1.00 0.00 C ATOM 2684 CD1 PHE B 76 0.148 16.352 -19.195 1.00 0.00 C ATOM 2685 CD2 PHE B 76 0.526 14.044 -18.559 1.00 0.00 C ATOM 2686 CE1 PHE B 76 -1.085 15.997 -19.753 1.00 0.00 C ATOM 2687 CE2 PHE B 76 -0.704 13.687 -19.120 1.00 0.00 C ATOM 2688 CZ PHE B 76 -1.510 14.663 -19.717 1.00 0.00 C ATOM 0 H PHE B 76 4.274 15.949 -16.544 1.00 0.00 H new ATOM 0 HA PHE B 76 1.656 17.184 -16.532 1.00 0.00 H new ATOM 0 HB2 PHE B 76 2.733 16.553 -18.608 1.00 0.00 H new ATOM 0 HB3 PHE B 76 2.965 14.902 -18.066 1.00 0.00 H new ATOM 0 HD1 PHE B 76 0.479 17.380 -19.226 1.00 0.00 H new ATOM 0 HD2 PHE B 76 1.147 13.291 -18.096 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -1.708 16.751 -20.211 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -1.032 12.658 -19.093 1.00 0.00 H new ATOM 0 HZ PHE B 76 -2.460 14.387 -20.150 1.00 0.00 H new ATOM 2698 N VAL B 77 1.898 14.275 -15.153 1.00 0.00 N ATOM 2699 CA VAL B 77 1.134 13.279 -14.344 1.00 0.00 C ATOM 2700 C VAL B 77 0.524 13.972 -13.127 1.00 0.00 C ATOM 2701 O VAL B 77 -0.577 13.674 -12.718 1.00 0.00 O ATOM 2702 CB VAL B 77 2.081 12.161 -13.874 1.00 0.00 C ATOM 2703 CG1 VAL B 77 1.310 10.849 -13.687 1.00 0.00 C ATOM 2704 CG2 VAL B 77 3.172 11.973 -14.918 1.00 0.00 C ATOM 0 H VAL B 77 2.906 14.123 -15.180 1.00 0.00 H new ATOM 0 HA VAL B 77 0.340 12.849 -14.955 1.00 0.00 H new ATOM 0 HB VAL B 77 2.523 12.439 -12.917 1.00 0.00 H new ATOM 0 HG11 VAL B 77 1.995 10.069 -13.354 1.00 0.00 H new ATOM 0 HG12 VAL B 77 0.529 10.989 -12.940 1.00 0.00 H new ATOM 0 HG13 VAL B 77 0.857 10.555 -14.634 1.00 0.00 H new ATOM 0 HG21 VAL B 77 3.851 11.183 -14.597 1.00 0.00 H new ATOM 0 HG22 VAL B 77 2.720 11.698 -15.871 1.00 0.00 H new ATOM 0 HG23 VAL B 77 3.728 12.903 -15.035 1.00 0.00 H new ATOM 2714 N SER B 78 1.248 14.876 -12.529 1.00 0.00 N ATOM 2715 CA SER B 78 0.714 15.566 -11.319 1.00 0.00 C ATOM 2716 C SER B 78 -0.532 16.373 -11.675 1.00 0.00 C ATOM 2717 O SER B 78 -1.478 16.436 -10.915 1.00 0.00 O ATOM 2718 CB SER B 78 1.780 16.512 -10.747 1.00 0.00 C ATOM 2719 OG SER B 78 2.695 15.766 -9.960 1.00 0.00 O ATOM 0 H SER B 78 2.181 15.167 -12.822 1.00 0.00 H new ATOM 0 HA SER B 78 0.453 14.812 -10.576 1.00 0.00 H new ATOM 0 HB2 SER B 78 2.307 17.017 -11.557 1.00 0.00 H new ATOM 0 HB3 SER B 78 1.309 17.286 -10.141 1.00 0.00 H new ATOM 0 HG SER B 78 2.550 15.966 -9.012 1.00 0.00 H new ATOM 2725 N MET B 79 -0.531 17.021 -12.802 1.00 0.00 N ATOM 2726 CA MET B 79 -1.708 17.852 -13.166 1.00 0.00 C ATOM 2727 C MET B 79 -2.925 16.981 -13.513 1.00 0.00 C ATOM 2728 O MET B 79 -4.040 17.296 -13.148 1.00 0.00 O ATOM 2729 CB MET B 79 -1.351 18.741 -14.360 1.00 0.00 C ATOM 2730 CG MET B 79 0.096 19.224 -14.255 1.00 0.00 C ATOM 2731 SD MET B 79 0.307 20.703 -15.284 1.00 0.00 S ATOM 2732 CE MET B 79 -0.496 20.089 -16.793 1.00 0.00 C ATOM 0 H MET B 79 0.228 17.012 -13.483 1.00 0.00 H new ATOM 0 HA MET B 79 -1.971 18.468 -12.306 1.00 0.00 H new ATOM 0 HB2 MET B 79 -1.489 18.186 -15.288 1.00 0.00 H new ATOM 0 HB3 MET B 79 -2.024 19.597 -14.398 1.00 0.00 H new ATOM 0 HG2 MET B 79 0.342 19.450 -13.217 1.00 0.00 H new ATOM 0 HG3 MET B 79 0.779 18.439 -14.581 1.00 0.00 H new ATOM 0 HE1 MET B 79 -0.257 20.749 -17.627 1.00 0.00 H new ATOM 0 HE2 MET B 79 -0.138 19.083 -17.012 1.00 0.00 H new ATOM 0 HE3 MET B 79 -1.576 20.066 -16.647 1.00 0.00 H new ATOM 2742 N VAL B 80 -2.734 15.902 -14.222 1.00 0.00 N ATOM 2743 CA VAL B 80 -3.911 15.046 -14.586 1.00 0.00 C ATOM 2744 C VAL B 80 -4.513 14.432 -13.327 1.00 0.00 C ATOM 2745 O VAL B 80 -5.715 14.304 -13.197 1.00 0.00 O ATOM 2746 CB VAL B 80 -3.495 13.936 -15.552 1.00 0.00 C ATOM 2747 CG1 VAL B 80 -4.716 13.077 -15.898 1.00 0.00 C ATOM 2748 CG2 VAL B 80 -2.955 14.557 -16.838 1.00 0.00 C ATOM 0 H VAL B 80 -1.830 15.575 -14.563 1.00 0.00 H new ATOM 0 HA VAL B 80 -4.655 15.673 -15.077 1.00 0.00 H new ATOM 0 HB VAL B 80 -2.727 13.321 -15.083 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -4.421 12.285 -16.587 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -5.119 12.634 -14.987 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.478 13.700 -16.367 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -2.658 