USER MOD reduce.3.24.130724 H: found=0, std=0, add=1410, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1410 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 74 MET CE :methyl -176:sc= -0.0177 (180deg=-0.0261) USER MOD Set 1.2: B 74 MET CE :methyl 179:sc= -0.02 (180deg=-0.0137) USER MOD Set 2.1: B 33 LYS NZ :NH3+ -129:sc= -2.26 (180deg=-4.36!) USER MOD Set 2.2: B 50 GLN : amide:sc= -2.42 K(o=-4.7,f=-3.1) USER MOD Set 3.1: B 25 HIS : no HE2:sc= -3.59! C(o=-6.6!,f=-16!) USER MOD Set 3.2: B 26 LYS NZ :NH3+ 177:sc= -3.06! (180deg=0) USER MOD Set 4.1: A 33 LYS NZ :NH3+ -127:sc= -2.37 (180deg=-4.31!) USER MOD Set 4.2: A 50 GLN : amide:sc= -2.34 K(o=-4.7,f=-3.5) USER MOD Set 5.1: A 25 HIS : no HE2:sc= -4.34! C(o=-7.5!,f=-17!) USER MOD Set 5.2: A 26 LYS NZ :NH3+ 172:sc= -3.14! (180deg=0) USER MOD Single : A 1 SER N :NH3+ -110:sc= 0.072 (180deg=-0.249) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0448 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 MET CE :methyl 153:sc= -0.411 (180deg=-1.48) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 16 GLN : amide:sc= -1.81 K(o=-1.8,f=-3.3!) USER MOD Single : A 17 TYR OH : rot 176:sc= 0.157 USER MOD Single : A 18 SER OG : rot -62:sc= 0.714 USER MOD Single : A 24 LYS NZ :NH3+ -159:sc= -0.363 (180deg=-0.824) USER MOD Single : A 28 LYS NZ :NH3+ 166:sc= -0.022 (180deg=-0.274) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= -0.0572 USER MOD Single : A 37 ASN : amide:sc= -0.0313 K(o=-0.031,f=-1.7!) USER MOD Single : A 38 ASN : amide:sc= -0.882 K(o=-0.88,f=-3.1!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= -0.509 K(o=-0.51,f=-1) USER MOD Single : A 48 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.138) USER MOD Single : A 55 LYS NZ :NH3+ -158:sc= -0.901 (180deg=-1.44) USER MOD Single : A 57 MET CE :methyl -139:sc= 0 (180deg=-0.155) USER MOD Single : A 59 THR OG1 : rot 79:sc= 0.546 USER MOD Single : A 68 CYS SG : rot 170:sc= -1.8 USER MOD Single : A 71 GLN : amide:sc= -3! C(o=-3!,f=-3.4!) USER MOD Single : A 78 SER OG : rot -38:sc= -0.779 USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot -18:sc= 0.602 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0.01 USER MOD Single : A 84 CYS SG : rot -157:sc= 0.11 USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 HIS : no HD1:sc= -0.238 K(o=-0.24,f=-1) USER MOD Single : B 1 SER N :NH3+ -115:sc= 0.0769 (180deg=-0.3) USER MOD Single : B 1 SER OG : rot 180:sc= 0.127 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 MET CE :methyl 151:sc= -0.317 (180deg=-1.39) USER MOD Single : B 15 HIS : no HD1:sc= 0 X(o=0,f=-0.018) USER MOD Single : B 16 GLN : amide:sc= -1.91 K(o=-1.9,f=-3.4!) USER MOD Single : B 17 TYR OH : rot -5:sc= 0.189 USER MOD Single : B 18 SER OG : rot -69:sc= 0.942 USER MOD Single : B 24 LYS NZ :NH3+ -158:sc= -0.407 (180deg=-1.07) USER MOD Single : B 28 LYS NZ :NH3+ 166:sc= -0.0196 (180deg=-0.278) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 180:sc= -0.0915 USER MOD Single : B 37 ASN : amide:sc= -0.0268 K(o=-0.027,f=-1.8!) USER MOD Single : B 38 ASN : amide:sc= -0.907 K(o=-0.91,f=-3.4!) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= -0.533 K(o=-0.53,f=-1) USER MOD Single : B 48 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.251) USER MOD Single : B 55 LYS NZ :NH3+ -156:sc= -1.16 (180deg=-1.83) USER MOD Single : B 57 MET CE :methyl 163:sc= 0 (180deg=-0.0906) USER MOD Single : B 59 THR OG1 : rot 79:sc= 0.52 USER MOD Single : B 68 CYS SG : rot 180:sc= -1.98 USER MOD Single : B 71 GLN : amide:sc= -3.26! C(o=-3.3!,f=-3.3!) USER MOD Single : B 78 SER OG : rot -36:sc= -0.752 USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 81 THR OG1 : rot -17:sc= 0.255 USER MOD Single : B 82 THR OG1 : rot 180:sc= 0.0106 USER MOD Single : B 84 CYS SG : rot -160:sc= 0.182 USER MOD Single : B 85 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 90 HIS : no HD1:sc= -0.263 K(o=-0.26,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 67.367 12.508 -9.614 1.00 0.00 N ATOM 2 CA SER A 1 68.177 11.588 -10.462 1.00 0.00 C ATOM 3 C SER A 1 67.660 10.157 -10.301 1.00 0.00 C ATOM 4 O SER A 1 67.050 9.816 -9.308 1.00 0.00 O ATOM 5 CB SER A 1 69.641 11.652 -10.024 1.00 0.00 C ATOM 6 OG SER A 1 69.792 10.954 -8.795 1.00 0.00 O ATOM 0 H1 SER A 1 66.779 13.114 -10.222 1.00 0.00 H new ATOM 0 H2 SER A 1 66.754 11.951 -8.985 1.00 0.00 H new ATOM 0 H3 SER A 1 68.001 13.102 -9.043 1.00 0.00 H new ATOM 0 HA SER A 1 68.095 11.888 -11.507 1.00 0.00 H new ATOM 0 HB2 SER A 1 70.281 11.211 -10.788 1.00 0.00 H new ATOM 0 HB3 SER A 1 69.953 12.690 -9.907 1.00 0.00 H new ATOM 0 HG SER A 1 70.729 10.991 -8.511 1.00 0.00 H new ATOM 14 N GLU A 2 67.881 9.323 -11.281 1.00 0.00 N ATOM 15 CA GLU A 2 67.386 7.918 -11.204 1.00 0.00 C ATOM 16 C GLU A 2 67.995 7.207 -9.995 1.00 0.00 C ATOM 17 O GLU A 2 67.330 6.449 -9.317 1.00 0.00 O ATOM 18 CB GLU A 2 67.789 7.169 -12.478 1.00 0.00 C ATOM 19 CG GLU A 2 67.011 7.725 -13.676 1.00 0.00 C ATOM 20 CD GLU A 2 67.603 9.075 -14.095 1.00 0.00 C ATOM 21 OE1 GLU A 2 68.660 9.420 -13.594 1.00 0.00 O ATOM 22 OE2 GLU A 2 66.987 9.740 -14.912 1.00 0.00 O ATOM 0 H GLU A 2 68.386 9.556 -12.136 1.00 0.00 H new ATOM 0 HA GLU A 2 66.301 7.931 -11.103 1.00 0.00 H new ATOM 0 HB2 GLU A 2 68.860 7.273 -12.649 1.00 0.00 H new ATOM 0 HB3 GLU A 2 67.587 6.104 -12.364 1.00 0.00 H new ATOM 0 HG2 GLU A 2 67.056 7.023 -14.509 1.00 0.00 H new ATOM 0 HG3 GLU A 2 65.959 7.843 -13.416 1.00 0.00 H new ATOM 29 N LEU A 3 69.247 7.441 -9.706 1.00 0.00 N ATOM 30 CA LEU A 3 69.878 6.778 -8.532 1.00 0.00 C ATOM 31 C LEU A 3 69.304 7.375 -7.239 1.00 0.00 C ATOM 32 O LEU A 3 69.112 6.692 -6.254 1.00 0.00 O ATOM 33 CB LEU A 3 71.400 7.017 -8.596 1.00 0.00 C ATOM 34 CG LEU A 3 72.166 5.866 -7.925 1.00 0.00 C ATOM 35 CD1 LEU A 3 73.657 6.213 -7.889 1.00 0.00 C ATOM 36 CD2 LEU A 3 71.656 5.649 -6.494 1.00 0.00 C ATOM 0 H LEU A 3 69.859 8.063 -10.234 1.00 0.00 H new ATOM 0 HA LEU A 3 69.673 5.708 -8.545 1.00 0.00 H new ATOM 0 HB2 LEU A 3 71.714 7.110 -9.636 1.00 0.00 H new ATOM 0 HB3 LEU A 3 71.645 7.958 -8.103 1.00 0.00 H new ATOM 0 HG LEU A 3 72.009 4.950 -8.495 1.00 0.00 H new ATOM 0 HD11 LEU A 3 74.208 5.401 -7.414 1.00 0.00 H new ATOM 0 HD12 LEU A 3 74.023 6.353 -8.906 1.00 0.00 H new ATOM 0 HD13 LEU A 3 73.803 7.132 -7.321 1.00 0.00 H new ATOM 0 HD21 LEU A 3 72.208 4.831 -6.031 1.00 0.00 H new ATOM 0 HD22 LEU A 3 71.803 6.560 -5.913 1.00 0.00 H new ATOM 0 HD23 LEU A 3 70.595 5.402 -6.520 1.00 0.00 H new ATOM 48 N GLU A 4 69.029 8.653 -7.237 1.00 0.00 N ATOM 49 CA GLU A 4 68.476 9.298 -6.014 1.00 0.00 C ATOM 50 C GLU A 4 67.047 8.815 -5.761 1.00 0.00 C ATOM 51 O GLU A 4 66.655 8.582 -4.634 1.00 0.00 O ATOM 52 CB GLU A 4 68.483 10.818 -6.191 1.00 0.00 C ATOM 53 CG GLU A 4 67.986 11.493 -4.910 1.00 0.00 C ATOM 54 CD GLU A 4 68.036 13.010 -5.086 1.00 0.00 C ATOM 55 OE1 GLU A 4 68.606 13.453 -6.070 1.00 0.00 O ATOM 56 OE2 GLU A 4 67.503 13.704 -4.236 1.00 0.00 O ATOM 0 H GLU A 4 69.164 9.277 -8.032 1.00 0.00 H new ATOM 0 HA GLU A 4 69.095 9.027 -5.159 1.00 0.00 H new ATOM 0 HB2 GLU A 4 69.491 11.161 -6.426 1.00 0.00 H new ATOM 0 HB3 GLU A 4 67.847 11.098 -7.031 1.00 0.00 H new ATOM 0 HG2 GLU A 4 66.967 11.174 -4.689 1.00 0.00 H new ATOM 0 HG3 GLU A 4 68.604 11.193 -4.064 1.00 0.00 H new ATOM 63 N LYS A 5 66.260 8.670 -6.789 1.00 0.00 N ATOM 64 CA LYS A 5 64.855 8.209 -6.592 1.00 0.00 C ATOM 65 C LYS A 5 64.865 6.833 -5.931 1.00 0.00 C ATOM 66 O LYS A 5 64.065 6.544 -5.063 1.00 0.00 O ATOM 67 CB LYS A 5 64.133 8.137 -7.943 1.00 0.00 C ATOM 68 CG LYS A 5 62.671 7.738 -7.723 1.00 0.00 C ATOM 69 CD LYS A 5 61.943 7.665 -9.069 1.00 0.00 C ATOM 70 CE LYS A 5 60.487 7.252 -8.835 1.00 0.00 C ATOM 71 NZ LYS A 5 59.730 7.343 -10.115 1.00 0.00 N ATOM 0 H LYS A 5 66.527 8.850 -7.757 1.00 0.00 H new ATOM 0 HA LYS A 5 64.327 8.915 -5.951 1.00 0.00 H new ATOM 0 HB2 LYS A 5 64.185 9.102 -8.447 1.00 0.00 H new ATOM 0 HB3 LYS A 5 64.625 7.412 -8.592 1.00 0.00 H new ATOM 0 HG2 LYS A 5 62.620 6.773 -7.219 1.00 0.00 H new ATOM 0 HG3 LYS A 5 62.181 8.463 -7.073 1.00 0.00 H new ATOM 0 HD2 LYS A 5 61.983 8.632 -9.570 1.00 0.00 H new ATOM 0 HD3 LYS A 5 62.436 6.947 -9.724 1.00 0.00 H new ATOM 0 HE2 LYS A 5 60.445 6.234 -8.447 1.00 0.00 H new ATOM 0 HE3 LYS A 5 60.031 7.898 -8.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 58.742 7.062 -9.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 59.759 8.321 -10.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 60.160 6.709 -10.818 1.00 0.00 H new ATOM 85 N ALA A 6 65.767 5.984 -6.329 1.00 0.00 N ATOM 86 CA ALA A 6 65.827 4.630 -5.716 1.00 0.00 C ATOM 87 C ALA A 6 66.077 4.790 -4.212 1.00 0.00 C ATOM 88 O ALA A 6 65.413 4.184 -3.393 1.00 0.00 O ATOM 89 CB ALA A 6 66.974 3.835 -6.364 1.00 0.00 C ATOM 0 H ALA A 6 66.464 6.168 -7.051 1.00 0.00 H new ATOM 0 HA ALA A 6 64.892 4.094 -5.875 1.00 0.00 H new ATOM 0 HB1 ALA A 6 67.024 2.841 -5.920 1.00 0.00 H new ATOM 0 HB2 ALA A 6 66.794 3.745 -7.435 1.00 0.00 H new ATOM 0 HB3 ALA A 6 67.917 4.355 -6.197 1.00 0.00 H new ATOM 95 N MET A 7 67.020 5.614 -3.847 1.00 0.00 N ATOM 96 CA MET A 7 67.306 5.831 -2.402 1.00 0.00 C ATOM 97 C MET A 7 66.065 6.414 -1.715 1.00 0.00 C ATOM 98 O MET A 7 65.622 5.929 -0.692 1.00 0.00 O ATOM 99 CB MET A 7 68.477 6.805 -2.286 1.00 0.00 C ATOM 100 CG MET A 7 68.665 7.234 -0.831 1.00 0.00 C ATOM 101 SD MET A 7 70.249 8.096 -0.658 1.00 0.00 S ATOM 102 CE MET A 7 69.964 9.371 -1.911 1.00 0.00 C ATOM 0 H MET A 7 67.606 6.147 -4.489 1.00 0.00 H new ATOM 0 HA MET A 7 67.560 4.888 -1.919 1.00 0.00 H new ATOM 0 HB2 MET A 7 69.389 6.335 -2.655 1.00 0.00 H new ATOM 0 HB3 MET A 7 68.295 7.680 -2.910 1.00 0.00 H new ATOM 0 HG2 MET A 7 67.848 7.887 -0.524 1.00 0.00 H new ATOM 0 HG3 MET A 7 68.639 6.362 -0.177 1.00 0.00 H new ATOM 0 HE1 MET A 7 70.547 10.259 -1.666 1.00 0.00 H new ATOM 0 HE2 MET A 7 70.269 8.996 -2.888 1.00 0.00 H new ATOM 0 HE3 MET A 7 68.905 9.627 -1.935 1.00 0.00 H new ATOM 112 N VAL A 8 65.505 7.456 -2.269 1.00 0.00 N ATOM 113 CA VAL A 8 64.297 8.077 -1.653 1.00 0.00 C ATOM 114 C VAL A 8 63.172 7.038 -1.594 1.00 0.00 C ATOM 115 O VAL A 8 62.437 6.955 -0.631 1.00 0.00 O ATOM 116 CB VAL A 8 63.859 9.276 -2.506 1.00 0.00 C ATOM 117 CG1 VAL A 8 62.489 9.778 -2.043 1.00 0.00 C ATOM 118 CG2 VAL A 8 64.885 10.403 -2.362 1.00 0.00 C ATOM 0 H VAL A 8 65.833 7.905 -3.124 1.00 0.00 H new ATOM 0 HA VAL A 8 64.524 8.417 -0.643 1.00 0.00 H new ATOM 0 HB VAL A 8 63.793 8.966 -3.549 1.00 0.00 H new ATOM 0 HG11 VAL A 8 62.187 10.629 -2.654 1.00 0.00 H new ATOM 0 HG12 VAL A 8 61.755 8.979 -2.146 1.00 0.00 H new ATOM 0 HG13 VAL A 8 62.548 10.085 -0.999 1.00 0.00 H new ATOM 0 HG21 VAL A 8 64.576 11.256 -2.967 1.00 0.00 H new ATOM 0 HG22 VAL A 8 64.950 10.704 -1.317 1.00 0.00 H new ATOM 0 HG23 VAL A 8 65.860 10.053 -2.700 1.00 0.00 H new ATOM 128 N ALA A 9 63.033 6.249 -2.621 1.00 0.00 N ATOM 129 CA ALA A 9 61.956 5.217 -2.630 1.00 0.00 C ATOM 130 C ALA A 9 62.152 4.257 -1.455 1.00 0.00 C ATOM 131 O ALA A 9 61.207 3.846 -0.813 1.00 0.00 O ATOM 132 CB ALA A 9 62.021 4.433 -3.946 1.00 0.00 C ATOM 0 H ALA A 9 63.618 6.273 -3.456 1.00 0.00 H new ATOM 0 HA ALA A 9 60.985 5.703 -2.538 1.00 0.00 H new ATOM 0 HB1 ALA A 9 61.236 3.677 -3.958 1.00 0.00 H new ATOM 0 HB2 ALA A 9 61.880 5.116 -4.784 1.00 0.00 H new ATOM 0 HB3 ALA A 9 62.993 3.948 -4.033 1.00 0.00 H new ATOM 138 N LEU A 10 63.369 3.880 -1.186 1.00 0.00 N ATOM 139 CA LEU A 10 63.628 2.926 -0.071 1.00 0.00 C ATOM 140 C LEU A 10 63.157 3.527 1.260 1.00 0.00 C ATOM 141 O LEU A 10 62.533 2.864 2.065 1.00 0.00 O ATOM 142 CB LEU A 10 65.136 2.632 -0.017 1.00 0.00 C ATOM 143 CG LEU A 10 65.421 1.319 0.747 1.00 0.00 C ATOM 144 CD1 LEU A 10 66.781 0.763 0.315 1.00 0.00 C ATOM 145 CD2 LEU A 10 65.452 1.566 2.263 1.00 0.00 C ATOM 0 H LEU A 10 64.199 4.192 -1.691 1.00 0.00 H new ATOM 0 HA LEU A 10 63.077 2.001 -0.241 1.00 0.00 H new ATOM 0 HB2 LEU A 10 65.532 2.560 -1.030 1.00 0.00 H new ATOM 0 HB3 LEU A 10 65.653 3.459 0.469 1.00 0.00 H new ATOM 0 HG LEU A 10 64.627 0.609 0.516 1.00 0.00 H new ATOM 0 HD11 LEU A 10 66.983 -0.163 0.853 1.00 0.00 H new ATOM 0 HD12 LEU A 10 66.769 0.565 -0.757 1.00 0.00 H new ATOM 0 HD13 LEU A 10 67.560 1.491 0.541 1.00 0.00 H new ATOM 0 HD21 LEU A 10 65.654 0.628 2.780 1.00 0.00 H new ATOM 0 HD22 LEU A 10 66.235 2.286 2.498 1.00 0.00 H new ATOM 0 HD23 LEU A 10 64.488 1.959 2.587 1.00 0.00 H new ATOM 157 N ILE A 11 63.440 4.779 1.497 1.00 0.00 N ATOM 158 CA ILE A 11 63.002 5.404 2.778 1.00 0.00 C ATOM 159 C ILE A 11 61.479 5.335 2.873 1.00 0.00 C ATOM 160 O ILE A 11 60.926 4.922 3.873 1.00 0.00 O ATOM 161 CB ILE A 11 63.451 6.866 2.814 1.00 0.00 C ATOM 162 CG1 ILE A 11 64.981 6.927 2.856 1.00 0.00 C ATOM 163 CG2 ILE A 11 62.881 7.545 4.061 1.00 0.00 C ATOM 164 CD1 ILE A 11 65.449 8.366 2.621 1.00 0.00 C ATOM 0 H ILE A 11 63.952 5.393 0.864 1.00 0.00 H new ATOM 0 HA ILE A 11 63.447 4.870 3.618 1.00 0.00 H new ATOM 0 HB ILE A 11 63.089 7.379 1.923 1.00 0.00 H new ATOM 0 HG12 ILE A 11 65.342 6.570 3.821 1.00 0.00 H new ATOM 0 HG13 ILE A 11 65.401 6.269 2.095 1.00 0.00 H new ATOM 0 HG21 ILE A 11 63.201 8.587 4.087 1.00 0.00 H new ATOM 0 HG22 ILE A 11 61.792 7.500 4.034 1.00 0.00 H new ATOM 0 HG23 ILE A 11 63.243 7.032 4.952 1.00 0.00 H new ATOM 0 HD11 ILE A 11 66.538 8.404 2.652 1.00 0.00 H new ATOM 0 HD12 ILE A 11 65.101 8.707 1.646 1.00 0.00 H new ATOM 0 HD13 ILE A 11 65.041 9.013 3.398 1.00 0.00 H new ATOM 176 N ASP A 12 60.796 5.751 1.846 1.00 0.00 N ATOM 177 CA ASP A 12 59.310 5.722 1.889 1.00 0.00 C ATOM 178 C ASP A 12 58.854 4.279 2.097 1.00 0.00 C ATOM 179 O ASP A 12 57.930 4.010 2.839 1.00 0.00 O ATOM 180 CB ASP A 12 58.749 6.251 0.567 1.00 0.00 C ATOM 181 CG ASP A 12 57.219 6.245 0.617 1.00 0.00 C ATOM 182 OD1 ASP A 12 56.677 5.598 1.498 1.00 0.00 O ATOM 183 OD2 ASP A 12 56.618 6.891 -0.223 1.00 0.00 O ATOM 0 H ASP A 12 61.201 6.109 0.981 1.00 0.00 H new ATOM 0 HA ASP A 12 58.949 6.347 2.706 1.00 0.00 H new ATOM 0 HB2 ASP A 12 59.113 7.262 0.385 1.00 0.00 H new ATOM 0 HB3 ASP A 12 59.098 5.633 -0.260 1.00 0.00 H new ATOM 188 N VAL A 13 59.499 3.346 1.457 1.00 0.00 N ATOM 189 CA VAL A 13 59.101 1.923 1.633 1.00 0.00 C ATOM 190 C VAL A 13 59.419 1.484 3.069 1.00 0.00 C ATOM 191 O VAL A 13 58.661 0.767 3.692 1.00 0.00 O ATOM 192 CB VAL A 13 59.873 1.046 0.639 1.00 0.00 C ATOM 193 CG1 VAL A 13 59.640 -0.438 0.964 1.00 0.00 C ATOM 194 CG2 VAL A 13 59.393 1.345 -0.787 1.00 0.00 C ATOM 0 H VAL A 13 60.281 3.506 0.822 1.00 0.00 H new ATOM 0 HA VAL A 13 58.032 1.815 1.448 1.00 0.00 H new ATOM 0 HB VAL A 13 60.938 1.265 0.716 1.00 0.00 H new ATOM 0 HG11 VAL A 13 60.190 -1.057 0.255 1.00 0.00 H new ATOM 0 HG12 VAL A 13 59.988 -0.648 1.975 1.00 0.00 H new ATOM 0 HG13 VAL A 13 58.576 -0.663 0.892 1.00 0.00 H new ATOM 0 HG21 VAL A 13 59.941 0.722 -1.494 1.00 0.00 H new ATOM 0 HG22 VAL A 13 58.327 1.130 -0.865 1.00 0.00 H new ATOM 0 HG23 VAL A 13 59.569 2.396 -1.017 1.00 0.00 H new ATOM 204 N PHE A 14 60.541 1.904 3.597 1.00 0.00 N ATOM 205 CA PHE A 14 60.913 1.507 4.990 1.00 0.00 C ATOM 206 C PHE A 14 59.902 2.063 5.995 1.00 0.00 C ATOM 207 O PHE A 14 59.373 1.342 6.818 1.00 0.00 O ATOM 208 CB PHE A 14 62.297 2.070 5.325 1.00 0.00 C ATOM 209 CG PHE A 14 62.674 1.698 6.744 1.00 0.00 C ATOM 210 CD1 PHE A 14 62.316 2.542 7.804 1.00 0.00 C ATOM 211 CD2 PHE A 14 63.389 0.522 6.999 1.00 0.00 C ATOM 212 CE1 PHE A 14 62.671 2.208 9.117 1.00 0.00 C ATOM 213 CE2 PHE A 14 63.743 0.188 8.314 1.00 0.00 C ATOM 214 CZ PHE A 14 63.385 1.031 9.373 1.00 0.00 C ATOM 0 H PHE A 14 61.216 2.505 3.124 1.00 0.00 H new ATOM 0 HA PHE A 14 60.919 0.419 5.051 1.00 0.00 H new ATOM 0 HB2 PHE A 14 63.037 1.678 4.628 1.00 0.00 H new ATOM 0 HB3 PHE A 14 62.296 3.154 5.212 1.00 0.00 H new ATOM 0 HD1 PHE A 14 61.766 3.451 7.608 1.00 0.00 H new ATOM 0 HD2 PHE A 14 63.668 -0.128 6.183 1.00 0.00 H new ATOM 0 HE1 PHE A 14 62.394 2.859 9.933 1.00 0.00 H new ATOM 0 HE2 PHE A 14 64.293 -0.721 8.510 1.00 0.00 H new ATOM 0 HZ PHE A 14 63.659 0.774 10.386 1.00 0.00 H new ATOM 224 N HIS A 15 59.676 3.350 5.979 1.00 0.00 N ATOM 225 CA HIS A 15 58.751 3.964 6.974 1.00 0.00 C ATOM 226 C HIS A 15 57.344 3.384 6.871 1.00 0.00 C ATOM 227 O HIS A 15 56.706 3.132 7.875 1.00 0.00 O ATOM 228 CB HIS A 15 58.683 5.471 6.723 1.00 0.00 C ATOM 229 CG HIS A 15 57.751 6.108 7.717 1.00 0.00 C ATOM 230 ND1 HIS A 15 57.945 6.008 9.087 1.00 0.00 N ATOM 231 CD2 HIS A 15 56.611 6.859 7.554 1.00 0.00 C ATOM 232 CE1 HIS A 15 56.946 6.681 9.690 1.00 0.00 C ATOM 233 NE2 HIS A 15 56.108 7.216 8.799 1.00 0.00 N ATOM 0 H HIS A 15 60.094 4.004 5.317 1.00 0.00 H new ATOM 0 HA HIS A 15 59.135 3.750 7.971 1.00 0.00 H new ATOM 0 HB2 HIS A 15 59.677 5.909 6.809 1.00 0.00 H new ATOM 0 HB3 HIS A 15 58.336 5.665 5.708 1.00 0.00 H new ATOM 0 HD2 HIS A 15 56.174 7.130 6.604 1.00 0.00 H new ATOM 0 HE1 HIS A 15 56.837 6.776 10.760 1.00 0.00 H new ATOM 0 HE2 HIS A 15 55.274 7.770 8.992 1.00 0.00 H new ATOM 242 N GLN A 16 56.834 3.164 5.694 1.00 0.00 N ATOM 243 CA GLN A 16 55.458 2.603 5.598 1.00 0.00 C ATOM 244 C GLN A 16 55.445 1.156 6.083 1.00 0.00 C ATOM 245 O GLN A 16 54.529 0.723 6.752 1.00 0.00 O ATOM 246 CB GLN A 16 54.998 2.656 4.142 1.00 0.00 C ATOM 247 CG GLN A 16 54.759 4.113 3.740 1.00 0.00 C ATOM 248 CD GLN A 16 54.488 4.196 2.237 1.00 0.00 C ATOM 249 OE1 GLN A 16 54.797 3.281 1.500 1.00 0.00 O ATOM 250 NE2 GLN A 16 53.926 5.267 1.748 1.00 0.00 N ATOM 0 H GLN A 16 57.301 3.345 4.805 1.00 0.00 H new ATOM 0 HA GLN A 16 54.785 3.191 6.223 1.00 0.00 H new ATOM 0 HB2 GLN A 16 55.751 2.207 3.494 1.00 0.00 H new ATOM 0 HB3 GLN A 16 54.083 2.077 4.016 1.00 0.00 H new ATOM 0 HG2 GLN A 16 53.913 4.519 4.295 1.00 0.00 H new ATOM 0 HG3 GLN A 16 55.628 4.718 3.996 1.00 0.00 H new ATOM 0 HE21 GLN A 16 53.667 6.035 2.367 1.00 0.00 H new ATOM 0 HE22 GLN A 16 53.746 5.336 0.746 1.00 0.00 H new ATOM 259 N TYR A 17 56.450 0.403 5.746 1.00 0.00 N ATOM 260 CA TYR A 17 56.482 -1.017 6.189 1.00 0.00 C ATOM 261 C TYR A 17 56.836 -1.101 7.677 1.00 0.00 C ATOM 262 O TYR A 17 56.220 -1.825 8.432 1.00 0.00 O ATOM 263 CB TYR A 17 57.508 -1.800 5.375 1.00 0.00 C ATOM 264 CG TYR A 17 57.470 -3.237 5.822 1.00 0.00 C ATOM 265 CD1 TYR A 17 56.587 -4.135 5.210 1.00 0.00 C ATOM 266 CD2 TYR A 17 58.299 -3.667 6.862 1.00 0.00 C ATOM 267 CE1 TYR A 17 56.534 -5.466 5.638 1.00 0.00 C ATOM 268 CE2 TYR A 17 58.246 -4.997 7.293 1.00 0.00 C ATOM 269 CZ TYR A 17 57.364 -5.897 6.680 1.00 0.00 C ATOM 270 OH TYR A 17 57.312 -7.207 7.106 1.00 0.00 O ATOM 0 H TYR A 17 57.247 0.706 5.186 1.00 0.00 H new ATOM 0 HA TYR A 17 55.494 -1.450 6.032 1.00 0.00 H new ATOM 0 HB2 TYR A 17 57.284 -1.727 4.311 1.00 0.00 H new ATOM 0 HB3 TYR A 17 58.505 -1.384 5.520 1.00 0.00 H new ATOM 0 HD1 TYR A 17 55.947 -3.800 4.407 1.00 0.00 H new ATOM 0 HD2 TYR A 17 58.980 -2.973 7.332 1.00 0.00 H new ATOM 0 HE1 TYR A 17 55.854 -6.160 5.166 1.00 0.00 H new ATOM 0 HE2 TYR A 17 58.885 -5.330 8.098 1.00 0.00 H new ATOM 0 HH TYR A 17 57.999 -7.357 7.788 1.00 0.00 H new ATOM 280 N SER A 18 57.832 -0.371 8.099 1.00 0.00 N ATOM 281 CA SER A 18 58.239 -0.407 9.532 1.00 0.00 C ATOM 282 C SER A 18 57.176 0.274 10.399 1.00 0.00 C ATOM 283 O SER A 18 57.108 0.062 11.593 1.00 0.00 O ATOM 284 CB SER A 18 59.582 0.311 9.693 1.00 0.00 C ATOM 285 OG SER A 18 60.117 0.027 10.978 1.00 0.00 O ATOM 0 H SER A 18 58.384 0.252 7.509 1.00 0.00 H new ATOM 0 HA SER A 18 58.339 -1.444 9.853 1.00 0.00 H new ATOM 0 HB2 SER A 18 60.276 -0.014 8.918 1.00 0.00 H new ATOM 0 HB3 SER A 18 59.449 1.386 9.572 1.00 0.00 H new ATOM 0 HG SER A 18 59.506 0.361 11.668 1.00 0.00 H new ATOM 291 N GLY A 19 56.350 1.098 9.811 1.00 0.00 N ATOM 292 CA GLY A 19 55.297 1.802 10.604 1.00 0.00 C ATOM 293 C GLY A 19 54.049 0.922 10.719 1.00 0.00 C ATOM 294 O GLY A 19 52.968 1.402 11.001 1.00 0.00 O ATOM 0 H GLY A 19 56.358 1.315 8.814 1.00 0.00 H new ATOM 0 HA2 GLY A 19 55.677 2.040 11.598 1.00 0.00 H new ATOM 0 HA3 GLY A 19 55.042 2.748 10.126 1.00 0.00 H new ATOM 298 N ARG A 20 54.186 -0.363 10.527 1.00 0.00 N ATOM 299 CA ARG A 20 53.010 -1.271 10.651 1.00 0.00 C ATOM 300 C ARG A 20 52.889 -1.724 12.108 1.00 0.00 C ATOM 301 O ARG A 20 51.869 -1.550 12.746 1.00 0.00 O ATOM 302 CB ARG A 20 53.220 -2.483 9.745 1.00 0.00 C ATOM 303 CG ARG A 20 53.162 -2.031 8.283 1.00 0.00 C ATOM 304 CD ARG A 20 53.387 -3.233 7.366 1.00 0.00 C ATOM 305 NE ARG A 20 52.230 -4.162 7.477 1.00 0.00 N ATOM 306 CZ ARG A 20 52.111 -5.158 6.644 1.00 0.00 C ATOM 307 NH1 ARG A 20 53.027 -5.364 5.738 1.00 0.00 N ATOM 308 NH2 ARG A 20 51.080 -5.952 6.720 1.00 0.00 N ATOM 0 H ARG A 20 55.064 -0.824 10.289 1.00 0.00 H new ATOM 0 HA ARG A 20 52.098 -0.754 10.354 1.00 0.00 H new ATOM 0 HB2 ARG A 20 54.182 -2.949 