USER MOD reduce.3.24.130724 H: found=0, std=0, add=1818, rem=0, adj=68 USER MOD reduce.3.24.130724 removed 1828 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: Y 105 HIS : no HE2:sc= -9.37! C(o=-12!,f=-14!) USER MOD Set 1.2: Y 109 MET CE :methyl -176:sc= -2.59! (180deg=-0.913) USER MOD Set 2.1: X 105 HIS : no HE2:sc= -8.89! C(o=-11!,f=-14!) USER MOD Set 2.2: X 109 MET CE :methyl -177:sc= -2.34 (180deg=-0.892) USER MOD Set 3.1: A 15 HIS : no HD1:sc= -0.397 K(o=-0.58,f=-4.5) USER MOD Set 3.2: B 85 HIS : no HE2:sc= -0.185 K(o=-0.58,f=-6.2) USER MOD Set 4.1: A 7 MET CE :methyl 164:sc= -1.36 (180deg=-1.99!) USER MOD Set 4.2: B 81 THR OG1 : rot 71:sc= 0.359 USER MOD Set 5.1: B 79 MET CE :methyl -164:sc= -0.913 (180deg=-1.79!) USER MOD Set 5.2: Y 111 LYS NZ :NH3+ 175:sc= -2.22 (180deg=-2.46!) USER MOD Set 6.1: B 37 ASN : amide:sc= -7.27! C(o=-12!,f=-26!) USER MOD Set 6.2: B 38 ASN :FLIP amide:sc= -4.28 F(o=-16!,f=-12) USER MOD Set 7.1: A 81 THR OG1 : rot 71:sc= 0.304 USER MOD Set 7.2: B 7 MET CE :methyl 168:sc= -1.5 (180deg=-2.1) USER MOD Set 8.1: A 85 HIS : no HE2:sc= -0.498 K(o=-1.4,f=-6.9) USER MOD Set 8.2: B 15 HIS : no HD1:sc= -0.906 K(o=-1.4,f=-5.3) USER MOD Set 9.1: A 79 MET CE :methyl -163:sc= -0.78 (180deg=-1.61) USER MOD Set 9.2: X 111 LYS NZ :NH3+ 169:sc= -2.99 (180deg=-3.17!) USER MOD Set10.1: A 37 ASN : amide:sc= -7.15! C(o=-11!,f=-26!) USER MOD Set10.2: A 38 ASN :FLIP amide:sc= -4.13! C(o=-15!,f=-11!) USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 0 MET N :NH3+ -166:sc=-0.00463 (180deg=-0.202) USER MOD Single : A 1 SER OG : rot -46:sc= -0.245 USER MOD Single : A 5 LYS NZ :NH3+ -152:sc= -0.0414 (180deg=-0.688) USER MOD Single : A 16 GLN : amide:sc= -0.165 X(o=-0.16,f=-0.19) USER MOD Single : A 17 TYR OH : rot -32:sc= 0.792 USER MOD Single : A 18 SER OG : rot -142:sc= 1.07 USER MOD Single : A 24 LYS NZ :NH3+ 157:sc= -0.186 (180deg=-0.95) USER MOD Single : A 25 HIS : no HD1:sc= 0 X(o=0,f=-0.07) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 156:sc= -0.179 (180deg=-0.807) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 144:sc= -0.373 (180deg=-1.39!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 LYS NZ :NH3+ -164:sc= -0.109 (180deg=-0.501) USER MOD Single : A 50 GLN :FLIP amide:sc= -5.11! C(o=-8.7!,f=-5.1!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl -108:sc= -1.86 (180deg=-5.51!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 CYS SG : rot 25:sc= -0.46 USER MOD Single : A 71 GLN : amide:sc= -0.0181 K(o=-0.018,f=-0.66) USER MOD Single : A 74 MET CE :methyl -160:sc= -2.59 (180deg=-4.56!) USER MOD Single : A 78 SER OG : rot -46:sc= 1.11 USER MOD Single : A 82 THR OG1 : rot -170:sc= -0.203 USER MOD Single : A 84 CYS SG : rot 180:sc= 0 USER MOD Single : A 90 HIS : no HD1:sc= -0.246 X(o=-0.25,f=0) USER MOD Single : B 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 0 MET N :NH3+ -168:sc=-0.00195 (180deg=-0.156) USER MOD Single : B 1 SER OG : rot -52:sc= -0.355 USER MOD Single : B 5 LYS NZ :NH3+ -153:sc= -0.0284 (180deg=-0.621) USER MOD Single : B 16 GLN : amide:sc= -0.163 X(o=-0.16,f=-0.19) USER MOD Single : B 17 TYR OH : rot -26:sc= 0.775 USER MOD Single : B 18 SER OG : rot -144:sc= 0.963 USER MOD Single : B 24 LYS NZ :NH3+ 155:sc= -0.192 (180deg=-0.925) USER MOD Single : B 25 HIS : no HD1:sc= 0 X(o=0,f=-0.083) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ 135:sc= -0.122 (180deg=-0.751) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ 143:sc= -0.461 (180deg=-1.97!) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 48 LYS NZ :NH3+ -157:sc= -0.174 (180deg=-0.501) USER MOD Single : B 50 GLN :FLIP amide:sc= -5.12! C(o=-8.6!,f=-5.1!) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl -110:sc= -1.97 (180deg=-5.68!) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 CYS SG : rot 32:sc= -0.506 USER MOD Single : B 71 GLN : amide:sc=-0.00715 K(o=-0.0071,f=-0.61) USER MOD Single : B 74 MET CE :methyl -157:sc= -2.53 (180deg=-4.48!) USER MOD Single : B 78 SER OG : rot -83:sc= 1.16 USER MOD Single : B 82 THR OG1 : rot -170:sc= -0.215 USER MOD Single : B 84 CYS SG : rot 180:sc= 0 USER MOD Single : B 90 HIS : no HD1:sc= -0.239 X(o=-0.24,f=0) USER MOD Single : X 92 SER OG : rot 32:sc= 0.0884 USER MOD Single : X 93 HIS : no HD1:sc= 0.482 K(o=0.48,f=-2.3!) USER MOD Single : X 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 96 SER OG : rot 180:sc= -0.0877 USER MOD Single : X 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 100 GLN : amide:sc= -0.428 X(o=-0.43,f=-0.29) USER MOD Single : X 101 SER OG : rot 180:sc= 0 USER MOD Single : X 102 THR OG1 : rot 180:sc= 0 USER MOD Single : X 103 SER OG : rot 74:sc= 0.286 USER MOD Single : X 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 107 LYS NZ :NH3+ 138:sc= -0.236 (180deg=-1.18!) USER MOD Single : X 112 THR OG1 : rot -4:sc= 0.346 USER MOD Single : Y 92 SER OG : rot 27:sc= 0.0929 USER MOD Single : Y 93 HIS : no HD1:sc= 0.493 K(o=0.49,f=-2.3!) USER MOD Single : Y 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 96 SER OG : rot 180:sc= -0.121 USER MOD Single : Y 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 100 GLN : amide:sc= -0.428 X(o=-0.43,f=-0.29) USER MOD Single : Y 101 SER OG : rot 180:sc= 0 USER MOD Single : Y 102 THR OG1 : rot 180:sc= 0 USER MOD Single : Y 103 SER OG : rot 77:sc= 0.285 USER MOD Single : Y 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 107 LYS NZ :NH3+ 150:sc= -0.262 (180deg=-1.28!) USER MOD Single : Y 112 THR OG1 : rot -9:sc= 0.332 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 -1.428 -2.851 -12.166 1.00 0.00 N ATOM 2 CA MET A 0 -1.887 -2.747 -13.580 1.00 0.00 C ATOM 3 C MET A 0 -3.001 -1.700 -13.685 1.00 0.00 C ATOM 4 O MET A 0 -4.108 -1.916 -13.236 1.00 0.00 O ATOM 5 CB MET A 0 -2.428 -4.103 -14.045 1.00 0.00 C ATOM 6 CG MET A 0 -1.282 -5.110 -14.166 1.00 0.00 C ATOM 7 SD MET A 0 -1.942 -6.693 -14.748 1.00 0.00 S ATOM 8 CE MET A 0 -0.382 -7.609 -14.770 1.00 0.00 C ATOM 0 H1 MET A 0 -0.529 -3.373 -12.130 1.00 0.00 H new ATOM 0 H2 MET A 0 -1.290 -1.897 -11.775 1.00 0.00 H new ATOM 0 H3 MET A 0 -2.144 -3.355 -11.605 1.00 0.00 H new ATOM 0 HA MET A 0 -1.047 -2.451 -14.208 1.00 0.00 H new ATOM 0 HB2 MET A 0 -3.172 -4.469 -13.337 1.00 0.00 H new ATOM 0 HB3 MET A 0 -2.930 -3.993 -15.006 1.00 0.00 H new ATOM 0 HG2 MET A 0 -0.528 -4.739 -14.860 1.00 0.00 H new ATOM 0 HG3 MET A 0 -0.792 -5.239 -13.201 1.00 0.00 H new ATOM 0 HE1 MET A 0 -0.564 -8.630 -15.106 1.00 0.00 H new ATOM 0 HE2 MET A 0 0.316 -7.122 -15.451 1.00 0.00 H new ATOM 0 HE3 MET A 0 0.043 -7.628 -13.767 1.00 0.00 H new ATOM 20 N SER A 1 -2.717 -0.571 -14.279 1.00 0.00 N ATOM 21 CA SER A 1 -3.766 0.488 -14.421 1.00 0.00 C ATOM 22 C SER A 1 -4.261 0.928 -13.040 1.00 0.00 C ATOM 23 O SER A 1 -5.319 1.509 -12.903 1.00 0.00 O ATOM 24 CB SER A 1 -4.942 -0.060 -15.236 1.00 0.00 C ATOM 25 OG SER A 1 -5.710 1.025 -15.740 1.00 0.00 O ATOM 0 H SER A 1 -1.806 -0.334 -14.672 1.00 0.00 H new ATOM 0 HA SER A 1 -3.335 1.347 -14.934 1.00 0.00 H new ATOM 0 HB2 SER A 1 -4.575 -0.674 -16.059 1.00 0.00 H new ATOM 0 HB3 SER A 1 -5.564 -0.702 -14.612 1.00 0.00 H new ATOM 0 HG SER A 1 -5.856 1.681 -15.027 1.00 0.00 H new ATOM 31 N GLU A 2 -3.499 0.665 -12.022 1.00 0.00 N ATOM 32 CA GLU A 2 -3.905 1.074 -10.647 1.00 0.00 C ATOM 33 C GLU A 2 -3.660 2.565 -10.481 1.00 0.00 C ATOM 34 O GLU A 2 -3.847 3.133 -9.423 1.00 0.00 O ATOM 35 CB GLU A 2 -3.082 0.288 -9.638 1.00 0.00 C ATOM 36 CG GLU A 2 -3.540 -1.161 -9.693 1.00 0.00 C ATOM 37 CD GLU A 2 -2.739 -1.999 -8.694 1.00 0.00 C ATOM 38 OE1 GLU A 2 -1.771 -1.483 -8.161 1.00 0.00 O ATOM 39 OE2 GLU A 2 -3.104 -3.144 -8.485 1.00 0.00 O ATOM 0 H GLU A 2 -2.604 0.180 -12.080 1.00 0.00 H new ATOM 0 HA GLU A 2 -4.963 0.868 -10.485 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -2.020 0.362 -9.871 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -3.218 0.694 -8.635 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -4.604 -1.224 -9.463 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -3.407 -1.555 -10.700 1.00 0.00 H new ATOM 46 N LEU A 3 -3.226 3.193 -11.527 1.00 0.00 N ATOM 47 CA LEU A 3 -2.936 4.643 -11.474 1.00 0.00 C ATOM 48 C LEU A 3 -4.195 5.410 -11.077 1.00 0.00 C ATOM 49 O LEU A 3 -4.113 6.487 -10.539 1.00 0.00 O ATOM 50 CB LEU A 3 -2.416 5.075 -12.853 1.00 0.00 C ATOM 51 CG LEU A 3 -2.551 6.598 -13.067 1.00 0.00 C ATOM 52 CD1 LEU A 3 -1.570 7.040 -14.167 1.00 0.00 C ATOM 53 CD2 LEU A 3 -4.001 6.980 -13.472 1.00 0.00 C ATOM 0 H LEU A 3 -3.057 2.755 -12.433 1.00 0.00 H new ATOM 0 HA LEU A 3 -2.176 4.862 -10.724 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -1.370 4.785 -12.954 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -2.969 4.548 -13.631 1.00 0.00 H new ATOM 0 HG LEU A 3 -2.318 7.105 -12.131 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -1.660 8.115 -14.324 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -0.551 6.801 -13.863 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -1.804 6.517 -15.094 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -4.066 8.058 -13.616 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -4.265 6.473 -14.400 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -4.691 6.677 -12.684 1.00 0.00 H new ATOM 65 N GLU A 4 -5.358 4.875 -11.317 1.00 0.00 N ATOM 66 CA GLU A 4 -6.596 5.613 -10.912 1.00 0.00 C ATOM 67 C GLU A 4 -6.635 5.732 -9.392 1.00 0.00 C ATOM 68 O GLU A 4 -6.999 6.754 -8.843 1.00 0.00 O ATOM 69 CB GLU A 4 -7.836 4.875 -11.426 1.00 0.00 C ATOM 70 CG GLU A 4 -9.097 5.635 -11.006 1.00 0.00 C ATOM 71 CD GLU A 4 -10.309 5.059 -11.740 1.00 0.00 C ATOM 72 OE1 GLU A 4 -10.111 4.206 -12.591 1.00 0.00 O ATOM 73 OE2 GLU A 4 -11.414 5.483 -11.443 1.00 0.00 O ATOM 0 H GLU A 4 -5.510 3.973 -11.769 1.00 0.00 H new ATOM 0 HA GLU A 4 -6.587 6.612 -11.347 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.796 4.789 -12.512 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -7.860 3.861 -11.026 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.240 5.556 -9.928 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -8.989 6.695 -11.236 1.00 0.00 H new ATOM 80 N LYS A 5 -6.254 4.697 -8.712 1.00 0.00 N ATOM 81 CA LYS A 5 -6.252 4.731 -7.226 1.00 0.00 C ATOM 82 C LYS A 5 -5.165 5.690 -6.745 1.00 0.00 C ATOM 83 O LYS A 5 -5.321 6.363 -5.753 1.00 0.00 O ATOM 84 CB LYS A 5 -5.969 3.327 -6.701 1.00 0.00 C ATOM 85 CG LYS A 5 -7.177 2.433 -6.984 1.00 0.00 C ATOM 86 CD LYS A 5 -6.909 1.016 -6.463 1.00 0.00 C ATOM 87 CE LYS A 5 -5.810 0.340 -7.296 1.00 0.00 C ATOM 88 NZ LYS A 5 -5.938 -1.139 -7.166 1.00 0.00 N ATOM 0 H LYS A 5 -5.940 3.818 -9.123 1.00 0.00 H new ATOM 0 HA LYS A 5 -7.220 5.072 -6.858 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -5.079 2.919 -7.180 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -5.768 3.360 -5.630 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -8.065 2.844 -6.505 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -7.377 2.405 -8.055 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -6.608 1.057 -5.416 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -7.824 0.426 -6.508 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -5.897 0.634 -8.342 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -4.827 0.664 -6.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -5.005 -1.581 -7.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -6.305 -1.374 -6.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -6.593 -1.496 -7.891 1.00 0.00 H new ATOM 102 N ALA A 6 -4.056 5.734 -7.430 1.00 0.00 N ATOM 103 CA ALA A 6 -2.945 6.633 -7.005 1.00 0.00 C ATOM 104 C ALA A 6 -3.352 8.102 -7.145 1.00 0.00 C ATOM 105 O ALA A 6 -3.026 8.923 -6.312 1.00 0.00 O ATOM 106 CB ALA A 6 -1.708 6.356 -7.870 1.00 0.00 C ATOM 0 H ALA A 6 -3.870 5.184 -8.269 1.00 0.00 H new ATOM 0 HA ALA A 6 -2.717 6.437 -5.957 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -0.894 7.012 -7.561 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -1.403 5.317 -7.747 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -1.947 6.542 -8.917 1.00 0.00 H new ATOM 112 N MET A 7 -4.045 8.445 -8.192 1.00 0.00 N ATOM 113 CA MET A 7 -4.452 9.866 -8.380 1.00 0.00 C ATOM 114 C MET A 7 -5.411 10.269 -7.268 1.00 0.00 C ATOM 115 O MET A 7 -5.349 11.361 -6.729 1.00 0.00 O ATOM 116 CB MET A 7 -5.170 10.016 -9.723 1.00 0.00 C ATOM 117 CG MET A 7 -4.182 9.817 -10.873 1.00 0.00 C ATOM 118 SD MET A 7 -5.013 10.208 -12.436 1.00 0.00 S ATOM 119 CE MET A 7 -3.532 10.498 -13.433 1.00 0.00 C ATOM 0 H MET A 7 -4.348 7.805 -8.926 1.00 0.00 H new ATOM 0 HA MET A 7 -3.566 10.500 -8.357 1.00 0.00 H new ATOM 0 HB2 MET A 7 -5.977 9.287 -9.796 1.00 0.00 H new ATOM 0 HB3 MET A 7 -5.626 11.004 -9.792 1.00 0.00 H new ATOM 0 HG2 MET A 7 -3.312 10.459 -10.738 1.00 0.00 H new ATOM 0 HG3 MET A 7 -3.820 8.789 -10.885 1.00 0.00 H new ATOM 0 HE1 MET A 7 -3.795 10.476 -14.491 1.00 0.00 H new ATOM 0 HE2 MET A 7 -3.111 11.472 -13.184 1.00 0.00 H new ATOM 0 HE3 MET A 7 -2.796 9.721 -13.226 1.00 0.00 H new ATOM 129 N VAL A 8 -6.292 9.386 -6.921 1.00 0.00 N ATOM 130 CA VAL A 8 -7.268 9.689 -5.841 1.00 0.00 C ATOM 131 C VAL A 8 -6.522 9.846 -4.518 1.00 0.00 C ATOM 132 O VAL A 8 -6.866 10.660 -3.691 1.00 0.00 O ATOM 133 CB VAL A 8 -8.291 8.551 -5.729 1.00 0.00 C ATOM 134 CG1 VAL A 8 -9.144 8.739 -4.464 1.00 0.00 C ATOM 135 CG2 VAL A 8 -9.198 8.567 -6.963 1.00 0.00 C ATOM 0 H VAL A 8 -6.382 8.460 -7.339 1.00 0.00 H new ATOM 0 HA VAL A 8 -7.793 10.615 -6.075 1.00 0.00 H new ATOM 0 HB VAL A 8 -7.767 7.597 -5.668 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -9.869 7.928 -4.390 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -8.499 8.731 -3.586 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.670 9.692 -4.518 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.927 7.760 -6.889 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -9.719 9.523 -7.019 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -8.594 8.429 -7.860 1.00 0.00 H new ATOM 145 N ALA A 9 -5.525 9.039 -4.310 1.00 0.00 N ATOM 146 CA ALA A 9 -4.754 9.085 -3.034 1.00 0.00 C ATOM 147 C ALA A 9 -4.024 10.415 -2.873 1.00 0.00 C ATOM 148 O ALA A 9 -3.946 10.945 -1.790 1.00 0.00 O ATOM 149 CB ALA A 9 -3.737 7.952 -3.009 1.00 0.00 C ATOM 0 H ALA A 9 -5.204 8.338 -4.978 1.00 0.00 H new ATOM 0 HA ALA A 9 -5.460 8.976 -2.211 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -3.175 7.988 -2.076 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -4.255 6.996 -3.084 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -3.051 8.060 -3.850 1.00 0.00 H new ATOM 155 N LEU A 10 -3.467 10.954 -3.916 1.00 0.00 N ATOM 156 CA LEU A 10 -2.740 12.245 -3.751 1.00 0.00 C ATOM 157 C LEU A 10 -3.725 13.286 -3.232 1.00 0.00 C ATOM 158 O LEU A 10 -3.404 14.099 -2.392 1.00 0.00 O ATOM 159 CB LEU A 10 -2.149 12.703 -5.103 1.00 0.00 C ATOM 160 CG LEU A 10 -0.697 12.232 -5.247 1.00 0.00 C ATOM 161 CD1 LEU A 10 -0.659 10.714 -5.416 1.00 0.00 C ATOM 162 CD2 LEU A 10 -0.077 12.906 -6.474 1.00 0.00 C ATOM 0 H LEU A 10 -3.480 10.569 -4.860 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.918 12.121 -3.045 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.749 12.305 -5.921 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -2.193 13.790 -5.175 1.00 0.00 H new ATOM 0 HG LEU A 10 -0.133 12.501 -4.354 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.375 10.385 -5.518 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -1.106 10.239 -4.543 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -1.219 10.433 -6.308 1.00 0.00 H new ATOM 0 HD21 LEU A 10 0.956 12.578 -6.586 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -0.643 12.632 -7.364 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -0.102 13.988 -6.346 1.00 0.00 H new ATOM 174 N ILE A 11 -4.918 13.267 -3.733 1.00 0.00 N ATOM 175 CA ILE A 11 -5.928 14.251 -3.275 1.00 0.00 C ATOM 176 C ILE A 11 -6.314 13.985 -1.806 1.00 0.00 C ATOM 177 O ILE A 11 -6.531 14.906 -1.044 1.00 0.00 O ATOM 178 CB ILE A 11 -7.154 14.165 -4.189 1.00 0.00 C ATOM 179 CG1 ILE A 11 -6.771 14.715 -5.571 1.00 0.00 C ATOM 180 CG2 ILE A 11 -8.295 15.001 -3.608 1.00 0.00 C ATOM 181 CD1 ILE A 11 -7.869 14.406 -6.594 1.00 0.00 C ATOM 0 H ILE A 11 -5.241 12.610 -4.443 1.00 0.00 H new ATOM 0 HA ILE A 11 -5.511 15.257 -3.328 1.00 0.00 H new ATOM 0 HB ILE A 11 -7.481 13.129 -4.272 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.615 15.792 -5.510 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.828 14.274 -5.896 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -9.164 14.936 -4.263 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -8.556 14.623 -2.620 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -7.979 16.041 -3.527 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -7.581 14.803 -7.568 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -8.005 13.327 -6.668 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.803 14.868 -6.276 1.00 0.00 H new ATOM 193 N ASP A 12 -6.435 12.741 -1.408 1.00 0.00 N ATOM 194 CA ASP A 12 -6.849 12.443 0.004 1.00 0.00 C ATOM 195 C ASP A 12 -5.775 12.882 1.019 1.00 0.00 C ATOM 196 O ASP A 12 -6.083 13.400 2.074 1.00 0.00 O ATOM 197 CB ASP A 12 -7.079 10.934 0.141 1.00 0.00 C ATOM 198 CG ASP A 12 -8.338 10.536 -0.633 1.00 0.00 C ATOM 199 OD1 ASP A 12 -9.192 11.386 -0.815 1.00 0.00 O ATOM 200 OD2 ASP A 12 -8.426 9.385 -1.030 1.00 0.00 O ATOM 0 H ASP A 12 -6.267 11.923 -1.994 1.00 0.00 H new ATOM 0 HA ASP A 12 -7.762 12.999 0.218 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -6.217 10.388 -0.241 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -7.186 10.666 1.192 1.00 0.00 H new ATOM 205 N VAL A 13 -4.525 12.671 0.716 1.00 0.00 N ATOM 206 CA VAL A 13 -3.430 13.060 1.662 1.00 0.00 C ATOM 207 C VAL A 13 -3.299 14.593 1.696 1.00 0.00 C ATOM 208 O VAL A 13 -3.068 15.200 2.731 1.00 0.00 O ATOM 209 CB VAL A 13 -2.106 12.368 1.198 1.00 0.00 C ATOM 210 CG1 VAL A 13 -1.040 13.398 0.787 1.00 0.00 C ATOM 211 CG2 VAL A 13 -1.537 11.489 2.327 1.00 0.00 C ATOM 0 H VAL A 13 -4.207 12.242 -0.153 1.00 0.00 H new ATOM 0 HA VAL A 13 -3.655 12.731 2.676 1.00 0.00 H new ATOM 0 HB VAL A 13 -2.351 11.753 0.332 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -0.135 12.879 0.471 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -1.418 14.003 -0.037 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -0.811 14.043 1.635 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -0.616 11.014 1.989 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -1.327 12.108 3.199 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -2.264 10.722 2.593 1.00 0.00 H new ATOM 221 N PHE A 14 -3.424 15.214 0.563 1.00 0.00 N ATOM 222 CA PHE A 14 -3.289 16.689 0.508 1.00 0.00 C ATOM 223 C PHE A 14 -4.344 17.325 1.396 1.00 0.00 C ATOM 224 O PHE A 14 -4.084 18.288 2.075 1.00 0.00 O ATOM 225 CB PHE A 14 -3.470 17.176 -0.929 1.00 0.00 C ATOM 226 CG PHE A 14 -3.353 18.681 -0.956 1.00 0.00 C ATOM 227 CD1 PHE A 14 -2.106 19.282 -1.151 1.00 0.00 C ATOM 228 CD2 PHE A 14 -4.493 19.477 -0.784 1.00 0.00 C ATOM 229 CE1 PHE A 14 -1.995 20.676 -1.175 1.00 0.00 C ATOM 230 CE2 PHE A 14 -4.382 20.872 -0.808 1.00 0.00 C ATOM 231 CZ PHE A 14 -3.133 21.472 -1.004 1.00 0.00 C ATOM 0 H PHE A 14 -3.615 14.762 -0.331 1.00 0.00 H new ATOM 0 HA PHE A 14 -2.296 16.972 0.858 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -2.716 16.728 -1.576 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -4.443 16.867 -1.312 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -1.227 18.669 -1.283 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -5.457 19.014 -0.633 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -1.031 21.138 -1.326 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -5.261 21.486 -0.675 1.00 0.00 H new ATOM 0 HZ PHE A 14 -3.048 22.548 -1.023 1.00 0.00 H new ATOM 241 N HIS A 15 -5.530 16.802 1.396 1.00 0.00 N ATOM 242 CA HIS A 15 -6.591 17.391 2.252 1.00 0.00 C ATOM 243 C HIS A 15 -6.275 17.125 3.724 1.00 0.00 C ATOM 244 O HIS A 15 -6.759 17.812 4.600 1.00 0.00 O ATOM 245 CB HIS A 15 -7.948 16.780 1.896 1.00 0.00 C ATOM 246 CG HIS A 15 -8.446 17.367 0.601 1.00 0.00 C ATOM 247 ND1 HIS A 15 -8.987 16.583 -0.408 1.00 0.00 N ATOM 248 CD2 HIS A 15 -8.497 18.661 0.139 1.00 0.00 C ATOM 249 CE1 HIS A 15 -9.338 17.403 -1.416 1.00 0.00 C ATOM 250 NE2 HIS A 15 -9.061 18.677 -1.131 1.00 0.00 N ATOM 0 H HIS A 15 -5.813 15.994 0.842 1.00 0.00 H new ATOM 0 HA HIS A 15 -6.629 18.467 2.081 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -7.857 15.698 1.805 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -8.665 16.974 2.694 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -8.152 19.530 0.679 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -9.788 17.071 -2.340 1.00 0.00 H new ATOM 0 HE2 HIS A 15 -9.228 19.492 -1.722 1.00 0.00 H new ATOM 259 N GLN A 16 -5.483 16.130 4.018 1.00 0.00 N ATOM 260 CA GLN A 16 -5.177 15.845 5.444 1.00 0.00 C ATOM 261 C GLN A 16 -4.501 17.064 6.085 1.00 0.00 C ATOM 262 O GLN A 16 -4.834 17.449 7.188 1.00 0.00 O ATOM 263 CB GLN A 16 -4.246 14.627 5.524 1.00 0.00 C ATOM 264 CG GLN A 16 -3.908 14.303 6.981 1.00 0.00 C ATOM 265 CD GLN A 16 -5.191 13.994 7.756 1.00 0.00 C ATOM 266 OE1 GLN A 16 -5.968 13.149 7.357 1.00 0.00 O ATOM 267 NE2 GLN A 16 -5.446 14.648 8.856 1.00 0.00 N ATOM 0 H GLN A 16 -5.040 15.510 3.340 1.00 0.00 H new ATOM 0 HA GLN A 16 -6.101 15.633 5.982 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -4.723 13.766 5.056 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -3.330 14.825 4.968 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -3.231 13.450 7.026 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -3.390 15.145 7.439 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -4.794 15.357 9.191 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -6.298 14.450 9.381 1.00 0.00 H new ATOM 276 N TYR A 17 -3.549 17.673 5.421 1.00 0.00 N ATOM 277 CA TYR A 17 -2.857 18.866 6.033 1.00 0.00 C ATOM 278 C TYR A 17 -3.510 20.189 5.612 1.00 0.00 C ATOM 279 O TYR A 17 -3.593 21.119 6.389 1.00 0.00 O ATOM 280 CB TYR A 17 -1.393 18.864 5.602 1.00 0.00 C ATOM 281 CG TYR A 17 -0.695 17.739 6.314 1.00 0.00 C ATOM 282 CD1 TYR A 17 -0.846 16.432 5.850 1.00 0.00 C ATOM 283 CD2 TYR A 17 0.069 17.997 7.455 1.00 0.00 C ATOM 284 CE1 TYR A 17 -0.229 15.378 6.522 1.00 0.00 C ATOM 285 CE2 TYR A 17 0.683 16.942 8.136 1.00 0.00 C ATOM 286 CZ TYR A 17 0.536 15.630 7.670 1.00 0.00 C ATOM 287 OH TYR A 17 1.134 14.588 8.348 1.00 0.00 O ATOM 0 H TYR A 17 -3.220 17.405 4.493 1.00 0.00 H new ATOM 0 HA TYR A 17 -2.942 18.787 7.117 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -1.315 18.737 4.522 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -0.924 19.817 5.846 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -1.441 16.237 4.970 1.00 0.00 H new ATOM 0 HD2 TYR A 17 0.185 19.010 7.810 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.340 14.367 6.158 1.00 0.00 H new ATOM 0 HE2 TYR A 17 1.270 17.139 9.021 1.00 0.00 H new ATOM 0 HH TYR A 17 0.577 13.785 8.271 1.00 0.00 H new ATOM 297 N SER A 18 -3.948 20.297 4.394 1.00 0.00 N ATOM 298 CA SER A 18 -4.563 21.577 3.931 1.00 0.00 C ATOM 299 C SER A 18 -5.786 21.912 4.784 1.00 0.00 C ATOM 300 O SER A 18 -6.023 23.053 5.126 1.00 0.00 O ATOM 301 CB SER A 18 -4.991 21.434 2.472 1.00 0.00 C ATOM 302 OG SER A 18 -5.362 22.709 1.962 1.00 0.00 O ATOM 0 H SER A 18 -3.909 19.556 3.694 1.00 0.00 H new ATOM 0 HA SER A 18 -3.830 22.378 4.027 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.175 21.017 1.881 1.00 0.00 H new ATOM 0 HB3 SER A 18 -5.828 20.741 2.393 1.00 0.00 H new ATOM 0 HG SER A 18 -6.130 22.610 1.361 1.00 0.00 H new ATOM 308 N GLY A 19 -6.569 20.931 5.122 1.00 0.00 N ATOM 309 CA GLY A 19 -7.782 21.196 5.947 1.00 0.00 C ATOM 310 C GLY A 19 -7.383 21.383 7.410 1.00 0.00 C ATOM 311 O GLY A 19 -8.163 21.846 8.219 1.00 0.00 O ATOM 0 H GLY A 19 -6.424 19.955 4.864 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -8.293 22.088 5.583 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -8.484 20.367 5.855 1.00 0.00 H new ATOM 315 N ARG A 20 -6.174 21.042 7.761 1.00 0.00 N ATOM 316 CA ARG A 20 -5.744 21.223 9.176 1.00 0.00 C ATOM 317 C ARG A 20 -5.852 22.704 9.530 1.00 0.00 C ATOM 318 O ARG A 20 -6.344 23.072 10.578 1.00 0.00 O ATOM 319 CB ARG A 20 -4.289 20.786 9.333 1.00 0.00 C ATOM 320 CG ARG A 20 -3.872 20.921 10.797 1.00 0.00 C ATOM 321 CD ARG A 20 -2.421 20.484 10.944 1.00 0.00 C ATOM 322 NE ARG A 20 -2.048 20.483 12.386 1.00 0.00 N ATOM 323 CZ ARG A 20 -0.976 19.854 12.783 1.00 0.00 C ATOM 324 NH1 ARG A 20 -0.231 19.223 11.917 1.00 0.00 N ATOM 325 NH2 ARG A 20 -0.652 19.855 14.047 1.00 0.00 N ATOM 0 H ARG A 20 -5.470 20.649 7.136 1.00 0.00 H new ATOM 0 HA ARG A 20 -6.376 20.624 9.831 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -4.171 19.754 9.004 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -3.644 21.398 8.702 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -3.989 21.953 11.128 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -4.515 20.309 11.429 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -2.285 19.489 10.521 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -1.769 21.158 10.389 1.00 0.00 H new ATOM 0 HE ARG A 20 -2.631 20.974 13.064 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -0.487 19.221 10.930 1.00 0.00 H new ATOM 0 HH12 ARG A 20 0.607 18.731 12.228 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -1.236 20.347 14.723 1.00 0.00 H new ATOM 0 HH22 ARG A 20 0.186 19.364 14.359 1.00 0.00 H new ATOM 339 N GLU A 21 -5.385 23.552 8.649 1.00 0.00 N ATOM 340 CA GLU A 21 -5.434 25.028 8.892 1.00 0.00 C ATOM 341 C GLU A 21 -6.383 25.671 7.879 1.00 0.00 C ATOM 342 O GLU A 21 -6.708 25.094 6.860 1.00 0.00 O ATOM 343 CB GLU A 21 -4.035 25.623 8.714 1.00 0.00 C ATOM 344 CG GLU A 21 -3.106 25.101 9.813 1.00 0.00 C ATOM 345 CD GLU A 21 -1.709 25.698 9.629 1.00 0.00 C ATOM 346 OE1 GLU A 21 -1.496 26.360 8.626 1.00 0.00 O ATOM 347 OE2 GLU A 21 -0.873 25.476 10.490 1.00 0.00 O ATOM 0 H GLU A 21 -4.966 23.281 7.759 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.786 25.219 9.906 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -3.639 25.358 7.734 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -4.085 26.711 8.754 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -3.500 25.367 10.794 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -3.056 24.013 9.775 1.00 0.00 H new ATOM 354 N GLY A 22 -6.840 26.855 8.165 1.00 0.00 N ATOM 355 CA GLY A 22 -7.785 27.543 7.241 1.00 0.00 C ATOM 356 C GLY A 22 -7.252 27.532 5.804 1.00 0.00 C ATOM 357 O GLY A 22 -7.979 27.812 4.872 1.00 0.00 O ATOM 0 H GLY A 22 -6.599 27.381 9.005 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -8.757 27.051 7.276 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -7.936 28.571 7.569 1.00 0.00 H new ATOM 361 N ASP A 23 -5.997 27.224 5.604 1.00 0.00 N ATOM 362 CA ASP A 23 -5.453 27.217 4.219 1.00 0.00 C ATOM 363 C ASP A 23 -5.962 25.974 3.475 1.00 0.00 C ATOM 364 O ASP A 23 -5.200 25.113 3.087 1.00 0.00 O ATOM 365 CB ASP A 23 -3.930 27.186 4.303 1.00 0.00 C ATOM 366 CG ASP A 23 -3.426 28.518 4.861 1.00 0.00 C ATOM 367 OD1 ASP A 23 -4.097 29.515 4.655 1.00 0.00 O ATOM 368 OD2 ASP A 23 -2.376 28.518 5.483 1.00 0.00 O ATOM 0 H ASP A 23 -5.331 26.979 6.337 1.00 0.00 H new ATOM 0 HA ASP A 23 -5.778 28.106 3.679 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -3.606 26.365 4.943 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -3.504 27.008 3.316 1.00 0.00 H new ATOM 373 N LYS A 24 -7.253 25.875 3.291 1.00 0.00 N ATOM 374 CA LYS A 24 -7.835 24.689 2.590 1.00 0.00 C ATOM 375 C LYS A 24 -7.485 24.695 1.094 1.00 0.00 C ATOM 376 O LYS A 24 -7.218 23.663 0.509 1.00 0.00 O ATOM 377 CB LYS A 24 -9.360 24.746 2.733 1.00 0.00 C ATOM 378 CG LYS A 24 -9.758 24.468 4.186 1.00 0.00 C ATOM 379 CD LYS A 24 -11.182 24.972 4.439 1.00 0.00 C ATOM 380 CE LYS A 24 -12.163 24.246 3.517 1.00 0.00 C ATOM 381 NZ LYS A 24 -11.895 22.782 3.555 1.00 0.00 N ATOM 0 H LYS A 24 -7.935 26.569 3.598 1.00 0.00 H new ATOM 0 HA LYS A 24 -7.425 23.783 3.037 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -9.726 25.726 2.428 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -9.824 24.013 2.073 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -9.699 23.399 4.391 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -9.062 24.961 4.864 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -11.457 24.805 5.480 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -11.233 26.047 4.265 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -13.188 24.446 3.830 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -12.062 24.618 2.