USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 931 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 53 HIS : no HD1:sc= -0.911 K(o=-0.72,f=-3.4!) USER MOD Set 1.2: A 94 SER OG : rot -159:sc= 0.195 USER MOD Set 2.1: A 87 LYS NZ :NH3+ -179:sc= 1.04 (180deg=-0.0301) USER MOD Set 2.2: A 89 HIS : no HD1:sc=-0.000174 X(o=2,f=2) USER MOD Set 2.3: A 119 THR OG1 : rot -80:sc= 0.92 USER MOD Set 3.1: A 28 HIS : no HD1:sc= 1.03 K(o=2.4,f=-4.9!) USER MOD Set 3.2: A 40 SER OG : rot -126:sc= 1.32 USER MOD Set 4.1: A 22 TYR OH : rot -79:sc= 0.96 USER MOD Set 4.2: A 102 HIS : no HE2:sc= -0.404 X(o=1.7,f=1.5!) USER MOD Set 4.3: A 105 SER OG : rot 169:sc= 1.17 USER MOD Single : A 1 MET CE :methyl 178:sc= 0 (180deg=-0.0144) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 SER OG : rot -173:sc= 1.14 USER MOD Single : A 21 LYS NZ :NH3+ -178:sc= 1.23 (180deg=1.2) USER MOD Single : A 29 SER OG : rot -68:sc= 1.17 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 1.87 (180deg=1.87) USER MOD Single : A 47 TYR OH : rot -15:sc= 1.28 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 81:sc= 1.29 USER MOD Single : A 64 MET CE :methyl -166:sc=-0.000891 (180deg=-0.383) USER MOD Single : A 65 GLN : amide:sc= 1.09 K(o=1.1,f=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= 1.14 K(o=1.1,f=-0.3) USER MOD Single : A 69 CYS SG : rot 16:sc= -0.406 USER MOD Single : A 71 CYS SG : rot -120:sc= -0.625 USER MOD Single : A 73 CYS SG : rot -172:sc= 2.24 USER MOD Single : A 80 SER OG : rot -112:sc= 0.46 USER MOD Single : A 81 HIS : no HE2:sc= 1.16 K(o=1.2,f=-3.5!) USER MOD Single : A 82 GLN : amide:sc= 0.927 K(o=0.93,f=-0.016) USER MOD Single : A 83 SER OG : rot 179:sc= -0.655 USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 97 TYR OH : rot -79:sc= 0.403 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 THR OG1 : rot 10:sc= 0.113 USER MOD Single : A 108 LYS NZ :NH3+ 154:sc= 1.69 (180deg=0.151) USER MOD Single : A 110 LYS NZ :NH3+ -178:sc= 1.66 (180deg=1.63) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= -0.128 K(o=-0.13,f=-3.4!) USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.822 -4.318 -7.379 1.00 10.00 N ATOM 2 CA MET A 1 6.421 -4.757 -6.096 1.00 10.00 C ATOM 3 C MET A 1 6.439 -3.594 -5.108 1.00 10.00 C ATOM 4 O MET A 1 6.906 -2.519 -5.464 1.00 10.00 O ATOM 5 CB MET A 1 7.829 -5.345 -6.312 1.00 10.00 C ATOM 6 CG MET A 1 8.500 -5.824 -5.018 1.00 10.00 C ATOM 7 SD MET A 1 7.523 -6.987 -4.026 1.00 10.00 S ATOM 8 CE MET A 1 8.760 -7.383 -2.751 1.00 10.00 C ATOM 0 H1 MET A 1 5.812 -5.114 -8.048 1.00 10.00 H new ATOM 0 H2 MET A 1 4.848 -3.993 -7.214 1.00 10.00 H new ATOM 0 H3 MET A 1 6.385 -3.539 -7.776 1.00 10.00 H new ATOM 0 HA MET A 1 5.807 -5.553 -5.674 1.00 10.00 H new ATOM 0 HB2 MET A 1 7.761 -6.182 -7.007 1.00 10.00 H new ATOM 0 HB3 MET A 1 8.461 -4.591 -6.781 1.00 10.00 H new ATOM 0 HG2 MET A 1 9.449 -6.296 -5.273 1.00 10.00 H new ATOM 0 HG3 MET A 1 8.732 -4.954 -4.404 1.00 10.00 H new ATOM 0 HE1 MET A 1 8.325 -8.066 -2.022 1.00 10.00 H new ATOM 0 HE2 MET A 1 9.626 -7.854 -3.217 1.00 10.00 H new ATOM 0 HE3 MET A 1 9.072 -6.467 -2.249 1.00 10.00 H new ATOM 20 N ALA A 2 5.904 -3.797 -3.899 1.00 10.00 N ATOM 21 CA ALA A 2 5.913 -2.826 -2.807 1.00 10.00 C ATOM 22 C ALA A 2 5.908 -3.584 -1.478 1.00 10.00 C ATOM 23 O ALA A 2 5.464 -4.740 -1.438 1.00 10.00 O ATOM 24 CB ALA A 2 4.674 -1.926 -2.903 1.00 10.00 C ATOM 0 H ALA A 2 5.439 -4.670 -3.649 1.00 10.00 H new ATOM 0 HA ALA A 2 6.804 -2.201 -2.871 1.00 10.00 H new ATOM 0 HB1 ALA A 2 4.685 -1.204 -2.087 1.00 10.00 H new ATOM 0 HB2 ALA A 2 4.682 -1.397 -3.856 1.00 10.00 H new ATOM 0 HB3 ALA A 2 3.774 -2.537 -2.834 1.00 10.00 H new ATOM 30 N VAL A 3 6.366 -2.928 -0.414 1.00 10.00 N ATOM 31 CA VAL A 3 6.531 -3.474 0.922 1.00 10.00 C ATOM 32 C VAL A 3 6.211 -2.366 1.934 1.00 10.00 C ATOM 33 O VAL A 3 6.390 -1.185 1.632 1.00 10.00 O ATOM 34 CB VAL A 3 7.987 -3.964 1.101 1.00 10.00 C ATOM 35 CG1 VAL A 3 8.177 -5.377 0.531 1.00 10.00 C ATOM 36 CG2 VAL A 3 9.060 -3.044 0.486 1.00 10.00 C ATOM 0 H VAL A 3 6.646 -1.949 -0.469 1.00 10.00 H new ATOM 0 HA VAL A 3 5.861 -4.319 1.078 1.00 10.00 H new ATOM 0 HB VAL A 3 8.135 -3.956 2.181 1.00 10.00 H new ATOM 0 HG11 VAL A 3 9.211 -5.691 0.673 1.00 10.00 H new ATOM 0 HG12 VAL A 3 7.513 -6.070 1.048 1.00 10.00 H new ATOM 0 HG13 VAL A 3 7.942 -5.375 -0.533 1.00 10.00 H new ATOM 0 HG21 VAL A 3 10.048 -3.469 0.662 1.00 10.00 H new ATOM 0 HG22 VAL A 3 8.890 -2.953 -0.587 1.00 10.00 H new ATOM 0 HG23 VAL A 3 9.002 -2.058 0.948 1.00 10.00 H new ATOM 46 N ALA A 4 5.716 -2.751 3.114 1.00 10.00 N ATOM 47 CA ALA A 4 5.585 -1.844 4.248 1.00 10.00 C ATOM 48 C ALA A 4 6.965 -1.592 4.870 1.00 10.00 C ATOM 49 O ALA A 4 7.928 -2.296 4.566 1.00 10.00 O ATOM 50 CB ALA A 4 4.626 -2.447 5.283 1.00 10.00 C ATOM 0 H ALA A 4 5.396 -3.700 3.306 1.00 10.00 H new ATOM 0 HA ALA A 4 5.177 -0.891 3.910 1.00 10.00 H new ATOM 0 HB1 ALA A 4 4.530 -1.767 6.130 1.00 10.00 H new ATOM 0 HB2 ALA A 4 3.648 -2.599 4.827 1.00 10.00 H new ATOM 0 HB3 ALA A 4 5.018 -3.403 5.629 1.00 10.00 H new ATOM 56 N ASP A 5 7.040 -0.637 5.800 1.00 10.00 N ATOM 57 CA ASP A 5 8.229 -0.362 6.606 1.00 10.00 C ATOM 58 C ASP A 5 7.762 0.226 7.938 1.00 10.00 C ATOM 59 O ASP A 5 6.712 0.878 8.001 1.00 10.00 O ATOM 60 CB ASP A 5 9.167 0.621 5.885 1.00 10.00 C ATOM 61 CG ASP A 5 10.451 0.863 6.691 1.00 10.00 C ATOM 62 OD1 ASP A 5 11.397 0.058 6.544 1.00 10.00 O ATOM 63 OD2 ASP A 5 10.432 1.797 7.529 1.00 10.00 O ATOM 0 H ASP A 5 6.257 -0.020 6.018 1.00 10.00 H new ATOM 0 HA ASP A 5 8.789 -1.283 6.770 1.00 10.00 H new ATOM 0 HB2 ASP A 5 9.422 0.228 4.901 1.00 10.00 H new ATOM 0 HB3 ASP A 5 8.651 1.568 5.726 1.00 10.00 H new ATOM 68 N LEU A 6 8.514 -0.010 9.018 1.00 10.00 N ATOM 69 CA LEU A 6 8.164 0.447 10.361 1.00 10.00 C ATOM 70 C LEU A 6 8.040 1.972 10.465 1.00 10.00 C ATOM 71 O LEU A 6 7.356 2.447 11.377 1.00 10.00 O ATOM 72 CB LEU A 6 9.195 -0.065 11.380 1.00 10.00 C ATOM 73 CG LEU A 6 9.251 -1.595 11.544 1.00 10.00 C ATOM 74 CD1 LEU A 6 10.355 -1.942 12.541 1.00 10.00 C ATOM 75 CD2 LEU A 6 7.926 -2.188 12.043 1.00 10.00 C ATOM 0 H LEU A 6 9.391 -0.529 8.981 1.00 10.00 H new ATOM 0 HA LEU A 6 7.181 0.034 10.585 1.00 10.00 H new ATOM 0 HB2 LEU A 6 10.182 0.289 11.083 1.00 10.00 H new ATOM 0 HB3 LEU A 6 8.975 0.381 12.350 1.00 10.00 H new ATOM 0 HG LEU A 6 9.450 -2.024 10.562 1.00 10.00 H new ATOM 0 HD11 LEU A 6 10.405 -3.024 12.666 1.00 10.00 H new ATOM 0 HD12 LEU A 6 11.311 -1.575 12.167 1.00 10.00 H new ATOM 0 HD13 LEU A 6 10.138 -1.475 13.502 1.00 10.00 H new ATOM 0 HD21 LEU A 6 8.025 -3.269 12.140 1.00 10.00 H new ATOM 0 HD22 LEU A 6 7.677 -1.758 13.013 1.00 10.00 H new ATOM 0 HD23 LEU A 6 7.133 -1.958 11.331 1.00 10.00 H new ATOM 87 N ALA A 7 8.681 2.739 9.578 1.00 10.00 N ATOM 88 CA ALA A 7 8.525 4.187 9.533 1.00 10.00 C ATOM 89 C ALA A 7 7.107 4.599 9.121 1.00 10.00 C ATOM 90 O ALA A 7 6.653 5.667 9.531 1.00 10.00 O ATOM 91 CB ALA A 7 9.536 4.784 8.551 1.00 10.00 C ATOM 0 H ALA A 7 9.320 2.370 8.874 1.00 10.00 H new ATOM 0 HA ALA A 7 8.705 4.570 10.538 1.00 10.00 H new ATOM 0 HB1 ALA A 7 9.417 5.867 8.520 1.00 10.00 H new ATOM 0 HB2 ALA A 7 10.547 4.540 8.876 1.00 10.00 H new ATOM 0 HB3 ALA A 7 9.365 4.371 7.557 1.00 10.00 H new ATOM 97 N LEU A 8 6.417 3.776 8.318 1.00 10.00 N ATOM 98 CA LEU A 8 5.064 4.079 7.849 1.00 10.00 C ATOM 99 C LEU A 8 4.049 3.861 8.972 1.00 10.00 C ATOM 100 O LEU A 8 3.018 4.527 9.021 1.00 10.00 O ATOM 101 CB LEU A 8 4.685 3.187 6.649 1.00 10.00 C ATOM 102 CG LEU A 8 5.634 3.262 5.438 1.00 10.00 C ATOM 103 CD1 LEU A 8 5.115 2.343 4.326 1.00 10.00 C ATOM 104 CD2 LEU A 8 5.781 4.685 4.885 1.00 10.00 C ATOM 0 H LEU A 8 6.782 2.886 7.979 1.00 10.00 H new ATOM 0 HA LEU A 8 5.047 5.123 7.537 1.00 10.00 H new ATOM 0 HB2 LEU A 8 4.639 2.152 6.989 1.00 10.00 H new ATOM 0 HB3 LEU A 8 3.682 3.459 6.319 1.00 10.00 H new ATOM 0 HG LEU A 8 6.618 2.942 5.781 1.00 10.00 H new ATOM 0 HD11 LEU A 8 5.786 2.395 3.468 1.00 10.00 H new ATOM 0 HD12 LEU A 8 5.073 1.317 4.692 1.00 10.00 H new ATOM 0 HD13 LEU A 8 4.117 2.663 4.026 1.00 10.00 H new ATOM 0 HD21 LEU A 8 6.461 4.676 4.033 1.00 10.00 H new ATOM 0 HD22 LEU A 8 4.806 5.054 4.567 1.00 10.00 H new ATOM 0 HD23 LEU A 8 6.180 5.338 5.661 1.00 10.00 H new ATOM 116 N ILE A 9 4.324 2.900 9.857 1.00 10.00 N ATOM 117 CA ILE A 9 3.459 2.561 10.976 1.00 10.00 C ATOM 118 C ILE A 9 3.516 3.728 11.980 1.00 10.00 C ATOM 119 O ILE A 9 4.616 4.043 12.459 1.00 10.00 O ATOM 120 CB ILE A 9 3.904 1.195 11.552 1.00 10.00 C ATOM 121 CG1 ILE A 9 3.470 0.089 10.558 1.00 10.00 C ATOM 122 CG2 ILE A 9 3.316 0.925 12.951 1.00 10.00 C ATOM 123 CD1 ILE A 9 4.241 -1.223 10.706 1.00 10.00 C ATOM 0 H ILE A 9 5.169 2.330 9.810 1.00 10.00 H new ATOM 0 HA ILE A 9 2.415 2.438 10.687 1.00 10.00 H new ATOM 0 HB ILE A 9 4.987 1.203 11.673 1.00 10.00 H new ATOM 0 HG12 ILE A 9 2.407 -0.110 10.694 1.00 10.00 H new ATOM 0 HG13 ILE A 9 3.597 0.460 9.541 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.659 -0.046 13.309 1.00 10.00 H new ATOM 0 HG22 ILE A 9 3.645 1.703 13.640 1.00 10.00 H new ATOM 0 HG23 ILE A 9 2.227 0.927 12.895 1.00 10.00 H new ATOM 0 HD11 ILE A 9 3.877 -1.944 9.974 1.00 10.00 H new ATOM 0 HD12 ILE A 9 5.303 -1.042 10.539 1.00 10.00 H new ATOM 0 HD13 ILE A 9 4.094 -1.620 11.710 1.00 10.00 H new ATOM 135 N PRO A 10 2.366 4.338 12.348 1.00 10.00 N ATOM 136 CA PRO A 10 2.302 5.422 13.323 1.00 10.00 C ATOM 137 C PRO A 10 3.072 5.069 14.589 1.00 10.00 C ATOM 138 O PRO A 10 2.957 3.952 15.105 1.00 10.00 O ATOM 139 CB PRO A 10 0.816 5.649 13.617 1.00 10.00 C ATOM 140 CG PRO A 10 0.140 5.204 12.325 1.00 10.00 C ATOM 141 CD PRO A 10 1.025 4.052 11.850 1.00 10.00 C ATOM 0 HA PRO A 10 2.764 6.329 12.933 1.00 10.00 H new ATOM 0 HB2 PRO A 10 0.479 5.062 14.472 1.00 10.00 H new ATOM 0 HB3 PRO A 10 0.604 6.694 13.844 1.00 10.00 H new ATOM 0 HG2 PRO A 10 -0.886 4.879 12.498 1.00 10.00 H new ATOM 0 HG3 PRO A 10 0.100 6.010 11.593 1.00 10.00 H new ATOM 0 HD2 PRO A 10 0.662 3.098 12.234 1.00 10.00 H new ATOM 0 HD3 PRO A 10 1.021 3.980 10.762 1.00 10.00 H new ATOM 149 N ASP A 11 3.869 6.006 15.098 1.00 10.00 N ATOM 150 CA ASP A 11 4.794 5.733 16.198 1.00 10.00 C ATOM 151 C ASP A 11 4.114 5.836 17.566 1.00 10.00 C ATOM 152 O ASP A 11 4.437 5.099 18.498 1.00 10.00 O ATOM 153 CB ASP A 11 5.981 6.694 16.102 1.00 10.00 C ATOM 154 CG ASP A 11 7.184 6.082 16.802 1.00 10.00 C ATOM 155 OD1 ASP A 11 7.617 5.003 16.337 1.00 10.00 O ATOM 156 OD2 ASP A 11 7.687 6.650 17.790 1.00 10.00 O ATOM 0 H ASP A 11 3.893 6.969 14.763 1.00 10.00 H new ATOM 0 HA ASP A 11 5.145 4.705 16.106 1.00 10.00 H new ATOM 0 HB2 ASP A 11 6.217 6.894 15.057 1.00 10.00 H new ATOM 0 HB3 ASP A 11 5.727 7.650 16.560 1.00 10.00 H new ATOM 161 N VAL A 12 3.079 6.672 17.637 1.00 10.00 N ATOM 162 CA VAL A 12 2.189 6.880 18.765 1.00 10.00 C ATOM 163 C VAL A 12 0.850 7.281 18.141 1.00 10.00 C ATOM 164 O VAL A 12 0.835 8.042 17.174 1.00 10.00 O ATOM 165 CB VAL A 12 2.786 7.927 19.733 1.00 10.00 C ATOM 166 CG1 VAL A 12 3.410 9.150 19.050 1.00 10.00 C ATOM 167 CG2 VAL A 12 1.759 8.411 20.767 1.00 10.00 C ATOM 0 H VAL A 12 2.827 7.263 16.845 1.00 10.00 H new ATOM 0 HA VAL A 12 2.051 5.995 19.386 1.00 10.00 H new ATOM 0 HB VAL A 12 3.592 7.386 20.228 1.00 10.00 H new ATOM 0 HG11 VAL A 12 3.802 9.829 19.807 1.00 10.00 H new ATOM 0 HG12 VAL A 12 4.221 8.828 18.397 1.00 10.00 H new ATOM 0 HG13 VAL A 12 2.651 9.664 18.460 1.00 10.00 H new ATOM 0 HG21 VAL A 12 2.224 9.145 21.425 1.00 10.00 H new ATOM 0 HG22 VAL A 12 0.913 8.868 20.253 1.00 10.00 H new ATOM 0 HG23 VAL A 12 1.410 7.564 21.357 1.00 10.00 H new ATOM 177 N ASP A 13 -0.246 6.696 18.622 1.00 10.00 N ATOM 178 CA ASP A 13 -1.594 6.948 18.118 1.00 10.00 C ATOM 179 C ASP A 13 -2.546 6.596 19.255 1.00 10.00 C ATOM 180 O ASP A 13 -2.748 5.414 19.552 1.00 10.00 O ATOM 181 CB ASP A 13 -1.887 6.112 16.860 1.00 10.00 C ATOM 182 CG ASP A 13 -3.322 6.299 16.347 1.00 10.00 C ATOM 183 OD1 ASP A 13 -3.881 7.395 16.562 1.00 10.00 O ATOM 184 OD2 ASP A 13 -3.852 5.335 15.743 1.00 10.00 O ATOM 0 H ASP A 13 -0.221 6.022 19.387 1.00 10.00 H new ATOM 0 HA ASP A 13 -1.712 7.989 17.817 1.00 10.00 H new ATOM 0 HB2 ASP A 13 -1.185 6.388 16.073 1.00 10.00 H new ATOM 0 HB3 ASP A 13 -1.719 5.058 17.081 1.00 10.00 H new ATOM 189 N ILE A 14 -2.999 7.614 19.988 1.00 10.00 N ATOM 190 CA ILE A 14 -3.738 7.468 21.235 1.00 10.00 C ATOM 191 C ILE A 14 -5.011 8.317 21.181 1.00 10.00 C ATOM 192 O ILE A 14 -5.030 9.476 21.585 1.00 10.00 O ATOM 193 CB ILE A 14 -2.847 7.729 22.475 1.00 10.00 C ATOM 194 CG1 ILE A 14 -1.953 8.989 22.352 1.00 10.00 C ATOM 195 CG2 ILE A 14 -1.996 6.474 22.755 1.00 10.00 C ATOM 196 CD1 ILE A 14 -1.323 9.418 23.682 1.00 10.00 C ATOM 0 H ILE A 14 -2.856 8.588 19.720 1.00 10.00 H new ATOM 0 HA ILE A 14 -4.054 6.431 21.349 1.00 10.00 H new ATOM 0 HB ILE A 14 -3.512 7.933 23.314 1.00 10.00 H new ATOM 0 HG12 ILE A 14 -1.161 8.795 21.629 1.00 10.00 H new ATOM 0 HG13 ILE A 14 -2.549 9.812 21.958 1.00 10.00 H new ATOM 0 HG21 ILE A 14 -1.365 6.649 23.627 1.00 10.00 H new ATOM 0 HG22 ILE A 14 -2.652 5.625 22.946 1.00 10.00 H new ATOM 0 HG23 ILE A 14 -1.368 6.260 21.890 1.00 10.00 H new ATOM 0 HD11 ILE A 14 -0.710 10.305 23.525 1.00 10.00 H new ATOM 0 HD12 ILE A 14 -2.110 9.643 24.401 1.00 10.00 H new ATOM 0 HD13 ILE A 14 -0.700 8.610 24.067 1.00 10.00 H new ATOM 208 N ASP A 15 -6.075 7.715 20.652 1.00 10.00 N ATOM 209 CA ASP A 15 -7.439 8.237 20.759 1.00 10.00 C ATOM 210 C ASP A 15 -7.873 8.295 22.236 1.00 10.00 C ATOM 211 O ASP A 15 -8.687 9.135 22.622 1.00 10.00 O ATOM 212 CB ASP A 15 -8.375 7.345 19.931 1.00 10.00 C ATOM 213 CG ASP A 15 -9.854 7.496 20.320 1.00 10.00 C ATOM 214 OD1 ASP A 15 -10.505 8.449 19.839 1.00 10.00 O ATOM 215 OD2 ASP A 15 -10.350 6.619 21.073 1.00 