USER MOD reduce.3.24.130724 H: found=0, std=0, add=1428, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1418 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: B 55 LYS NZ :NH3+ -157:sc= -0.0466 (180deg=-0.446) USER MOD Set 2.2: B 59 THR OG1 : rot 86:sc= 0.93 USER MOD Set 3.1: B 29 LYS NZ :NH3+ -163:sc= 0.0903 (180deg=-0.427) USER MOD Set 3.2: B 30 SER OG : rot 180:sc= 0.0887 USER MOD Set 4.1: B 25 HIS : no HD1:sc= -2.54! C(o=-5!,f=-4.7!) USER MOD Set 4.2: B 26 LYS NZ :NH3+ -114:sc= -2.43! (180deg=-0.358) USER MOD Set 5.1: B 17 TYR OH : rot 110:sc= 0.187 USER MOD Set 5.2: B 38 ASN : amide:sc= -0.369 K(o=-0.18,f=-2) USER MOD Set 6.1: A 55 LYS NZ :NH3+ -156:sc= -0.0494 (180deg=-0.462) USER MOD Set 6.2: A 59 THR OG1 : rot 84:sc= 0.874 USER MOD Set 7.1: A 29 LYS NZ :NH3+ -161:sc= 0.0837 (180deg=-0.542) USER MOD Set 7.2: A 30 SER OG : rot 180:sc= 0.0893 USER MOD Set 8.1: A 25 HIS : no HD1:sc= -2.67! C(o=-5.1!,f=-4.6!) USER MOD Set 8.2: A 26 LYS NZ :NH3+ -111:sc= -2.38! (180deg=-0.34) USER MOD Set 9.1: A 17 TYR OH : rot 110:sc= 0.191 USER MOD Set 9.2: A 38 ASN : amide:sc= -0.359 K(o=-0.17,f=-1.9!) USER MOD Single : A 0 MET CE :methyl 153:sc= -0.192 (180deg=-1.29) USER MOD Single : A 0 MET N :NH3+ -162:sc= 0.814 (180deg=0.26) USER MOD Single : A 1 SER OG : rot -167:sc= 0.313 USER MOD Single : A 5 LYS NZ :NH3+ 165:sc= -0.0573 (180deg=-0.398) USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=-0.061) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -159:sc= -0.0665 (180deg=-0.695) USER MOD Single : A 37 ASN : amide:sc=-0.00306 X(o=-0.0031,f=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HE2:sc= -1.14! C(o=-1.1!,f=-6.2!) USER MOD Single : A 48 LYS NZ :NH3+ -163:sc= -0.0889 (180deg=-0.59) USER MOD Single : A 50 GLN : amide:sc= -0.0205 K(o=-0.021,f=-1.7!) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 68 CYS SG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= 0.0142 X(o=0.014,f=0) USER MOD Single : A 78 SER OG : rot 84:sc= -0.265 USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot -92:sc= 1.09 USER MOD Single : A 82 THR OG1 : rot 62:sc= 1.07 USER MOD Single : A 84 CYS SG : rot -51:sc= -0.645 USER MOD Single : A 85 HIS : no HD1:sc= -2.05! C(o=-2.1!,f=-5.4!) USER MOD Single : A 90 HIS : no HD1:sc= -0.0164 X(o=-0.016,f=-0.016) USER MOD Single : B 0 MET CE :methyl 154:sc= -0.234 (180deg=-1.39!) USER MOD Single : B 0 MET N :NH3+ -166:sc= 0.726 (180deg=0.157!) USER MOD Single : B 1 SER OG : rot -169:sc= 0.305 USER MOD Single : B 5 LYS NZ :NH3+ 164:sc= -0.0431 (180deg=-0.456) USER MOD Single : B 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 15 HIS : no HD1:sc= 0 X(o=0,f=-0.034) USER MOD Single : B 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 18 SER OG : rot 180:sc= 0 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 LYS NZ :NH3+ -134:sc= -0.0661 (180deg=-0.705) USER MOD Single : B 37 ASN : amide:sc= -0.0123 X(o=-0.012,f=0) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HE2:sc= -1.13! C(o=-1.1!,f=-5.7!) USER MOD Single : B 48 LYS NZ :NH3+ -164:sc= -0.057 (180deg=-0.533) USER MOD Single : B 50 GLN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : B 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 68 CYS SG : rot 180:sc= 0 USER MOD Single : B 71 GLN : amide:sc= 0.0116 X(o=0.012,f=0) USER MOD Single : B 78 SER OG : rot 83:sc= -0.171 USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 81 THR OG1 : rot -89:sc= 1.07 USER MOD Single : B 82 THR OG1 : rot 64:sc= 1.05 USER MOD Single : B 84 CYS SG : rot -49:sc= -0.722 USER MOD Single : B 85 HIS : no HD1:sc= -2.11 K(o=-2.1,f=-5!) USER MOD Single : B 90 HIS : no HD1:sc= 0 X(o=0,f=-0.003) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 -9.302 7.294 12.789 1.00 0.00 N ATOM 2 CA MET A 0 -10.536 6.930 13.540 1.00 0.00 C ATOM 3 C MET A 0 -10.638 5.407 13.640 1.00 0.00 C ATOM 4 O MET A 0 -10.692 4.850 14.719 1.00 0.00 O ATOM 5 CB MET A 0 -11.759 7.482 12.804 1.00 0.00 C ATOM 6 CG MET A 0 -12.976 7.460 13.735 1.00 0.00 C ATOM 7 SD MET A 0 -14.361 8.312 12.940 1.00 0.00 S ATOM 8 CE MET A 0 -14.525 7.205 11.518 1.00 0.00 C ATOM 0 H1 MET A 0 -9.064 8.289 12.974 1.00 0.00 H new ATOM 0 H2 MET A 0 -8.516 6.687 13.097 1.00 0.00 H new ATOM 0 H3 MET A 0 -9.463 7.160 11.770 1.00 0.00 H new ATOM 0 HA MET A 0 -10.495 7.356 14.543 1.00 0.00 H new ATOM 0 HB2 MET A 0 -11.564 8.501 12.468 1.00 0.00 H new ATOM 0 HB3 MET A 0 -11.959 6.886 11.914 1.00 0.00 H new ATOM 0 HG2 MET A 0 -13.252 6.431 13.965 1.00 0.00 H new ATOM 0 HG3 MET A 0 -12.732 7.944 14.681 1.00 0.00 H new ATOM 0 HE1 MET A 0 -15.554 7.224 11.159 1.00 0.00 H new ATOM 0 HE2 MET A 0 -13.856 7.533 10.722 1.00 0.00 H new ATOM 0 HE3 MET A 0 -14.264 6.189 11.815 1.00 0.00 H new ATOM 20 N SER A 1 -10.659 4.725 12.526 1.00 0.00 N ATOM 21 CA SER A 1 -10.750 3.237 12.564 1.00 0.00 C ATOM 22 C SER A 1 -9.344 2.656 12.733 1.00 0.00 C ATOM 23 O SER A 1 -8.356 3.345 12.571 1.00 0.00 O ATOM 24 CB SER A 1 -11.365 2.724 11.260 1.00 0.00 C ATOM 25 OG SER A 1 -10.356 2.658 10.260 1.00 0.00 O ATOM 0 H SER A 1 -10.617 5.134 11.592 1.00 0.00 H new ATOM 0 HA SER A 1 -11.379 2.929 13.399 1.00 0.00 H new ATOM 0 HB2 SER A 1 -11.805 1.739 11.415 1.00 0.00 H new ATOM 0 HB3 SER A 1 -12.169 3.386 10.939 1.00 0.00 H new ATOM 0 HG SER A 1 -10.773 2.529 9.383 1.00 0.00 H new ATOM 31 N GLU A 2 -9.244 1.399 13.065 1.00 0.00 N ATOM 32 CA GLU A 2 -7.898 0.787 13.251 1.00 0.00 C ATOM 33 C GLU A 2 -7.075 0.953 11.970 1.00 0.00 C ATOM 34 O GLU A 2 -5.874 1.130 12.011 1.00 0.00 O ATOM 35 CB GLU A 2 -8.057 -0.705 13.576 1.00 0.00 C ATOM 36 CG GLU A 2 -6.777 -1.231 14.237 1.00 0.00 C ATOM 37 CD GLU A 2 -6.716 -0.752 15.689 1.00 0.00 C ATOM 38 OE1 GLU A 2 -7.569 0.033 16.071 1.00 0.00 O ATOM 39 OE2 GLU A 2 -5.818 -1.180 16.395 1.00 0.00 O ATOM 0 H GLU A 2 -10.033 0.770 13.215 1.00 0.00 H new ATOM 0 HA GLU A 2 -7.383 1.284 14.073 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -8.908 -0.853 14.241 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -8.263 -1.265 12.664 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -6.758 -2.320 14.202 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -5.902 -0.879 13.690 1.00 0.00 H new ATOM 46 N LEU A 3 -7.712 0.887 10.833 1.00 0.00 N ATOM 47 CA LEU A 3 -6.968 1.032 9.551 1.00 0.00 C ATOM 48 C LEU A 3 -6.272 2.398 9.511 1.00 0.00 C ATOM 49 O LEU A 3 -5.094 2.496 9.228 1.00 0.00 O ATOM 50 CB LEU A 3 -7.956 0.901 8.375 1.00 0.00 C ATOM 51 CG LEU A 3 -7.253 0.294 7.152 1.00 0.00 C ATOM 52 CD1 LEU A 3 -8.248 0.189 5.994 1.00 0.00 C ATOM 53 CD2 LEU A 3 -6.077 1.185 6.737 1.00 0.00 C ATOM 0 H LEU A 3 -8.717 0.739 10.737 1.00 0.00 H new ATOM 0 HA LEU A 3 -6.211 0.251 9.472 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.798 0.274 8.667 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -8.361 1.880 8.121 1.00 0.00 H new ATOM 0 HG LEU A 3 -6.881 -0.699 7.405 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -7.751 -0.242 5.125 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -9.082 -0.448 6.288 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -8.621 1.182 5.744 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.580 0.751 5.869 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.445 2.180 6.485 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -5.368 1.259 7.561 1.00 0.00 H new ATOM 65 N GLU A 4 -6.987 3.455 9.791 1.00 0.00 N ATOM 66 CA GLU A 4 -6.355 4.804 9.764 1.00 0.00 C ATOM 67 C GLU A 4 -5.180 4.832 10.744 1.00 0.00 C ATOM 68 O GLU A 4 -4.095 5.281 10.429 1.00 0.00 O ATOM 69 CB GLU A 4 -7.385 5.862 10.164 1.00 0.00 C ATOM 70 CG GLU A 4 -8.664 5.672 9.341 1.00 0.00 C ATOM 71 CD GLU A 4 -9.526 6.935 9.427 1.00 0.00 C ATOM 72 OE1 GLU A 4 -10.066 7.187 10.491 1.00 0.00 O ATOM 73 OE2 GLU A 4 -9.632 7.625 8.427 1.00 0.00 O ATOM 0 H GLU A 4 -7.977 3.442 10.036 1.00 0.00 H new ATOM 0 HA GLU A 4 -5.994 5.018 8.758 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.610 5.781 11.228 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.979 6.860 9.999 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -8.411 5.463 8.302 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.223 4.813 9.712 1.00 0.00 H new ATOM 80 N LYS A 5 -5.402 4.343 11.934 1.00 0.00 N ATOM 81 CA LYS A 5 -4.326 4.316 12.966 1.00 0.00 C ATOM 82 C LYS A 5 -3.032 3.781 12.349 1.00 0.00 C ATOM 83 O LYS A 5 -1.952 4.289 12.583 1.00 0.00 O ATOM 84 CB LYS A 5 -4.762 3.368 14.092 1.00 0.00 C ATOM 85 CG LYS A 5 -3.805 3.484 15.296 1.00 0.00 C ATOM 86 CD LYS A 5 -4.237 4.637 16.211 1.00 0.00 C ATOM 87 CE LYS A 5 -3.385 4.622 17.482 1.00 0.00 C ATOM 88 NZ LYS A 5 -1.950 4.790 17.121 1.00 0.00 N ATOM 0 H LYS A 5 -6.295 3.956 12.239 1.00 0.00 H new ATOM 0 HA LYS A 5 -4.156 5.322 13.350 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -5.779 3.607 14.404 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -4.774 2.341 13.727 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -3.799 2.549 15.856 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -2.787 3.651 14.945 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.122 5.589 15.694 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -5.292 4.538 16.466 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -3.698 5.423 18.152 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -3.529 3.684 18.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -1.404 5.033 17.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -1.587 3.902 16.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -1.855 5.552 16.420 1.00 0.00 H new ATOM 102 N ALA A 6 -3.146 2.748 11.564 1.00 0.00 N ATOM 103 CA ALA A 6 -1.950 2.140 10.918 1.00 0.00 C ATOM 104 C ALA A 6 -1.522 2.955 9.690 1.00 0.00 C ATOM 105 O ALA A 6 -0.360 2.986 9.348 1.00 0.00 O ATOM 106 CB ALA A 6 -2.283 0.695 10.511 1.00 0.00 C ATOM 0 H ALA A 6 -4.030 2.292 11.339 1.00 0.00 H new ATOM 0 HA ALA A 6 -1.120 2.140 11.625 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.413 0.241 10.037 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -2.554 0.121 11.397 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.118 0.698 9.810 1.00 0.00 H new ATOM 112 N MET A 7 -2.420 3.623 9.029 1.00 0.00 N ATOM 113 CA MET A 7 -1.992 4.419 7.843 1.00 0.00 C ATOM 114 C MET A 7 -0.932 5.436 8.293 1.00 0.00 C ATOM 115 O MET A 7 0.120 5.575 7.688 1.00 0.00 O ATOM 116 CB MET A 7 -3.211 5.149 7.249 1.00 0.00 C ATOM 117 CG MET A 7 -2.981 5.437 5.759 1.00 0.00 C ATOM 118 SD MET A 7 -3.427 3.968 4.791 1.00 0.00 S ATOM 119 CE MET A 7 -1.832 3.695 3.975 1.00 0.00 C ATOM 0 H MET A 7 -3.415 3.655 9.250 1.00 0.00 H new ATOM 0 HA MET A 7 -1.570 3.765 7.080 1.00 0.00 H new ATOM 0 HB2 MET A 7 -4.106 4.540 7.375 1.00 0.00 H new ATOM 0 HB3 MET A 7 -3.382 6.082 7.785 1.00 0.00 H new ATOM 0 HG2 MET A 7 -3.582 6.291 5.444 1.00 0.00 H new ATOM 0 HG3 MET A 7 -1.938 5.700 5.584 1.00 0.00 H new ATOM 0 HE1 MET A 7 -1.900 2.822 3.325 1.00 0.00 H new ATOM 0 HE2 MET A 7 -1.573 4.571 3.380 1.00 0.00 H new ATOM 0 HE3 MET A 7 -1.062 3.527 4.728 1.00 0.00 H new ATOM 129 N VAL A 8 -1.198 6.137 9.360 1.00 0.00 N ATOM 130 CA VAL A 8 -0.215 7.135 9.865 1.00 0.00 C ATOM 131 C VAL A 8 1.073 6.420 10.280 1.00 0.00 C ATOM 132 O VAL A 8 2.160 6.931 10.102 1.00 0.00 O ATOM 133 CB VAL A 8 -0.809 7.868 11.072 1.00 0.00 C ATOM 134 CG1 VAL A 8 -0.013 9.149 11.337 1.00 0.00 C ATOM 135 CG2 VAL A 8 -2.267 8.228 10.775 1.00 0.00 C ATOM 0 H VAL A 8 -2.057 6.061 9.905 1.00 0.00 H new ATOM 0 HA VAL A 8 0.010 7.855 9.078 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.760 7.224 11.950 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -0.437 9.669 12.196 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.027 8.895 11.543 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.062 9.795 10.461 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -2.695 8.750 11.631 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -2.311 8.873 9.898 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -2.835 7.317 10.585 1.00 0.00 H new ATOM 145 N ALA A 9 0.963 5.238 10.826 1.00 0.00 N ATOM 146 CA ALA A 9 2.187 4.496 11.241 1.00 0.00 C ATOM 147 C ALA A 9 3.103 4.313 10.030 1.00 0.00 C ATOM 148 O ALA A 9 4.290 4.548 10.095 1.00 0.00 O ATOM 149 CB ALA A 9 1.785 3.125 11.787 1.00 0.00 C ATOM 0 H ALA A 9 0.081 4.756 11.002 1.00 0.00 H new ATOM 0 HA ALA A 9 2.713 5.057 12.014 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.678 2.579 12.092 1.00 0.00 H new ATOM 0 HB2 ALA A 9 1.127 3.254 12.647 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.263 2.564 11.012 1.00 0.00 H new ATOM 155 N LEU A 10 2.568 3.880 8.927 1.00 0.00 N ATOM 156 CA LEU A 10 3.426 3.674 7.722 1.00 0.00 C ATOM 157 C LEU A 10 4.305 4.910 7.519 1.00 0.00 C ATOM 158 O LEU A 10 5.492 4.810 7.274 1.00 0.00 O ATOM 159 CB LEU A 10 2.513 3.483 6.486 1.00 0.00 C ATOM 160 CG LEU A 10 2.263 1.984 6.203 1.00 0.00 C ATOM 161 CD1 LEU A 10 3.525 1.323 5.613 1.00 0.00 C ATOM 162 CD2 LEU A 10 1.852 1.258 7.500 1.00 0.00 C ATOM 0 H LEU A 10 1.580 3.660 8.803 1.00 0.00 H new ATOM 0 HA LEU A 10 4.056 2.795 7.855 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.562 3.988 6.652 1.00 0.00 H new ATOM 0 HB3 LEU A 10 2.974 3.949 5.615 1.00 0.00 H new ATOM 0 HG LEU A 10 1.455 1.904 5.476 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.328 0.268 5.421 1.00 0.00 H new ATOM 0 HD12 LEU A 10 3.792 1.818 4.679 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.349 1.415 6.321 1.00 0.00 H new ATOM 0 HD21 LEU A 10 1.679 0.203 7.287 1.00 0.00 H new ATOM 0 HD22 LEU A 10 2.648 1.353 8.238 1.00 0.00 H new ATOM 0 HD23 LEU A 10 0.938 1.704 7.893 1.00 0.00 H new ATOM 174 N ILE A 11 3.728 6.076 7.629 1.00 0.00 N ATOM 175 CA ILE A 11 4.537 7.312 7.454 1.00 0.00 C ATOM 176 C ILE A 11 5.556 7.394 8.593 1.00 0.00 C ATOM 177 O ILE A 11 6.713 7.705 8.389 1.00 0.00 O ATOM 178 CB ILE A 11 3.619 8.535 7.484 1.00 0.00 C ATOM 179 CG1 ILE A 11 2.693 8.496 6.265 1.00 0.00 C ATOM 180 CG2 ILE A 11 4.468 9.808 7.439 1.00 0.00 C ATOM 181 CD1 ILE A 11 1.617 9.572 6.403 1.00 0.00 C ATOM 0 H ILE A 11 2.739 6.224 7.831 1.00 0.00 H new ATOM 0 HA ILE A 11 5.057 7.288 6.496 1.00 0.00 H new ATOM 0 HB ILE A 11 3.024 8.528 8.397 1.00 0.00 H new ATOM 0 HG12 ILE A 11 3.268 8.658 5.353 1.00 0.00 H new ATOM 0 HG13 ILE A 11 2.230 7.513 6.179 1.00 0.00 H new ATOM 0 HG21 ILE A 11 3.816 10.681 7.460 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.134 9.832 8.301 1.00 0.00 H new ATOM 0 HG23 ILE A 11 5.059 9.819 6.523 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.959 9.542 5.534 1.00 0.00 H new ATOM 0 HD12 ILE A 11 1.034 9.390 7.306 1.00 0.00 H new ATOM 0 HD13 ILE A 11 2.089 10.552 6.467 1.00 0.00 H new ATOM 193 N ASP A 12 5.126 7.105 9.795 1.00 0.00 N ATOM 194 CA ASP A 12 6.050 7.148 10.962 1.00 0.00 C ATOM 195 C ASP A 12 7.314 6.345 10.661 1.00 0.00 C ATOM 196 O ASP A 12 8.419 6.802 10.874 1.00 0.00 O ATOM 197 CB ASP A 12 5.360 6.523 12.182 1.00 0.00 C ATOM 198 CG ASP A 12 4.059 7.274 12.471 1.00 0.00 C ATOM 199 OD1 ASP A 12 3.803 8.257 11.796 1.00 0.00 O ATOM 200 OD2 ASP A 12 3.344 6.858 13.367 1.00 0.00 O ATOM 0 H ASP A 12 4.166 6.839 10.017 1.00 0.00 H new ATOM 0 HA ASP A 12 6.312 8.187 11.163 1.00 0.00 H new ATOM 0 HB2 ASP A 12 5.151 5.470 11.995 1.00 0.00 H new ATOM 0 HB3 ASP A 12 6.019 6.568 13.049 1.00 0.00 H new ATOM 205 N VAL A 13 7.158 5.134 10.186 1.00 0.00 N ATOM 206 CA VAL A 13 8.353 4.292 9.898 1.00 0.00 C ATOM 207 C VAL A 13 9.029 4.727 8.597 1.00 0.00 C ATOM 208 O VAL A 13 10.236 4.861 8.543 1.00 0.00 O ATOM 209 CB VAL A 13 7.944 2.822 9.808 1.00 0.00 C ATOM 210 CG1 VAL A 13 9.173 1.975 9.476 1.00 0.00 C ATOM 211 CG2 VAL A 13 7.363 2.369 11.149 1.00 0.00 C ATOM 0 H VAL A 13 6.258 4.696 9.987 1.00 0.00 H new ATOM 0 HA VAL A 13 9.066 4.420 10.712 1.00 0.00 H new ATOM 0 HB VAL A 13 7.193 2.701 9.028 1.00 0.00 H new ATOM 0 HG11 VAL A 13 8.885 0.926 9.411 1.00 0.00 H new ATOM 0 HG12 VAL A 13 9.590 2.297 8.522 1.00 0.00 H new ATOM 0 HG13 VAL A 13 9.922 2.098 10.259 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.072 1.321 11.084 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.114 2.489 11.930 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.489 2.974 11.390 1.00 0.00 H new ATOM 221 N PHE A 14 8.293 4.937 7.545 1.00 0.00 N ATOM 222 CA PHE A 14 8.959 5.344 6.274 1.00 0.00 C ATOM 223 C PHE A 14 9.887 6.532 6.546 1.00 0.00 C ATOM 224 O PHE A 14 10.927 6.680 5.933 1.00 0.00 O ATOM 225 CB PHE A 14 7.909 5.741 5.235 1.00 0.00 C ATOM 226 CG PHE A 14 8.600 6.092 3.938 1.00 0.00 C ATOM 227 CD1 PHE A 14 9.111 7.381 3.743 1.00 0.00 C ATOM 228 CD2 PHE A 14 8.734 5.126 2.933 1.00 0.00 C ATOM 229 CE1 PHE A 14 9.756 7.704 2.543 1.00 0.00 C ATOM 230 CE2 PHE A 14 9.379 5.449 1.733 1.00 0.00 C ATOM 231 CZ PHE A 14 9.891 6.738 1.537 1.00 0.00 C ATOM 0 H PHE A 14 7.278 4.848 7.506 1.00 0.00 H new ATOM 0 HA PHE A 14 9.539 4.505 5.888 1.00 0.00 H new ATOM 0 HB2 PHE A 14 7.208 4.921 5.077 1.00 0.00 H new ATOM 0 HB3 PHE A 14 7.329 6.591 5.593 1.00 0.00 H new ATOM 0 HD1 PHE A 14 9.008 8.126 4.518 1.00 0.00 H new ATOM 0 HD2 PHE A 14 8.340 4.132 3.084 1.00 0.00 H new ATOM 0 HE1 PHE A 14 10.150 8.698 2.393 1.00 0.00 H new ATOM 0 HE2 PHE A 14 9.482 4.704 0.958 1.00 0.00 H new ATOM 0 HZ PHE A 14 10.389 6.987 0.612 1.00 0.00 H new ATOM 241 N HIS A 15 9.510 7.386 7.460 1.00 0.00 N ATOM 242 CA HIS A 15 10.354 8.574 7.771 1.00 0.00 C ATOM 243 C HIS A 15 11.505 8.181 8.703 1.00 0.00 C ATOM 244 O HIS A 15 12.565 8.776 8.682 1.00 0.00 O ATOM 245 CB HIS A 15 9.492 9.640 8.451 1.00 0.00 C ATOM 246 CG HIS A 15 10.231 10.950 8.468 1.00 0.00 C ATOM 247 ND1 HIS A 15 10.513 11.656 7.308 1.00 0.00 N ATOM 248 CD2 HIS A 15 10.752 11.697 9.497 1.00 0.00 C ATOM 249 CE1 HIS A 15 11.176 12.771 7.663 1.00 0.00 C ATOM 250 NE2 HIS A 15 11.348 12.846 8.985 1.00 0.00 N ATOM 0 H HIS A 15 8.651 7.311 8.005 1.00 0.00 H new ATOM 0 HA HIS A 15 10.770 8.967 6.843 1.00 0.00 H new ATOM 0 HB2 HIS A 15 8.547 9.751 7.920 1.00 0.00 H new ATOM 0 HB3 HIS A 15 9.252 9.333 9.469 1.00 0.00 H new ATOM 0 HD2 HIS A 15 10.706 11.433 10.543 1.00 0.00 H new ATOM 0 HE1 HIS A 15 11.527 13.515 6.964 1.00 0.00 H new ATOM 0 HE2 HIS A 15 11.816 13.587 9.508 1.00 0.00 H new ATOM 258 N GLN A 16 11.296 7.198 9.538 1.00 0.00 N ATOM 259 CA GLN A 16 12.368 6.787 10.488 1.00 0.00 C ATOM 260 C GLN A 16 13.657 6.488 9.724 1.00 0.00 C ATOM 261 O GLN A 16 14.727 6.911 10.114 1.00 0.00 O ATOM 262 CB GLN A 16 11.929 5.541 11.259 1.00 0.00 C ATOM 263 CG GLN A 16 12.849 5.339 12.463 1.00 0.00 C ATOM 264 CD GLN A 16 12.482 4.035 13.171 1.00 0.00 C ATOM 265 OE1 GLN A 16 12.623 2.965 12.612 1.00 0.00 O ATOM 266 NE2 GLN A 16 12.013 4.078 14.388 1.00 0.00 N ATOM 0 H GLN A 16 10.430 6.663 9.603 1.00 0.00 H new ATOM 0 HA GLN A 16 12.548 7.601 11.190 1.00 0.00 H new ATOM 0 HB2 GLN A 16 10.896 5.650 11.591 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.965 4.666 10.609 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.889 5.309 12.138 1.00 0.00 H new ATOM 0 HG3 GLN A 16 12.754 6.179 13.152 1.00 0.00 H new ATOM 0 HE21 GLN A 16 11.895 4.976 14.857 1.00 0.00 H new ATOM 0 HE22 GLN A 16 11.765 3.214 14.870 1.00 0.00 H new ATOM 275 N TYR A 17 13.573 5.770 8.636 1.00 0.00 N ATOM 276 CA TYR A 17 14.803 5.458 7.859 1.00 0.00 C ATOM 277 C TYR A 17 15.251 6.715 7.117 1.00 0.00 C ATOM 278 O TYR A 17 16.428 7.007 7.022 1.00 0.00 O ATOM 279 CB TYR A 17 14.504 4.343 6.852 1.00 0.00 C ATOM 280 CG TYR A 17 14.393 3.024 7.581 1.00 0.00 C ATOM 281 CD1 TYR A 17 13.208 2.694 8.249 1.00 0.00 C ATOM 282 CD2 TYR A 17 15.475 2.135 7.593 1.00 0.00 C ATOM 283 CE1 TYR A 17 13.103 1.475 8.929 1.00 0.00 C ATOM 284 CE2 TYR A 17 15.370 0.915 8.275 1.00 0.00 C ATOM 285 CZ TYR A 17 14.184 0.586 8.942 1.00 0.00 C ATOM 286 OH TYR A 17 14.080 -0.614 9.615 1.00 0.00 O ATOM 0 H TYR A 17 12.708 5.388 8.254 1.00 0.00 H new ATOM 0 HA TYR A 17 15.593 5.127 8.533 1.00 0.00 H new ATOM 0 HB2 TYR A 17 13.576 4.557 6.321 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.295 4.292 6.104 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.374 3.380 8.240 1.00 0.00 H new ATOM 0 HD2 TYR A 17 16.389 2.389 7.077 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.188 1.221 9.443 1.00 0.00 H new ATOM 0 HE2 TYR A 17 16.204 0.229 8.286 1.00 0.00 H new ATOM 0 HH TYR A 17 14.047 -1.350 8.969 1.00 0.00 H new ATOM 296 N SER A 18 14.317 7.464 6.588 1.00 0.00 N ATOM 297 CA SER A 18 14.674 8.712 5.849 1.00 0.00 C ATOM 298 C SER A 18 14.469 9.931 6.754 1.00 0.00 C ATOM 299 O SER A 18 13.752 10.848 6.403 1.00 0.00 O ATOM 300 CB SER A 18 13.773 8.845 4.620 1.00 0.00 C ATOM 301 OG SER A 18 13.738 7.605 3.927 1.00 0.00 O ATOM 0 H SER A 18 13.318 7.263 6.637 1.00 0.00 H new ATOM 0 HA SER A 18 15.719 8.661 5.543 1.00 0.00 H new ATOM 0 HB2 SER A 18 12.767 9.134 4.922 1.00 0.00 H new ATOM 0 HB3 SER A 18 14.147 9.631 3.964 1.00 0.00 H new ATOM 0 HG SER A 18 13.160 7.686 3.140 1.00 0.00 H new ATOM 307 N GLY A 19 15.105 9.969 7.906 1.00 0.00 N ATOM 308 CA GLY A 19 14.968 11.150 8.825 1.00 0.00 C ATOM 309 C GLY A 19 16.345 11.801 8.955 1.00 0.00 C ATOM 310 O GLY A 19 16.487 12.892 9.473 1.00 0.00 O ATOM 0 H GLY A 19 15.716 9.228 8.250 1.00 0.00 H new ATOM 0 HA2 GLY A 19 14.245 11.862 8.427 1.00 0.00 H new ATOM 0 HA3 GLY A 19 14.601 10.834 9.801 1.00 0.00 H new ATOM 314 N ARG A 20 17.354 11.147 8.454 1.00 0.00 N ATOM 315 CA ARG A 20 18.730 11.715 8.497 1.00 0.00 C ATOM 316 C ARG A 20 18.785 12.969 7.625 1.00 0.00 C ATOM 317 O ARG A 20 19.504 13.898 7.934 1.00 0.00 O ATOM 318 CB ARG A 20 19.726 10.678 7.973 1.00 0.00 C ATOM 319 CG ARG A 20 21.150 11.101 8.338 1.00 0.00 C ATOM 320 CD ARG A 20 22.147 10.133 7.700 1.00 0.00 C ATOM 321 NE ARG A 20 23.535 10.573 8.013 1.00 0.00 N ATOM 322 CZ ARG A 20 24.551 9.955 7.476 1.00 0.00 C ATOM 323 NH1 ARG