13.766 -17.527 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -3.730 15.169 -17.300 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -2.091 15.180 -16.606 1.00 0.00 H new ATOM 2758 N THR B 81 -3.690 14.053 -12.402 1.00 0.00 N ATOM 2759 CA THR B 81 -4.206 13.446 -11.147 1.00 0.00 C ATOM 2760 C THR B 81 -5.112 14.454 -10.464 1.00 0.00 C ATOM 2761 O THR B 81 -6.130 14.118 -9.892 1.00 0.00 O ATOM 2762 CB THR B 81 -3.038 13.112 -10.226 1.00 0.00 C ATOM 2763 OG1 THR B 81 -2.199 12.157 -10.850 1.00 0.00 O ATOM 2764 CG2 THR B 81 -3.558 12.567 -8.889 1.00 0.00 C ATOM 0 H THR B 81 -2.675 14.136 -12.458 1.00 0.00 H new ATOM 0 HA THR B 81 -4.758 12.533 -11.371 1.00 0.00 H new ATOM 0 HB THR B 81 -2.465 14.019 -10.032 1.00 0.00 H new ATOM 0 HG1 THR B 81 -1.631 12.604 -11.512 1.00 0.00 H new ATOM 0 HG21 THR B 81 -2.715 12.332 -8.239 1.00 0.00 H new ATOM 0 HG22 THR B 81 -4.187 13.317 -8.410 1.00 0.00 H new ATOM 0 HG23 THR B 81 -4.142 11.664 -9.067 1.00 0.00 H new ATOM 2772 N THR B 82 -4.733 15.690 -10.516 1.00 0.00 N ATOM 2773 CA THR B 82 -5.540 16.747 -9.873 1.00 0.00 C ATOM 2774 C THR B 82 -6.948 16.728 -10.473 1.00 0.00 C ATOM 2775 O THR B 82 -7.932 16.865 -9.773 1.00 0.00 O ATOM 2776 CB THR B 82 -4.873 18.097 -10.135 1.00 0.00 C ATOM 2777 OG1 THR B 82 -3.488 17.994 -9.841 1.00 0.00 O ATOM 2778 CG2 THR B 82 -5.499 19.145 -9.228 1.00 0.00 C ATOM 0 H THR B 82 -3.887 16.017 -10.983 1.00 0.00 H new ATOM 0 HA THR B 82 -5.608 16.580 -8.798 1.00 0.00 H new ATOM 0 HB THR B 82 -5.010 18.382 -11.178 1.00 0.00 H new ATOM 0 HG1 THR B 82 -3.053 18.856 -10.008 1.00 0.00 H new ATOM 0 HG21 THR B 82 -5.028 20.111 -9.409 1.00 0.00 H new ATOM 0 HG22 THR B 82 -6.566 19.217 -9.437 1.00 0.00 H new ATOM 0 HG23 THR B 82 -5.352 18.859 -8.186 1.00 0.00 H new ATOM 2786 N ALA B 83 -7.057 16.530 -11.759 1.00 0.00 N ATOM 2787 CA ALA B 83 -8.407 16.469 -12.389 1.00 0.00 C ATOM 2788 C ALA B 83 -9.186 15.314 -11.749 1.00 0.00 C ATOM 2789 O ALA B 83 -10.371 15.403 -11.498 1.00 0.00 O ATOM 2790 CB ALA B 83 -8.266 16.236 -13.902 1.00 0.00 C ATOM 0 H ALA B 83 -6.272 16.408 -12.399 1.00 0.00 H new ATOM 0 HA ALA B 83 -8.938 17.408 -12.232 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -9.255 16.192 -14.357 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -7.699 17.055 -14.345 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -7.744 15.296 -14.078 1.00 0.00 H new ATOM 2796 N CYS B 84 -8.509 14.226 -11.495 1.00 0.00 N ATOM 2797 CA CYS B 84 -9.167 13.036 -10.883 1.00 0.00 C ATOM 2798 C CYS B 84 -9.758 13.402 -9.517 1.00 0.00 C ATOM 2799 O CYS B 84 -10.818 12.938 -9.151 1.00 0.00 O ATOM 2800 CB CYS B 84 -8.125 11.929 -10.706 1.00 0.00 C ATOM 2801 SG CYS B 84 -8.962 10.342 -10.464 1.00 0.00 S ATOM 0 H CYS B 84 -7.514 14.110 -11.689 1.00 0.00 H new ATOM 0 HA CYS B 84 -9.971 12.694 -11.534 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -7.478 11.881 -11.582 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -7.487 12.150 -9.850 1.00 0.00 H new ATOM 0 HG CYS B 84 -10.141 10.546 -9.956 1.00 0.00 H new ATOM 2807 N HIS B 85 -9.089 14.229 -8.758 1.00 0.00 N ATOM 2808 CA HIS B 85 -9.628 14.607 -7.420 1.00 0.00 C ATOM 2809 C HIS B 85 -10.988 15.271 -7.608 1.00 0.00 C ATOM 2810 O HIS B 85 -11.917 15.040 -6.859 1.00 0.00 O ATOM 2811 CB HIS B 85 -8.669 15.600 -6.762 1.00 0.00 C ATOM 2812 CG HIS B 85 -9.188 16.000 -5.408 1.00 0.00 C ATOM 2813 ND1 HIS B 85 -10.437 16.580 -5.237 1.00 0.00 N ATOM 2814 CD2 HIS B 85 -8.627 15.940 -4.156 1.00 0.00 C ATOM 2815 CE1 HIS B 85 -10.584 16.847 -3.925 1.00 0.00 C ATOM 2816 NE2 HIS B 85 -9.511 16.476 -3.226 1.00 0.00 N ATOM 0 H HIS B 85 -8.197 14.657 -9.006 1.00 0.00 H new ATOM 0 HA HIS B 85 -9.731 13.722 -6.792 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -7.680 15.152 -6.663 1.00 0.00 H new ATOM 0 HB3 HIS B 85 -8.557 16.482 -7.392 1.00 0.00 H new ATOM 0 HD2 HIS B 85 -7.650 15.539 -3.929 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -11.462 17.305 -3.493 1.00 0.00 H new ATOM 0 HE2 HIS B 85 -9.368 16.566 -2.220 1.00 0.00 H new ATOM 2825 N GLU B 86 -11.113 16.085 -8.611 1.00 0.00 N ATOM 2826 CA GLU B 86 -12.411 16.759 -8.871 1.00 0.00 C ATOM 