10.00 O ATOM 0 H ASP A 15 -6.015 6.840 20.131 1.00 10.00 H new ATOM 0 HA ASP A 15 -7.484 9.253 20.368 1.00 10.00 H new ATOM 0 HB2 ASP A 15 -8.257 7.587 18.875 1.00 10.00 H new ATOM 0 HB3 ASP A 15 -8.078 6.304 20.055 1.00 10.00 H new ATOM 220 N SER A 16 -7.278 7.434 23.076 1.00 10.00 N ATOM 221 CA SER A 16 -7.345 7.483 24.531 1.00 10.00 C ATOM 222 C SER A 16 -6.599 8.708 25.085 1.00 10.00 C ATOM 223 O SER A 16 -5.642 8.557 25.847 1.00 10.00 O ATOM 224 CB SER A 16 -6.786 6.184 25.128 1.00 10.00 C ATOM 225 OG SER A 16 -7.513 5.060 24.679 1.00 10.00 O ATOM 0 H SER A 16 -6.715 6.654 22.738 1.00 10.00 H new ATOM 0 HA SER A 16 -8.391 7.580 24.822 1.00 10.00 H new ATOM 0 HB2 SER A 16 -5.737 6.076 24.852 1.00 10.00 H new ATOM 0 HB3 SER A 16 -6.825 6.235 26.216 1.00 10.00 H new ATOM 0 HG SER A 16 -7.209 4.261 25.158 1.00 10.00 H new ATOM 231 N ASP A 17 -7.029 9.914 24.716 1.00 10.00 N ATOM 232 CA ASP A 17 -6.514 11.208 25.195 1.00 10.00 C ATOM 233 C ASP A 17 -7.049 11.520 26.610 1.00 10.00 C ATOM 234 O ASP A 17 -7.538 12.604 26.917 1.00 10.00 O ATOM 235 CB ASP A 17 -6.872 12.294 24.164 1.00 10.00 C ATOM 236 CG ASP A 17 -6.239 13.662 24.477 1.00 10.00 C ATOM 237 OD1 ASP A 17 -5.012 13.673 24.740 1.00 10.00 O ATOM 238 OD2 ASP A 17 -6.960 14.684 24.354 1.00 10.00 O ATOM 0 H ASP A 17 -7.785 10.027 24.040 1.00 10.00 H new ATOM 0 HA ASP A 17 -5.428 11.174 25.287 1.00 10.00 H new ATOM 0 HB2 ASP A 17 -6.547 11.968 23.176 1.00 10.00 H new ATOM 0 HB3 ASP A 17 -7.956 12.404 24.123 1.00 10.00 H new ATOM 243 N GLY A 18 -7.118 10.491 27.459 1.00 10.00 N ATOM 244 CA GLY A 18 -7.773 10.495 28.753 1.00 10.00 C ATOM 245 C GLY A 18 -7.873 9.060 29.268 1.00 10.00 C ATOM 246 O GLY A 18 -7.283 8.130 28.701 1.00 10.00 O ATOM 0 H GLY A 18 -6.693 9.589 27.243 1.00 10.00 H new ATOM 0 HA2 GLY A 18 -7.211 11.109 29.457 1.00 10.00 H new ATOM 0 HA3 GLY A 18 -8.767 10.935 28.670 1.00 10.00 H new ATOM 250 N VAL A 19 -8.619 8.865 30.359 1.00 10.00 N ATOM 251 CA VAL A 19 -8.736 7.583 31.046 1.00 10.00 C ATOM 252 C VAL A 19 -9.605 6.620 30.220 1.00 10.00 C ATOM 253 O VAL A 19 -10.772 6.403 30.531 1.00 10.00 O ATOM 254 CB VAL A 19 -9.227 7.771 32.503 1.00 10.00 C ATOM 255 CG1 VAL A 19 -9.076 6.451 33.280 1.00 10.00 C ATOM 256 CG2 VAL A 19 -8.424 8.851 33.251 1.00 10.00 C ATOM 0 H VAL A 19 -9.166 9.608 30.794 1.00 10.00 H new ATOM 0 HA VAL A 19 -7.751 7.124 31.129 1.00 10.00 H new ATOM 0 HB VAL A 19 -10.271 8.080 32.447 1.00 10.00 H new ATOM 0 HG11 VAL A 19 -9.423 6.590 34.304 1.00 10.00 H new ATOM 0 HG12 VAL A 19 -9.670 5.675 32.798 1.00 10.00 H new ATOM 0 HG13 VAL A 19 -8.028 6.152 33.289 1.00 10.00 H new ATOM 0 HG21 VAL A 19 -8.804 8.948 34.268 1.00 10.00 H new ATOM 0 HG22 VAL A 19 -7.372 8.566 33.282 1.00 10.00 H new ATOM 0 HG23 VAL A 19 -8.527 9.805 32.733 1.00 10.00 H new ATOM 266 N PHE A 20 -9.018 6.027 29.180 1.00 10.00 N ATOM 267 CA PHE A 20 -9.691 5.105 28.262 1.00 10.00 C ATOM 268 C PHE A 20 -8.791 3.914 27.891 1.00 10.00 C ATOM 269 O PHE A 20 -9.049 3.211 26.922 1.00 10.00 O ATOM 270 CB PHE A 20 -10.182 5.862 27.018 1.00 10.00 C ATOM 271 CG PHE A 20 -11.018 7.107 27.270 1.00 10.00 C ATOM 272 CD1 PHE A 20 -12.349 6.989 27.716 1.00 10.00 C ATOM 273 CD2 PHE A 20 -10.473 8.386 27.044 1.00 10.00 C ATOM 274 CE1 PHE A 20 -13.124 8.141 27.947 1.00 10.00 C ATOM 275 CE2 PHE A 20 -11.249 9.536 27.266 1.00 10.00 C ATOM 276 CZ PHE A 20 -12.574 9.416 27.722 1.00 10.00 C ATOM 0 H PHE A 20 -8.037 6.178 28.946 1.00 10.00 H new ATOM 0 HA PHE A 20 -10.560 4.688 28.770 1.00 10.00 H new ATOM 0 HB2 PHE A 20 -9.312 6.149 26.427 1.00 10.00 H new ATOM 0 HB3 PHE A 20 -10.769 5.174 26.409 1.00 10.00 H new ATOM 0 HD1 PHE A 20 -12.776 6.011 27.881 1.00 10.00 H new ATOM 0 HD2 PHE A 20 -9.454 8.483 26.699 1.00 10.00 H new ATOM 0 HE1 PHE A 20 -14.141 8.046 28.297 1.00 10.00 H new ATOM 0 HE2 PHE A 20 -10.827 10.514 27.086 1.00 10.00 H new ATOM 0 HZ PHE A 20 -13.168 10.301 27.899 1.00 10.00 H new ATOM 286 N LYS A 21 -7.765 3.671 28.722 1.00 10.00 N ATOM 287 CA LYS A 21 -6.715 2.646 28.609 1.00 10.00 C ATOM 288 C LYS A 21 -5.812 2.841 27.381 1.00 10.00 C ATOM 289 O LYS A 21 -6.244 3.287 26.326 1.00 10.00 O ATOM 290 CB LYS A 21 -7.322 1.227 28.685 1.00 10.00 C ATOM 291 CG LYS A 21 -8.032 0.982 30.031 1.00 10.00 C ATOM 292 CD LYS A 21 -8.735 -0.382 30.103 1.00 10.00 C ATOM 293 CE LYS A 21 -9.415 -0.523 31.475 1.00 10.00 C ATOM 294 NZ LYS A 21 -10.061 -1.844 31.673 1.00 10.00 N ATOM 0 H LYS A 21 -7.638 4.235 29.562 1.00 10.00 H new ATOM 0 HA LYS A 21 -6.054 2.767 29.467 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -8.032 1.091 27.869 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -6.534 0.486 28.549 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -7.302 1.051 30.838 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -8.765 1.771 30.197 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -9.474 -0.467 29.306 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -8.013 -1.186 29.956 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -8.674 -0.367 32.259 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -10.164 0.261 31.584 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -10.530 -1.865 32.601 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -10.766 -2.001 30.925 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -9.340 -2.593 31.632 1.00 10.00 H new ATOM 308 N TYR A 22 -4.531 2.492 27.510 1.00 10.00 N ATOM 309 CA TYR A 22 -3.549 2.509 26.426 1.00 10.00 C ATOM 310 C TYR A 22 -2.561 1.359 26.652 1.00 10.00 C ATOM 311 O TYR A 22 -2.413 0.892 27.784 1.00 10.00 O ATOM 312 CB TYR A 22 -2.829 3.875 26.352 1.00 10.00 C ATOM 313 CG TYR A 22 -1.429 3.876 26.942 1.00 10.00 C ATOM 314 CD1 TYR A 22 -1.243 4.026 28.328 1.00 10.00 C ATOM 315 CD2 TYR A 22 -0.323 3.600 26.115 1.00 10.00 C ATOM 316 CE1 TYR A 22 0.035 3.878 28.892 1.00 10.00 C ATOM 317 CE2 TYR A 22 0.957 3.441 26.672 1.00 10.00 C ATOM 318 CZ TYR A 22 1.142 3.592 28.061 1.00 10.00 C ATOM 319 OH TYR A 22 2.386 3.463 28.591 1.00 10.00 O ATOM 0 H TYR A 22 -4.137 2.181 28.398 1.00 10.00 H new ATOM 0 HA TYR A 22 -4.049 2.370 25.468 1.00 10.00 H new ATOM 0 HB2 TYR A 22 -2.771 4.186 25.309 1.00 10.00 H new ATOM 0 HB3 TYR A 22 -3.431 4.619 26.874 1.00 10.00 H new ATOM 0 HD1 TYR A 22 -2.087 4.256 28.962 1.00 10.00 H new ATOM 0 HD2 TYR A 22 -0.459 3.510 25.047 1.00 10.00 H new ATOM 0 HE1 TYR A 22 0.171 3.983 29.958 1.00 10.00 H new ATOM 0 HE2 TYR A 22 1.798 3.203 26.037 1.00 10.00 H new ATOM 0 HH TYR A 22 2.763 4.352 28.762 1.00 10.00 H new ATOM 329 N VAL A 23 -1.899 0.904 25.593 1.00 10.00 N ATOM 330 CA VAL A 23 -0.998 -0.241 25.583 1.00 10.00 C ATOM 331 C VAL A 23 0.336 0.206 24.974 1.00 10.00 C ATOM 332 O VAL A 23 0.373 1.061 24.083 1.00 10.00 O ATOM 333 CB VAL A 23 -1.612 -1.414 24.781 1.00 10.00 C ATOM 334 CG1 VAL A 23 -1.034 -2.764 25.223 1.00 10.00 C ATOM 335 CG2 VAL A 23 -3.139 -1.529 24.889 1.00 10.00 C ATOM 0 H VAL A 23 -1.981 1.345 24.677 1.00 10.00 H new ATOM 0 HA VAL A 23 -0.836 -0.599 26.600 1.00 10.00 H new ATOM 0 HB VAL A 23 -1.352 -1.181 23.748 1.00 10.00 H new ATOM 0 HG11 VAL A 23 -1.489 -3.564 24.638 1.00 10.00 H new ATOM 0 HG12 VAL A 23 0.045 -2.767 25.065 1.00 10.00 H new ATOM 0 HG13 VAL A 23 -1.247 -2.922 26.280 1.00 10.00 H new ATOM 0 HG21 VAL A 23 -3.483 -2.377 24.297 1.00 10.00 H new ATOM 0 HG22 VAL A 23 -3.420 -1.677 25.932 1.00 10.00 H new ATOM 0 HG23 VAL A 23 -3.600 -0.615 24.516 1.00 10.00 H new ATOM 345 N LEU A 24 1.430 -0.398 25.442 1.00 10.00 N ATOM 346 CA LEU A 24 2.766 -0.263 24.873 1.00 10.00 C ATOM 347 C LEU A 24 3.076 -1.608 24.227 1.00 10.00 C ATOM 348 O LEU A 24 3.060 -2.639 24.901 1.00 10.00 O ATOM 349 CB LEU A 24 3.783 0.093 25.973 1.00 10.00 C ATOM 350 CG LEU A 24 5.252 0.079 25.497 1.00 10.00 C ATOM 351 CD1 LEU A 24 5.548 1.103 24.394 1.00 10.00 C ATOM 352 CD2 LEU A 24 6.170 0.350 26.691 1.00 10.00 C ATOM 0 H LEU A 24 1.406 -1.014 26.254 1.00 10.00 H new ATOM 0 HA LEU A 24 2.822 0.540 24.138 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.548 1.083 26.365 1.00 10.00 H new ATOM 0 HB3 LEU A 24 3.672 -0.611 26.798 1.00 10.00 H new ATOM 0 HG LEU A 24 5.435 -0.907 25.070 1.00 10.00 H new ATOM 0 HD11 LEU A 24 6.598 1.037 24.109 1.00 10.00 H new ATOM 0 HD12 LEU A 24 4.922 0.894 23.526 1.00 10.00 H new ATOM 0 HD13 LEU A 24 5.334 2.106 24.762 1.00 10.00 H new ATOM 0 HD21 LEU A 24 7.209 0.341 26.361 1.00 10.00 H new ATOM 0 HD22 LEU A 24 5.933 1.324 27.118 1.00 10.00 H new ATOM 0 HD23 LEU A 24 6.023 -0.422 27.446 1.00 10.00 H new ATOM 364 N ILE A 25 3.324 -1.609 22.921 1.00 10.00 N ATOM 365 CA ILE A 25 3.404 -2.830 22.133 1.00 10.00 C ATOM 366 C ILE A 25 4.687 -2.730 21.313 1.00 10.00 C ATOM 367 O ILE A 25 4.997 -1.668 20.770 1.00 10.00 O ATOM 368 CB ILE A 25 2.117 -2.962 21.273 1.00 10.00 C ATOM 369 CG1 ILE A 25 0.836 -3.051 22.141 1.00 10.00 C ATOM 370 CG2 ILE A 25 2.204 -4.190 20.352 1.00 10.00 C ATOM 371 CD1 ILE A 25 -0.461 -2.766 21.369 1.00 10.00 C ATOM 0 H ILE A 25 3.475 -0.758 22.379 1.00 10.00 H new ATOM 0 HA ILE A 25 3.451 -3.734 22.739 1.00 10.00 H new ATOM 0 HB ILE A 25 2.048 -2.057 20.669 1.00 10.00 H new ATOM 0 HG12 ILE A 25 0.775 -4.047 22.579 1.00 10.00 H new ATOM 0 HG13 ILE A 25 0.919 -2.344 22.966 1.00 10.00 H new ATOM 0 HG21 ILE A 25 1.293 -4.265 19.758 1.00 10.00 H new ATOM 0 HG22 ILE A 25 3.062 -4.087 19.688 1.00 10.00 H new ATOM 0 HG23 ILE A 25 2.318 -5.090 20.956 1.00 10.00 H new ATOM 0 HD11 ILE A 25 -1.312 -2.848 22.045 1.00 10.00 H new ATOM 0 HD12 ILE A 25 -0.423 -1.759 20.953 1.00 10.00 H new ATOM 0 HD13 ILE A 25 -0.569 -3.489 20.560 1.00 10.00 H new ATOM 383 N ARG A 26 5.450 -3.814 21.240 1.00 10.00 N ATOM 384 CA ARG A 26 6.554 -3.949 20.309 1.00 10.00 C ATOM 385 C ARG A 26 5.979 -4.522 19.027 1.00 10.00 C ATOM 386 O ARG A 26 5.070 -5.349 19.070 1.00 10.00 O ATOM 387 CB ARG A 26 7.621 -4.857 20.928 1.00 10.00 C ATOM 388 CG ARG A 26 8.820 -5.084 19.995 1.00 10.00 C ATOM 389 CD ARG A 26 9.965 -5.780 20.732 1.00 10.00 C ATOM 390 NE ARG A 26 10.529 -4.894 21.762 1.00 10.00 N ATOM 391 CZ ARG A 26 10.868 -5.200 23.016 1.00 10.00 C ATOM 392 NH1 ARG A 26 10.684 -6.414 23.539 1.00 10.00 N ATOM 393 NH2 ARG A 26 11.414 -4.225 23.735 1.00 10.00 N ATOM 0 H ARG A 26 5.314 -4.632 21.835 1.00 10.00 H new ATOM 0 HA ARG A 26 7.036 -2.996 20.091 1.00 10.00 H new ATOM 0 HB2 ARG A 26 7.971 -4.416 21.861 1.00 10.00 H new ATOM 0 HB3 ARG A 26 7.173 -5.819 21.178 1.00 10.00 H new ATOM 0 HG2 ARG A 26 8.512 -5.688 19.142 1.00 10.00 H new ATOM 0 HG3 ARG A 26 9.165 -4.128 19.601 1.00 10.00 H new ATOM 0 HD2 ARG A 26 9.603 -6.699 21.193 1.00 10.00 H new ATOM 0 HD3 ARG A 26 10.742 -6.064 20.023 1.00 10.00 H new ATOM 0 HE ARG A 26 10.680 -3.925 21.483 1.00 10.00 H new ATOM 0 HH11 ARG A 26 10.268 -7.155 22.974 1.00 10.00 H new ATOM 0 HH12 ARG A 26 10.959 -6.601 24.503 1.00 10.00 H new ATOM 0 HH21 ARG A 26 11.553 -3.303 23.322 1.00 10.00 H new ATOM 0 HH22 ARG A 26 11.694 -4.399 24.700 1.00 10.00 H new ATOM 407 N VAL A 27 6.499 -4.087 17.889 1.00 10.00 N ATOM 408 CA VAL A 27 6.085 -4.524 16.573 1.00 10.00 C ATOM 409 C VAL A 27 7.350 -4.982 15.848 1.00 10.00 C ATOM 410 O VAL A 27 8.414 -4.370 15.993 1.00 10.00 O ATOM 411 CB VAL A 27 5.281 -3.399 15.882 1.00 10.00 C ATOM 412 CG1 VAL A 27 6.027 -2.057 15.785 1.00 10.00 C ATOM 413 CG2 VAL A 27 4.813 -3.816 14.484 1.00 10.00 C ATOM 0 H VAL A 27 7.248 -3.395 17.861 1.00 10.00 H new ATOM 0 HA VAL A 27 5.397 -5.370 16.587 1.00 10.00 H new ATOM 0 HB VAL A 27 4.420 -3.242 16.532 1.00 10.00 H new ATOM 0 HG11 VAL A 27 5.393 -1.323 15.287 1.00 10.00 H new ATOM 0 HG12 VAL A 27 6.273 -1.704 16.787 1.00 10.00 H new ATOM 0 HG13 VAL A 27 6.945 -2.191 15.212 1.00 10.00 H new ATOM 0 HG21 VAL A 27 4.251 -3.000 14.030 1.00 10.00 H new ATOM 0 HG22 VAL A 27 5.679 -4.049 13.865 1.00 10.00 H new ATOM 0 HG23 VAL A 27 4.175 -4.696 14.561 1.00 10.00 H new ATOM 423 N HIS A 28 7.228 -6.054 15.074 1.00 10.00 N ATOM 424 CA HIS A 28 8.302 -6.742 14.382 1.00 10.00 C ATOM 425 C HIS A 28 7.901 -6.779 12.914 1.00 10.00 C ATOM 426 O HIS A 28 6.765 -7.138 12.601 1.00 10.00 O ATOM 427 CB HIS A 28 8.432 -8.175 14.917 1.00 10.00 C ATOM 428 CG HIS A 28 8.601 -8.287 16.411 1.00 10.00 C ATOM 429 ND1 HIS A 28 9.755 -8.048 17.116 1.00 10.00 N ATOM 430 CD2 HIS A 28 7.657 -8.704 17.311 1.00 10.00 C ATOM 431 CE1 HIS A 28 9.525 -8.337 18.405 1.00 10.00 C ATOM 432 NE2 HIS A 28 8.250 -8.712 18.577 1.00 10.00 N ATOM 0 H HIS A 28 6.321 -6.489 14.905 1.00 10.00 H new ATOM 0 HA HIS A 28 9.258 -6.239 14.527 1.00 10.00 H new ATOM 0 HB2 HIS A 28 7.545 -8.737 14.624 1.00 10.00 H new ATOM 0 HB3 HIS A 28 9.285 -8.651 14.434 1.00 10.00 H new ATOM 0 HD2 HIS A 28 6.637 -8.978 17.084 1.00 10.00 H new ATOM 0 HE1 HIS A 28 10.262 -8.276 19.192 1.00 10.00 H new ATOM 0 HE2 HIS A 28 7.800 -8.956 19.459 1.00 10.00 H new ATOM 440 N SER A 29 8.794 -6.365 12.020 1.00 10.00 N ATOM 441 CA SER A 29 8.499 -6.320 10.598 1.00 10.00 C ATOM 442 C SER A 29 8.631 -7.706 9.961 1.00 10.00 C ATOM 443 O SER A 29 9.480 -8.503 10.358 1.00 10.00 O ATOM 444 CB SER A 29 9.371 -5.263 9.910 1.00 10.00 C ATOM 445 OG SER A 29 10.755 -5.454 10.125 1.00 10.00 O ATOM 0 H SER A 29 9.735 -6.054 12.262 1.00 10.00 H new ATOM 0 HA SER A 29 7.460 -6.021 10.460 1.00 10.00 H new ATOM 0 HB2 SER A 29 9.171 -5.279 8.839 1.00 10.00 H new ATOM 0 HB3 SER A 29 9.087 -4.275 10.273 1.00 10.00 H new ATOM 0 HG SER A 29 10.967 -5.282 11.066 1.00 10.00 H new ATOM 451 N ALA A 30 7.789 -7.972 8.963 1.00 10.00 N ATOM 452 CA ALA A 30 7.868 -9.100 8.042 1.00 10.00 C ATOM 453 C ALA A 30 7.124 -8.678 6.760 1.00 10.00 C ATOM 454 O ALA A 30 6.054 -9.214 6.451 1.00 10.00 O ATOM 455 CB ALA A 30 7.271 -10.354 8.684 1.00 10.00 C ATOM 0 H ALA A 30 6.989 -7.371 8.766 1.00 10.00 H new ATOM 0 HA ALA A 30 8.900 -9.353 7.798 1.00 10.00 H new ATOM 0 HB1 ALA A 30 7.337 -11.187 7.985 1.00 10.00 H new ATOM 0 HB2 ALA A 30 7.824 -10.597 9.591 1.00 10.00 H new ATOM 0 HB3 ALA A 30 6.226 -10.172 8.934 1.00 10.00 H new ATOM 461 N PRO A 31 7.612 -7.624 6.075 1.00 10.00 N ATOM 462 CA PRO A 31 6.892 -6.963 4.996 1.00 10.00 C ATOM 463 C PRO A 31 6.499 -7.959 3.907 1.00 10.00 C ATOM 464 O PRO A 31 7.264 -8.872 3.589 1.00 10.00 O ATOM 465 CB PRO A 31 7.821 -5.866 4.462 1.00 10.00 C ATOM 466 CG PRO A 31 8.866 -5.677 5.560 1.00 10.00 C ATOM 467 CD PRO A 31 8.937 -7.047 6.228 1.00 10.00 C ATOM 0 HA PRO A 31 5.957 -6.530 5.351 1.00 10.00 H new ATOM 0 HB2 PRO A 31 8.284 -6.162 3.521 1.00 10.00 H new ATOM 0 HB3 PRO A 31 7.275 -4.942 4.271 1.00 10.00 H new ATOM 0 HG2 PRO A 31 9.831 -5.381 5.148 1.00 10.00 H new ATOM 0 HG3 PRO A 31 8.570 -4.902 6.266 1.00 10.00 H new ATOM 0 HD2 PRO A 31 9.695 -7.674 5.758 1.00 10.00 H new ATOM 0 HD3 PRO A 31 9.206 -6.957 7.280 1.00 10.00 H new ATOM 475 N ARG A 32 5.315 -7.764 3.311 1.00 10.00 N ATOM 476 CA ARG A 32 4.728 -8.649 2.295 1.00 10.00 C ATOM 477 C ARG A 32 4.778 -10.142 2.690 1.00 10.00 C ATOM 478 O ARG A 32 4.810 -11.004 1.814 1.00 10.00 O ATOM 479 CB ARG A 32 5.373 -8.321 0.929 1.00 10.00 C ATOM 480 CG ARG A 32 4.468 -8.628 -0.273 1.00 10.00 C ATOM 481 CD ARG A 32 5.186 -8.283 -1.585 1.00 10.00 C ATOM 482 NE ARG A 32 4.286 -8.428 -2.744 1.00 10.00 N ATOM 483 CZ ARG A 32 3.463 -7.494 -3.236 1.00 10.00 C ATOM 484 NH1 ARG A 32 3.474 -6.246 -2.759 1.00 10.00 N ATOM 485 NH2 ARG A 32 2.646 -7.800 -4.243 1.00 10.00 N ATOM 0 H ARG A 32 4.722 -6.963 3.528 1.00 10.00 H new ATOM 0 HA ARG A 32 3.658 -8.458 2.215 1.00 10.00 H new ATOM 0 HB2 ARG A 32 5.642 -7.265 0.909 1.00 10.00 H new ATOM 0 HB3 ARG A 32 6.299 -8.888 0.829 1.00 10.00 H new ATOM 0 HG2 ARG A 32 4.192 -9.682 -0.269 1.00 10.00 H new ATOM 0 HG3 ARG A 32 3.543 -8.056 -0.196 1.00 10.00 H new ATOM 0 HD2 ARG A 32 5.561 -7.260 -1.539 1.00 10.00 H new ATOM 0 HD3 ARG A 32 6.051 -8.934 -1.710 1.00 10.00 H new ATOM 0 HE ARG A 32 4.291 -9.331 -3.219 1.00 10.00 H new ATOM 0 HH11 ARG A 32 4.116 -5.993 -2.008 1.00 10.00 H new ATOM 0 HH12 ARG A 32 2.840 -5.547 -3.146 1.00 10.00 H new ATOM 0 HH21 ARG A 32 2.650 -8.742 -4.635 1.00 10.00 H new ATOM 0 HH22 ARG A 32 2.017 -7.093 -4.622 1.00 10.00 H new ATOM 499 N SER A 33 4.824 -10.439 3.994 1.00 10.00 N ATOM 500 CA SER A 33 4.966 -11.777 4.553 1.00 10.00 C ATOM 501 C SER A 33 6.171 -12.556 3.992 1.00 10.00 C ATOM 502 O SER A 33 6.121 -13.784 3.937 1.00 10.00 O ATOM 503 CB SER A 33 3.632 -12.532 4.423 1.00 10.00 C ATOM 504 OG SER A 33 2.554 -11.739 4.894 1.00 10.00 O ATOM 0 H SER A 33 4.760 -9.719 4.714 1.00 10.00 H new ATOM 0 HA SER A 33 5.198 -11.678 5.613 1.00 10.00 H new ATOM 0 HB2 SER A 33 3.462 -12.802 3.381 1.00 10.00 H new ATOM 0 HB3 SER A 33 3.679 -13.462 4.989 1.00 10.00 H new ATOM 0 HG SER A 33 1.716 -12.238 4.800 1.00 10.00 H new ATOM 510 N GLY A 34 7.250 -11.878 3.573 1.00 10.00 N ATOM 511 CA GLY A 34 8.422 -12.574 3.039 1.00 10.00 C ATOM 512 C GLY A 34 9.607 -11.702 2.616 1.00 10.00 C ATOM 513 O GLY A 34 10.609 -12.254 2.163 1.00 10.00 O ATOM 0 H GLY A 34 7.332 -10.862 3.594 1.00 10.00 H new ATOM 0 HA2 GLY A 34 8.771 -13.280 3.793 1.00 10.00 H new ATOM 0 HA3 GLY A 34 8.106 -13.160 2.176 1.00 10.00 H new ATOM 517 N ALA A 35 9.528 -10.370 2.708 1.00 10.00 N ATOM 518 CA ALA A 35 10.653 -9.495 2.392 1.00 10.00 C ATOM 519 C ALA A 35 11.834 -9.759 3.349 1.00 10.00 C ATOM 520 O ALA A 35 11.605 -10.115 4.506 1.00 10.00 O ATOM 521 CB ALA A 35 10.202 -8.033 2.484 1.00 10.00 C ATOM 0 H ALA A 35 8.686 -9.874 3.002 1.00 10.00 H new ATOM 0 HA ALA A 35 10.992 -9.703 1.377 1.00 10.00 H new ATOM 0 HB1 ALA A 35 11.041 -7.378 2.248 1.00 10.00 H new ATOM 0 HB2 ALA A 35 9.393 -7.856 1.775 1.00 10.00 H new ATOM 0 HB3 ALA A 35 9.851 -7.823 3.494 1.00 10.00 H new ATOM 527 N PRO A 36 13.088 -9.515 2.921 1.00 10.00 N ATOM 528 CA PRO A 36 14.290 -9.728 3.727 1.00 10.00 C ATOM 529 C PRO A 36 14.502 -8.597 4.755 1.00 10.00 C ATOM 530 O PRO A 36 15.516 -7.899 4.724 1.00 10.00 O ATOM 531 CB PRO A 36 15.422 -9.867 2.697 1.00 10.00 C ATOM 532 CG PRO A 36 14.979 -8.928 1.577 1.00 10.00 C ATOM 533 CD PRO A 36 13.462 -9.118 1.568 1.00 10.00 C ATOM 0 HA PRO A 36 14.231 -10.618 4.354 1.00 10.00 H new ATOM 0 HB2 PRO A 36 16.386 -9.573 3.113 1.00 10.00 H new ATOM 0 HB3 PRO A 36 15.526 -10.894 2.346 1.00 10.00 H new ATOM 0 HG2 PRO A 36 15.257 -7.894 1.780 1.00 10.00 H new ATOM 0 HG3 PRO A 36 15.428 -9.197 0.621 1.00 10.00 H new ATOM 0 HD2 PRO A 36 12.957 -8.196 1.280 1.00 10.00 H new ATOM 0 HD3 PRO A 36 13.170 -9.880 0.845 1.00 10.00 H new ATOM 541 N ALA A 37 13.534 -8.387 5.650 1.00 10.00 N ATOM 542 CA ALA A 37 13.599 -7.425 6.741 1.00 10.00 C ATOM 543 C ALA A 37 12.937 -8.042 7.972 1.00 10.00 C ATOM 544 O ALA A 37 11.914 -8.716 7.845 1.00 10.00 O ATOM 545 CB ALA A 37 12.884 -6.132 6.333 1.00 10.00 C ATOM 0 H ALA A 37 12.654 -8.903 5.630 1.00 10.00 H new ATOM 0 HA ALA A 37 14.636 -7.182 6.971 1.00 10.00 H new ATOM 0 HB1 ALA A 37 12.935 -5.414 7.152 1.00 10.00 H new ATOM 0 HB2 ALA A 37 13.368 -5.711 5.451 1.00 10.00 H new ATOM 0 HB3 ALA A 37 11.841 -6.350 6.105 1.00 10.00 H new ATOM 551 N ALA A 38 13.524 -7.793 9.145 1.00 10.00 N ATOM 552 CA ALA A 38 13.085 -8.321 10.435 1.00 10.00 C ATOM 553 C ALA A 38 13.438 -7.334 11.563 1.00 10.00 C ATOM 554 O ALA A 38 13.708 -7.731 12.698 1.00 10.00 O ATOM 555 CB ALA A 38 13.714 -9.705 10.658 1.00 10.00 C ATOM 0 H ALA A 38 14.348 -7.196 9.223 1.00 10.00 H new ATOM 0 HA ALA A 38 12.001 -8.438 10.441 1.00 10.00 H new ATOM 0 HB1 ALA A 38 13.389 -10.102 11.620 1.00 10.00 H new ATOM 0 HB2 ALA A 38 13.400 -10.380 9.862 1.00 10.00 H new ATOM 0 HB3 ALA A 38 14.800 -9.616 10.651 1.00 10.00 H new ATOM 561 N GLU A 39 13.472 -6.038 11.245 1.00 10.00 N ATOM 562 CA GLU A 39 13.666 -4.970 12.222 1.00 10.00 C ATOM 563 C GLU A 39 12.436 -4.904 13.138 1.00 10.00 C ATOM 564 O GLU A 39 11.361 -5.387 12.766 1.00 10.00 O ATOM 565 CB GLU A 39 13.867 -3.626 11.498 1.00 10.00 C ATOM 566 CG GLU A 39 15.100 -3.585 10.577 1.00 10.00 C ATOM 567 CD GLU A 39 16.421 -3.851 11.311 1.00 10.00 C ATOM 568 OE1 GLU A 39 16.811 -2.986 12.126 1.00 10.00 O ATOM 569 OE2 GLU A 39 17.013 -4.930 11.083 1.00 10.00 O ATOM 0 H GLU A 39 13.364 -5.699 10.289 1.00 10.00 H new ATOM 0 HA GLU A 39 14.553 -5.174 12.821 1.00 10.00 H new ATOM 0 HB2 GLU A 39 12.978 -3.408 10.906 1.00 10.00 H new ATOM 0 HB3 GLU A 39 13.957 -2.835 12.242 1.00 10.00 H new ATOM 0 HG2 GLU A 39 14.978 -4.325 9.786 1.00 10.00 H new ATOM 0 HG3 GLU A 39 15.151 -2.609 10.095 1.00 10.00 H new ATOM 576 N SER A 40 12.554 -4.260 14.301 1.00 10.00 N ATOM 577 CA SER A 40 11.459 -4.086 15.255 1.00 10.00 C ATOM 578 C SER A 40 11.509 -2.678 15.860 1.00 10.00 C ATOM 579 O SER A 40 12.559 -2.041 15.848 1.00 10.00 O ATOM 580 CB SER A 40 11.563 -5.141 16.366 1.00 10.00 C ATOM 581 OG SER A 40 11.767 -6.453 15.854 1.00 10.00 O ATOM 0 H SER A 40 13.429 -3.838 14.611 1.00 10.00 H new ATOM 0 HA SER A 40 10.510 -4.212 14.734 1.00 10.00 H new ATOM 0 HB2 SER A 40 12.386 -4.882 17.032 1.00 10.00 H new ATOM 0 HB3 SER A 40 10.652 -5.125 16.964 1.00 10.00 H new ATOM 0 HG SER A 40 11.079 -7.053 16.209 1.00 10.00 H new ATOM 587 N LYS A 41 10.395 -2.203 16.425 1.00 10.00 N ATOM 588 CA LYS A 41 10.322 -0.965 17.212 1.00 10.00 C ATOM 589 C LYS A 41 9.211 -1.083 18.251 1.00 10.00 C ATOM 590 O LYS A 41 8.460 -2.053 18.214 1.00 10.00 O ATOM 591 CB LYS A 41 10.132 0.274 16.308 1.00 10.00 C ATOM 592 CG LYS A 41 8.739 0.433 15.664 1.00 10.00 C ATOM 593 CD LYS A 41 8.602 1.824 15.027 1.00 10.00 C ATOM 594 CE LYS A 41 7.173 2.077 14.524 1.00 10.00 C ATOM 595 NZ LYS A 41 7.005 3.461 14.030 1.00 10.00 N ATOM 0 H LYS A 41 9.496 -2.679 16.347 1.00 10.00 H new ATOM 0 HA LYS A 41 11.270 -0.825 17.732 1.00 10.00 H new ATOM 0 HB2 LYS A 41 10.341 1.166 16.899 1.00 10.00 H new ATOM 0 HB3 LYS A 41 10.876 0.236 15.513 1.00 10.00 H new ATOM 0 HG2 LYS A 41 8.591 -0.337 14.907 1.00 10.00 H new ATOM 0 HG3 LYS A 41 7.964 0.293 16.418 1.00 10.00 H new ATOM 0 HD2 LYS A 41 8.872 2.587 15.757 1.00 10.00 H new ATOM 0 HD3 LYS A 41 9.302 1.915 14.197 1.00 10.00 H new ATOM 0 HE2 LYS A 41 6.939 1.374 13.725 1.00 10.00 H new ATOM 0 HE3 LYS A 41 6.464 1.890 15.331 1.00 10.00 H new ATOM 0 HZ1 LYS A 41 6.028 3.595 13.699 1.00 10.00 H new ATOM 0 HZ2 LYS A 41 7.205 4.131 14.800 1.00 10.00 H new ATOM 0 HZ3 LYS A 41 7.664 3.631 13.244 1.00 10.00 H new ATOM 609 N GLU A 42 9.040 -0.086 19.112 1.00 10.00 N ATOM 610 CA GLU A 42 7.895 0.014 20.005 1.00 10.00 C ATOM 611 C GLU A 42 6.887 0.988 19.389 1.00 10.00 C ATOM 612 O GLU A 42 7.257 1.877 18.617 1.00 10.00 O ATOM 613 CB GLU A 42 8.337 0.486 21.401 1.00 10.00 C ATOM 614 CG GLU A 42 9.044 -0.600 22.239 1.00 10.00 C ATOM 615 CD GLU A 42 10.485 -0.946 21.829 1.00 10.00 C ATOM 616 OE1 GLU A 42 11.222 -0.011 21.454 1.00 10.00 O ATOM 617 OE2 GLU A 42 10.854 -2.143 21.940 1.00 10.00 O ATOM 0 H GLU A 42 9.702 0.684 19.209 1.00 10.00 H new ATOM 0 HA GLU A 42 7.430 -0.964 20.126 1.00 10.00 H new ATOM 0 HB2 GLU A 42 9.008 1.338 21.289 1.00 10.00 H new ATOM 0 HB3 GLU A 42 7.462 0.839 21.947 1.00 10.00 H new ATOM 0 HG2 GLU A 42 9.053 -0.277 23.280 1.00 10.00 H new ATOM 0 HG3 GLU A 42 8.447 -1.511 22.193 1.00 10.00 H new ATOM 624 N ILE A 43 5.619 0.872 19.775 1.00 10.00 N ATOM 625 CA ILE A 43 4.515 1.739 19.387 1.00 10.00 C ATOM 626 C ILE A 43 3.603 1.932 20.603 1.00 10.00 C ATOM 627 O ILE A 43 3.468 1.042 21.444 1.00 10.00 O ATOM 628 CB ILE A 43 3.733 1.158 18.179 1.00 10.00 C ATOM 629 CG1 ILE A 43 3.330 -0.325 18.358 1.00 10.00 C ATOM 630 CG2 ILE A 43 4.533 1.359 16.883 1.00 10.00 C ATOM 631 CD1 ILE A 43 2.309 -0.842 17.337 1.00 10.00 C ATOM 0 H ILE A 43 5.320 0.126 20.403 1.00 10.00 H new ATOM 0 HA ILE A 43 4.905 2.704 19.065 1.00 10.00 H new ATOM 0 HB ILE A 43 2.797 1.713 18.117 1.00 10.00 H new ATOM 0 HG12 ILE A 43 4.227 -0.941 18.297 1.00 10.00 H new ATOM 0 HG13 ILE A 43 2.920 -0.457 19.359 1.00 10.00 H new ATOM 0 HG21 ILE A 43 3.974 0.947 16.043 1.00 10.00 H new ATOM 0 HG22 ILE A 43 4.701 2.424 16.720 1.00 10.00 H new ATOM 0 HG23 ILE A 43 5.493 0.849 16.965 1.00 10.00 H new ATOM 0 HD11 ILE A 43 2.088 -1.890 17.542 1.00 10.00 H new ATOM 0 HD12 ILE A 43 1.392 -0.257 17.411 1.00 10.00 H new ATOM 0 HD13 ILE A 43 2.720 -0.748 16.332 1.00 10.00 H new ATOM 643 N VAL A 44 2.957 3.094 20.682 1.00 10.00 N ATOM 644 CA VAL A 44 2.016 3.443 21.745 1.00 10.00 C ATOM 645 C VAL A 44 0.633 3.460 21.091 1.00 10.00 C ATOM 646 O VAL A 44 0.458 4.154 20.081 1.00 10.00 O ATOM 647 CB VAL A 44 2.411 4.819 22.329 1.00 10.00 C ATOM 648 CG1 VAL A 44 1.563 5.215 23.542 1.00 10.00 C ATOM 649 CG2 VAL A 44 3.886 4.888 22.757 1.00 10.00 C ATOM 0 H VAL A 44 3.076 3.836 19.993 1.00 10.00 H new ATOM 0 HA VAL A 44 2.021 2.736 22.574 1.00 10.00 H new ATOM 0 HB VAL A 44 2.233 5.514 21.509 1.00 10.00 H new ATOM 0 HG11 VAL A 44 1.886 6.189 23.909 1.00 10.00 H new ATOM 0 HG12 VAL A 44 0.514 5.266 23.251 1.00 10.00 H new ATOM 0 HG13 VAL A 44 1.686 4.472 24.330 1.00 10.00 H new ATOM 0 HG21 VAL A 44 4.102 5.878 23.159 1.00 10.00 H new ATOM 0 HG22 VAL A 44 4.078 4.136 23.522 1.00 10.00 H new ATOM 0 HG23 VAL A 44 4.524 4.699 21.894 1.00 10.00 H new ATOM 659 N ARG A 45 -0.330 2.689 21.607 1.00 10.00 N ATOM 660 CA ARG A 45 -1.666 2.540 21.024 1.00 10.00 C ATOM 661 C ARG A 45 -2.679 2.780 22.130 1.00 10.00 C ATOM 662 O ARG A 45 -2.405 2.412 23.268 1.00 10.00 O ATOM 663 CB ARG A 45 -1.838 1.107 20.482 1.00 10.00 C ATOM 664 CG ARG A 45 -0.895 0.685 19.340 1.00 10.00 C ATOM 665 CD ARG A 45 -1.200 1.352 17.992 1.00 10.00 C ATOM 666 NE ARG A 45 -0.488 2.629 17.886 1.00 10.00 N ATOM 667 CZ ARG A 45 0.479 2.928 17.018 1.00 10.00 C ATOM 668 NH1 ARG A 45 0.691 2.239 15.895 1.00 10.00 N ATOM 669 NH2 ARG A 45 1.294 3.924 17.316 1.00 10.00 N ATOM 0 H ARG A 45 -0.199 2.141 22.457 1.00 10.00 H new ATOM 0 HA ARG A 45 -1.807 3.247 20.206 1.00 10.00 H new ATOM 0 HB2 ARG A 45 -1.703 0.411 21.310 1.00 10.00 H new ATOM 0 HB3 ARG A 45 -2.865 0.995 20.135 1.00 10.00 H new ATOM 0 HG2 ARG A 45 0.130 0.920 19.625 1.00 10.00 H new ATOM 0 HG3 ARG A 45 -0.952 -0.397 19.218 1.00 10.00 H new ATOM 0 HD2 ARG A 45 -0.903 0.693 17.176 1.00 10.00 H new ATOM 0 HD3 ARG A 45 -2.273 1.516 17.894 1.00 10.00 H new ATOM 0 HE ARG A 45 -0.759 3.362 18.542 1.00 10.00 H new ATOM 0 HH11 ARG A 45 0.098 1.441 15.667 1.00 10.00 H new ATOM 0 HH12 ARG A 45 1.446 2.511 15.265 1.00 10.00 H new ATOM 0 HH21 ARG A 45 1.173 4.438 18.188 1.00 10.00 H new ATOM 0 HH22 ARG A 45 2.044 4.179 16.674 1.00 10.00 H new ATOM 683 N GLY A 46 -3.854 3.316 21.833 1.00 10.00 N ATOM 684 CA GLY A 46 -4.908 3.441 22.826 1.00 10.00 C ATOM 685 C GLY A 46 -6.152 3.979 22.159 1.00 10.00 C ATOM 686 O GLY A 46 -6.082 5.036 21.538 1.00 10.00 O ATOM 0 H GLY A 46 -4.101 3.672 20.909 1.00 10.00 H new ATOM 0 HA2 GLY A 46 -5.114 2.472 23.280 1.00 10.00 H new ATOM 0 HA3 GLY A 46 -4.592 4.108 23.628 1.00 10.00 H new ATOM 690 N TYR A 47 -7.269 3.261 22.274 1.00 10.00 N ATOM 691 CA TYR A 47 -8.526 3.675 21.661 1.00 10.00 C ATOM 692 C TYR A 47 -9.696 3.383 22.593 1.00 10.00 C ATOM 693 O TYR A 47 -9.782 2.282 23.143 1.00 10.00 O ATOM 694 CB TYR A 47 -8.719 2.945 20.329 1.00 10.00 C ATOM 695 CG TYR A 47 -7.526 2.966 19.389 1.00 10.00 C ATOM 696 CD1 TYR A 47 -7.359 4.019 18.470 1.00 10.00 C ATOM 697 CD2 TYR A 47 -6.570 1.932 19.447 1.00 10.00 C ATOM 698 CE1 TYR A 47 -6.225 4.062 17.640 1.00 10.00 C ATOM 699 CE2 TYR A 47 -5.446 1.956 18.605 1.00 10.00 C ATOM 700 CZ TYR A 47 -5.262 3.032 17.705 1.00 10.00 C ATOM 701 OH TYR A 47 -4.158 3.052 16.912 1.00 10.00 O ATOM 0 H TYR A 47 -7.326 2.383 22.791 1.00 10.00 H new ATOM 0 HA TYR A 47 -8.490 4.749 21.478 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -8.975 1.906 20.538 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -9.572 3.386 19.814 