USER MOD reduce.3.24.130724 H: found=0, std=0, add=921, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 110 THR OG1 : rot -176:sc= 1 USER MOD Set 1.2: A 139 TYR OH : rot 180:sc= 1.08 USER MOD Set 2.1: A 113 SER OG : rot -140:sc= 0.547 USER MOD Set 2.2: A 116 HIS : no HD1:sc= -3.74 K(o=-4,f=-3.4!) USER MOD Set 2.3: A 119 LYS NZ :NH3+ -136:sc= -0.835 (180deg=0) USER MOD Set 3.1: A 77 GLN : amide:sc= 0.329 K(o=-2.4,f=-7.2!) USER MOD Set 3.2: A 91 GLN : amide:sc= -2.74! C(o=-2.4!,f=-3!) USER MOD Set 4.1: A 72 SER OG : rot 105:sc= 1.09 USER MOD Set 4.2: A 75 THR OG1 : rot 55:sc= 0.0758 USER MOD Single : A 30 CYS SG : rot 2:sc= -1.95! USER MOD Single : A 31 SER OG : rot -50:sc= 0.361 USER MOD Single : A 32 ASN : amide:sc= -6.04! C(o=-6!,f=-9.2!) USER MOD Single : A 35 HIS : no HE2:sc= -4.86! K(o=-4.9!,f=-2.2) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 70:sc= -0.247 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= -1.15! C(o=-1.1!,f=-3!) USER MOD Single : A 55 HIS : no HD1:sc= -3.58! K(o=-3.6!,f=-2) USER MOD Single : A 57 GLN : amide:sc= -9.64! C(o=-9.6!,f=-8.4!) USER MOD Single : A 59 GLN : amide:sc= -0.235 X(o=-0.23,f=-0.24) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0.705 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -127:sc= -0.0262 (180deg=-0.307) USER MOD Single : A 73 THR OG1 : rot 44:sc= 0.243 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl 132:sc= -0.234 (180deg=-2.26) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot -99:sc= 0.00241 USER MOD Single : A 90 SER OG : rot -98:sc= 0.378 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -0.647 K(o=-0.65,f=-6!) USER MOD Single : A 97 CYS SG : rot 163:sc= 0.771 USER MOD Single : A 106 ASN : amide:sc= -0.0192 X(o=-0.019,f=-0.11) USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 ASN : amide:sc= -0.101 K(o=-0.1,f=-2.9!) USER MOD Single : A 111 TYR OH : rot 180:sc= -0.414 USER MOD Single : A 114 LYS NZ :NH3+ 158:sc= -0.0348 (180deg=-0.683) USER MOD Single : A 115 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.0875) USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 167:sc= 0.024 (180deg=0.00632) USER MOD Single : A 127 LYS NZ :NH3+ -141:sc= 0.239 (180deg=-0.15) USER MOD Single : A 128 ASN : amide:sc= -0.151 X(o=-0.15,f=0) USER MOD Single : A 130 SER OG : rot 55:sc= 1.11 USER MOD Single : A 131 CYS SG : rot 118:sc= -3.68! USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 127:sc= 0.422 USER MOD Single : A 138 HIS : no HE2:sc= 0.0854 K(o=0.085,f=-1.5) USER MOD Single : A 141 GLN : amide:sc= 0.522 K(o=0.52,f=-0.05) USER MOD Single : A 142 LYS NZ :NH3+ 141:sc= -0.0771 (180deg=-0.678) USER MOD ----------------------------------------------------------------- ATOM 21 N CYS A 30 -7.804 3.710 2.878 1.00 0.00 N ATOM 22 CA CYS A 30 -8.532 2.583 2.253 1.00 0.00 C ATOM 23 C CYS A 30 -10.000 2.533 2.702 1.00 0.00 C ATOM 24 O CYS A 30 -10.318 2.820 3.853 1.00 0.00 O ATOM 25 CB CYS A 30 -7.879 1.266 2.678 1.00 0.00 C ATOM 26 SG CYS A 30 -8.418 -0.191 1.719 1.00 0.00 S ATOM 0 HA CYS A 30 -8.492 2.726 1.173 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -6.797 1.365 2.587 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -8.095 1.092 3.732 1.00 0.00 H new ATOM 0 HG CYS A 30 -9.254 0.182 0.796 1.00 0.00 H new ATOM 27 N SER A 31 -10.837 1.960 1.832 1.00 0.00 N ATOM 28 CA SER A 31 -12.211 1.580 2.236 1.00 0.00 C ATOM 29 C SER A 31 -12.197 0.193 2.939 1.00 0.00 C ATOM 30 O SER A 31 -13.037 -0.680 2.694 1.00 0.00 O ATOM 31 CB SER A 31 -13.149 1.610 1.033 1.00 0.00 C ATOM 32 OG SER A 31 -14.488 1.387 1.508 1.00 0.00 O ATOM 0 H SER A 31 -10.603 1.749 0.862 1.00 0.00 H new ATOM 0 HA SER A 31 -12.590 2.307 2.955 1.00 0.00 H new ATOM 0 HB2 SER A 31 -13.081 2.570 0.521 1.00 0.00 H new ATOM 0 HB3 SER A 31 -12.868 0.843 0.311 1.00 0.00 H new ATOM 0 HG SER A 31 -14.502 0.599 2.090 1.00 0.00 H new ATOM 33 N ASN A 32 -11.279 0.104 3.902 1.00 0.00 N ATOM 34 CA ASN A 32 -11.036 -1.130 4.674 1.00 0.00 C ATOM 35 C ASN A 32 -11.701 -1.117 6.068 1.00 0.00 C ATOM 36 O ASN A 32 -12.438 -2.022 6.442 1.00 0.00 O ATOM 37 CB ASN A 32 -9.537 -1.426 4.814 1.00 0.00 C ATOM 38 CG ASN A 32 -8.756 -0.710 5.923 1.00 0.00 C ATOM 39 OD1 ASN A 32 -8.390 0.465 5.863 1.00 0.00 O ATOM 40 ND2 ASN A 32 -8.476 -1.470 6.950 1.00 0.00 N ATOM 0 H ASN A 32 -10.679 0.882 4.174 1.00 0.00 H new ATOM 0 HA ASN A 32 -11.504 -1.928 4.098 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -9.423 -2.499 4.966 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -9.060 -1.186 3.863 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -7.940 -1.094 7.732 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -8.794 -2.439 6.969 1.00 0.00 H new ATOM 41 N GLY A 33 -11.613 0.080 6.630 1.00 0.00 N ATOM 42 CA GLY A 33 -11.740 0.457 8.051 1.00 0.00 C ATOM 43 C GLY A 33 -10.511 1.364 8.199 1.00 0.00 C ATOM 44 O GLY A 33 -9.521 1.037 8.860 1.00 0.00 O ATOM 0 H GLY A 33 -11.433 0.902 6.053 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -12.672 0.981 8.261 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -11.703 -0.406 8.716 1.00 0.00 H new ATOM 45 N GLY A 34 -10.671 2.513 7.545 1.00 0.00 N ATOM 46 CA GLY A 34 -9.598 3.226 6.842 1.00 0.00 C ATOM 47 C GLY A 34 -8.560 3.988 7.650 1.00 0.00 C ATOM 48 O GLY A 34 -8.867 4.939 8.361 1.00 0.00 O ATOM 0 H GLY A 34 -11.571 2.988 7.486 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.067 2.498 6.229 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -10.067 3.935 6.160 1.00 0.00 H new ATOM 49 N HIS A 35 -7.330 3.542 7.431 1.00 0.00 N ATOM 50 CA HIS A 35 -6.134 4.283 7.848 1.00 0.00 C ATOM 51 C HIS A 35 -5.282 4.635 6.604 1.00 0.00 C ATOM 52 O HIS A 35 -5.500 4.086 5.520 1.00 0.00 O ATOM 53 CB HIS A 35 -5.341 3.506 8.891 1.00 0.00 C ATOM 54 CG HIS A 35 -6.204 3.136 10.108 1.00 0.00 C ATOM 55 ND1 HIS A 35 -7.227 2.287 10.173 1.00 0.00 N ATOM 56 CD2 HIS A 35 -6.201 3.843 11.215 1.00 0.00 C ATOM 57 CE1 HIS A 35 -7.843 2.482 11.339 1.00 0.00 C ATOM 58 NE2 HIS A 35 -7.206 3.453 11.978 1.00 0.00 N ATOM 0 H HIS A 35 -7.127 2.660 6.961 1.00 0.00 H new ATOM 0 HA HIS A 35 -6.437 5.215 8.325 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -4.940 2.598 8.440 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -4.489 4.102 9.218 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -7.492 1.609 9.459 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -5.491 4.618 11.462 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -8.708 1.944 11.699 1.00 0.00 H new ATOM 59 N PHE A 36 -4.180 5.321 6.855 1.00 0.00 N ATOM 60 CA PHE A 36 -3.387 6.009 5.808 1.00 0.00 C ATOM 61 C PHE A 36 -2.017 5.348 5.839 1.00 0.00 C ATOM 62 O PHE A 36 -1.395 5.239 6.900 1.00 0.00 O ATOM 63 CB PHE A 36 -3.272 7.503 6.130 1.00 0.00 C ATOM 64 CG PHE A 36 -4.597 8.240 6.363 1.00 0.00 C ATOM 65 CD1 PHE A 36 -5.321 8.048 7.567 1.00 0.00 C ATOM 66 CD2 PHE A 36 -5.101 9.100 5.359 1.00 0.00 C ATOM 67 CE1 PHE A 36 -6.552 8.697 7.766 1.00 0.00 C ATOM 68 CE2 PHE A 36 -6.328 9.768 5.558 1.00 0.00 C ATOM 69 CZ PHE A 36 -7.042 9.555 6.757 1.00 0.00 C ATOM 0 H PHE A 36 -3.794 5.427 7.793 1.00 0.00 H new ATOM 0 HA PHE A 36 -3.850 5.929 4.824 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -2.653 7.617 7.020 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -2.745 7.992 5.311 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -4.925 7.400 8.335 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -4.548 9.245 4.443 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -7.114 8.542 8.675 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -6.716 10.434 4.802 1.00 0.00 H new ATOM 0 HZ PHE A 36 -7.985 10.060 6.906 1.00 0.00 H new ATOM 70 N LEU A 37 -1.754 4.635 4.745 1.00 0.00 N ATOM 71 CA LEU A 37 -0.481 3.938 4.493 1.00 0.00 C ATOM 72 C LEU A 37 0.729 4.718 5.026 1.00 0.00 C ATOM 73 O LEU A 37 1.118 5.713 4.432 1.00 0.00 O ATOM 74 CB LEU A 37 -0.335 3.769 2.972 1.00 0.00 C ATOM 75 CG LEU A 37 -1.182 2.642 2.398 1.00 0.00 C ATOM 76 CD1 LEU A 37 -1.345 2.841 0.887 1.00 0.00 C ATOM 77 CD2 LEU A 37 -0.549 1.278 2.694 1.00 0.00 C ATOM 0 H LEU A 37 -2.430 4.520 3.990 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.502 2.979 5.011 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -0.610 4.704 2.483 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.712 3.582 2.735 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.164 2.665 2.871 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.952 2.034 0.477 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.835 3.796 0.697 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.364 2.835 0.411 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.172 0.489 2.274 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.444 1.233 2.247 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.468 1.141 3.772 1.00 0.00 H new ATOM 78 N ARG A 38 1.316 4.251 6.126 1.00 0.00 N ATOM 79 CA ARG A 38 2.496 4.915 6.723 1.00 0.00 C ATOM 80 C ARG A 38 3.685 3.983 6.968 1.00 0.00 C ATOM 81 O ARG A 38 3.579 2.951 7.644 1.00 0.00 O ATOM 82 CB ARG A 38 2.086 5.685 7.984 1.00 0.00 C ATOM 83 CG ARG A 38 3.250 6.545 8.520 1.00 0.00 C ATOM 84 CD ARG A 38 2.910 7.575 9.600 1.00 0.00 C ATOM 85 NE ARG A 38 2.146 6.923 10.669 1.00 0.00 N ATOM 86 CZ ARG A 38 1.642 7.505 11.766 1.00 0.00 C ATOM 87 NH1 ARG A 38 1.594 8.823 11.886 1.00 0.00 N ATOM 88 NH2 ARG A 38 1.098 6.773 12.718 1.00 0.00 N ATOM 0 H ARG A 38 1.003 3.420 6.628 1.00 0.00 H new ATOM 0 HA ARG A 38 2.864 5.625 5.983 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.232 6.324 7.761 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.766 4.983 8.753 1.00 0.00 H new ATOM 0 HG2 ARG A 38 4.012 5.875 8.918 1.00 0.00 H new ATOM 0 HG3 ARG A 38 3.698 7.072 7.678 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.824 8.010 10.004 1.00 0.00 H new ATOM 0 HD3 ARG A 38 2.331 8.392 9.170 1.00 0.00 H new ATOM 0 HE ARG A 38 1.981 5.922 10.567 1.00 0.00 H new ATOM 0 HH11 ARG A 38 1.945 9.417 11.134 1.00 0.00 H new ATOM 0 HH12 ARG A 38 1.206 9.244 12.730 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.059 5.758 12.622 1.00 0.00 H new ATOM 0 HH22 ARG A 38 0.716 7.221 13.551 1.00 0.00 H new ATOM 89 N ILE A 39 4.749 4.272 6.234 1.00 0.00 N ATOM 90 CA ILE A 39 6.098 3.810 6.607 1.00 0.00 C ATOM 91 C ILE A 39 6.626 4.692 7.728 1.00 0.00 C ATOM 92 O ILE A 39 7.194 5.770 7.556 1.00 0.00 O ATOM 93 CB ILE A 39 7.101 3.649 5.433 1.00 0.00 C ATOM 94 CG1 ILE A 39 8.509 3.249 5.909 1.00 0.00 C ATOM 95 CG2 ILE A 39 7.218 4.911 4.572 1.00 0.00 C ATOM 96 CD1 ILE A 39 8.582 1.985 6.777 1.00 0.00 C ATOM 0 H ILE A 39 4.715 4.823 5.376 1.00 0.00 H new ATOM 0 HA ILE A 39 5.997 2.784 6.961 1.00 0.00 H new ATOM 0 HB ILE A 39 6.685 2.845 4.826 1.00 0.00 H new ATOM 0 HG12 ILE A 39 9.141 3.104 5.033 1.00 0.00 H new ATOM 0 HG13 ILE A 39 8.932 4.080 6.473 1.00 0.00 H new ATOM 0 HG21 ILE A 39 7.933 4.738 3.768 1.00 0.00 H new ATOM 0 HG22 ILE A 39 6.244 5.152 4.146 1.00 0.00 H new ATOM 0 HG23 ILE A 39 7.560 5.742 5.189 1.00 0.00 H new ATOM 0 HD11 ILE A 39 9.618 1.795 7.057 1.00 0.00 H new ATOM 0 HD12 ILE A 39 7.984 2.127 7.677 1.00 0.00 H new ATOM 0 HD13 ILE A 39 8.196 1.135 6.215 1.00 0.00 H new ATOM 97 N LEU A 40 6.452 4.081 8.882 1.00 0.00 N ATOM 98 CA LEU A 40 6.851 4.701 10.142 1.00 0.00 C ATOM 99 C LEU A 40 8.381 4.815 10.204 1.00 0.00 C ATOM 100 O LEU A 40 9.064 3.863 9.798 1.00 0.00 O ATOM 101 CB LEU A 40 6.349 3.924 11.369 1.00 0.00 C ATOM 102 CG LEU A 40 4.898 4.156 11.788 1.00 0.00 C ATOM 103 CD1 LEU A 40 4.727 5.629 12.146 1.00 0.00 C ATOM 104 CD2 LEU A 40 3.884 3.754 10.722 1.00 0.00 C ATOM 0 H LEU A 40 6.037 3.154 8.980 1.00 0.00 H new ATOM 0 HA LEU A 40 6.393 5.690 10.170 1.00 0.00 H new ATOM 0 HB2 LEU A 40 6.480 2.860 11.173 1.00 0.00 H new ATOM 0 HB3 LEU A 40 6.990 4.174 12.214 1.00 0.00 H new ATOM 0 HG LEU A 40 4.697 3.516 12.647 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.696 5.813 12.448 1.00 0.00 H new ATOM 0 HD12 LEU A 40 5.396 5.884 12.968 1.00 0.00 H new ATOM 0 HD13 LEU A 40 4.966 6.244 11.279 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.876 3.946 11.088 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.058 4.335 9.816 1.00 0.00 H new ATOM 0 HD23 LEU A 40 3.993 2.693 10.498 1.00 0.00 H new ATOM 105 N PRO A 41 8.894 5.878 10.827 1.00 0.00 N ATOM 106 CA PRO A 41 10.342 6.037 11.056 1.00 0.00 C ATOM 107 C PRO A 41 10.942 4.906 11.921 1.00 0.00 C ATOM 108 O PRO A 41 12.116 4.572 11.799 1.00 0.00 O ATOM 109 CB PRO A 41 10.473 7.420 11.702 1.00 0.00 C ATOM 110 CG PRO A 41 9.128 7.656 12.378 1.00 0.00 C ATOM 111 CD PRO A 41 8.111 6.961 11.462 1.00 0.00 C ATOM 0 HA PRO A 41 10.912 5.966 10.129 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.289 7.445 12.424 1.00 0.00 H new ATOM 0 HB3 PRO A 41 10.683 8.188 10.957 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.110 7.235 13.383 1.00 0.00 H new ATOM 0 HG3 PRO A 41 8.913 8.720 12.474 1.00 0.00 H new ATOM 0 HD2 PRO A 41 7.267 6.566 12.028 1.00 0.00 H new ATOM 0 HD3 PRO A 41 7.704 7.649 10.721 1.00 0.00 H new ATOM 112 N ASP A 42 10.058 4.242 12.671 1.00 0.00 N ATOM 113 CA ASP A 42 10.303 3.049 13.496 1.00 0.00 C ATOM 114 C ASP A 42 10.602 1.774 12.677 1.00 0.00 C ATOM 115 O ASP A 42 10.790 0.701 13.259 1.00 0.00 O ATOM 116 CB ASP A 42 9.019 2.890 14.320 1.00 0.00 C ATOM 117 CG ASP A 42 9.123 1.938 15.512 1.00 0.00 C ATOM 118 OD1 ASP A 42 9.993 2.201 16.372 1.00 0.00 O ATOM 119 OD2 ASP A 42 8.244 1.054 15.598 1.00 0.00 O ATOM 0 H ASP A 42 9.085 4.542 12.723 1.00 0.00 H new ATOM 0 HA ASP A 42 11.196 3.179 14.107 1.00 0.00 H new ATOM 0 HB2 ASP A 42 8.717 3.872 14.685 1.00 0.00 H new ATOM 0 HB3 ASP A 42 8.225 2.537 13.662 1.00 0.00 H new ATOM 120 N GLY A 43 10.433 1.885 11.363 1.00 0.00 N ATOM 121 CA GLY A 43 10.669 0.812 10.380 1.00 0.00 C ATOM 122 C GLY A 43 9.506 -0.187 10.230 1.00 0.00 C ATOM 123 O GLY A 43 9.742 -1.336 9.874 1.00 0.00 