9.957 1.00 0.00 H new ATOM 0 HB3 ARG A 20 52.453 -3.234 9.937 1.00 0.00 H new ATOM 0 HG2 ARG A 20 52.195 -1.575 8.071 1.00 0.00 H new ATOM 0 HG3 ARG A 20 53.921 -1.271 8.096 1.00 0.00 H new ATOM 0 HD2 ARG A 20 53.503 -2.901 6.334 1.00 0.00 H new ATOM 0 HD3 ARG A 20 54.308 -3.747 7.641 1.00 0.00 H new ATOM 0 HE ARG A 20 51.530 -4.020 8.205 1.00 0.00 H new ATOM 0 HH11 ARG A 20 53.836 -4.746 5.681 1.00 0.00 H new ATOM 0 HH12 ARG A 20 52.934 -6.143 5.086 1.00 0.00 H new ATOM 0 HH21 ARG A 20 50.366 -5.794 7.431 1.00 0.00 H new ATOM 0 HH22 ARG A 20 50.987 -6.731 6.068 1.00 0.00 H new ATOM 322 N GLU A 21 53.939 -2.303 12.637 1.00 0.00 N ATOM 323 CA GLU A 21 53.927 -2.775 14.052 1.00 0.00 C ATOM 324 C GLU A 21 55.286 -2.456 14.686 1.00 0.00 C ATOM 325 O GLU A 21 56.265 -2.247 13.996 1.00 0.00 O ATOM 326 CB GLU A 21 53.692 -4.288 14.081 1.00 0.00 C ATOM 327 CG GLU A 21 52.270 -4.595 13.602 1.00 0.00 C ATOM 328 CD GLU A 21 52.037 -6.107 13.626 1.00 0.00 C ATOM 329 OE1 GLU A 21 52.927 -6.816 14.064 1.00 0.00 O ATOM 330 OE2 GLU A 21 50.972 -6.529 13.207 1.00 0.00 O ATOM 0 H GLU A 21 54.814 -2.470 12.140 1.00 0.00 H new ATOM 0 HA GLU A 21 53.131 -2.277 14.606 1.00 0.00 H new ATOM 0 HB2 GLU A 21 54.418 -4.792 13.443 1.00 0.00 H new ATOM 0 HB3 GLU A 21 53.837 -4.670 15.092 1.00 0.00 H new ATOM 0 HG2 GLU A 21 51.544 -4.094 14.242 1.00 0.00 H new ATOM 0 HG3 GLU A 21 52.124 -4.210 12.593 1.00 0.00 H new ATOM 337 N GLY A 22 55.358 -2.415 15.993 1.00 0.00 N ATOM 338 CA GLY A 22 56.658 -2.106 16.671 1.00 0.00 C ATOM 339 C GLY A 22 56.696 -0.625 17.052 1.00 0.00 C ATOM 340 O GLY A 22 55.767 0.114 16.796 1.00 0.00 O ATOM 0 H GLY A 22 54.573 -2.582 16.622 1.00 0.00 H new ATOM 0 HA2 GLY A 22 56.772 -2.724 17.561 1.00 0.00 H new ATOM 0 HA3 GLY A 22 57.491 -2.344 16.009 1.00 0.00 H new ATOM 344 N ASP A 23 57.758 -0.184 17.674 1.00 0.00 N ATOM 345 CA ASP A 23 57.837 1.251 18.075 1.00 0.00 C ATOM 346 C ASP A 23 57.742 2.140 16.830 1.00 0.00 C ATOM 347 O ASP A 23 56.890 3.001 16.748 1.00 0.00 O ATOM 348 CB ASP A 23 59.168 1.499 18.795 1.00 0.00 C ATOM 349 CG ASP A 23 59.274 2.967 19.227 1.00 0.00 C ATOM 350 OD1 ASP A 23 58.678 3.808 18.575 1.00 0.00 O ATOM 351 OD2 ASP A 23 59.952 3.224 20.208 1.00 0.00 O ATOM 0 H ASP A 23 58.569 -0.751 17.920 1.00 0.00 H new ATOM 0 HA ASP A 23 57.012 1.492 18.745 1.00 0.00 H new ATOM 0 HB2 ASP A 23 59.244 0.850 19.667 1.00 0.00 H new ATOM 0 HB3 ASP A 23 59.998 1.246 18.136 1.00 0.00 H new ATOM 356 N LYS A 24 58.591 1.921 15.852 1.00 0.00 N ATOM 357 CA LYS A 24 58.530 2.749 14.607 1.00 0.00 C ATOM 358 C LYS A 24 59.566 2.248 13.592 1.00 0.00 C ATOM 359 O LYS A 24 59.222 1.746 12.538 1.00 0.00 O ATOM 360 CB LYS A 24 58.834 4.219 14.928 1.00 0.00 C ATOM 361 CG LYS A 24 58.407 5.090 13.742 1.00 0.00 C ATOM 362 CD LYS A 24 58.909 6.526 13.937 1.00 0.00 C ATOM 363 CE LYS A 24 58.290 7.141 15.199 1.00 0.00 C ATOM 364 NZ LYS A 24 56.847 6.775 15.285 1.00 0.00 N ATOM 0 H LYS A 24 59.320 1.208 15.863 1.00 0.00 H new ATOM 0 HA LYS A 24 57.526 2.664 14.190 1.00 0.00 H new ATOM 0 HB2 LYS A 24 58.303 4.525 15.829 1.00 0.00 H new ATOM 0 HB3 LYS A 24 59.898 4.348 15.126 1.00 0.00 H new ATOM 0 HG2 LYS A 24 58.808 4.679 12.816 1.00 0.00 H new ATOM 0 HG3 LYS A 24 57.321 5.085 13.649 1.00 0.00 H new ATOM 0 HD2 LYS A 24 59.996 6.530 14.018 1.00 0.00 H new ATOM 0 HD3 LYS A 24 58.652 7.130 13.067 1.00 0.00 H new ATOM 0 HE2 LYS A 24 58.818 6.786 16.084 1.00 0.00 H new ATOM 0 HE3 LYS A 24 58.399 8.225 15.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 56.354 7.450 15.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 56.424 6.804 14.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 56.755 5.815 15.675 1.00 0.00 H new ATOM 378 N HIS A 25 60.834 2.394 13.901 1.00 0.00 N ATOM 379 CA HIS A 25 61.916 1.949 12.967 1.00 0.00 C ATOM 380 C HIS A 25 62.626 0.720 13.533 1.00 0.00 C ATOM 381 O HIS A 25 63.765 0.447 13.208 1.00 0.00 O ATOM 382 CB HIS A 25 62.922 3.086 12.772 1.00 0.00 C ATOM 383 CG HIS A 25 63.521 3.474 14.095 1.00 0.00 C ATOM 384 ND1 HIS A 25 62.762 4.033 15.114 1.00 0.00 N ATOM 385 CD2 HIS A 25 64.807 3.409 14.575 1.00 0.00 C ATOM 386 CE1 HIS A 25 63.591 4.284 16.144 1.00 0.00 C ATOM 387 NE2 HIS A 25 64.844 3.921 15.867 1.00 0.00 N ATOM 0 H HIS A 25 61.168 2.808 14.772 1.00 0.00 H new ATOM 0 HA HIS A 25 61.473 1.688 12.006 1.00 0.00 H new ATOM 0 HB2 HIS A 25 63.708 2.773 12.085 1.00 0.00 H new ATOM 0 HB3 HIS A 25 62.428 3.946 12.321 1.00 0.00 H new ATOM 0 HD1 HIS A 25 61.760 4.219 15.087 1.00 0.00 H new ATOM 0 HD2 HIS A 25 65.657 3.021 14.033 1.00 0.00 H new ATOM 0 HE1 HIS A 25 63.280 4.725 17.079 1.00 0.00 H new ATOM 396 N LYS A 26 61.954 -0.033 14.366 1.00 0.00 N ATOM 397 CA LYS A 26 62.570 -1.268 14.950 1.00 0.00 C ATOM 398 C LYS A 26 61.952 -2.484 14.252 1.00 0.00 C ATOM 399 O LYS A 26 60.752 -2.678 14.272 1.00 0.00 O ATOM 400 CB LYS A 26 62.268 -1.329 16.468 1.00 0.00 C ATOM 401 CG LYS A 26 63.449 -0.786 17.289 1.00 0.00 C ATOM 402 CD LYS A 26 63.541 0.733 17.143 1.00 0.00 C ATOM 403 CE LYS A 26 64.568 1.269 18.145 1.00 0.00 C ATOM 404 NZ LYS A 26 64.606 2.757 18.081 1.00 0.00 N ATOM 0 H LYS A 26 60.999 0.154 14.670 1.00 0.00 H new ATOM 0 HA LYS A 26 63.650 -1.259 14.806 1.00 0.00 H new ATOM 0 HB2 LYS A 26 61.371 -0.749 16.687 1.00 0.00 H new ATOM 0 HB3 LYS A 26 62.061 -2.359 16.760 1.00 0.00 H new ATOM 0 HG2 LYS A 26 63.323 -1.051 18.339 1.00 0.00 H new ATOM 0 HG3 LYS A 26 64.377 -1.248 16.953 1.00 0.00 H new ATOM 0 HD2 LYS A 26 63.834 0.996 16.127 1.00 0.00 H new ATOM 0 HD3 LYS A 26 62.567 1.188 17.322 1.00 0.00 H new ATOM 0 HE2 LYS A 26 64.309 0.946 19.153 1.00 0.00 H new ATOM 0 HE3 LYS A 26 65.554 0.861 17.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 65.201 3.123 18.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 65.002 3.055 17.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 63.642 3.133 18.180 1.00 0.00 H new ATOM 418 N LEU A 27 62.763 -3.301 13.631 1.00 0.00 N ATOM 419 CA LEU A 27 62.223 -4.501 12.926 1.00 0.00 C ATOM 420 C LEU A 27 62.373 -5.723 13.830 1.00 0.00 C ATOM 421 O LEU A 27 63.455 -6.076 14.253 1.00 0.00 O ATOM 422 CB LEU A 27 63.006 -4.725 11.630 1.00 0.00 C ATOM 423 CG LEU A 27 62.885 -3.492 10.722 1.00 0.00 C ATOM 424 CD1 LEU A 27 63.754 -3.694 9.474 1.00 0.00 C ATOM 425 CD2 LEU A 27 61.418 -3.283 10.301 1.00 0.00 C ATOM 0 H LEU A 27 63.776 -3.189 13.582 1.00 0.00 H new ATOM 0 HA LEU A 27 61.170 -4.346 12.690 1.00 0.00 H new ATOM 0 HB2 LEU A 27 64.054 -4.917 11.858 1.00 0.00 H new ATOM 0 HB3 LEU A 27 62.625 -5.606 11.113 1.00 0.00 H new ATOM 0 HG LEU A 27 63.223 -2.612 11.268 1.00 0.00 H new ATOM 0 HD11 LEU A 27 63.670 -2.821 8.827 1.00 0.00 H new ATOM 0 HD12 LEU A 27 64.794 -3.826 9.772 1.00 0.00 H new ATOM 0 HD13 LEU A 27 63.416 -4.579 8.934 1.00 0.00 H new ATOM 0 HD21 LEU A 27 61.345 -2.406 9.658 1.00 0.00 H new ATOM 0 HD22 LEU A 27 61.066 -4.161 9.759 1.00 0.00 H new ATOM 0 HD23 LEU A 27 60.803 -3.134 11.188 1.00 0.00 H new ATOM 437 N LYS A 28 61.279 -6.366 14.124 1.00 0.00 N ATOM 438 CA LYS A 28 61.312 -7.573 14.997 1.00 0.00 C ATOM 439 C LYS A 28 61.479 -8.817 14.122 1.00 0.00 C ATOM 440 O LYS A 28 61.272 -8.772 12.925 1.00 0.00 O ATOM 441 CB LYS A 28 59.996 -7.652 15.782 1.00 0.00 C ATOM 442 CG LYS A 28 60.060 -8.780 16.816 1.00 0.00 C ATOM 443 CD LYS A 28 58.800 -8.744 17.683 1.00 0.00 C ATOM 444 CE LYS A 28 58.800 -9.939 18.638 1.00 0.00 C ATOM 445 NZ LYS A 28 59.920 -9.801 19.609 1.00 0.00 N ATOM 0 H LYS A 28 60.351 -6.104 13.793 1.00 0.00 H new ATOM 0 HA LYS A 28 62.146 -7.514 15.696 1.00 0.00 H new ATOM 0 HB2 LYS A 28 59.805 -6.702 16.282 1.00 0.00 H new ATOM 0 HB3 LYS A 28 59.166 -7.824 15.097 1.00 0.00 H new ATOM 0 HG2 LYS A 28 60.143 -9.744 16.314 1.00 0.00 H new ATOM 0 HG3 LYS A 28 60.947 -8.668 17.439 1.00 0.00 H new ATOM 0 HD2 LYS A 28 58.762 -7.813 18.249 1.00 0.00 H new ATOM 0 HD3 LYS A 28 57.911 -8.770 17.052 1.00 0.00 H new ATOM 0 HE2 LYS A 28 57.850 -9.993 19.169 1.00 0.00 H new ATOM 0 HE3 LYS A 28 58.905 -10.867 18.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 59.784 -10.471 20.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 60.821 -10.006 19.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 59.939 -8.830 19.982 1.00 0.00 H new ATOM 459 N LYS A 29 61.858 -9.926 14.696 1.00 0.00 N ATOM 460 CA LYS A 29 62.037 -11.154 13.874 1.00 0.00 C ATOM 461 C LYS A 29 60.708 -11.501 13.202 1.00 0.00 C ATOM 462 O LYS A 29 60.670 -11.877 12.047 1.00 0.00 O ATOM 463 CB LYS A 29 62.477 -12.313 14.776 1.00 0.00 C ATOM 464 CG LYS A 29 63.911 -12.074 15.254 1.00 0.00 C ATOM 465 CD LYS A 29 64.249 -13.036 16.400 1.00 0.00 C ATOM 466 CE LYS A 29 64.291 -14.477 15.883 1.00 0.00 C ATOM 467 NZ LYS A 29 64.941 -15.350 16.903 1.00 0.00 N ATOM 0 H LYS A 29 62.050 -10.034 15.692 1.00 0.00 H new ATOM 0 HA LYS A 29 62.799 -10.983 13.114 1.00 0.00 H new ATOM 0 HB2 LYS A 29 61.807 -12.396 15.631 1.00 0.00 H new ATOM 0 HB3 LYS A 29 62.417 -13.255 14.231 1.00 0.00 H new ATOM 0 HG2 LYS A 29 64.607 -12.220 14.428 1.00 0.00 H new ATOM 0 HG3 LYS A 29 64.025 -11.043 15.588 1.00 0.00 H new ATOM 0 HD2 LYS A 29 65.212 -12.770 16.836 1.00 0.00 H new ATOM 0 HD3 LYS A 29 63.505 -12.947 17.191 1.00 0.00 H new ATOM 0 HE2 LYS A 29 63.281 -14.830 15.676 1.00 0.00 H new ATOM 0 HE3 LYS A 29 64.843 -14.522 14.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 64.971 -16.329 16.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 65.910 -15.016 17.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 64.396 -15.314 17.788 1.00 0.00 H new ATOM 481 N SER A 30 59.614 -11.357 13.899 1.00 0.00 N ATOM 482 CA SER A 30 58.301 -11.660 13.268 1.00 0.00 C ATOM 483 C SER A 30 58.075 -10.676 12.116 1.00 0.00 C ATOM 484 O SER A 30 57.601 -11.035 11.057 1.00 0.00 O ATOM 485 CB SER A 30 57.189 -11.504 14.306 1.00 0.00 C ATOM 486 OG SER A 30 57.127 -10.149 14.731 1.00 0.00 O ATOM 0 H SER A 30 59.573 -11.045 14.869 1.00 0.00 H new ATOM 0 HA SER A 30 58.293 -12.682 12.890 1.00 0.00 H new ATOM 0 HB2 SER A 30 56.233 -11.807 13.879 1.00 0.00 H new ATOM 0 HB3 SER A 30 57.378 -12.156 15.159 1.00 0.00 H new ATOM 0 HG SER A 30 56.414 -10.047 15.395 1.00 0.00 H new ATOM 492 N GLU A 31 58.438 -9.438 12.319 1.00 0.00 N ATOM 493 CA GLU A 31 58.277 -8.416 11.243 1.00 0.00 C ATOM 494 C GLU A 31 59.277 -8.705 10.121 1.00 0.00 C ATOM 495 O GLU A 31 59.016 -8.468 8.959 1.00 0.00 O ATOM 496 CB GLU A 31 58.542 -7.021 11.817 1.00 0.00 C ATOM 497 CG GLU A 31 57.412 -6.641 12.775 1.00 0.00 C ATOM 498 CD GLU A 31 57.676 -5.249 13.355 1.00 0.00 C ATOM 499 OE1 GLU A 31 58.643 -4.629 12.943 1.00 0.00 O ATOM 500 OE2 GLU A 31 56.904 -4.827 14.200 1.00 0.00 O ATOM 0 H GLU A 31 58.841 -9.088 13.188 1.00 0.00 H new ATOM 0 HA GLU A 31 57.262 -8.457 10.849 1.00 0.00 H new ATOM 0 HB2 GLU A 31 59.498 -7.007 12.341 1.00 0.00 H new ATOM 0 HB3 GLU A 31 58.610 -6.291 11.010 1.00 0.00 H new ATOM 0 HG2 GLU A 31 56.457 -6.652 12.249 1.00 0.00 H new ATOM 0 HG3 GLU A 31 57.342 -7.374 13.579 1.00 0.00 H new ATOM 507 N LEU A 32 60.420 -9.227 10.472 1.00 0.00 N ATOM 508 CA LEU A 32 61.443 -9.549 9.438 1.00 0.00 C ATOM 509 C LEU A 32 60.966 -10.734 8.597 1.00 0.00 C ATOM 510 O LEU A 32 61.134 -10.766 7.394 1.00 0.00 O ATOM 511 CB LEU A 32 62.773 -9.892 10.123 1.00 0.00 C ATOM 512 CG LEU A 32 63.844 -10.241 9.075 1.00 0.00 C ATOM 513 CD1 LEU A 32 64.074 -9.051 8.127 1.00 0.00 C ATOM 514 CD2 LEU A 32 65.153 -10.578 9.799 1.00 0.00 C ATOM 0 H LEU A 32 60.690 -9.445 11.431 1.00 0.00 H new ATOM 0 HA LEU A 32 61.589 -8.687 8.787 1.00 0.00 H new ATOM 0 HB2 LEU A 32 63.107 -9.047 10.726 1.00 0.00 H new ATOM 0 HB3 LEU A 32 62.633 -10.733 10.802 1.00 0.00 H new ATOM 0 HG LEU A 32 63.508 -11.095 8.487 1.00 0.00 H new ATOM 0 HD11 LEU A 32 64.834 -9.313 7.391 1.00 0.00 H new ATOM 0 HD12 LEU A 32 63.143 -8.808 7.615 1.00 0.00 H new ATOM 0 HD13 LEU A 32 64.408 -8.187 8.702 1.00 0.00 H new ATOM 0 HD21 LEU A 32 65.920 -10.827 9.066 1.00 0.00 H new ATOM 0 HD22 LEU A 32 65.477 -9.718 10.385 1.00 0.00 H new ATOM 0 HD23 LEU A 32 64.994 -11.429 10.461 1.00 0.00 H new ATOM 526 N LYS A 33 60.376 -11.710 9.225 1.00 0.00 N ATOM 527 CA LYS A 33 59.890 -12.898 8.468 1.00 0.00 C ATOM 528 C LYS A 33 58.799 -12.479 7.482 1.00 0.00 C ATOM 529 O LYS A 33 58.745 -12.951 6.363 1.00 0.00 O ATOM 530 CB LYS A 33 59.323 -13.928 9.446 1.00 0.00 C ATOM 531 CG LYS A 33 58.824 -15.149 8.670 1.00 0.00 C ATOM 532 CD LYS A 33 58.486 -16.280 9.648 1.00 0.00 C ATOM 533 CE LYS A 33 57.377 -15.831 10.608 1.00 0.00 C ATOM 534 NZ LYS A 33 57.977 -15.065 11.737 1.00 0.00 N ATOM 0 H LYS A 33 60.208 -11.738 10.231 1.00 0.00 H new ATOM 0 HA LYS A 33 60.722 -13.335 7.916 1.00 0.00 H new ATOM 0 HB2 LYS A 33 60.090 -14.227 10.161 1.00 0.00 H new ATOM 0 HB3 LYS A 33 58.506 -13.490 10.019 1.00 0.00 H new ATOM 0 HG2 LYS A 33 57.943 -14.885 8.085 1.00 0.00 H new ATOM 0 HG3 LYS A 33 59.586 -15.480 7.965 1.00 0.00 H new ATOM 0 HD2 LYS A 33 58.165 -17.164 9.097 1.00 0.00 H new ATOM 0 HD3 LYS A 33 59.375 -16.561 10.213 1.00 0.00 H new ATOM 0 HE2 LYS A 33 56.652 -15.212 10.079 1.00 0.00 H new ATOM 0 HE3 LYS A 33 56.838 -16.698 10.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 57.663 -15.475 12.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 59.014 -15.113 11.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 57.673 -14.072 11.683 1.00 0.00 H new ATOM 548 N GLU A 34 57.927 -11.595 7.884 1.00 0.00 N ATOM 549 CA GLU A 34 56.844 -11.156 6.961 1.00 0.00 C ATOM 550 C GLU A 34 57.457 -10.381 5.795 1.00 0.00 C ATOM 551 O GLU A 34 57.083 -10.557 4.653 1.00 0.00 O ATOM 552 CB GLU A 34 55.863 -10.261 7.721 1.00 0.00 C ATOM 553 CG GLU A 34 55.098 -11.107 8.741 1.00 0.00 C ATOM 554 CD GLU A 34 54.128 -10.219 9.522 1.00 0.00 C ATOM 555 OE1 GLU A 34 54.587 -9.500 10.394 1.00 0.00 O ATOM 556 OE2 GLU A 34 52.944 -10.273 9.236 1.00 0.00 O ATOM 0 H GLU A 34 57.918 -11.160 8.807 1.00 0.00 H new ATOM 0 HA GLU A 34 56.312 -12.026 6.575 1.00 0.00 H new ATOM 0 HB2 GLU A 34 56.401 -9.458 8.226 1.00 0.00 H new ATOM 0 HB3 GLU A 34 55.168 -9.791 7.026 1.00 0.00 H new ATOM 0 HG2 GLU A 34 54.551 -11.901 8.232 1.00 0.00 H new ATOM 0 HG3 GLU A 34 55.796 -11.589 9.425 1.00 0.00 H new ATOM 563 N LEU A 35 58.384 -9.513 6.081 1.00 0.00 N ATOM 564 CA LEU A 35 59.013 -8.709 4.997 1.00 0.00 C ATOM 565 C LEU A 35 59.681 -9.649 3.991 1.00 0.00 C ATOM 566 O LEU A 35 59.525 -9.504 2.796 1.00 0.00 O ATOM 567 CB LEU A 35 60.071 -7.785 5.612 1.00 0.00 C ATOM 568 CG LEU A 35 60.748 -6.933 4.527 1.00 0.00 C ATOM 569 CD1 LEU A 35 59.710 -6.047 3.816 1.00 0.00 C ATOM 570 CD2 LEU A 35 61.812 -6.046 5.184 1.00 0.00 C ATOM 0 H LEU A 35 58.735 -9.325 7.020 1.00 0.00 H new ATOM 0 HA LEU A 35 58.254 -8.114 4.489 1.00 0.00 H new ATOM 0 HB2 LEU A 35 59.606 -7.135 6.354 1.00 0.00 H new ATOM 0 HB3 LEU A 35 60.821 -8.380 6.134 1.00 0.00 H new ATOM 0 HG LEU A 35 61.209 -7.590 3.790 1.00 0.00 H new ATOM 0 HD11 LEU A 35 60.205 -5.450 3.050 1.00 0.00 H new ATOM 0 HD12 LEU A 35 58.952 -6.677 3.351 1.00 0.00 H new ATOM 0 HD13 LEU A 35 59.237 -5.386 4.542 1.00 0.00 H new ATOM 0 HD21 LEU A 35 62.299 -5.437 4.422 1.00 0.00 H new ATOM 0 HD22 LEU A 35 61.340 -5.396 5.921 1.00 0.00 H new ATOM 0 HD23 LEU A 35 62.555 -6.673 5.677 1.00 0.00 H new ATOM 582 N ILE A 36 60.423 -10.611 4.465 1.00 0.00 N ATOM 583 CA ILE A 36 61.094 -11.555 3.530 1.00 0.00 C ATOM 584 C ILE A 36 60.040 -12.321 2.723 1.00 0.00 C ATOM 585 O ILE A 36 60.172 -12.499 1.530 1.00 0.00 O ATOM 586 CB ILE A 36 61.954 -12.541 4.327 1.00 0.00 C ATOM 587 CG1 ILE A 36 63.113 -11.784 4.983 1.00 0.00 C ATOM 588 CG2 ILE A 36 62.513 -13.608 3.384 1.00 0.00 C ATOM 589 CD1 ILE A 36 63.843 -12.706 5.962 1.00 0.00 C ATOM 0 H ILE A 36 60.593 -10.784 5.456 1.00 0.00 H new ATOM 0 HA ILE A 36 61.730 -10.994 2.845 1.00 0.00 H new ATOM 0 HB ILE A 36 61.346 -13.019 5.095 1.00 0.00 H new ATOM 0 HG12 ILE A 36 63.805 -11.427 4.220 1.00 0.00 H new ATOM 0 HG13 ILE A 36 62.736 -10.906 5.508 1.00 0.00 H new ATOM 0 HG21 ILE A 36 63.125 -14.310 3.951 1.00 0.00 H new ATOM 0 HG22 ILE A 36 61.690 -14.144 2.912 1.00 0.00 H new ATOM 0 HG23 ILE A 36 63.123 -13.132 2.617 1.00 0.00 H new ATOM 0 HD11 ILE A 36 64.667 -12.164 6.427 1.00 0.00 H new ATOM 0 HD12 ILE A 36 63.149 -13.041 6.733 1.00 0.00 H new ATOM 0 HD13 ILE A 36 64.234 -13.570 5.425 1.00 0.00 H new ATOM 601 N ASN A 37 59.001 -12.783 3.363 1.00 0.00 N ATOM 602 CA ASN A 37 57.953 -13.545 2.626 1.00 0.00 C ATOM 603 C ASN A 37 57.297 -12.657 1.567 1.00 0.00 C ATOM 604 O ASN A 37 56.988 -13.101 0.479 1.00 0.00 O ATOM 605 CB ASN A 37 56.875 -14.016 3.605 1.00 0.00 C ATOM 606 CG ASN A 37 57.436 -15.108 4.516 1.00 0.00 C ATOM 607 OD1 ASN A 37 58.428 -15.735 4.197 1.00 0.00 O ATOM 608 ND2 ASN A 37 56.835 -15.363 5.647 1.00 0.00 N ATOM 0 H ASN A 37 58.832 -12.666 4.362 1.00 0.00 H new ATOM 0 HA ASN A 37 58.423 -14.402 2.143 1.00 0.00 H new ATOM 0 HB2 ASN A 37 56.524 -13.176 4.204 1.00 0.00 H new ATOM 0 HB3 ASN A 37 56.014 -14.397 3.055 1.00 0.00 H new ATOM 0 HD21 ASN A 37 57.197 -16.089 6.265 1.00 0.00 H new ATOM 0 HD22 ASN A 37 56.003 -14.836 5.913 1.00 0.00 H new ATOM 615 N ASN A 38 57.053 -11.413 1.884 1.00 0.00 N ATOM 616 CA ASN A 38 56.384 -10.508 0.905 1.00 0.00 C ATOM 617 C ASN A 38 57.368 -10.000 -0.151 1.00 0.00 C ATOM 618 O ASN A 38 57.106 -10.058 -1.335 1.00 0.00 O ATOM 619 CB ASN A 38 55.805 -9.313 1.661 1.00 0.00 C ATOM 620 CG ASN A 38 54.914 -8.498 0.724 1.00 0.00 C ATOM 621 OD1 ASN A 38 55.074 -8.546 -0.480 1.00 0.00 O ATOM 622 ND2 ASN A 38 53.975 -7.748 1.229 1.00 0.00 N ATOM 0 H ASN A 38 57.288 -10.985 2.779 1.00 0.00 H new ATOM 0 HA ASN A 38 55.598 -11.067 0.397 1.00 0.00 H new ATOM 0 HB2 ASN A 38 55.229 -9.657 2.520 1.00 0.00 H new ATOM 0 HB3 ASN A 38 56.611 -8.689 2.048 1.00 0.00 H new ATOM 0 HD21 ASN A 38 53.373 -7.200 0.614 1.00 0.00 H new ATOM 0 HD22 ASN A 38 53.842 -7.709 2.240 1.00 0.00 H new ATOM 629 N GLU A 39 58.481 -9.462 0.267 1.00 0.00 N ATOM 630 CA GLU A 39 59.458 -8.903 -0.718 1.00 0.00 C ATOM 631 C GLU A 39 60.405 -9.984 -1.241 1.00 0.00 C ATOM 632 O GLU A 39 60.307 -10.400 -2.379 1.00 0.00 O ATOM 633 CB GLU A 39 60.270 -7.792 -0.047 1.00 0.00 C ATOM 634 CG GLU A 39 59.388 -6.553 0.127 1.00 0.00 C ATOM 635 CD GLU A 39 60.193 -5.440 0.796 1.00 0.00 C ATOM 636 OE1 GLU A 39 61.290 -5.718 1.250 1.00 0.00 O ATOM 637 OE2 GLU A 39 59.698 -4.325 0.841 1.00 0.00 O ATOM 0 H GLU A 39 58.758 -9.384 1.245 1.00 0.00 H new ATOM 0 HA GLU A 39 58.901 -8.504 -1.566 1.00 0.00 H new ATOM 0 HB2 GLU A 39 60.638 -8.129 0.922 1.00 0.00 H new ATOM 0 HB3 GLU A 39 61.143 -7.548 -0.652 1.00 0.00 H new ATOM 0 HG2 GLU A 39 59.020 -6.217 -0.843 1.00 0.00 H new ATOM 0 HG3 GLU A 39 58.515 -6.798 0.732 1.00 0.00 H new ATOM 644 N LEU A 40 61.345 -10.418 -0.449 1.00 0.00 N ATOM 645 CA LEU A 40 62.315 -11.441 -0.943 1.00 0.00 C ATOM 646 C LEU A 40 61.789 -12.856 -0.693 1.00 0.00 C ATOM 647 O LEU A 40 61.985 -13.429 0.359 1.00 0.00 O ATOM 648 CB LEU A 40 63.653 -11.271 -0.212 1.00 0.00 C ATOM 649 CG LEU A 40 64.357 -9.960 -0.652 1.00 0.00 C ATOM 650 CD1 LEU A 40 63.945 -8.800 0.263 1.00 0.00 C ATOM 651 CD2 LEU A 40 65.876 -10.141 -0.566 1.00 0.00 C ATOM 0 H LEU A 40 61.485 -10.112 0.514 1.00 0.00 H new ATOM 0 HA LEU A 40 62.449 -11.298 -2.015 1.00 0.00 H new ATOM 0 HB2 LEU A 40 63.485 -11.255 0.865 1.00 0.00 H new ATOM 0 HB3 LEU A 40 64.298 -12.124 -0.422 1.00 0.00 H new ATOM 0 HG LEU A 40 64.062 -9.734 -1.677 1.00 0.00 H new ATOM 0 HD11 LEU A 40 64.447 -7.887 -0.058 1.00 0.00 H new ATOM 0 HD12 LEU A 40 62.866 -8.659 0.208 1.00 0.00 H new ATOM 0 HD13 LEU A 40 64.229 -9.028 1.290 1.00 0.00 H new ATOM 0 HD21 LEU A 40 66.370 -9.220 -0.875 1.00 0.00 H new ATOM 0 HD22 LEU A 40 66.157 -10.377 0.461 1.00 0.00 H new ATOM 0 HD23 LEU A 40 66.183 -10.955 -1.222 1.00 0.00 H new ATOM 663 N SER A 41 61.149 -13.434 -1.673 1.00 0.00 N ATOM 664 CA SER A 41 60.626 -14.828 -1.530 1.00 0.00 C ATOM 665 C SER A 41 60.850 -15.569 -2.847 1.00 0.00 C ATOM 666 O SER A 41 61.129 -16.752 -2.874 1.00 0.00 O ATOM 667 CB SER A 41 59.129 -14.787 -1.219 1.00 0.00 C ATOM 668 OG SER A 41 58.686 -16.096 -0.882 1.00 0.00 O ATOM 0 H SER A 41 60.963 -12.998 -2.576 1.00 0.00 H new ATOM 0 HA SER A 41 61.145 -15.338 -0.718 1.00 0.00 H new ATOM 0 HB2 SER A 41 58.935 -14.101 -0.394 1.00 0.00 H new ATOM 0 HB3 SER A 41 58.576 -14.414 -2.081 1.00 0.00 H new ATOM 0 HG SER A 41 57.727 -16.075 -0.680 1.00 0.00 H new ATOM 674 N HIS A 42 60.715 -14.873 -3.942 1.00 0.00 N ATOM 675 CA HIS A 42 60.898 -15.508 -5.275 1.00 0.00 C ATOM 676 C HIS A 42 62.384 -15.778 -5.539 1.00 0.00 C ATOM 677 O HIS A 42 62.735 -16.412 -6.515 1.00 0.00 O ATOM 678 CB HIS A 42 60.350 -14.572 -6.352 1.00 0.00 C ATOM 679 CG HIS A 42 60.567 -15.187 -7.705 1.00 0.00 C ATOM 680 ND1 HIS A 42 61.614 -14.806 -8.531 1.00 0.00 N ATOM 681 CD2 HIS A 42 59.882 -16.161 -8.391 1.00 0.00 C ATOM 682 CE1 HIS A 42 61.531 -15.541 -9.656 1.00 0.00 C ATOM 683 NE2 HIS A 42 60.494 -16.380 -9.619 1.00 0.00 N ATOM 0 H HIS A 42 60.483 -13.880 -3.969 1.00 0.00 H new ATOM 0 HA HIS A 42 60.362 -16.457 -5.296 1.00 0.00 H new ATOM 0 HB2 HIS A 42 59.287 -14.393 -6.188 1.00 0.00 H new ATOM 0 HB3 HIS A 42 60.848 -13.604 -6.296 1.00 0.00 H new ATOM 0 HD2 HIS A 42 59.004 -16.676 -8.031 1.00 0.00 H new ATOM 0 HE1 HIS A 42 62.218 -15.461 -10.485 1.00 0.00 H new ATOM 0 HE2 HIS A 42 60.210 -17.043 -10.341 1.00 0.00 H new ATOM 692 N PHE A 43 63.262 -15.313 -4.682 1.00 0.00 N ATOM 693 CA PHE A 43 64.729 -15.555 -4.878 1.00 0.00 C ATOM 694 C PHE A 43 65.240 -16.454 -3.754 1.00 0.00 C ATOM 695 O PHE A 43 66.366 -16.913 -3.775 1.00 0.00 O ATOM 696 CB PHE A 43 65.469 -14.217 -4.804 1.00 0.00 C ATOM 697 CG PHE A 43 65.159 -13.390 -6.025 1.00 0.00 C ATOM 698 CD1 PHE A 43 64.049 -12.539 -6.033 1.00 0.00 C ATOM 699 CD2 PHE A 43 65.982 -13.479 -7.152 1.00 0.00 C ATOM 700 CE1 PHE A 43 63.761 -11.775 -7.169 1.00 0.00 C ATOM 701 CE2 PHE A 43 65.696 -12.715 -8.290 1.00 0.00 C ATOM 702 CZ PHE A 43 64.585 -11.863 -8.299 1.00 0.00 C ATOM 0 H PHE A 43 63.025 -14.773 -3.850 1.00 0.00 H new ATOM 0 HA PHE A 43 64.898 -16.027 -5.846 1.00 0.00 H new ATOM 0 HB2 PHE A 43 65.173 -13.677 -3.904 1.00 0.00 H new ATOM 0 HB3 PHE A 43 66.543 -14.389 -4.734 1.00 0.00 H new ATOM 0 HD1 PHE A 43 63.414 -12.472 -5.162 1.00 0.00 H new ATOM 0 HD2 PHE A 43 66.838 -14.137 -7.145 1.00 0.00 H new ATOM 0 HE1 PHE A 43 62.904 -11.118 -7.175 1.00 0.00 H new ATOM 0 HE2 PHE A 43 66.332 -12.783 -9.160 1.00 0.00 H new ATOM 0 HZ PHE A 43 64.363 -11.274 -9.177 1.00 0.00 H new ATOM 712 N LEU A 44 64.423 -16.687 -2.757 1.00 0.00 N ATOM 713 CA LEU A 44 64.842 -17.531 -1.594 1.00 0.00 C ATOM 714 C LEU A 44 64.141 -18.893 -1.644 1.00 0.00 C ATOM 715 O LEU A 44 63.302 -19.152 -2.485 1.00 0.00 O ATOM 716 CB LEU A 44 64.471 -16.807 -0.291 1.00 0.00 C ATOM 717 CG LEU A 44 65.531 -15.742 0.042 1.00 0.00 C ATOM 718 CD1 LEU A 44 65.536 -14.641 -1.030 1.00 0.00 C ATOM 719 CD2 LEU A 44 65.210 -15.125 1.406 1.00 0.00 C ATOM 0 H LEU A 44 63.472 -16.324 -2.698 1.00 0.00 H new ATOM 0 HA LEU A 44 65.919 -17.692 -1.637 1.00 0.00 H new ATOM 0 HB2 LEU A 44 63.492 -16.338 -0.392 1.00 0.00 H new ATOM 0 HB3 LEU A 44 64.397 -17.526 0.525 1.00 0.00 H new ATOM 0 HG LEU A 44 66.514 -16.212 0.067 1.00 0.00 H new ATOM 0 HD11 LEU A 44 66.290 -13.895 -0.781 1.00 0.00 H new ATOM 0 HD12 LEU A 44 65.766 -15.080 -2.001 1.00 0.00 H new ATOM 0 HD13 LEU A 44 64.555 -14.167 -1.069 1.00 0.00 H new ATOM 0 HD21 LEU A 44 65.957 -14.369 1.648 1.00 0.00 H new ATOM 0 HD22 LEU A 44 64.224 -14.662 1.373 1.00 0.00 H new ATOM 0 HD23 LEU A 44 65.220 -15.903 2.169 1.00 0.00 H new ATOM 731 N GLU A 45 64.503 -19.766 -0.742 1.00 0.00 N ATOM 732 CA GLU A 45 63.901 -21.128 -0.701 1.00 0.00 C ATOM 733 C GLU A 45 62.650 -21.123 0.185 1.00 0.00 C ATOM 734 O GLU A 45 62.154 -22.164 0.565 1.00 0.00 O ATOM 735 CB GLU A 45 64.926 -22.105 -0.121 1.00 0.00 C ATOM 736 CG GLU A 45 66.114 -22.224 -1.077 1.00 0.00 C ATOM 737 CD GLU A 45 67.178 -23.133 -0.459 1.00 0.00 C ATOM 738 OE1 GLU A 45 66.930 -23.655 0.617 1.00 0.00 O ATOM 739 OE2 GLU A 45 68.223 -23.290 -1.067 1.00 0.00 O ATOM 0 H GLU A 45 65.202 -19.588 -0.021 1.00 0.00 H new ATOM 0 HA GLU A 45 63.621 -21.431 -1.710 1.00 0.00 H new ATOM 0 HB2 GLU A 45 65.264 -21.757 0.855 1.00 0.00 H new ATOM 0 HB3 GLU A 45 64.468 -23.082 0.030 1.00 0.00 H new ATOM 0 HG2 GLU A 45 65.785 -22.630 -2.034 1.00 0.00 H new ATOM 0 HG3 GLU A 45 66.534 -21.238 -1.276 1.00 0.00 H new ATOM 746 N GLU A 46 62.144 -19.962 0.523 1.00 0.00 N ATOM 747 CA GLU A 46 60.925 -19.887 1.386 1.00 0.00 C ATOM 748 C GLU A 46 61.181 -20.628 2.702 1.00 0.00 C ATOM 749 O GLU A 46 61.047 -21.833 2.785 1.00 0.00 O ATOM 750 CB GLU A 46 59.724 -20.512 0.659 1.00 0.00 C ATOM 751 CG GLU A 46 59.315 -19.618 -0.513 1.00 0.00 C ATOM 752 CD GLU A 46 58.120 -20.239 -1.240 1.00 0.00 C ATOM 753 OE1 GLU A 46 57.770 -21.361 -0.914 1.00 0.00 O ATOM 754 OE2 GLU A 46 57.571 -19.579 -2.108 1.00 0.00 O ATOM 0 H GLU A 46 62.525 -19.060 0.237 1.00 0.00 H new ATOM 0 HA GLU A 46 60.702 -18.841 1.598 1.00 0.00 H new ATOM 0 HB2 GLU A 46 59.982 -21.508 0.298 1.00 0.00 H new ATOM 0 HB3 GLU A 46 58.889 -20.630 1.349 1.00 0.00 H new ATOM 0 HG2 GLU A 46 59.056 -18.623 -0.151 1.00 0.00 H new ATOM 0 HG3 GLU A 46 60.151 -19.499 -1.202 1.00 0.00 H new ATOM 761 N ILE A 47 61.560 -19.914 3.730 1.00 0.00 N ATOM 762 CA ILE A 47 61.839 -20.572 5.039 1.00 0.00 C ATOM 763 C ILE A 47 60.543 -21.133 5.631 1.00 0.00 C ATOM 764 O ILE A 47 59.575 -20.424 5.824 1.00 0.00 O ATOM 765 CB ILE A 47 62.434 -19.546 6.006 1.00 0.00 C ATOM 766 CG1 ILE A 47 63.780 -19.056 5.466 1.00 0.00 C ATOM 767 CG2 ILE A 47 62.644 -20.203 7.368 1.00 0.00 C ATOM 768 CD1 ILE A 47 64.222 -17.816 6.246 1.00 0.00 C ATOM 0 H ILE A 47 61.688 -18.902 3.718 1.00 0.00 H new ATOM 0 HA ILE A 47 62.545 -21.388 4.885 1.00 0.00 H new ATOM 0 HB ILE A 47 61.754 -18.700 6.106 1.00 0.00 H new ATOM 0 HG12 ILE A 47 64.529 -19.843 5.558 1.00 0.00 H new ATOM 0 HG13 ILE A 47 63.694 -18.820 4.405 1.00 0.00 H new ATOM 0 HG21 ILE A 47 63.068 -19.476 8.061 1.00 0.00 H new ATOM 0 HG22 ILE A 47 61.687 -20.556 7.753 1.00 0.00 H new ATOM 0 HG23 ILE A 47 63.327 -21.046 7.264 1.00 0.00 H new ATOM 0 HD11 ILE A 47 65.180 -17.467 5.862 1.00 0.00 H new ATOM 0 HD12 ILE A 47 63.477 -17.029 6.131 1.00 0.00 H new ATOM 0 HD13 ILE A 47 64.324 -18.068 7.302 1.00 0.00 H new ATOM 780 N LYS A 48 60.527 -22.410 5.921 1.00 0.00 N ATOM 781 CA LYS A 48 59.307 -23.057 6.504 1.00 0.00 C ATOM 782 C LYS A 48 59.507 -23.292 8.007 1.00 0.00 C ATOM 783 O LYS A 48 58.556 -23.392 8.756 1.00 0.00 O ATOM 784 CB LYS A 48 59.089 -24.403 5.798 1.00 0.00 C ATOM 785 CG LYS A 48 57.860 -25.139 6.359 1.00 0.00 C ATOM 786 CD LYS A 48 56.582 -24.331 6.098 1.00 0.00 C ATOM 787 CE LYS A 48 55.363 -25.255 6.203 1.00 0.00 C ATOM 788 NZ LYS A 48 55.280 -25.817 7.581 1.00 0.00 N ATOM 0 H LYS A 48 61.316 -23.041 5.778 1.00 0.00 H new ATOM 0 HA LYS A 48 58.441 -22.411 6.363 1.00 0.00 H new ATOM 0 HB2 LYS A 48 58.959 -24.238 4.728 1.00 0.00 H new ATOM 0 HB3 LYS A 48 59.975 -25.027 5.919 1.00 0.00 H new ATOM 0 HG2 LYS A 48 57.776 -26.123 5.897 1.00 0.00 H new ATOM 0 HG3 LYS A 48 57.983 -25.300 7.430 1.00 0.00 H new ATOM 0 HD2 LYS A 48 56.499 -23.518 6.820 1.00 0.00 H new ATOM 0 HD3 LYS A 48 56.622 -23.876 5.108 1.00 0.00 H new ATOM 0 HE2 LYS A 48 54.453 -24.702 5.969 1.00 0.00 H new ATOM 0 HE3 LYS A 48 55.441 -26.062 5.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 54.362 -26.289 7.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 56.046 -26.506 7.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 55.373 -25.049 8.276 1.00 0.00 H new ATOM 802 N GLU A 49 60.735 -23.399 8.451 1.00 0.00 N ATOM 803 CA GLU A 49 60.996 -23.650 9.906 1.00 0.00 C ATOM 804 C GLU A 49 61.384 -22.346 10.608 1.00 0.00 C ATOM 805 O GLU A 49 62.167 -21.564 10.105 1.00 0.00 O ATOM 806 CB GLU A 49 62.143 -24.655 10.043 1.00 0.00 C ATOM 807 CG GLU A 49 61.679 -26.032 9.563 1.00 0.00 C ATOM 808 CD GLU A 49 60.655 -26.602 10.545 1.00 0.00 C ATOM 809 OE1 GLU A 49 60.759 -26.302 11.723 1.00 0.00 O ATOM 810 OE2 GLU A 49 59.785 -27.334 10.103 1.00 0.00 O ATOM 0 H GLU A 49 61.570 -23.324 7.870 1.00 0.00 H new ATOM 0 HA GLU A 49 60.091 -24.046 10.367 1.00 0.00 H new ATOM 0 HB2 GLU A 49 63.001 -24.325 9.458 1.00 0.00 H new ATOM 0 HB3 GLU A 49 62.468 -24.711 11.082 1.00 0.00 H new ATOM 0 HG2 GLU A 49 61.239 -25.952 8.569 1.00 0.00 H new ATOM 0 HG3 GLU A 49 62.532 -26.705 9.480 1.00 0.00 H new ATOM 817 N GLN A 50 60.842 -22.110 11.775 1.00 0.00 N ATOM 818 CA GLN A 50 61.179 -20.863 12.521 1.00 0.00 C ATOM 819 C GLN A 50 62.634 -20.925 12.992 1.00 0.00 C ATOM 820 O GLN A 50 63.345 -19.942 12.974 1.00 0.00 O ATOM 821 CB GLN A 50 60.251 -20.727 13.733 1.00 0.00 C ATOM 822 CG GLN A 50 58.811 -20.521 13.256 1.00 0.00 C ATOM 823 CD GLN A 50 58.689 -19.158 12.569 1.00 0.00 C ATOM 824 OE1 GLN A 50 59.261 -18.184 13.018 1.00 0.00 O ATOM 825 NE2 GLN A 50 57.964 -19.049 11.488 1.00 0.00 N ATOM 0 H GLN A 50 60.180 -22.729 12.243 1.00 0.00 H new ATOM 0 HA GLN A 50 61.049 -20.001 11.866 1.00 0.00 H new ATOM 0 HB2 GLN A 50 60.315 -21.620 14.355 1.00 0.00 H new ATOM 0 HB3 GLN A 50 60.564 -19.885 14.351 1.00 0.00 H new ATOM 0 HG2 GLN A 50 58.529 -21.315 12.564 1.00 0.00 H new ATOM 0 HG3 GLN A 50 58.125 -20.576 14.102 1.00 0.00 H new ATOM 0 HE21 GLN A 50 57.484 -19.866 11.111 1.00 0.00 H new ATOM 0 HE22 GLN A 50 57.878 -18.147 11.021 1.00 0.00 H new ATOM 834 N GLU A 51 63.070 -22.070 13.436 1.00 0.00 N ATOM 835 CA GLU A 51 64.469 -22.203 13.939 1.00 0.00 C ATOM 836 C GLU A 51 65.453 -21.718 12.870 1.00 0.00 C ATOM 837 O GLU A 51 66.494 -21.172 13.178 1.00 0.00 O ATOM 838 CB GLU A 51 64.753 -23.673 14.257 1.00 0.00 C ATOM 839 CG GLU A 51 63.889 -24.117 15.441 1.00 0.00 C ATOM 840 CD GLU A 51 64.365 -23.418 16.715 1.00 0.00 C ATOM 841 OE1 GLU A 51 65.559 -23.194 16.833 1.00 0.00 O ATOM 842 OE2 GLU A 51 63.529 -23.118 17.551 1.00 0.00 O ATOM 0 H GLU A 51 62.516 -22.925 13.473 1.00 0.00 H new ATOM 0 HA GLU A 51 64.588 -21.600 14.839 1.00 0.00 H new ATOM 0 HB2 GLU A 51 64.540 -24.292 13.386 1.00 0.00 H new ATOM 0 HB3 GLU A 51 65.809 -23.807 14.493 1.00 0.00 H new ATOM 0 HG2 GLU A 51 62.843 -23.876 15.251 1.00 0.00 H new ATOM 0 HG3 GLU A 51 63.950 -25.198 15.563 1.00 0.00 H new ATOM 849 N VAL A 52 65.124 -21.886 11.623 1.00 0.00 N ATOM 850 CA VAL A 52 66.027 -21.408 10.538 1.00 0.00 C ATOM 851 C VAL A 52 66.123 -19.882 10.612 1.00 0.00 C ATOM 852 O VAL A 52 67.153 -19.298 10.340 1.00 0.00 O ATOM 853 CB VAL A 52 65.461 -21.833 9.179 1.00 0.00 C ATOM 854 CG1 VAL A 52 66.234 -21.142 8.051 1.00 0.00 C ATOM 855 CG2 VAL A 52 65.595 -23.351 9.026 1.00 0.00 C ATOM 0 H VAL A 52 64.265 -22.335 11.305 1.00 0.00 H new ATOM 0 HA VAL A 52 67.020 -21.842 10.658 1.00 0.00 H new ATOM 0 HB VAL A 52 64.411 -21.546 9.124 1.00 0.00 H new ATOM 0 HG11 VAL A 52 65.825 -21.450 7.088 1.00 0.00 H new ATOM 0 HG12 VAL A 52 66.142 -20.061 8.156 1.00 0.00 H new ATOM 0 HG13 VAL A 52 67.286 -21.423 8.105 1.00 0.00 H new ATOM 0 HG21 VAL A 52 65.193 -23.656 8.060 1.00 0.00 H new ATOM 0 HG22 VAL A 52 66.647 -23.631 9.086 1.00 0.00 H new ATOM 0 HG23 VAL A 52 65.041 -23.847 9.823 1.00 0.00 H new ATOM 865 N VAL A 53 65.057 -19.234 10.999 1.00 0.00 N ATOM 866 CA VAL A 53 65.095 -17.750 11.111 1.00 0.00 C ATOM 867 C VAL A 53 65.986 -17.375 12.296 1.00 0.00 C ATOM 868 O VAL A 53 66.803 -16.480 12.217 1.00 0.00 O ATOM 869 CB VAL A 53 63.678 -17.204 11.352 1.00 0.00 C ATOM 870 CG1 VAL A 53 63.750 -15.709 11.708 1.00 0.00 C ATOM 871 CG2 VAL A 53 62.825 -17.398 10.091 1.00 0.00 C ATOM 0 H VAL A 53 64.166 -19.667 11.241 1.00 0.00 H new ATOM 0 HA VAL A 53 65.488 -17.323 10.188 1.00 0.00 H new ATOM 0 HB VAL A 53 63.221 -17.747 12.179 1.00 0.00 H new ATOM 0 HG11 VAL A 53 62.744 -15.327 11.878 1.00 0.00 H new ATOM 0 HG12 VAL A 53 64.345 -15.578 12.612 1.00 0.00 H new ATOM 0 HG13 VAL A 53 64.212 -15.161 10.887 1.00 0.00 H new ATOM 0 HG21 VAL A 53 61.822 -17.010 10.267 1.00 0.00 H new ATOM 0 HG22 VAL A 53 63.280 -16.863 9.258 1.00 0.00 H new ATOM 0 HG23 VAL A 53 62.766 -18.460 9.851 1.00 0.00 H new ATOM 881 N ASP A 54 65.818 -18.054 13.397 1.00 0.00 N ATOM 882 CA ASP A 54 66.630 -17.747 14.610 1.00 0.00 C ATOM 883 C ASP A 54 68.116 -17.936 14.303 1.00 0.00 C ATOM 884 O ASP A 54 68.929 -17.073 14.569 1.00 0.00 O ATOM 885 CB ASP A 54 66.210 -18.690 15.742 1.00 0.00 C ATOM 886 CG ASP A 54 67.025 -18.397 17.006 1.00 0.00 C ATOM 887 OD1 ASP A 54 68.073 -17.785 16.891 1.00 0.00 O ATOM 888 OD2 ASP A 54 66.582 -18.790 18.074 1.00 0.00 O ATOM 0 H ASP A 54 65.148 -18.815 13.510 1.00 0.00 H new ATOM 0 HA ASP A 54 66.462 -16.713 14.911 1.00 0.00 H new ATOM 0 HB2 ASP A 54 65.147 -18.569 15.950 1.00 0.00 H new ATOM 0 HB3 ASP A 54 66.359 -19.726 15.436 1.00 0.00 H new ATOM 893 N LYS A 55 68.479 -19.048 13.738 1.00 0.00 N ATOM 894 CA LYS A 55 69.914 -19.266 13.410 1.00 0.00 C ATOM 895 C LYS A 55 70.360 -18.169 12.448 1.00 0.00 C ATOM 896 O LYS A 55 71.363 -17.513 12.647 1.00 0.00 O ATOM 897 CB LYS A 55 70.093 -20.635 12.754 1.00 0.00 C ATOM 898 CG LYS A 55 71.586 -20.958 12.643 1.00 0.00 C ATOM 899 CD LYS A 55 71.777 -22.296 11.918 1.00 0.00 C ATOM 900 CE LYS A 55 71.093 -23.432 12.693 1.00 0.00 C ATOM 901 NZ LYS A 55 71.255 -23.220 14.160 1.00 0.00 N ATOM 0 H LYS A 55 67.851 -19.812 13.489 1.00 0.00 H new ATOM 0 HA LYS A 55 70.515 -19.233 14.319 1.00 0.00 H new ATOM 0 HB2 LYS A 55 69.587 -21.401 13.342 1.00 0.00 H new ATOM 0 HB3 LYS A 55 69.635 -20.639 11.765 1.00 0.00 H new ATOM 0 HG2 LYS A 55 72.100 -20.164 12.101 1.00 0.00 H new ATOM 0 HG3 LYS A 55 72.032 -21.006 13.637 1.00 0.00 H new ATOM 0 HD2 LYS A 55 71.362 -22.233 10.912 1.00 0.00 H new ATOM 0 HD3 LYS A 55 72.841 -22.510 11.812 1.00 0.00 H new ATOM 0 HE2 LYS A 55 70.034 -23.471 12.438 1.00 0.00 H new ATOM 0 HE3 LYS A 55 71.525 -24.391 12.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 71.138 -24.126 14.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 72.203 -22.839 14.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 70.537 -22.547 14.495 1.00 0.00 H new ATOM 915 N VAL A 56 69.605 -17.966 11.406 1.00 0.00 N ATOM 916 CA VAL A 56 69.959 -16.911 10.421 1.00 0.00 C ATOM 917 C VAL A 56 69.942 -15.550 11.114 1.00 0.00 C ATOM 918 O VAL A 56 70.792 -14.715 10.879 1.00 0.00 O ATOM 919 CB VAL A 56 68.937 -16.919 9.275 1.00 0.00 C ATOM 920 CG1 VAL A 56 69.138 -15.684 8.383 1.00 0.00 C ATOM 921 CG2 VAL A 56 69.126 -18.186 8.436 1.00 0.00 C ATOM 0 H VAL A 56 68.755 -18.488 11.194 1.00 0.00 H new ATOM 0 HA VAL A 56 70.954 -17.102 10.018 1.00 0.00 H new ATOM 0 HB VAL A 56 67.931 -16.899 9.693 1.00 0.00 H new ATOM 0 HG11 VAL A 56 68.409 -15.698 7.573 1.00 0.00 H new ATOM 0 HG12 VAL A 56 69.003 -14.780 8.977 1.00 0.00 H new ATOM 0 HG13 VAL A 56 70.145 -15.697 7.965 1.00 0.00 H new ATOM 0 HG21 VAL A 56 68.402 -18.194 7.622 1.00 0.00 H new ATOM 0 HG22 VAL A 56 70.135 -18.203 8.024 1.00 0.00 H new ATOM 0 HG23 VAL A 56 68.976 -19.064 9.064 1.00 0.00 H new ATOM 931 N MET A 57 68.979 -15.317 11.962 1.00 0.00 N ATOM 932 CA MET A 57 68.908 -14.002 12.657 1.00 0.00 C ATOM 933 C MET A 57 70.181 -13.782 13.476 1.00 0.00 C ATOM 934 O MET A 57 70.816 -12.752 13.386 1.00 0.00 O ATOM 935 CB MET A 57 67.686 -13.975 13.582 1.00 0.00 C ATOM 936 CG MET A 57 67.459 -12.553 14.103 1.00 0.00 C ATOM 937 SD MET A 57 66.638 -11.572 12.820 1.00 0.00 S ATOM 938 CE MET A 57 66.616 -9.997 13.711 1.00 0.00 C ATOM 0 H MET A 57 68.241 -15.978 12.203 1.00 0.00 H new ATOM 0 HA MET A 57 68.817 -13.207 11.917 1.00 0.00 H new ATOM 0 HB2 MET A 57 66.803 -14.320 13.043 1.00 0.00 H new ATOM 0 HB3 MET A 57 67.836 -14.658 14.418 1.00 0.00 H new ATOM 0 HG2 MET A 57 66.849 -12.577 15.006 1.00 0.00 H new ATOM 0 HG3 MET A 57 68.411 -12.096 14.374 1.00 0.00 H new ATOM 0 HE1 MET A 57 65.658 -9.502 13.551 1.00 0.00 H new ATOM 0 HE2 MET A 57 66.756 -10.180 14.776 1.00 0.00 H new ATOM 0 HE3 MET A 57 67.420 -9.360 13.343 1.00 0.00 H new ATOM 948 N GLU A 58 70.563 -14.743 14.272 1.00 0.00 N ATOM 949 CA GLU A 58 71.798 -14.582 15.089 1.00 0.00 C ATOM 950 C GLU A 58 72.988 -14.368 14.152 1.00 0.00 C ATOM 951 O GLU A 58 73.839 -13.533 14.385 1.00 0.00 O ATOM 952 CB GLU A 58 72.017 -15.840 15.940 1.00 0.00 C ATOM 953 CG GLU A 58 73.245 -15.665 16.842 1.00 0.00 C ATOM 954 CD GLU A 58 73.020 -14.504 17.815 1.00 0.00 C ATOM 955 OE1 GLU A 58 71.872 -14.146 18.027 1.00 0.00 O ATOM 956 OE2 GLU A 58 73.999 -13.994 18.334 1.00 0.00 O ATOM 0 H GLU A 58 70.074 -15.630 14.392 1.00 0.00 H new ATOM 0 HA GLU A 58 71.698 -13.722 15.751 1.00 0.00 H new ATOM 0 HB2 GLU A 58 71.134 -16.033 16.549 1.00 0.00 H new ATOM 0 HB3 GLU A 58 72.153 -16.706 15.293 1.00 0.00 H new ATOM 0 HG2 GLU A 58 73.433 -16.584 17.397 1.00 0.00 H new ATOM 0 HG3 GLU A 58 74.129 -15.474 16.234 1.00 0.00 H new ATOM 963 N THR A 59 73.038 -15.110 13.083 1.00 0.00 N ATOM 964 CA THR A 59 74.153 -14.955 12.107 1.00 0.00 C ATOM 965 C THR A 59 74.054 -13.581 11.439 1.00 0.00 C ATOM 966 O THR A 59 75.043 -12.914 11.206 1.00 0.00 O ATOM 967 CB THR A 59 74.048 -16.050 11.040 1.00 0.00 C ATOM 968 OG1 THR A 59 74.134 -17.325 11.659 1.00 0.00 O ATOM 969 CG2 THR A 59 75.183 -15.895 10.025 1.00 0.00 C ATOM 0 H THR A 59 72.350 -15.823 12.841 1.00 0.00 H new ATOM 0 HA THR A 59 75.108 -15.041 12.625 1.00 0.00 H new ATOM 0 HB THR A 59 73.092 -15.960 10.525 1.00 0.00 H new ATOM 0 HG1 THR A 59 73.268 -17.555 12.056 1.00 0.00 H new ATOM 0 HG21 THR A 59 75.104 -16.676 9.269 1.00 0.00 H new ATOM 0 HG22 THR A 59 75.113 -14.918 9.547 1.00 0.00 H new ATOM 0 HG23 THR A 59 76.142 -15.981 10.536 1.00 0.00 H new ATOM 977 N LEU A 60 72.860 -13.164 11.127 1.00 0.00 N ATOM 978 CA LEU A 60 72.670 -11.840 10.468 1.00 0.00 C ATOM 979 C LEU A 60 72.939 -10.711 11.475 1.00 0.00 C ATOM 980 O LEU A 60 73.540 -9.705 11.152 1.00 0.00 O ATOM 981 CB LEU A 60 71.223 -11.756 9.939 1.00 0.00 C ATOM 982 CG LEU A 60 71.115 -10.815 8.724 1.00 0.00 C ATOM 983 CD1 LEU A 60 71.699 -9.439 9.056 1.00 0.00 C ATOM 984 CD2 LEU A 60 71.851 -11.414 7.505 1.00 0.00 C ATOM 0 H LEU A 60 72.001 -13.686 11.301 1.00 0.00 H new ATOM 0 HA LEU A 60 73.369 -11.731 9.638 1.00 0.00 H new ATOM 0 HB2 LEU A 60 70.879 -12.752 9.660 1.00 0.00 H new ATOM 0 HB3 LEU A 60 70.565 -11.402 10.733 1.00 0.00 H new ATOM 0 HG LEU A 60 70.059 -10.701 8.478 1.00 0.00 H new ATOM 0 HD11 LEU A 60 71.614 -8.788 8.186 1.00 0.00 H new ATOM 0 HD12 LEU A 60 71.150 -9.003 9.891 1.00 0.00 H new ATOM 0 HD13 LEU A 60 72.749 -9.545 9.328 1.00 0.00 H new ATOM 0 HD21 LEU A 60 71.763 -10.735 6.657 1.00 0.00 H new ATOM 0 HD22 LEU A 60 72.904 -11.556 7.749 1.00 0.00 H new ATOM 0 HD23 LEU A 60 71.406 -12.375 7.247 1.00 0.00 H new ATOM 996 N ASP A 61 72.485 -10.862 12.686 1.00 0.00 N ATOM 997 CA ASP A 61 72.693 -9.786 13.701 1.00 0.00 C ATOM 998 C ASP A 61 74.178 -9.641 14.037 1.00 0.00 C ATOM 999 O ASP A 61 74.721 -10.382 14.831 1.00 0.00 O ATOM 1000 CB ASP A 61 71.929 -10.138 14.977 1.00 0.00 C ATOM 1001 CG ASP A 61 70.424 -10.044 14.716 1.00 0.00 C ATOM 1002 OD1 ASP A 61 70.053 -9.504 13.687 1.00 0.00 O ATOM 1003 OD2 ASP A 61 69.668 -10.511 15.553 1.00 0.00 O ATOM 0 H ASP A 61 71.979 -11.682 13.020 1.00 0.00 H new ATOM 0 HA ASP A 61 72.328 -8.845 13.289 1.00 0.00 H new ATOM 0 HB2 ASP A 61 72.190 -11.145 15.303 1.00 0.00 H new ATOM 0 HB3 ASP A 61 72.212 -9.459 15.781 1.00 0.00 H new ATOM 1008 N GLU A 62 74.831 -8.675 13.456 1.00 0.00 N ATOM 1009 CA GLU A 62 76.273 -8.462 13.762 1.00 0.00 C ATOM 1010 C GLU A 62 76.412 -8.028 15.222 1.00 0.00 C ATOM 1011 O GLU A 62 77.322 -8.432 15.919 1.00 0.00 O ATOM 1012 CB GLU A 62 76.845 -7.384 12.838 1.00 0.00 C ATOM 1013 CG GLU A 62 76.927 -7.926 11.411 1.00 0.00 C ATOM 1014 CD GLU A 62 78.022 -8.992 11.336 1.00 0.00 C ATOM 1015 OE1 GLU A 62 78.832 -9.043 12.247 1.00 0.00 O ATOM 1016 OE2 GLU A 62 78.029 -9.742 10.374 1.00 0.00 O ATOM 0 H GLU A 62 74.429 -8.023 12.782 1.00 0.00 H new ATOM 0 HA GLU A 62 76.825 -9.388 13.603 1.00 0.00 H new ATOM 0 HB2 GLU A 62 76.215 -6.495 12.865 1.00 0.00 H new ATOM 0 HB3 GLU A 62 77.835 -7.083 13.182 1.00 0.00 H new ATOM 0 HG2 GLU A 62 75.968 -8.352 11.116 1.00 0.00 H new ATOM 0 HG3 GLU A 62 77.144 -7.116 10.714 1.00 0.00 H new ATOM 1023 N ASP A 63 75.519 -7.193 15.682 1.00 0.00 N ATOM 1024 CA ASP A 63 75.589 -6.711 17.091 1.00 0.00 C ATOM 1025 C ASP A 63 74.871 -7.692 18.028 1.00 0.00 C ATOM 1026 O ASP A 63 74.979 -7.597 19.235 1.00 0.00 O ATOM 1027 CB ASP A 63 74.913 -5.341 17.173 1.00 0.00 C ATOM 1028 CG ASP A 63 73.453 -5.469 16.734 1.00 0.00 C ATOM 1029 OD1 ASP A 63 73.108 -6.505 16.187 1.00 0.00 O ATOM 1030 OD2 ASP A 63 72.709 -4.526 16.940 1.00 0.00 O ATOM 0 H ASP A 63 74.740 -6.822 15.138 1.00 0.00 H new ATOM 0 HA ASP A 63 76.632 -6.638 17.398 1.00 0.00 H new ATOM 0 HB2 ASP A 63 74.966 -4.957 18.192 1.00 0.00 H new ATOM 0 HB3 ASP A 63 75.435 -4.627 16.536 1.00 0.00 H new ATOM 1035 N GLY A 64 74.145 -8.637 17.491 1.00 0.00 N ATOM 1036 CA GLY A 64 73.436 -9.617 18.365 1.00 0.00 C ATOM 1037 C GLY A 64 72.320 -8.918 19.151 1.00 0.00 C ATOM 1038 O GLY A 64 71.930 -9.362 20.214 1.00 0.00 O ATOM 0 H GLY A 64 74.013 -8.772 16.489 1.00 0.00 H new ATOM 0 HA2 GLY A 64 73.015 -10.419 17.758 1.00 0.00 H new ATOM 0 HA3 GLY A 64 74.143 -10.077 19.055 1.00 0.00 H new ATOM 1042 N ASP A 65 71.812 -7.822 18.654 1.00 0.00 N ATOM 1043 CA ASP A 65 70.736 -7.096 19.394 1.00 0.00 C ATOM 1044 C ASP A 65 69.420 -7.873 19.312 1.00 0.00 C ATOM 1045 O ASP A 65 68.447 -7.523 19.952 1.00 0.00 O ATOM 1046 CB ASP A 65 70.538 -5.709 18.783 1.00 0.00 C