2827 C GLU B 86 -13.455 15.709 -9.271 1.00 0.00 C ATOM 2828 O GLU B 86 -14.628 15.846 -8.989 1.00 0.00 O ATOM 2829 CB GLU B 86 -12.231 17.768 -10.011 1.00 0.00 C ATOM 2830 CG GLU B 86 -13.535 18.539 -10.244 1.00 0.00 C ATOM 2831 CD GLU B 86 -13.861 19.380 -9.009 1.00 0.00 C ATOM 2832 OE1 GLU B 86 -12.959 19.614 -8.221 1.00 0.00 O ATOM 2833 OE2 GLU B 86 -15.007 19.776 -8.872 1.00 0.00 O ATOM 0 H GLU B 86 -10.367 16.315 -9.268 1.00 0.00 H new ATOM 0 HA GLU B 86 -12.747 17.278 -7.974 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -11.427 18.463 -9.768 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -11.939 17.249 -10.924 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -13.438 19.182 -11.119 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -14.349 17.844 -10.448 1.00 0.00 H new ATOM 2840 N PHE B 87 -13.036 14.680 -9.961 1.00 0.00 N ATOM 2841 CA PHE B 87 -14.000 13.630 -10.424 1.00 0.00 C ATOM 2842 C PHE B 87 -14.101 12.478 -9.411 1.00 0.00 C ATOM 2843 O PHE B 87 -15.081 11.761 -9.382 1.00 0.00 O ATOM 2844 CB PHE B 87 -13.514 13.081 -11.769 1.00 0.00 C ATOM 2845 CG PHE B 87 -14.613 12.281 -12.432 1.00 0.00 C ATOM 2846 CD1 PHE B 87 -14.811 10.937 -12.090 1.00 0.00 C ATOM 2847 CD2 PHE B 87 -15.427 12.882 -13.399 1.00 0.00 C ATOM 2848 CE1 PHE B 87 -15.821 10.197 -12.714 1.00 0.00 C ATOM 2849 CE2 PHE B 87 -16.438 12.141 -14.022 1.00 0.00 C ATOM 2850 CZ PHE B 87 -16.635 10.799 -13.680 1.00 0.00 C ATOM 0 H PHE B 87 -12.064 14.519 -10.226 1.00 0.00 H new ATOM 0 HA PHE B 87 -14.988 14.080 -10.523 1.00 0.00 H new ATOM 0 HB2 PHE B 87 -13.210 13.903 -12.417 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -12.636 12.452 -11.618 1.00 0.00 H new ATOM 0 HD1 PHE B 87 -14.184 10.472 -11.344 1.00 0.00 H new ATOM 0 HD2 PHE B 87 -15.275 13.918 -13.665 1.00 0.00 H new ATOM 0 HE1 PHE B 87 -15.973 9.161 -12.450 1.00 0.00 H new ATOM 0 HE2 PHE B 87 -17.066 12.606 -14.767 1.00 0.00 H new ATOM 0 HZ PHE B 87 -17.415 10.228 -14.161 1.00 0.00 H new ATOM 2860 N PHE B 88 -13.098 12.276 -8.592 1.00 0.00 N ATOM 2861 CA PHE B 88 -13.149 11.146 -7.602 1.00 0.00 C ATOM 2862 C PHE B 88 -13.698 11.668 -6.280 1.00 0.00 C ATOM 2863 O PHE B 88 -13.471 11.104 -5.229 1.00 0.00 O ATOM 2864 CB PHE B 88 -11.736 10.563 -7.390 1.00 0.00 C ATOM 2865 CG PHE B 88 -11.440 9.532 -8.462 1.00 0.00 C ATOM 2866 CD1 PHE B 88 -11.809 9.779 -9.788 1.00 0.00 C ATOM 2867 CD2 PHE B 88 -10.811 8.327 -8.125 1.00 0.00 C ATOM 2868 CE1 PHE B 88 -11.552 8.825 -10.778 1.00 0.00 C ATOM 2869 CE2 PHE B 88 -10.551 7.372 -9.117 1.00 0.00 C ATOM 2870 CZ PHE B 88 -10.923 7.621 -10.443 1.00 0.00 C ATOM 0 H PHE B 88 -12.248 12.840 -8.563 1.00 0.00 H new ATOM 0 HA PHE B 88 -13.798 10.357 -7.983 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -10.994 11.361 -7.425 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -11.666 10.106 -6.403 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -12.294 10.708 -10.048 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -10.526 8.134 -7.101 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -11.839 9.018 -11.801 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -10.063 6.444 -8.858 1.00 0.00 H new ATOM 0 HZ PHE B 88 -10.725 6.884 -11.207 1.00 0.00 H new ATOM 3114 N ARG X 104 21.041 19.876 3.522 1.00 0.00 N ATOM 3115 CA ARG X 104 20.121 18.837 2.976 1.00 0.00 C ATOM 3116 C ARG X 104 19.108 19.466 2.010 1.00 0.00 C ATOM 3117 O ARG X 104 18.786 18.892 0.988 1.00 0.00 O ATOM 3118 CB ARG X 104 19.353 18.172 4.130 1.00 0.00 C ATOM 3119 CG ARG X 104 18.789 19.250 5.102 1.00 0.00 C ATOM 3120 CD ARG X 104 17.276 19.083 5.283 1.00 0.00 C ATOM 3121 NE ARG X 104 16.609 19.083 3.951 1.00 0.00 N ATOM 3122 CZ ARG X 104 15.368 18.694 3.845 1.00 0.00 C ATOM 3123 NH1 ARG X 104 14.714 18.310 4.907 1.00 0.00 N ATOM 3124 NH2 ARG X 104 14.779 18.695 2.680 1.00 0.00 N ATOM 0 HA ARG X 104 20.717 18.097 2.441 1.00 0.00 H new ATOM 0 HB2 ARG X 104 18.536 17.570 3.732 1.00 0.00 H new ATOM 0 HB3 ARG X 104 20.013 17.495 4.672 1.00 0.00 H new ATOM 0 HG2 ARG X 104 19.286 19.170 6.069 1.00 0.00 H new ATOM 0 HG3 ARG X 104 19.005 20.245 4.713 1.00 0.00 H new ATOM 0 HD2 ARG X 104 17.063 18.151 5.807 