USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 879 hydrogens (32 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 NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 105 HECFE :(H bumps) USER MOD NoAdj-H: A 105 HEC HAC : A 105 HEC CAC : A 17 CYS SG :(H bumps) USER MOD NoAdj-H: A 105 HEC HAB : A 105 HEC CAB : A 14 CYS SG :(H bumps) USER MOD Set 1.1: A 52 ASN : amide:sc= 0.914 K(o=2.7,f=-1.9!) USER MOD Set 1.2: A 67 TYR OH : rot -143:sc= 0.107 USER MOD Set 1.3: A 78 THR OG1 : rot -70:sc= 1.25 USER MOD Set 1.4: A 80 MET CE :methyl -172:sc= -0.655 (180deg=-0.786) USER MOD Set 1.5: A 105 HEC O2D : rot -40:sc= 1.1 USER MOD Set 2.1: A 53 LYS NZ :NH3+ -166:sc= 1.56 (180deg=1.06) USER MOD Set 2.2: A 54 ASN : amide:sc= 1.09 K(o=2.6,f=-8.1!) USER MOD Set 3.1: A 26 HIS : no HE2:sc= -0.698 K(o=-1.3,f=-3.7) USER MOD Set 3.2: A 31 ASN : amide:sc= 0.67 K(o=-1.3,f=-2.5) USER MOD Set 3.3: A 33 HIS : no HD1:sc= -1.29 X(o=-1.3,f=-1.3) USER MOD Single : A 1 GLY N :NH3+ 159:sc= 3.6 (180deg=2.49) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 127:sc= 2.37 (180deg=0.309) USER MOD Single : A 8 LYS NZ :NH3+ -177:sc= 1.25 (180deg=1.2) USER MOD Single : A 12 GLN : amide:sc= -0.0441 X(o=-0.044,f=-0.52) USER MOD Single : A 13 LYS NZ :NH3+ 149:sc= 1.24 (180deg=1.02) USER MOD Single : A 16 GLN : amide:sc= -0.637 K(o=-0.64,f=-5.4!) USER MOD Single : A 19 THR OG1 : rot -38:sc= 1.06 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ -156:sc= 1.08 (180deg=-0.406) USER MOD Single : A 40 THR OG1 : rot -80:sc= 0.147 USER MOD Single : A 42 GLN : amide:sc= 0.226 K(o=0.23,f=-4.6!) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 178:sc= 1.27 USER MOD Single : A 49 THR OG1 : rot -178:sc= 1.31 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -101:sc= 0.0843 (180deg=-0.847!) USER MOD Single : A 63 THR OG1 : rot 170:sc= 1.32 USER MOD Single : A 65 MET CE :methyl -125:sc= -0.0114 (180deg=-0.101) USER MOD Single : A 70 ASN : amide:sc= -0.395 K(o=-0.4,f=-3.1!) USER MOD Single : A 72 LYS NZ :NH3+ 159:sc= 1.11 (180deg=0.681) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 TYR OH : rot 9:sc= 0.944 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 177:sc= 1.29 (180deg=1.26) USER MOD Single : A 88 LYS NZ :NH3+ -162:sc= 1.27 (180deg=1.15) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0706 USER MOD Single : A 97 TYR OH : rot 136:sc= 0.741 USER MOD Single : A 99 LYS NZ :NH3+ -162:sc= 1.34 (180deg=-0.264!) USER MOD Single : A 100 LYS NZ :NH3+ 147:sc= 1.07 (180deg=0.355) USER MOD Single : A 102 THR OG1 : rot -38:sc= 2.04 USER MOD Single : A 103 ASN : amide:sc= -0.148 X(o=-0.15,f=-0.41) USER MOD Single : A 105 HEC O2A : rot 37:sc= 2.07 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.138 1.205 -0.327 1.00 10.00 N ATOM 2 CA GLY A 1 2.099 -0.106 0.349 1.00 10.00 C ATOM 3 C GLY A 1 1.329 -0.050 1.651 1.00 10.00 C ATOM 4 O GLY A 1 1.886 -0.367 2.694 1.00 10.00 O ATOM 0 H1 GLY A 1 2.936 1.228 -0.994 1.00 10.00 H new ATOM 0 H2 GLY A 1 1.249 1.355 -0.845 1.00 10.00 H new ATOM 0 H3 GLY A 1 2.257 1.957 0.381 1.00 10.00 H new ATOM 0 HA2 GLY A 1 1.640 -0.841 -0.312 1.00 10.00 H new ATOM 0 HA3 GLY A 1 3.117 -0.444 0.544 1.00 10.00 H new ATOM 10 N ASP A 2 0.063 0.366 1.594 1.00 10.00 N ATOM 11 CA ASP A 2 -0.667 0.926 2.728 1.00 10.00 C ATOM 12 C ASP A 2 -2.094 0.359 2.804 1.00 10.00 C ATOM 13 O ASP A 2 -2.825 0.314 1.813 1.00 10.00 O ATOM 14 CB ASP A 2 -0.671 2.454 2.578 1.00 10.00 C ATOM 15 CG ASP A 2 0.739 3.057 2.649 1.00 10.00 C ATOM 16 OD1 ASP A 2 1.463 2.993 1.623 1.00 10.00 O ATOM 17 OD2 ASP A 2 1.078 3.568 3.738 1.00 10.00 O ATOM 0 H ASP A 2 -0.493 0.321 0.740 1.00 10.00 H new ATOM 0 HA ASP A 2 -0.179 0.651 3.663 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -1.129 2.721 1.626 1.00 10.00 H new ATOM 0 HB3 ASP A 2 -1.289 2.891 3.362 1.00 10.00 H new ATOM 22 N VAL A 3 -2.490 -0.077 4.006 1.00 10.00 N ATOM 23 CA VAL A 3 -3.688 -0.887 4.266 1.00 10.00 C ATOM 24 C VAL A 3 -4.956 -0.177 3.791 1.00 10.00 C ATOM 25 O VAL A 3 -5.690 -0.730 2.982 1.00 10.00 O ATOM 26 CB VAL A 3 -3.753 -1.268 5.760 1.00 10.00 C ATOM 27 CG1 VAL A 3 -5.040 -2.015 6.139 1.00 10.00 C ATOM 28 CG2 VAL A 3 -2.561 -2.155 6.147 1.00 10.00 C ATOM 0 H VAL A 3 -1.966 0.132 4.856 1.00 10.00 H new ATOM 0 HA VAL A 3 -3.621 -1.810 3.689 1.00 10.00 H new ATOM 0 HB VAL A 3 -3.730 -0.323 6.303 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -5.022 -2.254 7.202 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -5.903 -1.386 5.922 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -5.109 -2.937 5.561 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -2.627 -2.412 7.204 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -2.577 -3.067 5.550 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -1.632 -1.617 5.961 1.00 10.00 H new ATOM 38 N GLU A 4 -5.218 1.051 4.236 1.00 10.00 N ATOM 39 CA GLU A 4 -6.447 1.796 3.937 1.00 10.00 C ATOM 40 C GLU A 4 -6.616 2.233 2.482 1.00 10.00 C ATOM 41 O GLU A 4 -7.755 2.350 2.011 1.00 10.00 O ATOM 42 CB GLU A 4 -6.500 3.013 4.841 1.00 10.00 C ATOM 43 CG GLU A 4 -7.094 2.707 6.227 1.00 10.00 C ATOM 44 CD GLU A 4 -6.555 1.422 6.867 1.00 10.00 C ATOM 45 OE1 GLU A 4 -5.329 1.386 7.120 1.00 10.00 O ATOM 46 OE2 GLU A 4 -7.352 0.461 7.007 1.00 10.00 O ATOM 0 H GLU A 4 -4.569 1.570 4.828 1.00 10.00 H new ATOM 0 HA GLU A 4 -7.270 1.105 4.118 1.00 10.00 H new ATOM 0 HB2 GLU A 4 -5.493 3.412 4.963 1.00 10.00 H new ATOM 0 HB3 GLU A 4 -7.094 3.790 4.361 1.00 10.00 H new ATOM 0 HG2 GLU A 4 -6.889 3.546 6.892 1.00 10.00 H new ATOM 0 HG3 GLU A 4 -8.178 2.629 6.137 1.00 10.00 H new ATOM 53 N LYS A 5 -5.516 2.439 1.749 1.00 10.00 N ATOM 54 CA LYS A 5 -5.550 2.513 0.287 1.00 10.00 C ATOM 55 C LYS A 5 -5.988 1.162 -0.286 1.00 10.00 C ATOM 56 O LYS A 5 -6.833 1.098 -1.178 1.00 10.00 O ATOM 57 CB LYS A 5 -4.149 2.865 -0.245 1.00 10.00 C ATOM 58 CG LYS A 5 -3.517 4.137 0.345 1.00 10.00 C ATOM 59 CD LYS A 5 -3.663 5.387 -0.530 1.00 10.00 C ATOM 60 CE LYS A 5 -5.129 5.813 -0.555 1.00 10.00 C ATOM 61 NZ LYS A 5 -5.319 7.177 -1.092 1.00 10.00 N ATOM 0 H LYS A 5 -4.586 2.558 2.150 1.00 10.00 H new ATOM 0 HA LYS A 5 -6.258 3.283 -0.018 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -3.483 2.025 -0.048 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -4.208 2.978 -1.327 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -3.970 4.335 1.317 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -2.457 3.953 0.519 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -3.044 6.194 -0.138 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -3.315 5.180 -1.542 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -5.698 5.107 -1.160 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -5.534 5.766 0.456 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 -6.332 7.414 -1.086 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -4.800 7.858 -0.501 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 -4.959 7.220 -2.067 1.00 10.00 H new ATOM 75 N GLY A 6 -5.450 0.081 0.281 1.00 10.00 N ATOM 76 CA GLY A 6 -5.573 -1.272 -0.247 1.00 10.00 C ATOM 77 C GLY A 6 -6.976 -1.819 -0.047 1.00 10.00 C ATOM 78 O GLY A 6 -7.554 -2.375 -0.975 1.00 10.00 O ATOM 0 H GLY A 6 -4.904 0.127 1.141 1.00 10.00 H new ATOM 0 HA2 GLY A 6 -5.328 -1.273 -1.309 1.00 10.00 H new ATOM 0 HA3 GLY A 6 -4.853 -1.924 0.247 1.00 10.00 H new ATOM 82 N LYS A 7 -7.549 -1.568 1.136 1.00 10.00 N ATOM 83 CA LYS A 7 -8.929 -1.859 1.525 1.00 10.00 C ATOM 84 C LYS A 7 -9.913 -1.445 0.431 1.00 10.00 C ATOM 85 O LYS A 7 -10.667 -2.250 -0.110 1.00 10.00 O ATOM 86 CB LYS A 7 -9.262 -1.121 2.840 1.00 10.00 C ATOM 87 CG LYS A 7 -8.487 -1.598 4.081 1.00 10.00 C ATOM 88 CD LYS A 7 -9.387 -2.375 5.037 1.00 10.00 C ATOM 89 CE LYS A 7 -8.635 -2.774 6.307 1.00 10.00 C ATOM 90 NZ LYS A 7 -9.558 -3.424 7.260 1.00 10.00 N ATOM 0 H LYS A 7 -7.026 -1.128 1.893 1.00 10.00 H new ATOM 0 HA LYS A 7 -9.024 -2.935 1.673 1.00 10.00 H new ATOM 0 HB2 LYS A 7 -9.069 -0.058 2.699 1.00 10.00 H new ATOM 0 HB3 LYS A 7 -10.329 -1.228 3.036 1.00 10.00 H new ATOM 0 HG2 LYS A 7 -7.654 -2.228 3.771 1.00 10.00 H new ATOM 0 HG3 LYS A 7 -8.061 -0.738 4.598 1.00 10.00 H new ATOM 0 HD2 LYS A 7 -10.253 -1.767 5.300 1.00 10.00 H new ATOM 0 HD3 LYS A 7 -9.764 -3.268 4.539 1.00 10.00 H new ATOM 0 HE2 LYS A 7 -7.819 -3.453 6.058 1.00 10.00 H new ATOM 0 HE3 LYS A 7 -8.187 -1.893 6.766 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 -9.167 -4.343 7.550 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 -9.676 -2.818 8.097 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 -10.482 -3.569 6.805 1.00 10.00 H new ATOM 104 N LYS A 8 -9.889 -0.151 0.112 1.00 10.00 N ATOM 105 CA LYS A 8 -10.840 0.493 -0.796 1.00 10.00 C ATOM 106 C LYS A 8 -10.609 0.090 -2.248 1.00 10.00 C ATOM 107 O LYS A 8 -11.576 -0.211 -2.938 1.00 10.00 O ATOM 108 CB LYS A 8 -10.811 2.014 -0.603 1.00 10.00 C ATOM 109 CG LYS A 8 -11.279 2.386 0.816 1.00 10.00 C ATOM 110 CD LYS A 8 -11.561 3.885 0.973 1.00 10.00 C ATOM 111 CE LYS A 8 -10.328 4.764 0.738 1.00 10.00 C ATOM 112 NZ LYS A 8 -9.314 4.628 1.810 1.00 10.00 N ATOM 0 H LYS A 8 -9.192 0.494 0.486 1.00 10.00 H new ATOM 0 HA LYS A 8 -11.841 0.142 -0.544 1.00 10.00 H new ATOM 0 HB2 LYS A 8 -9.801 2.388 -0.769 1.00 10.00 H new ATOM 0 HB3 LYS A 8 -11.454 2.493 -1.342 1.00 10.00 H new ATOM 0 HG2 LYS A 8 -12.182 1.824 1.055 1.00 10.00 H new ATOM 0 HG3 LYS A 8 -10.517 2.087 1.536 1.00 10.00 H new ATOM 0 HD2 LYS A 8 -12.344 4.175 0.272 1.00 10.00 H new ATOM 0 HD3 LYS A 8 -11.945 4.072 1.976 1.00 10.00 H new ATOM 0 HE2 LYS A 8 -9.877 4.501 -0.219 1.00 10.00 H new ATOM 0 HE3 LYS A 8 -10.638 5.806 0.668 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 -8.526 5.281 1.627 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 -9.747 4.856 2.728 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 -8.957 3.651 1.828 1.00 10.00 H new ATOM 126 N ILE A 9 -9.352 0.022 -2.706 1.00 10.00 N ATOM 127 CA ILE A 9 -9.042 -0.456 -4.063 1.00 10.00 C ATOM 128 C ILE A 9 -9.398 -1.950 -4.228 1.00 10.00 C ATOM 129 O ILE A 9 -9.967 -2.323 -5.258 1.00 10.00 O ATOM 130 CB ILE A 9 -7.579 -0.115 -4.429 1.00 10.00 C ATOM 131 CG1 ILE A 9 -7.288 1.408 -4.417 1.00 10.00 C ATOM 132 CG2 ILE A 9 -7.200 -0.684 -5.804 1.00 10.00 C ATOM 133 CD1 ILE A 9 -8.007 2.254 -5.478 1.00 10.00 C ATOM 0 H ILE A 9 -8.534 0.291 -2.159 1.00 10.00 H new ATOM 0 HA ILE A 9 -9.670 0.069 -4.783 1.00 10.00 H new ATOM 0 HB ILE A 9 -6.970 -0.581 -3.654 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -7.553 1.798 -3.434 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -6.214 1.551 -4.538 1.00 10.00 H new ATOM 0 HG21 ILE A 9 -6.166 -0.427 -6.032 1.00 10.00 H new ATOM 0 HG22 ILE A 9 -7.310 -1.768 -5.792 1.00 10.00 H new ATOM 0 HG23 ILE A 9 -7.855 -0.261 -6.566 1.00 10.00 H new ATOM 0 HD11 ILE A 9 -7.721 3.300 -5.365 1.00 10.00 H new ATOM 0 HD12 ILE A 9 -7.726 1.906 -6.472 1.00 10.00 H new ATOM 0 HD13 ILE A 9 -9.085 2.157 -5.351 1.00 10.00 H new ATOM 145 N PHE A 10 -9.186 -2.791 -3.199 1.00 10.00 N ATOM 146 CA PHE A 10 -9.719 -4.157 -3.157 1.00 10.00 C ATOM 147 C PHE A 10 -11.235 -4.134 -3.328 1.00 10.00 C ATOM 148 O PHE A 10 -11.773 -4.791 -4.216 1.00 10.00 O ATOM 149 CB PHE A 10 -9.338 -4.893 -1.866 1.00 10.00 C ATOM 150 CG PHE A 10 -9.735 -6.361 -1.891 1.00 10.00 C ATOM 151 CD1 PHE A 10 -11.024 -6.771 -1.494 1.00 10.00 C ATOM 152 CD2 PHE A 10 -8.809 -7.324 -2.328 1.00 10.00 C ATOM 153 CE1 PHE A 10 -11.388 -8.130 -1.551 1.00 10.00 C ATOM 154 CE2 PHE A 10 -9.156 -8.685 -2.343 1.00 10.00 C ATOM 155 CZ PHE A 10 -10.450 -9.085 -1.975 1.00 10.00 C ATOM 0 H PHE A 10 -8.640 -2.539 -2.375 1.00 10.00 H new ATOM 0 HA PHE A 10 -9.269 -4.707 -3.983 1.00 10.00 H new ATOM 0 HB2 PHE A 10 -8.262 -4.814 -1.711 1.00 10.00 H new ATOM 0 HB3 PHE A 10 -9.819 -4.405 -1.018 1.00 10.00 H new ATOM 0 HD1 PHE A 10 -11.736 -6.039 -1.144 1.00 10.00 H new ATOM 0 HD2 PHE A 10 -7.826 -7.016 -2.654 1.00 10.00 H new ATOM 0 HE1 PHE A 10 -12.385 -8.437 -1.270 1.00 10.00 H new ATOM 0 HE2 PHE A 10 -8.426 -9.424 -2.638 1.00 10.00 H new ATOM 0 HZ PHE A 10 -10.725 -10.129 -2.018 1.00 10.00 H new ATOM 165 N VAL A 11 -11.944 -3.335 -2.525 1.00 10.00 N ATOM 166 CA VAL A 11 -13.404 -3.234 -2.623 1.00 10.00 C ATOM 167 C VAL A 11 -13.902 -2.713 -3.990 1.00 10.00 C ATOM 168 O VAL A 11 -15.063 -2.911 -4.338 1.00 10.00 O ATOM 169 CB VAL A 11 -13.968 -2.462 -1.405 1.00 10.00 C ATOM 170 CG1 VAL A 11 -15.454 -2.092 -1.502 1.00 10.00 C ATOM 171 CG2 VAL A 11 -13.814 -3.311 -0.130 1.00 10.00 C ATOM 0 H VAL A 11 -11.531 -2.749 -1.800 1.00 10.00 H new ATOM 0 HA VAL A 11 -13.811 -4.244 -2.582 1.00 10.00 H new ATOM 0 HB VAL A 11 -13.392 -1.537 -1.380 1.00 10.00 H new ATOM 0 HG11 VAL A 11 -15.755 -1.555 -0.603 1.00 10.00 H new ATOM 0 HG12 VAL A 11 -15.615 -1.458 -2.374 1.00 10.00 H new ATOM 0 HG13 VAL A 11 -16.049 -3.000 -1.598 1.00 10.00 H new ATOM 0 HG21 VAL A 11 -14.213 -2.762 0.723 1.00 10.00 H new ATOM 0 HG22 VAL A 11 -14.361 -4.246 -0.247 1.00 10.00 H new ATOM 0 HG23 VAL A 11 -12.759 -3.527 0.038 1.00 10.00 H new ATOM 181 N GLN A 12 -13.014 -2.143 -4.810 1.00 10.00 N ATOM 182 CA GLN A 12 -13.319 -1.554 -6.117 1.00 10.00 C ATOM 183 C GLN A 12 -13.146 -2.563 -7.262 1.00 10.00 C ATOM 184 O GLN A 12 -13.897 -2.522 -8.239 1.00 10.00 O ATOM 185 CB GLN A 12 -12.396 -0.342 -6.352 1.00 10.00 C ATOM 186 CG GLN A 12 -12.973 0.693 -7.331 1.00 10.00 C ATOM 187 CD GLN A 12 -14.202 1.428 -6.790 1.00 10.00 C