ATOM 1047 CG ASP A 65 70.090 -5.849 17.326 1.00 0.00 C ATOM 1048 OD1 ASP A 65 70.283 -6.917 16.767 1.00 0.00 O ATOM 1049 OD2 ASP A 65 69.558 -4.887 16.796 1.00 0.00 O ATOM 0 H ASP A 65 72.094 -7.398 17.770 1.00 0.00 H new ATOM 0 HA ASP A 65 71.033 -7.001 20.439 1.00 0.00 H new ATOM 0 HB2 ASP A 65 69.792 -5.153 19.351 1.00 0.00 H new ATOM 0 HB3 ASP A 65 71.467 -5.141 18.835 1.00 0.00 H new ATOM 1054 N GLY A 66 69.379 -8.934 18.559 1.00 0.00 N ATOM 1055 CA GLY A 66 68.123 -9.735 18.473 1.00 0.00 C ATOM 1056 C GLY A 66 67.118 -9.068 17.531 1.00 0.00 C ATOM 1057 O GLY A 66 66.106 -9.648 17.189 1.00 0.00 O ATOM 0 H GLY A 66 70.157 -9.283 18.000 1.00 0.00 H new ATOM 0 HA2 GLY A 66 68.351 -10.740 18.117 1.00 0.00 H new ATOM 0 HA3 GLY A 66 67.684 -9.840 19.465 1.00 0.00 H new ATOM 1061 N GLU A 67 67.382 -7.863 17.096 1.00 0.00 N ATOM 1062 CA GLU A 67 66.450 -7.157 16.168 1.00 0.00 C ATOM 1063 C GLU A 67 67.293 -6.461 15.100 1.00 0.00 C ATOM 1064 O GLU A 67 68.487 -6.316 15.261 1.00 0.00 O ATOM 1065 CB GLU A 67 65.638 -6.123 16.958 1.00 0.00 C ATOM 1066 CG GLU A 67 66.546 -4.980 17.430 1.00 0.00 C ATOM 1067 CD GLU A 67 65.774 -4.094 18.412 1.00 0.00 C ATOM 1068 OE1 GLU A 67 65.101 -4.640 19.270 1.00 0.00 O ATOM 1069 OE2 GLU A 67 65.874 -2.883 18.291 1.00 0.00 O ATOM 0 H GLU A 67 68.215 -7.332 17.348 1.00 0.00 H new ATOM 0 HA GLU A 67 65.759 -7.858 15.700 1.00 0.00 H new ATOM 0 HB2 GLU A 67 64.837 -5.726 16.334 1.00 0.00 H new ATOM 0 HB3 GLU A 67 65.166 -6.600 17.817 1.00 0.00 H new ATOM 0 HG2 GLU A 67 67.438 -5.383 17.910 1.00 0.00 H new ATOM 0 HG3 GLU A 67 66.882 -4.391 16.577 1.00 0.00 H new ATOM 1076 N CYS A 68 66.704 -6.035 14.005 1.00 0.00 N ATOM 1077 CA CYS A 68 67.507 -5.358 12.933 1.00 0.00 C ATOM 1078 C CYS A 68 67.159 -3.867 12.877 1.00 0.00 C ATOM 1079 O CYS A 68 66.088 -3.483 12.448 1.00 0.00 O ATOM 1080 CB CYS A 68 67.171 -5.999 11.586 1.00 0.00 C ATOM 1081 SG CYS A 68 68.241 -5.305 10.304 1.00 0.00 S ATOM 0 H CYS A 68 65.707 -6.126 13.808 1.00 0.00 H new ATOM 0 HA CYS A 68 68.569 -5.469 13.153 1.00 0.00 H new ATOM 0 HB2 CYS A 68 67.306 -7.079 11.642 1.00 0.00 H new ATOM 0 HB3 CYS A 68 66.125 -5.821 11.337 1.00 0.00 H new ATOM 0 HG CYS A 68 68.109 -5.993 9.209 1.00 0.00 H new ATOM 1087 N ASP A 69 68.053 -3.028 13.325 1.00 0.00 N ATOM 1088 CA ASP A 69 67.777 -1.563 13.317 1.00 0.00 C ATOM 1089 C ASP A 69 67.838 -1.014 11.889 1.00 0.00 C ATOM 1090 O ASP A 69 68.063 -1.733 10.936 1.00 0.00 O ATOM 1091 CB ASP A 69 68.804 -0.838 14.193 1.00 0.00 C ATOM 1092 CG ASP A 69 70.186 -0.914 13.543 1.00 0.00 C ATOM 1093 OD1 ASP A 69 70.369 -1.757 12.682 1.00 0.00 O ATOM 1094 OD2 ASP A 69 71.040 -0.127 13.919 1.00 0.00 O ATOM 0 H ASP A 69 68.965 -3.295 13.697 1.00 0.00 H new ATOM 0 HA ASP A 69 66.776 -1.394 13.715 1.00 0.00 H new ATOM 0 HB2 ASP A 69 68.511 0.204 14.326 1.00 0.00 H new ATOM 0 HB3 ASP A 69 68.833 -1.290 15.185 1.00 0.00 H new ATOM 1099 N PHE A 70 67.632 0.266 11.752 1.00 0.00 N ATOM 1100 CA PHE A 70 67.661 0.908 10.405 1.00 0.00 C ATOM 1101 C PHE A 70 69.036 0.709 9.752 1.00 0.00 C ATOM 1102 O PHE A 70 69.141 0.323 8.605 1.00 0.00 O ATOM 1103 CB PHE A 70 67.367 2.403 10.567 1.00 0.00 C ATOM 1104 CG PHE A 70 67.389 3.085 9.221 1.00 0.00 C ATOM 1105 CD1 PHE A 70 66.218 3.159 8.456 1.00 0.00 C ATOM 1106 CD2 PHE A 70 68.573 3.659 8.745 1.00 0.00 C ATOM 1107 CE1 PHE A 70 66.233 3.804 7.214 1.00 0.00 C ATOM 1108 CE2 PHE A 70 68.588 4.304 7.502 1.00 0.00 C ATOM 1109 CZ PHE A 70 67.418 4.375 6.736 1.00 0.00 C ATOM 0 H PHE A 70 67.442 0.904 12.525 1.00 0.00 H new ATOM 0 HA PHE A 70 66.908 0.450 9.764 1.00 0.00 H new ATOM 0 HB2 PHE A 70 66.393 2.541 11.037 1.00 0.00 H new ATOM 0 HB3 PHE A 70 68.107 2.858 11.226 1.00 0.00 H new ATOM 0 HD1 PHE A 70 65.303 2.718 8.825 1.00 0.00 H new ATOM 0 HD2 PHE A 70 69.475 3.605 9.336 1.00 0.00 H new ATOM 0 HE1 PHE A 70 65.330 3.861 6.624 1.00 0.00 H new ATOM 0 HE2 PHE A 70 69.502 4.747 7.134 1.00 0.00 H new ATOM 0 HZ PHE A 70 67.430 4.870 5.776 1.00 0.00 H new ATOM 1119 N GLN A 71 70.087 1.007 10.460 1.00 0.00 N ATOM 1120 CA GLN A 71 71.447 0.871 9.857 1.00 0.00 C ATOM 1121 C GLN A 71 71.671 -0.577 9.405 1.00 0.00 C ATOM 1122 O GLN A 71 71.994 -0.831 8.261 1.00 0.00 O ATOM 1123 CB GLN A 71 72.507 1.256 10.892 1.00 0.00 C ATOM 1124 CG GLN A 71 72.431 2.758 11.169 1.00 0.00 C ATOM 1125 CD GLN A 71 71.156 3.068 11.953 1.00 0.00 C ATOM 1126 OE1 GLN A 71 70.869 2.431 12.948 1.00 0.00 O ATOM 1127 NE2 GLN A 71 70.370 4.025 11.544 1.00 0.00 N ATOM 0 H GLN A 71 70.068 1.337 11.425 1.00 0.00 H new ATOM 0 HA GLN A 71 71.526 1.532 8.994 1.00 0.00 H new ATOM 0 HB2 GLN A 71 72.349 0.697 11.814 1.00 0.00 H new ATOM 0 HB3 GLN A 71 73.500 0.993 10.526 1.00 0.00 H new ATOM 0 HG2 GLN A 71 73.306 3.079 11.735 1.00 0.00 H new ATOM 0 HG3 GLN A 71 72.437 3.312 10.231 1.00 0.00 H new ATOM 0 HE21 GLN A 71 70.610 4.560 10.709 1.00 0.00 H new ATOM 0 HE22 GLN A 71 69.516 4.238 12.059 1.00 0.00 H new ATOM 1136 N GLU A 72 71.505 -1.528 10.281 1.00 0.00 N ATOM 1137 CA GLU A 72 71.718 -2.953 9.877 1.00 0.00 C ATOM 1138 C GLU A 72 70.738 -3.285 8.748 1.00 0.00 C ATOM 1139 O GLU A 72 71.063 -3.962 7.793 1.00 0.00 O ATOM 1140 CB GLU A 72 71.438 -3.857 11.083 1.00 0.00 C ATOM 1141 CG GLU A 72 71.659 -5.324 10.703 1.00 0.00 C ATOM 1142 CD GLU A 72 71.375 -6.208 11.920 1.00 0.00 C ATOM 1143 OE1 GLU A 72 71.217 -5.661 12.999 1.00 0.00 O ATOM 1144 OE2 GLU A 72 71.311 -7.413 11.750 1.00 0.00 O ATOM 0 H GLU A 72 71.233 -1.386 11.254 1.00 0.00 H new ATOM 0 HA GLU A 72 72.742 -3.108 9.538 1.00 0.00 H new ATOM 0 HB2 GLU A 72 72.093 -3.585 11.911 1.00 0.00 H new ATOM 0 HB3 GLU A 72 70.413 -3.712 11.426 1.00 0.00 H new ATOM 0 HG2 GLU A 72 71.004 -5.601 9.877 1.00 0.00 H new ATOM 0 HG3 GLU A 72 72.683 -5.473 10.361 1.00 0.00 H new ATOM 1151 N PHE A 73 69.535 -2.815 8.877 1.00 0.00 N ATOM 1152 CA PHE A 73 68.509 -3.102 7.839 1.00 0.00 C ATOM 1153 C PHE A 73 69.076 -2.739 6.466 1.00 0.00 C ATOM 1154 O PHE A 73 68.877 -3.443 5.496 1.00 0.00 O ATOM 1155 CB PHE A 73 67.241 -2.296 8.104 1.00 0.00 C ATOM 1156 CG PHE A 73 66.247 -2.584 7.005 1.00 0.00 C ATOM 1157 CD1 PHE A 73 65.538 -3.787 7.005 1.00 0.00 C ATOM 1158 CD2 PHE A 73 66.042 -1.650 5.984 1.00 0.00 C ATOM 1159 CE1 PHE A 73 64.622 -4.060 5.983 1.00 0.00 C ATOM 1160 CE2 PHE A 73 65.125 -1.921 4.960 1.00 0.00 C ATOM 1161 CZ PHE A 73 64.415 -3.128 4.960 1.00 0.00 C ATOM 0 H PHE A 73 69.214 -2.242 9.658 1.00 0.00 H new ATOM 0 HA PHE A 73 68.255 -4.162 7.868 1.00 0.00 H new ATOM 0 HB2 PHE A 73 66.820 -2.562 9.074 1.00 0.00 H new ATOM 0 HB3 PHE A 73 67.470 -1.231 8.137 1.00 0.00 H new ATOM 0 HD1 PHE A 73 65.697 -4.507 7.794 1.00 0.00 H new ATOM 0 HD2 PHE A 73 66.591 -0.720 5.985 1.00 0.00 H new ATOM 0 HE1 PHE A 73 64.074 -4.991 5.984 1.00 0.00 H new ATOM 0 HE2 PHE A 73 64.966 -1.200 4.172 1.00 0.00 H new ATOM 0 HZ PHE A 73 63.708 -3.339 4.171 1.00 0.00 H new ATOM 1171 N MET A 74 69.792 -1.655 6.377 1.00 0.00 N ATOM 1172 CA MET A 74 70.386 -1.258 5.069 1.00 0.00 C ATOM 1173 C MET A 74 71.436 -2.301 4.660 1.00 0.00 C ATOM 1174 O MET A 74 71.682 -2.526 3.492 1.00 0.00 O ATOM 1175 CB MET A 74 71.051 0.115 5.202 1.00 0.00 C ATOM 1176 CG MET A 74 71.437 0.634 3.815 1.00 0.00 C ATOM 1177 SD MET A 74 69.942 1.125 2.920 1.00 0.00 S ATOM 1178 CE MET A 74 70.584 0.876 1.248 1.00 0.00 C ATOM 0 H MET A 74 69.993 -1.025 7.154 1.00 0.00 H new ATOM 0 HA MET A 74 69.605 -1.205 4.311 1.00 0.00 H new ATOM 0 HB2 MET A 74 70.370 0.815 5.687 1.00 0.00 H new ATOM 0 HB3 MET A 74 71.936 0.042 5.834 1.00 0.00 H new ATOM 0 HG2 MET A 74 72.114 1.483 3.908 1.00 0.00 H new ATOM 0 HG3 MET A 74 71.969 -0.139 3.260 1.00 0.00 H new ATOM 0 HE1 MET A 74 69.836 1.192 0.520 1.00 0.00 H new ATOM 0 HE2 MET A 74 71.491 1.465 1.115 1.00 0.00 H new ATOM 0 HE3 MET A 74 70.812 -0.180 1.099 1.00 0.00 H new ATOM 1188 N ALA A 75 72.044 -2.946 5.621 1.00 0.00 N ATOM 1189 CA ALA A 75 73.065 -3.988 5.294 1.00 0.00 C ATOM 1190 C ALA A 75 72.366 -5.160 4.599 1.00 0.00 C ATOM 1191 O ALA A 75 72.744 -5.585 3.524 1.00 0.00 O ATOM 1192 CB ALA A 75 73.731 -4.473 6.586 1.00 0.00 C ATOM 0 H ALA A 75 71.879 -2.798 6.617 1.00 0.00 H new ATOM 0 HA ALA A 75 73.828 -3.572 4.636 1.00 0.00 H new ATOM 0 HB1 ALA A 75 74.476 -5.233 6.348 1.00 0.00 H new ATOM 0 HB2 ALA A 75 74.216 -3.633 7.083 1.00 0.00 H new ATOM 0 HB3 ALA A 75 72.976 -4.899 7.247 1.00 0.00 H new ATOM 1198 N PHE A 76 71.347 -5.682 5.223 1.00 0.00 N ATOM 1199 CA PHE A 76 70.605 -6.832 4.628 1.00 0.00 C ATOM 1200 C PHE A 76 70.256 -6.478 3.183 1.00 0.00 C ATOM 1201 O PHE A 76 70.365 -7.285 2.281 1.00 0.00 O ATOM 1202 CB PHE A 76 69.318 -7.056 5.424 1.00 0.00 C ATOM 1203 CG PHE A 76 68.670 -8.347 4.998 1.00 0.00 C ATOM 1204 CD1 PHE A 76 67.772 -8.358 3.926 1.00 0.00 C ATOM 1205 CD2 PHE A 76 68.966 -9.531 5.678 1.00 0.00 C ATOM 1206 CE1 PHE A 76 67.166 -9.561 3.536 1.00 0.00 C ATOM 1207 CE2 PHE A 76 68.364 -10.732 5.291 1.00 0.00 C ATOM 1208 CZ PHE A 76 67.463 -10.748 4.220 1.00 0.00 C ATOM 0 H PHE A 76 70.993 -5.361 6.124 1.00 0.00 H new ATOM 0 HA PHE A 76 71.211 -7.738 4.656 1.00 0.00 H new ATOM 0 HB2 PHE A 76 69.540 -7.085 6.491 1.00 0.00 H new ATOM 0 HB3 PHE A 76 68.632 -6.224 5.264 1.00 0.00 H new ATOM 0 HD1 PHE A 76 67.546 -7.442 3.400 1.00 0.00 H new ATOM 0 HD2 PHE A 76 69.661 -9.518 6.504 1.00 0.00 H new ATOM 0 HE1 PHE A 76 66.471 -9.573 2.709 1.00 0.00 H new ATOM 0 HE2 PHE A 76 68.594 -11.646 5.818 1.00 0.00 H new ATOM 0 HZ PHE A 76 66.997 -11.675 3.921 1.00 0.00 H new ATOM 1218 N VAL A 77 69.878 -5.255 2.967 1.00 0.00 N ATOM 1219 CA VAL A 77 69.565 -4.810 1.584 1.00 0.00 C ATOM 1220 C VAL A 77 70.853 -4.894 0.765 1.00 0.00 C ATOM 1221 O VAL A 77 70.853 -5.327 -0.370 1.00 0.00 O ATOM 1222 CB VAL A 77 69.045 -3.369 1.601 1.00 0.00 C ATOM 1223 CG1 VAL A 77 68.959 -2.830 0.170 1.00 0.00 C ATOM 1224 CG2 VAL A 77 67.651 -3.345 2.232 1.00 0.00 C ATOM 0 H VAL A 77 69.771 -4.542 3.688 1.00 0.00 H new ATOM 0 HA VAL A 77 68.794 -5.443 1.145 1.00 0.00 H new ATOM 0 HB VAL A 77 69.727 -2.746 2.180 1.00 0.00 H new ATOM 0 HG11 VAL A 77 68.589 -1.805 0.189 1.00 0.00 H new ATOM 0 HG12 VAL A 77 69.949 -2.850 -0.286 1.00 0.00 H new ATOM 0 HG13 VAL A 77 68.278 -3.451 -0.412 1.00 0.00 H new ATOM 0 HG21 VAL A 77 67.276 -2.322 2.247 1.00 0.00 H new ATOM 0 HG22 VAL A 77 66.976 -3.970 1.648 1.00 0.00 H new ATOM 0 HG23 VAL A 77 67.707 -3.726 3.252 1.00 0.00 H new ATOM 1234 N SER A 78 71.957 -4.488 1.341 1.00 0.00 N ATOM 1235 CA SER A 78 73.249 -4.553 0.605 1.00 0.00 C ATOM 1236 C SER A 78 73.669 -6.012 0.442 1.00 0.00 C ATOM 1237 O SER A 78 74.050 -6.439 -0.625 1.00 0.00 O ATOM 1238 CB SER A 78 74.323 -3.809 1.399 1.00 0.00 C ATOM 1239 OG SER A 78 74.680 -4.578 2.541 1.00 0.00 O ATOM 0 H SER A 78 72.016 -4.115 2.289 1.00 0.00 H new ATOM 0 HA SER A 78 73.131 -4.093 -0.376 1.00 0.00 H new ATOM 0 HB2 SER A 78 75.199 -3.636 0.774 1.00 0.00 H new ATOM 0 HB3 SER A 78 73.953 -2.831 1.706 1.00 0.00 H new ATOM 0 HG SER A 78 73.880 -5.006 2.910 1.00 0.00 H new ATOM 1245 N MET A 79 73.627 -6.772 1.502 1.00 0.00 N ATOM 1246 CA MET A 79 74.053 -8.201 1.419 1.00 0.00 C ATOM 1247 C MET A 79 73.393 -8.858 0.210 1.00 0.00 C ATOM 1248 O MET A 79 74.012 -9.610 -0.516 1.00 0.00 O ATOM 1249 CB MET A 79 73.621 -8.927 2.695 1.00 0.00 C ATOM 1250 CG MET A 79 74.248 -10.321 2.740 1.00 0.00 C ATOM 1251 SD MET A 79 73.797 -11.126 4.301 1.00 0.00 S ATOM 1252 CE MET A 79 75.141 -12.339 4.366 1.00 0.00 C ATOM 0 H MET A 79 73.316 -6.466 2.424 1.00 0.00 H new ATOM 0 HA MET A 79 75.136 -8.257 1.314 1.00 0.00 H new ATOM 0 HB2 MET A 79 73.926 -8.354 3.571 1.00 0.00 H new ATOM 0 HB3 MET A 79 72.534 -9.006 2.728 1.00 0.00 H new ATOM 0 HG2 MET A 79 73.901 -10.917 1.896 1.00 0.00 H new ATOM 0 HG3 MET A 79 75.332 -10.248 2.654 1.00 0.00 H new ATOM 0 HE1 MET A 79 75.042 -12.944 5.267 1.00 0.00 H new ATOM 0 HE2 MET A 79 75.091 -12.984 3.489 1.00 0.00 H new ATOM 0 HE3 MET A 79 76.099 -11.820 4.381 1.00 0.00 H new ATOM 1262 N VAL A 80 72.154 -8.560 -0.031 1.00 0.00 N ATOM 1263 CA VAL A 80 71.474 -9.144 -1.213 1.00 0.00 C ATOM 1264 C VAL A 80 72.099 -8.527 -2.468 1.00 0.00 C ATOM 1265 O VAL A 80 72.154 -9.137 -3.516 1.00 0.00 O ATOM 1266 CB VAL A 80 69.970 -8.852 -1.150 1.00 0.00 C ATOM 1267 CG1 VAL A 80 69.292 -9.394 -2.413 1.00 0.00 C ATOM 1268 CG2 VAL A 80 69.377 -9.543 0.086 1.00 0.00 C ATOM 0 H VAL A 80 71.581 -7.937 0.539 1.00 0.00 H new ATOM 0 HA VAL A 80 71.600 -10.227 -1.233 1.00 0.00 H new ATOM 0 HB VAL A 80 69.805 -7.776 -1.085 1.00 0.00 H new ATOM 0 HG11 VAL A 80 68.223 -9.187 -2.369 1.00 0.00 H new ATOM 0 HG12 VAL A 80 69.720 -8.911 -3.291 1.00 0.00 H new ATOM 0 HG13 VAL A 80 69.451 -10.470 -2.478 1.00 0.00 H new ATOM 0 HG21 VAL A 80 68.307 -9.340 0.138 1.00 0.00 H new ATOM 0 HG22 VAL A 80 69.539 -10.618 0.015 1.00 0.00 H new ATOM 0 HG23 VAL A 80 69.863 -9.162 0.984 1.00 0.00 H new ATOM 1278 N THR A 81 72.609 -7.327 -2.343 1.00 0.00 N ATOM 1279 CA THR A 81 73.282 -6.664 -3.500 1.00 0.00 C ATOM 1280 C THR A 81 74.734 -7.161 -3.584 1.00 0.00 C ATOM 1281 O THR A 81 75.226 -7.519 -4.637 1.00 0.00 O ATOM 1282 CB THR A 81 73.276 -5.144 -3.296 1.00 0.00 C ATOM 1283 OG1 THR A 81 71.974 -4.725 -2.918 1.00 0.00 O ATOM 1284 CG2 THR A 81 73.678 -4.446 -4.599 1.00 0.00 C ATOM 0 H THR A 81 72.587 -6.776 -1.485 1.00 0.00 H new ATOM 0 HA THR A 81 72.752 -6.906 -4.421 1.00 0.00 H new ATOM 0 HB THR A 81 73.987 -4.882 -2.513 1.00 0.00 H new ATOM 0 HG1 THR A 81 71.326 -5.424 -3.147 1.00 0.00 H new ATOM 0 HG21 THR A 81 73.673 -3.366 -4.450 1.00 0.00 H new ATOM 0 HG22 THR A 81 74.678 -4.767 -4.890 1.00 0.00 H new ATOM 0 HG23 THR A 81 72.970 -4.707 -5.385 1.00 0.00 H new ATOM 1292 N THR A 82 75.419 -7.171 -2.468 1.00 0.00 N ATOM 1293 CA THR A 82 76.843 -7.623 -2.435 1.00 0.00 C ATOM 1294 C THR A 82 76.919 -9.130 -2.693 1.00 0.00 C ATOM 1295 O THR A 82 77.964 -9.660 -3.016 1.00 0.00 O ATOM 1296 CB THR A 82 77.445 -7.304 -1.057 1.00 0.00 C ATOM 1297 OG1 THR A 82 76.988 -6.029 -0.629 1.00 0.00 O ATOM 1298 CG2 THR A 82 78.976 -7.295 -1.145 1.00 0.00 C ATOM 0 H THR A 82 75.045 -6.880 -1.565 1.00 0.00 H new ATOM 0 HA THR A 82 77.405 -7.102 -3.210 1.00 0.00 H new ATOM 0 HB THR A 82 77.133 -8.066 -0.343 1.00 0.00 H new ATOM 0 HG1 THR A 82 77.369 -5.823 0.250 1.00 0.00 H new ATOM 0 HG21 THR A 82 79.395 -7.068 -0.165 1.00 0.00 H new ATOM 0 HG22 THR A 82 79.327 -8.273 -1.473 1.00 0.00 H new ATOM 0 HG23 THR A 82 79.295 -6.537 -1.860 1.00 0.00 H new ATOM 1306 N ALA A 83 75.824 -9.822 -2.566 1.00 0.00 N ATOM 1307 CA ALA A 83 75.849 -11.288 -2.822 1.00 0.00 C ATOM 1308 C ALA A 83 75.889 -11.519 -4.332 1.00 0.00 C ATOM 1309 O ALA A 83 76.844 -12.042 -4.870 1.00 0.00 O ATOM 1310 CB ALA A 83 74.588 -11.933 -2.242 1.00 0.00 C ATOM 0 H ALA A 83 74.917 -9.440 -2.298 1.00 0.00 H new ATOM 0 HA ALA A 83 76.726 -11.732 -2.351 1.00 0.00 H new ATOM 0 HB1 ALA A 83 74.609 -13.006 -2.431 1.00 0.00 H new ATOM 0 HB2 ALA A 83 74.549 -11.754 -1.167 1.00 0.00 H new ATOM 0 HB3 ALA A 83 73.707 -11.498 -2.714 1.00 0.00 H new ATOM 1316 N CYS A 84 74.849 -11.129 -5.013 1.00 0.00 N ATOM 1317 CA CYS A 84 74.808 -11.321 -6.490 1.00 0.00 C ATOM 1318 C CYS A 84 75.672 -10.254 -7.172 1.00 0.00 C ATOM 1319 O CYS A 84 75.172 -9.379 -7.850 1.00 0.00 O ATOM 1320 CB CYS A 84 73.364 -11.196 -6.978 1.00 0.00 C ATOM 1321 SG CYS A 84 72.405 -12.615 -6.390 1.00 0.00 S ATOM 0 H CYS A 84 74.024 -10.685 -4.611 1.00 0.00 H new ATOM 0 HA CYS A 84 75.193 -12.310 -6.738 1.00 0.00 H new ATOM 0 HB2 CYS A 84 72.924 -10.269 -6.612 1.00 0.00 H new ATOM 0 HB3 CYS A 84 73.339 -11.152 -8.067 1.00 0.00 H new ATOM 0 HG CYS A 84 71.375 -12.792 -7.162 1.00 0.00 H new ATOM 1327 N HIS A 85 76.966 -10.328 -7.006 1.00 0.00 N ATOM 1328 CA HIS A 85 77.864 -9.327 -7.652 1.00 0.00 C ATOM 1329 C HIS A 85 77.688 -9.387 -9.172 1.00 0.00 C ATOM 1330 O HIS A 85 77.675 -8.376 -9.846 1.00 0.00 O ATOM 1331 CB HIS A 85 79.318 -9.646 -7.294 1.00 0.00 C ATOM 1332 CG HIS A 85 80.237 -8.690 -8.005 1.00 0.00 C ATOM 1333 ND1 HIS A 85 80.406 -7.374 -7.597 1.00 0.00 N ATOM 1334 CD2 HIS A 85 81.044 -8.849 -9.105 1.00 0.00 C ATOM 1335 CE1 HIS A 85 81.286 -6.798 -8.440 1.00 0.00 C ATOM 1336 NE2 HIS A 85 81.702 -7.655 -9.374 1.00 0.00 N ATOM 0 H HIS A 85 77.440 -11.040 -6.450 1.00 0.00 H new ATOM 0 HA HIS A 85 77.611 -8.328 -7.298 1.00 0.00 H new ATOM 0 HB2 HIS A 85 79.462 -9.570 -6.216 1.00 0.00 H new ATOM 0 HB3 HIS A 85 79.555 -10.672 -7.576 1.00 0.00 H new ATOM 0 HD2 HIS A 85 81.151 -9.761 -9.673 1.00 0.00 H new ATOM 0 HE1 HIS A 85 81.613 -5.771 -8.368 1.00 0.00 H new ATOM 0 HE2 HIS A 85 82.364 -7.472 -10.128 1.00 0.00 H new ATOM 1345 N GLU A 86 77.557 -10.569 -9.714 1.00 0.00 N ATOM 1346 CA GLU A 86 77.385 -10.710 -11.189 1.00 0.00 C ATOM 1347 C GLU A 86 76.008 -10.174 -11.598 1.00 0.00 C ATOM 1348 O GLU A 86 75.025 -10.379 -10.915 1.00 0.00 O ATOM 1349 CB GLU A 86 77.490 -12.188 -11.575 1.00 0.00 C ATOM 1350 CG GLU A 86 78.892 -12.706 -11.241 1.00 0.00 C ATOM 1351 CD GLU A 86 79.913 -12.072 -12.188 1.00 0.00 C ATOM 1352 OE1 GLU A 86 79.515 -11.649 -13.260 1.00 0.00 O ATOM 1353 OE2 GLU A 86 81.076 -12.019 -11.823 1.00 0.00 O ATOM 0 H GLU A 86 77.562 -11.447 -9.195 1.00 0.00 H new ATOM 0 HA GLU A 86 78.163 -10.143 -11.701 1.00 0.00 H new ATOM 0 HB2 GLU A 86 76.739 -12.769 -11.039 1.00 0.00 H new ATOM 0 HB3 GLU A 86 77.289 -12.312 -12.639 1.00 0.00 H new ATOM 0 HG2 GLU A 86 79.142 -12.467 -10.207 1.00 0.00 H new ATOM 0 HG3 GLU A 86 78.921 -13.792 -11.333 1.00 0.00 H new ATOM 1360 N PHE A 87 75.931 -9.487 -12.706 1.00 0.00 N ATOM 1361 CA PHE A 87 74.618 -8.938 -13.156 1.00 0.00 C ATOM 1362 C PHE A 87 73.685 -10.094 -13.541 1.00 0.00 C ATOM 1363 O PHE A 87 74.095 -11.049 -14.169 1.00 0.00 O ATOM 1364 CB PHE A 87 74.843 -8.025 -14.368 1.00 0.00 C ATOM 1365 CG PHE A 87 73.526 -7.451 -14.836 1.00 0.00 C ATOM 1366 CD1 PHE A 87 73.018 -6.292 -14.236 1.00 0.00 C ATOM 1367 CD2 PHE A 87 72.812 -8.076 -15.865 1.00 0.00 C ATOM 1368 CE1 PHE A 87 71.798 -5.758 -14.665 1.00 0.00 C ATOM 1369 CE2 PHE A 87 71.590 -7.541 -16.293 1.00 0.00 C ATOM 1370 CZ PHE A 87 71.083 -6.382 -15.694 1.00 0.00 C ATOM 0 H PHE A 87 76.720 -9.282 -13.319 1.00 0.00 H new ATOM 0 HA PHE A 87 74.162 -8.364 -12.349 1.00 0.00 H new ATOM 0 HB2 PHE A 87 75.527 -7.218 -14.104 1.00 0.00 H new ATOM 0 HB3 PHE A 87 75.311 -8.588 -15.176 1.00 0.00 H new ATOM 0 HD1 PHE A 87 73.568 -5.810 -13.442 1.00 0.00 H new ATOM 0 HD2 PHE A 87 73.203 -8.970 -16.329 1.00 0.00 H new ATOM 0 HE1 PHE A 87 71.408 -4.864 -14.202 1.00 0.00 H new ATOM 0 HE2 PHE A 87 71.038 -8.024 -17.086 1.00 0.00 H new ATOM 0 HZ PHE A 87 70.141 -5.970 -16.025 1.00 0.00 H new ATOM 1380 N PHE A 88 72.435 -10.016 -13.163 1.00 0.00 N ATOM 1381 CA PHE A 88 71.478 -11.113 -13.501 1.00 0.00 C ATOM 1382 C PHE A 88 71.357 -11.245 -15.023 1.00 0.00 C ATOM 1383 O PHE A 88 71.356 -10.266 -15.740 1.00 0.00 O ATOM 1384 CB PHE A 88 70.103 -10.792 -12.904 1.00 0.00 C ATOM 1385 CG PHE A 88 70.115 -11.045 -11.412 1.00 0.00 C ATOM 1386 CD1 PHE A 88 70.482 -10.023 -10.529 1.00 0.00 C ATOM 1387 CD2 PHE A 88 69.757 -12.305 -10.914 1.00 0.00 C ATOM 1388 CE1 PHE A 88 70.491 -10.260 -9.148 1.00 0.00 C ATOM 1389 CE2 PHE A 88 69.765 -12.540 -9.534 1.00 0.00 C ATOM 1390 CZ PHE A 88 70.131 -11.518 -8.651 1.00 0.00 C ATOM 0 H PHE A 88 72.035 -9.240 -12.635 1.00 0.00 H new ATOM 0 HA PHE A 88 71.846 -12.052 -13.087 1.00 0.00 H new ATOM 0 HB2 PHE A 88 69.845 -9.752 -13.103 1.00 0.00 H new ATOM 0 HB3 PHE A 88 69.338 -11.407 -13.379 1.00 0.00 H new ATOM 0 HD1 PHE A 88 70.758 -9.052 -10.912 1.00 0.00 H new ATOM 0 HD2 PHE A 88 69.475 -13.095 -11.595 1.00 0.00 H new ATOM 0 HE1 PHE A 88 70.776 -9.472 -8.467 1.00 0.00 H new ATOM 0 HE2 PHE A 88 69.488 -13.511 -9.150 1.00 0.00 H new ATOM 0 HZ PHE A 88 70.136 -11.700 -7.586 1.00 0.00 H new ATOM 1400 N GLU A 89 71.257 -12.450 -15.520 1.00 0.00 N ATOM 1401 CA GLU A 89 71.142 -12.637 -16.995 1.00 0.00 C ATOM 1402 C GLU A 89 69.889 -11.923 -17.506 1.00 0.00 C ATOM 1403 O GLU A 89 68.849 -11.946 -16.879 1.00 0.00 O ATOM 1404 CB GLU A 89 71.034 -14.132 -17.313 1.00 0.00 C ATOM 1405 CG GLU A 89 72.328 -14.841 -16.913 1.00 0.00 C ATOM 1406 CD GLU A 89 73.457 -14.407 -17.848 1.00 0.00 C ATOM 1407 OE1 GLU A 89 73.168 -14.117 -18.997 1.00 0.00 O ATOM 1408 OE2 GLU A 89 74.591 -14.373 -17.399 1.00 0.00 O ATOM 0 H GLU A 89 71.250 -13.309 -14.970 1.00 0.00 H new ATOM 0 HA GLU A 89 72.024 -12.220 -17.481 1.00 0.00 H new ATOM 0 HB2 GLU A 89 70.190 -14.567 -16.778 1.00 0.00 H new ATOM 0 HB3 GLU A 89 70.844 -14.274 -18.377 1.00 0.00 H new ATOM 0 HG2 GLU A 89 72.583 -14.600 -15.881 1.00 0.00 H new ATOM 0 HG3 GLU A 89 72.194 -15.922 -16.964 1.00 0.00 H new ATOM 1415 N HIS A 90 69.984 -11.286 -18.640 1.00 0.00 N ATOM 1416 CA HIS A 90 68.804 -10.565 -19.196 1.00 0.00 C ATOM 1417 C HIS A 90 