1.00 0.00 H new ATOM 0 HD3 ARG X 104 16.882 19.892 5.898 1.00 0.00 H new ATOM 0 HE ARG X 104 17.122 19.387 3.123 1.00 0.00 H new ATOM 0 HH11 ARG X 104 15.173 18.314 5.818 1.00 0.00 H new ATOM 0 HH12 ARG X 104 13.744 18.006 4.826 1.00 0.00 H new ATOM 0 HH21 ARG X 104 15.289 19.000 1.851 1.00 0.00 H new ATOM 0 HH22 ARG X 104 13.809 18.391 2.599 1.00 0.00 H new ATOM 3138 N HIS X 105 18.590 20.628 2.313 1.00 0.00 N ATOM 3139 CA HIS X 105 17.594 21.245 1.389 1.00 0.00 C ATOM 3140 C HIS X 105 18.246 21.480 0.025 1.00 0.00 C ATOM 3141 O HIS X 105 17.644 21.271 -1.007 1.00 0.00 O ATOM 3142 CB HIS X 105 17.080 22.577 1.969 1.00 0.00 C ATOM 3143 CG HIS X 105 18.111 23.670 1.805 1.00 0.00 C ATOM 3144 ND1 HIS X 105 18.767 24.242 2.886 1.00 0.00 N ATOM 3145 CD2 HIS X 105 18.602 24.308 0.690 1.00 0.00 C ATOM 3146 CE1 HIS X 105 19.607 25.177 2.403 1.00 0.00 C ATOM 3147 NE2 HIS X 105 19.544 25.254 1.074 1.00 0.00 N ATOM 0 H HIS X 105 18.810 21.170 3.149 1.00 0.00 H new ATOM 0 HA HIS X 105 16.746 20.570 1.273 1.00 0.00 H new ATOM 0 HB2 HIS X 105 16.156 22.865 1.467 1.00 0.00 H new ATOM 0 HB3 HIS X 105 16.843 22.451 3.025 1.00 0.00 H new ATOM 0 HD1 HIS X 105 18.637 23.998 3.868 1.00 0.00 H new ATOM 0 HD2 HIS X 105 18.302 24.105 -0.327 1.00 0.00 H new ATOM 0 HE1 HIS X 105 20.252 25.789 3.017 1.00 0.00 H new ATOM 3156 N LYS X 106 19.476 21.910 0.023 1.00 0.00 N ATOM 3157 CA LYS X 106 20.187 22.165 -1.259 1.00 0.00 C ATOM 3158 C LYS X 106 20.276 20.868 -2.061 1.00 0.00 C ATOM 3159 O LYS X 106 20.184 20.861 -3.275 1.00 0.00 O ATOM 3160 CB LYS X 106 21.596 22.680 -0.967 1.00 0.00 C ATOM 3161 CG LYS X 106 22.293 23.037 -2.285 1.00 0.00 C ATOM 3162 CD LYS X 106 23.708 23.560 -2.006 1.00 0.00 C ATOM 3163 CE LYS X 106 24.658 22.390 -1.722 1.00 0.00 C ATOM 3164 NZ LYS X 106 26.066 22.881 -1.739 1.00 0.00 N ATOM 0 H LYS X 106 20.024 22.097 0.863 1.00 0.00 H new ATOM 0 HA LYS X 106 19.639 22.911 -1.835 1.00 0.00 H new ATOM 0 HB2 LYS X 106 21.548 23.556 -0.320 1.00 0.00 H new ATOM 0 HB3 LYS X 106 22.169 21.921 -0.434 1.00 0.00 H new ATOM 0 HG2 LYS X 106 22.341 22.159 -2.930 1.00 0.00 H new ATOM 0 HG3 LYS X 106 21.716 23.792 -2.818 1.00 0.00 H new ATOM 0 HD2 LYS X 106 24.068 24.131 -2.862 1.00 0.00 H new ATOM 0 HD3 LYS X 106 23.691 24.240 -1.154 1.00 0.00 H new ATOM 0 HE2 LYS X 106 24.427 21.947 -0.753 1.00 0.00 H new ATOM 0 HE3 LYS X 106 24.524 21.609 -2.470 1.00 0.00 H new ATOM 0 HZ1 LYS X 106 26.712 22.089 -1.547 1.00 0.00 H new ATOM 0 HZ2 LYS X 106 26.282 23.285 -2.673 1.00 0.00 H new ATOM 0 HZ3 LYS X 106 26.188 23.612 -1.009 1.00 0.00 H new ATOM 3178 N LYS X 107 20.480 19.769 -1.396 1.00 0.00 N ATOM 3179 CA LYS X 107 20.605 18.487 -2.130 1.00 0.00 C ATOM 3180 C LYS X 107 19.346 18.259 -2.964 1.00 0.00 C ATOM 3181 O LYS X 107 19.427 17.815 -4.084 1.00 0.00 O ATOM 3182 CB LYS X 107 20.776 17.342 -1.129 1.00 0.00 C ATOM 3183 CG LYS X 107 21.124 16.053 -1.879 1.00 0.00 C ATOM 3184 CD LYS X 107 21.130 14.869 -0.902 1.00 0.00 C ATOM 3185 CE LYS X 107 22.326 14.972 0.052 1.00 0.00 C ATOM 3186 NZ LYS X 107 22.555 13.650 0.705 1.00 0.00 N ATOM 0 H LYS X 107 20.565 19.704 -0.382 1.00 0.00 H new ATOM 0 HA LYS X 107 21.474 18.523 -2.787 1.00 0.00 H new ATOM 0 HB2 LYS X 107 21.564 17.584 -0.415 1.00 0.00 H new ATOM 0 HB3 LYS X 107 19.858 17.206 -0.557 1.00 0.00 H new ATOM 0 HG2 LYS X 107 20.399 15.877 -2.674 1.00 0.00 H new ATOM 0 HG3 LYS X 107 22.100 16.150 -2.354 1.00 0.00 H new ATOM 0 HD2 LYS X 107 20.201 14.855 -0.332 1.00 0.00 H new ATOM 0 HD3 LYS X 107 21.178 13.932 -1.456 1.00 0.00 H new ATOM 0 HE2 LYS X 107 23.217 15.278 -0.496 1.00 0.00 H new ATOM 0 HE3 LYS X 107 22.138 15.735 0.807 1.00 0.00 H new ATOM 0 HZ1 LYS X 107 23.366 13.718 1.352 1.00 0.00 H new ATOM 0 HZ2 LYS X 107 21.707 13.376 1.240 1.00 0.00 H new ATOM 0 HZ3 LYS X 107 22.752 12.933 -0.022 1.00 0.00 H new ATOM 3200 N LEU X 108 18.189 18.573 -2.440 1.00 0.00 N ATOM 3201 CA LEU X 108 16.932 18.379 -3.228 1.00 0.00 C ATOM 3202 C LEU X 108 16.860 19.426 -4.350 1.00 0.00 C ATOM 3203 O LEU X 108 16.229 19.219 -5.367 1.00 0.00 O ATOM 3204 CB LEU X 108 15.705 18.535 -2.312 1.00 0.00 C ATOM 3205 CG LEU X 108 14.481 17.857 -2.958 1.00 