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -12.751 22.265 3.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -11.119 22.554 2.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -11.628 22.503 4.521 1.00 0.00 H new ATOM 395 N HIS A 25 -7.513 25.842 0.460 1.00 0.00 N ATOM 396 CA HIS A 25 -7.216 25.900 -1.010 1.00 0.00 C ATOM 397 C HIS A 25 -5.734 26.189 -1.251 1.00 0.00 C ATOM 398 O HIS A 25 -5.290 26.281 -2.378 1.00 0.00 O ATOM 399 CB HIS A 25 -8.056 27.008 -1.652 1.00 0.00 C ATOM 400 CG HIS A 25 -9.508 26.612 -1.637 1.00 0.00 C ATOM 401 ND1 HIS A 25 -10.329 26.852 -0.544 1.00 0.00 N ATOM 402 CD2 HIS A 25 -10.302 25.996 -2.574 1.00 0.00 C ATOM 403 CE1 HIS A 25 -11.555 26.388 -0.847 1.00 0.00 C ATOM 404 NE2 HIS A 25 -11.591 25.859 -2.071 1.00 0.00 N ATOM 0 H HIS A 25 -7.728 26.740 0.894 1.00 0.00 H new ATOM 0 HA HIS A 25 -7.462 24.936 -1.454 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -7.918 27.944 -1.110 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -7.726 27.181 -2.676 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -9.975 25.669 -3.550 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -12.404 26.438 -0.182 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -12.395 25.442 -2.540 1.00 0.00 H new ATOM 413 N LYS A 26 -4.961 26.340 -0.213 1.00 0.00 N ATOM 414 CA LYS A 26 -3.508 26.630 -0.399 1.00 0.00 C ATOM 415 C LYS A 26 -2.718 25.984 0.733 1.00 0.00 C ATOM 416 O LYS A 26 -3.280 25.470 1.679 1.00 0.00 O ATOM 417 CB LYS A 26 -3.281 28.145 -0.413 1.00 0.00 C ATOM 418 CG LYS A 26 -3.734 28.760 0.913 1.00 0.00 C ATOM 419 CD LYS A 26 -3.888 30.274 0.745 1.00 0.00 C ATOM 420 CE LYS A 26 -4.190 30.915 2.098 1.00 0.00 C ATOM 421 NZ LYS A 26 -4.689 32.303 1.884 1.00 0.00 N ATOM 0 H LYS A 26 -5.270 26.276 0.757 1.00 0.00 H new ATOM 0 HA LYS A 26 -3.168 26.219 -1.350 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -2.226 28.360 -0.580 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -3.833 28.595 -1.238 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -4.681 28.320 1.226 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -3.007 28.542 1.695 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -2.975 30.698 0.327 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -4.692 30.491 0.041 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -4.935 30.327 2.634 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -3.292 30.930 2.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -4.896 32.743 2.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -3.964 32.860 1.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -5.556 32.276 1.310 1.00 0.00 H new ATOM 435 N LEU A 27 -1.416 25.971 0.624 1.00 0.00 N ATOM 436 CA LEU A 27 -0.572 25.332 1.678 1.00 0.00 C ATOM 437 C LEU A 27 0.597 26.268 2.006 1.00 0.00 C ATOM 438 O LEU A 27 1.278 26.739 1.123 1.00 0.00 O ATOM 439 CB LEU A 27 -0.047 24.005 1.119 1.00 0.00 C ATOM 440 CG LEU A 27 0.526 23.131 2.246 1.00 0.00 C ATOM 441 CD1 LEU A 27 -0.609 22.500 3.076 1.00 0.00 C ATOM 442 CD2 LEU A 27 1.374 22.017 1.629 1.00 0.00 C ATOM 0 H LEU A 27 -0.897 26.378 -0.154 1.00 0.00 H new ATOM 0 HA LEU A 27 -1.145 25.149 2.587 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -0.853 23.473 0.613 1.00 0.00 H new ATOM 0 HB3 LEU A 27 0.724 24.198 0.374 1.00 0.00 H new ATOM 0 HG LEU A 27 1.134 23.754 2.901 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.182 21.885 3.868 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -1.219 23.288 3.517 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -1.230 21.879 2.430 1.00 0.00 H new ATOM 0 HD21 LEU A 27 1.785 21.391 2.421 1.00 0.00 H new ATOM 0 HD22 LEU A 27 0.753 21.409 0.972 1.00 0.00 H new ATOM 0 HD23 LEU A 27 2.189 22.456 1.054 1.00 0.00 H new ATOM 454 N LYS A 28 0.833 26.561 3.263 1.00 0.00 N ATOM 455 CA LYS A 28 1.954 27.483 3.623 1.00 0.00 C ATOM 456 C LYS A 28 3.201 26.669 3.994 1.00 0.00 C ATOM 457 O LYS A 28 3.103 25.584 4.532 1.00 0.00 O ATOM 458 CB LYS A 28 1.503 28.344 4.812 1.00 0.00 C ATOM 459 CG LYS A 28 2.610 29.313 5.231 1.00 0.00 C ATOM 460 CD LYS A 28 2.125 30.152 6.414 1.00 0.00 C ATOM 461 CE LYS A 28 3.195 31.182 6.785 1.00 0.00 C ATOM 462 NZ LYS A 28 3.462 32.067 5.613 1.00 0.00 N ATOM 0 H LYS A 28 0.298 26.201 4.053 1.00 0.00 H new ATOM 0 HA LYS A 28 2.206 28.123 2.777 1.00 0.00 H new ATOM 0 HB2 LYS A 28 0.607 28.903 4.543 1.00 0.00 H new ATOM 0 HB3 LYS A 28 1.238 27.702 5.652 1.00 0.00 H new ATOM 0 HG2 LYS A 28 3.508 28.760 5.506 1.00 0.00 H new ATOM 0 HG3 LYS A 28 2.878 29.961 4.396 1.00 0.00 H new ATOM 0 HD2 LYS A 28 1.193 30.656 6.158 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.914 29.508 7.268 1.00 0.00 H new ATOM 0 HE2 LYS A 28 2.862 31.777 7.635 1.00 0.00 H new ATOM 0 HE3 LYS A 28 4.112 30.677 7.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 3.847 32.975 5.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 4.150 31.609 4.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 2.575 32.235 5.096 1.00 0.00 H new ATOM 476 N LYS A 29 4.374 27.186 3.698 1.00 0.00 N ATOM 477 CA LYS A 29 5.637 26.456 4.020 1.00 0.00 C ATOM 478 C LYS A 29 5.528 25.834 5.410 1.00 0.00 C ATOM 479 O LYS A 29 6.208 24.884 5.738 1.00 0.00 O ATOM 480 CB LYS A 29 6.818 27.442 4.014 1.00 0.00 C ATOM 481 CG LYS A 29 6.750 28.388 5.223 1.00 0.00 C ATOM 482 CD LYS A 29 7.782 29.504 5.058 1.00 0.00 C ATOM 483 CE LYS A 29 7.885 30.291 6.364 1.00 0.00 C ATOM 484 NZ LYS A 29 8.930 31.344 6.226 1.00 0.00 N ATOM 0 H LYS A 29 4.507 28.090 3.244 1.00 0.00 H new ATOM 0 HA LYS A 29 5.798 25.677 3.275 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.758 26.890 4.032 1.00 0.00 H new ATOM 0 HB3 LYS A 29 6.807 28.023 3.092 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.750 28.813 5.309 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.942 27.834 6.142 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.752 29.082 4.796 1.00 0.00 H new ATOM 0 HD3 LYS A 29 7.492 30.166 4.242 1.00 0.00 H new ATOM 0 HE2 LYS A 29 6.924 30.746 6.604 1.00 0.00 H new ATOM 0 HE3 LYS A 29 8.135 29.621 7.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.001 31.881 7.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 9.846 30.899 6.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 8.673 31.989 5.452 1.00 0.00 H new ATOM 498 N SER A 30 4.685 26.385 6.229 1.00 0.00 N ATOM 499 CA SER A 30 4.534 25.844 7.613 1.00 0.00 C ATOM 500 C SER A 30 3.755 24.536 7.559 1.00 0.00 C ATOM 501 O SER A 30 4.165 23.528 8.099 1.00 0.00 O ATOM 502 CB SER A 30 3.781 26.851 8.483 1.00 0.00 C ATOM 503 OG SER A 30 4.614 27.976 8.733 1.00 0.00 O ATOM 0 H SER A 30 4.093 27.185 6.006 1.00 0.00 H new ATOM 0 HA SER A 30 5.520 25.667 8.042 1.00 0.00 H new ATOM 0 HB2 SER A 30 2.865 27.167 7.983 1.00 0.00 H new ATOM 0 HB3 SER A 30 3.487 26.386 9.424 1.00 0.00 H new ATOM 0 HG SER A 30 4.132 28.623 9.289 1.00 0.00 H new ATOM 509 N GLU A 31 2.640 24.545 6.893 1.00 0.00 N ATOM 510 CA GLU A 31 1.828 23.310 6.773 1.00 0.00 C ATOM 511 C GLU A 31 2.622 22.288 5.966 1.00 0.00 C ATOM 512 O GLU A 31 2.564 21.103 6.210 1.00 0.00 O ATOM 513 CB GLU A 31 0.523 23.643 6.060 1.00 0.00 C ATOM 514 CG GLU A 31 -0.350 24.492 6.983 1.00 0.00 C ATOM 515 CD GLU A 31 -1.535 25.045 6.196 1.00 0.00 C ATOM 516 OE1 GLU A 31 -2.475 24.301 5.977 1.00 0.00 O ATOM 517 OE2 GLU A 31 -1.477 26.205 5.821 1.00 0.00 O ATOM 0 H GLU A 31 2.253 25.363 6.422 1.00 0.00 H new ATOM 0 HA GLU A 31 1.600 22.900 7.757 1.00 0.00 H new ATOM 0 HB2 GLU A 31 0.727 24.182 5.135 1.00 0.00 H new ATOM 0 HB3 GLU A 31 0.000 22.727 5.786 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.705 23.891 7.820 1.00 0.00 H new ATOM 0 HG3 GLU A 31 0.235 25.310 7.403 1.00 0.00 H new ATOM 524 N LEU A 32 3.364 22.755 5.002 1.00 0.00 N ATOM 525 CA LEU A 32 4.179 21.839 4.161 1.00 0.00 C ATOM 526 C LEU A 32 5.170 21.083 5.039 1.00 0.00 C ATOM 527 O LEU A 32 5.366 19.907 4.876 1.00 0.00 O ATOM 528 CB LEU A 32 4.937 22.663 3.115 1.00 0.00 C ATOM 529 CG LEU A 32 5.871 21.769 2.287 1.00 0.00 C ATOM 530 CD1 LEU A 32 5.077 20.635 1.624 1.00 0.00 C ATOM 531 CD2 LEU A 32 6.535 22.628 1.206 1.00 0.00 C ATOM 0 H LEU A 32 3.441 23.743 4.759 1.00 0.00 H new ATOM 0 HA LEU A 32 3.529 21.122 3.661 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.227 23.164 2.456 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.517 23.442 3.610 1.00 0.00 H new ATOM 0 HG LEU A 32 6.625 21.329 2.939 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.753 20.010 1.041 1.00 0.00 H new ATOM 0 HD12 LEU A 32 4.596 20.030 2.393 1.00 0.00 H new ATOM 0 HD13 LEU A 32 4.317 21.059 0.967 1.00 0.00 H new ATOM 0 HD21 LEU A 32 7.203 22.008 0.608 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.768 23.061 0.563 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.107 23.427 1.677 1.00 0.00 H new ATOM 543 N LYS A 33 5.801 21.749 5.962 1.00 0.00 N ATOM 544 CA LYS A 33 6.784 21.048 6.850 1.00 0.00 C ATOM 545 C LYS A 33 6.104 19.934 7.634 1.00 0.00 C ATOM 546 O LYS A 33 6.666 18.876 7.824 1.00 0.00 O ATOM 547 CB LYS A 33 7.386 22.061 7.828 1.00 0.00 C ATOM 548 CG LYS A 33 8.394 21.370 8.756 1.00 0.00 C ATOM 549 CD LYS A 33 8.982 22.400 9.719 1.00 0.00 C ATOM 550 CE LYS A 33 9.986 21.715 10.646 1.00 0.00 C ATOM 551 NZ LYS A 33 10.667 22.738 11.486 1.00 0.00 N ATOM 0 H LYS A 33 5.684 22.746 6.145 1.00 0.00 H new ATOM 0 HA LYS A 33 7.567 20.609 6.231 1.00 0.00 H new ATOM 0 HB2 LYS A 33 7.879 22.861 7.276 1.00 0.00 H new ATOM 0 HB3 LYS A 33 6.594 22.522 8.418 1.00 0.00 H new ATOM 0 HG2 LYS A 33 7.904 20.572 9.314 1.00 0.00 H new ATOM 0 HG3 LYS A 33 9.188 20.908 8.170 1.00 0.00 H new ATOM 0 HD2 LYS A 33 9.472 23.198 9.161 1.00 0.00 H new ATOM 0 HD3 LYS A 33 8.187 22.862 10.304 1.00 0.00 H new ATOM 0 HE2 LYS A 33 9.475 20.990 11.280 1.00 0.00 H new ATOM 0 HE3 LYS A 33 10.721 21.164 10.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 10.840 22.349 12.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 11.573 22.999 11.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 10.064 23.582 11.563 1.00 0.00 H new ATOM 565 N GLU A 34 4.919 20.154 8.109 1.00 0.00 N ATOM 566 CA GLU A 34 4.247 19.095 8.899 1.00 0.00 C ATOM 567 C GLU A 34 3.868 17.948 7.973 1.00 0.00 C ATOM 568 O GLU A 34 3.826 16.807 8.361 1.00 0.00 O ATOM 569 CB GLU A 34 2.993 19.667 9.562 1.00 0.00 C ATOM 570 CG GLU A 34 3.395 20.686 10.630 1.00 0.00 C ATOM 571 CD GLU A 34 2.139 21.256 11.291 1.00 0.00 C ATOM 572 OE1 GLU A 34 1.058 20.993 10.790 1.00 0.00 O ATOM 573 OE2 GLU A 34 2.279 21.946 12.288 1.00 0.00 O ATOM 0 H GLU A 34 4.387 21.016 7.986 1.00 0.00 H new ATOM 0 HA GLU A 34 4.921 18.729 9.674 1.00 0.00 H new ATOM 0 HB2 GLU A 34 2.358 20.141 8.814 1.00 0.00 H new ATOM 0 HB3 GLU A 34 2.409 18.864 10.013 1.00 0.00 H new ATOM 0 HG2 GLU A 34 4.030 20.212 11.379 1.00 0.00 H new ATOM 0 HG3 GLU A 34 3.978 21.489 10.180 1.00 0.00 H new ATOM 580 N LEU A 35 3.592 18.249 6.751 1.00 0.00 N ATOM 581 CA LEU A 35 3.223 17.188 5.787 1.00 0.00 C ATOM 582 C LEU A 35 4.449 16.331 5.480 1.00 0.00 C ATOM 583 O LEU A 35 4.378 15.127 5.387 1.00 0.00 O ATOM 584 CB LEU A 35 2.721 17.868 4.507 1.00 0.00 C ATOM 585 CG LEU A 35 2.315 16.824 3.449 1.00 0.00 C ATOM 586 CD1 LEU A 35 1.441 17.512 2.392 1.00 0.00 C ATOM 587 CD2 LEU A 35 3.565 16.194 2.773 1.00 0.00 C ATOM 0 H LEU A 35 3.605 19.195 6.369 1.00 0.00 H new ATOM 0 HA LEU A 35 2.445 16.545 6.199 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.868 18.505 4.740 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.501 18.514 4.105 1.00 0.00 H new ATOM 0 HG LEU A 35 1.760 16.022 3.936 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.145 16.785 1.635 1.00 0.00 H new ATOM 0 HD12 LEU A 35 0.551 17.923 2.868 1.00 0.00 H new ATOM 0 HD13 LEU A 35 2.005 18.317 1.921 1.00 0.00 H new ATOM 0 HD21 LEU A 35 3.247 15.461 2.031 1.00 0.00 H new ATOM 0 HD22 LEU A 35 4.147 16.975 2.285 1.00 0.00 H new ATOM 0 HD23 LEU A 35 4.178 15.703 3.528 1.00 0.00 H new ATOM 599 N ILE A 36 5.569 16.957 5.296 1.00 0.00 N ATOM 600 CA ILE A 36 6.800 16.212 4.948 1.00 0.00 C ATOM 601 C ILE A 36 7.373 15.446 6.140 1.00 0.00 C ATOM 602 O ILE A 36 7.716 14.289 6.013 1.00 0.00 O ATOM 603 CB ILE A 36 7.847 17.198 4.430 1.00 0.00 C ATOM 604 CG1 ILE A 36 7.301 17.907 3.188 1.00 0.00 C ATOM 605 CG2 ILE A 36 9.117 16.433 4.051 1.00 0.00 C ATOM 606 CD1 ILE A 36 8.227 19.063 2.810 1.00 0.00 C ATOM 0 H ILE A 36 5.685 17.967 5.373 1.00 0.00 H new ATOM 0 HA ILE A 36 6.542 15.480 4.183 1.00 0.00 H new ATOM 0 HB ILE A 36 8.075 17.931 5.204 1.00 0.00 H new ATOM 0 HG12 ILE A 36 7.224 17.203 2.359 1.00 0.00 H new ATOM 0 HG13 ILE A 36 6.296 18.281 3.383 1.00 0.00 H new ATOM 0 HG21 ILE A 36 9.866 17.133 3.681 1.00 0.00 H new ATOM 0 HG22 ILE A 36 9.505 15.915 4.928 1.00 0.00 H new ATOM 0 HG23 ILE A 36 8.885 15.705 3.274 1.00 0.00 H new ATOM 0 HD11 ILE A 36 7.837 19.567 1.926 1.00 0.00 H new ATOM 0 HD12 ILE A 36 8.281 19.771 3.637 1.00 0.00 H new ATOM 0 HD13 ILE A 36 9.224 18.676 2.598 1.00 0.00 H new ATOM 618 N ASN A 37 7.537 16.064 7.287 1.00 0.00 N ATOM 619 CA ASN A 37 8.160 15.297 8.423 1.00 0.00 C ATOM 620 C ASN A 37 7.140 14.462 9.210 1.00 0.00 C ATOM 621 O ASN A 37 7.505 13.493 9.845 1.00 0.00 O ATOM 622 CB ASN A 37 8.888 16.250 9.369 1.00 0.00 C ATOM 623 CG ASN A 37 7.981 17.406 9.757 1.00 0.00 C ATOM 624 OD1 ASN A 37 6.782 17.337 9.593 1.00 0.00 O ATOM 625 ND2 ASN A 37 8.518 18.481 10.258 1.00 0.00 N ATOM 0 H ASN A 37 7.279 17.030 7.486 1.00 0.00 H new ATOM 0 HA ASN A 37 8.870 14.601 7.977 1.00 0.00 H new ATOM 0 HB2 ASN A 37 9.206 15.713 10.263 1.00 0.00 H new ATOM 0 HB3 ASN A 37 9.789 16.632 8.889 1.00 0.00 H new ATOM 0 HD21 ASN A 37 7.929 19.273 10.516 1.00 0.00 H new ATOM 0 HD22 ASN A 37 9.528 18.531 10.393 1.00 0.00 H new ATOM 632 N ASN A 38 5.882 14.815 9.201 1.00 0.00 N ATOM 633 CA ASN A 38 4.878 14.013 9.985 1.00 0.00 C ATOM 634 C ASN A 38 4.197 12.968 9.097 1.00 0.00 C ATOM 635 O ASN A 38 3.891 11.883 9.547 1.00 0.00 O ATOM 636 CB ASN A 38 3.813 14.941 10.576 1.00 0.00 C ATOM 637 CG ASN A 38 4.491 16.194 11.125 1.00 0.00 C ATOM 638 OD1 ASN A 38 5.764 16.153 11.402 1.00 0.00 O flip ATOM 639 ND2 ASN A 38 3.860 17.217 11.300 1.00 0.00 N flip ATOM 0 H ASN A 38 5.502 15.614 8.693 1.00 0.00 H new ATOM 0 HA ASN A 38 5.409 13.501 10.787 1.00 0.00 H new ATOM 0 HB2 ASN A 38 3.084 15.212 9.812 1.00 0.00 H new ATOM 0 HB3 ASN A 38 3.268 14.430 11.370 1.00 0.00 H new ATOM 0 HD21 ASN A 38 2.864 17.245 11.082 1.00 0.00 H new ATOM 0 HD22 ASN A 38 4.326 18.048 11.665 1.00 0.00 H new ATOM 646 N GLU A 39 3.945 13.267 7.845 1.00 0.00 N ATOM 647 CA GLU A 39 3.273 12.253 6.973 1.00 0.00 C ATOM 648 C GLU A 39 4.334 11.366 6.314 1.00 0.00 C ATOM 649 O GLU A 39 4.039 10.289 5.838 1.00 0.00 O ATOM 650 CB GLU A 39 2.434 12.955 5.886 1.00 0.00 C ATOM 651 CG GLU A 39 1.393 11.980 5.329 1.00 0.00 C ATOM 652 CD GLU A 39 0.215 11.866 6.304 1.00 0.00 C ATOM 653 OE1 GLU A 39 0.379 12.244 7.451 1.00 0.00 O ATOM 654 OE2 GLU A 39 -0.835 11.413 5.882 1.00 0.00 O ATOM 0 H GLU A 39 4.171 14.154 7.395 1.00 0.00 H new ATOM 0 HA GLU A 39 2.611 11.640 7.585 1.00 0.00 H new ATOM 0 HB2 GLU A 39 1.939 13.831 6.304 1.00 0.00 H new ATOM 0 HB3 GLU A 39 3.082 13.308 5.084 1.00 0.00 H new ATOM 0 HG2 GLU A 39 1.041 12.326 4.357 1.00 0.00 H new ATOM 0 HG3 GLU A 39 1.845 11.000 5.174 1.00 0.00 H new ATOM 661 N LEU A 40 5.571 11.805 6.305 1.00 0.00 N ATOM 662 CA LEU A 40 6.677 10.989 5.695 1.00 0.00 C ATOM 663 C LEU A 40 7.814 10.893 6.718 1.00 0.00 C ATOM 664 O LEU A 40 8.978 10.957 6.377 1.00 0.00 O ATOM 665 CB LEU A 40 7.205 11.657 4.402 1.00 0.00 C ATOM 666 CG LEU A 40 6.064 12.317 3.603 1.00 0.00 C ATOM 667 CD1 LEU A 40 6.656 13.170 2.474 1.00 0.00 C ATOM 668 CD2 LEU A 40 5.160 11.244 2.983 1.00 0.00 C ATOM 0 H LEU A 40 5.866 12.699 6.696 1.00 0.00 H new ATOM 0 HA LEU A 40 6.300 10.000 5.437 1.00 0.00 H new ATOM 0 HB2 LEU A 40 7.953 12.407 4.658 1.00 0.00 H new ATOM 0 HB3 LEU A 40 7.701 10.911 3.782 1.00 0.00 H new ATOM 0 HG LEU A 40 5.479 12.940 4.280 1.00 0.00 H new ATOM 0 HD11 LEU A 40 5.849 13.637 1.909 1.00 0.00 H new ATOM 0 HD12 LEU A 40 7.296 13.943 2.899 1.00 0.00 H new ATOM 0 HD13 LEU A 40 7.245 12.537 1.810 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.358 11.724 2.422 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.747 10.616 2.313 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.731 10.628 3.774 1.00 0.00 H new ATOM 680 N SER A 41 7.480 10.772 7.972 1.00 0.00 N ATOM 681 CA SER A 41 8.532 10.707 9.026 1.00 0.00 C ATOM 682 C SER A 41 9.460 9.508 8.798 1.00 0.00 C ATOM 683 O SER A 41 10.668 9.643 8.807 1.00 0.00 O ATOM 684 CB SER A 41 7.857 10.560 10.390 1.00 0.00 C ATOM 685 OG SER A 41 8.817 10.778 11.414 1.00 0.00 O ATOM 0 H SER A 41 6.521 10.715 8.314 1.00 0.00 H new ATOM 0 HA SER A 41 9.125 11.621 8.986 1.00 0.00 H new ATOM 0 HB2 SER A 41 7.040 11.275 10.483 1.00 0.00 H new ATOM 0 HB3 SER A 41 7.423 9.565 10.488 1.00 0.00 H new ATOM 0 HG SER A 41 8.387 10.686 12.290 1.00 0.00 H new ATOM 691 N HIS A 42 8.913 8.334 8.605 1.00 0.00 N ATOM 692 CA HIS A 42 9.772 7.124 8.391 1.00 0.00 C ATOM 693 C HIS A 42 9.876 6.792 6.899 1.00 0.00 C ATOM 694 O HIS A 42 10.874 6.270 6.442 1.00 0.00 O ATOM 695 CB HIS A 42 9.154 5.932 9.128 1.00 0.00 C ATOM 696 CG HIS A 42 9.288 6.122 10.617 1.00 0.00 C ATOM 697 ND1 HIS A 42 10.456 5.809 11.302 1.00 0.00 N ATOM 698 CD2 HIS A 42 8.407 6.577 11.570 1.00 0.00 C ATOM 699 CE1 HIS A 42 10.248 6.078 12.605 1.00 0.00 C ATOM 700 NE2 HIS A 42 9.018 6.547 12.819 1.00 0.00 N ATOM 0 H HIS A 42 7.908 8.159 8.586 1.00 0.00 H new ATOM 0 HA HIS A 42 10.771 7.331 8.776 1.00 0.00 H new ATOM 0 HB2 HIS A 42 8.102 5.833 8.859 1.00 0.00 H new ATOM 0 HB3 HIS A 42 9.649 5.010 8.825 1.00 0.00 H new ATOM 0 HD2 HIS A 42 7.397 6.907 11.378 1.00 0.00 H new ATOM 0 HE1 HIS A 42 10.986 5.932 13.380 1.00 0.00 H new ATOM 0 HE2 HIS A 42 8.611 6.825 13.712 1.00 0.00 H new ATOM 709 N PHE A 43 8.851 7.063 6.142 1.00 0.00 N ATOM 710 CA PHE A 43 8.891 6.733 4.688 1.00 0.00 C ATOM 711 C PHE A 43 9.931 7.600 3.962 1.00 0.00 C ATOM 712 O PHE A 43 10.563 7.157 3.023 1.00 0.00 O ATOM 713 CB PHE A 43 7.498 6.955 4.078 1.00 0.00 C ATOM 714 CG PHE A 43 7.545 6.914 2.555 1.00 0.00 C ATOM 715 CD1 PHE A 43 8.434 6.059 1.871 1.00 0.00 C ATOM 716 CD2 PHE A 43 6.691 7.751 1.823 1.00 0.00 C ATOM 717 CE1 PHE A 43 8.458 6.048 0.471 1.00 0.00 C ATOM 718 CE2 PHE A 43 6.725 7.734 0.424 1.00 0.00 C ATOM 719 CZ PHE A 43 7.605 6.884 -0.251 1.00 0.00 C ATOM 0 H PHE A 43 7.987 7.498 6.465 1.00 0.00 H new ATOM 0 HA PHE A 43 9.179 5.688 4.570 1.00 0.00 H new ATOM 0 HB2 PHE A 43 6.813 6.190 4.443 1.00 0.00 H new ATOM 0 HB3 PHE A 43 7.105 7.917 4.406 1.00 0.00 H new ATOM 0 HD1 PHE A 43 9.097 5.412 2.427 1.00 0.00 H new ATOM 0 HD2 PHE A 43 6.007 8.409 2.339 1.00 0.00 H new ATOM 0 HE1 PHE A 43 9.138 5.391 -0.051 1.00 0.00 H new ATOM 0 HE2 PHE A 43 6.067 8.381 -0.137 1.00 0.00 H new ATOM 0 HZ PHE A 43 7.625 6.874 -1.331 1.00 0.00 H new ATOM 729 N LEU A 44 10.105 8.833 4.375 1.00 0.00 N ATOM 730 CA LEU A 44 11.095 9.733 3.694 1.00 0.00 C ATOM 731 C LEU A 44 11.916 10.464 4.752 1.00 0.00 C ATOM 732 O LEU A 44 11.516 10.574 5.894 1.00 0.00 O ATOM 733 CB LEU A 44 10.336 10.756 2.830 1.00 0.00 C ATOM 734 CG LEU A 44 11.279 11.382 1.777 1.00 0.00 C ATOM 735 CD1 LEU A 44 11.334 10.498 0.525 1.00 0.00 C ATOM 736 CD2 LEU A 44 10.765 12.773 1.379 1.00 0.00 C ATOM 0 H LEU A 44 9.604 9.257 5.156 1.00 0.00 H new ATOM 0 HA LEU A 44 11.759 9.145 3.061 1.00 0.00 H new ATOM 0 HB2 LEU A 44 9.498 10.269 2.332 1.00 0.00 H new ATOM 0 HB3 LEU A 44 9.919 11.538 3.464 1.00 0.00 H new ATOM 0 HG LEU A 44 12.276 11.465 2.210 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.001 10.949 -0.210 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.705 9.509 0.794 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.335 10.407 0.100 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.433 13.209 0.637 1.00 0.00 H new ATOM 0 HD22 LEU A 44 9.764 12.684 0.958 1.00 0.00 H new ATOM 0 HD23 LEU A 44 10.732 13.415 2.260 1.00 0.00 H new ATOM 748 N GLU A 45 13.061 10.969 4.388 1.00 0.00 N ATOM 749 CA GLU A 45 13.890 11.689 5.384 1.00 0.00 C ATOM 750 C GLU A 45 13.084 12.872 5.926 1.00 0.00 C ATOM 751 O GLU A 45 12.811 13.828 5.227 1.00 0.00 O ATOM 752 CB GLU A 45 15.168 12.193 4.701 1.00 0.00 C ATOM 753 CG GLU A 45 16.070 12.896 5.721 1.00 0.00 C ATOM 754 CD GLU A 45 16.507 11.901 6.798 1.00 0.00 C ATOM 755 OE1 GLU A 45 16.489 10.713 6.520 1.00 0.00 O ATOM 756 OE2 GLU A 45 16.849 12.343 7.883 1.00 0.00 O ATOM 0 H GLU A 45 13.454 10.913 3.448 1.00 0.00 H new ATOM 0 HA GLU A 45 14.162 11.026 6.205 1.00 0.00 H new ATOM 0 HB2 GLU A 45 15.701 11.357 4.248 1.00 0.00 H new ATOM 0 HB3 GLU A 45 14.912 12.881 3.896 1.00 0.00 H new ATOM 0 HG2 GLU A 45 16.945 13.312 5.221 1.00 0.00 H new ATOM 0 HG3 GLU A 45 15.537 13.730 6.178 1.00 0.00 H new ATOM 763 N GLU A 46 12.700 12.807 7.169 1.00 0.00 N ATOM 764 CA GLU A 46 11.905 13.913 7.774 1.00 0.00 C ATOM 765 C GLU A 46 12.756 15.192 7.813 1.00 0.00 C ATOM 766 O GLU A 46 13.971 15.135 7.829 1.00 0.00 O ATOM 767 CB GLU A 46 11.477 13.494 9.198 1.00 0.00 C ATOM 768 CG GLU A 46 12.569 13.828 10.222 1.00 0.00 C ATOM 769 CD GLU A 46 12.268 13.118 11.544 1.00 0.00 C ATOM 770 OE1 GLU A 46 11.150 13.239 12.019 1.00 0.00 O ATOM 771 OE2 GLU A 46 13.161 12.464 12.058 1.00 0.00 O ATOM 0 H GLU A 46 12.904 12.030 7.797 1.00 0.00 H new ATOM 0 HA GLU A 46 11.014 14.112 7.179 1.00 0.00 H new ATOM 0 HB2 GLU A 46 10.552 14.004 9.468 1.00 0.00 H new ATOM 0 HB3 GLU A 46 11.269 12.424 9.219 1.00 0.00 H new ATOM 0 HG2 GLU A 46 13.543 13.517 9.844 1.00 0.00 H new ATOM 0 HG3 GLU A 46 12.617 14.906 10.379 1.00 0.00 H new ATOM 778 N ILE A 47 12.135 16.344 7.836 1.00 0.00 N ATOM 779 CA ILE A 47 12.924 17.602 7.881 1.00 0.00 C ATOM 780 C ILE A 47 13.382 17.842 9.318 1.00 0.00 C ATOM 781 O ILE A 47 12.647 17.607 10.256 1.00 0.00 O ATOM 782 CB ILE A 47 12.061 18.787 7.443 1.00 0.00 C ATOM 783 CG1 ILE A 47 11.361 18.451 6.110 1.00 0.00 C ATOM 784 CG2 ILE A 47 12.951 20.051 7.289 1.00 0.00 C ATOM 785 CD1 ILE A 47 12.389 18.041 5.050 1.00 0.00 C ATOM 0 H ILE A 47 11.122 16.463 7.826 1.00 0.00 H new ATOM 0 HA ILE A 47 13.778 17.511 7.210 1.00 0.00 H new ATOM 0 HB ILE A 47 11.300 18.986 8.197 1.00 0.00 H new ATOM 0 HG12 ILE A 47 10.645 17.643 6.262 1.00 0.00 H new ATOM 0 HG13 ILE A 47 10.796 19.316 5.761 1.00 0.00 H new ATOM 0 HG21 ILE A 47 12.335 20.894 6.977 1.00 0.00 H new ATOM 0 HG22 ILE A 47 13.424 20.281 8.243 1.00 0.00 H new ATOM 0 HG23 ILE A 47 13.719 19.866 6.538 1.00 0.00 H new ATOM 0 HD11 ILE A 47 11.876 17.808 4.117 1.00 0.00 H new ATOM 0 HD12 ILE A 47 13.088 18.861 4.885 1.00 0.00 H new ATOM 0 HD13 ILE A 47 12.935 17.162 5.393 1.00 0.00 H new ATOM 797 N LYS A 48 14.592 18.298 9.497 1.00 0.00 N ATOM 798 CA LYS A 48 15.115 18.545 10.875 1.00 0.00 C ATOM 799 C LYS A 48 15.118 20.047 11.174 1.00 0.00 C ATOM 800 O LYS A 48 15.130 20.460 12.317 1.00 0.00 O ATOM 801 CB LYS A 48 16.538 17.990 10.950 1.00 0.00 C ATOM 802 CG LYS A 48 16.546 16.529 10.428 1.00 0.00 C ATOM 803 CD LYS A 48 17.012 16.475 8.969 1.00 0.00 C ATOM 804 CE LYS A 48 17.140 15.012 8.537 1.00 0.00 C ATOM 805 NZ LYS A 48 18.224 14.354 9.319 1.00 0.00 N ATOM 0 H LYS A 48 15.246 18.512 8.744 1.00 0.00 H new ATOM 0 HA LYS A 48 14.481 18.053 11.612 1.00 0.00 H new ATOM 0 HB2 LYS A 48 17.212 18.605 10.354 1.00 0.00 H new ATOM 0 HB3 LYS A 48 16.900 18.023 11.978 1.00 0.00 H new ATOM 0 HG2 LYS A 48 17.205 15.920 11.048 1.00 0.00 H new ATOM 0 HG3 LYS A 48 15.546 16.103 10.511 1.00 0.00 H new ATOM 0 HD2 LYS A 48 16.301 16.995 8.328 1.00 0.00 H new ATOM 0 HD3 LYS A 48 17.970 16.984 8.861 1.00 0.00 H new ATOM 0 HE2 LYS A 48 16.196 14.491 8.696 1.00 0.00 H new ATOM 0 HE3 LYS A 48 17.360 14.955 7.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 18.496 13.464 8.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 19.049 14.985 9.