ATOM 188 OE1 GLN A 12 -14.384 1.605 -5.595 1.00 10.00 O ATOM 189 NE2 GLN A 12 -15.087 1.891 -7.650 1.00 10.00 N ATOM 0 H GLN A 12 -12.024 -2.077 -4.572 1.00 10.00 H new ATOM 0 HA GLN A 12 -14.364 -1.244 -6.110 1.00 10.00 H new ATOM 0 HB2 GLN A 12 -12.200 0.145 -5.397 1.00 10.00 H new ATOM 0 HB3 GLN A 12 -11.438 -0.695 -6.733 1.00 10.00 H new ATOM 0 HG2 GLN A 12 -12.200 1.423 -7.572 1.00 10.00 H new ATOM 0 HG3 GLN A 12 -13.240 0.192 -8.261 1.00 10.00 H new ATOM 0 HE21 GLN A 12 -14.948 1.750 -8.651 1.00 10.00 H new ATOM 0 HE22 GLN A 12 -15.911 2.390 -7.315 1.00 10.00 H new ATOM 198 N LYS A 13 -12.115 -3.423 -7.188 1.00 10.00 N ATOM 199 CA LYS A 13 -11.680 -4.313 -8.272 1.00 10.00 C ATOM 200 C LYS A 13 -11.484 -5.781 -7.889 1.00 10.00 C ATOM 201 O LYS A 13 -11.143 -6.574 -8.762 1.00 10.00 O ATOM 202 CB LYS A 13 -10.382 -3.731 -8.867 1.00 10.00 C ATOM 203 CG LYS A 13 -10.624 -2.382 -9.558 1.00 10.00 C ATOM 204 CD LYS A 13 -11.340 -2.586 -10.897 1.00 10.00 C ATOM 205 CE LYS A 13 -12.175 -1.367 -11.297 1.00 10.00 C ATOM 206 NZ LYS A 13 -13.556 -1.456 -10.766 1.00 10.00 N ATOM 0 H LYS A 13 -11.547 -3.519 -6.346 1.00 10.00 H new ATOM 0 HA LYS A 13 -12.492 -4.342 -8.998 1.00 10.00 H new ATOM 0 HB2 LYS A 13 -9.644 -3.606 -8.075 1.00 10.00 H new ATOM 0 HB3 LYS A 13 -9.963 -4.437 -9.585 1.00 10.00 H new ATOM 0 HG2 LYS A 13 -11.223 -1.739 -8.913 1.00 10.00 H new ATOM 0 HG3 LYS A 13 -9.673 -1.874 -9.721 1.00 10.00 H new ATOM 0 HD2 LYS A 13 -10.603 -2.790 -11.674 1.00 10.00 H new ATOM 0 HD3 LYS A 13 -11.986 -3.462 -10.832 1.00 10.00 H new ATOM 0 HE2 LYS A 13 -11.699 -0.460 -10.924 1.00 10.00 H new ATOM 0 HE3 LYS A 13 -12.206 -1.287 -12.384 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 -13.917 -0.499 -10.576 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 -14.167 -1.924 -11.465 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 -13.554 -2.007 -9.884 1.00 10.00 H new ATOM 220 N CYS A 14 -11.719 -6.140 -6.626 1.00 10.00 N ATOM 221 CA CYS A 14 -11.517 -7.479 -6.079 1.00 10.00 C ATOM 222 C CYS A 14 -12.727 -7.975 -5.268 1.00 10.00 C ATOM 223 O CYS A 14 -13.130 -9.134 -5.396 1.00 10.00 O ATOM 224 CB CYS A 14 -10.303 -7.431 -5.157 1.00 10.00 C ATOM 225 SG CYS A 14 -8.761 -6.684 -5.766 1.00 10.00 S ATOM 0 H CYS A 14 -12.068 -5.480 -5.931 1.00 10.00 H new ATOM 0 HA CYS A 14 -11.375 -8.168 -6.912 1.00 10.00 H new ATOM 0 HB2 CYS A 14 -10.596 -6.892 -4.256 1.00 10.00 H new ATOM 0 HB3 CYS A 14 -10.077 -8.454 -4.858 1.00 10.00 H new ATOM 230 N ALA A 15 -13.322 -7.122 -4.415 1.00 10.00 N ATOM 231 CA ALA A 15 -14.478 -7.546 -3.607 1.00 10.00 C ATOM 232 C ALA A 15 -15.715 -7.866 -4.459 1.00 10.00 C ATOM 233 O ALA A 15 -16.520 -8.705 -4.066 1.00 10.00 O ATOM 234 CB ALA A 15 -14.853 -6.502 -2.561 1.00 10.00 C ATOM 0 H ALA A 15 -13.029 -6.156 -4.269 1.00 10.00 H new ATOM 0 HA ALA A 15 -14.159 -8.461 -3.107 1.00 10.00 H new ATOM 0 HB1 ALA A 15 -15.710 -6.854 -1.987 1.00 10.00 H new ATOM 0 HB2 ALA A 15 -14.009 -6.339 -1.891 1.00 10.00 H new ATOM 0 HB3 ALA A 15 -15.108 -5.565 -3.057 1.00 10.00 H new ATOM 240 N GLN A 16 -15.809 -7.264 -5.650 1.00 10.00 N ATOM 241 CA GLN A 16 -16.771 -7.541 -6.714 1.00 10.00 C ATOM 242 C GLN A 16 -16.739 -8.988 -7.256 1.00 10.00 C ATOM 243 O GLN A 16 -17.560 -9.343 -8.099 1.00 10.00 O ATOM 244 CB GLN A 16 -16.597 -6.469 -7.809 1.00 10.00 C ATOM 245 CG GLN A 16 -15.178 -6.146 -8.291 1.00 10.00 C ATOM 246 CD GLN A 16 -14.497 -7.372 -8.862 1.00 10.00 C ATOM 247 OE1 GLN A 16 -13.761 -8.048 -8.170 1.00 10.00 O ATOM 248 NE2 GLN A 16 -14.759 -7.726 -10.103 1.00 10.00 N ATOM 0 H GLN A 16 -15.166 -6.516 -5.911 1.00 10.00 H new ATOM 0 HA GLN A 16 -17.774 -7.476 -6.293 1.00 10.00 H new ATOM 0 HB2 GLN A 16 -17.179 -6.782 -8.676 1.00 10.00 H new ATOM 0 HB3 GLN A 16 -17.042 -5.544 -7.442 1.00 10.00 H new ATOM 0 HG2 GLN A 16 -15.219 -5.364 -9.049 1.00 10.00 H new ATOM 0 HG3 GLN A 16 -14.590 -5.755 -7.461 1.00 10.00 H new ATOM 0 HE21 GLN A 16 -15.378 -7.153 -10.677 1.00 10.00 H new ATOM 0 HE22 GLN A 16 -14.343 -8.573 -10.490 1.00 10.00 H new ATOM 257 N CYS A 17 -15.833 -9.823 -6.736 1.00 10.00 N ATOM 258 CA CYS A 17 -15.620 -11.221 -7.094 1.00 10.00 C ATOM 259 C CYS A 17 -15.254 -12.094 -5.873 1.00 10.00 C ATOM 260 O CYS A 17 -15.672 -13.252 -5.827 1.00 10.00 O ATOM 261 CB CYS A 17 -14.494 -11.249 -8.127 1.00 10.00 C ATOM 262 SG CYS A 17 -14.996 -10.921 -9.841 1.00 10.00 S ATOM 0 H CYS A 17 -15.189 -9.516 -6.007 1.00 10.00 H new ATOM 0 HA CYS A 17 -16.543 -11.639 -7.495 1.00 10.00 H new ATOM 0 HB2 CYS A 17 -13.743 -10.513 -7.840 1.00 10.00 H new ATOM 0 HB3 CYS A 17 -14.014 -12.227 -8.088 1.00 10.00 H new ATOM 267 N HIS A 18 -14.534 -11.535 -4.883 1.00 10.00 N ATOM 268 CA HIS A 18 -14.002 -12.229 -3.706 1.00 10.00 C ATOM 269 C HIS A 18 -14.592 -11.775 -2.348 1.00 10.00 C ATOM 270 O HIS A 18 -14.373 -12.432 -1.329 1.00 10.00 O ATOM 271 CB HIS A 18 -12.480 -12.027 -3.713 1.00 10.00 C ATOM 272 CG HIS A 18 -11.760 -12.676 -4.857 1.00 10.00 C ATOM 273 ND1 HIS A 18 -11.428 -13.997 -4.878 1.00 10.00 N ATOM 274 CD2 HIS A 18 -11.130 -12.076 -5.915 1.00 10.00 C ATOM 275 CE1 HIS A 18 -10.574 -14.192 -5.891 1.00 10.00 C ATOM 276 NE2 HIS A 18 -10.384 -13.064 -6.568 1.00 10.00 N ATOM 0 H HIS A 18 -14.299 -10.542 -4.886 1.00 10.00 H new ATOM 0 HA HIS A 18 -14.291 -13.277 -3.787 1.00 10.00 H new ATOM 0 HB2 HIS A 18 -12.271 -10.957 -3.731 1.00 10.00 H new ATOM 0 HB3 HIS A 18 -12.073 -12.416 -2.780 1.00 10.00 H new ATOM 0 HD1 HIS A 18 -11.770 -14.712 -4.235 1.00 10.00 H new ATOM 0 HD2 HIS A 18 -11.197 -11.035 -6.193 1.00 10.00 H new ATOM 0 HE1 HIS A 18 -10.104 -15.136 -6.126 1.00 10.00 H new ATOM 284 N THR A 19 -15.360 -10.680 -2.302 1.00 10.00 N ATOM 285 CA THR A 19 -15.950 -10.013 -1.119 1.00 10.00 C ATOM 286 C THR A 19 -14.986 -9.539 -0.016 1.00 10.00 C ATOM 287 O THR A 19 -14.874 -8.334 0.204 1.00 10.00 O ATOM 288 CB THR A 19 -17.103 -10.821 -0.507 1.00 10.00 C ATOM 289 OG1 THR A 19 -16.654 -12.072 -0.037 1.00 10.00 O ATOM 290 CG2 THR A 19 -18.246 -11.046 -1.493 1.00 10.00 C ATOM 0 H THR A 19 -15.610 -10.191 -3.161 1.00 10.00 H new ATOM 0 HA THR A 19 -16.328 -9.089 -1.556 1.00 10.00 H new ATOM 0 HB THR A 19 -17.478 -10.226 0.326 1.00 10.00 H new ATOM 0 HG1 THR A 19 -15.979 -12.429 -0.651 1.00 10.00 H new ATOM 0 HG21 THR A 19 -19.035 -11.622 -1.010 1.00 10.00 H new ATOM 0 HG22 THR A 19 -18.644 -10.084 -1.814 1.00 10.00 H new ATOM 0 HG23 THR A 19 -17.876 -11.593 -2.360 1.00 10.00 H new ATOM 298 N VAL A 20 -14.344 -10.465 0.706 1.00 10.00 N ATOM 299 CA VAL A 20 -13.608 -10.306 1.976 1.00 10.00 C ATOM 300 C VAL A 20 -14.308 -9.333 2.939 1.00 10.00 C ATOM 301 O VAL A 20 -15.244 -9.732 3.625 1.00 10.00 O ATOM 302 CB VAL A 20 -12.120 -9.975 1.737 1.00 10.00 C ATOM 303 CG1 VAL A 20 -11.302 -10.043 3.036 1.00 10.00 C ATOM 304 CG2 VAL A 20 -11.475 -10.947 0.748 1.00 10.00 C ATOM 0 H VAL A 20 -14.322 -11.435 0.391 1.00 10.00 H new ATOM 0 HA VAL A 20 -13.622 -11.271 2.483 1.00 10.00 H new ATOM 0 HB VAL A 20 -12.108 -8.961 1.336 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -10.260 -9.803 2.823 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -11.700 -9.326 3.754 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -11.365 -11.048 3.453 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -10.428 -10.680 0.606 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -11.541 -11.962 1.140 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -11.996 -10.892 -0.208 1.00 10.00 H new ATOM 314 N GLU A 21 -13.896 -8.058 2.976 1.00 10.00 N ATOM 315 CA GLU A 21 -14.454 -7.031 3.861 1.00 10.00 C ATOM 316 C GLU A 21 -15.923 -6.701 3.533 1.00 10.00 C ATOM 317 O GLU A 21 -16.649 -6.179 4.378 1.00 10.00 O ATOM 318 CB GLU A 21 -13.539 -5.795 3.801 1.00 10.00 C ATOM 319 CG GLU A 21 -13.819 -4.781 4.918 1.00 10.00 C ATOM 320 CD GLU A 21 -12.666 -3.781 5.047 1.00 10.00 C ATOM 321 OE1 GLU A 21 -12.613 -2.842 4.221 1.00 10.00 O ATOM 322 OE2 GLU A 21 -11.828 -3.969 5.962 1.00 10.00 O ATOM 0 H GLU A 21 -13.149 -7.706 2.377 1.00 10.00 H new ATOM 0 HA GLU A 21 -14.480 -7.409 4.883 1.00 10.00 H new ATOM 0 HB2 GLU A 21 -12.500 -6.117 3.864 1.00 10.00 H new ATOM 0 HB3 GLU A 21 -13.663 -5.305 2.835 1.00 10.00 H new ATOM 0 HG2 GLU A 21 -14.746 -4.248 4.708 1.00 10.00 H new ATOM 0 HG3 GLU A 21 -13.960 -5.305 5.864 1.00 10.00 H new ATOM 329 N LYS A 22 -16.416 -7.063 2.338 1.00 10.00 N ATOM 330 CA LYS A 22 -17.851 -7.065 2.013 1.00 10.00 C ATOM 331 C LYS A 22 -18.538 -8.329 2.560 1.00 10.00 C ATOM 332 O LYS A 22 -19.128 -9.117 1.820 1.00 10.00 O ATOM 333 CB LYS A 22 -18.060 -6.849 0.503 1.00 10.00 C ATOM 334 CG LYS A 22 -17.454 -5.543 -0.053 1.00 10.00 C ATOM 335 CD LYS A 22 -17.974 -4.248 0.601 1.00 10.00 C ATOM 336 CE LYS A 22 -17.133 -3.835 1.820 1.00 10.00 C ATOM 337 NZ LYS A 22 -17.637 -2.591 2.448 1.00 10.00 N ATOM 0 H LYS A 22 -15.825 -7.365 1.564 1.00 10.00 H new ATOM 0 HA LYS A 22 -18.336 -6.226 2.512 1.00 10.00 H new ATOM 0 HB2 LYS A 22 -17.626 -7.692 -0.034 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -19.130 -6.855 0.294 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -16.372 -5.583 0.068 1.00 10.00 H new ATOM 0 HG3 LYS A 22 -17.653 -5.496 -1.124 1.00 10.00 H new ATOM 0 HD2 LYS A 22 -17.965 -3.443 -0.134 1.00 10.00 H new ATOM 0 HD3 LYS A 22 -19.011 -4.389 0.908 1.00 10.00 H new ATOM 0 HE2 LYS A 22 -17.140 -4.640 2.555 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -16.097 -3.692 1.514 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -17.041 -2.349 3.265 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -17.607 -1.816 1.756 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 -18.617 -2.734 2.764 1.00 10.00 H new ATOM 351 N GLY A 23 -18.469 -8.507 3.882 1.00 10.00 N ATOM 352 CA GLY A 23 -19.147 -9.557 4.649 1.00 10.00 C ATOM 353 C GLY A 23 -18.512 -10.947 4.529 1.00 10.00 C ATOM 354 O GLY A 23 -18.140 -11.528 5.544 1.00 10.00 O ATOM 0 H GLY A 23 -17.912 -7.893 4.476 1.00 10.00 H new ATOM 0 HA2 GLY A 23 -19.162 -9.269 5.700 1.00 10.00 H new ATOM 0 HA3 GLY A 23 -20.184 -9.616 4.320 1.00 10.00 H new ATOM 358 N GLY A 24 -18.418 -11.481 3.305 1.00 10.00 N ATOM 359 CA GLY A 24 -17.821 -12.789 3.016 1.00 10.00 C ATOM 360 C GLY A 24 -18.736 -13.720 2.214 1.00 10.00 C ATOM 361 O GLY A 24 -19.797 -14.127 2.682 1.00 10.00 O ATOM 0 H GLY A 24 -18.762 -11.005 2.471 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -16.893 -12.641 2.463 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -17.558 -13.274 3.956 1.00 10.00 H new ATOM 365 N LYS A 25 -18.291 -14.071 1.004 1.00 10.00 N ATOM 366 CA LYS A 25 -18.903 -14.984 0.028 1.00 10.00 C ATOM 367 C LYS A 25 -17.845 -15.390 -1.020 1.00 10.00 C ATOM 368 O LYS A 25 -16.734 -14.859 -1.023 1.00 10.00 O ATOM 369 CB LYS A 25 -20.123 -14.272 -0.600 1.00 10.00 C ATOM 370 CG LYS A 25 -21.171 -15.219 -1.208 1.00 10.00 C ATOM 371 CD LYS A 25 -22.538 -14.533 -1.395 1.00 10.00 C ATOM 372 CE LYS A 25 -22.445 -13.276 -2.270 1.00 10.00 C ATOM 373 NZ LYS A 25 -23.775 -12.685 -2.544 1.00 10.00 N ATOM 0 H LYS A 25 -17.414 -13.690 0.648 1.00 10.00 H new ATOM 0 HA LYS A 25 -19.253 -15.902 0.500 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -20.604 -13.661 0.164 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -19.771 -13.593 -1.377 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -20.814 -15.582 -2.172 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -21.289 -16.090 -0.563 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -23.236 -15.237 -1.848 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -22.944 -14.265 -0.420 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -21.816 -12.536 -1.775 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -21.960 -13.527 -3.213 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -23.663 -11.839 -3.138 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -24.368 -13.380 -3.040 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -24.229 -12.420 -1.646 1.00 10.00 H new ATOM 387 N HIS A 26 -18.170 -16.332 -1.909 1.00 10.00 N ATOM 388 CA HIS A 26 -17.192 -17.028 -2.762 1.00 10.00 C ATOM 389 C HIS A 26 -17.847 -17.508 -4.076 1.00 10.00 C ATOM 390 O HIS A 26 -18.060 -18.701 -4.298 1.00 10.00 O ATOM 391 CB HIS A 26 -16.556 -18.175 -1.946 1.00 10.00 C ATOM 392 CG HIS A 26 -17.553 -19.026 -1.194 1.00 10.00 C ATOM 393 ND1 HIS A 26 -18.547 -19.783 -1.768 1.00 10.00 N ATOM 394 CD2 HIS A 26 -17.681 -19.125 0.168 1.00 10.00 C ATOM 395 CE1 HIS A 26 -19.293 -20.297 -0.778 1.00 10.00 C ATOM 396 NE2 HIS A 26 -18.810 -19.916 0.416 1.00 10.00 N ATOM 0 H HIS A 26 -19.130 -16.640 -2.062 1.00 10.00 H new ATOM 0 HA HIS A 26 -16.397 -16.346 -3.064 1.00 10.00 H new ATOM 0 HB2 HIS A 26 -15.986 -18.814 -2.621 1.00 10.00 H new ATOM 0 HB3 HIS A 26 -15.848 -17.751 -1.235 1.00 10.00 H new ATOM 0 HD1 HIS A 26 -18.691 -19.928 -2.767 1.00 10.00 H new ATOM 0 HD2 HIS A 26 -17.034 -18.678 0.908 1.00 10.00 H new ATOM 0 HE1 HIS A 26 -20.158 -20.927 -0.921 1.00 10.00 H new ATOM 404 N LYS A 27 -18.231 -16.542 -4.927 1.00 10.00 N ATOM 405 CA LYS A 27 -18.931 -16.774 -6.201 1.00 10.00 C ATOM 406 C LYS A 27 -17.965 -16.809 -7.383 1.00 10.00 C ATOM 407 O LYS A 27 -17.661 -17.889 -7.880 1.00 10.00 O ATOM 408 CB LYS A 27 -20.066 -15.754 -6.395 1.00 10.00 C ATOM 409 CG LYS A 27 -21.240 -16.079 -5.461 1.00 10.00 C ATOM 410 CD LYS A 27 -22.311 -14.987 -5.464 1.00 10.00 C ATOM 411 CE LYS A 27 -23.093 -14.885 -6.780 1.00 10.00 C ATOM 412 NZ LYS A 27 -24.177 -13.881 -6.668 