O ATOM 0 H GLY A 43 10.117 2.752 10.929 1.00 0.00 H new ATOM 0 HA2 GLY A 43 10.870 1.265 9.409 1.00 0.00 H new ATOM 0 HA3 GLY A 43 11.566 0.264 10.668 1.00 0.00 H new ATOM 124 N THR A 44 8.276 0.299 10.377 1.00 0.00 N ATOM 125 CA THR A 44 7.087 -0.584 10.248 1.00 0.00 C ATOM 126 C THR A 44 6.038 0.036 9.337 1.00 0.00 C ATOM 127 O THR A 44 5.837 1.247 9.322 1.00 0.00 O ATOM 128 CB THR A 44 6.486 -1.029 11.595 1.00 0.00 C ATOM 129 OG1 THR A 44 5.288 -1.769 11.334 1.00 0.00 O ATOM 130 CG2 THR A 44 6.200 0.124 12.567 1.00 0.00 C ATOM 0 H THR A 44 8.063 1.275 10.581 1.00 0.00 H new ATOM 0 HA THR A 44 7.447 -1.501 9.782 1.00 0.00 H new ATOM 0 HB THR A 44 7.233 -1.646 12.094 1.00 0.00 H new ATOM 0 HG1 THR A 44 4.893 -2.061 12.182 1.00 0.00 H new ATOM 0 HG21 THR A 44 5.779 -0.274 13.490 1.00 0.00 H new ATOM 0 HG22 THR A 44 7.128 0.651 12.789 1.00 0.00 H new ATOM 0 HG23 THR A 44 5.490 0.815 12.113 1.00 0.00 H new ATOM 131 N VAL A 45 5.529 -0.817 8.448 1.00 0.00 N ATOM 132 CA VAL A 45 4.475 -0.410 7.498 1.00 0.00 C ATOM 133 C VAL A 45 3.092 -0.666 8.111 1.00 0.00 C ATOM 134 O VAL A 45 2.611 -1.789 8.277 1.00 0.00 O ATOM 135 CB VAL A 45 4.742 -0.994 6.112 1.00 0.00 C ATOM 136 CG1 VAL A 45 3.633 -0.731 5.092 1.00 0.00 C ATOM 137 CG2 VAL A 45 6.003 -0.311 5.565 1.00 0.00 C ATOM 0 H VAL A 45 5.822 -1.790 8.360 1.00 0.00 H new ATOM 0 HA VAL A 45 4.491 0.665 7.321 1.00 0.00 H new ATOM 0 HB VAL A 45 4.827 -2.073 6.237 1.00 0.00 H new ATOM 0 HG11 VAL A 45 3.904 -1.180 4.136 1.00 0.00 H new ATOM 0 HG12 VAL A 45 2.700 -1.169 5.447 1.00 0.00 H new ATOM 0 HG13 VAL A 45 3.503 0.344 4.964 1.00 0.00 H new ATOM 0 HG21 VAL A 45 6.228 -0.703 4.573 1.00 0.00 H new ATOM 0 HG22 VAL A 45 5.836 0.764 5.501 1.00 0.00 H new ATOM 0 HG23 VAL A 45 6.842 -0.509 6.232 1.00 0.00 H new ATOM 138 N ASP A 46 2.605 0.457 8.612 1.00 0.00 N ATOM 139 CA ASP A 46 1.325 0.550 9.335 1.00 0.00 C ATOM 140 C ASP A 46 0.378 1.559 8.676 1.00 0.00 C ATOM 141 O ASP A 46 0.706 2.155 7.659 1.00 0.00 O ATOM 142 CB ASP A 46 1.567 1.016 10.778 1.00 0.00 C ATOM 143 CG ASP A 46 2.171 -0.065 11.675 1.00 0.00 C ATOM 144 OD1 ASP A 46 1.719 -1.226 11.577 1.00 0.00 O ATOM 145 OD2 ASP A 46 3.018 0.324 12.511 1.00 0.00 O ATOM 0 H ASP A 46 3.089 1.352 8.532 1.00 0.00 H new ATOM 0 HA ASP A 46 0.874 -0.442 9.314 1.00 0.00 H new ATOM 0 HB2 ASP A 46 2.232 1.880 10.766 1.00 0.00 H new ATOM 0 HB3 ASP A 46 0.622 1.347 11.208 1.00 0.00 H new ATOM 146 N GLY A 47 -0.860 1.552 9.159 1.00 0.00 N ATOM 147 CA GLY A 47 -1.798 2.655 8.924 1.00 0.00 C ATOM 148 C GLY A 47 -1.610 3.697 10.048 1.00 0.00 C ATOM 149 O GLY A 47 -0.596 3.721 10.733 1.00 0.00 O ATOM 0 H GLY A 47 -1.243 0.791 9.720 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.614 3.109 7.950 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.824 2.286 8.915 1.00 0.00 H new ATOM 150 N THR A 48 -2.701 4.423 10.289 1.00 0.00 N ATOM 151 CA THR A 48 -2.719 5.570 11.230 1.00 0.00 C ATOM 152 C THR A 48 -4.088 6.232 11.414 1.00 0.00 C ATOM 153 O THR A 48 -4.742 6.672 10.474 1.00 0.00 O ATOM 154 CB THR A 48 -1.708 6.641 10.822 1.00 0.00 C ATOM 155 OG1 THR A 48 -1.755 7.722 11.754 1.00 0.00 O ATOM 156 CG2 THR A 48 -1.915 7.123 9.374 1.00 0.00 C ATOM 0 H THR A 48 -3.601 4.243 9.845 1.00 0.00 H new ATOM 0 HA THR A 48 -2.449 5.128 12.189 1.00 0.00 H new ATOM 0 HB THR A 48 -0.713 6.198 10.847 1.00 0.00 H new ATOM 0 HG1 THR A 48 -1.385 7.429 12.613 1.00 0.00 H new ATOM 0 HG21 THR A 48 -1.172 7.883 9.134 1.00 0.00 H new ATOM 0 HG22 THR A 48 -1.806 6.280 8.691 1.00 0.00 H new ATOM 0 HG23 THR A 48 -2.914 7.547 9.271 1.00 0.00 H new ATOM 157 N ARG A 49 -4.524 6.164 12.652 1.00 0.00 N ATOM 158 CA ARG A 49 -5.688 6.936 13.132 1.00 0.00 C ATOM 159 C ARG A 49 -5.449 8.448 13.291 1.00 0.00 C ATOM 160 O ARG A 49 -6.386 9.238 13.323 1.00 0.00 O ATOM 161 CB ARG A 49 -6.142 6.293 14.438 1.00 0.00 C ATOM 162 CG ARG A 49 -5.054 6.226 15.519 1.00 0.00 C ATOM 163 CD ARG A 49 -5.627 5.542 16.757 1.00 0.00 C ATOM 164 NE ARG A 49 -6.812 6.317 17.170 1.00 0.00 N ATOM 165 CZ ARG A 49 -7.111 6.702 18.401 1.00 0.00 C ATOM 166 NH1 ARG A 49 -6.429 6.228 19.427 1.00 0.00 N ATOM 167 NH2 ARG A 49 -8.223 7.362 18.660 1.00 0.00 N ATOM 0 H ARG A 49 -4.094 5.578 13.367 1.00 0.00 H new ATOM 0 HA ARG A 49 -6.465 6.890 12.369 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -6.992 6.852 14.829 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -6.494 5.283 14.229 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -4.190 5.674 15.150 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -4.709 7.229 15.769 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -5.899 4.510 16.536 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -4.888 5.512 17.558 1.00 0.00 H new ATOM 0 HE ARG A 49 -7.466 6.583 16.434 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -5.670 5.564 19.272 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -6.661 6.526 20.375 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -8.871 7.585 17.905 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -8.435 7.650 19.615 1.00 0.00 H new ATOM 168 N ASP A 50 -4.175 8.819 13.332 1.00 0.00 N ATOM 169 CA ASP A 50 -3.714 10.202 13.526 1.00 0.00 C ATOM 170 C ASP A 50 -2.339 10.377 12.860 1.00 0.00 C ATOM 171 O ASP A 50 -1.320 9.943 13.411 1.00 0.00 O ATOM 172 CB ASP A 50 -3.661 10.519 15.022 1.00 0.00 C ATOM 173 CG ASP A 50 -3.276 11.977 15.340 1.00 0.00 C ATOM 174 OD1 ASP A 50 -3.050 12.753 14.378 1.00 0.00 O ATOM 175 OD2 ASP A 50 -3.126 12.275 16.538 1.00 0.00 O ATOM 0 H ASP A 50 -3.408 8.154 13.229 1.00 0.00 H new ATOM 0 HA ASP A 50 -4.409 10.901 13.060 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -4.635 10.307 15.463 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -2.943 9.852 15.499 1.00 0.00 H new ATOM 176 N ARG A 51 -2.355 11.051 11.717 1.00 0.00 N ATOM 177 CA ARG A 51 -1.142 11.273 10.896 1.00 0.00 C ATOM 178 C ARG A 51 -0.240 12.361 11.524 1.00 0.00 C ATOM 179 O ARG A 51 -0.121 13.483 11.027 1.00 0.00 O ATOM 180 CB ARG A 51 -1.471 11.653 9.451 1.00 0.00 C ATOM 181 CG ARG A 51 -2.466 10.753 8.713 1.00 0.00 C ATOM 182 CD ARG A 51 -3.800 11.478 8.525 1.00 0.00 C ATOM 183 NE ARG A 51 -4.679 11.282 9.695 1.00 0.00 N ATOM 184 CZ ARG A 51 -5.009 12.198 10.611 1.00 0.00 C ATOM 185 NH1 ARG A 51 -4.351 13.344 10.748 1.00 0.00 N ATOM 186 NH2 ARG A 51 -5.866 11.896 11.577 1.00 0.00 N ATOM 0 H ARG A 51 -3.200 11.464 11.322 1.00 0.00 H new ATOM 0 HA ARG A 51 -0.608 10.323 10.877 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -1.864 12.670 9.448 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -0.541 11.669 8.883 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -2.059 10.469 7.743 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.621 9.832 9.276 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -3.621 12.543 8.374 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -4.296 11.108 7.627 1.00 0.00 H new ATOM 0 HE ARG A 51 -5.076 10.350 9.817 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -3.559 13.553 10.140 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -4.638 14.015 11.461 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -6.275 10.963 11.622 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -6.116 12.597 12.275 1.00 0.00 H new ATOM 187 N SER A 52 0.400 11.935 12.602 1.00 0.00 N ATOM 188 CA SER A 52 1.401 12.682 13.392 1.00 0.00 C ATOM 189 C SER A 52 2.291 13.558 12.501 1.00 0.00 C ATOM 190 O SER A 52 2.444 14.761 12.702 1.00 0.00 O ATOM 191 CB SER A 52 2.266 11.657 14.135 1.00 0.00 C ATOM 192 OG SER A 52 3.369 12.304 14.761 1.00 0.00 O ATOM 0 H SER A 52 0.233 11.003 12.982 1.00 0.00 H new ATOM 0 HA SER A 52 0.887 13.346 14.087 1.00 0.00 H new ATOM 0 HB2 SER A 52 1.666 11.139 14.884 1.00 0.00 H new ATOM 0 HB3 SER A 52 2.627 10.901 13.437 1.00 0.00 H new ATOM 0 HG SER A 52 3.913 11.640 15.233 1.00 0.00 H new ATOM 193 N ASP A 53 2.906 12.846 11.565 1.00 0.00 N ATOM 194 CA ASP A 53 3.802 13.395 10.539 1.00 0.00 C ATOM 195 C ASP A 53 3.955 12.407 9.393 1.00 0.00 C ATOM 196 O ASP A 53 3.853 11.198 9.591 1.00 0.00 O ATOM 197 CB ASP A 53 5.165 13.603 11.205 1.00 0.00 C ATOM 198 CG ASP A 53 5.892 14.865 10.769 1.00 0.00 C ATOM 199 OD1 ASP A 53 5.670 15.310 9.621 1.00 0.00 O ATOM 200 OD2 ASP A 53 6.700 15.341 11.599 1.00 0.00 O ATOM 0 H ASP A 53 2.795 11.835 11.492 1.00 0.00 H new ATOM 0 HA ASP A 53 3.402 14.327 10.140 1.00 0.00 H new ATOM 0 HB2 ASP A 53 5.027 13.633 12.286 1.00 0.00 H new ATOM 0 HB3 ASP A 53 5.797 12.741 10.988 1.00 0.00 H new ATOM 201 N GLN A 54 3.775 13.048 8.247 1.00 0.00 N ATOM 202 CA GLN A 54 4.010 12.672 6.837 1.00 0.00 C ATOM 203 C GLN A 54 4.916 11.489 6.455 1.00 0.00 C ATOM 204 O GLN A 54 5.221 11.306 5.276 1.00 0.00 O ATOM 205 CB GLN A 54 4.522 13.928 6.134 1.00 0.00 C ATOM 206 CG GLN A 54 3.427 14.915 5.728 1.00 0.00 C ATOM 207 CD GLN A 54 2.662 15.511 6.914 1.00 0.00 C ATOM 208 OE1 GLN A 54 3.201 15.894 7.942 1.00 0.00 O ATOM 209 NE2 GLN A 54 1.353 15.441 6.860 1.00 0.00 N ATOM 0 H GLN A 54 3.401 13.996 8.280 1.00 0.00 H new ATOM 0 HA GLN A 54 3.041 12.282 6.526 1.00 0.00 H new ATOM 0 HB2 GLN A 54 5.227 14.436 6.792 1.00 0.00 H new ATOM 0 HB3 GLN A 54 5.075 13.631 5.243 1.00 0.00 H new ATOM 0 HG2 GLN A 54 3.876 15.725 5.153 1.00 0.00 H new ATOM 0 HG3 GLN A 54 2.721 14.409 5.069 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.894 15.123 6.007 1.00 0.00 H new ATOM 0 HE22 GLN A 54 0.794 15.705 7.671 1.00 0.00 H new ATOM 210 N HIS A 55 5.252 10.627 7.407 1.00 0.00 N ATOM 211 CA HIS A 55 5.894 9.338 7.103 1.00 0.00 C ATOM 212 C HIS A 55 4.953 8.457 6.244 1.00 0.00 C ATOM 213 O HIS A 55 5.336 7.364 5.822 1.00 0.00 O ATOM 214 CB HIS A 55 6.333 8.663 8.418 1.00 0.00 C ATOM 215 CG HIS A 55 7.110 9.603 9.345 1.00 0.00 C ATOM 216 ND1 HIS A 55 6.666 10.012 10.534 1.00 0.00 N ATOM 217 CD2 HIS A 55 8.302 10.158 9.147 1.00 0.00 C ATOM 218 CE1 HIS A 55 7.589 10.812 11.076 1.00 0.00 C ATOM 219 NE2 HIS A 55 8.589 10.898 10.204 1.00 0.00 N ATOM 0 H HIS A 55 5.093 10.791 8.401 1.00 0.00 H new ATOM 0 HA HIS A 55 6.792 9.493 6.505 1.00 0.00 H new ATOM 0 HB2 HIS A 55 5.451 8.293 8.941 1.00 0.00 H new ATOM 0 HB3 HIS A 55 6.953 7.797 8.186 1.00 0.00 H new ATOM 0 HD2 HIS A 55 8.926 10.027 8.275 1.00 0.00 H new ATOM 0 HE1 HIS A 55 7.533 11.297 12.040 1.00 0.00 H new ATOM 0 HE2 HIS A 55 9.440 11.446 10.330 1.00 0.00 H new ATOM 220 N ILE A 56 3.708 8.903 6.061 1.00 0.00 N ATOM 221 CA ILE A 56 2.747 8.340 5.082 1.00 0.00 C ATOM 222 C ILE A 56 3.363 8.122 3.693 1.00 0.00 C ATOM 223 O ILE A 56 3.785 9.039 2.987 1.00 0.00 O ATOM 224 CB ILE A 56 1.345 9.006 5.068 1.00 0.00 C ATOM 225 CG1 ILE A 56 1.391 10.519 4.835 1.00 0.00 C ATOM 226 CG2 ILE A 56 0.554 8.665 6.330 1.00 0.00 C ATOM 227 CD1 ILE A 56 1.323 10.884 3.345 1.00 0.00 C ATOM 0 H ILE A 56 3.322 9.681 6.595 1.00 0.00 H new ATOM 0 HA ILE A 56 2.528 7.342 5.462 1.00 0.00 H new ATOM 0 HB ILE A 56 0.823 8.584 4.210 1.00 0.00 H new ATOM 0 HG12 ILE A 56 0.560 10.990 5.360 1.00 0.00 H new ATOM 0 HG13 ILE A 56 2.309 10.922 5.264 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -0.423 9.147 6.289 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.423 7.585 6.397 1.00 0.00 H new ATOM 0 HG23 ILE A 56 1.097 9.020 7.206 1.00 0.00 H new ATOM 0 HD11 ILE A 56 1.359 11.968 3.234 1.00 0.00 H new ATOM 0 HD12 ILE A 56 2.169 10.437 2.822 1.00 0.00 H new ATOM 0 HD13 ILE A 56 0.393 10.506 2.920 1.00 0.00 H new ATOM 228 N GLN A 57 3.305 6.851 3.333 1.00 0.00 N ATOM 229 CA GLN A 57 3.969 6.272 2.150 1.00 0.00 C ATOM 230 C GLN A 57 3.218 6.401 0.819 1.00 0.00 C ATOM 231 O GLN A 57 3.722 5.961 -0.212 1.00 0.00 O ATOM 232 CB GLN A 57 4.416 4.828 2.426 1.00 0.00 C ATOM 233 CG GLN A 57 3.268 3.849 2.688 1.00 0.00 C ATOM 234 CD GLN A 57 3.659 2.724 3.648 1.00 0.00 C ATOM 235 OE1 GLN A 57 4.771 2.229 3.701 1.00 0.00 O ATOM 236 NE2 GLN A 57 2.718 2.313 4.457 1.00 0.00 N ATOM 0 H GLN A 57 2.779 6.160 3.867 1.00 0.00 H new ATOM 0 HA GLN A 57 4.847 6.899 1.996 1.00 0.00 H new ATOM 0 HB2 GLN A 57 4.995 4.471 1.574 1.00 0.00 H new ATOM 0 HB3 GLN A 57 5.083 4.826 3.288 1.00 0.00 H new ATOM 0 HG2 GLN A 57 2.418 4.394 3.100 1.00 0.00 H new ATOM 0 HG3 GLN A 57 2.941 3.417 1.742 1.00 0.00 H new ATOM 0 HE21 GLN A 57 1.788 2.729 4.411 1.00 0.00 H new ATOM 0 HE22 GLN A 57 2.914 1.576 5.135 1.00 0.00 H new ATOM 237 N LEU A 58 2.232 7.290 0.827 1.00 0.00 N ATOM 238 CA LEU A 58 1.296 7.392 -0.293 1.00 0.00 C ATOM 239 C LEU A 58 1.355 8.725 -1.043 1.00 0.00 C ATOM 240 O LEU A 58 0.817 9.754 -0.627 1.00 0.00 O ATOM 241 CB LEU A 58 -0.082 6.972 0.215 1.00 0.00 C ATOM 242 CG LEU A 58 -1.230 7.060 -0.809 1.00 0.00 C ATOM 243 CD1 LEU A 58 -0.879 6.462 -2.184 1.00 0.00 C ATOM 244 CD2 LEU A 58 -2.474 6.395 -0.221 1.00 0.00 C ATOM 0 H LEU A 58 2.058 7.947 1.588 1.00 0.00 H new ATOM 0 HA LEU A 58 1.588 6.705 -1.087 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.018 5.945 0.574 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.337 7.594 1.073 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.421 8.117 -0.997 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.735 6.560 -2.852 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.027 6.995 -2.606 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.627 5.408 -2.069 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -3.292 6.453 -0.940 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.258 5.350 -0.001 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -2.761 6.908 0.697 1.00 0.00 H new ATOM 245 N GLN A 59 2.297 8.679 -1.955 1.00 0.00 N ATOM 246 CA GLN A 59 2.425 9.612 -3.072 1.00 0.00 C ATOM 247 C GLN A 59 3.011 8.843 -4.232 1.00 0.00 C ATOM 248 O GLN A 59 4.066 8.206 -4.139 1.00 0.00 O ATOM 249 CB GLN A 59 3.376 10.750 -2.694 1.00 0.00 C ATOM 250 CG GLN A 59 3.031 12.083 -3.392 1.00 0.00 C ATOM 251 CD GLN A 59 3.074 12.003 -4.929 1.00 0.00 C ATOM 252 OE1 GLN A 59 2.066 11.988 -5.623 1.00 0.00 O ATOM 253 NE2 GLN