USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1131 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 105 LYS NZ :NH3+ -177:sc= 1.97 (180deg=0.794) USER MOD Set 1.2: A 109 GLN : amide:sc= 0.925 K(o=2.9,f=-12!) USER MOD Set 2.1: A 31 THR OG1 : rot -52:sc= 1.76 USER MOD Set 2.2: A 33 LYS NZ :NH3+ -165:sc= 0.776 (180deg=-0.00689) USER MOD Set 2.3: A 54 GLN : amide:sc= 0.521 K(o=3.1,f=-0.52) USER MOD Single : A 1 GLY N :NH3+ -103:sc= 0.0812 (180deg=0) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.124) USER MOD Single : A 10 LYS NZ :NH3+ -166:sc= 1.02 (180deg=0.9) USER MOD Single : A 13 CYS SG : rot 83:sc= 0.185 USER MOD Single : A 17 TYR OH : rot 30:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.0215 K(o=-0.021,f=-1.1) USER MOD Single : A 25 SER OG : rot 120:sc= 0.00975 USER MOD Single : A 34 TYR OH : rot 41:sc= 1.7 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.0262 USER MOD Single : A 44 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 48 TYR OH : rot -21:sc= 1.23 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 HIS : no HD1:sc=-0.000167 X(o=-0.00017,f=-0.00017) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 55 CYS SG : rot 110:sc= -0.529 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.169 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot -38:sc= 0.338 USER MOD Single : A 73 MET CE :methyl 173:sc= 0 (180deg=-0.052) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -176:sc= 0.93 (180deg=0.821) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 75:sc= 0.0997 USER MOD Single : A 88 ASN : amide:sc=-0.00592 K(o=-0.0059,f=-1.1) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= -0.439 X(o=-0.44,f=-0.34) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot -83:sc= 0.217 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ -123:sc= -0.104 (180deg=-2.97!) USER MOD Single : A 102 THR OG1 : rot -90:sc= -0.0981 USER MOD Single : A 110 ASN : amide:sc= -0.0499 X(o=-0.05,f=0) USER MOD Single : A 113 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0811) USER MOD Single : A 118 SER OG : rot 124:sc= 1.26 USER MOD Single : A 121 LYS NZ :NH3+ -136:sc= -0.0777 (180deg=-1.03) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= -0.229 K(o=-0.23,f=-1.9) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.0665 K(o=-0.066,f=-0.99) USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.117 -10.254 -5.951 1.00 0.00 N ATOM 2 CA GLY A 1 -4.120 -10.615 -4.945 1.00 0.00 C ATOM 3 C GLY A 1 -3.539 -11.507 -3.856 1.00 0.00 C ATOM 4 O GLY A 1 -2.425 -12.022 -3.984 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.798 -9.277 -5.789 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.305 -10.900 -5.879 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.535 -10.328 -6.900 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.524 -9.709 -4.494 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.951 -11.128 -5.429 1.00 0.00 H new ATOM 7 N ILE A 2 -4.295 -11.682 -2.771 1.00 0.00 N ATOM 8 CA ILE A 2 -4.014 -12.585 -1.662 1.00 0.00 C ATOM 9 C ILE A 2 -4.453 -13.978 -2.129 1.00 0.00 C ATOM 10 O ILE A 2 -5.631 -14.317 -1.998 1.00 0.00 O ATOM 11 CB ILE A 2 -4.780 -12.151 -0.375 1.00 0.00 C ATOM 12 CG1 ILE A 2 -4.702 -10.635 -0.070 1.00 0.00 C ATOM 13 CG2 ILE A 2 -4.261 -12.992 0.808 1.00 0.00 C ATOM 14 CD1 ILE A 2 -5.577 -10.188 1.105 1.00 0.00 C ATOM 0 H ILE A 2 -5.166 -11.168 -2.639 1.00 0.00 H new ATOM 0 HA ILE A 2 -2.956 -12.573 -1.400 1.00 0.00 H new ATOM 0 HB ILE A 2 -5.841 -12.338 -0.543 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -3.666 -10.371 0.141 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -4.997 -10.080 -0.961 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -4.786 -12.702 1.718 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -4.437 -14.049 0.608 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -3.192 -12.820 0.935 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -5.466 -9.114 1.254 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -6.620 -10.418 0.890 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -5.268 -10.713 2.009 1.00 0.00 H new ATOM 26 N ARG A 3 -3.571 -14.776 -2.737 1.00 0.00 N ATOM 27 CA ARG A 3 -3.925 -16.142 -3.133 1.00 0.00 C ATOM 28 C ARG A 3 -2.667 -16.997 -3.216 1.00 0.00 C ATOM 29 O ARG A 3 -2.122 -17.182 -4.300 1.00 0.00 O ATOM 30 CB ARG A 3 -4.731 -16.110 -4.448 1.00 0.00 C ATOM 31 CG ARG A 3 -5.379 -17.471 -4.746 1.00 0.00 C ATOM 32 CD ARG A 3 -6.751 -17.328 -5.426 1.00 0.00 C ATOM 33 NE ARG A 3 -7.865 -17.730 -4.549 1.00 0.00 N ATOM 34 CZ ARG A 3 -8.441 -17.030 -3.563 1.00 0.00 C ATOM 35 NH1 ARG A 3 -8.017 -15.821 -3.215 1.00 0.00 N ATOM 36 NH2 ARG A 3 -9.460 -17.563 -2.909 1.00 0.00 N ATOM 0 H ARG A 3 -2.615 -14.503 -2.964 1.00 0.00 H new ATOM 0 HA ARG A 3 -4.567 -16.603 -2.383 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -5.504 -15.344 -4.383 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -4.074 -15.831 -5.272 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -4.717 -18.053 -5.387 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -5.493 -18.028 -3.816 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -6.893 -16.292 -5.735 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -6.769 -17.936 -6.331 1.00 0.00 H new ATOM 0 HE ARG A 3 -8.247 -18.661 -4.714 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -7.229 -15.397 -3.704 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -8.480 -15.316 -2.459 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -9.795 -18.493 -3.158 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -9.910 -17.044 -2.155 1.00 0.00 H new ATOM 50 N MET A 4 -2.176 -17.495 -2.086 1.00 0.00 N ATOM 51 CA MET A 4 -0.931 -18.252 -2.010 1.00 0.00 C ATOM 52 C MET A 4 -1.021 -19.368 -0.971 1.00 0.00 C ATOM 53 O MET A 4 -2.036 -19.535 -0.294 1.00 0.00 O ATOM 54 CB MET A 4 0.241 -17.287 -1.720 1.00 0.00 C ATOM 55 CG MET A 4 0.046 -16.362 -0.510 1.00 0.00 C ATOM 56 SD MET A 4 -0.106 -17.191 1.095 1.00 0.00 S ATOM 57 CE MET A 4 -1.120 -15.972 1.969 1.00 0.00 C ATOM 0 H MET A 4 -2.638 -17.383 -1.184 1.00 0.00 H new ATOM 0 HA MET A 4 -0.750 -18.737 -2.969 1.00 0.00 H new ATOM 0 HB2 MET A 4 1.145 -17.876 -1.564 1.00 0.00 H new ATOM 0 HB3 MET A 4 0.410 -16.671 -2.603 1.00 0.00 H new ATOM 0 HG2 MET A 4 0.888 -15.672 -0.464 1.00 0.00 H new ATOM 0 HG3 MET A 4 -0.849 -15.762 -0.675 1.00 0.00 H new ATOM 0 HE1 MET A 4 -1.314 -16.320 2.983 1.00 0.00 H new ATOM 0 HE2 MET A 4 -0.592 -15.019 2.007 1.00 0.00 H new ATOM 0 HE3 MET A 4 -2.066 -15.841 1.443 1.00 0.00 H new ATOM 67 N ALA A 5 0.037 -20.171 -0.882 1.00 0.00 N ATOM 68 CA ALA A 5 0.236 -21.240 0.084 1.00 0.00 C ATOM 69 C ALA A 5 1.693 -21.115 0.535 1.00 0.00 C ATOM 70 O ALA A 5 2.492 -22.049 0.402 1.00 0.00 O ATOM 71 CB ALA A 5 -0.100 -22.603 -0.537 1.00 0.00 C ATOM 0 H ALA A 5 0.825 -20.084 -1.524 1.00 0.00 H new ATOM 0 HA ALA A 5 -0.428 -21.161 0.945 1.00 0.00 H new ATOM 0 HB1 ALA A 5 0.056 -23.388 0.203 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -1.141 -22.609 -0.859 1.00 0.00 H new ATOM 0 HB3 ALA A 5 0.547 -22.781 -1.396 1.00 0.00 H new ATOM 77 N THR A 6 2.043 -19.935 1.035 1.00 0.00 N ATOM 78 CA THR A 6 3.385 -19.543 1.450 1.00 0.00 C ATOM 79 C THR A 6 3.233 -18.851 2.814 1.00 0.00 C ATOM 80 O THR A 6 2.114 -18.501 3.203 1.00 0.00 O ATOM 81 CB THR A 6 3.960 -18.601 0.369 1.00 0.00 C ATOM 82 OG1 THR A 6 3.610 -18.987 -0.953 1.00 0.00 O ATOM 83 CG2 THR A 6 5.491 -18.540 0.399 1.00 0.00 C ATOM 0 H THR A 6 1.363 -19.187 1.169 1.00 0.00 H new ATOM 0 HA THR A 6 4.072 -20.383 1.553 1.00 0.00 H new ATOM 0 HB THR A 6 3.522 -17.633 0.612 1.00 0.00 H new ATOM 0 HG1 THR A 6 3.999 -18.355 -1.592 1.00 0.00 H new ATOM 0 HG21 THR A 6 5.844 -17.864 -0.380 1.00 0.00 H new ATOM 0 HG22 THR A 6 5.822 -18.176 1.372 1.00 0.00 H new ATOM 0 HG23 THR A 6 5.898 -19.536 0.227 1.00 0.00 H new ATOM 91 N LYS A 7 4.317 -18.654 3.566 1.00 0.00 N ATOM 92 CA LYS A 7 4.257 -18.084 4.914 1.00 0.00 C ATOM 93 C LYS A 7 5.214 -16.913 5.053 1.00 0.00 C ATOM 94 O LYS A 7 5.884 -16.555 4.090 1.00 0.00 O ATOM 95 CB LYS A 7 4.508 -19.200 5.944 1.00 0.00 C ATOM 96 CG LYS A 7 3.397 -20.264 5.941 1.00 0.00 C ATOM 97 CD LYS A 7 3.449 -21.280 7.095 1.00 0.00 C ATOM 98 CE LYS A 7 4.500 -22.388 6.955 1.00 0.00 C ATOM 99 NZ LYS A 7 5.845 -22.012 7.433 1.00 0.00 N ATOM 0 H LYS A 7 5.262 -18.885 3.258 1.00 0.00 H new ATOM 0 HA LYS A 7 3.264 -17.676 5.104 1.00 0.00 H new ATOM 0 HB2 LYS A 7 5.465 -19.677 5.732 1.00 0.00 H new ATOM 0 HB3 LYS A 7 4.584 -18.761 6.939 1.00 0.00 H new ATOM 0 HG2 LYS A 7 2.433 -19.757 5.970 1.00 0.00 H new ATOM 0 HG3 LYS A 7 3.443 -20.809 4.998 1.00 0.00 H new ATOM 0 HD2 LYS A 7 3.638 -20.740 8.023 1.00 0.00 H new ATOM 0 HD3 LYS A 7 2.468 -21.745 7.191 1.00 0.00 H new ATOM 0 HE2 LYS A 7 4.163 -23.265 7.508 1.00 0.00 H new ATOM 0 HE3 LYS A 7 4.568 -22.678 5.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 6.409 -22.871 7.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 6.313 -21.418 6.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 5.761 -21.482 8.324 1.00 0.00 H new ATOM 113 N ILE A 8 5.239 -16.278 6.223 1.00 0.00 N ATOM 114 CA ILE A 8 6.163 -15.185 6.508 1.00 0.00 C ATOM 115 C ILE A 8 6.723 -15.328 7.912 1.00 0.00 C ATOM 116 O ILE A 8 6.044 -15.849 8.802 1.00 0.00 O ATOM 117 CB ILE A 8 5.508 -13.790 6.342 1.00 0.00 C ATOM 118 CG1 ILE A 8 4.642 -13.248 7.503 1.00 0.00 C ATOM 119 CG2 ILE A 8 4.719 -13.696 5.041 1.00 0.00 C ATOM 120 CD1 ILE A 8 3.376 -14.030 7.870 1.00 0.00 C ATOM 0 H ILE A 8 4.619 -16.508 7.000 1.00 0.00 H new ATOM 0 HA ILE A 8 6.969 -15.252 5.778 1.00 0.00 H new ATOM 0 HB ILE A 8 6.382 -13.139 6.336 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.270 -13.190 8.392 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.347 -12.229 7.254 1.00 0.00 H new ATOM 0 HG21 ILE A 8 4.273 -12.705 4.957 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.387 -13.866 4.197 1.00 0.00 H new ATOM 0 HG23 ILE A 8 3.932 -14.450 5.038 1.00 0.00 H new ATOM 0 HD11 ILE A 8 2.870 -13.535 8.699 1.00 0.00 H new ATOM 0 HD12 ILE A 8 2.709 -14.068 7.009 1.00 0.00 H new ATOM 0 HD13 ILE A 8 3.647 -15.044 8.164 1.00 0.00 H new ATOM 132 N ASP A 9 7.938 -14.828 8.126 1.00 0.00 N ATOM 133 CA ASP A 9 8.549 -14.802 9.444 1.00 0.00 C ATOM 134 C ASP A 9 8.314 -13.376 9.903 1.00 0.00 C ATOM 135 O ASP