1.00 10.00 N ATOM 0 H LYS A 27 -18.059 -15.554 -4.743 1.00 10.00 H new ATOM 0 HA LYS A 27 -19.390 -17.762 -6.158 1.00 10.00 H new ATOM 0 HB2 LYS A 27 -19.699 -14.748 -6.192 1.00 10.00 H new ATOM 0 HB3 LYS A 27 -20.403 -15.767 -7.432 1.00 10.00 H new ATOM 0 HG2 LYS A 27 -21.689 -17.025 -5.763 1.00 10.00 H new ATOM 0 HG3 LYS A 27 -20.866 -16.214 -4.446 1.00 10.00 H new ATOM 0 HD2 LYS A 27 -23.011 -15.177 -4.651 1.00 10.00 H new ATOM 0 HD3 LYS A 27 -21.837 -14.027 -5.259 1.00 10.00 H new ATOM 0 HE2 LYS A 27 -22.418 -14.609 -7.590 1.00 10.00 H new ATOM 0 HE3 LYS A 27 -23.516 -15.857 -7.034 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 -24.694 -13.827 -7.569 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 -24.831 -14.160 -5.909 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 -23.767 -12.951 -6.448 1.00 10.00 H new ATOM 426 N THR A 28 -17.519 -15.644 -7.863 1.00 10.00 N ATOM 427 CA THR A 28 -16.672 -15.549 -9.062 1.00 10.00 C ATOM 428 C THR A 28 -15.202 -15.837 -8.760 1.00 10.00 C ATOM 429 O THR A 28 -14.493 -16.303 -9.641 1.00 10.00 O ATOM 430 CB THR A 28 -16.792 -14.170 -9.729 1.00 10.00 C ATOM 431 OG1 THR A 28 -18.098 -13.648 -9.601 1.00 10.00 O ATOM 432 CG2 THR A 28 -16.482 -14.256 -11.227 1.00 10.00 C ATOM 0 H THR A 28 -17.732 -14.743 -7.436 1.00 10.00 H new ATOM 0 HA THR A 28 -17.037 -16.313 -9.748 1.00 10.00 H new ATOM 0 HB THR A 28 -16.076 -13.521 -9.225 1.00 10.00 H new ATOM 0 HG1 THR A 28 -18.143 -12.770 -10.033 1.00 10.00 H new ATOM 0 HG21 THR A 28 -16.574 -13.267 -11.675 1.00 10.00 H new ATOM 0 HG22 THR A 28 -15.466 -14.625 -11.368 1.00 10.00 H new ATOM 0 HG23 THR A 28 -17.185 -14.938 -11.705 1.00 10.00 H new ATOM 440 N GLY A 29 -14.762 -15.614 -7.518 1.00 10.00 N ATOM 441 CA GLY A 29 -13.531 -16.151 -6.943 1.00 10.00 C ATOM 442 C GLY A 29 -13.806 -16.739 -5.548 1.00 10.00 C ATOM 443 O GLY A 29 -14.917 -16.579 -5.029 1.00 10.00 O ATOM 0 H GLY A 29 -15.278 -15.029 -6.860 1.00 10.00 H new ATOM 0 HA2 GLY A 29 -13.123 -16.922 -7.596 1.00 10.00 H new ATOM 0 HA3 GLY A 29 -12.781 -15.363 -6.872 1.00 10.00 H new ATOM 447 N PRO A 30 -12.821 -17.395 -4.905 1.00 10.00 N ATOM 448 CA PRO A 30 -12.953 -17.841 -3.523 1.00 10.00 C ATOM 449 C PRO A 30 -12.896 -16.646 -2.562 1.00 10.00 C ATOM 450 O PRO A 30 -12.367 -15.587 -2.889 1.00 10.00 O ATOM 451 CB PRO A 30 -11.772 -18.792 -3.303 1.00 10.00 C ATOM 452 CG PRO A 30 -10.685 -18.224 -4.214 1.00 10.00 C ATOM 453 CD PRO A 30 -11.474 -17.653 -5.393 1.00 10.00 C ATOM 0 HA PRO A 30 -13.907 -18.334 -3.334 1.00 10.00 H new ATOM 0 HB2 PRO A 30 -11.456 -18.805 -2.260 1.00 10.00 H new ATOM 0 HB3 PRO A 30 -12.026 -19.817 -3.572 1.00 10.00 H new ATOM 0 HG2 PRO A 30 -10.101 -17.454 -3.711 1.00 10.00 H new ATOM 0 HG3 PRO A 30 -9.985 -18.996 -4.535 1.00 10.00 H new ATOM 0 HD2 PRO A 30 -11.013 -16.736 -5.761 1.00 10.00 H new ATOM 0 HD3 PRO A 30 -11.491 -18.357 -6.225 1.00 10.00 H new ATOM 461 N ASN A 31 -13.374 -16.822 -1.333 1.00 10.00 N ATOM 462 CA ASN A 31 -13.118 -15.868 -0.257 1.00 10.00 C ATOM 463 C ASN A 31 -11.612 -15.843 0.068 1.00 10.00 C ATOM 464 O ASN A 31 -11.038 -16.883 0.397 1.00 10.00 O ATOM 465 CB ASN A 31 -13.987 -16.209 0.977 1.00 10.00 C ATOM 466 CG ASN A 31 -14.051 -17.673 1.425 1.00 10.00 C ATOM 467 OD1 ASN A 31 -15.018 -18.096 2.032 1.00 10.00 O ATOM 468 ND2 ASN A 31 -13.055 -18.493 1.162 1.00 10.00 N ATOM 0 H ASN A 31 -13.944 -17.621 -1.056 1.00 10.00 H new ATOM 0 HA ASN A 31 -13.400 -14.864 -0.575 1.00 10.00 H new ATOM 0 HB2 ASN A 31 -13.622 -15.618 1.817 1.00 10.00 H new ATOM 0 HB3 ASN A 31 -15.005 -15.877 0.772 1.00 10.00 H new ATOM 0 HD21 ASN A 31 -13.101 -19.466 1.466 1.00 10.00 H new ATOM 0 HD22 ASN A 31 -12.237 -18.156 0.654 1.00 10.00 H new ATOM 475 N LEU A 32 -10.963 -14.673 0.033 1.00 10.00 N ATOM 476 CA LEU A 32 -9.650 -14.518 0.666 1.00 10.00 C ATOM 477 C LEU A 32 -9.860 -14.386 2.186 1.00 10.00 C ATOM 478 O LEU A 32 -9.757 -13.305 2.765 1.00 10.00 O ATOM 479 CB LEU A 32 -8.819 -13.368 0.068 1.00 10.00 C ATOM 480 CG LEU A 32 -8.274 -13.597 -1.354 1.00 10.00 C ATOM 481 CD1 LEU A 32 -9.325 -13.414 -2.446 1.00 10.00 C ATOM 482 CD2 LEU A 32 -7.168 -12.575 -1.623 1.00 10.00 C ATOM 0 H LEU A 32 -11.320 -13.832 -0.420 1.00 10.00 H new ATOM 0 HA LEU A 32 -9.049 -15.405 0.463 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -9.434 -12.468 0.059 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -7.977 -13.172 0.731 1.00 10.00 H new ATOM 0 HG LEU A 32 -7.922 -14.628 -1.389 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -8.871 -13.591 -3.421 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -10.138 -14.123 -2.291 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -9.717 -12.398 -2.407 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -6.771 -12.724 -2.627 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -7.576 -11.567 -1.540 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -6.368 -12.704 -0.894 1.00 10.00 H new ATOM 494 N HIS A 33 -10.169 -15.522 2.819 1.00 10.00 N ATOM 495 CA HIS A 33 -9.989 -15.774 4.242 1.00 10.00 C ATOM 496 C HIS A 33 -8.488 -15.815 4.570 1.00 10.00 C ATOM 497 O HIS A 33 -7.658 -15.531 3.707 1.00 10.00 O ATOM 498 CB HIS A 33 -10.694 -17.104 4.575 1.00 10.00 C ATOM 499 CG HIS A 33 -10.382 -18.274 3.658 1.00 10.00 C ATOM 500 ND1 HIS A 33 -9.364 -18.382 2.725 1.00 10.00 N ATOM 501 CD2 HIS A 33 -11.192 -19.364 3.499 1.00 10.00 C ATOM 502 CE1 HIS A 33 -9.614 -19.476 1.985 1.00 10.00 C ATOM 503 NE2 HIS A 33 -10.701 -20.121 2.436 1.00 10.00 N ATOM 0 H HIS A 33 -10.568 -16.322 2.328 1.00 10.00 H new ATOM 0 HA HIS A 33 -10.427 -14.981 4.848 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -10.429 -17.387 5.594 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -11.771 -16.935 4.561 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -12.062 -19.598 4.094 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -9.020 -19.793 1.141 1.00 10.00 H new ATOM 0 HE2 HIS A 33 -11.090 -20.991 2.074 1.00 10.00 H new ATOM 511 N GLY A 34 -8.137 -16.222 5.795 1.00 10.00 N ATOM 512 CA GLY A 34 -6.790 -16.658 6.160 1.00 10.00 C ATOM 513 C GLY A 34 -6.063 -17.351 4.997 1.00 10.00 C ATOM 514 O GLY A 34 -6.479 -18.431 4.567 1.00 10.00 O ATOM 0 H GLY A 34 -8.796 -16.257 6.573 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.208 -15.796 6.487 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.849 -17.342 7.007 1.00 10.00 H new ATOM 518 N LEU A 35 -4.986 -16.728 4.510 1.00 10.00 N ATOM 519 CA LEU A 35 -4.220 -17.149 3.337 1.00 10.00 C ATOM 520 C LEU A 35 -2.709 -17.059 3.574 1.00 10.00 C ATOM 521 O LEU A 35 -1.983 -17.996 3.242 1.00 10.00 O ATOM 522 CB LEU A 35 -4.631 -16.282 2.121 1.00 10.00 C ATOM 523 CG LEU A 35 -4.869 -17.085 0.837 1.00 10.00 C ATOM 524 CD1 LEU A 35 -6.117 -17.974 0.919 1.00 10.00 C ATOM 525 CD2 LEU A 35 -5.046 -16.124 -0.341 1.00 10.00 C ATOM 0 H LEU A 35 -4.610 -15.883 4.940 1.00 10.00 H new ATOM 0 HA LEU A 35 -4.448 -18.196 3.139 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -5.540 -15.734 2.369 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -3.853 -15.542 1.936 1.00 10.00 H new ATOM 0 HG LEU A 35 -4.000 -17.728 0.701 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -6.237 -18.520 -0.017 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -6.006 -18.682 1.740 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -6.996 -17.353 1.092 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -5.215 -16.695 -1.254 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -5.901 -15.475 -0.155 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -4.148 -15.517 -0.454 1.00 10.00 H new ATOM 537 N PHE A 36 -2.230 -15.939 4.130 1.00 10.00 N ATOM 538 CA PHE A 36 -0.805 -15.612 4.185 1.00 10.00 C ATOM 539 C PHE A 36 -0.095 -16.534 5.182 1.00 10.00 C ATOM 540 O PHE A 36 -0.322 -16.451 6.387 1.00 10.00 O ATOM 541 CB PHE A 36 -0.572 -14.135 4.545 1.00 10.00 C ATOM 542 CG PHE A 36 -0.845 -13.096 3.456 1.00 10.00 C ATOM 543 CD1 PHE A 36 -1.979 -13.162 2.622 1.00 10.00 C ATOM 544 CD2 PHE A 36 0.065 -12.037 3.269 1.00 10.00 C ATOM 545 CE1 PHE A 36 -2.155 -12.242 1.574 1.00 10.00 C ATOM 546 CE2 PHE A 36 -0.110 -11.110 2.226 1.00 10.00 C ATOM 547 CZ PHE A 36 -1.216 -11.220 1.369 1.00 10.00 C ATOM 0 H PHE A 36 -2.827 -15.231 4.557 1.00 10.00 H new ATOM 0 HA PHE A 36 -0.384 -15.770 3.192 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -1.197 -13.895 5.405 1.00 10.00 H new ATOM 0 HB3 PHE A 36 0.464 -14.025 4.864 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -2.721 -13.928 2.790 1.00 10.00 H new ATOM 0 HD2 PHE A 36 0.909 -11.936 3.936 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -3.015 -12.322 0.925 1.00 10.00 H new ATOM 0 HE2 PHE A 36 0.606 -10.314 2.085 1.00 10.00 H new ATOM 0 HZ PHE A 36 -1.344 -10.521 0.556 1.00 10.00 H new ATOM 557 N GLY A 37 0.729 -17.447 4.665 1.00 10.00 N ATOM 558 CA GLY A 37 1.388 -18.484 5.455 1.00 10.00 C ATOM 559 C GLY A 37 0.507 -19.708 5.730 1.00 10.00 C ATOM 560 O GLY A 37 0.951 -20.606 6.443 1.00 10.00 O ATOM 0 H GLY A 37 0.959 -17.486 3.672 1.00 10.00 H new ATOM 0 HA2 GLY A 37 2.289 -18.807 4.934 1.00 10.00 H new ATOM 0 HA3 GLY A 37 1.706 -18.056 6.406 1.00 10.00 H new ATOM 564 N ARG A 38 -0.717 -19.769 5.171 1.00 10.00 N ATOM 565 CA ARG A 38 -1.550 -20.978 5.183 1.00 10.00 C ATOM 566 C ARG A 38 -1.095 -21.910 4.059 1.00 10.00 C ATOM 567 O ARG A 38 -0.095 -22.593 4.272 1.00 10.00 O ATOM 568 CB ARG A 38 -3.051 -20.632 5.259 1.00 10.00 C ATOM 569 CG ARG A 38 -3.400 -20.225 6.709 1.00 10.00 C ATOM 570 CD ARG A 38 -4.845 -19.748 6.970 1.00 10.00 C ATOM 571 NE ARG A 38 -5.883 -20.550 6.280 1.00 10.00 N ATOM 572 CZ ARG A 38 -6.001 -21.866 6.426 1.00 10.00 C ATOM 573 NH1 ARG A 38 -5.537 -22.496 7.479 1.00 10.00 N ATOM 574 NH2 ARG A 38 -6.505 -22.594 5.474 1.00 10.00 N ATOM 0 H ARG A 38 -1.153 -18.977 4.698 1.00 10.00 H new ATOM 0 HA ARG A 38 -1.407 -21.555 6.097 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -3.285 -19.818 4.573 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -3.651 -21.489 4.954 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -3.201 -21.078 7.358 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -2.720 -19.429 7.011 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -5.036 -19.773 8.043 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -4.935 -18.709 6.654 1.00 10.00 H new ATOM 0 HE ARG A 38 -6.538 -20.069 5.664 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -5.068 -21.975 8.219 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -5.646 -23.507 7.557 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -6.814 -22.156 4.606 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -6.592 -23.603 5.595 1.00 10.00 H new ATOM 588 N LYS A 39 -1.735 -21.920 2.879 1.00 10.00 N ATOM 589 CA LYS A 39 -1.300 -22.692 1.685 1.00 10.00 C ATOM 590 C LYS A 39 -1.777 -22.004 0.384 1.00 10.00 C ATOM 591 O LYS A 39 -1.402 -20.866 0.105 1.00 10.00 O ATOM 592 CB LYS A 39 -1.726 -24.197 1.728 1.00 10.00 C ATOM 593 CG LYS A 39 -1.410 -25.045 2.965 1.00 10.00 C ATOM 594 CD LYS A 39 0.077 -25.391 3.155 1.00 10.00 C ATOM 595 CE LYS A 39 0.375 -25.917 4.571 1.00 10.00 C ATOM 596 NZ LYS A 39 -0.016 -24.944 5.622 1.00 10.00 N ATOM 0 H LYS A 39 -2.587 -21.384 2.716 1.00 10.00 H new ATOM 0 HA LYS A 39 -0.210 -22.695 1.698 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -2.805 -24.234 1.576 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -1.267 -24.689 0.871 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -1.760 -24.513 3.850 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -1.979 -25.973 2.905 1.00 10.00 H new ATOM 0 HD2 LYS A 39 0.370 -26.142 2.421 1.00 10.00 H new ATOM 0 HD3 LYS A 39 0.682 -24.505 2.964 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -0.159 -26.854 4.729 1.00 10.00 H new ATOM 0 HE3 LYS A 39 1.439 -26.137 4.659 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 0.539 -25.122 6.483 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 0.167 -23.977 5.285 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -1.028 -25.051 5.834 1.00 10.00 H new ATOM 610 N THR A 40 -2.584 -22.694 -0.425 1.00 10.00 N ATOM 611 CA THR A 40 -3.202 -22.289 -1.695 1.00 10.00 C ATOM 612 C THR A 40 -4.549 -23.028 -1.795 1.00 10.00 C ATOM 613 O THR A 40 -4.784 -23.963 -1.024 1.00 10.00 O ATOM 614 CB THR A 40 -2.264 -22.678 -2.862 1.00 10.00 C ATOM 615 OG1 THR A 40 -0.948 -22.242 -2.592 1.00 10.00 O ATOM 616 CG2 THR A 40 -2.621 -22.067 -4.218 1.00 10.00 C ATOM 0 H THR A 40 -2.850 -23.649 -0.184 1.00 10.00 H new ATOM 0 HA THR A 40 -3.365 -21.212 -1.743 1.00 10.00 H new ATOM 0 HB THR A 40 -2.368 -23.761 -2.929 1.00 10.00 H new ATOM 0 HG1 THR A 40 -0.871 -21.287 -2.799 1.00 10.00 H new ATOM 0 HG21 THR A 40 -1.904 -22.401 -4.968 1.00 10.00 H new ATOM 0 HG22 THR A 40 -3.623 -22.384 -4.508 1.00 10.00 H new ATOM 0 HG23 THR A 40 -2.591 -20.980 -4.146 1.00 10.00 H new ATOM 624 N GLY A 41 -5.444 -22.632 -2.705 1.00 10.00 N ATOM 625 CA GLY A 41 -6.512 -23.469 -3.266 1.00 10.00 C ATOM 626 C GLY A 41 -7.663 -23.900 -2.357 1.00 10.00 C ATOM 627 O GLY A 41 -8.594 -24.561 -2.814 1.00 10.00 O ATOM 0 H GLY A 41 -5.446 -21.686 -3.086 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -6.942 -22.932 -4.112 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -6.049 -24.372 -3.664 1.00 10.00 H new ATOM 631 N GLN A 42 -7.587 -23.546 -1.083 1.00 10.00 N ATOM 632 CA GLN A 42 -8.610 -23.738 -0.067 1.00 10.00 C ATOM 633 C GLN A 