A 20 24.401 9.312 6.349 1.00 0.00 N ATOM 324 NH2 ARG A 20 25.717 9.982 8.063 1.00 0.00 N ATOM 0 H ARG A 20 17.283 10.231 8.011 1.00 0.00 H new ATOM 0 HA ARG A 20 18.988 11.975 9.523 1.00 0.00 H new ATOM 0 HB2 ARG A 20 19.506 9.700 8.400 1.00 0.00 H new ATOM 0 HB3 ARG A 20 19.631 10.582 6.891 1.00 0.00 H new ATOM 0 HG2 ARG A 20 21.340 12.117 7.991 1.00 0.00 H new ATOM 0 HG3 ARG A 20 21.273 11.106 9.421 1.00 0.00 H new ATOM 0 HD2 ARG A 20 21.981 9.123 8.075 1.00 0.00 H new ATOM 0 HD3 ARG A 20 21.999 10.100 6.621 1.00 0.00 H new ATOM 0 HE ARG A 20 23.691 11.357 8.647 1.00 0.00 H new ATOM 0 HH11 ARG A 20 23.490 9.293 5.890 1.00 0.00 H new ATOM 0 HH12 ARG A 20 25.194 8.829 5.928 1.00 0.00 H new ATOM 0 HH21 ARG A 20 25.834 10.486 8.942 1.00 0.00 H new ATOM 0 HH22 ARG A 20 26.511 9.499 7.643 1.00 0.00 H new ATOM 338 N GLU A 21 18.030 13.038 6.558 1.00 0.00 N ATOM 339 CA GLU A 21 18.062 14.281 5.723 1.00 0.00 C ATOM 340 C GLU A 21 16.684 14.535 5.112 1.00 0.00 C ATOM 341 O GLU A 21 16.189 15.644 5.124 1.00 0.00 O ATOM 342 CB GLU A 21 19.093 14.124 4.602 1.00 0.00 C ATOM 343 CG GLU A 21 20.485 13.927 5.203 1.00 0.00 C ATOM 344 CD GLU A 21 21.532 13.978 4.089 1.00 0.00 C ATOM 345 OE1 GLU A 21 21.591 13.038 3.314 1.00 0.00 O ATOM 346 OE2 GLU A 21 22.257 14.957 4.029 1.00 0.00 O ATOM 0 H GLU A 21 17.403 12.303 6.231 1.00 0.00 H new ATOM 0 HA GLU A 21 18.337 15.125 6.356 1.00 0.00 H new ATOM 0 HB2 GLU A 21 18.834 13.272 3.974 1.00 0.00 H new ATOM 0 HB3 GLU A 21 19.085 15.006 3.962 1.00 0.00 H new ATOM 0 HG2 GLU A 21 20.687 14.702 5.942 1.00 0.00 H new ATOM 0 HG3 GLU A 21 20.537 12.970 5.722 1.00 0.00 H new ATOM 353 N GLY A 22 16.058 13.526 4.577 1.00 0.00 N ATOM 354 CA GLY A 22 14.713 13.730 3.969 1.00 0.00 C ATOM 355 C GLY A 22 14.760 14.925 3.012 1.00 0.00 C ATOM 356 O GLY A 22 13.740 15.389 2.543 1.00 0.00 O ATOM 0 H GLY A 22 16.417 12.572 4.534 1.00 0.00 H new ATOM 0 HA2 GLY A 22 14.405 12.833 3.432 1.00 0.00 H new ATOM 0 HA3 GLY A 22 13.972 13.905 4.749 1.00 0.00 H new ATOM 360 N ASP A 23 15.933 15.428 2.713 1.00 0.00 N ATOM 361 CA ASP A 23 16.025 16.591 1.780 1.00 0.00 C ATOM 362 C ASP A 23 15.163 16.293 0.553 1.00 0.00 C ATOM 363 O ASP A 23 14.174 16.952 0.302 1.00 0.00 O ATOM 364 CB ASP A 23 17.479 16.795 1.350 1.00 0.00 C ATOM 365 CG ASP A 23 18.314 17.229 2.557 1.00 0.00 C ATOM 366 OD1 ASP A 23 17.814 17.127 3.665 1.00 0.00 O ATOM 367 OD2 ASP A 23 19.438 17.656 2.352 1.00 0.00 O ATOM 0 H ASP A 23 16.824 15.086 3.072 1.00 0.00 H new ATOM 0 HA ASP A 23 15.675 17.497 2.275 1.00 0.00 H new ATOM 0 HB2 ASP A 23 17.878 15.871 0.932 1.00 0.00 H new ATOM 0 HB3 ASP A 23 17.535 17.550 0.566 1.00 0.00 H new ATOM 372 N LYS A 24 15.505 15.275 -0.191 1.00 0.00 N ATOM 373 CA LYS A 24 14.677 14.904 -1.373 1.00 0.00 C ATOM 374 C LYS A 24 13.598 13.929 -0.897 1.00 0.00 C ATOM 375 O LYS A 24 13.621 13.467 0.226 1.00 0.00 O ATOM 376 CB LYS A 24 15.554 14.227 -2.430 1.00 0.00 C ATOM 377 CG LYS A 24 16.774 15.107 -2.728 1.00 0.00 C ATOM 378 CD LYS A 24 17.554 14.542 -3.933 1.00 0.00 C ATOM 379 CE LYS A 24 16.969 15.076 -5.253 1.00 0.00 C ATOM 380 NZ LYS A 24 17.228 14.091 -6.342 1.00 0.00 N ATOM 0 H LYS A 24 16.322 14.685 -0.031 1.00 0.00 H new ATOM 0 HA LYS A 24 14.225 15.791 -1.816 1.00 0.00 H new ATOM 0 HB2 LYS A 24 15.877 13.248 -2.076 1.00 0.00 H new ATOM 0 HB3 LYS A 24 14.980 14.063 -3.342 1.00 0.00 H new ATOM 0 HG2 LYS A 24 16.453 16.127 -2.939 1.00 0.00 H new ATOM 0 HG3 LYS A 24 17.423 15.151 -1.853 1.00 0.00 H new ATOM 0 HD2 LYS A 24 18.605 14.820 -3.856 1.00 0.00 H new ATOM 0 HD3 LYS A 24 17.510 13.453 -3.923 1.00 0.00 H new ATOM 0 HE2 LYS A 24 15.897 15.245 -5.147 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.420 16.037 -5.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 16.834 14.449 -7.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 18.253 13.952 -6.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 16.778 13.184 -6.104 1.00 0.00 H new ATOM 394 N HIS A 25 12.672 13.590 -1.755 1.00 0.00 N ATOM 395 CA HIS A 25 11.597 12.615 -1.389 1.00 0.00 C ATOM 396 C HIS A 25 11.724 11.422 -2.334 1.00 0.00 C ATOM 397 O HIS A 25 10.766 10.980 -2.937 1.00 0.00 O ATOM 398 CB HIS A 25 10.226 13.276 -1.555 1.00 0.00 C ATOM 399 CG HIS A 25 10.009 13.648 -2.996 1.00 0.00 C ATOM 400 ND1 HIS A 25 10.841 14.530 -3.666 1.00 0.00 N ATOM 401 CD2 HIS A 25 9.050 13.273 -3.904 1.00 0.00 C ATOM 402 CE1 HIS A 25 10.371 14.657 -4.920 1.00 0.00 C ATOM 403 NE2 HIS A 25 9.280 13.911 -5.119 1.00 0.00 N ATOM 0 H HIS A 25 12.613 13.951 -2.707 1.00 0.00 H new ATOM 0 HA HIS A 25 11.697 12.293 -0.353 1.00 0.00 H new ATOM 0 HB2 HIS A 25 9.442 12.595 -1.224 1.00 0.00 H new ATOM 0 HB3 HIS A 25 10.163 14.165 -0.927 1.00 0.00 H new ATOM 0 HD2 HIS A 25 8.240 12.587 -3.705 1.00 0.00 H new ATOM 0 HE1 HIS A 25 10.821 15.286 -5.674 1.00 0.00 H new ATOM 0 HE2 HIS A 25 8.734 13.827 -5.976 1.00 0.00 H new ATOM 411 N LYS A 26 12.920 10.901 -2.457 1.00 0.00 N ATOM 412 CA LYS A 26 13.167 9.731 -3.351 1.00 0.00 C ATOM 413 C LYS A 26 13.953 8.658 -2.590 1.00 0.00 C ATOM 414 O LYS A 26 14.770 8.968 -1.745 1.00 0.00 O ATOM 415 CB LYS A 26 13.990 10.188 -4.557 1.00 0.00 C ATOM 416 CG LYS A 26 13.144 11.119 -5.430 1.00 0.00 C ATOM 417 CD LYS A 26 14.054 11.870 -6.405 1.00 0.00 C ATOM 418 CE LYS A 26 13.200 12.669 -7.390 1.00 0.00 C ATOM 419 NZ LYS A 26 12.396 13.680 -6.645 1.00 0.00 N ATOM 0 H LYS A 26 13.747 11.243 -1.968 1.00 0.00 H new ATOM 0 HA LYS A 26 12.213 9.319 -3.682 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.890 10.704 -4.222 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.315 9.324 -5.137 1.00 0.00 H new ATOM 0 HG2 LYS A 26 12.400 10.543 -5.980 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.600 11.827 -4.805 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.718 12.539 -5.857 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.686 11.165 -6.945 1.00 0.00 H new ATOM 0 HE2 LYS A 26 13.838 13.164 -8.122 1.00 0.00 H new ATOM 0 HE3 LYS A 26 12.541 12.000 -7.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 11.390 13.418 -6.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 12.711 13.713 -5.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 12.525 14.616 -7.081 1.00 0.00 H new ATOM 433 N LEU A 27 13.721 7.402 -2.886 1.00 0.00 N ATOM 434 CA LEU A 27 14.462 6.295 -2.189 1.00 0.00 C ATOM 435 C LEU A 27 15.199 5.466 -3.251 1.00 0.00 C ATOM 436 O LEU A 27 14.681 5.216 -4.321 1.00 0.00 O ATOM 437 CB LEU A 27 13.444 5.414 -1.415 1.00 0.00 C ATOM 438 CG LEU A 27 13.884 5.225 0.048 1.00 0.00 C ATOM 439 CD1 LEU A 27 12.752 4.573 0.843 1.00 0.00 C ATOM 440 CD2 LEU A 27 15.120 4.325 0.102 1.00 0.00 C ATOM 0 H LEU A 27 13.046 7.091 -3.585 1.00 0.00 H new ATOM 0 HA LEU A 27 15.185 6.696 -1.479 1.00 0.00 H new ATOM 0 HB2 LEU A 27 12.458 5.878 -1.446 1.00 0.00 H new ATOM 0 HB3 LEU A 27 13.354 4.442 -1.901 1.00 0.00 H new ATOM 0 HG LEU A 27 14.122 6.198 0.479 1.00 0.00 H new ATOM 0 HD11 LEU A 27 13.065 4.440 1.879 1.00 0.00 H new ATOM 0 HD12 LEU A 27 11.869 5.212 0.810 1.00 0.00 H new ATOM 0 HD13 LEU A 27 12.514 3.602 0.408 1.00 0.00 H new ATOM 0 HD21 LEU A 27 15.429 4.193 1.139 1.00 0.00 H new ATOM 0 HD22 LEU A 27 14.882 3.354 -0.332 1.00 0.00 H new ATOM 0 HD23 LEU A 27 15.931 4.786 -0.462 1.00 0.00 H new ATOM 452 N LYS A 28 16.408 5.044 -2.971 1.00 0.00 N ATOM 453 CA LYS A 28 17.166 4.242 -3.980 1.00 0.00 C ATOM 454 C LYS A 28 16.797 2.763 -3.837 1.00 0.00 C ATOM 455 O LYS A 28 16.497 2.295 -2.757 1.00 0.00 O ATOM 456 CB LYS A 28 18.671 4.408 -3.746 1.00 0.00 C ATOM 457 CG LYS A 28 19.077 5.867 -3.982 1.00 0.00 C ATOM 458 CD LYS A 28 20.449 6.127 -3.353 1.00 0.00 C ATOM 459 CE LYS A 28 21.504 5.259 -4.043 1.00 0.00 C ATOM 460 NZ LYS A 28 22.865 5.744 -3.676 1.00 0.00 N ATOM 0 H LYS A 28 16.899 5.219 -2.094 1.00 0.00 H new ATOM 0 HA LYS A 28 16.911 4.591 -4.981 1.00 0.00 H new ATOM 0 HB2 LYS A 28 18.925 4.111 -2.729 1.00 0.00 H new ATOM 0 HB3 LYS A 28 19.227 3.753 -4.417 1.00 0.00 H new ATOM 0 HG2 LYS A 28 19.110 6.077 -5.051 1.00 0.00 H new ATOM 0 HG3 LYS A 28 18.334 6.536 -3.548 1.00 0.00 H new ATOM 0 HD2 LYS A 28 20.711 7.181 -3.450 1.00 0.00 H new ATOM 0 HD3 LYS A 28 20.420 5.903 -2.287 1.00 0.00 H new ATOM 0 HE2 LYS A 28 21.385 4.217 -3.745 1.00 0.00 H new ATOM 0 HE3 LYS A 28 21.372 5.298 -5.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 23.582 5.154 -4.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 22.976 6.732 -3.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 22.988 5.685 -2.645 1.00 0.00 H new ATOM 474 N LYS A 29 16.824 2.016 -4.905 1.00 0.00 N ATOM 475 CA LYS A 29 16.482 0.570 -4.804 1.00 0.00 C ATOM 476 C LYS A 29 17.409 -0.111 -3.788 1.00 0.00 C ATOM 477 O LYS A 29 16.995 -0.944 -3.008 1.00 0.00 O ATOM 478 CB LYS A 29 16.674 -0.082 -6.180 1.00 0.00 C ATOM 479 CG LYS A 29 18.173 -0.160 -6.516 1.00 0.00 C ATOM 480 CD LYS A 29 18.361 -0.386 -8.021 1.00 0.00 C ATOM 481 CE LYS A 29 19.765 -0.934 -8.293 1.00 0.00 C ATOM 482 NZ LYS A 29 20.772 -0.097 -7.584 1.00 0.00 N ATOM 0 H LYS A 29 17.067 2.343 -5.840 1.00 0.00 H new ATOM 0 HA LYS A 29 15.448 0.460 -4.478 1.00 0.00 H new ATOM 0 HB2 LYS A 29 16.239 -1.081 -6.183 1.00 0.00 H new ATOM 0 HB3 LYS A 29 16.151 0.495 -6.942 1.00 0.00 H new ATOM 0 HG2 LYS A 29 18.671 0.761 -6.213 1.00 0.00 H new ATOM 0 HG3 LYS A 29 18.638 -0.972 -5.957 1.00 0.00 H new ATOM 0 HD2 LYS A 29 17.610 -1.085 -8.389 1.00 0.00 H new ATOM 0 HD3 LYS A 29 18.216 0.551 -8.559 1.00 0.00 H new ATOM 0 HE2 LYS A 29 19.835 -1.968 -7.956 1.00 0.00 H new ATOM 0 HE3 LYS A 29 19.966 -0.933 -9.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 21.710 -0.250 -8.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.513 0.906 -7.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.798 -0.362 -6.579 1.00 0.00 H new ATOM 496 N SER A 30 18.666 0.234 -3.817 1.00 0.00 N ATOM 497 CA SER A 30 19.652 -0.386 -2.886 1.00 0.00 C ATOM 498 C SER A 30 19.243 -0.172 -1.426 1.00 0.00 C ATOM 499 O SER A 30 19.384 -1.053 -0.594 1.00 0.00 O ATOM 500 CB SER A 30 21.021 0.257 -3.111 1.00 0.00 C ATOM 501 OG SER A 30 21.395 0.103 -4.474 1.00 0.00 O ATOM 0 H SER A 30 19.058 0.928 -4.454 1.00 0.00 H new ATOM 0 HA SER A 30 19.688 -1.457 -3.086 1.00 0.00 H new ATOM 0 HB2 SER A 30 20.986 1.314 -2.849 1.00 0.00 H new ATOM 0 HB3 SER A 30 21.764 -0.208 -2.463 1.00 0.00 H new ATOM 0 HG SER A 30 22.271 0.516 -4.621 1.00 0.00 H new ATOM 507 N GLU A 31 18.738 0.990 -1.096 1.00 0.00 N ATOM 508 CA GLU A 31 18.344 1.233 0.323 1.00 0.00 C ATOM 509 C GLU A 31 16.978 0.599 0.573 1.00 0.00 C ATOM 510 O GLU A 31 16.702 0.081 1.637 1.00 0.00 O ATOM 511 CB GLU A 31 18.288 2.735 0.610 1.00 0.00 C ATOM 512 CG GLU A 31 19.685 3.338 0.455 1.00 0.00 C ATOM 513 CD GLU A 31 19.650 4.812 0.860 1.00 0.00 C ATOM 514 OE1 GLU A 31 18.831 5.535 0.317 1.00 0.00 O ATOM 515 OE2 GLU A 31 20.442 5.194 1.706 1.00 0.00 O ATOM 0 H GLU A 31 18.584 1.769 -1.737 1.00 0.00 H new ATOM 0 HA GLU A 31 19.084 0.786 0.987 1.00 0.00 H new ATOM 0 HB2 GLU A 31 17.593 3.221 -0.075 1.00 0.00 H new ATOM 0 HB3 GLU A 31 17.915 2.909 1.619 1.00 0.00 H new ATOM 0 HG2 GLU A 31 20.398 2.796 1.076 1.00 0.00 H new ATOM 0 HG3 GLU A 31 20.023 3.241 -0.577 1.00 0.00 H new ATOM 522 N LEU A 32 16.128 0.622 -0.418 1.00 0.00 N ATOM 523 CA LEU A 32 14.786 0.005 -0.263 1.00 0.00 C ATOM 524 C LEU A 32 14.976 -1.482 0.033 1.00 0.00 C ATOM 525 O LEU A 32 14.328 -2.030 0.902 1.00 0.00 O ATOM 526 CB LEU A 32 13.977 0.204 -1.553 1.00 0.00 C ATOM 527 CG LEU A 32 12.701 -0.649 -1.537 1.00 0.00 C ATOM 528 CD1 LEU A 32 11.879 -0.336 -0.283 1.00 0.00 C ATOM 529 CD2 LEU A 32 11.871 -0.327 -2.783 1.00 0.00 C ATOM 0 H LEU A 32 16.309 1.043 -1.329 1.00 0.00 H new ATOM 0 HA LEU A 32 14.239 0.472 0.556 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.714 1.256 -1.664 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.588 -0.064 -2.415 1.00 0.00 H new ATOM 0 HG LEU A 32 12.970 -1.705 -1.531 1.00 0.00 H new ATOM 0 HD11 LEU A 32 10.975 -0.945 -0.279 1.00 0.00 H new ATOM 0 HD12 LEU A 32 12.471 -0.559 0.605 1.00 0.00 H new ATOM 0 HD13 LEU A 32 11.605 0.719 -0.281 1.00 0.00 H new ATOM 0 HD21 LEU A 32 10.962 -0.929 -2.780 1.00 0.00 H new ATOM 0 HD22 LEU A 32 11.606 0.730 -2.781 1.00 0.00 H new ATOM 0 HD23 LEU A 32 12.453 -0.553 -3.676 1.00 0.00 H new ATOM 541 N LYS A 33 15.839 -2.156 -0.681 1.00 0.00 N ATOM 542 CA LYS A 33 16.017 -3.608 -0.417 1.00 0.00 C ATOM 543 C LYS A 33 16.325 -3.805 1.064 1.00 0.00 C ATOM 544 O LYS A 33 15.636 -4.520 1.763 1.00 0.00 O ATOM 545 CB LYS A 33 17.172 -4.151 -1.263 1.00 0.00 C ATOM 546 CG LYS A 33 17.331 -5.655 -1.012 1.00 0.00 C ATOM 547 CD LYS A 33 18.428 -6.211 -1.922 1.00 0.00 C ATOM 548 CE LYS A 33 18.651 -7.691 -1.607 1.00 0.00 C ATOM 549 NZ LYS A 33 19.131 -7.834 -0.204 1.00 0.00 N ATOM 0 H LYS A 33 16.419 -1.768 -1.425 1.00 0.00 H new ATOM 0 HA LYS A 33 15.106 -4.145 -0.679 1.00 0.00 H new ATOM 0 HB2 LYS A 33 16.980 -3.967 -2.320 1.00 0.00 H new ATOM 0 HB3 LYS A 33 18.096 -3.630 -1.012 1.00 0.00 H new ATOM 0 HG2 LYS A 33 17.584 -5.835 0.033 1.00 0.00 H new ATOM 0 HG3 LYS A 33 16.389 -6.168 -1.205 1.00 0.00 H new ATOM 0 HD2 LYS A 33 18.144 -6.090 -2.967 1.00 0.00 H new ATOM 0 HD3 LYS A 33 19.353 -5.654 -1.776 1.00 0.00 H new ATOM 0 HE2 LYS A 33 17.723 -8.247 -1.743 1.00 0.00 H new ATOM 0 HE3 LYS A 33 19.381 -8.115 -2.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 19.612 -8.749 -0.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 19.795 -7.065 0.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 18.321 -7.788 0.446 1.00 0.00 H new ATOM 563 N GLU A 34 17.362 -3.178 1.548 1.00 0.00 N ATOM 564 CA GLU A 34 17.712 -3.337 2.991 1.00 0.00 C ATOM 565 C GLU A 34 16.452 -3.116 3.836 1.00 0.00 C ATOM 566 O GLU A 34 16.244 -3.769 4.840 1.00 0.00 O ATOM 567 CB GLU A 34 18.778 -2.303 3.372 1.00 0.00 C ATOM 568 CG GLU A 34 19.336 -2.611 4.766 1.00 0.00 C ATOM 569 CD GLU A 34 18.317 -2.202 5.832 1.00 0.00 C ATOM 570 OE1 GLU A 34 17.632 -1.215 5.622 1.00 0.00 O ATOM 571 OE2 GLU A 34 18.242 -2.883 6.842 1.00 0.00 O ATOM 0 H GLU A 34 17.979 -2.567 1.013 1.00 0.00 H new ATOM 0 HA GLU A 34 18.103 -4.338 3.171 1.00 0.00 H new ATOM 0 HB2 GLU A 34 19.584 -2.313 2.639 1.00 0.00 H new ATOM 0 HB3 GLU A 34 18.347 -1.302 3.357 1.00 0.00 H new ATOM 0 HG2 GLU A 34 19.559 -3.674 4.852 1.00 0.00 H new ATOM 0 HG3 GLU A 34 20.273 -2.075 4.920 1.00 0.00 H new ATOM 578 N LEU A 35 15.609 -2.207 3.435 1.00 0.00 N ATOM 579 CA LEU A 35 14.361 -1.945 4.209 1.00 0.00 C ATOM 580 C LEU A 35 13.419 -3.152 4.096 1.00 0.00 C ATOM 581 O LEU A 35 12.748 -3.508 5.044 1.00 0.00 O ATOM 582 CB LEU A 35 13.683 -0.677 3.664 1.00 0.00 C ATOM 583 CG LEU A 35 12.542 -0.203 4.608 1.00 0.00 C ATOM 584 CD1 LEU A 35 12.454 1.328 4.597 1.00 0.00 C ATOM 585 CD2 LEU A 35 11.192 -0.773 4.147 1.00 0.00 C ATOM 0 H LEU A 35 15.730 -1.631 2.602 1.00 0.00 H new ATOM 0 HA LEU A 35 14.603 -1.793 5.261 1.00 0.00 H new ATOM 0 HB2 LEU A 35 14.422 0.116 3.555 1.00 0.00 H new ATOM 0 HB3 LEU A 35 13.279 -0.875 2.671 1.00 0.00 H new ATOM 0 HG LEU A 35 12.765 -0.558 5.614 1.00 0.00 H new ATOM 0 HD11 LEU A 35 11.652 1.651 5.261 1.00 0.00 H new ATOM 0 HD12 LEU A 35 13.400 1.749 4.938 1.00 0.00 H new ATOM 0 HD13 LEU A 35 12.248 1.673 3.584 1.00 0.00 H new ATOM 0 HD21 LEU A 35 10.404 -0.431 4.819 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.979 -0.430 3.134 1.00 0.00 H new ATOM 0 HD23 LEU A 35 11.233 -1.862 4.160 1.00 0.00 H new ATOM 597 N ILE A 36 13.372 -3.799 2.962 1.00 0.00 N ATOM 598 CA ILE A 36 12.486 -4.994 2.813 1.00 0.00 C ATOM 599 C ILE A 36 12.920 -6.088 3.795 1.00 0.00 C ATOM 600 O ILE A 36 12.109 -6.839 4.300 1.00 0.00 O ATOM 601 CB ILE A 36 12.613 -5.524 1.377 1.00 0.00 C ATOM 602 CG1 ILE A 36 12.046 -4.472 0.413 1.00 0.00 C ATOM 603 CG2 ILE A 36 11.823 -6.836 1.230 1.00 0.00 C ATOM 604 CD1 ILE A 36 12.240 -4.920 -1.040 1.00 0.00 C ATOM 0 H ILE A 36 13.909 -3.552 2.131 1.00 0.00 H new ATOM 0 HA ILE A 36 11.454 -4.714 3.023 1.00 0.00 H new ATOM 0 HB ILE A 36 13.661 -5.717 1.147 1.00 0.00 H new ATOM 0 HG12 ILE A 36 10.986 -4.318 0.615 1.00 0.00 H new ATOM 0 HG13 ILE A 36 12.543 -3.516 0.575 1.00 0.00 H new ATOM 0 HG21 ILE A 36 11.918 -7.205 0.209 1.00 0.00 H new ATOM 0 HG22 ILE A 36 12.219 -7.579 1.923 1.00 0.00 H new ATOM 0 HG23 ILE A 36 10.772 -6.655 1.454 1.00 0.00 H new ATOM 0 HD11 ILE A 36 11.833 -4.164 -1.711 1.00 0.00 H new ATOM 0 HD12 ILE A 36 13.303 -5.050 -1.242 1.00 0.00 H new ATOM 0 HD13 ILE A 36 11.722 -5.865 -1.202 1.00 0.00 H new ATOM 616 N ASN A 37 14.196 -6.214 4.031 1.00 0.00 N ATOM 617 CA ASN A 37 14.689 -7.294 4.935 1.00 0.00 C ATOM 618 C ASN A 37 14.237 -7.075 6.384 1.00 0.00 C ATOM 619 O ASN A 37 13.764 -7.984 7.036 1.00 0.00 O ATOM 620 CB ASN A 37 16.219 -7.321 4.892 1.00 0.00 C ATOM 621 CG ASN A 37 16.731 -8.479 5.748 1.00 0.00 C ATOM 622 OD1 ASN A 37 17.505 -8.278 6.662 1.00 0.00 O ATOM 623 ND2 ASN A 37 16.329 -9.693 5.489 1.00 0.00 N ATOM 0 H ASN A 37 14.921 -5.615 3.637 1.00 0.00 H new ATOM 0 HA ASN A 37 14.272 -8.240 4.589 1.00 0.00 H new ATOM 0 HB2 ASN A 37 16.563 -7.435 3.864 1.00 0.00 H new ATOM 0 HB3 ASN A 37 16.621 -6.377 5.260 1.00 0.00 H new ATOM 0 HD21 ASN A 37 16.665 -10.473 6.054 1.00 0.00 H new ATOM 0 HD22 ASN A 37 15.679 -9.862 4.721 1.00 0.00 H new ATOM 630 N ASN A 38 14.417 -5.894 6.908 1.00 0.00 N ATOM 631 CA ASN A 38 14.039 -5.637 8.333 1.00 0.00 C ATOM 632 C ASN A 38 12.563 -5.241 8.459 1.00 0.00 C ATOM 633 O ASN A 38 12.118 -4.880 9.530 1.00 0.00 O ATOM 634 CB ASN A 38 14.913 -4.507 8.882 1.00 0.00 C ATOM 635 CG ASN A 38 14.683 -4.362 10.387 1.00 0.00 C ATOM 636 OD1 ASN A 38 14.386 -5.326 11.065 1.00 0.00 O ATOM 637 ND2 ASN A 38 14.813 -3.188 10.943 1.00 0.00 N ATOM 0 H ASN A 38 14.810 -5.093 6.413 1.00 0.00 H new ATOM 0 HA ASN A 38 14.193 -6.554 8.901 1.00 0.00 H new ATOM 0 HB2 ASN A 38 15.964 -4.718 8.684 1.00 0.00 H new ATOM 0 HB3 ASN A 38 14.675 -3.571 8.376 1.00 0.00 H new ATOM 0 HD21 ASN A 38 14.665 -3.080 11.946 1.00 0.00 H new ATOM 0 HD22 ASN A 38 15.062 -2.379 10.374 1.00 0.00 H new ATOM 644 N GLU A 39 11.801 -5.286 7.391 1.00 0.00 N ATOM 645 CA GLU A 39 10.352 -4.887 7.478 1.00 0.00 C ATOM 646 C GLU A 39 9.439 -5.997 6.945 1.00 0.00 C ATOM 647 O GLU A 39 8.298 -6.102 7.352 1.00 0.00 O ATOM 648 CB GLU A 39 10.140 -3.618 6.653 1.00 0.00 C ATOM 649 CG GLU A 39 10.949 -2.472 7.266 1.00 0.00 C ATOM 650 CD GLU A 39 10.359 -2.091 8.626 1.00 0.00 C ATOM 651 OE1 GLU A 39 10.733 -2.710 9.608 1.00 0.00 O ATOM 652 OE2 GLU A 39 9.546 -1.182 8.662 1.00 0.00 O ATOM 0 H GLU A 39 12.114 -5.580 6.466 1.00 0.00 H new ATOM 0 HA GLU A 39 10.100 -4.711 8.524 1.00 0.00 H new ATOM 0 HB2 GLU A 39 10.450 -3.786 5.622 1.00 0.00 H new ATOM 0 HB3 GLU A 39 9.082 -3.359 6.630 1.00 0.00 H new ATOM 0 HG2 GLU A 39 11.991 -2.771 7.382 1.00 0.00 H new ATOM 0 HG3 GLU A 39 10.938 -1.609 6.600 1.00 0.00 H new ATOM 659 N LEU A 40 9.919 -6.829 6.051 1.00 0.00 N ATOM 660 CA LEU A 40 9.063 -7.938 5.504 1.00 0.00 C ATOM 661 C LEU A 40 9.686 -9.285 5.880 1.00 0.00 C ATOM 662 O LEU A 40 9.441 -10.297 5.251 1.00 0.00 O ATOM 663 CB LEU A 40 8.974 -7.808 3.971 1.00 0.00 C ATOM 664 CG LEU A 40 7.871 -6.794 3.588 1.00 0.00 C ATOM 665 CD1 LEU A 40 8.176 -6.183 2.214 1.00 0.00 C ATOM 666 CD2 LEU A 40 6.503 -7.499 3.533 1.00 0.00 C ATOM 0 H LEU A 40 10.866 -6.791 5.675 1.00 0.00 H new ATOM 0 HA LEU A 40 8.060 -7.875 5.925 1.00 0.00 H new ATOM 0 HB2 LEU A 40 9.934 -7.483 3.569 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.756 -8.780 3.528 1.00 0.00 H new ATOM 0 HG LEU A 40 7.845 -6.006 4.341 1.00 0.00 H new ATOM 0 HD11 LEU A 40 7.395 -5.470 1.951 1.00 0.00 H new ATOM 0 HD12 LEU A 40 9.138 -5.671 2.249 1.00 0.00 H new ATOM 0 HD13 LEU A 40 8.213 -6.973 1.464 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.732 -6.777 3.263 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.533 -8.294 2.788 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.274 -7.926 4.510 1.00 0.00 H new ATOM 678 N SER A 41 10.487 -9.301 6.908 1.00 0.00 N ATOM 679 CA SER A 41 11.130 -10.571 7.344 1.00 0.00 C ATOM 680 C SER A 41 10.079 -11.485 7.980 1.00 0.00 C ATOM 681 O SER A 41 10.239 -12.688 8.027 1.00 0.00 O ATOM 682 CB SER A 41 12.222 -10.262 8.372 1.00 0.00 C ATOM 683 OG SER A 41 12.353 -11.362 9.264 1.00 0.00 O ATOM 0 H SER A 41 10.725 -8.483 7.469 1.00 0.00 H new ATOM 0 HA SER A 41 11.571 -11.069 6.480 1.00 0.00 H new ATOM 0 HB2 SER A 41 13.170 -10.073 7.867 1.00 0.00 H new ATOM 0 HB3 SER A 41 11.970 -9.358 8.926 1.00 0.00 H new ATOM 0 HG SER A 41 13.052 -11.168 9.922 1.00 0.00 H new ATOM 689 N HIS A 42 9.008 -10.925 8.476 1.00 0.00 N ATOM 690 CA HIS A 42 7.954 -11.764 9.116 1.00 0.00 C ATOM 691 C HIS A 42 7.179 -12.540 8.047 1.00 0.00 C ATOM 692 O HIS A 42 6.988 -13.735 8.152 1.00 0.00 O ATOM 693 CB HIS A 42 6.989 -10.860 9.886 1.00 0.00 C ATOM 694 CG HIS A 42 5.911 -11.694 10.520 1.00 0.00 C ATOM 695 ND1 HIS A 42 5.837 -13.067 10.345 1.00 0.00 N ATOM 696 CD2 HIS A 42 4.857 -11.362 11.336 1.00 0.00 C ATOM 697 CE1 HIS A 42 4.772 -13.507 11.042 1.00 0.00 C ATOM 698 NE2 HIS A 42 4.140 -12.508 11.664 1.00 0.00 N ATOM 0 H HIS A 42 8.818 -9.923 8.466 1.00 0.00 H new ATOM 0 HA HIS A 42 8.425 -12.472 9.799 1.00 0.00 H new ATOM 0 HB2 HIS A 42 7.529 -10.303 10.652 1.00 0.00 H new ATOM 0 HB3 HIS A 42 6.546 -10.127 9.212 1.00 0.00 H new ATOM 0 HD1 HIS A 42 6.473 -13.639 9.790 1.00 0.00 H new ATOM 0 HD2 HIS A 42 4.621 -10.363 11.672 1.00 0.00 H new ATOM 0 HE1 HIS A 42 4.466 -14.542 11.092 1.00 0.00 H new ATOM 706 N PHE A 43 6.722 -11.870 7.024 1.00 0.00 N ATOM 707 CA PHE A 43 5.952 -12.573 5.959 1.00 0.00 C ATOM 708 C PHE A 43 6.876 -13.521 5.191 1.00 0.00 C ATOM 709 O PHE A 43 6.430 -14.428 4.518 1.00 0.00 O ATOM 710 CB PHE A 43 5.354 -11.543 5.000 1.00 0.00 C ATOM 711 CG PHE A 43 4.226 -10.812 5.691 