A 9 9.167 -12.495 9.751 1.00 0.00 O ATOM 136 CB ASP A 9 10.024 -15.214 9.445 1.00 0.00 C ATOM 137 CG ASP A 9 10.500 -15.410 10.889 1.00 0.00 C ATOM 138 OD1 ASP A 9 10.387 -14.486 11.720 1.00 0.00 O ATOM 139 OD2 ASP A 9 10.980 -16.521 11.218 1.00 0.00 O ATOM 0 H ASP A 9 8.522 -14.431 7.390 1.00 0.00 H new ATOM 0 HA ASP A 9 8.114 -15.536 10.122 1.00 0.00 H new ATOM 0 HB2 ASP A 9 10.155 -16.137 8.879 1.00 0.00 H new ATOM 0 HB3 ASP A 9 10.626 -14.450 8.953 1.00 0.00 H new ATOM 144 N LYS A 10 7.079 -13.098 10.341 1.00 0.00 N ATOM 145 CA LYS A 10 6.699 -11.757 10.720 1.00 0.00 C ATOM 146 C LYS A 10 7.546 -11.274 11.882 1.00 0.00 C ATOM 147 O LYS A 10 7.697 -10.072 11.994 1.00 0.00 O ATOM 148 CB LYS A 10 5.191 -11.674 11.028 1.00 0.00 C ATOM 149 CG LYS A 10 4.591 -10.298 10.686 1.00 0.00 C ATOM 150 CD LYS A 10 4.187 -9.432 11.897 1.00 0.00 C ATOM 151 CE LYS A 10 2.668 -9.210 11.991 1.00 0.00 C ATOM 152 NZ LYS A 10 2.170 -8.159 11.074 1.00 0.00 N ATOM 0 H LYS A 10 6.337 -13.791 10.437 1.00 0.00 H new ATOM 0 HA LYS A 10 6.887 -11.091 9.878 1.00 0.00 H new ATOM 0 HB2 LYS A 10 4.666 -12.445 10.464 1.00 0.00 H new ATOM 0 HB3 LYS A 10 5.028 -11.885 12.085 1.00 0.00 H new ATOM 0 HG2 LYS A 10 5.315 -9.743 10.090 1.00 0.00 H new ATOM 0 HG3 LYS A 10 3.712 -10.450 10.060 1.00 0.00 H new ATOM 0 HD2 LYS A 10 4.537 -9.909 12.812 1.00 0.00 H new ATOM 0 HD3 LYS A 10 4.687 -8.466 11.830 1.00 0.00 H new ATOM 0 HE2 LYS A 10 2.157 -10.147 11.770 1.00 0.00 H new ATOM 0 HE3 LYS A 10 2.410 -8.940 13.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 1.202 -7.891 11.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 2.789 -7.325 11.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 2.168 -8.521 10.099 1.00 0.00 H new ATOM 166 N GLU A 11 8.119 -12.151 12.704 1.00 0.00 N ATOM 167 CA GLU A 11 8.957 -11.766 13.829 1.00 0.00 C ATOM 168 C GLU A 11 10.239 -11.112 13.319 1.00 0.00 C ATOM 169 O GLU A 11 10.505 -9.950 13.634 1.00 0.00 O ATOM 170 CB GLU A 11 9.301 -12.991 14.684 1.00 0.00 C ATOM 171 CG GLU A 11 8.080 -13.750 15.203 1.00 0.00 C ATOM 172 CD GLU A 11 8.542 -15.067 15.808 1.00 0.00 C ATOM 173 OE1 GLU A 11 9.026 -15.046 16.959 1.00 0.00 O ATOM 174 OE2 GLU A 11 8.452 -16.113 15.119 1.00 0.00 O ATOM 0 H GLU A 11 8.011 -13.160 12.603 1.00 0.00 H new ATOM 0 HA GLU A 11 8.410 -11.053 14.446 1.00 0.00 H new ATOM 0 HB2 GLU A 11 9.915 -13.672 14.095 1.00 0.00 H new ATOM 0 HB3 GLU A 11 9.905 -12.671 15.533 1.00 0.00 H new ATOM 0 HG2 GLU A 11 7.555 -13.155 15.950 1.00 0.00 H new ATOM 0 HG3 GLU A 11 7.377 -13.934 14.391 1.00 0.00 H new ATOM 181 N ALA A 12 11.024 -11.846 12.527 1.00 0.00 N ATOM 182 CA ALA A 12 12.294 -11.387 11.992 1.00 0.00 C ATOM 183 C ALA A 12 12.064 -10.214 11.048 1.00 0.00 C ATOM 184 O ALA A 12 12.775 -9.211 11.108 1.00 0.00 O ATOM 185 CB ALA A 12 12.993 -12.540 11.267 1.00 0.00 C ATOM 0 H ALA A 12 10.784 -12.794 12.238 1.00 0.00 H new ATOM 0 HA ALA A 12 12.934 -11.051 12.808 1.00 0.00 H new ATOM 0 HB1 ALA A 12 13.946 -12.194 10.866 1.00 0.00 H new ATOM 0 HB2 ALA A 12 13.169 -13.357 11.967 1.00 0.00 H new ATOM 0 HB3 ALA A 12 12.362 -12.892 10.451 1.00 0.00 H new ATOM 191 N CYS A 13 11.051 -10.304 10.181 1.00 0.00 N ATOM 192 CA CYS A 13 10.791 -9.215 9.260 1.00 0.00 C ATOM 193 C CYS A 13 10.323 -7.965 10.027 1.00 0.00 C ATOM 194 O CYS A 13 10.728 -6.857 9.671 1.00 0.00 O ATOM 195 CB CYS A 13 9.846 -9.662 8.143 1.00 0.00 C ATOM 196 SG CYS A 13 10.518 -11.098 7.260 1.00 0.00 S ATOM 0 H CYS A 13 10.418 -11.100 10.104 1.00 0.00 H new ATOM 0 HA CYS A 13 11.715 -8.927 8.758 1.00 0.00 H new ATOM 0 HB2 CYS A 13 8.872 -9.912 8.564 1.00 0.00 H new ATOM 0 HB3 CYS A 13 9.690 -8.841 7.444 1.00 0.00 H new ATOM 0 HG CYS A 13 10.236 -12.183 7.918 1.00 0.00 H new ATOM 202 N ARG A 14 9.527 -8.116 11.101 1.00 0.00 N ATOM 203 CA ARG A 14 9.109 -6.998 11.953 1.00 0.00 C ATOM 204 C ARG A 14 10.335 -6.395 12.620 1.00 0.00 C ATOM 205 O ARG A 14 10.365 -5.184 12.806 1.00 0.00 O ATOM 206 CB ARG A 14 8.112 -7.453 13.032 1.00 0.00 C ATOM 207 CG ARG A 14 7.726 -6.396 14.073 1.00 0.00 C ATOM 208 CD ARG A 14 6.929 -7.073 15.190 1.00 0.00 C ATOM 209 NE ARG A 14 6.430 -6.081 16.145 1.00 0.00 N ATOM 210 CZ ARG A 14 7.048 -5.589 17.223 1.00 0.00 C ATOM 211 NH1 ARG A 14 8.226 -6.054 17.632 1.00 0.00 N ATOM 212 NH2 ARG A 14 6.466 -4.602 17.882 1.00 0.00 N ATOM 0 H ARG A 14 9.158 -9.019 11.399 1.00 0.00 H new ATOM 0 HA ARG A 14 8.613 -6.257 11.327 1.00 0.00 H new ATOM 0 HB2 ARG A 14 7.204 -7.798 12.538 1.00 0.00 H new ATOM 0 HB3 ARG A 14 8.537 -8.311 13.553 1.00 0.00 H new ATOM 0 HG2 ARG A 14 8.620 -5.923 14.480 1.00 0.00 H new ATOM 0 HG3 ARG A 14 7.132 -5.609 13.609 1.00 0.00 H new ATOM 0 HD2 ARG A 14 6.093 -7.626 14.763 1.00 0.00 H new ATOM 0 HD3 ARG A 14 7.560 -7.797 15.706 1.00 0.00 H new ATOM 0 HE ARG A 14 5.493 -5.720 15.965 1.00 0.00 H new ATOM 0 HH11 ARG A 14 8.683 -6.807 17.118 1.00 0.00 H new ATOM 0 HH12 ARG A 14 8.672 -5.657 18.459 1.00 0.00 H new ATOM 0 HH21 ARG A 14 5.569 -4.236 17.564 1.00 0.00 H new ATOM 0 HH22 ARG A 14 6.914 -4.207 18.708 1.00 0.00 H new ATOM 226 N ALA A 15 11.328 -7.208 12.981 1.00 0.00 N ATOM 227 CA ALA A 15 12.504 -6.755 13.700 1.00 0.00 C ATOM 228 C ALA