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -8.105 4.797 18.402 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -6.702 1.117 20.143 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -6.091 4.884 16.952 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -4.723 1.154 18.645 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.285 3.703 16.190 1.00 10.00 H new ATOM 711 N LYS A 48 -10.612 4.349 22.738 1.00 10.00 N ATOM 712 CA LYS A 48 -11.659 4.306 23.758 1.00 10.00 C ATOM 713 C LYS A 48 -12.790 3.325 23.456 1.00 10.00 C ATOM 714 O LYS A 48 -13.639 3.119 24.323 1.00 10.00 O ATOM 715 CB LYS A 48 -12.180 5.732 24.031 1.00 10.00 C ATOM 716 CG LYS A 48 -13.133 6.285 22.955 1.00 10.00 C ATOM 717 CD LYS A 48 -13.316 7.809 23.063 1.00 10.00 C ATOM 718 CE LYS A 48 -13.866 8.302 24.413 1.00 10.00 C ATOM 719 NZ LYS A 48 -15.269 7.878 24.659 1.00 10.00 N ATOM 0 H LYS A 48 -10.645 5.181 22.149 1.00 10.00 H new ATOM 0 HA LYS A 48 -11.201 3.912 24.666 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -12.695 5.738 24.992 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -11.327 6.405 24.122 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -12.745 6.037 21.967 1.00 10.00 H new ATOM 0 HG3 LYS A 48 -14.104 5.797 23.047 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -12.354 8.289 22.882 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -13.990 8.136 22.271 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -13.233 7.926 25.216 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -13.810 9.390 24.446 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -15.584 8.239 25.582 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -15.883 8.258 23.911 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -15.323 6.839 24.657 1.00 10.00 H new ATOM 733 N TRP A 49 -12.883 2.782 22.234 1.00 10.00 N ATOM 734 CA TRP A 49 -13.866 1.744 21.937 1.00 10.00 C ATOM 735 C TRP A 49 -13.572 0.452 22.708 1.00 10.00 C ATOM 736 O TRP A 49 -14.498 -0.328 22.907 1.00 10.00 O ATOM 737 CB TRP A 49 -13.996 1.503 20.420 1.00 10.00 C ATOM 738 CG TRP A 49 -12.736 1.422 19.605 1.00 10.00 C ATOM 739 CD1 TRP A 49 -12.333 2.354 18.710 1.00 10.00 C ATOM 740 CD2 TRP A 49 -11.701 0.384 19.580 1.00 10.00 C ATOM 741 NE1 TRP A 49 -11.134 1.978 18.145 1.00 10.00 N ATOM 742 CE2 TRP A 49 -10.669 0.804 18.687 1.00 10.00 C ATOM 743 CE3 TRP A 49 -11.503 -0.857 20.223 1.00 10.00 C ATOM 744 CZ2 TRP A 49 -9.474 0.091 18.519 1.00 10.00 C ATOM 745 CZ3 TRP A 49 -10.300 -1.575 20.080 1.00 10.00 C ATOM 746 CH2 TRP A 49 -9.275 -1.087 19.254 1.00 10.00 C ATOM 0 H TRP A 49 -12.293 3.045 21.445 1.00 10.00 H new ATOM 0 HA TRP A 49 -14.836 2.102 22.282 1.00 10.00 H new ATOM 0 HB2 TRP A 49 -14.546 0.573 20.276 1.00 10.00 H new ATOM 0 HB3 TRP A 49 -14.609 2.304 20.007 1.00 10.00 H new ATOM 0 HD1 TRP A 49 -12.872 3.259 18.473 1.00 10.00 H new ATOM 0 HE1 TRP A 49 -10.652 2.505 17.416 1.00 10.00 H new ATOM 0 HE3 TRP A 49 -12.291 -1.265 20.838 1.00 10.00 H new ATOM 0 HZ2 TRP A 49 -8.717 0.444 17.834 1.00 10.00 H new ATOM 0 HZ3 TRP A 49 -10.165 -2.507 20.609 1.00 10.00 H new ATOM 0 HH2 TRP A 49 -8.336 -1.617 19.185 1.00 10.00 H new ATOM 757 N ALA A 50 -12.319 0.213 23.114 1.00 10.00 N ATOM 758 CA ALA A 50 -11.963 -0.959 23.892 1.00 10.00 C ATOM 759 C ALA A 50 -12.484 -0.839 25.324 1.00 10.00 C ATOM 760 O ALA A 50 -12.696 0.256 25.844 1.00 10.00 O ATOM 761 CB ALA A 50 -10.440 -1.112 23.897 1.00 10.00 C ATOM 0 H ALA A 50 -11.533 0.830 22.909 1.00 10.00 H new ATOM 0 HA ALA A 50 -12.421 -1.839 23.440 1.00 10.00 H new ATOM 0 HB1 ALA A 50 -10.165 -1.991 24.480 1.00 10.00 H new ATOM 0 HB2 ALA A 50 -10.083 -1.229 22.874 1.00 10.00 H new ATOM 0 HB3 ALA A 50 -9.987 -0.226 24.341 1.00 10.00 H new ATOM 767 N GLU A 51 -12.523 -1.981 26.012 1.00 10.00 N ATOM 768 CA GLU A 51 -12.863 -2.081 27.436 1.00 10.00 C ATOM 769 C GLU A 51 -11.684 -2.676 28.228 1.00 10.00 C ATOM 770 O GLU A 51 -11.581 -2.499 29.447 1.00 10.00 O ATOM 771 CB GLU A 51 -14.142 -2.920 27.626 1.00 10.00 C ATOM 772 CG GLU A 51 -15.393 -2.258 27.022 1.00 10.00 C ATOM 773 CD GLU A 51 -16.668 -3.069 27.303 1.00 10.00 C ATOM 774 OE1 GLU A 51 -16.967 -3.990 26.508 1.00 10.00 O ATOM 775 OE2 GLU A 51 -17.330 -2.785 28.328 1.00 10.00 O ATOM 0 H GLU A 51 -12.315 -2.884 25.587 1.00 10.00 H new ATOM 0 HA GLU A 51 -13.057 -1.080 27.822 1.00 10.00 H new ATOM 0 HB2 GLU A 51 -13.999 -3.899 27.168 1.00 10.00 H new ATOM 0 HB3 GLU A 51 -14.305 -3.087 28.691 1.00 10.00 H new ATOM 0 HG2 GLU A 51 -15.505 -1.254 27.431 1.00 10.00 H new ATOM 0 HG3 GLU A 51 -15.262 -2.151 25.945 1.00 10.00 H new ATOM 782 N TYR A 52 -10.734 -3.328 27.548 1.00 10.00 N ATOM 783 CA TYR A 52 -9.557 -3.949 28.131 1.00 10.00 C ATOM 784 C TYR A 52 -8.415 -3.833 27.129 1.00 10.00 C ATOM 785 O TYR A 52 -8.634 -3.811 25.920 1.00 10.00 O ATOM 786 CB TYR A 52 -9.826 -5.431 28.446 1.00 10.00 C ATOM 787 CG TYR A 52 -10.838 -5.665 29.552 1.00 10.00 C ATOM 788 CD1 TYR A 52 -10.425 -5.647 30.899 1.00 10.00 C ATOM 789 CD2 TYR A 52 -12.193 -5.891 29.239 1.00 10.00 C ATOM 790 CE1 TYR A 52 -11.363 -5.843 31.929 1.00 10.00 C ATOM 791 CE2 TYR A 52 -13.136 -6.087 30.264 1.00 10.00 C ATOM 792 CZ TYR A 52 -12.724 -6.064 31.615 1.00 10.00 C ATOM 793 OH TYR A 52 -13.621 -6.251 32.622 1.00 10.00 O ATOM 0 H TYR A 52 -10.774 -3.437 26.535 1.00 10.00 H new ATOM 0 HA TYR A 52 -9.300 -3.447 29.064 1.00 10.00 H new ATOM 0 HB2 TYR A 52 -10.177 -5.924 27.539 1.00 10.00 H new ATOM 0 HB3 TYR A 52 -8.886 -5.907 28.724 1.00 10.00 H new ATOM 0 HD1 TYR A 52 -9.386 -5.482 31.141 1.00 10.00 H new ATOM 0 HD2 TYR A 52 -12.509 -5.914 28.207 1.00 10.00 H new ATOM 0 HE1 TYR A 52 -11.043 -5.825 32.960 1.00 10.00 H new ATOM 0 HE2 TYR A 52 -14.174 -6.255 30.018 1.00 10.00 H new ATOM 0 HH TYR A 52 -14.514 -6.389 32.243 1.00 10.00 H new ATOM 803 N HIS A 53 -7.184 -3.807 27.637 1.00 10.00 N ATOM 804 CA HIS A 53 -5.967 -3.669 26.843 1.00 10.00 C ATOM 805 C HIS A 53 -5.833 -4.774 25.793 1.00 10.00 C ATOM 806 O HIS A 53 -5.302 -4.518 24.716 1.00 10.00 O ATOM 807 CB HIS A 53 -4.760 -3.678 27.791 1.00 10.00 C ATOM 808 CG HIS A 53 -4.844 -2.624 28.869 1.00 10.00 C ATOM 809 ND1 HIS A 53 -5.576 -2.724 30.059 1.00 10.00 N ATOM 810 CD2 HIS A 53 -4.218 -1.419 28.840 1.00 10.00 C ATOM 811 CE1 HIS A 53 -5.387 -1.551 30.693 1.00 10.00 C ATOM 812 NE2 HIS A 53 -4.568 -0.753 29.987 1.00 10.00 N ATOM 0 H HIS A 53 -7.002 -3.883 28.638 1.00 10.00 H new ATOM 0 HA HIS A 53 -6.013 -2.726 26.298 1.00 10.00 H new ATOM 0 HB2 HIS A 53 -4.679 -4.660 28.257 1.00 10.00 H new ATOM 0 HB3 HIS A 53 -3.850 -3.524 27.212 1.00 10.00 H new ATOM 0 HD2 HIS A 53 -3.567 -1.054 28.060 1.00 10.00 H new ATOM 0 HE1 HIS A 53 -5.833 -1.287 31.641 1.00 10.00 H new ATOM 0 HE2 HIS A 53 -4.261 0.182 30.256 1.00 10.00 H new ATOM 820 N ALA A 54 -6.340 -5.973 26.091 1.00 10.00 N ATOM 821 CA ALA A 54 -6.329 -7.093 25.165 1.00 10.00 C ATOM 822 C ALA A 54 -7.095 -6.796 23.873 1.00 10.00 C ATOM 823 O ALA A 54 -6.678 -7.282 22.828 1.00 10.00 O ATOM 824 CB ALA A 54 -6.899 -8.334 25.858 1.00 10.00 C ATOM 0 H ALA A 54 -6.771 -6.189 26.990 1.00 10.00 H new ATOM 0 HA ALA A 54 -5.294 -7.274 24.876 1.00 10.00 H new ATOM 0 HB1 ALA A 54 -6.891 -9.174 25.164 1.00 10.00 H new ATOM 0 HB2 ALA A 54 -6.290 -8.577 26.729 1.00 10.00 H new ATOM 0 HB3 ALA A 54 -7.923 -8.136 26.176 1.00 10.00 H new ATOM 830 N ASP A 55 -8.169 -5.999 23.925 1.00 10.00 N ATOM 831 CA ASP A 55 -8.958 -5.700 22.720 1.00 10.00 C ATOM 832 C ASP A 55 -8.181 -4.762 21.791 1.00 10.00 C ATOM 833 O ASP A 55 -8.181 -4.914 20.571 1.00 10.00 O ATOM 834 CB ASP A 55 -10.300 -5.057 23.102 1.00 10.00 C ATOM 835 CG ASP A 55 -11.285 -4.999 21.924 1.00 10.00 C ATOM 836 OD1 ASP A 55 -11.356 -5.991 21.169 1.00 10.00 O ATOM 837 OD2 ASP A 55 -12.000 -3.977 21.817 1.00 10.00 O ATOM 0 H ASP A 55 -8.510 -5.553 24.777 1.00 10.00 H new ATOM 0 HA ASP A 55 -9.151 -6.637 22.198 1.00 10.00 H new ATOM 0 HB2 ASP A 55 -10.749 -5.622 23.919 1.00 10.00 H new ATOM 0 HB3 ASP A 55 -10.122 -4.047 23.472 1.00 10.00 H new ATOM 842 N ILE A 56 -7.440 -3.812 22.381 1.00 10.00 N ATOM 843 CA ILE A 56 -6.546 -2.933 21.637 1.00 10.00 C ATOM 844 C ILE A 56 -5.450 -3.798 21.008 1.00 10.00 C ATOM 845 O ILE A 56 -5.196 -3.683 19.811 1.00 10.00 O ATOM 846 CB ILE A 56 -5.968 -1.818 22.550 1.00 10.00 C ATOM 847 CG1 ILE A 56 -7.086 -0.952 23.170 1.00 10.00 C ATOM 848 CG2 ILE A 56 -4.965 -0.949 21.762 1.00 10.00 C ATOM 849 CD1 ILE A 56 -6.631 -0.063 24.335 1.00 10.00 C ATOM 0 H ILE A 56 -7.449 -3.637 23.386 1.00 10.00 H new ATOM 0 HA ILE A 56 -7.091 -2.416 20.847 1.00 10.00 H new ATOM 0 HB ILE A 56 -5.440 -2.298 23.374 1.00 10.00 H new ATOM 0 HG12 ILE A 56 -7.512 -0.319 22.391 1.00 10.00 H new ATOM 0 HG13 ILE A 56 -7.884 -1.607 23.520 1.00 10.00 H new ATOM 0 HG21 ILE A 56 -4.567 -0.171 22.414 1.00 10.00 H new ATOM 0 HG22 ILE A 56 -4.148 -1.573 21.401 1.00 10.00 H new ATOM 0 HG23 ILE A 56 -5.471 -0.488 20.914 1.00 10.00 H new ATOM 0 HD11 ILE A 56 -7.480 0.510 24.709 1.00 10.00 H new ATOM 0 HD12 ILE A 56 -6.234 -0.687 25.135 1.00 10.00 H new ATOM 0 HD13 ILE A 56 -5.856 0.621 23.990 1.00 10.00 H new ATOM 861 N TYR A 57 -4.777 -4.630 21.810 1.00 10.00 N ATOM 862 CA TYR A 57 -3.686 -5.468 21.333 1.00 10.00 C ATOM 863 C TYR A 57 -4.135 -6.372 20.182 1.00 10.00 C ATOM 864 O TYR A 57 -3.415 -6.479 19.189 1.00 10.00 O ATOM 865 CB TYR A 57 -3.133 -6.295 22.495 1.00 10.00 C ATOM 866 CG TYR A 57 -1.992 -7.218 22.110 1.00 10.00 C ATOM 867 CD1 TYR A 57 -0.749 -6.675 21.738 1.00 10.00 C ATOM 868 CD2 TYR A 57 -2.170 -8.616 22.123 1.00 10.00 C ATOM 869 CE1 TYR A 57 0.321 -7.520 21.409 1.00 10.00 C ATOM 870 CE2 TYR A 57 -1.100 -9.469 21.800 1.00 10.00 C ATOM 871 CZ TYR A 57 0.155 -8.920 21.454 1.00 10.00 C ATOM 872 OH TYR A 57 1.223 -9.719 21.203 1.00 10.00 O ATOM 0 H TYR A 57 -4.977 -4.737 22.804 1.00 10.00 H new ATOM 0 HA TYR A 57 -2.897 -4.824 20.944 1.00 10.00 H new ATOM 0 HB2 TYR A 57 -2.790 -5.618 23.278 1.00 10.00 H new ATOM 0 HB3 TYR A 57 -3.941 -6.891 22.920 1.00 10.00 H new ATOM 0 HD1 TYR A 57 -0.618 -5.603 21.706 1.00 10.00 H new ATOM 0 HD2 TYR A 57 -3.132 -9.034 22.382 1.00 10.00 H new ATOM 0 HE1 TYR A 57 1.273 -7.098 21.121 1.00 10.00 H new ATOM 0 HE2 TYR A 57 -1.237 -10.540 21.816 1.00 10.00 H new ATOM 0 HH TYR A 57 0.952 -10.658 21.272 1.00 10.00 H new ATOM 882 N ASP A 58 -5.318 -6.984 20.286 1.00 10.00 N ATOM 883 CA ASP A 58 -5.864 -7.844 19.234 1.00 10.00 C ATOM 884 C ASP A 58 -6.118 -7.053 17.950 1.00 10.00 C ATOM 885 O ASP A 58 -5.679 -7.460 16.873 1.00 10.00 O ATOM 886 CB ASP A 58 -7.163 -8.513 19.695 1.00 10.00 C ATOM 887 CG ASP A 58 -7.767 -9.365 18.567 1.00 10.00 C ATOM 888 OD1 ASP A 58 -7.217 -10.463 18.317 1.00 10.00 O ATOM 889 OD2 ASP A 58 -8.744 -8.900 17.937 1.00 10.00 O ATOM 0 H ASP A 58 -5.924 -6.897 21.102 1.00 10.00 H new ATOM 0 HA ASP A 58 -5.123 -8.616 19.026 1.00 10.00 H new ATOM 0 HB2 ASP A 58 -6.966 -9.140 20.565 1.00 10.00 H new ATOM 0 HB3 ASP A 58 -7.879 -7.752 20.006 1.00 10.00 H new ATOM 894 N LYS A 59 -6.727 -5.864 18.056 1.00 10.00 N ATOM 895 CA LYS A 59 -6.989 -5.013 16.895 1.00 10.00 C ATOM 896 C LYS A 59 -5.673 -4.629 16.222 1.00 10.00 C ATOM 897 O LYS A 59 -5.557 -4.731 15.002 1.00 10.00 O ATOM 898 CB LYS A 59 -7.779 -3.772 17.345 1.00 10.00 C ATOM 899 CG LYS A 59 -8.319 -2.928 16.176 1.00 10.00 C ATOM 900 CD LYS A 59 -9.496 -3.557 15.409 1.00 10.00 C ATOM 901 CE LYS A 59 -10.745 -3.708 16.295 1.00 10.00 C ATOM 902 NZ LYS A 59 -11.912 -4.224 15.540 1.00 10.00 N ATOM 0 H LYS A 59 -7.048 -5.471 18.941 1.00 10.00 H new ATOM 0 HA LYS A 59 -7.588 -5.554 16.162 1.00 10.00 H new ATOM 0 HB2 LYS A 59 -8.614 -4.090 17.969 1.00 10.00 H new ATOM 0 HB3 LYS A 59 -7.136 -3.148 17.966 1.00 10.00 H new ATOM 0 HG2 LYS A 59 -8.633 -1.958 16.562 1.00 10.00 H new ATOM 0 HG3 LYS A 59 -7.505 -2.743 15.475 1.00 10.00 H new ATOM 0 HD2 LYS A 59 -9.737 -2.939 14.544 1.00 10.00 H new ATOM 0 HD3 LYS A 59 -9.200 -4.535 15.029 1.00 10.00 H new ATOM 0 HE2 LYS A 59 -10.522 -4.383 17.121 1.00 10.00 H new ATOM 0 HE3 LYS A 59 -10.996 -2.742 16.732 1.00 10.00 H new ATOM 0 HZ1 LYS A 59 -12.729 -4.309 16.178 1.00 10.00 H new ATOM 0 HZ2 LYS A 59 -12.143 -3.568 14.767 1.00 10.00 H new ATOM 0 HZ3 LYS A 59 -11.684 -5.158 15.144 1.00 10.00 H new ATOM 916 N VAL A 60 -4.699 -4.175 17.009 1.00 10.00 N ATOM 917 CA VAL A 60 -3.395 -3.755 16.518 1.00 10.00 C ATOM 918 C VAL A 60 -2.688 -4.942 15.855 1.00 10.00 C ATOM 919 O VAL A 60 -2.135 -4.778 14.772 1.00 10.00 O ATOM 920 CB VAL A 60 -2.600 -3.138 17.688 1.00 10.00 C ATOM 921 CG1 VAL A 60 -1.134 -2.840 17.333 1.00 10.00 C ATOM 922 CG2 VAL A 60 -3.257 -1.820 18.147 1.00 10.00 C ATOM 0 H VAL A 60 -4.799 -4.089 18.020 1.00 10.00 H new ATOM 0 HA VAL A 60 -3.488 -2.987 15.750 1.00 10.00 H new ATOM 0 HB VAL A 60 -2.614 -3.884 18.483 1.00 10.00 H new ATOM 0 HG11 VAL A 60 -0.631 -2.408 18.198 1.00 10.00 H new ATOM 0 HG12 VAL A 60 -0.634 -3.765 17.047 1.00 10.00 H new ATOM 0 HG13 VAL A 60 -1.097 -2.135 16.502 1.00 10.00 H new ATOM 0 HG21 VAL A 60 -2.685 -1.397 18.973 1.00 10.00 H new ATOM 0 HG22 VAL A 60 -3.274 -1.113 17.317 1.00 10.00 H new ATOM 0 HG23 VAL A 60 -4.277 -2.017 18.476 1.00 10.00 H new ATOM 932 N SER A 61 -2.719 -6.132 16.456 1.00 10.00 N ATOM 933 CA SER A 61 -2.098 -7.314 15.876 1.00 10.00 C ATOM 934 C SER A 61 -2.741 -7.647 14.524 1.00 10.00 C ATOM 935 O SER A 61 -2.014 -7.912 13.567 1.00 10.00 O ATOM 936 CB SER A 61 -2.200 -8.495 16.849 1.00 10.00 C ATOM 937 OG SER A 61 -1.607 -8.164 18.090 1.00 10.00 O ATOM 0 H SER A 61 -3.174 -6.299 17.354 1.00 10.00 H new ATOM 0 HA SER A 61 -1.041 -7.111 15.701 1.00 10.00 H new ATOM 0 HB2 SER A 61 -3.246 -8.762 16.998 1.00 10.00 H new ATOM 0 HB3 SER A 61 -1.706 -9.368 16.424 1.00 10.00 H new ATOM 0 HG SER A 61 -2.237 -7.636 18.623 1.00 10.00 H new ATOM 943 N GLY A 62 -4.073 -7.590 14.428 1.00 10.00 N