1.00 0.00 C ATOM 712 CD1 PHE A 43 4.507 -9.750 6.560 1.00 0.00 C ATOM 713 CD2 PHE A 43 2.898 -11.197 5.465 1.00 0.00 C ATOM 714 CE1 PHE A 43 3.462 -9.074 7.201 1.00 0.00 C ATOM 715 CE2 PHE A 43 1.854 -10.520 6.106 1.00 0.00 C ATOM 716 CZ PHE A 43 2.136 -9.459 6.974 1.00 0.00 C ATOM 0 H PHE A 43 6.848 -10.868 6.880 1.00 0.00 H new ATOM 0 HA PHE A 43 5.149 -13.152 6.415 1.00 0.00 H new ATOM 0 HB2 PHE A 43 6.121 -10.836 4.683 1.00 0.00 H new ATOM 0 HB3 PHE A 43 4.986 -12.037 4.101 1.00 0.00 H new ATOM 0 HD1 PHE A 43 5.530 -9.453 6.736 1.00 0.00 H new ATOM 0 HD2 PHE A 43 2.680 -12.016 4.796 1.00 0.00 H new ATOM 0 HE1 PHE A 43 3.679 -8.255 7.871 1.00 0.00 H new ATOM 0 HE2 PHE A 43 0.830 -10.817 5.931 1.00 0.00 H new ATOM 0 HZ PHE A 43 1.330 -8.937 7.469 1.00 0.00 H new ATOM 726 N LEU A 44 8.160 -13.309 5.278 1.00 0.00 N ATOM 727 CA LEU A 44 9.115 -14.188 4.544 1.00 0.00 C ATOM 728 C LEU A 44 8.773 -15.658 4.822 1.00 0.00 C ATOM 729 O LEU A 44 9.064 -16.533 4.030 1.00 0.00 O ATOM 730 CB LEU A 44 10.551 -13.869 5.014 1.00 0.00 C ATOM 731 CG LEU A 44 11.562 -14.002 3.857 1.00 0.00 C ATOM 732 CD1 LEU A 44 11.467 -15.403 3.241 1.00 0.00 C ATOM 733 CD2 LEU A 44 11.298 -12.929 2.776 1.00 0.00 C ATOM 0 H LEU A 44 8.590 -12.564 5.826 1.00 0.00 H new ATOM 0 HA LEU A 44 9.042 -14.010 3.471 1.00 0.00 H new ATOM 0 HB2 LEU A 44 10.588 -12.857 5.417 1.00 0.00 H new ATOM 0 HB3 LEU A 44 10.830 -14.545 5.823 1.00 0.00 H new ATOM 0 HG LEU A 44 12.566 -13.851 4.254 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.184 -15.491 2.424 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.691 -16.151 4.002 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.459 -15.565 2.858 1.00 0.00 H new ATOM 0 HD21 LEU A 44 12.022 -13.040 1.969 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.290 -13.052 2.379 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.395 -11.937 3.217 1.00 0.00 H new ATOM 745 N GLU A 45 8.161 -15.936 5.939 1.00 0.00 N ATOM 746 CA GLU A 45 7.809 -17.347 6.262 1.00 0.00 C ATOM 747 C GLU A 45 6.558 -17.763 5.486 1.00 0.00 C ATOM 748 O GLU A 45 6.451 -18.878 5.015 1.00 0.00 O ATOM 749 CB GLU A 45 7.543 -17.474 7.764 1.00 0.00 C ATOM 750 CG GLU A 45 7.417 -18.952 8.139 1.00 0.00 C ATOM 751 CD GLU A 45 6.943 -19.072 9.589 1.00 0.00 C ATOM 752 OE1 GLU A 45 7.119 -18.118 10.329 1.00 0.00 O ATOM 753 OE2 GLU A 45 6.413 -20.115 9.934 1.00 0.00 O ATOM 0 H GLU A 45 7.890 -15.248 6.642 1.00 0.00 H new ATOM 0 HA GLU A 45 8.637 -17.997 5.980 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.354 -17.013 8.328 1.00 0.00 H new ATOM 0 HB3 GLU A 45 6.629 -16.942 8.028 1.00 0.00 H new ATOM 0 HG2 GLU A 45 6.712 -19.448 7.472 1.00 0.00 H new ATOM 0 HG3 GLU A 45 8.378 -19.452 8.017 1.00 0.00 H new ATOM 760 N GLU A 46 5.604 -16.880 5.361 1.00 0.00 N ATOM 761 CA GLU A 46 4.347 -17.226 4.628 1.00 0.00 C ATOM 762 C GLU A 46 4.486 -16.885 3.139 1.00 0.00 C ATOM 763 O GLU A 46 3.703 -16.133 2.594 1.00 0.00 O ATOM 764 CB GLU A 46 3.185 -16.427 5.221 1.00 0.00 C ATOM 765 CG GLU A 46 3.029 -16.780 6.702 1.00 0.00 C ATOM 766 CD GLU A 46 1.846 -16.009 7.288 1.00 0.00 C ATOM 767 OE1 GLU A 46 0.766 -16.109 6.731 1.00 0.00 O ATOM 768 OE2 GLU A 46 2.042 -15.330 8.282 1.00 0.00 O ATOM 0 H GLU A 46 5.639 -15.932 5.735 1.00 0.00 H new ATOM 0 HA GLU A 46 4.159 -18.295 4.730 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.369 -15.359 5.108 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.264 -16.651 4.683 1.00 0.00 H new ATOM 0 HG2 GLU A 46 2.871 -17.852 6.816 1.00 0.00 H new ATOM 0 HG3 GLU A 46 3.942 -16.533 7.244 1.00 0.00 H new ATOM 775 N ILE A 47 5.465 -17.452 2.476 1.00 0.00 N ATOM 776 CA ILE A 47 5.660 -17.191 1.011 1.00 0.00 C ATOM 777 C ILE A 47 5.494 -18.510 0.257 1.00 0.00 C ATOM 778 O ILE A 47 6.366 -19.356 0.279 1.00 0.00 O ATOM 779 CB ILE A 47 7.075 -16.654 0.766 1.00 0.00 C ATOM 780 CG1 ILE A 47 7.323 -15.406 1.628 1.00 0.00 C ATOM 781 CG2 ILE A 47 7.247 -16.302 -0.714 1.00 0.00 C ATOM 782 CD1 ILE A 47 6.237 -14.351 1.381 1.00 0.00 C ATOM 0 H ILE A 47 6.144 -18.091 2.889 1.00 0.00 H new ATOM 0 HA ILE A 47 4.930 -16.459 0.666 1.00 0.00 H new ATOM 0 HB ILE A 47 7.797 -17.423 1.040 1.00 0.00 H new ATOM 0 HG12 ILE A 47 7.335 -15.683 2.682 1.00 0.00 H new ATOM 0 HG13 ILE A 47 8.303 -14.987 1.397 1.00 0.00 H new ATOM 0 HG21 ILE A 47 8.254 -15.921 -0.883 1.00 0.00 H new ATOM 0 HG22 ILE A 47 7.090 -17.194 -1.321 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.519 -15.540 -0.994 1.00 0.00 H new ATOM 0 HD11 ILE A 47 6.432 -13.476 2.001 1.00 0.00 H new ATOM 0 HD12 ILE A 47 6.245 -14.060 0.331 1.00 0.00 H new ATOM 0 HD13 ILE A 47 5.262 -14.766 1.636 1.00 0.00 H new ATOM 794 N LYS A 48 4.384 -18.704 -0.406 1.00 0.00 N ATOM 795 CA LYS A 48 4.183 -19.983 -1.149 1.00 0.00 C ATOM 796 C LYS A 48 4.855 -19.879 -2.519 1.00 0.00 C ATOM 797 O LYS A 48 5.632 -20.730 -2.907 1.00 0.00 O ATOM 798 CB LYS A 48 2.686 -20.245 -1.327 1.00 0.00 C ATOM 799 CG LYS A 48 2.072 -20.639 0.018 1.00 0.00 C ATOM 800 CD LYS A 48 0.545 -20.606 -0.085 1.00 0.00 C ATOM 801 CE LYS A 48 -0.064 -20.840 1.298 1.00 0.00 C ATOM 802 NZ LYS A 48 0.447 -22.124 1.853 1.00 0.00 N ATOM 0 H LYS A 48 3.614 -18.038 -0.465 1.00 0.00 H new ATOM 0 HA LYS A 48 4.625 -20.806 -0.587 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.194 -19.354 -1.716 1.00 0.00 H new ATOM 0 HB3 LYS A 48 2.530 -21.039 -2.057 1.00 0.00 H new ATOM 0 HG2 LYS A 48 2.406 -21.637 0.303 1.00 0.00 H new ATOM 0 HG3 LYS A 48 2.409 -19.955 0.797 1.00 0.00 H new ATOM 0 HD2 LYS A 48 0.217 -19.645 -0.481 1.00 0.00 H new ATOM 0 HD3 LYS A 48 0.200 -21.371 -0.780 1.00 0.00 H new ATOM 0 HE2 LYS A 48 0.192 -20.016 1.964 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -1.151 -20.868 1.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -0.163 -22.430 2.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 0.443 -22.850 1.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 1.418 -21.990 2.201 1.00 0.00 H new ATOM 816 N GLU A 49 4.569 -18.836 -3.254 1.00 0.00 N ATOM 817 CA GLU A 49 5.199 -18.671 -4.595 1.00 0.00 C ATOM 818 C GLU A 49 6.575 -18.023 -4.426 1.00 0.00 C ATOM 819 O GLU A 49 6.683 -16.831 -4.212 1.00 0.00 O ATOM 820 CB GLU A 49 4.318 -17.776 -5.470 1.00 0.00 C ATOM 821 CG GLU A 49 3.028 -18.518 -5.833 1.00 0.00 C ATOM 822 CD GLU A 49 2.139 -18.637 -4.593 1.00 0.00 C ATOM 823 OE1 GLU A 49 1.980 -17.644 -3.903 1.00 0.00 O ATOM 824 OE2 GLU A 49 1.630 -19.720 -4.356 1.00 0.00 O ATOM 0 H GLU A 49 3.926 -18.092 -2.982 1.00 0.00 H new ATOM 0 HA GLU A 49 5.307 -19.646 -5.071 1.00 0.00 H new ATOM 0 HB2 GLU A 49 4.081 -16.853 -4.941 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.855 -17.495 -6.376 1.00 0.00 H new ATOM 0 HG2 GLU A 49 2.499 -17.984 -6.622 1.00 0.00 H new ATOM 0 HG3 GLU A 49 3.263 -19.509 -6.221 1.00 0.00 H new ATOM 831 N GLN A 50 7.629 -18.785 -4.522 1.00 0.00 N ATOM 832 CA GLN A 50 8.989 -18.193 -4.368 1.00 0.00 C ATOM 833 C GLN A 50 9.396 -17.503 -5.673 1.00 0.00 C ATOM 834 O GLN A 50 10.255 -16.644 -5.687 1.00 0.00 O ATOM 835 CB GLN A 50 9.992 -19.303 -4.044 1.00 0.00 C ATOM 836 CG GLN A 50 9.614 -19.960 -2.714 1.00 0.00 C ATOM 837 CD GLN A 50 10.722 -20.921 -2.283 1.00 0.00 C ATOM 838 OE1 GLN A 50 11.848 -20.807 -2.724 1.00 0.00 O ATOM 839 NE2 GLN A 50 10.449 -21.872 -1.432 1.00 0.00 N ATOM 0 H GLN A 50 7.609 -19.789 -4.700 1.00 0.00 H new ATOM 0 HA GLN A 50 8.979 -17.463 -3.559 1.00 0.00 H new ATOM 0 HB2 GLN A 50 9.997 -20.047 -4.841 1.00 0.00 H new ATOM 0 HB3 GLN A 50 11.000 -18.892 -3.985 1.00 0.00 H new ATOM 0 HG2 GLN A 50 9.463 -19.197 -1.950 1.00 0.00 H new ATOM 0 HG3 GLN A 50 8.672 -20.498 -2.818 1.00 0.00 H new ATOM 0 HE21 GLN A 50 9.504 -21.969 -1.061 1.00 0.00 H new ATOM 0 HE22 GLN A 50 11.181 -22.519 -1.138 1.00 0.00 H new ATOM 848 N GLU A 51 8.791 -17.872 -6.768 1.00 0.00 N ATOM 849 CA GLU A 51 9.150 -17.238 -8.070 1.00 0.00 C ATOM 850 C GLU A 51 8.596 -15.811 -8.136 1.00 0.00 C ATOM 851 O GLU A 51 9.103 -14.983 -8.866 1.00 0.00 O ATOM 852 CB GLU A 51 8.605 -18.070 -9.233 1.00 0.00 C ATOM 853 CG GLU A 51 9.251 -19.456 -9.220 1.00 0.00 C ATOM 854 CD GLU A 51 10.745 -19.327 -9.517 1.00 0.00 C ATOM 855 OE1 GLU A 51 11.086 -18.595 -10.431 1.00 0.00 O ATOM 856 OE2 GLU A 51 11.524 -19.964 -8.826 1.00 0.00 O ATOM 0 H GLU A 51 8.063 -18.585 -6.819 1.00 0.00 H new ATOM 0 HA GLU A 51 10.236 -17.196 -8.149 1.00 0.00 H new ATOM 0 HB2 GLU A 51 7.522 -18.162 -9.151 1.00 0.00 H new ATOM 0 HB3 GLU A 51 8.812 -17.570 -10.179 1.00 0.00 H new ATOM 0 HG2 GLU A 51 9.102 -19.929 -8.249 1.00 0.00 H new ATOM 0 HG3 GLU A 51 8.776 -20.097 -9.963 1.00 0.00 H new ATOM 863 N VAL A 52 7.593 -15.492 -7.365 1.00 0.00 N ATOM 864 CA VAL A 52 7.072 -14.094 -7.387 1.00 0.00 C ATOM 865 C VAL A 52 8.065 -13.206 -6.637 1.00 0.00 C ATOM 866 O VAL A 52 8.479 -12.177 -7.131 1.00 0.00 O ATOM 867 CB VAL A 52 5.710 -14.029 -6.688 1.00 0.00 C ATOM 868 CG1 VAL A 52 5.283 -12.567 -6.530 1.00 0.00 C ATOM 869 CG2 VAL A 52 4.668 -14.768 -7.527 1.00 0.00 C ATOM 0 H VAL A 52 7.116 -16.129 -6.728 1.00 0.00 H new ATOM 0 HA VAL A 52 6.954 -13.758 -8.417 1.00 0.00 H new ATOM 0 HB VAL A 52 5.788 -14.496 -5.706 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.314 -12.523 -6.033 1.00 0.00 H new ATOM 0 HG12 VAL A 52 6.023 -12.035 -5.932 1.00 0.00 H new ATOM 0 HG13 VAL A 52 5.208 -12.102 -7.513 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.700 -14.721 -7.029 1.00 0.00 H new ATOM 0 HG22 VAL A 52 4.594 -14.301 -8.509 1.00 0.00 H new ATOM 0 HG23 VAL A 52 4.966 -15.810 -7.643 1.00 0.00 H new ATOM 879 N VAL A 53 8.459 -13.586 -5.456 1.00 0.00 N ATOM 880 CA VAL A 53 9.430 -12.746 -4.705 1.00 0.00 C ATOM 881 C VAL A 53 10.736 -12.666 -5.500 1.00 0.00 C ATOM 882 O VAL A 53 11.426 -11.667 -5.482 1.00 0.00 O ATOM 883 CB VAL A 53 9.693 -13.369 -3.329 1.00 0.00 C ATOM 884 CG1 VAL A 53 10.856 -12.645 -2.645 1.00 0.00 C ATOM 885 CG2 VAL A 53 8.438 -13.238 -2.465 1.00 0.00 C ATOM 0 H VAL A 53 8.154 -14.435 -4.981 1.00 0.00 H new ATOM 0 HA VAL A 53 9.024 -11.744 -4.567 1.00 0.00 H new ATOM 0 HB VAL A 53 9.947 -14.422 -3.454 1.00 0.00 H new ATOM 0 HG11 VAL A 53 11.038 -13.092 -1.668 1.00 0.00 H new ATOM 0 HG12 VAL A 53 11.752 -12.736 -3.259 1.00 0.00 H new ATOM 0 HG13 VAL A 53 10.606 -11.591 -2.521 1.00 0.00 H new ATOM 0 HG21 VAL A 53 8.622 -13.680 -1.486 1.00 0.00 H new ATOM 0 HG22 VAL A 53 8.187 -12.184 -2.346 1.00 0.00 H new ATOM 0 HG23 VAL A 53 7.609 -13.756 -2.947 1.00 0.00 H new ATOM 895 N ASP A 54 11.079 -13.715 -6.196 1.00 0.00 N ATOM 896 CA ASP A 54 12.338 -13.703 -6.990 1.00 0.00 C ATOM 897 C ASP A 54 12.281 -12.580 -8.028 1.00 0.00 C ATOM 898 O ASP A 54 13.224 -11.833 -8.202 1.00 0.00 O ATOM 899 CB ASP A 54 12.505 -15.045 -7.706 1.00 0.00 C ATOM 900 CG ASP A 54 12.633 -16.164 -6.673 1.00 0.00 C ATOM 901 OD1 ASP A 54 12.617 -15.858 -5.492 1.00 0.00 O ATOM 902 OD2 ASP A 54 12.743 -17.309 -7.080 1.00 0.00 O ATOM 0 H ASP A 54 10.541 -14.580 -6.249 1.00 0.00 H new ATOM 0 HA ASP A 54 13.183 -13.538 -6.321 1.00 0.00 H new ATOM 0 HB2 ASP A 54 11.649 -15.231 -8.355 1.00 0.00 H new ATOM 0 HB3 ASP A 54 13.389 -15.021 -8.343 1.00 0.00 H new ATOM 907 N LYS A 55 11.185 -12.467 -8.734 1.00 0.00 N ATOM 908 CA LYS A 55 11.077 -11.405 -9.776 1.00 0.00 C ATOM 909 C LYS A 55 11.035 -10.026 -9.117 1.00 0.00 C ATOM 910 O LYS A 55 11.460 -9.046 -9.697 1.00 0.00 O ATOM 911 CB LYS A 55 9.819 -11.623 -10.615 1.00 0.00 C ATOM 912 CG LYS A 55 9.703 -10.511 -11.659 1.00 0.00 C ATOM 913 CD LYS A 55 8.588 -10.852 -12.650 1.00 0.00 C ATOM 914 CE LYS A 55 8.296 -9.632 -13.525 1.00 0.00 C ATOM 915 NZ LYS A 55 7.621 -8.585 -12.707 1.00 0.00 N ATOM 0 H LYS A 55 10.363 -13.063 -8.634 1.00 0.00 H new ATOM 0 HA LYS A 55 11.950 -11.458 -10.427 1.00 0.00 H new ATOM 0 HB2 LYS A 55 9.861 -12.595 -11.107 1.00 0.00 H new ATOM 0 HB3 LYS A 55 8.938 -11.628 -9.974 1.00 0.00 H new ATOM 0 HG2 LYS A 55 9.491 -9.560 -11.170 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.649 -10.394 -12.187 1.00 0.00 H new ATOM 0 HD2 LYS A 55 8.885 -11.697 -13.272 1.00 0.00 H new ATOM 0 HD3 LYS A 55 7.688 -11.152 -12.113 1.00 0.00 H new ATOM 0 HE2 LYS A 55 9.223 -9.240 -13.943 1.00 0.00 H new ATOM 0 HE3 LYS A 55 7.663 -9.917 -14.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 7.070 -7.960 -13.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 6.985 -9.038 -12.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 8.336 -8.026 -12.200 1.00 0.00 H new ATOM 929 N VAL A 56 10.570 -9.931 -7.902 1.00 0.00 N ATOM 930 CA VAL A 56 10.559 -8.610 -7.216 1.00 0.00 C ATOM 931 C VAL A 56 12.005 -8.153 -7.034 1.00 0.00 C ATOM 932 O VAL A 56 12.389 -7.080 -7.456 1.00 0.00 O ATOM 933 CB VAL A 56 9.899 -8.761 -5.841 1.00 0.00 C ATOM 934 CG1 VAL A 56 10.059 -7.462 -5.048 1.00 0.00 C ATOM 935 CG2 VAL A 56 8.409 -9.061 -6.023 1.00 0.00 C ATOM 0 H VAL A 56 10.198 -10.709 -7.357 1.00 0.00 H new ATOM 0 HA VAL A 56 10.003 -7.881 -7.806 1.00 0.00 H new ATOM 0 HB VAL A 56 10.376 -9.578 -5.300 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.589 -7.572 -4.071 1.00 0.00 H new ATOM 0 HG12 VAL A 56 11.119 -7.243 -4.918 1.00 0.00 H new ATOM 0 HG13 VAL A 56 9.583 -6.644 -5.589 1.00 0.00 H new ATOM 0 HG21 VAL A 56 7.938 -9.169 -5.046 1.00 0.00 H new ATOM 0 HG22 VAL A 56 7.937 -8.242 -6.566 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.290 -9.986 -6.587 1.00 0.00 H new ATOM 945 N MET A 57 12.808 -8.958 -6.397 1.00 0.00 N ATOM 946 CA MET A 57 14.227 -8.573 -6.171 1.00 0.00 C ATOM 947 C MET A 57 14.909 -8.245 -7.501 1.00 0.00 C ATOM 948 O MET A 57 15.852 -7.481 -7.548 1.00 0.00 O ATOM 949 CB MET A 57 14.962 -9.731 -5.494 1.00 0.00 C ATOM 950 CG MET A 57 14.415 -9.923 -4.078 1.00 0.00 C ATOM 951 SD MET A 57 14.904 -8.518 -3.046 1.00 0.00 S ATOM 952 CE MET A 57 14.264 -9.153 -1.477 1.00 0.00 C ATOM 0 H MET A 57 12.541 -9.868 -6.022 1.00 0.00 H new ATOM 0 HA MET A 57 14.258 -7.689 -5.533 1.00 0.00 H new ATOM 0 HB2 MET A 57 14.833 -10.646 -6.073 1.00 0.00 H new ATOM 0 HB3 MET A 57 16.032 -9.525 -5.457 1.00 0.00 H new ATOM 0 HG2 MET A 57 13.329 -10.008 -4.105 1.00 0.00 H new ATOM 0 HG3 MET A 57 14.797 -10.851 -3.652 1.00 0.00 H new ATOM 0 HE1 MET A 57 14.461 -8.431 -0.685 1.00 0.00 H new ATOM 0 HE2 MET A 57 13.189 -9.315 -1.561 1.00 0.00 H new ATOM 0 HE3 MET A 57 14.755 -10.096 -1.239 1.00 0.00 H new ATOM 962 N GLU A 58 14.430 -8.792 -8.593 1.00 0.00 N ATOM 963 CA GLU A 58 15.045 -8.481 -9.919 1.00 0.00 C ATOM 964 C GLU A 58 14.420 -7.202 -10.478 1.00 0.00 C ATOM 965 O GLU A 58 15.089 -6.407 -11.108 1.00 0.00 O ATOM 966 CB GLU A 58 14.842 -9.646 -10.890 1.00 0.00 C ATOM 967 CG GLU A 58 15.680 -10.842 -10.434 1.00 0.00 C ATOM 968 CD GLU A 58 15.339 -12.063 -11.290 1.00 0.00 C ATOM 969 OE1 GLU A 58 15.136 -11.890 -12.481 1.00 0.00 O ATOM 970 OE2 GLU A 58 15.287 -13.151 -10.741 1.00 0.00 O ATOM 0 H GLU A 58 13.642 -9.439 -8.622 1.00 0.00 H new ATOM 0 HA GLU A 58 16.117 -8.331 -9.792 1.00 0.00 H new ATOM 0 HB2 GLU A 58 13.788 -9.921 -10.930 1.00 0.00 H new ATOM 0 HB3 GLU A 58 15.132 -9.348 -11.898 1.00 0.00 H new ATOM 0 HG2 GLU A 58 16.741 -10.609 -10.521 1.00 0.00 H new ATOM 0 HG3 GLU A 58 15.485 -11.056 -9.383 1.00 0.00 H new ATOM 977 N THR A 59 13.156 -6.977 -10.248 1.00 0.00 N ATOM 978 CA THR A 59 12.539 -5.726 -10.770 1.00 0.00 C ATOM 979 C THR A 59 13.145 -4.546 -10.008 1.00 0.00 C ATOM 980 O THR A 59 13.583 -3.583 -10.605 1.00 0.00 O ATOM 981 CB THR A 59 11.015 -5.765 -10.599 1.00 0.00 C ATOM 982 OG1 THR A 59 10.552 -7.089 -10.826 1.00 0.00 O ATOM 983 CG2 THR A 59 10.357 -4.814 -11.604 1.00 0.00 C ATOM 0 H THR A 59 12.532 -7.595 -9.729 1.00 0.00 H new ATOM 0 HA THR A 59 12.742 -5.622 -11.836 1.00 0.00 H new ATOM 0 HB THR A 59 10.755 -5.453 -9.587 1.00 0.00 H new ATOM 0 HG1 THR A 59 10.638 -7.611 -10.001 1.00 0.00 H new ATOM 0 HG21 THR A 59 9.275 -4.845 -11.479 1.00 0.00 H new ATOM 0 HG22 THR A 59 10.713 -3.799 -11.431 1.00 0.00 H new ATOM 0 HG23 THR A 59 10.614 -5.121 -12.618 1.00 0.00 H new ATOM 991 N LEU A 60 13.225 -4.615 -8.709 1.00 0.00 N ATOM 992 CA LEU A 60 13.862 -3.497 -7.962 1.00 0.00 C ATOM 993 C LEU A 60 15.299 -3.355 -8.467 1.00 0.00 C ATOM 994 O LEU A 60 15.699 -2.308 -8.935 1.00 0.00 O ATOM 995 CB LEU A 60 13.872 -3.820 -6.455 1.00 0.00 C ATOM 996 CG LEU A 60 12.559 -3.367 -5.807 1.00 0.00 C ATOM 997 CD1 LEU A 60 11.407 -4.227 -6.326 1.00 0.00 C ATOM 998 CD2 LEU A 60 12.668 -3.522 -4.289 1.00 0.00 C ATOM 0 H LEU A 60 12.881 -5.387 -8.138 1.00 0.00 H new ATOM 0 HA LEU A 60 13.309 -2.570 -8.117 1.00 0.00 H new ATOM 0 HB2 LEU A 60 14.009 -4.891 -6.306 1.00 0.00 H new ATOM 0 HB3 LEU A 60 14.714 -3.322 -5.975 1.00 0.00 H new ATOM 0 HG LEU A 60 12.369 -2.323 -6.057 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.474 -3.903 -5.864 1.00 0.00 H new ATOM 0 HD12 LEU A 60 11.332 -4.120 -7.408 1.00 0.00 H new ATOM 0 HD13 LEU A 60 11.592 -5.272 -6.077 1.00 0.00 H new ATOM 0 HD21 LEU A 60 11.737 -3.201 -3.823 1.00 0.00 H new ATOM 0 HD22 LEU A 60 12.856 -4.567 -4.043 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.489 -2.908 -3.919 1.00 0.00 H new ATOM 1010 N ASP A 61 16.075 -4.403 -8.393 1.00 0.00 N ATOM 1011 CA ASP A 61 17.477 -4.321 -8.887 1.00 0.00 C ATOM 1012 C ASP A 61 17.473 -3.728 -10.298 1.00 0.00 C ATOM 1013 O ASP A 61 18.458 -3.183 -10.756 1.00 0.00 O ATOM 1014 CB ASP A 61 18.089 -5.724 -8.922 1.00 0.00 C ATOM 1015 CG ASP A 61 19.605 -5.616 -9.100 1.00 0.00 C ATOM 1016 OD1 ASP A 61 20.174 -4.660 -8.599 1.00 0.00 O ATOM 1017 OD2 ASP A 61 20.171 -6.492 -9.733 1.00 0.00 O ATOM 0 H ASP A 61 15.799 -5.308 -8.013 1.00 0.00 H new ATOM 0 HA ASP A 61 18.067 -3.689 -8.223 1.00 0.00 H new ATOM 0 HB2 ASP A 61 17.858 -6.256 -7.999 1.00 0.00 H new ATOM 0 HB3 ASP A 61 17.656 -6.301 -9.740 1.00 0.00 H new ATOM 1022 N GLU A 62 16.361 -3.827 -10.988 1.00 0.00 N ATOM 1023 CA GLU A 62 16.265 -3.270 -12.375 1.00 0.00 C ATOM 1024 C GLU A 62 15.483 -1.963 -12.332 1.00 0.00 C ATOM 1025 O GLU A 62 14.655 -1.678 -13.174 1.00 0.00 O ATOM 1026 CB GLU A 62 15.535 -4.238 -13.257 1.00 0.00 C ATOM 1027 CG GLU A 62 16.417 -5.454 -13.559 1.00 0.00 C ATOM 1028 CD GLU A 62 17.455 -5.083 -14.620 1.00 0.00 C ATOM 1029 OE1 GLU A 62 17.056 -4.615 -15.673 1.00 0.00 O ATOM 1030 OE2 GLU A 62 18.632 -5.275 -14.361 1.00 0.00 O ATOM 0 H GLU A 62 15.510 -4.273 -10.647 1.00 0.00 H new ATOM 0 HA GLU A 62 17.268 -3.099 -12.767 1.00 0.00 H new ATOM 0 HB2 GLU A 62 14.614 -4.560 -12.771 1.00 0.00 H new ATOM 0 HB3 GLU A 62 15.249 -3.748 -14.188 1.00 0.00 H new ATOM 0 HG2 GLU A 62 16.915 -5.789 -12.650 1.00 0.00 H new ATOM 0 HG3 GLU A 62 15.803 -6.283 -13.910 1.00 0.00 H new ATOM 1037 N ASP A 63 15.757 -1.189 -11.356 1.00 0.00 N ATOM 1038 CA ASP A 63 15.068 0.126 -11.189 1.00 0.00 C ATOM 1039 C ASP A 63 14.985 0.838 -12.538 1.00 0.00 C ATOM 1040 O ASP A 63 14.023 1.513 -12.846 1.00 0.00 O ATOM 1041 CB ASP A 63 15.921 0.994 -10.256 1.00 0.00 C ATOM 1042 CG ASP A 63 17.301 1.205 -10.878 1.00 0.00 C ATOM 1043 OD1 ASP A 63 17.766 0.304 -11.558 1.00 0.00 O ATOM 1044 OD2 ASP A 63 17.870 2.263 -10.666 1.00 0.00 O ATOM 0 H ASP A 63 16.447 -1.400 -10.635 1.00 0.00 H new ATOM 0 HA ASP A 63 14.067 -0.032 -10.787 1.00 0.00 H new ATOM 0 HB2 ASP A 63 15.434 1.955 -10.090 1.00 0.00 H new ATOM 0 HB3 ASP A 63 16.019 0.513 -9.283 1.00 0.00 H new ATOM 1049 N GLY A 64 15.985 0.651 -13.349 1.00 0.00 N ATOM 1050 CA GLY A 64 16.006 1.266 -14.711 1.00 0.00 C ATOM 1051 C GLY A 64 15.770 2.783 -14.657 1.00 0.00 C ATOM 1052 O GLY A 64 15.924 3.458 -15.655 1.00 0.00 O ATOM 0 H GLY A 64 16.806 0.088 -13.125 1.00 0.00 H new ATOM 0 HA2 GLY A 64 16.966 1.064 -15.186 1.00 0.00 H new ATOM 0 HA3 GLY A 64 15.240 0.801 -15.331 1.00 0.00 H new ATOM 1056 N ASP A 65 15.405 3.338 -13.517 1.00 0.00 N ATOM 1057 CA ASP A 65 15.170 4.831 -13.441 1.00 0.00 C ATOM 1058 C ASP A 65 16.303 5.562 -12.673 1.00 0.00 C ATOM 1059 O ASP A 65 16.596 6.698 -12.991 1.00 0.00 O ATOM 1060 CB ASP A 65 13.843 5.082 -12.725 1.00 0.00 C ATOM 1061 CG ASP A 65 13.770 4.219 -11.464 1.00 0.00 C ATOM 1062 OD1 ASP A 65 14.714 4.252 -10.693 1.00 0.00 O ATOM 1063 OD2 ASP A 65 12.772 3.540 -11.292 1.00 0.00 O ATOM 0 H ASP A 65 15.260 2.831 -12.644 1.00 0.00 H new ATOM 0 HA ASP A 65 15.151 5.222 -14.458 1.00 0.00 H new ATOM 0 HB2 ASP A 65 13.753 6.136 -12.462 1.00 0.00 H new ATOM 0 HB3 ASP A 65 13.010 4.847 -13.388 1.00 0.00 H new ATOM 1068 N GLY A 66 16.949 4.968 -11.681 1.00 0.00 N ATOM 1069 CA GLY A 66 18.043 5.689 -10.946 1.00 0.00 C ATOM 1070 C GLY A 66 17.530 6.132 -9.572 1.00 0.00 C ATOM 1071 O GLY A 66 18.291 6.282 -8.637 1.00 0.00 O ATOM 0 H GLY A 66 16.763 4.020 -11.354 1.00 0.00 H new ATOM 0 HA2 GLY A 66 18.909 5.037 -10.830 1.00 0.00 H new ATOM 0 HA3 GLY A 66 18.371 6.555 -11.520 1.00 0.00 H new ATOM 1075 N GLU A 67 16.242 6.327 -9.434 1.00 0.00 N ATOM 1076 CA GLU A 67 15.680 6.742 -8.112 1.00 0.00 C ATOM 1077 C GLU A 67 14.257 6.191 -7.957 1.00 0.00 C ATOM 1078 O GLU A 67 13.438 6.327 -8.845 1.00 0.00 O ATOM 1079 CB GLU A 67 15.674 8.274 -8.021 1.00 0.00 C ATOM 1080 CG GLU A 67 14.569 8.867 -8.906 1.00 0.00 C ATOM 1081 CD GLU A 67 14.654 8.273 -10.314 1.00 0.00 C ATOM 1082 OE1 GLU A 67 15.746 8.244 -10.859 1.00 0.00 O ATOM 1083 OE2 GLU A 67 13.626 7.858 -10.824 1.00 0.00 O ATOM 0 H GLU A 67 15.555 6.217 -10.180 1.00 0.00 H new ATOM 0 HA GLU A 67 16.297 6.341 -7.308 1.00 0.00 H new ATOM 0 HB2 GLU A 67 15.522 8.581 -6.986 1.00 0.00 H new ATOM 0 HB3 GLU A 67 16.643 8.665 -8.330 1.00 0.00 H new ATOM 0 HG2 GLU A 67 13.591 8.657 -8.472 1.00 0.00 H new ATOM 0 HG3 GLU A 67 14.671 9.951 -8.953 1.00 0.00 H new ATOM 1090 N CYS A 68 13.950 5.572 -6.840 1.00 0.00 N ATOM 1091 CA CYS A 68 12.573 5.015 -6.631 1.00 0.00 C ATOM 1092 C CYS A 68 11.772 5.956 -5.722 1.00 0.00 C ATOM 1093 O CYS A 68 12.197 6.294 -4.635 1.00 0.00 O ATOM 1094 CB CYS A 68 12.678 3.634 -5.973 1.00 0.00 