0.00 C ATOM 3206 CD1 LEU X 108 14.561 16.321 -2.794 1.00 0.00 C ATOM 3207 CD2 LEU X 108 13.193 18.384 -2.307 1.00 0.00 C ATOM 0 H LEU X 108 18.059 18.954 -1.503 1.00 0.00 H new ATOM 0 HA LEU X 108 16.936 17.377 -3.658 1.00 0.00 H new ATOM 0 HB2 LEU X 108 15.908 18.089 -1.338 1.00 0.00 H new ATOM 0 HB3 LEU X 108 15.499 19.592 -2.142 1.00 0.00 H new ATOM 0 HG LEU X 108 14.472 18.093 -4.022 1.00 0.00 H new ATOM 0 HD11 LEU X 108 13.688 15.860 -3.256 1.00 0.00 H new ATOM 0 HD12 LEU X 108 15.466 15.950 -3.276 1.00 0.00 H new ATOM 0 HD13 LEU X 108 14.586 16.069 -1.734 1.00 0.00 H new ATOM 0 HD21 LEU X 108 12.330 17.902 -2.766 1.00 0.00 H new ATOM 0 HD22 LEU X 108 13.207 18.162 -1.240 1.00 0.00 H new ATOM 0 HD23 LEU X 108 13.127 19.462 -2.452 1.00 0.00 H new ATOM 3219 N MET X 109 17.490 20.556 -4.169 1.00 0.00 N ATOM 3220 CA MET X 109 17.430 21.609 -5.223 1.00 0.00 C ATOM 3221 C MET X 109 17.951 21.044 -6.541 1.00 0.00 C ATOM 3222 O MET X 109 17.617 21.533 -7.601 1.00 0.00 O ATOM 3223 CB MET X 109 18.258 22.831 -4.814 1.00 0.00 C ATOM 3224 CG MET X 109 17.637 23.474 -3.573 1.00 0.00 C ATOM 3225 SD MET X 109 16.022 24.184 -3.998 1.00 0.00 S ATOM 3226 CE MET X 109 15.124 23.653 -2.515 1.00 0.00 C ATOM 0 H MET X 109 18.040 20.794 -3.343 1.00 0.00 H new ATOM 0 HA MET X 109 16.393 21.922 -5.347 1.00 0.00 H new ATOM 0 HB2 MET X 109 19.286 22.534 -4.607 1.00 0.00 H new ATOM 0 HB3 MET X 109 18.292 23.551 -5.632 1.00 0.00 H new ATOM 0 HG2 MET X 109 17.522 22.730 -2.785 1.00 0.00 H new ATOM 0 HG3 MET X 109 18.296 24.251 -3.185 1.00 0.00 H new ATOM 0 HE1 MET X 109 14.090 23.993 -2.574 1.00 0.00 H new ATOM 0 HE2 MET X 109 15.145 22.565 -2.447 1.00 0.00 H new ATOM 0 HE3 MET X 109 15.596 24.081 -1.631 1.00 0.00 H new ATOM 3236 N PHE X 110 18.779 20.031 -6.488 1.00 0.00 N ATOM 3237 CA PHE X 110 19.333 19.442 -7.750 1.00 0.00 C ATOM 3238 C PHE X 110 18.237 19.383 -8.834 1.00 0.00 C ATOM 3239 O PHE X 110 18.435 19.808 -9.954 1.00 0.00 O ATOM 3240 CB PHE X 110 19.877 18.020 -7.454 1.00 0.00 C ATOM 3241 CG PHE X 110 18.819 16.946 -7.686 1.00 0.00 C ATOM 3242 CD1 PHE X 110 18.667 16.386 -8.962 1.00 0.00 C ATOM 3243 CD2 PHE X 110 18.002 16.503 -6.634 1.00 0.00 C ATOM 3244 CE1 PHE X 110 17.705 15.391 -9.183 1.00 0.00 C ATOM 3245 CE2 PHE X 110 17.046 15.512 -6.856 1.00 0.00 C ATOM 3246 CZ PHE X 110 16.896 14.952 -8.126 1.00 0.00 C ATOM 0 H PHE X 110 19.096 19.585 -5.627 1.00 0.00 H new ATOM 0 HA PHE X 110 20.146 20.068 -8.118 1.00 0.00 H new ATOM 0 HB2 PHE X 110 20.740 17.822 -8.089 1.00 0.00 H new ATOM 0 HB3 PHE X 110 20.223 17.971 -6.422 1.00 0.00 H new ATOM 0 HD1 PHE X 110 19.292 16.722 -9.776 1.00 0.00 H new ATOM 0 HD2 PHE X 110 18.114 16.931 -5.649 1.00 0.00 H new ATOM 0 HE1 PHE X 110 17.587 14.963 -10.167 1.00 0.00 H new ATOM 0 HE2 PHE X 110 16.420 15.177 -6.043 1.00 0.00 H new ATOM 0 HZ PHE X 110 16.158 14.182 -8.294 1.00 0.00 H new ATOM 3256 N LYS X 111 17.088 18.858 -8.501 1.00 0.00 N ATOM 3257 CA LYS X 111 15.982 18.768 -9.502 1.00 0.00 C ATOM 3258 C LYS X 111 15.370 20.151 -9.757 1.00 0.00 C ATOM 3259 O LYS X 111 14.905 20.439 -10.842 1.00 0.00 O ATOM 3260 CB LYS X 111 14.897 17.826 -8.977 1.00 0.00 C ATOM 3261 CG LYS X 111 14.107 18.512 -7.863 1.00 0.00 C ATOM 3262 CD LYS X 111 13.227 17.484 -7.152 1.00 0.00 C ATOM 3263 CE LYS X 111 14.082 16.523 -6.325 1.00 0.00 C ATOM 3264 NZ LYS X 111 13.280 16.074 -5.158 1.00 0.00 N ATOM 0 H LYS X 111 16.866 18.486 -7.577 1.00 0.00 H new ATOM 0 HA LYS X 111 16.389 18.385 -10.438 1.00 0.00 H new ATOM 0 HB2 LYS X 111 14.227 17.542 -9.788 1.00 0.00 H new ATOM 0 HB3 LYS X 111 15.350 16.909 -8.601 1.00 0.00 H new ATOM 0 HG2 LYS X 111 14.790 18.976 -7.151 1.00 0.00 H new ATOM 0 HG3 LYS X 111 13.490 19.309 -8.278 1.00 0.00 H new ATOM 0 HD2 LYS X 111 12.514 17.994 -6.504 1.00 0.00 H new ATOM 0 HD3 LYS X 111 12.647 16.924 -7.886 1.00 0.00 H new ATOM 0 HE2 LYS X 111 14.385 15.668 -6.929 1.00 0.00 H new ATOM 0 HE3 LYS X 111 14.995 17.017 -5.991 1.00 0.00 H new ATOM 0 HZ1 LYS X 111 13.672 15.184 -4.789 1.00 0.00 H new ATOM 0 HZ2 LYS X 111 13.312 16.801 -4.415 1.00 0.00 H new ATOM 0 HZ3 LYS X 111 12.294 15.922 -5.452 1.00 0.00 H new ATOM 3278 N THR X 112 