A 59 4.256 11.887 -5.475 1.00 0.00 N ATOM 0 H GLN A 59 3.028 7.967 -1.948 1.00 0.00 H new ATOM 0 HA GLN A 59 1.455 10.038 -3.328 1.00 0.00 H new ATOM 0 HB2 GLN A 59 3.349 10.895 -1.614 1.00 0.00 H new ATOM 0 HB3 GLN A 59 4.396 10.465 -2.952 1.00 0.00 H new ATOM 0 HG2 GLN A 59 2.036 12.399 -3.081 1.00 0.00 H new ATOM 0 HG3 GLN A 59 3.729 12.850 -3.057 1.00 0.00 H new ATOM 0 HE21 GLN A 59 5.092 11.900 -4.890 1.00 0.00 H new ATOM 0 HE22 GLN A 59 4.343 11.783 -6.486 1.00 0.00 H new ATOM 254 N LEU A 60 2.207 8.821 -5.272 1.00 0.00 N ATOM 255 CA LEU A 60 2.320 7.699 -6.190 1.00 0.00 C ATOM 256 C LEU A 60 2.593 8.067 -7.652 1.00 0.00 C ATOM 257 O LEU A 60 1.906 8.870 -8.283 1.00 0.00 O ATOM 258 CB LEU A 60 1.155 6.744 -5.996 1.00 0.00 C ATOM 259 CG LEU A 60 -0.213 7.218 -6.481 1.00 0.00 C ATOM 260 CD1 LEU A 60 -1.034 5.959 -6.386 1.00 0.00 C ATOM 261 CD2 LEU A 60 -0.847 8.358 -5.674 1.00 0.00 C ATOM 0 H LEU A 60 1.503 9.523 -5.501 1.00 0.00 H new ATOM 0 HA LEU A 60 3.236 7.173 -5.922 1.00 0.00 H new ATOM 0 HB2 LEU A 60 1.392 5.811 -6.507 1.00 0.00 H new ATOM 0 HB3 LEU A 60 1.078 6.514 -4.933 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.144 7.660 -7.475 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.054 6.164 -6.711 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.598 5.191 -7.025 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.045 5.609 -5.354 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.815 8.615 -6.105 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.983 8.040 -4.640 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -0.194 9.231 -5.702 1.00 0.00 H new ATOM 262 N SER A 61 3.623 7.410 -8.145 1.00 0.00 N ATOM 263 CA SER A 61 4.182 7.659 -9.494 1.00 0.00 C ATOM 264 C SER A 61 4.168 6.437 -10.399 1.00 0.00 C ATOM 265 O SER A 61 4.781 5.400 -10.134 1.00 0.00 O ATOM 266 CB SER A 61 5.592 8.219 -9.413 1.00 0.00 C ATOM 267 OG SER A 61 6.216 8.265 -10.710 1.00 0.00 O ATOM 0 H SER A 61 4.113 6.678 -7.630 1.00 0.00 H new ATOM 0 HA SER A 61 3.519 8.397 -9.946 1.00 0.00 H new ATOM 0 HB2 SER A 61 5.563 9.222 -8.986 1.00 0.00 H new ATOM 0 HB3 SER A 61 6.191 7.604 -8.741 1.00 0.00 H new ATOM 0 HG SER A 61 7.121 8.631 -10.625 1.00 0.00 H new ATOM 268 N ALA A 62 3.317 6.565 -11.388 1.00 0.00 N ATOM 269 CA ALA A 62 3.192 5.574 -12.462 1.00 0.00 C ATOM 270 C ALA A 62 4.329 5.574 -13.492 1.00 0.00 C ATOM 271 O ALA A 62 4.558 6.524 -14.232 1.00 0.00 O ATOM 272 CB ALA A 62 1.822 5.702 -13.141 1.00 0.00 C ATOM 0 H ALA A 62 2.683 7.358 -11.483 1.00 0.00 H new ATOM 0 HA ALA A 62 3.277 4.603 -11.974 1.00 0.00 H new ATOM 0 HB1 ALA A 62 1.740 4.962 -13.937 1.00 0.00 H new ATOM 0 HB2 ALA A 62 1.035 5.534 -12.406 1.00 0.00 H new ATOM 0 HB3 ALA A 62 1.717 6.701 -13.563 1.00 0.00 H new ATOM 273 N GLU A 63 5.011 4.443 -13.476 1.00 0.00 N ATOM 274 CA GLU A 63 6.109 4.065 -14.378 1.00 0.00 C ATOM 275 C GLU A 63 5.583 3.749 -15.800 1.00 0.00 C ATOM 276 O GLU A 63 6.292 3.955 -16.776 1.00 0.00 O ATOM 277 CB GLU A 63 6.782 2.869 -13.694 1.00 0.00 C ATOM 278 CG GLU A 63 7.900 2.144 -14.462 1.00 0.00 C ATOM 279 CD GLU A 63 7.389 1.128 -15.484 1.00 0.00 C ATOM 280 OE1 GLU A 63 6.447 0.379 -15.127 1.00 0.00 O ATOM 281 OE2 GLU A 63 7.931 1.118 -16.603 1.00 0.00 O ATOM 0 H GLU A 63 4.808 3.712 -12.794 1.00 0.00 H new ATOM 0 HA GLU A 63 6.826 4.871 -14.535 1.00 0.00 H new ATOM 0 HB2 GLU A 63 7.195 3.213 -12.746 1.00 0.00 H new ATOM 0 HB3 GLU A 63 6.008 2.138 -13.458 1.00 0.00 H new ATOM 0 HG2 GLU A 63 8.514 2.884 -14.975 1.00 0.00 H new ATOM 0 HG3 GLU A 63 8.546 1.633 -13.748 1.00 0.00 H new ATOM 282 N SER A 64 4.382 3.173 -15.852 1.00 0.00 N ATOM 283 CA SER A 64 3.686 2.725 -17.078 1.00 0.00 C ATOM 284 C SER A 64 2.235 2.266 -16.728 1.00 0.00 C ATOM 285 O SER A 64 1.739 2.573 -15.647 1.00 0.00 O ATOM 286 CB SER A 64 4.524 1.603 -17.703 1.00 0.00 C ATOM 287 OG SER A 64 3.977 1.149 -18.955 1.00 0.00 O ATOM 0 H SER A 64 3.836 2.994 -15.009 1.00 0.00 H new ATOM 0 HA SER A 64 3.588 3.535 -17.801 1.00 0.00 H new ATOM 0 HB2 SER A 64 5.543 1.957 -17.861 1.00 0.00 H new ATOM 0 HB3 SER A 64 4.582 0.765 -17.008 1.00 0.00 H new ATOM 0 HG SER A 64 4.542 0.436 -19.319 1.00 0.00 H new ATOM 288 N VAL A 65 1.655 1.446 -17.600 1.00 0.00 N ATOM 289 CA VAL A 65 0.287 0.880 -17.570 1.00 0.00 C ATOM 290 C VAL A 65 -0.116 0.218 -16.236 1.00 0.00 C ATOM 291 O VAL A 65 0.286 -0.904 -15.901 1.00 0.00 O ATOM 292 CB VAL A 65 0.168 -0.063 -18.792 1.00 0.00 C ATOM 293 CG1 VAL A 65 1.155 -1.236 -18.739 1.00 0.00 C ATOM 294 CG2 VAL A 65 -1.275 -0.558 -18.987 1.00 0.00 C ATOM 0 H VAL A 65 2.166 1.125 -18.423 1.00 0.00 H new ATOM 0 HA VAL A 65 -0.438 1.691 -17.638 1.00 0.00 H new ATOM 0 HB VAL A 65 0.440 0.533 -19.663 1.00 0.00 H new ATOM 0 HG11 VAL A 65 1.024 -1.862 -19.622 1.00 0.00 H new ATOM 0 HG12 VAL A 65 2.175 -0.852 -18.714 1.00 0.00 H new ATOM 0 HG13 VAL A 65 0.968 -1.828 -17.843 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -1.319 -1.217 -19.854 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.596 -1.103 -18.099 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.934 0.295 -19.146 1.00 0.00 H new ATOM 295 N GLY A 66 -0.771 1.026 -15.430 1.00 0.00 N ATOM 296 CA GLY A 66 -1.250 0.662 -14.074 1.00 0.00 C ATOM 297 C GLY A 66 -0.133 0.661 -13.007 1.00 0.00 C ATOM 298 O GLY A 66 -0.361 0.953 -11.832 1.00 0.00 O ATOM 0 H GLY A 66 -1.001 1.985 -15.688 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -2.029 1.362 -13.772 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.707 -0.327 -14.112 1.00 0.00 H new ATOM 299 N GLU A 67 1.076 0.440 -13.483 1.00 0.00 N ATOM 300 CA GLU A 67 2.298 0.257 -12.717 1.00 0.00 C ATOM 301 C GLU A 67 2.764 1.512 -11.967 1.00 0.00 C ATOM 302 O GLU A 67 3.423 2.389 -12.525 1.00 0.00 O ATOM 303 CB GLU A 67 3.413 -0.135 -13.677 1.00 0.00 C ATOM 304 CG GLU A 67 3.085 -1.383 -14.492 1.00 0.00 C ATOM 305 CD GLU A 67 4.125 -1.691 -15.565 1.00 0.00 C ATOM 306 OE1 GLU A 67 5.200 -2.218 -15.213 1.00 0.00 O ATOM 307 OE2 GLU A 67 3.794 -1.430 -16.740 1.00 0.00 O ATOM 0 H GLU A 67 1.245 0.379 -14.487 1.00 0.00 H new ATOM 0 HA GLU A 67 2.080 -0.508 -11.972 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.609 0.695 -14.356 1.00 0.00 H new ATOM 0 HB3 GLU A 67 4.329 -0.307 -13.111 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.002 -2.237 -13.820 1.00 0.00 H new ATOM 0 HG3 GLU A 67 2.111 -1.255 -14.965 1.00 0.00 H new ATOM 308 N VAL A 68 2.580 1.431 -10.667 1.00 0.00 N ATOM 309 CA VAL A 68 2.831 2.562 -9.767 1.00 0.00 C ATOM 310 C VAL A 68 3.690 2.312 -8.527 1.00 0.00 C ATOM 311 O VAL A 68 3.432 1.470 -7.676 1.00 0.00 O ATOM 312 CB VAL A 68 1.516 3.256 -9.457 1.00 0.00 C ATOM 313 CG1 VAL A 68 0.499 2.340 -8.774 1.00 0.00 C ATOM 314 CG2 VAL A 68 1.586 4.439 -8.542 1.00 0.00 C ATOM 0 H VAL A 68 2.254 0.588 -10.195 1.00 0.00 H new ATOM 0 HA VAL A 68 3.491 3.226 -10.325 1.00 0.00 H new ATOM 0 HB VAL A 68 1.225 3.568 -10.460 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -0.418 2.896 -8.580 1.00 0.00 H new ATOM 0 HG12 VAL A 68 0.279 1.492 -9.423 1.00 0.00 H new ATOM 0 HG13 VAL A 68 0.911 1.978 -7.832 1.00 0.00 H new ATOM 0 HG21 VAL A 68 0.586 4.847 -8.398 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.995 4.131 -7.580 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.229 5.202 -8.982 1.00 0.00 H new ATOM 315 N TYR A 69 4.568 3.289 -8.407 1.00 0.00 N ATOM 316 CA TYR A 69 5.527 3.427 -7.321 1.00 0.00 C ATOM 317 C TYR A 69 4.954 4.295 -6.198 1.00 0.00 C ATOM 318 O TYR A 69 4.612 5.457 -6.416 1.00 0.00 O ATOM 319 CB TYR A 69 6.773 4.132 -7.856 1.00 0.00 C ATOM 320 CG TYR A 69 7.823 3.167 -8.422 1.00 0.00 C ATOM 321 CD1 TYR A 69 8.178 1.995 -7.712 1.00 0.00 C ATOM 322 CD2 TYR A 69 8.310 3.418 -9.719 1.00 0.00 C ATOM 323 CE1 TYR A 69 9.004 1.037 -8.325 1.00 0.00 C ATOM 324 CE2 TYR A 69 9.159 2.467 -10.332 1.00 0.00 C ATOM 325 CZ TYR A 69 9.497 1.298 -9.631 1.00 0.00 C ATOM 326 OH TYR A 69 10.381 0.422 -10.178 1.00 0.00 O ATOM 0 H TYR A 69 4.638 4.042 -9.092 1.00 0.00 H new ATOM 0 HA TYR A 69 5.759 2.434 -6.935 1.00 0.00 H new ATOM 0 HB2 TYR A 69 6.478 4.834 -8.636 1.00 0.00 H new ATOM 0 HB3 TYR A 69 7.223 4.717 -7.054 1.00 0.00 H new ATOM 0 HD1 TYR A 69 7.817 1.838 -6.706 1.00 0.00 H new ATOM 0 HD2 TYR A 69 8.039 4.325 -10.239 1.00 0.00 H new ATOM 0 HE1 TYR A 69 9.259 0.121 -7.813 1.00 0.00 H new ATOM 0 HE2 TYR A 69 9.543 2.638 -11.327 1.00 0.00 H new ATOM 0 HH TYR A 69 10.632 0.727 -11.075 1.00 0.00 H new ATOM 327 N ILE A 70 4.819 3.697 -5.026 1.00 0.00 N ATOM 328 CA ILE A 70 4.193 4.392 -3.879 1.00 0.00 C ATOM 329 C ILE A 70 5.267 4.844 -2.889 1.00 0.00 C ATOM 330 O ILE A 70 5.713 4.145 -1.985 1.00 0.00 O ATOM 331 CB ILE A 70 3.050 3.547 -3.302 1.00 0.00 C ATOM 332 CG1 ILE A 70 2.076 3.239 -4.435 1.00 0.00 C ATOM 333 CG2 ILE A 70 2.292 4.284 -2.193 1.00 0.00 C ATOM 334 CD1 ILE A 70 1.049 2.149 -4.113 1.00 0.00 C ATOM 0 H ILE A 70 5.125 2.744 -4.830 1.00 0.00 H new ATOM 0 HA ILE A 70 3.708 5.316 -4.196 1.00 0.00 H new ATOM 0 HB ILE A 70 3.474 2.640 -2.870 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.545 4.154 -4.699 1.00 0.00 H new ATOM 0 HG13 ILE A 70 2.645 2.936 -5.314 1.00 0.00 H new ATOM 0 HG21 ILE A 70 1.492 3.648 -1.814 1.00 0.00 H new ATOM 0 HG22 ILE A 70 2.979 4.525 -1.382 1.00 0.00 H new ATOM 0 HG23 ILE A 70 1.865 5.204 -2.593 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.399 1.996 -4.974 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.567 1.219 -3.880 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.450 2.456 -3.256 1.00 0.00 H new ATOM 335 N LYS A 71 5.664 6.073 -3.186 1.00 0.00 N ATOM 336 CA LYS A 71 6.760 6.813 -2.538 1.00 0.00 C ATOM 337 C LYS A 71 6.227 7.624 -1.355 1.00 0.00 C ATOM 338 O LYS A 71 5.143 8.205 -1.390 1.00 0.00 O ATOM 339 CB LYS A 71 7.322 7.733 -3.635 1.00 0.00 C ATOM 340 CG LYS A 71 8.531 8.584 -3.210 1.00 0.00 C ATOM 341 CD LYS A 71 8.510 9.921 -3.958 1.00 0.00 C ATOM 342 CE LYS A 71 7.429 10.872 -3.406 1.00 0.00 C ATOM 343 NZ LYS A 71 7.874 11.364 -2.098 1.00 0.00 N ATOM 0 H LYS A 71 5.213 6.617 -3.922 1.00 0.00 H new ATOM 0 HA LYS A 71 7.528 6.152 -2.136 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.609 7.121 -4.490 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.528 8.399 -3.972 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.505 8.758 -2.134 1.00 0.00 H new ATOM 0 HG3 LYS A 71 9.457 8.051 -3.425 1.00 0.00 H new ATOM 0 HD2 LYS A 71 9.487 10.397 -3.878 1.00 0.00 H new ATOM 0 HD3 LYS A 71 8.329 9.741 -5.018 1.00 0.00 H new ATOM 0 HE2 LYS A 71 7.270 11.705 -4.091 1.00 0.00 H new ATOM 0 HE3 LYS A 71 6.477 10.350 -3.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 7.130 11.193 -1.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 8.741 10.864 -1.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 8.067 12.384 -2.158 1.00 0.00 H new ATOM 344 N SER A 72 7.061 7.691 -0.315 1.00 0.00 N ATOM 345 CA SER A 72 6.721 8.418 0.907 1.00 0.00 C ATOM 346 C SER A 72 7.119 9.892 0.925 1.00 0.00 C ATOM 347 O SER A 72 8.290 10.259 0.858 1.00 0.00 O ATOM 348 CB SER A 72 7.212 7.664 2.143 1.00 0.00 C ATOM 349 OG SER A 72 7.103 8.513 3.291 1.00 0.00 O ATOM 0 H SER A 72 7.980 7.248 -0.296 1.00 0.00 H new ATOM 0 HA SER A 72 5.632 8.452 0.928 1.00 0.00 H new ATOM 0 HB2 SER A 72 6.622 6.759 2.289 1.00 0.00 H new ATOM 0 HB3 SER A 72 8.247 7.351 2.005 1.00 0.00 H new ATOM 0 HG SER A 72 6.338 8.231 3.835 1.00 0.00 H new ATOM 350 N THR A 73 6.096 10.699 1.193 1.00 0.00 N ATOM 351 CA THR A 73 6.188 12.175 1.269 1.00 0.00 C ATOM 352 C THR A 73 7.281 12.705 2.205 1.00 0.00 C ATOM 353 O THR A 73 8.016 13.621 1.817 1.00 0.00 O ATOM 354 CB THR A 73 4.848 12.834 1.614 1.00 0.00 C ATOM 355 OG1 THR A 73 4.301 12.298 2.828 1.00 0.00 O ATOM 356 CG2 THR A 73 3.854 12.752 0.460 1.00 0.00 C ATOM 0 H THR A 73 5.154 10.349 1.369 1.00 0.00 H new ATOM 0 HA THR A 73 6.477 12.460 0.257 1.00 0.00 H new ATOM 0 HB THR A 73 5.044 13.893 1.782 1.00 0.00 H new ATOM 0 HG1 THR A 73 5.010 12.219 3.499 1.00 0.00 H new ATOM 0 HG21 THR A 73 2.919 13.232 0.750 1.00 0.00 H new ATOM 0 HG22 THR A 73 4.267 13.259 -0.412 1.00 0.00 H new ATOM 0 HG23 THR A 73 3.665 11.707 0.216 1.00 0.00 H new ATOM 357 N GLU A 74 7.400 12.136 3.402 1.00 0.00 N ATOM 358 CA GLU A 74 8.496 12.503 4.322 1.00 0.00 C ATOM 359 C GLU A 74 9.623 11.457 4.367 1.00 0.00 C ATOM 360 O GLU A 74 10.789 11.815 4.264 1.00 0.00 O ATOM 361 CB GLU A 74 7.928 12.712 5.725 1.00 0.00 C ATOM 362 CG GLU A 74 8.824 13.600 6.606 1.00 0.00 C ATOM 363 CD GLU A 74 8.115 14.056 7.880 1.00 0.00 C ATOM 364 OE1 GLU A 74 7.267 13.292 8.398 1.00 0.00 O ATOM 365 OE2 GLU A 74 8.461 15.167 8.334 1.00 0.00 O ATOM 0 H GLU A 74 6.763 11.426 3.763 1.00 0.00 H new ATOM 0 HA GLU A 74 8.939 13.424 3.944 1.00 0.00 H new ATOM 0 HB2 GLU A 74 6.939 13.165 5.648 1.00 0.00 H new ATOM 0 HB3 GLU A 74 7.798 11.743 6.207 1.00 0.00 H new ATOM 0 HG2 GLU A 74 9.727 13.051 6.872 1.00 0.00 H new ATOM 0 HG3 GLU A 74 9.139 14.474 6.036 1.00 0.00 H new ATOM 366 N THR A 75 9.258 10.192 4.549 1.00 0.00 N ATOM 367 CA THR A 75 10.241 9.112 4.726 1.00 0.00 C ATOM 368 C THR A 75 10.947 8.585 3.458 1.00 0.00 C ATOM 369 O THR A 75 11.953 7.876 3.578 1.00 0.00 O ATOM 370 CB THR A 75 9.688 7.924 5.526 1.00 0.00 C ATOM 371 OG1 THR A 75 8.263 7.844 5.515 1.00 0.00 O ATOM 372 CG2 THR A 75 10.245 7.971 6.956 1.00 0.00 C ATOM 0 H THR A 75 8.287 9.882 4.579 1.00 0.00 H new ATOM 0 HA THR A 75 11.014 9.628 5.295 1.00 0.00 H new ATOM 0 HB THR A 75 10.024 7.011 5.035 1.00 0.00 H new ATOM 0 HG1 THR A 75 7.943 7.833 4.589 1.00 0.00 H new ATOM 0 HG21 THR A 75 9.854 7.129 7.527 1.00 0.00 H new ATOM 0 HG22 THR A 75 11.333 7.914 6.925 1.00 0.00 H new ATOM 0 HG23 THR A 75 9.944 8.904 7.433 1.00 0.00 H new ATOM 373 N GLY A 76 10.379 8.867 2.284 1.00 0.00 N ATOM 374 CA GLY A 76 10.834 8.353 0.976 1.00 0.00 C ATOM 375 C GLY A 76 10.509 6.884 0.713 1.00 0.00 C ATOM 376 O GLY A 76 9.882 6.548 -0.285 1.00 0.00 