C ATOM 1095 SG CYS A 68 14.024 2.701 -6.743 1.00 0.00 S ATOM 0 H CYS A 68 14.595 5.428 -6.063 1.00 0.00 H new ATOM 0 HA CYS A 68 12.067 4.923 -7.592 1.00 0.00 H new ATOM 0 HB2 CYS A 68 12.861 3.742 -4.904 1.00 0.00 H new ATOM 0 HB3 CYS A 68 11.737 3.094 -6.083 1.00 0.00 H new ATOM 0 HG CYS A 68 14.116 1.531 -6.185 1.00 0.00 H new ATOM 1101 N ASP A 69 10.620 6.387 -6.164 1.00 0.00 N ATOM 1102 CA ASP A 69 9.792 7.312 -5.333 1.00 0.00 C ATOM 1103 C ASP A 69 8.958 6.510 -4.328 1.00 0.00 C ATOM 1104 O ASP A 69 9.101 5.310 -4.203 1.00 0.00 O ATOM 1105 CB ASP A 69 8.860 8.112 -6.244 1.00 0.00 C ATOM 1106 CG ASP A 69 9.691 8.889 -7.266 1.00 0.00 C ATOM 1107 OD1 ASP A 69 10.743 8.397 -7.641 1.00 0.00 O ATOM 1108 OD2 ASP A 69 9.263 9.962 -7.656 1.00 0.00 O ATOM 0 H ASP A 69 10.215 6.138 -7.067 1.00 0.00 H new ATOM 0 HA ASP A 69 10.449 7.991 -4.789 1.00 0.00 H new ATOM 0 HB2 ASP A 69 8.169 7.441 -6.755 1.00 0.00 H new ATOM 0 HB3 ASP A 69 8.257 8.800 -5.651 1.00 0.00 H new ATOM 1113 N PHE A 70 8.080 7.168 -3.615 1.00 0.00 N ATOM 1114 CA PHE A 70 7.228 6.450 -2.623 1.00 0.00 C ATOM 1115 C PHE A 70 6.146 5.665 -3.369 1.00 0.00 C ATOM 1116 O PHE A 70 5.666 4.655 -2.891 1.00 0.00 O ATOM 1117 CB PHE A 70 6.592 7.467 -1.669 1.00 0.00 C ATOM 1118 CG PHE A 70 5.870 6.759 -0.544 1.00 0.00 C ATOM 1119 CD1 PHE A 70 4.622 6.166 -0.773 1.00 0.00 C ATOM 1120 CD2 PHE A 70 6.444 6.708 0.731 1.00 0.00 C ATOM 1121 CE1 PHE A 70 3.952 5.520 0.274 1.00 0.00 C ATOM 1122 CE2 PHE A 70 5.775 6.065 1.777 1.00 0.00 C ATOM 1123 CZ PHE A 70 4.529 5.470 1.549 1.00 0.00 C ATOM 0 H PHE A 70 7.917 8.173 -3.678 1.00 0.00 H new ATOM 0 HA PHE A 70 7.833 5.755 -2.041 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.362 8.121 -1.260 1.00 0.00 H new ATOM 0 HB3 PHE A 70 5.893 8.100 -2.216 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.177 6.207 -1.756 1.00 0.00 H new ATOM 0 HD2 PHE A 70 7.406 7.166 0.908 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.991 5.061 0.098 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.220 6.028 2.760 1.00 0.00 H new ATOM 0 HZ PHE A 70 4.012 4.972 2.356 1.00 0.00 H new ATOM 1133 N GLN A 71 5.768 6.094 -4.541 1.00 0.00 N ATOM 1134 CA GLN A 71 4.735 5.334 -5.300 1.00 0.00 C ATOM 1135 C GLN A 71 5.288 3.940 -5.606 1.00 0.00 C ATOM 1136 O GLN A 71 4.569 2.960 -5.603 1.00 0.00 O ATOM 1137 CB GLN A 71 4.428 6.055 -6.615 1.00 0.00 C ATOM 1138 CG GLN A 71 3.563 7.285 -6.337 1.00 0.00 C ATOM 1139 CD GLN A 71 3.169 7.942 -7.661 1.00 0.00 C ATOM 1140 OE1 GLN A 71 4.017 8.380 -8.412 1.00 0.00 O ATOM 1141 NE2 GLN A 71 1.906 8.030 -7.980 1.00 0.00 N ATOM 0 H GLN A 71 6.126 6.930 -5.003 1.00 0.00 H new ATOM 0 HA GLN A 71 3.821 5.259 -4.711 1.00 0.00 H new ATOM 0 HB2 GLN A 71 5.356 6.353 -7.103 1.00 0.00 H new ATOM 0 HB3 GLN A 71 3.911 5.381 -7.298 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.670 6.997 -5.782 1.00 0.00 H new ATOM 0 HG3 GLN A 71 4.110 7.994 -5.715 1.00 0.00 H new ATOM 0 HE21 GLN A 71 1.194 7.662 -7.349 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.631 8.467 -8.860 1.00 0.00 H new ATOM 1150 N GLU A 72 6.562 3.845 -5.863 1.00 0.00 N ATOM 1151 CA GLU A 72 7.170 2.519 -6.163 1.00 0.00 C ATOM 1152 C GLU A 72 7.270 1.682 -4.882 1.00 0.00 C ATOM 1153 O GLU A 72 7.307 0.470 -4.921 1.00 0.00 O ATOM 1154 CB GLU A 72 8.563 2.711 -6.767 1.00 0.00 C ATOM 1155 CG GLU A 72 8.456 3.539 -8.049 1.00 0.00 C ATOM 1156 CD GLU A 72 7.798 2.700 -9.145 1.00 0.00 C ATOM 1157 OE1 GLU A 72 8.067 1.511 -9.195 1.00 0.00 O ATOM 1158 OE2 GLU A 72 7.036 3.260 -9.917 1.00 0.00 O ATOM 0 H GLU A 72 7.211 4.632 -5.878 1.00 0.00 H new ATOM 0 HA GLU A 72 6.537 1.995 -6.879 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.215 3.212 -6.052 1.00 0.00 H new ATOM 0 HB3 GLU A 72 9.013 1.742 -6.984 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.870 4.440 -7.865 1.00 0.00 H new ATOM 0 HG3 GLU A 72 9.446 3.863 -8.369 1.00 0.00 H new ATOM 1165 N PHE A 73 7.285 2.321 -3.744 1.00 0.00 N ATOM 1166 CA PHE A 73 7.353 1.566 -2.458 1.00 0.00 C ATOM 1167 C PHE A 73 5.966 1.004 -2.118 1.00 0.00 C ATOM 1168 O PHE A 73 5.848 -0.122 -1.682 1.00 0.00 O ATOM 1169 CB PHE A 73 7.872 2.489 -1.341 1.00 0.00 C ATOM 1170 CG PHE A 73 7.506 1.937 0.020 1.00 0.00 C ATOM 1171 CD1 PHE A 73 6.229 2.169 0.545 1.00 0.00 C ATOM 1172 CD2 PHE A 73 8.440 1.196 0.753 1.00 0.00 C ATOM 1173 CE1 PHE A 73 5.886 1.661 1.802 1.00 0.00 C ATOM 1174 CE2 PHE A 73 8.096 0.688 2.012 1.00 0.00 C ATOM 1175 CZ PHE A 73 6.819 0.921 2.536 1.00 0.00 C ATOM 0 H PHE A 73 7.253 3.336 -3.648 1.00 0.00 H new ATOM 0 HA PHE A 73 8.045 0.730 -2.555 1.00 0.00 H new ATOM 0 HB2 PHE A 73 8.954 2.590 -1.419 1.00 0.00 H new ATOM 0 HB3 PHE A 73 7.449 3.487 -1.460 1.00 0.00 H new ATOM 0 HD1 PHE A 73 5.508 2.741 -0.021 1.00 0.00 H new ATOM 0 HD2 PHE A 73 9.425 1.016 0.348 1.00 0.00 H new ATOM 0 HE1 PHE A 73 4.901 1.840 2.206 1.00 0.00 H new ATOM 0 HE2 PHE A 73 8.816 0.116 2.579 1.00 0.00 H new ATOM 0 HZ PHE A 73 6.554 0.529 3.507 1.00 0.00 H new ATOM 1185 N MET A 74 4.921 1.750 -2.299 1.00 0.00 N ATOM 1186 CA MET A 74 3.580 1.194 -1.958 1.00 0.00 C ATOM 1187 C MET A 74 3.201 0.107 -2.976 1.00 0.00 C ATOM 1188 O MET A 74 2.519 -0.839 -2.635 1.00 0.00 O ATOM 1189 CB MET A 74 2.534 2.326 -1.950 1.00 0.00 C ATOM 1190 CG MET A 74 1.476 2.062 -0.870 1.00 0.00 C ATOM 1191 SD MET A 74 2.237 2.212 0.768 1.00 0.00 S ATOM 1192 CE MET A 74 1.217 0.978 1.614 1.00 0.00 C ATOM 0 H MET A 74 4.929 2.704 -2.661 1.00 0.00 H new ATOM 0 HA MET A 74 3.609 0.746 -0.965 1.00 0.00 H new ATOM 0 HB2 MET A 74 3.023 3.282 -1.764 1.00 0.00 H new ATOM 0 HB3 MET A 74 2.057 2.397 -2.927 1.00 0.00 H new ATOM 0 HG2 MET A 74 0.655 2.772 -0.968 1.00 0.00 H new ATOM 0 HG3 MET A 74 1.052 1.066 -0.996 1.00 0.00 H new ATOM 0 HE1 MET A 74 1.523 0.907 2.658 1.00 0.00 H new ATOM 0 HE2 MET A 74 0.169 1.274 1.562 1.00 0.00 H new ATOM 0 HE3 MET A 74 1.344 0.009 1.132 1.00 0.00 H new ATOM 1202 N ALA A 75 3.629 0.198 -4.204 1.00 0.00 N ATOM 1203 CA ALA A 75 3.278 -0.864 -5.195 1.00 0.00 C ATOM 1204 C ALA A 75 4.176 -2.097 -5.018 1.00 0.00 C ATOM 1205 O ALA A 75 3.687 -3.198 -4.858 1.00 0.00 O ATOM 1206 CB ALA A 75 3.463 -0.310 -6.609 1.00 0.00 C ATOM 0 H ALA A 75 4.205 0.958 -4.566 1.00 0.00 H new ATOM 0 HA ALA A 75 2.242 -1.161 -5.034 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.209 -1.080 -7.338 1.00 0.00 H new ATOM 0 HB2 ALA A 75 2.812 0.552 -6.750 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.501 -0.007 -6.748 1.00 0.00 H new ATOM 1212 N PHE A 76 5.473 -1.947 -5.061 1.00 0.00 N ATOM 1213 CA PHE A 76 6.351 -3.149 -4.913 1.00 0.00 C ATOM 1214 C PHE A 76 6.079 -3.825 -3.564 1.00 0.00 C ATOM 1215 O PHE A 76 6.142 -5.033 -3.442 1.00 0.00 O ATOM 1216 CB PHE A 76 7.834 -2.733 -5.008 1.00 0.00 C ATOM 1217 CG PHE A 76 8.265 -2.692 -6.464 1.00 0.00 C ATOM 1218 CD1 PHE A 76 8.235 -3.863 -7.234 1.00 0.00 C ATOM 1219 CD2 PHE A 76 8.684 -1.488 -7.044 1.00 0.00 C ATOM 1220 CE1 PHE A 76 8.621 -3.828 -8.577 1.00 0.00 C ATOM 1221 CE2 PHE A 76 9.073 -1.455 -8.388 1.00 0.00 C ATOM 1222 CZ PHE A 76 9.041 -2.625 -9.155 1.00 0.00 C ATOM 0 H PHE A 76 5.959 -1.059 -5.190 1.00 0.00 H new ATOM 0 HA PHE A 76 6.132 -3.854 -5.715 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.977 -1.755 -4.549 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.455 -3.438 -4.455 1.00 0.00 H new ATOM 0 HD1 PHE A 76 7.913 -4.793 -6.789 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.707 -0.584 -6.453 1.00 0.00 H new ATOM 0 HE1 PHE A 76 8.595 -4.731 -9.169 1.00 0.00 H new ATOM 0 HE2 PHE A 76 9.398 -0.526 -8.833 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.340 -2.599 -10.192 1.00 0.00 H new ATOM 1232 N VAL A 77 5.766 -3.061 -2.560 1.00 0.00 N ATOM 1233 CA VAL A 77 5.479 -3.673 -1.232 1.00 0.00 C ATOM 1234 C VAL A 77 4.214 -4.529 -1.351 1.00 0.00 C ATOM 1235 O VAL A 77 4.073 -5.540 -0.692 1.00 0.00 O ATOM 1236 CB VAL A 77 5.280 -2.565 -0.188 1.00 0.00 C ATOM 1237 CG1 VAL A 77 4.658 -3.147 1.087 1.00 0.00 C ATOM 1238 CG2 VAL A 77 6.638 -1.942 0.152 1.00 0.00 C ATOM 0 H VAL A 77 5.696 -2.044 -2.598 1.00 0.00 H new ATOM 0 HA VAL A 77 6.313 -4.300 -0.916 1.00 0.00 H new ATOM 0 HB VAL A 77 4.613 -1.806 -0.596 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.521 -2.352 1.821 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.692 -3.592 0.850 1.00 0.00 H new ATOM 0 HG13 VAL A 77 5.318 -3.911 1.498 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.502 -1.154 0.893 1.00 0.00 H new ATOM 0 HG22 VAL A 77 7.300 -2.709 0.555 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.080 -1.519 -0.750 1.00 0.00 H new ATOM 1248 N SER A 78 3.298 -4.134 -2.191 1.00 0.00 N ATOM 1249 CA SER A 78 2.047 -4.927 -2.358 1.00 0.00 C ATOM 1250 C SER A 78 2.373 -6.258 -3.043 1.00 0.00 C ATOM 1251 O SER A 78 1.983 -7.314 -2.586 1.00 0.00 O ATOM 1252 CB SER A 78 1.056 -4.137 -3.217 1.00 0.00 C ATOM 1253 OG SER A 78 1.097 -2.768 -2.839 1.00 0.00 O ATOM 0 H SER A 78 3.361 -3.296 -2.769 1.00 0.00 H new ATOM 0 HA SER A 78 1.606 -5.122 -1.381 1.00 0.00 H new ATOM 0 HB2 SER A 78 1.307 -4.243 -4.273 1.00 0.00 H new ATOM 0 HB3 SER A 78 0.048 -4.532 -3.087 1.00 0.00 H new ATOM 0 HG SER A 78 1.835 -2.322 -3.305 1.00 0.00 H new ATOM 1259 N MET A 79 3.065 -6.216 -4.147 1.00 0.00 N ATOM 1260 CA MET A 79 3.392 -7.476 -4.872 1.00 0.00 C ATOM 1261 C MET A 79 4.001 -8.501 -3.913 1.00 0.00 C ATOM 1262 O MET A 79 3.708 -9.675 -3.990 1.00 0.00 O ATOM 1263 CB MET A 79 4.396 -7.174 -5.988 1.00 0.00 C ATOM 1264 CG MET A 79 3.699 -6.413 -7.119 1.00 0.00 C ATOM 1265 SD MET A 79 2.726 -7.571 -8.114 1.00 0.00 S ATOM 1266 CE MET A 79 4.025 -7.997 -9.299 1.00 0.00 C ATOM 0 H MET A 79 3.419 -5.363 -4.579 1.00 0.00 H new ATOM 0 HA MET A 79 2.475 -7.886 -5.295 1.00 0.00 H new ATOM 0 HB2 MET A 79 5.224 -6.583 -5.595 1.00 0.00 H new ATOM 0 HB3 MET A 79 4.820 -8.103 -6.369 1.00 0.00 H new ATOM 0 HG2 MET A 79 3.052 -5.639 -6.706 1.00 0.00 H new ATOM 0 HG3 MET A 79 4.438 -5.911 -7.744 1.00 0.00 H new ATOM 0 HE1 MET A 79 3.637 -8.715 -10.022 1.00 0.00 H new ATOM 0 HE2 MET A 79 4.351 -7.097 -9.820 1.00 0.00 H new ATOM 0 HE3 MET A 79 4.871 -8.436 -8.770 1.00 0.00 H new ATOM 1276 N VAL A 80 4.847 -8.077 -3.015 1.00 0.00 N ATOM 1277 CA VAL A 80 5.463 -9.054 -2.070 1.00 0.00 C ATOM 1278 C VAL A 80 4.409 -9.534 -1.073 1.00 0.00 C ATOM 1279 O VAL A 80 4.140 -10.713 -0.962 1.00 0.00 O ATOM 1280 CB VAL A 80 6.606 -8.386 -1.302 1.00 0.00 C ATOM 1281 CG1 VAL A 80 7.169 -9.369 -0.274 1.00 0.00 C ATOM 1282 CG2 VAL A 80 7.714 -7.979 -2.275 1.00 0.00 C ATOM 0 H VAL A 80 5.137 -7.107 -2.894 1.00 0.00 H new ATOM 0 HA VAL A 80 5.850 -9.900 -2.637 1.00 0.00 H new ATOM 0 HB VAL A 80 6.229 -7.499 -0.794 1.00 0.00 H new ATOM 0 HG11 VAL A 80 7.983 -8.895 0.274 1.00 0.00 H new ATOM 0 HG12 VAL A 80 6.382 -9.657 0.423 1.00 0.00 H new ATOM 0 HG13 VAL A 80 7.543 -10.256 -0.786 1.00 0.00 H new ATOM 0 HG21 VAL A 80 8.526 -7.504 -1.724 1.00 0.00 H new ATOM 0 HG22 VAL A 80 8.092 -8.864 -2.787 1.00 0.00 H new ATOM 0 HG23 VAL A 80 7.315 -7.279 -3.009 1.00 0.00 H new ATOM 1292 N THR A 81 3.799 -8.635 -0.354 1.00 0.00 N ATOM 1293 CA THR A 81 2.758 -9.054 0.616 1.00 0.00 C ATOM 1294 C THR A 81 1.637 -9.757 -0.149 1.00 0.00 C ATOM 1295 O THR A 81 1.073 -10.733 0.304 1.00 0.00 O ATOM 1296 CB THR A 81 2.203 -7.816 1.322 1.00 0.00 C ATOM 1297 OG1 THR A 81 1.958 -6.798 0.361 1.00 0.00 O ATOM 1298 CG2 THR A 81 3.217 -7.314 2.352 1.00 0.00 C ATOM 0 H THR A 81 3.977 -7.632 -0.398 1.00 0.00 H new ATOM 0 HA THR A 81 3.181 -9.731 1.358 1.00 0.00 H new ATOM 0 HB THR A 81 1.273 -8.072 1.829 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.749 -6.224 0.284 1.00 0.00 H new ATOM 0 HG21 THR A 81 2.820 -6.432 2.854 1.00 0.00 H new ATOM 0 HG22 THR A 81 3.406 -8.096 3.088 1.00 0.00 H new ATOM 0 HG23 THR A 81 4.149 -7.056 1.849 1.00 0.00 H new ATOM 1306 N THR A 82 1.317 -9.261 -1.313 1.00 0.00 N ATOM 1307 CA THR A 82 0.239 -9.882 -2.130 1.00 0.00 C ATOM 1308 C THR A 82 0.740 -11.188 -2.756 1.00 0.00 C ATOM 1309 O THR A 82 -0.040 -12.038 -3.137 1.00 0.00 O ATOM 1310 CB THR A 82 -0.187 -8.914 -3.237 1.00 0.00 C ATOM 1311 OG1 THR A 82 -0.520 -7.658 -2.660 1.00 0.00 O ATOM 1312 CG2 THR A 82 -1.405 -9.477 -3.974 1.00 0.00 C ATOM 0 H THR A 82 1.761 -8.445 -1.735 1.00 0.00 H new ATOM 0 HA THR A 82 -0.614 -10.100 -1.487 1.00 0.00 H new ATOM 0 HB THR A 82 0.633 -8.787 -3.944 1.00 0.00 H new ATOM 0 HG1 THR A 82 0.269 -7.282 -2.218 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.706 -8.786 -4.761 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.150 -10.441 -4.415 1.00 0.00 H new ATOM 0 HG23 THR A 82 -2.228 -9.606 -3.271 1.00 0.00 H new ATOM 1320 N ALA A 83 2.032 -11.363 -2.868 1.00 0.00 N ATOM 1321 CA ALA A 83 2.552 -12.625 -3.471 1.00 0.00 C ATOM 1322 C ALA A 83 1.929 -13.810 -2.739 1.00 0.00 C ATOM 1323 O ALA A 83 1.501 -14.773 -3.343 1.00 0.00 O ATOM 1324 CB ALA A 83 4.075 -12.687 -3.329 1.00 0.00 C ATOM 0 H ALA A 83 2.742 -10.694 -2.571 1.00 0.00 H new ATOM 0 HA ALA A 83 2.294 -12.656 -4.530 1.00 0.00 H new ATOM 0 HB1 ALA A 83 4.444 -13.612 -3.772 1.00 0.00 H new ATOM 0 HB2 ALA A 83 4.523 -11.835 -3.841 1.00 0.00 H new ATOM 0 HB3 ALA A 83 4.343 -12.658 -2.273 1.00 0.00 H new ATOM 1330 N CYS A 84 1.866 -13.741 -1.438 1.00 0.00 N ATOM 1331 CA CYS A 84 1.258 -14.856 -0.664 1.00 0.00 C ATOM 1332 C CYS A 84 -0.264 -14.769 -0.788 1.00 0.00 C ATOM 1333 O CYS A 84 -0.980 -14.806 0.192 1.00 0.00 O ATOM 1334 CB CYS A 84 1.660 -14.736 0.807 1.00 0.00 C ATOM 1335 SG CYS A 84 0.894 -16.075 1.754 1.00 0.00 S ATOM 0 H CYS A 84 2.210 -12.960 -0.879 1.00 0.00 H new ATOM 0 HA CYS A 84 1.608 -15.812 -1.053 1.00 0.00 H new ATOM 0 HB2 CYS A 84 2.745 -14.783 0.903 1.00 0.00 H new ATOM 0 HB3 CYS A 84 1.346 -13.770 1.203 1.00 0.00 H new ATOM 0 HG CYS A 84 -0.379 -16.117 1.495 1.00 0.00 H new ATOM 1341 N HIS A 85 -0.759 -14.642 -1.990 1.00 0.00 N ATOM 1342 CA HIS A 85 -2.234 -14.541 -2.191 1.00 0.00 C ATOM 1343 C HIS A 85 -2.946 -15.614 -1.366 1.00 0.00 C ATOM 1344 O HIS A 85 -2.325 -16.478 -0.781 1.00 0.00 O ATOM 1345 CB HIS A 85 -2.559 -14.740 -3.673 1.00 0.00 C ATOM 1346 CG HIS A 85 -2.144 -16.122 -4.097 1.00 0.00 C ATOM 1347 ND1 HIS A 85 -1.393 -16.952 -3.280 1.00 0.00 N ATOM 1348 CD2 HIS A 85 -2.366 -16.833 -5.250 1.00 0.00 C ATOM 1349 CE1 HIS A 85 -1.191 -18.102 -3.946 1.00 0.00 C ATOM 1350 NE2 HIS A 85 -1.763 -18.083 -5.153 1.00 0.00 N ATOM 0 H HIS A 85 -0.203 -14.604 -2.845 1.00 0.00 H new ATOM 0 HA HIS A 85 -2.574 -13.557 -1.869 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -3.627 -14.601 -3.844 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -2.040 -13.993 -4.273 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -2.924 -16.476 -6.103 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -0.634 -18.940 -3.553 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -1.759 -18.825 -5.853 1.00 0.00 H new ATOM 1358 N GLU A 86 -4.249 -15.565 -1.319 1.00 0.00 N ATOM 1359 CA GLU A 86 -5.011 -16.579 -0.537 1.00 0.00 C ATOM 1360 C GLU A 86 -4.627 -16.481 0.945 1.00 0.00 C ATOM 1361 O GLU A 86 -4.840 -17.398 1.713 1.00 0.00 O ATOM 1362 CB GLU A 86 -4.687 -17.983 -1.070 1.00 0.00 C ATOM 1363 CG GLU A 86 -5.815 -18.952 -0.704 1.00 0.00 C ATOM 1364 CD GLU A 86 -5.507 -20.337 -1.276 1.00 0.00 C ATOM 1365 OE1 GLU A 86 -4.392 -20.535 -1.730 1.00 0.00 O ATOM 1366 OE2 GLU A 86 -6.391 -21.177 -1.249 1.00 0.00 O ATOM 0 H GLU A 86 -4.821 -14.864 -1.790 1.00 0.00 H new ATOM 0 HA GLU A 86 -6.080 -16.393 -0.641 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -4.560 -17.950 -2.152 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.744 -18.333 -0.649 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -5.921 -19.010 0.379 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -6.764 -18.587 -1.098 1.00 0.00 H new ATOM 1373 N PHE A 87 -4.066 -15.375 1.352 1.00 0.00 N ATOM 1374 CA PHE A 87 -3.674 -15.220 2.781 1.00 0.00 C ATOM 1375 C PHE A 87 -4.921 -15.299 3.664 1.00 0.00 C ATOM 1376 O PHE A 87 -4.846 -15.619 4.833 1.00 0.00 O ATOM 1377 CB PHE A 87 -2.982 -13.870 2.986 1.00 0.00 C ATOM 1378 CG PHE A 87 -3.799 -12.775 2.343 1.00 0.00 C ATOM 1379 CD1 PHE A 87 -3.650 -12.500 0.979 1.00 0.00 C ATOM 1380 CD2 PHE A 87 -4.702 -12.031 3.112 1.00 0.00 C ATOM 1381 CE1 PHE A 87 -4.403 -11.481 0.384 1.00 0.00 C ATOM 1382 CE2 PHE A 87 -5.455 -11.012 2.518 1.00 0.00 C ATOM 1383 CZ PHE A 87 -5.306 -10.737 1.153 1.00 0.00 C ATOM 0 H PHE A 87 -3.862 -14.572 0.756 1.00 0.00 H new ATOM 0 HA PHE A 87 -2.985 -16.019 3.054 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -2.863 -13.670 4.051 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -1.982 -13.893 2.552 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -2.954 -13.074 0.385 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -4.817 -12.244 4.165 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -4.287 -11.269 -0.669 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -6.151 -10.438 3.112 1.00 0.00 H new ATOM 0 HZ PHE A 87 -5.887 -9.951 0.694 1.00 0.00 H new ATOM 1393 N PHE A 88 -6.070 -15.007 3.115 1.00 0.00 N ATOM 1394 CA PHE A 88 -7.317 -15.066 3.928 1.00 0.00 C ATOM 1395 C PHE A 88 -7.387 -16.412 4.652 1.00 0.00 C ATOM 1396 O PHE A 88 -7.813 -16.500 5.786 1.00 0.00 O ATOM 1397 CB PHE A 88 -8.536 -14.914 3.014 1.00 0.00 C ATOM 1398 CG PHE A 88 -8.294 -13.788 2.035 1.00 0.00 C ATOM 1399 CD1 PHE A 88 -8.368 -12.458 2.467 1.00 0.00 C ATOM 1400 CD2 PHE A 88 -7.997 -14.074 0.697 1.00 0.00 C ATOM 1401 CE1 PHE A 88 -8.145 -11.414 1.559 1.00 0.00 C ATOM 1402 CE2 PHE A 88 -7.774 -13.031 -0.210 1.00 0.00 C ATOM 1403 CZ PHE A 88 -7.848 -11.701 0.221 1.00 0.00 C ATOM 0 H PHE A 88 -6.198 -14.731 2.141 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.312 -14.257 4.659 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.719 -15.844 2.477 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -9.426 -14.708 3.608 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -8.597 -12.237 3.499 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -7.940 -15.100 0.364 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -8.202 -10.388 1.891 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -7.545 -13.252 -1.242 1.00 0.00 H new ATOM 0 HZ PHE A 88 -7.676 -10.896 -0.479 1.00 0.00 H new ATOM 1413 N GLU A 89 -6.972 -17.461 3.996 1.00 0.00 N ATOM 1414 CA GLU A 89 -7.012 -18.808 4.633 1.00 0.00 C ATOM 1415 C GLU A 89 -5.751 -19.016 5.472 1.00 0.00 C ATOM 1416 O GLU A 89 -4.967 -19.910 5.222 1.00 0.00 O ATOM 1417 CB GLU A 89 -7.081 -19.884 3.547 1.00 0.00 C ATOM 1418 CG GLU A 89 -8.438 -19.813 2.844 1.00 0.00 C ATOM 1419 CD GLU A 89 -8.473 -20.829 1.703 1.00 0.00 C ATOM 1420 OE1 GLU A 89 -7.481 -20.934 1.000 1.00 0.00 O ATOM 1421 OE2 GLU A 89 -9.490 -21.485 1.551 1.00 0.00 O ATOM 0 H GLU A 89 -6.606 -17.443 3.044 1.00 0.00 H new ATOM 0 HA GLU A 89 -7.891 -18.878 5.274 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -6.277 -19.739 2.825 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -6.939 -20.871 3.988 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -9.239 -20.019 3.554 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -8.607 -18.808 2.456 1.00 0.00 H new ATOM 1428 N HIS A 90 -5.550 -18.200 6.468 1.00 0.00 N ATOM 1429 CA HIS A 90 -4.343 -18.357 7.325 1.00 0.00 C ATOM 1430 C HIS A 90 -4.454 -19.658 8.125 1.00 0.00 C ATOM 1431 O HIS A 90 -4.740 -19.650 9.306 1.00 0.00 O ATOM 1432 CB HIS A 90 -4.248 -17.171 8.287 1.00 0.00 C ATOM 1433 CG HIS A 90 -2.940 -17.230 9.027 1.00 0.00 C ATOM 1434 ND1 HIS A 90 -2.877 -17.348 10.406 1.00 0.00 N ATOM 1435 CD2 HIS A 90 -1.638 -17.188 8.593 1.00 0.00 C ATOM 1436 CE1 HIS A 90 -1.577 -17.374 10.751 1.00 0.00 C ATOM 1437 NE2 HIS A 90 -0.779 -17.279 9.684 1.00 0.00 N ATOM 0 H HIS A 90 -6.169 -17.431 6.726 1.00 0.00 H new ATOM 0 HA HIS A 90 -3.451 -18.391 6.700 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -4.324 -16.234 7.735 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -5.079 -17.194 8.992 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -1.328 -17.098 7.562 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -1.222 -17.461 11.767 1.00 0.00 H new ATOM 0 HE2 HIS A 90 0.241 -17.274 9.672 1.00 0.00 H new ATOM 1445 N GLU A 91 -4.235 -20.776 7.487 1.00 0.00 N ATOM 1446 CA GLU A 91 -4.332 -22.078 8.206 1.00 0.00 C ATOM 1447 C GLU A 91 -5.654 -22.141 8.971 1.00 0.00 C ATOM 1448 O GLU A 91 -6.683 -21.920 8.354 1.00 0.00 O ATOM 1449 CB GLU A 91 -3.168 -22.207 9.190 1.00 0.00 C ATOM 1450 CG GLU A 91 -1.845 -22.081 8.434 1.00 0.00 C ATOM 1451 CD GLU A 91 -0.682 -22.342 9.393 1.00 0.00 C ATOM 1452 OE1 GLU A 91 -0.304 -21.422 10.100 1.00 0.00 O ATOM 1453 OE2 GLU A 91 -0.189 -23.458 9.405 1.00 0.00 O ATOM 1454 OXT GLU A 91 -5.615 -22.409 10.160 1.00 0.00 O ATOM 0 H GLU A 91 -3.993 -20.844 6.498 1.00 0.00 H new ATOM 0 HA GLU A 91 -4.290 -22.894 7.485 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -3.237 -21.434 9.955 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.216 -23.168 9.703 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -1.816 -22.793 7.609 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -1.756 -21.085 8.000 1.00 0.00 H new TER 1461 GLU A 91 ATOM 1462 N MET B 0 7.185 -7.813 13.981 1.00 0.00 N ATOM 1463 CA MET B 0 8.283 -7.464 14.927 1.00 0.00 C ATOM 1464 C MET B 0 8.365 -5.944 15.071 1.00 0.00 C ATOM 1465 O MET B 0 8.244 -5.408 16.154 1.00 0.00 O ATOM 1466 CB MET B 0 9.609 -8.004 14.386 1.00 0.00 C ATOM 1467 CG MET B 0 10.660 -8.001 15.500 1.00 0.00 C ATOM 1468 SD MET B 0 12.157 -8.839 14.921 1.00 0.00 S ATOM 1469 CE MET B 0 12.544 -7.706 13.565 1.00 0.00 C ATOM 0 H1 MET B 0 6.969 -8.827 14.059 1.00 0.00 H new ATOM 0 H2 MET B 0 6.336 -7.259 14.215 1.00 0.00 H new ATOM 0 H3 MET B 0 7.483 -7.597 13.008 1.00 0.00 H new ATOM 0 HA