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 17.885 14.152 10.281 1.00 0.00 H new ATOM 819 N GLU A 49 15.096 20.868 10.154 1.00 0.00 N ATOM 820 CA GLU A 49 15.086 22.349 10.367 1.00 0.00 C ATOM 821 C GLU A 49 14.125 22.986 9.350 1.00 0.00 C ATOM 822 O GLU A 49 14.065 22.582 8.206 1.00 0.00 O ATOM 823 CB GLU A 49 16.505 22.893 10.175 1.00 0.00 C ATOM 824 CG GLU A 49 16.553 24.374 10.564 1.00 0.00 C ATOM 825 CD GLU A 49 16.382 24.515 12.077 1.00 0.00 C ATOM 826 OE1 GLU A 49 16.577 23.530 12.770 1.00 0.00 O ATOM 827 OE2 GLU A 49 16.053 25.605 12.517 1.00 0.00 O ATOM 0 H GLU A 49 15.084 20.575 9.177 1.00 0.00 H new ATOM 0 HA GLU A 49 14.751 22.588 11.376 1.00 0.00 H new ATOM 0 HB2 GLU A 49 17.207 22.325 10.785 1.00 0.00 H new ATOM 0 HB3 GLU A 49 16.813 22.771 9.137 1.00 0.00 H new ATOM 0 HG2 GLU A 49 17.502 24.811 10.253 1.00 0.00 H new ATOM 0 HG3 GLU A 49 15.765 24.922 10.047 1.00 0.00 H new ATOM 834 N GLN A 50 13.357 23.960 9.765 1.00 0.00 N ATOM 835 CA GLN A 50 12.378 24.605 8.833 1.00 0.00 C ATOM 836 C GLN A 50 13.100 25.339 7.697 1.00 0.00 C ATOM 837 O GLN A 50 12.535 25.573 6.652 1.00 0.00 O ATOM 838 CB GLN A 50 11.511 25.600 9.614 1.00 0.00 C ATOM 839 CG GLN A 50 12.393 26.692 10.244 1.00 0.00 C ATOM 840 CD GLN A 50 12.649 27.808 9.228 1.00 0.00 C ATOM 841 OE1 GLN A 50 13.850 27.977 8.750 1.00 0.00 O flip ATOM 842 NE2 GLN A 50 11.744 28.533 8.866 1.00 0.00 N flip ATOM 0 H GLN A 50 13.364 24.339 10.712 1.00 0.00 H new ATOM 0 HA GLN A 50 11.753 23.826 8.396 1.00 0.00 H new ATOM 0 HB2 GLN A 50 10.777 26.054 8.949 1.00 0.00 H new ATOM 0 HB3 GLN A 50 10.955 25.077 10.392 1.00 0.00 H new ATOM 0 HG2 GLN A 50 11.905 27.100 11.129 1.00 0.00 H new ATOM 0 HG3 GLN A 50 13.340 26.263 10.571 1.00 0.00 H new ATOM 0 HE21 GLN A 50 10.804 28.401 9.240 1.00 0.00 H new ATOM 0 HE22 GLN A 50 11.924 29.274 8.188 1.00 0.00 H new ATOM 851 N GLU A 51 14.332 25.709 7.882 1.00 0.00 N ATOM 852 CA GLU A 51 15.059 26.425 6.793 1.00 0.00 C ATOM 853 C GLU A 51 15.116 25.542 5.558 1.00 0.00 C ATOM 854 O GLU A 51 14.976 26.012 4.454 1.00 0.00 O ATOM 855 CB GLU A 51 16.476 26.770 7.260 1.00 0.00 C ATOM 856 CG GLU A 51 17.303 25.489 7.390 1.00 0.00 C ATOM 857 CD GLU A 51 18.617 25.802 8.110 1.00 0.00 C ATOM 858 OE1 GLU A 51 19.000 26.960 8.124 1.00 0.00 O ATOM 859 OE2 GLU A 51 19.217 24.878 8.633 1.00 0.00 O ATOM 0 H GLU A 51 14.869 25.550 8.735 1.00 0.00 H new ATOM 0 HA GLU A 51 14.534 27.348 6.548 1.00 0.00 H new ATOM 0 HB2 GLU A 51 16.948 27.449 6.550 1.00 0.00 H new ATOM 0 HB3 GLU A 51 16.437 27.288 8.218 1.00 0.00 H new ATOM 0 HG2 GLU A 51 16.743 24.736 7.944 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.507 25.073 6.403 1.00 0.00 H new ATOM 866 N VAL A 52 15.312 24.267 5.731 1.00 0.00 N ATOM 867 CA VAL A 52 15.363 23.369 4.552 1.00 0.00 C ATOM 868 C VAL A 52 14.042 23.462 3.826 1.00 0.00 C ATOM 869 O VAL A 52 13.989 23.479 2.620 1.00 0.00 O ATOM 870 CB VAL A 52 15.599 21.933 5.011 1.00 0.00 C ATOM 871 CG1 VAL A 52 15.456 20.970 3.825 1.00 0.00 C ATOM 872 CG2 VAL A 52 16.999 21.828 5.604 1.00 0.00 C ATOM 0 H VAL A 52 15.438 23.811 6.635 1.00 0.00 H new ATOM 0 HA VAL A 52 16.176 23.664 3.889 1.00 0.00 H new ATOM 0 HB VAL A 52 14.860 21.664 5.765 1.00 0.00 H new ATOM 0 HG11 VAL A 52 15.626 19.948 4.164 1.00 0.00 H new ATOM 0 HG12 VAL A 52 14.452 21.052 3.409 1.00 0.00 H new ATOM 0 HG13 VAL A 52 16.188 21.225 3.059 1.00 0.00 H new ATOM 0 HG21 VAL A 52 17.178 20.805 5.935 1.00 0.00 H new ATOM 0 HG22 VAL A 52 17.736 22.099 4.848 1.00 0.00 H new ATOM 0 HG23 VAL A 52 17.086 22.505 6.454 1.00 0.00 H new ATOM 882 N VAL A 53 12.975 23.523 4.554 1.00 0.00 N ATOM 883 CA VAL A 53 11.650 23.623 3.909 1.00 0.00 C ATOM 884 C VAL A 53 11.603 24.891 3.077 1.00 0.00 C ATOM 885 O VAL A 53 11.087 24.895 1.993 1.00 0.00 O ATOM 886 CB VAL A 53 10.577 23.655 4.987 1.00 0.00 C ATOM 887 CG1 VAL A 53 9.196 23.763 4.341 1.00 0.00 C ATOM 888 CG2 VAL A 53 10.680 22.370 5.807 1.00 0.00 C ATOM 0 H VAL A 53 12.963 23.508 5.574 1.00 0.00 H new ATOM 0 HA VAL A 53 11.475 22.765 3.260 1.00 0.00 H new ATOM 0 HB VAL A 53 10.720 24.519 5.636 1.00 0.00 H new ATOM 0 HG11 VAL A 53 8.432 23.785 5.118 1.00 0.00 H new ATOM 0 HG12 VAL A 53 9.141 24.678 3.751 1.00 0.00 H new ATOM 0 HG13 VAL A 53 9.029 22.903 3.693 1.00 0.00 H new ATOM 0 HG21 VAL A 53 9.918 22.374 6.586 1.00 0.00 H new ATOM 0 HG22 VAL A 53 10.529 21.509 5.155 1.00 0.00 H new ATOM 0 HG23 VAL A 53 11.667 22.309 6.265 1.00 0.00 H new ATOM 898 N ASP A 54 12.156 25.960 3.574 1.00 0.00 N ATOM 899 CA ASP A 54 12.164 27.229 2.798 1.00 0.00 C ATOM 900 C ASP A 54 12.936 27.000 1.497 1.00 0.00 C ATOM 901 O ASP A 54 12.573 27.490 0.452 1.00 0.00 O ATOM 902 CB ASP A 54 12.828 28.338 3.623 1.00 0.00 C ATOM 903 CG ASP A 54 12.831 29.646 2.826 1.00 0.00 C ATOM 904 OD1 ASP A 54 12.647 29.587 1.622 1.00 0.00 O ATOM 905 OD2 ASP A 54 13.011 30.687 3.436 1.00 0.00 O ATOM 0 H ASP A 54 12.605 26.010 4.489 1.00 0.00 H new ATOM 0 HA ASP A 54 11.143 27.535 2.569 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.293 28.475 4.563 1.00 0.00 H new ATOM 0 HB3 ASP A 54 13.849 28.054 3.877 1.00 0.00 H new ATOM 910 N LYS A 55 14.005 26.259 1.573 1.00 0.00 N ATOM 911 CA LYS A 55 14.832 25.972 0.361 1.00 0.00 C ATOM 912 C LYS A 55 13.957 25.237 -0.653 1.00 0.00 C ATOM 913 O LYS A 55 13.983 25.498 -1.845 1.00 0.00 O ATOM 914 CB LYS A 55 16.014 25.071 0.765 1.00 0.00 C ATOM 915 CG LYS A 55 17.122 25.115 -0.308 1.00 0.00 C ATOM 916 CD LYS A 55 18.069 26.284 -0.025 1.00 0.00 C ATOM 917 CE LYS A 55 19.173 26.319 -1.086 1.00 0.00 C ATOM 918 NZ LYS A 55 20.061 27.491 -0.844 1.00 0.00 N ATOM 0 H LYS A 55 14.348 25.833 2.434 1.00 0.00 H new ATOM 0 HA LYS A 55 15.211 26.897 -0.072 1.00 0.00 H new ATOM 0 HB2 LYS A 55 16.416 25.398 1.724 1.00 0.00 H new ATOM 0 HB3 LYS A 55 15.668 24.046 0.897 1.00 0.00 H new ATOM 0 HG2 LYS A 55 17.677 24.177 -0.310 1.00 0.00 H new ATOM 0 HG3 LYS A 55 16.679 25.225 -1.298 1.00 0.00 H new ATOM 0 HD2 LYS A 55 17.516 27.223 -0.030 1.00 0.00 H new ATOM 0 HD3 LYS A 55 18.507 26.178 0.967 1.00 0.00 H new ATOM 0 HE2 LYS A 55 19.753 25.397 -1.052 1.00 0.00 H new ATOM 0 HE3 LYS A 55 18.733 26.382 -2.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 20.810 27.514 -1.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 19.502 28.367 -0.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 20.491 27.412 0.100 1.00 0.00 H new ATOM 932 N VAL A 56 13.160 24.331 -0.164 1.00 0.00 N ATOM 933 CA VAL A 56 12.247 23.569 -1.049 1.00 0.00 C ATOM 934 C VAL A 56 11.194 24.531 -1.573 1.00 0.00 C ATOM 935 O VAL A 56 10.686 24.385 -2.668 1.00 0.00 O ATOM 936 CB VAL A 56 11.579 22.444 -0.238 1.00 0.00 C ATOM 937 CG1 VAL A 56 10.319 21.934 -0.951 1.00 0.00 C ATOM 938 CG2 VAL A 56 12.561 21.283 -0.076 1.00 0.00 C ATOM 0 H VAL A 56 13.104 24.085 0.824 1.00 0.00 H new ATOM 0 HA VAL A 56 12.793 23.124 -1.881 1.00 0.00 H new ATOM 0 HB VAL A 56 11.298 22.841 0.737 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.863 21.139 -0.360 1.00 0.00 H new ATOM 0 HG12 VAL A 56 9.609 22.753 -1.066 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.589 21.547 -1.934 1.00 0.00 H new ATOM 0 HG21 VAL A 56 12.090 20.485 0.498 1.00 0.00 H new ATOM 0 HG22 VAL A 56 12.843 20.905 -1.059 1.00 0.00 H new ATOM 0 HG23 VAL A 56 13.451 21.630 0.448 1.00 0.00 H new ATOM 948 N MET A 57 10.858 25.514 -0.791 1.00 0.00 N ATOM 949 CA MET A 57 9.828 26.480 -1.244 1.00 0.00 C ATOM 950 C MET A 57 10.392 27.326 -2.371 1.00 0.00 C ATOM 951 O MET A 57 9.686 27.734 -3.252 1.00 0.00 O ATOM 952 CB MET A 57 9.360 27.354 -0.081 1.00 0.00 C ATOM 953 CG MET A 57 8.543 26.489 0.884 1.00 0.00 C ATOM 954 SD MET A 57 6.958 26.034 0.123 1.00 0.00 S ATOM 955 CE MET A 57 6.010 27.511 0.570 1.00 0.00 C ATOM 0 H MET A 57 11.249 25.689 0.135 1.00 0.00 H new ATOM 0 HA MET A 57 8.960 25.934 -1.614 1.00 0.00 H new ATOM 0 HB2 MET A 57 10.217 27.789 0.434 1.00 0.00 H new ATOM 0 HB3 MET A 57 8.756 28.183 -0.450 1.00 0.00 H new ATOM 0 HG2 MET A 57 9.103 25.590 1.142 1.00 0.00 H new ATOM 0 HG3 MET A 57 8.367 27.033 1.812 1.00 0.00 H new ATOM 0 HE1 MET A 57 5.288 27.259 1.346 1.00 0.00 H new ATOM 0 HE2 MET A 57 6.688 28.280 0.941 1.00 0.00 H new ATOM 0 HE3 MET A 57 5.483 27.885 -0.308 1.00 0.00 H new ATOM 965 N GLU A 58 11.663 27.568 -2.393 1.00 0.00 N ATOM 966 CA GLU A 58 12.207 28.368 -3.514 1.00 0.00 C ATOM 967 C GLU A 58 11.870 27.608 -4.795 1.00 0.00 C ATOM 968 O GLU A 58 11.488 28.179 -5.796 1.00 0.00 O ATOM 969 CB GLU A 58 13.723 28.510 -3.357 1.00 0.00 C ATOM 970 CG GLU A 58 14.286 29.354 -4.501 1.00 0.00 C ATOM 971 CD GLU A 58 15.801 29.491 -4.332 1.00 0.00 C ATOM 972 OE1 GLU A 58 16.297 29.107 -3.285 1.00 0.00 O ATOM 973 OE2 GLU A 58 16.439 29.978 -5.251 1.00 0.00 O ATOM 0 H GLU A 58 12.340 27.254 -1.698 1.00 0.00 H new ATOM 0 HA GLU A 58 11.780 29.371 -3.536 1.00 0.00 H new ATOM 0 HB2 GLU A 58 13.956 28.976 -2.400 1.00 0.00 H new ATOM 0 HB3 GLU A 58 14.191 27.526 -3.355 1.00 0.00 H new ATOM 0 HG2 GLU A 58 14.056 28.888 -5.459 1.00 0.00 H new ATOM 0 HG3 GLU A 58 13.819 30.339 -4.506 1.00 0.00 H new ATOM 980 N THR A 59 11.991 26.310 -4.749 1.00 0.00 N ATOM 981 CA THR A 59 11.659 25.472 -5.937 1.00 0.00 C ATOM 982 C THR A 59 10.154 25.168 -6.007 1.00 0.00 C ATOM 983 O THR A 59 9.570 25.138 -7.072 1.00 0.00 O ATOM 984 CB THR A 59 12.407 24.148 -5.822 1.00 0.00 C ATOM 985 OG1 THR A 59 13.804 24.393 -5.796 1.00 0.00 O ATOM 986 CG2 THR A 59 12.060 23.244 -7.007 1.00 0.00 C ATOM 0 H THR A 59 12.309 25.789 -3.932 1.00 0.00 H new ATOM 0 HA THR A 59 11.948 26.019 -6.834 1.00 0.00 H new ATOM 0 HB THR A 59 12.110 23.649 -4.900 1.00 0.00 H new ATOM 0 HG1 THR A 59 14.284 23.542 -5.720 1.00 0.00 H new ATOM 0 HG21 THR A 59 12.599 22.301 -6.915 1.00 0.00 H new ATOM 0 HG22 THR A 59 10.988 23.049 -7.014 1.00 0.00 H new ATOM 0 HG23 THR A 59 12.346 23.737 -7.936 1.00 0.00 H new ATOM 994 N LEU A 60 9.533 24.898 -4.888 1.00 0.00 N ATOM 995 CA LEU A 60 8.084 24.544 -4.894 1.00 0.00 C ATOM 996 C LEU A 60 7.233 25.811 -4.829 1.00 0.00 C ATOM 997 O LEU A 60 6.074 25.802 -5.191 1.00 0.00 O ATOM 998 CB LEU A 60 7.791 23.642 -3.689 1.00 0.00 C ATOM 999 CG LEU A 60 6.315 23.227 -3.671 1.00 0.00 C ATOM 1000 CD1 LEU A 60 5.964 22.435 -4.947 1.00 0.00 C ATOM 1001 CD2 LEU A 60 6.064 22.361 -2.431 1.00 0.00 C ATOM 0 H LEU A 60 9.970 24.908 -3.967 1.00 0.00 H new ATOM 0 HA LEU A 60 7.837 24.015 -5.814 1.00 0.00 H new ATOM 0 HB2 LEU A 60 8.423 22.755 -3.730 1.00 0.00 H new ATOM 0 HB3 LEU A 60 8.038 24.167 -2.766 1.00 0.00 H new ATOM 0 HG LEU A 60 5.686 24.116 -3.638 1.00 0.00 H new ATOM 0 HD11 LEU A 60 4.913 22.148 -4.919 1.00 0.00 H new ATOM 0 HD12 LEU A 60 6.147 23.057 -5.823 1.00 0.00 H new ATOM 0 HD13 LEU A 60 6.584 21.540 -5.002 1.00 0.00 H new ATOM 0 HD21 LEU A 60 5.017 22.058 -2.405 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.697 21.475 -2.472 1.00 0.00 H new ATOM 0 HD23 LEU A 60 6.299 22.934 -1.534 1.00 0.00 H new ATOM 1013 N ASP A 61 7.790 26.913 -4.408 1.00 0.00 N ATOM 1014 CA ASP A 61 6.980 28.163 -4.381 1.00 0.00 C ATOM 1015 C ASP A 61 6.978 28.707 -5.793 1.00 0.00 C ATOM 1016 O ASP A 61 7.540 29.743 -6.090 1.00 0.00 O ATOM 1017 CB ASP A 61 7.574 29.207 -3.437 1.00 0.00 C ATOM 1018 CG ASP A 61 6.580 30.349 -3.265 1.00 0.00 C ATOM 1019 OD1 ASP A 61 5.469 30.223 -3.754 1.00 0.00 O ATOM 1020 OD2 ASP A 61 6.954 31.338 -2.664 1.00 0.00 O ATOM 0 H ASP A 61 8.754 27.003 -4.087 1.00 0.00 H new ATOM 0 HA ASP A 61 5.975 27.943 -4.021 1.00 0.00 H new ATOM 0 HB2 ASP A 61 7.798 28.755 -2.471 1.00 0.00 H new ATOM 0 HB3 ASP A 61 8.514 29.585 -3.838 1.00 0.00 H new ATOM 1025 N GLU A 62 6.365 27.983 -6.666 1.00 0.00 N ATOM 1026 CA GLU A 62 6.320 28.393 -8.086 1.00 0.00 C ATOM 1027 C GLU A 62 5.693 29.782 -8.188 1.00 0.00 C ATOM 1028 O GLU A 62 6.126 30.615 -8.960 1.00 0.00 O ATOM 1029 CB GLU A 62 5.470 27.383 -8.845 1.00 0.00 C ATOM 1030 CG GLU A 62 6.005 25.969 -8.570 1.00 0.00 C ATOM 1031 CD GLU A 62 5.196 24.951 -9.377 1.00 0.00 C ATOM 1032 OE1 GLU A 62 4.199 25.343 -9.959 1.00 0.00 O ATOM 1033 OE2 GLU A 62 5.585 23.795 -9.394 1.00 0.00 O ATOM 0 H GLU A 62 5.884 27.109 -6.456 1.00 0.00 H new ATOM 0 HA GLU A 62 7.324 28.426 -8.509 1.00 0.00 H new ATOM 0 HB2 GLU A 62 4.428 27.458 -8.533 1.00 0.00 H new ATOM 0 HB3 GLU A 62 5.499 27.595 -9.914 1.00 0.00 H new ATOM 0 HG2 GLU A 62 7.059 25.909 -8.841 1.00 0.00 H new ATOM 0 HG3 GLU A 62 5.936 25.743 -7.506 1.00 0.00 H new ATOM 1040 N ASP A 63 4.683 30.043 -7.409 1.00 0.00 N ATOM 1041 CA ASP A 63 4.040 31.385 -7.454 1.00 0.00 C ATOM 1042 C ASP A 63 4.940 32.382 -6.725 1.00 0.00 C ATOM 1043 O ASP A 63 4.802 33.581 -6.867 1.00 0.00 O ATOM 1044 CB ASP A 63 2.685 31.330 -6.750 1.00 0.00 C ATOM 1045 CG ASP A 63 1.750 30.394 -7.513 1.00 0.00 C ATOM 1046 OD1 ASP A 63 1.878 30.317 -8.724 1.00 0.00 O ATOM 1047 OD2 ASP A 63 0.918 29.771 -6.874 1.00 0.00 O ATOM 0 H ASP A 63 4.275 29.387 -6.744 1.00 0.00 H new ATOM 0 HA ASP A 63 3.896 31.690 -8.491 1.00 0.00 H new ATOM 0 HB2 ASP A 63 2.810 30.980 -5.725 1.00 0.00 H new ATOM 0 HB3 ASP A 63 2.251 32.329 -6.695 1.00 0.00 H new ATOM 1052 N GLY A 64 5.870 31.891 -5.952 1.00 0.00 N ATOM 1053 CA GLY A 64 6.792 32.810 -5.217 1.00 0.00 C ATOM 1054 C GLY A 64 6.016 33.590 -4.146 1.00 0.00 C ATOM 1055 O GLY A 64 6.338 34.721 -3.843 1.00 0.00 O ATOM 0 H GLY A 64 6.033 30.896 -5.796 1.00 0.00 H new ATOM 0 HA2 GLY A 64 7.594 32.237 -4.751 1.00 0.00 H new ATOM 0 HA3 GLY A 64 7.260 33.504 -5.916 1.00 0.00 H new ATOM 1059 N ASP A 65 4.993 32.998 -3.575 1.00 0.00 N ATOM 1060 CA ASP A 65 4.186 33.707 -2.526 1.00 0.00 C ATOM 1061 C ASP A 65 4.514 33.136 -1.145 1.00 0.00 C ATOM 1062 O ASP A 65 3.882 33.464 -0.160 1.00 0.00 O ATOM 1063 CB ASP A 65 2.697 33.505 -2.818 1.00 0.00 C ATOM 1064 CG ASP A 65 2.373 32.012 -2.795 1.00 0.00 C ATOM 1065 OD1 ASP A 65 3.292 31.227 -2.952 1.00 0.00 O ATOM 1066 OD2 ASP A 65 1.212 31.679 -2.620 1.00 0.00 O ATOM 0 H ASP A 65 4.680 32.051 -3.790 1.00 0.00 H new ATOM 0 HA ASP A 65 4.426 34.770 -2.540 1.00 0.00 H new ATOM 0 HB2 ASP A 65 2.095 34.030 -2.076 1.00 0.00 H new ATOM 0 HB3 ASP A 65 2.445 33.928 -3.791 1.00 0.00 H new ATOM 1071 N GLY A 66 5.493 32.281 -1.067 1.00 0.00 N ATOM 1072 CA GLY A 66 5.860 31.682 0.245 1.00 0.00 C ATOM 1073 C GLY A 66 4.886 30.549 0.564 1.00 0.00 C ATOM 1074 O GLY A 66 4.949 29.933 1.609 1.00 0.00 O ATOM 0 H GLY A 66 6.057 31.970 -1.858 1.00 0.00 H new ATOM 0 HA2 GLY A 66 6.881 31.303 0.213 1.00 0.00 H new ATOM 0 HA3 GLY A 66 5.826 32.440 1.028 1.00 0.00 H new ATOM 1078 N GLU A 67 3.977 30.281 -0.336 1.00 0.00 N ATOM 1079 CA GLU A 67 2.973 29.200 -0.115 1.00 0.00 C ATOM 1080 C GLU A 67 2.765 28.428 -1.422 1.00 0.00 C ATOM 1081 O GLU A 67 2.657 29.011 -2.482 1.00 0.00 O ATOM 1082 CB GLU A 67 1.641 29.836 0.293 1.00 0.00 C ATOM 1083 CG GLU A 67 1.884 30.870 1.388 1.00 0.00 C ATOM 1084 CD GLU A 67 0.549 31.473 1.828 1.00 0.00 C ATOM 1085 OE1 GLU A 67 -0.442 31.217 1.163 1.00 0.00 O ATOM 1086 OE2 GLU A 67 0.539 32.176 2.824 1.00 0.00 O ATOM 0 H GLU A 67 3.887 30.772 -1.226 1.00 0.00 H new ATOM 0 HA GLU A 67 3.326 28.525 0.665 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.172 30.308 -0.570 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.954 29.069 0.649 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.382 30.404 2.238 1.00 0.00 H new ATOM 0 HG3 GLU A 67 2.546 31.655 1.021 1.00 0.00 H new ATOM 1093 N CYS A 68 2.687 27.124 -1.356 1.00 0.00 N ATOM 1094 CA CYS A 68 2.461 26.313 -2.598 1.00 0.00 C ATOM 1095 C CYS A 68 0.981 25.934 -2.684 1.00 0.00 C ATOM 1096 O CYS A 68 0.389 25.452 -1.741 1.00 0.00 O ATOM 1097 CB CYS A 68 3.343 25.059 -2.569 1.00 0.00 C ATOM 1098 SG CYS A 68 2.597 23.795 -1.506 1.00 0.00 S ATOM 0 H CYS A 68 2.770 26.582 -0.496 1.00 0.00 H new ATOM 0 HA CYS A 68 2.730 26.897 -3.478 1.00 0.00 H new ATOM 0 HB2 CYS A 68 3.466 24.669 -3.579 1.00 0.00 H new ATOM 0 HB3 CYS A 68 4.337 25.313 -2.202 1.00 0.00 H new ATOM 0 HG CYS A 68 1.312 23.984 -1.443 1.00 0.00 H new ATOM 1104 N ASP A 69 0.389 26.166 -3.818 1.00 0.00 N ATOM 1105 CA ASP A 69 -1.053 25.852 -4.012 1.00 0.00 C ATOM 1106 C ASP A 69 -1.228 24.344 -4.159 1.00 0.00 C ATOM 1107 O ASP A 69 -0.267 23.608 -4.257 1.00 0.00 O ATOM 1108 CB ASP A 69 -1.552 26.561 -5.272 1.00 0.00 C ATOM 1109 CG ASP A 69 -3.025 26.220 -5.509 1.00 0.00 C ATOM 1110 OD1 ASP A 69 -3.289 25.145 -6.023 1.00 0.00 O ATOM 1111 OD2 ASP A 69 -3.863 27.043 -5.181 1.00 0.00 O ATOM 0 H ASP A 69 0.851 26.567 -4.634 1.00 0.00 H new ATOM 0 HA ASP A 69 -1.628 26.194 -3.152 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -1.431 27.639 -5.166 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -0.956 26.257 -6.132 1.00 0.00 H new ATOM 1116 N PHE A 70 -2.441 23.869 -4.164 1.00 0.00 N ATOM 1117 CA PHE A 70 -2.651 22.413 -4.291 1.00 0.00 C ATOM 1118 C PHE A 70 -1.979 21.913 -5.572 1.00 0.00 C ATOM 1119 O PHE A 70 -1.387 20.859 -5.590 1.00 0.00 O ATOM 1120 CB PHE A 70 -4.162 22.130 -4.332 1.00 0.00 C ATOM 1121 CG PHE A 70 -4.421 20.754 -4.906 1.00 0.00 C ATOM 1122 CD1 PHE A 70 -3.747 19.645 -4.385 1.00 0.00 C ATOM 1123 CD2 PHE A 70 -5.318 20.591 -5.969 1.00 0.00 C ATOM 1124 CE1 PHE A 70 -3.967 18.377 -4.924 1.00 0.00 C ATOM 1125 CE2 PHE A 70 -5.541 19.323 -6.506 1.00 0.00 C ATOM 1126 CZ PHE A 70 -4.864 18.213 -5.986 1.00 0.00 C ATOM 0 H PHE A 70 -3.290 24.429 -4.086 1.00 0.00 H new ATOM 0 HA PHE A 70 -2.212 21.893 -3.440 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -4.579 22.197 -3.327 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -4.664 22.885 -4.937 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -3.056 19.770 -3.565 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -5.837 21.447 -6.373 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.445 17.522 -4.522 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -6.236 19.197 -7.323 1.00 0.00 H new ATOM 0 HZ PHE A 70 -5.034 17.232 -6.404 1.00 0.00 H new ATOM 1136 N GLN A 71 -2.061 22.650 -6.641 1.00 0.00 N ATOM 1137 CA GLN A 71 -1.418 22.179 -7.898 1.00 0.00 C ATOM 1138 C GLN A 71 0.104 22.173 -7.732 1.00 0.00 C ATOM 1139 O GLN A 71 0.780 21.278 -8.200 1.00 0.00 O ATOM 1140 CB GLN A 71 -1.814 23.086 -9.067 1.00 0.00 C ATOM 1141 CG GLN A 71 -1.310 24.505 -8.819 1.00 0.00 C ATOM 1142 CD GLN A 71 -1.876 25.439 -9.890 1.00 0.00 C ATOM 1143 OE1 GLN A 71 -3.042 25.362 -10.223 1.00 0.00 O ATOM 1144 NE2 GLN A 71 -1.095 26.320 -10.452 1.00 0.00 N ATOM 0 H GLN A 71 -2.540 23.549 -6.701 1.00 0.00 H new ATOM 0 HA GLN A 71 -1.758 21.165 -8.111 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -1.395 22.700 -9.996 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -2.898 23.091 -9.183 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -1.614 24.843 -7.828 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -0.220 24.525 -8.842 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -0.116 26.385 -10.173 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -1.463 26.943 -11.170 1.00 0.00 H new ATOM 1153 N GLU A 72 0.658 23.164 -7.080 1.00 0.00 N ATOM 1154 CA GLU A 72 2.136 23.197 -6.908 1.00 0.00 C ATOM 1155 C GLU A 72 2.594 22.009 -6.065 1.00 0.00 C ATOM 1156 O GLU A 72 3.579 21.364 -6.365 1.00 0.00 O ATOM 1157 CB GLU A 72 2.522 24.495 -6.196 1.00 0.00 C ATOM 1158 CG GLU A 72 2.293 25.679 -7.134 1.00 0.00 C ATOM 1159 CD GLU A 72 2.585 26.986 -6.394 1.00 0.00 C ATOM 1160 OE1 GLU A 72 3.751 27.316 -6.251 1.00 0.00 O ATOM 1161 OE2 GLU A 72 1.638 27.634 -5.980 1.00 0.00 O ATOM 0 H GLU A 72 0.152 23.945 -6.663 1.00 0.00 H new ATOM 0 HA GLU A 72 2.614 23.145 -7.886 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.928 24.615 -5.290 1.00 0.00 H new ATOM 0 HB3 GLU A 72 3.567 24.457 -5.890 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.938 25.593 -8.008 1.00 0.00 H new ATOM 0 HG3 GLU A 72 1.265 25.676 -7.495 1.00 0.00 H new ATOM 1168 N PHE A 73 1.881 21.710 -5.020 1.00 0.00 N ATOM 1169 CA PHE A 73 2.269 20.565 -4.153 1.00 0.00 C ATOM 1170 C PHE A 73 2.199 19.270 -4.951 1.00 0.00 C ATOM 1171 O PHE A 73 2.983 18.367 -4.755 1.00 0.00 O ATOM 1172 CB PHE A 73 1.330 20.471 -2.944 1.00 0.00 C ATOM 1173 CG PHE A 73 1.630 19.193 -2.196 1.00 0.00 C ATOM 1174 CD1 PHE A 73 2.608 19.172 -1.196 1.00 0.00 C ATOM 1175 CD2 PHE A 73 0.938 18.022 -2.526 1.00 0.00 C ATOM 1176 CE1 PHE A 73 2.895 17.976 -0.527 1.00 0.00 C ATOM 1177 CE2 PHE A 73 1.220 16.830 -1.855 1.00 0.00 C ATOM 1178 CZ PHE A 73 2.199 16.805 -0.858 1.00 0.00 C ATOM 0 H PHE A 73 1.042 22.211 -4.726 1.00 0.00 H new ATOM 0 HA PHE A 73 3.288 20.723 -3.800 1.00 0.00 H new ATOM 0 HB2 PHE A 73 1.468 21.333 -2.291 1.00 0.00 H new ATOM 0 HB3 PHE A 73 0.290 20.482 -3.271 1.00 0.00 H new ATOM 0 HD1 PHE A 73 3.140 20.076 -0.941 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.185 18.040 -3.300 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.652 17.956 0.243 1.00 0.00 H new ATOM 0 HE2 PHE A 73 0.682 15.928 -2.106 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.420 15.882 -0.342 1.00 0.00 H new ATOM 1188 N MET A 74 1.246 19.169 -5.822 1.00 0.00 N ATOM 1189 CA MET A 74 1.083 17.927 -6.616 1.00 0.00 C ATOM 1190 C MET A 74 2.337 17.652 -7.443 1.00 0.00 C ATOM 1191 O MET A 74 2.738 16.516 -7.626 1.00 0.00 O ATOM 1192 CB MET A 74 -0.133 18.071 -7.538 1.00 0.00 C ATOM 1193 CG MET A 74 -1.423 17.910 -6.723 1.00 0.00 C ATOM 1194 SD MET A 74 -1.570 16.204 -6.129 1.00 0.00 S ATOM 1195 CE MET A 74 -1.731 15.399 -7.741 1.00 0.00 C ATOM 0 H MET A 74 0.564 19.901 -6.022 1.00 0.00 H new ATOM 0 HA MET A 74 0.929 17.088 -5.937 1.00 0.00 H new ATOM 0 HB2 MET A 74 -0.119 19.046 -8.025 1.00 0.00 H new ATOM 0 HB3 MET A 74 -0.094 17.320 -8.327 1.00 0.00 H new ATOM 0 HG2 MET A 74 -1.418 18.599 -5.878 1.00 0.00 H new ATOM 0 HG3 MET A 74 -2.286 18.166 -7.338 1.00 0.00 H new ATOM 0 HE1 MET A 74 -2.180 14.414 -7.613 1.00 0.00 H new ATOM 0 HE2 MET A 74 -2.365 16.005 -8.389 1.00 0.00 H new ATOM 0 HE3 MET A 74 -0.746 15.292 -8.194 1.00 0.00 H new ATOM 1205 N ALA A 75 2.952 18.665 -7.967 1.00 0.00 N ATOM 1206 CA ALA A 75 4.159 18.421 -8.799 1.00 0.00 C ATOM 1207 C ALA A 75 5.331 17.928 -7.945 1.00 0.00 C ATOM 1208 O ALA A 75 6.148 17.149 -8.394 1.00 0.00 O ATOM 1209 CB ALA A 75 4.551 19.708 -9.529 1.00 0.00 C ATOM 0 H ALA A 75 2.679 19.642 -7.860 1.00 0.00 H new ATOM 0 HA ALA A 75 3.921 17.645 -9.527 1.00 0.00 H new ATOM 0 HB1 ALA A 75 5.436 19.526 -10.138 1.00 0.00 H new ATOM 0 HB2 ALA A 75 3.729 20.028 -10.170 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.767 20.489 -8.800 1.00 0.00 H new ATOM 1215 N PHE A 76 5.429 18.373 -6.729 1.00 0.00 N ATOM 1216 CA PHE A 76 6.562 17.924 -5.861 1.00 0.00 C ATOM 1217 C PHE A 76 6.484 16.414 -5.650 1.00 0.00 C ATOM 1218 O PHE A 76 7.478 15.726 -5.615 1.00 0.00 O ATOM 1219 CB PHE A 76 6.482 18.650 -4.515 1.00 0.00 C ATOM 1220 CG PHE A 76 7.727 18.388 -3.698 1.00 0.00 C ATOM 1221 CD1 PHE A 76 8.897 19.114 -3.956 1.00 0.00 C ATOM 1222 CD2 PHE A 76 7.708 17.436 -2.670 1.00 0.00 C ATOM 1223 CE1 PHE A 76 10.045 18.888 -3.188 1.00 0.00 C ATOM 1224 CE2 PHE A 76 8.859 17.210 -1.905 1.00 0.00 C ATOM 1225 CZ PHE A 76 10.026 17.936 -2.164 1.00 0.00 C ATOM 0 H PHE A 76 4.779 19.027 -6.293 1.00 0.00 H new ATOM 0 HA PHE A 76 7.511 18.161 -6.343 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.366 19.721 -4.679 1.00 0.00 H new ATOM 0 HB3 PHE A 76 5.602 18.315 -3.966 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.913 19.848 -4.748 1.00 0.00 H new ATOM 0 HD2 PHE A 76 6.806 16.877 -2.468 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.946 19.449 -3.386 1.00 0.00 H new ATOM 0 HE2 PHE A 76 8.845 16.474 -1.114 1.00 0.00 H new ATOM 0 HZ PHE A 76 10.913 17.761 -1.573 1.00 0.00 H new ATOM 1235 N VAL A 77 5.304 15.913 -5.493 1.00 0.00 N ATOM 1236 CA VAL A 77 5.098 14.450 -5.266 1.00 0.00 C ATOM 1237 C VAL A 77 5.643 13.655 -6.448 1.00 0.00 C ATOM 1238 O VAL A 77 6.193 12.588 -6.294 1.00 0.00 O ATOM 1239 CB VAL A 77 3.588 14.163 -5.129 1.00 0.00 C ATOM 1240 CG1 VAL A 77 3.350 12.958 -4.216 1.00 0.00 C ATOM 1241 CG2 VAL A 77 2.894 15.392 -4.559 1.00 0.00 C ATOM 0 H VAL A 77 4.445 16.462 -5.511 1.00 0.00 H new ATOM 0 HA VAL A 77 5.622 14.155 -4.357 1.00 0.00 H new ATOM 0 HB VAL A 77 3.179 13.933 -6.113 1.00 0.00 H new ATOM 0 HG11 VAL A 77 2.279 12.771 -4.132 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.839 12.080 -4.637 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.761 13.163 -3.228 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.827 15.194 -4.460 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.312 15.624 -3.580 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.046 16.239 -5.228 1.00 0.00 H new ATOM 1251 N SER A 78 5.434 14.148 -7.630 1.00 0.00 N ATOM 1252 CA SER A 78 5.887 13.405 -8.835 1.00 0.00 C ATOM 1253 C SER A 78 7.405 13.280 -8.863 1.00 0.00 C ATOM 1254 O SER A 78 7.942 12.262 -9.251 1.00 0.00 O ATOM 1255 CB SER A 78 5.426 14.149 -10.083 1.00 0.00 C ATOM 1256 OG SER A 78 6.199 15.331 -10.241 1.00 0.00 O ATOM 0 H SER A 78 4.968 15.036 -7.817 1.00 0.00 H new ATOM 0 HA SER A 78 5.457 12.404 -8.806 1.00 0.00 H new ATOM 0 HB2 SER A 78 5.533 13.511 -10.960 1.00 0.00 H new ATOM 0 HB3 SER A 78 4.369 14.401 -10.000 1.00 0.00 H new ATOM 0 HG SER A 78 6.265 15.796 -9.381 1.00 0.00 H new ATOM 1262 N MET A 79 8.109 14.309 -8.494 1.00 0.00 N ATOM 1263 CA MET A 79 9.594 14.223 -8.552 1.00 0.00 C ATOM 1264 C MET A 79 10.137 13.352 -7.415 1.00 0.00 C ATOM 1265 O MET A 79 11.051 12.576 -7.603 1.00 0.00 O ATOM 1266 CB MET A 79 10.185 15.622 -8.447 1.00 0.00 C ATOM 1267 CG MET A 79 9.502 16.552 -9.456 1.00 0.00 C ATOM 1268 SD MET A 79 10.507 18.043 -9.693 1.00 0.00 S ATOM 1269 CE MET A 79 10.834 18.402 -7.950 1.00 0.00 C ATOM 0 H MET A 79 7.730 15.195 -8.159 1.00 0.00 H new ATOM 0 HA MET A 79 9.878 13.768 -9.501 1.00 0.00 H new ATOM 0 HB2 MET A 79 10.053 16.007 -7.436 1.00 0.00 H new ATOM 0 HB3 MET A 79 11.258 15.589 -8.638 1.00 0.00 H new ATOM 0 HG2 MET A 79 9.369 16.037 -10.407 1.00 0.00 H new ATOM 0 HG3 MET A 79 8.509 16.824 -9.099 1.00 0.00 H new ATOM 0 HE1 MET A 79 11.177 19.432 -7.849 1.00 0.00 H new ATOM 0 HE2 MET A 79 9.920 18.265 -7.373 1.00 0.00 H new ATOM 0 HE3 MET A 79 11.603 17.725 -7.577 1.00 0.00 H new ATOM 1279 N VAL A 80 9.591 13.475 -6.239 1.00 0.00 N ATOM 1280 CA VAL A 80 10.093 12.649 -5.099 1.00 0.00 C ATOM 1281 C VAL A 80 9.891 11.173 -5.429 1.00 0.00 C ATOM 1282 O VAL A 80 10.723 10.337 -5.140 1.00 0.00 O ATOM 1283 CB VAL A 80 9.336 12.990 -3.814 1.00 0.00 C ATOM 1284 CG1 VAL A 80 9.903 12.168 -2.648 1.00 0.00 C ATOM 1285 CG2 VAL A 80 9.493 14.480 -3.503 1.00 0.00 C ATOM 0 H VAL A 80 8.823 14.107 -6.015 1.00 0.00 H new ATOM 0 HA VAL A 80 11.151 12.860 -4.946 1.00 0.00 H new ATOM 0 HB VAL A 80 8.280 12.755 -3.948 1.00 0.00 H new ATOM 0 HG11 VAL A 80 9.362 12.413 -1.734 1.00 0.00 H new ATOM 0 HG12 VAL A 80 9.790 11.105 -2.863 1.00 0.00 H new ATOM 0 HG13 VAL A 80 10.960 12.402 -2.518 1.00 0.00 H new ATOM 0 HG21 VAL A 80 8.953 14.719 -2.587 1.00 0.00 H new ATOM 0 HG22 VAL A 80 10.549 14.715 -3.373 1.00 0.00 H new ATOM 0 HG23 VAL A 80 9.089 15.068 -4.327 1.00 0.00 H new ATOM 1295 N THR A 81 8.783 10.855 -6.029 1.00 0.00 N ATOM 1296 CA THR A 81 8.501 9.440 -6.386 1.00 0.00 C ATOM 1297 C THR A 81 9.593 8.964 -7.320 1.00 0.00 C ATOM 1298 O THR A 81 10.063 7.848 -7.242 1.00 0.00 O ATOM 1299 CB THR A 81 7.162 9.351 -7.114 1.00 0.00 C ATOM 1300 OG1 THR A 81 6.135 9.834 -6.272 1.00 0.00 O ATOM 1301 CG2 THR A 81 6.876 7.893 -7.503 1.00 0.00 C ATOM 0 H THR A 81 8.054 11.519 -6.290 1.00 0.00 H new ATOM 0 HA THR A 81 8.465 8.828 -5.485 1.00 0.00 H new ATOM 0 HB THR A 81 7.202 9.957 -8.019 1.00 0.00 H new ATOM 0 HG1 THR A 81 6.216 10.806 -6.182 1.00 0.00 H new ATOM 0 HG21 THR A 81 5.919 7.836 -8.022 1.00 0.00 H new ATOM 0 HG22 THR A 81 7.667 7.530 -8.159 1.00 0.00 H new ATOM 0 HG23 THR A 81 6.838 7.277 -6.604 1.00 0.00 H new ATOM 1309 N THR A 82 9.990 9.814 -8.212 1.00 0.00 N ATOM 1310 CA THR A 82 11.044 9.444 -9.175 1.00 0.00 C ATOM 1311 C THR A 82 12.253 8.926 -8.392 1.00 0.00 C ATOM 1312 O THR A 82 12.905 7.982 -8.791 1.00 0.00 O ATOM 1313 CB THR A 82 11.421 10.685 -9.991 1.00 0.00 C ATOM 1314 OG1 THR A 82 10.243 11.424 -10.283 1.00 0.00 O ATOM 1315 CG2 THR A 82 12.075 10.255 -11.298 1.00 0.00 C ATOM 0 H THR A 82 9.624 10.760 -8.315 1.00 0.00 H new ATOM 0 HA THR A 82 10.698 8.666 -9.856 1.00 0.00 H new ATOM 0 HB THR A 82 12.116 11.301 -9.420 1.00 0.00 H new ATOM 0 HG1 THR A 82 10.451 12.128 -10.933 1.00 0.00 H new ATOM 0 HG21 THR A 82 12.343 11.138 -11.878 1.00 0.00 H new ATOM 0 HG22 THR A 82 12.973 9.676 -11.082 1.00 0.00 H new ATOM 0 HG23 THR A 82 11.377 9.643 -11.870 1.00 0.00 H new ATOM 1323 N ALA A 83 12.537 9.514 -7.262 1.00 0.00 N ATOM 1324 CA ALA A 83 13.677 9.028 -6.440 1.00 0.00 C ATOM 1325 C ALA A 83 13.386 7.587 -6.014 1.00 0.00 C ATOM 1326 O ALA A 83 14.261 6.749 -5.972 1.00 0.00 O ATOM 1327 CB ALA A 83 13.838 9.914 -5.200 1.00 0.00 C ATOM 0 H ALA A 83 12.029 10.309 -6.874 1.00 0.00 H new ATOM 0 HA ALA A 83 14.600 9.068 -7.019 1.00 0.00 H new ATOM 0 HB1 ALA A 83 14.675 9.553 -4.601 1.00 0.00 H new ATOM 0 HB2 ALA A 83 14.029 10.942 -5.509 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.925 9.878 -4.606 1.00 0.00 H new ATOM 1333 N CYS A 84 12.150 7.305 -5.691 1.00 0.00 N ATOM 1334 CA CYS A 84 11.770 5.929 -5.257 1.00 0.00 C ATOM 1335 C CYS A 84 12.078 4.921 -6.368 1.00 0.00 C ATOM 1336 O CYS A 84 12.498 3.812 -6.105 1.00 0.00 O ATOM 1337 CB CYS A 84 10.271 5.881 -4.952 1.00 0.00 C ATOM 1338 SG CYS A 84 9.878 4.331 -4.104 1.00 0.00 S ATOM 0 H CYS A 84 11.382 7.976 -5.710 1.00 0.00 H new ATOM 0 HA CYS A 84 12.342 5.675 -4.365 1.00 0.00 H new ATOM 0 HB2 CYS A 84 9.988 6.730 -4.330 1.00 0.00 H new ATOM 0 HB3 CYS A 84 9.698 5.958 -5.876 1.00 0.00 H new ATOM 0 HG CYS A 84 8.605 4.290 -3.843 1.00 0.00 H new ATOM 1344 N HIS A 85 11.866 5.281 -7.608 1.00 0.00 N ATOM 1345 CA HIS A 85 12.143 4.310 -8.705 1.00 0.00 C ATOM 1346 C HIS A 85 13.619 3.929 -8.644 1.00 0.00 C ATOM 1347 O HIS A 85 13.981 2.777 -8.783 1.00 0.00 O ATOM 1348 CB HIS A 85 11.847 4.975 -10.049 1.00 0.00 C ATOM 1349 CG HIS A 85 12.104 4.006 -11.170 1.00 0.00 C ATOM 1350 ND1 HIS A 85 12.322 4.429 -12.475 1.00 0.00 N ATOM 1351 CD2 HIS A 85 12.169 2.635 -11.205 1.00 0.00 C ATOM 1352 CE1 HIS A 85 12.504 3.332 -13.232 1.00 0.00 C ATOM 1353 NE2 HIS A 85 12.420 2.216 -12.507 1.00 0.00 N ATOM 0 H HIS A 85 11.518 6.193 -7.904 1.00 0.00 H new ATOM 0 HA HIS A 85 11.519 3.423 -8.595 1.00 0.00 H new ATOM 0 HB2 HIS A 85 10.810 5.310 -10.078 1.00 0.00 H new ATOM 0 HB3 HIS A 85 12.472 5.860 -10.172 1.00 0.00 H new ATOM 0 HD1 HIS A 85 12.341 5.396 -12.800 1.00 0.00 H new ATOM 0 HD2 HIS A 85 12.044 1.983 -10.353 1.00 0.00 H new ATOM 0 HE1 HIS A 85 12.694 3.353 -14.295 1.00 0.00 H new ATOM 1362 N GLU A 86 14.470 4.882 -8.396 1.00 0.00 N ATOM 1363 CA GLU A 86 15.918 4.573 -8.277 1.00 0.00 C ATOM 1364 C GLU A 86 16.113 3.603 -7.110 1.00 0.00 C ATOM 1365 O GLU A 86 16.911 2.688 -7.169 1.00 0.00 O ATOM 1366 CB GLU A 86 16.704 5.864 -8.023 1.00 0.00 C ATOM 1367 CG GLU A 86 16.745 6.700 -9.305 1.00 0.00 C ATOM 1368 CD GLU A 86 17.469 8.021 -9.032 1.00 0.00 C ATOM 1369 OE1 GLU A 86 17.960 8.189 -7.929 1.00 0.00 O ATOM 1370 OE2 GLU A 86 17.526 8.839 -9.936 1.00 0.00 O ATOM 0 H GLU A 86 14.224 5.864 -8.270 1.00 0.00 H new ATOM 0 HA GLU A 86 16.282 4.120 -9.199 1.00 0.00 H new ATOM 0 HB2 GLU A 86 16.237 6.434 -7.220 1.00 0.00 H new ATOM 0 HB3 GLU A 86 17.717 5.627 -7.699 1.00 0.00 H new ATOM 0 HG2 GLU A 86 17.257 6.149 -10.094 1.00 0.00 H new ATOM 0 HG3 GLU A 86 15.732 6.895 -9.657 1.00 0.00 H new ATOM 1377 N PHE A 87 15.390 3.813 -6.043 1.00 0.00 N ATOM 1378 CA PHE A 87 15.520 2.928 -4.850 1.00 0.00 C ATOM 1379 C PHE A 87 14.719 1.637 -5.051 1.00 0.00 C ATOM 1380 O PHE A 87 14.999 0.626 -4.439 1.00 0.00 O ATOM 1381 CB PHE A 87 14.984 3.660 -3.617 1.00 0.00 C ATOM 1382 CG PHE A 87 15.257 2.835 -2.384 1.00 0.00 C ATOM 1383 CD1 PHE A 87 14.331 1.870 -1.967 1.00 0.00 C ATOM 1384 CD2 PHE A 87 16.438 3.031 -1.659 1.00 0.00 C ATOM 1385 CE1 PHE A 87 14.588 1.103 -0.824 1.00 0.00 C ATOM 1386 CE2 PHE A 87 16.694 2.264 -0.517 1.00 0.00 C ATOM 1387 CZ PHE A 87 15.769 1.300 -0.100 1.00 0.00 C ATOM 0 H PHE A 87 14.709 4.566 -5.946 1.00 0.00 H new ATOM 0 HA PHE A 87 16.572 2.677 -4.712 1.00 0.00 H new ATOM 0 HB2 PHE A 87 15.458 4.637 -3.526 1.00 0.00 H new ATOM 0 HB3 PHE A 87 13.913 3.834 -3.721 1.00 0.00 H new ATOM 0 HD1 PHE A 87 13.420 1.718 -2.527 1.00 0.00 H new ATOM 0 HD2 PHE A 87 17.152 3.775 -1.981 1.00 0.00 H new ATOM 0 HE1 PHE A 87 13.875 0.359 -0.501 1.00 0.00 H new ATOM 0 HE2 PHE A 87 17.605 2.416 0.043 1.00 0.00 H new ATOM 0 HZ PHE A 87 15.967 0.708 0.781 1.00 0.00 H new ATOM 1397 N PHE A 88 13.718 1.661 -5.897 1.00 0.00 N ATOM 1398 CA PHE A 88 12.895 0.431 -6.128 1.00 0.00 C ATOM 1399 C PHE A 88 13.471 -0.310 -7.333 1.00 0.00 C ATOM 1400 O PHE A 88 12.832 -1.135 -7.954 1.00 0.00 O ATOM 1401 CB PHE A 88 11.416 0.827 -6.377 1.00 0.00 C ATOM 1402 CG PHE A 88 10.480 -0.127 -5.658 1.00 0.00 C ATOM 1403 CD1 PHE A 88 10.758 -1.501 -5.636 1.00 0.00 C ATOM 1404 CD2 PHE A 88 9.338 0.366 -5.014 1.00 0.00 C ATOM 1405 CE1 PHE A 88 9.894 -2.379 -4.971 1.00 0.00 C ATOM 1406 CE2 PHE A 88 8.475 -0.513 -4.350 1.00 0.00 C ATOM 1407 CZ PHE A 88 8.752 -1.885 -4.328 1.00 0.00 C ATOM 0 H PHE A 88 13.435 2.478 -6.438 1.00 0.00 H new ATOM 0 HA PHE A 88 12.925 -0.219 -5.254 1.00 0.00 H new ATOM 0 HB2 PHE A 88 11.243 1.846 -6.030 1.00 0.00 H new ATOM 0 HB3 PHE A 88 11.206 0.815 -7.446 1.00 0.00 H new ATOM 0 HD1 PHE A 88 11.639 -1.882 -6.132 1.00 0.00 H new ATOM 0 HD2 PHE A 88 9.124 1.424 -5.030 1.00 0.00 H new ATOM 0 HE1 PHE A 88 10.108 -3.437 -4.954 1.00 0.00 H new ATOM 0 HE2 PHE A 88 7.594 -0.132 -3.854 1.00 0.00 H new ATOM 0 HZ PHE A 88 8.085 -2.562 -3.815 1.00 0.00 H new ATOM 1417 N GLU A 89 14.689 -0.013 -7.649 1.00 0.00 N ATOM 1418 CA GLU A 89 15.367 -0.677 -8.792 1.00 0.00 C ATOM 1419 C GLU A 89 16.113 -1.892 -8.241 1.00 0.00 C ATOM 1420 O GLU A 89 15.515 -2.810 -7.716 1.00 0.00 O ATOM 1421 CB GLU A 89 16.354 0.318 -9.412 1.00 0.00 C ATOM 1422 CG GLU A 89 16.906 -0.231 -10.732 1.00 0.00 C ATOM 1423 CD GLU A 89 17.812 0.818 -11.379 1.00 0.00 C ATOM 1424 OE1 GLU A 89 17.810 1.945 -10.910 1.00 0.00 O ATOM 1425 OE2 GLU A 89 18.485 0.479 -12.339 1.00 0.00 O ATOM 0 H GLU A 89 15.259 0.675 -7.157 1.00 0.00 H new ATOM 0 HA GLU A 89 14.656 -0.994 -9.555 1.00 0.00 H new ATOM 0 HB2 GLU A 89 15.857 1.272 -9.587 1.00 0.00 H new ATOM 0 HB3 GLU A 89 17.173 0.508 -8.718 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.465 -1.149 -10.551 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.086 -0.484 -11.404 1.00 0.00 H new ATOM 1432 N HIS A 90 17.411 -1.892 -8.314 1.00 0.00 N ATOM 1433 CA HIS A 90 18.180 -3.031 -7.746 1.00 0.00 C ATOM 1434 C HIS A 90 18.101 -2.933 -6.227 1.00 0.00 C ATOM 1435 O HIS A 90 17.936 -3.915 -5.533 1.00 0.00 O ATOM 1436 CB HIS A 90 19.640 -2.960 -8.202 1.00 0.00 C ATOM 1437 CG HIS A 90 19.725 -3.297 -9.665 1.00 0.00 C ATOM 1438 ND1 HIS A 90 19.742 -4.609 -10.114 1.00 0.00 N ATOM 1439 CD2 HIS A 90 19.799 -2.512 -10.790 1.00 0.00 C ATOM 1440 CE1 HIS A 90 19.825 -4.577 -11.457 1.00 0.00 C ATOM 1441 NE2 HIS A 90 19.862 -3.325 -11.917 1.00 0.00 N ATOM 0 H HIS A 90 17.973 -1.155 -8.741 1.00 0.00 H new ATOM 0 HA HIS A 90 17.764 -3.979 -8.088 1.00 0.00 H new ATOM 0 HB2 HIS A 90 20.040 -1.962 -8.024 1.00 0.00 H new ATOM 0 HB3 HIS A 90 20.248 -3.655 -7.622 1.00 0.00 H new ATOM 0 HD2 HIS A 90 19.807 -1.432 -10.798 1.00 0.00 H new ATOM 0 HE1 HIS A 90 19.858 -5.455 -12.084 1.00 0.00 H new ATOM 0 HE2 HIS A 90 19.924 -3.027 -12.890 1.00 0.00 H new ATOM 1450 N GLU A 91 18.196 -1.730 -5.722 1.00 0.00 N ATOM 1451 CA GLU A 91 18.112 -1.498 -4.253 1.00 0.00 C ATOM 1452 CB GLU A 91 19.250 -2.229 -3.523 1.00 0.00 C ATOM 1453 CG GLU A 91 19.164 -1.947 -2.019 1.00 0.00 C ATOM 1454 CD GLU A 91 20.219 -2.771 -1.279 1.00 0.00 C ATOM 1455 OE1 GLU A 91 20.831 -3.618 -1.910 1.00 0.00 O ATOM 1456 OE2 GLU A 91 20.398 -2.542 -0.094 1.00 0.00 O ATOM 0 H GLU A 91 18.331 -0.885 -6.278 1.00 0.00 H new ATOM 0 HB2 GLU A 91 19.183 -3.301 -3.706 1.00 0.00 H new ATOM 0 HB3 GLU A 91 20.214 -1.899 -3.910 1.00 0.00 H new ATOM 0 HG2 GLU A 91 19.319 -0.885 -1.829 1.00 0.00 H new ATOM 0 HG3 GLU A 91 18.169 -2.195 -1.649 1.00 0.00 H new TER 1463 GLU A 91 ATOM 1464 N MET B 0 -5.071 8.343 4.665 1.00 0.00 N ATOM 1465 CA MET B 0 -4.191 9.007 5.668 1.00 0.00 C ATOM 1466 C MET B 0 -2.739 8.574 5.439 1.00 0.00 C ATOM 1467 O MET B 0 -2.370 7.450 5.714 1.00 0.00 O ATOM 1468 CB MET B 0 -4.620 8.599 7.080 1.00 0.00 C ATOM 1469 CG MET B 0 -5.982 9.215 7.411 1.00 0.00 C ATOM 1470 SD MET B 0 -6.432 8.782 9.111 1.00 0.00 S ATOM 1471 CE MET B 0 -8.038 9.614 9.151 1.00 0.00 C ATOM 0 H1 MET B 0 -6.013 8.784 4.684 1.00 0.00 H new ATOM 0 H2 MET B 0 -4.658 8.449 3.716 1.00 0.00 H new ATOM 0 H3 MET B 0 -5.157 7.332 4.894 1.00 0.00 H new ATOM 0 HA MET B 0 -4.275 10.088 5.559 1.00 0.00 H new ATOM 0 HB2 MET B 0 -4.675 7.513 7.153 1.00 0.00 H new ATOM 0 HB3 MET B 0 -3.876 8.929 7.805 1.00 0.00 H new ATOM 0 HG2 MET B 0 -5.942 10.298 7.297 1.00 0.00 H new ATOM 0 HG3 MET B 0 -6.739 8.849 6.717 1.00 0.00 H new ATOM 0 HE1 MET B 0 -8.498 9.471 10.129 1.00 0.00 H new ATOM 0 HE2 MET B 0 -7.900 10.680 8.967 1.00 0.00 H new ATOM 0 HE3 MET B 0 -8.685 9.194 8.381 1.00 0.00 H new ATOM 1483 N SER B 1 -1.913 9.457 4.943 1.00 0.00 N ATOM 1484 CA SER B 1 -0.480 9.096 4.703 1.00 0.00 C ATOM 1485 C SER B 1 -0.385 7.927 3.716 1.00 0.00 C ATOM 1486 O SER B 1 0.623 7.255 3.628 1.00 0.00 O ATOM 1487 CB SER B 1 0.176 8.695 6.030 1.00 0.00 C ATOM 1488 OG SER B 1 1.590 8.789 5.907 1.00 0.00 O ATOM 0 H SER B 1 -2.166 10.413 4.693 1.00 0.00 H new ATOM 0 HA SER B 1 0.035 9.959 4.282 1.00 0.00 H new ATOM 0 HB2 SER B 1 -0.174 9.345 6.832 1.00 0.00 H new ATOM 0 HB3 SER B 1 -0.110 7.677 6.296 1.00 0.00 H new ATOM 0 HG SER B 1 1.883 8.292 5.115 1.00 0.00 H new ATOM 1494 N GLU B 2 -1.420 7.692 2.970 1.00 0.00 N ATOM 1495 CA GLU B 2 -1.400 6.582 1.976 1.00 0.00 C ATOM 1496 C GLU B 2 -0.586 7.014 0.766 1.00 0.00 C ATOM 1497 O GLU B 2 -0.475 6.310 -0.218 1.00 0.00 O ATOM 1498 CB GLU B 2 -2.831 6.267 1.565 1.00 0.00 C ATOM 1499 CG GLU B 2 -3.525 5.625 2.756 1.00 0.00 C ATOM 1500 CD GLU B 2 -4.975 5.292 2.401 1.00 0.00 C ATOM 1501 OE1 GLU B 2 -5.422 5.728 1.354 1.00 0.00 O ATOM 1502 OE2 GLU B 2 -5.615 4.612 3.186 1.00 0.00 O ATOM 0 H GLU B 2 -2.290 8.224 3.003 1.00 0.00 H new ATOM 0 HA GLU B 2 -0.946 5.690 2.408 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -3.351 7.176 1.264 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -2.843 5.594 0.707 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -2.997 4.718 3.049 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -3.497 6.301 3.611 1.00 0.00 H new ATOM 1509 N LEU B 3 -0.033 8.183 0.838 1.00 0.00 N ATOM 1510 CA LEU B 3 0.766 8.713 -0.289 1.00 0.00 C ATOM 1511 C LEU B 3 1.929 7.771 -0.591 1.00 0.00 C ATOM 1512 O LEU B 3 2.424 7.739 -1.690 1.00 0.00 O ATOM 1513 CB LEU B 3 1.253 10.115 0.098 1.00 0.00 C ATOM 1514 CG LEU B 3 2.461 10.557 -0.755 1.00 0.00 C ATOM 1515 CD1 LEU B 3 2.569 12.095 -0.726 1.00 0.00 C ATOM 1516 CD2 LEU B 3 3.775 9.919 -0.223 1.00 0.00 C ATOM 0 H LEU B 3 -0.102 8.805 1.644 1.00 0.00 H new ATOM 0 HA LEU B 3 0.166 8.781 -1.197 1.00 0.00 H new ATOM 0 HB2 LEU B 3 0.439 10.830 -0.026 1.00 0.00 H new ATOM 0 HB3 LEU B 3 1.529 10.126 1.152 1.00 0.00 H new ATOM 0 HG LEU B 3 2.312 10.220 -1.781 1.00 0.00 H new ATOM 0 HD11 LEU B 3 3.421 12.411 -1.327 1.00 0.00 H new ATOM 0 HD12 LEU B 3 1.656 12.532 -1.132 1.00 0.00 H new ATOM 0 HD13 LEU B 3 2.706 12.431 0.302 1.00 0.00 H new ATOM 0 HD21 LEU B 3 4.613 10.244 -0.839 1.00 0.00 H new ATOM 0 HD22 LEU B 3 3.940 10.232 0.808 1.00 0.00 H new ATOM 0 HD23 LEU B 3 3.695 8.833 -0.264 1.00 0.00 H new ATOM 1528 N GLU B 4 2.369 6.995 0.358 1.00 0.00 N ATOM 1529 CA GLU B 4 3.499 6.057 0.066 1.00 0.00 C ATOM 1530 C GLU B 4 3.037 5.024 -0.959 1.00 0.00 C ATOM 1531 O GLU B 4 3.761 4.659 -1.864 1.00 0.00 O ATOM 1532 CB GLU B 4 3.952 5.365 1.355 1.00 0.00 C ATOM 1533 CG GLU B 4 5.111 4.414 1.046 1.00 0.00 C ATOM 1534 CD GLU B 4 5.729 3.921 2.356 1.00 0.00 C ATOM 1535 OE1 GLU B 4 5.328 4.412 3.399 1.00 0.00 O ATOM 1536 OE2 GLU B 4 6.596 3.064 2.294 1.00 0.00 O ATOM 0 H GLU B 4 2.005 6.965 1.311 1.00 0.00 H new ATOM 0 HA GLU B 4 4.344 6.614 -0.339 1.00 0.00 H new ATOM 0 HB2 GLU B 4 4.264 6.108 2.089 1.00 0.00 H new ATOM 0 HB3 GLU B 4 3.122 4.812 1.794 1.00 0.00 H new ATOM 0 HG2 GLU B 4 4.755 3.568 0.459 1.00 0.00 H new ATOM 0 HG3 GLU B 4 5.864 4.924 0.446 1.00 0.00 H new ATOM 1543 N LYS B 5 1.832 4.562 -0.825 1.00 0.00 N ATOM 1544 CA LYS B 5 1.297 3.560 -1.786 1.00 0.00 C ATOM 1545 C LYS B 5 1.102 4.221 -3.147 1.00 0.00 C ATOM 1546 O LYS B 5 1.290 3.608 -4.171 1.00 0.00 O ATOM 1547 CB LYS B 5 -0.043 3.044 -1.271 1.00 0.00 C ATOM 1548 CG LYS B 5 0.197 2.184 -0.031 1.00 0.00 C ATOM 1549 CD LYS B 5 -1.140 1.656 0.501 1.00 0.00 C ATOM 1550 CE LYS B 5 -1.975 2.807 1.080 1.00 0.00 C ATOM 1551 NZ LYS B 5 -2.980 2.251 2.030 1.00 0.00 N ATOM 0 H LYS B 5 1.186 4.836 -0.085 1.00 0.00 H new ATOM 0 HA LYS B 5 1.996 2.729 -1.885 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -0.700 3.879 -1.028 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -0.543 2.459 -2.043 1.00 0.00 H new ATOM 0 HG2 LYS B 5 0.856 1.351 -0.277 1.00 0.00 H new ATOM 0 HG3 LYS B 5 0.699 2.771 0.738 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -1.691 1.166 -0.302 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -0.962 0.904 1.270 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -1.329 3.520 1.591 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -2.476 3.349 0.278 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -3.804 2.884 2.073 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -3.282 1.311 1.705 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -2.556 2.170 2.976 1.00 0.00 H new ATOM 1565 N ALA B 6 0.702 5.461 -3.162 1.00 0.00 N ATOM 1566 CA ALA B 6 0.473 6.159 -4.458 1.00 0.00 C ATOM 1567 C ALA B 6 1.790 6.343 -5.216 1.00 0.00 C ATOM 1568 O ALA B 6 1.841 6.205 -6.419 1.00 0.00 O ATOM 1569 CB ALA B 6 -0.169 7.527 -4.189 1.00 0.00 C ATOM 0 H ALA B 6 0.523 6.023 -2.330 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.193 5.553 -5.072 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -0.338 8.042 -5.135 1.00 0.00 H new ATOM 0 HB2 ALA B 6 -1.121 7.388 -3.676 1.00 0.00 H new ATOM 0 HB3 ALA B 6 0.496 8.124 -3.565 1.00 0.00 H new ATOM 1575 N MET B 7 2.846 6.666 -4.532 1.00 0.00 N ATOM 1576 CA MET B 7 4.147 6.872 -5.225 1.00 0.00 C ATOM 1577 C MET B 7 4.605 5.557 -5.842 1.00 0.00 C ATOM 1578 O MET B 7 5.126 5.508 -6.942 1.00 0.00 O ATOM 1579 CB MET B 7 5.194 7.333 -4.210 1.00 0.00 C ATOM 1580 CG MET B 7 4.870 8.745 -3.724 1.00 0.00 C ATOM 1581 SD MET B 7 6.228 9.333 -2.677 1.00 0.00 S ATOM 1582 CE MET B 7 5.883 11.104 -2.804 1.00 0.00 C ATOM 0 H MET B 7 2.867 6.797 -3.521 1.00 0.00 H new ATOM 0 HA MET B 7 4.027 7.625 -6.004 1.00 0.00 H new ATOM 0 HB2 MET B 7 5.219 6.646 -3.364 1.00 0.00 H new ATOM 0 HB3 MET B 7 6.185 7.315 -4.664 1.00 0.00 H new ATOM 0 HG2 MET B 7 4.733 9.414 -4.574 1.00 0.00 H new ATOM 0 HG3 MET B 7 3.935 8.745 -3.164 1.00 0.00 H new ATOM 0 HE1 MET B 7 6.473 11.644 -2.063 1.00 0.00 H new ATOM 0 HE2 MET B 7 6.145 11.455 -3.802 1.00 0.00 H new ATOM 0 HE3 MET B 7 4.823 11.282 -2.624 1.00 0.00 H new ATOM 1592 N VAL B 8 4.409 4.491 -5.133 1.00 0.00 N ATOM 1593 CA VAL B 8 4.825 3.161 -5.653 1.00 0.00 C ATOM 1594 C VAL B 8 3.974 2.812 -6.872 1.00 0.00 C ATOM 1595 O VAL B 8 4.438 2.218 -7.819 1.00 0.00 O ATOM 1596 CB VAL B 8 4.638 2.096 -4.565 1.00 0.00 C ATOM 1597 CG1 VAL B 8 4.828 0.700 -5.169 1.00 0.00 C ATOM 1598 CG2 VAL B 8 5.668 2.314 -3.452 1.00 0.00 C ATOM 0 H VAL B 8 3.976 4.479 -4.209 1.00 0.00 H new ATOM 0 HA VAL B 8 5.876 3.192 -5.939 1.00 0.00 H new ATOM 0 HB VAL B 8 3.632 2.177 -4.152 1.00 0.00 H new ATOM 0 HG11 VAL B 8 4.694 -0.054 -4.393 1.00 0.00 H new ATOM 0 HG12 VAL B 8 4.093 0.542 -5.958 1.00 0.00 H new ATOM 0 HG13 VAL B 8 5.832 0.617 -5.586 1.00 0.00 H new ATOM 0 HG21 VAL B 8 5.534 1.557 -2.679 1.00 0.00 H new ATOM 0 HG22 VAL B 8 6.673 2.236 -3.866 1.00 0.00 H new ATOM 0 HG23 VAL B 8 5.530 3.304 -3.017 1.00 0.00 H new ATOM 1608 N ALA B 9 2.721 3.155 -6.825 1.00 0.00 N ATOM 1609 CA ALA B 9 1.792 2.833 -7.947 1.00 0.00 C ATOM 1610 C ALA B 9 2.195 3.556 -9.229 1.00 0.00 C ATOM 1611 O ALA B 9 2.111 3.004 -10.299 1.00 0.00 O ATOM 1612 CB ALA B 9 0.378 3.250 -7.571 1.00 0.00 C ATOM 0 H ALA B 9 2.291 3.653 -6.046 1.00 0.00 H new ATOM 0 HA ALA B 9 1.839 1.759 -8.124 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -0.301 3.015 -8.391 1.00 0.00 H new ATOM 0 HB2 ALA B 9 0.066 2.712 -6.676 1.00 0.00 H new ATOM 0 HB3 ALA B 9 0.354 4.322 -7.377 1.00 0.00 H new ATOM 1618 N LEU B 10 2.613 4.786 -9.151 1.00 0.00 N ATOM 1619 CA LEU B 10 2.991 5.500 -10.406 1.00 0.00 C ATOM 1620 C LEU B 10 4.126 4.730 -11.071 1.00 0.00 C ATOM 1621 O LEU B 10 4.173 4.587 -12.274 1.00 0.00 O ATOM 1622 CB LEU B 10 3.449 6.940 -10.087 1.00 0.00 C ATOM 1623 CG LEU B 10 2.277 7.921 -10.219 1.00 0.00 C ATOM 1624 CD1 LEU B 10 1.275 7.674 -9.095 1.00 0.00 C ATOM 1625 CD2 LEU B 10 2.812 9.354 -10.127 1.00 0.00 C ATOM 0 H LEU B 10 2.710 5.323 -8.289 1.00 0.00 H new ATOM 0 HA LEU B 10 2.131 5.556 -11.073 1.00 0.00 H new ATOM 0 HB2 LEU B 10 3.854 6.983 -9.076 1.00 0.00 H new ATOM 0 HB3 LEU B 10 4.252 7.231 -10.765 1.00 0.00 H new ATOM 0 HG LEU B 10 1.781 7.776 -11.179 1.00 0.00 H new ATOM 0 HD11 LEU B 10 0.443 8.371 -9.190 1.00 0.00 H new ATOM 0 HD12 LEU B 10 0.901 6.652 -9.159 1.00 0.00 H new ATOM 0 HD13 LEU B 10 1.764 7.822 -8.132 1.00 0.00 H new ATOM 0 HD21 LEU B 10 1.985 10.058 -10.220 1.00 0.00 H new ATOM 0 HD22 LEU B 10 3.304 9.498 -9.165 1.00 0.00 H new ATOM 0 HD23 LEU B 10 3.528 9.527 -10.930 1.00 0.00 H new ATOM 1637 N ILE B 11 5.041 4.243 -10.296 1.00 0.00 N ATOM 1638 CA ILE B 11 6.177 3.484 -10.874 1.00 0.00 C ATOM 1639 C ILE B 11 5.684 2.151 -11.471 1.00 0.00 C ATOM 1640 O ILE B 11 6.163 1.715 -12.498 1.00 0.00 O ATOM 1641 CB ILE B 11 7.224 3.242 -9.782 1.00 0.00 C ATOM 1642 CG1 ILE B 11 7.889 4.582 -9.436 1.00 0.00 C ATOM 1643 CG2 ILE B 11 8.287 2.267 -10.291 1.00 0.00 C ATOM 1644 CD1 ILE B 11 8.717 4.456 -8.149 1.00 0.00 C ATOM 0 H ILE B 11 5.054 4.337 -9.280 1.00 0.00 H new ATOM 0 HA ILE B 11 6.631 4.060 -11.680 1.00 0.00 H new ATOM 0 HB ILE B 11 6.745 2.819 -8.899 1.00 0.00 H new ATOM 0 HG12 ILE B 11 8.530 4.899 -10.258 1.00 0.00 H new ATOM 0 HG13 ILE B 11 7.127 5.351 -9.311 1.00 0.00 H new ATOM 0 HG21 ILE B 11 9.029 2.098 -9.511 1.00 0.00 H new ATOM 0 HG22 ILE B 11 7.816 1.320 -10.555 1.00 0.00 H new ATOM 0 HG23 ILE B 11 8.774 2.687 -11.171 1.00 0.00 H new ATOM 0 HD11 ILE B 11 9.181 5.415 -7.919 1.00 0.00 H new ATOM 0 HD12 ILE B 11 8.067 4.161 -7.325 1.00 0.00 H new ATOM 0 HD13 ILE B 11 9.492 3.702 -8.287 1.00 0.00 H new ATOM 1656 N ASP B 12 4.757 1.483 -10.828 1.00 0.00 N ATOM 1657 CA ASP B 12 4.277 0.165 -11.361 1.00 0.00 C ATOM 1658 C ASP B 12 3.533 0.323 -12.701 1.00 0.00 C ATOM 1659 O ASP B 12 3.689 -0.476 -13.602 1.00 0.00 O ATOM 1660 CB ASP B 12 3.330 -0.464 -10.335 1.00 0.00 C ATOM 1661 CG ASP B 12 4.126 -0.906 -9.105 1.00 0.00 C ATOM 1662 OD1 ASP B 12 5.309 -1.164 -9.250 1.00 0.00 O ATOM 1663 OD2 ASP B 12 3.537 -0.980 -8.039 1.00 0.00 O ATOM 0 H ASP B 12 4.313 1.789 -9.962 1.00 0.00 H new ATOM 0 HA ASP B 12 5.146 -0.469 -11.534 1.00 0.00 H new ATOM 0 HB2 ASP B 12 2.563 0.254 -10.045 1.00 0.00 H new ATOM 0 HB3 ASP B 12 2.817 -1.319 -10.775 1.00 0.00 H new ATOM 1668 N VAL B 13 2.724 1.335 -12.835 1.00 0.00 N ATOM 1669 CA VAL B 13 1.959 1.542 -14.106 1.00 0.00 C ATOM 1670 C VAL B 13 2.920 1.994 -15.218 1.00 0.00 C ATOM 1671 O VAL B 13 2.807 1.602 -16.369 1.00 0.00 O ATOM 1672 CB VAL B 13 0.834 2.594 -13.839 1.00 0.00 C ATOM 1673 CG1 VAL B 13 1.017 3.861 -14.693 1.00 0.00 C ATOM 1674 CG2 VAL B 13 -0.548 1.987 -14.145 1.00 0.00 C ATOM 0 H VAL B 13 2.555 2.037 -12.114 1.00 0.00 H new ATOM 0 HA VAL B 13 1.493 0.614 -14.438 1.00 0.00 H new ATOM 0 HB VAL B 13 0.901 2.871 -12.787 1.00 0.00 H new ATOM 0 HG11 VAL B 13 0.214 4.565 -14.476 1.00 0.00 H new ATOM 0 HG12 VAL B 13 1.977 4.322 -14.459 1.00 0.00 H new ATOM 0 HG13 VAL B 13 0.990 3.595 -15.750 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -1.322 2.730 -13.955 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -0.588 1.681 -15.190 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -0.714 1.119 -13.507 1.00 0.00 H new ATOM 1684 N PHE B 14 3.849 2.835 -14.880 1.00 0.00 N ATOM 1685 CA PHE B 14 4.801 3.338 -15.900 1.00 0.00 C ATOM 1686 C PHE B 14 5.561 2.168 -16.497 1.00 0.00 C ATOM 1687 O PHE B 14 5.808 2.126 -17.677 1.00 0.00 O ATOM 1688 CB PHE B 14 5.788 4.314 -15.257 1.00 0.00 C ATOM 1689 CG PHE B 14 6.761 4.793 -16.308 1.00 0.00 C ATOM 1690 CD1 PHE B 14 6.475 5.936 -17.061 1.00 0.00 C ATOM 1691 CD2 PHE B 14 7.950 4.088 -16.532 1.00 0.00 C ATOM 1692 CE1 PHE B 14 7.375 6.375 -18.038 1.00 0.00 C ATOM 1693 CE2 PHE B 14 8.852 4.527 -17.508 1.00 0.00 C ATOM 1694 CZ PHE B 14 8.565 5.671 -18.261 1.00 0.00 C ATOM 0 H PHE B 14 3.991 3.198 -13.937 1.00 0.00 H new ATOM 0 HA PHE B 14 4.248 3.856 -16.684 1.00 0.00 H new ATOM 0 HB2 PHE B 14 5.254 5.160 -14.825 1.00 0.00 H new ATOM 0 HB3 PHE B 14 6.324 3.826 -14.443 1.00 0.00 H new ATOM 0 HD1 PHE B 14 5.558 6.480 -16.888 1.00 0.00 H new ATOM 0 HD2 PHE B 14 8.171 3.205 -15.951 1.00 0.00 H new ATOM 0 HE1 PHE B 14 7.152 7.257 -18.620 1.00 0.00 H new ATOM 0 HE2 PHE B 14 9.769 3.983 -17.680 1.00 0.00 H new ATOM 0 HZ PHE B 14 9.261 6.011 -19.014 1.00 0.00 H new ATOM 1704 N HIS B 15 5.936 1.221 -15.696 1.00 0.00 N ATOM 1705 CA HIS B 15 6.680 0.057 -16.238 1.00 0.00 C ATOM 1706 C HIS B 15 5.751 -0.795 -17.103 1.00 0.00 C ATOM 1707 O HIS B 15 6.199 -1.554 -17.938 1.00 0.00 O ATOM 1708 CB HIS B 15 7.236 -0.789 -15.091 1.00 0.00 C ATOM 1709 CG HIS B 15 8.432 -0.104 -14.488 1.00 0.00 C ATOM 1710 ND1 HIS B 15 8.610 0.007 -13.116 1.00 0.00 N ATOM 1711 CD2 HIS B 15 9.525 0.503 -15.059 1.00 0.00 C ATOM 1712 CE1 HIS B 15 9.770 0.658 -12.909 1.00 0.00 C ATOM 1713 NE2 HIS B 15 10.364 0.980 -14.060 1.00 0.00 N ATOM 0 H HIS B 15 5.761 1.200 -14.691 1.00 0.00 H new ATOM 0 HA HIS B 15 7.508 0.419 -16.848 1.00 0.00 H new ATOM 0 HB2 HIS B 15 6.469 -0.938 -14.331 1.00 0.00 H new ATOM 0 HB3 HIS B 15 7.517 -1.776 -15.458 1.00 0.00 H new ATOM 0 HD2 HIS B 15 9.704 0.595 -16.120 1.00 0.00 H new ATOM 0 HE1 HIS B 15 10.170 0.891 -11.933 1.00 0.00 H new ATOM 0 HE2 HIS B 15 11.249 1.473 -14.181 1.00 0.00 H new ATOM 1722 N GLN B 16 4.464 -0.701 -16.908 1.00 0.00 N ATOM 1723 CA GLN B 16 3.548 -1.534 -17.727 1.00 0.00 C ATOM 1724 C GLN B 16 3.731 -1.201 -19.213 1.00 0.00 C ATOM 1725 O GLN B 16 3.792 -2.086 -20.044 1.00 0.00 O ATOM 1726 CB GLN B 16 2.101 -1.252 -17.304 1.00 0.00 C ATOM 1727 CG GLN B 16 1.125 -2.096 -18.129 1.00 0.00 C ATOM 1728 CD GLN B 16 1.417 -3.583 -17.920 1.00 0.00 C ATOM 1729 OE1 GLN B 16 1.456 -4.056 -16.802 1.00 0.00 O ATOM 1730 NE2 GLN B 16 1.630 -4.344 -18.958 1.00 0.00 N ATOM 0 H GLN B 16 4.014 -0.091 -16.225 1.00 0.00 H new ATOM 0 HA GLN B 16 3.775 -2.589 -17.572 1.00 0.00 H new ATOM 0 HB2 GLN B 16 1.976 -1.474 -16.244 1.00 0.00 H new ATOM 0 HB3 GLN B 16 1.877 -0.194 -17.437 1.00 0.00 H new ATOM 0 HG2 GLN B 16 0.099 -1.873 -17.835 1.00 0.00 H new ATOM 0 HG3 GLN B 16 1.216 -1.844 -19.186 1.00 0.00 H new ATOM 0 HE21 GLN B 16 1.597 -3.947 -19.897 1.00 0.00 H new ATOM 0 HE22 GLN B 16 1.829 -5.336 -18.831 1.00 0.00 H new ATOM 1739 N TYR B 17 3.806 0.059 -19.567 1.00 0.00 N ATOM 1740 CA TYR B 17 3.968 0.416 -21.024 1.00 0.00 C ATOM 1741 C TYR B 17 5.441 0.588 -21.417 1.00 0.00 C ATOM 1742 O TYR B 17 5.843 0.234 -22.508 1.00 0.00 O ATOM 1743 CB TYR B 17 3.217 1.716 -21.301 1.00 0.00 C ATOM 1744 CG TYR B 17 1.742 1.429 -21.246 1.00 0.00 C ATOM 1745 CD1 TYR B 17 1.108 1.316 -20.009 1.00 0.00 C ATOM 1746 CD2 TYR B 17 1.019 1.239 -22.427 1.00 0.00 C ATOM 1747 CE1 TYR B 17 -0.252 1.019 -19.946 1.00 0.00 C ATOM 1748 CE2 TYR B 17 -0.344 0.935 -22.369 1.00 0.00 C ATOM 1749 CZ TYR B 17 -0.984 0.824 -21.127 1.00 0.00 C ATOM 1750 OH TYR B 17 -2.328 0.516 -21.069 1.00 0.00 O ATOM 0 H TYR B 17 3.763 0.851 -18.925 1.00 0.00 H new ATOM 0 HA TYR B 17 3.562 -0.402 -21.618 1.00 0.00 H new ATOM 0 HB2 TYR B 17 3.484 2.474 -20.564 1.00 0.00 H new ATOM 0 HB3 TYR B 17 3.491 2.112 -22.279 1.00 0.00 H new ATOM 0 HD1 TYR B 17 1.672 1.459 -19.099 1.00 0.00 H new ATOM 0 HD2 TYR B 17 1.513 1.327 -23.383 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -0.743 0.939 -18.987 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -0.904 0.786 -23.281 1.00 0.00 H new ATOM 0 HH TYR B 17 -2.524 0.066 -20.221 1.00 0.00 H new ATOM 1760 N SER B 18 6.243 1.143 -20.560 1.00 0.00 N ATOM 1761 CA SER B 18 7.678 1.359 -20.908 1.00 0.00 C ATOM 1762 C SER B 18 8.350 0.020 -21.212 1.00 0.00 C ATOM 1763 O SER B 18 9.154 -0.090 -22.117 1.00 0.00 O ATOM 1764 CB SER B 18 8.390 2.027 -19.731 1.00 0.00 C ATOM 1765 OG SER B 18 9.695 2.425 -20.133 1.00 0.00 O ATOM 0 H SER B 18 5.971 1.459 -19.629 1.00 0.00 H new ATOM 0 HA SER B 18 7.740 1.998 -21.789 1.00 0.00 H new ATOM 0 HB2 SER B 18 7.822 2.893 -19.392 1.00 0.00 H new ATOM 0 HB3 SER B 18 8.451 1.337 -18.890 1.00 0.00 H new ATOM 0 HG SER B 18 10.319 2.303 -19.387 1.00 0.00 H new ATOM 1771 N GLY B 19 8.034 -0.994 -20.462 1.00 0.00 N ATOM 1772 CA GLY B 19 8.659 -2.325 -20.704 1.00 0.00 C ATOM 1773 C GLY B 19 7.996 -3.002 -21.906 1.00 0.00 C ATOM 1774 O GLY B 19 8.498 -3.974 -22.434 1.00 0.00 O ATOM 0 H GLY B 19 7.369 -0.961 -19.690 1.00 0.00 H new ATOM 0 HA2 GLY B 19 9.727 -2.207 -20.886 1.00 0.00 H new ATOM 0 HA3 GLY B 19 8.554 -2.952 -19.819 1.00 0.00 H new ATOM 1778 N ARG B 20 6.880 -2.494 -22.352 1.00 0.00 N ATOM 1779 CA ARG B 20 6.210 -3.115 -23.528 1.00 0.00 C ATOM 1780 C ARG B 20 7.164 -3.059 -24.717 1.00 0.00 C ATOM 1781 O ARG B 20 7.334 -4.020 -25.441 1.00 0.00 O ATOM 1782 CB ARG B 20 4.948 -2.330 -23.871 1.00 0.00 C ATOM 1783 CG ARG B 20 4.223 -3.017 -25.028 1.00 0.00 C ATOM 1784 CD ARG B 20 2.966 -2.227 -25.366 1.00 0.00 C ATOM 1785 NE ARG B 20 2.206 -2.935 -26.432 1.00 0.00 N ATOM 1786 CZ ARG B 20 0.958 -2.631 -26.653 1.00 0.00 C ATOM 1787 NH1 ARG B 20 0.378 -1.698 -25.947 1.00 0.00 N ATOM 1788 NH2 ARG B 20 0.288 -3.261 -27.580 1.00 0.00 N ATOM 0 H ARG B 20 6.406 -1.682 -21.956 1.00 0.00 H new ATOM 0 HA ARG B 20 5.946 -4.147 -23.299 1.00 0.00 H new ATOM 0 HB2 ARG B 20 4.294 -2.272 -23.001 1.00 0.00 H new ATOM 0 HB3 ARG B 20 5.206 -1.307 -24.145 1.00 0.00 H new ATOM 0 HG2 ARG B 20 4.876 -3.076 -25.899 1.00 0.00 H new ATOM 0 HG3 ARG B 20 3.963 -4.040 -24.755 1.00 0.00 H new ATOM 0 HD2 ARG B 20 2.346 -2.113 -24.477 1.00 0.00 H new ATOM 0 HD3 ARG B 20 3.233 -1.224 -25.700 1.00 0.00 H new ATOM 0 HE ARG B 20 2.662 -3.658 -26.989 1.00 0.00 H new ATOM 0 HH11 ARG B 20 0.902 -1.207 -25.222 1.00 0.00 H new ATOM 0 HH12 ARG B 20 -0.599 -1.460 -26.120 1.00 0.00 H new ATOM 0 HH21 ARG B 20 0.741 -3.990 -28.130 1.00 0.00 H new ATOM 0 HH22 ARG B 20 -0.689 -3.024 -27.754 1.00 0.00 H new ATOM 1802 N GLU B 21 7.786 -1.925 -24.916 1.00 0.00 N ATOM 1803 CA GLU B 21 8.743 -1.756 -26.055 1.00 0.00 C ATOM 1804 C GLU B 21 10.155 -1.557 -25.498 1.00 0.00 C ATOM 1805 O GLU B 21 10.341 -1.231 -24.343 1.00 0.00 O ATOM 1806 CB GLU B 21 8.353 -0.523 -26.878 1.00 0.00 C ATOM 1807 CG GLU B 21 6.996 -0.756 -27.545 1.00 0.00 C ATOM 1808 CD GLU B 21 6.613 0.477 -28.365 1.00 0.00 C ATOM 1809 OE1 GLU B 21 7.315 1.470 -28.268 1.00 0.00 O ATOM 1810 OE2 GLU B 21 5.620 0.411 -29.072 1.00 0.00 O ATOM 0 H GLU B 21 7.671 -1.098 -24.331 1.00 0.00 H new ATOM 0 HA GLU B 21 8.712 -2.642 -26.689 1.00 0.00 H new ATOM 0 HB2 GLU B 21 8.307 0.356 -26.235 1.00 0.00 H new ATOM 0 HB3 GLU B 21 9.112 -0.324 -27.635 1.00 0.00 H new ATOM 0 HG2 GLU B 21 7.041 -1.634 -28.189 1.00 0.00 H new ATOM 0 HG3 GLU B 21 6.236 -0.954 -26.789 1.00 0.00 H new ATOM 1817 N GLY B 22 11.149 -1.769 -26.312 1.00 0.00 N ATOM 1818 CA GLY B 22 12.554 -1.615 -25.845 1.00 0.00 C ATOM 1819 C GLY B 22 12.749 -0.274 -25.125 1.00 0.00 C ATOM 1820 O GLY B 22 13.738 -0.071 -24.451 1.00 0.00 O ATOM 0 H GLY B 22 11.048 -2.045 -27.289 1.00 0.00 H new ATOM 0 HA2 GLY B 22 12.809 -2.434 -25.172 1.00 0.00 H new ATOM 0 HA3 GLY B 22 13.233 -1.678 -26.695 1.00 0.00 H new ATOM 1824 N ASP B 23 11.834 0.651 -25.262 1.00 0.00 N ATOM 1825 CA ASP B 23 12.010 1.965 -24.584 1.00 0.00 C ATOM 1826 C ASP B 23 11.745 1.807 -23.079 1.00 0.00 C ATOM 1827 O ASP B 23 10.822 2.380 -22.536 1.00 0.00 O ATOM 1828 CB ASP B 23 11.014 2.949 -25.187 1.00 0.00 C ATOM 1829 CG ASP B 23 11.410 3.254 -26.633 1.00 0.00 C ATOM 1830 OD1 ASP B 23 12.591 3.183 -26.931 1.00 0.00 O ATOM 1831 OD2 ASP B 23 10.526 3.556 -27.417 1.00 0.00 O ATOM 0 H ASP B 23 10.980 0.553 -25.810 1.00 0.00 H new ATOM 0 HA ASP B 23 13.027 2.331 -24.723 1.00 0.00 H new ATOM 0 HB2 ASP B 23 10.008 2.530 -25.155 1.00 0.00 H new ATOM 0 HB3 ASP B 23 10.995 3.869 -24.602 1.00 0.00 H new ATOM 1836 N LYS B 24 12.547 1.019 -22.409 1.00 0.00 N ATOM 1837 CA LYS B 24 12.350 0.796 -20.943 1.00 0.00 C ATOM 1838 C LYS B 24 12.697 2.059 -20.139 1.00 0.00 C ATOM 1839 O LYS B 24 12.040 2.385 -19.170 1.00 0.00 O ATOM 1840 CB LYS B 24 13.282 -0.332 -20.494 1.00 0.00 C ATOM 1841 CG LYS B 24 12.809 -1.665 -21.087 1.00 0.00 C ATOM 1842 CD LYS B 24 13.951 -2.685 -21.046 1.00 0.00 C ATOM 1843 CE LYS B 24 14.390 -2.909 -19.598 1.00 0.00 C ATOM 1844 NZ LYS B 24 13.189 -3.114 -18.739 1.00 0.00 N ATOM 0 H LYS B 24 13.336 0.517 -22.817 1.00 0.00 H new ATOM 0 HA LYS B 24 11.305 0.543 -20.766 1.00 0.00 H new ATOM 0 HB2 LYS B 24 14.302 -0.122 -20.815 1.00 0.00 H new ATOM 0 HB3 LYS B 24 13.296 -0.392 -19.406 1.00 0.00 H new ATOM 0 HG2 LYS B 24 11.954 -2.040 -20.525 1.00 0.00 H new ATOM 0 HG3 LYS B 24 12.476 -1.519 -22.115 1.00 0.00 H new ATOM 0 HD2 LYS B 24 13.626 -3.627 -21.488 1.00 0.00 H new ATOM 0 HD3 LYS B 24 14.792 -2.328 -21.640 1.00 0.00 H new ATOM 0 HE2 LYS B 24 15.047 -3.777 -19.536 1.00 0.00 H new ATOM 0 HE3 LYS B 24 14.961 -2.051 -19.243 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 13.454 -3.664 -17.897 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 12.811 -2.191 -18.444 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 12.463 -3.630 -19.275 1.00 0.00 H new ATOM 1858 N HIS B 25 13.744 2.756 -20.509 1.00 0.00 N ATOM 1859 CA HIS B 25 14.151 3.976 -19.736 1.00 0.00 C ATOM 1860 C HIS B 25 13.520 5.235 -20.337 1.00 0.00 C ATOM 1861 O HIS B 25 13.730 6.330 -19.855 1.00 0.00 O ATOM 1862 CB HIS B 25 15.676 4.113 -19.775 1.00 0.00 C ATOM 1863 CG HIS B 25 16.303 3.007 -18.970 1.00 0.00 C ATOM 1864 ND1 HIS B 25 16.571 1.757 -19.512 1.00 0.00 N ATOM 1865 CD2 HIS B 25 16.720 2.946 -17.662 1.00 0.00 C ATOM 1866 CE1 HIS B 25 17.123 1.004 -18.541 1.00 0.00 C ATOM 1867 NE2 HIS B 25 17.235 1.682 -17.398 1.00 0.00 N ATOM 0 H HIS B 25 14.334 2.535 -21.311 1.00 0.00 H new ATOM 0 HA HIS B 25 13.807 3.867 -18.708 1.00 0.00 H new ATOM 0 HB2 HIS B 25 16.029 4.071 -20.806 1.00 0.00 H new ATOM 0 HB3 HIS B 25 15.975 5.082 -19.375 1.00 0.00 H new ATOM 0 HD2 HIS B 25 16.657 3.755 -16.949 1.00 0.00 H new ATOM 0 HE1 HIS B 25 17.436 -0.021 -18.672 1.00 0.00 H new ATOM 0 HE2 HIS B 25 17.618 1.344 -16.515 1.00 0.00 H new ATOM 1876 N LYS B 26 12.754 5.098 -21.383 1.00 0.00 N ATOM 1877 CA LYS B 26 12.122 6.298 -22.008 1.00 0.00 C ATOM 1878 C LYS B 26 10.764 5.910 -22.579 1.00 0.00 C ATOM 1879 O LYS B 26 10.406 4.751 -22.616 1.00 0.00 O ATOM 1880 CB LYS B 26 13.030 6.847 -23.114 1.00 0.00 C ATOM 1881 CG LYS B 26 13.230 5.792 -24.205 1.00 0.00 C ATOM 1882 CD LYS B 26 14.438 6.173 -25.066 1.00 0.00 C ATOM 1883 CE LYS B 26 14.568 5.196 -26.236 1.00 0.00 C ATOM 1884 NZ LYS B 26 15.901 5.369 -26.879 1.00 0.00 N ATOM 0 H LYS B 26 12.537 4.209 -21.833 1.00 0.00 H new ATOM 0 HA LYS B 26 11.984 7.075 -21.256 1.00 0.00 H new ATOM 0 HB2 LYS B 26 12.589 7.746 -23.544 1.00 0.00 H new ATOM 0 HB3 LYS B 26 13.994 7.134 -22.694 1.00 0.00 H new ATOM 0 HG2 LYS B 26 13.385 4.812 -23.754 1.00 0.00 H new ATOM 0 HG3 LYS B 26 12.336 5.720 -24.825 1.00 0.00 H new ATOM 0 HD2 LYS B 26 14.323 7.190 -25.440 1.00 0.00 H new ATOM 0 HD3 LYS B 26 15.346 6.156 -24.463 1.00 0.00 H new ATOM 0 HE2 LYS B 26 14.452 4.171 -25.883 1.00 0.00 H new ATOM 0 HE3 LYS B 26 13.775 5.374 -26.963 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 15.991 4.706 -27.675 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 15.994 6.344 -27.229 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 16.650 5.178 -26.183 1.00 0.00 H new ATOM 1898 N LEU B 27 9.987 6.876 -22.987 1.00 0.00 N ATOM 1899 CA LEU B 27 8.628 6.583 -23.532 1.00 0.00 C ATOM 1900 C LEU B 27 8.425 7.396 -24.817 1.00 0.00 C ATOM 1901 O LEU B 27 8.658 8.584 -24.839 1.00 0.00 O ATOM 1902 CB LEU B 27 7.599 7.003 -22.478 1.00 0.00 C ATOM 1903 CG LEU B 27 6.222 6.398 -22.797 1.00 0.00 C ATOM 1904 CD1 LEU B 27 6.198 4.890 -22.467 1.00 0.00 C ATOM 1905 CD2 LEU B 27 5.162 7.119 -21.961 1.00 0.00 C ATOM 0 H LEU B 27 10.237 7.865 -22.966 1.00 0.00 H new ATOM 0 HA LEU B 27 8.516 5.523 -23.760 1.00 0.00 H new ATOM 0 HB2 LEU B 27 7.927 6.676 -21.491 1.00 0.00 H new ATOM 0 HB3 LEU B 27 7.526 8.090 -22.445 1.00 0.00 H new ATOM 0 HG LEU B 27 6.016 6.521 -23.860 1.00 0.00 H new ATOM 0 HD11 LEU B 27 5.214 4.482 -22.700 1.00 0.00 H new ATOM 0 HD12 LEU B 27 6.954 4.376 -23.060 1.00 0.00 H new ATOM 0 HD13 LEU B 27 6.408 4.746 -21.407 1.00 0.00 H new ATOM 0 HD21 LEU B 27 4.180 6.699 -22.178 1.00 0.00 H new ATOM 0 HD22 LEU B 27 5.385 6.991 -20.902 1.00 0.00 H new ATOM 0 HD23 LEU B 27 5.165 8.181 -22.207 1.00 0.00 H new ATOM 1917 N LYS B 28 8.011 6.774 -25.896 1.00 0.00 N ATOM 1918 CA LYS B 28 7.817 7.531 -27.172 1.00 0.00 C ATOM 1919 C LYS B 28 6.344 7.933 -27.318 1.00 0.00 C ATOM 1920 O LYS B 28 5.455 7.227 -26.884 1.00 0.00 O ATOM 1921 CB LYS B 28 8.239 6.625 -28.337 1.00 0.00 C ATOM 1922 CG LYS B 28 8.061 7.349 -29.673 1.00 0.00 C ATOM 1923 CD LYS B 28 8.496 6.425 -30.811 1.00 0.00 C ATOM 1924 CE LYS B 28 8.408 7.176 -32.142 1.00 0.00 C ATOM 1925 NZ LYS B 28 9.310 8.363 -32.105 1.00 0.00 N ATOM 0 H LYS B 28 7.800 5.777 -25.947 1.00 0.00 H new ATOM 0 HA LYS B 28 8.421 8.438 -27.171 1.00 0.00 H new ATOM 0 HB2 LYS B 28 9.280 6.327 -28.214 1.00 0.00 H new ATOM 0 HB3 LYS B 28 7.643 5.712 -28.329 1.00 0.00 H new ATOM 0 HG2 LYS B 28 7.019 7.642 -29.805 1.00 0.00 H new ATOM 0 HG3 LYS B 28 8.653 8.264 -29.686 1.00 0.00 H new ATOM 0 HD2 LYS B 28 9.516 6.080 -30.643 1.00 0.00 H new ATOM 0 HD3 LYS B 28 7.860 5.540 -30.838 1.00 0.00 H new ATOM 0 HE2 LYS B 28 8.691 6.517 -32.963 1.00 0.00 H new ATOM 0 HE3 LYS B 28 7.381 7.492 -32.326 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 9.847 8.419 -32.994 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 8.743 9.227 -31.989 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 9.970 8.272 -31.307 1.00 0.00 H new ATOM 1939 N LYS B 29 6.084 9.073 -27.922 1.00 0.00 N ATOM 1940 CA LYS B 29 4.677 9.545 -28.102 1.00 0.00 C ATOM 1941 C LYS B 29 3.794 8.369 -28.512 1.00 0.00 C ATOM 1942 O LYS B 29 2.594 8.377 -28.325 1.00 0.00 O ATOM 1943 CB LYS B 29 4.630 10.610 -29.214 1.00 0.00 C ATOM 1944 CG LYS B 29 4.849 9.973 -30.594 1.00 0.00 C ATOM 1945 CD LYS B 29 5.043 11.071 -31.639 1.00 0.00 C ATOM 1946 CE LYS B 29 5.003 10.449 -33.036 1.00 0.00 C ATOM 1947 NZ LYS B 29 5.206 11.510 -34.060 1.00 0.00 N ATOM 0 H LYS B 29 6.796 9.699 -28.300 1.00 0.00 H new ATOM 0 HA LYS B 29 4.319 9.970 -27.164 1.00 0.00 H new ATOM 0 HB2 LYS B 29 3.667 11.120 -29.194 1.00 0.00 H new ATOM 0 HB3 LYS B 29 5.395 11.365 -29.032 1.00 0.00 H new ATOM 0 HG2 LYS B 29 5.722 9.321 -30.570 1.00 0.00 H new ATOM 0 HG3 LYS B 29 3.994 9.351 -30.859 1.00 0.00 H new ATOM 0 HD2 LYS B 29 4.262 11.825 -31.541 1.00 0.00 H new ATOM 0 HD3 LYS B 29 5.996 11.577 -31.480 1.00 0.00 H new ATOM 0 HE2 LYS B 29 5.777 9.687 -33.128 1.00 0.00 H new ATOM 0 HE3 LYS B 29 4.046 9.952 -33.197 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 5.179 11.086 -35.009 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 4.452 12.222 -33.977 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 6.129 11.965 -33.910 1.00 0.00 H new ATOM 1961 N SER B 30 4.390 7.369 -29.088 1.00 0.00 N ATOM 1962 CA SER B 30 3.592 6.188 -29.535 1.00 0.00 C ATOM 1963 C SER B 30 3.196 5.360 -28.320 1.00 0.00 C ATOM 1964 O SER B 30 2.047 5.020 -28.132 1.00 0.00 O ATOM 1965 CB SER B 30 4.425 5.329 -30.485 1.00 0.00 C ATOM 1966 OG SER B 30 4.594 6.017 -31.718 1.00 0.00 O ATOM 0 H SER B 30 5.392 7.313 -29.271 1.00 0.00 H new ATOM 0 HA SER B 30 2.697 6.532 -30.054 1.00 0.00 H new ATOM 0 HB2 SER B 30 5.396 5.113 -30.040 1.00 0.00 H new ATOM 0 HB3 SER B 30 3.932 4.372 -30.655 1.00 0.00 H new ATOM 0 HG SER B 30 5.130 5.468 -32.328 1.00 0.00 H new ATOM 1972 N GLU B 31 4.144 5.047 -27.490 1.00 0.00 N ATOM 1973 CA GLU B 31 3.838 4.254 -26.275 1.00 0.00 C ATOM 1974 C GLU B 31 2.947 5.096 -25.367 1.00 0.00 C ATOM 1975 O GLU B 31 2.075 4.594 -24.691 1.00 0.00 O ATOM 1976 CB GLU B 31 5.141 3.920 -25.558 1.00 0.00 C ATOM 1977 CG GLU B 31 5.931 2.914 -26.396 1.00 0.00 C ATOM 1978 CD GLU B 31 7.339 2.770 -25.825 1.00 0.00 C ATOM 1979 OE1 GLU B 31 7.491 2.076 -24.834 1.00 0.00 O ATOM 1980 OE2 GLU B 31 8.243 3.362 -26.390 1.00 0.00 O ATOM 0 H GLU B 31 5.124 5.308 -27.602 1.00 0.00 H new ATOM 0 HA GLU B 31 3.328 3.327 -26.538 1.00 0.00 H new ATOM 0 HB2 GLU B 31 5.729 4.825 -25.405 1.00 0.00 H new ATOM 0 HB3 GLU B 31 4.932 3.505 -24.572 1.00 0.00 H new ATOM 0 HG2 GLU B 31 5.426 1.948 -26.395 1.00 0.00 H new ATOM 0 HG3 GLU B 31 5.980 3.247 -27.433 1.00 0.00 H new ATOM 1987 N LEU B 32 3.168 6.382 -25.355 1.00 0.00 N ATOM 1988 CA LEU B 32 2.347 7.285 -24.505 1.00 0.00 C ATOM 1989 C LEU B 32 0.882 7.176 -24.914 1.00 0.00 C ATOM 1990 O LEU B 32 0.012 7.126 -24.084 1.00 0.00 O ATOM 1991 CB LEU B 32 2.834 8.727 -24.688 1.00 0.00 C ATOM 1992 CG LEU B 32 1.943 9.708 -23.911 1.00 0.00 C ATOM 1993 CD1 LEU B 32 1.918 9.339 -22.421 1.00 0.00 C ATOM 1994 CD2 LEU B 32 2.505 11.127 -24.080 1.00 0.00 C ATOM 0 H LEU B 32 3.890 6.849 -25.904 1.00 0.00 H new ATOM 0 HA LEU B 32 2.446 6.999 -23.458 1.00 0.00 H new ATOM 0 HB2 LEU B 32 3.864 8.814 -24.343 1.00 0.00 H new ATOM 0 HB3 LEU B 32 2.829 8.985 -25.747 1.00 0.00 H new ATOM 0 HG LEU B 32 0.926 9.659 -24.299 1.00 0.00 H new ATOM 0 HD11 LEU B 32 1.283 10.042 -21.883 1.00 0.00 H new ATOM 0 HD12 LEU B 32 1.523 8.330 -22.303 1.00 0.00 H new ATOM 0 HD13 LEU B 32 2.930 9.382 -22.018 1.00 0.00 H new ATOM 0 HD21 LEU B 32 1.881 11.833 -23.533 1.00 0.00 H new ATOM 0 HD22 LEU B 32 3.522 11.164 -23.690 1.00 0.00 H new ATOM 0 HD23 LEU B 32 2.512 11.392 -25.137 1.00 0.00 H new ATOM 2006 N LYS B 33 0.605 7.149 -26.186 1.00 0.00 N ATOM 2007 CA LYS B 33 -0.821 7.045 -26.639 1.00 0.00 C ATOM 2008 C LYS B 33 -1.460 5.761 -26.119 1.00 0.00 C ATOM 2009 O LYS B 33 -2.610 5.752 -25.733 1.00 0.00 O ATOM 2010 CB LYS B 33 -0.864 7.043 -28.170 1.00 0.00 C ATOM 2011 CG LYS B 33 -2.314 6.936 -28.663 1.00 0.00 C ATOM 2012 CD LYS B 33 -2.325 6.938 -30.189 1.00 0.00 C ATOM 2013 CE LYS B 33 -3.767 6.885 -30.694 1.00 0.00 C ATOM 2014 NZ LYS B 33 -3.772 6.980 -32.181 1.00 0.00 N ATOM 0 H LYS B 33 1.297 7.194 -26.934 1.00 0.00 H new ATOM 0 HA LYS B 33 -1.376 7.897 -26.246 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -0.409 7.956 -28.554 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -0.279 6.208 -28.556 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -2.773 6.022 -28.285 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -2.903 7.770 -28.282 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -1.831 7.834 -30.565 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -1.765 6.083 -30.567 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -4.242 5.957 -30.376 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -4.345 7.703 -30.264 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -4.520 6.368 -32.565 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -3.950 7.964 -32.465 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -2.850 6.674 -32.552 1.00 0.00 H new ATOM 2028 N GLU B 34 -0.748 4.676 -26.120 1.00 0.00 N ATOM 2029 CA GLU B 34 -1.357 3.409 -25.643 1.00 0.00 C ATOM 2030 C GLU B 34 -1.566 3.492 -24.139 1.00 0.00 C ATOM 2031 O GLU B 34 -2.471 2.915 -23.591 1.00 0.00 O ATOM 2032 CB GLU B 34 -0.437 2.235 -25.981 1.00 0.00 C ATOM 2033 CG GLU B 34 -0.378 2.055 -27.499 1.00 0.00 C ATOM 2034 CD GLU B 34 0.543 0.881 -27.838 1.00 0.00 C ATOM 2035 OE1 GLU B 34 1.215 0.403 -26.940 1.00 0.00 O ATOM 2036 OE2 GLU B 34 0.559 0.481 -28.991 1.00 0.00 O ATOM 0 H GLU B 34 0.222 4.610 -26.428 1.00 0.00 H new ATOM 0 HA GLU B 34 -2.318 3.255 -26.134 1.00 0.00 H new ATOM 0 HB2 GLU B 34 0.563 2.417 -25.586 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -0.805 1.323 -25.510 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -1.378 1.873 -27.893 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -0.011 2.967 -27.970 1.00 0.00 H new ATOM 2043 N LEU B 35 -0.730 4.210 -23.471 1.00 0.00 N ATOM 2044 CA LEU B 35 -0.874 4.347 -22.004 1.00 0.00 C ATOM 2045 C LEU B 35 -2.110 5.188 -21.690 1.00 0.00 C ATOM 2046 O LEU B 35 -2.859 4.903 -20.785 1.00 0.00 O ATOM 2047 CB LEU B 35 0.386 5.040 -21.469 1.00 0.00 C ATOM 2048 CG LEU B 35 0.303 5.226 -19.942 1.00 0.00 C ATOM 2049 CD1 LEU B 35 1.714 5.499 -19.399 1.00 0.00 C ATOM 2050 CD2 LEU B 35 -0.643 6.404 -19.571 1.00 0.00 C ATOM 0 H LEU B 35 0.057 4.715 -23.878 1.00 0.00 H new ATOM 0 HA LEU B 35 -0.991 3.370 -21.535 1.00 0.00 H new ATOM 0 HB2 LEU B 35 1.266 4.448 -21.720 1.00 0.00 H new ATOM 0 HB3 LEU B 35 0.506 6.010 -21.952 1.00 0.00 H new ATOM 0 HG LEU B 35 -0.103 4.318 -19.497 1.00 0.00 H new ATOM 0 HD11 LEU B 35 1.668 5.633 -18.318 1.00 0.00 H new ATOM 0 HD12 LEU B 35 2.364 4.656 -19.633 1.00 0.00 H new ATOM 0 HD13 LEU B 35 2.113 6.403 -19.860 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -0.682 6.512 -18.487 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -0.267 7.326 -20.014 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -1.644 6.201 -19.952 1.00 0.00 H new ATOM 2062 N ILE B 36 -2.306 6.241 -22.422 1.00 0.00 N ATOM 2063 CA ILE B 36 -3.454 7.139 -22.155 1.00 0.00 C ATOM 2064 C ILE B 36 -4.783 6.530 -22.601 1.00 0.00 C ATOM 2065 O ILE B 36 -5.745 6.562 -21.864 1.00 0.00 O ATOM 2066 CB ILE B 36 -3.232 8.460 -22.891 1.00 0.00 C ATOM 2067 CG1 ILE B 36 -1.938 9.107 -22.390 1.00 0.00 C ATOM 2068 CG2 ILE B 36 -4.404 9.405 -22.613 1.00 0.00 C ATOM 2069 CD1 ILE B 36 -1.578 10.291 -23.288 1.00 0.00 C ATOM 0 H ILE B 36 -1.713 6.521 -23.203 1.00 0.00 H new ATOM 0 HA ILE B 36 -3.511 7.297 -21.078 1.00 0.00 H new ATOM 0 HB ILE B 36 -3.161 8.270 -23.962 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -2.062 9.442 -21.360 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -1.129 8.376 -22.392 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -4.245 10.347 -23.138 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -5.330 8.948 -22.961 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -4.473 9.594 -21.542 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -0.657 10.751 -22.931 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -1.437 9.942 -24.311 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -2.384 11.025 -23.263 1.00 0.00 H new ATOM 2081 N ASN B 37 -4.888 6.016 -23.805 1.00 0.00 N ATOM 2082 CA ASN B 37 -6.228 5.479 -24.232 1.00 0.00 C ATOM 2083 C ASN B 37 -6.463 4.032 -23.776 1.00 0.00 C ATOM 2084 O ASN B 37 -7.594 3.607 -23.655 1.00 0.00 O ATOM 2085 CB ASN B 37 -6.379 5.574 -25.749 1.00 0.00 C ATOM 2086 CG ASN B 37 -5.164 4.975 -26.438 1.00 0.00 C ATOM 2087 OD1 ASN B 37 -4.407 4.245 -25.840 1.00 0.00 O ATOM 2088 ND2 ASN B 37 -4.947 5.272 -27.686 1.00 0.00 N ATOM 0 H ASN B 37 -4.136 5.944 -24.491 1.00 0.00 H new ATOM 0 HA ASN B 37 -6.982 6.097 -23.745 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -7.281 5.049 -26.065 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -6.497 6.616 -26.045 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -4.134 4.889 -28.168 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -5.590 5.888 -28.183 1.00 0.00 H new ATOM 2095 N ASN B 38 -5.434 3.260 -23.539 1.00 0.00 N ATOM 2096 CA ASN B 38 -5.656 1.834 -23.112 1.00 0.00 C ATOM 2097 C ASN B 38 -5.623 1.706 -21.586 1.00 0.00 C ATOM 2098 O ASN B 38 -6.351 0.917 -21.019 1.00 0.00 O ATOM 2099 CB ASN B 38 -4.576 0.931 -23.716 1.00 0.00 C ATOM 2100 CG ASN B 38 -4.339 1.340 -25.168 1.00 0.00 C ATOM 2101 OD1 ASN B 38 -5.261 2.017 -25.792 1.00 0.00 O flip ATOM 2102 ND2 ASN B 38 -3.309 1.044 -25.737 1.00 0.00 N flip ATOM 0 H ASN B 38 -4.458 3.545 -23.620 1.00 0.00 H new ATOM 0 HA ASN B 38 -6.638 1.526 -23.470 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -3.651 1.017 -23.145 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -4.886 -0.113 -23.665 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -2.589 0.514 -25.246 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -3.163 1.325 -26.707 1.00 0.00 H new ATOM 2109 N GLU B 39 -4.792 2.457 -20.905 1.00 0.00 N ATOM 2110 CA GLU B 39 -4.749 2.334 -19.415 1.00 0.00 C ATOM 2111 C GLU B 39 -5.774 3.290 -18.798 1.00 0.00 C ATOM 2112 O GLU B 39 -6.162 3.137 -17.657 1.00 0.00 O ATOM 2113 CB GLU B 39 -3.340 2.676 -18.891 1.00 0.00 C ATOM 2114 CG GLU B 39 -3.158 2.092 -17.488 1.00 0.00 C ATOM 2115 CD GLU B 39 -2.866 0.591 -17.584 1.00 0.00 C ATOM 2116 OE1 GLU B 39 -3.141 0.017 -18.624 1.00 0.00 O ATOM 2117 OE2 GLU B 39 -2.360 0.043 -16.619 1.00 0.00 O ATOM 0 H GLU B 39 -4.151 3.140 -21.309 1.00 0.00 H new ATOM 0 HA GLU B 39 -4.988 1.308 -19.135 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -2.583 2.274 -19.564 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -3.203 3.757 -18.867 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -2.340 2.599 -16.977 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -4.057 2.260 -16.895 1.00 0.00 H new ATOM 2124 N LEU B 40 -6.231 4.262 -19.553 1.00 0.00 N ATOM 2125 CA LEU B 40 -7.253 5.232 -19.028 1.00 0.00 C ATOM 2126 C LEU B 40 -8.409 5.294 -20.033 1.00 0.00 C ATOM 2127 O LEU B 40 -8.961 6.344 -20.299 1.00 0.00 O ATOM 2128 CB LEU B 40 -6.638 6.644 -18.866 1.00 0.00 C ATOM 2129 CG LEU B 40 -5.176 6.570 -18.385 1.00 0.00 C ATOM 2130 CD1 LEU B 40 -4.539 7.961 -18.476 1.00 0.00 C ATOM 2131 CD2 LEU B 40 -5.117 6.099 -16.927 1.00 0.00 C ATOM 0 H LEU B 40 -5.940 4.428 -20.516 1.00 0.00 H new ATOM 0 HA LEU B 40 -7.603 4.899 -18.051 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -6.683 7.173 -19.818 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -7.228 7.220 -18.153 1.00 0.00 H new ATOM 0 HG LEU B 40 -4.637 5.863 -19.016 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -3.505 7.910 -18.136 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -4.565 8.306 -19.510 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -5.094 8.657 -17.847 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -4.078 6.052 -16.602 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -5.663 6.800 -16.296 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -5.568 5.110 -16.846 1.00 0.00 H new ATOM 2143 N SER B 41 -8.755 4.179 -20.614 1.00 0.00 N ATOM 2144 CA SER B 41 -9.846 4.171 -21.630 1.00 0.00 C ATOM 2145 C SER B 41 -11.162 4.664 -21.019 1.00 0.00 C ATOM 2146 O SER B 41 -11.823 5.523 -21.571 1.00 0.00 O ATOM 2147 CB SER B 41 -10.039 2.741 -22.136 1.00 0.00 C ATOM 2148 OG SER B 41 -10.867 2.756 -23.291 1.00 0.00 O ATOM 0 H SER B 41 -8.329 3.271 -20.429 1.00 0.00 H new ATOM 0 HA SER B 41 -9.569 4.835 -22.449 1.00 0.00 H new ATOM 0 HB2 SER B 41 -9.074 2.294 -22.373 1.00 0.00 H new ATOM 0 HB3 SER B 41 -10.492 2.126 -21.358 1.00 0.00 H new ATOM 0 HG SER B 41 -10.990 1.840 -23.617 1.00 0.00 H new ATOM 2154 N HIS B 42 -11.559 4.125 -19.896 1.00 0.00 N ATOM 2155 CA HIS B 42 -12.846 4.558 -19.261 1.00 0.00 C ATOM 2156 C HIS B 42 -12.581 5.560 -18.135 1.00 0.00 C ATOM 2157 O HIS B 42 -13.389 6.426 -17.865 1.00 0.00 O ATOM 2158 CB HIS B 42 -13.559 3.334 -18.681 1.00 0.00 C ATOM 2159 CG HIS B 42 -14.068 2.460 -19.797 1.00 0.00 C ATOM 2160 ND1 HIS B 42 -15.266 2.716 -20.453 1.00 0.00 N ATOM 2161 CD2 HIS B 42 -13.561 1.322 -20.375 1.00 0.00 C ATOM 2162 CE1 HIS B 42 -15.437 1.752 -21.378 1.00 0.00 C ATOM 2163 NE2 HIS B 42 -14.427 0.881 -21.369 1.00 0.00 N ATOM 0 H HIS B 42 -11.049 3.402 -19.388 1.00 0.00 H new ATOM 0 HA HIS B 42 -13.467 5.034 -20.020 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -12.874 2.769 -18.049 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -14.388 3.651 -18.049 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -12.633 0.844 -20.100 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -16.285 1.692 -22.043 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -14.314 0.062 -21.967 1.00 0.00 H new ATOM 2172 N PHE B 43 -11.474 5.437 -17.458 1.00 0.00 N ATOM 2173 CA PHE B 43 -11.184 6.372 -16.333 1.00 0.00 C ATOM 2174 C PHE B 43 -10.961 7.800 -16.855 1.00 0.00 C ATOM 2175 O PHE B 43 -11.309 8.762 -16.201 1.00 0.00 O ATOM 2176 CB PHE B 43 -9.943 5.881 -15.566 1.00 0.00 C ATOM 2177 CG PHE B 43 -9.426 6.942 -14.604 1.00 0.00 C ATOM 2178 CD1 PHE B 43 -10.310 7.801 -13.921 1.00 0.00 C ATOM 2179 CD2 PHE B 43 -8.044 7.068 -14.399 1.00 0.00 C ATOM 2180 CE1 PHE B 43 -9.809 8.770 -13.043 1.00 0.00 C ATOM 2181 CE2 PHE B 43 -7.553 8.041 -13.523 1.00 0.00 C ATOM 2182 CZ PHE B 43 -8.433 8.890 -12.845 1.00 0.00 C ATOM 0 H PHE B 43 -10.758 4.732 -17.633 1.00 0.00 H new ATOM 0 HA PHE B 43 -12.040 6.391 -15.659 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -10.191 4.976 -15.012 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -9.158 5.616 -16.274 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -11.375 7.712 -14.075 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -7.359 6.413 -14.918 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -10.489 9.425 -12.518 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -6.488 8.137 -13.369 1.00 0.00 H new ATOM 0 HZ PHE B 43 -8.048 9.638 -12.168 1.00 0.00 H new ATOM 2192 N LEU B 44 -10.374 7.949 -18.019 1.00 0.00 N ATOM 2193 CA LEU B 44 -10.115 9.320 -18.573 1.00 0.00 C ATOM 2194 C LEU B 44 -10.517 9.347 -20.045 1.00 0.00 C ATOM 2195 O LEU B 44 -10.621 8.321 -20.687 1.00 0.00 O ATOM 2196 CB LEU B 44 -8.616 9.643 -18.440 1.00 0.00 C ATOM 2197 CG LEU B 44 -8.378 11.168 -18.550 1.00 0.00 C ATOM 2198 CD1 LEU B 44 -8.528 11.828 -17.174 1.00 0.00 C ATOM 2199 CD2 LEU B 44 -6.961 11.440 -19.076 1.00 0.00 C ATOM 0 H LEU B 44 -10.062 7.180 -18.612 1.00 0.00 H new ATOM 0 HA LEU B 44 -10.696 10.061 -18.023 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -8.243 9.279 -17.483 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -8.056 9.125 -19.218 1.00 0.00 H new ATOM 0 HG LEU B 44 -9.115 11.583 -19.237 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -8.358 12.901 -17.265 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -9.534 11.651 -16.793 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -7.799 11.402 -16.485 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -6.801 12.516 -19.151 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -6.230 11.011 -18.391 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -6.845 10.987 -20.060 1.00 0.00 H new ATOM 2211 N GLU B 45 -10.745 10.509 -20.587 1.00 0.00 N ATOM 2212 CA GLU B 45 -11.137 10.584 -22.016 1.00 0.00 C ATOM 2213 C GLU B 45 -10.025 9.959 -22.860 1.00 0.00 C ATOM 2214 O GLU B 45 -8.937 10.490 -22.971 1.00 0.00 O ATOM 2215 CB GLU B 45 -11.329 12.055 -22.409 1.00 0.00 C ATOM 2216 CG GLU B 45 -11.784 12.157 -23.869 1.00 0.00 C ATOM 2217 CD GLU B 45 -13.144 11.477 -24.035 1.00 0.00 C ATOM 2218 OE1 GLU B 45 -13.843 11.349 -23.043 1.00 0.00 O ATOM 2219 OE2 GLU B 45 -13.462 11.091 -25.148 1.00 0.00 O ATOM 0 H GLU B 45 -10.677 11.405 -20.104 1.00 0.00 H new ATOM 0 HA GLU B 45 -12.070 10.046 -22.183 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -12.068 12.520 -21.757 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -10.395 12.601 -22.272 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -11.851 13.203 -24.167 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -11.049 11.686 -24.522 1.00 0.00 H new ATOM 2226 N GLU B 46 -10.296 8.830 -23.453 1.00 0.00 N ATOM 2227 CA GLU B 46 -9.266 8.149 -24.289 1.00 0.00 C ATOM 2228 C GLU B 46 -8.929 9.030 -25.501 1.00 0.00 C ATOM 2229 O GLU B 46 -9.728 9.839 -25.928 1.00 0.00 O ATOM 2230 CB GLU B 46 -9.819 6.778 -24.742 1.00 0.00 C ATOM 2231 CG GLU B 46 -10.653 6.918 -26.020 1.00 0.00 C ATOM 2232 CD GLU B 46 -11.450 5.633 -26.255 1.00 0.00 C ATOM 2233 OE1 GLU B 46 -10.849 4.571 -26.224 1.00 0.00 O ATOM 2234 OE2 GLU B 46 -12.648 5.734 -26.461 1.00 0.00 O ATOM 0 H GLU B 46 -11.192 8.346 -23.395 1.00 0.00 H new ATOM 0 HA GLU B 46 -8.353 7.991 -23.715 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -8.993 6.088 -24.916 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -10.431 6.349 -23.949 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -11.330 7.768 -25.933 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -10.002 7.115 -26.872 1.00 0.00 H new ATOM 2241 N ILE B 47 -7.759 8.878 -26.065 1.00 0.00 N ATOM 2242 CA ILE B 47 -7.400 9.705 -27.244 1.00 0.00 C ATOM 2243 C ILE B 47 -8.054 9.102 -28.484 1.00 0.00 C ATOM 2244 O ILE B 47 -8.111 7.897 -28.639 1.00 0.00 O ATOM 2245 CB ILE B 47 -5.885 9.712 -27.451 1.00 0.00 C ATOM 2246 CG1 ILE B 47 -5.182 10.056 -26.121 1.00 0.00 C ATOM 2247 CG2 ILE B 47 -5.512 10.742 -28.552 1.00 0.00 C ATOM 2248 CD1 ILE B 47 -5.709 11.383 -25.560 1.00 0.00 C ATOM 0 H ILE B 47 -7.043 8.219 -25.759 1.00 0.00 H new ATOM 0 HA ILE B 47 -7.745 10.726 -27.079 1.00 0.00 H new ATOM 0 HB ILE B 47 -5.555 8.725 -27.774 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -5.349 9.257 -25.398 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -4.106 10.123 -26.279 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -4.432 10.744 -28.697 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -6.003 10.470 -29.486 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -5.839 11.736 -28.246 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -5.202 11.609 -24.622 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -5.519 12.182 -26.277 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -6.781 11.303 -25.382 1.00 0.00 H new ATOM 2260 N LYS B 48 -8.560 9.926 -29.363 1.00 0.00 N ATOM 2261 CA LYS B 48 -9.227 9.406 -30.595 1.00 0.00 C ATOM 2262 C LYS B 48 -8.306 9.586 -31.806 1.00 0.00 C ATOM 2263 O LYS B 48 -8.456 8.922 -32.813 1.00 0.00 O ATOM 2264 CB LYS B 48 -10.528 10.186 -30.797 1.00 0.00 C ATOM 2265 CG LYS B 48 -11.335 10.194 -29.472 1.00 0.00 C ATOM 2266 CD LYS B 48 -11.103 11.498 -28.701 1.00 0.00 C ATOM 2267 CE LYS B 48 -12.030 11.534 -27.481 1.00 0.00 C ATOM 2268 NZ LYS B 48 -13.452 11.571 -27.933 1.00 0.00 N ATOM 0 H LYS B 48 -8.540 10.943 -29.281 1.00 0.00 H new ATOM 0 HA LYS B 48 -9.442 8.343 -30.488 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -10.308 11.207 -31.108 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -11.118 9.731 -31.592 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -12.397 10.078 -29.687 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -11.040 9.345 -28.856 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -10.062 11.567 -28.384 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -11.297 12.355 -29.346 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -11.859 10.657 -26.856 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -11.809 12.409 -26.870 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -14.045 11.977 -27.181 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -13.529 12.157 -28.789 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -13.774 10.605 -28.144 1.00 0.00 H new ATOM 2282 N GLU B 49 -7.345 10.470 -31.714 1.00 0.00 N ATOM 2283 CA GLU B 49 -6.399 10.691 -32.851 1.00 0.00 C ATOM 2284 C GLU B 49 -4.986 10.884 -32.284 1.00 0.00 C ATOM 2285 O GLU B 49 -4.798 11.520 -31.266 1.00 0.00 O ATOM 2286 CB GLU B 49 -6.834 11.932 -33.633 1.00 0.00 C ATOM 2287 CG GLU B 49 -5.987 12.071 -34.901 1.00 0.00 C ATOM 2288 CD GLU B 49 -6.350 10.960 -35.887 1.00 0.00 C ATOM 2289 OE1 GLU B 49 -7.404 10.368 -35.723 1.00 0.00 O ATOM 2290 OE2 GLU B 49 -5.563 10.717 -36.788 1.00 0.00 O ATOM 0 H GLU B 49 -7.174 11.052 -30.894 1.00 0.00 H new ATOM 0 HA GLU B 49 -6.403 9.833 -33.523 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -7.889 11.856 -33.896 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -6.724 12.821 -33.012 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -6.156 13.046 -35.358 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -4.928 12.016 -34.650 1.00 0.00 H new ATOM 2297 N GLN B 50 -3.994 10.317 -32.919 1.00 0.00 N ATOM 2298 CA GLN B 50 -2.596 10.440 -32.403 1.00 0.00 C ATOM 2299 C GLN B 50 -2.112 11.893 -32.460 1.00 0.00 C ATOM 2300 O GLN B 50 -1.209 12.273 -31.751 1.00 0.00 O ATOM 2301 CB GLN B 50 -1.664 9.558 -33.240 1.00 0.00 C ATOM 2302 CG GLN B 50 -1.689 10.007 -34.712 1.00 0.00 C ATOM 2303 CD GLN B 50 -0.701 11.159 -34.929 1.00 0.00 C ATOM 2304 OE1 GLN B 50 -1.157 12.353 -35.196 1.00 0.00 O flip ATOM 2305 NE2 GLN B 50 0.498 10.968 -34.862 1.00 0.00 N flip ATOM 0 H GLN B 50 -4.091 9.772 -33.776 1.00 0.00 H new ATOM 0 HA GLN B 50 -2.584 10.115 -31.363 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -0.648 9.618 -32.851 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -1.973 8.515 -33.165 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -1.431 9.169 -35.360 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -2.695 10.324 -34.986 1.00 0.00 H new ATOM 0 HE21 GLN B 50 0.855 10.036 -34.653 1.00 0.00 H new ATOM 0 HE22 GLN B 50 1.147 11.740 -35.014 1.00 0.00 H new ATOM 2314 N GLU B 51 -2.693 12.710 -33.289 1.00 0.00 N ATOM 2315 CA GLU B 51 -2.241 14.130 -33.364 1.00 0.00 C ATOM 2316 C GLU B 51 -2.423 14.786 -32.005 1.00 0.00 C ATOM 2317 O GLU B 51 -1.601 15.563 -31.577 1.00 0.00 O ATOM 2318 CB GLU B 51 -3.056 14.881 -34.422 1.00 0.00 C ATOM 2319 CG GLU B 51 -4.501 15.026 -33.947 1.00 0.00 C ATOM 2320 CD GLU B 51 -5.370 15.523 -35.103 1.00 0.00 C ATOM 2321 OE1 GLU B 51 -4.814 16.071 -36.041 1.00 0.00 O ATOM 2322 OE2 GLU B 51 -6.575 15.347 -35.030 1.00 0.00 O ATOM 0 H GLU B 51 -3.458 12.461 -33.916 1.00 0.00 H new ATOM 0 HA GLU B 51 -1.188 14.163 -33.644 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -2.621 15.864 -34.601 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -3.026 14.342 -35.369 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -4.873 14.068 -33.584 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -4.552 15.725 -33.113 1.00 0.00 H new ATOM 2329 N VAL B 52 -3.489 14.484 -31.321 1.00 0.00 N ATOM 2330 CA VAL B 52 -3.696 15.097 -29.988 1.00 0.00 C ATOM 2331 C VAL B 52 -2.541 14.707 -29.098 1.00 0.00 C ATOM 2332 O VAL B 52 -2.044 15.496 -28.333 1.00 0.00 O ATOM 2333 CB VAL B 52 -5.002 14.589 -29.388 1.00 0.00 C ATOM 2334 CG1 VAL B 52 -5.132 15.059 -27.934 1.00 0.00 C ATOM 2335 CG2 VAL B 52 -6.163 15.121 -30.218 1.00 0.00 C ATOM 0 H VAL B 52 -4.221 13.843 -31.627 1.00 0.00 H new ATOM 0 HA VAL B 52 -3.748 16.182 -30.078 1.00 0.00 H new ATOM 0 HB VAL B 52 -5.013 13.499 -29.399 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -6.068 14.691 -27.515 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -4.296 14.672 -27.351 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -5.124 16.148 -27.902 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -7.104 14.764 -29.799 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -6.150 16.211 -30.205 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -6.067 14.769 -31.245 1.00 0.00 H new ATOM 2345 N VAL B 53 -2.109 13.493 -29.198 1.00 0.00 N ATOM 2346 CA VAL B 53 -0.975 13.046 -28.362 1.00 0.00 C ATOM 2347 C VAL B 53 0.237 13.898 -28.685 1.00 0.00 C ATOM 2348 O VAL B 53 0.966 14.283 -27.812 1.00 0.00 O ATOM 2349 CB VAL B 53 -0.692 11.582 -28.660 1.00 0.00 C ATOM 2350 CG1 VAL B 53 0.491 11.098 -27.820 1.00 0.00 C ATOM 2351 CG2 VAL B 53 -1.945 10.776 -28.325 1.00 0.00 C ATOM 0 H VAL B 53 -2.493 12.786 -29.825 1.00 0.00 H new ATOM 0 HA VAL B 53 -1.212 13.153 -27.303 1.00 0.00 H new ATOM 0 HB VAL B 53 -0.438 11.453 -29.712 1.00 0.00 H new ATOM 0 HG11 VAL B 53 0.688 10.048 -28.039 1.00 0.00 H new ATOM 0 HG12 VAL B 53 1.374 11.690 -28.060 1.00 0.00 H new ATOM 0 HG13 VAL B 53 0.256 11.210 -26.762 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -1.765 9.721 -28.531 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -2.188 10.903 -27.270 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -2.778 11.128 -28.934 1.00 0.00 H new ATOM 2361 N ASP B 54 0.444 14.208 -29.933 1.00 0.00 N ATOM 2362 CA ASP B 54 1.603 15.061 -30.310 1.00 0.00 C ATOM 2363 C ASP B 54 1.454 16.418 -29.623 1.00 0.00 C ATOM 2364 O ASP B 54 2.408 17.001 -29.160 1.00 0.00 O ATOM 2365 CB ASP B 54 1.645 15.239 -31.832 1.00 0.00 C ATOM 2366 CG ASP B 54 2.847 16.105 -32.220 1.00 0.00 C ATOM 2367 OD1 ASP B 54 3.372 16.784 -31.353 1.00 0.00 O ATOM 2368 OD2 ASP B 54 3.226 16.070 -33.379 1.00 0.00 O ATOM 0 H ASP B 54 -0.142 13.906 -30.711 1.00 0.00 H new ATOM 0 HA ASP B 54 2.533 14.589 -29.993 1.00 0.00 H new ATOM 0 HB2 ASP B 54 1.713 14.266 -32.319 1.00 0.00 H new ATOM 0 HB3 ASP B 54 0.723 15.705 -32.178 1.00 0.00 H new ATOM 2373 N LYS B 55 0.252 16.918 -29.569 1.00 0.00 N ATOM 2374 CA LYS B 55 -0.005 18.239 -28.919 1.00 0.00 C ATOM 2375 C LYS B 55 0.412 18.141 -27.451 1.00 0.00 C ATOM 2376 O LYS B 55 1.024 19.035 -26.889 1.00 0.00 O ATOM 2377 CB LYS B 55 -1.510 18.555 -29.005 1.00 0.00 C ATOM 2378 CG LYS B 55 -1.761 20.059 -28.772 1.00 0.00 C ATOM 2379 CD LYS B 55 -1.657 20.814 -30.100 1.00 0.00 C ATOM 2380 CE LYS B 55 -1.906 22.305 -29.864 1.00 0.00 C ATOM 2381 NZ LYS B 55 -1.742 23.046 -31.147 1.00 0.00 N ATOM 0 H LYS B 55 -0.577 16.463 -29.952 1.00 0.00 H new ATOM 0 HA LYS B 55 0.560 19.027 -29.417 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -1.893 18.264 -29.983 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -2.053 17.970 -28.263 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -2.748 20.209 -28.334 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -1.034 20.453 -28.061 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -0.670 20.665 -30.538 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -2.384 20.422 -30.811 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -2.910 22.459 -29.469 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -1.208 22.688 -29.119 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -1.911 24.060 -30.987 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -0.776 22.909 -31.506 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -2.425 22.687 -31.845 1.00 0.00 H new ATOM 2395 N VAL B 56 0.098 17.033 -26.841 1.00 0.00 N ATOM 2396 CA VAL B 56 0.472 16.815 -25.423 1.00 0.00 C ATOM 2397 C VAL B 56 1.986 16.686 -25.355 1.00 0.00 C ATOM 2398 O VAL B 56 2.612 17.042 -24.376 1.00 0.00 O ATOM 2399 CB VAL B 56 -0.193 15.523 -24.913 1.00 0.00 C ATOM 2400 CG1 VAL B 56 0.520 15.010 -23.656 1.00 0.00 C ATOM 2401 CG2 VAL B 56 -1.659 15.804 -24.575 1.00 0.00 C ATOM 0 H VAL B 56 -0.409 16.261 -27.274 1.00 0.00 H new ATOM 0 HA VAL B 56 0.139 17.646 -24.802 1.00 0.00 H new ATOM 0 HB VAL B 56 -0.126 14.766 -25.694 1.00 0.00 H new ATOM 0 HG11 VAL B 56 0.036 14.097 -23.310 1.00 0.00 H new ATOM 0 HG12 VAL B 56 1.564 14.801 -23.889 1.00 0.00 H new ATOM 0 HG13 VAL B 56 0.467 15.767 -22.873 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -2.131 14.890 -24.214 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -1.714 16.571 -23.802 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -2.178 16.152 -25.468 1.00 0.00 H new ATOM 2411 N MET B 57 2.578 16.172 -26.392 1.00 0.00 N ATOM 2412 CA MET B 57 4.052 16.013 -26.378 1.00 0.00 C ATOM 2413 C MET B 57 4.706 17.382 -26.454 1.00 0.00 C ATOM 2414 O MET B 57 5.754 17.599 -25.908 1.00 0.00 O ATOM 2415 CB MET B 57 4.511 15.118 -27.528 1.00 0.00 C ATOM 2416 CG MET B 57 4.063 13.681 -27.243 1.00 0.00 C ATOM 2417 SD MET B 57 5.019 12.995 -25.860 1.00 0.00 S ATOM 2418 CE MET B 57 6.459 12.413 -26.793 1.00 0.00 C ATOM 0 H MET B 57 2.109 15.858 -27.242 1.00 0.00 H new ATOM 0 HA MET B 57 4.353 15.529 -25.449 1.00 0.00 H new ATOM 0 HB2 MET B 57 4.087 15.466 -28.470 1.00 0.00 H new ATOM 0 HB3 MET B 57 5.595 15.162 -27.631 1.00 0.00 H new ATOM 0 HG2 MET B 57 2.999 13.663 -27.005 1.00 0.00 H new ATOM 0 HG3 MET B 57 4.201 13.065 -28.132 1.00 0.00 H new ATOM 0 HE1 MET B 57 6.465 11.323 -26.811 1.00 0.00 H new ATOM 0 HE2 MET B 57 6.409 12.792 -27.814 1.00 0.00 H new ATOM 0 HE3 MET B 57 7.371 12.773 -26.317 1.00 0.00 H new ATOM 2428 N GLU B 58 4.093 18.333 -27.083 1.00 0.00 N ATOM 2429 CA GLU B 58 4.724 19.672 -27.121 1.00 0.00 C ATOM 2430 C GLU B 58 4.888 20.120 -25.670 1.00 0.00 C ATOM 2431 O GLU B 58 5.893 20.683 -25.284 1.00 0.00 O ATOM 2432 CB GLU B 58 3.818 20.646 -27.882 1.00 0.00 C ATOM 2433 CG GLU B 58 4.482 22.022 -27.956 1.00 0.00 C ATOM 2434 CD GLU B 58 3.569 22.984 -28.718 1.00 0.00 C ATOM 2435 OE1 GLU B 58 2.600 22.518 -29.296 1.00 0.00 O ATOM 2436 OE2 GLU B 58 3.855 24.170 -28.715 1.00 0.00 O ATOM 0 H GLU B 58 3.198 18.247 -27.565 1.00 0.00 H new ATOM 0 HA GLU B 58 5.688 19.646 -27.629 1.00 0.00 H new ATOM 0 HB2 GLU B 58 3.627 20.270 -28.887 1.00 0.00 H new ATOM 0 HB3 GLU B 58 2.852 20.725 -27.382 1.00 0.00 H new ATOM 0 HG2 GLU B 58 4.672 22.401 -26.952 1.00 0.00 H new ATOM 0 HG3 GLU B 58 5.448 21.946 -28.456 1.00 0.00 H new ATOM 2443 N THR B 59 3.902 19.843 -24.862 1.00 0.00 N ATOM 2444 CA THR B 59 3.974 20.214 -23.419 1.00 0.00 C ATOM 2445 C THR B 59 4.727 19.151 -22.603 1.00 0.00 C ATOM 2446 O THR B 59 5.466 19.467 -21.691 1.00 0.00 O ATOM 2447 CB THR B 59 2.556 20.319 -22.871 1.00 0.00 C ATOM 2448 OG1 THR B 59 1.844 21.322 -23.582 1.00 0.00 O ATOM 2449 CG2 THR B 59 2.596 20.667 -21.384 1.00 0.00 C ATOM 0 H THR B 59 3.042 19.371 -25.142 1.00 0.00 H new ATOM 0 HA THR B 59 4.506 21.162 -23.335 1.00 0.00 H new ATOM 0 HB THR B 59 2.051 19.361 -22.996 1.00 0.00 H new ATOM 0 HG1 THR B 59 0.932 21.387 -23.230 1.00 0.00 H new ATOM 0 HG21 THR B 59 1.579 20.740 -21.000 1.00 0.00 H new ATOM 0 HG22 THR B 59 3.133 19.888 -20.842 1.00 0.00 H new ATOM 0 HG23 THR B 59 3.105 21.621 -21.247 1.00 0.00 H new ATOM 2457 N LEU B 60 4.510 17.893 -22.893 1.00 0.00 N ATOM 2458 CA LEU B 60 5.168 16.811 -22.105 1.00 0.00 C ATOM 2459 C LEU B 60 6.546 16.500 -22.687 1.00 0.00 C ATOM 2460 O LEU B 60 7.394 15.945 -22.018 1.00 0.00 O ATOM 2461 CB LEU B 60 4.278 15.561 -22.145 1.00 0.00 C ATOM 2462 CG LEU B 60 4.899 14.432 -21.315 1.00 0.00 C ATOM 2463 CD1 LEU B 60 5.048 14.869 -19.845 1.00 0.00 C ATOM 2464 CD2 LEU B 60 3.994 13.195 -21.405 1.00 0.00 C ATOM 0 H LEU B 60 3.902 17.569 -23.645 1.00 0.00 H new ATOM 0 HA LEU B 60 5.299 17.134 -21.072 1.00 0.00 H new ATOM 0 HB2 LEU B 60 3.287 15.801 -21.760 1.00 0.00 H new ATOM 0 HB3 LEU B 60 4.148 15.233 -23.176 1.00 0.00 H new ATOM 0 HG LEU B 60 5.889 14.195 -21.705 1.00 0.00 H new ATOM 0 HD11 LEU B 60 5.490 14.057 -19.267 1.00 0.00 H new ATOM 0 HD12 LEU B 60 5.692 15.747 -19.790 1.00 0.00 H new ATOM 0 HD13 LEU B 60 4.067 15.113 -19.437 1.00 0.00 H new ATOM 0 HD21 LEU B 60 4.426 12.385 -20.818 1.00 0.00 H new ATOM 0 HD22 LEU B 60 3.005 13.438 -21.015 1.00 0.00 H new ATOM 0 HD23 LEU B 60 3.907 12.883 -22.446 1.00 0.00 H new ATOM 2476 N ASP B 61 6.802 16.875 -23.910 1.00 0.00 N ATOM 2477 CA ASP B 61 8.157 16.614 -24.473 1.00 0.00 C ATOM 2478 C ASP B 61 9.057 17.712 -23.953 1.00 0.00 C ATOM 2479 O ASP B 61 9.529 18.563 -24.681 1.00 0.00 O ATOM 2480 CB ASP B 61 8.153 16.643 -25.999 1.00 0.00 C ATOM 2481 CG ASP B 61 9.495 16.130 -26.510 1.00 0.00 C ATOM 2482 OD1 ASP B 61 10.280 15.667 -25.697 1.00 0.00 O ATOM 2483 OD2 ASP B 61 9.721 16.226 -27.701 1.00 0.00 O ATOM 0 H ASP B 61 6.145 17.343 -24.535 1.00 0.00 H new ATOM 0 HA ASP B 61 8.498 15.623 -24.174 1.00 0.00 H new ATOM 0 HB2 ASP B 61 7.342 16.025 -26.385 1.00 0.00 H new ATOM 0 HB3 ASP B 61 7.978 17.658 -26.356 1.00 0.00 H new ATOM 2488 N GLU B 62 9.267 17.703 -22.682 1.00 0.00 N ATOM 2489 CA GLU B 62 10.105 18.746 -22.052 1.00 0.00 C ATOM 2490 C GLU B 62 11.489 18.732 -22.697 1.00 0.00 C ATOM 2491 O GLU B 62 12.083 19.765 -22.943 1.00 0.00 O ATOM 2492 CB GLU B 62 10.222 18.429 -20.567 1.00 0.00 C ATOM 2493 CG GLU B 62 8.816 18.232 -19.981 1.00 0.00 C ATOM 2494 CD GLU B 62 8.920 17.981 -18.476 1.00 0.00 C ATOM 2495 OE1 GLU B 62 10.027 17.790 -18.002 1.00 0.00 O ATOM 2496 OE2 GLU B 62 7.889 17.975 -17.823 1.00 0.00 O ATOM 0 H GLU B 62 8.889 17.008 -22.038 1.00 0.00 H new ATOM 0 HA GLU B 62 9.660 19.732 -22.187 1.00 0.00 H new ATOM 0 HB2 GLU B 62 10.819 17.529 -20.421 1.00 0.00 H new ATOM 0 HB3 GLU B 62 10.735 19.240 -20.049 1.00 0.00 H new ATOM 0 HG2 GLU B 62 8.204 19.114 -20.172 1.00 0.00 H new ATOM 0 HG3 GLU B 62 8.323 17.391 -20.467 1.00 0.00 H new ATOM 2503 N ASP B 63 12.002 17.571 -22.984 1.00 0.00 N ATOM 2504 CA ASP B 63 13.341 17.488 -23.628 1.00 0.00 C ATOM 2505 C ASP B 63 13.201 17.869 -25.101 1.00 0.00 C ATOM 2506 O ASP B 63 14.168 18.174 -25.773 1.00 0.00 O ATOM 2507 CB ASP B 63 13.861 16.055 -23.527 1.00 0.00 C ATOM 2508 CG ASP B 63 14.102 15.701 -22.060 1.00 0.00 C ATOM 2509 OD1 ASP B 63 14.422 16.598 -21.298 1.00 0.00 O ATOM 2510 OD2 ASP B 63 13.958 14.537 -21.723 1.00 0.00 O ATOM 0 H ASP B 63 11.552 16.674 -22.801 1.00 0.00 H new ATOM 0 HA ASP B 63 14.037 18.164 -23.131 1.00 0.00 H new ATOM 0 HB2 ASP B 63 13.141 15.364 -23.965 1.00 0.00 H new ATOM 0 HB3 ASP B 63 14.787 15.952 -24.093 1.00 0.00 H new ATOM 2515 N GLY B 64 11.997 17.854 -25.606 1.00 0.00 N ATOM 2516 CA GLY B 64 11.785 18.220 -27.040 1.00 0.00 C ATOM 2517 C GLY B 64 12.402 17.150 -27.951 1.00 0.00 C ATOM 2518 O GLY B 64 12.865 17.448 -29.034 1.00 0.00 O ATOM 0 H GLY B 64 11.152 17.605 -25.091 1.00 0.00 H new ATOM 0 HA2 GLY B 64 10.719 18.314 -27.246 1.00 0.00 H new ATOM 0 HA3 GLY B 64 12.237 19.190 -27.247 1.00 0.00 H new ATOM 2522 N ASP B 65 12.417 15.908 -27.524 1.00 0.00 N ATOM 2523 CA ASP B 65 13.014 14.818 -28.367 1.00 0.00 C ATOM 2524 C ASP B 65 11.900 13.962 -28.970 1.00 0.00 C ATOM 2525 O ASP B 65 12.149 12.937 -29.574 1.00 0.00 O ATOM 2526 CB ASP B 65 13.911 13.940 -27.491 1.00 0.00 C ATOM 2527 CG ASP B 65 13.077 13.325 -26.368 1.00 0.00 C ATOM 2528 OD1 ASP B 65 12.024 13.867 -26.080 1.00 0.00 O ATOM 2529 OD2 ASP B 65 13.504 12.324 -25.817 1.00 0.00 O ATOM 0 H ASP B 65 12.041 15.601 -26.627 1.00 0.00 H new ATOM 0 HA ASP B 65 13.601 15.261 -29.171 1.00 0.00 H new ATOM 0 HB2 ASP B 65 14.368 13.154 -28.092 1.00 0.00 H new ATOM 0 HB3 ASP B 65 14.723 14.534 -27.072 1.00 0.00 H new ATOM 2534 N GLY B 66 10.676 14.370 -28.805 1.00 0.00 N ATOM 2535 CA GLY B 66 9.541 13.582 -29.360 1.00 0.00 C ATOM 2536 C GLY B 66 9.248 12.407 -28.426 1.00 0.00 C ATOM 2537 O GLY B 66 8.393 11.586 -28.689 1.00 0.00 O ATOM 0 H GLY B 66 10.410 15.220 -28.307 1.00 0.00 H new ATOM 0 HA2 GLY B 66 8.658 14.213 -29.460 1.00 0.00 H new ATOM 0 HA3 GLY B 66 9.787 13.218 -30.357 1.00 0.00 H new ATOM 2541 N GLU B 67 9.964 12.325 -27.335 1.00 0.00 N ATOM 2542 CA GLU B 67 9.760 11.213 -26.363 1.00 0.00 C ATOM 2543 C GLU B 67 9.847 11.767 -24.938 1.00 0.00 C ATOM 2544 O GLU B 67 10.710 12.563 -24.628 1.00 0.00 O ATOM 2545 CB GLU B 67 10.872 10.175 -26.551 1.00 0.00 C ATOM 2546 CG GLU B 67 11.029 9.859 -28.036 1.00 0.00 C ATOM 2547 CD GLU B 67 12.106 8.789 -28.222 1.00 0.00 C ATOM 2548 OE1 GLU B 67 12.791 8.492 -27.257 1.00 0.00 O ATOM 2549 OE2 GLU B 67 12.223 8.280 -29.324 1.00 0.00 O ATOM 0 H GLU B 67 10.691 12.991 -27.074 1.00 0.00 H new ATOM 0 HA GLU B 67 8.784 10.756 -26.529 1.00 0.00 H new ATOM 0 HB2 GLU B 67 11.811 10.555 -26.148 1.00 0.00 H new ATOM 0 HB3 GLU B 67 10.633 9.266 -25.998 1.00 0.00 H new ATOM 0 HG2 GLU B 67 10.081 9.510 -28.446 1.00 0.00 H new ATOM 0 HG3 GLU B 67 11.300 10.762 -28.583 1.00 0.00 H new ATOM 2556 N CYS B 68 8.975 11.338 -24.064 1.00 0.00 N ATOM 2557 CA CYS B 68 9.019 11.825 -22.645 1.00 0.00 C ATOM 2558 C CYS B 68 9.709 10.771 -21.778 1.00 0.00 C ATOM 2559 O CYS B 68 9.393 9.600 -21.822 1.00 0.00 O ATOM 2560 CB CYS B 68 7.596 12.097 -22.142 1.00 0.00 C ATOM 2561 SG CYS B 68 6.791 10.545 -21.666 1.00 0.00 S ATOM 0 H CYS B 68 8.231 10.670 -24.268 1.00 0.00 H new ATOM 0 HA CYS B 68 9.582 12.756 -22.589 1.00 0.00 H new ATOM 0 HB2 CYS B 68 7.628 12.775 -21.289 1.00 0.00 H new ATOM 0 HB3 CYS B 68 7.016 12.592 -22.921 1.00 0.00 H new ATOM 0 HG CYS B 68 7.683 9.715 -21.212 1.00 0.00 H new ATOM 2567 N ASP B 69 10.660 11.195 -20.999 1.00 0.00 N ATOM 2568 CA ASP B 69 11.411 10.257 -20.122 1.00 0.00 C ATOM 2569 C ASP B 69 10.535 9.857 -18.939 1.00 0.00 C ATOM 2570 O ASP B 69 9.468 10.401 -18.736 1.00 0.00 O ATOM 2571 CB ASP B 69 12.683 10.948 -19.623 1.00 0.00 C ATOM 2572 CG ASP B 69 13.451 10.011 -18.689 1.00 0.00 C ATOM 2573 OD1 ASP B 69 13.066 9.909 -17.535 1.00 0.00 O ATOM 2574 OD2 ASP B 69 14.416 9.417 -19.141 1.00 0.00 O ATOM 0 H ASP B 69 10.954 12.169 -20.931 1.00 0.00 H new ATOM 0 HA ASP B 69 11.682 9.362 -20.681 1.00 0.00 H new ATOM 0 HB2 ASP B 69 13.311 11.228 -20.469 1.00 0.00 H new ATOM 0 HB3 ASP B 69 12.426 11.868 -19.098 1.00 0.00 H new ATOM 2579 N PHE B 70 10.963 8.904 -18.161 1.00 0.00 N ATOM 2580 CA PHE B 70 10.142 8.476 -17.010 1.00 0.00 C ATOM 2581 C PHE B 70 9.860 9.685 -16.115 1.00 0.00 C ATOM 2582 O PHE B 70 8.774 9.839 -15.608 1.00 0.00 O ATOM 2583 CB PHE B 70 10.902 7.393 -16.225 1.00 0.00 C ATOM 2584 CG PHE B 70 10.329 7.260 -14.829 1.00 0.00 C ATOM 2585 CD1 PHE B 70 8.951 7.090 -14.654 1.00 0.00 C ATOM 2586 CD2 PHE B 70 11.172 7.324 -13.713 1.00 0.00 C ATOM 2587 CE1 PHE B 70 8.418 6.985 -13.368 1.00 0.00 C ATOM 2588 CE2 PHE B 70 10.639 7.216 -12.428 1.00 0.00 C ATOM 2589 CZ PHE B 70 9.261 7.047 -12.253 1.00 0.00 C ATOM 0 H PHE B 70 11.846 8.407 -18.277 1.00 0.00 H new ATOM 0 HA PHE B 70 9.194 8.064 -17.356 1.00 0.00 H new ATOM 0 HB2 PHE B 70 10.832 6.439 -16.747 1.00 0.00 H new ATOM 0 HB3 PHE B 70 11.960 7.649 -16.169 1.00 0.00 H new ATOM 0 HD1 PHE B 70 8.300 7.040 -15.514 1.00 0.00 H new ATOM 0 HD2 PHE B 70 12.235 7.457 -13.847 1.00 0.00 H new ATOM 0 HE1 PHE B 70 7.354 6.856 -13.234 1.00 0.00 H new ATOM 0 HE2 PHE B 70 11.290 7.263 -11.568 1.00 0.00 H new ATOM 0 HZ PHE B 70 8.849 6.965 -11.258 1.00 0.00 H new ATOM 2599 N GLN B 71 10.817 10.542 -15.914 1.00 0.00 N ATOM 2600 CA GLN B 71 10.565 11.723 -15.042 1.00 0.00 C ATOM 2601 C GLN B 71 9.555 12.659 -15.711 1.00 0.00 C ATOM 2602 O GLN B 71 8.697 13.221 -15.059 1.00 0.00 O ATOM 2603 CB GLN B 71 11.874 12.472 -14.775 1.00 0.00 C ATOM 2604 CG GLN B 71 12.444 13.008 -16.087 1.00 0.00 C ATOM 2605 CD GLN B 71 13.839 13.584 -15.835 1.00 0.00 C ATOM 2606 OE1 GLN B 71 14.635 12.992 -15.134 1.00 0.00 O ATOM 2607 NE2 GLN B 71 14.167 14.727 -16.373 1.00 0.00 N ATOM 0 H GLN B 71 11.755 10.480 -16.310 1.00 0.00 H new ATOM 0 HA GLN B 71 10.157 11.378 -14.092 1.00 0.00 H new ATOM 0 HB2 GLN B 71 11.697 13.295 -14.082 1.00 0.00 H new ATOM 0 HB3 GLN B 71 12.594 11.805 -14.301 1.00 0.00 H new ATOM 0 HG2 GLN B 71 12.496 12.210 -16.827 1.00 0.00 H new ATOM 0 HG3 GLN B 71 11.788 13.778 -16.494 1.00 0.00 H new ATOM 0 HE21 GLN B 71 13.499 15.224 -16.962 1.00 0.00 H new ATOM 0 HE22 GLN B 71 15.092 15.123 -16.205 1.00 0.00 H new ATOM 2616 N GLU B 72 9.648 12.843 -17.003 1.00 0.00 N ATOM 2617 CA GLU B 72 8.691 13.753 -17.687 1.00 0.00 C ATOM 2618 C GLU B 72 7.270 13.201 -17.580 1.00 0.00 C ATOM 2619 O GLU B 72 6.329 13.923 -17.317 1.00 0.00 O ATOM 2620 CB GLU B 72 9.079 13.862 -19.164 1.00 0.00 C ATOM 2621 CG GLU B 72 10.385 14.646 -19.297 1.00 0.00 C ATOM 2622 CD GLU B 72 10.823 14.663 -20.763 1.00 0.00 C ATOM 2623 OE1 GLU B 72 10.276 15.451 -21.515 1.00 0.00 O ATOM 2624 OE2 GLU B 72 11.697 13.884 -21.110 1.00 0.00 O ATOM 0 H GLU B 72 10.342 12.404 -17.608 1.00 0.00 H new ATOM 0 HA GLU B 72 8.727 14.734 -17.214 1.00 0.00 H new ATOM 0 HB2 GLU B 72 9.195 12.867 -19.594 1.00 0.00 H new ATOM 0 HB3 GLU B 72 8.286 14.360 -19.722 1.00 0.00 H new ATOM 0 HG2 GLU B 72 10.248 15.665 -18.935 1.00 0.00 H new ATOM 0 HG3 GLU B 72 11.160 14.190 -18.680 1.00 0.00 H new ATOM 2631 N PHE B 73 7.113 11.924 -17.774 1.00 0.00 N ATOM 2632 CA PHE B 73 5.758 11.313 -17.687 1.00 0.00 C ATOM 2633 C PHE B 73 5.207 11.481 -16.277 1.00 0.00 C ATOM 2634 O PHE B 73 4.025 11.665 -16.081 1.00 0.00 O ATOM 2635 CB PHE B 73 5.826 9.821 -18.030 1.00 0.00 C ATOM 2636 CG PHE B 73 4.481 9.193 -17.742 1.00 0.00 C ATOM 2637 CD1 PHE B 73 3.491 9.165 -18.729 1.00 0.00 C ATOM 2638 CD2 PHE B 73 4.223 8.660 -16.473 1.00 0.00 C ATOM 2639 CE1 PHE B 73 2.241 8.602 -18.446 1.00 0.00 C ATOM 2640 CE2 PHE B 73 2.977 8.094 -16.193 1.00 0.00 C ATOM 2641 CZ PHE B 73 1.985 8.066 -17.177 1.00 0.00 C ATOM 0 H PHE B 73 7.868 11.273 -17.990 1.00 0.00 H new ATOM 0 HA PHE B 73 5.102 11.814 -18.399 1.00 0.00 H new ATOM 0 HB2 PHE B 73 6.088 9.687 -19.079 1.00 0.00 H new ATOM 0 HB3 PHE B 73 6.604 9.334 -17.442 1.00 0.00 H new ATOM 0 HD1 PHE B 73 3.690 9.577 -19.707 1.00 0.00 H new ATOM 0 HD2 PHE B 73 4.988 8.687 -15.711 1.00 0.00 H new ATOM 0 HE1 PHE B 73 1.474 8.581 -19.206 1.00 0.00 H new ATOM 0 HE2 PHE B 73 2.780 7.678 -15.216 1.00 0.00 H new ATOM 0 HZ PHE B 73 1.021 7.631 -16.959 1.00 0.00 H new ATOM 2651 N MET B 74 6.054 11.389 -15.301 1.00 0.00 N ATOM 2652 CA MET B 74 5.596 11.505 -13.894 1.00 0.00 C ATOM 2653 C MET B 74 4.939 12.863 -13.656 1.00 0.00 C ATOM 2654 O MET B 74 3.981 12.982 -12.912 1.00 0.00 O ATOM 2655 CB MET B 74 6.795 11.335 -12.955 1.00 0.00 C ATOM 2656 CG MET B 74 7.188 9.855 -12.876 1.00 0.00 C ATOM 2657 SD MET B 74 5.889 8.915 -12.033 1.00 0.00 S ATOM 2658 CE MET B 74 6.040 9.698 -10.410 1.00 0.00 C ATOM 0 H MET B 74 7.056 11.237 -15.417 1.00 0.00 H new ATOM 0 HA MET B 74 4.860 10.726 -13.694 1.00 0.00 H new ATOM 0 HB2 MET B 74 7.637 11.925 -13.315 1.00 0.00 H new ATOM 0 HB3 MET B 74 6.546 11.708 -11.962 1.00 0.00 H new ATOM 0 HG2 MET B 74 7.344 9.457 -13.879 1.00 0.00 H new ATOM 0 HG3 MET B 74 8.131 9.749 -12.341 1.00 0.00 H new ATOM 0 HE1 MET B 74 5.646 9.029 -9.645 1.00 0.00 H new ATOM 0 HE2 MET B 74 7.090 9.907 -10.203 1.00 0.00 H new ATOM 0 HE3 MET B 74 5.476 10.631 -10.402 1.00 0.00 H new ATOM 2668 N ALA B 75 5.450 13.895 -14.249 1.00 0.00 N ATOM 2669 CA ALA B 75 4.847 15.233 -14.010 1.00 0.00 C ATOM 2670 C ALA B 75 3.460 15.334 -14.650 1.00 0.00 C ATOM 2671 O ALA B 75 2.584 16.005 -14.143 1.00 0.00 O ATOM 2672 CB ALA B 75 5.762 16.319 -14.577 1.00 0.00 C ATOM 0 H ALA B 75 6.249 13.876 -14.882 1.00 0.00 H new ATOM 0 HA ALA B 75 4.736 15.373 -12.935 1.00 0.00 H new ATOM 0 HB1 ALA B 75 5.317 17.298 -14.400 1.00 0.00 H new ATOM 0 HB2 ALA B 75 6.734 16.268 -14.087 1.00 0.00 H new ATOM 0 HB3 ALA B 75 5.888 16.166 -15.649 1.00 0.00 H new ATOM 2678 N PHE B 76 3.251 14.687 -15.756 1.00 0.00 N ATOM 2679 CA PHE B 76 1.913 14.763 -16.424 1.00 0.00 C ATOM 2680 C PHE B 76 0.845 14.185 -15.500 1.00 0.00 C ATOM 2681 O PHE B 76 -0.259 14.669 -15.426 1.00 0.00 O ATOM 2682 CB PHE B 76 1.961 13.969 -17.734 1.00 0.00 C ATOM 2683 CG PHE B 76 0.702 14.204 -18.538 1.00 0.00 C ATOM 2684 CD1 PHE B 76 0.573 15.366 -19.308 1.00 0.00 C ATOM 2685 CD2 PHE B 76 -0.326 13.253 -18.531 1.00 0.00 C ATOM 2686 CE1 PHE B 76 -0.584 15.579 -20.067 1.00 0.00 C ATOM 2687 CE2 PHE B 76 -1.483 13.468 -19.290 1.00 0.00 C ATOM 2688 CZ PHE B 76 -1.611 14.630 -20.057 1.00 0.00 C ATOM 0 H PHE B 76 3.943 14.108 -16.232 1.00 0.00 H new ATOM 0 HA PHE B 76 1.666 15.803 -16.640 1.00 0.00 H new ATOM 0 HB2 PHE B 76 2.833 14.267 -18.316 1.00 0.00 H new ATOM 0 HB3 PHE B 76 2.070 12.906 -17.519 1.00 0.00 H new ATOM 0 HD1 PHE B 76 1.366 16.099 -19.317 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -0.227 12.354 -17.941 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -0.683 16.476 -20.660 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -2.277 12.736 -19.283 1.00 0.00 H new ATOM 0 HZ PHE B 76 -2.504 14.795 -20.642 1.00 0.00 H new ATOM 2698 N VAL B 77 1.178 13.143 -14.814 1.00 0.00 N ATOM 2699 CA VAL B 77 0.214 12.478 -13.885 1.00 0.00 C ATOM 2700 C VAL B 77 -0.233 13.456 -12.804 1.00 0.00 C ATOM 2701 O VAL B 77 -1.368 13.461 -12.385 1.00 0.00 O ATOM 2702 CB VAL B 77 0.902 11.273 -13.207 1.00 0.00 C ATOM 2703 CG1 VAL B 77 -0.118 10.175 -12.898 1.00 0.00 C ATOM 2704 CG2 VAL B 77 1.978 10.723 -14.133 1.00 0.00 C ATOM 0 H VAL B 77 2.099 12.705 -14.852 1.00 0.00 H new ATOM 0 HA VAL B 77 -0.652 12.146 -14.457 1.00 0.00 H new ATOM 0 HB VAL B 77 1.351 11.604 -12.270 1.00 0.00 H new ATOM 0 HG11 VAL B 77 0.386 9.334 -12.421 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -0.883 10.567 -12.228 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -0.584 9.840 -13.825 1.00 0.00 H new ATOM 0 HG21 VAL B 77 2.466 9.872 -13.658 1.00 0.00 H new ATOM 0 HG22 VAL B 77 1.523 10.404 -15.070 1.00 0.00 H new ATOM 0 HG23 VAL B 77 2.716 11.499 -14.334 1.00 0.00 H new ATOM 2714 N SER B 78 0.675 14.244 -12.317 1.00 0.00 N ATOM 2715 CA SER B 78 0.329 15.187 -11.222 1.00 0.00 C ATOM 2716 C SER B 78 -0.687 16.220 -11.688 1.00 0.00 C ATOM 2717 O SER B 78 -1.576 16.597 -10.953 1.00 0.00 O ATOM 2718 CB SER B 78 1.591 15.909 -10.768 1.00 0.00 C ATOM 2719 OG SER B 78 1.992 16.834 -11.770 1.00 0.00 O ATOM 0 H SER B 78 1.645 14.278 -12.629 1.00 0.00 H new ATOM 0 HA SER B 78 -0.105 14.616 -10.401 1.00 0.00 H new ATOM 0 HB2 SER B 78 1.407 16.431 -9.829 1.00 0.00 H new ATOM 0 HB3 SER B 78 2.388 15.189 -10.582 1.00 0.00 H new ATOM 0 HG SER B 78 2.515 16.368 -12.455 1.00 0.00 H new ATOM 2725 N MET B 79 -0.553 16.713 -12.883 1.00 0.00 N ATOM 2726 CA MET B 79 -1.513 17.754 -13.341 1.00 0.00 C ATOM 2727 C MET B 79 -2.873 17.133 -13.671 1.00 0.00 C ATOM 2728 O MET B 79 -3.907 17.694 -13.368 1.00 0.00 O ATOM 2729 CB MET B 79 -0.956 18.444 -14.577 1.00 0.00 C ATOM 2730 CG MET B 79 0.486 18.894 -14.318 1.00 0.00 C ATOM 2731 SD MET B 79 0.978 20.116 -15.565 1.00 0.00 S ATOM 2732 CE MET B 79 0.374 19.237 -17.027 1.00 0.00 C ATOM 0 H MET B 79 0.167 16.447 -13.555 1.00 0.00 H new ATOM 0 HA MET B 79 -1.650 