A 15 13.208 -5.656 12.908 1.00 0.00 C ATOM 229 O ALA A 15 13.474 -4.586 13.453 1.00 0.00 O ATOM 230 CB ALA A 15 13.424 -7.946 14.003 1.00 0.00 C ATOM 0 H ALA A 15 11.332 -8.207 12.778 1.00 0.00 H new ATOM 0 HA ALA A 15 12.211 -6.324 14.657 1.00 0.00 H new ATOM 0 HB1 ALA A 15 14.304 -7.598 14.543 1.00 0.00 H new ATOM 0 HB2 ALA A 15 12.889 -8.673 14.613 1.00 0.00 H new ATOM 0 HB3 ALA A 15 13.733 -8.414 13.068 1.00 0.00 H new ATOM 236 N ALA A 16 13.478 -5.891 11.622 1.00 0.00 N ATOM 237 CA ALA A 16 14.082 -4.889 10.755 1.00 0.00 C ATOM 238 C ALA A 16 13.137 -3.711 10.504 1.00 0.00 C ATOM 239 O ALA A 16 13.554 -2.555 10.566 1.00 0.00 O ATOM 240 CB ALA A 16 14.469 -5.539 9.433 1.00 0.00 C ATOM 0 H ALA A 16 13.283 -6.778 11.158 1.00 0.00 H new ATOM 0 HA ALA A 16 14.968 -4.495 11.252 1.00 0.00 H new ATOM 0 HB1 ALA A 16 14.922 -4.793 8.780 1.00 0.00 H new ATOM 0 HB2 ALA A 16 15.183 -6.341 9.617 1.00 0.00 H new ATOM 0 HB3 ALA A 16 13.579 -5.948 8.954 1.00 0.00 H new ATOM 246 N TYR A 17 11.868 -4.008 10.218 1.00 0.00 N ATOM 247 CA TYR A 17 10.806 -3.023 10.035 1.00 0.00 C ATOM 248 C TYR A 17 10.747 -2.039 11.207 1.00 0.00 C ATOM 249 O TYR A 17 10.571 -0.845 10.987 1.00 0.00 O ATOM 250 CB TYR A 17 9.500 -3.799 9.800 1.00 0.00 C ATOM 251 CG TYR A 17 8.170 -3.118 10.065 1.00 0.00 C ATOM 252 CD1 TYR A 17 7.648 -3.150 11.374 1.00 0.00 C ATOM 253 CD2 TYR A 17 7.387 -2.603 9.015 1.00 0.00 C ATOM 254 CE1 TYR A 17 6.343 -2.703 11.633 1.00 0.00 C ATOM 255 CE2 TYR A 17 6.083 -2.135 9.268 1.00 0.00 C ATOM 256 CZ TYR A 17 5.546 -2.215 10.574 1.00 0.00 C ATOM 257 OH TYR A 17 4.253 -1.859 10.806 1.00 0.00 O ATOM 0 H TYR A 17 11.544 -4.968 10.105 1.00 0.00 H new ATOM 0 HA TYR A 17 10.995 -2.391 9.167 1.00 0.00 H new ATOM 0 HB2 TYR A 17 9.498 -4.128 8.761 1.00 0.00 H new ATOM 0 HB3 TYR A 17 9.537 -4.696 10.418 1.00 0.00 H new ATOM 0 HD1 TYR A 17 8.257 -3.522 12.185 1.00 0.00 H new ATOM 0 HD2 TYR A 17 7.787 -2.567 8.013 1.00 0.00 H new ATOM 0 HE1 TYR A 17 5.950 -2.732 12.638 1.00 0.00 H new ATOM 0 HE2 TYR A 17 5.494 -1.716 8.466 1.00 0.00 H new ATOM 0 HH TYR A 17 4.161 -1.542 11.729 1.00 0.00 H new ATOM 267 N ASN A 18 10.942 -2.509 12.442 1.00 0.00 N ATOM 268 CA ASN A 18 10.873 -1.679 13.635 1.00 0.00 C ATOM 269 C ASN A 18 11.998 -0.644 13.656 1.00 0.00 C ATOM 270 O ASN A 18 11.748 0.510 13.999 1.00 0.00 O ATOM 271 CB ASN A 18 10.893 -2.549 14.900 1.00 0.00 C ATOM 272 CG ASN A 18 10.473 -1.750 16.128 1.00 0.00 C ATOM 273 OD1 ASN A 18 9.605 -0.876 16.047 1.00 0.00 O ATOM 274 ND2 ASN A 18 11.029 -2.060 17.284 1.00 0.00 N ATOM 0 H ASN A 18 11.154 -3.487 12.638 1.00 0.00 H new ATOM 0 HA ASN A 18 9.929 -1.134 13.614 1.00 0.00 H new ATOM 0 HB2 ASN A 18 10.223 -3.399 14.770 1.00 0.00 H new ATOM 0 HB3 ASN A 18 11.894 -2.952 15.051 1.00 0.00 H new ATOM 0 HD21 ASN A 18 10.743 -1.574 18.134 1.00 0.00 H new ATOM 0 HD22 ASN A 18 11.744 -2.786 17.327 1.00 0.00 H new ATOM 281 N LEU A 19 13.224 -1.035 13.289 1.00 0.00 N ATOM 282 CA LEU A 19 14.355 -0.127 13.178 1.00 0.00 C ATOM 283 C LEU A 19 14.075 0.921 12.123 1.00 0.00 C ATOM 284 O LEU A 19 14.107 2.103 12.433 1.00 0.00 O ATOM 285 CB LEU A 19 15.652 -0.885 12.868 1.00 0.00 C ATOM 286 CG LEU A 19 16.320 -1.504 14.102 1.00 0.00 C ATOM 287 CD1 LEU A 19 15.401 -2.178 15.121 1.00 0.00 C ATOM 288 CD2 LEU A 19 17.372 -2.509 13.641 1.00 0.00 C ATOM 0 H LEU A 19 13.454 -2.002 13.060 1.00 0.00 H new ATOM 0 HA LEU A 19 14.492 0.370 14.138 1.00 0.00 H new ATOM 0 HB2 LEU A 19 15.436 -1.675 12.149 1.00 0.00 H new ATOM 0 HB3 LEU A 19 16.355 -0.202 12.390 1.00 0.00 H new ATOM 0 HG LEU A 19 16.744 -0.655 14.639 1.00 0.00 H new ATOM 0 HD11 LEU A 19 15.997 -2.574 15.943 1.00 0.00 H new ATOM 0 HD12 LEU A 19 14.689 -1.449 15.507 1.00 0.00 H new ATOM 0 HD13 LEU A 19 14.860 -2.993 14.640 1.00 0.00 H new ATOM 0 HD21 LEU A 19 17.854 -2.956 14.511 1.00 0.00 H new ATOM 0 HD22 LEU A 19 16.894 -3.290 13.049 1.00 0.00 H new ATOM 0 HD23 LEU A 19 18.120 -2.000 13.033 1.00 0.00 H new ATOM 300 N VAL A 20 13.746 0.497 10.904 1.00 0.00 N ATOM 301 CA VAL A 20 13.425 1.407 9.810 1.00 0.00 C ATOM 302 C VAL A 20 12.287 2.360 10.199 1.00 0.00 C ATOM 303 O VAL A 20 12.326 3.533 9.827 1.00 0.00 O ATOM 304 CB VAL A 20 13.162 0.555 8.553 1.00 0.00 C ATOM 305 CG1 VAL A 20 12.392 1.239 7.427 1.00 0.00 C ATOM 306 CG2 VAL A 20 14.513 0.126 7.979 1.00 0.00 C ATOM 0 H VAL A 20 13.695 -0.489 10.648 1.00 0.00 H new ATOM 0 HA VAL A 20 14.257 2.074 9.584 1.00 0.00 H new ATOM 0 HB VAL A 20 12.534 -0.268 8.893 1.00 0.00 H new ATOM 0 HG11 VAL A 20 12.267 0.544 6.597 1.00 0.00 H new ATOM 0 HG12 VAL A 20 11.412 1.548 7.792 1.00 0.00 H new ATOM 0 HG13 VAL A 20 12.946 2.114 7.087 1.00 0.00 H new ATOM 0 HG21 VAL A 20 14.354 -0.480 7.087 1.00 0.00 H new ATOM 0 HG22 VAL A 20 15.095 1.010 7.718 1.00 0.00 H new ATOM 0 HG23 VAL A 20 15.055 -0.459 8.722 1.00 0.00 H new ATOM 316 N ARG A 21 11.298 1.901 10.974 1.00 0.00 N ATOM 317 CA ARG A 21 10.220 2.750 11.465 1.00 0.00 C ATOM 318 C ARG A 21 10.750 3.810 12.433 1.00 0.00 C ATOM 319 O ARG A 21 10.254 4.935 12.400 1.00 0.00 O ATOM 320 CB ARG A 21 9.122 1.893 12.120 1.00 0.00 C ATOM 321 CG ARG A 21 7.904 2.734 12.538 1.00 0.00 C ATOM 322 CD ARG A 21 