MET B 0 8.083 -7.908 15.902 1.00 0.00 H new ATOM 0 HB2 MET B 0 9.472 -9.016 14.005 1.00 0.00 H new ATOM 0 HB3 MET B 0 9.949 -7.392 13.551 1.00 0.00 H new ATOM 0 HG2 MET B 0 10.893 -6.977 15.791 1.00 0.00 H new ATOM 0 HG3 MET B 0 10.269 -8.503 16.385 1.00 0.00 H new ATOM 0 HE1 MET B 0 13.615 -7.733 13.363 1.00 0.00 H new ATOM 0 HE2 MET B 0 11.999 -8.009 12.671 1.00 0.00 H new ATOM 0 HE3 MET B 0 12.252 -6.693 13.843 1.00 0.00 H new ATOM 1481 N SER B 1 8.563 -5.242 13.986 1.00 0.00 N ATOM 1482 CA SER B 1 8.644 -3.754 14.066 1.00 0.00 C ATOM 1483 C SER B 1 7.227 -3.175 14.019 1.00 0.00 C ATOM 1484 O SER B 1 6.279 -3.859 13.688 1.00 0.00 O ATOM 1485 CB SER B 1 9.459 -3.218 12.888 1.00 0.00 C ATOM 1486 OG SER B 1 8.623 -3.132 11.741 1.00 0.00 O ATOM 0 H SER B 1 8.672 -5.634 13.050 1.00 0.00 H new ATOM 0 HA SER B 1 9.130 -3.462 14.997 1.00 0.00 H new ATOM 0 HB2 SER B 1 9.867 -2.237 13.130 1.00 0.00 H new ATOM 0 HB3 SER B 1 10.305 -3.875 12.687 1.00 0.00 H new ATOM 0 HG SER B 1 9.172 -2.958 10.948 1.00 0.00 H new ATOM 1492 N GLU B 2 7.073 -1.924 14.354 1.00 0.00 N ATOM 1493 CA GLU B 2 5.713 -1.314 14.333 1.00 0.00 C ATOM 1494 C GLU B 2 5.106 -1.455 12.934 1.00 0.00 C ATOM 1495 O GLU B 2 3.915 -1.632 12.779 1.00 0.00 O ATOM 1496 CB GLU B 2 5.815 0.171 14.708 1.00 0.00 C ATOM 1497 CG GLU B 2 4.445 0.686 15.164 1.00 0.00 C ATOM 1498 CD GLU B 2 4.153 0.180 16.579 1.00 0.00 C ATOM 1499 OE1 GLU B 2 4.935 -0.613 17.077 1.00 0.00 O ATOM 1500 OE2 GLU B 2 3.152 0.596 17.139 1.00 0.00 O ATOM 0 H GLU B 2 7.827 -1.299 14.640 1.00 0.00 H new ATOM 0 HA GLU B 2 5.074 -1.826 15.052 1.00 0.00 H new ATOM 0 HB2 GLU B 2 6.548 0.305 15.504 1.00 0.00 H new ATOM 0 HB3 GLU B 2 6.165 0.749 13.852 1.00 0.00 H new ATOM 0 HG2 GLU B 2 4.430 1.776 15.146 1.00 0.00 H new ATOM 0 HG3 GLU B 2 3.670 0.345 14.478 1.00 0.00 H new ATOM 1507 N LEU B 3 5.917 -1.369 11.916 1.00 0.00 N ATOM 1508 CA LEU B 3 5.388 -1.489 10.528 1.00 0.00 C ATOM 1509 C LEU B 3 4.711 -2.854 10.351 1.00 0.00 C ATOM 1510 O LEU B 3 3.594 -2.945 9.881 1.00 0.00 O ATOM 1511 CB LEU B 3 6.552 -1.337 9.528 1.00 0.00 C ATOM 1512 CG LEU B 3 6.053 -0.707 8.219 1.00 0.00 C ATOM 1513 CD1 LEU B 3 7.220 -0.581 7.238 1.00 0.00 C ATOM 1514 CD2 LEU B 3 4.960 -1.589 7.605 1.00 0.00 C ATOM 0 H LEU B 3 6.924 -1.221 11.985 1.00 0.00 H new ATOM 0 HA LEU B 3 4.652 -0.706 10.344 1.00 0.00 H new ATOM 0 HB2 LEU B 3 7.335 -0.716 9.963 1.00 0.00 H new ATOM 0 HB3 LEU B 3 6.995 -2.312 9.324 1.00 0.00 H new ATOM 0 HG LEU B 3 5.643 0.281 8.427 1.00 0.00 H new ATOM 0 HD11 LEU B 3 6.867 -0.134 6.309 1.00 0.00 H new ATOM 0 HD12 LEU B 3 7.995 0.050 7.673 1.00 0.00 H new ATOM 0 HD13 LEU B 3 7.631 -1.569 7.032 1.00 0.00 H new ATOM 0 HD21 LEU B 3 4.608 -1.139 6.677 1.00 0.00 H new ATOM 0 HD22 LEU B 3 5.365 -2.579 7.398 1.00 0.00 H new ATOM 0 HD23 LEU B 3 4.128 -1.677 8.304 1.00 0.00 H new ATOM 1526 N GLU B 4 5.374 -3.916 10.723 1.00 0.00 N ATOM 1527 CA GLU B 4 4.757 -5.264 10.570 1.00 0.00 C ATOM 1528 C GLU B 4 3.439 -5.309 11.348 1.00 0.00 C ATOM 1529 O GLU B 4 2.421 -5.751 10.855 1.00 0.00 O ATOM 1530 CB GLU B 4 5.712 -6.331 11.110 1.00 0.00 C ATOM 1531 CG GLU B 4 7.106 -6.127 10.506 1.00 0.00 C ATOM 1532 CD GLU B 4 7.945 -7.391 10.706 1.00 0.00 C ATOM 1533 OE1 GLU B 4 8.308 -7.664 11.838 1.00 0.00 O ATOM 1534 OE2 GLU B 4 8.211 -8.063 9.723 1.00 0.00 O ATOM 0 H GLU B 4 6.312 -3.908 11.124 1.00 0.00 H new ATOM 0 HA GLU B 4 4.563 -5.459 9.515 1.00 0.00 H new ATOM 0 HB2 GLU B 4 5.763 -6.271 12.197 1.00 0.00 H new ATOM 0 HB3 GLU B 4 5.340 -7.325 10.863 1.00 0.00 H new ATOM 0 HG2 GLU B 4 7.023 -5.899 9.443 1.00 0.00 H new ATOM 0 HG3 GLU B 4 7.596 -5.275 10.978 1.00 0.00 H new ATOM 1541 N LYS B 5 3.467 -4.843 12.567 1.00 0.00 N ATOM 1542 CA LYS B 5 2.240 -4.833 13.414 1.00 0.00 C ATOM 1543 C LYS B 5 1.060 -4.286 12.607 1.00 0.00 C ATOM 1544 O LYS B 5 -0.042 -4.797 12.656 1.00 0.00 O ATOM 1545 CB LYS B 5 2.488 -3.907 14.613 1.00 0.00 C ATOM 1546 CG LYS B 5 1.350 -4.045 15.645 1.00 0.00 C ATOM 1547 CD LYS B 5 1.632 -5.215 16.596 1.00 0.00 C ATOM 1548 CE LYS B 5 0.588 -5.224 17.714 1.00 0.00 C ATOM 1549 NZ LYS B 5 -0.770 -5.383 17.124 1.00 0.00 N ATOM 0 H LYS B 5 4.300 -4.464 13.018 1.00 0.00 H new ATOM 0 HA LYS B 5 2.013 -5.846 13.748 1.00 0.00 H new ATOM 0 HB2 LYS B 5 3.442 -4.153 15.079 1.00 0.00 H new ATOM 0 HB3 LYS B 5 2.556 -2.873 14.274 1.00 0.00 H new ATOM 0 HG2 LYS B 5 1.252 -3.121 16.214 1.00 0.00 H new ATOM 0 HG3 LYS B 5 0.402 -4.205 15.132 1.00 0.00 H new ATOM 0 HD2 LYS B 5 1.603 -6.157 16.049 1.00 0.00 H new ATOM 0 HD3 LYS B 5 2.632 -5.122 17.018 1.00 0.00 H new ATOM 0 HE2 LYS B 5 0.792 -6.038 18.410 1.00 0.00 H new ATOM 0 HE3 LYS B 5 0.642 -4.297 18.284 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -1.442 -5.659 17.868 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -1.072 -4.482 16.701 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -0.745 -6.119 16.390 1.00 0.00 H new ATOM 1563 N ALA B 6 1.297 -3.238 11.870 1.00 0.00 N ATOM 1564 CA ALA B 6 0.218 -2.617 11.052 1.00 0.00 C ATOM 1565 C ALA B 6 -0.005 -3.409 9.756 1.00 0.00 C ATOM 1566 O ALA B 6 -1.097 -3.432 9.232 1.00 0.00 O ATOM 1567 CB ALA B 6 0.610 -1.166 10.731 1.00 0.00 C ATOM 0 H ALA B 6 2.205 -2.779 11.798 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.715 -2.630 11.616 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -0.173 -0.701 10.132 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.735 -0.609 11.660 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.547 -1.157 10.173 1.00 0.00 H new ATOM 1573 N MET B 7 0.989 -4.065 9.235 1.00 0.00 N ATOM 1574 CA MET B 7 0.758 -4.839 7.981 1.00 0.00 C ATOM 1575 C MET B 7 -0.359 -5.863 8.237 1.00 0.00 C ATOM 1576 O MET B 7 -1.300 -5.989 7.469 1.00 0.00 O ATOM 1577 CB MET B 7 2.057 -5.559 7.578 1.00 0.00 C ATOM 1578 CG MET B 7 2.070 -5.819 6.064 1.00 0.00 C ATOM 1579 SD MET B 7 2.662 -4.332 5.208 1.00 0.00 S ATOM 1580 CE MET B 7 1.218 -4.042 4.152 1.00 0.00 C ATOM 0 H MET B 7 1.936 -4.102 9.612 1.00 0.00 H new ATOM 0 HA MET B 7 0.463 -4.171 7.172 1.00 0.00 H new ATOM 0 HB2 MET B 7 2.919 -4.954 7.858 1.00 0.00 H new ATOM 0 HB3 MET B 7 2.141 -6.502 8.117 1.00 0.00 H new ATOM 0 HG2 MET B 7 2.715 -6.667 5.834 1.00 0.00 H new ATOM 0 HG3 MET B 7 1.069 -6.078 5.719 1.00 0.00 H new ATOM 0 HE1 MET B 7 1.388 -3.157 3.539 1.00 0.00 H new ATOM 0 HE2 MET B 7 1.060 -4.906 3.507 1.00 0.00 H new ATOM 0 HE3 MET B 7 0.337 -3.888 4.775 1.00 0.00 H new ATOM 1590 N VAL B 8 -0.266 -6.584 9.319 1.00 0.00 N ATOM 1591 CA VAL B 8 -1.316 -7.591 9.642 1.00 0.00 C ATOM 1592 C VAL B 8 -2.655 -6.881 9.859 1.00 0.00 C ATOM 1593 O VAL B 8 -3.699 -7.387 9.499 1.00 0.00 O ATOM 1594 CB VAL B 8 -0.921 -8.346 10.914 1.00 0.00 C ATOM 1595 CG1 VAL B 8 -1.747 -9.631 11.025 1.00 0.00 C ATOM 1596 CG2 VAL B 8 0.566 -8.702 10.849 1.00 0.00 C ATOM 0 H VAL B 8 0.494 -6.519 9.996 1.00 0.00 H new ATOM 0 HA VAL B 8 -1.412 -8.297 8.817 1.00 0.00 H new ATOM 0 HB VAL B 8 -1.110 -7.717 11.784 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -1.465 -10.168 11.931 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -2.807 -9.380 11.067 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -1.558 -10.261 10.156 1.00 0.00 H new ATOM 0 HG21 VAL B 8 0.851 -9.240 11.753 1.00 0.00 H new ATOM 0 HG22 VAL B 8 0.752 -9.331 9.979 1.00 0.00 H new ATOM 0 HG23 VAL B 8 1.156 -7.789 10.769 1.00 0.00 H new ATOM 1606 N ALA B 9 -2.636 -5.710 10.437 1.00 0.00 N ATOM 1607 CA ALA B 9 -3.912 -4.974 10.665 1.00 0.00 C ATOM 1608 C ALA B 9 -4.623 -4.767 9.325 1.00 0.00 C ATOM 1609 O ALA B 9 -5.804 -5.003 9.195 1.00 0.00 O ATOM 1610 CB ALA B 9 -3.606 -3.614 11.292 1.00 0.00 C ATOM 0 H ALA B 9 -1.794 -5.233 10.760 1.00 0.00 H new ATOM 0 HA ALA B 9 -4.553 -5.549 11.334 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -4.537 -3.073 11.460 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -3.094 -3.759 12.243 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -2.968 -3.039 10.620 1.00 0.00 H new ATOM 1616 N LEU B 10 -3.919 -4.316 8.331 1.00 0.00 N ATOM 1617 CA LEU B 10 -4.572 -4.086 7.008 1.00 0.00 C ATOM 1618 C LEU B 10 -5.405 -5.316 6.643 1.00 0.00 C ATOM 1619 O LEU B 10 -6.538 -5.211 6.213 1.00 0.00 O ATOM 1620 CB LEU B 10 -3.473 -3.872 5.938 1.00 0.00 C ATOM 1621 CG LEU B 10 -3.185 -2.368 5.727 1.00 0.00 C ATOM 1622 CD1 LEU B 10 -4.337 -1.695 4.954 1.00 0.00 C ATOM 1623 CD2 LEU B 10 -2.988 -1.668 7.086 1.00 0.00 C ATOM 0 H LEU B 10 -2.924 -4.096 8.371 1.00 0.00 H new ATOM 0 HA LEU B 10 -5.217 -3.208 7.055 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -2.559 -4.381 6.245 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -3.787 -4.321 4.996 1.00 0.00 H new ATOM 0 HG LEU B 10 -2.271 -2.275 5.141 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -4.114 -0.637 4.817 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -4.449 -2.172 3.980 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -5.264 -1.800 5.518 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -2.786 -0.609 6.924 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -3.891 -1.777 7.686 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -2.147 -2.122 7.611 1.00 0.00 H new ATOM 1635 N ILE B 11 -4.851 -6.484 6.823 1.00 0.00 N ATOM 1636 CA ILE B 11 -5.619 -7.716 6.497 1.00 0.00 C ATOM 1637 C ILE B 11 -6.808 -7.819 7.457 1.00 0.00 C ATOM 1638 O ILE B 11 -7.917 -8.125 7.064 1.00 0.00 O ATOM 1639 CB ILE B 11 -4.716 -8.941 6.651 1.00 0.00 C ATOM 1640 CG1 ILE B 11 -3.606 -8.880 5.598 1.00 0.00 C ATOM 1641 CG2 ILE B 11 -5.544 -10.211 6.447 1.00 0.00 C ATOM 1642 CD1 ILE B 11 -2.564 -9.960 5.886 1.00 0.00 C ATOM 0 H ILE B 11 -3.907 -6.637 7.179 1.00 0.00 H new ATOM 0 HA ILE B 11 -5.978 -7.672 5.469 1.00 0.00 H new ATOM 0 HB ILE B 11 -4.276 -8.952 7.648 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -4.027 -9.023 4.603 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -3.137 -7.896 5.607 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -4.902 -11.085 6.556 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -6.340 -10.250 7.191 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -5.981 -10.204 5.448 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -1.775 -9.914 5.135 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -2.134 -9.796 6.874 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -3.038 -10.941 5.855 1.00 0.00 H new ATOM 1654 N ASP B 12 -6.577 -7.552 8.717 1.00 0.00 N ATOM 1655 CA ASP B 12 -7.675 -7.617 9.720 1.00 0.00 C ATOM 1656 C ASP B 12 -8.876 -6.807 9.235 1.00 0.00 C ATOM 1657 O ASP B 12 -10.000 -7.266 9.260 1.00 0.00 O ATOM 1658 CB ASP B 12 -7.191 -7.016 11.046 1.00 0.00 C ATOM 1659 CG ASP B 12 -5.952 -7.773 11.526 1.00 0.00 C ATOM 1660 OD1 ASP B 12 -5.589 -8.744 10.882 1.00 0.00 O ATOM 1661 OD2 ASP B 12 -5.390 -7.374 12.533 1.00 0.00 O ATOM 0 H ASP B 12 -5.666 -7.290 9.094 1.00 0.00 H new ATOM 0 HA ASP B 12 -7.963 -8.659 9.857 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -6.957 -5.960 10.915 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -7.981 -7.077 11.795 1.00 0.00 H new ATOM 1666 N VAL B 13 -8.648 -5.587 8.814 1.00 0.00 N ATOM 1667 CA VAL B 13 -9.784 -4.738 8.354 1.00 0.00 C ATOM 1668 C VAL B 13 -10.241 -5.149 6.954 1.00 0.00 C ATOM 1669 O VAL B 13 -11.423 -5.280 6.705 1.00 0.00 O ATOM 1670 CB VAL B 13 -9.369 -3.267 8.358 1.00 0.00 C ATOM 1671 CG1 VAL B 13 -10.530 -2.413 7.849 1.00 0.00 C ATOM 1672 CG2 VAL B 13 -9.010 -2.840 9.783 1.00 0.00 C ATOM 0 H VAL B 13 -7.729 -5.147 8.770 1.00 0.00 H new ATOM 0 HA VAL B 13 -10.619 -4.879 9.041 1.00 0.00 H new ATOM 0 HB VAL B 13 -8.503 -3.131 7.710 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -10.237 -1.363 7.851 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -10.787 -2.716 6.834 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -11.394 -2.550 8.499 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -8.714 -1.791 9.785 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -9.875 -2.974 10.432 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -8.184 -3.450 10.149 1.00 0.00 H new ATOM 1682 N PHE B 14 -9.346 -5.339 6.029 1.00 0.00 N ATOM 1683 CA PHE B 14 -9.798 -5.722 4.661 1.00 0.00 C ATOM 1684 C PHE B 14 -10.756 -6.914 4.759 1.00 0.00 C ATOM 1685 O PHE B 14 -11.684 -7.049 3.984 1.00 0.00 O ATOM 1686 CB PHE B 14 -8.594 -6.101 3.796 1.00 0.00 C ATOM 1687 CG PHE B 14 -9.068 -6.426 2.399 1.00 0.00 C ATOM 1688 CD1 PHE B 14 -9.539 -7.711 2.101 1.00 0.00 C ATOM 1689 CD2 PHE B 14 -9.041 -5.442 1.403 1.00 0.00 C ATOM 1690 CE1 PHE B 14 -9.983 -8.011 0.806 1.00 0.00 C ATOM 1691 CE2 PHE B 14 -9.486 -5.742 0.110 1.00 0.00 C ATOM 1692 CZ PHE B 14 -9.956 -7.026 -0.189 1.00 0.00 C ATOM 0 H PHE B 14 -8.338 -5.248 6.154 1.00 0.00 H new ATOM 0 HA PHE B 14 -10.310 -4.876 4.203 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -7.878 -5.279 3.768 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -8.078 -6.959 4.226 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -9.560 -8.470 2.869 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -8.677 -4.451 1.632 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -10.346 -9.002 0.575 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -9.467 -4.982 -0.657 1.00 0.00 H new ATOM 0 HZ PHE B 14 -10.298 -7.257 -1.187 1.00 0.00 H new ATOM 1702 N HIS B 15 -10.529 -7.785 5.705 1.00 0.00 N ATOM 1703 CA HIS B 15 -11.409 -8.978 5.854 1.00 0.00 C ATOM 1704 C HIS B 15 -12.695 -8.602 6.597 1.00 0.00 C ATOM 1705 O HIS B 15 -13.737 -9.194 6.395 1.00 0.00 O ATOM 1706 CB HIS B 15 -10.666 -10.057 6.644 1.00 0.00 C ATOM 1707 CG HIS B 15 -11.395 -11.367 6.518 1.00 0.00 C ATOM 1708 ND1 HIS B 15 -11.487 -12.050 5.315 1.00 0.00 N ATOM 1709 CD2 HIS B 15 -12.073 -12.132 7.435 1.00 0.00 C ATOM 1710 CE1 HIS B 15 -12.195 -13.172 5.538 1.00 0.00 C ATOM 1711 NE2 HIS B 15 -12.577 -13.271 6.814 1.00 0.00 N ATOM 0 H HIS B 15 -9.769 -7.721 6.383 1.00 0.00 H new ATOM 0 HA HIS B 15 -11.669 -9.352 4.864 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -9.647 -10.159 6.270 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -10.593 -9.769 7.693 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -12.196 -11.887 8.480 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -12.426 -13.904 4.778 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -13.121 -14.020 7.241 1.00 0.00 H new ATOM 1719 N GLN B 16 -12.625 -7.635 7.473 1.00 0.00 N ATOM 1720 CA GLN B 16 -13.837 -7.240 8.247 1.00 0.00 C ATOM 1721 C GLN B 16 -14.987 -6.926 7.291 1.00 0.00 C ATOM 1722 O GLN B 16 -16.105 -7.355 7.497 1.00 0.00 O ATOM 1723 CB GLN B 16 -13.529 -6.009 9.101 1.00 0.00 C ATOM 1724 CG GLN B 16 -14.630 -5.828 10.146 1.00 0.00 C ATOM 1725 CD GLN B 16 -14.384 -4.538 10.927 1.00 0.00 C ATOM 1726 OE1 GLN B 16 -14.435 -3.458 10.372 1.00 0.00 O ATOM 1727 NE2 GLN B 16 -14.116 -4.605 12.203 1.00 0.00 N ATOM 0 H GLN B 16 -11.782 -7.102 7.686 1.00 0.00 H new ATOM 0 HA GLN B 16 -14.127 -8.066 8.897 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -12.562 -6.125 9.591 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -13.462 -5.123 8.470 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -15.605 -5.791 9.660 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -14.645 -6.680 10.826 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -14.073 -5.512 12.668 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -13.949 -3.751 12.735 1.00 0.00 H new ATOM 1736 N TYR B 17 -14.731 -6.187 6.244 1.00 0.00 N ATOM 1737 CA TYR B 17 -15.821 -5.860 5.286 1.00 0.00 C ATOM 1738 C TYR B 17 -16.142 -7.102 4.458 1.00 0.00 C ATOM 1739 O TYR B 17 -17.287 -7.391 4.171 1.00 0.00 O ATOM 1740 CB TYR B 17 -15.367 -4.726 4.361 1.00 0.00 C ATOM 1741 CG TYR B 17 -15.376 -3.421 5.123 1.00 0.00 C ATOM 1742 CD1 TYR B 17 -14.314 -3.105 5.978 1.00 0.00 C ATOM 1743 CD2 TYR B 17 -16.448 -2.531 4.978 1.00 0.00 C ATOM 1744 CE1 TYR B 17 -14.323 -1.899 6.688 1.00 0.00 C ATOM 1745 CE2 TYR B 17 -16.456 -1.325 5.690 1.00 0.00 C ATOM 1746 CZ TYR B 17 -15.393 -1.009 6.545 1.00 0.00 C ATOM 1747 OH TYR B 17 -15.401 0.178 7.248 1.00 0.00 O ATOM 0 H TYR B 17 -13.817 -5.798 6.013 1.00 0.00 H new ATOM 0 HA TYR B 17 -16.710 -5.542 5.831 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -14.366 -4.931 3.981 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -16.029 -4.660 3.497 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -13.488 -3.792 6.090 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -17.267 -2.775 4.318 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -13.503 -1.655 7.347 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -17.282 -0.638 5.580 1.00 0.00 H new ATOM 0 HH TYR B 17 -15.267 0.926 6.629 1.00 0.00 H new ATOM 1757 N SER B 18 -15.134 -7.842 4.073 1.00 0.00 N ATOM 1758 CA SER B 18 -15.365 -9.075 3.262 1.00 0.00 C ATOM 1759 C SER B 18 -15.305 -10.311 4.166 1.00 0.00 C ATOM 1760 O SER B 18 -14.540 -11.222 3.917 1.00 0.00 O ATOM 1761 CB SER B 18 -14.279 -9.187 2.192 1.00 0.00 C ATOM 1762 OG SER B 18 -14.135 -7.934 1.537 1.00 0.00 O ATOM 0 H SER B 18 -14.156 -7.644 4.287 1.00 0.00 H new ATOM 0 HA SER B 18 -16.347 -9.016 2.792 1.00 0.00 H new ATOM 0 HB2 SER B 18 -13.334 -9.484 2.646 1.00 0.00 H new ATOM 0 HB3 SER B 18 -14.542 -9.960 1.470 1.00 0.00 H new ATOM 0 HG SER B 18 -13.438 -8.002 0.851 1.00 0.00 H new ATOM 1768 N GLY B 19 -16.118 -10.370 5.200 1.00 0.00 N ATOM 1769 CA GLY B 19 -16.128 -11.568 6.107 1.00 0.00 C ATOM 1770 C GLY B 19 -17.507 -12.221 6.002 1.00 0.00 C ATOM 1771 O GLY B 19 -17.728 -13.320 6.471 1.00 0.00 O ATOM 0 H GLY B 19 -16.778 -9.636 5.455 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -15.348 -12.273 5.818 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -15.923 -11.270 7.135 1.00 0.00 H new ATOM 1775 N ARG B 20 -18.424 -11.556 5.358 1.00 0.00 N ATOM 1776 CA ARG B 20 -19.788 -12.123 5.170 1.00 0.00 C ATOM 1777 C ARG B 20 -19.699 -13.360 4.277 1.00 0.00 C ATOM 1778 O ARG B 20 -20.457 -14.294 4.450 1.00 0.00 O ATOM 1779 CB ARG B 20 -20.688 -11.075 4.512 1.00 0.00 C ATOM 1780 CG ARG B 20 -22.152 -11.503 4.636 1.00 0.00 C ATOM 1781 CD ARG B 20 -23.035 -10.523 3.865 1.00 0.00 C ATOM 1782 NE ARG B 20 -24.455 -10.967 3.944 1.00 0.00 N ATOM 1783 CZ ARG B 20 -25.373 -10.337 3.262 1.00 0.00 C ATOM 1784 NH1 ARG B 20 -25.045 -9.674 2.186 1.00 0.00 N ATOM 1785 NH2 ARG B 20 -26.617 -10.374 3.654 1.00 0.00 N ATOM 0 H ARG B 20 -18.285 -10.632 4.949 1.00 0.00 H new ATOM 0 HA ARG B 20 -20.208 -12.402 6.136 1.00 0.00 H new ATOM 0 HB2 ARG B 20 -20.541 -10.105 4.987 1.00 0.00 H new ATOM 0 HB3 ARG B 20 -20.420 -10.959 3.462 1.00 0.00 H new ATOM 0 HG2 ARG B 20 -22.282 -12.512 4.244 1.00 0.00 H new ATOM 0 HG3 ARG B 20 -22.447 -11.528 5.685 1.00 0.00 H new ATOM 0 HD2 ARG B 20 -22.933 -9.520 4.280 1.00 0.00 H new ATOM 0 HD3 ARG B 20 -22.716 -10.471 2.824 1.00 0.00 H new ATOM 0 HE ARG B 20 -24.710 -11.762 4.530 1.00 0.00 H new ATOM 0 HH11 ARG B 20 -24.073 -9.649 1.879 1.00 0.00 H new ATOM 0 HH12 ARG B 20 -25.761 -9.181 1.652 1.00 0.00 H new ATOM 0 HH21 ARG B 20 -26.872 -10.895 4.493 1.00 0.00 H new ATOM 0 HH22 ARG B 20 -27.334 -9.882 3.121 1.00 0.00 H new ATOM 1799 N GLU B 21 -18.783 -13.410 3.344 1.00 0.00 N ATOM 1800 CA GLU B 21 -18.679 -14.637 2.491 1.00 0.00 C ATOM 1801 C GLU B 21 -17.220 -14.881 2.105 1.00 0.00 C ATOM 1802 O GLU B 21 -16.731 -15.990 2.175 1.00 0.00 O ATOM 1803 CB GLU B 21 -19.517 -14.458 1.223 1.00 0.00 C ATOM 1804 CG GLU B 21 -20.988 -14.271 1.597 1.00 0.00 C ATOM 1805 CD GLU B 21 -21.842 -14.300 0.328 1.00 0.00 C ATOM 1806 OE1 GLU B 21 -21.778 -13.346 -0.428 1.00 0.00 O ATOM 1807 OE2 GLU B 21 -22.547 -15.277 0.135 1.00 0.00 O ATOM 0 H GLU B 21 -18.113 -12.670 3.136 1.00 0.00 H new ATOM 0 HA GLU B 21 -19.051 -15.493 3.055 1.00 0.00 H new ATOM 0 HB2 GLU B 21 -19.163 -13.594 0.661 1.00 0.00 H new ATOM 0 HB3 GLU B 21 -19.404 -15.328 0.576 1.00 0.00 H new ATOM 0 HG2 GLU B 21 -21.304 -15.060 2.280 1.00 0.00 H new ATOM 0 HG3 GLU B 21 -21.124 -13.324 2.119 1.00 0.00 H new ATOM 1814 N GLY B 22 -16.518 -13.863 1.696 1.00 0.00 N ATOM 1815 CA GLY B 22 -15.093 -14.058 1.307 1.00 0.00 C ATOM 1816 C GLY B 22 -14.984 -15.234 0.333 1.00 0.00 C ATOM 1817 O GLY B 22 -13.901 -15.690 0.026 1.00 0.00 O ATOM 0 H GLY B 22 -16.866 -12.908 1.614 1.00 0.00 H new ATOM 0 HA2 GLY B 22 -14.705 -13.151 0.843 1.00 0.00 H new ATOM 0 HA3 GLY B 22 -14.486 -14.248 2.192 1.00 0.00 H new ATOM 1821 N ASP B 23 -16.092 -15.730 -0.159 1.00 0.00 N ATOM 1822 CA ASP B 23 -16.031 -16.876 -1.116 1.00 0.00 C ATOM 1823 C ASP B 23 -14.984 -16.555 -2.183 1.00 0.00 C ATOM 1824 O ASP B 23 -13.967 -17.211 -2.285 1.00 0.00 O ATOM 1825 CB ASP B 23 -17.398 -17.070 -1.778 1.00 0.00 C ATOM 1826 CG ASP B 23 -18.414 -17.525 -0.729 1.00 0.00 C ATOM 1827 OD1 ASP B 23 -18.099 -17.444 0.447 1.00 0.00 O ATOM 1828 OD2 ASP B 23 -19.490 -17.947 -1.119 1.00 0.00 O ATOM 0 H ASP B 23 -17.030 -15.393 0.059 1.00 0.00 H new ATOM 0 HA ASP B 23 -15.763 -17.792 -0.589 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -17.727 -16.138 -2.238 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -17.326 -17.810 -2.575 1.00 0.00 H new ATOM 1833 N LYS B 24 -15.205 -15.524 -2.953 1.00 0.00 N ATOM 1834 CA LYS B 24 -14.199 -15.132 -3.981 1.00 0.00 C ATOM 1835 C LYS B 24 -13.212 -14.166 -3.320 1.00 0.00 C ATOM 1836 O LYS B 24 -13.416 -13.726 -2.206 1.00 0.00 O ATOM 1837 CB LYS B 24 -14.896 -14.434 -5.152 1.00 0.00 C ATOM 1838 CG LYS B 24 -16.051 -15.307 -5.658 1.00 0.00 C ATOM 1839 CD LYS B 24 -16.629 -14.718 -6.961 1.00 0.00 C ATOM 1840 CE LYS B 24 -15.839 -15.228 -8.180 1.00 0.00 C ATOM 1841 NZ LYS B 24 -15.922 -14.223 -9.278 1.00 0.00 N ATOM 0 H LYS B 24 -16.038 -14.937 -2.915 1.00 0.00 H new ATOM 0 HA LYS B 24 -13.681 -16.012 -4.362 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -15.273 -13.461 -4.836 