67.655 -11.547 -19.432 1.00 0.00 C ATOM 1418 O HIS A 90 66.503 -11.239 -19.194 1.00 0.00 O ATOM 1419 CB HIS A 90 69.188 -9.916 -20.526 1.00 0.00 C ATOM 1420 CG HIS A 90 67.998 -9.188 -21.085 1.00 0.00 C ATOM 1421 ND1 HIS A 90 67.044 -9.820 -21.871 1.00 0.00 N ATOM 1422 CD2 HIS A 90 67.588 -7.881 -20.977 1.00 0.00 C ATOM 1423 CE1 HIS A 90 66.117 -8.902 -22.200 1.00 0.00 C ATOM 1424 NE2 HIS A 90 66.404 -7.707 -21.680 1.00 0.00 N ATOM 0 H HIS A 90 70.830 -11.233 -19.207 1.00 0.00 H new ATOM 0 HA HIS A 90 68.486 -9.801 -18.487 1.00 0.00 H new ATOM 0 HB2 HIS A 90 70.017 -9.223 -20.380 1.00 0.00 H new ATOM 0 HB3 HIS A 90 69.528 -10.676 -21.230 1.00 0.00 H new ATOM 0 HD2 HIS A 90 68.107 -7.108 -20.429 1.00 0.00 H new ATOM 0 HE1 HIS A 90 65.249 -9.107 -22.809 1.00 0.00 H new ATOM 0 HE2 HIS A 90 65.866 -6.846 -21.779 1.00 0.00 H new ATOM 1433 N GLU A 91 67.957 -12.721 -19.912 1.00 0.00 N ATOM 1434 CA GLU A 91 66.883 -13.725 -20.185 1.00 0.00 C ATOM 1435 C GLU A 91 66.671 -14.607 -18.953 1.00 0.00 C ATOM 1436 O GLU A 91 65.523 -14.829 -18.602 1.00 0.00 O ATOM 1437 CB GLU A 91 67.307 -14.594 -21.369 1.00 0.00 C ATOM 1438 CG GLU A 91 67.293 -13.752 -22.647 1.00 0.00 C ATOM 1439 CD GLU A 91 67.721 -14.617 -23.832 1.00 0.00 C ATOM 1440 OE1 GLU A 91 68.176 -15.725 -23.597 1.00 0.00 O ATOM 1441 OE2 GLU A 91 67.588 -14.159 -24.955 1.00 0.00 O ATOM 1442 OXT GLU A 91 67.655 -15.047 -18.385 1.00 0.00 O ATOM 0 H GLU A 91 68.904 -13.032 -20.129 1.00 0.00 H new ATOM 0 HA GLU A 91 65.951 -13.210 -20.417 1.00 0.00 H new ATOM 0 HB2 GLU A 91 68.304 -14.999 -21.198 1.00 0.00 H new ATOM 0 HB3 GLU A 91 66.631 -15.443 -21.472 1.00 0.00 H new ATOM 0 HG2 GLU A 91 66.295 -13.349 -22.819 1.00 0.00 H new ATOM 0 HG3 GLU A 91 67.966 -12.901 -22.542 1.00 0.00 H new TER 1449 GLU A 91 ATOM 1450 N SER B 1 60.096 -6.579 -8.136 1.00 0.00 N ATOM 1451 CA SER B 1 59.396 -5.696 -7.160 1.00 0.00 C ATOM 1452 C SER B 1 59.983 -4.285 -7.240 1.00 0.00 C ATOM 1453 O SER B 1 61.105 -4.094 -7.663 1.00 0.00 O ATOM 1454 CB SER B 1 59.583 -6.246 -5.747 1.00 0.00 C ATOM 1455 OG SER B 1 60.912 -5.990 -5.317 1.00 0.00 O ATOM 0 H1 SER B 1 59.424 -6.890 -8.867 1.00 0.00 H new ATOM 0 H2 SER B 1 60.875 -6.054 -8.582 1.00 0.00 H new ATOM 0 H3 SER B 1 60.478 -7.410 -7.641 1.00 0.00 H new ATOM 0 HA SER B 1 58.333 -5.663 -7.397 1.00 0.00 H new ATOM 0 HB2 SER B 1 58.872 -5.780 -5.065 1.00 0.00 H new ATOM 0 HB3 SER B 1 59.383 -7.317 -5.732 1.00 0.00 H new ATOM 0 HG SER B 1 61.035 -6.340 -4.410 1.00 0.00 H new ATOM 1463 N GLU B 2 59.226 -3.293 -6.857 1.00 0.00 N ATOM 1464 CA GLU B 2 59.725 -1.890 -6.932 1.00 0.00 C ATOM 1465 C GLU B 2 60.980 -1.726 -6.072 1.00 0.00 C ATOM 1466 O GLU B 2 61.912 -1.048 -6.456 1.00 0.00 O ATOM 1467 CB GLU B 2 58.640 -0.938 -6.417 1.00 0.00 C ATOM 1468 CG GLU B 2 57.458 -0.915 -7.394 1.00 0.00 C ATOM 1469 CD GLU B 2 56.634 -2.197 -7.237 1.00 0.00 C ATOM 1470 OE1 GLU B 2 56.881 -2.928 -6.292 1.00 0.00 O ATOM 1471 OE2 GLU B 2 55.767 -2.425 -8.065 1.00 0.00 O ATOM 0 H GLU B 2 58.278 -3.395 -6.493 1.00 0.00 H new ATOM 0 HA GLU B 2 59.968 -1.658 -7.969 1.00 0.00 H new ATOM 0 HB2 GLU B 2 58.302 -1.257 -5.431 1.00 0.00 H new ATOM 0 HB3 GLU B 2 59.049 0.066 -6.304 1.00 0.00 H new ATOM 0 HG2 GLU B 2 56.832 -0.043 -7.203 1.00 0.00 H new ATOM 0 HG3 GLU B 2 57.822 -0.828 -8.418 1.00 0.00 H new ATOM 1478 N LEU B 3 61.024 -2.336 -4.919 1.00 0.00 N ATOM 1479 CA LEU B 3 62.230 -2.212 -4.054 1.00 0.00 C ATOM 1480 C LEU B 3 63.395 -2.990 -4.687 1.00 0.00 C ATOM 1481 O LEU B 3 64.539 -2.590 -4.619 1.00 0.00 O ATOM 1482 CB LEU B 3 61.896 -2.793 -2.665 1.00 0.00 C ATOM 1483 CG LEU B 3 62.728 -2.113 -1.568 1.00 0.00 C ATOM 1484 CD1 LEU B 3 62.478 -2.825 -0.238 1.00 0.00 C ATOM 1485 CD2 LEU B 3 64.220 -2.183 -1.912 1.00 0.00 C ATOM 0 H LEU B 3 60.276 -2.915 -4.539 1.00 0.00 H new ATOM 0 HA LEU B 3 62.521 -1.166 -3.954 1.00 0.00 H new ATOM 0 HB2 LEU B 3 60.835 -2.659 -2.457 1.00 0.00 H new ATOM 0 HB3 LEU B 3 62.089 -3.866 -2.660 1.00 0.00 H new ATOM 0 HG LEU B 3 62.434 -1.066 -1.492 1.00 0.00 H new ATOM 0 HD11 LEU B 3 63.066 -2.348 0.546 1.00 0.00 H new ATOM 0 HD12 LEU B 3 61.419 -2.764 0.014 1.00 0.00 H new ATOM 0 HD13 LEU B 3 62.771 -3.871 -0.325 1.00 0.00 H new ATOM 0 HD21 LEU B 3 64.798 -1.697 -1.126 1.00 0.00 H new ATOM 0 HD22 LEU B 3 64.526 -3.226 -1.995 1.00 0.00 H new ATOM 0 HD23 LEU B 3 64.399 -1.676 -2.860 1.00 0.00 H new ATOM 1497 N GLU B 4 63.108 -4.102 -5.305 1.00 0.00 N ATOM 1498 CA GLU B 4 64.193 -4.908 -5.937 1.00 0.00 C ATOM 1499 C GLU B 4 64.753 -4.176 -7.159 1.00 0.00 C ATOM 1500 O GLU B 4 65.945 -4.178 -7.398 1.00 0.00 O ATOM 1501 CB GLU B 4 63.640 -6.275 -6.346 1.00 0.00 C ATOM 1502 CG GLU B 4 64.757 -7.129 -6.953 1.00 0.00 C ATOM 1503 CD GLU B 4 64.196 -8.496 -7.337 1.00 0.00 C ATOM 1504 OE1 GLU B 4 63.069 -8.777 -6.966 1.00 0.00 O ATOM 1505 OE2 GLU B 4 64.903 -9.240 -7.995 1.00 0.00 O ATOM 0 H GLU B 4 62.169 -4.489 -5.400 1.00 0.00 H new ATOM 0 HA GLU B 4 65.001 -5.048 -5.219 1.00 0.00 H new ATOM 0 HB2 GLU B 4 63.215 -6.780 -5.478 1.00 0.00 H new ATOM 0 HB3 GLU B 4 62.833 -6.149 -7.068 1.00 0.00 H new ATOM 0 HG2 GLU B 4 65.172 -6.634 -7.831 1.00 0.00 H new ATOM 0 HG3 GLU B 4 65.571 -7.245 -6.238 1.00 0.00 H new ATOM 1512 N LYS B 5 63.912 -3.554 -7.939 1.00 0.00 N ATOM 1513 CA LYS B 5 64.413 -2.833 -9.145 1.00 0.00 C ATOM 1514 C LYS B 5 65.393 -1.747 -8.710 1.00 0.00 C ATOM 1515 O LYS B 5 66.411 -1.527 -9.338 1.00 0.00 O ATOM 1516 CB LYS B 5 63.237 -2.192 -9.891 1.00 0.00 C ATOM 1517 CG LYS B 5 63.747 -1.540 -11.181 1.00 0.00 C ATOM 1518 CD LYS B 5 62.579 -0.896 -11.935 1.00 0.00 C ATOM 1519 CE LYS B 5 63.110 -0.207 -13.195 1.00 0.00 C ATOM 1520 NZ LYS B 5 61.966 0.257 -14.033 1.00 0.00 N ATOM 0 H LYS B 5 62.903 -3.513 -7.795 1.00 0.00 H new ATOM 0 HA LYS B 5 64.916 -3.538 -9.807 1.00 0.00 H new ATOM 0 HB2 LYS B 5 62.485 -2.946 -10.124 1.00 0.00 H new ATOM 0 HB3 LYS B 5 62.755 -1.446 -9.259 1.00 0.00 H new ATOM 0 HG2 LYS B 5 64.499 -0.787 -10.946 1.00 0.00 H new ATOM 0 HG3 LYS B 5 64.230 -2.287 -11.810 1.00 0.00 H new ATOM 0 HD2 LYS B 5 61.842 -1.653 -12.203 1.00 0.00 H new ATOM 0 HD3 LYS B 5 62.073 -0.172 -11.296 1.00 0.00 H new ATOM 0 HE2 LYS B 5 63.740 0.640 -12.921 1.00 0.00 H new ATOM 0 HE3 LYS B 5 63.734 -0.897 -13.763 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 62.329 0.725 -14.888 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 61.382 -0.559 -14.306 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 61.388 0.930 -13.490 1.00 0.00 H new ATOM 1534 N ALA B 6 65.101 -1.074 -7.637 1.00 0.00 N ATOM 1535 CA ALA B 6 66.021 -0.008 -7.161 1.00 0.00 C ATOM 1536 C ALA B 6 67.385 -0.639 -6.864 1.00 0.00 C ATOM 1537 O ALA B 6 68.415 -0.140 -7.273 1.00 0.00 O ATOM 1538 CB ALA B 6 65.452 0.618 -5.884 1.00 0.00 C ATOM 0 H ALA B 6 64.266 -1.215 -7.069 1.00 0.00 H new ATOM 0 HA ALA B 6 66.128 0.766 -7.921 1.00 0.00 H new ATOM 0 HB1 ALA B 6 66.124 1.400 -5.532 1.00 0.00 H new ATOM 0 HB2 ALA B 6 64.473 1.048 -6.095 1.00 0.00 H new ATOM 0 HB3 ALA B 6 65.353 -0.149 -5.116 1.00 0.00 H new ATOM 1544 N MET B 7 67.395 -1.741 -6.167 1.00 0.00 N ATOM 1545 CA MET B 7 68.685 -2.418 -5.856 1.00 0.00 C ATOM 1546 C MET B 7 69.369 -2.845 -7.161 1.00 0.00 C ATOM 1547 O MET B 7 70.532 -2.573 -7.384 1.00 0.00 O ATOM 1548 CB MET B 7 68.393 -3.641 -4.986 1.00 0.00 C ATOM 1549 CG MET B 7 69.651 -4.498 -4.831 1.00 0.00 C ATOM 1550 SD MET B 7 69.377 -5.750 -3.549 1.00 0.00 S ATOM 1551 CE MET B 7 67.898 -6.510 -4.266 1.00 0.00 C ATOM 0 H MET B 7 66.564 -2.203 -5.799 1.00 0.00 H new ATOM 0 HA MET B 7 69.350 -1.739 -5.322 1.00 0.00 H new ATOM 0 HB2 MET B 7 68.040 -3.322 -4.006 1.00 0.00 H new ATOM 0 HB3 MET B 7 67.595 -4.233 -5.435 1.00 0.00 H new ATOM 0 HG2 MET B 7 69.895 -4.979 -5.778 1.00 0.00 H new ATOM 0 HG3 MET B 7 70.501 -3.870 -4.565 1.00 0.00 H new ATOM 0 HE1 MET B 7 67.849 -7.559 -3.973 1.00 0.00 H new ATOM 0 HE2 MET B 7 67.010 -5.990 -3.905 1.00 0.00 H new ATOM 0 HE3 MET B 7 67.943 -6.439 -5.353 1.00 0.00 H new ATOM 1561 N VAL B 8 68.653 -3.516 -8.026 1.00 0.00 N ATOM 1562 CA VAL B 8 69.255 -3.964 -9.314 1.00 0.00 C ATOM 1563 C VAL B 8 69.733 -2.737 -10.095 1.00 0.00 C ATOM 1564 O VAL B 8 70.777 -2.748 -10.716 1.00 0.00 O ATOM 1565 CB VAL B 8 68.196 -4.718 -10.130 1.00 0.00 C ATOM 1566 CG1 VAL B 8 68.705 -4.978 -11.551 1.00 0.00 C ATOM 1567 CG2 VAL B 8 67.885 -6.055 -9.454 1.00 0.00 C ATOM 0 H VAL B 8 67.675 -3.773 -7.894 1.00 0.00 H new ATOM 0 HA VAL B 8 70.100 -4.625 -9.122 1.00 0.00 H new ATOM 0 HB VAL B 8 67.293 -4.109 -10.180 1.00 0.00 H new ATOM 0 HG11 VAL B 8 67.943 -5.513 -12.118 1.00 0.00 H new ATOM 0 HG12 VAL B 8 68.920 -4.028 -12.040 1.00 0.00 H new ATOM 0 HG13 VAL B 8 69.614 -5.578 -11.508 1.00 0.00 H new ATOM 0 HG21 VAL B 8 67.133 -6.590 -10.034 1.00 0.00 H new ATOM 0 HG22 VAL B 8 68.794 -6.654 -9.398 1.00 0.00 H new ATOM 0 HG23 VAL B 8 67.507 -5.875 -8.448 1.00 0.00 H new ATOM 1577 N ALA B 9 68.968 -1.683 -10.074 1.00 0.00 N ATOM 1578 CA ALA B 9 69.370 -0.457 -10.819 1.00 0.00 C ATOM 1579 C ALA B 9 70.711 0.055 -10.291 1.00 0.00 C ATOM 1580 O ALA B 9 71.560 0.494 -11.040 1.00 0.00 O ATOM 1581 CB ALA B 9 68.306 0.626 -10.624 1.00 0.00 C ATOM 0 H ALA B 9 68.082 -1.616 -9.574 1.00 0.00 H new ATOM 0 HA ALA B 9 69.466 -0.696 -11.878 1.00 0.00 H new ATOM 0 HB1 ALA B 9 68.597 1.524 -11.168 1.00 0.00 H new ATOM 0 HB2 ALA B 9 67.348 0.268 -11.002 1.00 0.00 H new ATOM 0 HB3 ALA B 9 68.213 0.858 -9.563 1.00 0.00 H new ATOM 1587 N LEU B 10 70.897 0.023 -9.001 1.00 0.00 N ATOM 1588 CA LEU B 10 72.170 0.528 -8.414 1.00 0.00 C ATOM 1589 C LEU B 10 73.356 -0.287 -8.948 1.00 0.00 C ATOM 1590 O LEU B 10 74.381 0.257 -9.308 1.00 0.00 O ATOM 1591 CB LEU B 10 72.086 0.404 -6.884 1.00 0.00 C ATOM 1592 CG LEU B 10 73.118 1.331 -6.196 1.00 0.00 C ATOM 1593 CD1 LEU B 10 72.663 1.629 -4.766 1.00 0.00 C ATOM 1594 CD2 LEU B 10 74.505 0.663 -6.149 1.00 0.00 C ATOM 0 H LEU B 10 70.220 -0.332 -8.326 1.00 0.00 H new ATOM 0 HA LEU B 10 72.320 1.571 -8.692 1.00 0.00 H new ATOM 0 HB2 LEU B 10 71.081 0.661 -6.549 1.00 0.00 H new ATOM 0 HB3 LEU B 10 72.266 -0.630 -6.589 1.00 0.00 H new ATOM 0 HG LEU B 10 73.188 2.255 -6.770 1.00 0.00 H new ATOM 0 HD11 LEU B 10 73.389 2.282 -4.282 1.00 0.00 H new ATOM 0 HD12 LEU B 10 71.691 2.122 -4.789 1.00 0.00 H new ATOM 0 HD13 LEU B 10 72.584 0.696 -4.207 1.00 0.00 H new ATOM 0 HD21 LEU B 10 75.215 1.332 -5.662 1.00 0.00 H new ATOM 0 HD22 LEU B 10 74.441 -0.269 -5.588 1.00 0.00 H new ATOM 0 HD23 LEU B 10 74.842 0.453 -7.164 1.00 0.00 H new ATOM 1606 N ILE B 11 73.224 -1.584 -9.011 1.00 0.00 N ATOM 1607 CA ILE B 11 74.353 -2.415 -9.523 1.00 0.00 C ATOM 1608 C ILE B 11 74.676 -1.998 -10.958 1.00 0.00 C ATOM 1609 O ILE B 11 75.814 -1.755 -11.305 1.00 0.00 O ATOM 1610 CB ILE B 11 73.952 -3.893 -9.493 1.00 0.00 C ATOM 1611 CG1 ILE B 11 73.736 -4.322 -8.037 1.00 0.00 C ATOM 1612 CG2 ILE B 11 75.061 -4.743 -10.131 1.00 0.00 C ATOM 1613 CD1 ILE B 11 73.092 -5.707 -7.999 1.00 0.00 C ATOM 0 H ILE B 11 72.390 -2.102 -8.733 1.00 0.00 H new ATOM 0 HA ILE B 11 75.232 -2.268 -8.896 1.00 0.00 H new ATOM 0 HB ILE B 11 73.030 -4.037 -10.056 1.00 0.00 H new ATOM 0 HG12 ILE B 11 74.689 -4.339 -7.507 1.00 0.00 H new ATOM 0 HG13 ILE B 11 73.099 -3.600 -7.526 1.00 0.00 H new ATOM 0 HG21 ILE B 11 74.773 -5.794 -10.108 1.00 0.00 H new ATOM 0 HG22 ILE B 11 75.210 -4.430 -11.164 1.00 0.00 H new ATOM 0 HG23 ILE B 11 75.988 -4.609 -9.574 1.00 0.00 H new ATOM 0 HD11 ILE B 11 72.940 -6.009 -6.963 1.00 0.00 H new ATOM 0 HD12 ILE B 11 72.131 -5.676 -8.513 1.00 0.00 H new ATOM 0 HD13 ILE B 11 73.745 -6.426 -8.494 1.00 0.00 H new ATOM 1625 N ASP B 12 73.683 -1.923 -11.796 1.00 0.00 N ATOM 1626 CA ASP B 12 73.938 -1.535 -13.210 1.00 0.00 C ATOM 1627 C ASP B 12 74.566 -0.141 -13.229 1.00 0.00 C ATOM 1628 O ASP B 12 75.470 0.132 -13.993 1.00 0.00 O ATOM 1629 CB ASP B 12 72.617 -1.516 -13.982 1.00 0.00 C ATOM 1630 CG ASP B 12 72.878 -1.131 -15.441 1.00 0.00 C ATOM 1631 OD1 ASP B 12 73.959 -0.641 -15.723 1.00 0.00 O ATOM 1632 OD2 ASP B 12 71.991 -1.338 -16.254 1.00 0.00 O ATOM 0 H ASP B 12 72.708 -2.113 -11.565 1.00 0.00 H new ATOM 0 HA ASP B 12 74.612 -2.252 -13.678 1.00 0.00 H new ATOM 0 HB2 ASP B 12 72.142 -2.496 -13.934 1.00 0.00 H new ATOM 0 HB3 ASP B 12 71.928 -0.805 -13.526 1.00 0.00 H new ATOM 1637 N VAL B 13 74.100 0.743 -12.391 1.00 0.00 N ATOM 1638 CA VAL B 13 74.685 2.112 -12.365 1.00 0.00 C ATOM 1639 C VAL B 13 76.127 2.034 -11.843 1.00 0.00 C ATOM 1640 O VAL B 13 77.010 2.712 -12.330 1.00 0.00 O ATOM 1641 CB VAL B 13 73.850 3.011 -11.445 1.00 0.00 C ATOM 1642 CG1 VAL B 13 74.574 4.346 -11.222 1.00 0.00 C ATOM 1643 CG2 VAL B 13 72.486 3.270 -12.089 1.00 0.00 C ATOM 0 H VAL B 13 73.344 0.578 -11.727 1.00 0.00 H new ATOM 0 HA VAL B 13 74.683 2.531 -13.371 1.00 0.00 H new ATOM 0 HB VAL B 13 73.713 2.514 -10.484 1.00 0.00 H new ATOM 0 HG11 VAL B 13 73.975 4.980 -10.568 1.00 0.00 H new ATOM 0 HG12 VAL B 13 75.544 4.161 -10.760 1.00 0.00 H new ATOM 0 HG13 VAL B 13 74.718 4.846 -12.180 1.00 0.00 H new ATOM 0 HG21 VAL B 13 71.891 3.909 -11.436 1.00 0.00 H new ATOM 0 HG22 VAL B 13 72.626 3.763 -13.051 1.00 0.00 H new ATOM 0 HG23 VAL B 13 71.969 2.322 -12.239 1.00 0.00 H new ATOM 1653 N PHE B 14 76.370 1.216 -10.850 1.00 0.00 N ATOM 1654 CA PHE B 14 77.752 1.101 -10.293 1.00 0.00 C ATOM 1655 C PHE B 14 78.715 0.554 -11.352 1.00 0.00 C ATOM 1656 O PHE B 14 79.755 1.127 -11.610 1.00 0.00 O ATOM 1657 CB PHE B 14 77.737 0.148 -9.095 1.00 0.00 C ATOM 1658 CG PHE B 14 79.138 -0.011 -8.545 1.00 0.00 C ATOM 1659 CD1 PHE B 14 79.989 -0.995 -9.069 1.00 0.00 C ATOM 1660 CD2 PHE B 14 79.585 0.817 -7.507 1.00 0.00 C ATOM 1661 CE1 PHE B 14 81.284 -1.150 -8.554 1.00 0.00 C ATOM 1662 CE2 PHE B 14 80.880 0.662 -6.993 1.00 0.00 C ATOM 1663 CZ PHE B 14 81.730 -0.322 -7.516 1.00 0.00 C ATOM 0 H PHE B 14 75.672 0.623 -10.401 1.00 0.00 H new ATOM 0 HA PHE B 14 78.088 2.091 -9.984 1.00 0.00 H new ATOM 0 HB2 PHE B 14 77.075 0.534 -8.320 1.00 0.00 H new ATOM 0 HB3 PHE B 14 77.343 -0.823 -9.396 1.00 0.00 H new ATOM 0 HD1 PHE B 14 79.647 -1.634 -9.870 1.00 0.00 H new ATOM 0 HD2 PHE B 14 78.931 1.575 -7.102 1.00 0.00 H new ATOM 0 HE1 PHE B 14 81.938 -1.908 -8.958 1.00 0.00 H new ATOM 0 HE2 PHE B 14 81.223 1.302 -6.193 1.00 0.00 H new ATOM 0 HZ PHE B 14 82.727 -0.442 -7.119 1.00 0.00 H new ATOM 1673 N HIS B 15 78.408 -0.578 -11.927 1.00 0.00 N ATOM 1674 CA HIS B 15 79.334 -1.194 -12.922 1.00 0.00 C ATOM 1675 C HIS B 15 79.572 -0.278 -14.118 1.00 0.00 C ATOM 1676 O HIS B 15 80.683 -0.171 -14.598 1.00 0.00 O ATOM 1677 CB HIS B 15 78.729 -2.511 -13.412 1.00 0.00 C ATOM 1678 CG HIS B 15 79.641 -3.143 -14.427 1.00 0.00 C ATOM 1679 ND1 HIS B 15 80.960 -3.471 -14.143 1.00 0.00 N ATOM 1680 CD2 HIS B 15 79.436 -3.513 -15.734 1.00 0.00 C ATOM 1681 CE1 HIS B 15 81.493 -4.012 -15.255 1.00 0.00 C ATOM 1682 NE2 HIS B 15 80.605 -4.059 -16.250 1.00 0.00 N ATOM 0 H HIS B 15 77.553 -1.105 -11.750 1.00 0.00 H new ATOM 0 HA HIS B 15 80.293 -1.364 -12.434 1.00 0.00 H new ATOM 0 HB2 HIS B 15 78.580 -3.189 -12.571 1.00 0.00 H new ATOM 0 HB3 HIS B 15 77.749 -2.330 -13.853 1.00 0.00 H new ATOM 0 HD2 HIS B 15 78.509 -3.397 -16.277 1.00 0.00 H new ATOM 0 HE1 HIS B 15 82.511 -4.364 -15.332 1.00 0.00 H new ATOM 0 HE2 HIS B 15 80.753 -4.420 -17.192 1.00 0.00 H new ATOM 1691 N GLN B 16 78.572 0.389 -14.618 1.00 0.00 N ATOM 1692 CA GLN B 16 78.810 1.279 -15.785 1.00 0.00 C ATOM 1693 C GLN B 16 79.645 2.485 -15.365 1.00 0.00 C ATOM 1694 O GLN B 16 80.522 2.927 -16.080 1.00 0.00 O ATOM 1695 CB GLN B 16 77.466 1.757 -16.341 1.00 0.00 C ATOM 1696 CG GLN B 16 76.747 0.580 -17.003 1.00 0.00 C ATOM 1697 CD GLN B 16 75.323 0.992 -17.377 1.00 0.00 C ATOM 1698 OE1 GLN B 16 74.805 1.967 -16.871 1.00 0.00 O ATOM 1699 NE2 GLN B 16 74.662 0.278 -18.246 1.00 0.00 N ATOM 0 H GLN B 16 77.612 0.358 -14.275 1.00 0.00 H new ATOM 0 HA GLN B 16 79.350 0.724 -16.552 1.00 0.00 H new ATOM 0 HB2 GLN B 16 76.853 2.168 -15.539 1.00 0.00 H new ATOM 0 HB3 GLN B 16 77.622 2.557 -17.065 1.00 0.00 H new ATOM 0 HG2 GLN B 16 77.290 0.263 -17.893 1.00 0.00 H new ATOM 0 HG3 GLN B 16 76.723 -0.273 -16.324 1.00 0.00 H new ATOM 0 HE21 GLN B 16 75.098 -0.541 -18.670 1.00 0.00 H new ATOM 0 HE22 GLN B 16 73.709 0.538 -18.501 1.00 0.00 H new ATOM 1708 N TYR B 17 79.379 3.024 -14.211 1.00 0.00 N ATOM 1709 CA TYR B 17 80.159 4.204 -13.755 1.00 0.00 C ATOM 1710 C TYR B 17 81.554 3.771 -13.292 1.00 0.00 C ATOM 1711 O TYR B 17 82.548 4.384 -13.628 1.00 0.00 O ATOM 1712 CB TYR B 17 79.431 4.907 -12.610 1.00 0.00 C ATOM 1713 CG TYR B 17 80.230 6.122 -12.215 1.00 0.00 C ATOM 1714 CD1 TYR B 17 81.219 6.020 -11.230 1.00 0.00 C ATOM 1715 CD2 TYR B 17 79.998 7.345 -12.853 1.00 0.00 C ATOM 1716 CE1 TYR B 17 81.975 7.145 -10.882 1.00 0.00 C ATOM 1717 CE2 TYR B 17 80.752 8.470 -12.503 1.00 0.00 C ATOM 1718 CZ TYR B 17 81.742 8.370 -11.518 1.00 0.00 C ATOM 1719 OH TYR B 17 82.489 9.478 -11.175 1.00 0.00 O ATOM 0 H TYR B 17 78.658 2.700 -13.566 1.00 0.00 H new ATOM 0 HA TYR B 17 80.261 4.896 -14.591 1.00 0.00 H new ATOM 0 HB2 TYR B 17 78.427 5.197 -12.920 1.00 0.00 H new ATOM 0 HB3 TYR B 17 79.320 4.233 -11.760 1.00 0.00 H new ATOM 0 HD1 TYR B 17 81.398 5.075 -10.739 1.00 0.00 H new ATOM 0 HD2 TYR B 17 79.237 7.421 -13.616 1.00 0.00 H new ATOM 0 HE1 TYR B 17 82.739 7.068 -10.122 1.00 0.00 H new ATOM 0 HE2 TYR B 17 80.571 9.415 -12.992 1.00 0.00 H new ATOM 0 HH TYR B 17 83.073 9.258 -10.419 1.00 0.00 H new ATOM 1729 N SER B 18 81.635 2.722 -12.520 1.00 0.00 N ATOM 1730 CA SER B 18 82.961 2.246 -12.027 1.00 0.00 C ATOM 1731 C SER B 18 83.767 1.647 -13.182 1.00 0.00 C ATOM 1732 O SER B 18 84.973 1.526 -13.112 1.00 0.00 O ATOM 1733 CB SER B 18 82.745 1.177 -10.951 1.00 0.00 C ATOM 1734 OG SER B 18 83.941 1.011 -10.203 1.00 0.00 O ATOM 0 H SER B 18 80.836 2.171 -12.207 1.00 0.00 H new ATOM 0 HA SER B 18 83.511 3.089 -11.608 1.00 0.00 H new ATOM 0 HB2 SER B 18 81.928 1.470 -10.291 1.00 0.00 H new ATOM 0 HB3 SER B 18 82.458 0.233 -11.414 1.00 0.00 H new ATOM 0 HG SER B 18 84.627 0.601 -10.770 1.00 0.00 H new ATOM 1740 N GLY B 19 83.110 1.258 -14.242 1.00 0.00 N ATOM 1741 CA GLY B 19 83.836 0.651 -15.399 1.00 0.00 C ATOM 1742 C GLY B 19 84.344 1.746 -16.338 1.00 0.00 C ATOM 1743 O GLY B 19 84.643 1.494 -17.488 1.00 0.00 O ATOM 0 H GLY B 19 82.099 1.334 -14.358 1.00 0.00 H new ATOM 0 HA2 GLY B 19 84.673 0.053 -15.039 1.00 0.00 H new ATOM 0 HA3 GLY B 19 83.173 -0.023 -15.940 1.00 0.00 H new ATOM 1747 N ARG B 20 84.469 2.954 -15.860 1.00 0.00 N ATOM 1748 CA ARG B 20 84.984 4.053 -16.725 1.00 0.00 C ATOM 1749 C ARG B 20 86.509 4.091 -16.618 1.00 0.00 C ATOM 1750 O ARG B 20 87.217 4.005 -17.602 1.00 0.00 O ATOM 1751 CB ARG B 20 84.400 5.380 -16.245 1.00 0.00 C ATOM 1752 CG ARG B 20 82.894 5.387 -16.504 1.00 0.00 C ATOM 1753 CD ARG B 20 82.300 6.704 -16.008 1.00 0.00 C ATOM 1754 NE ARG B 20 82.790 7.823 -16.861 1.00 0.00 N ATOM 1755 CZ ARG B 20 82.249 9.004 -16.758 1.00 0.00 C ATOM 1756 NH1 ARG B 20 81.305 9.217 -15.880 1.00 0.00 N ATOM 1757 NH2 ARG B 20 82.658 9.976 -17.525 1.00 0.00 N ATOM 0 H ARG B 20 84.236 3.228 -14.905 1.00 0.00 H new ATOM 0 HA ARG B 20 84.694 3.885 -17.762 1.00 0.00 H new ATOM 0 HB2 ARG B 20 84.599 5.516 -15.182 1.00 0.00 H new ATOM 0 HB3 ARG B 20 84.875 6.211 -16.767 1.00 0.00 H new ATOM 0 HG2 ARG B 20 82.696 5.264 -17.569 1.00 0.00 H new ATOM 0 HG3 ARG B 20 82.422 4.547 -15.994 1.00 0.00 H new ATOM 0 HD2 ARG B 20 81.211 6.659 -16.039 1.00 0.00 H new ATOM 0 HD3 ARG B 20 82.582 6.874 -14.969 1.00 0.00 H new ATOM 0 HE ARG B 20 83.548 7.665 -17.525 1.00 0.00 H new ATOM 0 HH11 ARG B 20 80.991 8.459 -15.275 1.00 0.00 H new ATOM 0 HH12 ARG B 20 80.882 10.142 -15.800 1.00 0.00 H new ATOM 0 HH21 ARG B 20 83.401 9.811 -18.205 1.00 0.00 H new ATOM 0 HH22 ARG B 20 82.235 10.901 -17.445 1.00 0.00 H new ATOM 1771 N GLU B 21 87.016 4.215 -15.418 1.00 0.00 N ATOM 1772 CA GLU B 21 88.492 4.254 -15.203 1.00 0.00 C ATOM 1773 C GLU B 21 88.825 3.440 -13.949 1.00 0.00 C ATOM 1774 O GLU B 21 87.974 3.201 -13.114 1.00 0.00 O ATOM 1775 CB GLU B 21 88.938 5.706 -15.007 1.00 0.00 C ATOM 1776 CG GLU B 21 88.756 6.481 -16.315 1.00 0.00 C ATOM 1777 CD GLU B 21 89.189 7.934 -16.111 1.00 0.00 C ATOM 1778 OE1 GLU B 21 89.661 8.244 -15.030 1.00 0.00 O ATOM 1779 OE2 GLU B 21 89.041 8.711 -17.039 1.00 0.00 O ATOM 0 H GLU B 21 86.460 4.292 -14.566 1.00 0.00 H new ATOM 0 HA GLU B 21 89.009 3.834 -16.066 1.00 0.00 H new ATOM 0 HB2 GLU B 21 88.355 6.172 -14.213 1.00 0.00 H new ATOM 0 HB3 GLU B 21 89.982 5.737 -14.696 1.00 0.00 H new ATOM 0 HG2 GLU B 21 89.347 6.022 -17.107 1.00 0.00 H new ATOM 0 HG3 GLU B 21 87.714 6.442 -16.631 1.00 0.00 H new ATOM 1786 N GLY B 22 90.052 3.011 -13.804 1.00 0.00 N ATOM 1787 CA GLY B 22 90.436 2.209 -12.598 1.00 0.00 C ATOM 1788 