42 -9.825 -22.836 -0.324 1.00 10.00 C ATOM 634 O GLN A 42 -9.693 -21.619 -0.447 1.00 10.00 O ATOM 635 CB GLN A 42 -7.981 -23.499 1.316 1.00 10.00 C ATOM 636 CG GLN A 42 -7.323 -22.112 1.481 1.00 10.00 C ATOM 637 CD GLN A 42 -5.950 -22.162 2.129 1.00 10.00 C ATOM 638 OE1 GLN A 42 -5.710 -21.532 3.147 1.00 10.00 O ATOM 639 NE2 GLN A 42 -5.003 -22.912 1.606 1.00 10.00 N ATOM 0 H GLN A 42 -6.756 -23.088 -0.708 1.00 10.00 H new ATOM 0 HA GLN A 42 -8.985 -24.761 -0.106 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -8.751 -23.616 2.078 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -7.231 -24.269 1.500 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -7.236 -21.642 0.501 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -7.976 -21.479 2.082 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -5.186 -23.445 0.756 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -4.086 -22.960 2.051 1.00 10.00 H new ATOM 648 N ALA A 43 -11.007 -23.451 -0.400 1.00 10.00 N ATOM 649 CA ALA A 43 -12.304 -22.797 -0.528 1.00 10.00 C ATOM 650 C ALA A 43 -13.408 -23.813 -0.173 1.00 10.00 C ATOM 651 O ALA A 43 -13.168 -25.019 -0.266 1.00 10.00 O ATOM 652 CB ALA A 43 -12.480 -22.321 -1.977 1.00 10.00 C ATOM 0 H ALA A 43 -11.086 -24.468 -0.372 1.00 10.00 H new ATOM 0 HA ALA A 43 -12.367 -21.941 0.144 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -13.447 -21.830 -2.084 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -11.686 -21.617 -2.228 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -12.431 -23.177 -2.650 1.00 10.00 H new ATOM 658 N PRO A 44 -14.609 -23.353 0.225 1.00 10.00 N ATOM 659 CA PRO A 44 -15.793 -24.194 0.389 1.00 10.00 C ATOM 660 C PRO A 44 -16.502 -24.379 -0.977 1.00 10.00 C ATOM 661 O PRO A 44 -15.904 -24.897 -1.919 1.00 10.00 O ATOM 662 CB PRO A 44 -16.606 -23.455 1.464 1.00 10.00 C ATOM 663 CG PRO A 44 -16.347 -21.994 1.101 1.00 10.00 C ATOM 664 CD PRO A 44 -14.883 -21.994 0.673 1.00 10.00 C ATOM 0 HA PRO A 44 -15.601 -25.218 0.710 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -17.666 -23.706 1.420 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -16.264 -23.693 2.471 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -17.001 -21.657 0.297 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -16.518 -21.332 1.950 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -14.708 -21.274 -0.127 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -14.232 -21.715 1.501 1.00 10.00 H new ATOM 672 N GLY A 45 -17.765 -23.950 -1.119 1.00 10.00 N ATOM 673 CA GLY A 45 -18.547 -24.040 -2.354 1.00 10.00 C ATOM 674 C GLY A 45 -18.094 -23.043 -3.426 1.00 10.00 C ATOM 675 O GLY A 45 -18.780 -22.050 -3.667 1.00 10.00 O ATOM 0 H GLY A 45 -18.283 -23.519 -0.353 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -18.471 -25.052 -2.752 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -19.598 -23.865 -2.125 1.00 10.00 H new ATOM 679 N PHE A 46 -16.955 -23.317 -4.070 1.00 10.00 N ATOM 680 CA PHE A 46 -16.407 -22.533 -5.178 1.00 10.00 C ATOM 681 C PHE A 46 -15.704 -23.427 -6.219 1.00 10.00 C ATOM 682 O PHE A 46 -14.619 -23.952 -5.977 1.00 10.00 O ATOM 683 CB PHE A 46 -15.455 -21.459 -4.636 1.00 10.00 C ATOM 684 CG PHE A 46 -14.712 -20.732 -5.734 1.00 10.00 C ATOM 685 CD1 PHE A 46 -15.421 -19.944 -6.653 1.00 10.00 C ATOM 686 CD2 PHE A 46 -13.333 -20.929 -5.904 1.00 10.00 C ATOM 687 CE1 PHE A 46 -14.755 -19.397 -7.762 1.00 10.00 C ATOM 688 CE2 PHE A 46 -12.668 -20.341 -6.995 1.00 10.00 C ATOM 689 CZ PHE A 46 -13.380 -19.591 -7.935 1.00 10.00 C ATOM 0 H PHE A 46 -16.371 -24.117 -3.825 1.00 10.00 H new ATOM 0 HA PHE A 46 -17.235 -22.043 -5.691 1.00 10.00 H new ATOM 0 HB2 PHE A 46 -16.023 -20.738 -4.048 1.00 10.00 H new ATOM 0 HB3 PHE A 46 -14.736 -21.923 -3.962 1.00 10.00 H new ATOM 0 HD1 PHE A 46 -16.475 -19.759 -6.508 1.00 10.00 H new ATOM 0 HD2 PHE A 46 -12.782 -21.532 -5.197 1.00 10.00 H new ATOM 0 HE1 PHE A 46 -15.309 -18.821 -8.488 1.00 10.00 H new ATOM 0 HE2 PHE A 46 -11.602 -20.470 -7.107 1.00 10.00 H new ATOM 0 HZ PHE A 46 -12.873 -19.165 -8.788 1.00 10.00 H new ATOM 699 N THR A 47 -16.335 -23.603 -7.385 1.00 10.00 N ATOM 700 CA THR A 47 -15.817 -24.400 -8.507 1.00 10.00 C ATOM 701 C THR A 47 -14.774 -23.619 -9.319 1.00 10.00 C ATOM 702 O THR A 47 -15.127 -22.872 -10.230 1.00 10.00 O ATOM 703 CB THR A 47 -16.967 -24.856 -9.423 1.00 10.00 C ATOM 704 OG1 THR A 47 -17.974 -25.481 -8.659 1.00 10.00 O ATOM 705 CG2 THR A 47 -16.514 -25.870 -10.476 1.00 10.00 C ATOM 0 H THR A 47 -17.244 -23.185 -7.582 1.00 10.00 H new ATOM 0 HA THR A 47 -15.328 -25.279 -8.087 1.00 10.00 H new ATOM 0 HB THR A 47 -17.332 -23.958 -9.921 1.00 10.00 H new ATOM 0 HG1 THR A 47 -18.703 -25.766 -9.249 1.00 10.00 H new ATOM 0 HG21 THR A 47 -17.365 -26.157 -11.094 1.00 10.00 H new ATOM 0 HG22 THR A 47 -15.744 -25.423 -11.104 1.00 10.00 H new ATOM 0 HG23 THR A 47 -16.111 -26.753 -9.981 1.00 10.00 H new ATOM 713 N TYR A 48 -13.487 -23.816 -9.014 1.00 10.00 N ATOM 714 CA TYR A 48 -12.371 -23.329 -9.834 1.00 10.00 C ATOM 715 C TYR A 48 -12.013 -24.271 -11.000 1.00 10.00 C ATOM 716 O TYR A 48 -12.515 -25.387 -11.109 1.00 10.00 O ATOM 717 CB TYR A 48 -11.143 -23.055 -8.946 1.00 10.00 C ATOM 718 CG TYR A 48 -10.945 -23.936 -7.722 1.00 10.00 C ATOM 719 CD1 TYR A 48 -10.810 -25.336 -7.835 1.00 10.00 C ATOM 720 CD2 TYR A 48 -10.831 -23.323 -6.461 1.00 10.00 C ATOM 721 CE1 TYR A 48 -10.501 -26.105 -6.694 1.00 10.00 C ATOM 722 CE2 TYR A 48 -10.488 -24.077 -5.327 1.00 10.00 C ATOM 723 CZ TYR A 48 -10.292 -25.469 -5.448 1.00 10.00 C ATOM 724 OH TYR A 48 -9.800 -26.173 -4.392 1.00 10.00 O ATOM 0 H TYR A 48 -13.187 -24.324 -8.182 1.00 10.00 H new ATOM 0 HA TYR A 48 -12.699 -22.397 -10.295 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -10.253 -23.141 -9.569 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -11.197 -22.020 -8.609 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -10.943 -25.817 -8.793 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -11.009 -22.262 -6.364 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -10.424 -27.179 -6.772 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -10.375 -23.594 -4.368 1.00 10.00 H new ATOM 0 HH TYR A 48 -9.688 -25.575 -3.624 1.00 10.00 H new ATOM 734 N THR A 49 -11.099 -23.808 -11.861 1.00 10.00 N ATOM 735 CA THR A 49 -10.554 -24.461 -13.065 1.00 10.00 C ATOM 736 C THR A 49 -9.651 -25.675 -12.810 1.00 10.00 C ATOM 737 O THR A 49 -9.246 -26.341 -13.761 1.00 10.00 O ATOM 738 CB THR A 49 -9.711 -23.431 -13.832 1.00 10.00 C ATOM 739 OG1 THR A 49 -8.815 -22.797 -12.942 1.00 10.00 O ATOM 740 CG2 THR A 49 -10.565 -22.343 -14.482 1.00 10.00 C ATOM 0 H THR A 49 -10.683 -22.887 -11.724 1.00 10.00 H new ATOM 0 HA THR A 49 -11.423 -24.826 -13.613 1.00 10.00 H new ATOM 0 HB THR A 49 -9.184 -23.976 -14.615 1.00 10.00 H new ATOM 0 HG1 THR A 49 -8.294 -22.123 -13.427 1.00 10.00 H new ATOM 0 HG21 THR A 49 -9.920 -21.641 -15.011 1.00 10.00 H new ATOM 0 HG22 THR A 49 -11.260 -22.799 -15.187 1.00 10.00 H new ATOM 0 HG23 THR A 49 -11.125 -21.812 -13.712 1.00 10.00 H new ATOM 748 N ASP A 50 -9.351 -25.975 -11.544 1.00 10.00 N ATOM 749 CA ASP A 50 -8.213 -26.777 -11.087 1.00 10.00 C ATOM 750 C ASP A 50 -6.857 -26.378 -11.733 1.00 10.00 C ATOM 751 O ASP A 50 -6.707 -25.289 -12.286 1.00 10.00 O ATOM 752 CB ASP A 50 -8.574 -28.280 -11.181 1.00 10.00 C ATOM 753 CG ASP A 50 -7.955 -29.102 -10.044 1.00 10.00 C ATOM 754 OD1 ASP A 50 -6.713 -29.251 -10.019 1.00 10.00 O ATOM 755 OD2 ASP A 50 -8.679 -29.476 -9.095 1.00 10.00 O ATOM 0 H ASP A 50 -9.926 -25.647 -10.768 1.00 10.00 H new ATOM 0 HA ASP A 50 -8.030 -26.555 -10.036 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -9.658 -28.393 -11.159 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -8.232 -28.674 -12.138 1.00 10.00 H new ATOM 760 N ALA A 51 -5.818 -27.200 -11.531 1.00 10.00 N ATOM 761 CA ALA A 51 -4.390 -26.970 -11.770 1.00 10.00 C ATOM 762 C ALA A 51 -3.769 -25.800 -10.979 1.00 10.00 C ATOM 763 O ALA A 51 -2.689 -25.978 -10.418 1.00 10.00 O ATOM 764 CB ALA A 51 -4.097 -26.906 -13.274 1.00 10.00 C ATOM 0 H ALA A 51 -5.975 -28.136 -11.159 1.00 10.00 H new ATOM 0 HA ALA A 51 -3.876 -27.839 -11.358 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -3.032 -26.735 -13.430 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -4.385 -27.848 -13.741 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -4.665 -26.090 -13.721 1.00 10.00 H new ATOM 770 N ASN A 52 -4.436 -24.644 -10.868 1.00 10.00 N ATOM 771 CA ASN A 52 -3.931 -23.448 -10.188 1.00 10.00 C ATOM 772 C ASN A 52 -3.605 -23.746 -8.711 1.00 10.00 C ATOM 773 O ASN A 52 -2.441 -23.738 -8.303 1.00 10.00 O ATOM 774 CB ASN A 52 -4.867 -22.244 -10.466 1.00 10.00 C ATOM 775 CG ASN A 52 -5.842 -21.884 -9.353 1.00 10.00 C ATOM 776 OD1 ASN A 52 -6.702 -22.675 -8.993 1.00 10.00 O ATOM 777 ND2 ASN A 52 -5.670 -20.734 -8.738 1.00 10.00 N ATOM 0 H ASN A 52 -5.368 -24.513 -11.261 1.00 10.00 H new ATOM 0 HA ASN A 52 -2.968 -23.144 -10.599 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -4.250 -21.371 -10.677 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -5.440 -22.456 -11.369 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -6.260 -20.487 -7.944 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -4.946 -20.089 -9.055 1.00 10.00 H new ATOM 784 N LYS A 53 -4.630 -24.145 -7.952 1.00 10.00 N ATOM 785 CA LYS A 53 -4.568 -24.712 -6.609 1.00 10.00 C ATOM 786 C LYS A 53 -3.576 -25.863 -6.511 1.00 10.00 C ATOM 787 O LYS A 53 -2.810 -25.939 -5.555 1.00 10.00 O ATOM 788 CB LYS A 53 -5.982 -25.088 -6.142 1.00 10.00 C ATOM 789 CG LYS A 53 -7.013 -25.656 -7.125 1.00 10.00 C ATOM 790 CD LYS A 53 -6.867 -27.097 -7.617 1.00 10.00 C ATOM 791 CE LYS A 53 -6.717 -28.182 -6.544 1.00 10.00 C ATOM 792 NZ LYS A 53 -6.803 -29.536 -7.151 1.00 10.00 N ATOM 0 H LYS A 53 -5.591 -24.074 -8.287 1.00 10.00 H new ATOM 0 HA LYS A 53 -4.183 -23.955 -5.926 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -5.870 -25.817 -5.340 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -6.421 -24.193 -5.700 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -7.994 -25.568 -6.658 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -7.019 -25.010 -8.003 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -7.739 -27.338 -8.225 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -5.998 -27.146 -8.273 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -5.761 -28.067 -6.034 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -7.496 -28.066 -5.790 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -6.938 -30.244 -6.402 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -7.607 -29.571 -7.809 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -5.924 -29.741 -7.667 1.00 10.00 H new ATOM 806 N ASN A 54 -3.586 -26.746 -7.508 1.00 10.00 N ATOM 807 CA ASN A 54 -2.727 -27.917 -7.587 1.00 10.00 C ATOM 808 C ASN A 54 -1.229 -27.626 -7.771 1.00 10.00 C ATOM 809 O ASN A 54 -0.428 -28.523 -7.506 1.00 10.00 O ATOM 810 CB ASN A 54 -3.261 -28.876 -8.662 1.00 10.00 C ATOM 811 CG ASN A 54 -3.340 -30.279 -8.097 1.00 10.00 C ATOM 812 OD1 ASN A 54 -4.422 -30.794 -7.857 1.00 10.00 O ATOM 813 ND2 ASN A 54 -2.207 -30.871 -7.780 1.00 10.00 N ATOM 0 H ASN A 54 -4.214 -26.660 -8.307 1.00 10.00 H new ATOM 0 HA ASN A 54 -2.774 -28.391 -6.607 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -4.247 -28.552 -8.996 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -2.608 -28.861 -9.534 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -2.218 -31.782 -7.322 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -1.318 -30.418 -7.992 1.00 10.00 H new ATOM 820 N LYS A 55 -0.848 -26.415 -8.210 1.00 10.00 N ATOM 821 CA LYS A 55 0.548 -25.952 -8.228 1.00 10.00 C ATOM 822 C LYS A 55 1.032 -25.591 -6.813 1.00 10.00 C ATOM 823 O LYS A 55 2.202 -25.790 -6.499 1.00 10.00 O ATOM 824 CB LYS A 55 0.695 -24.766 -9.205 1.00 10.00 C ATOM 825 CG LYS A 55 2.013 -24.754 -10.004 1.00 10.00 C ATOM 826 CD LYS A 55 3.283 -24.815 -9.146 1.00 10.00 C ATOM 827 CE LYS A 55 4.535 -24.465 -9.953 1.00 10.00 C ATOM 828 NZ LYS A 55 5.750 -24.550 -9.107 1.00 10.00 N ATOM 0 H LYS A 55 -1.508 -25.723 -8.566 1.00 10.00 H new ATOM 0 HA LYS A 55 1.184 -26.764 -8.581 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -0.140 -24.784 -9.906 1.00 10.00 H new ATOM 0 HB3 LYS A 55 0.618 -23.836 -8.642 1.00 10.00 H new ATOM 0 HG2 LYS A 55 2.014 -25.601 -10.690 1.00 10.00 H new ATOM 0 HG3 LYS A 55 2.045 -23.850 -10.613 1.00 10.00 H new ATOM 0 HD2 LYS A 55 3.188 -24.126 -8.307 1.00 10.00 H new ATOM 0 HD3 LYS A 55 3.390 -25.815 -8.726 1.00 10.00 H new ATOM 0 HE2 LYS A 55 4.628 -25.145 -10.800 1.00 10.00 H new ATOM 0 HE3 LYS A 55 4.440 -23.459 -10.361 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 6.587 -24.308 -9.676 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 5.667 -23.884 -8.313 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 5.849 -25.517 -8.739 1.00 10.00 H new ATOM 842 N GLY A 56 0.133 -25.097 -5.954 1.00 10.00 N ATOM 843 CA GLY A 56 0.338 -25.065 -4.498 1.00 10.00 C ATOM 844 C GLY A 56 1.463 -24.149 -3.989 1.00 10.00 C ATOM 845 O GLY A 56 2.038 -24.427 -2.939 1.00 10.00 O ATOM 0 H GLY A 56 -0.762 -24.706 -6.249 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -0.595 -24.755 -4.028 1.00 10.00 H new ATOM 0 HA3 GLY A 56 0.544 -26.080 -4.159 1.00 10.00 H new ATOM 849 N ILE A 57 1.775 -23.065 -4.715 1.00 10.00 N ATOM 850 CA ILE A 57 