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -14.184 -14.253 -5.957 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -15.699 -16.323 -5.834 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -16.831 -15.367 -4.899 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -17.679 -14.996 -7.058 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -16.589 -13.629 -6.924 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -14.798 -15.400 -7.907 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -16.242 -16.184 -8.515 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -15.389 -14.565 -10.103 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -16.917 -14.081 -9.544 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -15.518 -13.321 -8.954 1.00 0.00 H new ATOM 1855 N HIS B 25 -12.161 -13.812 -4.012 1.00 0.00 N ATOM 1856 CA HIS B 25 -11.160 -12.846 -3.461 1.00 0.00 C ATOM 1857 C HIS B 25 -11.137 -11.635 -4.391 1.00 0.00 C ATOM 1858 O HIS B 25 -10.095 -11.183 -4.824 1.00 0.00 O ATOM 1859 CB HIS B 25 -9.780 -13.505 -3.416 1.00 0.00 C ATOM 1860 CG HIS B 25 -9.333 -13.850 -4.810 1.00 0.00 C ATOM 1861 ND1 HIS B 25 -10.046 -14.719 -5.621 1.00 0.00 N ATOM 1862 CD2 HIS B 25 -8.242 -13.459 -5.546 1.00 0.00 C ATOM 1863 CE1 HIS B 25 -9.380 -14.823 -6.787 1.00 0.00 C ATOM 1864 NE2 HIS B 25 -8.274 -14.074 -6.794 1.00 0.00 N ATOM 0 H HIS B 25 -11.949 -14.155 -4.949 1.00 0.00 H new ATOM 0 HA HIS B 25 -11.425 -12.543 -2.448 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -9.061 -12.832 -2.950 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -9.817 -14.406 -2.803 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -7.475 -12.778 -5.208 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -9.701 -15.437 -7.615 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -7.598 -13.974 -7.551 1.00 0.00 H new ATOM 1872 N LYS B 26 -12.299 -11.111 -4.694 1.00 0.00 N ATOM 1873 CA LYS B 26 -12.401 -9.923 -5.595 1.00 0.00 C ATOM 1874 C LYS B 26 -13.301 -8.864 -4.949 1.00 0.00 C ATOM 1875 O LYS B 26 -14.242 -9.189 -4.252 1.00 0.00 O ATOM 1876 CB LYS B 26 -13.019 -10.358 -6.925 1.00 0.00 C ATOM 1877 CG LYS B 26 -12.043 -11.272 -7.668 1.00 0.00 C ATOM 1878 CD LYS B 26 -12.783 -12.004 -8.790 1.00 0.00 C ATOM 1879 CE LYS B 26 -11.780 -12.786 -9.640 1.00 0.00 C ATOM 1880 NZ LYS B 26 -11.105 -13.811 -8.796 1.00 0.00 N ATOM 0 H LYS B 26 -13.193 -11.462 -4.350 1.00 0.00 H new ATOM 0 HA LYS B 26 -11.408 -9.505 -5.762 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -13.959 -10.880 -6.747 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -13.250 -9.484 -7.534 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -11.222 -10.686 -8.081 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -11.604 -11.992 -6.977 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -13.525 -12.682 -8.368 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -13.322 -11.289 -9.411 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -12.291 -13.266 -10.475 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -11.041 -12.107 -10.066 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -10.096 -13.577 -8.706 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -11.542 -13.827 -7.853 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -11.205 -14.746 -9.240 1.00 0.00 H new ATOM 1894 N LEU B 27 -13.027 -7.603 -5.181 1.00 0.00 N ATOM 1895 CA LEU B 27 -13.872 -6.509 -4.591 1.00 0.00 C ATOM 1896 C LEU B 27 -14.432 -5.659 -5.742 1.00 0.00 C ATOM 1897 O LEU B 27 -13.749 -5.390 -6.710 1.00 0.00 O ATOM 1898 CB LEU B 27 -12.994 -5.643 -3.648 1.00 0.00 C ATOM 1899 CG LEU B 27 -13.663 -5.482 -2.271 1.00 0.00 C ATOM 1900 CD1 LEU B 27 -12.674 -4.846 -1.293 1.00 0.00 C ATOM 1901 CD2 LEU B 27 -14.893 -4.581 -2.399 1.00 0.00 C ATOM 0 H LEU B 27 -12.250 -7.279 -5.757 1.00 0.00 H new ATOM 0 HA LEU B 27 -14.698 -6.924 -4.013 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -12.014 -6.106 -3.529 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -12.831 -4.662 -4.095 1.00 0.00 H new ATOM 0 HG LEU B 27 -13.965 -6.462 -1.902 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -13.148 -4.732 -0.318 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -11.796 -5.484 -1.197 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -12.372 -3.867 -1.666 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -15.365 -4.469 -1.423 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -14.590 -3.602 -2.770 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -15.602 -5.030 -3.095 1.00 0.00 H new ATOM 1913 N LYS B 28 -15.671 -5.241 -5.652 1.00 0.00 N ATOM 1914 CA LYS B 28 -16.258 -4.420 -6.754 1.00 0.00 C ATOM 1915 C LYS B 28 -15.920 -2.944 -6.526 1.00 0.00 C ATOM 1916 O LYS B 28 -15.798 -2.497 -5.403 1.00 0.00 O ATOM 1917 CB LYS B 28 -17.781 -4.588 -6.767 1.00 0.00 C ATOM 1918 CG LYS B 28 -18.141 -6.042 -7.092 1.00 0.00 C ATOM 1919 CD LYS B 28 -19.596 -6.312 -6.697 1.00 0.00 C ATOM 1920 CE LYS B 28 -20.528 -5.430 -7.530 1.00 0.00 C ATOM 1921 NZ LYS B 28 -21.929 -5.920 -7.395 1.00 0.00 N ATOM 0 H LYS B 28 -16.296 -5.431 -4.869 1.00 0.00 H new ATOM 0 HA LYS B 28 -15.845 -4.751 -7.707 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -18.195 -4.309 -5.798 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -18.223 -3.920 -7.506 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -18.001 -6.233 -8.156 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -17.476 -6.720 -6.557 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -19.837 -7.363 -6.855 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -19.739 -6.108 -5.636 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -20.460 -4.394 -7.197 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -20.224 -5.449 -8.577 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -22.563 -5.320 -7.961 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -21.988 -6.902 -7.733 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -22.216 -5.880 -6.396 1.00 0.00 H new ATOM 1935 N LYS B 29 -15.776 -2.177 -7.570 1.00 0.00 N ATOM 1936 CA LYS B 29 -15.458 -0.733 -7.389 1.00 0.00 C ATOM 1937 C LYS B 29 -16.537 -0.071 -6.522 1.00 0.00 C ATOM 1938 O LYS B 29 -16.255 0.747 -5.670 1.00 0.00 O ATOM 1939 CB LYS B 29 -15.429 -0.056 -8.766 1.00 0.00 C ATOM 1940 CG LYS B 29 -16.854 0.030 -9.336 1.00 0.00 C ATOM 1941 CD LYS B 29 -16.799 0.284 -10.847 1.00 0.00 C ATOM 1942 CE LYS B 29 -18.143 0.839 -11.331 1.00 0.00 C ATOM 1943 NZ LYS B 29 -19.248 -0.010 -10.808 1.00 0.00 N ATOM 0 H LYS B 29 -15.864 -2.486 -8.538 1.00 0.00 H new ATOM 0 HA LYS B 29 -14.490 -0.629 -6.900 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -15.001 0.943 -8.681 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -14.790 -0.620 -9.445 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -17.392 -0.896 -9.134 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -17.404 0.832 -8.844 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -16.000 0.989 -11.077 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -16.568 -0.643 -11.372 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -18.268 1.867 -10.991 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -18.169 0.858 -12.421 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -20.116 0.176 -11.351 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -18.989 -1.013 -10.902 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -19.412 0.213 -9.805 1.00 0.00 H new ATOM 1957 N SER B 30 -17.773 -0.414 -6.759 1.00 0.00 N ATOM 1958 CA SER B 30 -18.897 0.190 -5.986 1.00 0.00 C ATOM 1959 C SER B 30 -18.726 -0.052 -4.484 1.00 0.00 C ATOM 1960 O SER B 30 -19.000 0.813 -3.669 1.00 0.00 O ATOM 1961 CB SER B 30 -20.210 -0.447 -6.440 1.00 0.00 C ATOM 1962 OG SER B 30 -20.361 -0.268 -7.842 1.00 0.00 O ATOM 0 H SER B 30 -18.056 -1.095 -7.464 1.00 0.00 H new ATOM 0 HA SER B 30 -18.904 1.265 -6.168 1.00 0.00 H new ATOM 0 HB2 SER B 30 -20.216 -1.509 -6.195 1.00 0.00 H new ATOM 0 HB3 SER B 30 -21.049 0.006 -5.912 1.00 0.00 H new ATOM 0 HG SER B 30 -21.202 -0.677 -8.135 1.00 0.00 H new ATOM 1968 N GLU B 31 -18.279 -1.221 -4.099 1.00 0.00 N ATOM 1969 CA GLU B 31 -18.116 -1.490 -2.640 1.00 0.00 C ATOM 1970 C GLU B 31 -16.810 -0.863 -2.163 1.00 0.00 C ATOM 1971 O GLU B 31 -16.709 -0.365 -1.059 1.00 0.00 O ATOM 1972 CB GLU B 31 -18.105 -2.997 -2.376 1.00 0.00 C ATOM 1973 CG GLU B 31 -19.458 -3.596 -2.764 1.00 0.00 C ATOM 1974 CD GLU B 31 -19.485 -5.078 -2.386 1.00 0.00 C ATOM 1975 OE1 GLU B 31 -18.588 -5.791 -2.804 1.00 0.00 O ATOM 1976 OE2 GLU B 31 -20.402 -5.474 -1.686 1.00 0.00 O ATOM 0 H GLU B 31 -18.024 -1.988 -4.721 1.00 0.00 H new ATOM 0 HA GLU B 31 -18.952 -1.053 -2.094 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -17.308 -3.471 -2.949 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -17.899 -3.190 -1.323 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -20.263 -3.065 -2.255 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -19.626 -3.479 -3.835 1.00 0.00 H new ATOM 1983 N LEU B 32 -15.812 -0.868 -3.005 1.00 0.00 N ATOM 1984 CA LEU B 32 -14.513 -0.255 -2.625 1.00 0.00 C ATOM 1985 C LEU B 32 -14.750 1.226 -2.336 1.00 0.00 C ATOM 1986 O LEU B 32 -14.251 1.757 -1.364 1.00 0.00 O ATOM 1987 CB LEU B 32 -13.507 -0.431 -3.773 1.00 0.00 C ATOM 1988 CG LEU B 32 -12.252 0.420 -3.536 1.00 0.00 C ATOM 1989 CD1 LEU B 32 -11.641 0.083 -2.173 1.00 0.00 C ATOM 1990 CD2 LEU B 32 -11.233 0.121 -4.639 1.00 0.00 C ATOM 0 H LEU B 32 -15.843 -1.272 -3.941 1.00 0.00 H new ATOM 0 HA LEU B 32 -14.104 -0.738 -1.737 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -13.228 -1.481 -3.860 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -13.972 -0.146 -4.717 1.00 0.00 H new ATOM 0 HG LEU B 32 -12.521 1.476 -3.553 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.751 0.691 -2.013 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -12.368 0.289 -1.387 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -11.369 -0.972 -2.147 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -10.337 0.721 -4.479 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -10.970 -0.937 -4.615 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -11.665 0.365 -5.609 1.00 0.00 H new ATOM 2002 N LYS B 33 -15.489 1.914 -3.166 1.00 0.00 N ATOM 2003 CA LYS B 33 -15.710 3.361 -2.907 1.00 0.00 C ATOM 2004 C LYS B 33 -16.252 3.531 -1.491 1.00 0.00 C ATOM 2005 O LYS B 33 -15.685 4.232 -0.677 1.00 0.00 O ATOM 2006 CB LYS B 33 -16.716 3.922 -3.917 1.00 0.00 C ATOM 2007 CG LYS B 33 -16.916 5.420 -3.667 1.00 0.00 C ATOM 2008 CD LYS B 33 -17.854 5.994 -4.730 1.00 0.00 C ATOM 2009 CE LYS B 33 -18.128 7.469 -4.428 1.00 0.00 C ATOM 2010 NZ LYS B 33 -18.826 7.585 -3.117 1.00 0.00 N ATOM 0 H LYS B 33 -15.942 1.541 -4.000 1.00 0.00 H new ATOM 0 HA LYS B 33 -14.769 3.901 -3.010 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -16.357 3.758 -4.933 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -17.668 3.398 -3.827 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -17.334 5.581 -2.673 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -15.956 5.936 -3.697 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -17.406 5.892 -5.719 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -18.790 5.435 -4.744 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -17.192 8.027 -4.404 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -18.739 7.906 -5.218 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -19.628 8.241 -3.208 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -19.175 6.650 -2.825 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -18.163 7.946 -2.402 1.00 0.00 H new ATOM 2024 N GLU B 34 -17.352 2.895 -1.191 1.00 0.00 N ATOM 2025 CA GLU B 34 -17.929 3.029 0.180 1.00 0.00 C ATOM 2026 C GLU B 34 -16.820 2.791 1.212 1.00 0.00 C ATOM 2027 O GLU B 34 -16.778 3.424 2.248 1.00 0.00 O ATOM 2028 CB GLU B 34 -19.040 1.988 0.365 1.00 0.00 C ATOM 2029 CG GLU B 34 -19.815 2.271 1.657 1.00 0.00 C ATOM 2030 CD GLU B 34 -18.980 1.842 2.865 1.00 0.00 C ATOM 2031 OE1 GLU B 34 -18.268 0.857 2.749 1.00 0.00 O ATOM 2032 OE2 GLU B 34 -19.068 2.503 3.887 1.00 0.00 O ATOM 0 H GLU B 34 -17.873 2.293 -1.829 1.00 0.00 H new ATOM 0 HA GLU B 34 -18.345 4.027 0.314 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -19.718 2.012 -0.488 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -18.609 0.987 0.401 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -20.052 3.333 1.725 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -20.763 1.733 1.649 1.00 0.00 H new ATOM 2039 N LEU B 35 -15.922 1.887 0.934 1.00 0.00 N ATOM 2040 CA LEU B 35 -14.814 1.610 1.893 1.00 0.00 C ATOM 2041 C LEU B 35 -13.869 2.818 1.955 1.00 0.00 C ATOM 2042 O LEU B 35 -13.359 3.155 3.004 1.00 0.00 O ATOM 2043 CB LEU B 35 -14.055 0.352 1.440 1.00 0.00 C ATOM 2044 CG LEU B 35 -13.079 -0.141 2.546 1.00 0.00 C ATOM 2045 CD1 LEU B 35 -12.988 -1.671 2.520 1.00 0.00 C ATOM 2046 CD2 LEU B 35 -11.673 0.436 2.317 1.00 0.00 C ATOM 0 H LEU B 35 -15.907 1.326 0.082 1.00 0.00 H new ATOM 0 HA LEU B 35 -15.221 1.438 2.890 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -14.766 -0.438 1.199 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -13.498 0.568 0.529 1.00 0.00 H new ATOM 0 HG LEU B 35 -13.460 0.195 3.510 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -12.302 -2.008 3.298 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -13.975 -2.097 2.697 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -12.621 -1.997 1.547 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -11.002 0.081 3.100 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -11.300 0.112 1.345 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -11.718 1.525 2.343 1.00 0.00 H new ATOM 2058 N ILE B 36 -13.641 3.486 0.855 1.00 0.00 N ATOM 2059 CA ILE B 36 -12.745 4.683 0.873 1.00 0.00 C ATOM 2060 C ILE B 36 -13.333 5.759 1.792 1.00 0.00 C ATOM 2061 O ILE B 36 -12.615 6.500 2.435 1.00 0.00 O ATOM 2062 CB ILE B 36 -12.641 5.240 -0.556 1.00 0.00 C ATOM 2063 CG1 ILE B 36 -11.926 4.205 -1.435 1.00 0.00 C ATOM 2064 CG2 ILE B 36 -11.841 6.553 -0.550 1.00 0.00 C ATOM 2065 CD1 ILE B 36 -11.885 4.680 -2.892 1.00 0.00 C ATOM 0 H ILE B 36 -14.036 3.255 -0.057 1.00 0.00 H new ATOM 0 HA ILE B 36 -11.759 4.399 1.241 1.00 0.00 H new ATOM 0 HB ILE B 36 -13.639 5.439 -0.948 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -10.912 4.046 -1.069 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -12.442 3.247 -1.372 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -11.772 6.941 -1.566 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -12.344 7.283 0.084 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -10.839 6.367 -0.164 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -11.375 3.935 -3.503 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -12.902 4.816 -3.259 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -11.349 5.627 -2.951 1.00 0.00 H new ATOM 2077 N ASN B 37 -14.631 5.881 1.823 1.00 0.00 N ATOM 2078 CA ASN B 37 -15.265 6.945 2.656 1.00 0.00 C ATOM 2079 C ASN B 37 -15.050 6.699 4.154 1.00 0.00 C ATOM 2080 O ASN B 37 -14.689 7.595 4.890 1.00 0.00 O ATOM 2081 CB ASN B 37 -16.767 6.974 2.369 1.00 0.00 C ATOM 2082 CG ASN B 37 -17.413 8.117 3.153 1.00 0.00 C ATOM 2083 OD1 ASN B 37 -18.323 7.899 3.928 1.00 0.00 O ATOM 2084 ND2 ASN B 37 -16.976 9.335 2.985 1.00 0.00 N ATOM 0 H ASN B 37 -15.282 5.290 1.307 1.00 0.00 H new ATOM 0 HA ASN B 37 -14.800 7.897 2.398 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -16.942 7.107 1.301 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -17.220 6.024 2.651 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -17.398 10.105 3.504 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -16.212 9.518 2.334 1.00 0.00 H new ATOM 2091 N ASN B 38 -15.309 5.508 4.621 1.00 0.00 N ATOM 2092 CA ASN B 38 -15.164 5.224 6.083 1.00 0.00 C ATOM 2093 C ASN B 38 -13.727 4.825 6.437 1.00 0.00 C ATOM 2094 O ASN B 38 -13.459 4.443 7.559 1.00 0.00 O ATOM 2095 CB ASN B 38 -16.113 4.085 6.464 1.00 0.00 C ATOM 2096 CG ASN B 38 -16.126 3.912 7.984 1.00 0.00 C ATOM 2097 OD1 ASN B 38 -15.944 4.863 8.718 1.00 0.00 O ATOM 2098 ND2 ASN B 38 -16.342 2.728 8.489 1.00 0.00 N ATOM 0 H ASN B 38 -15.615 4.717 4.055 1.00 0.00 H new ATOM 0 HA ASN B 38 -15.410 6.130 6.636 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -17.119 4.301 6.104 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -15.795 3.159 5.985 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -16.358 2.600 9.501 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -16.495 1.930 7.872 1.00 0.00 H new ATOM 2105 N GLU B 39 -12.803 4.888 5.505 1.00 0.00 N ATOM 2106 CA GLU B 39 -11.386 4.486 5.816 1.00 0.00 C ATOM 2107 C GLU B 39 -10.402 5.605 5.458 1.00 0.00 C ATOM 2108 O GLU B 39 -9.341 5.701 6.044 1.00 0.00 O ATOM 2109 CB GLU B 39 -11.043 3.233 5.012 1.00 0.00 C ATOM 2110 CG GLU B 39 -11.938 2.076 5.466 1.00 0.00 C ATOM 2111 CD GLU B 39 -11.572 1.669 6.896 1.00 0.00 C ATOM 2112 OE1 GLU B 39 -12.099 2.270 7.816 1.00 0.00 O ATOM 2113 OE2 GLU B 39 -10.773 0.759 7.045 1.00 0.00 O ATOM 0 H GLU B 39 -12.965 5.198 4.547 1.00 0.00 H new ATOM 0 HA GLU B 39 -11.303 4.290 6.885 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -11.184 3.421 3.948 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -9.994 2.973 5.153 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -12.985 2.374 5.420 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -11.818 1.226 4.794 1.00 0.00 H new ATOM 2120 N LEU B 40 -10.734 6.454 4.514 1.00 0.00 N ATOM 2121 CA LEU B 40 -9.804 7.572 4.131 1.00 0.00 C ATOM 2122 C LEU B 40 -10.482 8.913 4.427 1.00 0.00 C ATOM 2123 O LEU B 40 -10.140 9.935 3.866 1.00 0.00 O ATOM 2124 CB LEU B 40 -9.470 7.470 2.631 1.00 0.00 C ATOM 2125 CG LEU B 40 -8.317 6.463 2.410 1.00 0.00 C ATOM 2126 CD1 LEU B 40 -8.398 5.878 0.994 1.00 0.00 C ATOM 2127 CD2 LEU B 40 -6.960 7.167 2.589 1.00 0.00 C ATOM 0 H LEU B 40 -11.609 6.423 3.990 1.00 0.00 H new ATOM 0 HA LEU B 40 -8.881 7.500 4.706 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.352 7.152 2.075 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -9.186 8.450 2.246 1.00 0.00 H new ATOM 0 HG LEU B 40 -8.409 5.661 3.142 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -7.583 5.170 0.846 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -9.352 5.366 0.866 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -8.317 6.682 0.263 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -6.154 6.450 2.431 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -6.872 7.977 1.865 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -6.891 7.574 3.598 1.00 0.00 H new ATOM 2139 N SER B 41 -11.437 8.910 5.314 1.00 0.00 N ATOM 2140 CA SER B 41 -12.144 10.172 5.665 1.00 0.00 C ATOM 2141 C SER B 41 -11.210 11.074 6.478 1.00 0.00 C ATOM 2142 O SER B 41 -11.378 12.276 6.521 1.00 0.00 O ATOM 2143 CB SER B 41 -13.385 9.846 6.499 1.00 0.00 C ATOM 2144 OG SER B 41 -13.661 10.929 7.378 1.00 0.00 O ATOM 0 H SER B 41 -11.760 8.082 5.814 1.00 0.00 H new ATOM 0 HA SER B 41 -12.442 10.686 4.751 1.00 0.00 H new ATOM 0 HB2 SER B 41 -14.239 9.667 5.846 1.00 0.00 H new ATOM 0 HB3 SER B 41 -13.223 8.932 7.070 1.00 0.00 H new ATOM 0 HG SER B 41 -14.456 10.722 7.912 1.00 0.00 H new ATOM 2150 N HIS B 42 -10.232 10.503 7.129 1.00 0.00 N ATOM 2151 CA HIS B 42 -9.295 11.329 7.945 1.00 0.00 C ATOM 2152 C HIS B 42 -8.361 12.124 7.029 1.00 0.00 C ATOM 2153 O HIS B 42 -8.191 13.317 7.185 1.00 0.00 O ATOM 2154 CB HIS B 42 -8.465 10.409 8.843 1.00 0.00 C ATOM 2155 CG HIS B 42 -7.503 11.230 9.657 1.00 0.00 C ATOM 2156 ND1 HIS B 42 -7.405 12.606 9.522 1.00 0.00 N ATOM 2157 CD2 HIS B 42 -6.594 10.882 10.625 1.00 0.00 C ATOM 2158 CE1 HIS B 42 -6.467 13.032 10.388 1.00 0.00 C ATOM 2159 NE2 HIS B 42 -5.940 12.021 11.085 1.00 0.00 N ATOM 0 H HIS B 42 -10.041 9.501 7.131 1.00 0.00 H new ATOM 0 HA HIS B 42 -9.869 12.025 8.557 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -9.121 9.840 9.502 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -7.919 9.687 8.235 1.00 0.00 H new ATOM 0 HD1 HIS B 42 -7.945 13.189 8.883 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -6.414 9.877 10.976 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -6.176 14.065 10.505 1.00 0.00 H new ATOM 2167 N PHE B 43 -7.744 11.473 6.080 1.00 0.00 N ATOM 2168 CA PHE B 43 -6.814 12.195 5.166 1.00 0.00 C ATOM 2169 C PHE B 43 -7.605 13.157 4.277 1.00 0.00 C ATOM 2170 O PHE B 43 -7.059 14.077 3.701 1.00 0.00 O ATOM 2171 CB PHE B 43 -6.069 11.181 4.296 1.00 0.00 C ATOM 2172 CG PHE B 43 -5.064 10.436 5.145 1.00 0.00 C ATOM 2173 CD1 PHE B 43 -5.479 9.359 5.937 1.00 0.00 C ATOM 2174 CD2 PHE B 43 -3.719 10.824 5.142 1.00 0.00 C ATOM 2175 CE1 PHE B 43 -4.549 8.671 6.726 1.00 0.00 C ATOM 2176 CE2 PHE B 43 -2.789 10.135 5.930 1.00 0.00 C ATOM 2177 CZ PHE B 43 -3.205 9.058 6.721 1.00 0.00 C ATOM 0 H PHE B 43 -7.844 10.474 5.899 1.00 0.00 H new ATOM 0 HA PHE B 43 -6.096 12.765 5.755 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -6.774 10.481 3.849 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -5.563 11.691 3.476 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -6.516 9.059 5.940 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -3.398 11.655 4.532 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -4.870 7.841 7.339 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -1.751 10.434 5.927 1.00 0.00 H new ATOM 0 HZ PHE B 43 -2.488 8.525 7.328 1.00 0.00 H new ATOM 2187 N LEU B 44 -8.886 12.945 4.153 1.00 0.00 N ATOM 2188 CA LEU B 44 -9.713 13.839 3.292 1.00 0.00 C ATOM 2189 C LEU B 44 -9.423 15.304 3.648 1.00 0.00 C ATOM 2190 O LEU B 44 -9.585 16.193 2.837 1.00 0.00 O ATOM 2191 CB LEU B 44 -11.205 13.513 3.520 1.00 0.00 C ATOM 2192 CG LEU B 44 -12.018 