C GLY B 22 90.426 0.719 -12.950 1.00 0.00 C ATOM 1789 O GLY B 22 90.132 0.341 -14.067 1.00 0.00 O ATOM 0 H GLY B 22 90.807 3.180 -14.468 1.00 0.00 H new ATOM 0 HA2 GLY B 22 91.426 2.505 -12.252 1.00 0.00 H new ATOM 0 HA3 GLY B 22 89.741 2.405 -11.781 1.00 0.00 H new ATOM 1793 N ASP B 23 90.753 -0.130 -12.012 1.00 0.00 N ATOM 1794 CA ASP B 23 90.766 -1.590 -12.311 1.00 0.00 C ATOM 1795 C ASP B 23 89.365 -2.037 -12.735 1.00 0.00 C ATOM 1796 O ASP B 23 89.185 -2.595 -13.800 1.00 0.00 O ATOM 1797 CB ASP B 23 91.201 -2.358 -11.058 1.00 0.00 C ATOM 1798 CG ASP B 23 91.230 -3.864 -11.341 1.00 0.00 C ATOM 1799 OD1 ASP B 23 90.475 -4.309 -12.189 1.00 0.00 O ATOM 1800 OD2 ASP B 23 92.013 -4.550 -10.703 1.00 0.00 O ATOM 0 H ASP B 23 91.010 0.123 -11.058 1.00 0.00 H new ATOM 0 HA ASP B 23 91.466 -1.794 -13.121 1.00 0.00 H new ATOM 0 HB2 ASP B 23 92.188 -2.021 -10.741 1.00 0.00 H new ATOM 0 HB3 ASP B 23 90.514 -2.148 -10.238 1.00 0.00 H new ATOM 1805 N LYS B 24 88.368 -1.778 -11.923 1.00 0.00 N ATOM 1806 CA LYS B 24 86.975 -2.176 -12.293 1.00 0.00 C ATOM 1807 C LYS B 24 85.986 -1.682 -11.229 1.00 0.00 C ATOM 1808 O LYS B 24 85.159 -0.831 -11.487 1.00 0.00 O ATOM 1809 CB LYS B 24 86.865 -3.706 -12.390 1.00 0.00 C ATOM 1810 CG LYS B 24 85.573 -4.070 -13.127 1.00 0.00 C ATOM 1811 CD LYS B 24 85.323 -5.579 -13.040 1.00 0.00 C ATOM 1812 CE LYS B 24 86.463 -6.351 -13.715 1.00 0.00 C ATOM 1813 NZ LYS B 24 86.859 -5.674 -14.984 1.00 0.00 N ATOM 0 H LYS B 24 88.459 -1.309 -11.022 1.00 0.00 H new ATOM 0 HA LYS B 24 86.738 -1.728 -13.258 1.00 0.00 H new ATOM 0 HB2 LYS B 24 87.727 -4.112 -12.919 1.00 0.00 H new ATOM 0 HB3 LYS B 24 86.866 -4.147 -11.393 1.00 0.00 H new ATOM 0 HG2 LYS B 24 84.733 -3.529 -12.692 1.00 0.00 H new ATOM 0 HG3 LYS B 24 85.643 -3.765 -14.171 1.00 0.00 H new ATOM 0 HD2 LYS B 24 85.240 -5.880 -11.996 1.00 0.00 H new ATOM 0 HD3 LYS B 24 84.375 -5.825 -13.519 1.00 0.00 H new ATOM 0 HE2 LYS B 24 87.319 -6.412 -13.043 1.00 0.00 H new ATOM 0 HE3 LYS B 24 86.148 -7.374 -13.922 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 87.337 -6.356 -15.607 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 86.011 -5.305 -15.460 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 87.506 -4.888 -14.771 1.00 0.00 H new ATOM 1827 N HIS B 25 86.065 -2.222 -10.033 1.00 0.00 N ATOM 1828 CA HIS B 25 85.133 -1.812 -8.933 1.00 0.00 C ATOM 1829 C HIS B 25 85.893 -1.011 -7.876 1.00 0.00 C ATOM 1830 O HIS B 25 85.495 -0.951 -6.729 1.00 0.00 O ATOM 1831 CB HIS B 25 84.514 -3.058 -8.289 1.00 0.00 C ATOM 1832 CG HIS B 25 85.598 -3.945 -7.742 1.00 0.00 C ATOM 1833 ND1 HIS B 25 86.536 -4.556 -8.563 1.00 0.00 N ATOM 1834 CD2 HIS B 25 85.899 -4.349 -6.463 1.00 0.00 C ATOM 1835 CE1 HIS B 25 87.347 -5.289 -7.777 1.00 0.00 C ATOM 1836 NE2 HIS B 25 87.001 -5.197 -6.492 1.00 0.00 N ATOM 0 H HIS B 25 86.743 -2.937 -9.771 1.00 0.00 H new ATOM 0 HA HIS B 25 84.342 -1.190 -9.351 1.00 0.00 H new ATOM 0 HB2 HIS B 25 83.834 -2.765 -7.489 1.00 0.00 H new ATOM 0 HB3 HIS B 25 83.923 -3.603 -9.025 1.00 0.00 H new ATOM 0 HD1 HIS B 25 86.599 -4.466 -9.577 1.00 0.00 H new ATOM 0 HD2 HIS B 25 85.363 -4.054 -5.573 1.00 0.00 H new ATOM 0 HE1 HIS B 25 88.175 -5.878 -8.142 1.00 0.00 H new ATOM 1845 N LYS B 26 86.973 -0.381 -8.256 1.00 0.00 N ATOM 1846 CA LYS B 26 87.762 0.441 -7.284 1.00 0.00 C ATOM 1847 C LYS B 26 87.487 1.919 -7.580 1.00 0.00 C ATOM 1848 O LYS B 26 87.719 2.396 -8.673 1.00 0.00 O ATOM 1849 CB LYS B 26 89.271 0.146 -7.462 1.00 0.00 C ATOM 1850 CG LYS B 26 89.760 -0.881 -6.428 1.00 0.00 C ATOM 1851 CD LYS B 26 89.206 -2.267 -6.756 1.00 0.00 C ATOM 1852 CE LYS B 26 89.911 -3.305 -5.880 1.00 0.00 C ATOM 1853 NZ LYS B 26 89.471 -4.673 -6.272 1.00 0.00 N ATOM 0 H LYS B 26 87.347 -0.399 -9.205 1.00 0.00 H new ATOM 0 HA LYS B 26 87.475 0.200 -6.260 1.00 0.00 H new ATOM 0 HB2 LYS B 26 89.455 -0.231 -8.468 1.00 0.00 H new ATOM 0 HB3 LYS B 26 89.840 1.070 -7.359 1.00 0.00 H new ATOM 0 HG2 LYS B 26 90.850 -0.910 -6.421 1.00 0.00 H new ATOM 0 HG3 LYS B 26 89.442 -0.582 -5.429 1.00 0.00 H new ATOM 0 HD2 LYS B 26 88.131 -2.294 -6.580 1.00 0.00 H new ATOM 0 HD3 LYS B 26 89.362 -2.495 -7.810 1.00 0.00 H new ATOM 0 HE2 LYS B 26 90.992 -3.214 -5.990 1.00 0.00 H new ATOM 0 HE3 LYS B 26 89.681 -3.125 -4.830 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 89.989 -5.379 -5.710 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 88.451 -4.773 -6.097 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 89.666 -4.824 -7.282 1.00 0.00 H new ATOM 1867 N LEU B 27 86.988 2.646 -6.614 1.00 0.00 N ATOM 1868 CA LEU B 27 86.693 4.091 -6.840 1.00 0.00 C ATOM 1869 C LEU B 27 87.851 4.930 -6.302 1.00 0.00 C ATOM 1870 O LEU B 27 88.194 4.868 -5.139 1.00 0.00 O ATOM 1871 CB LEU B 27 85.412 4.470 -6.099 1.00 0.00 C ATOM 1872 CG LEU B 27 84.239 3.625 -6.613 1.00 0.00 C ATOM 1873 CD1 LEU B 27 82.979 3.972 -5.809 1.00 0.00 C ATOM 1874 CD2 LEU B 27 83.998 3.899 -8.109 1.00 0.00 C ATOM 0 H LEU B 27 86.772 2.301 -5.679 1.00 0.00 H new ATOM 0 HA LEU B 27 86.567 4.276 -7.907 1.00 0.00 H new ATOM 0 HB2 LEU B 27 85.542 4.314 -5.028 1.00 0.00 H new ATOM 0 HB3 LEU B 27 85.199 5.529 -6.243 1.00 0.00 H new ATOM 0 HG LEU B 27 84.475 2.568 -6.488 1.00 0.00 H new ATOM 0 HD11 LEU B 27 82.141 3.375 -6.169 1.00 0.00 H new ATOM 0 HD12 LEU B 27 83.150 3.758 -4.754 1.00 0.00 H new ATOM 0 HD13 LEU B 27 82.749 5.030 -5.932 1.00 0.00 H new ATOM 0 HD21 LEU B 27 83.163 3.293 -8.460 1.00 0.00 H new ATOM 0 HD22 LEU B 27 83.766 4.954 -8.253 1.00 0.00 H new ATOM 0 HD23 LEU B 27 84.894 3.644 -8.675 1.00 0.00 H new ATOM 1886 N LYS B 28 88.450 5.715 -7.151 1.00 0.00 N ATOM 1887 CA LYS B 28 89.589 6.576 -6.723 1.00 0.00 C ATOM 1888 C LYS B 28 89.041 7.934 -6.278 1.00 0.00 C ATOM 1889 O LYS B 28 87.913 8.280 -6.569 1.00 0.00 O ATOM 1890 CB LYS B 28 90.550 6.746 -7.907 1.00 0.00 C ATOM 1891 CG LYS B 28 91.816 7.490 -7.468 1.00 0.00 C ATOM 1892 CD LYS B 28 92.790 7.562 -8.647 1.00 0.00 C ATOM 1893 CE LYS B 28 94.020 8.383 -8.254 1.00 0.00 C ATOM 1894 NZ LYS B 28 94.768 7.683 -7.174 1.00 0.00 N ATOM 0 H LYS B 28 88.197 5.799 -8.136 1.00 0.00 H new ATOM 0 HA LYS B 28 90.126 6.121 -5.891 1.00 0.00 H new ATOM 0 HB2 LYS B 28 90.817 5.769 -8.310 1.00 0.00 H new ATOM 0 HB3 LYS B 28 90.056 7.297 -8.708 1.00 0.00 H new ATOM 0 HG2 LYS B 28 91.563 8.494 -7.128 1.00 0.00 H new ATOM 0 HG3 LYS B 28 92.281 6.976 -6.627 1.00 0.00 H new ATOM 0 HD2 LYS B 28 93.092 6.557 -8.943 1.00 0.00 H new ATOM 0 HD3 LYS B 28 92.299 8.015 -9.509 1.00 0.00 H new ATOM 0 HE2 LYS B 28 94.665 8.527 -9.121 1.00 0.00 H new ATOM 0 HE3 LYS B 28 93.715 9.373 -7.915 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 95.712 8.108 -7.074 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 94.250 7.775 -6.277 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 94.866 6.676 -7.416 1.00 0.00 H new ATOM 1908 N LYS B 29 89.818 8.706 -5.568 1.00 0.00 N ATOM 1909 CA LYS B 29 89.313 10.029 -5.109 1.00 0.00 C ATOM 1910 C LYS B 29 88.943 10.873 -6.329 1.00 0.00 C ATOM 1911 O LYS B 29 87.936 11.553 -6.337 1.00 0.00 O ATOM 1912 CB LYS B 29 90.406 10.740 -4.306 1.00 0.00 C ATOM 1913 CG LYS B 29 90.609 10.021 -2.968 1.00 0.00 C ATOM 1914 CD LYS B 29 91.904 10.507 -2.308 1.00 0.00 C ATOM 1915 CE LYS B 29 91.759 11.969 -1.881 1.00 0.00 C ATOM 1916 NZ LYS B 29 92.874 12.328 -0.959 1.00 0.00 N ATOM 0 H LYS B 29 90.772 8.480 -5.288 1.00 0.00 H new ATOM 0 HA LYS B 29 88.435 9.891 -4.479 1.00 0.00 H new ATOM 0 HB2 LYS B 29 91.338 10.750 -4.871 1.00 0.00 H new ATOM 0 HB3 LYS B 29 90.127 11.779 -4.133 1.00 0.00 H new ATOM 0 HG2 LYS B 29 89.761 10.212 -2.310 1.00 0.00 H new ATOM 0 HG3 LYS B 29 90.653 8.944 -3.127 1.00 0.00 H new ATOM 0 HD2 LYS B 29 92.134 9.888 -1.441 1.00 0.00 H new ATOM 0 HD3 LYS B 29 92.737 10.404 -3.004 1.00 0.00 H new ATOM 0 HE2 LYS B 29 91.773 12.618 -2.756 1.00 0.00 H new ATOM 0 HE3 LYS B 29 90.800 12.122 -1.386 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 92.777 13.322 -0.668 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 92.840 11.716 -0.119 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 93.783 12.197 -1.446 1.00 0.00 H new ATOM 1930 N SER B 30 89.727 10.821 -7.372 1.00 0.00 N ATOM 1931 CA SER B 30 89.379 11.608 -8.588 1.00 0.00 C ATOM 1932 C SER B 30 88.058 11.077 -9.151 1.00 0.00 C ATOM 1933 O SER B 30 87.200 11.827 -9.573 1.00 0.00 O ATOM 1934 CB SER B 30 90.484 11.450 -9.635 1.00 0.00 C ATOM 1935 OG SER B 30 90.572 10.085 -10.022 1.00 0.00 O ATOM 0 H SER B 30 90.585 10.273 -7.434 1.00 0.00 H new ATOM 0 HA SER B 30 89.279 12.663 -8.334 1.00 0.00 H new ATOM 0 HB2 SER B 30 90.270 12.073 -10.503 1.00 0.00 H new ATOM 0 HB3 SER B 30 91.437 11.787 -9.228 1.00 0.00 H new ATOM 0 HG SER B 30 91.278 9.980 -10.694 1.00 0.00 H new ATOM 1941 N GLU B 31 87.887 9.782 -9.133 1.00 0.00 N ATOM 1942 CA GLU B 31 86.620 9.177 -9.639 1.00 0.00 C ATOM 1943 C GLU B 31 85.481 9.512 -8.671 1.00 0.00 C ATOM 1944 O GLU B 31 84.345 9.687 -9.061 1.00 0.00 O ATOM 1945 CB GLU B 31 86.779 7.657 -9.735 1.00 0.00 C ATOM 1946 CG GLU B 31 87.742 7.318 -10.875 1.00 0.00 C ATOM 1947 CD GLU B 31 87.918 5.801 -10.965 1.00 0.00 C ATOM 1948 OE1 GLU B 31 87.234 5.101 -10.237 1.00 0.00 O ATOM 1949 OE2 GLU B 31 88.733 5.365 -11.762 1.00 0.00 O ATOM 0 H GLU B 31 88.575 9.113 -8.787 1.00 0.00 H new ATOM 0 HA GLU B 31 86.392 9.578 -10.627 1.00 0.00 H new ATOM 0 HB2 GLU B 31 87.158 7.260 -8.793 1.00 0.00 H new ATOM 0 HB3 GLU B 31 85.810 7.189 -9.911 1.00 0.00 H new ATOM 0 HG2 GLU B 31 87.356 7.706 -11.818 1.00 0.00 H new ATOM 0 HG3 GLU B 31 88.706 7.797 -10.704 1.00 0.00 H new ATOM 1956 N LEU B 32 85.794 9.610 -7.410 1.00 0.00 N ATOM 1957 CA LEU B 32 84.745 9.948 -6.405 1.00 0.00 C ATOM 1958 C LEU B 32 84.309 11.404 -6.587 1.00 0.00 C ATOM 1959 O LEU B 32 83.143 11.731 -6.496 1.00 0.00 O ATOM 1960 CB LEU B 32 85.305 9.738 -4.994 1.00 0.00 C ATOM 1961 CG LEU B 32 84.249 10.100 -3.936 1.00 0.00 C ATOM 1962 CD1 LEU B 32 82.988 9.236 -4.120 1.00 0.00 C ATOM 1963 CD2 LEU B 32 84.843 9.860 -2.542 1.00 0.00 C ATOM 0 H LEU B 32 86.730 9.471 -7.030 1.00 0.00 H new ATOM 0 HA LEU B 32 83.880 9.300 -6.546 1.00 0.00 H new ATOM 0 HB2 LEU B 32 85.612 8.700 -4.869 1.00 0.00 H new ATOM 0 HB3 LEU B 32 86.194 10.353 -4.854 1.00 0.00 H new ATOM 0 HG LEU B 32 83.969 11.148 -4.047 1.00 0.00 H new ATOM 0 HD11 LEU B 32 82.250 9.504 -3.364 1.00 0.00 H new ATOM 0 HD12 LEU B 32 82.570 9.408 -5.112 1.00 0.00 H new ATOM 0 HD13 LEU B 32 83.250 8.183 -4.015 1.00 0.00 H new ATOM 0 HD21 LEU B 32 84.103 10.113 -1.783 1.00 0.00 H new ATOM 0 HD22 LEU B 32 85.122 8.811 -2.441 1.00 0.00 H new ATOM 0 HD23 LEU B 32 85.726 10.485 -2.410 1.00 0.00 H new ATOM 1975 N LYS B 33 85.241 12.278 -6.839 1.00 0.00 N ATOM 1976 CA LYS B 33 84.887 13.712 -7.021 1.00 0.00 C ATOM 1977 C LYS B 33 83.987 13.874 -8.247 1.00 0.00 C ATOM 1978 O LYS B 33 83.042 14.637 -8.239 1.00 0.00 O ATOM 1979 CB LYS B 33 86.166 14.529 -7.210 1.00 0.00 C ATOM 1980 CG LYS B 33 85.806 16.005 -7.396 1.00 0.00 C ATOM 1981 CD LYS B 33 87.078 16.857 -7.327 1.00 0.00 C ATOM 1982 CE LYS B 33 88.034 16.469 -8.461 1.00 0.00 C ATOM 1983 NZ LYS B 33 88.830 15.275 -8.055 1.00 0.00 N ATOM 0 H LYS B 33 86.234 12.061 -6.927 1.00 0.00 H new ATOM 0 HA LYS B 33 84.354 14.067 -6.139 1.00 0.00 H new ATOM 0 HB2 LYS B 33 86.818 14.409 -6.345 1.00 0.00 H new ATOM 0 HB3 LYS B 33 86.717 14.166 -8.077 1.00 0.00 H new ATOM 0 HG2 LYS B 33 85.310 16.151 -8.356 1.00 0.00 H new ATOM 0 HG3 LYS B 33 85.104 16.319 -6.624 1.00 0.00 H new ATOM 0 HD2 LYS B 33 86.822 17.914 -7.402 1.00 0.00 H new ATOM 0 HD3 LYS B 33 87.568 16.716 -6.364 1.00 0.00 H new ATOM 0 HE2 LYS B 33 87.470 16.252 -9.368 1.00 0.00 H new ATOM 0 HE3 LYS B 33 88.699 17.301 -8.691 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 89.841 15.463 -8.210 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 88.665 15.074 -7.048 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 88.539 14.454 -8.624 1.00 0.00 H new ATOM 1997 N GLU B 34 84.270 13.162 -9.304 1.00 0.00 N ATOM 1998 CA GLU B 34 83.424 13.284 -10.525 1.00 0.00 C ATOM 1999 C GLU B 34 82.026 12.742 -10.230 1.00 0.00 C ATOM 2000 O GLU B 34 81.030 13.323 -10.614 1.00 0.00 O ATOM 2001 CB GLU B 34 84.064 12.484 -11.662 1.00 0.00 C ATOM 2002 CG GLU B 34 85.346 13.187 -12.112 1.00 0.00 C ATOM 2003 CD GLU B 34 86.014 12.379 -13.227 1.00 0.00 C ATOM 2004 OE1 GLU B 34 86.601 11.353 -12.921 1.00 0.00 O ATOM 2005 OE2 GLU B 34 85.923 12.798 -14.369 1.00 0.00 O ATOM 0 H GLU B 34 85.046 12.504 -9.375 1.00 0.00 H new ATOM 0 HA GLU B 34 83.347 14.331 -10.819 1.00 0.00 H new ATOM 0 HB2 GLU B 34 84.288 11.471 -11.328 1.00 0.00 H new ATOM 0 HB3 GLU B 34 83.370 12.398 -12.498 1.00 0.00 H new ATOM 0 HG2 GLU B 34 85.116 14.192 -12.466 1.00 0.00 H new ATOM 0 HG3 GLU B 34 86.028 13.294 -11.269 1.00 0.00 H new ATOM 2012 N LEU B 35 81.947 11.625 -9.567 1.00 0.00 N ATOM 2013 CA LEU B 35 80.616 11.028 -9.263 1.00 0.00 C ATOM 2014 C LEU B 35 79.800 12.019 -8.428 1.00 0.00 C ATOM 2015 O LEU B 35 78.644 12.273 -8.704 1.00 0.00 O ATOM 2016 CB LEU B 35 80.821 9.732 -8.465 1.00 0.00 C ATOM 2017 CG LEU B 35 79.467 9.085 -8.132 1.00 0.00 C ATOM 2018 CD1 LEU B 35 78.722 8.719 -9.429 1.00 0.00 C ATOM 2019 CD2 LEU B 35 79.715 7.819 -7.306 1.00 0.00 C ATOM 0 H LEU B 35 82.748 11.097 -9.221 1.00 0.00 H new ATOM 0 HA LEU B 35 80.085 10.809 -10.189 1.00 0.00 H new ATOM 0 HB2 LEU B 35 81.431 9.036 -9.041 1.00 0.00 H new ATOM 0 HB3 LEU B 35 81.364 9.947 -7.545 1.00 0.00 H new ATOM 0 HG LEU B 35 78.857 9.787 -7.564 1.00 0.00 H new ATOM 0 HD11 LEU B 35 77.764 8.261 -9.182 1.00 0.00 H new ATOM 0 HD12 LEU B 35 78.552 9.620 -10.018 1.00 0.00 H new ATOM 0 HD13 LEU B 35 79.322 8.016 -10.007 1.00 0.00 H new ATOM 0 HD21 LEU B 35 78.761 7.350 -7.063 1.00 0.00 H new ATOM 0 HD22 LEU B 35 80.325 7.123 -7.881 1.00 0.00 H new ATOM 0 HD23 LEU B 35 80.235 8.082 -6.385 1.00 0.00 H new ATOM 2031 N ILE B 36 80.391 12.582 -7.410 1.00 0.00 N ATOM 2032 CA ILE B 36 79.647 13.557 -6.562 1.00 0.00 C ATOM 2033 C ILE B 36 79.215 14.759 -7.411 1.00 0.00 C ATOM 2034 O ILE B 36 78.101 15.229 -7.313 1.00 0.00 O ATOM 2035 CB ILE B 36 80.549 14.033 -5.416 1.00 0.00 C ATOM 2036 CG1 ILE B 36 80.803 12.872 -4.450 1.00 0.00 C ATOM 2037 CG2 ILE B 36 79.858 15.172 -4.659 1.00 0.00 C ATOM 2038 CD1 ILE B 36 81.900 13.266 -3.458 1.00 0.00 C ATOM 0 H ILE B 36 81.356 12.409 -7.129 1.00 0.00 H new ATOM 0 HA ILE B 36 78.762 13.073 -6.149 1.00 0.00 H new ATOM 0 HB ILE B 36 81.496 14.385 -5.826 1.00 0.00 H new ATOM 0 HG12 ILE B 36 79.887 12.622 -3.915 1.00 0.00 H new ATOM 0 HG13 ILE B 36 81.101 11.982 -5.004 1.00 0.00 H new ATOM 0 HG21 ILE B 36 80.499 15.510 -3.845 1.00 0.00 H new ATOM 0 HG22 ILE B 36 79.671 16.001 -5.341 1.00 0.00 H new ATOM 0 HG23 ILE B 36 78.912 14.817 -4.252 1.00 0.00 H new ATOM 0 HD11 ILE B 36 82.082 12.441 -2.770 1.00 0.00 H new ATOM 0 HD12 ILE B 36 82.817 13.494 -4.001 1.00 0.00 H new ATOM 0 HD13 ILE B 36 81.583 14.144 -2.895 1.00 0.00 H new ATOM 2050 N ASN B 37 80.089 15.267 -8.236 1.00 0.00 N ATOM 2051 CA ASN B 37 79.723 16.446 -9.076 1.00 0.00 C ATOM 2052 C ASN B 37 78.575 16.089 -10.022 1.00 0.00 C ATOM 2053 O ASN B 37 77.689 16.884 -10.264 1.00 0.00 O ATOM 2054 CB ASN B 37 80.931 16.877 -9.911 1.00 0.00 C ATOM 2055 CG ASN B 37 82.000 17.490 -9.008 1.00 0.00 C ATOM 2056 OD1 ASN B 37 81.716 17.914 -7.905 1.00 0.00 O ATOM 2057 ND2 ASN B 37 83.232 17.555 -9.434 1.00 0.00 N ATOM 0 H ASN B 37 81.039 14.919 -8.366 1.00 0.00 H new ATOM 0 HA ASN B 37 79.412 17.257 -8.418 1.00 0.00 H new ATOM 0 HB2 ASN B 37 81.341 16.018 -10.442 1.00 0.00 H new ATOM 0 HB3 ASN B 37 80.622 17.601 -10.665 1.00 0.00 H new ATOM 0 HD21 ASN B 37 83.956 17.961 -8.841 1.00 0.00 H new ATOM 0 HD22 ASN B 37 83.471 17.199 -10.360 1.00 0.00 H new ATOM 2064 N ASN B 38 78.596 14.910 -10.583 1.00 0.00 N ATOM 2065 CA ASN B 38 77.524 14.515 -11.542 1.00 0.00 C ATOM 2066 C ASN B 38 76.249 14.090 -10.808 1.00 0.00 C ATOM 2067 O ASN B 38 75.166 14.544 -11.119 1.00 0.00 O ATOM 2068 CB ASN B 38 78.030 13.346 -12.388 1.00 0.00 C ATOM 2069 CG ASN B 38 77.045 13.072 -13.525 1.00 0.00 C ATOM 2070 OD1 ASN B 38 75.881 13.410 -13.431 1.00 0.00 O ATOM 2071 ND2 ASN B 38 77.466 12.474 -14.604 1.00 0.00 N ATOM 0 H ASN B 38 79.311 14.202 -10.418 1.00 0.00 H new ATOM 0 HA ASN B 38 77.284 15.373 -12.170 1.00 0.00 H new ATOM 0 HB2 ASN B 38 79.015 13.577 -12.794 1.00 0.00 H new ATOM 0 HB3 ASN B 38 78.142 12.457 -11.768 1.00 0.00 H new ATOM 0 HD21 ASN B 38 76.819 12.289 -15.370 1.00 0.00 H new ATOM 0 HD22 ASN B 38 78.443 12.191 -14.682 1.00 0.00 H new ATOM 2078 N GLU B 39 76.357 13.192 -9.867 1.00 0.00 N ATOM 2079 CA GLU B 39 75.135 12.710 -9.154 1.00 0.00 C ATOM 2080 C GLU B 39 74.775 13.622 -7.979 1.00 0.00 C ATOM 2081 O GLU B 39 73.805 14.351 -8.031 1.00 0.00 O ATOM 2082 CB GLU B 39 75.368 11.287 -8.640 1.00 0.00 C ATOM 2083 CG GLU B 39 75.379 10.317 -9.822 1.00 0.00 C ATOM 2084 CD GLU B 39 75.613 8.892 -9.316 1.00 0.00 C ATOM 2085 OE1 GLU B 39 75.945 8.744 -8.152 1.00 0.00 O ATOM 2086 OE2 GLU B 39 75.460 7.973 -10.104 1.00 0.00 O ATOM 0 H GLU B 39 77.234 12.771 -9.560 1.00 0.00 H new ATOM 0 HA GLU B 39 74.306 12.723 -9.861 1.00 0.00 H new ATOM 0 HB2 GLU B 39 76.314 11.233 -8.102 1.00 0.00 H new ATOM 0 HB3 GLU B 39 74.584 11.010 -7.935 1.00 0.00 H new ATOM 0 HG2 GLU B 39 74.432 10.372 -10.359 1.00 0.00 H new ATOM 0 HG3 GLU B 39 76.162 10.596 -10.527 1.00 0.00 H new ATOM 2093 N LEU B 40 75.516 13.568 -6.905 1.00 0.00 N ATOM 2094 CA LEU B 40 75.169 14.411 -5.723 1.00 0.00 C ATOM 2095 C LEU B 40 75.841 15.783 -5.815 1.00 0.00 C ATOM 2096 O LEU B 40 76.964 15.969 -5.398 1.00 0.00 O ATOM 2097 CB LEU B 40 75.639 13.709 -4.442 1.00 0.00 C ATOM 2098 CG LEU B 40 74.797 12.434 -4.175 1.00 0.00 C ATOM 2099 CD1 LEU B 40 75.459 11.211 -4.827 1.00 0.00 C ATOM 2100 CD2 LEU B 40 74.689 12.192 -2.666 1.00 0.00 C ATOM 0 H LEU B 40 76.342 12.980 -6.794 1.00 0.00 H new ATOM 0 HA LEU B 40 74.088 14.550 -5.704 1.00 0.00 H new ATOM 0 HB2 LEU B 40 76.692 13.443 -4.533 1.00 0.00 H new ATOM 0 HB3 LEU B 40 75.554 14.391 -3.596 1.00 0.00 H new ATOM 0 HG LEU B 40 73.805 12.579 -4.602 1.00 0.00 H new ATOM 0 HD11 LEU B 40 74.857 10.324 -4.631 1.00 0.00 H new ATOM 0 HD12 LEU B 40 75.534 11.368 -5.903 1.00 0.00 H new ATOM 0 HD13 LEU B 40 76.456 11.072 -4.410 1.00 0.00 H new ATOM 0 HD21 LEU B 40 74.097 11.295 -2.483 1.00 0.00 H new ATOM 0 HD22 LEU B 40 75.686 12.060 -2.246 1.00 0.00 H new ATOM 0 HD23 LEU B 40 74.207 13.048 -2.194 1.00 0.00 H new ATOM 2112 N SER B 41 75.140 16.755 -6.333 1.00 0.00 N ATOM 2113 CA SER B 41 75.703 18.137 -6.437 1.00 0.00 C ATOM 2114 C SER B 41 74.598 19.137 -6.100 1.00 0.00 C ATOM 2115 O SER B 41 74.833 20.171 -5.504 1.00 0.00 O ATOM 2116 CB SER B 41 76.198 18.386 -7.862 1.00 0.00 C ATOM 2117 OG SER B 41 76.923 19.609 -7.897 1.00 0.00 O ATOM 0 H SER B 41 74.191 16.652 -6.693 1.00 0.00 H new ATOM 0 HA SER B 41 76.538 18.252 -5.746 1.00 0.00 H new ATOM 0 HB2 SER B 41 76.834 17.563 -8.188 1.00 0.00 H new ATOM 0 HB3 SER B 41 75.354 18.429 -8.551 1.00 0.00 H new ATOM 0 HG SER B 41 77.244 19.773 -8.808 1.00 0.00 H new ATOM 2123 N HIS B 42 73.393 18.836 -6.496 1.00 0.00 N ATOM 2124 CA HIS B 42 72.252 19.751 -6.228 1.00 0.00 C ATOM 2125 C HIS B 42 71.863 19.703 -4.748 1.00 0.00 C ATOM 2126 O HIS B 42 71.044 20.480 -4.297 1.00 0.00 O ATOM 2127 CB HIS B 42 71.060 19.328 -7.085 1.00 0.00 C ATOM 2128 CG HIS B 42 69.893 20.227 -6.795 1.00 0.00 C ATOM 2129 ND1 HIS B 42 68.855 19.847 -5.956 1.00 0.00 N ATOM 2130 CD2 HIS B 42 69.588 21.496 -7.221 1.00 0.00 C ATOM 2131 CE1 HIS B 42 67.983 20.870 -5.904 1.00 0.00 C ATOM 2132 NE2 HIS B 42 68.383 21.896 -6.656 1.00 0.00 N ATOM 0 H HIS B 42 73.149 17.984 -7.000 1.00 0.00 H new ATOM 0 HA HIS B 42 72.547 20.770 -6.477 1.00 0.00 H new ATOM 0 HB2 HIS B 42 71.321 19.382 -8.142 1.00 0.00 H new ATOM 0 HB3 HIS B 42 70.796 18.292 -6.874 1.00 0.00 H new ATOM 0 HD2 HIS B 42 70.191 22.091 -7.891 1.00 0.00 H new ATOM 0 HE1 HIS B 42 67.072 20.861 -5.325 1.00 0.00 H new ATOM 0 HE2 HIS B 42 67.905 22.787 -6.789 1.00 0.00 H new ATOM 2141 N PHE B 43 72.444 18.810 -3.981 1.00 0.00 N ATOM 2142 CA PHE B 43 72.113 18.721 -2.521 1.00 0.00 C ATOM 2143 C PHE B 43 73.347 19.112 -1.707 1.00 0.00 C ATOM 2144 O PHE B 43 73.287 19.262 -0.502 1.00 0.00 O ATOM 2145 CB PHE B 43 71.744 17.274 -2.184 1.00 0.00 C ATOM 2146 CG PHE B 43 70.405 16.933 -2.787 1.00 0.00 C ATOM 2147 CD1 PHE B 43 70.329 16.431 -4.091 1.00 0.00 C ATOM 2148 CD2 PHE B 43 69.236 17.125 -2.041 1.00 0.00 C ATOM 2149 CE1 PHE B 43 69.084 16.119 -4.648 1.00 0.00 C ATOM 2150 CE2 PHE B 43 67.991 16.814 -2.597 1.00 0.00 C ATOM 2151 CZ PHE B 43 67.915 16.311 -3.901 1.00 0.00 C ATOM 0 H PHE B 43 73.137 18.135 -4.305 1.00 0.00 H new ATOM 0 HA PHE B 43 71.282 