O ATOM 0 H GLY A 76 9.565 9.477 2.207 1.00 0.00 H new ATOM 0 HA2 GLY A 76 10.383 8.956 0.188 1.00 0.00 H new ATOM 0 HA3 GLY A 76 11.913 8.490 0.904 1.00 0.00 H new ATOM 377 N GLN A 77 10.862 6.070 1.715 1.00 0.00 N ATOM 378 CA GLN A 77 10.754 4.598 1.755 1.00 0.00 C ATOM 379 C GLN A 77 9.461 4.064 1.111 1.00 0.00 C ATOM 380 O GLN A 77 8.350 4.248 1.608 1.00 0.00 O ATOM 381 CB GLN A 77 10.856 4.084 3.198 1.00 0.00 C ATOM 382 CG GLN A 77 12.069 4.592 3.984 1.00 0.00 C ATOM 383 CD GLN A 77 13.410 4.276 3.313 1.00 0.00 C ATOM 384 OE1 GLN A 77 13.764 3.137 3.039 1.00 0.00 O ATOM 385 NE2 GLN A 77 14.207 5.304 3.082 1.00 0.00 N ATOM 0 H GLN A 77 11.257 6.442 2.579 1.00 0.00 H new ATOM 0 HA GLN A 77 11.589 4.222 1.165 1.00 0.00 H new ATOM 0 HB2 GLN A 77 9.950 4.369 3.734 1.00 0.00 H new ATOM 0 HB3 GLN A 77 10.886 2.995 3.178 1.00 0.00 H new ATOM 0 HG2 GLN A 77 11.982 5.671 4.113 1.00 0.00 H new ATOM 0 HG3 GLN A 77 12.057 4.150 4.980 1.00 0.00 H new ATOM 0 HE21 GLN A 77 13.901 6.249 3.315 1.00 0.00 H new ATOM 0 HE22 GLN A 77 15.128 5.153 2.671 1.00 0.00 H new ATOM 386 N TYR A 78 9.694 3.407 -0.015 1.00 0.00 N ATOM 387 CA TYR A 78 8.659 2.897 -0.924 1.00 0.00 C ATOM 388 C TYR A 78 7.849 1.783 -0.285 1.00 0.00 C ATOM 389 O TYR A 78 8.408 0.798 0.207 1.00 0.00 O ATOM 390 CB TYR A 78 9.297 2.342 -2.202 1.00 0.00 C ATOM 391 CG TYR A 78 9.933 3.434 -3.062 1.00 0.00 C ATOM 392 CD1 TYR A 78 11.134 4.043 -2.631 1.00 0.00 C ATOM 393 CD2 TYR A 78 9.240 3.889 -4.204 1.00 0.00 C ATOM 394 CE1 TYR A 78 11.622 5.161 -3.310 1.00 0.00 C ATOM 395 CE2 TYR A 78 9.738 5.006 -4.901 1.00 0.00 C ATOM 396 CZ TYR A 78 10.913 5.630 -4.439 1.00 0.00 C ATOM 397 OH TYR A 78 11.450 6.658 -5.153 1.00 0.00 O ATOM 0 H TYR A 78 10.639 3.203 -0.339 1.00 0.00 H new ATOM 0 HA TYR A 78 8.001 3.735 -1.154 1.00 0.00 H new ATOM 0 HB2 TYR A 78 10.056 1.606 -1.935 1.00 0.00 H new ATOM 0 HB3 TYR A 78 8.539 1.820 -2.786 1.00 0.00 H new ATOM 0 HD1 TYR A 78 11.670 3.646 -1.782 1.00 0.00 H new ATOM 0 HD2 TYR A 78 8.343 3.389 -4.538 1.00 0.00 H new ATOM 0 HE1 TYR A 78 12.523 5.657 -2.979 1.00 0.00 H new ATOM 0 HE2 TYR A 78 9.227 5.379 -5.776 1.00 0.00 H new ATOM 0 HH TYR A 78 10.859 6.879 -5.903 1.00 0.00 H new ATOM 398 N LEU A 79 6.531 1.947 -0.377 1.00 0.00 N ATOM 399 CA LEU A 79 5.609 0.860 -0.035 1.00 0.00 C ATOM 400 C LEU A 79 5.888 -0.301 -0.999 1.00 0.00 C ATOM 401 O LEU A 79 5.929 -0.124 -2.212 1.00 0.00 O ATOM 402 CB LEU A 79 4.155 1.312 -0.168 1.00 0.00 C ATOM 403 CG LEU A 79 3.168 0.236 0.321 1.00 0.00 C ATOM 404 CD1 LEU A 79 3.342 -0.097 1.794 1.00 0.00 C ATOM 405 CD2 LEU A 79 1.779 0.787 0.053 1.00 0.00 C ATOM 0 H LEU A 79 6.079 2.809 -0.681 1.00 0.00 H new ATOM 0 HA LEU A 79 5.762 0.554 1.000 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.006 2.227 0.405 1.00 0.00 H new ATOM 0 HB3 LEU A 79 3.944 1.551 -1.210 1.00 0.00 H new ATOM 0 HG LEU A 79 3.345 -0.701 -0.207 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.620 -0.861 2.082 1.00 0.00 H new ATOM 0 HD12 LEU A 79 4.352 -0.469 1.966 1.00 0.00 H new ATOM 0 HD13 LEU A 79 3.179 0.800 2.392 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.032 0.064 0.381 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.646 1.720 0.600 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.661 0.973 -1.015 1.00 0.00 H new ATOM 406 N ALA A 80 6.454 -1.337 -0.385 1.00 0.00 N ATOM 407 CA ALA A 80 6.920 -2.548 -1.069 1.00 0.00 C ATOM 408 C ALA A 80 6.368 -3.798 -0.398 1.00 0.00 C ATOM 409 O ALA A 80 5.941 -3.746 0.754 1.00 0.00 O ATOM 410 CB ALA A 80 8.451 -2.556 -0.962 1.00 0.00 C ATOM 0 H ALA A 80 6.606 -1.362 0.623 1.00 0.00 H new ATOM 0 HA ALA A 80 6.583 -2.547 -2.106 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.846 -3.442 -1.459 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.854 -1.663 -1.439 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.742 -2.569 0.088 1.00 0.00 H new ATOM 411 N MET A 81 6.544 -4.929 -1.068 1.00 0.00 N ATOM 412 CA MET A 81 6.156 -6.238 -0.510 1.00 0.00 C ATOM 413 C MET A 81 7.342 -7.204 -0.703 1.00 0.00 C ATOM 414 O MET A 81 8.118 -7.050 -1.650 1.00 0.00 O ATOM 415 CB MET A 81 4.917 -6.782 -1.216 1.00 0.00 C ATOM 416 CG MET A 81 4.323 -7.952 -0.439 1.00 0.00 C ATOM 417 SD MET A 81 2.701 -7.597 0.343 1.00 0.00 S ATOM 418 CE MET A 81 1.711 -6.991 -1.010 1.00 0.00 C ATOM 0 H MET A 81 6.953 -4.977 -2.001 1.00 0.00 H new ATOM 0 HA MET A 81 5.915 -6.133 0.548 1.00 0.00 H new ATOM 0 HB2 MET A 81 4.174 -5.991 -1.317 1.00 0.00 H new ATOM 0 HB3 MET A 81 5.179 -7.104 -2.224 1.00 0.00 H new ATOM 0 HG2 MET A 81 4.209 -8.800 -1.114 1.00 0.00 H new ATOM 0 HG3 MET A 81 5.028 -8.253 0.336 1.00 0.00 H new ATOM 0 HE1 MET A 81 0.747 -7.499 -1.011 1.00 0.00 H new ATOM 0 HE2 MET A 81 1.556 -5.918 -0.895 1.00 0.00 H new ATOM 0 HE3 MET A 81 2.224 -7.185 -1.952 1.00 0.00 H new ATOM 419 N ASP A 82 7.586 -8.040 0.302 1.00 0.00 N ATOM 420 CA ASP A 82 8.619 -9.090 0.198 1.00 0.00 C ATOM 421 C ASP A 82 7.978 -10.483 0.104 1.00 0.00 C ATOM 422 O ASP A 82 6.890 -10.718 0.619 1.00 0.00 O ATOM 423 CB ASP A 82 9.590 -9.035 1.388 1.00 0.00 C ATOM 424 CG ASP A 82 11.050 -9.238 0.959 1.00 0.00 C ATOM 425 OD1 ASP A 82 11.292 -10.178 0.158 1.00 0.00 O ATOM 426 OD2 ASP A 82 11.894 -8.476 1.465 1.00 0.00 O ATOM 0 H ASP A 82 7.092 -8.019 1.194 1.00 0.00 H new ATOM 0 HA ASP A 82 9.184 -8.904 -0.715 1.00 0.00 H new ATOM 0 HB2 ASP A 82 9.492 -8.072 1.890 1.00 0.00 H new ATOM 0 HB3 ASP A 82 9.317 -9.802 2.113 1.00 0.00 H new ATOM 427 N THR A 83 8.834 -11.404 -0.317 1.00 0.00 N ATOM 428 CA THR A 83 8.529 -12.835 -0.540 1.00 0.00 C ATOM 429 C THR A 83 7.896 -13.529 0.679 1.00 0.00 C ATOM 430 O THR A 83 7.144 -14.486 0.544 1.00 0.00 O ATOM 431 CB THR A 83 9.799 -13.613 -0.898 1.00 0.00 C ATOM 432 OG1 THR A 83 10.783 -13.389 0.125 1.00 0.00 O ATOM 433 CG2 THR A 83 10.369 -13.224 -2.267 1.00 0.00 C ATOM 0 H THR A 83 9.806 -11.177 -0.525 1.00 0.00 H new ATOM 0 HA THR A 83 7.809 -12.844 -1.358 1.00 0.00 H new ATOM 0 HB THR A 83 9.537 -14.669 -0.959 1.00 0.00 H new ATOM 0 HG1 THR A 83 11.600 -13.884 -0.093 1.00 0.00 H new ATOM 0 HG21 THR A 83 11.268 -13.808 -2.466 1.00 0.00 H new ATOM 0 HG22 THR A 83 9.627 -13.425 -3.040 1.00 0.00 H new ATOM 0 HG23 THR A 83 10.618 -12.163 -2.269 1.00 0.00 H new ATOM 434 N ASP A 84 8.283 -13.038 1.856 1.00 0.00 N ATOM 435 CA ASP A 84 7.693 -13.394 3.166 1.00 0.00 C ATOM 436 C ASP A 84 6.203 -13.065 3.387 1.00 0.00 C ATOM 437 O ASP A 84 5.671 -13.311 4.469 1.00 0.00 O ATOM 438 CB ASP A 84 8.537 -12.759 4.281 1.00 0.00 C ATOM 439 CG ASP A 84 9.906 -13.419 4.402 1.00 0.00 C ATOM 440 OD1 ASP A 84 9.969 -14.531 4.968 1.00 0.00 O ATOM 441 OD2 ASP A 84 10.871 -12.787 3.899 1.00 0.00 O ATOM 0 H ASP A 84 9.040 -12.359 1.937 1.00 0.00 H new ATOM 0 HA ASP A 84 7.716 -14.484 3.186 1.00 0.00 H new ATOM 0 HB2 ASP A 84 8.663 -11.695 4.080 1.00 0.00 H new ATOM 0 HB3 ASP A 84 8.008 -12.844 5.230 1.00 0.00 H new ATOM 442 N GLY A 85 5.626 -12.365 2.428 1.00 0.00 N ATOM 443 CA GLY A 85 4.179 -12.077 2.360 1.00 0.00 C ATOM 444 C GLY A 85 3.738 -10.909 3.241 1.00 0.00 C ATOM 445 O GLY A 85 2.655 -10.952 3.829 1.00 0.00 O ATOM 0 H GLY A 85 6.150 -11.965 1.650 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.910 -11.861 1.326 1.00 0.00 H new ATOM 0 HA3 GLY A 85 3.627 -12.970 2.654 1.00 0.00 H new ATOM 446 N LEU A 86 4.465 -9.807 3.102 1.00 0.00 N ATOM 447 CA LEU A 86 4.265 -8.620 3.946 1.00 0.00 C ATOM 448 C LEU A 86 4.872 -7.359 3.324 1.00 0.00 C ATOM 449 O LEU A 86 5.858 -7.422 2.583 1.00 0.00 O ATOM 450 CB LEU A 86 4.805 -8.904 5.365 1.00 0.00 C ATOM 451 CG LEU A 86 6.302 -9.202 5.358 1.00 0.00 C ATOM 452 CD1 LEU A 86 7.039 -7.895 5.656 1.00 0.00 C ATOM 453 CD2 LEU A 86 6.655 -10.249 6.416 1.00 0.00 C ATOM 0 H LEU A 86 5.206 -9.704 2.409 1.00 0.00 H new ATOM 0 HA LEU A 86 3.197 -8.417 4.021 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.609 -8.044 6.006 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.269 -9.750 5.794 1.00 0.00 H new ATOM 0 HG LEU A 86 6.594 -9.600 4.386 1.00 0.00 H new ATOM 0 HD11 LEU A 86 8.114 -8.076 5.658 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.796 -7.158 4.891 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.733 -7.519 6.632 1.00 0.00 H new ATOM 0 HD21 LEU A 86 7.727 -10.444 6.391 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.376 -9.878 7.402 1.00 0.00 H new ATOM 0 HD23 LEU A 86 6.113 -11.172 6.209 1.00 0.00 H new ATOM 454 N LEU A 87 4.320 -6.246 3.770 1.00 0.00 N ATOM 455 CA LEU A 87 4.712 -4.906 3.302 1.00 0.00 C ATOM 456 C LEU A 87 5.892 -4.352 4.101 1.00 0.00 C ATOM 457 O LEU A 87 5.957 -4.465 5.328 1.00 0.00 O ATOM 458 CB LEU A 87 3.552 -3.905 3.391 1.00 0.00 C ATOM 459 CG LEU A 87 2.288 -4.434 2.716 1.00 0.00 C ATOM 460 CD1 LEU A 87 1.051 -4.104 3.563 1.00 0.00 C ATOM 461 CD2 LEU A 87 2.144 -3.984 1.270 1.00 0.00 C ATOM 0 H LEU A 87 3.581 -6.234 4.472 1.00 0.00 H new ATOM 0 HA LEU A 87 5.003 -5.027 2.259 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.340 -3.687 4.438 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.847 -2.966 2.923 1.00 0.00 H new ATOM 0 HG LEU A 87 2.380 -5.519 2.661 1.00 0.00 H new ATOM 0 HD11 LEU A 87 0.159 -4.488 3.068 1.00 0.00 H new ATOM 0 HD12 LEU A 87 1.149 -4.566 4.545 1.00 0.00 H new ATOM 0 HD13 LEU A 87 0.966 -3.023 3.678 1.00 0.00 H new ATOM 0 HD21 LEU A 87 1.226 -4.395 0.851 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.106 -2.895 1.230 1.00 0.00 H new ATOM 0 HD23 LEU A 87 2.997 -4.339 0.692 1.00 0.00 H new ATOM 462 N TYR A 88 6.818 -3.786 3.348 1.00 0.00 N ATOM 463 CA TYR A 88 7.999 -3.071 3.872 1.00 0.00 C ATOM 464 C TYR A 88 8.297 -1.768 3.134 1.00 0.00 C ATOM 465 O TYR A 88 8.034 -1.641 1.940 1.00 0.00 O ATOM 466 CB TYR A 88 9.275 -3.929 3.953 1.00 0.00 C ATOM 467 CG TYR A 88 9.900 -4.482 2.679 1.00 0.00 C ATOM 468 CD1 TYR A 88 9.126 -4.966 1.608 1.00 0.00 C ATOM 469 CD2 TYR A 88 11.312 -4.532 2.651 1.00 0.00 C ATOM 470 CE1 TYR A 88 9.779 -5.472 0.469 1.00 0.00 C ATOM 471 CE2 TYR A 88 11.966 -5.058 1.525 1.00 0.00 C ATOM 472 CZ TYR A 88 11.187 -5.521 0.450 1.00 0.00 C ATOM 473 OH TYR A 88 11.799 -6.101 -0.614 1.00 0.00 O ATOM 0 H TYR A 88 6.781 -3.804 2.329 1.00 0.00 H new ATOM 0 HA TYR A 88 7.708 -2.827 4.893 1.00 0.00 H new ATOM 0 HB2 TYR A 88 10.036 -3.332 4.455 1.00 0.00 H new ATOM 0 HB3 TYR A 88 9.055 -4.777 4.602 1.00 0.00 H new ATOM 0 HD1 TYR A 88 8.047 -4.949 1.660 1.00 0.00 H new ATOM 0 HD2 TYR A 88 11.885 -4.168 3.491 1.00 0.00 H new ATOM 0 HE1 TYR A 88 9.208 -5.818 -0.380 1.00 0.00 H new ATOM 0 HE2 TYR A 88 13.044 -5.106 1.486 1.00 0.00 H new ATOM 0 HH TYR A 88 12.052 -7.020 -0.385 1.00 0.00 H new ATOM 474 N GLY A 89 8.974 -0.875 3.846 1.00 0.00 N ATOM 475 CA GLY A 89 9.354 0.446 3.329 1.00 0.00 C ATOM 476 C GLY A 89 10.746 0.375 2.683 1.00 0.00 C ATOM 477 O GLY A 89 11.743 0.767 3.279 1.00 0.00 O ATOM 0 H GLY A 89 9.279 -1.042 4.805 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.621 0.784 2.597 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.356 1.176 4.138 1.00 0.00 H new ATOM 478 N SER A 90 10.781 -0.269 1.523 1.00 0.00 N ATOM 479 CA SER A 90 12.024 -0.427 0.742 1.00 0.00 C ATOM 480 C SER A 90 12.552 0.878 0.132 1.00 0.00 C ATOM 481 O SER A 90 11.847 1.623 -0.547 1.00 0.00 O ATOM 482 CB SER A 90 11.893 -1.529 -0.314 1.00 0.00 C ATOM 483 OG SER A 90 13.070 -1.544 -1.142 1.00 0.00 O ATOM 0 H SER A 90 9.962 -0.697 1.091 1.00 0.00 H new ATOM 0 HA SER A 90 12.779 -0.736 1.465 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.764 -2.497 0.170 1.00 0.00 H new ATOM 0 HB3 SER A 90 11.007 -1.357 -0.926 1.00 0.00 H new ATOM 0 HG SER A 90 12.893 -1.052 -1.971 1.00 0.00 H new ATOM 484 N GLN A 91 13.833 1.117 0.381 1.00 0.00 N ATOM 485 CA GLN A 91 14.611 2.279 -0.076 1.00 0.00 C ATOM 486 C GLN A 91 14.615 2.398 -1.607 1.00 0.00 C ATOM 487 O GLN A 91 14.393 3.457 -2.193 1.00 0.00 O ATOM 488 CB GLN A 91 16.099 2.097 0.296 1.00 0.00 C ATOM 489 CG GLN A 91 16.445 1.877 1.780 1.00 0.00 C ATOM 490 CD GLN A 91 15.967 0.511 2.274 1.00 0.00 C ATOM 491 OE1 GLN A 91 16.415 -0.543 1.848 1.00 0.00 O ATOM 492 NE2 GLN A 91 14.839 0.507 2.960 1.00 0.00 N ATOM 0 H GLN A 91 14.396 0.474 0.938 1.00 0.00 H new ATOM 0 HA GLN A 91 14.152 3.150 0.392 1.00 0.00 H new ATOM 0 HB2 GLN A 91 16.484 1.247 -0.267 1.00 0.00 H new ATOM 0 HB3 GLN A 91 16.641 2.978 -0.047 1.00 0.00 H new ATOM 0 HG2 GLN A 91 17.523 1.958 1.918 1.00 0.00 H new ATOM 0 HG3 GLN A 91 15.987 2.662 2.381 1.00 0.00 H new ATOM 0 HE21 GLN A 91 14.458 1.382 3.319 1.00 0.00 H new ATOM 0 HE22 GLN A 91 14.349 -0.371 3.131 1.00 0.00 H new ATOM 493 N THR A 92 14.809 1.224 -2.196 1.00 0.00 N ATOM 494 CA THR A 92 15.115 1.019 -3.621 1.00 0.00 C ATOM 495 C THR A 92 13.790 0.663 -4.321 1.00 0.00 C ATOM 496 O THR A 92 13.120 -0.264 -3.865 1.00 0.00 O ATOM 497 CB THR A 92 16.056 -0.198 -3.711 1.00 0.00 C ATOM 498 OG1 THR A 92 16.948 -0.211 -2.589 1.00 0.00 O ATOM 499 CG2 THR A 92 16.849 -0.192 -5.019 1.00 0.00 C ATOM 0 H THR A 92 14.757 0.347 -1.678 1.00 0.00 H new ATOM 0 HA THR A 92 15.571 1.898 -4.075 1.00 0.00 H new ATOM 0 HB THR A 92 15.446 -1.101 -3.695 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.542 -0.988 -2.652 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.503 -1.063 -5.052 1.00 0.00 H new ATOM 0 HG22 THR A 92 16.160 -0.224 -5.863 1.00 0.00 H new ATOM 0 HG23 THR A 92 17.450 0.716 -5.076 1.00 0.00 H new ATOM 500 N PRO A 93 13.426 1.376 -5.398 1.00 0.00 N ATOM 501 CA PRO A 93 12.244 1.025 -6.171 1.00 0.00 C ATOM 502 C PRO A 93 12.507 -0.173 -7.095 1.00 0.00 C ATOM 503 O PRO A 93 13.447 -0.219 -7.873 1.00 0.00 O ATOM 504 CB PRO A 93 11.871 2.240 -6.985 1.00 0.00 C ATOM 505 CG PRO A 93 13.227 2.929 -7.214 1.00 0.00 C ATOM 506 CD PRO A 93 14.014 2.611 -5.925 1.00 0.00 C ATOM 0 HA PRO A 93 11.435 0.733 -5.501 1.00 0.00 H new ATOM 0 HB2 PRO A 93 11.393 1.965 -7.925 1.00 0.00 H new ATOM 0 HB3 PRO A 93 11.175 2.886 -6.451 1.00 0.00 H new ATOM 