13.669 2.219 1.00 0.00 C ATOM 2193 CD1 LEU B 44 -11.828 15.081 1.652 1.00 0.00 C ATOM 2194 CD2 LEU B 44 -11.582 12.615 1.174 1.00 0.00 C ATOM 0 H LEU B 44 -9.397 12.190 4.611 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.468 13.681 2.242 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -11.304 12.494 3.893 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.611 14.174 4.286 1.00 0.00 H new ATOM 0 HG LEU B 44 -13.072 13.513 2.447 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -12.405 15.185 0.733 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -12.172 15.815 2.381 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -10.772 15.248 1.438 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -12.167 12.742 0.263 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -10.524 12.744 0.946 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -11.747 11.615 1.575 1.00 0.00 H new ATOM 2206 N GLU B 45 -8.998 15.560 4.854 1.00 0.00 N ATOM 2207 CA GLU B 45 -8.706 16.964 5.256 1.00 0.00 C ATOM 2208 C GLU B 45 -7.347 17.393 4.699 1.00 0.00 C ATOM 2209 O GLU B 45 -7.168 18.517 4.271 1.00 0.00 O ATOM 2210 CB GLU B 45 -8.684 17.062 6.783 1.00 0.00 C ATOM 2211 CG GLU B 45 -8.622 18.533 7.201 1.00 0.00 C ATOM 2212 CD GLU B 45 -8.387 18.625 8.710 1.00 0.00 C ATOM 2213 OE1 GLU B 45 -8.678 17.658 9.395 1.00 0.00 O ATOM 2214 OE2 GLU B 45 -7.921 19.661 9.155 1.00 0.00 O ATOM 0 H GLU B 45 -8.840 14.859 5.578 1.00 0.00 H new ATOM 0 HA GLU B 45 -9.480 17.620 4.857 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -9.574 16.592 7.201 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -7.823 16.524 7.180 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -7.820 19.041 6.666 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -9.551 19.037 6.935 1.00 0.00 H new ATOM 2221 N GLU B 46 -6.383 16.512 4.711 1.00 0.00 N ATOM 2222 CA GLU B 46 -5.026 16.869 4.195 1.00 0.00 C ATOM 2223 C GLU B 46 -4.924 16.557 2.698 1.00 0.00 C ATOM 2224 O GLU B 46 -4.062 15.814 2.271 1.00 0.00 O ATOM 2225 CB GLU B 46 -3.973 16.059 4.953 1.00 0.00 C ATOM 2226 CG GLU B 46 -4.056 16.384 6.446 1.00 0.00 C ATOM 2227 CD GLU B 46 -2.982 15.600 7.199 1.00 0.00 C ATOM 2228 OE1 GLU B 46 -1.826 15.710 6.825 1.00 0.00 O ATOM 2229 OE2 GLU B 46 -3.333 14.903 8.136 1.00 0.00 O ATOM 0 H GLU B 46 -6.475 15.557 5.057 1.00 0.00 H new ATOM 0 HA GLU B 46 -4.858 17.936 4.344 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -4.134 14.993 4.793 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -2.978 16.292 4.574 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -3.919 17.454 6.604 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -5.044 16.129 6.830 1.00 0.00 H new ATOM 2236 N ILE B 47 -5.785 17.137 1.897 1.00 0.00 N ATOM 2237 CA ILE B 47 -5.742 16.904 0.415 1.00 0.00 C ATOM 2238 C ILE B 47 -5.460 18.237 -0.277 1.00 0.00 C ATOM 2239 O ILE B 47 -6.326 19.083 -0.380 1.00 0.00 O ATOM 2240 CB ILE B 47 -7.099 16.373 -0.063 1.00 0.00 C ATOM 2241 CG1 ILE B 47 -7.479 15.110 0.724 1.00 0.00 C ATOM 2242 CG2 ILE B 47 -7.030 16.049 -1.558 1.00 0.00 C ATOM 2243 CD1 ILE B 47 -6.365 14.059 0.635 1.00 0.00 C ATOM 0 H ILE B 47 -6.523 17.768 2.208 1.00 0.00 H new ATOM 0 HA ILE B 47 -4.965 16.178 0.177 1.00 0.00 H new ATOM 0 HB ILE B 47 -7.858 17.137 0.106 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -7.661 15.367 1.768 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -8.408 14.697 0.331 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -7.996 15.672 -1.894 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -6.780 16.952 -2.115 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -6.265 15.292 -1.731 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -6.655 13.173 1.199 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -6.203 13.788 -0.408 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -5.444 14.469 1.051 1.00 0.00 H new ATOM 2255 N LYS B 48 -4.259 18.441 -0.751 1.00 0.00 N ATOM 2256 CA LYS B 48 -3.943 19.734 -1.428 1.00 0.00 C ATOM 2257 C LYS B 48 -4.387 19.657 -2.890 1.00 0.00 C ATOM 2258 O LYS B 48 -5.093 20.515 -3.381 1.00 0.00 O ATOM 2259 CB LYS B 48 -2.437 19.998 -1.359 1.00 0.00 C ATOM 2260 CG LYS B 48 -2.048 20.366 0.075 1.00 0.00 C ATOM 2261 CD LYS B 48 -0.525 20.333 0.217 1.00 0.00 C ATOM 2262 CE LYS B 48 -0.146 20.540 1.684 1.00 0.00 C ATOM 2263 NZ LYS B 48 -0.741 21.815 2.174 1.00 0.00 N ATOM 0 H LYS B 48 -3.489 17.774 -0.700 1.00 0.00 H new ATOM 0 HA LYS B 48 -4.470 20.547 -0.928 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -1.887 19.114 -1.681 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -2.167 20.806 -2.039 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -2.425 21.358 0.322 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -2.504 19.668 0.777 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -0.136 19.379 -0.139 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -0.074 21.111 -0.400 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -0.504 19.704 2.285 1.00 0.00 H new ATOM 0 HE3 LYS B 48 0.938 20.567 1.790 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -0.277 22.096 3.061 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -0.604 22.559 1.460 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -1.758 21.681 2.343 1.00 0.00 H new ATOM 2277 N GLU B 49 -3.985 18.627 -3.588 1.00 0.00 N ATOM 2278 CA GLU B 49 -4.392 18.488 -5.016 1.00 0.00 C ATOM 2279 C GLU B 49 -5.776 17.838 -5.081 1.00 0.00 C ATOM 2280 O GLU B 49 -5.914 16.643 -4.910 1.00 0.00 O ATOM 2281 CB GLU B 49 -3.379 17.609 -5.755 1.00 0.00 C ATOM 2282 CG GLU B 49 -2.050 18.355 -5.892 1.00 0.00 C ATOM 2283 CD GLU B 49 -1.371 18.451 -4.524 1.00 0.00 C ATOM 2284 OE1 GLU B 49 -1.323 17.444 -3.837 1.00 0.00 O ATOM 2285 OE2 GLU B 49 -0.909 19.529 -4.188 1.00 0.00 O ATOM 0 H GLU B 49 -3.393 17.877 -3.231 1.00 0.00 H new ATOM 0 HA GLU B 49 -4.425 19.471 -5.486 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -3.229 16.676 -5.212 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -3.762 17.346 -6.741 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -1.400 17.835 -6.596 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -2.222 19.353 -6.295 1.00 0.00 H new ATOM 2292 N GLN B 50 -6.802 18.603 -5.331 1.00 0.00 N ATOM 2293 CA GLN B 50 -8.168 18.010 -5.408 1.00 0.00 C ATOM 2294 C GLN B 50 -8.359 17.345 -6.774 1.00 0.00 C ATOM 2295 O GLN B 50 -9.203 16.488 -6.942 1.00 0.00 O ATOM 2296 CB GLN B 50 -9.212 19.115 -5.228 1.00 0.00 C ATOM 2297 CG GLN B 50 -9.053 19.746 -3.844 1.00 0.00 C ATOM 2298 CD GLN B 50 -10.218 20.701 -3.578 1.00 0.00 C ATOM 2299 OE1 GLN B 50 -11.259 20.596 -4.196 1.00 0.00 O ATOM 2300 NE2 GLN B 50 -10.086 21.635 -2.676 1.00 0.00 N ATOM 0 H GLN B 50 -6.755 19.610 -5.485 1.00 0.00 H new ATOM 0 HA GLN B 50 -8.287 17.265 -4.622 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -9.091 19.874 -6.001 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -10.215 18.704 -5.339 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -9.025 18.969 -3.080 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -8.107 20.285 -3.785 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -9.212 21.723 -2.157 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -10.857 22.277 -2.490 1.00 0.00 H new ATOM 2309 N GLU B 51 -7.587 17.733 -7.751 1.00 0.00 N ATOM 2310 CA GLU B 51 -7.732 17.124 -9.106 1.00 0.00 C ATOM 2311 C GLU B 51 -7.171 15.698 -9.108 1.00 0.00 C ATOM 2312 O GLU B 51 -7.554 14.885 -9.925 1.00 0.00 O ATOM 2313 CB GLU B 51 -7.008 17.977 -10.150 1.00 0.00 C ATOM 2314 CG GLU B 51 -7.651 19.364 -10.215 1.00 0.00 C ATOM 2315 CD GLU B 51 -9.079 19.242 -10.750 1.00 0.00 C ATOM 2316 OE1 GLU B 51 -9.267 18.527 -11.721 1.00 0.00 O ATOM 2317 OE2 GLU B 51 -9.959 19.866 -10.182 1.00 0.00 O ATOM 0 H GLU B 51 -6.861 18.445 -7.671 1.00 0.00 H new ATOM 0 HA GLU B 51 -8.791 17.085 -9.360 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -5.952 18.066 -9.893 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -7.059 17.495 -11.127 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -7.660 19.819 -9.224 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -7.065 20.018 -10.860 1.00 0.00 H new ATOM 2324 N VAL B 52 -6.304 15.364 -8.193 1.00 0.00 N ATOM 2325 CA VAL B 52 -5.784 13.966 -8.156 1.00 0.00 C ATOM 2326 C VAL B 52 -6.883 13.065 -7.592 1.00 0.00 C ATOM 2327 O VAL B 52 -7.210 12.046 -8.166 1.00 0.00 O ATOM 2328 CB VAL B 52 -4.551 13.887 -7.250 1.00 0.00 C ATOM 2329 CG1 VAL B 52 -4.152 12.421 -7.052 1.00 0.00 C ATOM 2330 CG2 VAL B 52 -3.390 14.640 -7.897 1.00 0.00 C ATOM 0 H VAL B 52 -5.936 15.989 -7.476 1.00 0.00 H new ATOM 0 HA VAL B 52 -5.502 13.648 -9.160 1.00 0.00 H new ATOM 0 HB VAL B 52 -4.786 14.336 -6.285 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -3.275 12.367 -6.407 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -4.977 11.879 -6.589 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -3.920 11.973 -8.018 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -2.514 14.583 -7.251 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -3.159 14.191 -8.863 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -3.668 15.684 -8.039 1.00 0.00 H new ATOM 2340 N VAL B 53 -7.462 13.424 -6.483 1.00 0.00 N ATOM 2341 CA VAL B 53 -8.539 12.570 -5.913 1.00 0.00 C ATOM 2342 C VAL B 53 -9.700 12.507 -6.908 1.00 0.00 C ATOM 2343 O VAL B 53 -10.383 11.508 -7.020 1.00 0.00 O ATOM 2344 CB VAL B 53 -9.020 13.168 -4.586 1.00 0.00 C ATOM 2345 CG1 VAL B 53 -10.276 12.433 -4.110 1.00 0.00 C ATOM 2346 CG2 VAL B 53 -7.919 13.020 -3.534 1.00 0.00 C ATOM 0 H VAL B 53 -7.239 14.264 -5.950 1.00 0.00 H new ATOM 0 HA VAL B 53 -8.159 11.565 -5.730 1.00 0.00 H new ATOM 0 HB VAL B 53 -9.253 14.223 -4.731 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -10.613 12.862 -3.167 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -11.063 12.536 -4.857 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -10.047 11.377 -3.967 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -8.259 13.445 -2.589 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -7.688 11.964 -3.395 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -7.024 13.546 -3.867 1.00 0.00 H new ATOM 2356 N ASP B 54 -9.929 13.569 -7.631 1.00 0.00 N ATOM 2357 CA ASP B 54 -11.045 13.573 -8.616 1.00 0.00 C ATOM 2358 C ASP B 54 -10.820 12.470 -9.653 1.00 0.00 C ATOM 2359 O ASP B 54 -11.721 11.727 -9.989 1.00 0.00 O ATOM 2360 CB ASP B 54 -11.098 14.929 -9.325 1.00 0.00 C ATOM 2361 CG ASP B 54 -11.392 16.028 -8.305 1.00 0.00 C ATOM 2362 OD1 ASP B 54 -11.565 15.700 -7.143 1.00 0.00 O ATOM 2363 OD2 ASP B 54 -11.437 17.181 -8.703 1.00 0.00 O ATOM 0 H ASP B 54 -9.391 14.434 -7.581 1.00 0.00 H new ATOM 0 HA ASP B 54 -11.985 13.396 -8.094 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -10.150 15.127 -9.825 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -11.869 14.918 -10.096 1.00 0.00 H new ATOM 2368 N LYS B 55 -9.625 12.368 -10.176 1.00 0.00 N ATOM 2369 CA LYS B 55 -9.349 11.326 -11.206 1.00 0.00 C ATOM 2370 C LYS B 55 -9.410 9.935 -10.575 1.00 0.00 C ATOM 2371 O LYS B 55 -9.735 8.967 -11.234 1.00 0.00 O ATOM 2372 CB LYS B 55 -7.973 11.558 -11.829 1.00 0.00 C ATOM 2373 CG LYS B 55 -7.689 10.466 -12.861 1.00 0.00 C ATOM 2374 CD LYS B 55 -6.431 10.824 -13.654 1.00 0.00 C ATOM 2375 CE LYS B 55 -6.000 9.621 -14.493 1.00 0.00 C ATOM 2376 NZ LYS B 55 -5.462 8.558 -13.598 1.00 0.00 N ATOM 0 H LYS B 55 -8.831 12.961 -9.934 1.00 0.00 H new ATOM 0 HA LYS B 55 -10.107 11.392 -11.987 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -7.937 12.539 -12.303 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -7.206 11.550 -11.055 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -7.556 9.506 -12.362 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -8.538 10.359 -13.536 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -6.626 11.680 -14.300 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -5.629 11.113 -12.974 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -6.848 9.238 -15.061 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -5.241 9.921 -15.216 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -4.831 7.934 -14.140 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -4.930 8.996 -12.819 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -6.249 8.001 -13.209 1.00 0.00 H new ATOM 2390 N VAL B 56 -9.146 9.817 -9.303 1.00 0.00 N ATOM 2391 CA VAL B 56 -9.242 8.483 -8.649 1.00 0.00 C ATOM 2392 C VAL B 56 -10.699 8.025 -8.710 1.00 0.00 C ATOM 2393 O VAL B 56 -11.007 6.960 -9.208 1.00 0.00 O ATOM 2394 CB VAL B 56 -8.812 8.608 -7.184 1.00 0.00 C ATOM 2395 CG1 VAL B 56 -9.094 7.294 -6.451 1.00 0.00 C ATOM 2396 CG2 VAL B 56 -7.313 8.909 -7.118 1.00 0.00 C ATOM 0 H VAL B 56 -8.869 10.584 -8.690 1.00 0.00 H new ATOM 0 HA VAL B 56 -8.597 7.764 -9.155 1.00 0.00 H new ATOM 0 HB VAL B 56 -9.371 9.416 -6.712 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -8.787 7.386 -5.409 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -10.160 7.073 -6.497 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -8.535 6.486 -6.924 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -7.005 8.998 -6.076 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -6.758 8.099 -7.592 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -7.106 9.844 -7.639 1.00 0.00 H new ATOM 2406 N MET B 57 -11.594 8.819 -8.195 1.00 0.00 N ATOM 2407 CA MET B 57 -13.031 8.431 -8.206 1.00 0.00 C ATOM 2408 C MET B 57 -13.489 8.128 -9.635 1.00 0.00 C ATOM 2409 O MET B 57 -14.412 7.367 -9.846 1.00 0.00 O ATOM 2410 CB MET B 57 -13.866 9.577 -7.635 1.00 0.00 C ATOM 2411 CG MET B 57 -13.555 9.741 -6.146 1.00 0.00 C ATOM 2412 SD MET B 57 -14.200 8.318 -5.232 1.00 0.00 S ATOM 2413 CE MET B 57 -13.821 8.924 -3.569 1.00 0.00 C ATOM 0 H MET B 57 -11.392 9.722 -7.766 1.00 0.00 H new ATOM 0 HA MET B 57 -13.163 7.536 -7.598 1.00 0.00 H new ATOM 0 HB2 MET B 57 -13.646 10.502 -8.168 1.00 0.00 H new ATOM 0 HB3 MET B 57 -14.927 9.373 -7.776 1.00 0.00 H new ATOM 0 HG2 MET B 57 -12.479 9.825 -5.996 1.00 0.00 H new ATOM 0 HG3 MET B 57 -14.002 10.661 -5.770 1.00 0.00 H new ATOM 0 HE1 MET B 57 -14.141 8.188 -2.832 1.00 0.00 H new ATOM 0 HE2 MET B 57 -12.747 9.086 -3.477 1.00 0.00 H new ATOM 0 HE3 MET B 57 -14.346 9.863 -3.396 1.00 0.00 H new ATOM 2423 N GLU B 58 -12.843 8.696 -10.625 1.00 0.00 N ATOM 2424 CA GLU B 58 -13.237 8.410 -12.038 1.00 0.00 C ATOM 2425 C GLU B 58 -12.528 7.141 -12.513 1.00 0.00 C ATOM 2426 O GLU B 58 -13.086 6.359 -13.257 1.00 0.00 O ATOM 2427 CB GLU B 58 -12.884 9.592 -12.943 1.00 0.00 C ATOM 2428 CG GLU B 58 -13.786 10.781 -12.604 1.00 0.00 C ATOM 2429 CD GLU B 58 -13.315 12.017 -13.372 1.00 0.00 C ATOM 2430 OE1 GLU B 58 -12.923 11.866 -14.517 1.00 0.00 O ATOM 2431 OE2 GLU B 58 -13.353 13.095 -12.801 1.00 0.00 O ATOM 0 H GLU B 58 -12.062 9.343 -10.515 1.00 0.00 H new ATOM 0 HA GLU B 58 -14.315 8.259 -12.087 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -11.837 9.866 -12.810 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -13.010 9.313 -13.989 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -14.820 10.552 -12.863 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -13.761 10.975 -11.532 1.00 0.00 H new ATOM 2438 N THR B 59 -11.317 6.910 -12.088 1.00 0.00 N ATOM 2439 CA THR B 59 -10.622 5.669 -12.528 1.00 0.00 C ATOM 2440 C THR B 59 -11.340 4.475 -11.894 1.00 0.00 C ATOM 2441 O THR B 59 -11.675 3.524 -12.572 1.00 0.00 O ATOM 2442 CB THR B 59 -9.146 5.703 -12.114 1.00 0.00 C ATOM 2443 OG1 THR B 59 -8.654 7.030 -12.239 1.00 0.00 O ATOM 2444 CG2 THR B 59 -8.333 4.770 -13.017 1.00 0.00 C ATOM 0 H THR B 59 -10.785 7.517 -11.464 1.00 0.00 H new ATOM 0 HA THR B 59 -10.652 5.585 -13.614 1.00 0.00 H new ATOM 0 HB THR B 59 -9.053 5.372 -11.080 1.00 0.00 H new ATOM 0 HG1 THR B 59 -8.844 7.528 -11.417 1.00 0.00 H new ATOM 0 HG21 THR B 59 -7.285 4.798 -12.719 1.00 0.00 H new ATOM 0 HG22 THR B 59 -8.711 3.752 -12.922 1.00 0.00 H new ATOM 0 HG23 THR B 59 -8.424 5.096 -14.053 1.00 0.00 H new ATOM 2452 N LEU B 60 -11.627 4.520 -10.624 1.00 0.00 N ATOM 2453 CA LEU B 60 -12.374 3.389 -10.010 1.00 0.00 C ATOM 2454 C LEU B 60 -13.711 3.258 -10.742 1.00 0.00 C ATOM 2455 O LEU B 60 -14.029 2.220 -11.286 1.00 0.00 O ATOM 2456 CB LEU B 60 -12.626 3.684 -8.519 1.00 0.00 C ATOM 2457 CG LEU B 60 -11.432 3.217 -7.677 1.00 0.00 C ATOM 2458 CD1 LEU B 60 -10.214 4.086 -7.988 1.00 0.00 C ATOM 2459 CD2 LEU B 60 -11.784 3.344 -6.193 1.00 0.00 C ATOM 0 H LEU B 60 -11.380 5.281 -9.991 1.00 0.00 H new ATOM 0 HA LEU B 60 -11.802 2.465 -10.092 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -12.787 4.752 -8.374 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -13.533 3.178 -8.189 1.00 0.00 H new ATOM 0 HG LEU B 60 -11.202 2.178 -7.913 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -9.367 3.753 -7.389 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -9.966 4.000 -9.046 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -10.439 5.126 -7.751 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -10.939 3.013 -5.589 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -12.011 4.384 -5.961 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -12.653 2.725 -5.971 1.00 0.00 H new ATOM 2471 N ASP B 61 -14.490 4.306 -10.774 1.00 0.00 N ATOM 2472 CA ASP B 61 -15.795 4.234 -11.487 1.00 0.00 C ATOM 2473 C ASP B 61 -15.564 3.667 -12.890 1.00 0.00 C ATOM 2474 O ASP B 61 -16.462 3.132 -13.510 1.00 0.00 O ATOM 2475 CB ASP B 61 -16.397 5.638 -11.594 1.00 0.00 C ATOM 2476 CG ASP B 61 -17.864 5.535 -12.014 1.00 0.00 C ATOM 2477 OD1 ASP B 61 -18.504 4.570 -11.629 1.00 0.00 O ATOM 2478 OD2 ASP B 61 -18.323 6.423 -12.713 1.00 0.00 O ATOM 0 H ASP B 61 -14.279 5.204 -10.339 1.00 0.00 H new ATOM 0 HA ASP B 61 -16.482 3.590 -10.938 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -16.317 6.153 -10.637 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -15.840 6.229 -12.321 1.00 0.00 H new ATOM 2483 N GLU B 62 -14.356 3.777 -13.390 1.00 0.00 N ATOM 2484 CA GLU B 62 -14.039 3.242 -14.751 1.00 0.00 C ATOM 2485 C GLU B 62 -13.272 1.937 -14.611 1.00 0.00 C ATOM 2486 O GLU B 62 -12.318 1.668 -15.314 1.00 0.00 O ATOM 2487 CB GLU B 62 -13.176 4.230 -15.488 1.00 0.00 C ATOM 2488 CG GLU B 62 -14.002 5.453 -15.906 1.00 0.00 C ATOM 2489 CD GLU B 62 -14.857 5.103 -17.127 1.00 0.00 C ATOM 2490 OE1 GLU B 62 -14.293 4.654 -18.111 1.00 0.00 O ATOM 2491 OE2 GLU B 62 -16.060 5.291 -17.057 1.00 0.00 O ATOM 0 H GLU B 62 -13.571 4.218 -12.910 1.00 0.00 H new ATOM 0 HA GLU B 62 -14.966 3.075 -15.299 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -12.347 4.543 -14.853 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -12.742 3.757 -16.369 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -14.640 5.772 -15.082 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -13.341 6.288 -16.139 1.00 0.00 H new ATOM 2498 N ASP B 63 -13.697 1.144 -13.705 1.00 0.00 N ATOM 2499 CA ASP B 63 -13.043 -0.178 -13.450 1.00 0.00 C ATOM 2500 C ASP B 63 -12.741 -0.859 -14.786 1.00 0.00 C ATOM 2501 O ASP B 63 -11.740 -1.530 -14.948 1.00 0.00 O ATOM 2502 CB ASP B 63 -14.029 -1.057 -12.685 1.00 0.00 C ATOM 2503 CG ASP B 63 -15.292 -1.254 -13.527 1.00 0.00 C ATOM 2504 OD1 ASP B 63 -15.643 -0.340 -14.255 1.00 0.00 O ATOM 2505 OD2 ASP B 63 -15.886 -2.315 -13.429 1.00 0.00 O ATOM 0 H ASP B 63 -14.494 1.344 -13.101 1.00 0.00 H new ATOM 0 HA ASP B 63 -12.122 -0.035 -12.885 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -13.574 -2.022 -12.460 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -14.283 -0.594 -11.732 1.00 0.00 H new ATOM 2510 N GLY B 64 -13.598 -0.654 -15.743 1.00 0.00 N ATOM 2511 CA GLY B 64 -13.401 -1.242 -17.097 1.00 0.00 C ATOM 2512 C GLY B 64 -13.173 -2.762 -17.038 1.00 0.00 C ATOM 2513 O GLY B 64 -13.163 -3.418 -18.062 1.00 0.00 O ATOM 0 H GLY B 64 -14.444 -0.093 -15.643 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -14.274 -1.030 -17.715 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -12.547 -0.766 -17.578 1.00 0.00 H new ATOM 2517 N ASP B 65 -12.993 -3.339 -15.867 1.00 0.00 N ATOM 2518 CA ASP B 65 -12.770 -4.831 -15.784 1.00 0.00 C ATOM 2519 C ASP B 65 -14.010 -5.577 -15.220 1.00 0.00 C ATOM 2520 O ASP B 65 -14.246 -6.707 -15.601 1.00 0.00 O ATOM 2521 CB ASP B 65 -11.574 -5.099 -14.867 1.00 0.00 C ATOM 2522 CG ASP B 65 -11.707 -4.260 -13.595 1.00 0.00 C ATOM 2523 OD1 ASP B 65 -12.762 -4.307 -12.986 1.00 0.00 O ATOM 2524 OD2 ASP B 65 -10.750 -3.585 -13.252 1.00 0.00 O ATOM 0 H ASP B 65 -12.990 -2.850 -14.972 1.00 0.00 H new ATOM 0 HA ASP B 65 -12.587 -5.200 -16.793 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -11.527 -6.158 -14.613 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -10.645 -4.853 -15.382 1.00 0.00 H new ATOM 2529 N GLY B 66 -14.808 -5.002 -14.334 1.00 0.00 N ATOM 2530 CA GLY B 66 -16.003 -5.734 -13.800 1.00 0.00 C ATOM 2531 C GLY B 66 -15.717 -6.202 -12.366 1.00 0.00 C ATOM 2532 O GLY B 66 -16.618 -6.370 -11.569 1.00 0.00 O ATOM 0 H GLY B 66 -14.678 -4.061 -13.963 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -16.878 -5.084 -13.814 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -16.232 -6.590 -14.435 1.00 0.00 H new ATOM 2536 N GLU B 67 -14.468 -6.403 -12.028 1.00 0.00 N ATOM 2537 CA GLU B 67 -14.125 -6.844 -10.640 1.00 0.00 C ATOM 2538 C GLU B 67 -12.745 -6.297 -10.249 1.00 0.00 C ATOM 2539 O GLU B 67 -11.795 -6.417 -10.997 1.00 0.00 O ATOM 2540 CB GLU B 67 -14.130 -8.377 -10.577 1.00 0.00 C ATOM 2541 CG GLU B 67 -12.896 -8.955 -11.285 1.00 0.00 C ATOM 2542 CD GLU B 67 -12.756 -8.334 -12.677 1.00 0.00 C ATOM 2543 OE1 GLU B 67 -13.746 -8.294 -13.389 1.00 0.00 O ATOM 2544 OE2 GLU B 67 -11.661 -7.911 -13.008 1.00 0.00 O ATOM 0 H GLU B 67 -13.671 -6.281 -12.653 