6.946 1.928 13.414 1.00 0.00 C ATOM 323 NE ARG A 21 5.916 2.808 13.992 1.00 0.00 N ATOM 324 CZ ARG A 21 5.276 2.627 15.152 1.00 0.00 C ATOM 325 NH1 ARG A 21 5.426 1.499 15.838 1.00 0.00 N ATOM 326 NH2 ARG A 21 4.474 3.575 15.619 1.00 0.00 N ATOM 0 H ARG A 21 11.227 0.929 11.276 1.00 0.00 H new ATOM 0 HA ARG A 21 9.782 3.275 10.617 1.00 0.00 H new ATOM 0 HB2 ARG A 21 8.804 1.117 11.423 1.00 0.00 H new ATOM 0 HB3 ARG A 21 9.531 1.388 12.995 1.00 0.00 H new ATOM 0 HG2 ARG A 21 8.239 3.618 13.080 1.00 0.00 H new ATOM 0 HG3 ARG A 21 7.379 3.085 11.649 1.00 0.00 H new ATOM 0 HD2 ARG A 21 6.473 1.144 12.822 1.00 0.00 H new ATOM 0 HD3 ARG A 21 7.501 1.434 14.212 1.00 0.00 H new ATOM 0 HE ARG A 21 5.666 3.638 13.454 1.00 0.00 H new ATOM 0 HH11 ARG A 21 6.034 0.762 15.481 1.00 0.00 H new ATOM 0 HH12 ARG A 21 4.934 1.370 16.722 1.00 0.00 H new ATOM 0 HH21 ARG A 21 4.347 4.440 15.093 1.00 0.00 H new ATOM 0 HH22 ARG A 21 3.985 3.439 16.504 1.00 0.00 H new ATOM 340 N ASP A 22 11.717 3.504 13.297 1.00 0.00 N ATOM 341 CA ASP A 22 12.202 4.482 14.267 1.00 0.00 C ATOM 342 C ASP A 22 13.109 5.492 13.564 1.00 0.00 C ATOM 343 O ASP A 22 14.140 5.129 12.996 1.00 0.00 O ATOM 344 CB ASP A 22 12.971 3.786 15.402 1.00 0.00 C ATOM 345 CG ASP A 22 13.582 4.784 16.391 1.00 0.00 C ATOM 346 OD1 ASP A 22 13.095 5.932 16.499 1.00 0.00 O ATOM 347 OD2 ASP A 22 14.568 4.426 17.073 1.00 0.00 O ATOM 0 H ASP A 22 12.176 2.594 13.345 1.00 0.00 H new ATOM 0 HA ASP A 22 11.347 5.001 14.700 1.00 0.00 H new ATOM 0 HB2 ASP A 22 12.297 3.116 15.936 1.00 0.00 H new ATOM 0 HB3 ASP A 22 13.763 3.170 14.976 1.00 0.00 H new ATOM 352 N ASP A 23 12.784 6.783 13.654 1.00 0.00 N ATOM 353 CA ASP A 23 13.625 7.839 13.100 1.00 0.00 C ATOM 354 C ASP A 23 14.946 7.954 13.862 1.00 0.00 C ATOM 355 O ASP A 23 15.900 8.531 13.344 1.00 0.00 O ATOM 356 CB ASP A 23 12.905 9.191 13.130 1.00 0.00 C ATOM 357 CG ASP A 23 11.939 9.403 11.969 1.00 0.00 C ATOM 358 OD1 ASP A 23 12.412 9.799 10.881 1.00 0.00 O ATOM 359 OD2 ASP A 23 10.707 9.276 12.166 1.00 0.00 O ATOM 0 H ASP A 23 11.937 7.121 14.110 1.00 0.00 H new ATOM 0 HA ASP A 23 13.835 7.569 12.065 1.00 0.00 H new ATOM 0 HB2 ASP A 23 12.356 9.278 14.067 1.00 0.00 H new ATOM 0 HB3 ASP A 23 13.649 9.988 13.121 1.00 0.00 H new ATOM 364 N GLY A 24 15.016 7.433 15.089 1.00 0.00 N ATOM 365 CA GLY A 24 16.217 7.400 15.910 1.00 0.00 C ATOM 366 C GLY A 24 17.153 6.252 15.533 1.00 0.00 C ATOM 367 O GLY A 24 18.282 6.208 16.040 1.00 0.00 O ATOM 0 H GLY A 24 14.209 7.010 15.549 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.749 8.346 15.808 1.00 0.00 H new ATOM 0 HA3 GLY A 24 15.934 7.304 16.958 1.00 0.00 H new ATOM 371 N SER A 25 16.713 5.298 14.704 1.00 0.00 N ATOM 372 CA SER A 25 17.592 4.242 14.241 1.00 0.00 C ATOM 373 C SER A 25 18.521 4.877 13.211 1.00 0.00 C ATOM 374 O SER A 25 18.122 5.746 12.433 1.00 0.00 O ATOM 375 CB SER A 25 16.802 3.087 13.618 1.00 0.00 C ATOM 376 OG SER A 25 17.688 2.037 13.261 1.00 0.00 O ATOM 0 H SER A 25 15.759 5.244 14.348 1.00 0.00 H new ATOM 0 HA SER A 25 18.152 3.816 15.073 1.00 0.00 H new ATOM 0 HB2 SER A 25 16.056 2.722 14.324 1.00 0.00 H new ATOM 0 HB3 SER A 25 16.263 3.436 12.737 1.00 0.00 H new ATOM 0 HG SER A 25 17.442 1.222 13.747 1.00 0.00 H new ATOM 382 N ALA A 26 19.776 4.439 13.204 1.00 0.00 N ATOM 383 CA ALA A 26 20.757 4.879 12.227 1.00 0.00 C ATOM 384 C ALA A 26 20.456 4.268 10.851 1.00 0.00 C ATOM 385 O ALA A 26 21.046 4.698 9.862 1.00 0.00 O ATOM 386 CB ALA A 26 22.146 4.463 12.715 1.00 0.00 C ATOM 0 H ALA A 26 20.139 3.767 13.880 1.00 0.00 H new ATOM 0 HA ALA A 26 20.716 5.963 12.121 1.00 0.00 H new ATOM 0 HB1 ALA A 26 22.897 4.785 11.993 1.00 0.00 H new ATOM 0 HB2 ALA A 26 22.347 4.928 13.680 1.00 0.00 H new ATOM 0 HB3 ALA A 26 22.185 3.379 12.820 1.00 0.00 H new ATOM 392 N VAL A 27 19.597 3.246 10.795 1.00 0.00 N ATOM 393 CA VAL A 27 19.148 2.551 9.602 1.00 0.00 C ATOM 394 C VAL A 27 17.950 3.298 9.007 1.00 0.00 C ATOM 395 O VAL A 27 17.057 3.727 9.742 1.00 0.00 O ATOM 396 CB VAL A 27 18.749 1.113 10.009 1.00 0.00 C ATOM 397 CG1 VAL A 27 18.267 0.267 8.826 1.00 0.00 C ATOM 398 CG2 VAL A 27 19.913 0.359 10.675 1.00 0.00 C ATOM 0 H VAL A 27 19.174 2.863 11.641 1.00 0.00 H new ATOM 0 HA VAL A 27 19.936 2.511 8.850 1.00 0.00 H new ATOM 0 HB VAL A 27 17.929 1.245 10.715 1.00 0.00 H new ATOM 0 HG11 VAL A 27 18.002 -0.731 9.176 1.00 0.00 H new ATOM 0 HG12 VAL A 27 17.393 0.737 8.375 1.00 0.00 H new ATOM 0 HG13 VAL A 27 19.062 0.192 8.084 1.00 0.00 H new ATOM 0 HG21 VAL A 27 19.589 -0.646 10.945 1.00 0.00 H new ATOM 0 HG22 VAL A 27 20.751 0.296 9.980 1.00 0.00 H new ATOM 0 HG23 VAL A 27 20.226 0.892 11.573 1.00 0.00 H new ATOM 408 N ILE A 28 17.929 3.465 7.682 1.00 0.00 N ATOM 409 CA ILE A 28 16.826 4.060 6.946 1.00 0.00 C ATOM 410 C ILE A 28 16.211 3.027 5.988 1.00 0.00 C ATOM 411 O ILE A 28 15.026 3.140 5.679 1.00 0.00 O ATOM 412 CB ILE A 28 17.226 5.388 6.264 1.00 0.00 C ATOM 413 CG1 ILE A 28 17.981 5.249 4.921 1.00 0.00 C ATOM 414 CG2 ILE A 28 17.997 6.314 7.226 1.00 0.00 C ATOM 415 CD1 ILE A 28 17.024 5.186 3.720 1.00 0.00 C ATOM 0 H ILE A 28 18.703 3.180 7.081 1.00 0.00 H new ATOM 0 HA ILE A 28 16.045 4.341 7.652 