2.900 -22.132 -4.495 1.00 10.00 C ATOM 851 C ILE A 57 2.999 -21.488 -3.098 1.00 10.00 C ATOM 852 O ILE A 57 4.018 -20.871 -2.803 1.00 10.00 O ATOM 853 CB ILE A 57 2.946 -21.025 -5.581 1.00 10.00 C ATOM 854 CG1 ILE A 57 1.843 -19.946 -5.485 1.00 10.00 C ATOM 855 CG2 ILE A 57 3.030 -21.618 -6.997 1.00 10.00 C ATOM 856 CD1 ILE A 57 0.397 -20.448 -5.509 1.00 10.00 C ATOM 0 H ILE A 57 1.215 -22.796 -5.524 1.00 10.00 H new ATOM 0 HA ILE A 57 3.770 -22.784 -4.570 1.00 10.00 H new ATOM 0 HB ILE A 57 3.870 -20.487 -5.368 1.00 10.00 H new ATOM 0 HG12 ILE A 57 1.994 -19.384 -4.564 1.00 10.00 H new ATOM 0 HG13 ILE A 57 1.976 -19.247 -6.311 1.00 10.00 H new ATOM 0 HG21 ILE A 57 3.060 -20.810 -7.728 1.00 10.00 H new ATOM 0 HG22 ILE A 57 3.933 -22.222 -7.086 1.00 10.00 H new ATOM 0 HG23 ILE A 57 2.156 -22.243 -7.182 1.00 10.00 H new ATOM 0 HD11 ILE A 57 -0.284 -19.600 -5.435 1.00 10.00 H new ATOM 0 HD12 ILE A 57 0.213 -20.982 -6.441 1.00 10.00 H new ATOM 0 HD13 ILE A 57 0.231 -21.120 -4.667 1.00 10.00 H new ATOM 868 N THR A 58 2.004 -21.675 -2.223 1.00 10.00 N ATOM 869 CA THR A 58 1.844 -21.058 -0.899 1.00 10.00 C ATOM 870 C THR A 58 1.818 -19.523 -0.914 1.00 10.00 C ATOM 871 O THR A 58 2.812 -18.823 -1.131 1.00 10.00 O ATOM 872 CB THR A 58 2.858 -21.634 0.100 1.00 10.00 C ATOM 873 OG1 THR A 58 2.644 -23.028 0.168 1.00 10.00 O ATOM 874 CG2 THR A 58 2.683 -21.076 1.516 1.00 10.00 C ATOM 0 H THR A 58 1.233 -22.308 -2.436 1.00 10.00 H new ATOM 0 HA THR A 58 0.846 -21.330 -0.554 1.00 10.00 H new ATOM 0 HB THR A 58 3.856 -21.367 -0.247 1.00 10.00 H new ATOM 0 HG1 THR A 58 3.280 -23.426 0.799 1.00 10.00 H new ATOM 0 HG21 THR A 58 3.428 -21.520 2.177 1.00 10.00 H new ATOM 0 HG22 THR A 58 2.812 -19.994 1.499 1.00 10.00 H new ATOM 0 HG23 THR A 58 1.685 -21.317 1.881 1.00 10.00 H new ATOM 882 N TRP A 59 0.618 -18.994 -0.665 1.00 10.00 N ATOM 883 CA TRP A 59 0.352 -17.577 -0.459 1.00 10.00 C ATOM 884 C TRP A 59 1.010 -17.086 0.840 1.00 10.00 C ATOM 885 O TRP A 59 0.913 -17.746 1.876 1.00 10.00 O ATOM 886 CB TRP A 59 -1.171 -17.383 -0.429 1.00 10.00 C ATOM 887 CG TRP A 59 -1.914 -17.804 -1.672 1.00 10.00 C ATOM 888 CD1 TRP A 59 -3.005 -18.604 -1.701 1.00 10.00 C ATOM 889 CD2 TRP A 59 -1.628 -17.498 -3.075 1.00 10.00 C ATOM 890 NE1 TRP A 59 -3.453 -18.743 -2.998 1.00 10.00 N ATOM 891 CE2 TRP A 59 -2.611 -18.133 -3.893 1.00 10.00 C ATOM 892 CE3 TRP A 59 -0.625 -16.770 -3.746 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -2.598 -18.071 -5.295 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -0.583 -16.718 -5.151 1.00 10.00 C ATOM 895 CH2 TRP A 59 -1.567 -17.362 -5.922 1.00 10.00 C ATOM 0 H TRP A 59 -0.224 -19.566 -0.600 1.00 10.00 H new ATOM 0 HA TRP A 59 0.779 -16.986 -1.270 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -1.572 -17.941 0.417 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -1.380 -16.329 -0.244 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -3.458 -19.066 -0.836 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -4.305 -19.238 -3.260 1.00 10.00 H new ATOM 0 HE3 TRP A 59 0.123 -16.244 -3.172 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -3.366 -18.559 -5.877 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 0.213 -16.178 -5.642 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -1.527 -17.309 -7.000 1.00 10.00 H new ATOM 906 N LYS A 60 1.673 -15.918 0.791 1.00 10.00 N ATOM 907 CA LYS A 60 2.340 -15.303 1.960 1.00 10.00 C ATOM 908 C LYS A 60 2.707 -13.822 1.818 1.00 10.00 C ATOM 909 O LYS A 60 2.764 -13.154 2.840 1.00 10.00 O ATOM 910 CB LYS A 60 3.548 -16.143 2.454 1.00 10.00 C ATOM 911 CG LYS A 60 4.956 -15.715 2.001 1.00 10.00 C ATOM 912 CD LYS A 60 5.279 -15.988 0.529 1.00 10.00 C ATOM 913 CE LYS A 60 5.683 -17.452 0.311 1.00 10.00 C ATOM 914 NZ LYS A 60 6.541 -17.592 -0.885 1.00 10.00 N ATOM 0 H LYS A 60 1.764 -15.368 -0.063 1.00 10.00 H new ATOM 0 HA LYS A 60 1.567 -15.316 2.729 1.00 10.00 H new ATOM 0 HB2 LYS A 60 3.533 -16.142 3.544 1.00 10.00 H new ATOM 0 HB3 LYS A 60 3.392 -17.173 2.134 1.00 10.00 H new ATOM 0 HG2 LYS A 60 5.072 -14.648 2.190 1.00 10.00 H new ATOM 0 HG3 LYS A 60 5.691 -16.230 2.619 1.00 10.00 H new ATOM 0 HD2 LYS A 60 4.411 -15.752 -0.086 1.00 10.00 H new ATOM 0 HD3 LYS A 60 6.087 -15.333 0.204 1.00 10.00 H new ATOM 0 HE2 LYS A 60 6.213 -17.821 1.189 1.00 10.00 H new ATOM 0 HE3 LYS A 60 4.790 -18.066 0.196 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 5.972 -17.944 -1.681 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 6.947 -16.667 -1.131 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 7.309 -18.264 -0.685 1.00 10.00 H new ATOM 928 N GLU A 61 2.969 -13.351 0.590 1.00 10.00 N ATOM 929 CA GLU A 61 3.301 -11.978 0.152 1.00 10.00 C ATOM 930 C GLU A 61 3.908 -12.071 -1.250 1.00 10.00 C ATOM 931 O GLU A 61 3.219 -11.782 -2.225 1.00 10.00 O ATOM 932 CB GLU A 61 4.189 -11.221 1.167 1.00 10.00 C ATOM 933 CG GLU A 61 4.730 -9.870 0.677 1.00 10.00 C ATOM 934 CD GLU A 61 4.659 -8.813 1.787 1.00 10.00 C ATOM 935 OE1 GLU A 61 5.318 -8.974 2.843 1.00 10.00 O ATOM 936 OE2 GLU A 61 3.876 -7.847 1.648 1.00 10.00 O ATOM 0 H GLU A 61 2.953 -13.986 -0.208 1.00 10.00 H new ATOM 0 HA GLU A 61 2.396 -11.372 0.108 1.00 10.00 H new ATOM 0 HB2 GLU A 61 3.613 -11.056 2.078 1.00 10.00 H new ATOM 0 HB3 GLU A 61 5.033 -11.858 1.434 1.00 10.00 H new ATOM 0 HG2 GLU A 61 5.762 -9.986 0.346 1.00 10.00 H new ATOM 0 HG3 GLU A 61 4.154 -9.535 -0.186 1.00 10.00 H new ATOM 943 N GLU A 62 5.149 -12.571 -1.341 1.00 10.00 N ATOM 944 CA GLU A 62 5.947 -12.719 -2.570 1.00 10.00 C ATOM 945 C GLU A 62 5.109 -13.303 -3.718 1.00 10.00 C ATOM 946 O GLU A 62 4.875 -12.663 -4.742 1.00 10.00 O ATOM 947 CB GLU A 62 7.146 -13.663 -2.315 1.00 10.00 C ATOM 948 CG GLU A 62 8.018 -13.388 -1.080 1.00 10.00 C ATOM 949 CD GLU A 62 8.951 -14.581 -0.813 1.00 10.00 C ATOM 950 OE1 GLU A 62 8.419 -15.715 -0.690 1.00 10.00 O ATOM 951 OE2 GLU A 62 10.176 -14.360 -0.730 1.00 10.00 O ATOM 0 H GLU A 62 5.651 -12.901 -0.516 1.00 10.00 H new ATOM 0 HA GLU A 62 6.296 -11.725 -2.852 1.00 10.00 H new ATOM 0 HB2 GLU A 62 6.762 -14.680 -2.235 1.00 10.00 H new ATOM 0 HB3 GLU A 62 7.790 -13.633 -3.194 1.00 10.00 H new ATOM 0 HG2 GLU A 62 8.607 -12.484 -1.235 1.00 10.00 H new ATOM 0 HG3 GLU A 62 7.385 -13.210 -0.211 1.00 10.00 H new ATOM 958 N THR A 63 4.623 -14.528 -3.493 1.00 10.00 N ATOM 959 CA THR A 63 3.874 -15.372 -4.417 1.00 10.00 C ATOM 960 C THR A 63 2.606 -14.703 -4.904 1.00 10.00 C ATOM 961 O THR A 63 2.306 -14.815 -6.082 1.00 10.00 O ATOM 962 CB THR A 63 3.564 -16.729 -3.752 1.00 10.00 C ATOM 963 OG1 THR A 63 3.241 -16.578 -2.375 1.00 10.00 O ATOM 964 CG2 THR A 63 4.787 -17.640 -3.845 1.00 10.00 C ATOM 0 H THR A 63 4.755 -14.986 -2.591 1.00 10.00 H new ATOM 0 HA THR A 63 4.495 -15.539 -5.297 1.00 10.00 H new ATOM 0 HB THR A 63 2.711 -17.158 -4.277 1.00 10.00 H new ATOM 0 HG1 THR A 63 2.892 -17.425 -2.026 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.564 -18.597 -3.374 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.042 -17.801 -4.892 1.00 10.00 H new ATOM 0 HG23 THR A 63 5.629 -17.172 -3.335 1.00 10.00 H new ATOM 972 N LEU A 64 1.873 -13.996 -4.042 1.00 10.00 N ATOM 973 CA LEU A 64 0.661 -13.275 -4.401 1.00 10.00 C ATOM 974 C LEU A 64 0.929 -11.972 -5.157 1.00 10.00 C ATOM 975 O LEU A 64 0.151 -11.621 -6.039 1.00 10.00 O ATOM 976 CB LEU A 64 -0.146 -13.049 -3.113 1.00 10.00 C ATOM 977 CG LEU A 64 -1.655 -13.282 -3.287 1.00 10.00 C ATOM 978 CD1 LEU A 64 -2.277 -13.737 -1.966 1.00 10.00 C ATOM 979 CD2 LEU A 64 -2.367 -12.001 -3.716 1.00 10.00 C ATOM 0 H LEU A 64 2.115 -13.910 -3.055 1.00 10.00 H new ATOM 0 HA LEU A 64 0.085 -13.875 -5.106 1.00 10.00 H new ATOM 0 HB2 LEU A 64 0.229 -13.716 -2.337 1.00 10.00 H new ATOM 0 HB3 LEU A 64 0.018 -12.029 -2.765 1.00 10.00 H new ATOM 0 HG LEU A 64 -1.775 -14.046 -4.055 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -3.346 -13.898 -2.104 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -1.808 -14.667 -1.644 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -2.121 -12.970 -1.207 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -3.433 -12.198 -3.831 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -2.220 -11.232 -2.958 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -1.957 -11.658 -4.666 1.00 10.00 H new ATOM 991 N MET A 65 2.034 -11.285 -4.862 1.00 10.00 N ATOM 992 CA MET A 65 2.502 -10.143 -5.648 1.00 10.00 C ATOM 993 C MET A 65 2.839 -10.608 -7.066 1.00 10.00 C ATOM 994 O MET A 65 2.271 -10.102 -8.033 1.00 10.00 O ATOM 995 CB MET A 65 3.710 -9.488 -4.941 1.00 10.00 C ATOM 996 CG MET A 65 3.573 -7.967 -4.876 1.00 10.00 C ATOM 997 SD MET A 65 4.929 -7.093 -4.043 1.00 10.00 S ATOM 998 CE MET A 65 4.717 -7.664 -2.336 1.00 10.00 C ATOM 0 H MET A 65 2.633 -11.507 -4.066 1.00 10.00 H new ATOM 0 HA MET A 65 1.721 -9.387 -5.726 1.00 10.00 H new ATOM 0 HB2 MET A 65 3.801 -9.888 -3.931 1.00 10.00 H new ATOM 0 HB3 MET A 65 4.626 -9.748 -5.471 1.00 10.00 H new ATOM 0 HG2 MET A 65 3.488 -7.584 -5.893 1.00 10.00 H new ATOM 0 HG3 MET A 65 2.641 -7.725 -4.365 1.00 10.00 H new ATOM 0 HE1 MET A 65 4.624 -6.804 -1.673 1.00 10.00 H new ATOM 0 HE2 MET A 65 3.817 -8.275 -2.266 1.00 10.00 H new ATOM 0 HE3 MET A 65 5.582 -8.257 -2.041 1.00 10.00 H new ATOM 1008 N GLU A 66 3.679 -11.644 -7.162 1.00 10.00 N ATOM 1009 CA GLU A 66 4.170 -12.221 -8.417 1.00 10.00 C ATOM 1010 C GLU A 66 3.024 -12.847 -9.220 1.00 10.00 C ATOM 1011 O GLU A 66 2.953 -12.705 -10.440 1.00 10.00 O ATOM 1012 CB GLU A 66 5.228 -13.281 -8.069 1.00 10.00 C ATOM 1013 CG GLU A 66 6.299 -13.453 -9.154 1.00 10.00 C ATOM 1014 CD GLU A 66 7.466 -14.353 -8.708 1.00 10.00 C ATOM 1015 OE1 GLU A 66 7.310 -15.104 -7.710 1.00 10.00 O ATOM 1016 OE2 GLU A 66 8.497 -14.340 -9.414 1.00 10.00 O ATOM 0 H GLU A 66 4.048 -12.120 -6.339 1.00 10.00 H new ATOM 0 HA GLU A 66 4.608 -11.439 -9.037 1.00 10.00 H new ATOM 0 HB2 GLU A 66 5.712 -13.006 -7.132 1.00 10.00 H new ATOM 0 HB3 GLU A 66 4.732 -14.238 -7.903 1.00 10.00 H new ATOM 0 HG2 GLU A 66 5.840 -13.878 -10.046 1.00 10.00 H new ATOM 0 HG3 GLU A 66 6.688 -12.473 -9.432 1.00 10.00 H new ATOM 1023 N TYR A 67 2.085 -13.488 -8.511 1.00 10.00 N ATOM 1024 CA TYR A 67 0.827 -13.967 -9.064 1.00 10.00 C ATOM 1025 C TYR A 67 0.008 -12.812 -9.616 1.00 10.00 C ATOM 1026 O TYR A 67 -0.224 -12.790 -10.820 1.00 10.00 O ATOM 1027 CB TYR A 67 0.037 -14.741 -8.015 1.00 10.00 C ATOM 1028 CG TYR A 67 -1.413 -15.041 -8.348 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -1.724 -16.046 -9.278 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -2.449 -14.363 -7.673 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -3.069 -16.385 -9.518 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -3.797 -14.671 -7.942 1.00 10.00 C ATOM 1033 CZ TYR A 67 -4.110 -15.689 -8.868 1.00 10.00 C ATOM 1034 OH TYR A 67 -5.402 -16.009 -9.146 1.00 10.00 O ATOM 0 H TYR A 67 2.188 -13.688 -7.516 1.00 10.00 H new ATOM 0 HA TYR A 67 1.052 -14.646 -9.887 1.00 10.00 H new ATOM 0 HB2 TYR A 67 0.548 -15.686 -7.831 1.00 10.00 H new ATOM 0 HB3 TYR A 67 0.064 -14.177 -7.082 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -0.934 -16.557 -9.808 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -2.207 -13.603 -6.945 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -3.306 -17.184 -10.205 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -4.587 -14.131 -7.442 1.00 10.00 H new ATOM 0 HH TYR A 67 -5.947 -15.195 -9.149 1.00 10.00 H new ATOM 1044 N LEU A 68 -0.440 -11.860 -8.784 1.00 10.00 N ATOM 1045 CA LEU A 68 -1.309 -10.795 -9.288 1.00 10.00 C ATOM 1046 C LEU A 68 -0.656 -9.982 -10.415 1.00 10.00 C ATOM 1047 O LEU A 68 -1.369 -9.554 -11.317 1.00 10.00 O ATOM 1048 CB LEU A 68 -1.773 -9.882 -8.150 1.00 10.00 C ATOM 1049 CG LEU A 68 -2.763 -10.516 -7.161 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -3.047 -9.532 -6.026 1.00 10.00 C ATOM 1051 CD2 LEU A 68 -4.101 -10.879 -7.806 1.00 10.00 C ATOM 0 H LEU A 68 -0.222 -11.807 -7.789 1.00 10.00 H new ATOM 0 HA LEU A 68 -2.183 -11.282 -9.720 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -0.897 -9.546 -7.596 1.00 10.00 H new ATOM 0 HB3 LEU A 68 -2.236 -8.995 -8.583 1.00 10.00 H new ATOM 0 HG LEU A 68 -2.297 -11.433 -6.799 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -3.749 -9.980 -5.323 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -2.117 -9.295 -5.509 1.00 10.00 H new ATOM 0 HD13 LEU A 68 -3.477 -8.618 -6.436 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -4.757 -11.323 -7.057 1.00 10.00 H new ATOM 0 HD22 LEU A 68 -4.566 -9.980 -8.209 1.00 10.00 H new ATOM 0 HD23 LEU A 68 -3.934 -11.594 -8.612 1.00 10.00 H new ATOM 1063 N GLU A 69 0.671 -9.802 -10.413 1.00 10.00 N ATOM 1064 CA GLU A 69 1.427 -9.210 -11.517 1.00 10.00 C ATOM 1065 C GLU A 69 1.266 -9.934 -12.868 1.00 10.00 C ATOM 1066 O GLU A 69 1.186 -9.245 -13.886 1.00 10.00 O ATOM 1067 CB GLU A 69 2.896 -9.116 -11.088 1.00 10.00 C ATOM 1068 CG GLU A 69 3.076 -7.903 -10.162 1.00 10.00 C ATOM 1069 CD GLU A 69 4.286 -7.977 -9.220 1.00 10.00 C ATOM 1070 OE1 GLU A 69 5.218 -8.767 -9.488 1.00 10.00 O ATOM 1071 OE2 GLU A 69 4.254 -7.215 -8.226 1.00 10.00 O ATOM 0 H GLU A 69 1.259 -10.071 -9.624 1.00 10.00 H new ATOM 0 HA GLU A 69 1.016 -8.219 -11.709 1.00 10.00 H new ATOM 0 HB2 GLU A 69 3.196 -10.029 -10.574 1.00 10.00 H new ATOM 0 HB3 GLU A 69 3.537 -9.018 -11.964 1.00 10.00 H new ATOM 0 HG2 GLU A 69 3.167 -7.007 -10.776 1.00 10.00 H new