19.387 -2.287 1.00 0.00 H new ATOM 0 HB2 PHE B 43 72.508 16.596 -2.566 1.00 0.00 H new ATOM 0 HB3 PHE B 43 71.711 17.140 -1.103 1.00 0.00 H new ATOM 0 HD1 PHE B 43 71.231 16.284 -4.667 1.00 0.00 H new ATOM 0 HD2 PHE B 43 69.296 17.514 -1.035 1.00 0.00 H new ATOM 0 HE1 PHE B 43 69.024 15.730 -5.654 1.00 0.00 H new ATOM 0 HE2 PHE B 43 67.089 16.962 -2.021 1.00 0.00 H new ATOM 0 HZ PHE B 43 66.954 16.071 -4.331 1.00 0.00 H new ATOM 2161 N LEU B 44 74.473 19.247 -2.361 1.00 0.00 N ATOM 2162 CA LEU B 44 75.742 19.597 -1.648 1.00 0.00 C ATOM 2163 C LEU B 44 76.136 21.049 -1.941 1.00 0.00 C ATOM 2164 O LEU B 44 75.513 21.737 -2.726 1.00 0.00 O ATOM 2165 CB LEU B 44 76.856 18.651 -2.125 1.00 0.00 C ATOM 2166 CG LEU B 44 76.761 17.306 -1.385 1.00 0.00 C ATOM 2167 CD1 LEU B 44 75.457 16.583 -1.759 1.00 0.00 C ATOM 2168 CD2 LEU B 44 77.960 16.436 -1.777 1.00 0.00 C ATOM 0 H LEU B 44 74.569 19.129 -3.370 1.00 0.00 H new ATOM 0 HA LEU B 44 75.595 19.489 -0.573 1.00 0.00 H new ATOM 0 HB2 LEU B 44 76.772 18.490 -3.200 1.00 0.00 H new ATOM 0 HB3 LEU B 44 77.831 19.105 -1.946 1.00 0.00 H new ATOM 0 HG LEU B 44 76.765 17.485 -0.310 1.00 0.00 H new ATOM 0 HD11 LEU B 44 75.403 15.633 -1.228 1.00 0.00 H new ATOM 0 HD12 LEU B 44 74.605 17.203 -1.481 1.00 0.00 H new ATOM 0 HD13 LEU B 44 75.438 16.400 -2.833 1.00 0.00 H new ATOM 0 HD21 LEU B 44 77.901 15.480 -1.257 1.00 0.00 H new ATOM 0 HD22 LEU B 44 77.949 16.265 -2.853 1.00 0.00 H new ATOM 0 HD23 LEU B 44 78.884 16.944 -1.500 1.00 0.00 H new ATOM 2180 N GLU B 45 77.171 21.510 -1.291 1.00 0.00 N ATOM 2181 CA GLU B 45 77.640 22.912 -1.482 1.00 0.00 C ATOM 2182 C GLU B 45 78.660 22.972 -2.627 1.00 0.00 C ATOM 2183 O GLU B 45 79.359 23.953 -2.785 1.00 0.00 O ATOM 2184 CB GLU B 45 78.301 23.387 -0.188 1.00 0.00 C ATOM 2185 CG GLU B 45 77.257 23.442 0.928 1.00 0.00 C ATOM 2186 CD GLU B 45 77.927 23.877 2.232 1.00 0.00 C ATOM 2187 OE1 GLU B 45 79.120 24.129 2.205 1.00 0.00 O ATOM 2188 OE2 GLU B 45 77.236 23.944 3.235 1.00 0.00 O ATOM 0 H GLU B 45 77.719 20.965 -0.626 1.00 0.00 H new ATOM 0 HA GLU B 45 76.793 23.552 -1.729 1.00 0.00 H new ATOM 0 HB2 GLU B 45 79.110 22.711 0.089 1.00 0.00 H new ATOM 0 HB3 GLU B 45 78.745 24.372 -0.334 1.00 0.00 H new ATOM 0 HG2 GLU B 45 76.463 24.141 0.664 1.00 0.00 H new ATOM 0 HG3 GLU B 45 76.792 22.464 1.054 1.00 0.00 H new ATOM 2195 N GLU B 46 78.758 21.930 -3.414 1.00 0.00 N ATOM 2196 CA GLU B 46 79.736 21.924 -4.547 1.00 0.00 C ATOM 2197 C GLU B 46 81.147 22.173 -4.008 1.00 0.00 C ATOM 2198 O GLU B 46 81.551 23.298 -3.792 1.00 0.00 O ATOM 2199 CB GLU B 46 79.366 23.010 -5.568 1.00 0.00 C ATOM 2200 CG GLU B 46 78.074 22.615 -6.286 1.00 0.00 C ATOM 2201 CD GLU B 46 77.703 23.695 -7.305 1.00 0.00 C ATOM 2202 OE1 GLU B 46 78.349 24.731 -7.304 1.00 0.00 O ATOM 2203 OE2 GLU B 46 76.783 23.466 -8.073 1.00 0.00 O ATOM 0 H GLU B 46 78.201 21.080 -3.321 1.00 0.00 H new ATOM 0 HA GLU B 46 79.706 20.953 -5.041 1.00 0.00 H new ATOM 0 HB2 GLU B 46 79.237 23.968 -5.065 1.00 0.00 H new ATOM 0 HB3 GLU B 46 80.173 23.135 -6.290 1.00 0.00 H new ATOM 0 HG2 GLU B 46 78.203 21.656 -6.788 1.00 0.00 H new ATOM 0 HG3 GLU B 46 77.268 22.490 -5.563 1.00 0.00 H new ATOM 2210 N ILE B 47 81.896 21.126 -3.779 1.00 0.00 N ATOM 2211 CA ILE B 47 83.278 21.295 -3.240 1.00 0.00 C ATOM 2212 C ILE B 47 84.169 21.970 -4.285 1.00 0.00 C ATOM 2213 O ILE B 47 84.308 21.502 -5.398 1.00 0.00 O ATOM 2214 CB ILE B 47 83.857 19.924 -2.889 1.00 0.00 C ATOM 2215 CG1 ILE B 47 83.020 19.289 -1.774 1.00 0.00 C ATOM 2216 CG2 ILE B 47 85.302 20.089 -2.411 1.00 0.00 C ATOM 2217 CD1 ILE B 47 83.412 17.819 -1.612 1.00 0.00 C ATOM 0 H ILE B 47 81.610 20.161 -3.942 1.00 0.00 H new ATOM 0 HA ILE B 47 83.239 21.919 -2.347 1.00 0.00 H new ATOM 0 HB ILE B 47 83.836 19.283 -3.770 1.00 0.00 H new ATOM 0 HG12 ILE B 47 83.178 19.823 -0.837 1.00 0.00 H new ATOM 0 HG13 ILE B 47 81.959 19.369 -2.011 1.00 0.00 H new ATOM 0 HG21 ILE B 47 85.716 19.112 -2.160 1.00 0.00 H new ATOM 0 HG22 ILE B 47 85.898 20.543 -3.203 1.00 0.00 H new ATOM 0 HG23 ILE B 47 85.323 20.729 -1.529 1.00 0.00 H new ATOM 0 HD11 ILE B 47 82.816 17.369 -0.818 1.00 0.00 H new ATOM 0 HD12 ILE B 47 83.231 17.289 -2.547 1.00 0.00 H new ATOM 0 HD13 ILE B 47 84.469 17.751 -1.355 1.00 0.00 H new ATOM 2229 N LYS B 48 84.776 23.075 -3.925 1.00 0.00 N ATOM 2230 CA LYS B 48 85.668 23.812 -4.876 1.00 0.00 C ATOM 2231 C LYS B 48 87.136 23.558 -4.520 1.00 0.00 C ATOM 2232 O LYS B 48 88.010 23.681 -5.355 1.00 0.00 O ATOM 2233 CB LYS B 48 85.363 25.312 -4.760 1.00 0.00 C ATOM 2234 CG LYS B 48 86.257 26.139 -5.699 1.00 0.00 C ATOM 2235 CD LYS B 48 85.953 25.803 -7.165 1.00 0.00 C ATOM 2236 CE LYS B 48 86.476 26.926 -8.066 1.00 0.00 C ATOM 2237 NZ LYS B 48 87.943 27.090 -7.854 1.00 0.00 N ATOM 0 H LYS B 48 84.691 23.503 -3.003 1.00 0.00 H new ATOM 0 HA LYS B 48 85.491 23.467 -5.895 1.00 0.00 H new ATOM 0 HB2 LYS B 48 84.315 25.492 -5.001 1.00 0.00 H new ATOM 0 HB3 LYS B 48 85.514 25.637 -3.731 1.00 0.00 H new ATOM 0 HG2 LYS B 48 86.095 27.202 -5.522 1.00 0.00 H new ATOM 0 HG3 LYS B 48 87.306 25.937 -5.483 1.00 0.00 H new ATOM 0 HD2 LYS B 48 86.421 24.857 -7.437 1.00 0.00 H new ATOM 0 HD3 LYS B 48 84.879 25.680 -7.306 1.00 0.00 H new ATOM 0 HE2 LYS B 48 86.272 26.693 -9.111 1.00 0.00 H new ATOM 0 HE3 LYS B 48 85.959 27.859 -7.841 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 88.341 27.673 -8.618 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 88.112 27.555 -6.939 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 88.401 26.156 -7.857 1.00 0.00 H new ATOM 2251 N GLU B 49 87.420 23.220 -3.285 1.00 0.00 N ATOM 2252 CA GLU B 49 88.841 22.978 -2.873 1.00 0.00 C ATOM 2253 C GLU B 49 89.126 21.475 -2.820 1.00 0.00 C ATOM 2254 O GLU B 49 88.338 20.697 -2.319 1.00 0.00 O ATOM 2255 CB GLU B 49 89.071 23.578 -1.485 1.00 0.00 C ATOM 2256 CG GLU B 49 89.022 25.105 -1.573 1.00 0.00 C ATOM 2257 CD GLU B 49 90.247 25.620 -2.332 1.00 0.00 C ATOM 2258 OE1 GLU B 49 91.285 24.987 -2.241 1.00 0.00 O ATOM 2259 OE2 GLU B 49 90.126 26.642 -2.988 1.00 0.00 O ATOM 0 H GLU B 49 86.730 23.101 -2.544 1.00 0.00 H new ATOM 0 HA GLU B 49 89.507 23.444 -3.600 1.00 0.00 H new ATOM 0 HB2 GLU B 49 88.311 23.219 -0.792 1.00 0.00 H new ATOM 0 HB3 GLU B 49 90.036 23.257 -1.094 1.00 0.00 H new ATOM 0 HG2 GLU B 49 88.110 25.420 -2.080 1.00 0.00 H new ATOM 0 HG3 GLU B 49 88.996 25.535 -0.572 1.00 0.00 H new ATOM 2266 N GLN B 50 90.259 21.064 -3.329 1.00 0.00 N ATOM 2267 CA GLN B 50 90.611 19.615 -3.307 1.00 0.00 C ATOM 2268 C GLN B 50 90.873 19.176 -1.864 1.00 0.00 C ATOM 2269 O GLN B 50 90.509 18.092 -1.458 1.00 0.00 O ATOM 2270 CB GLN B 50 91.870 19.381 -4.150 1.00 0.00 C ATOM 2271 CG GLN B 50 91.570 19.670 -5.624 1.00 0.00 C ATOM 2272 CD GLN B 50 90.569 18.645 -6.156 1.00 0.00 C ATOM 2273 OE1 GLN B 50 90.672 17.471 -5.866 1.00 0.00 O ATOM 2274 NE2 GLN B 50 89.596 19.044 -6.928 1.00 0.00 N ATOM 0 H GLN B 50 90.956 21.672 -3.759 1.00 0.00 H new ATOM 0 HA GLN B 50 89.786 19.034 -3.719 1.00 0.00 H new ATOM 0 HB2 GLN B 50 92.677 20.025 -3.801 1.00 0.00 H new ATOM 0 HB3 GLN B 50 92.210 18.352 -4.034 1.00 0.00 H new ATOM 0 HG2 GLN B 50 91.167 20.677 -5.732 1.00 0.00 H new ATOM 0 HG3 GLN B 50 92.490 19.631 -6.207 1.00 0.00 H new ATOM 0 HE21 GLN B 50 89.510 20.031 -7.171 1.00 0.00 H new ATOM 0 HE22 GLN B 50 88.921 18.369 -7.288 1.00 0.00 H new ATOM 2283 N GLU B 51 91.528 20.004 -1.099 1.00 0.00 N ATOM 2284 CA GLU B 51 91.849 19.638 0.313 1.00 0.00 C ATOM 2285 C GLU B 51 90.566 19.241 1.049 1.00 0.00 C ATOM 2286 O GLU B 51 90.576 18.390 1.917 1.00 0.00 O ATOM 2287 CB GLU B 51 92.485 20.842 1.013 1.00 0.00 C ATOM 2288 CG GLU B 51 93.859 21.133 0.399 1.00 0.00 C ATOM 2289 CD GLU B 51 94.827 19.999 0.738 1.00 0.00 C ATOM 2290 OE1 GLU B 51 94.715 19.457 1.824 1.00 0.00 O ATOM 2291 OE2 GLU B 51 95.666 19.693 -0.094 1.00 0.00 O ATOM 0 H GLU B 51 91.857 20.924 -1.391 1.00 0.00 H new ATOM 0 HA GLU B 51 92.543 18.797 0.321 1.00 0.00 H new ATOM 0 HB2 GLU B 51 91.840 21.715 0.913 1.00 0.00 H new ATOM 0 HB3 GLU B 51 92.588 20.642 2.079 1.00 0.00 H new ATOM 0 HG2 GLU B 51 93.770 21.237 -0.682 1.00 0.00 H new ATOM 0 HG3 GLU B 51 94.245 22.079 0.779 1.00 0.00 H new ATOM 2298 N VAL B 52 89.461 19.831 0.698 1.00 0.00 N ATOM 2299 CA VAL B 52 88.174 19.471 1.357 1.00 0.00 C ATOM 2300 C VAL B 52 87.842 18.012 1.030 1.00 0.00 C ATOM 2301 O VAL B 52 87.289 17.291 1.837 1.00 0.00 O ATOM 2302 CB VAL B 52 87.062 20.391 0.841 1.00 0.00 C ATOM 2303 CG1 VAL B 52 85.693 19.886 1.312 1.00 0.00 C ATOM 2304 CG2 VAL B 52 87.291 21.804 1.381 1.00 0.00 C ATOM 0 H VAL B 52 89.391 20.551 -0.021 1.00 0.00 H new ATOM 0 HA VAL B 52 88.259 19.592 2.437 1.00 0.00 H new ATOM 0 HB VAL B 52 87.081 20.398 -0.249 1.00 0.00 H new ATOM 0 HG11 VAL B 52 84.912 20.549 0.938 1.00 0.00 H new ATOM 0 HG12 VAL B 52 85.526 18.878 0.931 1.00 0.00 H new ATOM 0 HG13 VAL B 52 85.666 19.871 2.402 1.00 0.00 H new ATOM 0 HG21 VAL B 52 86.503 22.464 1.018 1.00 0.00 H new ATOM 0 HG22 VAL B 52 87.274 21.784 2.471 1.00 0.00 H new ATOM 0 HG23 VAL B 52 88.259 22.172 1.040 1.00 0.00 H new ATOM 2314 N VAL B 53 88.196 17.568 -0.146 1.00 0.00 N ATOM 2315 CA VAL B 53 87.921 16.151 -0.515 1.00 0.00 C ATOM 2316 C VAL B 53 88.836 15.248 0.314 1.00 0.00 C ATOM 2317 O VAL B 53 88.423 14.238 0.844 1.00 0.00 O ATOM 2318 CB VAL B 53 88.211 15.931 -2.007 1.00 0.00 C ATOM 2319 CG1 VAL B 53 88.150 14.433 -2.329 1.00 0.00 C ATOM 2320 CG2 VAL B 53 87.172 16.671 -2.854 1.00 0.00 C ATOM 0 H VAL B 53 88.662 18.123 -0.864 1.00 0.00 H new ATOM 0 HA VAL B 53 86.875 15.917 -0.319 1.00 0.00 H new ATOM 0 HB VAL B 53 89.205 16.315 -2.235 1.00 0.00 H new ATOM 0 HG11 VAL B 53 88.356 14.280 -3.388 1.00 0.00 H new ATOM 0 HG12 VAL B 53 88.894 13.902 -1.734 1.00 0.00 H new ATOM 0 HG13 VAL B 53 87.157 14.050 -2.094 1.00 0.00 H new ATOM 0 HG21 VAL B 53 87.384 16.511 -3.911 1.00 0.00 H new ATOM 0 HG22 VAL B 53 86.177 16.292 -2.622 1.00 0.00 H new ATOM 0 HG23 VAL B 53 87.215 17.737 -2.633 1.00 0.00 H new ATOM 2330 N ASP B 54 90.086 15.608 0.413 1.00 0.00 N ATOM 2331 CA ASP B 54 91.055 14.781 1.187 1.00 0.00 C ATOM 2332 C ASP B 54 90.603 14.672 2.643 1.00 0.00 C ATOM 2333 O ASP B 54 90.527 13.594 3.199 1.00 0.00 O ATOM 2334 CB ASP B 54 92.438 15.437 1.118 1.00 0.00 C ATOM 2335 CG ASP B 54 93.460 14.606 1.899 1.00 0.00 C ATOM 2336 OD1 ASP B 54 93.048 13.809 2.726 1.00 0.00 O ATOM 2337 OD2 ASP B 54 94.643 14.779 1.653 1.00 0.00 O ATOM 0 H ASP B 54 90.481 16.447 -0.013 1.00 0.00 H new ATOM 0 HA ASP B 54 91.102 13.779 0.760 1.00 0.00 H new ATOM 0 HB2 ASP B 54 92.753 15.530 0.079 1.00 0.00 H new ATOM 0 HB3 ASP B 54 92.390 16.446 1.528 1.00 0.00 H new ATOM 2342 N LYS B 55 90.295 15.772 3.265 1.00 0.00 N ATOM 2343 CA LYS B 55 89.839 15.705 4.679 1.00 0.00 C ATOM 2344 C LYS B 55 88.578 14.850 4.737 1.00 0.00 C ATOM 2345 O LYS B 55 88.465 13.933 5.526 1.00 0.00 O ATOM 2346 CB LYS B 55 89.539 17.114 5.193 1.00 0.00 C ATOM 2347 CG LYS B 55 89.291 17.065 6.703 1.00 0.00 C ATOM 2348 CD LYS B 55 88.904 18.458 7.214 1.00 0.00 C ATOM 2349 CE LYS B 55 90.029 19.466 6.937 1.00 0.00 C ATOM 2350 NZ LYS B 55 91.356 18.809 7.109 1.00 0.00 N ATOM 0 H LYS B 55 90.338 16.707 2.861 1.00 0.00 H new ATOM 0 HA LYS B 55 90.616 15.265 5.304 1.00 0.00 H new ATOM 0 HB2 LYS B 55 90.374 17.779 4.972 1.00 0.00 H new ATOM 0 HB3 LYS B 55 88.665 17.520 4.683 1.00 0.00 H new ATOM 0 HG2 LYS B 55 88.497 16.352 6.927 1.00 0.00 H new ATOM 0 HG3 LYS B 55 90.187 16.716 7.216 1.00 0.00 H new ATOM 0 HD2 LYS B 55 87.985 18.787 6.728 1.00 0.00 H new ATOM 0 HD3 LYS B 55 88.701 18.416 8.284 1.00 0.00 H new ATOM 0 HE2 LYS B 55 89.936 19.857 5.924 1.00 0.00 H new ATOM 0 HE3 LYS B 55 89.943 20.315 7.616 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 92.075 19.529 7.325 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 91.306 18.125 7.891 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 91.615 18.314 6.232 1.00 0.00 H new ATOM 2364 N VAL B 56 87.632 15.143 3.890 1.00 0.00 N ATOM 2365 CA VAL B 56 86.372 14.353 3.867 1.00 0.00 C ATOM 2366 C VAL B 56 86.693 12.900 3.515 1.00 0.00 C ATOM 2367 O VAL B 56 86.140 11.981 4.080 1.00 0.00 O ATOM 2368 CB VAL B 56 85.418 14.940 2.815 1.00 0.00 C ATOM 2369 CG1 VAL B 56 84.225 13.996 2.603 1.00 0.00 C ATOM 2370 CG2 VAL B 56 84.906 16.308 3.293 1.00 0.00 C ATOM 0 H VAL B 56 87.679 15.901 3.209 1.00 0.00 H new ATOM 0 HA VAL B 56 85.897 14.393 4.847 1.00 0.00 H new ATOM 0 HB VAL B 56 85.955 15.057 1.874 1.00 0.00 H new ATOM 0 HG11 VAL B 56 83.554 14.420 1.856 1.00 0.00 H new ATOM 0 HG12 VAL B 56 84.585 13.026 2.259 1.00 0.00 H new ATOM 0 HG13 VAL B 56 83.688 13.871 3.543 1.00 0.00 H new ATOM 0 HG21 VAL B 56 84.229 16.724 2.547 1.00 0.00 H new ATOM 0 HG22 VAL B 56 84.375 16.188 4.237 1.00 0.00 H new ATOM 0 HG23 VAL B 56 85.750 16.983 3.434 1.00 0.00 H new ATOM 2380 N MET B 57 87.581 12.686 2.584 1.00 0.00 N ATOM 2381 CA MET B 57 87.922 11.287 2.198 1.00 0.00 C ATOM 2382 C MET B 57 88.470 10.535 3.410 1.00 0.00 C ATOM 2383 O MET B 57 88.034 9.446 3.726 1.00 0.00 O ATOM 2384 CB MET B 57 88.976 11.302 1.086 1.00 0.00 C ATOM 2385 CG MET B 57 89.130 9.896 0.499 1.00 0.00 C ATOM 2386 SD MET B 57 87.764 9.584 -0.646 1.00 0.00 S ATOM 2387 CE MET B 57 88.200 7.884 -1.078 1.00 0.00 C ATOM 0 H MET B 57 88.083 13.414 2.076 1.00 0.00 H new ATOM 0 HA MET B 57 87.023 10.786 1.839 1.00 0.00 H new ATOM 0 HB2 MET B 57 88.683 12.003 0.304 1.00 0.00 H new ATOM 0 HB3 MET B 57 89.931 11.647 1.482 1.00 0.00 H new ATOM 0 HG2 MET B 57 90.084 9.807 -0.020 1.00 0.00 H new ATOM 0 HG3 MET B 57 89.130 9.153 1.296 1.00 0.00 H new ATOM 0 HE1 MET B 57 87.340 7.392 -1.533 1.00 0.00 H new ATOM 0 HE2 MET B 57 89.031 7.890 -1.784 1.00 0.00 H new ATOM 0 HE3 MET B 57 88.492 7.343 -0.178 1.00 0.00 H new ATOM 2397 N GLU B 58 89.422 11.104 4.093 1.00 0.00 N ATOM 2398 CA GLU B 58 89.992 10.413 5.285 1.00 0.00 C ATOM 2399 C GLU B 58 88.875 10.183 6.305 1.00 0.00 C ATOM 2400 O GLU B 58 88.769 9.131 6.904 1.00 0.00 O ATOM 2401 CB GLU B 58 91.100 11.279 5.899 1.00 0.00 C ATOM 2402 CG GLU B 58 91.740 10.556 7.088 1.00 0.00 C ATOM 2403 CD GLU B 58 92.410 9.265 6.612 1.00 0.00 C ATOM 2404 OE1 GLU B 58 92.682 9.163 5.427 1.00 0.00 O ATOM 2405 OE2 GLU B 58 92.644 8.403 7.442 1.00 0.00 O ATOM 0 H GLU B 58 89.830 12.014 3.880 1.00 0.00 H new ATOM 0 HA GLU B 58 90.419 9.454 4.993 1.00 0.00 H new ATOM 0 HB2 GLU B 58 91.858 11.499 5.147 1.00 0.00 H new ATOM 0 HB3 GLU B 58 90.687 12.234 6.224 1.00 0.00 H new ATOM 0 HG2 GLU B 58 92.476 11.203 7.566 1.00 0.00 H new ATOM 0 HG3 GLU B 58 90.982 10.328 7.837 1.00 0.00 H new ATOM 2412 N THR B 59 88.033 11.159 6.491 1.00 0.00 N ATOM 2413 CA THR B 59 86.903 11.009 7.451 1.00 0.00 C ATOM 2414 C THR B 59 85.930 9.951 6.927 1.00 0.00 C ATOM 2415 O THR B 59 85.403 9.148 7.671 1.00 0.00 O ATOM 2416 CB THR B 59 86.170 12.349 7.587 1.00 0.00 C ATOM 2417 OG1 THR B 59 87.072 13.337 8.066 1.00 0.00 O ATOM 2418 CG2 THR B 59 84.995 12.204 8.560 1.00 0.00 C ATOM 0 H THR B 59 88.078 12.061 6.017 1.00 0.00 H new ATOM 0 HA THR B 59 87.288 10.703 8.423 1.00 0.00 H new ATOM 0 HB THR B 59 85.788 12.651 6.612 1.00 0.00 H new ATOM 0 HG1 THR B 59 87.632 13.654 7.327 1.00 0.00 H new ATOM 0 HG21 THR B 59 84.479 13.160 8.652 1.00 0.00 H new ATOM 0 HG22 THR B 59 84.302 11.452 8.184 1.00 0.00 H new ATOM 0 HG23 THR B 59 85.368 11.897 9.537 1.00 0.00 H new ATOM 2426 N LEU B 60 85.692 9.954 5.646 1.00 0.00 N ATOM 2427 CA LEU B 60 84.754 8.960 5.049 1.00 0.00 C ATOM 2428 C LEU B 60 85.393 7.565 5.065 1.00 0.00 C ATOM 2429 O LEU B 60 84.745 6.576 5.343 1.00 0.00 O ATOM 2430 CB LEU B 60 84.437 9.385 3.602 1.00 0.00 C ATOM 2431 CG LEU B 60 83.043 8.894 3.164 1.00 0.00 C ATOM 2432 CD1 LEU B 60 82.931 7.373 3.349 1.00 0.00 C ATOM 2433 CD2 LEU B 60 81.936 9.606 3.977 1.00 0.00 C ATOM 0 H LEU B 60 86.109 10.606 4.981 1.00 0.00 H new ATOM 0 HA LEU B 60 83.832 8.924 5.629 1.00 0.00 H new ATOM 0 HB2 LEU B 60 84.484 10.471 3.522 1.00 0.00 H new ATOM 0 HB3 LEU B 60 85.194 8.983 2.929 1.00 0.00 H new ATOM 0 HG LEU B 60 82.912 9.134 2.109 1.00 0.00 H new ATOM 0 HD11 LEU B 60 81.941 7.040 3.036 1.00 0.00 H new ATOM 0 HD12 LEU B 60 83.689 6.876 2.744 1.00 0.00 H new ATOM 0 HD13 LEU B 60 83.083 7.122 4.399 1.00 0.00 H new ATOM 0 HD21 LEU B 60 80.959 9.247 3.654 1.00 0.00 H new ATOM 0 HD22 LEU B 60 82.069 9.392 5.038 1.00 0.00 H new ATOM 0 HD23 LEU B 60 81.999 10.682 3.813 1.00 0.00 H new ATOM 2445 N ASP B 61 86.655 7.472 4.744 1.00 0.00 N ATOM 2446 CA ASP B 61 87.321 6.137 4.713 1.00 0.00 C ATOM 2447 C ASP B 61 87.399 5.539 6.117 1.00 0.00 C ATOM 2448 O ASP B 61 88.274 5.866 6.896 1.00 0.00 O ATOM 2449 CB ASP B 61 88.738 6.286 4.159 1.00 0.00 C ATOM 2450 CG ASP B 61 88.675 6.662 2.677 1.00 0.00 C ATOM 2451 OD1 ASP B 61 87.604 6.551 2.103 1.00 0.00 O ATOM 2452 OD2 ASP B 61 89.699 7.051 2.141 1.00 0.00 O ATOM 0 H ASP B 61 87.254 8.262 4.502 1.00 0.00 H new ATOM 0 HA ASP B 61 86.735 5.474 4.076 1.00 0.00 H new ATOM 0 HB2 ASP B 61 89.278 7.052 4.716 1.00 0.00 H new ATOM 0 HB3 ASP B 61 89.288 5.353 4.285 1.00 0.00 H new ATOM 2457 N GLU B 62 86.508 4.644 6.437 1.00 0.00 N ATOM 2458 CA GLU B 62 86.547 4.002 7.779 1.00 0.00 C ATOM 2459 C GLU B 62 87.815 3.153 7.887 1.00 0.00 C ATOM 2460 O GLU B 62 88.457 3.101 8.917 1.00 0.00 O ATOM 2461 CB GLU B 62 85.310 3.119 7.968 1.00 0.00 C ATOM 2462 CG GLU B 62 84.069 4.004 8.103 1.00 0.00 C ATOM 2463 CD GLU B 62 84.115 4.742 9.443 1.00 0.00 C ATOM 2464 OE1 GLU B 62 84.886 4.333 10.296 1.00 0.00 O ATOM 2465 OE2 GLU B 62 83.384 5.708 9.593 1.00 0.00 O ATOM 0 H GLU B 62 85.754 4.329 5.827 1.00 0.00 H new ATOM 0 HA GLU B 62 86.553 4.769 8.554 1.00 0.00 H new ATOM 0 HB2 GLU B 62 85.198 2.444 7.119 1.00 0.00 H new ATOM 0 HB3 GLU B 62 85.425 2.498 8.856 1.00 0.00 H new ATOM 0 HG2 GLU B 62 84.028 4.720 7.282 1.00 0.00 H new ATOM 0 HG3 GLU B 62 83.167 3.396 8.041 1.00 0.00 H new ATOM 2472 N ASP B 63 88.170 2.476 6.828 1.00 0.00 N ATOM 2473 CA ASP B 63 89.388 1.615 6.852 1.00 0.00 C ATOM 2474 C ASP B 63 90.634 2.438 6.497 1.00 0.00 C ATOM 2475 O ASP B 63 91.750 1.980 6.653 1.00 0.00 O ATOM 2476 CB ASP B 63 89.212 0.492 5.831 1.00 0.00 C ATOM 2477 CG ASP B 63 89.023 1.098 4.438 1.00 0.00 C ATOM 2478 OD1 ASP B 63 88.817 2.298 4.358 1.00 0.00 O ATOM 2479 OD2 ASP B 63 89.077 0.351 3.476 1.00 0.00 O ATOM 0 H ASP B 63 87.665 2.483 5.942 1.00 0.00 H new ATOM 0 HA ASP B 63 89.519 1.202 7.852 1.00 0.00 H new ATOM 0 HB2 ASP B 63 90.083 -0.163 5.840 1.00 0.00 H new ATOM 0 HB3 ASP B 63 88.350 -0.121 6.093 1.00 0.00 H new ATOM 2484 N GLY B 64 90.465 3.646 6.031 1.00 0.00 N ATOM 2485 CA GLY B 64 91.653 4.480 5.683 1.00 0.00 C ATOM 2486 C GLY B 64 92.376 3.889 4.468 1.00 0.00 C ATOM 2487 O GLY B 64 93.559 4.098 4.283 1.00 0.00 O ATOM 0 H GLY B 64 89.560 4.091 5.876 1.00 0.00 H new ATOM 0 HA2 GLY B 64 91.339 5.501 5.467 1.00 0.00 H new ATOM 0 HA3 GLY B 64 92.334 4.529 6.533 1.00 0.00 H new ATOM 2491 N ASP B 65 91.689 3.142 3.646 1.00 0.00 N ATOM 2492 CA ASP B 65 92.358 2.532 2.458 1.00 0.00 C ATOM 2493 C ASP B 65 92.661 3.605 1.408 1.00 0.00 C ATOM 2494 O ASP B 65 93.319 3.344 0.421 1.00 0.00 O ATOM 2495 CB ASP B 65 91.445 1.471 1.841 1.00 0.00 C ATOM 2496 CG ASP B 65 90.152 2.128 1.356 1.00 0.00 C ATOM 2497 OD1 ASP B 65 89.863 3.227 1.802 1.00 0.00 O ATOM 2498 OD2 ASP B 65 89.473 1.521 0.544 1.00 0.00 O ATOM 0 H ASP B 65 90.697 2.928 3.744 1.00 0.00 H new ATOM 0 HA ASP B 65 93.292 2.074 2.782 1.00 0.00 H new ATOM 0 HB2 ASP B 65 91.950 0.981 1.009 1.00 0.00 H new ATOM 0 HB3 ASP B 65 91.219 0.699 2.576 1.00 0.00 H new ATOM 2503 N GLY B 66 92.215 4.812 1.615 1.00 0.00 N ATOM 2504 CA GLY B 66 92.513 5.893 0.628 1.00 0.00 C ATOM 2505 C GLY B 66 91.579 5.796 -0.580 1.00 0.00 C ATOM 2506 O GLY B 66 91.541 6.683 -1.409 1.00 0.00 O ATOM 0 H GLY B 66 91.659 5.099 2.421 1.00 0.00 H new ATOM 0 HA2 GLY B 66 92.400 6.867 1.103 1.00 0.00 H new ATOM 0 HA3 GLY B 66 93.549 5.816 0.299 1.00 0.00 H new ATOM 2510 N GLU B 67 90.820 4.737 -0.690 1.00 0.00 N ATOM 2511 CA GLU B 67 89.881 4.578 -1.840 1.00 0.00 C ATOM 2512 C GLU B 67 88.564 4.025 -1.297 1.00 0.00 C ATOM 2513 O GLU B 67 88.515 3.544 -0.184 1.00 0.00 O ATOM 2514 CB GLU B 67 90.486 3.603 -2.856 1.00 0.00 C ATOM 2515 CG GLU B 67 90.530 2.185 -2.274 1.00 0.00 C ATOM 2516 CD GLU B 67 91.348 1.281 -3.198 1.00 0.00 C ATOM 2517 OE1 GLU B 67 92.402 1.712 -3.636 1.00 0.00 O ATOM 2518 OE2 GLU B 67 90.909 0.170 -3.448 1.00 0.00 O ATOM 0 H GLU B 67 90.811 3.965 -0.023 1.00 0.00 H new ATOM 0 HA GLU B 67 89.708 5.533 -2.336 1.00 0.00 H new ATOM 0 HB2 GLU B 67 89.895 3.609 -3.772 1.00 0.00 H new ATOM 0 HB3 GLU B 67 91.492 3.925 -3.124 1.00 0.00 H new ATOM 0 HG2 GLU B 67 90.973 2.202 -1.278 1.00 0.00 H new ATOM 0 HG3 GLU B 67 89.519 1.793 -2.166 1.00 0.00 H new ATOM 2525 