1.00 0.00 H new ATOM 0 HB ILE A 28 16.271 5.845 6.006 1.00 0.00 H new ATOM 0 HG12 ILE A 28 18.659 6.093 4.799 1.00 0.00 H new ATOM 0 HG13 ILE A 28 18.594 4.348 4.942 1.00 0.00 H new ATOM 0 HG21 ILE A 28 18.261 7.237 6.710 1.00 0.00 H new ATOM 0 HG22 ILE A 28 17.371 6.546 8.087 1.00 0.00 H new ATOM 0 HG23 ILE A 28 18.906 5.814 7.562 1.00 0.00 H new ATOM 0 HD11 ILE A 28 17.601 5.089 2.800 1.00 0.00 H new ATOM 0 HD12 ILE A 28 16.363 4.326 3.827 1.00 0.00 H new ATOM 0 HD13 ILE A 28 16.429 6.099 3.680 1.00 0.00 H new ATOM 427 N TRP A 29 16.968 2.026 5.509 1.00 0.00 N ATOM 428 CA TRP A 29 16.467 1.013 4.582 1.00 0.00 C ATOM 429 C TRP A 29 16.824 -0.388 5.051 1.00 0.00 C ATOM 430 O TRP A 29 17.827 -0.593 5.728 1.00 0.00 O ATOM 431 CB TRP A 29 16.964 1.249 3.142 1.00 0.00 C ATOM 432 CG TRP A 29 18.429 1.115 2.845 1.00 0.00 C ATOM 433 CD1 TRP A 29 19.293 2.140 2.660 1.00 0.00 C ATOM 434 CD2 TRP A 29 19.202 -0.105 2.602 1.00 0.00 C ATOM 435 NE1 TRP A 29 20.546 1.638 2.381 1.00 0.00 N ATOM 436 CE2 TRP A 29 20.557 0.263 2.366 1.00 0.00 C ATOM 437 CE3 TRP A 29 18.905 -1.485 2.557 1.00 0.00 C ATOM 438 CZ2 TRP A 29 21.577 -0.685 2.207 1.00 0.00 C ATOM 439 CZ3 TRP A 29 19.917 -2.447 2.361 1.00 0.00 C ATOM 440 CH2 TRP A 29 21.254 -2.049 2.207 1.00 0.00 C ATOM 0 H TRP A 29 17.949 1.901 5.759 1.00 0.00 H new ATOM 0 HA TRP A 29 15.381 1.104 4.572 1.00 0.00 H new ATOM 0 HB2 TRP A 29 16.432 0.554 2.493 1.00 0.00 H new ATOM 0 HB3 TRP A 29 16.660 2.254 2.850 1.00 0.00 H new ATOM 0 HD1 TRP A 29 19.040 3.188 2.721 1.00 0.00 H new ATOM 0 HE1 TRP A 29 21.367 2.217 2.206 1.00 0.00 H new ATOM 0 HE3 TRP A 29 17.882 -1.810 2.675 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 22.602 -0.368 2.086 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 19.662 -3.496 2.329 1.00 0.00 H new ATOM 0 HH2 TRP A 29 22.030 -2.790 2.089 1.00 0.00 H new ATOM 451 N VAL A 30 16.013 -1.352 4.629 1.00 0.00 N ATOM 452 CA VAL A 30 16.129 -2.791 4.844 1.00 0.00 C ATOM 453 C VAL A 30 15.746 -3.482 3.542 1.00 0.00 C ATOM 454 O VAL A 30 15.070 -2.903 2.692 1.00 0.00 O ATOM 455 CB VAL A 30 15.169 -3.187 5.989 1.00 0.00 C ATOM 456 CG1 VAL A 30 14.737 -4.661 6.067 1.00 0.00 C ATOM 457 CG2 VAL A 30 15.779 -2.821 7.349 1.00 0.00 C ATOM 0 H VAL A 30 15.184 -1.127 4.079 1.00 0.00 H new ATOM 0 HA VAL A 30 17.141 -3.084 5.122 1.00 0.00 H new ATOM 0 HB VAL A 30 14.269 -2.621 5.750 1.00 0.00 H new ATOM 0 HG11 VAL A 30 14.066 -4.799 6.915 1.00 0.00 H new ATOM 0 HG12 VAL A 30 14.222 -4.938 5.147 1.00 0.00 H new ATOM 0 HG13 VAL A 30 15.617 -5.292 6.195 1.00 0.00 H new ATOM 0 HG21 VAL A 30 15.091 -3.106 8.145 1.00 0.00 H new ATOM 0 HG22 VAL A 30 16.723 -3.350 7.479 1.00 0.00 H new ATOM 0 HG23 VAL A 30 15.957 -1.746 7.391 1.00 0.00 H new ATOM 467 N THR A 31 16.150 -4.737 3.398 1.00 0.00 N ATOM 468 CA THR A 31 15.795 -5.580 2.273 1.00 0.00 C ATOM 469 C THR A 31 15.103 -6.824 2.816 1.00 0.00 C ATOM 470 O THR A 31 15.355 -7.237 3.951 1.00 0.00 O ATOM 471 CB THR A 31 16.993 -5.910 1.370 1.00 0.00 C ATOM 472 OG1 THR A 31 18.078 -6.496 2.069 1.00 0.00 O ATOM 473 CG2 THR A 31 17.486 -4.695 0.588 1.00 0.00 C ATOM 0 H THR A 31 16.748 -5.205 4.079 1.00 0.00 H new ATOM 0 HA THR A 31 15.110 -5.040 1.619 1.00 0.00 H new ATOM 0 HB THR A 31 16.611 -6.649 0.666 1.00 0.00 H new ATOM 0 HG1 THR A 31 18.308 -5.939 2.842 1.00 0.00 H new ATOM 0 HG21 THR A 31 18.333 -4.982 -0.034 1.00 0.00 H new ATOM 0 HG22 THR A 31 16.682 -4.319 -0.045 1.00 0.00 H new ATOM 0 HG23 THR A 31 17.795 -3.915 1.284 1.00 0.00 H new ATOM 481 N PHE A 32 14.251 -7.434 2.000 1.00 0.00 N ATOM 482 CA PHE A 32 13.572 -8.673 2.312 1.00 0.00 C ATOM 483 C PHE A 32 13.938 -9.633 1.192 1.00 0.00 C ATOM 484 O PHE A 32 13.792 -9.307 0.012 1.00 0.00 O ATOM 485 CB PHE A 32 12.058 -8.450 2.461 1.00 0.00 C ATOM 486 CG PHE A 32 11.658 -7.692 3.718 1.00 0.00 C ATOM 487 CD1 PHE A 32 12.090 -8.148 4.978 1.00 0.00 C ATOM 488 CD2 PHE A 32 10.854 -6.536 3.643 1.00 0.00 C ATOM 489 CE1 PHE A 32 11.789 -7.422 6.142 1.00 0.00 C ATOM 490 CE2 PHE A 32 10.504 -5.846 4.819 1.00 0.00 C ATOM 491 CZ PHE A 32 10.986 -6.274 6.067 1.00 0.00 C ATOM 0 H PHE A 32 14.011 -7.065 1.080 1.00 0.00 H new ATOM 0 HA PHE A 32 13.880 -9.088 3.272 1.00 0.00 H new ATOM 0 HB2 PHE A 32 11.696 -7.903 1.590 1.00 0.00 H new ATOM 0 HB3 PHE A 32 11.558 -9.419 2.460 1.00 0.00 H new ATOM 0 HD1 PHE A 32 12.658 -9.064 5.050 1.00 0.00 H new ATOM 0 HD2 PHE A 32 10.507 -6.180 2.684 1.00 0.00 H new ATOM 0 HE1 PHE A 32 12.176 -7.748 7.096 1.00 0.00 H new ATOM 0 HE2 PHE A 32 9.860 -4.981 4.761 1.00 0.00 H new ATOM 0 HZ PHE A 32 10.740 -5.723 6.963 1.00 0.00 H new ATOM 501 N LYS A 33 14.498 -10.779 1.565 1.00 0.00 N ATOM 502 CA LYS A 33 14.890 -11.852 0.670 1.00 0.00 C ATOM 503 C LYS A 33 13.849 -12.957 0.886 1.00 0.00 C ATOM 504 O LYS A 33 12.984 -12.835 1.757 1.00 0.00 O ATOM 505 CB LYS A 33 16.300 -12.371 1.060 1.00 0.00 C ATOM 506 CG LYS A 33 17.417 -11.343 1.362 1.00 0.00 C ATOM 507 CD LYS A 33 17.971 -10.686 0.096 1.00 0.00 C ATOM 508 CE LYS A 33 19.277 -9.885 0.302 1.00 0.00 C ATOM 509 NZ LYS A 33 19.140 -8.411 0.174 1.00 0.00 N ATOM 0 H LYS A 33 14.698 -10.990 2.543 1.00 0.00 H new ATOM 0 HA LYS A 33 14.932 -11.527 -0.370 1.00 0.00 H new ATOM 0 HB2 LYS A 33 16.187 -13.003 1.941 1.00 0.00 H new ATOM 0 HB3 LYS A 33 16.651 -13.011 0.251 1.00 0.00 H new ATOM 0 HG2 LYS A 33 17.026 -10.572 2.026 1.00 0.00 H new ATOM 0 HG3 LYS A 33 18.228 -11.840 1.894 1.00 0.00 H new ATOM 0 HD2 LYS A 33 18.150 -11.460 -0.650 1.00 0.00 H new ATOM 0 HD3 LYS A 33 17.212 -10.019 -0.312 1.00 0.00 H new ATOM 0 HE2 LYS A 33 19.672 -10.113 1.292 1.00 0.00 H new ATOM 0 HE3 LYS A 33 20.014 -10.230 -0.