18.479 -12.539 1.00 0.00 H new ATOM 0 HB2 MET B 79 -0.987 17.764 -15.429 1.00 0.00 H new ATOM 0 HB3 MET B 79 -1.574 19.304 -14.834 1.00 0.00 H new ATOM 0 HG2 MET B 79 0.569 19.325 -13.320 1.00 0.00 H new ATOM 0 HG3 MET B 79 1.157 18.035 -14.352 1.00 0.00 H new ATOM 0 HE1 MET B 79 0.820 19.670 -17.922 1.00 0.00 H new ATOM 0 HE2 MET B 79 0.649 18.184 -16.958 1.00 0.00 H new ATOM 0 HE3 MET B 79 -0.711 19.326 -17.083 1.00 0.00 H new ATOM 2742 N VAL B 80 -2.885 15.988 -14.292 1.00 0.00 N ATOM 2743 CA VAL B 80 -4.191 15.349 -14.639 1.00 0.00 C ATOM 2744 C VAL B 80 -4.964 15.064 -13.355 1.00 0.00 C ATOM 2745 O VAL B 80 -6.164 15.236 -13.281 1.00 0.00 O ATOM 2746 CB VAL B 80 -3.970 14.040 -15.395 1.00 0.00 C ATOM 2747 CG1 VAL B 80 -5.330 13.420 -15.736 1.00 0.00 C ATOM 2748 CG2 VAL B 80 -3.201 14.313 -16.685 1.00 0.00 C ATOM 0 H VAL B 80 -2.055 15.467 -14.574 1.00 0.00 H new ATOM 0 HA VAL B 80 -4.755 16.029 -15.278 1.00 0.00 H new ATOM 0 HB VAL B 80 -3.396 13.354 -14.772 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -5.179 12.485 -16.276 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -5.881 13.223 -14.816 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.899 14.111 -16.359 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -3.046 13.377 -17.221 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -3.772 14.999 -17.311 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -2.235 14.759 -16.446 1.00 0.00 H new ATOM 2758 N THR B 81 -4.275 14.628 -12.344 1.00 0.00 N ATOM 2759 CA THR B 81 -4.942 14.324 -11.051 1.00 0.00 C ATOM 2760 C THR B 81 -5.595 15.593 -10.547 1.00 0.00 C ATOM 2761 O THR B 81 -6.686 15.585 -10.014 1.00 0.00 O ATOM 2762 CB THR B 81 -3.902 13.871 -10.028 1.00 0.00 C ATOM 2763 OG1 THR B 81 -3.247 12.710 -10.502 1.00 0.00 O ATOM 2764 CG2 THR B 81 -4.582 13.582 -8.680 1.00 0.00 C ATOM 0 H THR B 81 -3.268 14.467 -12.357 1.00 0.00 H new ATOM 0 HA THR B 81 -5.680 13.535 -11.191 1.00 0.00 H new ATOM 0 HB THR B 81 -3.167 14.663 -9.886 1.00 0.00 H new ATOM 0 HG1 THR B 81 -2.659 12.948 -11.249 1.00 0.00 H new ATOM 0 HG21 THR B 81 -3.833 13.260 -7.956 1.00 0.00 H new ATOM 0 HG22 THR B 81 -5.071 14.486 -8.318 1.00 0.00 H new ATOM 0 HG23 THR B 81 -5.325 12.795 -8.809 1.00 0.00 H new ATOM 2772 N THR B 82 -4.921 16.686 -10.710 1.00 0.00 N ATOM 2773 CA THR B 82 -5.472 17.972 -10.244 1.00 0.00 C ATOM 2774 C THR B 82 -6.873 18.142 -10.837 1.00 0.00 C ATOM 2775 O THR B 82 -7.780 18.622 -10.186 1.00 0.00 O ATOM 2776 CB THR B 82 -4.547 19.099 -10.714 1.00 0.00 C ATOM 2777 OG1 THR B 82 -3.198 18.672 -10.588 1.00 0.00 O ATOM 2778 CG2 THR B 82 -4.766 20.330 -9.842 1.00 0.00 C ATOM 0 H THR B 82 -4.003 16.742 -11.151 1.00 0.00 H new ATOM 0 HA THR B 82 -5.539 17.999 -9.156 1.00 0.00 H new ATOM 0 HB THR B 82 -4.764 19.345 -11.753 1.00 0.00 H new ATOM 0 HG1 THR B 82 -2.599 19.434 -10.734 1.00 0.00 H new ATOM 0 HG21 THR B 82 -4.109 21.133 -10.175 1.00 0.00 H new ATOM 0 HG22 THR B 82 -5.804 20.653 -9.923 1.00 0.00 H new ATOM 0 HG23 THR B 82 -4.542 20.085 -8.804 1.00 0.00 H new ATOM 2786 N ALA B 83 -7.064 17.721 -12.058 1.00 0.00 N ATOM 2787 CA ALA B 83 -8.414 17.822 -12.676 1.00 0.00 C ATOM 2788 C ALA B 83 -9.386 16.967 -11.854 1.00 0.00 C ATOM 2789 O ALA B 83 -10.520 17.334 -11.631 1.00 0.00 O ATOM 2790 CB ALA B 83 -8.354 17.321 -14.130 1.00 0.00 C ATOM 0 H ALA B 83 -6.343 17.312 -12.653 1.00 0.00 H new ATOM 0 HA ALA B 83 -8.754 18.858 -12.683 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -9.343 17.395 -14.582 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -7.650 17.931 -14.696 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -8.026 16.282 -14.143 1.00 0.00 H new ATOM 2796 N CYS B 84 -8.939 15.820 -11.411 1.00 0.00 N ATOM 2797 CA CYS B 84 -9.816 14.918 -10.608 1.00 0.00 C ATOM 2798 C CYS B 84 -10.280 15.629 -9.331 1.00 0.00 C ATOM 2799 O CYS B 84 -11.402 15.461 -8.899 1.00 0.00 O ATOM 2800 CB CYS B 84 -9.034 13.659 -10.224 1.00 0.00 C ATOM 2801 SG CYS B 84 -10.165 12.443 -9.503 1.00 0.00 S ATOM 0 H CYS B 84 -7.996 15.467 -11.573 1.00 0.00 H new ATOM 0 HA CYS B 84 -10.687 14.649 -11.205 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -8.544 13.240 -11.103 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -8.249 13.909 -9.511 1.00 0.00 H new ATOM 0 HG CYS B 84 -9.502 11.373 -9.179 1.00 0.00 H new ATOM 2807 N HIS B 85 -9.438 16.420 -8.714 1.00 0.00 N ATOM 2808 CA HIS B 85 -9.868 17.116 -7.466 1.00 0.00 C ATOM 2809 C HIS B 85 -11.069 17.997 -7.799 1.00 0.00 C ATOM 2810 O HIS B 85 -12.035 18.054 -7.065 1.00 0.00 O ATOM 2811 CB HIS B 85 -8.719 17.988 -6.955 1.00 0.00 C ATOM 2812 CG HIS B 85 -9.129 18.689 -5.688 1.00 0.00 C ATOM 2813 ND1 HIS B 85 -8.492 19.841 -5.244 1.00 0.00 N ATOM 2814 CD2 HIS B 85 -10.095 18.410 -4.753 1.00 0.00 C ATOM 2815 CE1 HIS B 85 -9.077 20.208 -4.088 1.00 0.00 C ATOM 2816 NE2 HIS B 85 -10.057 19.369 -3.748 1.00 0.00 N ATOM 0 H HIS B 85 -8.483 16.612 -9.017 1.00 0.00 H new ATOM 0 HA HIS B 85 -10.137 16.391 -6.698 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -7.838 17.372 -6.771 1.00 0.00 H new ATOM 0 HB3 HIS B 85 -8.443 18.721 -7.713 1.00 0.00 H new ATOM 0 HD1 HIS B 85 -7.722 20.321 -5.709 1.00 0.00 H new ATOM 0 HD2 HIS B 85 -10.778 17.575 -4.792 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -8.789 21.073 -3.509 1.00 0.00 H new ATOM 2825 N GLU B 86 -11.035 18.653 -8.923 1.00 0.00 N ATOM 2826 CA GLU B 86 -12.193 19.492 -9.328 1.00 0.00 C ATOM 2827 C GLU B 86 -13.418 18.589 -9.479 1.00 0.00 C ATOM 2828 O GLU B 86 -14.522 18.948 -9.122 1.00 0.00 O ATOM 2829 CB GLU B 86 -11.893 20.189 -10.659 1.00 0.00 C ATOM 2830 CG GLU B 86 -10.834 21.273 -10.442 1.00 0.00 C ATOM 2831 CD GLU B 86 -10.497 21.937 -11.778 1.00 0.00 C ATOM 2832 OE1 GLU B 86 -11.106 21.572 -12.769 1.00 0.00 O ATOM 2833 OE2 GLU B 86 -9.636 22.802 -11.787 1.00 0.00 O ATOM 0 H GLU B 86 -10.254 18.644 -9.579 1.00 0.00 H new ATOM 0 HA GLU B 86 -12.382 20.254 -8.572 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -11.540 19.462 -11.390 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -12.804 20.631 -11.063 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -11.201 22.018 -9.737 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -9.936 20.836 -10.005 1.00 0.00 H new ATOM 2840 N PHE B 87 -13.221 17.418 -10.021 1.00 0.00 N ATOM 2841 CA PHE B 87 -14.357 16.472 -10.220 1.00 0.00 C ATOM 2842 C PHE B 87 -14.671 15.734 -8.916 1.00 0.00 C ATOM 2843 O PHE B 87 -15.771 15.255 -8.719 1.00 0.00 O ATOM 2844 CB PHE B 87 -13.979 15.448 -11.292 1.00 0.00 C ATOM 2845 CG PHE B 87 -15.180 14.591 -11.610 1.00 0.00 C ATOM 2846 CD1 PHE B 87 -15.419 13.421 -10.878 1.00 0.00 C ATOM 2847 CD2 PHE B 87 -16.058 14.966 -12.635 1.00 0.00 C ATOM 2848 CE1 PHE B 87 -16.533 12.627 -11.172 1.00 0.00 C ATOM 2849 CE2 PHE B 87 -17.172 14.171 -12.928 1.00 0.00 C ATOM 2850 CZ PHE B 87 -17.410 13.002 -12.196 1.00 0.00 C ATOM 0 H PHE B 87 -12.315 17.073 -10.337 1.00 0.00 H new ATOM 0 HA PHE B 87 -15.235 17.037 -10.531 1.00 0.00 H new ATOM 0 HB2 PHE B 87 -13.633 15.957 -12.191 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -13.156 14.825 -10.942 1.00 0.00 H new ATOM 0 HD1 PHE B 87 -14.743 13.132 -10.087 1.00 0.00 H new ATOM 0 HD2 PHE B 87 -15.875 15.869 -13.199 1.00 0.00 H new ATOM 0 HE1 PHE B 87 -16.716 11.724 -10.608 1.00 0.00 H new ATOM 0 HE2 PHE B 87 -17.848 14.460 -13.719 1.00 0.00 H new ATOM 0 HZ PHE B 87 -18.270 12.389 -12.421 1.00 0.00 H new ATOM 2860 N PHE B 88 -13.717 15.628 -8.024 1.00 0.00 N ATOM 2861 CA PHE B 88 -13.968 14.908 -6.735 1.00 0.00 C ATOM 2862 C PHE B 88 -14.387 15.937 -5.687 1.00 0.00 C ATOM 2863 O PHE B 88 -14.328 15.712 -4.495 1.00 0.00 O ATOM 2864 CB PHE B 88 -12.684 14.162 -6.295 1.00 0.00 C ATOM 2865 CG PHE B 88 -13.028 12.787 -5.747 1.00 0.00 C ATOM 2866 CD1 PHE B 88 -14.153 12.620 -4.929 1.00 0.00 C ATOM 2867 CD2 PHE B 88 -12.220 11.684 -6.059 1.00 0.00 C ATOM 2868 CE1 PHE B 88 -14.470 11.354 -4.424 1.00 0.00 C ATOM 2869 CE2 PHE B 88 -12.538 10.417 -5.551 1.00 0.00 C ATOM 2870 CZ PHE B 88 -13.663 10.253 -4.734 1.00 0.00 C ATOM 0 H PHE B 88 -12.777 16.008 -8.132 1.00 0.00 H new ATOM 0 HA PHE B 88 -14.761 14.170 -6.855 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -12.006 14.063 -7.142 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -12.162 14.743 -5.535 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -14.776 13.469 -4.688 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -11.353 11.811 -6.690 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -15.338 11.226 -3.794 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -11.915 9.567 -5.790 1.00 0.00 H new ATOM 0 HZ PHE B 88 -13.908 9.277 -4.343 1.00 0.00 H new ATOM 2880 N GLU B 89 -14.818 17.067 -6.145 1.00 0.00 N ATOM 2881 CA GLU B 89 -15.270 18.141 -5.225 1.00 0.00 C ATOM 2882 C GLU B 89 -16.777 17.975 -5.028 1.00 0.00 C ATOM 2883 O GLU B 89 -17.235 16.975 -4.514 1.00 0.00 O ATOM 2884 CB GLU B 89 -14.965 19.490 -5.881 1.00 0.00 C ATOM 2885 CG GLU B 89 -15.189 20.635 -4.885 1.00 0.00 C ATOM 2886 CD GLU B 89 -14.794 21.962 -5.537 1.00 0.00 C ATOM 2887 OE1 GLU B 89 -14.189 21.921 -6.596 1.00 0.00 O ATOM 2888 OE2 GLU B 89 -15.093 22.995 -4.960 1.00 0.00 O ATOM 0 H GLU B 89 -14.879 17.300 -7.136 1.00 0.00 H new ATOM 0 HA GLU B 89 -14.764 18.089 -4.261 1.00 0.00 H new ATOM 0 HB2 GLU B 89 -13.934 19.504 -6.235 1.00 0.00 H new ATOM 0 HB3 GLU B 89 -15.603 19.629 -6.754 1.00 0.00 H new ATOM 0 HG2 GLU B 89 -16.234 20.665 -4.578 1.00 0.00 H new ATOM 0 HG3 GLU B 89 -14.597 20.469 -3.985 1.00 0.00 H new ATOM 2895 N HIS B 90 -17.555 18.920 -5.468 1.00 0.00 N ATOM 2896 CA HIS B 90 -19.029 18.777 -5.340 1.00 0.00 C ATOM 2897 C HIS B 90 -19.484 17.717 -6.337 1.00 0.00 C ATOM 2898 O HIS B 90 -20.315 16.882 -6.044 1.00 0.00 O ATOM 2899 CB HIS B 90 -19.714 20.112 -5.650 1.00 0.00 C ATOM 2900 CG HIS B 90 -19.456 21.080 -4.528 1.00 0.00 C ATOM 2901 ND1 HIS B 90 -20.211 21.076 -3.362 1.00 0.00 N ATOM 2902 CD2 HIS B 90 -18.536 22.089 -4.374 1.00 0.00 C ATOM 2903 CE1 HIS B 90 -19.737 22.053 -2.567 1.00 0.00 C ATOM 2904 NE2 HIS B 90 -18.718 22.698 -3.137 1.00 0.00 N ATOM 0 H HIS B 90 -17.236 19.783 -5.909 1.00 0.00 H new ATOM 0 HA HIS B 90 -19.294 18.484 -4.324 1.00 0.00 H new ATOM 0 HB2 HIS B 90 -19.336 20.518 -6.589 1.00 0.00 H new ATOM 0 HB3 HIS B 90 -20.786 19.962 -5.776 1.00 0.00 H new ATOM 0 HD2 HIS B 90 -17.787 22.366 -5.101 1.00 0.00 H new ATOM 0 HE1 HIS B 90 -20.132 22.286 -1.589 1.00 0.00 H new ATOM 0 HE2 HIS B 90 -18.184 23.475 -2.747 1.00 0.00 H new ATOM 2913 N GLU B 91 -18.902 17.740 -7.508 1.00 0.00 N ATOM 2914 CA GLU B 91 -19.240 16.742 -8.561 1.00 0.00 C ATOM 2915 CB GLU B 91 -20.722 16.850 -8.955 1.00 0.00 C ATOM 2916 CG GLU B 91 -21.039 15.819 -10.043 1.00 0.00 C ATOM 2917 CD GLU B 91 -22.538 15.843 -10.350 1.00 0.00 C ATOM 2918 OE1 GLU B 91 -23.265 16.479 -9.605 1.00 0.00 O ATOM 2919 OE2 GLU B 91 -22.933 15.218 -11.320 1.00 0.00 O ATOM 0 H GLU B 91 -18.194 18.422 -7.782 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -21.354 16.680 -8.083 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -20.941 17.855 -9.317 1.00 0.00 H new ATOM 0 HG2 GLU B 91 -20.469 16.040 -10.945 1.00 0.00 H new ATOM 0 HG3 GLU B 91 -20.741 14.824 -9.713 1.00 0.00 H new TER 2926 GLU B 91 ATOM 2927 N SER X 92 29.806 40.441 7.395 1.00 0.00 N ATOM 2928 CA SER X 92 29.662 39.058 6.856 1.00 0.00 C ATOM 2929 C SER X 92 30.921 38.247 7.176 1.00 0.00 C ATOM 2930 O SER X 92 31.980 38.483 6.630 1.00 0.00 O ATOM 2931 CB SER X 92 29.468 39.119 5.341 1.00 0.00 C ATOM 2932 OG SER X 92 28.272 39.831 5.052 1.00 0.00 O ATOM 0 HA SER X 92 28.797 38.580 7.316 1.00 0.00 H new ATOM 0 HB2 SER X 92 30.321 39.611 4.873 1.00 0.00 H new ATOM 0 HB3 SER X 92 29.415 38.112 4.928 1.00 0.00 H new ATOM 0 HG SER X 92 28.127 40.518 5.736 1.00 0.00 H new ATOM 2940 N HIS X 93 30.811 37.289 8.056 1.00 0.00 N ATOM 2941 CA HIS X 93 31.996 36.457 8.412 1.00 0.00 C ATOM 2942 C HIS X 93 32.257 35.434 7.302 1.00 0.00 C ATOM 2943 O HIS X 93 31.392 35.139 6.503 1.00 0.00 O ATOM 2944 CB HIS X 93 31.727 35.734 9.734 1.00 0.00 C ATOM 2945 CG HIS X 93 30.517 34.854 9.587 1.00 0.00 C ATOM 2946 ND1 HIS X 93 29.224 35.358 9.650 1.00 0.00 N ATOM 2947 CD2 HIS X 93 30.384 33.504 9.378 1.00 0.00 C ATOM 2948 CE1 HIS X 93 28.378 34.325 9.482 1.00 0.00 C ATOM 2949 NE2 HIS X 93 29.034 33.176 9.313 1.00 0.00 N ATOM 0 H HIS X 93 29.949 37.046 8.545 1.00 0.00 H new ATOM 0 HA HIS X 93 32.873 37.095 8.521 1.00 0.00 H new ATOM 0 HB2 HIS X 93 32.593 35.135 10.016 1.00 0.00 H new ATOM 0 HB3 HIS X 93 31.567 36.460 10.532 1.00 0.00 H new ATOM 0 HD2 HIS X 93 31.201 32.805 9.279 1.00 0.00 H new ATOM 0 HE1 HIS X 93 27.302 34.415 9.484 1.00 0.00 H new ATOM 0 HE2 HIS X 93 28.630 32.251 9.167 1.00 0.00 H new ATOM 2958 N LEU X 94 33.447 34.895 7.242 1.00 0.00 N ATOM 2959 CA LEU X 94 33.764 33.896 6.178 1.00 0.00 C ATOM 2960 C LEU X 94 33.199 32.530 6.573 1.00 0.00 C ATOM 2961 O LEU X 94 32.999 32.242 7.736 1.00 0.00 O ATOM 2962 CB LEU X 94 35.285 33.781 6.006 1.00 0.00 C ATOM 2963 CG LEU X 94 35.866 35.052 5.357 1.00 0.00 C ATOM 2964 CD1 LEU X 94 35.339 35.216 3.918 1.00 0.00 C ATOM 2965 CD2 LEU X 94 35.493 36.288 6.192 1.00 0.00 C ATOM 0 H LEU X 94 34.213 35.103 7.883 1.00 0.00 H new ATOM 0 HA LEU X 94 33.316 34.223 5.239 1.00 0.00 H new ATOM 0 HB2 LEU X 94 35.753 33.618 6.977 1.00 0.00 H new ATOM 0 HB3 LEU X 94 35.520 32.914 5.389 1.00 0.00 H new ATOM 0 HG LEU X 94 36.951 34.956 5.322 1.00 0.00 H new ATOM 0 HD11 LEU X 94 35.761 36.119 3.477 1.00 0.00 H new ATOM 0 HD12 LEU X 94 35.631 34.351 3.323 1.00 0.00 H new ATOM 0 HD13 LEU X 94 34.252 35.294 3.935 1.00 0.00 H new ATOM 0 HD21 LEU X 94 35.908 37.181 5.725 1.00 0.00 H new ATOM 0 HD22 LEU X 94 34.408 36.377 6.245 1.00 0.00 H new ATOM 0 HD23 LEU X 94 35.898 36.183 7.198 1.00 0.00 H new ATOM 2977 N LYS X 95 32.937 31.682 5.609 1.00 0.00 N ATOM 2978 CA LYS X 95 32.380 30.330 5.922 1.00 0.00 C ATOM 2979 C LYS X 95 33.516 29.301 5.944 1.00 0.00 C ATOM 2980 O LYS X 95 33.898 28.764 4.923 1.00 0.00 O ATOM 2981 CB LYS X 95 31.374 29.942 4.834 1.00 0.00 C ATOM 2982 CG LYS X 95 30.136 30.840 4.934 1.00 0.00 C ATOM 2983 CD LYS X 95 29.120 30.457 3.845 1.00 0.00 C ATOM 2984 CE LYS X 95 29.610 30.913 2.463 1.00 0.00 C ATOM 2985 NZ LYS X 95 28.458 30.940 1.516 1.00 0.00 N ATOM 0 H LYS X 95 33.085 31.868 4.617 1.00 0.00 H new ATOM 0 HA LYS X 95 31.889 30.352 6.895 1.00 0.00 H new ATOM 0 HB2 LYS X 95 31.831 30.044 3.850 1.00 0.00 H new ATOM 0 HB3 LYS X 95 31.087 28.896 4.946 1.00 0.00 H new ATOM 0 HG2 LYS X 95 29.681 30.738 5.919 1.00 0.00 H new ATOM 0 HG3 LYS X 95 30.425 31.885 4.823 1.00 0.00 H new ATOM 0 HD2 LYS X 95 28.969 29.378 3.845 1.00 0.00 H new ATOM 0 HD3 LYS X 95 28.155 30.914 4.064 1.00 0.00 H new ATOM 0 HE2 LYS X 95 30.062 31.903 2.533 1.00 0.00 H new ATOM 0 HE3 LYS X 95 30.381 30.236 2.096 1.00 0.00 H new ATOM 0 HZ1 LYS X 95 28.786 31.249 0.579 1.00 0.00 H new ATOM 0 HZ2 LYS X 95 28.047 29.988 1.443 1.00 0.00 H new ATOM 0 HZ3 LYS X 95 27.737 31.603 1.866 1.00 0.00 H new ATOM 2999 N SER X 96 34.054 29.018 7.100 1.00 0.00 N ATOM 3000 CA SER X 96 35.158 28.019 7.185 1.00 0.00 C ATOM 3001 C SER X 96 34.602 26.611 6.958 1.00 0.00 C ATOM 3002 O SER X 96 35.217 25.791 6.305 1.00 0.00 O ATOM 3003 CB SER X 96 35.808 28.090 8.566 1.00 0.00 C ATOM 3004 OG SER X 96 34.887 27.624 9.544 1.00 0.00 O ATOM 0 H SER X 96 33.777 29.435 7.989 1.00 0.00 H new ATOM 0 HA SER X 96 35.901 28.242 6.419 1.00 0.00 H new ATOM 0 HB2 SER X 96 36.714 27.484 8.586 1.00 0.00 H new ATOM 0 HB3 SER X 96 36.105 29.115 8.789 1.00 0.00 H new ATOM 0 HG SER X 96 35.302 27.667 10.431 1.00 0.00 H new ATOM 3010 N LYS X 97 33.443 26.324 7.503 1.00 0.00 N ATOM 3011 CA LYS X 97 32.835 24.964 7.335 1.00 0.00 C ATOM 3012 C LYS X 97 31.365 25.104 6.935 1.00 0.00 C ATOM 3013 O LYS X 97 30.568 25.674 7.654 1.00 0.00 O ATOM 3014 CB LYS X 97 32.932 24.203 8.663 1.00 0.00 C ATOM 3015 CG LYS X 97 32.325 22.806 8.502 1.00 0.00 C ATOM 3016 CD LYS X 97 32.645 21.953 9.737 1.00 0.00 C ATOM 3017 CE LYS X 97 31.861 22.463 10.950 1.00 0.00 C ATOM 3018 NZ LYS X 97 31.889 21.431 12.025 1.00 0.00 N ATOM 0 H LYS X 97 32.890 26.976 8.059 1.00 0.00 H new ATOM 0 HA LYS X 97 33.369 24.418 6.557 1.00 0.00 H new ATOM 0 HB2 LYS X 97 33.974 24.124 8.973 1.00 0.00 H new ATOM 0 HB3 LYS X 97 32.407 24.750 9.446 1.00 0.00 H new ATOM 0 HG2 LYS X 97 31.246 22.882 8.371 1.00 0.00 H new ATOM 0 HG3 LYS X 97 32.722 22.328 7.606 1.00 0.00 H new ATOM 0 HD2 LYS X 97 32.392 20.911 9.543 1.00 0.00 H new ATOM 0 HD3 LYS X 97 33.714 21.988 9.945 1.00 0.00 H new ATOM 0 HE2 LYS X 97 32.296 23.394 11.313 1.00 0.00 H new ATOM 0 HE3 LYS X 97 30.831 22.681 10.666 1.00 0.00 H new ATOM 0 HZ1 LYS X 97 31.357 21.775 12.850 1.00 0.00 H new ATOM 0 HZ2 LYS X 97 31.455 20.553 11.675 1.00 0.00 H new ATOM 0 HZ3 LYS X 97 32.874 21.244 12.301 1.00 0.00 H new ATOM 3032 N LYS X 98 31.002 24.580 5.789 1.00 0.00 N ATOM 3033 CA LYS X 98 29.583 24.663 5.315 1.00 0.00 C ATOM 3034 C LYS X 98 28.974 23.258 5.291 1.00 0.00 C ATOM 3035 O LYS X 98 27.887 23.051 4.788 1.00 0.00 O ATOM 3036 CB LYS X 98 29.561 25.259 3.906 1.00 0.00 C ATOM 3037 CG LYS X 98 30.404 24.395 2.965 1.00 0.00 C ATOM 3038 CD LYS X 98 30.466 25.054 1.585 1.00 0.00 C ATOM 3039 CE LYS X 98 31.180 24.121 0.608 1.00 0.00 C ATOM 3040 NZ LYS X 98 31.353 24.808 -0.702 1.00 0.00 N ATOM 0 H LYS X 98 31.635 24.093 5.155 1.00 0.00 H new ATOM 0 HA LYS X 98 29.003 25.295 5.987 1.00 0.00 H new ATOM 0 HB2 LYS X 98 28.535 25.316 3.541 1.00 0.00 H new ATOM 0 HB3 LYS X 98 29.950 26.277 3.926 1.00 0.00 H new ATOM 0 HG2 LYS X 98 31.410 24.275 3.368 1.00 0.00 H new ATOM 0 HG3 LYS X 98 29.971 23.398 2.884 1.00 0.00 H new ATOM 0 HD2 LYS X 98 29.459 25.271 1.228 1.00 0.00 H new ATOM 0 HD3 LYS X 98 30.994 26.006 1.648 1.00 0.00 H new ATOM 0 HE2 LYS X 98 32.151 23.832 1.009 1.00 0.00 H new ATOM 0 HE3 LYS X 98 30.604 23.205 0.477 1.00 0.00 H new ATOM 0 HZ1 LYS X 98 31.839 24.172 -1.366 1.00 0.00 H new ATOM 0 HZ2 LYS X 98 30.421 25.063 -1.086 1.00 0.00 H new ATOM 0 HZ3 LYS X 98 31.920 25.670 -0.570 1.00 0.00 H new ATOM 3054 N GLY X 99 29.669 22.292 5.828 1.00 0.00 N ATOM 3055 CA GLY X 99 29.137 20.898 5.834 1.00 0.00 C ATOM 3056 C GLY X 99 27.959 20.797 6.803 1.00 0.00 C ATOM 3057 O GLY X 99 27.936 19.956 7.680 1.00 0.00 O ATOM 0 H GLY X 99 30.584 22.408 6.264 1.00 0.00 H new ATOM 0 HA2 GLY X 99 28.819 20.616 4.830 1.00 0.00 H new ATOM 0 HA3 GLY X 99 29.922 20.201 6.127 1.00 0.00 H new ATOM 3061 N GLN X 100 26.978 21.643 6.652 1.00 0.00 N ATOM 3062 CA GLN X 100 25.801 21.592 7.565 1.00 0.00 C ATOM 3063 C GLN X 100 24.860 20.476 7.112 1.00 0.00 C ATOM 3064 O GLN X 100 24.912 20.029 5.984 1.00 0.00 O ATOM 3065 CB GLN X 100 25.055 22.932 7.531 1.00 0.00 C ATOM 3066 CG GLN X 100 25.936 24.046 8.109 1.00 0.00 C ATOM 3067 CD GLN X 100 26.271 23.738 9.572 1.00 0.00 C ATOM 3068 OE1 GLN X 100 27.419 23.785 9.966 1.00 0.00 O ATOM 3069 NE2 GLN X 100 25.313 23.409 10.396 1.00 0.00 N ATOM 0 H GLN X 100 26.940 22.368 5.936 1.00 0.00 H new ATOM 0 HA GLN X 100 26.142 21.398 8.582 1.00 0.00 H new ATOM 0 HB2 GLN X 100 24.776 23.175 6.506 1.00 0.00 H new ATOM 0 HB3 GLN X 100 24.131 22.856 8.104 1.00 0.00 H new ATOM 0 HG2 GLN X 100 26.854 24.135 7.527 1.00 0.00 H new ATOM 0 HG3 GLN X 100 25.420 25.004 8.039 1.00 0.00 H new ATOM 0 HE21 GLN X 100 24.348 23.369 10.067 1.00 0.00 H new ATOM 0 HE22 GLN X 100 25.529 23.192 11.369 1.00 0.00 H new ATOM 3078 N SER X 101 24.004 20.017 7.986 1.00 0.00 N ATOM 3079 CA SER X 101 23.065 18.926 7.605 1.00 0.00 C ATOM 3080 C SER X 101 22.375 19.293 6.296 1.00 0.00 C ATOM 3081 O SER X 101 21.951 18.434 5.554 1.00 0.00 O ATOM 3082 CB SER X 101 22.013 18.741 8.696 1.00 0.00 C ATOM 3083 OG SER X 101 21.272 19.945 8.840 1.00 0.00 O ATOM 0 H SER X 101 23.916 20.351 8.946 1.00 0.00 H new ATOM 0 HA SER X 101 23.622 17.997 7.483 1.00 0.00 H new ATOM 0 HB2 SER X 101 21.346 17.918 8.439 1.00 0.00 H new ATOM 0 HB3 SER X 101 22.492 18.480 9.639 1.00 0.00 H new ATOM 0 HG SER X 101 20.594 19.830 9.538 1.00 0.00 H new ATOM 3089 N THR X 102 22.269 20.567 6.008 1.00 0.00 N ATOM 3090 CA THR X 102 21.614 21.015 4.740 1.00 0.00 C ATOM 3091 C THR X 102 22.028 20.090 3.591 1.00 0.00 C ATOM 3092 O THR X 102 21.329 19.949 2.607 1.00 0.00 O ATOM 3093 CB THR X 102 22.040 22.455 4.430 1.00 0.00 C ATOM 3094 OG1 THR X 102 21.246 22.963 3.368 1.00 0.00 O ATOM 3095 CG2 THR X 102 23.517 22.491 4.028 1.00 0.00 C ATOM 0 H THR X 102 22.611 21.322 6.602 1.00 0.00 H new ATOM 0 HA THR X 102 20.531 20.976 4.855 1.00 0.00 H new ATOM 0 HB THR X 102 21.900 23.069 5.320 1.00 0.00 H new ATOM 0 HG1 THR X 102 21.516 23.884 3.169 1.00 0.00 H new ATOM 0 HG21 THR X 102 23.810 23.518 3.810 1.00 0.00 H new ATOM 0 HG22 THR X 102 24.126 22.106 4.846 1.00 0.00 H new ATOM 0 HG23 THR X 102 23.668 21.875 3.142 1.00 0.00 H new ATOM 3103 N SER X 103 23.158 19.451 3.719 1.00 0.00 N ATOM 3104 CA SER X 103 23.615 18.527 2.646 1.00 0.00 C ATOM 3105 C SER X 103 22.499 17.526 2.339 1.00 0.00 C ATOM 3106 O SER X 103 22.335 17.092 1.217 1.00 0.00 O ATOM 3107 CB SER X 103 24.850 17.766 3.124 1.00 0.00 C ATOM 3108 OG SER X 103 25.897 18.687 3.400 1.00 0.00 O ATOM 0 H SER X 103 23.784 19.529 4.521 1.00 0.00 H new ATOM 0 HA SER X 103 23.860 19.098 1.750 1.00 0.00 H new ATOM 0 HB2 SER X 103 24.612 17.191 4.019 1.00 0.00 H new ATOM 0 HB3 SER X 103 25.169 17.054 2.363 1.00 0.00 H new ATOM 0 HG SER X 103 25.704 19.161 4.235 1.00 0.00 H new ATOM 3114 N ARG X 104 21.727 17.158 3.327 1.00 0.00 N ATOM 3115 CA ARG X 104 20.623 16.189 3.083 1.00 0.00 C ATOM 3116 C ARG X 104 19.656 16.777 2.048 1.00 0.00 C ATOM 3117 O ARG X 104 19.172 16.091 1.162 1.00 0.00 O ATOM 3118 CB ARG X 104 19.872 15.929 4.403 1.00 0.00 C ATOM 3119 CG ARG X 104 19.516 17.272 5.111 1.00 0.00 C ATOM 3120 CD ARG X 104 17.999 17.413 5.275 1.00 0.00 C ATOM 3121 NE ARG X 104 17.349 17.406 3.936 1.00 0.00 N ATOM 3122 CZ ARG X 104 16.062 17.228 3.840 1.00 0.00 C ATOM 3123 NH1 ARG X 104 15.345 17.071 4.917 1.00 0.00 N ATOM 3124 NH2 ARG X 104 15.490 17.211 2.667 1.00 0.00 N ATOM 0 H ARG X 104 21.814 17.486 4.289 1.00 0.00 H new ATOM 0 HA ARG X 104 21.031 15.250 2.708 1.00 0.00 H new ATOM 0 HB2 ARG X 104 18.961 15.365 4.203 1.00 0.00 H new ATOM 0 HB3 ARG X 104 20.487 15.317 5.062 1.00 0.00 H new ATOM 0 HG2 ARG X 104 19.998 17.312 6.088 1.00 0.00 H new ATOM 0 HG3 ARG X 104 19.903 18.109 4.530 1.00 0.00 H new ATOM 0 HD2 ARG X 104 17.611 16.595 5.883 1.00 0.00 H new ATOM 0 HD3 ARG X 104 17.764 18.339 5.799 1.00 0.00 H new ATOM 0 HE ARG X 104 17.910 17.540 3.095 1.00 0.00 H new ATOM 0 HH11 ARG X 104 15.792 17.088 5.834 1.00 0.00 H new ATOM 0 HH12 ARG X 104 14.337 16.932 4.843 1.00 0.00 H new ATOM 0 HH21 ARG X 104 16.051 17.337 1.824 1.00 0.00 H new ATOM 0 HH22 ARG X 104 14.482 17.072 2.593 1.00 0.00 H new ATOM 3138 N HIS X 105 19.378 18.048 2.143 1.00 0.00 N ATOM 3139 CA HIS X 105 18.456 18.679 1.165 1.00 0.00 C ATOM 3140 C HIS X 105 19.053 18.558 -0.234 1.00 0.00 C ATOM 3141 O HIS X 105 18.362 18.304 -1.197 1.00 0.00 O ATOM 3142 CB HIS X 105 18.267 20.154 1.516 1.00 0.00 C ATOM 3143 CG HIS X 105 17.296 20.769 0.548 1.00 0.00 C ATOM 3144 ND1 HIS X 105 17.695 21.664 -0.435 1.00 0.00 N ATOM 3145 CD2 HIS X 105 15.940 20.621 0.392 1.00 0.00 C ATOM 3146 CE1 HIS X 105 16.598 22.015 -1.132 1.00 0.00 C ATOM 3147 NE2 HIS X 105 15.507 21.407 -0.668 1.00 0.00 N ATOM 0 H HIS X 105 19.751 18.675 2.856 1.00 0.00 H new ATOM 0 HA HIS X 105 17.489 18.177 1.196 1.00 0.00 H new ATOM 0 HB2 HIS X 105 17.895 20.253 2.536 1.00 0.00 H new ATOM 0 HB3 HIS X 105 19.223 20.676 1.473 1.00 0.00 H new ATOM 0 HD1 HIS X 105 18.646 21.995 -0.599 1.00 0.00 H new ATOM 0 HD2 HIS X 105 15.308 19.991 1.000 1.00 0.00 H new ATOM 0 HE1 HIS X 105 16.602 22.704 -1.964 1.00 0.00 H new ATOM 3156 N LYS X 106 20.339 18.740 -0.344 1.00 0.00 N ATOM 3157 CA LYS X 106 21.002 18.647 -1.675 1.00 0.00 C ATOM 3158 C LYS X 106 20.782 17.252 -2.258 1.00 0.00 C ATOM 3159 O LYS X 106 20.721 17.072 -3.462 1.00 0.00 O ATOM 3160 CB LYS X 106 22.507 18.902 -1.519 1.00 0.00 C ATOM 3161 CG LYS X 106 22.765 20.350 -1.061 1.00 0.00 C ATOM 3162 CD LYS X 106 22.759 21.318 -2.261 1.00 0.00 C ATOM 3163 CE LYS X 106 24.110 21.282 -2.989 1.00 0.00 C ATOM 3164 NZ LYS X 106 24.204 22.444 -3.918 1.00 0.00 N ATOM 0 H LYS X 106 20.963 18.950 0.435 1.00 0.00 H new ATOM 0 HA LYS X 106 20.575 19.394 -2.344 1.00 0.00 H new ATOM 0 HB2 LYS X 106 22.927 18.205 -0.794 1.00 0.00 H new ATOM 0 HB3 LYS X 106 23.013 18.719 -2.467 1.00 0.00 H new ATOM 0 HG2 LYS X 106 22.001 20.650 -0.343 1.00 0.00 H new ATOM 0 HG3 LYS X 106 23.725 20.407 -0.548 1.00 0.00 H new ATOM 0 HD2 LYS X 106 21.960 21.046 -2.951 1.00 0.00 H new ATOM 0 HD3 LYS X 106 22.552 22.331 -1.917 1.00 0.00 H new ATOM 0 HE2 LYS X 106 24.926 21.313 -2.267 1.00 0.00 H new ATOM 0 HE3 LYS X 106 24.211 20.350 -3.544 1.00 0.00 H new ATOM 0 HZ1 LYS X 106 25.119 22.421 -4.412 1.00 0.00 H new ATOM 0 HZ2 LYS X 106 23.433 22.395 -4.615 1.00 0.00 H new ATOM 0 HZ3 LYS X 106 24.125 23.329 -3.377 1.00 0.00 H new ATOM 3178 N LYS X 107 20.664 16.262 -1.423 1.00 0.00 N ATOM 3179 CA LYS X 107 20.450 14.890 -1.947 1.00 0.00 C ATOM 3180 C LYS X 107 19.159 14.881 -2.761 1.00 0.00 C ATOM 3181 O LYS X 107 19.082 14.266 -3.804 1.00 0.00 O ATOM 3182 CB LYS X 107 20.319 13.915 -0.777 1.00 0.00 C ATOM 3183 CG LYS X 107 20.117 12.491 -1.312 1.00 0.00 C ATOM 3184 CD LYS X 107 20.214 11.474 -0.164 1.00 0.00 C ATOM 3185 CE LYS X 107 18.906 11.452 0.636 1.00 0.00 C ATOM 3186 NZ LYS X 107 17.776 11.082 -0.263 1.00 0.00 N ATOM 0 H LYS X 107 20.706 16.343 -0.407 1.00 0.00 H new ATOM 0 HA LYS X 107 21.291 14.590 -2.572 1.00 0.00 H new ATOM 0 HB2 LYS X 107 21.213 13.957 -0.154 1.00 0.00 H new ATOM 0 HB3 LYS X 107 19.477 14.200 -0.146 1.00 0.00 H new ATOM 0 HG2 LYS X 107 19.144 12.411 -1.797 1.00 0.00 H new ATOM 0 HG3 LYS X 107 20.869 12.269 -2.069 1.00 0.00 H new ATOM 0 HD2 LYS X 107 20.421 10.481 -0.564 1.00 0.00 H new ATOM 0 HD3 LYS X 107 21.045 11.733 0.492 1.00 0.00 H new ATOM 0 HE2 LYS X 107 18.981 10.737 1.455 1.00 0.00 H new ATOM 0 HE3 LYS X 107 18.724 12.430 1.082 1.00 0.00 H new ATOM 0 HZ1 LYS X 107 17.146 10.416 0.227 1.00 0.00 H new ATOM 0 HZ2 LYS X 107 17.243 11.937 -0.520 1.00 0.00 H new ATOM 0 HZ3 LYS X 107 18.150 10.635 -1.124 1.00 0.00 H new ATOM 3200 N LEU X 108 18.144 15.566 -2.298 1.00 0.00 N ATOM 3201 CA LEU X 108 16.860 15.597 -3.064 1.00 0.00 C ATOM 3202 C LEU X 108 17.019 16.496 -4.310 1.00 0.00 C ATOM 3203 O LEU X 108 16.344 16.326 -5.308 1.00 0.00 O ATOM 3204 CB LEU X 108 15.723 16.130 -2.162 1.00 0.00 C ATOM 3205 CG LEU X 108 14.369 15.513 -2.583 1.00 0.00 C ATOM 3206 CD1 LEU X 108 14.175 14.145 -1.919 1.00 0.00 C ATOM 3207 CD2 LEU X 108 13.216 16.439 -2.168 1.00 0.00 C ATOM 0 H LEU X 108 18.147 16.101 -1.430 1.00 0.00 H new ATOM 0 HA LEU X 108 16.608 14.587 -3.386 1.00 0.00 H new ATOM 0 HB2 LEU X 108 15.932 15.888 -1.120 1.00 0.00 H new ATOM 0 HB3 LEU X 108 15.673 17.217 -2.233 1.00 0.00 H new ATOM 0 HG LEU X 108 14.371 15.391 -3.666 1.00 0.00 H new ATOM 0 HD11 LEU X 108 13.217 13.724 -2.226 1.00 0.00 H new ATOM 0 HD12 LEU X 108 14.980 13.476 -2.223 