15.338 21.001 -8.763 1.00 0.00 N ATOM 3279 CA THR X 112 14.725 22.346 -8.972 1.00 0.00 C ATOM 3280 C THR X 112 15.493 23.060 -10.077 1.00 0.00 C ATOM 3281 O THR X 112 14.921 23.739 -10.907 1.00 0.00 O ATOM 3282 CB THR X 112 14.789 23.163 -7.679 1.00 0.00 C ATOM 3283 OG1 THR X 112 16.144 23.332 -7.292 1.00 0.00 O ATOM 3284 CG2 THR X 112 14.023 22.435 -6.574 1.00 0.00 C ATOM 0 H THR X 112 15.705 20.825 -7.828 1.00 0.00 H new ATOM 0 HA THR X 112 13.678 22.235 -9.256 1.00 0.00 H new ATOM 0 HB THR X 112 14.337 24.141 -7.844 1.00 0.00 H new ATOM 0 HG1 THR X 112 16.683 22.600 -7.659 1.00 0.00 H new ATOM 0 HG21 THR X 112 14.070 23.018 -5.654 1.00 0.00 H new ATOM 0 HG22 THR X 112 12.982 22.312 -6.873 1.00 0.00 H new ATOM 0 HG23 THR X 112 14.470 21.455 -6.406 1.00 0.00 H new ATOM 3292 N GLU X 113 16.783 22.889 -10.108 1.00 0.00 N ATOM 3293 CA GLU X 113 17.593 23.528 -11.178 1.00 0.00 C ATOM 3294 CB GLU X 113 17.238 22.869 -12.514 1.00 0.00 C ATOM 3295 CG GLU X 113 17.487 21.358 -12.418 1.00 0.00 C ATOM 3296 CD GLU X 113 18.994 21.084 -12.464 1.00 0.00 C ATOM 3297 OE1 GLU X 113 19.736 22.004 -12.767 1.00 0.00 O ATOM 3298 OE2 GLU X 113 19.380 19.959 -12.196 1.00 0.00 O ATOM 0 H GLU X 113 17.312 22.333 -9.437 1.00 0.00 H new ATOM 0 HB2 GLU X 113 16.194 23.062 -12.761 1.00 0.00 H new ATOM 0 HB3 GLU X 113 17.840 23.298 -13.315 1.00 0.00 H new ATOM 0 HG2 GLU X 113 17.064 20.967 -11.493 1.00 0.00 H new ATOM 0 HG3 GLU X 113 16.988 20.844 -13.239 1.00 0.00 H new ATOM 3493 N ARG Y 104 -11.784 18.010 -27.257 1.00 0.00 N ATOM 3494 CA ARG Y 104 -11.377 17.225 -26.058 1.00 0.00 C ATOM 3495 C ARG Y 104 -10.035 17.728 -25.509 1.00 0.00 C ATOM 3496 O ARG Y 104 -9.845 17.805 -24.312 1.00 0.00 O ATOM 3497 CB ARG Y 104 -11.233 15.744 -26.439 1.00 0.00 C ATOM 3498 CG ARG Y 104 -10.406 15.595 -27.749 1.00 0.00 C ATOM 3499 CD ARG Y 104 -9.219 14.651 -27.536 1.00 0.00 C ATOM 3500 NE ARG Y 104 -8.382 15.147 -26.408 1.00 0.00 N ATOM 3501 CZ ARG Y 104 -7.485 14.366 -25.873 1.00 0.00 C ATOM 3502 NH1 ARG Y 104 -7.295 13.169 -26.356 1.00 0.00 N ATOM 3503 NH2 ARG Y 104 -6.769 14.786 -24.866 1.00 0.00 N ATOM 0 HA ARG Y 104 -12.143 17.346 -25.292 1.00 0.00 H new ATOM 0 HB2 ARG Y 104 -10.745 15.200 -25.630 1.00 0.00 H new ATOM 0 HB3 ARG Y 104 -12.219 15.299 -26.572 1.00 0.00 H new ATOM 0 HG2 ARG Y 104 -11.043 15.212 -28.546 1.00 0.00 H new ATOM 0 HG3 ARG Y 104 -10.046 16.572 -28.071 1.00 0.00 H new ATOM 0 HD2 ARG Y 104 -9.576 13.644 -27.321 1.00 0.00 H new ATOM 0 HD3 ARG Y 104 -8.622 14.590 -28.446 1.00 0.00 H new ATOM 0 HE ARG Y 104 -8.510 16.095 -26.055 1.00 0.00 H new ATOM 0 HH11 ARG Y 104 -7.847 12.846 -27.150 1.00 0.00 H new ATOM 0 HH12 ARG Y 104 -6.594 12.556 -25.939 1.00 0.00 H new ATOM 0 HH21 ARG Y 104 -6.911 15.726 -24.496 1.00 0.00 H new ATOM 0 HH22 ARG Y 104 -6.068 14.174 -24.448 1.00 0.00 H new ATOM 3517 N HIS Y 105 -9.096 18.060 -26.358 1.00 0.00 N ATOM 3518 CA HIS Y 105 -7.783 18.538 -25.835 1.00 0.00 C ATOM 3519 C HIS Y 105 -8.001 19.807 -25.009 1.00 0.00 C ATOM 3520 O HIS Y 105 -7.398 19.999 -23.974 1.00 0.00 O ATOM 3521 CB HIS Y 105 -6.817 18.822 -27.002 1.00 0.00 C ATOM 3522 CG HIS Y 105 -7.172 20.118 -27.690 1.00 0.00 C ATOM 3523 ND1 HIS Y 105 -7.668 20.160 -28.986 1.00 0.00 N ATOM 3524 CD2 HIS Y 105 -7.106 21.426 -27.273 1.00 0.00 C ATOM 3525 CE1 HIS Y 105 -7.881 21.452 -29.298 1.00 0.00 C ATOM 3526 NE2 HIS Y 105 -7.556 22.260 -28.288 1.00 0.00 N ATOM 0 H HIS Y 105 -9.179 18.022 -27.374 1.00 0.00 H new ATOM 0 HA HIS Y 105 -7.343 17.767 -25.203 1.00 0.00 H new ATOM 0 HB2 HIS Y 105 -5.794 18.872 -26.629 1.00 0.00 H new ATOM 0 HB3 HIS Y 105 -6.855 18.002 -27.719 1.00 0.00 H new ATOM 0 HD1 HIS Y 105 -7.840 19.358 -29.592 1.00 0.00 H new ATOM 0 HD2 HIS Y 105 -6.758 21.755 -26.305 1.00 0.00 H new ATOM 0 HE1 HIS Y 105 -8.267 21.792 -30.248 1.00 0.00 H new ATOM 3535 N LYS Y 106 -8.864 20.670 -25.466 1.00 0.00 N ATOM 3536 CA LYS Y 106 -9.137 21.932 -24.726 1.00 0.00 C ATOM 3537 C LYS Y 106 -9.679 21.603 -23.336 1.00 0.00 C ATOM 3538 O LYS Y 106 -9.393 22.278 -22.364 1.00 0.00 O ATOM 3539 CB LYS Y 106 -10.167 22.763 -25.492 1.00 0.00 C ATOM 3540 CG LYS Y 106 -10.370 24.106 -24.781 1.00 