ATOM 944 CA GLY A 62 -4.777 -7.835 13.181 1.00 10.00 C ATOM 945 C GLY A 62 -4.360 -6.826 12.117 1.00 10.00 C ATOM 946 O GLY A 62 -4.052 -7.213 10.989 1.00 10.00 O ATOM 0 H GLY A 62 -4.685 -7.373 15.214 1.00 10.00 H new ATOM 0 HA2 GLY A 62 -4.567 -8.846 12.832 1.00 10.00 H new ATOM 0 HA3 GLY A 62 -5.852 -7.772 13.347 1.00 10.00 H new ATOM 950 N ASP A 63 -4.321 -5.537 12.464 1.00 10.00 N ATOM 951 CA ASP A 63 -3.910 -4.487 11.530 1.00 10.00 C ATOM 952 C ASP A 63 -2.467 -4.698 11.084 1.00 10.00 C ATOM 953 O ASP A 63 -2.198 -4.688 9.887 1.00 10.00 O ATOM 954 CB ASP A 63 -4.068 -3.087 12.133 1.00 10.00 C ATOM 955 CG ASP A 63 -3.748 -2.015 11.080 1.00 10.00 C ATOM 956 OD1 ASP A 63 -4.683 -1.653 10.330 1.00 10.00 O ATOM 957 OD2 ASP A 63 -2.566 -1.607 10.989 1.00 10.00 O ATOM 0 H ASP A 63 -4.571 -5.194 13.392 1.00 10.00 H new ATOM 0 HA ASP A 63 -4.569 -4.555 10.664 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -5.086 -2.954 12.500 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -3.403 -2.975 12.990 1.00 10.00 H new ATOM 962 N MET A 64 -1.556 -5.007 12.011 1.00 10.00 N ATOM 963 CA MET A 64 -0.154 -5.226 11.695 1.00 10.00 C ATOM 964 C MET A 64 0.017 -6.409 10.753 1.00 10.00 C ATOM 965 O MET A 64 0.849 -6.336 9.853 1.00 10.00 O ATOM 966 CB MET A 64 0.676 -5.423 12.973 1.00 10.00 C ATOM 967 CG MET A 64 0.940 -4.100 13.701 1.00 10.00 C ATOM 968 SD MET A 64 1.734 -2.814 12.699 1.00 10.00 S ATOM 969 CE MET A 64 0.525 -1.488 12.932 1.00 10.00 C ATOM 0 H MET A 64 -1.777 -5.111 13.001 1.00 10.00 H new ATOM 0 HA MET A 64 0.214 -4.335 11.187 1.00 10.00 H new ATOM 0 HB2 MET A 64 0.153 -6.106 13.642 1.00 10.00 H new ATOM 0 HB3 MET A 64 1.627 -5.892 12.718 1.00 10.00 H new ATOM 0 HG2 MET A 64 -0.008 -3.714 14.075 1.00 10.00 H new ATOM 0 HG3 MET A 64 1.567 -4.300 14.570 1.00 10.00 H new ATOM 0 HE1 MET A 64 0.704 -0.700 12.201 1.00 10.00 H new ATOM 0 HE2 MET A 64 -0.481 -1.885 12.798 1.00 10.00 H new ATOM 0 HE3 MET A 64 0.623 -1.079 13.938 1.00 10.00 H new ATOM 979 N GLN A 65 -0.770 -7.475 10.896 1.00 10.00 N ATOM 980 CA GLN A 65 -0.714 -8.599 9.971 1.00 10.00 C ATOM 981 C GLN A 65 -1.128 -8.165 8.561 1.00 10.00 C ATOM 982 O GLN A 65 -0.527 -8.636 7.596 1.00 10.00 O ATOM 983 CB GLN A 65 -1.581 -9.744 10.510 1.00 10.00 C ATOM 984 CG GLN A 65 -0.937 -10.398 11.746 1.00 10.00 C ATOM 985 CD GLN A 65 0.110 -11.440 11.372 1.00 10.00 C ATOM 986 OE1 GLN A 65 -0.212 -12.597 11.139 1.00 10.00 O ATOM 987 NE2 GLN A 65 1.371 -11.059 11.249 1.00 10.00 N ATOM 0 H GLN A 65 -1.454 -7.581 11.646 1.00 10.00 H new ATOM 0 HA GLN A 65 0.311 -8.961 9.893 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -2.569 -9.364 10.770 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.723 -10.494 9.731 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -0.475 -9.627 12.362 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -1.713 -10.867 12.351 1.00 10.00 H new ATOM 0 HE21 GLN A 65 1.633 -10.093 11.445 1.00 10.00 H new ATOM 0 HE22 GLN A 65 2.081 -11.731 10.958 1.00 10.00 H new ATOM 996 N LYS A 66 -2.091 -7.243 8.423 1.00 10.00 N ATOM 997 CA LYS A 66 -2.407 -6.647 7.125 1.00 10.00 C ATOM 998 C LYS A 66 -1.260 -5.766 6.614 1.00 10.00 C ATOM 999 O LYS A 66 -1.082 -5.700 5.400 1.00 10.00 O ATOM 1000 CB LYS A 66 -3.723 -5.849 7.173 1.00 10.00 C ATOM 1001 CG LYS A 66 -4.933 -6.731 7.511 1.00 10.00 C ATOM 1002 CD LYS A 66 -6.219 -5.897 7.554 1.00 10.00 C ATOM 1003 CE LYS A 66 -7.404 -6.806 7.899 1.00 10.00 C ATOM 1004 NZ LYS A 66 -8.688 -6.065 7.946 1.00 10.00 N ATOM 0 H LYS A 66 -2.661 -6.897 9.195 1.00 10.00 H new ATOM 0 HA LYS A 66 -2.538 -7.470 6.422 1.00 10.00 H new ATOM 0 HB2 LYS A 66 -3.637 -5.056 7.916 1.00 10.00 H new ATOM 0 HB3 LYS A 66 -3.887 -5.366 6.209 1.00 10.00 H new ATOM 0 HG2 LYS A 66 -5.032 -7.522 6.767 1.00 10.00 H new ATOM 0 HG3 LYS A 66 -4.777 -7.217 8.474 1.00 10.00 H new ATOM 0 HD2 LYS A 66 -6.127 -5.104 8.296 1.00 10.00 H new ATOM 0 HD3 LYS A 66 -6.385 -5.414 6.591 1.00 10.00 H new ATOM 0 HE2 LYS A 66 -7.474 -7.604 7.159 1.00 10.00 H new ATOM 0 HE3 LYS A 66 -7.226 -7.281 8.864 1.00 10.00 H new ATOM 0 HZ1 LYS A 66 -9.459 -6.721 8.183 1.00 10.00 H new ATOM 0 HZ2 LYS A 66 -8.633 -5.320 8.670 1.00 10.00 H new ATOM 0 HZ3 LYS A 66 -8.874 -5.633 7.018 1.00 10.00 H new ATOM 1018 N GLN A 67 -0.492 -5.107 7.492 1.00 10.00 N ATOM 1019 CA GLN A 67 0.656 -4.301 7.066 1.00 10.00 C ATOM 1020 C GLN A 67 1.776 -5.214 6.546 1.00 10.00 C ATOM 1021 O GLN A 67 2.405 -4.930 5.528 1.00 10.00 O ATOM 1022 CB GLN A 67 1.226 -3.417 8.201 1.00 10.00 C ATOM 1023 CG GLN A 67 0.256 -2.446 8.894 1.00 10.00 C ATOM 1024 CD GLN A 67 -0.468 -1.467 7.972 1.00 10.00 C ATOM 1025 OE1 GLN A 67 -0.015 -1.144 6.876 1.00 10.00 O ATOM 1026 NE2 GLN A 67 -1.600 -0.949 8.419 1.00 10.00 N ATOM 0 H GLN A 67 -0.646 -5.117 8.500 1.00 10.00 H new ATOM 0 HA GLN A 67 0.294 -3.642 6.277 1.00 10.00 H new ATOM 0 HB2 GLN A 67 1.646 -4.075 8.962 1.00 10.00 H new ATOM 0 HB3 GLN A 67 2.052 -2.834 7.792 1.00 10.00 H new ATOM 0 HG2 GLN A 67 -0.490 -3.029 9.433 1.00 10.00 H new ATOM 0 HG3 GLN A 67 0.812 -1.874 9.637 1.00 10.00 H new ATOM 0 HE21 GLN A 67 -1.963 -1.227 9.331 1.00 10.00 H new ATOM 0 HE22 GLN A 67 -2.110 -0.271 7.852 1.00 10.00 H new ATOM 1035 N GLY A 68 2.046 -6.298 7.272 1.00 10.00 N ATOM 1036 CA GLY A 68 3.196 -7.169 7.086 1.00 10.00 C ATOM 1037 C GLY A 68 4.100 -7.060 8.310 1.00 10.00 C ATOM 1038 O GLY A 68 5.293 -6.795 8.171 1.00 10.00 O ATOM 0 H GLY A 68 1.442 -6.602 8.036 1.00 10.00 H new ATOM 0 HA2 GLY A 68 2.870 -8.200 6.949 1.00 10.00 H new ATOM 0 HA3 GLY A 68 3.743 -6.885 6.187 1.00 10.00 H new ATOM 1042 N CYS A 69 3.527 -7.146 9.511 1.00 10.00 N ATOM 1043 CA CYS A 69 4.200 -7.045 10.795 1.00 10.00 C ATOM 1044 C CYS A 69 3.485 -7.960 11.797 1.00 10.00 C ATOM 1045 O CYS A 69 2.379 -8.432 11.534 1.00 10.00 O ATOM 1046 CB CYS A 69 4.149 -5.585 11.277 1.00 10.00 C ATOM 1047 SG CYS A 69 5.260 -4.523 10.308 1.00 10.00 S ATOM 0 H CYS A 69 2.523 -7.297 9.613 1.00 10.00 H new ATOM 0 HA CYS A 69 5.242 -7.351 10.705 1.00 10.00 H new ATOM 0 HB2 CYS A 69 3.128 -5.211 11.200 1.00 10.00 H new ATOM 0 HB3 CYS A 69 4.427 -5.539 12.330 1.00 10.00 H new ATOM 0 HG CYS A 69 5.598 -5.134 9.211 1.00 10.00 H new ATOM 1053 N ASP A 70 4.076 -8.167 12.968 1.00 10.00 N ATOM 1054 CA ASP A 70 3.526 -8.941 14.090 1.00 10.00 C ATOM 1055 C ASP A 70 3.878 -8.212 15.390 1.00 10.00 C ATOM 1056 O ASP A 70 4.716 -7.308 15.354 1.00 10.00 O ATOM 1057 CB ASP A 70 4.101 -10.366 14.077 1.00 10.00 C ATOM 1058 CG ASP A 70 3.544 -11.258 15.195 1.00 10.00 C ATOM 1059 OD1 ASP A 70 2.354 -11.063 15.549 1.00 10.00 O ATOM 1060 OD2 ASP A 70 4.312 -12.126 15.665 1.00 10.00 O ATOM 0 H ASP A 70 4.998 -7.783 13.178 1.00 10.00 H new ATOM 0 HA ASP A 70 2.443 -9.024 14.005 1.00 10.00 H new ATOM 0 HB2 ASP A 70 3.887 -10.828 13.113 1.00 10.00 H new ATOM 0 HB3 ASP A 70 5.186 -10.313 14.171 1.00 10.00 H new ATOM 1065 N CYS A 71 3.242 -8.543 16.517 1.00 10.00 N ATOM 1066 CA CYS A 71 3.312 -7.773 17.755 1.00 10.00 C ATOM 1067 C CYS A 71 3.737 -8.621 18.959 1.00 10.00 C ATOM 1068 O CYS A 71 3.657 -9.844 18.942 1.00 10.00 O ATOM 1069 CB CYS A 71 1.942 -7.137 18.029 1.00 10.00 C ATOM 1070 SG CYS A 71 1.501 -5.945 16.734 1.00 10.00 S ATOM 0 H CYS A 71 2.652 -9.372 16.592 1.00 10.00 H new ATOM 0 HA CYS A 71 4.075 -7.006 17.622 1.00 10.00 H new ATOM 0 HB2 CYS A 71 1.181 -7.916 18.085 1.00 10.00 H new ATOM 0 HB3 CYS A 71 1.957 -6.637 18.997 1.00 10.00 H new ATOM 0 HG CYS A 71 1.335 -4.770 17.264 1.00 10.00 H new ATOM 1076 N GLU A 72 4.121 -7.934 20.034 1.00 10.00 N ATOM 1077 CA GLU A 72 4.478 -8.467 21.341 1.00 10.00 C ATOM 1078 C GLU A 72 4.081 -7.379 22.345 1.00 10.00 C ATOM 1079 O GLU A 72 4.618 -6.273 22.292 1.00 10.00 O ATOM 1080 CB GLU A 72 5.993 -8.773 21.356 1.00 10.00 C ATOM 1081 CG GLU A 72 6.575 -9.038 22.754 1.00 10.00 C ATOM 1082 CD GLU A 72 8.084 -9.353 22.704 1.00 10.00 C ATOM 1083 OE1 GLU A 72 8.890 -8.385 22.794 1.00 10.00 O ATOM 1084 OE2 GLU A 72 8.429 -10.553 22.625 1.00 10.00 O ATOM 0 H GLU A 72 4.195 -6.917 20.009 1.00 10.00 H new ATOM 0 HA GLU A 72 3.972 -9.400 21.589 1.00 10.00 H new ATOM 0 HB2 GLU A 72 6.182 -9.643 20.727 1.00 10.00 H new ATOM 0 HB3 GLU A 72 6.525 -7.934 20.908 1.00 10.00 H new ATOM 0 HG2 GLU A 72 6.408 -8.167 23.387 1.00 10.00 H new ATOM 0 HG3 GLU A 72 6.046 -9.872 23.214 1.00 10.00 H new ATOM 1091 N CYS A 73 3.086 -7.612 23.205 1.00 10.00 N ATOM 1092 CA CYS A 73 2.724 -6.635 24.229 1.00 10.00 C ATOM 1093 C CYS A 73 3.872 -6.503 25.239 1.00 10.00 C ATOM 1094 O CYS A 73 4.434 -7.514 25.661 1.00 10.00 O ATOM 1095 CB CYS A 73 1.425 -7.053 24.928 1.00 10.00 C ATOM 1096 SG CYS A 73 0.835 -5.646 25.902 1.00 10.00 S ATOM 0 H CYS A 73 2.522 -8.462 23.211 1.00 10.00 H new ATOM 0 HA CYS A 73 2.556 -5.665 23.761 1.00 10.00 H new ATOM 0 HB2 CYS A 73 0.676 -7.349 24.194 1.00 10.00 H new ATOM 0 HB3 CYS A 73 1.599 -7.915 25.571 1.00 10.00 H new ATOM 0 HG CYS A 73 -0.164 -6.021 26.644 1.00 10.00 H new ATOM 1102 N LEU A 74 4.148 -5.271 25.683 1.00 10.00 N ATOM 1103 CA LEU A 74 5.119 -4.990 26.739 1.00 10.00 C ATOM 1104 C LEU A 74 4.423 -4.564 28.032 1.00 10.00 C ATOM 1105 O LEU A 74 5.072 -4.502 29.071 1.00 10.00 O ATOM 1106 CB LEU A 74 6.112 -3.899 26.294 1.00 10.00 C ATOM 1107 CG LEU A 74 6.855 -4.173 24.971 1.00 10.00 C ATOM 1108 CD1 LEU A 74 7.890 -3.065 24.734 1.00 10.00 C ATOM 1109 CD2 LEU A 74 7.570 -5.527 24.958 1.00 10.00 C ATOM 0 H LEU A 74 3.697 -4.434 25.313 1.00 10.00 H new ATOM 0 HA LEU A 74 5.670 -5.911 26.931 1.00 10.00 H new ATOM 0 HB2 LEU A 74 5.571 -2.958 26.198 1.00 10.00 H new ATOM 0 HB3 LEU A 74 6.851 -3.762 27.083 1.00 10.00 H new ATOM 0 HG LEU A 74 6.105 -4.191 24.180 1.00 10.00 H new ATOM 0 HD11 LEU A 74 8.418 -3.254 23.799 1.00 10.00 H new ATOM 0 HD12 LEU A 74 7.384 -2.101 24.676 1.00 10.00 H new ATOM 0 HD13 LEU A 74 8.604 -3.052 25.558 1.00 10.00 H new ATOM 0 HD21 LEU A 74 8.075 -5.663 24.001 1.00 10.00 H new ATOM 0 HD22 LEU A 74 8.304 -5.559 25.763 1.00 10.00 H new ATOM 0 HD23 LEU A 74 6.841 -6.325 25.100 1.00 10.00 H new ATOM 1121 N GLY A 75 3.129 -4.236 27.988 1.00 10.00 N ATOM 1122 CA GLY A 75 2.326 -3.828 29.134 1.00 10.00 C ATOM 1123 C GLY A 75 1.317 -2.759 28.728 1.00 10.00 C ATOM 1124 O GLY A 75 1.217 -2.403 27.554 1.00 10.00 O ATOM 0 H GLY A 75 2.596 -4.249 27.119 1.00 10.00 H new ATOM 0 HA2 GLY A 75 1.803 -4.692 29.545 1.00 10.00 H new ATOM 0 HA3 GLY A 75 2.975 -3.444 29.921 1.00 10.00 H new ATOM 1128 N GLY A 76 0.586 -2.197 29.689 1.00 10.00 N ATOM 1129 CA GLY A 76 -0.316 -1.084 29.430 1.00 10.00 C ATOM 1130 C GLY A 76 -0.550 -0.251 30.685 1.00 10.00 C ATOM 1131 O GLY A 76 0.017 -0.516 31.747 1.00 10.00 O ATOM 0 H GLY A 76 0.604 -2.500 30.663 1.00 10.00 H new ATOM 0 HA2 GLY A 76 0.100 -0.452 28.645 1.00 10.00 H new ATOM 0 HA3 GLY A 76 -1.269 -1.464 29.062 1.00 10.00 H new ATOM 1135 N GLY A 77 -1.422 0.740 30.559 1.00 10.00 N ATOM 1136 CA GLY A 77 -1.698 1.724 31.585 1.00 10.00 C ATOM 1137 C GLY A 77 -2.881 2.576 31.153 1.00 10.00 C ATOM 1138 O GLY A 77 -3.755 2.121 30.403 1.00 10.00 O ATOM 0 H GLY A 77 -1.972 0.882 29.711 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -1.917 1.229 32.531 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -0.822 2.352 31.749 1.00 10.00 H new ATOM 1142 N ARG A 78 -2.945 3.798 31.669 1.00 10.00 N ATOM 1143 CA ARG A 78 -3.998 4.784 31.437 1.00 10.00 C ATOM 1144 C ARG A 78 -3.334 6.155 31.286 1.00 10.00 C ATOM 1145 O ARG A 78 -2.173 6.325 31.650 1.00 10.00 O ATOM 1146 CB ARG A 78 -4.982 4.744 32.624 1.00 10.00 C ATOM 1147 CG ARG A 78 -6.054 3.652 32.457 1.00 10.00 C ATOM 1148 CD ARG A 78 -6.652 3.195 33.795 1.00 10.00 C ATOM 1149 NE ARG A 78 -5.873 2.090 34.399 1.00 10.00 N ATOM 1150 CZ ARG A 78 -5.495 1.981 35.684 1.00 10.00 C ATOM 1151 NH1 ARG A 78 -5.687 2.977 36.539 1.00 10.00 N ATOM 1152 NH2 ARG A 78 -4.936 0.855 36.102 1.00 10.00 N ATOM 0 H ARG A 78 -2.222 4.149 32.297 1.00 10.00 H new ATOM 0 HA ARG A 78 -4.563 4.571 30.529 1.00 10.00 H new ATOM 0 HB2 ARG A 78 -4.428 4.569 33.546 1.00 10.00 H new ATOM 0 HB3 ARG A 78 -5.468 5.715 32.723 1.00 10.00 H new ATOM 0 HG2 ARG A 78 -6.852 4.028 31.817 1.00 10.00 H new ATOM 0 HG3 ARG A 78 -5.615 2.794 31.948 1.00 10.00 H new ATOM 0 HD2 ARG A 78 -6.682 4.038 34.486 1.00 10.00 H new ATOM 0 HD3 ARG A 78 -7.681 2.872 33.641 1.00 10.00 H new ATOM 0 HE ARG A 78 -5.594 1.333 33.775 1.00 10.00 H new ATOM 0 HH11 ARG A 78 -6.127 3.842 36.224 1.00 10.00 H new ATOM 0 HH12 ARG A 78 -5.394 2.878 37.511 1.00 10.00 H new ATOM 0 HH21 ARG A 78 -4.797 0.082 35.451 1.00 10.00 H new ATOM 0 HH22 ARG A 78 -4.645 0.761 37.075 1.00 10.00 H new ATOM 1166 N ILE A 79 -4.063 7.128 30.744 1.00 10.00 N ATOM 1167 CA ILE A 79 -3.548 8.446 30.373 1.00 10.00 C ATOM 1168 C ILE A 79 -4.490 9.474 31.004 1.00 10.00 C ATOM 1169 O ILE A 79 -5.657 9.172 31.269 1.00 10.00 O ATOM 1170 CB ILE A 79 -3.417 8.545 28.826 1.00 10.00 C ATOM 1171 CG1 ILE A 79 -2.393 7.486 28.340 1.00 10.00 C ATOM 1172 CG2 ILE A 79 -3.014 9.952 28.348 1.00 10.00 C ATOM 1173 CD1 ILE A 79 -1.965 7.550 26.870 1.00 10.00 C ATOM 0 H ILE A 79 -5.057 7.019 30.545 1.00 10.00 H new ATOM 0 HA ILE A 79 -2.542 8.635 30.747 1.00 10.00 H new ATOM 0 HB ILE A 79 -4.398 8.349 28.392 1.00 10.00 H new ATOM 0 HG12 ILE A 79 -1.498 7.573 28.957 1.00 10.00 H new ATOM 0 HG13 ILE A 79 -2.814 6.498 28.527 1.00 10.00 H new ATOM 0 HG21 ILE A 79 -2.938 9.959 27.261 1.00 10.00 H new ATOM 0 HG22 ILE A 79 -3.768 10.673 28.664 1.00 10.00 H new ATOM 0 HG23 ILE A 79 -2.050 10.221 28.780 1.00 10.00 H new ATOM 0 HD11 ILE A 79 -1.248 6.755 26.665 1.00 10.00 H new ATOM 0 HD12 ILE A 79 -2.839 7.425 26.231 1.00 10.00 H new ATOM 0 HD13 ILE A 79 -1.503 8.516 26.667 1.00 10.00 H new ATOM 1185 N SER A 80 -3.971 10.651 31.331 1.00 10.00 N ATOM 1186 CA SER A 80 -4.669 11.706 32.046 1.00 10.00 C ATOM 1187 C SER