0 HG2 PRO A 93 13.731 2.539 -8.099 1.00 0.00 H new ATOM 0 HG3 PRO A 93 13.112 4.003 -7.360 1.00 0.00 H new ATOM 0 HD2 PRO A 93 15.075 2.481 -6.136 1.00 0.00 H new ATOM 0 HD3 PRO A 93 13.930 3.424 -5.204 1.00 0.00 H new ATOM 507 N ASN A 94 11.838 -1.232 -6.682 1.00 0.00 N ATOM 508 CA ASN A 94 11.873 -2.502 -7.412 1.00 0.00 C ATOM 509 C ASN A 94 10.438 -2.888 -7.827 1.00 0.00 C ATOM 510 O ASN A 94 9.475 -2.223 -7.458 1.00 0.00 O ATOM 511 CB ASN A 94 12.546 -3.514 -6.475 1.00 0.00 C ATOM 512 CG ASN A 94 12.775 -4.887 -7.106 1.00 0.00 C ATOM 513 OD1 ASN A 94 11.947 -5.789 -6.993 1.00 0.00 O ATOM 514 ND2 ASN A 94 13.830 -5.023 -7.872 1.00 0.00 N ATOM 0 H ASN A 94 11.259 -1.246 -5.842 1.00 0.00 H new ATOM 0 HA ASN A 94 12.443 -2.455 -8.340 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.505 -3.111 -6.149 1.00 0.00 H new ATOM 0 HB3 ASN A 94 11.931 -3.633 -5.583 1.00 0.00 H new ATOM 0 HD21 ASN A 94 13.977 -5.890 -8.389 1.00 0.00 H new ATOM 0 HD22 ASN A 94 14.504 -4.262 -7.951 1.00 0.00 H new ATOM 515 N GLU A 95 10.320 -3.990 -8.560 1.00 0.00 N ATOM 516 CA GLU A 95 9.022 -4.652 -8.845 1.00 0.00 C ATOM 517 C GLU A 95 8.208 -4.888 -7.570 1.00 0.00 C ATOM 518 O GLU A 95 6.986 -4.892 -7.552 1.00 0.00 O ATOM 519 CB GLU A 95 9.317 -6.056 -9.372 1.00 0.00 C ATOM 520 CG GLU A 95 10.144 -6.167 -10.652 1.00 0.00 C ATOM 521 CD GLU A 95 9.444 -5.518 -11.849 1.00 0.00 C ATOM 522 OE1 GLU A 95 8.521 -6.165 -12.384 1.00 0.00 O ATOM 523 OE2 GLU A 95 9.826 -4.379 -12.168 1.00 0.00 O ATOM 0 H GLU A 95 11.119 -4.463 -8.982 1.00 0.00 H new ATOM 0 HA GLU A 95 8.476 -4.013 -9.538 1.00 0.00 H new ATOM 0 HB2 GLU A 95 9.834 -6.608 -8.588 1.00 0.00 H new ATOM 0 HB3 GLU A 95 8.365 -6.559 -9.541 1.00 0.00 H new ATOM 0 HG2 GLU A 95 11.113 -5.693 -10.499 1.00 0.00 H new ATOM 0 HG3 GLU A 95 10.334 -7.218 -10.870 1.00 0.00 H new ATOM 524 N GLU A 96 8.944 -5.179 -6.501 1.00 0.00 N ATOM 525 CA GLU A 96 8.429 -5.303 -5.130 1.00 0.00 C ATOM 526 C GLU A 96 7.626 -4.066 -4.689 1.00 0.00 C ATOM 527 O GLU A 96 6.500 -4.184 -4.194 1.00 0.00 O ATOM 528 CB GLU A 96 9.602 -5.487 -4.185 1.00 0.00 C ATOM 529 CG GLU A 96 10.110 -6.915 -4.387 1.00 0.00 C ATOM 530 CD GLU A 96 11.045 -7.443 -3.295 1.00 0.00 C ATOM 531 OE1 GLU A 96 12.256 -7.144 -3.415 1.00 0.00 O ATOM 532 OE2 GLU A 96 10.585 -8.312 -2.523 1.00 0.00 O ATOM 0 H GLU A 96 9.949 -5.341 -6.561 1.00 0.00 H new ATOM 0 HA GLU A 96 7.756 -6.160 -5.104 1.00 0.00 H new ATOM 0 HB2 GLU A 96 10.388 -4.763 -4.399 1.00 0.00 H new ATOM 0 HB3 GLU A 96 9.295 -5.328 -3.151 1.00 0.00 H new ATOM 0 HG2 GLU A 96 9.250 -7.581 -4.458 1.00 0.00 H new ATOM 0 HG3 GLU A 96 10.632 -6.965 -5.343 1.00 0.00 H new ATOM 533 N CYS A 97 8.142 -2.920 -5.109 1.00 0.00 N ATOM 534 CA CYS A 97 7.657 -1.586 -4.718 1.00 0.00 C ATOM 535 C CYS A 97 6.683 -1.011 -5.766 1.00 0.00 C ATOM 536 O CYS A 97 5.981 -0.026 -5.509 1.00 0.00 O ATOM 537 CB CYS A 97 8.892 -0.691 -4.566 1.00 0.00 C ATOM 538 SG CYS A 97 10.310 -1.445 -3.679 1.00 0.00 S ATOM 0 H CYS A 97 8.934 -2.882 -5.751 1.00 0.00 H new ATOM 0 HA CYS A 97 7.100 -1.642 -3.783 1.00 0.00 H new ATOM 0 HB2 CYS A 97 9.226 -0.390 -5.559 1.00 0.00 H new ATOM 0 HB3 CYS A 97 8.598 0.217 -4.040 1.00 0.00 H new ATOM 0 HG CYS A 97 11.388 -0.760 -3.922 1.00 0.00 H new ATOM 539 N LEU A 98 6.702 -1.622 -6.950 1.00 0.00 N ATOM 540 CA LEU A 98 5.831 -1.248 -8.062 1.00 0.00 C ATOM 541 C LEU A 98 4.525 -2.027 -7.956 1.00 0.00 C ATOM 542 O LEU A 98 4.497 -3.228 -7.699 1.00 0.00 O ATOM 543 CB LEU A 98 6.521 -1.508 -9.409 1.00 0.00 C ATOM 544 CG LEU A 98 5.840 -0.659 -10.492 1.00 0.00 C ATOM 545 CD1 LEU A 98 5.913 0.802 -10.188 1.00 0.00 C ATOM 546 CD2 LEU A 98 6.649 -0.797 -11.767 1.00 0.00 C ATOM 0 H LEU A 98 7.328 -2.398 -7.166 1.00 0.00 H new ATOM 0 HA LEU A 98 5.616 -0.181 -8.009 1.00 0.00 H new ATOM 0 HB2 LEU A 98 7.580 -1.257 -9.344 1.00 0.00 H new ATOM 0 HB3 LEU A 98 6.459 -2.566 -9.666 1.00 0.00 H new ATOM 0 HG LEU A 98 4.806 -0.996 -10.561 1.00 0.00 H new ATOM 0 HD11 LEU A 98 5.419 1.364 -10.981 1.00 0.00 H new ATOM 0 HD12 LEU A 98 5.417 1.001 -9.238 1.00 0.00 H new ATOM 0 HD13 LEU A 98 6.957 1.108 -10.123 1.00 0.00 H new ATOM 0 HD21 LEU A 98 6.188 -0.203 -12.556 1.00 0.00 H new ATOM 0 HD22 LEU A 98 7.665 -0.443 -11.593 1.00 0.00 H new ATOM 0 HD23 LEU A 98 6.676 -1.844 -12.069 1.00 0.00 H new ATOM 547 N PHE A 99 3.472 -1.238 -7.984 1.00 0.00 N ATOM 548 CA PHE A 99 2.130 -1.767 -7.797 1.00 0.00 C ATOM 549 C PHE A 99 1.151 -1.527 -8.941 1.00 0.00 C ATOM 550 O PHE A 99 1.069 -0.442 -9.503 1.00 0.00 O ATOM 551 CB PHE A 99 1.527 -1.218 -6.501 1.00 0.00 C ATOM 552 CG PHE A 99 2.193 -1.769 -5.229 1.00 0.00 C ATOM 553 CD1 PHE A 99 1.730 -2.984 -4.673 1.00 0.00 C ATOM 554 CD2 PHE A 99 3.156 -0.986 -4.574 1.00 0.00 C ATOM 555 CE1 PHE A 99 2.235 -3.416 -3.427 1.00 0.00 C ATOM 556 CE2 PHE A 99 3.646 -1.425 -3.324 1.00 0.00 C ATOM 557 CZ PHE A 99 3.187 -2.621 -2.746 1.00 0.00 C ATOM 0 H PHE A 99 3.515 -0.230 -8.134 1.00 0.00 H new ATOM 0 HA PHE A 99 2.269 -2.847 -7.757 1.00 0.00 H new ATOM 0 HB2 PHE A 99 1.611 -0.131 -6.503 1.00 0.00 H new ATOM 0 HB3 PHE A 99 0.463 -1.456 -6.476 1.00 0.00 H new ATOM 0 HD1 PHE A 99 0.996 -3.577 -5.197 1.00 0.00 H new ATOM 0 HD2 PHE A 99 3.515 -0.068 -5.016 1.00 0.00 H new ATOM 0 HE1 PHE A 99 1.897 -4.347 -2.997 1.00 0.00 H new ATOM 0 HE2 PHE A 99 4.385 -0.833 -2.805 1.00 0.00 H new ATOM 0 HZ PHE A 99 3.561 -2.933 -1.782 1.00 0.00 H new ATOM 558 N LEU A 100 0.451 -2.577 -9.334 1.00 0.00 N ATOM 559 CA LEU A 100 -0.435 -2.505 -10.492 1.00 0.00 C ATOM 560 C LEU A 100 -1.860 -2.055 -10.204 1.00 0.00 C ATOM 561 O LEU A 100 -2.617 -2.752 -9.533 1.00 0.00 O ATOM 562 CB LEU A 100 -0.486 -3.921 -11.105 1.00 0.00 C ATOM 563 CG LEU A 100 -0.908 -3.900 -12.574 1.00 0.00 C ATOM 564 CD1 LEU A 100 0.317 -3.528 -13.392 1.00 0.00 C ATOM 565 CD2 LEU A 100 -1.361 -5.287 -13.023 1.00 0.00 C ATOM 0 H LEU A 100 0.476 -3.487 -8.874 1.00 0.00 H new ATOM 0 HA LEU A 100 -0.024 -1.744 -11.156 1.00 0.00 H new ATOM 0 HB2 LEU A 100 0.495 -4.388 -11.017 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -1.184 -4.536 -10.537 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.727 -3.194 -12.708 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.054 -3.503 -14.450 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.676 -2.546 -13.084 1.00 0.00 H new ATOM 0 HD13 LEU A 100 1.101 -4.268 -13.230 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.657 -5.251 -14.071 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.541 -5.995 -12.902 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.209 -5.607 -12.417 1.00 0.00 H new ATOM 566 N GLU A 101 -2.147 -0.863 -10.712 1.00 0.00 N ATOM 567 CA GLU A 101 -3.499 -0.245 -10.640 1.00 0.00 C ATOM 568 C GLU A 101 -4.563 -1.073 -11.376 1.00 0.00 C ATOM 569 O GLU A 101 -4.748 -1.020 -12.591 1.00 0.00 O ATOM 570 CB GLU A 101 -3.500 1.182 -11.160 1.00 0.00 C ATOM 571 CG GLU A 101 -2.781 2.131 -10.206 1.00 0.00 C ATOM 572 CD GLU A 101 -2.818 3.595 -10.646 1.00 0.00 C ATOM 573 OE1 GLU A 101 -2.578 3.849 -11.844 1.00 0.00 O ATOM 574 OE2 GLU A 101 -3.038 4.431 -9.745 1.00 0.00 O ATOM 0 H GLU A 101 -1.458 -0.282 -11.190 1.00 0.00 H new ATOM 0 HA GLU A 101 -3.761 -0.227 -9.582 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -3.018 1.214 -12.137 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -4.528 1.517 -11.301 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -3.232 2.047 -9.217 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -1.742 1.816 -10.110 1.00 0.00 H new ATOM 575 N ARG A 102 -5.151 -1.909 -10.549 1.00 0.00 N ATOM 576 CA ARG A 102 -6.222 -2.864 -10.859 1.00 0.00 C ATOM 577 C ARG A 102 -7.614 -2.230 -10.943 1.00 0.00 C ATOM 578 O ARG A 102 -8.519 -2.850 -11.482 1.00 0.00 O ATOM 579 CB ARG A 102 -6.174 -3.878 -9.712 1.00 0.00 C ATOM 580 CG ARG A 102 -5.087 -4.938 -9.855 1.00 0.00 C ATOM 581 CD ARG A 102 -5.362 -5.935 -10.994 1.00 0.00 C ATOM 582 NE ARG A 102 -6.310 -7.007 -10.599 1.00 0.00 N ATOM 583 CZ ARG A 102 -6.016 -8.305 -10.528 1.00 0.00 C ATOM 584 NH1 ARG A 102 -4.794 -8.770 -10.761 1.00 0.00 N ATOM 585 NH2 ARG A 102 -6.935 -9.210 -10.201 1.00 0.00 N ATOM 0 H ARG A 102 -4.882 -1.952 -9.566 1.00 0.00 H new ATOM 0 HA ARG A 102 -6.061 -3.302 -11.844 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -6.021 -3.342 -8.775 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -7.142 -4.374 -9.641 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -4.130 -4.447 -10.033 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -4.995 -5.484 -8.916 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -5.764 -5.398 -11.853 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -4.422 -6.386 -11.312 1.00 0.00 H new ATOM 0 HE ARG A 102 -7.262 -6.728 -10.363 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -4.041 -8.126 -11.004 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -4.608 -9.771 -10.697 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -7.890 -8.916 -9.998 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -6.684 -10.198 -10.154 1.00 0.00 H new ATOM 586 N LEU A 103 -7.785 -1.170 -10.151 1.00 0.00 N ATOM 587 CA LEU A 103 -8.996 -0.333 -10.039 1.00 0.00 C ATOM 588 C LEU A 103 -10.330 -1.046 -9.773 1.00 0.00 C ATOM 589 O LEU A 103 -10.762 -1.941 -10.495 1.00 0.00 O ATOM 590 CB LEU A 103 -9.169 0.581 -11.262 1.00 0.00 C ATOM 591 CG LEU A 103 -8.832 2.067 -11.040 1.00 0.00 C ATOM 592 CD1 LEU A 103 -9.606 2.665 -9.858 1.00 0.00 C ATOM 593 CD2 LEU A 103 -7.317 2.285 -10.917 1.00 0.00 C ATOM 0 H LEU A 103 -7.042 -0.848 -9.531 1.00 0.00 H new ATOM 0 HA LEU A 103 -8.787 0.234 -9.132 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -8.540 0.202 -12.068 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -10.202 0.509 -11.603 1.00 0.00 H new ATOM 0 HG LEU A 103 -9.162 2.610 -11.926 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -9.336 3.714 -9.740 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -10.677 2.585 -10.046 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -9.356 2.121 -8.947 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -7.113 3.344 -10.761 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -6.935 1.714 -10.071 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -6.826 1.952 -11.831 1.00 0.00 H new ATOM 594 N GLU A 104 -11.101 -0.409 -8.910 1.00 0.00 N ATOM 595 CA GLU A 104 -12.516 -0.774 -8.640 1.00 0.00 C ATOM 596 C GLU A 104 -13.477 0.136 -9.433 1.00 0.00 C ATOM 597 O GLU A 104 -14.648 0.329 -9.080 1.00 0.00 O ATOM 598 CB GLU A 104 -12.791 -0.573 -7.143 1.00 0.00 C ATOM 599 CG GLU A 104 -12.022 -1.561 -6.272 1.00 0.00 C ATOM 600 CD GLU A 104 -12.812 -2.823 -5.891 1.00 0.00 C ATOM 601 OE1 GLU A 104 -13.665 -3.271 -6.691 1.00 0.00 O ATOM 602 OE2 GLU A 104 -12.554 -3.305 -4.778 1.00 0.00 O ATOM 0 H GLU A 104 -10.777 0.387 -8.361 1.00 0.00 H new ATOM 0 HA GLU A 104 -12.677 -1.810 -8.939 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -12.520 0.444 -6.860 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.859 -0.682 -6.955 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -11.115 -1.860 -6.798 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -11.709 -1.054 -5.359 1.00 0.00 H new ATOM 603 N GLU A 105 -12.968 0.588 -10.579 1.00 0.00 N ATOM 604 CA GLU A 105 -13.492 1.686 -11.425 1.00 0.00 C ATOM 605 C GLU A 105 -13.653 3.038 -10.712 1.00 0.00 C ATOM 606 O GLU A 105 -12.969 4.004 -11.052 1.00 0.00 O ATOM 607 CB GLU A 105 -14.751 1.257 -12.186 1.00 0.00 C ATOM 608 CG GLU A 105 -15.125 2.287 -13.253 1.00 0.00 C ATOM 609 CD GLU A 105 -16.318 1.836 -14.102 1.00 0.00 C ATOM 610 OE1 GLU A 105 -17.459 2.005 -13.619 1.00 0.00 O ATOM 611 OE2 GLU A 105 -16.049 1.295 -15.198 1.00 0.00 O ATOM 0 H GLU A 105 -12.123 0.177 -10.976 1.00 0.00 H new ATOM 0 HA GLU A 105 -12.710 1.879 -12.160 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -14.584 0.287 -12.655 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -15.579 1.135 -11.487 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -15.362 3.236 -12.772 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -14.267 2.464 -13.901 1.00 0.00 H new ATOM 612 N ASN A 106 -14.378 3.019 -9.604 1.00 0.00 N ATOM 613 CA ASN A 106 -14.787 4.201 -8.821 1.00 0.00 C ATOM 614 C ASN A 106 -13.753 4.741 -7.837 1.00 0.00 C ATOM 615 O ASN A 106 -13.980 4.850 -6.634 1.00 0.00 O ATOM 616 CB ASN A 106 -16.059 3.785 -8.102 1.00 0.00 C ATOM 617 CG ASN A 106 -17.214 3.783 -9.098 1.00 0.00 C ATOM 618 OD1 ASN A 106 -17.408 4.662 -9.924 1.00 0.00 O ATOM 619 ND2 ASN A 106 -17.783 2.622 -9.211 1.00 0.00 N ATOM 0 H ASN A 106 -14.718 2.147 -9.199 1.00 0.00 H new ATOM 0 HA ASN A 106 -14.924 5.039 -9.504 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -15.937 2.794 -7.665 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -16.270 4.472 -7.282 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.403 2.432 -9.998 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.610 1.899 -8.512 1.00 0.00 H new ATOM 620 N HIS A 107 -12.599 5.036 -8.413 1.00 0.00 N ATOM 621 CA HIS A 107 -11.434 5.673 -7.755 1.00 0.00 C ATOM 622 C HIS A 107 -10.661 4.767 -6.777 1.00 0.00 C ATOM 623 O HIS A 107 -9.466 4.959 -6.578 1.00 0.00 O ATOM 624 CB HIS A 107 -11.805 6.990 -7.044 1.00 0.00 C ATOM 625 CG HIS A 107 -12.494 7.963 -8.008 1.00 0.00 C ATOM 626 ND1 HIS A 107 -13.802 7.983 -8.295 1.00 0.00 N ATOM 627 CD2 HIS A 107 -11.890 8.818 -8.817 1.00 0.00 C ATOM 628 CE1 HIS A 107 -13.990 8.829 -9.295 1.00 0.00 C ATOM 629 NE2 HIS A 107 -12.812 9.345 -9.609 1.00 0.00 N ATOM 0 H HIS A 107 -12.425 4.835 -9.398 1.00 0.00 H new ATOM 0 HA HIS A 107 -10.763 5.882 -8.588 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -12.465 6.779 -6.202 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -10.906 7.453 -6.636 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -10.834 9.046 -8.830 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -14.933 