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 20.082 -7.982 0.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 18.566 -8.187 -0.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 18.675 -8.030 1.023 1.00 0.00 H new ATOM 523 N TYR A 34 13.927 -14.036 0.121 1.00 0.00 N ATOM 524 CA TYR A 34 13.056 -15.194 0.296 1.00 0.00 C ATOM 525 C TYR A 34 13.922 -16.366 0.713 1.00 0.00 C ATOM 526 O TYR A 34 15.099 -16.429 0.349 1.00 0.00 O ATOM 527 CB TYR A 34 12.341 -15.568 -1.013 1.00 0.00 C ATOM 528 CG TYR A 34 11.278 -14.585 -1.433 1.00 0.00 C ATOM 529 CD1 TYR A 34 11.655 -13.341 -1.966 1.00 0.00 C ATOM 530 CD2 TYR A 34 9.917 -14.894 -1.251 1.00 0.00 C ATOM 531 CE1 TYR A 34 10.683 -12.365 -2.215 1.00 0.00 C ATOM 532 CE2 TYR A 34 8.935 -13.935 -1.549 1.00 0.00 C ATOM 533 CZ TYR A 34 9.322 -12.642 -1.972 1.00 0.00 C ATOM 534 OH TYR A 34 8.399 -11.656 -2.105 1.00 0.00 O ATOM 0 H TYR A 34 14.597 -14.136 -0.641 1.00 0.00 H new ATOM 0 HA TYR A 34 12.300 -14.954 1.044 1.00 0.00 H new ATOM 0 HB2 TYR A 34 13.081 -15.649 -1.809 1.00 0.00 H new ATOM 0 HB3 TYR A 34 11.887 -16.552 -0.899 1.00 0.00 H new ATOM 0 HD1 TYR A 34 12.693 -13.138 -2.183 1.00 0.00 H new ATOM 0 HD2 TYR A 34 9.628 -15.867 -0.883 1.00 0.00 H new ATOM 0 HE1 TYR A 34 10.976 -11.397 -2.594 1.00 0.00 H new ATOM 0 HE2 TYR A 34 7.888 -14.184 -1.455 1.00 0.00 H new ATOM 0 HH TYR A 34 8.608 -11.117 -2.896 1.00 0.00 H new ATOM 544 N ASP A 35 13.344 -17.310 1.444 1.00 0.00 N ATOM 545 CA ASP A 35 14.004 -18.540 1.844 1.00 0.00 C ATOM 546 C ASP A 35 12.938 -19.623 1.906 1.00 0.00 C ATOM 547 O ASP A 35 11.946 -19.438 2.602 1.00 0.00 O ATOM 548 CB ASP A 35 14.648 -18.369 3.216 1.00 0.00 C ATOM 549 CG ASP A 35 15.357 -19.661 3.603 1.00 0.00 C ATOM 550 OD1 ASP A 35 16.523 -19.839 3.180 1.00 0.00 O ATOM 551 OD2 ASP A 35 14.739 -20.541 4.245 1.00 0.00 O ATOM 0 H ASP A 35 12.384 -17.238 1.781 1.00 0.00 H new ATOM 0 HA ASP A 35 14.787 -18.804 1.134 1.00 0.00 H new ATOM 0 HB2 ASP A 35 15.358 -17.542 3.197 1.00 0.00 H new ATOM 0 HB3 ASP A 35 13.890 -18.120 3.958 1.00 0.00 H new ATOM 556 N GLY A 36 13.120 -20.726 1.180 1.00 0.00 N ATOM 557 CA GLY A 36 12.254 -21.900 1.172 1.00 0.00 C ATOM 558 C GLY A 36 10.777 -21.608 0.898 1.00 0.00 C ATOM 559 O GLY A 36 10.317 -21.748 -0.234 1.00 0.00 O ATOM 0 H GLY A 36 13.916 -20.828 0.551 1.00 0.00 H new ATOM 0 HA2 GLY A 36 12.618 -22.597 0.417 1.00 0.00 H new ATOM 0 HA3 GLY A 36 12.338 -22.402 2.136 1.00 0.00 H new ATOM 563 N SER A 37 10.014 -21.249 1.929 1.00 0.00 N ATOM 564 CA SER A 37 8.600 -20.913 1.844 1.00 0.00 C ATOM 565 C SER A 37 8.255 -19.660 2.666 1.00 0.00 C ATOM 566 O SER A 37 7.121 -19.542 3.146 1.00 0.00 O ATOM 567 CB SER A 37 7.777 -22.157 2.213 1.00 0.00 C ATOM 568 OG SER A 37 8.078 -22.653 3.504 1.00 0.00 O ATOM 0 H SER A 37 10.380 -21.183 2.879 1.00 0.00 H new ATOM 0 HA SER A 37 8.341 -20.636 0.822 1.00 0.00 H new ATOM 0 HB2 SER A 37 6.716 -21.913 2.161 1.00 0.00 H new ATOM 0 HB3 SER A 37 7.960 -22.939 1.477 1.00 0.00 H new ATOM 0 HG SER A 37 7.526 -23.442 3.688 1.00 0.00 H new ATOM 574 N THR A 38 9.212 -18.757 2.912 1.00 0.00 N ATOM 575 CA THR A 38 8.993 -17.579 3.738 1.00 0.00 C ATOM 576 C THR A 38 9.793 -16.371 3.247 1.00 0.00 C ATOM 577 O THR A 38 10.643 -16.476 2.356 1.00 0.00 O ATOM 578 CB THR A 38 9.278 -17.959 5.206 1.00 0.00 C ATOM 579 OG1 THR A 38 8.663 -17.086 6.124 1.00 0.00 O ATOM 580 CG2 THR A 38 10.763 -18.021 5.554 1.00 0.00 C ATOM 0 H THR A 38 10.159 -18.829 2.540 1.00 0.00 H new ATOM 0 HA THR A 38 7.954 -17.257 3.662 1.00 0.00 H new ATOM 0 HB THR A 38 8.852 -18.959 5.293 1.00 0.00 H new ATOM 0 HG1 THR A 38 8.873 -17.371 7.038 1.00 0.00 H new ATOM 0 HG21 THR A 38 10.880 -18.294 6.603 1.00 0.00 H new ATOM 0 HG22 THR A 38 11.253 -18.767 4.928 1.00 0.00 H new ATOM 0 HG23 THR A 38 11.218 -17.046 5.380 1.00 0.00 H new ATOM 588 N ILE A 39 9.477 -15.212 3.826 1.00 0.00 N ATOM 589 CA ILE A 39 10.153 -13.943 3.603 1.00 0.00 C ATOM 590 C ILE A 39 11.149 -13.839 4.756 1.00 0.00 C ATOM 591 O ILE A 39 10.785 -14.146 5.897 1.00 0.00 O ATOM 592 CB ILE A 39 9.167 -12.746 3.665 1.00 0.00 C ATOM 593 CG1 ILE A 39 7.895 -12.894 2.805 1.00 0.00 C ATOM 594 CG2 ILE A 39 9.881 -11.430 3.309 1.00 0.00 C ATOM 595 CD1 ILE A 39 8.142 -13.126 1.316 1.00 0.00 C ATOM 0 H ILE A 39 8.708 -15.134 4.492 1.00 0.00 H new ATOM 0 HA ILE A 39 10.618 -13.909 2.618 1.00 0.00 H new ATOM 0 HB ILE A 39 8.824 -12.731 4.700 1.00 0.00 H new ATOM 0 HG12 ILE A 39 7.307 -13.726 3.194 1.00 0.00 H new ATOM 0 HG13 ILE A 39 7.290 -11.995 2.921 1.00 0.00 H new ATOM 0 HG21 ILE A 39 9.170 -10.605 3.359 1.00 0.00 H new ATOM 0 HG22 ILE A 39 10.692 -11.253 4.015 1.00 0.00 H new ATOM 0 HG23 ILE A 39 10.287 -11.498 2.300 1.00 0.00 H