A 80 -3.959 13.042 31.776 1.00 10.00 C ATOM 1188 O SER A 80 -3.069 13.127 30.930 1.00 10.00 O ATOM 1189 CB SER A 80 -4.717 11.331 33.541 1.00 10.00 C ATOM 1190 OG SER A 80 -3.445 10.965 34.061 1.00 10.00 O ATOM 0 H SER A 80 -3.012 10.905 31.094 1.00 10.00 H new ATOM 0 HA SER A 80 -5.698 11.819 31.705 1.00 10.00 H new ATOM 0 HB2 SER A 80 -5.107 12.175 34.110 1.00 10.00 H new ATOM 0 HB3 SER A 80 -5.413 10.504 33.681 1.00 10.00 H new ATOM 0 HG SER A 80 -3.446 10.011 34.286 1.00 10.00 H new ATOM 1196 N HIS A 81 -4.325 14.091 32.512 1.00 10.00 N ATOM 1197 CA HIS A 81 -3.618 15.366 32.538 1.00 10.00 C ATOM 1198 C HIS A 81 -3.448 15.755 34.005 1.00 10.00 C ATOM 1199 O HIS A 81 -4.256 15.342 34.843 1.00 10.00 O ATOM 1200 CB HIS A 81 -4.397 16.452 31.779 1.00 10.00 C ATOM 1201 CG HIS A 81 -4.382 16.302 30.279 1.00 10.00 C ATOM 1202 ND1 HIS A 81 -3.691 17.097 29.391 1.00 10.00 N ATOM 1203 CD2 HIS A 81 -5.095 15.398 29.539 1.00 10.00 C ATOM 1204 CE1 HIS A 81 -3.977 16.677 28.149 1.00 10.00 C ATOM 1205 NE2 HIS A 81 -4.834 15.648 28.193 1.00 10.00 N ATOM 0 H HIS A 81 -5.143 14.075 33.121 1.00 10.00 H new ATOM 0 HA HIS A 81 -2.651 15.271 32.045 1.00 10.00 H new ATOM 0 HB2 HIS A 81 -5.432 16.445 32.121 1.00 10.00 H new ATOM 0 HB3 HIS A 81 -3.982 17.426 32.038 1.00 10.00 H new ATOM 0 HD1 HIS A 81 -3.071 17.869 29.635 1.00 10.00 H new ATOM 0 HD2 HIS A 81 -5.744 14.628 29.929 1.00 10.00 H new ATOM 0 HE1 HIS A 81 -3.574 17.107 27.244 1.00 10.00 H new ATOM 1213 N GLN A 82 -2.401 16.515 34.330 1.00 10.00 N ATOM 1214 CA GLN A 82 -2.053 16.891 35.699 1.00 10.00 C ATOM 1215 C GLN A 82 -1.486 18.311 35.731 1.00 10.00 C ATOM 1216 O GLN A 82 -1.056 18.839 34.704 1.00 10.00 O ATOM 1217 CB GLN A 82 -1.037 15.880 36.280 1.00 10.00 C ATOM 1218 CG GLN A 82 -1.610 14.495 36.635 1.00 10.00 C ATOM 1219 CD GLN A 82 -2.581 14.533 37.815 1.00 10.00 C ATOM 1220 OE1 GLN A 82 -2.177 14.450 38.964 1.00 10.00 O ATOM 1221 NE2 GLN A 82 -3.870 14.696 37.568 1.00 10.00 N ATOM 0 H GLN A 82 -1.759 16.894 33.634 1.00 10.00 H new ATOM 0 HA GLN A 82 -2.953 16.871 36.314 1.00 10.00 H new ATOM 0 HB2 GLN A 82 -0.231 15.746 35.559 1.00 10.00 H new ATOM 0 HB3 GLN A 82 -0.594 16.312 37.177 1.00 10.00 H new ATOM 0 HG2 GLN A 82 -2.122 14.086 35.764 1.00 10.00 H new ATOM 0 HG3 GLN A 82 -0.789 13.818 36.869 1.00 10.00 H new ATOM 0 HE21 GLN A 82 -4.200 14.765 36.605 1.00 10.00 H new ATOM 0 HE22 GLN A 82 -4.534 14.753 38.340 1.00 10.00 H new ATOM 1230 N SER A 83 -1.443 18.880 36.941 1.00 10.00 N ATOM 1231 CA SER A 83 -1.005 20.239 37.256 1.00 10.00 C ATOM 1232 C SER A 83 -1.921 21.314 36.644 1.00 10.00 C ATOM 1233 O SER A 83 -2.761 21.021 35.795 1.00 10.00 O ATOM 1234 CB SER A 83 0.473 20.408 36.864 1.00 10.00 C ATOM 1235 OG SER A 83 1.278 19.383 37.440 1.00 10.00 O ATOM 0 H SER A 83 -1.731 18.370 37.776 1.00 10.00 H new ATOM 0 HA SER A 83 -1.087 20.389 38.332 1.00 10.00 H new ATOM 0 HB2 SER A 83 0.569 20.383 35.779 1.00 10.00 H new ATOM 0 HB3 SER A 83 0.830 21.384 37.194 1.00 10.00 H new ATOM 0 HG SER A 83 2.210 19.503 37.161 1.00 10.00 H new ATOM 1241 N GLN A 84 -1.775 22.567 37.095 1.00 10.00 N ATOM 1242 CA GLN A 84 -2.557 23.691 36.572 1.00 10.00 C ATOM 1243 C GLN A 84 -2.283 23.919 35.077 1.00 10.00 C ATOM 1244 O GLN A 84 -3.167 24.389 34.365 1.00 10.00 O ATOM 1245 CB GLN A 84 -2.260 24.967 37.380 1.00 10.00 C ATOM 1246 CG GLN A 84 -2.709 24.862 38.847 1.00 10.00 C ATOM 1247 CD GLN A 84 -2.465 26.169 39.601 1.00 10.00 C ATOM 1248 OE1 GLN A 84 -1.368 26.419 40.081 1.00 10.00 O ATOM 1249 NE2 GLN A 84 -3.469 27.026 39.712 1.00 10.00 N ATOM 0 H GLN A 84 -1.115 22.827 37.828 1.00 10.00 H new ATOM 0 HA GLN A 84 -3.614 23.445 36.678 1.00 10.00 H new ATOM 0 HB2 GLN A 84 -1.190 25.172 37.346 1.00 10.00 H new ATOM 0 HB3 GLN A 84 -2.762 25.813 36.911 1.00 10.00 H new ATOM 0 HG2 GLN A 84 -3.769 24.610 38.887 1.00 10.00 H new ATOM 0 HG3 GLN A 84 -2.169 24.052 39.337 1.00 10.00 H new ATOM 0 HE21 GLN A 84 -4.378 26.802 39.306 1.00 10.00 H new ATOM 0 HE22 GLN A 84 -3.333 27.909 40.203 1.00 10.00 H new ATOM 1258 N ASP A 85 -1.083 23.559 34.608 1.00 10.00 N ATOM 1259 CA ASP A 85 -0.692 23.621 33.194 1.00 10.00 C ATOM 1260 C ASP A 85 -1.391 22.541 32.347 1.00 10.00 C ATOM 1261 O ASP A 85 -1.292 22.536 31.126 1.00 10.00 O ATOM 1262 CB ASP A 85 0.833 23.484 33.086 1.00 10.00 C ATOM 1263 CG ASP A 85 1.354 23.757 31.667 1.00 10.00 C ATOM 1264 OD1 ASP A 85 1.133 24.893 31.187 1.00 10.00 O ATOM 1265 OD2 ASP A 85 2.038 22.855 31.129 1.00 10.00 O ATOM 0 H ASP A 85 -0.340 23.209 35.213 1.00 10.00 H new ATOM 0 HA ASP A 85 -1.009 24.585 32.797 1.00 10.00 H new ATOM 0 HB2 ASP A 85 1.306 24.177 33.782 1.00 10.00 H new ATOM 0 HB3 ASP A 85 1.126 22.479 33.389 1.00 10.00 H new ATOM 1270 N LYS A 86 -2.141 21.620 32.977 1.00 10.00 N ATOM 1271 CA LYS A 86 -2.767 20.442 32.368 1.00 10.00 C ATOM 1272 C LYS A 86 -1.834 19.734 31.377 1.00 10.00 C ATOM 1273 O LYS A 86 -2.251 19.341 30.282 1.00 10.00 O ATOM 1274 CB LYS A 86 -4.194 20.735 31.856 1.00 10.00 C ATOM 1275 CG LYS A 86 -4.311 21.811 30.762 1.00 10.00 C ATOM 1276 CD LYS A 86 -5.759 21.935 30.265 1.00 10.00 C ATOM 1277 CE LYS A 86 -5.856 23.025 29.189 1.00 10.00 C ATOM 1278 NZ LYS A 86 -7.240 23.193 28.678 1.00 10.00 N ATOM 0 H LYS A 86 -2.335 21.684 33.976 1.00 10.00 H new ATOM 0 HA LYS A 86 -2.922 19.701 33.152 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -4.618 19.807 31.472 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -4.807 21.039 32.704 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -3.974 22.771 31.153 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -3.657 21.559 29.928 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -6.095 20.981 29.859 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -6.418 22.176 31.099 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -5.506 23.971 29.602 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -5.193 22.774 28.361 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -7.255 23.940 27.954 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -7.567 22.299 28.260 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -7.870 23.459 29.462 1.00 10.00 H new ATOM 1292 N LYS A 87 -0.574 19.525 31.781 1.00 10.00 N ATOM 1293 CA LYS A 87 0.369 18.717 31.011 1.00 10.00 C ATOM 1294 C LYS A 87 -0.158 17.294 30.903 1.00 10.00 C ATOM 1295 O LYS A 87 -0.934 16.870 31.765 1.00 10.00 O ATOM 1296 CB LYS A 87 1.803 18.830 31.564 1.00 10.00 C ATOM 1297 CG LYS A 87 2.039 18.692 33.079 1.00 10.00 C ATOM 1298 CD LYS A 87 1.753 17.296 33.651 1.00 10.00 C ATOM 1299 CE LYS A 87 2.219 17.172 35.109 1.00 10.00 C ATOM 1300 NZ LYS A 87 3.693 17.109 35.242 1.00 10.00 N ATOM 0 H LYS A 87 -0.186 19.909 32.643 1.00 10.00 H new ATOM 0 HA LYS A 87 0.445 19.103 29.994 1.00 10.00 H new ATOM 0 HB2 LYS A 87 2.406 18.070 31.068 1.00 10.00 H new ATOM 0 HB3 LYS A 87 2.197 19.799 31.258 1.00 10.00 H new ATOM 0 HG2 LYS A 87 3.075 18.953 33.296 1.00 10.00 H new ATOM 0 HG3 LYS A 87 1.412 19.417 33.598 1.00 10.00 H new ATOM 0 HD2 LYS A 87 0.684 17.091 33.592 1.00 10.00 H new ATOM 0 HD3 LYS A 87 2.256 16.544 33.043 1.00 10.00 H new ATOM 0 HE2 LYS A 87 1.844 18.023 35.678 1.00 10.00 H new ATOM 0 HE3 LYS A 87 1.781 16.276 35.550 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 3.947 17.009 36.246 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 4.055 16.292 34.710 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 4.113 17.982 34.864 1.00 10.00 H new ATOM 1314 N ILE A 88 0.255 16.561 29.871 1.00 10.00 N ATOM 1315 CA ILE A 88 -0.180 15.180 29.674 1.00 10.00 C ATOM 1316 C ILE A 88 0.474 14.353 30.785 1.00 10.00 C ATOM 1317 O ILE A 88 1.615 14.610 31.194 1.00 10.00 O ATOM 1318 CB ILE A 88 0.188 14.684 28.251 1.00 10.00 C ATOM 1319 CG1 ILE A 88 -0.468 15.579 27.170 1.00 10.00 C ATOM 1320 CG2 ILE A 88 -0.234 13.213 28.042 1.00 10.00 C ATOM 1321 CD1 ILE A 88 -0.044 15.260 25.730 1.00 10.00 C ATOM 0 H ILE A 88 0.895 16.903 29.154 1.00 10.00 H new ATOM 0 HA ILE A 88 -1.264 15.084 29.738 1.00 10.00 H new ATOM 0 HB ILE A 88 1.272 14.748 28.153 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -1.551 15.482 27.245 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -0.226 16.620 27.384 1.00 10.00 H new ATOM 0 HG21 ILE A 88 0.038 12.896 27.035 1.00 10.00 H new ATOM 0 HG22 ILE A 88 0.274 12.582 28.771 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.312 13.122 28.172 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -0.553 15.936 25.043 1.00 10.00 H new ATOM 0 HD12 ILE A 88 1.034 15.387 25.632 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.312 14.231 25.491 1.00 10.00 H new ATOM 1333 N HIS A 89 -0.234 13.343 31.278 1.00 10.00 N ATOM 1334 CA HIS A 89 0.264 12.437 32.290 1.00 10.00 C ATOM 1335 C HIS A 89 -0.132 11.008 31.929 1.00 10.00 C ATOM 1336 O HIS A 89 -1.099 10.788 31.204 1.00 10.00 O ATOM 1337 CB HIS A 89 -0.264 12.871 33.661 1.00 10.00 C ATOM 1338 CG HIS A 89 0.535 12.267 34.780 1.00 10.00 C ATOM 1339 ND1 HIS A 89 0.242 11.120 35.476 1.00 10.00 N ATOM 1340 CD2 HIS A 89 1.741 12.719 35.238 1.00 10.00 C ATOM 1341 CE1 HIS A 89 1.254 10.880 36.324 1.00 10.00 C ATOM 1342 NE2 HIS A 89 2.197 11.831 36.213 1.00 10.00 N ATOM 0 H HIS A 89 -1.185 13.133 30.976 1.00 10.00 H new ATOM 0 HA HIS A 89 1.353 12.468 32.337 1.00 10.00 H new ATOM 0 HB2 HIS A 89 -0.232 13.958 33.736 1.00 10.00 H new ATOM 0 HB3 HIS A 89 -1.309 12.576 33.759 1.00 10.00 H new ATOM 0 HD2 HIS A 89 2.252 13.609 34.903 1.00 10.00 H new ATOM 0 HE1 HIS A 89 1.304 10.040 37.001 1.00 10.00 H new ATOM 0 HE2 HIS A 89 3.070 11.892 36.736 1.00 10.00 H new ATOM 1350 N VAL A 90 0.594 10.022 32.441 1.00 10.00 N ATOM 1351 CA VAL A 90 0.383 8.602 32.174 1.00 10.00 C ATOM 1352 C VAL A 90 0.560 7.881 33.512 1.00 10.00 C ATOM 1353 O VAL A 90 1.393 8.272 34.332 1.00 10.00 O ATOM 1354 CB VAL A 90 1.366 8.114 31.083 1.00 10.00 C ATOM 1355 CG1 VAL A 90 1.117 6.651 30.704 1.00 10.00 C ATOM 1356 CG2 VAL A 90 1.293 8.955 29.793 1.00 10.00 C ATOM 0 H VAL A 90 1.374 10.194 33.076 1.00 10.00 H new ATOM 0 HA VAL A 90 -0.613 8.395 31.782 1.00 10.00 H new ATOM 0 HB VAL A 90 2.355 8.224 31.527 1.00 10.00 H new ATOM 0 HG11 VAL A 90 1.828 6.348 29.935 1.00 10.00 H new ATOM 0 HG12 VAL A 90 1.244 6.021 31.584 1.00 10.00 H new ATOM 0 HG13 VAL A 90 0.102 6.542 30.322 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.004 8.566 29.064 1.00 10.00 H new ATOM 0 HG22 VAL A 90 0.285 8.902 29.381 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.538 9.993 30.021 1.00 10.00 H new ATOM 1366 N TYR A 91 -0.261 6.878 33.803 1.00 10.00 N ATOM 1367 CA TYR A 91 -0.297 6.251 35.120 1.00 10.00 C ATOM 1368 C TYR A 91 -0.922 4.857 35.021 1.00 10.00 C ATOM 1369 O TYR A 91 -1.320 4.417 33.938 1.00 10.00 O ATOM 1370 CB TYR A 91 -1.077 7.164 36.093 1.00 10.00 C ATOM 1371 CG TYR A 91 -2.592 7.097 35.974 1.00 10.00 C ATOM 1372 CD1 TYR A 91 -3.267 7.694 34.890 1.00 10.00 C ATOM 1373 CD2 TYR A 91 -3.328 6.403 36.952 1.00 10.00 C ATOM 1374 CE1 TYR A 91 -4.665 7.596 34.784 1.00 10.00 C ATOM 1375 CE2 TYR A 91 -4.723 6.296 36.855 1.00 10.00 C ATOM 1376 CZ TYR A 91 -5.396 6.891 35.768 1.00 10.00 C ATOM 1377 OH TYR A 91 -6.743 6.751 35.672 1.00 10.00 O ATOM 0 H TYR A 91 -0.919 6.477 33.135 1.00 10.00 H new ATOM 0 HA TYR A 91 0.715 6.126 35.505 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -0.797 6.903 37.114 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -0.761 8.195 35.930 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -2.707 8.229 34.137 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -2.814 5.948 37.786 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -5.179 8.058 33.954 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -5.280 5.760 37.610 1.00 10.00 H new ATOM 0 HH TYR A 91 -7.074 6.236 36.437 1.00 10.00 H new ATOM 1387 N GLY A 92 -1.115 4.206 36.168 1.00 10.00 N ATOM 1388 CA GLY A 92 -1.884 2.982 36.248 1.00 10.00 C ATOM 1389 C GLY A 92 -1.080 1.781 35.767 1.00 10.00 C ATOM 1390 O GLY A 92 0.139 1.835 35.616 1.00 10.00 O ATOM 0 H GLY A 92 -0.739 4.519 37.063 1.00 10.00 H new ATOM 0 HA2 GLY A 92 -2.202 2.818 37.278 1.00 10.00 H new ATOM 0 HA3 GLY A 92 -2.788 3.080 35.647 1.00 10.00 H new ATOM 1394 N TYR A 93 -1.783 0.676 35.532 1.00 10.00 N ATOM 1395 CA TYR A 93 -1.230 -0.551 34.977 1.00 10.00 C ATOM 1396 C TYR A 93 -2.315 -1.239 34.153 1.00 10.00 C ATOM 1397 O TYR A 93 -3.505 -0.927 34.304 1.00 10.00 O ATOM 1398 CB TYR A 93 -0.706 -1.473 36.096 1.00 10.00 C ATOM 1399 CG TYR A 93 -1.717 -2.407 36.750 1.00 10.00 C ATOM 1400 CD1 TYR A 93 -2.865 -1.895 37.383 1.00 10.00 C ATOM 1401 CD2 TYR A 93 -1.516 -3.802 36.717 1.00 10.00 C ATOM 1402 CE1 TYR A 93 -3.811 -2.761 37.962 1.00 10.00 C ATOM 1403 CE2 TYR A 93 -2.454 -4.676 37.293 1.00 10.00 C ATOM 1404 CZ TYR A 93 -3.610 -4.157 37.922 1.00 10.00 C ATOM 1405 OH TYR A 93 -4.538 -4.991 38.468 1.00 10.00 O ATOM 0 H TYR A 93 -2.782 0.610 35.729 1.00 10.00 H new ATOM 0 HA TYR A 93 -0.380 -0.318 34.335 1.00 10.00 H new ATOM 0 HB2 TYR A 93 0.101 -2.080 35.685 1.00 10.00 H new ATOM 0 HB3 TYR A 93 -0.269 -0.847 36.874 1.00 10.00 H new ATOM 0 HD1 TYR A 93 -3.021 -0.827 37.425 1.00 10.00 H new ATOM 0 HD2 TYR A 93 -0.632 -4.203 36.244 1.00 10.00 H new ATOM 0 HE1 TYR A 93 -4.692 -2.357 38.438 1.00 10.00 H new ATOM 0 HE2 TYR A 93 -2.292 -5.743 37.255 1.00 10.00 H new ATOM 0 HH TYR A 93 -4.249 -5.921 38.356 1.00 10.00 H new ATOM 1415 N SER A 94 -1.933 -2.160 33.271 1.00 10.00 N ATOM 1416 CA SER A 94 -2.878 -3.029 32.599 1.00 10.00 C ATOM 1417 C SER A 94 -3.194 -4.201 33.512 1.00 10.00 C ATOM 1418 O SER A 94 -2.294 -4.944 33.892 1.00 10.00 O ATOM 1419 CB SER A 94 -2.307 -3.517 31.265 1.00 10.00 C ATOM 1420 OG SER A 94 -3.178 -4.457 30.670 1.00 10.00 O ATOM 0 H SER A 94 -0.961 -2.319 33.007 1.00 10.00 H new ATOM 0 HA SER A 94 -3.794 -2.479 