9.057 -9.769 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -12.642 10.035 -10.341 1.00 0.00 H new ATOM 630 N TYR A 108 -11.362 3.806 -6.187 1.00 0.00 N ATOM 631 CA TYR A 108 -10.757 2.785 -5.318 1.00 0.00 C ATOM 632 C TYR A 108 -9.721 1.952 -6.073 1.00 0.00 C ATOM 633 O TYR A 108 -10.003 1.324 -7.082 1.00 0.00 O ATOM 634 CB TYR A 108 -11.788 1.830 -4.706 1.00 0.00 C ATOM 635 CG TYR A 108 -12.759 2.531 -3.770 1.00 0.00 C ATOM 636 CD1 TYR A 108 -12.263 3.074 -2.565 1.00 0.00 C ATOM 637 CD2 TYR A 108 -14.018 2.865 -4.288 1.00 0.00 C ATOM 638 CE1 TYR A 108 -13.040 4.035 -1.893 1.00 0.00 C ATOM 639 CE2 TYR A 108 -14.793 3.835 -3.616 1.00 0.00 C ATOM 640 CZ TYR A 108 -14.271 4.424 -2.447 1.00 0.00 C ATOM 641 OH TYR A 108 -14.905 5.511 -1.939 1.00 0.00 O ATOM 0 H TYR A 108 -12.371 3.706 -6.294 1.00 0.00 H new ATOM 0 HA TYR A 108 -10.279 3.342 -4.512 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -12.348 1.346 -5.506 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -11.268 1.043 -4.160 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -11.309 2.759 -2.168 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -14.388 2.389 -5.184 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -12.695 4.467 -0.965 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -15.765 4.120 -3.990 1.00 0.00 H new ATOM 0 HH TYR A 108 -15.744 5.657 -2.425 1.00 0.00 H new ATOM 642 N ASN A 109 -8.503 2.112 -5.601 1.00 0.00 N ATOM 643 CA ASN A 109 -7.315 1.498 -6.208 1.00 0.00 C ATOM 644 C ASN A 109 -6.778 0.275 -5.468 1.00 0.00 C ATOM 645 O ASN A 109 -6.332 0.339 -4.322 1.00 0.00 O ATOM 646 CB ASN A 109 -6.237 2.561 -6.288 1.00 0.00 C ATOM 647 CG ASN A 109 -6.162 3.156 -7.693 1.00 0.00 C ATOM 648 OD1 ASN A 109 -5.345 2.766 -8.523 1.00 0.00 O ATOM 649 ND2 ASN A 109 -7.054 4.068 -8.011 1.00 0.00 N ATOM 0 H ASN A 109 -8.295 2.676 -4.777 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.610 1.128 -7.190 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -6.444 3.350 -5.565 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -5.273 2.128 -6.020 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -7.071 4.458 -8.954 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -7.729 4.386 -7.315 1.00 0.00 H new ATOM 650 N THR A 110 -6.935 -0.839 -6.175 1.00 0.00 N ATOM 651 CA THR A 110 -6.376 -2.150 -5.809 1.00 0.00 C ATOM 652 C THR A 110 -5.050 -2.292 -6.571 1.00 0.00 C ATOM 653 O THR A 110 -4.918 -1.816 -7.710 1.00 0.00 O ATOM 654 CB THR A 110 -7.428 -3.190 -6.226 1.00 0.00 C ATOM 655 OG1 THR A 110 -7.965 -2.844 -7.503 1.00 0.00 O ATOM 656 CG2 THR A 110 -8.563 -3.282 -5.208 1.00 0.00 C ATOM 0 H THR A 110 -7.468 -0.863 -7.044 1.00 0.00 H new ATOM 0 HA THR A 110 -6.166 -2.277 -4.747 1.00 0.00 H new ATOM 0 HB THR A 110 -6.936 -4.162 -6.275 1.00 0.00 H new ATOM 0 HG1 THR A 110 -8.680 -3.472 -7.738 1.00 0.00 H new ATOM 0 HG21 THR A 110 -9.287 -4.027 -5.537 1.00 0.00 H new ATOM 0 HG22 THR A 110 -8.159 -3.572 -4.238 1.00 0.00 H new ATOM 0 HG23 THR A 110 -9.054 -2.313 -5.122 1.00 0.00 H new ATOM 657 N TYR A 111 -4.043 -2.845 -5.903 1.00 0.00 N ATOM 658 CA TYR A 111 -2.666 -2.801 -6.420 1.00 0.00 C ATOM 659 C TYR A 111 -1.868 -4.083 -6.194 1.00 0.00 C ATOM 660 O TYR A 111 -1.374 -4.352 -5.093 1.00 0.00 O ATOM 661 CB TYR A 111 -1.869 -1.665 -5.771 1.00 0.00 C ATOM 662 CG TYR A 111 -2.450 -0.267 -5.807 1.00 0.00 C ATOM 663 CD1 TYR A 111 -2.091 0.536 -6.906 1.00 0.00 C ATOM 664 CD2 TYR A 111 -3.025 0.277 -4.631 1.00 0.00 C ATOM 665 CE1 TYR A 111 -2.295 1.921 -6.815 1.00 0.00 C ATOM 666 CE2 TYR A 111 -3.225 1.661 -4.550 1.00 0.00 C ATOM 667 CZ TYR A 111 -2.870 2.465 -5.662 1.00 0.00 C ATOM 668 OH TYR A 111 -3.273 3.761 -5.721 1.00 0.00 O ATOM 0 H TYR A 111 -4.145 -3.327 -5.010 1.00 0.00 H new ATOM 0 HA TYR A 111 -2.790 -2.652 -7.493 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -1.704 -1.929 -4.726 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.890 -1.630 -6.249 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -1.669 0.097 -7.798 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -3.305 -0.366 -3.810 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -2.009 2.565 -7.633 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.641 2.106 -3.658 1.00 0.00 H new ATOM 0 HH TYR A 111 -3.657 4.024 -4.859 1.00 0.00 H new ATOM 669 N ILE A 112 -1.677 -4.814 -7.289 1.00 0.00 N ATOM 670 CA ILE A 112 -0.828 -6.035 -7.291 1.00 0.00 C ATOM 671 C ILE A 112 0.631 -5.584 -7.163 1.00 0.00 C ATOM 672 O ILE A 112 1.118 -4.832 -8.000 1.00 0.00 O ATOM 673 CB ILE A 112 -0.953 -6.856 -8.595 1.00 0.00 C ATOM 674 CG1 ILE A 112 -2.371 -7.325 -8.893 1.00 0.00 C ATOM 675 CG2 ILE A 112 0.026 -8.039 -8.681 1.00 0.00 C ATOM 676 CD1 ILE A 112 -2.958 -8.353 -7.912 1.00 0.00 C ATOM 0 H ILE A 112 -2.093 -4.594 -8.194 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.154 -6.670 -6.467 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.673 -6.142 -9.369 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -3.025 -6.453 -8.910 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.388 -7.756 -9.894 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -0.122 -8.566 -9.623 1.00 0.00 H new ATOM 0 HG22 ILE A 112 1.050 -7.668 -8.630 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -0.155 -8.722 -7.851 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -3.970 -8.615 -8.221 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.337 -9.249 -7.908 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -2.984 -7.926 -6.910 1.00 0.00 H new ATOM 677 N SER A 113 1.328 -6.163 -6.199 1.00 0.00 N ATOM 678 CA SER A 113 2.794 -6.049 -6.125 1.00 0.00 C ATOM 679 C SER A 113 3.376 -6.767 -7.349 1.00 0.00 C ATOM 680 O SER A 113 3.161 -7.959 -7.536 1.00 0.00 O ATOM 681 CB SER A 113 3.382 -6.658 -4.854 1.00 0.00 C ATOM 682 OG SER A 113 4.810 -6.476 -4.839 1.00 0.00 O ATOM 0 H SER A 113 0.912 -6.719 -5.452 1.00 0.00 H new ATOM 0 HA SER A 113 3.053 -4.990 -6.107 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.938 -6.189 -3.976 1.00 0.00 H new ATOM 0 HB3 SER A 113 3.141 -7.720 -4.804 1.00 0.00 H new ATOM 0 HG SER A 113 5.239 -7.283 -4.486 1.00 0.00 H new ATOM 683 N LYS A 114 3.833 -5.939 -8.276 1.00 0.00 N ATOM 684 CA LYS A 114 4.418 -6.353 -9.561 1.00 0.00 C ATOM 685 C LYS A 114 5.234 -7.650 -9.527 1.00 0.00 C ATOM 686 O LYS A 114 4.979 -8.576 -10.291 1.00 0.00 O ATOM 687 CB LYS A 114 5.315 -5.212 -10.033 1.00 0.00 C ATOM 688 CG LYS A 114 5.274 -5.064 -11.534 1.00 0.00 C ATOM 689 CD LYS A 114 3.824 -4.717 -11.880 1.00 0.00 C ATOM 690 CE LYS A 114 3.697 -4.483 -13.365 1.00 0.00 C ATOM 691 NZ LYS A 114 4.022 -5.721 -14.050 1.00 0.00 N ATOM 0 H LYS A 114 3.810 -4.926 -8.160 1.00 0.00 H new ATOM 0 HA LYS A 114 3.587 -6.563 -10.235 1.00 0.00 H new ATOM 0 HB2 LYS A 114 4.997 -4.280 -9.565 1.00 0.00 H new ATOM 0 HB3 LYS A 114 6.340 -5.396 -9.712 1.00 0.00 H new ATOM 0 HG2 LYS A 114 5.954 -4.280 -11.868 1.00 0.00 H new ATOM 0 HG3 LYS A 114 5.584 -5.986 -12.026 1.00 0.00 H new ATOM 0 HD2 LYS A 114 3.163 -5.527 -11.572 1.00 0.00 H new ATOM 0 HD3 LYS A 114 3.513 -3.826 -11.334 1.00 0.00 H new ATOM 0 HE2 LYS A 114 2.685 -4.165 -13.614 1.00 0.00 H new ATOM 0 HE3 LYS A 114 4.369 -3.685 -13.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 3.599 -5.713 -15.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 5.055 -5.812 -14.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 3.645 -6.526 -13.510 1.00 0.00 H new ATOM 692 N LYS A 115 6.163 -7.700 -8.574 1.00 0.00 N ATOM 693 CA LYS A 115 6.948 -8.919 -8.326 1.00 0.00 C ATOM 694 C LYS A 115 6.047 -10.121 -7.974 1.00 0.00 C ATOM 695 O LYS A 115 6.108 -11.171 -8.598 1.00 0.00 O ATOM 696 CB LYS A 115 7.974 -8.681 -7.205 1.00 0.00 C ATOM 697 CG LYS A 115 8.802 -9.958 -7.099 1.00 0.00 C ATOM 698 CD LYS A 115 9.220 -10.324 -5.690 1.00 0.00 C ATOM 699 CE LYS A 115 9.320 -11.852 -5.628 1.00 0.00 C ATOM 700 NZ LYS A 115 10.351 -12.381 -6.538 1.00 0.00 N ATOM 0 H LYS A 115 6.394 -6.918 -7.961 1.00 0.00 H new ATOM 0 HA LYS A 115 7.476 -9.158 -9.249 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.608 -7.825 -7.435 1.00 0.00 H new ATOM 0 HB3 LYS A 115 7.474 -8.463 -6.261 1.00 0.00 H new ATOM 0 HG2 LYS A 115 8.228 -10.784 -7.519 1.00 0.00 H new ATOM 0 HG3 LYS A 115 9.696 -9.847 -7.712 1.00 0.00 H new ATOM 0 HD2 LYS A 115 10.177 -9.866 -5.442 1.00 0.00 H new ATOM 0 HD3 LYS A 115 8.493 -9.957 -4.966 1.00 0.00 H new ATOM 0 HE2 LYS A 115 9.548 -12.158 -4.607 1.00 0.00 H new ATOM 0 HE3 LYS A 115 8.354 -12.288 -5.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 10.550 -13.373 -6.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 10.010 -12.324 -7.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 11.221 -11.820 -6.440 1.00 0.00 H new ATOM 701 N HIS A 116 5.183 -9.905 -6.982 1.00 0.00 N ATOM 702 CA HIS A 116 4.281 -10.933 -6.444 1.00 0.00 C ATOM 703 C HIS A 116 2.992 -11.094 -7.257 1.00 0.00 C ATOM 704 O HIS A 116 1.999 -11.650 -6.787 1.00 0.00 O ATOM 705 CB HIS A 116 3.982 -10.556 -4.998 1.00 0.00 C ATOM 706 CG HIS A 116 5.254 -10.393 -4.172 1.00 0.00 C ATOM 707 ND1 HIS A 116 5.667 -9.232 -3.677 1.00 0.00 N ATOM 708 CD2 HIS A 116 6.137 -11.323 -3.846 1.00 0.00 C ATOM 709 CE1 HIS A 116 6.788 -9.460 -3.014 1.00 0.00 C ATOM 710 NE2 HIS A 116 7.091 -10.751 -3.131 1.00 0.00 N ATOM 0 H HIS A 116 5.086 -9.000 -6.521 1.00 0.00 H new ATOM 0 HA HIS A 116 4.770 -11.905 -6.504 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.415 -9.625 -4.976 1.00 0.00 H new ATOM 0 HB3 HIS A 116 3.353 -11.323 -4.547 1.00 0.00 H new ATOM 0 HD2 HIS A 116 6.087 -12.367 -4.117 1.00 0.00 H new ATOM 0 HE1 HIS A 116 7.361 -8.724 -2.470 1.00 0.00 H new ATOM 0 HE2 HIS A 116 7.911 -11.215 -2.740 1.00 0.00 H new ATOM 711 N ALA A 117 3.131 -10.802 -8.555 1.00 0.00 N ATOM 712 CA ALA A 117 2.118 -11.113 -9.573 1.00 0.00 C ATOM 713 C ALA A 117 1.821 -12.615 -9.616 1.00 0.00 C ATOM 714 O ALA A 117 0.648 -12.992 -9.548 1.00 0.00 O ATOM 715 CB ALA A 117 2.591 -10.627 -10.944 1.00 0.00 C ATOM 0 H ALA A 117 3.957 -10.339 -8.933 1.00 0.00 H new ATOM 0 HA ALA A 117 1.196 -10.596 -9.308 1.00 0.00 H new ATOM 0 HB1 ALA A 117 1.835 -10.861 -11.694 1.00 0.00 H new ATOM 0 HB2 ALA A 117 2.750 -9.549 -10.913 1.00 0.00 H new ATOM 0 HB3 ALA A 117 3.526 -11.124 -11.204 1.00 0.00 H new ATOM 716 N GLU A 118 2.855 -13.409 -9.293 1.00 0.00 N ATOM 717 CA GLU A 118 2.751 -14.882 -9.262 1.00 0.00 C ATOM 718 C GLU A 118 1.816 -15.414 -8.156 1.00 0.00 C ATOM 719 O GLU A 118 1.321 -16.537 -8.224 1.00 0.00 O ATOM 720 CB GLU A 118 4.118 -15.572 -9.061 1.00 0.00 C ATOM 721 CG GLU A 118 5.376 -14.817 -9.493 1.00 0.00 C ATOM 722 CD GLU A 118 5.469 -14.570 -11.002 1.00 0.00 C ATOM 723 OE1 GLU A 118 5.868 -15.517 -11.711 1.00 0.00 O ATOM 724 OE2 GLU A 118 5.164 -13.425 -11.402 1.00 0.00 O ATOM 0 H GLU A 118 3.780 -13.055 -9.048 1.00 0.00 H new ATOM 0 HA GLU A 118 2.337 -15.126 -10.240 1.00 0.00 H new ATOM 0 HB2 GLU A 118 4.219 -15.810 -8.002 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.096 -16.519 -9.600 1.00 0.00 H new ATOM 0 HG2 GLU A 118 5.407 -13.858 -8.976 1.00 0.00 H new ATOM 0 HG3 GLU A 118 6.253 -15.380 -9.173 1.00 0.00 H new ATOM 725 N LYS A 119 1.565 -14.541 -7.185 1.00 0.00 N ATOM 726 CA LYS A 119 0.828 -14.801 -5.936 1.00 0.00 C ATOM 727 C LYS A 119 -0.447 -13.963 -5.766 1.00 0.00 C ATOM 728 O LYS A 119 -1.238 -14.256 -4.858 1.00 0.00 O ATOM 729 CB LYS A 119 1.807 -14.514 -4.798 1.00 0.00 C ATOM 730 CG LYS A 119 2.802 -15.658 -4.620 1.00 0.00 C ATOM 731 CD LYS A 119 4.217 -15.157 -4.305 1.00 0.00 C ATOM 732 CE LYS A 119 4.911 -14.616 -5.557 1.00 0.00 C ATOM 733 NZ LYS A 119 6.304 -14.294 -5.236 1.00 0.00 N ATOM 0 H LYS A 119 1.886 -13.575 -7.245 1.00 0.00 H new ATOM 0 HA LYS A 119 0.476 -15.833 -5.945 1.00 0.00 H new ATOM 0 HB2 LYS A 119 2.346 -13.589 -5.004 1.00 0.00 H new ATOM 0 HB3 LYS A 119 1.255 -14.362 -3.870 1.00 0.00 H new ATOM 0 HG2 LYS A 119 2.462 -16.310 -3.815 1.00 0.00 H new ATOM 0 HG3 LYS A 119 2.826 -16.260 -5.528 1.00 0.00 H new ATOM 0 HD2 LYS A 119 4.167 -14.374 -3.548 1.00 0.00 H new ATOM 0 HD3 LYS A 119 4.807 -15.971 -3.883 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.871 -15.355 -6.357 1.00 0.00 H new ATOM 0 HE3 LYS A 119 4.394 -13.727 -5.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 6.553 -13.375 -5.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 6.421 -14.247 -4.