ATOM 0 HG3 GLU A 69 2.174 -7.787 -9.561 1.00 10.00 H new ATOM 1078 N ASN A 70 1.136 -11.270 -12.898 1.00 10.00 N ATOM 1079 CA ASN A 70 0.846 -12.027 -14.124 1.00 10.00 C ATOM 1080 C ASN A 70 0.326 -13.450 -13.804 1.00 10.00 C ATOM 1081 O ASN A 70 1.072 -14.434 -13.867 1.00 10.00 O ATOM 1082 CB ASN A 70 2.078 -12.071 -15.047 1.00 10.00 C ATOM 1083 CG ASN A 70 1.702 -12.517 -16.455 1.00 10.00 C ATOM 1084 OD1 ASN A 70 0.662 -13.115 -16.703 1.00 10.00 O ATOM 1085 ND2 ASN A 70 2.539 -12.225 -17.429 1.00 10.00 N ATOM 0 H ASN A 70 1.230 -11.857 -12.069 1.00 10.00 H new ATOM 0 HA ASN A 70 0.050 -11.506 -14.656 1.00 10.00 H new ATOM 0 HB2 ASN A 70 2.540 -11.084 -15.087 1.00 10.00 H new ATOM 0 HB3 ASN A 70 2.820 -12.754 -14.633 1.00 10.00 H new ATOM 0 HD21 ASN A 70 2.321 -12.497 -18.388 1.00 10.00 H new ATOM 0 HD22 ASN A 70 3.405 -11.727 -17.225 1.00 10.00 H new ATOM 1092 N PRO A 71 -0.971 -13.586 -13.471 1.00 10.00 N ATOM 1093 CA PRO A 71 -1.478 -14.756 -12.752 1.00 10.00 C ATOM 1094 C PRO A 71 -1.481 -16.013 -13.624 1.00 10.00 C ATOM 1095 O PRO A 71 -1.005 -17.068 -13.201 1.00 10.00 O ATOM 1096 CB PRO A 71 -2.859 -14.321 -12.240 1.00 10.00 C ATOM 1097 CG PRO A 71 -3.300 -13.224 -13.209 1.00 10.00 C ATOM 1098 CD PRO A 71 -1.983 -12.542 -13.545 1.00 10.00 C ATOM 0 HA PRO A 71 -0.842 -15.055 -11.918 1.00 10.00 H new ATOM 0 HB2 PRO A 71 -3.562 -15.154 -12.238 1.00 10.00 H new ATOM 0 HB3 PRO A 71 -2.803 -13.948 -11.217 1.00 10.00 H new ATOM 0 HG2 PRO A 71 -3.784 -13.634 -14.096 1.00 10.00 H new ATOM 0 HG3 PRO A 71 -4.009 -12.536 -12.749 1.00 10.00 H new ATOM 0 HD2 PRO A 71 -2.015 -12.097 -14.539 1.00 10.00 H new ATOM 0 HD3 PRO A 71 -1.768 -11.737 -12.842 1.00 10.00 H new ATOM 1106 N LYS A 72 -1.947 -15.866 -14.870 1.00 10.00 N ATOM 1107 CA LYS A 72 -1.990 -16.880 -15.924 1.00 10.00 C ATOM 1108 C LYS A 72 -0.610 -17.423 -16.300 1.00 10.00 C ATOM 1109 O LYS A 72 -0.494 -18.596 -16.641 1.00 10.00 O ATOM 1110 CB LYS A 72 -2.673 -16.249 -17.140 1.00 10.00 C ATOM 1111 CG LYS A 72 -4.202 -16.176 -16.985 1.00 10.00 C ATOM 1112 CD LYS A 72 -4.810 -15.132 -17.927 1.00 10.00 C ATOM 1113 CE LYS A 72 -4.710 -13.718 -17.336 1.00 10.00 C ATOM 1114 NZ LYS A 72 -5.952 -13.333 -16.632 1.00 10.00 N ATOM 0 H LYS A 72 -2.329 -14.975 -15.187 1.00 10.00 H new ATOM 0 HA LYS A 72 -2.547 -17.742 -15.557 1.00 10.00 H new ATOM 0 HB2 LYS A 72 -2.278 -15.245 -17.294 1.00 10.00 H new ATOM 0 HB3 LYS A 72 -2.429 -16.828 -18.031 1.00 10.00 H new ATOM 0 HG2 LYS A 72 -4.637 -17.153 -17.193 1.00 10.00 H new ATOM 0 HG3 LYS A 72 -4.453 -15.928 -15.954 1.00 10.00 H new ATOM 0 HD2 LYS A 72 -4.296 -15.164 -18.888 1.00 10.00 H new ATOM 0 HD3 LYS A 72 -5.855 -15.376 -18.116 1.00 10.00 H new ATOM 0 HE2 LYS A 72 -3.869 -13.671 -16.644 1.00 10.00 H new ATOM 0 HE3 LYS A 72 -4.507 -13.003 -18.133 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 -5.747 -12.565 -15.962 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 -6.658 -13.010 -17.324 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 -6.326 -14.154 -16.114 1.00 10.00 H new ATOM 1128 N LYS A 73 0.435 -16.581 -16.264 1.00 10.00 N ATOM 1129 CA LYS A 73 1.823 -17.027 -16.428 1.00 10.00 C ATOM 1130 C LYS A 73 2.351 -17.703 -15.154 1.00 10.00 C ATOM 1131 O LYS A 73 3.063 -18.698 -15.258 1.00 10.00 O ATOM 1132 CB LYS A 73 2.705 -15.848 -16.883 1.00 10.00 C ATOM 1133 CG LYS A 73 3.810 -16.212 -17.886 1.00 10.00 C ATOM 1134 CD LYS A 73 4.810 -17.253 -17.373 1.00 10.00 C ATOM 1135 CE LYS A 73 6.027 -17.296 -18.294 1.00 10.00 C ATOM 1136 NZ LYS A 73 6.974 -18.359 -17.884 1.00 10.00 N ATOM 0 H LYS A 73 0.340 -15.576 -16.121 1.00 10.00 H new ATOM 0 HA LYS A 73 1.859 -17.787 -17.209 1.00 10.00 H new ATOM 0 HB2 LYS A 73 2.065 -15.087 -17.330 1.00 10.00 H new ATOM 0 HB3 LYS A 73 3.167 -15.399 -16.004 1.00 10.00 H new ATOM 0 HG2 LYS A 73 3.347 -16.589 -18.798 1.00 10.00 H new ATOM 0 HG3 LYS A 73 4.353 -15.306 -18.155 1.00 10.00 H new ATOM 0 HD2 LYS A 73 5.119 -17.005 -16.358 1.00 10.00 H new ATOM 0 HD3 LYS A 73 4.338 -18.235 -17.332 1.00 10.00 H new ATOM 0 HE2 LYS A 73 5.703 -17.470 -19.320 1.00 10.00 H new ATOM 0 HE3 LYS A 73 6.532 -16.330 -18.279 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 7.790 -18.364 -18.528 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 7.300 -18.178 -16.913 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 6.497 -19.282 -17.923 1.00 10.00 H new ATOM 1150 N TYR A 74 2.044 -17.159 -13.969 1.00 10.00 N ATOM 1151 CA TYR A 74 2.634 -17.622 -12.715 1.00 10.00 C ATOM 1152 C TYR A 74 2.169 -19.015 -12.264 1.00 10.00 C ATOM 1153 O TYR A 74 2.996 -19.795 -11.789 1.00 10.00 O ATOM 1154 CB TYR A 74 2.392 -16.581 -11.618 1.00 10.00 C ATOM 1155 CG TYR A 74 3.296 -16.778 -10.420 1.00 10.00 C ATOM 1156 CD1 TYR A 74 4.687 -16.666 -10.594 1.00 10.00 C ATOM 1157 CD2 TYR A 74 2.768 -17.056 -9.144 1.00 10.00 C ATOM 1158 CE1 TYR A 74 5.548 -16.804 -9.496 1.00 10.00 C ATOM 1159 CE2 TYR A 74 3.624 -17.148 -8.030 1.00 10.00 C ATOM 1160 CZ TYR A 74 5.017 -16.995 -8.204 1.00 10.00 C ATOM 1161 OH TYR A 74 5.847 -16.926 -7.130 1.00 10.00 O ATOM 0 H TYR A 74 1.383 -16.390 -13.857 1.00 10.00 H new ATOM 0 HA TYR A 74 3.702 -17.733 -12.902 1.00 10.00 H new ATOM 0 HB2 TYR A 74 2.550 -15.583 -12.028 1.00 10.00 H new ATOM 0 HB3 TYR A 74 1.352 -16.633 -11.296 1.00 10.00 H new ATOM 0 HD1 TYR A 74 5.093 -16.473 -11.576 1.00 10.00 H new ATOM 0 HD2 TYR A 74 1.705 -17.199 -9.020 1.00 10.00 H new ATOM 0 HE1 TYR A 74 6.618 -16.764 -9.640 1.00 10.00 H new ATOM 0 HE2 TYR A 74 3.217 -17.335 -7.047 1.00 10.00 H new ATOM 0 HH TYR A 74 6.725 -16.596 -7.415 1.00 10.00 H new ATOM 1171 N ILE A 75 0.882 -19.353 -12.433 1.00 10.00 N ATOM 1172 CA ILE A 75 0.367 -20.709 -12.177 1.00 10.00 C ATOM 1173 C ILE A 75 -0.569 -21.178 -13.305 1.00 10.00 C ATOM 1174 O ILE A 75 -1.328 -20.370 -13.843 1.00 10.00 O ATOM 1175 CB ILE A 75 -0.300 -20.838 -10.783 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -1.359 -19.752 -10.497 1.00 10.00 C ATOM 1177 CG2 ILE A 75 0.772 -20.866 -9.684 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -2.081 -19.931 -9.153 1.00 10.00 C ATOM 0 H ILE A 75 0.169 -18.696 -12.750 1.00 10.00 H new ATOM 0 HA ILE A 75 1.229 -21.376 -12.167 1.00 10.00 H new ATOM 0 HB ILE A 75 -0.844 -21.783 -10.786 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -0.877 -18.774 -10.513 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -2.097 -19.757 -11.299 1.00 10.00 H new ATOM 0 HG21 ILE A 75 0.292 -20.957 -8.710 1.00 10.00 H new ATOM 0 HG22 ILE A 75 1.434 -21.717 -9.843 1.00 10.00 H new ATOM 0 HG23 ILE A 75 1.352 -19.944 -9.718 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -2.810 -19.131 -9.022 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -2.592 -20.893 -9.140 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -1.354 -19.896 -8.342 1.00 10.00 H new ATOM 1190 N PRO A 76 -0.547 -22.481 -13.661 1.00 10.00 N ATOM 1191 CA PRO A 76 -1.394 -23.037 -14.714 1.00 10.00 C ATOM 1192 C PRO A 76 -2.865 -23.053 -14.287 1.00 10.00 C ATOM 1193 O PRO A 76 -3.180 -22.920 -13.108 1.00 10.00 O ATOM 1194 CB PRO A 76 -0.862 -24.457 -14.947 1.00 10.00 C ATOM 1195 CG PRO A 76 -0.330 -24.855 -13.571 1.00 10.00 C ATOM 1196 CD PRO A 76 0.241 -23.541 -13.043 1.00 10.00 C ATOM 0 HA PRO A 76 -1.358 -22.440 -15.625 1.00 10.00 H new ATOM 0 HB2 PRO A 76 -1.648 -25.132 -15.286 1.00 10.00 H new ATOM 0 HB3 PRO A 76 -0.078 -24.475 -15.704 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -1.120 -25.242 -12.927 1.00 10.00 H new ATOM 0 HG3 PRO A 76 0.433 -25.630 -13.640 1.00 10.00 H new ATOM 0 HD2 PRO A 76 0.172 -23.495 -11.956 1.00 10.00 H new ATOM 0 HD3 PRO A 76 1.296 -23.443 -13.300 1.00 10.00 H new ATOM 1204 N GLY A 77 -3.783 -23.218 -15.245 1.00 10.00 N ATOM 1205 CA GLY A 77 -5.230 -23.327 -15.014 1.00 10.00 C ATOM 1206 C GLY A 77 -5.929 -22.074 -14.468 1.00 10.00 C ATOM 1207 O GLY A 77 -7.135 -21.944 -14.656 1.00 10.00 O ATOM 0 H GLY A 77 -3.534 -23.281 -16.232 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -5.707 -23.602 -15.955 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -5.404 -24.147 -14.317 1.00 10.00 H new ATOM 1211 N THR A 78 -5.225 -21.148 -13.810 1.00 10.00 N ATOM 1212 CA THR A 78 -5.767 -19.866 -13.345 1.00 10.00 C ATOM 1213 C THR A 78 -6.313 -19.070 -14.539 1.00 10.00 C ATOM 1214 O THR A 78 -5.578 -18.775 -15.483 1.00 10.00 O ATOM 1215 CB THR A 78 -4.700 -19.104 -12.523 1.00 10.00 C ATOM 1216 OG1 THR A 78 -5.073 -19.047 -11.159 1.00 10.00 O ATOM 1217 CG2 THR A 78 -4.401 -17.664 -12.926 1.00 10.00 C ATOM 0 H THR A 78 -4.239 -21.271 -13.580 1.00 10.00 H new ATOM 0 HA THR A 78 -6.608 -20.030 -12.671 1.00 10.00 H new ATOM 0 HB THR A 78 -3.802 -19.688 -12.723 1.00 10.00 H new ATOM 0 HG1 THR A 78 -5.842 -18.449 -11.055 1.00 10.00 H new ATOM 0 HG21 THR A 78 -3.636 -17.253 -12.267 1.00 10.00 H new ATOM 0 HG22 THR A 78 -4.043 -17.641 -13.955 1.00 10.00 H new ATOM 0 HG23 THR A 78 -5.309 -17.067 -12.844 1.00 10.00 H new ATOM 1225 N LYS A 79 -7.618 -18.768 -14.541 1.00 10.00 N ATOM 1226 CA LYS A 79 -8.252 -17.889 -15.529 1.00 10.00 C ATOM 1227 C LYS A 79 -8.162 -16.424 -15.087 1.00 10.00 C ATOM 1228 O LYS A 79 -7.417 -15.660 -15.703 1.00 10.00 O ATOM 1229 CB LYS A 79 -9.684 -18.375 -15.845 1.00 10.00 C ATOM 1230 CG LYS A 79 -10.074 -18.193 -17.322 1.00 10.00 C ATOM 1231 CD LYS A 79 -10.117 -16.736 -17.805 1.00 10.00 C ATOM 1232 CE LYS A 79 -10.519 -16.704 -19.284 1.00 10.00 C ATOM 1233 NZ LYS A 79 -10.550 -15.320 -19.810 1.00 10.00 N ATOM 0 H LYS A 79 -8.270 -19.133 -13.847 1.00 10.00 H new ATOM 0 HA LYS A 79 -7.709 -17.941 -16.473 1.00 10.00 H new ATOM 0 HB2 LYS A 79 -9.770 -19.429 -15.581 1.00 10.00 H new ATOM 0 HB3 LYS A 79 -10.392 -17.831 -15.219 1.00 10.00 H new ATOM 0 HG2 LYS A 79 -9.366 -18.745 -17.940 1.00 10.00 H new ATOM 0 HG3 LYS A 79 -11.054 -18.642 -17.482 1.00 10.00 H new ATOM 0 HD2 LYS A 79 -10.830 -16.165 -17.210 1.00 10.00 H new ATOM 0 HD3 LYS A 79 -9.142 -16.268 -17.671 1.00 10.00 H new ATOM 0 HE2 LYS A 79 -9.816 -17.299 -19.866 1.00 10.00 H new ATOM 0 HE3 LYS A 79 -11.501 -17.162 -19.405 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 -10.826 -15.336 -20.813 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 -11.239 -14.759 -19.270 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 -9.607 -14.892 -19.717 1.00 10.00 H new ATOM 1247 N MET A 80 -8.934 -16.071 -14.045 1.00 10.00 N ATOM 1248 CA MET A 80 -9.139 -14.749 -13.425 1.00 10.00 C ATOM 1249 C MET A 80 -8.958 -13.566 -14.397 1.00 10.00 C ATOM 1250 O MET A 80 -7.828 -13.170 -14.668 1.00 10.00 O ATOM 1251 CB MET A 80 -8.206 -14.632 -12.209 1.00 10.00 C ATOM 1252 CG MET A 80 -8.335 -13.278 -11.503 1.00 10.00 C ATOM 1253 SD MET A 80 -7.391 -13.155 -9.967 1.00 10.00 S ATOM 1254 CE MET A 80 -5.730 -12.969 -10.627 1.00 10.00 C ATOM 0 H MET A 80 -9.489 -16.780 -13.565 1.00 10.00 H new ATOM 0 HA MET A 80 -10.181 -14.685 -13.111 1.00 10.00 H new ATOM 0 HB2 MET A 80 -8.433 -15.430 -11.502 1.00 10.00 H new ATOM 0 HB3 MET A 80 -7.174 -14.774 -12.531 1.00 10.00 H new ATOM 0 HG2 MET A 80 -8.006 -12.493 -12.183 1.00 10.00 H new ATOM 0 HG3 MET A 80 -9.387 -13.092 -11.286 1.00 10.00 H new ATOM 0 HE1 MET A 80 -5.007 -13.022 -9.813 1.00 10.00 H new ATOM 0 HE2 MET A 80 -5.531 -13.767 -11.342 1.00 10.00 H new ATOM 0 HE3 MET A 80 -5.643 -12.004 -11.127 1.00 10.00 H new ATOM 1264 N ILE A 81 -10.066 -12.988 -14.891 1.00 10.00 N ATOM 1265 CA ILE A 81 -10.182 -11.920 -15.916 1.00 10.00 C ATOM 1266 C ILE A 81 -9.566 -10.558 -15.496 1.00 10.00 C ATOM 1267 O ILE A 81 -10.195 -9.502 -15.540 1.00 10.00 O ATOM 1268 CB ILE A 81 -11.670 -11.839 -16.366 1.00 10.00 C ATOM 1269 CG1 ILE A 81 -11.979 -10.996 -17.626 1.00 10.00 C ATOM 1270 CG2 ILE A 81 -12.601 -11.365 -15.242 1.00 10.00 C ATOM 1271 CD1 ILE A 81 -11.199 -11.410 -18.873 1.00 10.00 C ATOM 0 H ILE A 81 -10.986 -13.276 -14.559 1.00 10.00 H new ATOM 0 HA ILE A 81 -9.567 -12.188 -16.775 1.00 10.00 H new ATOM 0 HB ILE A 81 -11.864 -12.878 -16.634 1.00 10.00 H new ATOM 0 HG12 ILE A 81 -13.045 -11.064 -17.841 1.00 10.00 H new ATOM 0 HG13 ILE A 81 -11.764 -9.950 -17.409 1.00 10.00 H new ATOM 0 HG21 ILE A 81 -13.626 -11.327 -15.610 1.00 10.00 H new ATOM 0 HG22 ILE A 81 -12.542 -12.059 -14.404 1.00 10.00 H new ATOM 0 HG23 ILE A 81 -12.297 -10.372 -14.912 1.00 10.00 H new ATOM 0 HD11 ILE A 81 -11.478 -10.766 -19.707 1.00 10.00 H new ATOM 0 HD12 ILE A 81 -10.130 -11.314 -18.682 1.00 10.00 H new ATOM 0 HD13 ILE A 81 -11.432 -12.446 -19.120 1.00 10.00 H new ATOM 1283 N PHE A 82 -8.295 -10.579 -15.099 1.00 10.00 N ATOM 1284 CA PHE A 82 -7.506 -9.466 -14.589 1.00 10.00 C ATOM 1285 C PHE A 82 -5.997 -9.800 -14.634 1.00 10.00 C ATOM 1286 O PHE A 82 -5.592 -10.851 -15.152 1.00 10.00 O ATOM 1287 CB PHE A 82 -7.984 -9.129 -13.161 1.00 10.00 C ATOM 1288 CG PHE A 82 -7.850 -7.670 -12.773 1.00 10.00 C ATOM 1289 CD1 PHE A 82 -8.435 -6.655 -13.556 1.00 10.00 C ATOM 1290 CD2 PHE A 82 -7.162 -7.334 -11.600 1.00 10.00 C ATOM 1291 CE1 PHE A 82 -8.295 -5.307 -13.178 1.00 10.00 C ATOM 1292 CE2 PHE A 82 -7.015 -5.986 -11.223 1.00 10.00 C ATOM 1293 CZ PHE A 82 -7.581 -4.971 -12.014 1.00 10.00 C ATOM 0 H PHE A 82 -7.751 -11.442 -15.129 1.00 10.00 H new ATOM 0 HA PHE A 82 -7.650 -8.588 -15.219 1.00 10.00 H new ATOM 0 HB2 PHE A 82 -9.030 -9.421 -13.065 1.00 10.00 H new ATOM 0 HB3 PHE A 82 -7.418 -9.732 -12.452 1.00 10.00 H new ATOM 0 HD1 PHE A 82 -8.991 -6.912 -14.446 1.00 10.00 H new ATOM 0 HD2 PHE A 82 -6.742 -8.114 -10.982 