N CYS B 68 87.490 4.088 -2.052 1.00 0.00 N ATOM 2526 CA CYS B 68 86.180 3.562 -1.542 1.00 0.00 C ATOM 2527 C CYS B 68 85.798 2.286 -2.297 1.00 0.00 C ATOM 2528 O CYS B 68 85.438 2.320 -3.457 1.00 0.00 O ATOM 2529 CB CYS B 68 85.099 4.622 -1.768 1.00 0.00 C ATOM 2530 SG CYS B 68 83.544 4.067 -1.029 1.00 0.00 S ATOM 0 H CYS B 68 87.463 4.479 -2.994 1.00 0.00 H new ATOM 0 HA CYS B 68 86.270 3.335 -0.480 1.00 0.00 H new ATOM 0 HB2 CYS B 68 85.406 5.570 -1.326 1.00 0.00 H new ATOM 0 HB3 CYS B 68 84.964 4.797 -2.835 1.00 0.00 H new ATOM 0 HG CYS B 68 82.627 4.968 -1.220 1.00 0.00 H new ATOM 2536 N ASP B 69 85.891 1.160 -1.645 1.00 0.00 N ATOM 2537 CA ASP B 69 85.552 -0.129 -2.313 1.00 0.00 C ATOM 2538 C ASP B 69 84.035 -0.252 -2.502 1.00 0.00 C ATOM 2539 O ASP B 69 83.274 0.625 -2.146 1.00 0.00 O ATOM 2540 CB ASP B 69 86.075 -1.295 -1.469 1.00 0.00 C ATOM 2541 CG ASP B 69 85.265 -1.402 -0.175 1.00 0.00 C ATOM 2542 OD1 ASP B 69 84.622 -0.430 0.180 1.00 0.00 O ATOM 2543 OD2 ASP B 69 85.305 -2.456 0.440 1.00 0.00 O ATOM 0 H ASP B 69 86.189 1.077 -0.673 1.00 0.00 H new ATOM 0 HA ASP B 69 86.023 -0.155 -3.295 1.00 0.00 H new ATOM 0 HB2 ASP B 69 86.002 -2.225 -2.032 1.00 0.00 H new ATOM 0 HB3 ASP B 69 87.129 -1.144 -1.237 1.00 0.00 H new ATOM 2548 N PHE B 70 83.607 -1.347 -3.068 1.00 0.00 N ATOM 2549 CA PHE B 70 82.150 -1.567 -3.307 1.00 0.00 C ATOM 2550 C PHE B 70 81.383 -1.545 -1.976 1.00 0.00 C ATOM 2551 O PHE B 70 80.368 -0.893 -1.840 1.00 0.00 O ATOM 2552 CB PHE B 70 81.967 -2.922 -3.999 1.00 0.00 C ATOM 2553 CG PHE B 70 80.503 -3.181 -4.257 1.00 0.00 C ATOM 2554 CD1 PHE B 70 79.915 -2.745 -5.451 1.00 0.00 C ATOM 2555 CD2 PHE B 70 79.738 -3.874 -3.312 1.00 0.00 C ATOM 2556 CE1 PHE B 70 78.559 -3.000 -5.697 1.00 0.00 C ATOM 2557 CE2 PHE B 70 78.384 -4.127 -3.557 1.00 0.00 C ATOM 2558 CZ PHE B 70 77.793 -3.691 -4.749 1.00 0.00 C ATOM 0 H PHE B 70 84.211 -2.108 -3.379 1.00 0.00 H new ATOM 0 HA PHE B 70 81.757 -0.772 -3.940 1.00 0.00 H new ATOM 0 HB2 PHE B 70 82.518 -2.936 -4.940 1.00 0.00 H new ATOM 0 HB3 PHE B 70 82.380 -3.715 -3.376 1.00 0.00 H new ATOM 0 HD1 PHE B 70 80.506 -2.213 -6.182 1.00 0.00 H new ATOM 0 HD2 PHE B 70 80.193 -4.214 -2.393 1.00 0.00 H new ATOM 0 HE1 PHE B 70 78.105 -2.664 -6.617 1.00 0.00 H new ATOM 0 HE2 PHE B 70 77.794 -4.659 -2.826 1.00 0.00 H new ATOM 0 HZ PHE B 70 76.748 -3.887 -4.938 1.00 0.00 H new ATOM 2568 N GLN B 71 81.843 -2.284 -1.007 1.00 0.00 N ATOM 2569 CA GLN B 71 81.111 -2.331 0.295 1.00 0.00 C ATOM 2570 C GLN B 71 81.010 -0.919 0.883 1.00 0.00 C ATOM 2571 O GLN B 71 79.934 -0.442 1.186 1.00 0.00 O ATOM 2572 CB GLN B 71 81.866 -3.237 1.269 1.00 0.00 C ATOM 2573 CG GLN B 71 81.762 -4.691 0.803 1.00 0.00 C ATOM 2574 CD GLN B 71 82.606 -4.881 -0.458 1.00 0.00 C ATOM 2575 OE1 GLN B 71 83.757 -4.494 -0.497 1.00 0.00 O ATOM 2576 NE2 GLN B 71 82.079 -5.464 -1.499 1.00 0.00 N ATOM 0 H GLN B 71 82.687 -2.855 -1.056 1.00 0.00 H new ATOM 0 HA GLN B 71 80.108 -2.725 0.132 1.00 0.00 H new ATOM 0 HB2 GLN B 71 82.912 -2.936 1.325 1.00 0.00 H new ATOM 0 HB3 GLN B 71 81.451 -3.135 2.272 1.00 0.00 H new ATOM 0 HG2 GLN B 71 82.107 -5.362 1.590 1.00 0.00 H new ATOM 0 HG3 GLN B 71 80.722 -4.946 0.600 1.00 0.00 H new ATOM 0 HE21 GLN B 71 81.113 -5.789 -1.467 1.00 0.00 H new ATOM 0 HE22 GLN B 71 82.633 -5.595 -2.345 1.00 0.00 H new ATOM 2585 N GLU B 72 82.114 -0.245 1.051 1.00 0.00 N ATOM 2586 CA GLU B 72 82.058 1.137 1.625 1.00 0.00 C ATOM 2587 C GLU B 72 81.201 2.009 0.701 1.00 0.00 C ATOM 2588 O GLU B 72 80.415 2.825 1.136 1.00 0.00 O ATOM 2589 CB GLU B 72 83.481 1.706 1.693 1.00 0.00 C ATOM 2590 CG GLU B 72 83.460 3.120 2.280 1.00 0.00 C ATOM 2591 CD GLU B 72 84.891 3.662 2.336 1.00 0.00 C ATOM 2592 OE1 GLU B 72 85.806 2.886 2.110 1.00 0.00 O ATOM 2593 OE2 GLU B 72 85.046 4.842 2.600 1.00 0.00 O ATOM 0 H GLU B 72 83.047 -0.584 0.819 1.00 0.00 H new ATOM 0 HA GLU B 72 81.627 1.119 2.626 1.00 0.00 H new ATOM 0 HB2 GLU B 72 84.110 1.060 2.306 1.00 0.00 H new ATOM 0 HB3 GLU B 72 83.920 1.725 0.696 1.00 0.00 H new ATOM 0 HG2 GLU B 72 82.835 3.771 1.669 1.00 0.00 H new ATOM 0 HG3 GLU B 72 83.024 3.106 3.279 1.00 0.00 H new ATOM 2600 N PHE B 73 81.378 1.840 -0.574 1.00 0.00 N ATOM 2601 CA PHE B 73 80.600 2.660 -1.544 1.00 0.00 C ATOM 2602 C PHE B 73 79.114 2.571 -1.191 1.00 0.00 C ATOM 2603 O PHE B 73 78.393 3.547 -1.243 1.00 0.00 O ATOM 2604 CB PHE B 73 80.818 2.154 -2.968 1.00 0.00 C ATOM 2605 CG PHE B 73 79.975 2.980 -3.911 1.00 0.00 C ATOM 2606 CD1 PHE B 73 80.378 4.275 -4.256 1.00 0.00 C ATOM 2607 CD2 PHE B 73 78.788 2.453 -4.434 1.00 0.00 C ATOM 2608 CE1 PHE B 73 79.594 5.044 -5.125 1.00 0.00 C ATOM 2609 CE2 PHE B 73 78.005 3.222 -5.303 1.00 0.00 C ATOM 2610 CZ PHE B 73 78.408 4.517 -5.649 1.00 0.00 C ATOM 0 H PHE B 73 82.026 1.171 -0.990 1.00 0.00 H new ATOM 0 HA PHE B 73 80.937 3.695 -1.488 1.00 0.00 H new ATOM 0 HB2 PHE B 73 81.871 2.229 -3.238 1.00 0.00 H new ATOM 0 HB3 PHE B 73 80.545 1.101 -3.041 1.00 0.00 H new ATOM 0 HD1 PHE B 73 81.294 4.681 -3.852 1.00 0.00 H new ATOM 0 HD2 PHE B 73 78.477 1.454 -4.167 1.00 0.00 H new ATOM 0 HE1 PHE B 73 79.905 6.044 -5.391 1.00 0.00 H new ATOM 0 HE2 PHE B 73 77.089 2.816 -5.707 1.00 0.00 H new ATOM 0 HZ PHE B 73 77.804 5.109 -6.320 1.00 0.00 H new ATOM 2620 N MET B 74 78.654 1.412 -0.815 1.00 0.00 N ATOM 2621 CA MET B 74 77.220 1.264 -0.439 1.00 0.00 C ATOM 2622 C MET B 74 76.945 2.080 0.833 1.00 0.00 C ATOM 2623 O MET B 74 75.850 2.559 1.052 1.00 0.00 O ATOM 2624 CB MET B 74 76.906 -0.210 -0.181 1.00 0.00 C ATOM 2625 CG MET B 74 75.394 -0.394 -0.039 1.00 0.00 C ATOM 2626 SD MET B 74 74.612 -0.232 -1.663 1.00 0.00 S ATOM 2627 CE MET B 74 72.999 0.334 -1.073 1.00 0.00 C ATOM 0 H MET B 74 79.209 0.559 -0.751 1.00 0.00 H new ATOM 0 HA MET B 74 76.590 1.628 -1.251 1.00 0.00 H new ATOM 0 HB2 MET B 74 77.282 -0.822 -1.001 1.00 0.00 H new ATOM 0 HB3 MET B 74 77.410 -0.547 0.725 1.00 0.00 H new ATOM 0 HG2 MET B 74 75.174 -1.373 0.386 1.00 0.00 H new ATOM 0 HG3 MET B 74 74.989 0.350 0.647 1.00 0.00 H new ATOM 0 HE1 MET B 74 72.344 0.518 -1.925 1.00 0.00 H new ATOM 0 HE2 MET B 74 72.557 -0.430 -0.434 1.00 0.00 H new ATOM 0 HE3 MET B 74 73.123 1.256 -0.504 1.00 0.00 H new ATOM 2637 N ALA B 75 77.941 2.254 1.664 1.00 0.00 N ATOM 2638 CA ALA B 75 77.739 3.055 2.909 1.00 0.00 C ATOM 2639 C ALA B 75 77.477 4.511 2.518 1.00 0.00 C ATOM 2640 O ALA B 75 76.504 5.116 2.923 1.00 0.00 O ATOM 2641 CB ALA B 75 78.991 2.973 3.789 1.00 0.00 C ATOM 0 H ALA B 75 78.881 1.878 1.535 1.00 0.00 H new ATOM 0 HA ALA B 75 76.890 2.662 3.468 1.00 0.00 H new ATOM 0 HB1 ALA B 75 78.838 3.559 4.695 1.00 0.00 H new ATOM 0 HB2 ALA B 75 79.180 1.933 4.057 1.00 0.00 H new ATOM 0 HB3 ALA B 75 79.847 3.368 3.242 1.00 0.00 H new ATOM 2647 N PHE B 76 78.353 5.071 1.732 1.00 0.00 N ATOM 2648 CA PHE B 76 78.179 6.490 1.302 1.00 0.00 C ATOM 2649 C PHE B 76 76.755 6.658 0.771 1.00 0.00 C ATOM 2650 O PHE B 76 76.080 7.633 1.040 1.00 0.00 O ATOM 2651 CB PHE B 76 79.179 6.794 0.186 1.00 0.00 C ATOM 2652 CG PHE B 76 79.186 8.274 -0.103 1.00 0.00 C ATOM 2653 CD1 PHE B 76 78.292 8.809 -1.034 1.00 0.00 C ATOM 2654 CD2 PHE B 76 80.092 9.107 0.561 1.00 0.00 C ATOM 2655 CE1 PHE B 76 78.304 10.185 -1.304 1.00 0.00 C ATOM 2656 CE2 PHE B 76 80.108 10.480 0.294 1.00 0.00 C ATOM 2657 CZ PHE B 76 79.215 11.021 -0.639 1.00 0.00 C ATOM 0 H PHE B 76 79.185 4.607 1.367 1.00 0.00 H new ATOM 0 HA PHE B 76 78.349 7.169 2.137 1.00 0.00 H new ATOM 0 HB2 PHE B 76 80.176 6.467 0.480 1.00 0.00 H new ATOM 0 HB3 PHE B 76 78.913 6.239 -0.714 1.00 0.00 H new ATOM 0 HD1 PHE B 76 77.593 8.164 -1.545 1.00 0.00 H new ATOM 0 HD2 PHE B 76 80.780 8.690 1.281 1.00 0.00 H new ATOM 0 HE1 PHE B 76 77.613 10.601 -2.023 1.00 0.00 H new ATOM 0 HE2 PHE B 76 80.809 11.122 0.807 1.00 0.00 H new ATOM 0 HZ PHE B 76 79.227 12.081 -0.847 1.00 0.00 H new ATOM 2667 N VAL B 77 76.289 5.681 0.053 1.00 0.00 N ATOM 2668 CA VAL B 77 74.896 5.738 -0.464 1.00 0.00 C ATOM 2669 C VAL B 77 73.953 5.725 0.742 1.00 0.00 C ATOM 2670 O VAL B 77 72.978 6.449 0.791 1.00 0.00 O ATOM 2671 CB VAL B 77 74.619 4.528 -1.360 1.00 0.00 C ATOM 2672 CG1 VAL B 77 73.125 4.452 -1.689 1.00 0.00 C ATOM 2673 CG2 VAL B 77 75.419 4.671 -2.655 1.00 0.00 C ATOM 0 H VAL B 77 76.812 4.843 -0.200 1.00 0.00 H new ATOM 0 HA VAL B 77 74.745 6.640 -1.057 1.00 0.00 H new ATOM 0 HB VAL B 77 74.915 3.617 -0.840 1.00 0.00 H new ATOM 0 HG11 VAL B 77 72.936 3.588 -2.327 1.00 0.00 H new ATOM 0 HG12 VAL B 77 72.554 4.353 -0.766 1.00 0.00 H new ATOM 0 HG13 VAL B 77 72.820 5.360 -2.209 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.227 3.812 -3.298 1.00 0.00 H new ATOM 0 HG22 VAL B 77 75.119 5.584 -3.169 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.483 4.719 -2.422 1.00 0.00 H new ATOM 2683 N SER B 78 74.247 4.910 1.724 1.00 0.00 N ATOM 2684 CA SER B 78 73.379 4.854 2.933 1.00 0.00 C ATOM 2685 C SER B 78 73.535 6.148 3.730 1.00 0.00 C ATOM 2686 O SER B 78 72.570 6.750 4.144 1.00 0.00 O ATOM 2687 CB SER B 78 73.798 3.675 3.811 1.00 0.00 C ATOM 2688 OG SER B 78 75.043 3.971 4.429 1.00 0.00 O ATOM 0 H SER B 78 75.051 4.282 1.738 1.00 0.00 H new ATOM 0 HA SER B 78 72.341 4.731 2.625 1.00 0.00 H new ATOM 0 HB2 SER B 78 73.039 3.483 4.569 1.00 0.00 H new ATOM 0 HB3 SER B 78 73.883 2.770 3.209 1.00 0.00 H new ATOM 0 HG SER B 78 75.604 4.480 3.807 1.00 0.00 H new ATOM 2694 N MET B 79 74.748 6.564 3.972 1.00 0.00 N ATOM 2695 CA MET B 79 74.972 7.803 4.776 1.00 0.00 C ATOM 2696 C MET B 79 74.076 8.918 4.246 1.00 0.00 C ATOM 2697 O MET B 79 73.481 9.663 5.000 1.00 0.00 O ATOM 2698 CB MET B 79 76.442 8.217 4.660 1.00 0.00 C ATOM 2699 CG MET B 79 76.749 9.349 5.644 1.00 0.00 C ATOM 2700 SD MET B 79 78.505 9.779 5.523 1.00 0.00 S ATOM 2701 CE MET B 79 78.682 10.536 7.159 1.00 0.00 C ATOM 0 H MET B 79 75.596 6.100 3.648 1.00 0.00 H new ATOM 0 HA MET B 79 74.730 7.616 5.822 1.00 0.00 H new ATOM 0 HB2 MET B 79 77.086 7.362 4.865 1.00 0.00 H new ATOM 0 HB3 MET B 79 76.657 8.541 3.642 1.00 0.00 H new ATOM 0 HG2 MET B 79 76.132 10.219 5.420 1.00 0.00 H new ATOM 0 HG3 MET B 79 76.507 9.040 6.661 1.00 0.00 H new ATOM 0 HE1 MET B 79 79.709 10.876 7.293 1.00 0.00 H new ATOM 0 HE2 MET B 79 78.004 11.386 7.242 1.00 0.00 H new ATOM 0 HE3 MET B 79 78.439 9.802 7.928 1.00 0.00 H new ATOM 2711 N VAL B 80 73.945 9.021 2.959 1.00 0.00 N ATOM 2712 CA VAL B 80 73.054 10.066 2.391 1.00 0.00 C ATOM 2713 C VAL B 80 71.611 9.692 2.739 1.00 0.00 C ATOM 2714 O VAL B 80 70.754 10.539 2.896 1.00 0.00 O ATOM 2715 CB VAL B 80 73.242 10.143 0.871 1.00 0.00 C ATOM 2716 CG1 VAL B 80 72.254 11.162 0.285 1.00 0.00 C ATOM 2717 CG2 VAL B 80 74.679 10.587 0.556 1.00 0.00 C ATOM 0 H VAL B 80 74.415 8.429 2.274 1.00 0.00 H new ATOM 0 HA VAL B 80 73.294 11.044 2.807 1.00 0.00 H new ATOM 0 HB VAL B 80 73.058 9.163 0.431 1.00 0.00 H new ATOM 0 HG11 VAL B 80 72.387 11.218 -0.795 1.00 0.00 H new ATOM 0 HG12 VAL B 80 71.234 10.850 0.510 1.00 0.00 H new ATOM 0 HG13 VAL B 80 72.439 12.142 0.724 1.00 0.00 H new ATOM 0 HG21 VAL B 80 74.814 10.642 -0.524 1.00 0.00 H new ATOM 0 HG22 VAL B 80 74.861 11.568 0.995 1.00 0.00 H new ATOM 0 HG23 VAL B 80 75.382 9.866 0.973 1.00 0.00 H new ATOM 2727 N THR B 81 71.354 8.419 2.901 1.00 0.00 N ATOM 2728 CA THR B 81 69.986 7.964 3.289 1.00 0.00 C ATOM 2729 C THR B 81 69.829 8.085 4.812 1.00 0.00 C ATOM 2730 O THR B 81 68.847 8.592 5.315 1.00 0.00 O ATOM 2731 CB THR B 81 69.795 6.500 2.878 1.00 0.00 C ATOM 2732 OG1 THR B 81 70.229 6.325 1.537 1.00 0.00 O ATOM 2733 CG2 THR B 81 68.316 6.118 2.992 1.00 0.00 C ATOM 0 H THR B 81 72.038 7.672 2.780 1.00 0.00 H new ATOM 0 HA THR B 81 69.241 8.582 2.788 1.00 0.00 H new ATOM 0 HB THR B 81 70.382 5.861 3.538 1.00 0.00 H new ATOM 0 HG1 THR B 81 70.286 7.198 1.095 1.00 0.00 H new ATOM 0 HG21 THR B 81 68.186 5.076 2.699 1.00 0.00 H new ATOM 0 HG22 THR B 81 67.985 6.249 4.022 1.00 0.00 H new ATOM 0 HG23 THR B 81 67.724 6.756 2.336 1.00 0.00 H new ATOM 2741 N THR B 82 70.803 7.602 5.540 1.00 0.00 N ATOM 2742 CA THR B 82 70.757 7.653 7.032 1.00 0.00 C ATOM 2743 C THR B 82 70.879 9.103 7.510 1.00 0.00 C ATOM 2744 O THR B 82 70.558 9.422 8.637 1.00 0.00 O ATOM 2745 CB THR B 82 71.915 6.817 7.601 1.00 0.00 C ATOM 2746 OG1 THR B 82 72.050 5.627 6.838 1.00 0.00 O ATOM 2747 CG2 THR B 82 71.633 6.451 9.062 1.00 0.00 C ATOM 0 H THR B 82 71.642 7.167 5.156 1.00 0.00 H new ATOM 0 HA THR B 82 69.807 7.247 7.380 1.00 0.00 H new ATOM 0 HB THR B 82 72.835 7.399 7.551 1.00 0.00 H new ATOM 0 HG1 THR B 82 72.788 5.091 7.196 1.00 0.00 H new ATOM 0 HG21 THR B 82 72.460 5.859 9.455 1.00 0.00 H new ATOM 0 HG22 THR B 82 71.527 7.362 9.651 1.00 0.00 H new ATOM 0 HG23 THR B 82 70.712 5.871 9.121 1.00 0.00 H new ATOM 2755 N ALA B 83 71.327 9.985 6.661 1.00 0.00 N ATOM 2756 CA ALA B 83 71.451 11.410 7.079 1.00 0.00 C ATOM 2757 C ALA B 83 70.057 12.038 7.082 1.00 0.00 C ATOM 2758 O ALA B 83 69.539 12.435 8.107 1.00 0.00 O ATOM 2759 CB ALA B 83 72.344 12.162 6.087 1.00 0.00 C ATOM 0 H ALA B 83 71.611 9.784 5.702 1.00 0.00 H new ATOM 0 HA ALA B 83 71.893 11.469 8.073 1.00 0.00 H new ATOM 0 HB1 ALA B 83 72.433 13.204 6.395 1.00 0.00 H new ATOM 0 HB2 ALA B 83 73.333 11.704 6.068 1.00 0.00 H new ATOM 0 HB3 ALA B 83 71.902 12.114 5.092 1.00 0.00 H new ATOM 2765 N CYS B 84 69.452 12.133 5.933 1.00 0.00 N ATOM 2766 CA CYS B 84 68.092 12.736 5.851 1.00 0.00 C ATOM 2767 C CYS B 84 67.049 11.724 6.338 1.00 0.00 C ATOM 2768 O CYS B 84 66.249 11.227 5.571 1.00 0.00 O ATOM 2769 CB CYS B 84 67.794 13.116 4.400 1.00 0.00 C ATOM 2770 SG CYS B 84 68.839 14.512 3.913 1.00 0.00 S ATOM 0 H CYS B 84 69.841 11.819 5.044 1.00 0.00 H new ATOM 0 HA CYS B 84 68.051 13.626 6.479 1.00 0.00 H new ATOM 0 HB2 CYS B 84 67.978 12.264 3.745 1.00 0.00 H new ATOM 0 HB3 CYS B 84 66.742 13.380 4.291 1.00 0.00 H new ATOM 0 HG CYS B 84 68.324 15.097 2.873 1.00 0.00 H new ATOM 2776 N HIS B 85 67.048 11.423 7.609 1.00 0.00 N ATOM 2777 CA HIS B 85 66.049 10.453 8.147 1.00 0.00 C ATOM 2778 C HIS B 85 64.634 10.980 7.898 1.00 0.00 C ATOM 2779 O HIS B 85 63.734 10.239 7.556 1.00 0.00 O ATOM 2780 CB HIS B 85 66.273 10.281 9.653 1.00 0.00 C ATOM 2781 CG HIS B 85 65.222 9.366 10.220 1.00 0.00 C ATOM 2782 ND1 HIS B 85 65.244 7.992 10.018 1.00 0.00 N ATOM 2783 CD2 HIS B 85 64.109 9.615 10.986 1.00 0.00 C ATOM 2784 CE1 HIS B 85 64.176 7.471 10.651 1.00 0.00 C ATOM 2785 NE2 HIS B 85 63.454 8.418 11.254 1.00 0.00 N ATOM 0 H HIS B 85 67.695 11.806 8.298 1.00 0.00 H new ATOM 0 HA HIS B 85 66.168 9.492 7.646 1.00 0.00 H new ATOM 0 HB2 HIS B 85 67.265 9.870 9.838 1.00 0.00 H new ATOM 0 HB3 HIS B 85 66.232 11.250 10.150 1.00 0.00 H new ATOM 0 HD2 HIS B 85 63.792 10.589 11.327 1.00 0.00 H new ATOM 0 HE1 HIS B 85 63.934 6.419 10.669 1.00 0.00 H new ATOM 0 HE2 HIS B 85 62.600 8.290 11.798 1.00 0.00 H new ATOM 2794 N GLU B 86 64.434 12.260 8.066 1.00 0.00 N ATOM 2795 CA GLU B 86 63.081 12.849 7.845 1.00 0.00 C ATOM 2796 C GLU B 86 62.746 12.814 6.351 1.00 0.00 C ATOM 2797 O GLU B 86 63.589 13.053 5.511 1.00 0.00 O ATOM 2798 CB GLU B 86 63.075 14.302 8.336 1.00 0.00 C ATOM 2799 CG GLU B 86 63.325 14.337 9.847 1.00 0.00 C ATOM 2800 CD GLU B 86 62.116 13.756 10.584 1.00 0.00 C ATOM 2801 OE1 GLU B 86 61.038 13.766 10.014 1.00 0.00 O ATOM 2802 OE2 GLU B 86 62.289 13.312 11.708 1.00 0.00 O ATOM 0 H GLU B 86 65.153 12.926 8.348 1.00 0.00 H new ATOM 0 HA GLU B 86 62.338 12.273 8.396 1.00 0.00 H new ATOM 0 HB2 GLU B 86 63.844 14.875 7.817 1.00 0.00 H new ATOM 0 HB3 GLU B 86 62.118 14.770 8.105 1.00 0.00 H new ATOM 0 HG2 GLU B 86 64.221 13.765 10.090 1.00 0.00 H new ATOM 0 HG3 GLU B 86 63.503 15.362 10.172 1.00 0.00 H new ATOM 2809 N PHE B 87 61.519 12.513 6.012 1.00 0.00 N ATOM 2810 CA PHE B 87 61.131 12.460 4.572 1.00 0.00 C ATOM 2811 C PHE B 87 61.188 13.871 3.975 1.00 0.00 C ATOM 2812 O PHE B 87 60.778 14.834 4.592 1.00 0.00 O ATOM 2813 CB PHE B 87 59.706 11.905 4.454 1.00 0.00 C ATOM 2814 CG PHE B 87 59.298 11.833 3.001 1.00 0.00 C ATOM 2815 CD1 PHE B 87 59.662 10.723 2.228 1.00 0.00 C ATOM 2816 CD2 PHE B 87 58.558 12.873 2.426 1.00 0.00 C ATOM 2817 CE1 PHE B 87 59.285 10.654 0.880 1.00 0.00 C ATOM 2818 CE2 PHE B 87 58.181 12.803 1.079 1.00 0.00 C ATOM 2819 CZ PHE B 87 58.545 11.694 0.306 1.00 0.00 C ATOM 0 H PHE B 87 60.769 12.302 6.671 1.00 0.00 H new ATOM 0 HA PHE B 87 61.819 11.813 4.029 1.00 0.00 H new ATOM 0 HB2 PHE B 87 59.655 10.914 4.904 1.00 0.00 H new ATOM 0 HB3 PHE B 87 59.012 12.541 5.004 1.00 0.00 H new ATOM 0 HD1 PHE B 87 60.233 9.920 2.671 1.00 0.00 H new ATOM 0 HD2 PHE B 87 58.278 13.729 3.021 1.00 0.00 H new ATOM 0 HE1 PHE B 87 59.566 9.798 0.284 1.00 0.00 H new ATOM 0 HE2 PHE B 87 57.609 13.605 0.636 1.00 0.00 H new ATOM 0 HZ PHE B 87 58.255 11.641 -0.733 1.00 0.00 H new ATOM 2829 N PHE B 88 61.703 14.003 2.779 1.00 0.00 N ATOM 2830 CA PHE B 88 61.793 15.351 2.144 1.00 0.00 C ATOM 2831 C PHE B 88 60.388 15.934 1.967 1.00 0.00 C ATOM 2832 O PHE B 88 59.451 15.232 1.648 1.00 0.00 O ATOM 2833 CB PHE B 88 62.473 15.226 0.775 1.00 0.00 C ATOM 2834 CG PHE B 88 63.964 15.041 0.954 1.00 0.00 C ATOM 2835 CD1 PHE B 88 64.503 13.755 1.078 1.00 0.00 C ATOM 2836 CD2 PHE B 88 64.807 16.160 0.997 1.00 0.00 C ATOM 2837 CE1 PHE B 88 65.884 13.587 1.245 1.00 0.00 C ATOM 2838 CE2 PHE B 88 66.187 15.991 1.164 1.00 0.00 C ATOM 2839 CZ PHE B 88 66.726 14.706 1.287 1.00 0.00 C ATOM 0 H PHE B 88 62.065 13.234 2.215 1.00 0.00 H new ATOM 0 HA PHE B 88 62.378 16.013 2.783 1.00 0.00 H new ATOM 0 HB2 PHE B 88 62.056 14.380 0.228 1.00 0.00 H new ATOM 0 HB3 PHE B 88 62.278 16.118 0.180 1.00 0.00 H new ATOM 0 HD1 PHE B 88 63.854 12.892 1.045 1.00 0.00 H new ATOM 0 HD2 PHE B 88 64.392 17.153 0.901 1.00 0.00 H new ATOM 0 HE1 PHE B 88 66.299 12.595 1.341 1.00 0.00 H new ATOM 0 HE2 PHE B 88 66.836 16.854 1.198 1.00 0.00 H new ATOM 0 HZ PHE B 88 67.791 14.577 1.414 1.00 0.00 H new ATOM 2849 N GLU B 89 60.235 17.214 2.175 1.00 0.00 N ATOM 2850 CA GLU B 89 58.889 17.839 2.023 1.00 0.00 C ATOM 2851 C GLU B 89 58.390 17.637 0.590 1.00 0.00 C ATOM 2852 O GLU B 89 59.139 17.741 -0.360 1.00 0.00 O ATOM 2853 CB GLU B 89 58.996 19.337 2.312 1.00 0.00 C ATOM 2854 CG GLU B 89 59.368 19.549 3.780 1.00 0.00 C ATOM 2855 CD GLU B 89 58.196 19.137 4.673 1.00 0.00 C ATOM 2856 OE1 GLU B 89 57.066 19.269 4.235 1.00 0.00 O ATOM 2857 OE2 GLU B 89 58.450 18.694 5.782 1.00 0.00 O ATOM 0 H GLU B 89 60.983 17.854 2.443 1.00 0.00 H new ATOM 0 HA GLU B 89 58.191 17.376 2.720 1.00 0.00 H new ATOM 0 HB2 GLU B 89 59.748 19.790 1.666 1.00 0.00 H new ATOM 0 HB3 GLU B 89 58.049 19.829 2.091 1.00 0.00 H new ATOM 0 HG2 GLU B 89 60.252 18.962 4.030 1.00 0.00 H new ATOM 0 HG3 GLU B 89 59.620 20.595 3.954 1.00 0.00 H new ATOM 2864 N HIS B 90 57.129 17.343 0.431 1.00 0.00 N ATOM 2865 CA HIS B 90 56.576 17.128 -0.938 1.00 0.00 C ATOM 2866 C HIS B 90 56.759 18.392 -1.783 1.00 0.00 C ATOM 2867 O HIS B 90 57.066 18.328 -2.957 1.00 0.00 O ATOM 2868 CB HIS B 90 55.085 16.802 -0.838 1.00 0.00 C ATOM 2869 CG HIS B 90 54.528 16.584 -2.218 1.00 0.00 C ATOM 2870 ND1 HIS B 90 54.076 17.631 -3.008 1.00 0.00 N ATOM 2871 CD2 HIS B 90 54.344 15.445 -2.965 1.00 0.00 C ATOM 2872 CE1 HIS B 90 53.649 17.108 -4.172 1.00 0.00 C ATOM 2873 NE2 HIS B 90 53.790 15.781 -4.194 1.00 0.00 N ATOM 0 H HIS B 90 56.456 17.242 1.191 1.00 0.00 H new ATOM 0 HA HIS B 90 57.106 16.301 -1.410 1.00 0.00 H new ATOM 0 HB2 HIS B 90 54.936 15.910 -0.229 1.00 0.00 H new ATOM 0 HB3 HIS B 90 54.555 17.617 -0.345 1.00 0.00 H new ATOM 0 HD2 HIS B 90 54.592 14.443 -2.646 1.00 0.00 H new ATOM 0 HE1 HIS B 90 53.243 17.689 -4.987 1.00 0.00 H new ATOM 0 HE2 HIS B 90 53.543 15.147 -4.954 1.00 0.00 H new ATOM 2882 N GLU B 91 56.555 19.540 -1.198 1.00 0.00 N ATOM 2883 CA GLU B 91 56.698 20.817 -1.964 1.00 0.00 C ATOM 2884 C GLU B 91 58.132 21.337 -1.841 1.00 0.00 C ATOM 2885 O GLU B 91 58.686 21.731 -2.854 1.00 0.00 O ATOM 2886 CB GLU B 91 55.728 21.849 -1.389 1.00 0.00 C ATOM 2887 CG GLU B 91 54.293 21.436 -1.726 1.00 0.00 C ATOM 2888 CD GLU B 91 53.317 22.463 -1.150 1.00 0.00 C ATOM 2889 OE1 GLU B 91 53.758 23.306 -0.386 1.00 0.00 O ATOM 2890 OE2 GLU B 91 52.145 22.390 -1.481 1.00 0.00 O ATOM 2891 OXT GLU B 91 58.650 21.337 -0.737 1.00 0.00 O ATOM 0 H GLU B 91 56.294 19.652 -0.218 1.00 0.00 H new ATOM 0 HA GLU B 91 56.473 20.642 -3.016 1.00 0.00 H new ATOM 0 HB2 GLU B 91 55.854 21.921 -0.309 1.00 0.00 H new ATOM 0 HB3 GLU B 91 55.941 22.835 -1.801 1.00 0.00 H new ATOM 0 HG2 GLU B 91 54.168 21.366 -2.807 1.00 0.00 H new ATOM 0 HG3 GLU B 91 54.082 20.448 -1.316 1.00 0.00 H new TER 2898 GLU B 91 HETATM 2899 CA CA A 101 58.682 -1.806 12.612 1.00 0.00 CA HETATM 2900 CA CA B 102 86.653 2.397 -11.212 1.00 0.00 CA HETATM 2901 CA CA A 103 70.886 -7.222 14.503 1.00 0.00 CA HETATM 2902 CA CA B 104 87.704 3.945 2.409 1.00 0.00 CA