32.382 1.00 10.00 H new ATOM 0 HB2 SER A 94 -2.161 -2.671 30.593 1.00 10.00 H new ATOM 0 HB3 SER A 94 -1.328 -3.969 31.425 1.00 10.00 H new ATOM 0 HG SER A 94 -2.682 -4.997 30.020 1.00 10.00 H new ATOM 1426 N MET A 95 -4.484 -4.421 33.759 1.00 10.00 N ATOM 1427 CA MET A 95 -4.973 -5.620 34.420 1.00 10.00 C ATOM 1428 C MET A 95 -4.699 -6.865 33.560 1.00 10.00 C ATOM 1429 O MET A 95 -4.596 -7.959 34.104 1.00 10.00 O ATOM 1430 CB MET A 95 -6.482 -5.489 34.704 1.00 10.00 C ATOM 1431 CG MET A 95 -6.873 -4.243 35.518 1.00 10.00 C ATOM 1432 SD MET A 95 -6.959 -2.672 34.588 1.00 10.00 S ATOM 1433 CE MET A 95 -7.447 -1.573 35.950 1.00 10.00 C ATOM 0 H MET A 95 -5.221 -3.765 33.502 1.00 10.00 H new ATOM 0 HA MET A 95 -4.443 -5.734 35.366 1.00 10.00 H new ATOM 0 HB2 MET A 95 -7.017 -5.470 33.755 1.00 10.00 H new ATOM 0 HB3 MET A 95 -6.816 -6.377 35.240 1.00 10.00 H new ATOM 0 HG2 MET A 95 -7.845 -4.424 35.977 1.00 10.00 H new ATOM 0 HG3 MET A 95 -6.155 -4.123 36.329 1.00 10.00 H new ATOM 0 HE1 MET A 95 -7.551 -0.554 35.576 1.00 10.00 H new ATOM 0 HE2 MET A 95 -8.398 -1.907 36.364 1.00 10.00 H new ATOM 0 HE3 MET A 95 -6.684 -1.597 36.728 1.00 10.00 H new ATOM 1443 N ALA A 96 -4.612 -6.708 32.230 1.00 10.00 N ATOM 1444 CA ALA A 96 -4.395 -7.813 31.305 1.00 10.00 C ATOM 1445 C ALA A 96 -2.929 -8.261 31.260 1.00 10.00 C ATOM 1446 O ALA A 96 -2.682 -9.434 30.992 1.00 10.00 O ATOM 1447 CB ALA A 96 -4.854 -7.402 29.899 1.00 10.00 C ATOM 0 H ALA A 96 -4.692 -5.801 31.771 1.00 10.00 H new ATOM 0 HA ALA A 96 -4.981 -8.659 31.663 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -4.692 -8.228 29.207 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -5.914 -7.150 29.921 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -4.282 -6.535 29.569 1.00 10.00 H new ATOM 1453 N TYR A 97 -1.969 -7.354 31.491 1.00 10.00 N ATOM 1454 CA TYR A 97 -0.550 -7.632 31.261 1.00 10.00 C ATOM 1455 C TYR A 97 0.318 -7.259 32.461 1.00 10.00 C ATOM 1456 O TYR A 97 1.018 -8.104 33.012 1.00 10.00 O ATOM 1457 CB TYR A 97 -0.077 -6.856 30.021 1.00 10.00 C ATOM 1458 CG TYR A 97 -0.853 -7.137 28.751 1.00 10.00 C ATOM 1459 CD1 TYR A 97 -0.830 -8.427 28.190 1.00 10.00 C ATOM 1460 CD2 TYR A 97 -1.574 -6.105 28.117 1.00 10.00 C ATOM 1461 CE1 TYR A 97 -1.536 -8.698 27.008 1.00 10.00 C ATOM 1462 CE2 TYR A 97 -2.258 -6.359 26.915 1.00 10.00 C ATOM 1463 CZ TYR A 97 -2.257 -7.665 26.373 1.00 10.00 C ATOM 1464 OH TYR A 97 -2.938 -7.924 25.229 1.00 10.00 O ATOM 0 H TYR A 97 -2.156 -6.414 31.840 1.00 10.00 H new ATOM 0 HA TYR A 97 -0.443 -8.706 31.105 1.00 10.00 H new ATOM 0 HB2 TYR A 97 -0.136 -5.789 30.235 1.00 10.00 H new ATOM 0 HB3 TYR A 97 0.973 -7.088 29.845 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -0.266 -9.212 28.671 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -1.601 -5.118 28.555 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -1.527 -9.692 26.587 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -2.781 -5.561 26.409 1.00 10.00 H new ATOM 0 HH TYR A 97 -2.314 -7.942 24.474 1.00 10.00 H new ATOM 1474 N GLY A 98 0.286 -5.990 32.861 1.00 10.00 N ATOM 1475 CA GLY A 98 1.172 -5.394 33.845 1.00 10.00 C ATOM 1476 C GLY A 98 1.374 -3.917 33.500 1.00 10.00 C ATOM 1477 O GLY A 98 0.830 -3.444 32.494 1.00 10.00 O ATOM 0 H GLY A 98 -0.390 -5.323 32.488 1.00 10.00 H new ATOM 0 HA2 GLY A 98 0.747 -5.493 34.844 1.00 10.00 H new ATOM 0 HA3 GLY A 98 2.130 -5.914 33.853 1.00 10.00 H new ATOM 1481 N PRO A 99 2.103 -3.152 34.328 1.00 10.00 N ATOM 1482 CA PRO A 99 2.497 -1.788 33.994 1.00 10.00 C ATOM 1483 C PRO A 99 3.285 -1.762 32.683 1.00 10.00 C ATOM 1484 O PRO A 99 4.197 -2.572 32.505 1.00 10.00 O ATOM 1485 CB PRO A 99 3.363 -1.297 35.163 1.00 10.00 C ATOM 1486 CG PRO A 99 3.037 -2.252 36.310 1.00 10.00 C ATOM 1487 CD PRO A 99 2.672 -3.555 35.603 1.00 10.00 C ATOM 0 HA PRO A 99 1.628 -1.145 33.851 1.00 10.00 H new ATOM 0 HB2 PRO A 99 4.423 -1.327 34.911 1.00 10.00 H new ATOM 0 HB3 PRO A 99 3.127 -0.266 35.426 1.00 10.00 H new ATOM 0 HG2 PRO A 99 3.889 -2.383 36.976 1.00 10.00 H new ATOM 0 HG3 PRO A 99 2.212 -1.881 36.918 1.00 10.00 H new ATOM 0 HD2 PRO A 99 3.550 -4.185 35.461 1.00 10.00 H new ATOM 0 HD3 PRO A 99 1.957 -4.133 36.188 1.00 10.00 H new ATOM 1495 N ALA A 100 2.968 -0.828 31.784 1.00 10.00 N ATOM 1496 CA ALA A 100 3.830 -0.539 30.651 1.00 10.00 C ATOM 1497 C ALA A 100 5.136 0.071 31.164 1.00 10.00 C ATOM 1498 O ALA A 100 5.208 0.605 32.274 1.00 10.00 O ATOM 1499 CB ALA A 100 3.129 0.427 29.689 1.00 10.00 C ATOM 0 H ALA A 100 2.120 -0.263 31.824 1.00 10.00 H new ATOM 0 HA ALA A 100 4.049 -1.460 30.110 1.00 10.00 H new ATOM 0 HB1 ALA A 100 3.784 0.637 28.843 1.00 10.00 H new ATOM 0 HB2 ALA A 100 2.205 -0.025 29.329 1.00 10.00 H new ATOM 0 HB3 ALA A 100 2.899 1.357 30.210 1.00 10.00 H new ATOM 1505 N GLN A 101 6.159 0.079 30.309 1.00 10.00 N ATOM 1506 CA GLN A 101 7.375 0.840 30.534 1.00 10.00 C ATOM 1507 C GLN A 101 7.051 2.284 30.139 1.00 10.00 C ATOM 1508 O GLN A 101 7.497 2.762 29.098 1.00 10.00 O ATOM 1509 CB GLN A 101 8.552 0.224 29.754 1.00 10.00 C ATOM 1510 CG GLN A 101 8.915 -1.172 30.291 1.00 10.00 C ATOM 1511 CD GLN A 101 10.083 -1.798 29.525 1.00 10.00 C ATOM 1512 OE1 GLN A 101 11.192 -1.281 29.531 1.00 10.00 O ATOM 1513 NE2 GLN A 101 9.862 -2.906 28.828 1.00 10.00 N ATOM 0 H GLN A 101 6.161 -0.448 29.436 1.00 10.00 H new ATOM 0 HA GLN A 101 7.698 0.819 31.575 1.00 10.00 H new ATOM 0 HB2 GLN A 101 8.292 0.153 28.698 1.00 10.00 H new ATOM 0 HB3 GLN A 101 9.420 0.879 29.825 1.00 10.00 H new ATOM 0 HG2 GLN A 101 9.173 -1.098 31.347 1.00 10.00 H new ATOM 0 HG3 GLN A 101 8.045 -1.825 30.221 1.00 10.00 H new ATOM 0 HE21 GLN A 101 8.935 -3.332 28.827 1.00 10.00 H new ATOM 0 HE22 GLN A 101 10.619 -3.332 28.293 1.00 10.00 H new ATOM 1522 N HIS A 102 6.202 2.946 30.934 1.00 10.00 N ATOM 1523 CA HIS A 102 5.584 4.233 30.621 1.00 10.00 C ATOM 1524 C HIS A 102 6.587 5.300 30.176 1.00 10.00 C ATOM 1525 O HIS A 102 6.225 6.130 29.351 1.00 10.00 O ATOM 1526 CB HIS A 102 4.802 4.750 31.833 1.00 10.00 C ATOM 1527 CG HIS A 102 3.722 3.827 32.341 1.00 10.00 C ATOM 1528 ND1 HIS A 102 3.753 3.082 33.497 1.00 10.00 N ATOM 1529 CD2 HIS A 102 2.503 3.605 31.763 1.00 10.00 C ATOM 1530 CE1 HIS A 102 2.584 2.426 33.597 1.00 10.00 C ATOM 1531 NE2 HIS A 102 1.788 2.700 32.550 1.00 10.00 N ATOM 0 H HIS A 102 5.919 2.584 31.845 1.00 10.00 H new ATOM 0 HA HIS A 102 4.915 4.052 29.780 1.00 10.00 H new ATOM 0 HB2 HIS A 102 5.505 4.942 32.644 1.00 10.00 H new ATOM 0 HB3 HIS A 102 4.348 5.706 31.572 1.00 10.00 H new ATOM 0 HD1 HIS A 102 4.526 3.036 34.161 1.00 10.00 H new ATOM 0 HD2 HIS A 102 2.151 4.056 30.847 1.00 10.00 H new ATOM 0 HE1 HIS A 102 2.320 1.767 34.411 1.00 10.00 H new ATOM 1539 N ALA A 103 7.840 5.261 30.651 1.00 10.00 N ATOM 1540 CA ALA A 103 8.886 6.186 30.220 1.00 10.00 C ATOM 1541 C ALA A 103 9.101 6.157 28.700 1.00 10.00 C ATOM 1542 O ALA A 103 9.285 7.207 28.089 1.00 10.00 O ATOM 1543 CB ALA A 103 10.196 5.854 30.941 1.00 10.00 C ATOM 0 H ALA A 103 8.153 4.584 31.347 1.00 10.00 H new ATOM 0 HA ALA A 103 8.562 7.194 30.480 1.00 10.00 H new ATOM 0 HB1 ALA A 103 10.974 6.545 30.618 1.00 10.00 H new ATOM 0 HB2 ALA A 103 10.052 5.947 32.018 1.00 10.00 H new ATOM 0 HB3 ALA A 103 10.495 4.833 30.701 1.00 10.00 H new ATOM 1549 N ILE A 104 9.011 4.973 28.085 1.00 10.00 N ATOM 1550 CA ILE A 104 9.124 4.812 26.640 1.00 10.00 C ATOM 1551 C ILE A 104 7.939 5.549 26.010 1.00 10.00 C ATOM 1552 O ILE A 104 8.104 6.364 25.103 1.00 10.00 O ATOM 1553 CB ILE A 104 9.171 3.304 26.261 1.00 10.00 C ATOM 1554 CG1 ILE A 104 10.354 2.597 26.971 1.00 10.00 C ATOM 1555 CG2 ILE A 104 9.251 3.128 24.733 1.00 10.00 C ATOM 1556 CD1 ILE A 104 10.539 1.117 26.612 1.00 10.00 C ATOM 0 H ILE A 104 8.857 4.097 28.583 1.00 10.00 H new ATOM 0 HA ILE A 104 10.052 5.239 26.260 1.00 10.00 H new ATOM 0 HB ILE A 104 8.248 2.835 26.603 1.00 10.00 H new ATOM 0 HG12 ILE A 104 11.273 3.131 26.730 1.00 10.00 H new ATOM 0 HG13 ILE A 104 10.211 2.678 28.049 1.00 10.00 H new ATOM 0 HG21 ILE A 104 9.283 2.066 24.490 1.00 10.00 H new ATOM 0 HG22 ILE A 104 8.375 3.580 24.268 1.00 10.00 H new ATOM 0 HG23 ILE A 104 10.152 3.613 24.358 1.00 10.00 H new ATOM 0 HD11 ILE A 104 11.391 0.714 27.159 1.00 10.00 H new ATOM 0 HD12 ILE A 104 9.640 0.562 26.880 1.00 10.00 H new ATOM 0 HD13 ILE A 104 10.718 1.022 25.541 1.00 10.00 H new ATOM 1568 N SER A 105 6.725 5.279 26.496 1.00 10.00 N ATOM 1569 CA SER A 105 5.514 5.888 25.980 1.00 10.00 C ATOM 1570 C SER A 105 5.547 7.417 26.095 1.00 10.00 C ATOM 1571 O SER A 105 5.228 8.093 25.116 1.00 10.00 O ATOM 1572 CB SER A 105 4.301 5.297 26.708 1.00 10.00 C ATOM 1573 OG SER A 105 4.417 3.880 26.789 1.00 10.00 O ATOM 0 H SER A 105 6.562 4.627 27.263 1.00 10.00 H new ATOM 0 HA SER A 105 5.437 5.663 24.916 1.00 10.00 H new ATOM 0 HB2 SER A 105 4.227 5.721 27.710 1.00 10.00 H new ATOM 0 HB3 SER A 105 3.385 5.564 26.180 1.00 10.00 H new ATOM 0 HG SER A 105 3.736 3.530 27.401 1.00 10.00 H new ATOM 1579 N THR A 106 5.939 7.972 27.245 1.00 10.00 N ATOM 1580 CA THR A 106 5.922 9.411 27.432 1.00 10.00 C ATOM 1581 C THR A 106 6.894 10.094 26.478 1.00 10.00 C ATOM 1582 O THR A 106 6.537 11.131 25.925 1.00 10.00 O ATOM 1583 CB THR A 106 6.175 9.793 28.901 1.00 10.00 C ATOM 1584 OG1 THR A 106 7.309 9.168 29.464 1.00 10.00 O ATOM 1585 CG2 THR A 106 4.982 9.394 29.772 1.00 10.00 C ATOM 0 H THR A 106 6.269 7.443 28.052 1.00 10.00 H new ATOM 0 HA THR A 106 4.923 9.773 27.187 1.00 10.00 H new ATOM 0 HB THR A 106 6.335 10.871 28.886 1.00 10.00 H new ATOM 0 HG1 THR A 106 7.819 8.718 28.758 1.00 10.00 H new ATOM 0 HG21 THR A 106 5.179 9.672 30.808 1.00 10.00 H new ATOM 0 HG22 THR A 106 4.087 9.909 29.422 1.00 10.00 H new ATOM 0 HG23 THR A 106 4.829 8.317 29.708 1.00 10.00 H new ATOM 1593 N GLU A 107 8.084 9.532 26.243 1.00 10.00 N ATOM 1594 CA GLU A 107 9.039 10.118 25.309 1.00 10.00 C ATOM 1595 C GLU A 107 8.497 10.084 23.878 1.00 10.00 C ATOM 1596 O GLU A 107 8.633 11.068 23.154 1.00 10.00 O ATOM 1597 CB GLU A 107 10.391 9.392 25.369 1.00 10.00 C ATOM 1598 CG GLU A 107 11.194 9.748 26.629 1.00 10.00 C ATOM 1599 CD GLU A 107 12.599 9.116 26.614 1.00 10.00 C ATOM 1600 OE1 GLU A 107 13.501 9.742 26.010 1.00 10.00 O ATOM 1601 OE2 GLU A 107 12.772 8.041 27.232 1.00 10.00 O ATOM 0 H GLU A 107 8.405 8.672 26.689 1.00 10.00 H new ATOM 0 HA GLU A 107 9.188 11.156 25.605 1.00 10.00 H new ATOM 0 HB2 GLU A 107 10.223 8.315 25.341 1.00 10.00 H new ATOM 0 HB3 GLU A 107 10.976 9.646 24.485 1.00 10.00 H new ATOM 0 HG2 GLU A 107 11.284 10.831 26.708 1.00 10.00 H new ATOM 0 HG3 GLU A 107 10.653 9.408 27.512 1.00 10.00 H new ATOM 1608 N LYS A 108 7.839 8.990 23.486 1.00 10.00 N ATOM 1609 CA LYS A 108 7.284 8.850 22.140 1.00 10.00 C ATOM 1610 C LYS A 108 6.147 9.846 21.926 1.00 10.00 C ATOM 1611 O LYS A 108 6.133 10.516 20.893 1.00 10.00 O ATOM 1612 CB LYS A 108 6.854 7.392 21.927 1.00 10.00 C ATOM 1613 CG LYS A 108 8.093 6.495 21.739 1.00 10.00 C ATOM 1614 CD LYS A 108 7.762 4.997 21.774 1.00 10.00 C ATOM 1615 CE LYS A 108 7.116 4.449 20.494 1.00 10.00 C ATOM 1616 NZ LYS A 108 8.053 4.417 19.348 1.00 10.00 N ATOM 0 H LYS A 108 7.677 8.183 24.088 1.00 10.00 H new ATOM 0 HA LYS A 108 8.039 9.086 21.390 1.00 10.00 H new ATOM 0 HB2 LYS A 108 6.273 7.048 22.783 1.00 10.00 H new ATOM 0 HB3 LYS A 108 6.207 7.320 21.053 1.00 10.00 H new ATOM 0 HG2 LYS A 108 8.566 6.734 20.787 1.00 10.00 H new ATOM 0 HG3 LYS A 108 8.819 6.719 22.521 1.00 10.00 H new ATOM 0 HD2 LYS A 108 8.680 4.441 21.967 1.00 10.00 H new ATOM 0 HD3 LYS A 108 7.092 4.807 22.612 1.00 10.00 H new ATOM 0 HE2 LYS A 108 6.745 3.442 20.682 1.00 10.00 H new ATOM 0 HE3 LYS A 108 6.254 5.064 20.236 1.00 10.00 H new ATOM 0 HZ1 LYS A 108 7.757 3.679 18.678 1.00 10.00 H new ATOM 0 HZ2 LYS A 108 8.048 5.340 18.870 1.00 10.00 H new ATOM 0 HZ3 LYS A 108 9.013 4.209 19.690 1.00 10.00 H new ATOM 1630 N ILE A 109 5.241 9.999 22.902 1.00 10.00 N ATOM 1631 CA ILE A 109 4.217 11.043 22.880 1.00 10.00 C ATOM 1632 C ILE A 109 4.924 12.398 22.741 1.00 10.00 C ATOM 1633 O ILE A 109 4.607 13.161 21.835 1.00 10.00 O ATOM 1634 CB ILE A 109 3.317 10.968 24.144 1.00 10.00 C ATOM 1635 CG1 ILE A 109 2.521 9.643 24.229 1.00 10.00 C ATOM 1636 CG2 ILE A 109 2.307 12.133 24.188 1.00 10.00 C ATOM 1637 CD1 ILE A 109 1.996 9.322 25.635 1.00 10.00 C ATOM 0 H ILE A 109 5.201 9.401 23.727 1.00 10.00 H new ATOM 0 HA ILE A 109 3.548 10.904 22.031 1.00 10.00 H new ATOM 0 HB ILE A 109 4.001 11.029 24.991 1.00 10.00 H new ATOM 0 HG12 ILE A 109 1.678 9.692 23.540 1.00 10.00 H new ATOM 0 HG13 ILE A 109 3.159 8.825 23.895 1.00 10.00 H new ATOM 0 HG21 ILE A 109 1.694 12.049 25.085 1.00 10.00 H new ATOM 0 HG22 ILE A 109 2.845 13.081 24.204 1.00 10.00 H new ATOM 0 HG23 ILE A 109 1.667 12.093 23.306 1.00 10.00 H new ATOM 0 HD11 ILE A 109 1.449 8.379 25.613 1.00 10.00 H new ATOM 0 HD12 ILE A 109 2.835 9.239 26.326 1.00 10.00 H new ATOM 0 HD13 ILE A 109 1.331 10.119 25.966 1.00 10.00 H new ATOM 1649 N LYS A 110 5.900 12.692 23.602 1.00 10.00 N ATOM 1650 CA LYS A 110 6.572 13.990 23.656 1.00 10.00 C ATOM 1651 C LYS A 110 7.249 14.327 22.328 1.00 10.00 C ATOM 1652 O LYS A 110 7.176 15.468 21.884 1.00 10.00 O ATOM 1653 CB LYS A 110 7.563 13.966 24.830 1.00 10.00 C ATOM 1654 CG LYS A 110 8.083 15.358 25.217 1.00 10.00 C ATOM 1655 CD LYS A 110 8.943 15.345 26.496 1.00 10.00 C ATOM 1656 CE LYS A 110 8.219 14.665 27.670 1.00 10.00 C ATOM 1657 NZ LYS A 110 8.796 14.998 28.990 1.00 10.00 N ATOM 0 H LYS A 110 6.250 12.026 24.290 1.00 10.00 H new ATOM 0 HA LYS A 110 5.842 14.783 23.821 1.00 10.00 H new ATOM 0 HB2 LYS A 110 7.079 13.514 25.695 1.00 10.00 H new ATOM 0 HB3 LYS A 110 8.409 13.330 24.569 1.00 10.00 H new ATOM 0 HG2 LYS A 110 8.672 15.762 24.394 1.00 10.00 H new ATOM 0 HG3 LYS A 110 7.236 16.029 