1.00 10.00 H new ATOM 0 HE1 PHE A 82 -8.737 -4.529 -13.783 1.00 10.00 H new ATOM 0 HE2 PHE A 82 -6.468 -5.732 -10.327 1.00 10.00 H new ATOM 0 HZ PHE A 82 -7.468 -3.936 -11.728 1.00 10.00 H new ATOM 1303 N ALA A 83 -5.177 -8.878 -14.112 1.00 10.00 N ATOM 1304 CA ALA A 83 -3.710 -8.865 -14.128 1.00 10.00 C ATOM 1305 C ALA A 83 -3.183 -7.858 -13.073 1.00 10.00 C ATOM 1306 O ALA A 83 -3.887 -7.578 -12.100 1.00 10.00 O ATOM 1307 CB ALA A 83 -3.242 -8.527 -15.556 1.00 10.00 C ATOM 0 H ALA A 83 -5.552 -8.060 -13.631 1.00 10.00 H new ATOM 0 HA ALA A 83 -3.306 -9.841 -13.860 1.00 10.00 H new ATOM 0 HB1 ALA A 83 -2.153 -8.513 -15.588 1.00 10.00 H new ATOM 0 HB2 ALA A 83 -3.615 -9.281 -16.249 1.00 10.00 H new ATOM 0 HB3 ALA A 83 -3.626 -7.548 -15.843 1.00 10.00 H new ATOM 1313 N GLY A 84 -1.958 -7.331 -13.245 1.00 10.00 N ATOM 1314 CA GLY A 84 -1.174 -6.516 -12.297 1.00 10.00 C ATOM 1315 C GLY A 84 -1.719 -5.128 -11.930 1.00 10.00 C ATOM 1316 O GLY A 84 -0.947 -4.176 -11.847 1.00 10.00 O ATOM 0 H GLY A 84 -1.450 -7.474 -14.118 1.00 10.00 H new ATOM 0 HA2 GLY A 84 -1.063 -7.087 -11.375 1.00 10.00 H new ATOM 0 HA3 GLY A 84 -0.175 -6.385 -12.713 1.00 10.00 H new ATOM 1320 N ILE A 85 -3.023 -5.025 -11.664 1.00 10.00 N ATOM 1321 CA ILE A 85 -3.804 -3.826 -11.341 1.00 10.00 C ATOM 1322 C ILE A 85 -3.449 -2.617 -12.230 1.00 10.00 C ATOM 1323 O ILE A 85 -3.766 -2.676 -13.419 1.00 10.00 O ATOM 1324 CB ILE A 85 -3.910 -3.634 -9.807 1.00 10.00 C ATOM 1325 CG1 ILE A 85 -4.991 -2.590 -9.463 1.00 10.00 C ATOM 1326 CG2 ILE A 85 -2.593 -3.354 -9.056 1.00 10.00 C ATOM 1327 CD1 ILE A 85 -5.621 -2.847 -8.094 1.00 10.00 C ATOM 0 H ILE A 85 -3.615 -5.856 -11.669 1.00 10.00 H new ATOM 0 HA ILE A 85 -4.846 -3.962 -11.631 1.00 10.00 H new ATOM 0 HB ILE A 85 -4.206 -4.615 -9.434 1.00 10.00 H new ATOM 0 HG12 ILE A 85 -4.550 -1.593 -9.478 1.00 10.00 H new ATOM 0 HG13 ILE A 85 -5.767 -2.606 -10.228 1.00 10.00 H new ATOM 0 HG21 ILE A 85 -2.798 -3.239 -7.992 1.00 10.00 H new ATOM 0 HG22 ILE A 85 -1.905 -4.186 -9.205 1.00 10.00 H new ATOM 0 HG23 ILE A 85 -2.143 -2.439 -9.440 1.00 10.00 H new ATOM 0 HD11 ILE A 85 -6.377 -2.088 -7.893 1.00 10.00 H new ATOM 0 HD12 ILE A 85 -6.086 -3.833 -8.087 1.00 10.00 H new ATOM 0 HD13 ILE A 85 -4.850 -2.804 -7.325 1.00 10.00 H new ATOM 1339 N LYS A 86 -2.838 -1.535 -11.720 1.00 10.00 N ATOM 1340 CA LYS A 86 -2.364 -0.422 -12.560 1.00 10.00 C ATOM 1341 C LYS A 86 -1.133 0.289 -11.985 1.00 10.00 C ATOM 1342 O LYS A 86 -0.060 0.185 -12.572 1.00 10.00 O ATOM 1343 CB LYS A 86 -3.539 0.519 -12.898 1.00 10.00 C ATOM 1344 CG LYS A 86 -3.210 1.464 -14.068 1.00 10.00 C ATOM 1345 CD LYS A 86 -4.491 2.109 -14.623 1.00 10.00 C ATOM 1346 CE LYS A 86 -4.242 2.932 -15.896 1.00 10.00 C ATOM 1347 NZ LYS A 86 -3.486 4.176 -15.627 1.00 10.00 N ATOM 0 H LYS A 86 -2.660 -1.407 -10.724 1.00 10.00 H new ATOM 0 HA LYS A 86 -2.000 -0.834 -13.501 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -4.417 -0.075 -13.149 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -3.795 1.109 -12.018 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -2.522 2.240 -13.733 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -2.704 0.910 -14.859 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -5.221 1.329 -14.838 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -4.928 2.753 -13.860 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -3.693 2.325 -16.616 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -5.198 3.184 -16.355 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -3.344 4.695 -16.517 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -4.020 4.770 -14.961 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -2.562 3.938 -15.214 1.00 10.00 H new ATOM 1361 N LYS A 87 -1.258 1.032 -10.874 1.00 10.00 N ATOM 1362 CA LYS A 87 -0.103 1.627 -10.178 1.00 10.00 C ATOM 1363 C LYS A 87 0.645 0.564 -9.363 1.00 10.00 C ATOM 1364 O LYS A 87 0.025 -0.316 -8.762 1.00 10.00 O ATOM 1365 CB LYS A 87 -0.540 2.787 -9.262 1.00 10.00 C ATOM 1366 CG LYS A 87 -0.888 4.099 -9.995 1.00 10.00 C ATOM 1367 CD LYS A 87 -2.373 4.495 -9.931 1.00 10.00 C ATOM 1368 CE LYS A 87 -3.207 3.716 -10.948 1.00 10.00 C ATOM 1369 NZ LYS A 87 -4.657 3.909 -10.731 1.00 10.00 N ATOM 0 H LYS A 87 -2.155 1.237 -10.434 1.00 10.00 H new ATOM 0 HA LYS A 87 0.570 2.026 -10.937 1.00 10.00 H new ATOM 0 HB2 LYS A 87 -1.409 2.468 -8.686 1.00 10.00 H new ATOM 0 HB3 LYS A 87 0.259 2.988 -8.548 1.00 10.00 H new ATOM 0 HG2 LYS A 87 -0.292 4.906 -9.570 1.00 10.00 H new ATOM 0 HG3 LYS A 87 -0.596 4.004 -11.041 1.00 10.00 H new ATOM 0 HD2 LYS A 87 -2.756 4.311 -8.927 1.00 10.00 H new ATOM 0 HD3 LYS A 87 -2.474 5.564 -10.119 1.00 10.00 H new ATOM 0 HE2 LYS A 87 -2.944 4.037 -11.956 1.00 10.00 H new ATOM 0 HE3 LYS A 87 -2.967 2.655 -10.879 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 -5.189 3.407 -11.470 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 -4.922 3.533 -9.798 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 -4.882 4.924 -10.772 1.00 10.00 H new ATOM 1383 N LYS A 88 1.972 0.719 -9.231 1.00 10.00 N ATOM 1384 CA LYS A 88 2.770 -0.091 -8.293 1.00 10.00 C ATOM 1385 C LYS A 88 2.277 0.067 -6.849 1.00 10.00 C ATOM 1386 O LYS A 88 2.218 -0.912 -6.113 1.00 10.00 O ATOM 1387 CB LYS A 88 4.285 0.173 -8.431 1.00 10.00 C ATOM 1388 CG LYS A 88 4.803 1.408 -7.671 1.00 10.00 C ATOM 1389 CD LYS A 88 6.331 1.540 -7.753 1.00 10.00 C ATOM 1390 CE LYS A 88 6.853 2.477 -6.653 1.00 10.00 C ATOM 1391 NZ LYS A 88 6.922 1.803 -5.332 1.00 10.00 N ATOM 0 H LYS A 88 2.517 1.398 -9.762 1.00 10.00 H new ATOM 0 HA LYS A 88 2.620 -1.135 -8.566 1.00 10.00 H new ATOM 0 HB2 LYS A 88 4.825 -0.705 -8.077 1.00 10.00 H new ATOM 0 HB3 LYS A 88 4.523 0.289 -9.488 1.00 10.00 H new ATOM 0 HG2 LYS A 88 4.340 2.306 -8.081 1.00 10.00 H new ATOM 0 HG3 LYS A 88 4.501 1.342 -6.626 1.00 10.00 H new ATOM 0 HD2 LYS A 88 6.792 0.558 -7.650 1.00 10.00 H new ATOM 0 HD3 LYS A 88 6.616 1.925 -8.732 1.00 10.00 H new ATOM 0 HE2 LYS A 88 7.844 2.840 -6.927 1.00 10.00 H new ATOM 0 HE3 LYS A 88 6.203 3.349 -6.581 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 6.979 2.519 -4.580 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 6.071 1.222 -5.194 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 7.765 1.195 -5.296 1.00 10.00 H new ATOM 1405 N THR A 89 1.852 1.280 -6.478 1.00 10.00 N ATOM 1406 CA THR A 89 1.282 1.600 -5.170 1.00 10.00 C ATOM 1407 C THR A 89 0.088 0.697 -4.885 1.00 10.00 C ATOM 1408 O THR A 89 0.114 -0.031 -3.906 1.00 10.00 O ATOM 1409 CB THR A 89 0.885 3.083 -5.082 1.00 10.00 C ATOM 1410 OG1 THR A 89 1.773 3.883 -5.838 1.00 10.00 O ATOM 1411 CG2 THR A 89 0.928 3.586 -3.640 1.00 10.00 C ATOM 0 H THR A 89 1.898 2.088 -7.099 1.00 10.00 H new ATOM 0 HA THR A 89 2.043 1.421 -4.411 1.00 10.00 H new ATOM 0 HB THR A 89 -0.130 3.160 -5.473 1.00 10.00 H new ATOM 0 HG1 THR A 89 1.504 4.823 -5.772 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.642 4.637 -3.613 1.00 10.00 H new ATOM 0 HG22 THR A 89 0.235 3.006 -3.031 1.00 10.00 H new ATOM 0 HG23 THR A 89 1.938 3.474 -3.246 1.00 10.00 H new ATOM 1419 N GLU A 90 -0.901 0.641 -5.787 1.00 10.00 N ATOM 1420 CA GLU A 90 -2.070 -0.237 -5.664 1.00 10.00 C ATOM 1421 C GLU A 90 -1.664 -1.713 -5.550 1.00 10.00 C ATOM 1422 O GLU A 90 -2.253 -2.459 -4.762 1.00 10.00 O ATOM 1423 CB GLU A 90 -2.979 -0.059 -6.887 1.00 10.00 C ATOM 1424 CG GLU A 90 -3.562 1.356 -7.027 1.00 10.00 C ATOM 1425 CD GLU A 90 -4.140 1.632 -8.423 1.00 10.00 C ATOM 1426 OE1 GLU A 90 -3.605 1.093 -9.423 1.00 10.00 O ATOM 1427 OE2 GLU A 90 -5.042 2.493 -8.521 1.00 10.00 O ATOM 0 H GLU A 90 -0.911 1.211 -6.632 1.00 10.00 H new ATOM 0 HA GLU A 90 -2.599 0.042 -4.753 1.00 10.00 H new ATOM 0 HB2 GLU A 90 -2.413 -0.299 -7.787 1.00 10.00 H new ATOM 0 HB3 GLU A 90 -3.799 -0.775 -6.826 1.00 10.00 H new ATOM 0 HG2 GLU A 90 -4.345 1.496 -6.282 1.00 10.00 H new ATOM 0 HG3 GLU A 90 -2.783 2.087 -6.812 1.00 10.00 H new ATOM 1434 N ARG A 91 -0.640 -2.137 -6.314 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.082 -3.489 -6.230 1.00 10.00 C ATOM 1436 C ARG A 91 0.446 -3.799 -4.822 1.00 10.00 C ATOM 1437 O ARG A 91 0.062 -4.829 -4.256 1.00 10.00 O ATOM 1438 CB ARG A 91 0.947 -3.739 -7.361 1.00 10.00 C ATOM 1439 CG ARG A 91 1.818 -5.013 -7.274 1.00 10.00 C ATOM 1440 CD ARG A 91 1.088 -6.342 -7.516 1.00 10.00 C ATOM 1441 NE ARG A 91 0.086 -6.603 -6.477 1.00 10.00 N ATOM 1442 CZ ARG A 91 -1.228 -6.595 -6.598 1.00 10.00 C ATOM 1443 NH1 ARG A 91 -1.840 -6.647 -7.755 1.00 10.00 N ATOM 1444 NH2 ARG A 91 -1.938 -6.442 -5.512 1.00 10.00 N ATOM 0 H ARG A 91 -0.179 -1.546 -7.006 1.00 10.00 H new ATOM 0 HA ARG A 91 -0.886 -4.206 -6.396 1.00 10.00 H new ATOM 0 HB2 ARG A 91 0.405 -3.768 -8.306 1.00 10.00 H new ATOM 0 HB3 ARG A 91 1.615 -2.879 -7.402 1.00 10.00 H new ATOM 0 HG2 ARG A 91 2.626 -4.927 -8.000 1.00 10.00 H new ATOM 0 HG3 ARG A 91 2.279 -5.048 -6.287 1.00 10.00 H new ATOM 0 HD2 ARG A 91 0.604 -6.320 -8.492 1.00 10.00 H new ATOM 0 HD3 ARG A 91 1.812 -7.157 -7.538 1.00 10.00 H new ATOM 0 HE ARG A 91 0.449 -6.817 -5.548 1.00 10.00 H new ATOM 0 HH11 ARG A 91 -1.297 -6.697 -8.617 1.00 10.00 H new ATOM 0 HH12 ARG A 91 -2.859 -6.638 -7.794 1.00 10.00 H new ATOM 0 HH21 ARG A 91 -1.474 -6.334 -4.610 1.00 10.00 H new ATOM 0 HH22 ARG A 91 -2.957 -6.431 -5.566 1.00 10.00 H new ATOM 1458 N GLU A 92 1.275 -2.918 -4.254 1.00 10.00 N ATOM 1459 CA GLU A 92 1.732 -2.988 -2.858 1.00 10.00 C ATOM 1460 C GLU A 92 0.548 -2.969 -1.874 1.00 10.00 C ATOM 1461 O GLU A 92 0.450 -3.829 -1.001 1.00 10.00 O ATOM 1462 CB GLU A 92 2.635 -1.792 -2.507 1.00 10.00 C ATOM 1463 CG GLU A 92 3.901 -1.555 -3.338 1.00 10.00 C ATOM 1464 CD GLU A 92 4.334 -0.075 -3.288 1.00 10.00 C ATOM 1465 OE1 GLU A 92 4.002 0.622 -2.298 1.00 10.00 O ATOM 1466 OE2 GLU A 92 5.000 0.370 -4.256 1.00 10.00 O ATOM 0 H GLU A 92 1.656 -2.119 -4.760 1.00 10.00 H new ATOM 0 HA GLU A 92 2.283 -3.924 -2.766 1.00 10.00 H new ATOM 0 HB2 GLU A 92 2.026 -0.890 -2.568 1.00 10.00 H new ATOM 0 HB3 GLU A 92 2.939 -1.902 -1.466 1.00 10.00 H new ATOM 0 HG2 GLU A 92 4.708 -2.185 -2.964 1.00 10.00 H new ATOM 0 HG3 GLU A 92 3.720 -1.849 -4.372 1.00 10.00 H new ATOM 1473 N ASP A 93 -0.333 -1.973 -2.014 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.420 -1.630 -1.100 1.00 10.00 C ATOM 1475 C ASP A 93 -2.342 -2.819 -0.859 1.00 10.00 C ATOM 1476 O ASP A 93 -2.635 -3.142 0.288 1.00 10.00 O ATOM 1477 CB ASP A 93 -2.231 -0.445 -1.653 1.00 10.00 C ATOM 1478 CG ASP A 93 -1.498 0.899 -1.696 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -0.473 1.036 -0.987 1.00 10.00 O ATOM 1480 OD2 ASP A 93 -1.985 1.792 -2.422 1.00 10.00 O ATOM 0 H ASP A 93 -0.301 -1.348 -2.819 1.00 10.00 H new ATOM 0 HA ASP A 93 -0.973 -1.348 -0.147 1.00 10.00 H new ATOM 0 HB2 ASP A 93 -2.558 -0.692 -2.663 1.00 10.00 H new ATOM 0 HB3 ASP A 93 -3.129 -0.329 -1.047 1.00 10.00 H new ATOM 1485 N LEU A 94 -2.766 -3.503 -1.928 1.00 10.00 N ATOM 1486 CA LEU A 94 -3.600 -4.700 -1.828 1.00 10.00 C ATOM 1487 C LEU A 94 -2.934 -5.823 -1.028 1.00 10.00 C ATOM 1488 O LEU A 94 -3.597 -6.443 -0.198 1.00 10.00 O ATOM 1489 CB LEU A 94 -3.958 -5.178 -3.244 1.00 10.00 C ATOM 1490 CG LEU A 94 -5.347 -4.737 -3.717 1.00 10.00 C ATOM 1491 CD1 LEU A 94 -5.534 -3.224 -3.752 1.00 10.00 C ATOM 1492 CD2 LEU A 94 -5.571 -5.270 -5.131 1.00 10.00 C ATOM 0 H LEU A 94 -2.539 -3.239 -2.887 1.00 10.00 H new ATOM 0 HA LEU A 94 -4.505 -4.435 -1.281 1.00 10.00 H new ATOM 0 HB2 LEU A 94 -3.211 -4.802 -3.943 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -3.904 -6.266 -3.274 1.00 10.00 H new ATOM 0 HG LEU A 94 -6.063 -5.136 -2.998 1.00 10.00 H new ATOM 0 HD11 LEU A 94 -6.541 -2.990 -4.097 1.00 10.00 H new ATOM 0 HD12 LEU A 94 -5.389 -2.816 -2.752 1.00 10.00 H new ATOM 0 HD13 LEU A 94 -4.806 -2.783 -4.433 1.00 10.00 H new ATOM 0 HD21 LEU A 94 -6.556 -4.965 -5.483 1.00 10.00 H new ATOM 0 HD22 LEU A 94 -4.807 -4.868 -5.797 1.00 10.00 H new ATOM 0 HD23 LEU A 94 -5.510 -6.358 -5.124 1.00 10.00 H new ATOM 1504 N ILE A 95 -1.643 -6.086 -1.257 1.00 10.00 N ATOM 1505 CA ILE A 95 -0.907 -7.079 -0.466 1.00 10.00 C ATOM 1506 C ILE A 95 -0.789 -6.624 0.992 1.00 10.00 C ATOM 1507 O ILE A 95 -1.054 -7.423 1.888 1.00 10.00 O ATOM 1508 CB ILE A 95 0.463 -7.417 -1.093 1.00 10.00 C ATOM 1509 CG1 ILE A 95 0.358 -7.927 -2.547 1.00 10.00 C ATOM 1510 CG2 ILE A 95 1.204 -8.473 -0.256 1.00 10.00 C ATOM 1511 CD1 ILE A 95 -0.653 -9.050 -2.802 1.00 10.00 C ATOM 0 H ILE A 95 -1.088 -5.628 -1.980 1.00 10.00 H new ATOM 0 HA ILE A 95 -1.477 -8.008 -0.474 1.00 10.00 H new ATOM 0 HB ILE A 95 1.019 -6.480 -1.103 1.00 10.00 H new ATOM 0 HG12 ILE A 95 0.101 -7.083 -3.188 1.00 10.00 H new ATOM 0 HG13 ILE A 95 1.342 -8.276 -2.859 1.00 10.00 H new ATOM 0 HG21 ILE A 95 2.166 -8.694 -0.718 1.00 10.00 H new ATOM 0 HG22 ILE A 95 1.365 -8.091 0.752 1.00 10.00 H new ATOM 0 HG23 ILE A 95 0.607 -9.384 -0.208 1.00 10.00 H new ATOM 0 HD11 ILE A 95 -0.636 -9.323 -3.857 1.00 10.00 H new ATOM 0 HD12 ILE A 95 -0.391 -9.919 -2.198 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -1.652 -8.708 -2.532 1.00 10.00 H new ATOM 1523 N ALA A 96 -0.462 -5.351 1.246 1.00 10.00 N ATOM 1524 CA ALA A 96 -0.417 -4.778 2.593 1.00 10.00 C ATOM 1525 C ALA A 96 -1.766 -4.906 3.324 1.00 10.00 C ATOM 1526 O ALA A 96 -1.804 -5.340 4.476 1.00 10.00 O ATOM 1527 CB ALA A 96 0.053 -3.320 2.506 1.00 10.00 C ATOM 0 H ALA A 96 -0.219 -4.685 0.513 1.00 10.00 H new ATOM 0 HA ALA A 96 0.298 -5.344 