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 6.928 -15.031 -5.622 1.00 0.00 H new ATOM 734 N ASN A 120 -0.666 -12.998 -6.669 1.00 0.00 N ATOM 735 CA ASN A 120 -1.787 -12.014 -6.637 1.00 0.00 C ATOM 736 C ASN A 120 -1.846 -11.153 -5.363 1.00 0.00 C ATOM 737 O ASN A 120 -2.887 -10.626 -4.976 1.00 0.00 O ATOM 738 CB ASN A 120 -3.129 -12.719 -6.873 1.00 0.00 C ATOM 739 CG ASN A 120 -3.139 -13.458 -8.216 1.00 0.00 C ATOM 740 OD1 ASN A 120 -3.388 -12.896 -9.277 1.00 0.00 O ATOM 741 ND2 ASN A 120 -2.798 -14.724 -8.181 1.00 0.00 N ATOM 0 H ASN A 120 -0.054 -12.866 -7.474 1.00 0.00 H new ATOM 0 HA ASN A 120 -1.585 -11.317 -7.450 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -3.319 -13.425 -6.065 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -3.936 -11.987 -6.852 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -2.736 -15.260 -9.047 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -2.595 -15.173 -7.288 1.00 0.00 H new ATOM 742 N TRP A 121 -0.659 -10.875 -4.838 1.00 0.00 N ATOM 743 CA TRP A 121 -0.508 -10.090 -3.596 1.00 0.00 C ATOM 744 C TRP A 121 -0.735 -8.602 -3.820 1.00 0.00 C ATOM 745 O TRP A 121 0.013 -7.934 -4.550 1.00 0.00 O ATOM 746 CB TRP A 121 0.843 -10.296 -2.908 1.00 0.00 C ATOM 747 CG TRP A 121 1.026 -11.693 -2.332 1.00 0.00 C ATOM 748 CD1 TRP A 121 0.076 -12.615 -2.212 1.00 0.00 C ATOM 749 CD2 TRP A 121 2.198 -12.215 -1.773 1.00 0.00 C ATOM 750 NE1 TRP A 121 0.596 -13.715 -1.661 1.00 0.00 N ATOM 751 CE2 TRP A 121 1.875 -13.505 -1.354 1.00 0.00 C ATOM 752 CE3 TRP A 121 3.506 -11.717 -1.625 1.00 0.00 C ATOM 753 CZ2 TRP A 121 2.843 -14.337 -0.745 1.00 0.00 C ATOM 754 CZ3 TRP A 121 4.497 -12.553 -1.061 1.00 0.00 C ATOM 755 CH2 TRP A 121 4.165 -13.842 -0.602 1.00 0.00 C ATOM 0 H TRP A 121 0.224 -11.179 -5.248 1.00 0.00 H new ATOM 0 HA TRP A 121 -1.285 -10.473 -2.934 1.00 0.00 H new ATOM 0 HB2 TRP A 121 1.640 -10.100 -3.625 1.00 0.00 H new ATOM 0 HB3 TRP A 121 0.949 -9.565 -2.107 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -0.954 -12.494 -2.513 1.00 0.00 H new ATOM 0 HE1 TRP A 121 0.090 -14.586 -1.499 1.00 0.00 H new ATOM 0 HE3 TRP A 121 3.749 -10.712 -1.937 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 2.582 -15.326 -0.397 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 5.515 -12.201 -0.982 1.00 0.00 H new ATOM 0 HH2 TRP A 121 4.921 -14.458 -0.138 1.00 0.00 H new ATOM 756 N PHE A 122 -1.870 -8.160 -3.304 1.00 0.00 N ATOM 757 CA PHE A 122 -2.187 -6.725 -3.265 1.00 0.00 C ATOM 758 C PHE A 122 -1.764 -6.118 -1.923 1.00 0.00 C ATOM 759 O PHE A 122 -1.687 -6.814 -0.904 1.00 0.00 O ATOM 760 CB PHE A 122 -3.684 -6.439 -3.392 1.00 0.00 C ATOM 761 CG PHE A 122 -4.369 -6.981 -4.649 1.00 0.00 C ATOM 762 CD1 PHE A 122 -4.868 -8.305 -4.666 1.00 0.00 C ATOM 763 CD2 PHE A 122 -4.753 -6.060 -5.644 1.00 0.00 C ATOM 764 CE1 PHE A 122 -5.755 -8.709 -5.690 1.00 0.00 C ATOM 765 CE2 PHE A 122 -5.643 -6.452 -6.659 1.00 0.00 C ATOM 766 CZ PHE A 122 -6.142 -7.777 -6.675 1.00 0.00 C ATOM 0 H PHE A 122 -2.590 -8.763 -2.906 1.00 0.00 H new ATOM 0 HA PHE A 122 -1.650 -6.292 -4.109 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -4.188 -6.856 -2.520 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -3.831 -5.359 -3.360 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -4.572 -9.005 -3.899 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -4.363 -5.053 -5.627 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -6.132 -9.721 -5.718 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -5.944 -5.748 -7.421 1.00 0.00 H new ATOM 0 HZ PHE A 122 -6.829 -8.078 -7.452 1.00 0.00 H new ATOM 767 N VAL A 123 -1.470 -4.830 -1.986 1.00 0.00 N ATOM 768 CA VAL A 123 -1.367 -3.956 -0.799 1.00 0.00 C ATOM 769 C VAL A 123 -2.704 -3.984 -0.048 1.00 0.00 C ATOM 770 O VAL A 123 -3.757 -3.991 -0.676 1.00 0.00 O ATOM 771 CB VAL A 123 -0.827 -2.539 -1.176 1.00 0.00 C ATOM 772 CG1 VAL A 123 -1.127 -2.093 -2.590 1.00 0.00 C ATOM 773 CG2 VAL A 123 -1.270 -1.381 -0.273 1.00 0.00 C ATOM 0 H VAL A 123 -1.292 -4.344 -2.865 1.00 0.00 H new ATOM 0 HA VAL A 123 -0.618 -4.330 -0.101 1.00 0.00 H new ATOM 0 HB VAL A 123 0.239 -2.722 -1.042 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -0.712 -1.099 -2.754 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -0.680 -2.794 -3.295 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -2.206 -2.065 -2.741 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -0.832 -0.450 -0.634 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -2.357 -1.302 -0.290 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -0.936 -1.567 0.748 1.00 0.00 H new ATOM 774 N GLY A 124 -2.616 -3.929 1.276 1.00 0.00 N ATOM 775 CA GLY A 124 -3.786 -4.239 2.117 1.00 0.00 C ATOM 776 C GLY A 124 -3.637 -3.767 3.546 1.00 0.00 C ATOM 777 O GLY A 124 -2.581 -3.821 4.170 1.00 0.00 O ATOM 0 H GLY A 124 -1.771 -3.679 1.790 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -4.672 -3.778 1.680 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -3.953 -5.316 2.113 1.00 0.00 H new ATOM 778 N LEU A 125 -4.729 -3.140 3.931 1.00 0.00 N ATOM 779 CA LEU A 125 -4.816 -2.517 5.247 1.00 0.00 C ATOM 780 C LEU A 125 -5.527 -3.361 6.305 1.00 0.00 C ATOM 781 O LEU A 125 -6.418 -4.164 6.028 1.00 0.00 O ATOM 782 CB LEU A 125 -5.485 -1.165 5.103 1.00 0.00 C ATOM 783 CG LEU A 125 -4.486 -0.226 5.739 1.00 0.00 C ATOM 784 CD1 LEU A 125 -3.552 0.418 4.735 1.00 0.00 C ATOM 785 CD2 LEU A 125 -5.216 0.859 6.536 1.00 0.00 C ATOM 0 H LEU A 125 -5.568 -3.045 3.359 1.00 0.00 H new ATOM 0 HA LEU A 125 -3.795 -2.412 5.615 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -5.668 -0.914 4.058 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.449 -1.135 5.611 1.00 0.00 H new ATOM 0 HG LEU A 125 -3.870 -0.831 6.404 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -2.860 1.080 5.255 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -2.990 -0.356 4.212 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -4.133 0.994 4.015 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -4.487 1.530 6.990 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -5.865 1.426 5.869 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -5.817 0.394 7.318 1.00 0.00 H new ATOM 786 N LYS A 126 -4.934 -3.281 7.480 1.00 0.00 N ATOM 787 CA LYS A 126 -5.566 -3.813 8.684 1.00 0.00 C ATOM 788 C LYS A 126 -6.494 -2.756 9.327 1.00 0.00 C ATOM 789 O LYS A 126 -6.187 -1.571 9.382 1.00 0.00 O ATOM 790 CB LYS A 126 -4.485 -4.245 9.684 1.00 0.00 C ATOM 791 CG LYS A 126 -4.980 -5.319 10.649 1.00 0.00 C ATOM 792 CD LYS A 126 -4.185 -5.324 11.958 1.00 0.00 C ATOM 793 CE LYS A 126 -4.444 -4.036 12.728 1.00 0.00 C ATOM 794 NZ LYS A 126 -3.724 -4.028 14.009 1.00 0.00 N ATOM 0 H LYS A 126 -4.019 -2.856 7.633 1.00 0.00 H new ATOM 0 HA LYS A 126 -6.172 -4.677 8.410 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -3.619 -4.621 9.139 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -4.151 -3.376 10.252 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -6.035 -5.153 10.866 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -4.902 -6.297 10.174 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -4.471 -6.184 12.564 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -3.120 -5.423 11.746 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -4.132 -3.181 12.127 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -5.513 -3.926 12.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -3.736 -3.068 14.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -4.186 -4.684 14.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -2.740 -4.327 13.856 1.00 0.00 H new ATOM 795 N LYS A 127 -7.574 -3.257 9.915 1.00 0.00 N ATOM 796 CA LYS A 127 -8.729 -2.456 10.410 1.00 0.00 C ATOM 797 C LYS A 127 -8.448 -1.501 11.589 1.00 0.00 C ATOM 798 O LYS A 127 -9.278 -0.646 11.918 1.00 0.00 O ATOM 799 CB LYS A 127 -9.852 -3.407 10.850 1.00 0.00 C ATOM 800 CG LYS A 127 -10.176 -4.546 9.868 1.00 0.00 C ATOM 801 CD LYS A 127 -10.571 -4.042 8.480 1.00 0.00 C ATOM 802 CE LYS A 127 -10.589 -5.243 7.526 1.00 0.00 C ATOM 803 NZ LYS A 127 -10.972 -4.823 6.174 1.00 0.00 N ATOM 0 H LYS A 127 -7.691 -4.258 10.073 1.00 0.00 H new ATOM 0 HA LYS A 127 -8.995 -1.823 9.564 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -9.579 -3.845 11.810 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -10.757 -2.822 11.013 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.308 -5.199 9.778 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -10.988 -5.149 10.274 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -11.551 -3.566 8.512 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -9.863 -3.290 8.132 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -9.604 -5.710 7.502 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -11.289 -5.994 7.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -11.591 -5.543 5.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -11.479 -3.916 6.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -10.119 -4.712 5.590 1.00 0.00 H new ATOM 804 N ASN A 128 -7.235 -1.553 12.113 1.00 0.00 N ATOM 805 CA ASN A 128 -6.889 -0.993 13.432 1.00 0.00 C ATOM 806 C ASN A 128 -5.469 -0.395 13.401 1.00 0.00 C ATOM 807 O ASN A 128 -4.509 -0.931 13.966 1.00 0.00 O ATOM 808 CB ASN A 128 -6.931 -2.156 14.422 1.00 0.00 C ATOM 809 CG ASN A 128 -8.297 -2.812 14.722 1.00 0.00 C ATOM 810 OD1 ASN A 128 -8.381 -3.992 15.028 1.00 0.00 O ATOM 811 ND2 ASN A 128 -9.398 -2.107 14.565 1.00 0.00 N ATOM 0 H ASN A 128 -6.445 -1.988 11.637 1.00 0.00 H new ATOM 0 HA ASN A 128 -7.583 -0.201 13.713 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -6.263 -2.933 14.051 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -6.516 -1.804 15.367 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -10.309 -2.547 14.699 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -9.340 -1.121 14.310 1.00 0.00 H new ATOM 812 N GLY A 129 -5.329 0.579 12.513 1.00 0.00 N ATOM 813 CA GLY A 129 -4.072 1.325 12.295 1.00 0.00 C ATOM 814 C GLY A 129 -2.825 0.560 11.833 1.00 0.00 C ATOM 815 O GLY A 129 -1.729 1.113 11.924 1.00 0.00 O ATOM 0 H GLY A 129 -6.090 0.887 11.908 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -4.274 2.102 11.557 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -3.822 1.829 13.229 1.00 0.00 H new ATOM 816 N SER A 130 -2.953 -0.679 11.379 1.00 0.00 N ATOM 817 CA SER A 130 -1.816 -1.336 10.704 1.00 0.00 C ATOM 818 C SER A 130 -2.027 -1.676 9.219 1.00 0.00 C ATOM 819 O SER A 130 -3.103 -1.435 8.669 1.00 0.00 O ATOM 820 CB SER A 130 -1.329 -2.550 11.519 1.00 0.00 C ATOM 821 OG SER A 130 -0.115 -3.087 10.997 1.00 0.00 O ATOM 0 H SER A 130 -3.799 -1.244 11.456 1.00 0.00 H new ATOM 0 HA SER A 130 -1.027 -0.584 10.677 1.00 0.00 H new ATOM 0 HB2 SER A 130 -1.178 -2.254 12.557 1.00 0.00 H new ATOM 0 HB3 SER A 130 -2.099 -3.322 11.516 1.00 0.00 H new ATOM 0 HG SER A 130 0.561 -2.379 10.947 1.00 0.00 H new ATOM 822 N CYS A 131 -0.947 -2.029 8.532 1.00 0.00 N ATOM 823 CA CYS A 131 -0.983 -2.450 7.122 1.00 0.00 C ATOM 824 C CYS A 131 -0.605 -3.936 7.062 1.00 0.00 C ATOM 825 O CYS A 131 0.531 -4.321 7.364 1.00 0.00 O ATOM 826 CB CYS A 131 0.013 -1.673 6.261 1.00 0.00 C ATOM 827 SG CYS A 131 -0.467 0.050 5.919 1.00 0.00 S ATOM 0 H CYS A 131 -0.010 -2.034 8.934 1.00 0.00 H new ATOM 0 HA CYS A 131 -1.985 -2.261 6.736 1.00 0.00 H new ATOM 0 HB2 CYS A 131 0.983 -1.675 6.759 1.00 0.00 H new ATOM 0 HB3 CYS A 131 0.140 -2.196 5.313 1.00 0.00 H new ATOM 0 HG CYS A 131 0.418 0.856 6.426 1.00 0.00 H new ATOM 828 N LYS A 132 -1.563 -4.718 6.613 1.00 0.00 N ATOM 829 CA LYS A 132 -1.377 -6.170 6.666 1.00 0.00 C ATOM 830 C LYS A 132 -1.361 -6.944 5.350 1.00 0.00 C ATOM 831 O LYS A 132 -2.255 -6.837 4.522 1.00 0.00 O ATOM 832 CB LYS A 132 -2.241 -6.877 7.712 1.00 0.00 C ATOM 833 CG LYS A 132 -1.620 -6.749 9.111 1.00 0.00 C ATOM 834 CD LYS A 132 -0.182 -7.280 9.164 1.00 0.00 C ATOM 835 CE LYS A 132 0.494 -7.020 10.499 1.00 0.00 C ATOM 836 NZ LYS A 132 -0.025 -7.938 11.516 1.00 0.00 N ATOM 0 H LYS A 132 -2.449 -4.400 6.220 1.00 0.00 H new ATOM 0 HA LYS A 132 -0.338 -6.204 6.993 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -3.243 -6.447 7.713 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -2.346 -7.930 7.451 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -1.629 -5.702 9.415 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -2.233 -7.295 9.829 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -0.188 -8.352 8.968 1.00 0.00 H new ATOM 0 HD3 LYS A 132 0.402 -6.814 8.370 1.00 0.00 H new ATOM 0 HE2 LYS A 132 1.572 -7.147 10.400 1.00 0.00 H new ATOM 0 HE3 LYS A 132 0.322 -5.989 10.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 0.445 -7.751 12.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -1.050 -7.797 11.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 0.161 -8.919 11.226 1.00 0.00 H new ATOM 837 N ARG A 133 -0.152 -7.457 5.149 1.00 0.00 N ATOM 838 CA ARG A 133 0.125 -8.667 4.347 1.00 0.00 C ATOM 839 C ARG A 133 -0.064 -8.616 2.814 1.00 0.00 C ATOM 840 O ARG A 133 -0.060 -7.536 2.217 1.00 0.00 O ATOM 841 CB ARG A 133 -0.666 -9.836 4.955 1.00 0.00 C ATOM 842 CG ARG A 133 0.191 -10.768 5.809 1.00 0.00 C ATOM 843 CD ARG A 133 0.913 -10.071 6.958 1.00 0.00 C ATOM 844 NE ARG A 133 1.943 -11.005 7.438 1.00 0.00 N ATOM 845 CZ ARG A 133 2.764 -10.834 8.473 1.00 0.00 C ATOM 846 NH1 ARG A 133 2.835 -9.715 9.169 1.00 0.00 N ATOM 847 NH2 ARG A 133 3.540 -11.857 8.821 1.00 0.00 N ATOM 0 H ARG A 133 0.691 -7.040 5.545 1.00 0.00 H new ATOM 0 HA ARG A 133 1.206 -8.786 4.417 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -1.476 -9.438 5.566 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -1.125 -10.411 4.151 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -0.443 -11.555 6.217 1.00 0.00 H new ATOM 0 HG3 ARG A 133 0.930 -11.252 5.170 1.00 0.00 H new ATOM 0 HD2 ARG A 133 1.364 -9.137 6.622 1.00 0.00 H new ATOM 0 HD3 ARG A 133 0.216 -9.819 7.757 1.00 0.00 H new ATOM 0 HE ARG A 133 2.039 -11.879 6.922 1.00 0.00 H new ATOM 0 HH11 ARG A 133 2.241 -8.923 8.923 1.00 0.00 H new ATOM 0 HH12 ARG A 133 3.484 -9.642 9.953 1.00 0.00 H new ATOM 0 HH21 ARG A 133 3.493 -12.733 8.301 1.00 0.00 H new ATOM 0 HH22 ARG A 133 4.182 -11.765 9.608 1.00 0.00 H new ATOM 848 N GLY A 134 0.433 -9.740 2.296 1.00 0.00 N ATOM 849 CA GLY A 134 0.272 -10.251 0.921 1.00 0.00 C ATOM 850 C GLY A 134 -0.702 -11.444 0.829 1.00 0.00 C ATOM 851 O GLY A 134 -1.731 -11.313 0.156 1.00 0.00 O ATOM 0 H GLY A 134 1.002 -10.368 2.863 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -0.088 -9.446 0.280 1.00 0.00 H new ATOM 0 HA3 GLY A 134 1.246 -10.554 0.536 1.00 0.00 H new ATOM 852 N PRO A 135 -0.427 -12.613 1.431 1.00 0.00 N ATOM 853 CA PRO A 135 -1.264 -13.830 1.288 1.00 0.00 C ATOM 854 C PRO A 135 -2.409 -13.849 2.305 1.00 0.00 C ATOM 855 O PRO A 135 -2.566 -14.739 3.143 1.00 0.00 O ATOM 856 CB PRO A 135 -0.239 -14.958 1.435 1.00 0.00 C ATOM 857 CG PRO A 135 0.690 -14.440 2.525 1.00 0.00 C ATOM 858 CD PRO A 135 0.780 -12.936 2.225 1.00 0.00 C ATOM 0 HA PRO A 135 -1.800 -13.908 0.342 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -0.712 -15.898 1.721 1.00 0.00 H new ATOM 0 HB3 PRO A 135 0.296 -15.141 0.503 1.00 0.00 H new ATOM 0 HG2 PRO A 135 0.287 -14.629 3.520 1.00 0.00 H new ATOM 0 HG3 PRO A 135 1.668 -14.919 2.481 1.00 0.00 H new ATOM 0 HD2 PRO A 135 0.810 -12.354 3.146 1.00 0.00 H new ATOM 0 HD3 PRO A 135 1.688 -12.701 1.670 