1.00 0.00 H new ATOM 0 HD13 LEU X 108 14.190 14.261 -0.835 1.00 0.00 H new ATOM 0 HD21 LEU X 108 12.267 15.996 -2.469 1.00 0.00 H new ATOM 0 HD22 LEU X 108 13.228 16.572 -1.086 1.00 0.00 H new ATOM 0 HD23 LEU X 108 13.334 17.408 -2.654 1.00 0.00 H new ATOM 3219 N MET X 109 17.901 17.454 -4.266 1.00 0.00 N ATOM 3220 CA MET X 109 18.080 18.353 -5.444 1.00 0.00 C ATOM 3221 C MET X 109 18.453 17.537 -6.681 1.00 0.00 C ATOM 3222 O MET X 109 18.231 17.968 -7.792 1.00 0.00 O ATOM 3223 CB MET X 109 19.149 19.417 -5.153 1.00 0.00 C ATOM 3224 CG MET X 109 18.510 20.598 -4.406 1.00 0.00 C ATOM 3225 SD MET X 109 17.441 19.975 -3.075 1.00 0.00 S ATOM 3226 CE MET X 109 15.842 20.592 -3.675 1.00 0.00 C ATOM 0 H MET X 109 18.505 17.655 -3.469 1.00 0.00 H new ATOM 0 HA MET X 109 17.137 18.863 -5.639 1.00 0.00 H new ATOM 0 HB2 MET X 109 19.952 18.986 -4.554 1.00 0.00 H new ATOM 0 HB3 MET X 109 19.596 19.762 -6.085 1.00 0.00 H new ATOM 0 HG2 MET X 109 19.286 21.241 -3.991 1.00 0.00 H new ATOM 0 HG3 MET X 109 17.928 21.207 -5.098 1.00 0.00 H new ATOM 0 HE1 MET X 109 15.064 20.349 -2.952 1.00 0.00 H new ATOM 0 HE2 MET X 109 15.894 21.673 -3.802 1.00 0.00 H new ATOM 0 HE3 MET X 109 15.607 20.125 -4.631 1.00 0.00 H new ATOM 3236 N PHE X 110 19.026 16.374 -6.510 1.00 0.00 N ATOM 3237 CA PHE X 110 19.412 15.545 -7.701 1.00 0.00 C ATOM 3238 C PHE X 110 18.296 15.630 -8.760 1.00 0.00 C ATOM 3239 O PHE X 110 18.545 15.764 -9.942 1.00 0.00 O ATOM 3240 CB PHE X 110 19.616 14.079 -7.255 1.00 0.00 C ATOM 3241 CG PHE X 110 18.302 13.311 -7.286 1.00 0.00 C ATOM 3242 CD1 PHE X 110 17.330 13.534 -6.303 1.00 0.00 C ATOM 3243 CD2 PHE X 110 18.060 12.384 -8.308 1.00 0.00 C ATOM 3244 CE1 PHE X 110 16.119 12.832 -6.342 1.00 0.00 C ATOM 3245 CE2 PHE X 110 16.850 11.681 -8.346 1.00 0.00 C ATOM 3246 CZ PHE X 110 15.879 11.906 -7.363 1.00 0.00 C ATOM 0 H PHE X 110 19.244 15.960 -5.604 1.00 0.00 H new ATOM 0 HA PHE X 110 20.341 15.918 -8.132 1.00 0.00 H new ATOM 0 HB2 PHE X 110 20.340 13.594 -7.909 1.00 0.00 H new ATOM 0 HB3 PHE X 110 20.031 14.056 -6.247 1.00 0.00 H new ATOM 0 HD1 PHE X 110 17.514 14.248 -5.514 1.00 0.00 H new ATOM 0 HD2 PHE X 110 18.808 12.211 -9.068 1.00 0.00 H new ATOM 0 HE1 PHE X 110 15.370 13.005 -5.584 1.00 0.00 H new ATOM 0 HE2 PHE X 110 16.666 10.965 -9.133 1.00 0.00 H new ATOM 0 HZ PHE X 110 14.945 11.365 -7.393 1.00 0.00 H new ATOM 3256 N LYS X 111 17.070 15.571 -8.318 1.00 0.00 N ATOM 3257 CA LYS X 111 15.914 15.667 -9.251 1.00 0.00 C ATOM 3258 C LYS X 111 15.817 17.098 -9.804 1.00 0.00 C ATOM 3259 O LYS X 111 15.445 17.303 -10.938 1.00 0.00 O ATOM 3260 CB LYS X 111 14.630 15.338 -8.476 1.00 0.00 C ATOM 3261 CG LYS X 111 14.285 16.520 -7.559 1.00 0.00 C ATOM 3262 CD LYS X 111 13.410 16.079 -6.395 1.00 0.00 C ATOM 3263 CE LYS X 111 13.226 17.275 -5.451 1.00 0.00 C ATOM 3264 NZ LYS X 111 11.978 17.093 -4.656 1.00 0.00 N ATOM 0 H LYS X 111 16.818 15.459 -7.336 1.00 0.00 H new ATOM 0 HA LYS X 111 16.046 14.969 -10.077 1.00 0.00 H new ATOM 0 HB2 LYS X 111 13.810 15.147 -9.169 1.00 0.00 H new ATOM 0 HB3 LYS X 111 14.767 14.431 -7.887 1.00 0.00 H new ATOM 0 HG2 LYS X 111 15.203 16.967 -7.178 1.00 0.00 H new ATOM 0 HG3 LYS X 111 13.770 17.290 -8.133 1.00 0.00 H new ATOM 0 HD2 LYS X 111 12.443 15.729 -6.758 1.00 0.00 H new ATOM 0 HD3 LYS X 111 13.873 15.246 -5.866 1.00 0.00 H new ATOM 0 HE2 LYS X 111 14.085 17.362 -4.785 1.00 0.00 H new ATOM 0 HE3 LYS X 111 13.173 18.200 -6.025 1.00 0.00 H new ATOM 0 HZ1 LYS X 111 11.947 17.798 -3.892 1.00 0.00 H new ATOM 0 HZ2 LYS X 111 11.151 17.216 -5.275 1.00 0.00 H new ATOM 0 HZ3 LYS X 111 11.964 16.137 -4.246 1.00 0.00 H new ATOM 3278 N THR X 112 16.114 18.092 -8.990 1.00 0.00 N ATOM 3279 CA THR X 112 16.001 19.506 -9.474 1.00 0.00 C ATOM 3280 C THR X 112 16.987 19.729 -10.618 1.00 0.00 C ATOM 3281 O THR X 112 16.760 20.536 -11.497 1.00 0.00 O ATOM 3282 CB THR X 112 16.304 20.502 -8.341 1.00 0.00 C ATOM 3283 OG1 THR X 112 17.555 20.192 -7.749 1.00 0.00 O ATOM 3284 CG2 THR X 112 15.201 20.443 -7.279 1.00 0.00 C ATOM 0 H THR X 112 16.425 17.984 -8.025 1.00 0.00 H new ATOM 0 HA THR X 112 14.980 19.673 -9.818 1.00 0.00 H new ATOM 0 HB THR X 112 16.343 21.509 -8.757 1.00 0.00 H new ATOM 0 HG1 THR X 112 17.914 19.374 -8.152 1.00 0.00 H new ATOM 0 HG21 THR X 112 15.425 21.152 -6.482 1.00 0.00 H new ATOM 0 HG22 THR X 112 14.244 20.699 -7.734 1.00 0.00 H new ATOM 0 HG23 THR X 112 15.148 19.436 -6.865 1.00 0.00 H new ATOM 3292 N GLU X 113 18.076 19.016 -10.619 1.00 0.00 N ATOM 3293 CA GLU X 113 19.076 19.181 -11.710 1.00 0.00 C ATOM 3294 CB GLU X 113 18.411 18.901 -13.076 1.00 0.00 C ATOM 3295 CG GLU X 113 17.270 17.874 -12.914 1.00 0.00 C ATOM 3296 CD GLU X 113 17.115 17.051 -14.199 1.00 0.00 C ATOM 3297 OE1 GLU X 113 17.573 17.511 -15.233 1.00 0.00 O ATOM 3298 OE2 GLU X 113 16.545 15.975 -14.125 1.00 0.00 O ATOM 0 H GLU X 113 18.318 18.324 -9.910 1.00 0.00 H new ATOM 0 HB2 GLU X 113 18.019 19.828 -13.494 1.00 0.00 H new ATOM 0 HB3 GLU X 113 19.153 18.523 -13.779 1.00 0.00 H new ATOM 0 HG2 GLU X 113 17.482 17.213 -12.073 1.00 0.00 H new ATOM 0 HG3 GLU X 113 16.336 18.389 -12.688 1.00 0.00 H new TER 3305 GLU X 113 ATOM 3306 N SER Y 92 -1.767 27.445 -48.778 1.00 0.00 N ATOM 3307 CA SER Y 92 -2.438 27.354 -47.450 1.00 0.00 C ATOM 3308 C SER Y 92 -3.893 27.810 -47.578 1.00 0.00 C ATOM 3309 O SER Y 92 -4.174 28.972 -47.793 1.00 0.00 O ATOM 3310 CB SER Y 92 -1.709 28.250 -46.448 1.00 0.00 C ATOM 3311 OG SER Y 92 -0.365 27.807 -46.311 1.00 0.00 O ATOM 0 HA SER Y 92 -2.412 26.322 -47.101 1.00 0.00 H new ATOM 0 HB2 SER Y 92 -1.730 29.286 -46.787 1.00 0.00 H new ATOM 0 HB3 SER Y 92 -2.214 28.221 -45.482 1.00 0.00 H new ATOM 0 HG SER Y 92 -0.084 27.356 -47.134 1.00 0.00 H new ATOM 3319 N HIS Y 93 -4.820 26.901 -47.444 1.00 0.00 N ATOM 3320 CA HIS Y 93 -6.259 27.276 -47.553 1.00 0.00 C ATOM 3321 C HIS Y 93 -6.710 27.955 -46.257 1.00 0.00 C ATOM 3322 O HIS Y 93 -6.081 27.825 -45.226 1.00 0.00 O ATOM 3323 CB HIS Y 93 -7.093 26.016 -47.798 1.00 0.00 C ATOM 3324 CG HIS Y 93 -6.904 25.057 -46.655 1.00 0.00 C ATOM 3325 ND1 HIS Y 93 -5.780 24.249 -46.545 1.00 0.00 N ATOM 3326 CD2 HIS Y 93 -7.683 24.767 -45.564 1.00 0.00 C ATOM 3327 CE1 HIS Y 93 -5.914 23.519 -45.422 1.00 0.00 C ATOM 3328 NE2 HIS Y 93 -7.055 23.797 -44.790 1.00 0.00 N ATOM 0 H HIS Y 93 -4.643 25.913 -47.263 1.00 0.00 H new ATOM 0 HA HIS Y 93 -6.397 27.967 -48.385 1.00 0.00 H new ATOM 0 HB2 HIS Y 93 -8.146 26.278 -47.896 1.00 0.00 H new ATOM 0 HB3 HIS Y 93 -6.793 25.545 -48.734 1.00 0.00 H new ATOM 0 HD2 HIS Y 93 -8.637 25.222 -45.340 1.00 0.00 H new ATOM 0 HE1 HIS Y 93 -5.188 22.798 -45.076 1.00 0.00 H new ATOM 0 HE2 HIS Y 93 -7.396 23.385 -43.921 1.00 0.00 H new ATOM 3337 N LEU Y 94 -7.794 28.685 -46.302 1.00 0.00 N ATOM 3338 CA LEU Y 94 -8.281 29.379 -45.072 1.00 0.00 C ATOM 3339 C LEU Y 94 -9.031 28.383 -44.183 1.00 0.00 C ATOM 3340 O LEU Y 94 -9.544 27.384 -44.648 1.00 0.00 O ATOM 3341 CB LEU Y 94 -9.230 30.522 -45.458 1.00 0.00 C ATOM 3342 CG LEU Y 94 -8.460 31.680 -46.121 1.00 0.00 C ATOM 3343 CD1 LEU Y 94 -7.485 32.328 -45.119 1.00 0.00 C ATOM 3344 CD2 LEU Y 94 -7.685 31.167 -47.344 1.00 0.00 C ATOM 0 H LEU Y 94 -8.363 28.831 -47.136 1.00 0.00 H new ATOM 0 HA LEU Y 94 -7.426 29.784 -44.531 1.00 0.00 H new ATOM 0 HB2 LEU Y 94 -9.994 30.150 -46.141 1.00 0.00 H new ATOM 0 HB3 LEU Y 94 -9.747 30.886 -44.570 1.00 0.00 H new ATOM 0 HG LEU Y 94 -9.181 32.432 -46.443 1.00 0.00 H new ATOM 0 HD11 LEU Y 94 -6.951 33.144 -45.607 1.00 0.00 H new ATOM 0 HD12 LEU Y 94 -8.044 32.718 -44.268 1.00 0.00 H new ATOM 0 HD13 LEU Y 94 -6.770 31.582 -44.773 1.00 0.00 H new ATOM 0 HD21 LEU Y 94 -7.144 31.994 -47.805 1.00 0.00 H new ATOM 0 HD22 LEU Y 94 -6.977 30.400 -47.030 1.00 0.00 H new ATOM 0 HD23 LEU Y 94 -8.383 30.743 -48.066 1.00 0.00 H new ATOM 3356 N LYS Y 95 -9.095 28.646 -42.900 1.00 0.00 N ATOM 3357 CA LYS Y 95 -9.807 27.714 -41.970 1.00 0.00 C ATOM 3358 C LYS Y 95 -11.225 28.230 -41.716 1.00 0.00 C ATOM 3359 O LYS Y 95 -11.450 29.057 -40.853 1.00 0.00 O ATOM 3360 CB LYS Y 95 -9.048 27.658 -40.641 1.00 0.00 C ATOM 3361 CG LYS Y 95 -7.707 26.948 -40.846 1.00 0.00 C ATOM 3362 CD LYS Y 95 -6.935 26.884 -39.520 1.00 0.00 C ATOM 3363 CE LYS Y 95 -6.404 28.273 -39.135 1.00 0.00 C ATOM 3364 NZ LYS Y 95 -5.303 28.118 -38.142 1.00 0.00 N ATOM 0 H LYS Y 95 -8.684 29.467 -42.456 1.00 0.00 H new ATOM 0 HA LYS Y 95 -9.855 26.720 -42.414 1.00 0.00 H new ATOM 0 HB2 LYS Y 95 -8.883 28.667 -40.262 1.00 0.00 H new ATOM 0 HB3 LYS Y 95 -9.640 27.130 -39.894 1.00 0.00 H new ATOM 0 HG2 LYS Y 95 -7.875 25.941 -41.227 1.00 0.00 H new ATOM 0 HG3 LYS Y 95 -7.117 27.478 -41.594 1.00 0.00 H new ATOM 0 HD2 LYS Y 95 -7.586 26.507 -38.732 1.00 0.00 H new ATOM 0 HD3 LYS Y 95 -6.105 26.184 -39.610 1.00 0.00 H new ATOM 0 HE2 LYS Y 95 -6.041 28.795 -40.020 1.00 0.00 H new ATOM 0 HE3 LYS Y 95 -7.207 28.879 -38.715 1.00 0.00 H new ATOM 0 HZ1 LYS Y 95 -4.939 29.056 -37.878 1.00 0.00 H new ATOM 0 HZ2 LYS Y 95 -5.665 27.635 -37.295 1.00 0.00 H new ATOM 0 HZ3 LYS Y 95 -4.535 27.554 -38.560 1.00 0.00 H new ATOM 3378 N SER Y 96 -12.185 27.748 -42.458 1.00 0.00 N ATOM 3379 CA SER Y 96 -13.588 28.209 -42.255 1.00 0.00 C ATOM 3380 C SER Y 96 -14.141 27.629 -40.951 1.00 0.00 C ATOM 3381 O SER Y 96 -14.842 28.295 -40.215 1.00 0.00 O ATOM 3382 CB SER Y 96 -14.451 27.744 -43.429 1.00 0.00 C ATOM 3383 OG SER Y 96 -14.594 26.331 -43.372 1.00 0.00 O ATOM 0 H SER Y 96 -12.058 27.055 -43.196 1.00 0.00 H new ATOM 0 HA SER Y 96 -13.605 29.297 -42.198 1.00 0.00 H new ATOM 0 HB2 SER Y 96 -15.429 28.223 -43.389 1.00 0.00 H new ATOM 0 HB3 SER Y 96 -13.991 28.037 -44.373 1.00 0.00 H new ATOM 0 HG SER Y 96 -15.148 26.028 -44.121 1.00 0.00 H new ATOM 3389 N LYS Y 97 -13.835 26.386 -40.664 1.00 0.00 N ATOM 3390 CA LYS Y 97 -14.341 25.742 -39.410 1.00 0.00 C ATOM 3391 C LYS Y 97 -13.189 25.031 -38.697 1.00 0.00 C ATOM 3392 O LYS Y 97 -12.573 24.134 -39.238 1.00 0.00 O ATOM 3393 CB LYS Y 97 -15.425 24.720 -39.772 1.00 0.00 C ATOM 3394 CG LYS Y 97 -15.960 24.063 -38.497 1.00 0.00 C ATOM 3395 CD LYS Y 97 -17.217 23.245 -38.822 1.00 0.00 C ATOM 3396 CE LYS Y 97 -16.846 22.021 -39.666 1.00 0.00 C ATOM 3397 NZ LYS Y 97 -17.960 21.030 -39.621 1.00 0.00 N ATOM 0 H LYS Y 97 -13.253 25.786 -41.248 1.00 0.00 H new ATOM 0 HA LYS Y 97 -14.758 26.503 -38.751 1.00 0.00 H new ATOM 0 HB2 LYS Y 97 -16.237 25.211 -40.308 1.00 0.00 H new ATOM 0 HB3 LYS Y 97 -15.015 23.962 -40.439 1.00 0.00 H new ATOM 0 HG2 LYS Y 97 -15.197 23.417 -38.062 1.00 0.00 H new ATOM 0 HG3 LYS Y 97 -16.193 24.826 -37.754 1.00 0.00 H new ATOM 0 HD2 LYS Y 97 -17.702 22.926 -37.899 1.00 0.00 H new ATOM 0 HD3 LYS Y 97 -17.934 23.864 -39.361 1.00 0.00 H new ATOM 0 HE2 LYS Y 97 -16.653 22.321 -40.696 1.00 0.00 H new ATOM 0 HE3 LYS Y 97 -15.928 21.570 -39.288 1.00 0.00 H new ATOM 0 HZ1 LYS Y 97 -17.709 20.199 -40.194 1.00 0.00 H new ATOM 0 HZ2 LYS Y 97 -18.123 20.736 -38.637 1.00 0.00 H new ATOM 0 HZ3 LYS Y 97 -18.826 21.463 -40.001 1.00 0.00 H new ATOM 3411 N LYS Y 98 -12.901 25.426 -37.481 1.00 0.00 N ATOM 3412 CA LYS Y 98 -11.793 24.785 -36.700 1.00 0.00 C ATOM 3413 C LYS Y 98 -12.384 24.035 -35.505 1.00 0.00 C ATOM 3414 O LYS Y 98 -11.672 23.574 -34.635 1.00 0.00 O ATOM 3415 CB LYS Y 98 -10.833 25.867 -36.200 1.00 0.00 C ATOM 3416 CG LYS Y 98 -11.599 26.879 -35.345 1.00 0.00 C ATOM 3417 CD LYS Y 98 -10.667 28.029 -34.963 1.00 0.00 C ATOM 3418 CE LYS Y 98 -11.366 28.935 -33.946 1.00 0.00 C ATOM 3419 NZ LYS Y 98 -10.503 30.114 -33.655 1.00 0.00 N ATOM 0 H LYS Y 98 -13.391 26.173 -36.989 1.00 0.00 H new ATOM 0 HA LYS Y 98 -11.252 24.086 -37.338 1.00 0.00 H new ATOM 0 HB2 LYS Y 98 -10.032 25.415 -35.615 1.00 0.00 H new ATOM 0 HB3 LYS Y 98 -10.365 26.371 -37.046 1.00 0.00 H new ATOM 0 HG2 LYS Y 98 -12.459 27.261 -35.896 1.00 0.00 H new ATOM 0 HG3 LYS Y 98 -11.985 26.395 -34.448 1.00 0.00 H new ATOM 0 HD2 LYS Y 98 -9.742 27.637 -34.541 1.00 0.00 H new ATOM 0 HD3 LYS Y 98 -10.395 28.601 -35.850 1.00 0.00 H new ATOM 0 HE2 LYS Y 98 -12.329 29.264 -34.337 1.00 0.00 H new ATOM 0 HE3 LYS Y 98 -11.567 28.382 -33.028 1.00 0.00 H new ATOM 0 HZ1 LYS Y 98 -10.978 30.730 -32.964 1.00 0.00 H new ATOM 0 HZ2 LYS Y 98 -9.595 29.791 -33.265 1.00 0.00 H new ATOM 0 HZ3 LYS Y 98 -10.333 30.645 -34.533 1.00 0.00 H new ATOM 3433 N GLY Y 99 -13.683 23.913 -35.453 1.00 0.00 N ATOM 3434 CA GLY Y 99 -14.321 23.197 -34.312 1.00 0.00 C ATOM 3435 C GLY Y 99 -14.030 21.698 -34.414 1.00 0.00 C ATOM 3436 O GLY Y 99 -14.929 20.879 -34.396 1.00 0.00 O ATOM 0 H GLY Y 99 -14.330 24.279 -36.152 1.00 0.00 H new ATOM 0 HA2 GLY Y 99 -13.941 23.587 -33.368 1.00 0.00 H new ATOM 0 HA3 GLY Y 99 -15.397 23.369 -34.318 1.00 0.00 H new ATOM 3440 N GLN Y 100 -12.781 21.331 -34.519 1.00 0.00 N ATOM 3441 CA GLN Y 100 -12.435 19.884 -34.619 1.00 0.00 C ATOM 3442 C GLN Y 100 -12.463 19.260 -33.225 1.00 0.00 C ATOM 3443 O GLN Y 100 -12.378 19.945 -32.225 1.00 0.00 O ATOM 3444 CB GLN Y 100 -11.036 19.723 -35.225 1.00 0.00 C ATOM 3445 CG GLN Y 100 -11.030 20.214 -36.679 1.00 0.00 C ATOM 3446 CD GLN Y 100 -11.999 19.377 -37.521 1.00 0.00 C ATOM 3447 OE1 GLN Y 100 -12.822 19.916 -38.235 1.00 0.00 O ATOM 3448 NE2 GLN Y 100 -11.943 18.075 -37.458 1.00 0.00 N ATOM 0 H GLN Y 100 -11.986 21.970 -34.540 1.00 0.00 H new ATOM 0 HA GLN Y 100 -13.161 19.383 -35.260 1.00 0.00 H new ATOM 0 HB2 GLN Y 100 -10.311 20.288 -34.639 1.00 0.00 H new ATOM 0 HB3 GLN Y 100 -10.732 18.677 -35.185 1.00 0.00 H new ATOM 0 HG2 GLN Y 100 -11.317 21.265 -36.717 1.00 0.00 H new ATOM 0 HG3 GLN Y 100 -10.023 20.143 -37.091 1.00 0.00 H new ATOM 0 HE21 GLN Y 100 -11.252 17.623 -36.859 1.00 0.00 H new ATOM 0 HE22 GLN Y 100 -12.590 17.510 -38.008 1.00 0.00 H new ATOM 3457 N SER Y 101 -12.582 17.961 -33.149 1.00 0.00 N ATOM 3458 CA SER Y 101 -12.620 17.295 -31.818 1.00 0.00 C ATOM 3459 C SER Y 101 -11.450 17.793 -30.977 1.00 0.00 C ATOM 3460 O SER Y 101 -11.509 17.790 -29.766 1.00 0.00 O ATOM 3461 CB SER Y 101 -12.515 15.780 -31.987 1.00 0.00 C ATOM 3462 OG SER Y 101 -11.275 15.461 -32.603 1.00 0.00 O ATOM 0 H SER Y 101 -12.654 17.335 -33.951 1.00 0.00 H new ATOM 0 HA SER Y 101 -13.562 17.533 -31.323 1.00 0.00 H new ATOM 0 HB2 SER Y 101 -12.589 15.288 -31.017 1.00 0.00 H new ATOM 0 HB3 SER Y 101 -13.342 15.412 -32.595 1.00 0.00 H new ATOM 0 HG SER Y 101 -11.204 14.490 -32.711 1.00 0.00 H new ATOM 3468 N THR Y 102 -10.392 18.230 -31.616 1.00 0.00 N ATOM 3469 CA THR Y 102 -9.204 18.747 -30.870 1.00 0.00 C ATOM 3470 C THR Y 102 -9.670 19.583 -29.672 1.00 0.00 C ATOM 3471 O THR Y 102 -8.968 19.730 -28.691 1.00 0.00 O ATOM 3472 CB THR Y 102 -8.351 19.610 -31.808 1.00 0.00 C ATOM 3473 OG1 THR Y 102 -7.113 19.900 -31.178 1.00 0.00 O ATOM 3474 CG2 THR Y 102 -9.080 20.918 -32.131 1.00 0.00 C ATOM 0 H THR Y 102 -10.301 18.250 -32.632 1.00 0.00 H new ATOM 0 HA THR Y 102 -8.608 17.909 -30.508 1.00 0.00 H new ATOM 0 HB THR Y 102 -8.176 19.066 -32.736 1.00 0.00 H new ATOM 0 HG1 THR Y 102 -6.563 20.450 -31.774 1.00 0.00 H new ATOM 0 HG21 THR Y 102 -8.465 21.522 -32.798 1.00 0.00 H new ATOM 0 HG22 THR Y 102 -10.030 20.695 -32.617 1.00 0.00 H new ATOM 0 HG23 THR Y 102 -9.265 21.469 -31.209 1.00 0.00 H new ATOM 3482 N SER Y 103 -10.857 20.122 -29.745 1.00 0.00 N ATOM 3483 CA SER Y 103 -11.374 20.936 -28.612 1.00 0.00 C ATOM 3484 C SER Y 103 -11.265 20.121 -27.322 1.00 0.00 C ATOM 3485 O SER Y 103 -11.046 20.658 -26.255 1.00 0.00 O ATOM 3486 CB SER Y 103 -12.841 21.284 -28.862 1.00 0.00 C ATOM 3487 OG SER Y 103 -12.947 22.044 -30.059 1.00 0.00 O ATOM 0 H SER Y 103 -11.489 20.033 -30.540 1.00 0.00 H new ATOM 0 HA SER Y 103 -10.792 21.853 -28.524 1.00 0.00 H new ATOM 0 HB2 SER Y 103 -13.434 20.373 -28.943 1.00 0.00 H new ATOM 0 HB3 SER Y 103 -13.240 21.851 -28.021 1.00 0.00 H new ATOM 0 HG SER Y 103 -12.858 21.449 -30.833 1.00 0.00 H new ATOM 3493 N ARG Y 104 -11.414 18.826 -27.411 1.00 0.00 N ATOM 3494 CA ARG Y 104 -11.315 17.983 -26.186 1.00 0.00 C ATOM 3495 C ARG Y 104 -9.925 18.159 -25.563 1.00 0.00 C ATOM 3496 O ARG Y 104 -9.773 18.257 -24.357 1.00 0.00 O ATOM 3497 CB ARG Y 104 -11.527 16.504 -26.562 1.00 0.00 C ATOM 3498 CG ARG Y 104 -10.647 16.113 -27.787 1.00 0.00 C ATOM 3499 CD ARG Y 104 -9.673 14.988 -27.419 1.00 0.00 C ATOM 3500 NE ARG Y 104 -8.796 15.439 -26.302 1.00 0.00 N ATOM 3501 CZ ARG Y 104 -8.077 14.572 -25.647 1.00 0.00 C ATOM 3502 NH1 ARG Y 104 -8.127 13.310 -25.970 1.00 0.00 N ATOM 3503 NH2 ARG Y 104 -7.309 14.966 -24.668 1.00 0.00 N ATOM 0 H ARG Y 104 -11.599 18.318 -28.276 1.00 0.00 H new ATOM 0 HA ARG Y 104 -12.078 18.287 -25.469 1.00 0.00 H new ATOM 0 HB2 ARG Y 104 -11.278 15.869 -25.712 1.00 0.00 H new ATOM 0 HB3 ARG Y 104 -12.578 16.330 -26.793 1.00 0.00 H new ATOM 0 HG2 ARG Y 104 -11.284 15.793 -28.611 1.00 0.00 H new ATOM 0 HG3 ARG Y 104 -10.090 16.984 -28.134 1.00 0.00 H new ATOM 0 HD2 ARG Y 104 -10.225 14.095 -27.125 1.00 0.00 H new ATOM 0 HD3 ARG Y 104 -9.068 14.718 -28.285 1.00 0.00 H new ATOM 0 HE ARG Y 104 -8.759 16.427 -26.050 1.00 0.00 H new ATOM 0 HH11 ARG Y 104 -8.728 13.003 -26.734 1.00 0.00 H new ATOM 0 HH12 ARG Y 104 -7.565 12.630 -25.458 1.00 0.00 H new ATOM 0 HH21 ARG Y 104 -7.271 15.953 -24.415 1.00 0.00 H new ATOM 0 HH22 ARG Y 104 -6.747 14.286 -24.156 1.00 0.00 H new ATOM 3517 N HIS Y 105 -8.909 18.217 -26.378 1.00 0.00 N ATOM 3518 CA HIS Y 105 -7.538 18.398 -25.838 1.00 0.00 C ATOM 3519 C HIS Y 105 -7.465 19.730 -25.095 1.00 0.00 C ATOM 3520 O HIS Y 105 -6.850 19.840 -24.056 1.00 0.00 O ATOM 3521 CB HIS Y 105 -6.530 18.397 -26.988 1.00 0.00 C ATOM 3522 CG HIS Y 105 -5.145 18.532 -26.425 1.00 0.00 C ATOM 3523 ND1 HIS Y 105 -4.398 19.691 -26.565 1.00 0.00 N ATOM 3524 CD2 HIS Y 105 -4.359 17.664 -25.708 1.00 0.00 C ATOM 3525 CE1 HIS Y 105 -3.220 19.492 -25.945 1.00 0.00 C ATOM 3526 NE2 HIS Y 105 -3.148 18.275 -25.409 1.00 0.00 N ATOM 0 H HIS Y 105 -8.971 18.147 -27.394 1.00 0.00 H new ATOM 0 HA HIS Y 105 -7.303 17.583 -25.154 1.00 0.00 H new ATOM 0 HB2 HIS Y 105 -6.615 17.474 -27.562 1.00 0.00 H new ATOM 0 HB3 HIS Y 105 -6.740 19.219 -27.673 1.00 0.00 H new ATOM 0 HD1 HIS Y 105 -4.688 20.540 -27.050 1.00 0.00 H new ATOM 0 HD2 HIS Y 105 -4.639 16.661 -25.421 1.00 0.00 H new ATOM 0 HE1 HIS Y 105 -2.431 20.228 -25.889 1.00 0.00 H new ATOM 3535 N LYS Y 106 -8.086 20.744 -25.632 1.00 0.00 N ATOM 3536 CA LYS Y 106 -8.056 22.082 -24.977 1.00 0.00 C ATOM 3537 C LYS Y 106 -8.667 21.980 -23.582 1.00 0.00 C ATOM 3538 O LYS Y 106 -8.303 22.706 -22.676 1.00 0.00 O ATOM 3539 CB LYS Y 106 -8.861 23.084 -25.811 1.00 0.00 C ATOM 3540 CG LYS Y 106 -8.196 23.308 -27.182 1.00 0.00 C ATOM 3541 CD LYS Y 106 -7.062 24.350 -27.083 1.00 0.00 C ATOM 3542 CE LYS Y 106 -7.635 25.774 -27.098 1.00 0.00 C ATOM 3543 NZ LYS Y 106 -6.531 26.749 -27.335 1.00 0.00 N ATOM 0 H LYS Y 106 -8.616 20.703 -26.502 1.00 0.00 H new ATOM 0 HA LYS Y 106 -7.023 22.421 -24.901 1.00 0.00 H new ATOM 0 HB2 LYS Y 106 -9.877 22.716 -25.950 1.00 0.00 H new ATOM 0 HB3 LYS Y 106 -8.935 24.032 -25.278 1.00 0.00 H new ATOM 0 HG2 LYS Y 106 -7.797 22.365 -27.555 1.00 0.00 H new ATOM 0 HG3 LYS Y 106 -8.942 23.645 -27.902 1.00 0.00 H new ATOM 0 HD2 LYS Y 106 -6.493 24.191 -26.167 1.00 0.00 H new ATOM 0 HD3 LYS Y 106 -6.369 24.222 -27.915 1.00 0.00 H new ATOM 0 HE2 LYS Y 106 -8.390 25.866 -27.879 1.00 0.00 H new ATOM 0 HE3 LYS Y 106 -8.128 25.990 -26.150 1.00 0.00 H new ATOM 0 HZ1 LYS Y 106 -6.917 27.715 -27.346 1.00 0.00 H new ATOM 0 HZ2 LYS Y 106 -5.826 26.666 -26.575 1.00 0.00 H new ATOM 0 HZ3 LYS Y 106 -6.080 26.547 -28.250 1.00 0.00 H new ATOM 3557 N LYS Y 107 -9.595 21.086 -23.396 1.00 0.00 N ATOM 3558 CA LYS Y 107 -10.217 20.952 -22.056 1.00 0.00 C ATOM 3559 C LYS Y 107 -9.125 20.603 -21.050 1.00 0.00 C ATOM 3560 O LYS Y 107 -9.111 21.103 -19.945 1.00 0.00 O ATOM 3561 CB LYS Y 107 -11.264 19.835 -22.083 1.00 0.00 C ATOM 3562 CG LYS Y 107 -11.905 19.699 -20.696 1.00 0.00 C ATOM 3563 CD LYS Y 107 -13.119 18.760 -20.758 1.00 0.00 C ATOM 3564 CE LYS Y 107 -12.656 17.298 -20.778 1.00 0.00 C ATOM 3565 NZ LYS Y 107 -11.828 17.019 -19.570 1.00 0.00 N ATOM 0 H LYS Y 107 -9.946 20.447 -24.109 1.00 0.00 H new ATOM 0 HA LYS Y 107 -10.703 21.886 -21.775 1.00 0.00 H new ATOM 0 HB2 LYS Y 107 -12.028 20.057 -22.828 1.00 0.00 H new ATOM 0 HB3 LYS Y 107 -10.799 18.893 -22.374 1.00 0.00 H new ATOM 0 HG2 LYS Y 107 -11.174 19.312 -19.987 1.00 0.00 H new ATOM 0 HG3 LYS Y 107 -12.213 20.679 -20.333 1.00 0.00 H new ATOM 0 HD2 LYS Y 107 -13.766 18.933 -19.898 1.00 0.00 H new ATOM 0 HD3 LYS Y 107 -13.709 18.975 -21.649 1.00 0.00 H new ATOM 0 HE2 LYS Y 107 -13.519 16.633 -20.801 1.00 0.00 H new ATOM 0 HE3 LYS Y 107 -12.078 17.101 -21.681 1.00 0.00 H new ATOM 0 HZ1 LYS Y 107 -11.934 16.020 -19.299 1.00 0.00 H new ATOM 0 HZ2 LYS Y 107 -10.829 17.216 -19.781 1.00 0.00 H new ATOM 0 HZ3 LYS Y 107 -12.143 17.625 -18.786 1.00 0.00 H new ATOM 3579 N LEU Y 108 -8.202 19.755 -21.425 1.00 0.00 N ATOM 3580 CA LEU Y 108 -7.104 19.391 -20.478 1.00 0.00 C ATOM 3581 C LEU Y 108 -6.108 20.567 -20.356 1.00 0.00 C ATOM 3582 O LEU Y 108 -5.438 20.732 -19.355 1.00 0.00 O ATOM 3583 CB LEU Y 108 -6.377 18.125 -20.981 1.00 0.00 C ATOM 3584 CG LEU Y 108 -5.805 17.324 -19.788 1.00 0.00 C ATOM 3585 CD1 LEU Y 108 -6.877 16.403 -19.198 1.00 0.00 C ATOM 3586 CD2 LEU Y 108 -4.612 16.471 -20.246 1.00 0.00 C ATOM 0 H LEU Y 108 -8.160 19.302 -22.338 1.00 0.00 H new ATOM 0 HA LEU Y 108 -7.529 19.185 -19.495 1.00 0.00 H new ATOM 0 HB2 LEU Y 108 -7.068 17.502 -21.548 1.00 0.00 H new ATOM 0 HB3 LEU Y 108 -5.571 18.406 -21.659 1.00 0.00 H new ATOM 0 HG LEU Y 108 -5.479 18.034 -19.028 1.00 0.00 H new ATOM 0 HD11 LEU Y 108 -6.458 15.847 -18.360 1.00 0.00 H new ATOM 0 HD12 LEU Y 108 -7.720 17.001 -18.851 1.00 0.00 H new ATOM 0 HD13 LEU Y 108 -7.218 15.705 -19.963 1.00 0.00 H new ATOM 0 HD21 LEU Y 108 -4.218 15.912 -19.398 1.00 0.00 H new ATOM 0 HD22 LEU Y 108 -4.938 15.775 -21.019 1.00 0.00 H new ATOM 0 HD23 LEU Y 108 -3.833 17.120 -20.646 1.00 0.00 H new ATOM 3598 N MET Y 109 -5.997 21.384 -21.366 1.00 0.00 N ATOM 3599 CA MET Y 109 -5.039 22.529 -21.296 1.00 0.00 C ATOM 3600 C MET Y 109 -5.371 23.422 -20.101 1.00 0.00 C ATOM 3601 O MET Y 109 -4.518 24.130 -19.607 1.00 0.00 O ATOM 3602 CB MET Y 109 -5.068 23.339 -22.604 1.00 0.00 C ATOM 3603 CG MET Y 109 -4.152 22.676 -23.645 1.00 0.00 C ATOM 3604 SD MET Y 109 -4.427 20.880 -23.643 1.00 0.00 S ATOM 3605 CE MET Y 109 -2.779 20.338 -23.112 1.00 0.00 C ATOM 0 H MET Y 109 -6.525 21.311 -22.236 1.00 0.00 H new ATOM 0 HA MET Y 109 -4.032 22.133 -21.164 1.00 0.00 H new ATOM 0 HB2 MET Y 109 -6.087 23.395 -22.986 1.00 0.00 H new ATOM 0 HB3 MET Y 109 -4.741 24.362 -22.417 1.00 0.00 H new ATOM 0 HG2 MET Y 109 -4.355 23.084 -24.635 1.00 0.00 H new ATOM 0 HG3 MET Y 109 -3.109 22.895 -23.418 1.00 0.00 H new ATOM 0 HE1 MET Y 109 -2.734 19.249 -23.121 1.00 0.00 H new ATOM 0 HE2 MET Y 109 -2.028 20.738 -23.793 1.00 0.00 H new ATOM 0 HE3 MET Y 109 -2.584 20.701 -22.103 1.00 0.00 H new ATOM 3615 N PHE Y 110 -6.596 23.414 -19.639 1.00 0.00 N ATOM 3616 CA PHE Y 110 -6.962 24.285 -18.471 1.00 0.00 C ATOM 3617 C PHE Y 110 -5.821 24.252 -17.438 1.00 0.00 C ATOM 3618 O PHE Y 110 -5.439 25.257 -16.872 1.00 0.00 O ATOM 3619 CB PHE Y 110 -8.273 23.763 -17.836 1.00 0.00 C ATOM 3620 CG PHE Y 110 -7.984 22.684 -16.802 1.00 0.00 C ATOM 3621 CD1 PHE Y 110 -7.602 21.399 -17.208 1.00 0.00 C ATOM 3622 CD2 PHE Y 110 -8.092 22.979 -15.436 1.00 0.00 C ATOM 3623 CE1 PHE Y 110 -7.329 20.413 -16.253 1.00 0.00 C ATOM 3624 CE2 PHE Y 110 -7.820 21.991 -14.481 1.00 0.00 C ATOM 3625 CZ PHE Y 110 -7.438 20.708 -14.890 1.00 0.00 C ATOM 0 H PHE Y 110 -7.357 22.848 -20.014 1.00 0.00 H new ATOM 0 HA PHE Y 110 -7.113 25.312 -18.804 1.00 0.00 H new ATOM 0 HB2 PHE Y 110 -8.808 24.588 -17.366 1.00 0.00 H new ATOM 0 HB3 PHE Y 110 -8.924 23.362 -18.613 1.00 0.00 H new ATOM 0 HD1 PHE Y 110 -7.518 21.169 -18.260 1.00 0.00 H new ATOM 0 HD2 PHE Y 110 -8.385 23.969 -15.119 1.00 0.00 H new ATOM 0 HE1 PHE Y 110 -7.034 19.423 -16.569 1.00 0.00 H new ATOM 0 HE2 PHE Y 110 -7.905 22.219 -13.429 1.00 0.00 H new ATOM 0 HZ PHE Y 110 -7.228 19.946 -14.154 1.00 0.00 H new ATOM 3635 N LYS Y 111 -5.273 23.089 -17.218 1.00 0.00 N ATOM 3636 CA LYS Y 111 -4.147 22.944 -16.257 1.00 0.00 C ATOM 3637 C LYS Y 111 -2.888 23.607 -16.838 1.00 0.00 C ATOM 3638 O LYS Y 111 -2.100 24.181 -16.122 1.00 0.00 O ATOM 3639 CB LYS Y 111 -3.877 21.448 -16.042 1.00 0.00 C ATOM 3640 CG LYS Y 111 -3.198 20.881 -17.294 1.00 0.00 C ATOM 3641 CD LYS Y 111 -3.394 19.377 -17.396 1.00 0.00 C ATOM 3642 CE LYS Y 111 -2.802 18.901 -18.730 1.00 0.00 C ATOM 3643 NZ LYS Y 111 -2.437 17.459 -18.622 1.00 0.00 N ATOM 0 H LYS Y 111 -5.563 22.222 -17.670 1.00 0.00 H new ATOM 0 HA LYS Y 111 -4.402 23.421 -15.311 1.00 0.00 H new ATOM 0 HB2 LYS Y 111 -3.241 21.301 -15.169 1.00 0.00 H new ATOM 0 HB3 LYS Y 111 -4.811 20.920 -15.848 1.00 0.00 H new ATOM 0 HG2 LYS Y 111 -3.606 21.364 -18.182 1.00 0.00 H new ATOM 0 HG3 LYS Y 111 -2.133 21.110 -17.268 1.00 0.00 H new ATOM 0 HD2 LYS Y 111 -2.904 18.873 -16.563 1.00 0.00 H new ATOM 0 HD3 LYS Y 111 -4.454 19.128 -17.341 1.00 0.00 H new ATOM 0 HE2 LYS Y 111 -3.524 19.046 -19.534 1.00 0.00 H new ATOM 0 HE3 LYS Y 111 -1.922 19.493 -18.982 1.00 0.00 H new ATOM 0 HZ1 LYS Y 111 -2.115 17.112 -19.548 1.00 0.00 H new ATOM 0 HZ2 LYS Y 111 -1.673 17.345 -17.925 1.00 0.00 H new ATOM 0 HZ3 LYS Y 111 -3.268 16.912 -18.317 1.00 0.00 H new ATOM 3657 N THR Y 112 -2.677 23.493 -18.135 1.00 0.00 N ATOM 3658 CA THR Y 112 -1.450 24.100 -18.749 1.00 0.00 C ATOM 3659 C THR Y 112 -1.467 25.614 -18.537 1.00 0.00 C ATOM 3660 O THR Y 112 -0.437 26.251 -18.438 1.00 0.00 O ATOM 3661 CB THR Y 112 -1.375 23.794 -20.254 1.00 0.00 C ATOM 3662 OG1 THR Y 112 -2.583 24.182 -20.886 1.00 0.00 O ATOM 3663 CG2 THR Y 112 -1.137 22.299 -20.477 1.00 0.00 C ATOM 0 H THR Y 112 -3.296 23.010 -18.786 1.00 0.00 H new ATOM 0 HA THR Y 112 -0.575 23.666 -18.266 1.00 0.00 H new ATOM 0 HB THR Y 112 -0.546 24.355 -20.685 1.00 0.00 H new ATOM 0 HG1 THR Y 112 -3.245 24.425 -20.205 1.00 0.00 H new ATOM 0 HG21 THR Y 112 -1.086 22.094 -21.546 1.00 0.00 H new ATOM 0 HG22 THR Y 112 -0.199 22.006 -20.006 1.00 0.00 H new ATOM 0 HG23 THR Y 112 -1.957 21.731 -20.038 1.00 0.00 H new ATOM 3671 N GLU Y 113 -2.632 26.195 -18.470 1.00 0.00 N ATOM 3672 CA GLU Y 113 -2.729 27.669 -18.267 1.00 0.00 C ATOM 3673 CB GLU Y 113 -2.006 28.068 -16.962 1.00 0.00 C ATOM 3674 CG GLU Y 113 -2.073 26.913 -15.940 1.00 0.00 C ATOM 3675 CD GLU Y 113 -2.070 27.470 -14.511 1.00 0.00 C ATOM 3676 OE1 GLU Y 113 -1.646 28.601 -14.339 1.00 0.00 O ATOM 3677 OE2 GLU Y 113 -2.491 26.756 -13.616 1.00 0.00 O ATOM 0 H GLU Y 113 -3.526 25.710 -18.547 1.00 0.00 H new ATOM 0 HB2 GLU Y 113 -0.966 28.315 -17.175 1.00 0.00 H new ATOM 0 HB3 GLU Y 113 -2.466 28.962 -16.542 1.00 0.00 H new ATOM 0 HG2 GLU Y 113 -2.974 26.322 -16.106 1.00 0.00 H new ATOM 0 HG3 GLU Y 113 -1.223 26.244 -16.079 1.00 0.00 H new TER 3684 GLU Y 113 HETATM 3685 CA CA A 114 -3.804 24.174 4.124 1.00 0.00 CA HETATM 3686 CA CA A 115 3.137 29.348 -5.074 1.00 0.00 CA HETATM 3687 CA CA B 116 8.834 2.497 -23.164 1.00 0.00 CA HETATM 3688 CA CA B 117 11.583 14.678 -23.352 1.00 0.00 CA