3.190 1.00 10.00 H new ATOM 0 HB1 ALA A 96 0.088 -2.889 3.506 1.00 10.00 H new ATOM 0 HB2 ALA A 96 1.047 -3.284 2.060 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -0.642 -2.750 1.889 1.00 10.00 H new ATOM 1533 N TYR A 97 -2.871 -4.589 2.639 1.00 10.00 N ATOM 1534 CA TYR A 97 -4.240 -4.816 3.101 1.00 10.00 C ATOM 1535 C TYR A 97 -4.486 -6.296 3.420 1.00 10.00 C ATOM 1536 O TYR A 97 -4.877 -6.614 4.543 1.00 10.00 O ATOM 1537 CB TYR A 97 -5.233 -4.245 2.072 1.00 10.00 C ATOM 1538 CG TYR A 97 -6.544 -4.993 1.930 1.00 10.00 C ATOM 1539 CD1 TYR A 97 -7.501 -4.981 2.958 1.00 10.00 C ATOM 1540 CD2 TYR A 97 -6.767 -5.786 0.794 1.00 10.00 C ATOM 1541 CE1 TYR A 97 -8.689 -5.728 2.838 1.00 10.00 C ATOM 1542 CE2 TYR A 97 -7.907 -6.598 0.719 1.00 10.00 C ATOM 1543 CZ TYR A 97 -8.895 -6.542 1.714 1.00 10.00 C ATOM 1544 OH TYR A 97 -10.028 -7.281 1.588 1.00 10.00 O ATOM 0 H TYR A 97 -2.832 -4.153 1.718 1.00 10.00 H new ATOM 0 HA TYR A 97 -4.398 -4.285 4.040 1.00 10.00 H new ATOM 0 HB2 TYR A 97 -5.454 -3.213 2.343 1.00 10.00 H new ATOM 0 HB3 TYR A 97 -4.744 -4.221 1.098 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -7.325 -4.394 3.847 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -6.060 -5.771 -0.023 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -9.441 -5.674 3.611 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -8.026 -7.275 -0.114 1.00 10.00 H new ATOM 0 HH TYR A 97 -10.370 -7.202 0.673 1.00 10.00 H new ATOM 1554 N LEU A 98 -4.238 -7.210 2.474 1.00 10.00 N ATOM 1555 CA LEU A 98 -4.488 -8.637 2.681 1.00 10.00 C ATOM 1556 C LEU A 98 -3.624 -9.230 3.795 1.00 10.00 C ATOM 1557 O LEU A 98 -4.135 -10.037 4.563 1.00 10.00 O ATOM 1558 CB LEU A 98 -4.351 -9.409 1.361 1.00 10.00 C ATOM 1559 CG LEU A 98 -5.566 -9.154 0.456 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -5.263 -9.422 -1.009 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -6.793 -9.973 0.880 1.00 10.00 C ATOM 0 H LEU A 98 -3.862 -6.982 1.553 1.00 10.00 H new ATOM 0 HA LEU A 98 -5.518 -8.743 3.022 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -3.439 -9.104 0.848 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -4.261 -10.476 1.565 1.00 10.00 H new ATOM 0 HG LEU A 98 -5.797 -8.095 0.575 1.00 10.00 H new ATOM 0 HD11 LEU A 98 -6.154 -9.227 -1.606 1.00 10.00 H new ATOM 0 HD12 LEU A 98 -4.455 -8.769 -1.339 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -4.963 -10.462 -1.134 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -7.624 -9.757 0.209 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -6.555 -11.036 0.833 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -7.072 -9.709 1.900 1.00 10.00 H new ATOM 1573 N LYS A 99 -2.379 -8.766 3.965 1.00 10.00 N ATOM 1574 CA LYS A 99 -1.487 -9.133 5.077 1.00 10.00 C ATOM 1575 C LYS A 99 -2.055 -8.775 6.462 1.00 10.00 C ATOM 1576 O LYS A 99 -1.687 -9.404 7.457 1.00 10.00 O ATOM 1577 CB LYS A 99 -0.103 -8.514 4.816 1.00 10.00 C ATOM 1578 CG LYS A 99 1.031 -9.172 5.620 1.00 10.00 C ATOM 1579 CD LYS A 99 2.404 -8.910 4.976 1.00 10.00 C ATOM 1580 CE LYS A 99 2.829 -7.441 5.088 1.00 10.00 C ATOM 1581 NZ LYS A 99 3.965 -7.140 4.188 1.00 10.00 N ATOM 0 H LYS A 99 -1.951 -8.106 3.315 1.00 10.00 H new ATOM 0 HA LYS A 99 -1.394 -10.219 5.108 1.00 10.00 H new ATOM 0 HB2 LYS A 99 0.125 -8.592 3.753 1.00 10.00 H new ATOM 0 HB3 LYS A 99 -0.139 -7.452 5.058 1.00 10.00 H new ATOM 0 HG2 LYS A 99 1.027 -8.787 6.640 1.00 10.00 H new ATOM 0 HG3 LYS A 99 0.857 -10.246 5.684 1.00 10.00 H new ATOM 0 HD2 LYS A 99 3.153 -9.540 5.455 1.00 10.00 H new ATOM 0 HD3 LYS A 99 2.370 -9.197 3.925 1.00 10.00 H new ATOM 0 HE2 LYS A 99 1.986 -6.796 4.841 1.00 10.00 H new ATOM 0 HE3 LYS A 99 3.109 -7.219 6.118 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 4.424 -6.258 4.492 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 4.653 -7.919 4.225 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 3.617 -7.032 3.214 1.00 10.00 H new ATOM 1595 N LYS A 100 -3.012 -7.838 6.520 1.00 10.00 N ATOM 1596 CA LYS A 100 -3.866 -7.586 7.687 1.00 10.00 C ATOM 1597 C LYS A 100 -5.180 -8.369 7.622 1.00 10.00 C ATOM 1598 O LYS A 100 -5.485 -9.057 8.587 1.00 10.00 O ATOM 1599 CB LYS A 100 -4.127 -6.081 7.859 1.00 10.00 C ATOM 1600 CG LYS A 100 -2.887 -5.273 8.273 1.00 10.00 C ATOM 1601 CD LYS A 100 -2.331 -5.547 9.683 1.00 10.00 C ATOM 1602 CE LYS A 100 -3.042 -4.792 10.819 1.00 10.00 C ATOM 1603 NZ LYS A 100 -4.320 -5.410 11.246 1.00 10.00 N ATOM 0 H LYS A 100 -3.218 -7.219 5.736 1.00 10.00 H new ATOM 0 HA LYS A 100 -3.327 -7.944 8.564 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -4.512 -5.680 6.921 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -4.906 -5.941 8.609 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -2.095 -5.468 7.550 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -3.130 -4.213 8.202 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -2.396 -6.617 9.881 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -1.273 -5.284 9.698 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -2.373 -4.735 11.678 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -3.235 -3.769 10.496 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -4.457 -5.255 12.265 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -5.107 -4.978 10.721 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -4.294 -6.431 11.052 1.00 10.00 H new ATOM 1617 N ALA A 101 -5.939 -8.319 6.523 1.00 10.00 N ATOM 1618 CA ALA A 101 -7.240 -8.997 6.402 1.00 10.00 C ATOM 1619 C ALA A 101 -7.183 -10.532 6.573 1.00 10.00 C ATOM 1620 O ALA A 101 -8.164 -11.154 6.961 1.00 10.00 O ATOM 1621 CB ALA A 101 -7.875 -8.612 5.062 1.00 10.00 C ATOM 0 H ALA A 101 -5.669 -7.804 5.685 1.00 10.00 H new ATOM 0 HA ALA A 101 -7.857 -8.654 7.233 1.00 10.00 H new ATOM 0 HB1 ALA A 101 -8.840 -9.109 4.961 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -8.017 -7.532 5.024 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -7.221 -8.921 4.247 1.00 10.00 H new ATOM 1627 N THR A 102 -6.014 -11.138 6.343 1.00 10.00 N ATOM 1628 CA THR A 102 -5.679 -12.540 6.641 1.00 10.00 C ATOM 1629 C THR A 102 -5.399 -12.828 8.131 1.00 10.00 C ATOM 1630 O THR A 102 -4.975 -13.948 8.428 1.00 10.00 O ATOM 1631 CB THR A 102 -4.466 -12.960 5.788 1.00 10.00 C ATOM 1632 OG1 THR A 102 -4.245 -14.351 5.886 1.00 10.00 O ATOM 1633 CG2 THR A 102 -3.173 -12.289 6.250 1.00 10.00 C ATOM 0 H THR A 102 -5.231 -10.639 5.921 1.00 10.00 H new ATOM 0 HA THR A 102 -6.562 -13.128 6.391 1.00 10.00 H new ATOM 0 HB THR A 102 -4.704 -12.658 4.768 1.00 10.00 H new ATOM 0 HG1 THR A 102 -4.413 -14.645 6.806 1.00 10.00 H new ATOM 0 HG21 THR A 102 -2.347 -12.617 5.618 1.00 10.00 H new ATOM 0 HG22 THR A 102 -3.279 -11.207 6.177 1.00 10.00 H new ATOM 0 HG23 THR A 102 -2.970 -12.565 7.285 1.00 10.00 H new ATOM 1641 N ASN A 103 -5.599 -11.862 9.043 1.00 10.00 N ATOM 1642 CA ASN A 103 -5.132 -11.884 10.439 1.00 10.00 C ATOM 1643 C ASN A 103 -6.028 -11.075 11.407 1.00 10.00 C ATOM 1644 O ASN A 103 -6.226 -11.527 12.531 1.00 10.00 O ATOM 1645 CB ASN A 103 -3.714 -11.269 10.511 1.00 10.00 C ATOM 1646 CG ASN A 103 -2.591 -12.161 10.004 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -2.414 -13.284 10.443 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -1.741 -11.676 9.117 1.00 10.00 N ATOM 0 H ASN A 103 -6.112 -11.009 8.818 1.00 10.00 H new ATOM 0 HA ASN A 103 -5.155 -12.929 10.748 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -3.708 -10.343 9.936 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -3.504 -11.002 11.547 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -0.949 -12.240 8.808 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -1.877 -10.738 8.741 1.00 10.00 H new ATOM 1655 N GLU A 104 -6.493 -9.875 11.024 1.00 10.00 N ATOM 1656 CA GLU A 104 -7.340 -8.983 11.839 1.00 10.00 C ATOM 1657 C GLU A 104 -8.812 -9.405 11.956 1.00 10.00 C ATOM 1658 O GLU A 104 -9.380 -9.117 13.030 1.00 10.00 O ATOM 1659 CB GLU A 104 -7.185 -7.523 11.370 1.00 10.00 C ATOM 1660 CG GLU A 104 -7.939 -7.134 10.082 1.00 10.00 C ATOM 1661 CD GLU A 104 -7.575 -5.732 9.546 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -6.647 -5.089 10.094 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -8.191 -5.300 8.547 1.00 10.00 O ATOM 1664 OXT GLU A 104 -9.351 -9.973 10.977 1.00 10.00 O ATOM 0 H GLU A 104 -6.283 -9.483 10.106 1.00 10.00 H new ATOM 0 HA GLU A 104 -6.969 -9.072 12.860 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -7.521 -6.868 12.174 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -6.124 -7.323 11.219 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -7.727 -7.874 9.310 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -9.011 -7.172 10.274 1.00 10.00 H new TER 1671 GLU A 104 HETATM 1672 FE HEC A 105 -9.083 -13.221 -8.014 1.00 10.00 FE HETATM 1673 CHA HEC A 105 -8.257 -16.508 -7.532 1.00 10.00 C HETATM 1674 CHB HEC A 105 -6.925 -12.312 -5.559 1.00 10.00 C HETATM 1675 CHC HEC A 105 -9.614 -10.032 -8.834 1.00 10.00 C HETATM 1676 CHD HEC A 105 -11.715 -14.191 -9.927 1.00 10.00 C HETATM 1677 NA HEC A 105 -7.850 -14.210 -6.786 1.00 10.00 N HETATM 1678 C1A HEC A 105 -7.608 -15.570 -6.746 1.00 10.00 C HETATM 1679 C2A HEC A 105 -6.585 -15.887 -5.767 1.00 10.00 C HETATM 1680 C3A HEC A 105 -6.233 -14.718 -5.182 1.00 10.00 C HETATM 1681 C4A HEC A 105 -7.026 -13.669 -5.824 1.00 10.00 C HETATM 1682 CMA HEC A 105 -5.159 -14.547 -4.130 1.00 10.00 C HETATM 1683 CAA HEC A 105 -5.966 -17.250 -5.526 1.00 10.00 C HETATM 1684 CBA HEC A 105 -6.859 -18.309 -4.846 1.00 10.00 C HETATM 1685 CGA HEC A 105 -6.270 -19.715 -4.959 1.00 10.00 C HETATM 1686 O1A HEC A 105 -6.459 -20.332 -6.031 1.00 10.00 O HETATM 1687 O2A HEC A 105 -5.628 -20.146 -3.974 1.00 10.00 O HETATM 1688 NB HEC A 105 -8.477 -11.512 -7.272 1.00 10.00 N HETATM 1689 C1B HEC A 105 -7.615 -11.306 -6.222 1.00 10.00 C HETATM 1690 C2B HEC A 105 -7.463 -9.878 -5.957 1.00 10.00 C HETATM 1691 C3B HEC A 105 -8.166 -9.223 -6.923 1.00 10.00 C HETATM 1692 C4B HEC A 105 -8.777 -10.257 -7.752 1.00 10.00 C HETATM 1693 CMB HEC A 105 -6.616 -9.271 -4.855 1.00 10.00 C HETATM 1694 CAB HEC A 105 -8.262 -7.721 -7.168 1.00 10.00 C HETATM 1695 CBB HEC A 105 -6.971 -7.193 -7.799 1.00 10.00 C HETATM 1696 NC HEC A 105 -10.459 -12.306 -9.025 1.00 10.00 N HETATM 1697 C1C HEC A 105 -10.459 -10.981 -9.376 1.00 10.00 C HETATM 1698 C2C HEC A 105 -11.589 -10.670 -10.234 1.00 10.00 C HETATM 1699 C3C HEC A 105 -12.372 -11.785 -10.233 1.00 10.00 C HETATM 1700 C4C HEC A 105 -11.544 -12.840 -9.674 1.00 10.00 C HETATM 1701 CMC HEC A 105 -11.859 -9.303 -10.823 1.00 10.00 C HETATM 1702 CAC HEC A 105 -13.803 -11.968 -10.710 1.00 10.00 C HETATM 1703 CBC HEC A 105 -13.969 -11.924 -12.230 1.00 10.00 C HETATM 1704 ND HEC A 105 -9.828 -14.982 -8.610 1.00 10.00 N HETATM 1705 C1D HEC A 105 -10.856 -15.185 -9.500 1.00 10.00 C HETATM 1706 C2D HEC A 105 -10.907 -16.574 -9.937 1.00 10.00 C HETATM 1707 C3D HEC A 105 -10.019 -17.250 -9.167 1.00 10.00 C HETATM 1708 C4D HEC A 105 -9.307 -16.242 -8.391 1.00 10.00 C HETATM 1709 CMD HEC A 105 -11.789 -17.145 -11.030 1.00 10.00 C HETATM 1710 CAD HEC A 105 -9.763 -18.749 -9.154 1.00 10.00 C HETATM 1711 CBD HEC A 105 -8.476 -19.201 -9.869 1.00 10.00 C HETATM 1712 CGD HEC A 105 -8.327 -18.649 -11.284 1.00 10.00 C HETATM 1713 O1D HEC A 105 -9.093 -19.075 -12.178 1.00 10.00 O HETATM 1714 O2D HEC A 105 -7.400 -17.835 -11.475 1.00 10.00 O HETATM 0 HMD3 HEC A 105 -12.836 -16.981 -10.775 1.00 10.00 H new HETATM 0 HMD2 HEC A 105 -11.564 -16.650 -11.975 1.00 10.00 H new HETATM 0 HMD1 HEC A 105 -11.602 -18.215 -11.127 1.00 10.00 H new HETATM 0 HMC3 HEC A 105 -11.988 -8.579 -10.018 1.00 10.00 H new HETATM 0 HMC2 HEC A 105 -11.018 -9.004 -11.449 1.00 10.00 H new HETATM 0 HMC1 HEC A 105 -12.766 -9.340 -11.427 1.00 10.00 H new HETATM 0 HMB3 HEC A 105 -6.971 -9.624 -3.887 1.00 10.00 H new HETATM 0 HMB2 HEC A 105 -5.576 -9.568 -4.990 1.00 10.00 H new HETATM 0 HMB1 HEC A 105 -6.691 -8.184 -4.895 1.00 10.00 H new HETATM 0 HMA3 HEC A 105 -5.408 -15.148 -3.255 1.00 10.00 H new HETATM 0 HMA2 HEC A 105 -4.200 -14.872 -4.533 1.00 10.00 H new HETATM 0 HMA1 HEC A 105 -5.095 -13.497 -3.843 1.00 10.00 H new HETATM 0 HBD2 HEC A 105 -7.615 -18.891 -9.276 1.00 10.00 H new HETATM 0 HBD1 HEC A 105 -8.459 -20.290 -9.911 1.00 10.00 H new HETATM 0 HBC3 HEC A 105 -13.629 -10.959 -12.605 1.00 10.00 H new HETATM 0 HBC2 HEC A 105 -13.377 -12.719 -12.684 1.00 10.00 H new HETATM 0 HBC1 HEC A 105 -15.020 -12.063 -12.485 1.00 10.00 H new HETATM 0 HBB3 HEC A 105 -6.133 -7.388 -7.130 1.00 10.00 H new HETATM 0 HBB2 HEC A 105 -6.800 -7.695 -8.751 1.00 10.00 H new HETATM 0 HBB1 HEC A 105 -7.060 -6.120 -7.966 1.00 10.00 H new HETATM 0 HBA2 HEC A 105 -6.987 -18.053 -3.794 1.00 10.00 H new HETATM 0 HBA1 HEC A 105 -7.850 -18.294 -5.301 1.00 10.00 H new HETATM 0 HAD2 HEC A 105 -9.721 -19.085 -8.118 1.00 10.00 H new HETATM 0 HAD1 HEC A 105 -10.612 -19.250 -9.618 1.00 10.00 H new HETATM 0 HAA2 HEC A 105 -5.637 -17.648 -6.486 1.00 10.00 H new HETATM 0 HAA1 HEC A 105 -5.074 -17.115 -4.915 1.00 10.00 H new HETATM 0 HHD HEC A 105 -12.590 -14.491 -10.504 1.00 10.00 H new HETATM 0 HHC HEC A 105 -9.605 -9.041 -9.287 1.00 10.00 H new HETATM 0 HHB HEC A 105 -6.246 -12.009 -4.762 1.00 10.00 H new HETATM 0 HHA HEC A 105 -7.912 -17.540 -7.468 1.00 10.00 H new HETATM 0 H2D HEC A 105 -7.336 -17.227 -10.709 1.00 10.00 H new HETATM 0 H2A HEC A 105 -6.053 -19.839 -3.146 1.00 10.00 H new