1.00 0.00 H new ATOM 859 N ARG A 136 -3.314 -12.935 2.014 1.00 0.00 N ATOM 860 CA ARG A 136 -4.476 -12.516 2.834 1.00 0.00 C ATOM 861 C ARG A 136 -5.304 -11.488 2.042 1.00 0.00 C ATOM 862 O ARG A 136 -6.541 -11.478 2.074 1.00 0.00 O ATOM 863 CB ARG A 136 -3.942 -11.847 4.114 1.00 0.00 C ATOM 864 CG ARG A 136 -5.047 -11.296 5.019 1.00 0.00 C ATOM 865 CD ARG A 136 -4.504 -10.165 5.887 1.00 0.00 C ATOM 866 NE ARG A 136 -5.650 -9.487 6.521 1.00 0.00 N ATOM 867 CZ ARG A 136 -6.000 -8.211 6.334 1.00 0.00 C ATOM 868 NH1 ARG A 136 -5.242 -7.341 5.669 1.00 0.00 N ATOM 869 NH2 ARG A 136 -7.122 -7.740 6.854 1.00 0.00 N ATOM 0 H ARG A 136 -3.269 -12.417 1.137 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.098 -13.376 3.082 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -3.351 -12.572 4.674 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -3.270 -11.034 3.837 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -5.876 -10.932 4.412 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -5.440 -12.092 5.651 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -3.827 -10.558 6.645 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -3.932 -9.461 5.282 1.00 0.00 H new ATOM 0 HE ARG A 136 -6.225 -10.040 7.157 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -4.349 -7.639 5.275 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -5.554 -6.377 5.553 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -7.726 -8.352 7.402 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -7.382 -6.765 6.707 1.00 0.00 H new ATOM 870 N THR A 137 -4.575 -10.664 1.311 1.00 0.00 N ATOM 871 CA THR A 137 -5.071 -9.468 0.617 1.00 0.00 C ATOM 872 C THR A 137 -5.239 -9.664 -0.882 1.00 0.00 C ATOM 873 O THR A 137 -4.342 -9.408 -1.699 1.00 0.00 O ATOM 874 CB THR A 137 -4.097 -8.334 0.950 1.00 0.00 C ATOM 875 OG1 THR A 137 -2.752 -8.849 1.011 1.00 0.00 O ATOM 876 CG2 THR A 137 -4.551 -7.658 2.243 1.00 0.00 C ATOM 0 H THR A 137 -3.575 -10.808 1.173 1.00 0.00 H new ATOM 0 HA THR A 137 -6.078 -9.232 0.962 1.00 0.00 H new ATOM 0 HB THR A 137 -4.097 -7.572 0.170 1.00 0.00 H new ATOM 0 HG1 THR A 137 -2.171 -8.316 0.429 1.00 0.00 H new ATOM 0 HG21 THR A 137 -3.865 -6.848 2.491 1.00 0.00 H new ATOM 0 HG22 THR A 137 -5.555 -7.255 2.110 1.00 0.00 H new ATOM 0 HG23 THR A 137 -4.558 -8.388 3.052 1.00 0.00 H new ATOM 877 N HIS A 138 -6.394 -10.259 -1.157 1.00 0.00 N ATOM 878 CA HIS A 138 -6.872 -10.533 -2.525 1.00 0.00 C ATOM 879 C HIS A 138 -8.221 -9.877 -2.815 1.00 0.00 C ATOM 880 O HIS A 138 -8.955 -9.491 -1.908 1.00 0.00 O ATOM 881 CB HIS A 138 -6.928 -12.047 -2.770 1.00 0.00 C ATOM 882 CG HIS A 138 -7.895 -12.777 -1.820 1.00 0.00 C ATOM 883 ND1 HIS A 138 -9.219 -12.661 -1.786 1.00 0.00 N ATOM 884 CD2 HIS A 138 -7.530 -13.634 -0.876 1.00 0.00 C ATOM 885 CE1 HIS A 138 -9.680 -13.437 -0.810 1.00 0.00 C ATOM 886 NE2 HIS A 138 -8.632 -14.049 -0.261 1.00 0.00 N ATOM 0 H HIS A 138 -7.040 -10.572 -0.433 1.00 0.00 H new ATOM 0 HA HIS A 138 -6.158 -10.088 -3.218 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -7.232 -12.231 -3.800 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -5.928 -12.465 -2.653 1.00 0.00 H new ATOM 0 HD1 HIS A 138 -9.784 -12.077 -2.403 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -6.519 -13.939 -0.648 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -10.713 -13.550 -0.517 1.00 0.00 H new ATOM 887 N TYR A 139 -8.465 -9.673 -4.109 1.00 0.00 N ATOM 888 CA TYR A 139 -9.761 -9.211 -4.647 1.00 0.00 C ATOM 889 C TYR A 139 -10.971 -9.881 -3.973 1.00 0.00 C ATOM 890 O TYR A 139 -11.045 -11.095 -3.850 1.00 0.00 O ATOM 891 CB TYR A 139 -9.839 -9.361 -6.172 1.00 0.00 C ATOM 892 CG TYR A 139 -10.026 -8.006 -6.881 1.00 0.00 C ATOM 893 CD1 TYR A 139 -10.852 -6.997 -6.317 1.00 0.00 C ATOM 894 CD2 TYR A 139 -9.296 -7.775 -8.063 1.00 0.00 C ATOM 895 CE1 TYR A 139 -10.896 -5.726 -6.935 1.00 0.00 C ATOM 896 CE2 TYR A 139 -9.347 -6.512 -8.671 1.00 0.00 C ATOM 897 CZ TYR A 139 -10.129 -5.491 -8.098 1.00 0.00 C ATOM 898 OH TYR A 139 -9.984 -4.210 -8.529 1.00 0.00 O ATOM 0 H TYR A 139 -7.761 -9.824 -4.832 1.00 0.00 H new ATOM 0 HA TYR A 139 -9.811 -8.149 -4.406 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -8.928 -9.837 -6.536 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -10.668 -10.021 -6.429 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -11.436 -7.197 -5.431 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -8.701 -8.565 -8.498 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -11.511 -4.941 -6.521 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -8.788 -6.323 -9.576 1.00 0.00 H new ATOM 0 HH TYR A 139 -9.431 -4.198 -9.338 1.00 0.00 H new ATOM 899 N GLY A 140 -11.640 -9.000 -3.249 1.00 0.00 N ATOM 900 CA GLY A 140 -12.747 -9.341 -2.340 1.00 0.00 C ATOM 901 C GLY A 140 -12.569 -8.601 -1.012 1.00 0.00 C ATOM 902 O GLY A 140 -13.499 -7.971 -0.522 1.00 0.00 O ATOM 0 H GLY A 140 -11.432 -8.002 -3.270 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -13.700 -9.070 -2.794 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -12.771 -10.417 -2.168 1.00 0.00 H new ATOM 903 N GLN A 141 -11.329 -8.596 -0.502 1.00 0.00 N ATOM 904 CA GLN A 141 -10.977 -7.785 0.671 1.00 0.00 C ATOM 905 C GLN A 141 -11.087 -6.308 0.373 1.00 0.00 C ATOM 906 O GLN A 141 -10.498 -5.736 -0.541 1.00 0.00 O ATOM 907 CB GLN A 141 -9.532 -8.020 1.106 1.00 0.00 C ATOM 908 CG GLN A 141 -9.352 -9.334 1.864 1.00 0.00 C ATOM 909 CD GLN A 141 -9.019 -9.055 3.337 1.00 0.00 C ATOM 910 OE1 GLN A 141 -9.652 -8.261 4.032 1.00 0.00 O ATOM 911 NE2 GLN A 141 -7.978 -9.686 3.806 1.00 0.00 N ATOM 0 H GLN A 141 -10.556 -9.142 -0.882 1.00 0.00 H new ATOM 0 HA GLN A 141 -11.674 -8.084 1.454 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -8.888 -8.021 0.227 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -9.208 -7.193 1.738 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -10.263 -9.929 1.796 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -8.554 -9.919 1.408 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -7.468 -10.340 3.212 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -7.674 -9.525 4.766 1.00 0.00 H new ATOM 912 N LYS A 142 -11.907 -5.745 1.218 1.00 0.00 N ATOM 913 CA LYS A 142 -12.042 -4.289 1.439 1.00 0.00 C ATOM 914 C LYS A 142 -10.698 -3.634 1.828 1.00 0.00 C ATOM 915 O LYS A 142 -10.423 -2.487 1.476 1.00 0.00 O ATOM 916 CB LYS A 142 -13.084 -4.122 2.536 1.00 0.00 C ATOM 917 CG LYS A 142 -14.374 -4.828 2.113 1.00 0.00 C ATOM 918 CD LYS A 142 -15.597 -4.369 2.909 1.00 0.00 C ATOM 919 CE LYS A 142 -15.925 -2.894 2.635 1.00 0.00 C ATOM 920 NZ LYS A 142 -16.142 -2.705 1.198 1.00 0.00 N ATOM 0 H LYS A 142 -12.536 -6.291 1.807 1.00 0.00 H new ATOM 0 HA LYS A 142 -12.350 -3.787 0.522 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -12.715 -4.542 3.472 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -13.276 -3.064 2.715 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -14.549 -4.647 1.052 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -14.250 -5.904 2.237 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -16.455 -4.988 2.649 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -15.413 -4.510 3.974 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -16.815 -2.598 3.191 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -15.109 -2.258 2.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -16.927 -2.039 1.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -15.278 -2.323 0.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -16.376 -3.618 0.759 1.00 0.00 H new ATOM 921 N ALA A 143 -9.835 -4.478 2.394 1.00 0.00 N ATOM 922 CA ALA A 143 -8.441 -4.177 2.751 1.00 0.00 C ATOM 923 C ALA A 143 -7.546 -3.669 1.605 1.00 0.00 C ATOM 924 O ALA A 143 -6.685 -2.831 1.842 1.00 0.00 O ATOM 925 CB ALA A 143 -7.814 -5.405 3.426 1.00 0.00 C ATOM 0 H ALA A 143 -10.097 -5.435 2.628 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.493 -3.331 3.437 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -6.780 -5.186 3.692 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.376 -5.652 4.327 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -7.840 -6.251 2.739 1.00 0.00 H new ATOM 926 N ILE A 144 -7.843 -4.114 0.380 1.00 0.00 N ATOM 927 CA ILE A 144 -7.027 -3.807 -0.810 1.00 0.00 C ATOM 928 C ILE A 144 -7.418 -2.569 -1.647 1.00 0.00 C ATOM 929 O ILE A 144 -6.706 -2.232 -2.588 1.00 0.00 O ATOM 930 CB ILE A 144 -6.882 -5.036 -1.735 1.00 0.00 C ATOM 931 CG1 ILE A 144 -8.193 -5.465 -2.376 1.00 0.00 C ATOM 932 CG2 ILE A 144 -6.134 -6.132 -0.966 1.00 0.00 C ATOM 933 CD1 ILE A 144 -7.960 -6.387 -3.567 1.00 0.00 C ATOM 0 H ILE A 144 -8.655 -4.698 0.180 1.00 0.00 H new ATOM 0 HA ILE A 144 -6.071 -3.536 -0.362 1.00 0.00 H new ATOM 0 HB ILE A 144 -6.281 -4.778 -2.607 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -8.811 -5.974 -1.636 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -8.746 -4.583 -2.700 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -6.021 -7.010 -1.602 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -5.150 -5.765 -0.675 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -6.699 -6.401 -0.074 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -8.919 -6.673 -3.999 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -7.364 -5.868 -4.318 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -7.430 -7.281 -3.237 1.00 0.00 H new ATOM 934 N LEU A 145 -8.509 -1.882 -1.312 1.00 0.00 N ATOM 935 CA LEU A 145 -8.993 -0.760 -2.140 1.00 0.00 C ATOM 936 C LEU A 145 -8.829 0.647 -1.548 1.00 0.00 C ATOM 937 O LEU A 145 -9.599 1.110 -0.700 1.00 0.00 O ATOM 938 CB LEU A 145 -10.385 -0.973 -2.753 1.00 0.00 C ATOM 939 CG LEU A 145 -11.425 -1.548 -1.787 1.00 0.00 C ATOM 940 CD1 LEU A 145 -12.799 -0.929 -2.041 1.00 0.00 C ATOM 941 CD2 LEU A 145 -11.480 -3.072 -1.929 1.00 0.00 C ATOM 0 H LEU A 145 -9.074 -2.073 -0.485 1.00 0.00 H new ATOM 0 HA LEU A 145 -8.282 -0.787 -2.966 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -10.750 -0.019 -3.134 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -10.293 -1.643 -3.608 1.00 0.00 H new ATOM 0 HG LEU A 145 -11.131 -1.302 -0.767 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -13.523 -1.351 -1.344 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -12.744 0.150 -1.897 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -13.111 -1.144 -3.063 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -12.222 -3.475 -1.239 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -11.755 -3.332 -2.951 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -10.502 -3.494 -1.698 1.00 0.00 H new ATOM 942 N PHE A 146 -7.742 1.258 -1.985 1.00 0.00 N ATOM 943 CA PHE A 146 -7.242 2.576 -1.517 1.00 0.00 C ATOM 944 C PHE A 146 -7.693 3.784 -2.336 1.00 0.00 C ATOM 945 O PHE A 146 -8.239 3.646 -3.425 1.00 0.00 O ATOM 946 CB PHE A 146 -5.713 2.547 -1.522 1.00 0.00 C ATOM 947 CG PHE A 146 -5.150 1.443 -0.621 1.00 0.00 C ATOM 948 CD1 PHE A 146 -5.073 0.127 -1.121 1.00 0.00 C ATOM 949 CD2 PHE A 146 -4.849 1.736 0.722 1.00 0.00 C ATOM 950 CE1 PHE A 146 -4.747 -0.937 -0.256 1.00 0.00 C ATOM 951 CE2 PHE A 146 -4.510 0.670 1.583 1.00 0.00 C ATOM 952 CZ PHE A 146 -4.466 -0.650 1.100 1.00 0.00 C ATOM 0 H PHE A 146 -7.147 0.848 -2.705 1.00 0.00 H new ATOM 0 HA PHE A 146 -7.670 2.710 -0.523 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -5.358 2.397 -2.542 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -5.332 3.513 -1.190 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -5.264 -0.066 -2.166 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -4.877 2.753 1.085 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -4.712 -1.953 -0.622 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -4.283 0.870 2.620 1.00 0.00 H new ATOM 0 HZ PHE A 146 -4.214 -1.456 1.774 1.00 0.00 H new ATOM 953 N LEU A 147 -7.486 4.970 -1.768 1.00 0.00 N ATOM 954 CA LEU A 147 -7.694 6.228 -2.513 1.00 0.00 C ATOM 955 C LEU A 147 -6.400 6.998 -2.815 1.00 0.00 C ATOM 956 O LEU A 147 -5.650 7.353 -1.913 1.00 0.00 O ATOM 957 CB LEU A 147 -8.670 7.142 -1.780 1.00 0.00 C ATOM 958 CG LEU A 147 -10.043 6.484 -1.834 1.00 0.00 C ATOM 959 CD1 LEU A 147 -10.653 6.579 -0.453 1.00 0.00 C ATOM 960 CD2 LEU A 147 -10.932 7.074 -2.931 1.00 0.00 C ATOM 0 H LEU A 147 -7.177 5.095 -0.804 1.00 0.00 H new ATOM 0 HA LEU A 147 -8.112 5.925 -3.473 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -8.356 7.289 -0.747 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -8.698 8.126 -2.247 1.00 0.00 H new ATOM 0 HG LEU A 147 -9.944 5.434 -2.110 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -11.640 6.115 -0.458 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -10.014 6.063 0.263 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -10.746 7.627 -0.168 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -11.898 6.570 -2.926 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -11.077 8.139 -2.748 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -10.454 6.934 -3.901 1.00 0.00 H new ATOM 961 N PRO A 148 -6.125 7.154 -4.110 1.00 0.00 N ATOM 962 CA PRO A 148 -5.220 8.202 -4.626 1.00 0.00 C ATOM 963 C PRO A 148 -5.820 9.596 -4.412 1.00 0.00 C ATOM 964 O PRO A 148 -5.094 10.549 -4.143 1.00 0.00 O ATOM 965 CB PRO A 148 -5.081 7.893 -6.115 1.00 0.00 C ATOM 966 CG PRO A 148 -5.260 6.371 -6.152 1.00 0.00 C ATOM 967 CD PRO A 148 -6.390 6.147 -5.141 1.00 0.00 C ATOM 0 HA PRO A 148 -4.258 8.204 -4.114 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -5.838 8.406 -6.709 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -4.110 8.198 -6.504 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -5.530 6.018 -7.147 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -4.348 5.848 -5.864 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -7.371 6.286 -5.596 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -6.369 5.137 -4.732 1.00 0.00 H new