25.362 1.00 10.00 H new ATOM 0 HD2 LYS A 110 9.880 14.825 26.298 1.00 10.00 H new ATOM 0 HD3 LYS A 110 9.199 16.368 26.771 1.00 10.00 H new ATOM 0 HE2 LYS A 110 7.169 14.957 27.657 1.00 10.00 H new ATOM 0 HE3 LYS A 110 8.251 13.585 27.530 1.00 10.00 H new ATOM 0 HZ1 LYS A 110 8.284 14.481 29.733 1.00 10.00 H new ATOM 0 HZ2 LYS A 110 9.800 14.727 29.009 1.00 10.00 H new ATOM 0 HZ3 LYS A 110 8.711 16.021 29.158 1.00 10.00 H new ATOM 1671 N ALA A 111 7.883 13.347 21.682 1.00 10.00 N ATOM 1672 CA ALA A 111 8.569 13.529 20.415 1.00 10.00 C ATOM 1673 C ALA A 111 7.596 13.950 19.312 1.00 10.00 C ATOM 1674 O ALA A 111 7.945 14.789 18.483 1.00 10.00 O ATOM 1675 CB ALA A 111 9.291 12.231 20.026 1.00 10.00 C ATOM 0 H ALA A 111 7.931 12.391 22.036 1.00 10.00 H new ATOM 0 HA ALA A 111 9.302 14.328 20.532 1.00 10.00 H new ATOM 0 HB1 ALA A 111 9.805 12.371 19.075 1.00 10.00 H new ATOM 0 HB2 ALA A 111 10.018 11.974 20.796 1.00 10.00 H new ATOM 0 HB3 ALA A 111 8.564 11.425 19.930 1.00 10.00 H new ATOM 1681 N LYS A 112 6.397 13.358 19.260 1.00 10.00 N ATOM 1682 CA LYS A 112 5.422 13.657 18.205 1.00 10.00 C ATOM 1683 C LYS A 112 4.483 14.811 18.570 1.00 10.00 C ATOM 1684 O LYS A 112 3.917 15.410 17.659 1.00 10.00 O ATOM 1685 CB LYS A 112 4.631 12.394 17.823 1.00 10.00 C ATOM 1686 CG LYS A 112 5.495 11.244 17.266 1.00 10.00 C ATOM 1687 CD LYS A 112 6.403 11.639 16.090 1.00 10.00 C ATOM 1688 CE LYS A 112 7.097 10.397 15.513 1.00 10.00 C ATOM 1689 NZ LYS A 112 8.002 10.729 14.385 1.00 10.00 N ATOM 0 H LYS A 112 6.078 12.667 19.939 1.00 10.00 H new ATOM 0 HA LYS A 112 5.989 13.990 17.336 1.00 10.00 H new ATOM 0 HB2 LYS A 112 4.095 12.036 18.702 1.00 10.00 H new ATOM 0 HB3 LYS A 112 3.881 12.661 17.079 1.00 10.00 H new ATOM 0 HG2 LYS A 112 6.115 10.850 18.071 1.00 10.00 H new ATOM 0 HG3 LYS A 112 4.838 10.436 16.945 1.00 10.00 H new ATOM 0 HD2 LYS A 112 5.813 12.128 15.314 1.00 10.00 H new ATOM 0 HD3 LYS A 112 7.150 12.359 16.424 1.00 10.00 H new ATOM 0 HE2 LYS A 112 7.667 9.904 16.300 1.00 10.00 H new ATOM 0 HE3 LYS A 112 6.343 9.687 15.174 1.00 10.00 H new ATOM 0 HZ1 LYS A 112 8.447 9.859 14.029 1.00 10.00 H new ATOM 0 HZ2 LYS A 112 7.455 11.176 13.621 1.00 10.00 H new ATOM 0 HZ3 LYS A 112 8.739 11.386 14.713 1.00 10.00 H new ATOM 1703 N TYR A 113 4.352 15.158 19.850 1.00 10.00 N ATOM 1704 CA TYR A 113 3.468 16.208 20.341 1.00 10.00 C ATOM 1705 C TYR A 113 4.237 17.144 21.289 1.00 10.00 C ATOM 1706 O TYR A 113 3.827 17.307 22.438 1.00 10.00 O ATOM 1707 CB TYR A 113 2.223 15.568 20.988 1.00 10.00 C ATOM 1708 CG TYR A 113 1.444 14.633 20.075 1.00 10.00 C ATOM 1709 CD1 TYR A 113 0.579 15.160 19.096 1.00 10.00 C ATOM 1710 CD2 TYR A 113 1.596 13.237 20.192 1.00 10.00 C ATOM 1711 CE1 TYR A 113 -0.127 14.300 18.237 1.00 10.00 C ATOM 1712 CE2 TYR A 113 0.897 12.369 19.337 1.00 10.00 C ATOM 1713 CZ TYR A 113 0.031 12.900 18.356 1.00 10.00 C ATOM 1714 OH TYR A 113 -0.642 12.053 17.534 1.00 10.00 O ATOM 0 H TYR A 113 4.876 14.700 20.595 1.00 10.00 H new ATOM 0 HA TYR A 113 3.116 16.829 19.517 1.00 10.00 H new ATOM 0 HB2 TYR A 113 2.534 15.014 21.873 1.00 10.00 H new ATOM 0 HB3 TYR A 113 1.557 16.362 21.327 1.00 10.00 H new ATOM 0 HD1 TYR A 113 0.458 16.229 19.005 1.00 10.00 H new ATOM 0 HD2 TYR A 113 2.255 12.831 20.945 1.00 10.00 H new ATOM 0 HE1 TYR A 113 -0.789 14.708 17.487 1.00 10.00 H new ATOM 0 HE2 TYR A 113 1.021 11.300 19.429 1.00 10.00 H new ATOM 0 HH TYR A 113 -0.411 11.127 17.758 1.00 10.00 H new ATOM 1724 N PRO A 114 5.343 17.782 20.844 1.00 10.00 N ATOM 1725 CA PRO A 114 6.207 18.585 21.712 1.00 10.00 C ATOM 1726 C PRO A 114 5.540 19.877 22.209 1.00 10.00 C ATOM 1727 O PRO A 114 6.086 20.544 23.084 1.00 10.00 O ATOM 1728 CB PRO A 114 7.459 18.878 20.876 1.00 10.00 C ATOM 1729 CG PRO A 114 6.930 18.880 19.444 1.00 10.00 C ATOM 1730 CD PRO A 114 5.865 17.787 19.483 1.00 10.00 C ATOM 0 HA PRO A 114 6.441 18.041 22.627 1.00 10.00 H new ATOM 0 HB2 PRO A 114 7.905 19.836 21.142 1.00 10.00 H new ATOM 0 HB3 PRO A 114 8.227 18.118 21.021 1.00 10.00 H new ATOM 0 HG2 PRO A 114 6.509 19.847 19.168 1.00 10.00 H new ATOM 0 HG3 PRO A 114 7.715 18.656 18.721 1.00 10.00 H new ATOM 0 HD2 PRO A 114 5.073 17.989 18.762 1.00 10.00 H new ATOM 0 HD3 PRO A 114 6.291 16.818 19.225 1.00 10.00 H new ATOM 1738 N ASP A 115 4.383 20.248 21.646 1.00 10.00 N ATOM 1739 CA ASP A 115 3.553 21.358 22.126 1.00 10.00 C ATOM 1740 C ASP A 115 3.019 21.116 23.548 1.00 10.00 C ATOM 1741 O ASP A 115 2.549 22.045 24.196 1.00 10.00 O ATOM 1742 CB ASP A 115 2.390 21.595 21.151 1.00 10.00 C ATOM 1743 CG ASP A 115 1.579 22.855 21.502 1.00 10.00 C ATOM 1744 OD1 ASP A 115 2.175 23.957 21.432 1.00 10.00 O ATOM 1745 OD2 ASP A 115 0.353 22.714 21.720 1.00 10.00 O ATOM 0 H ASP A 115 3.992 19.777 20.830 1.00 10.00 H new ATOM 0 HA ASP A 115 4.183 22.247 22.170 1.00 10.00 H new ATOM 0 HB2 ASP A 115 2.782 21.689 20.138 1.00 10.00 H new ATOM 0 HB3 ASP A 115 1.730 20.727 21.159 1.00 10.00 H new ATOM 1750 N TYR A 116 3.127 19.889 24.072 1.00 10.00 N ATOM 1751 CA TYR A 116 2.683 19.519 25.407 1.00 10.00 C ATOM 1752 C TYR A 116 3.839 18.860 26.156 1.00 10.00 C ATOM 1753 O TYR A 116 4.609 18.080 25.588 1.00 10.00 O ATOM 1754 CB TYR A 116 1.503 18.539 25.314 1.00 10.00 C ATOM 1755 CG TYR A 116 0.273 19.066 24.598 1.00 10.00 C ATOM 1756 CD1 TYR A 116 -0.714 19.773 25.310 1.00 10.00 C ATOM 1757 CD2 TYR A 116 0.106 18.829 23.220 1.00 10.00 C ATOM 1758 CE1 TYR A 116 -1.859 20.249 24.647 1.00 10.00 C ATOM 1759 CE2 TYR A 116 -1.038 19.300 22.552 1.00 10.00 C ATOM 1760 CZ TYR A 116 -2.024 20.019 23.261 1.00 10.00 C ATOM 1761 OH TYR A 116 -3.139 20.458 22.609 1.00 10.00 O ATOM 0 H TYR A 116 3.538 19.109 23.559 1.00 10.00 H new ATOM 0 HA TYR A 116 2.360 20.412 25.942 1.00 10.00 H new ATOM 0 HB2 TYR A 116 1.841 17.637 24.803 1.00 10.00 H new ATOM 0 HB3 TYR A 116 1.217 18.245 26.324 1.00 10.00 H new ATOM 0 HD1 TYR A 116 -0.592 19.950 26.368 1.00 10.00 H new ATOM 0 HD2 TYR A 116 0.860 18.283 22.673 1.00 10.00 H new ATOM 0 HE1 TYR A 116 -2.614 20.791 25.197 1.00 10.00 H new ATOM 0 HE2 TYR A 116 -1.162 19.112 21.496 1.00 10.00 H new ATOM 0 HH TYR A 116 -3.082 20.213 21.662 1.00 10.00 H new ATOM 1771 N GLU A 117 3.915 19.118 27.463 1.00 10.00 N ATOM 1772 CA GLU A 117 4.792 18.386 28.365 1.00 10.00 C ATOM 1773 C GLU A 117 4.118 17.039 28.663 1.00 10.00 C ATOM 1774 O GLU A 117 2.887 16.937 28.641 1.00 10.00 O ATOM 1775 CB GLU A 117 5.035 19.248 29.621 1.00 10.00 C ATOM 1776 CG GLU A 117 5.907 18.608 30.712 1.00 10.00 C ATOM 1777 CD GLU A 117 7.324 18.281 30.208 1.00 10.00 C ATOM 1778 OE1 GLU A 117 7.454 17.253 29.491 1.00 10.00 O ATOM 1779 OE2 GLU A 117 8.283 18.969 30.609 1.00 10.00 O ATOM 0 H GLU A 117 3.366 19.844 27.923 1.00 10.00 H new ATOM 0 HA GLU A 117 5.772 18.182 27.934 1.00 10.00 H new ATOM 0 HB2 GLU A 117 5.501 20.184 29.312 1.00 10.00 H new ATOM 0 HB3 GLU A 117 4.069 19.502 30.057 1.00 10.00 H new ATOM 0 HG2 GLU A 117 5.974 19.284 31.564 1.00 10.00 H new ATOM 0 HG3 GLU A 117 5.430 17.694 31.066 1.00 10.00 H new ATOM 1786 N VAL A 118 4.904 16.010 28.989 1.00 10.00 N ATOM 1787 CA VAL A 118 4.418 14.659 29.252 1.00 10.00 C ATOM 1788 C VAL A 118 5.222 14.100 30.430 1.00 10.00 C ATOM 1789 O VAL A 118 6.450 14.226 30.455 1.00 10.00 O ATOM 1790 CB VAL A 118 4.553 13.760 27.997 1.00 10.00 C ATOM 1791 CG1 VAL A 118 3.675 12.507 28.137 1.00 10.00 C ATOM 1792 CG2 VAL A 118 4.184 14.443 26.669 1.00 10.00 C ATOM 0 H VAL A 118 5.916 16.098 29.079 1.00 10.00 H new ATOM 0 HA VAL A 118 3.357 14.681 29.500 1.00 10.00 H new ATOM 0 HB VAL A 118 5.614 13.514 27.953 1.00 10.00 H new ATOM 0 HG11 VAL A 118 3.782 11.887 27.247 1.00 10.00 H new ATOM 0 HG12 VAL A 118 3.987 11.940 29.014 1.00 10.00 H new ATOM 0 HG13 VAL A 118 2.632 12.804 28.249 1.00 10.00 H new ATOM 0 HG21 VAL A 118 4.310 13.736 25.849 1.00 10.00 H new ATOM 0 HG22 VAL A 118 3.146 14.775 26.706 1.00 10.00 H new ATOM 0 HG23 VAL A 118 4.834 15.303 26.509 1.00 10.00 H new ATOM 1802 N THR A 119 4.549 13.458 31.385 1.00 10.00 N ATOM 1803 CA THR A 119 5.161 12.833 32.560 1.00 10.00 C ATOM 1804 C THR A 119 4.392 11.548 32.906 1.00 10.00 C ATOM 1805 O THR A 119 3.347 11.287 32.307 1.00 10.00 O ATOM 1806 CB THR A 119 5.187 13.841 33.736 1.00 10.00 C ATOM 1807 OG1 THR A 119 4.115 14.778 33.689 1.00 10.00 O ATOM 1808 CG2 THR A 119 6.476 14.667 33.750 1.00 10.00 C ATOM 0 H THR A 119 3.534 13.355 31.363 1.00 10.00 H new ATOM 0 HA THR A 119 6.194 12.556 32.351 1.00 10.00 H new ATOM 0 HB THR A 119 5.104 13.219 34.627 1.00 10.00 H new ATOM 0 HG1 THR A 119 4.330 15.489 33.050 1.00 10.00 H new ATOM 0 HG21 THR A 119 6.454 15.361 34.590 1.00 10.00 H new ATOM 0 HG22 THR A 119 7.333 14.002 33.852 1.00 10.00 H new ATOM 0 HG23 THR A 119 6.560 15.227 32.819 1.00 10.00 H new ATOM 1816 N TRP A 120 4.892 10.746 33.848 1.00 10.00 N ATOM 1817 CA TRP A 120 4.181 9.571 34.331 1.00 10.00 C ATOM 1818 C TRP A 120 4.473 9.318 35.810 1.00 10.00 C ATOM 1819 O TRP A 120 5.413 9.897 36.360 1.00 10.00 O ATOM 1820 CB TRP A 120 4.543 8.343 33.478 1.00 10.00 C ATOM 1821 CG TRP A 120 5.950 7.841 33.600 1.00 10.00 C ATOM 1822 CD1 TRP A 120 7.033 8.347 32.969 1.00 10.00 C ATOM 1823 CD2 TRP A 120 6.446 6.721 34.396 1.00 10.00 C ATOM 1824 NE1 TRP A 120 8.161 7.649 33.347 1.00 10.00 N ATOM 1825 CE2 TRP A 120 7.856 6.620 34.211 1.00 10.00 C ATOM 1826 CE3 TRP A 120 5.837 5.754 35.225 1.00 10.00 C ATOM 1827 CZ2 TRP A 120 8.624 5.621 34.831 1.00 10.00 C ATOM 1828 CZ3 TRP A 120 6.595 4.743 35.845 1.00 10.00 C ATOM 1829 CH2 TRP A 120 7.987 4.678 35.656 1.00 10.00 C ATOM 0 H TRP A 120 5.798 10.896 34.293 1.00 10.00 H new ATOM 0 HA TRP A 120 3.111 9.754 34.236 1.00 10.00 H new ATOM 0 HB2 TRP A 120 3.866 7.531 33.743 1.00 10.00 H new ATOM 0 HB3 TRP A 120 4.356 8.586 32.432 1.00 10.00 H new ATOM 0 HD1 TRP A 120 7.017 9.173 32.274 1.00 10.00 H new ATOM 0 HE1 TRP A 120 9.104 7.868 33.027 1.00 10.00 H new ATOM 0 HE3 TRP A 120 4.770 5.791 35.386 1.00 10.00 H new ATOM 0 HZ2 TRP A 120 9.692 5.578 34.676 1.00 10.00 H new ATOM 0 HZ3 TRP A 120 6.104 4.012 36.470 1.00 10.00 H new ATOM 0 HH2 TRP A 120 8.565 3.906 36.143 1.00 10.00 H new ATOM 1840 N ALA A 121 3.713 8.409 36.431 1.00 10.00 N ATOM 1841 CA ALA A 121 3.958 7.919 37.784 1.00 10.00 C ATOM 1842 C ALA A 121 3.577 6.443 37.882 1.00 10.00 C ATOM 1843 O ALA A 121 2.651 5.988 37.209 1.00 10.00 O ATOM 1844 CB ALA A 121 3.148 8.733 38.797 1.00 10.00 C ATOM 0 H ALA A 121 2.894 7.987 35.994 1.00 10.00 H new ATOM 0 HA ALA A 121 5.019 8.030 38.010 1.00 10.00 H new ATOM 0 HB1 ALA A 121 3.340 8.357 39.802 1.00 10.00 H new ATOM 0 HB2 ALA A 121 3.441 9.781 38.739 1.00 10.00 H new ATOM 0 HB3 ALA A 121 2.086 8.641 38.572 1.00 10.00 H new ATOM 1850 N ASN A 122 4.279 5.708 38.744 1.00 10.00 N ATOM 1851 CA ASN A 122 4.020 4.314 39.105 1.00 10.00 C ATOM 1852 C ASN A 122 2.896 4.231 40.151 1.00 10.00 C ATOM 1853 O ASN A 122 3.047 3.573 41.177 1.00 10.00 O ATOM 1854 CB ASN A 122 5.323 3.639 39.590 1.00 10.00 C ATOM 1855 CG ASN A 122 5.851 4.172 40.924 1.00 10.00 C ATOM 1856 OD1 ASN A 122 5.875 5.376 41.151 1.00 10.00 O ATOM 1857 ND2 ASN A 122 6.362 3.304 41.788 1.00 10.00 N ATOM 0 H ASN A 122 5.087 6.089 39.236 1.00 10.00 H new ATOM 0 HA ASN A 122 3.679 3.770 38.224 1.00 10.00 H new ATOM 0 HB2 ASN A 122 5.150 2.567 39.684 1.00 10.00 H new ATOM 0 HB3 ASN A 122 6.092 3.772 38.829 1.00 10.00 H new ATOM 0 HD21 ASN A 122 6.783 3.636 42.656 1.00 10.00 H new ATOM 0 HD22 ASN A 122 6.334 2.305 41.584 1.00 10.00 H new ATOM 1864 N ASP A 123 1.782 4.926 39.915 1.00 10.00 N ATOM 1865 CA ASP A 123 0.713 5.148 40.893 1.00 10.00 C ATOM 1866 C ASP A 123 -0.656 5.038 40.211 1.00 10.00 C ATOM 1867 O ASP A 123 -0.743 5.022 38.976 1.00 10.00 O ATOM 1868 CB ASP A 123 0.914 6.529 41.552 1.00 10.00 C ATOM 1869 CG ASP A 123 -0.108 6.842 42.659 1.00 10.00 C ATOM 1870 OD1 ASP A 123 -0.498 5.895 43.381 1.00 10.00 O ATOM 1871 OD2 ASP A 123 -0.527 8.017 42.742 1.00 10.00 O ATOM 0 H ASP A 123 1.592 5.363 39.013 1.00 10.00 H new ATOM 0 HA ASP A 123 0.751 4.385 41.671 1.00 10.00 H new ATOM 0 HB2 ASP A 123 1.918 6.578 41.973 1.00 10.00 H new ATOM 0 HB3 ASP A 123 0.852 7.300 40.784 1.00 10.00 H new ATOM 1876 N GLY A 124 -1.725 4.937 41.005 1.00 10.00 N ATOM 1877 CA GLY A 124 -3.105 4.818 40.540 1.00 10.00 C ATOM 1878 C GLY A 124 -3.369 3.501 39.807 1.00 10.00 C ATOM 1879 O GLY A 124 -4.178 3.473 38.871 1.00 10.00 O ATOM 0 H GLY A 124 -1.649 4.936 42.022 1.00 10.00 H new ATOM 0 HA2 GLY A 124 -3.780 4.896 41.393 1.00 10.00 H new ATOM 0 HA3 GLY A 124 -3.333 5.651 39.875 1.00 10.00 H new ATOM 1883 N TYR A 125 -2.628 2.447 40.164 1.00 10.00 N ATOM 1884 CA TYR A 125 -2.773 1.112 39.594 1.00 10.00 C ATOM 1885 C TYR A 125 -4.203 0.629 39.816 1.00 10.00 C ATOM 1886 O TYR A 125 -4.870 0.413 38.777 1.00 10.00 O ATOM 1887 CB TYR A 125 -1.720 0.155 40.182 1.00 10.00 C ATOM 1888 CG TYR A 125 -0.276 0.309 39.702 1.00 10.00 C ATOM 1889 CD1 TYR A 125 0.168 1.438 38.981 1.00 10.00 C ATOM 1890 CD2 TYR A 125 0.643 -0.725 39.976 1.00 10.00 C ATOM 1891 CE1 TYR A 125 1.493 1.524 38.530 1.00 10.00 C ATOM 1892 CE2 TYR A 125 1.980 -0.639 39.544 1.00 10.00 C ATOM 1893 CZ TYR A 125 2.408 0.490 38.809 1.00 10.00 C ATOM 1894 OH TYR A 125 3.693 0.596 38.372 1.00 10.00 O ATOM 1895 OXT TYR A 125 -4.608 0.526 40.992 1.00 10.00 O ATOM 0 H TYR A 125 -1.896 2.504 40.873 1.00 10.00 H new ATOM 0 HA TYR A 125 -2.593 1.139 38.519 1.00 10.00 H new ATOM 0 HB2 TYR A 125 -1.728 0.272 41.266 1.00 10.00 H new ATOM 0 HB3 TYR A 125 -2.038 -0.866 39.969 1.00 10.00 H new ATOM 0 HD1 TYR A 125 -0.520 2.244 38.774 1.00 10.00 H new ATOM 0 HD2 TYR A 125 0.316 -1.596 40.525 1.00 10.00 H new ATOM 0 HE1 TYR A 125 1.814 2.387 37.966 1.00 10.00 H new ATOM 0 HE2 TYR A 125 2.676 -1.432 39.773 1.00 10.00 H new ATOM 0 HH TYR A 125 4.198 -0.198 38.646 1.00 10.00 H new TER 1905 TYR A 125