1.00 0.00 H new ATOM 0 HA GLU B 67 -14.865 -6.458 -9.939 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -14.144 -8.703 -9.537 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -15.037 -8.762 -11.044 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -12.001 -8.755 -10.696 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -12.987 -10.038 -11.368 1.00 0.00 H new ATOM 2551 N CYS B 68 -12.623 -5.700 -9.085 1.00 0.00 N ATOM 2552 CA CYS B 68 -11.298 -5.148 -8.648 1.00 0.00 C ATOM 2553 C CYS B 68 -10.652 -6.107 -7.640 1.00 0.00 C ATOM 2554 O CYS B 68 -11.244 -6.464 -6.641 1.00 0.00 O ATOM 2555 CB CYS B 68 -11.510 -3.779 -7.990 1.00 0.00 C ATOM 2556 SG CYS B 68 -12.717 -2.831 -8.948 1.00 0.00 S ATOM 0 H CYS B 68 -13.384 -5.571 -8.418 1.00 0.00 H new ATOM 0 HA CYS B 68 -10.645 -5.039 -9.514 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -11.861 -3.906 -6.966 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -10.565 -3.238 -7.938 1.00 0.00 H new ATOM 0 HG CYS B 68 -12.899 -1.671 -8.390 1.00 0.00 H new ATOM 2562 N ASP B 69 -9.443 -6.530 -7.900 1.00 0.00 N ATOM 2563 CA ASP B 69 -8.757 -7.472 -6.964 1.00 0.00 C ATOM 2564 C ASP B 69 -8.096 -6.690 -5.824 1.00 0.00 C ATOM 2565 O ASP B 69 -8.260 -5.492 -5.701 1.00 0.00 O ATOM 2566 CB ASP B 69 -7.689 -8.256 -7.729 1.00 0.00 C ATOM 2567 CG ASP B 69 -8.345 -9.012 -8.885 1.00 0.00 C ATOM 2568 OD1 ASP B 69 -9.324 -8.512 -9.415 1.00 0.00 O ATOM 2569 OD2 ASP B 69 -7.858 -10.079 -9.221 1.00 0.00 O ATOM 0 H ASP B 69 -8.899 -6.264 -8.721 1.00 0.00 H new ATOM 0 HA ASP B 69 -9.491 -8.160 -6.545 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -6.927 -7.577 -8.110 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -7.187 -8.956 -7.061 1.00 0.00 H new ATOM 2574 N PHE B 70 -7.343 -7.362 -4.992 1.00 0.00 N ATOM 2575 CA PHE B 70 -6.662 -6.663 -3.863 1.00 0.00 C ATOM 2576 C PHE B 70 -5.475 -5.865 -4.411 1.00 0.00 C ATOM 2577 O PHE B 70 -5.081 -4.866 -3.843 1.00 0.00 O ATOM 2578 CB PHE B 70 -6.185 -7.699 -2.838 1.00 0.00 C ATOM 2579 CG PHE B 70 -5.654 -7.013 -1.599 1.00 0.00 C ATOM 2580 CD1 PHE B 70 -4.387 -6.417 -1.614 1.00 0.00 C ATOM 2581 CD2 PHE B 70 -6.426 -6.985 -0.432 1.00 0.00 C ATOM 2582 CE1 PHE B 70 -3.895 -5.792 -0.462 1.00 0.00 C ATOM 2583 CE2 PHE B 70 -5.934 -6.362 0.720 1.00 0.00 C ATOM 2584 CZ PHE B 70 -4.668 -5.764 0.705 1.00 0.00 C ATOM 0 H PHE B 70 -7.171 -8.366 -5.046 1.00 0.00 H new ATOM 0 HA PHE B 70 -7.354 -5.978 -3.373 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -7.009 -8.360 -2.570 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -5.406 -8.322 -3.278 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.790 -6.439 -2.514 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -7.403 -7.445 -0.421 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.918 -5.331 -0.473 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -6.530 -6.342 1.620 1.00 0.00 H new ATOM 0 HZ PHE B 70 -4.288 -5.281 1.593 1.00 0.00 H new ATOM 2594 N GLN B 71 -4.915 -6.273 -5.515 1.00 0.00 N ATOM 2595 CA GLN B 71 -3.774 -5.500 -6.084 1.00 0.00 C ATOM 2596 C GLN B 71 -4.274 -4.100 -6.449 1.00 0.00 C ATOM 2597 O GLN B 71 -3.567 -3.122 -6.312 1.00 0.00 O ATOM 2598 CB GLN B 71 -3.259 -6.197 -7.346 1.00 0.00 C ATOM 2599 CG GLN B 71 -2.448 -7.433 -6.956 1.00 0.00 C ATOM 2600 CD GLN B 71 -1.845 -8.065 -8.212 1.00 0.00 C ATOM 2601 OE1 GLN B 71 -2.561 -8.488 -9.098 1.00 0.00 O ATOM 2602 NE2 GLN B 71 -0.547 -8.148 -8.326 1.00 0.00 N ATOM 0 H GLN B 71 -5.193 -7.099 -6.044 1.00 0.00 H new ATOM 0 HA GLN B 71 -2.966 -5.437 -5.355 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -4.096 -6.485 -7.982 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -2.640 -5.512 -7.925 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -1.657 -7.157 -6.259 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -3.086 -8.153 -6.444 1.00 0.00 H new ATOM 0 HE21 GLN B 71 0.054 -7.793 -7.582 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -0.134 -8.568 -9.159 1.00 0.00 H new ATOM 2611 N GLU B 72 -5.490 -4.000 -6.905 1.00 0.00 N ATOM 2612 CA GLU B 72 -6.045 -2.667 -7.274 1.00 0.00 C ATOM 2613 C GLU B 72 -6.350 -1.854 -6.010 1.00 0.00 C ATOM 2614 O GLU B 72 -6.383 -0.641 -6.032 1.00 0.00 O ATOM 2615 CB GLU B 72 -7.323 -2.846 -8.097 1.00 0.00 C ATOM 2616 CG GLU B 72 -7.010 -3.651 -9.360 1.00 0.00 C ATOM 2617 CD GLU B 72 -6.186 -2.792 -10.321 1.00 0.00 C ATOM 2618 OE1 GLU B 72 -6.446 -1.602 -10.391 1.00 0.00 O ATOM 2619 OE2 GLU B 72 -5.310 -3.338 -10.971 1.00 0.00 O ATOM 0 H GLU B 72 -6.126 -4.786 -7.039 1.00 0.00 H new ATOM 0 HA GLU B 72 -5.307 -2.130 -7.870 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -8.080 -3.359 -7.505 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -7.734 -1.873 -8.366 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -6.460 -4.555 -9.101 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -7.935 -3.968 -9.841 1.00 0.00 H new ATOM 2626 N PHE B 73 -6.546 -2.514 -4.902 1.00 0.00 N ATOM 2627 CA PHE B 73 -6.822 -1.783 -3.630 1.00 0.00 C ATOM 2628 C PHE B 73 -5.508 -1.229 -3.060 1.00 0.00 C ATOM 2629 O PHE B 73 -5.463 -0.112 -2.591 1.00 0.00 O ATOM 2630 CB PHE B 73 -7.511 -2.726 -2.627 1.00 0.00 C ATOM 2631 CG PHE B 73 -7.369 -2.200 -1.215 1.00 0.00 C ATOM 2632 CD1 PHE B 73 -6.192 -2.444 -0.496 1.00 0.00 C ATOM 2633 CD2 PHE B 73 -8.410 -1.473 -0.627 1.00 0.00 C ATOM 2634 CE1 PHE B 73 -6.055 -1.960 0.809 1.00 0.00 C ATOM 2635 CE2 PHE B 73 -8.273 -0.988 0.679 1.00 0.00 C ATOM 2636 CZ PHE B 73 -7.096 -1.232 1.397 1.00 0.00 C ATOM 0 H PHE B 73 -6.527 -3.531 -4.821 1.00 0.00 H new ATOM 0 HA PHE B 73 -7.492 -0.945 -3.823 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -8.567 -2.825 -2.879 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -7.072 -3.721 -2.696 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -5.389 -3.006 -0.950 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -9.318 -1.286 -1.180 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -5.147 -2.148 1.363 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -9.075 -0.425 1.133 1.00 0.00 H new ATOM 0 HZ PHE B 73 -6.991 -0.858 2.405 1.00 0.00 H new ATOM 2646 N MET B 74 -4.446 -1.973 -3.085 1.00 0.00 N ATOM 2647 CA MET B 74 -3.178 -1.425 -2.524 1.00 0.00 C ATOM 2648 C MET B 74 -2.643 -0.319 -3.448 1.00 0.00 C ATOM 2649 O MET B 74 -2.026 0.619 -2.984 1.00 0.00 O ATOM 2650 CB MET B 74 -2.144 -2.558 -2.370 1.00 0.00 C ATOM 2651 CG MET B 74 -1.273 -2.315 -1.129 1.00 0.00 C ATOM 2652 SD MET B 74 -2.287 -2.495 0.362 1.00 0.00 S ATOM 2653 CE MET B 74 -1.419 -1.278 1.384 1.00 0.00 C ATOM 0 H MET B 74 -4.394 -2.920 -3.461 1.00 0.00 H new ATOM 0 HA MET B 74 -3.367 -0.995 -1.540 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.655 -3.517 -2.283 1.00 0.00 H new ATOM 0 HB3 MET B 74 -1.516 -2.611 -3.259 1.00 0.00 H new ATOM 0 HG2 MET B 74 -0.446 -3.024 -1.107 1.00 0.00 H new ATOM 0 HG3 MET B 74 -0.837 -1.317 -1.167 1.00 0.00 H new ATOM 0 HE1 MET B 74 -1.889 -1.227 2.366 1.00 0.00 H new ATOM 0 HE2 MET B 74 -0.376 -1.574 1.496 1.00 0.00 H new ATOM 0 HE3 MET B 74 -1.469 -0.300 0.906 1.00 0.00 H new ATOM 2663 N ALA B 75 -2.868 -0.387 -4.730 1.00 0.00 N ATOM 2664 CA ALA B 75 -2.365 0.693 -5.632 1.00 0.00 C ATOM 2665 C ALA B 75 -3.282 1.924 -5.578 1.00 0.00 C ATOM 2666 O ALA B 75 -2.827 3.021 -5.322 1.00 0.00 O ATOM 2667 CB ALA B 75 -2.320 0.166 -7.067 1.00 0.00 C ATOM 0 H ALA B 75 -3.376 -1.140 -5.194 1.00 0.00 H new ATOM 0 HA ALA B 75 -1.368 0.986 -5.302 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -1.954 0.949 -7.731 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -1.653 -0.694 -7.118 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -3.322 -0.133 -7.376 1.00 0.00 H new ATOM 2673 N PHE B 76 -4.555 1.776 -5.831 1.00 0.00 N ATOM 2674 CA PHE B 76 -5.448 2.975 -5.804 1.00 0.00 C ATOM 2675 C PHE B 76 -5.397 3.627 -4.416 1.00 0.00 C ATOM 2676 O PHE B 76 -5.481 4.832 -4.283 1.00 0.00 O ATOM 2677 CB PHE B 76 -6.896 2.564 -6.143 1.00 0.00 C ATOM 2678 CG PHE B 76 -7.088 2.550 -7.649 1.00 0.00 C ATOM 2679 CD1 PHE B 76 -6.937 3.735 -8.383 1.00 0.00 C ATOM 2680 CD2 PHE B 76 -7.406 1.357 -8.312 1.00 0.00 C ATOM 2681 CE1 PHE B 76 -7.102 3.726 -9.771 1.00 0.00 C ATOM 2682 CE2 PHE B 76 -7.574 1.350 -9.701 1.00 0.00 C ATOM 2683 CZ PHE B 76 -7.422 2.534 -10.431 1.00 0.00 C ATOM 0 H PHE B 76 -5.012 0.891 -6.052 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.104 3.693 -6.548 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.110 1.578 -5.731 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.598 3.260 -5.684 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -6.693 4.656 -7.875 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.522 0.442 -7.750 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -6.982 4.640 -10.335 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -7.821 0.430 -10.210 1.00 0.00 H new ATOM 0 HZ PHE B 76 -7.552 2.528 -11.503 1.00 0.00 H new ATOM 2693 N VAL B 77 -5.248 2.843 -3.389 1.00 0.00 N ATOM 2694 CA VAL B 77 -5.178 3.430 -2.021 1.00 0.00 C ATOM 2695 C VAL B 77 -3.912 4.286 -1.920 1.00 0.00 C ATOM 2696 O VAL B 77 -3.880 5.284 -1.228 1.00 0.00 O ATOM 2697 CB VAL B 77 -5.146 2.302 -0.979 1.00 0.00 C ATOM 2698 CG1 VAL B 77 -4.739 2.860 0.389 1.00 0.00 C ATOM 2699 CG2 VAL B 77 -6.541 1.675 -0.873 1.00 0.00 C ATOM 0 H VAL B 77 -5.172 1.827 -3.434 1.00 0.00 H new ATOM 0 HA VAL B 77 -6.053 4.052 -1.831 1.00 0.00 H new ATOM 0 HB VAL B 77 -4.420 1.550 -1.288 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -4.719 2.052 1.120 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -3.749 3.310 0.319 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -5.459 3.616 0.703 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -6.524 0.873 -0.135 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -7.259 2.435 -0.567 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -6.832 1.270 -1.842 1.00 0.00 H new ATOM 2709 N SER B 78 -2.872 3.906 -2.610 1.00 0.00 N ATOM 2710 CA SER B 78 -1.613 4.701 -2.559 1.00 0.00 C ATOM 2711 C SER B 78 -1.826 6.045 -3.263 1.00 0.00 C ATOM 2712 O SER B 78 -1.518 7.092 -2.729 1.00 0.00 O ATOM 2713 CB SER B 78 -0.495 3.926 -3.262 1.00 0.00 C ATOM 2714 OG SER B 78 -0.593 2.550 -2.921 1.00 0.00 O ATOM 0 H SER B 78 -2.840 3.079 -3.207 1.00 0.00 H new ATOM 0 HA SER B 78 -1.336 4.878 -1.520 1.00 0.00 H new ATOM 0 HB2 SER B 78 -0.573 4.052 -4.342 1.00 0.00 H new ATOM 0 HB3 SER B 78 0.478 4.318 -2.965 1.00 0.00 H new ATOM 0 HG SER B 78 -1.257 2.117 -3.497 1.00 0.00 H new ATOM 2720 N MET B 79 -2.333 6.024 -4.464 1.00 0.00 N ATOM 2721 CA MET B 79 -2.542 7.298 -5.208 1.00 0.00 C ATOM 2722 C MET B 79 -3.299 8.305 -4.341 1.00 0.00 C ATOM 2723 O MET B 79 -2.999 9.480 -4.347 1.00 0.00 O ATOM 2724 CB MET B 79 -3.354 7.018 -6.476 1.00 0.00 C ATOM 2725 CG MET B 79 -2.482 6.278 -7.495 1.00 0.00 C ATOM 2726 SD MET B 79 -1.365 7.453 -8.299 1.00 0.00 S ATOM 2727 CE MET B 79 -2.458 7.902 -9.669 1.00 0.00 C ATOM 0 H MET B 79 -2.612 5.179 -4.963 1.00 0.00 H new ATOM 0 HA MET B 79 -1.570 7.715 -5.470 1.00 0.00 H new ATOM 0 HB2 MET B 79 -4.232 6.420 -6.232 1.00 0.00 H new ATOM 0 HB3 MET B 79 -3.714 7.954 -6.903 1.00 0.00 H new ATOM 0 HG2 MET B 79 -1.908 5.496 -6.998 1.00 0.00 H new ATOM 0 HG3 MET B 79 -3.110 5.789 -8.240 1.00 0.00 H new ATOM 0 HE1 MET B 79 -1.961 8.633 -10.307 1.00 0.00 H new ATOM 0 HE2 MET B 79 -2.694 7.012 -10.252 1.00 0.00 H new ATOM 0 HE3 MET B 79 -3.378 8.332 -9.274 1.00 0.00 H new ATOM 2737 N VAL B 80 -4.276 7.866 -3.598 1.00 0.00 N ATOM 2738 CA VAL B 80 -5.039 8.826 -2.745 1.00 0.00 C ATOM 2739 C VAL B 80 -4.159 9.286 -1.583 1.00 0.00 C ATOM 2740 O VAL B 80 -3.914 10.462 -1.409 1.00 0.00 O ATOM 2741 CB VAL B 80 -6.289 8.144 -2.183 1.00 0.00 C ATOM 2742 CG1 VAL B 80 -7.011 9.109 -1.240 1.00 0.00 C ATOM 2743 CG2 VAL B 80 -7.226 7.757 -3.329 1.00 0.00 C ATOM 0 H VAL B 80 -4.579 6.894 -3.543 1.00 0.00 H new ATOM 0 HA VAL B 80 -5.333 9.683 -3.351 1.00 0.00 H new ATOM 0 HB VAL B 80 -5.997 7.246 -1.638 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -7.902 8.627 -0.838 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -6.346 9.383 -0.421 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -7.300 10.006 -1.788 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -8.114 7.272 -2.925 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -7.519 8.652 -3.877 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -6.713 7.071 -4.003 1.00 0.00 H new ATOM 2753 N THR B 81 -3.670 8.373 -0.793 1.00 0.00 N ATOM 2754 CA THR B 81 -2.798 8.772 0.339 1.00 0.00 C ATOM 2755 C THR B 81 -1.571 9.488 -0.223 1.00 0.00 C ATOM 2756 O THR B 81 -1.088 10.455 0.332 1.00 0.00 O ATOM 2757 CB THR B 81 -2.362 7.520 1.101 1.00 0.00 C ATOM 2758 OG1 THR B 81 -1.964 6.520 0.174 1.00 0.00 O ATOM 2759 CG2 THR B 81 -3.527 7.001 1.946 1.00 0.00 C ATOM 0 H THR B 81 -3.837 7.371 -0.884 1.00 0.00 H new ATOM 0 HA THR B 81 -3.335 9.436 1.017 1.00 0.00 H new ATOM 0 HB THR B 81 -1.525 7.765 1.755 1.00 0.00 H new ATOM 0 HG1 THR B 81 -2.741 5.978 -0.077 1.00 0.00 H new ATOM 0 HG21 THR B 81 -3.214 6.109 2.488 1.00 0.00 H new ATOM 0 HG22 THR B 81 -3.832 7.769 2.657 1.00 0.00 H new ATOM 0 HG23 THR B 81 -4.367 6.755 1.296 1.00 0.00 H new ATOM 2767 N THR B 82 -1.068 9.014 -1.330 1.00 0.00 N ATOM 2768 CA THR B 82 0.126 9.649 -1.952 1.00 0.00 C ATOM 2769 C THR B 82 -0.271 10.967 -2.626 1.00 0.00 C ATOM 2770 O THR B 82 0.558 11.824 -2.861 1.00 0.00 O ATOM 2771 CB THR B 82 0.726 8.701 -2.994 1.00 0.00 C ATOM 2772 OG1 THR B 82 0.965 7.435 -2.395 1.00 0.00 O ATOM 2773 CG2 THR B 82 2.045 9.277 -3.516 1.00 0.00 C ATOM 0 H THR B 82 -1.437 8.207 -1.833 1.00 0.00 H new ATOM 0 HA THR B 82 0.864 9.854 -1.177 1.00 0.00 H new ATOM 0 HB THR B 82 0.030 8.587 -3.825 1.00 0.00 H new ATOM 0 HG1 THR B 82 0.113 7.037 -2.120 1.00 0.00 H new ATOM 0 HG21 THR B 82 2.470 8.600 -4.257 1.00 0.00 H new ATOM 0 HG22 THR B 82 1.861 10.249 -3.975 1.00 0.00 H new ATOM 0 HG23 THR B 82 2.744 9.393 -2.688 1.00 0.00 H new ATOM 2781 N ALA B 83 -1.528 11.146 -2.940 1.00 0.00 N ATOM 2782 CA ALA B 83 -1.947 12.419 -3.595 1.00 0.00 C ATOM 2783 C ALA B 83 -1.452 13.590 -2.750 1.00 0.00 C ATOM 2784 O ALA B 83 -0.934 14.564 -3.260 1.00 0.00 O ATOM 2785 CB ALA B 83 -3.473 12.480 -3.697 1.00 0.00 C ATOM 0 H ALA B 83 -2.275 10.472 -2.773 1.00 0.00 H new ATOM 0 HA ALA B 83 -1.523 12.469 -4.598 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -3.769 13.413 -4.177 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -3.832 11.638 -4.289 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -3.907 12.432 -2.698 1.00 0.00 H new ATOM 2791 N CYS B 84 -1.598 13.496 -1.458 1.00 0.00 N ATOM 2792 CA CYS B 84 -1.124 14.596 -0.576 1.00 0.00 C ATOM 2793 C CYS B 84 0.398 14.509 -0.456 1.00 0.00 C ATOM 2794 O CYS B 84 0.948 14.527 0.627 1.00 0.00 O ATOM 2795 CB CYS B 84 -1.756 14.449 0.810 1.00 0.00 C ATOM 2796 SG CYS B 84 -1.155 15.769 1.892 1.00 0.00 S ATOM 0 H CYS B 84 -2.025 12.705 -0.976 1.00 0.00 H new ATOM 0 HA CYS B 84 -1.409 15.560 -0.998 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -2.842 14.494 0.732 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -1.507 13.476 1.233 1.00 0.00 H new ATOM 0 HG CYS B 84 0.140 15.842 1.809 1.00 0.00 H new ATOM 2802 N HIS B 85 1.080 14.404 -1.565 1.00 0.00 N ATOM 2803 CA HIS B 85 2.568 14.306 -1.529 1.00 0.00 C ATOM 2804 C HIS B 85 3.137 15.362 -0.580 1.00 0.00 C ATOM 2805 O HIS B 85 2.428 16.216 -0.087 1.00 0.00 O ATOM 2806 CB HIS B 85 3.126 14.532 -2.935 1.00 0.00 C ATOM 2807 CG HIS B 85 2.782 15.922 -3.395 1.00 0.00 C ATOM 2808 ND1 HIS B 85 1.908 16.737 -2.693 1.00 0.00 N ATOM 2809 CD2 HIS B 85 3.184 16.654 -4.484 1.00 0.00 C ATOM 2810 CE1 HIS B 85 1.813 17.900 -3.362 1.00 0.00 C ATOM 2811 NE2 HIS B 85 2.571 17.903 -4.462 1.00 0.00 N ATOM 0 H HIS B 85 0.669 14.382 -2.498 1.00 0.00 H new ATOM 0 HA HIS B 85 2.854 13.315 -1.175 1.00 0.00 H new ATOM 0 HB2 HIS B 85 4.207 14.395 -2.935 1.00 0.00 H new ATOM 0 HB3 HIS B 85 2.712 13.797 -3.625 1.00 0.00 H new ATOM 0 HD2 HIS B 85 3.872 16.312 -5.243 1.00 0.00 H new ATOM 0 HE1 HIS B 85 1.198 18.731 -3.048 1.00 0.00 H new ATOM 0 HE2 HIS B 85 2.677 18.658 -5.140 1.00 0.00 H new ATOM 2819 N GLU B 86 4.415 15.311 -0.326 1.00 0.00 N ATOM 2820 CA GLU B 86 5.040 16.310 0.587 1.00 0.00 C ATOM 2821 C GLU B 86 4.424 16.184 1.986 1.00 0.00 C ATOM 2822 O GLU B 86 4.509 17.086 2.795 1.00 0.00 O ATOM 2823 CB GLU B 86 4.803 17.724 0.034 1.00 0.00 C ATOM 2824 CG GLU B 86 5.856 18.685 0.595 1.00 0.00 C ATOM 2825 CD GLU B 86 5.641 20.080 0.007 1.00 0.00 C ATOM 2826 OE1 GLU B 86 4.613 20.287 -0.617 1.00 0.00 O ATOM 2827 OE2 GLU B 86 6.508 20.918 0.190 1.00 0.00 O ATOM 0 H GLU B 86 5.056 14.618 -0.713 1.00 0.00 H new ATOM 0 HA GLU B 86 6.112 16.125 0.653 1.00 0.00 H new ATOM 0 HB2 GLU B 86 4.853 17.711 -1.055 1.00 0.00 H new ATOM 0 HB3 GLU B 86 3.804 18.067 0.304 1.00 0.00 H new ATOM 0 HG2 GLU B 86 5.786 18.723 1.682 1.00 0.00 H new ATOM 0 HG3 GLU B 86 6.856 18.327 0.352 1.00 0.00 H new ATOM 2834 N PHE B 87 3.806 15.071 2.276 1.00 0.00 N ATOM 2835 CA PHE B 87 3.191 14.890 3.622 1.00 0.00 C ATOM 2836 C PHE B 87 4.281 14.951 4.694 1.00 0.00 C ATOM 2837 O PHE B 87 4.018 15.250 5.842 1.00 0.00 O ATOM 2838 CB PHE B 87 2.478 13.537 3.688 1.00 0.00 C ATOM 2839 CG PHE B 87 3.390 12.454 3.164 1.00 0.00 C ATOM 2840 CD1 PHE B 87 3.461 12.204 1.788 1.00 0.00 C ATOM 2841 CD2 PHE B 87 4.159 11.695 4.054 1.00 0.00 C ATOM 2842 CE1 PHE B 87 4.302 11.196 1.303 1.00 0.00 C ATOM 2843 CE2 PHE B 87 4.999 10.686 3.569 1.00 0.00 C ATOM 2844 CZ PHE B 87 5.071 10.436 2.193 1.00 0.00 C ATOM 0 H PHE B 87 3.701 14.280 1.640 1.00 0.00 H new ATOM 0 HA PHE B 87 2.466 15.685 3.797 1.00 0.00 H new ATOM 0 HB2 PHE B 87 2.190 13.317 4.716 1.00 0.00 H new ATOM 0 HB3 PHE B 87 1.561 13.569 3.100 1.00 0.00 H new ATOM 0 HD1 PHE B 87 2.867 12.789 1.101 1.00 0.00 H new ATOM 0 HD2 PHE B 87 4.104 11.888 5.115 1.00 0.00 H new ATOM 0 HE1 PHE B 87 4.358 11.004 0.242 1.00 0.00 H new ATOM 0 HE2 PHE B 87 5.592 10.100 4.256 1.00 0.00 H new ATOM 0 HZ PHE B 87 5.719 9.658 1.818 1.00 0.00 H new ATOM 2854 N PHE B 88 5.503 14.669 4.331 1.00 0.00 N ATOM 2855 CA PHE B 88 6.604 14.711 5.335 1.00 0.00 C ATOM 2856 C PHE B 88 6.554 16.042 6.085 1.00 0.00 C ATOM 2857 O PHE B 88 6.793 16.109 7.274 1.00 0.00 O ATOM 2858 CB PHE B 88 7.953 14.574 4.625 1.00 0.00 C ATOM 2859 CG PHE B 88 7.874 13.467 3.600 1.00 0.00 C ATOM 2860 CD1 PHE B 88 7.880 12.129 4.012 1.00 0.00 C ATOM 2861 CD2 PHE B 88 7.794 13.779 2.236 1.00 0.00 C ATOM 2862 CE1 PHE B 88 7.807 11.103 3.062 1.00 0.00 C ATOM 2863 CE2 PHE B 88 7.722 12.753 1.287 1.00 0.00 C ATOM 2864 CZ PHE B 88 7.729 11.415 1.699 1.00 0.00 C ATOM 0 H PHE B 88 5.786 14.412 3.385 1.00 0.00 H new ATOM 0 HA PHE B 88 6.484 13.889 6.041 1.00 0.00 H new ATOM 0 HB2 PHE B 88 8.218 15.514 4.141 1.00 0.00 H new ATOM 0 HB3 PHE B 88 8.737 14.357 5.350 1.00 0.00 H new ATOM 0 HD1 PHE B 88 7.941 11.888 5.063 1.00 0.00 H new ATOM 0 HD2 PHE B 88 7.788 14.811 1.917 1.00 0.00 H new ATOM 0 HE1 PHE B 88 7.811 10.071 3.380 1.00 0.00 H new ATOM 0 HE2 PHE B 88 7.661 12.994 0.236 1.00 0.00 H new ATOM 0 HZ PHE B 88 7.674 10.624 0.966 1.00 0.00 H new ATOM 2874 N GLU B 89 6.248 17.104 5.391 1.00 0.00 N ATOM 2875 CA GLU B 89 6.182 18.440 6.051 1.00 0.00 C ATOM 2876 C GLU B 89 4.803 18.633 6.680 1.00 0.00 C ATOM 2877 O GLU B 89 4.068 19.532 6.325 1.00 0.00 O ATOM 2878 CB GLU B 89 6.423 19.535 5.011 1.00 0.00 C ATOM 2879 CG GLU B 89 7.874 19.476 4.533 1.00 0.00 C ATOM 2880 CD GLU B 89 8.090 20.513 3.431 1.00 0.00 C ATOM 2881 OE1 GLU B 89 7.224 20.632 2.580 1.00 0.00 O ATOM 2882 OE2 GLU B 89 9.117 21.171 3.457 1.00 0.00 O ATOM 0 H GLU B 89 6.040 17.104 4.392 1.00 0.00 H new ATOM 0 HA GLU B 89 6.946 18.498 6.826 1.00 0.00 H new ATOM 0 HB2 GLU B 89 5.746 19.405 4.167 1.00 0.00 H new ATOM 0 HB3 GLU B 89 6.211 20.513 5.442 1.00 0.00 H new ATOM 0 HG2 GLU B 89 8.551 19.668 5.366 1.00 0.00 H new ATOM 0 HG3 GLU B 89 8.105 18.479 4.159 1.00 0.00 H new ATOM 2889 N HIS B 90 4.447 17.799 7.617 1.00 0.00 N ATOM 2890 CA HIS B 90 3.117 17.941 8.272 1.00 0.00 C ATOM 2891 C HIS B 90 3.096 19.226 9.103 1.00 0.00 C ATOM 2892 O HIS B 90 3.189 19.196 10.314 1.00 0.00 O ATOM 2893 CB HIS B 90 2.871 16.737 9.184 1.00 0.00 C ATOM 2894 CG HIS B 90 1.462 16.783 9.705 1.00 0.00 C ATOM 2895 ND1 HIS B 90 1.178 16.876 11.058 1.00 0.00 N ATOM 2896 CD2 HIS B 90 0.246 16.751 9.068 1.00 0.00 C ATOM 2897 CE1 HIS B 90 -0.160 16.897 11.191 1.00 0.00 C ATOM 2898 NE2 HIS B 90 -0.777 16.822 10.008 1.00 0.00 N ATOM 0 H HIS B 90 5.019 17.026 7.957 1.00 0.00 H new ATOM 0 HA HIS B 90 2.336 17.987 7.513 1.00 0.00 H new ATOM 0 HB2 HIS B 90 3.037 15.811 8.634 1.00 0.00 H new ATOM 0 HB3 HIS B 90 3.577 16.746 10.014 1.00 0.00 H new ATOM 0 HD2 HIS B 90 0.105 16.681 7.999 1.00 0.00 H new ATOM 0 HE1 HIS B 90 -0.673 16.966 12.139 1.00 0.00 H new ATOM 0 HE2 HIS B 90 -1.782 16.818 9.832 1.00 0.00 H new ATOM 2906 N GLU B 91 2.980 20.356 8.459 1.00 0.00 N ATOM 2907 CA GLU B 91 2.958 21.644 9.208 1.00 0.00 C ATOM 2908 C GLU B 91 4.140 21.692 10.176 1.00 0.00 C ATOM 2909 O GLU B 91 5.256 21.481 9.729 1.00 0.00 O ATOM 2910 CB GLU B 91 1.651 21.757 9.995 1.00 0.00 C ATOM 2911 CG GLU B 91 0.466 21.646 9.035 1.00 0.00 C ATOM 2912 CD GLU B 91 -0.836 21.891 9.800 1.00 0.00 C ATOM 2913 OE1 GLU B 91 -1.320 20.958 10.420 1.00 0.00 O ATOM 2914 OE2 GLU B 91 -1.326 23.007 9.754 1.00 0.00 O ATOM 2915 OXT GLU B 91 3.911 21.938 11.349 1.00 0.00 O ATOM 0 H GLU B 91 2.900 20.442 7.446 1.00 0.00 H new ATOM 0 HA GLU B 91 3.030 22.473 8.504 1.00 0.00 H new ATOM 0 HB2 GLU B 91 1.598 20.970 10.747 1.00 0.00 H new ATOM 0 HB3 GLU B 91 1.615 22.708 10.526 1.00 0.00 H new ATOM 0 HG2 GLU B 91 0.568 22.372 8.229 1.00 0.00 H new ATOM 0 HG3 GLU B 91 0.449 20.658 8.574 1.00 0.00 H new TER 2922 GLU B 91