0.00 C ATOM 3541 CD LYS Y 106 -11.403 24.951 -25.540 1.00 0.00 C ATOM 3542 CE LYS Y 106 -12.821 24.469 -25.214 1.00 0.00 C ATOM 3543 NZ LYS Y 106 -13.805 25.473 -25.705 1.00 0.00 N ATOM 0 H LYS Y 106 -9.396 20.554 -26.328 1.00 0.00 H new ATOM 0 HA LYS Y 106 -8.212 22.501 -24.629 1.00 0.00 H new ATOM 0 HB2 LYS Y 106 -9.829 22.928 -26.515 1.00 0.00 H new ATOM 0 HB3 LYS Y 106 -11.113 22.224 -25.552 1.00 0.00 H new ATOM 0 HG2 LYS Y 106 -10.706 23.938 -23.758 1.00 0.00 H new ATOM 0 HG3 LYS Y 106 -9.423 24.642 -24.721 1.00 0.00 H new ATOM 0 HD2 LYS Y 106 -11.296 26.001 -25.268 1.00 0.00 H new ATOM 0 HD3 LYS Y 106 -11.224 24.880 -26.613 1.00 0.00 H new ATOM 0 HE2 LYS Y 106 -13.006 23.502 -25.682 1.00 0.00 H new ATOM 0 HE3 LYS Y 106 -12.932 24.329 -24.139 1.00 0.00 H new ATOM 0 HZ1 LYS Y 106 -14.769 25.150 -25.486 1.00 0.00 H new ATOM 0 HZ2 LYS Y 106 -13.631 26.386 -25.239 1.00 0.00 H new ATOM 0 HZ3 LYS Y 106 -13.703 25.585 -26.734 1.00 0.00 H new ATOM 3557 N LYS Y 107 -10.483 20.585 -23.234 1.00 0.00 N ATOM 3558 CA LYS Y 107 -11.063 20.246 -21.912 1.00 0.00 C ATOM 3559 C LYS Y 107 -9.932 19.999 -20.916 1.00 0.00 C ATOM 3560 O LYS Y 107 -10.011 20.417 -19.785 1.00 0.00 O ATOM 3561 CB LYS Y 107 -11.916 18.982 -22.040 1.00 0.00 C ATOM 3562 CG LYS Y 107 -12.727 18.786 -20.756 1.00 0.00 C ATOM 3563 CD LYS Y 107 -13.449 17.432 -20.791 1.00 0.00 C ATOM 3564 CE LYS Y 107 -14.577 17.456 -21.830 1.00 0.00 C ATOM 3565 NZ LYS Y 107 -15.499 16.311 -21.582 1.00 0.00 N ATOM 0 H LYS Y 107 -10.761 19.977 -24.005 1.00 0.00 H new ATOM 0 HA LYS Y 107 -11.686 21.069 -21.562 1.00 0.00 H new ATOM 0 HB2 LYS Y 107 -12.585 19.066 -22.897 1.00 0.00 H new ATOM 0 HB3 LYS Y 107 -11.279 18.116 -22.217 1.00 0.00 H new ATOM 0 HG2 LYS Y 107 -12.068 18.833 -19.889 1.00 0.00 H new ATOM 0 HG3 LYS Y 107 -13.453 19.592 -20.649 1.00 0.00 H new ATOM 0 HD2 LYS Y 107 -12.740 16.640 -21.033 1.00 0.00 H new ATOM 0 HD3 LYS Y 107 -13.857 17.205 -19.806 1.00 0.00 H new ATOM 0 HE2 LYS Y 107 -15.123 18.397 -21.769 1.00 0.00 H new ATOM 0 HE3 LYS Y 107 -14.162 17.393 -22.836 1.00 0.00 H new ATOM 0 HZ1 LYS Y 107 -16.265 16.324 -22.285 1.00 0.00 H new ATOM 0 HZ2 LYS Y 107 -14.972 15.418 -21.661 1.00 0.00 H new ATOM 0 HZ3 LYS Y 107 -15.903 16.391 -20.627 1.00 0.00 H new ATOM 3579 N LEU Y 108 -8.876 19.344 -21.327 1.00 0.00 N ATOM 3580 CA LEU Y 108 -7.738 19.094 -20.388 1.00 0.00 C ATOM 3581 C LEU Y 108 -6.993 20.410 -20.123 1.00 0.00 C ATOM 3582 O LEU Y 108 -6.367 20.582 -19.098 1.00 0.00 O ATOM 3583 CB LEU Y 108 -6.762 18.073 -21.000 1.00 0.00 C ATOM 3584 CG LEU Y 108 -5.906 17.436 -19.888 1.00 0.00 C ATOM 3585 CD1 LEU Y 108 -6.710 16.353 -19.137 1.00 0.00 C ATOM 3586 CD2 LEU Y 108 -4.641 16.815 -20.498 1.00 0.00 C ATOM 0 H LEU Y 108 -8.752 18.972 -22.269 1.00 0.00 H new ATOM 0 HA LEU Y 108 -8.132 18.698 -19.452 1.00 0.00 H new ATOM 0 HB2 LEU Y 108 -7.317 17.300 -21.532 1.00 0.00 H new ATOM 0 HB3 LEU Y 108 -6.119 18.564 -21.730 1.00 0.00 H new ATOM 0 HG LEU Y 108 -5.623 18.213 -19.178 1.00 0.00 H new ATOM 0 HD11 LEU Y 108 -6.089 15.915 -18.356 1.00 0.00 H new ATOM 0 HD12 LEU Y 108 -7.595 16.803 -18.687 1.00 0.00 H new ATOM 0 HD13 LEU Y 108 -7.015 15.575 -19.837 1.00 0.00 H new ATOM 0 HD21 LEU Y 108 -4.039 16.366 -19.708 1.00 0.00 H new ATOM 0 HD22 LEU Y 108 -4.924 16.048 -21.219 1.00 0.00 H new ATOM 0 HD23 LEU Y 108 -4.061 17.590 -21.000 1.00 0.00 H new ATOM 3598 N MET Y 109 -7.040 21.336 -21.041 1.00 0.00 N ATOM 3599 CA MET Y 109 -6.311 22.621 -20.829 1.00 0.00 C ATOM 3600 C MET Y 109 -6.797 23.280 -19.541 1.00 0.00 C ATOM 3601 O MET Y 109 -6.092 24.067 -18.944 1.00 0.00 O ATOM 3602 CB MET Y 109 -6.531 23.567 -22.014 1.00 0.00 C ATOM 3603 CG MET Y 109 -5.910 22.960 -23.274 1.00 0.00 C ATOM 3604 SD MET Y 109 -4.105 22.904 -23.099 1.00 0.00 S ATOM 3605 CE MET Y 109 -3.840 21.257 -23.807 1.00 0.00 C ATOM 0 H MET Y 109 -7.547 21.261 -21.923 1.00 0.00 H new ATOM 0 HA MET Y 109 -5.245 22.410 -20.749 1.00 0.00 H new ATOM 0 HB2 MET Y 109 -7.597 23.735 -22.166 1.00 0.00 H new ATOM 0 HB3 MET Y 109 -6.082 24.538 -21.806 1.00 0.00 H new ATOM 0 HG2 MET Y 109 -6.301 21.955 -23.436 1.00 0.00 H new ATOM 0 HG3 MET Y 109 -6.182 23.553 -24.147 1.00 0.00 H new ATOM 0 HE1 MET Y 109 -2.776 21.022 -23.794 1.00 0.00 H new ATOM 0 HE2 MET Y 109 -4.382 20.517 -23.219 1.00 0.00 H new ATOM 0 HE3 MET Y 109 -4.203 21.240 -24.835 1.00 0.00 H new ATOM 3615 N PHE Y 110 -7.997 22.979 -19.113 1.00 0.00 N ATOM 3616 CA PHE Y 110 -8.532 23.604 -17.859 1.00 0.00 C ATOM 3617 C PHE Y 110 -7.421 23.688 -16.793 1.00 0.00 C ATOM 3618 O PHE Y 110 -7.198 24.723 -16.196 1.00 0.00 O ATOM 3619 CB PHE Y 110 -9.720 22.755 -17.336 1.00 0.00 C ATOM 3620 CG PHE Y 110 -9.265 21.695 -16.337 1.00 0.00 C ATOM 3621 CD1 PHE Y 110 -9.171 22.021 -14.979 1.00 0.00 C ATOM 3622 CD2 PHE Y 110 -8.951 20.395 -16.762 1.00 0.00 C ATOM 3623 CE1 PHE Y 110 -8.766 21.054 -14.050 1.00 0.00 C ATOM 3624 CE2 PHE Y 110 -8.547 19.431 -15.834 1.00 0.00 C ATOM 3625 CZ PHE Y 110 -8.456 19.758 -14.479 1.00 0.00 C ATOM 0 H PHE Y 110 -8.631 22.328 -19.576 1.00 0.00 H new ATOM 0 HA PHE Y 110 -8.878 24.615 -18.073 1.00 0.00 H new ATOM 0 HB2 PHE Y 110 -10.453 23.409 -16.863 1.00 0.00 H new ATOM 0 HB3 PHE Y 110 -10.219 22.272 -18.176 1.00 0.00 H new ATOM 0 HD1 PHE Y 110 -9.411 23.020 -14.647 1.00 0.00 H new ATOM 0 HD2 PHE Y 110 -9.022 20.139 -17.809 1.00 0.00 H new ATOM 0 HE1 PHE Y 110 -8.693 21.308 -13.003 1.00 0.00 H new ATOM 0 HE2 PHE Y 110 -8.305 18.432 -16.165 1.00 0.00 H new ATOM 0 HZ PHE Y 110 -8.147 19.011 -13.763 1.00 0.00 H new ATOM 3635 N LYS Y 111 -6.730 22.605 -16.556 1.00 0.00 N ATOM 3636 CA LYS Y 111 -5.639 22.616 -15.535 1.00 0.00 C ATOM 3637 C LYS Y 111 -4.419 23.385 -16.059 1.00 0.00 C ATOM 3638 O LYS Y 111 -3.693 24.000 -15.303 1.00 0.00 O ATOM 3639 CB LYS Y 111 -5.226 21.177 -15.214 1.00 0.00 C ATOM 3640 CG LYS Y 111 -4.434 20.597 -16.384 1.00 0.00 C ATOM 3641 CD LYS Y 111 -4.270 19.087 -16.205 1.00 0.00 C ATOM 3642 CE LYS Y 111 -5.609 18.374 -16.391 1.00 0.00 C ATOM 3643 NZ LYS Y 111 -5.341 17.014 -16.923 1.00 0.00 N ATOM 0 H LYS Y 111 -6.873 21.711 -17.026 1.00 0.00 H new ATOM 0 HA LYS Y 111 -6.008 23.108 -14.635 1.00 0.00 H new ATOM 0 HB2 LYS Y 111 -4.622 21.155 -14.307 1.00 0.00 H new ATOM 0 HB3 LYS Y 111 -6.110 20.568 -15.023 1.00 0.00 H new ATOM 0 HG2 LYS Y 111 -4.948 20.807 -17.322 1.00 0.00 H new ATOM 0 HG3 LYS Y 111 -3.455 21.073 -16.443 1.00 0.00 H new ATOM 0 HD2 LYS Y 111 -3.546 18.707 -16.926 1.00 0.00 H new ATOM 0 HD3 LYS Y 111 -3.873 18.874 -15.212 1.00 0.00 H new ATOM 0 HE2 LYS Y 111 -6.142 18.313 -15.442 1.00 0.00 H new ATOM 0 HE3 LYS Y 111 -6.245 18.932 -17.078 1.00 0.00 H new ATOM 0 HZ1 LYS Y 111 -6.176 16.412 -16.774 1.00 0.00 H new ATOM 0 HZ2 LYS Y 111 -5.134 17.074 -17.941 1.00 0.00 H new ATOM 0 HZ3 LYS Y 111 -4.525 16.602 -16.428 1.00 0.00 H new ATOM 3657 N THR Y 112 -4.165 23.331 -17.342 1.00 0.00 N ATOM 3658 CA THR Y 112 -2.968 24.043 -17.877 1.00 0.00 C ATOM 3659 C THR Y 112 -3.107 25.528 -17.566 1.00 0.00 C ATOM 3660 O THR Y 112 -2.148 26.196 -17.234 1.00 0.00 O ATOM 3661 CB THR Y 112 -2.863 23.838 -19.390 1.00 0.00 C ATOM 3662 OG1 THR Y 112 -4.024 24.352 -20.023 1.00 0.00 O ATOM 3663 CG2 THR Y 112 -2.726 22.345 -19.696 1.00 0.00 C ATOM 0 H THR Y 112 -4.726 22.832 -18.032 1.00 0.00 H new ATOM 0 HA THR Y 112 -2.066 23.646 -17.411 1.00 0.00 H new ATOM 0 HB THR Y 112 -1.986 24.365 -19.766 1.00 0.00 H new ATOM 0 HG1 THR Y 112 -4.770 24.353 -19.387 1.00 0.00 H new ATOM 0 HG21 THR Y 112 -2.651 22.200 -20.774 1.00 0.00 H new ATOM 0 HG22 THR Y 112 -1.829 21.956 -19.214 1.00 0.00 H new ATOM 0 HG23 THR Y 112 -3.600 21.814 -19.318 1.00 0.00 H new ATOM 3671 N GLU Y 113 -4.301 26.041 -17.640 1.00 0.00 N ATOM 3672 CA GLU Y 113 -4.513 27.475 -17.313 1.00 0.00 C ATOM 3673 CB GLU Y 113 -4.276 27.667 -15.813 1.00 0.00 C ATOM 3674 CG GLU Y 113 -5.223 26.752 -15.027 1.00 0.00 C ATOM 3675 CD GLU Y 113 -6.645 27.315 -15.083 1.00 0.00 C ATOM 3676 OE1 GLU Y 113 -6.798 28.446 -15.516 1.00 0.00 O ATOM 3677 OE2 GLU Y 113 -7.556 26.607 -14.689 1.00 0.00 O ATOM 0 H GLU Y 113 -5.140 25.529 -17.913 1.00 0.00 H new ATOM 0 HB2 GLU Y 113 -3.240 27.436 -15.565 1.00 0.00 H new ATOM 0 HB3 GLU Y 113 -4.446 28.708 -15.537 1.00 0.00 H new ATOM 0 HG2 GLU Y 113 -5.203 25.746 -15.445 1.00 0.00 H new ATOM 0 HG3 GLU Y 113 -4.893 26.674 -13.991 1.00 0.00 H new