new ATOM 0 HD11 ILE A 39 7.187 -13.217 0.799 1.00 0.00 H new ATOM 0 HD12 ILE A 39 8.699 -12.285 0.904 1.00 0.00 H new ATOM 0 HD13 ILE A 39 8.716 -14.042 1.181 1.00 0.00 H new ATOM 607 N VAL A 40 12.371 -13.383 4.482 1.00 0.00 N ATOM 608 CA VAL A 40 13.398 -13.203 5.507 1.00 0.00 C ATOM 609 C VAL A 40 14.037 -11.815 5.404 1.00 0.00 C ATOM 610 O VAL A 40 14.144 -11.281 4.298 1.00 0.00 O ATOM 611 CB VAL A 40 14.442 -14.332 5.432 1.00 0.00 C ATOM 612 CG1 VAL A 40 13.777 -15.707 5.410 1.00 0.00 C ATOM 613 CG2 VAL A 40 15.347 -14.251 4.204 1.00 0.00 C ATOM 0 H VAL A 40 12.677 -13.128 3.543 1.00 0.00 H new ATOM 0 HA VAL A 40 12.926 -13.263 6.488 1.00 0.00 H new ATOM 0 HB VAL A 40 15.049 -14.200 6.328 1.00 0.00 H new ATOM 0 HG11 VAL A 40 14.543 -16.481 5.357 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.188 -15.841 6.317 1.00 0.00 H new ATOM 0 HG13 VAL A 40 13.125 -15.782 4.540 1.00 0.00 H new ATOM 0 HG21 VAL A 40 16.056 -15.079 4.220 1.00 0.00 H new ATOM 0 HG22 VAL A 40 14.740 -14.310 3.300 1.00 0.00 H new ATOM 0 HG23 VAL A 40 15.891 -13.307 4.215 1.00 0.00 H new ATOM 623 N PRO A 41 14.474 -11.195 6.512 1.00 0.00 N ATOM 624 CA PRO A 41 15.176 -9.921 6.446 1.00 0.00 C ATOM 625 C PRO A 41 16.575 -10.167 5.869 1.00 0.00 C ATOM 626 O PRO A 41 17.225 -11.169 6.193 1.00 0.00 O ATOM 627 CB PRO A 41 15.208 -9.394 7.881 1.00 0.00 C ATOM 628 CG PRO A 41 15.142 -10.663 8.728 1.00 0.00 C ATOM 629 CD PRO A 41 14.293 -11.618 7.892 1.00 0.00 C ATOM 0 HA PRO A 41 14.696 -9.186 5.800 1.00 0.00 H new ATOM 0 HB2 PRO A 41 16.117 -8.826 8.080 1.00 0.00 H new ATOM 0 HB3 PRO A 41 14.367 -8.731 8.084 1.00 0.00 H new ATOM 0 HG2 PRO A 41 16.135 -11.071 8.915 1.00 0.00 H new ATOM 0 HG3 PRO A 41 14.688 -10.471 9.700 1.00 0.00 H new ATOM 0 HD2 PRO A 41 14.613 -12.651 8.031 1.00 0.00 H new ATOM 0 HD3 PRO A 41 13.244 -11.567 8.183 1.00 0.00 H new ATOM 637 N GLY A 42 17.034 -9.262 5.010 1.00 0.00 N ATOM 638 CA GLY A 42 18.357 -9.266 4.405 1.00 0.00 C ATOM 639 C GLY A 42 19.181 -8.113 4.960 1.00 0.00 C ATOM 640 O GLY A 42 19.050 -7.754 6.132 1.00 0.00 O ATOM 0 H GLY A 42 16.467 -8.471 4.705 1.00 0.00 H new ATOM 0 HA2 GLY A 42 18.857 -10.213 4.608 1.00 0.00 H new ATOM 0 HA3 GLY A 42 18.272 -9.176 3.322 1.00 0.00 H new ATOM 644 N GLU A 43 20.065 -7.568 4.125 1.00 0.00 N ATOM 645 CA GLU A 43 20.874 -6.401 4.451 1.00 0.00 C ATOM 646 C GLU A 43 19.995 -5.195 4.784 1.00 0.00 C ATOM 647 O GLU A 43 18.834 -5.122 4.357 1.00 0.00 O ATOM 648 CB GLU A 43 21.763 -6.028 3.254 1.00 0.00 C ATOM 649 CG GLU A 43 23.033 -6.878 3.142 1.00 0.00 C ATOM 650 CD GLU A 43 24.203 -5.998 2.709 1.00 0.00 C ATOM 651 OE1 GLU A 43 24.709 -5.247 3.576 1.00 0.00 O ATOM 652 OE2 GLU A 43 24.528 -5.991 1.497 1.00 0.00 O ATOM 0 H GLU A 43 20.240 -7.933 3.189 1.00 0.00 H new ATOM 0 HA GLU A 43 21.484 -6.656 5.318 1.00 0.00 H new ATOM 0 HB2 GLU A 43 21.184 -6.133 2.336 1.00 0.00 H new ATOM 0 HB3 GLU A 43 22.045 -4.978 3.335 1.00 0.00 H new ATOM 0 HG2 GLU A 43 23.254 -7.348 4.100 1.00 0.00 H new ATOM 0 HG3 GLU A 43 22.883 -7.681 2.420 1.00 0.00 H new ATOM 659 N GLN A 44 20.594 -4.228 5.475 1.00 0.00 N ATOM 660 CA GLN A 44 20.009 -2.953 5.846 1.00 0.00 C ATOM 661 C GLN A 44 21.079 -1.867 5.714 1.00 0.00 C ATOM 662 O GLN A 44 22.269 -2.172 5.606 1.00 0.00 O ATOM 663 CB GLN A 44 19.391 -3.070 7.251 1.00 0.00 C ATOM 664 CG GLN A 44 20.388 -3.339 8.391 1.00 0.00 C ATOM 665 CD GLN A 44 19.694 -3.626 9.725 1.00 0.00 C ATOM 666 OE1 GLN A 44 18.598 -4.182 9.785 1.00 0.00 O ATOM 667 NE2 GLN A 44 20.313 -3.294 10.845 1.00 0.00 N ATOM 0 H GLN A 44 21.554 -4.324 5.807 1.00 0.00 H new ATOM 0 HA GLN A 44 19.193 -2.668 5.182 1.00 0.00 H new ATOM 0 HB2 GLN A 44 18.854 -2.147 7.471 1.00 0.00 H new ATOM 0 HB3 GLN A 44 18.654 -3.873 7.239 1.00 0.00 H new ATOM 0 HG2 GLN A 44 21.019 -4.187 8.124 1.00 0.00 H new ATOM 0 HG3 GLN A 44 21.045 -2.477 8.505 1.00 0.00 H new ATOM 0 HE21 GLN A 44 21.222 -2.833 10.808 1.00 0.00 H new ATOM 0 HE22 GLN A 44 19.882 -3.499 11.746 1.00 0.00 H new ATOM 676 N GLY A 45 20.684 -0.597 5.732 1.00 0.00 N ATOM 677 CA GLY A 45 21.609 0.503 5.528 1.00 0.00 C ATOM 678 C GLY A 45 21.008 1.855 5.867 1.00 0.00 C ATOM 679 O GLY A 45 19.843 1.964 6.253 1.00 0.00 O ATOM 0 H GLY A 45 19.719 -0.307 5.888 1.00 0.00 H new ATOM 0 HA2 GLY A 45 22.496 0.342 6.140 1.00 0.00 H new ATOM 0 HA3 GLY A 45 21.936 0.507 4.488 1.00 0.00 H new ATOM 683 N ALA A 46 21.824 2.894 5.707 1.00 0.00 N ATOM 684 CA ALA A 46 21.514 4.274 6.049 1.00 0.00 C ATOM 685 C ALA A 46 21.672 5.238 4.882 1.00 0.00 C ATOM 686 O ALA A 46 21.239 6.383 4.969 1.00 0.00 O ATOM 687 CB ALA A 46 22.476 4.701 7.147 1.00 0.00 C ATOM 0 H ALA A 46 22.761 2.789 5.318 1.00 0.00 H new ATOM 0 HA ALA A 46 20.469 4.312 6.357 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.271 5.734 7.429 1.00 0.00 H new ATOM 0 HB2 ALA A 46 22.346 4.056 8.016 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.501 4.620 6.785 1.00 0.00 H new ATOM 693 N GLU A 47 22.302 4.811 3.791 1.00 0.00 N ATOM 694 CA GLU A 47 22.458 5.618 2.594 1.00 0.00 C ATOM 695 C GLU A 47 22.052 4.729 1.426 1.00 0.00 C ATOM 696 O GLU A 47 22.352 3.531 1.417 1.00 0.00 O ATOM 697 CB GLU A 47 23.893 6.184 2.530 1.00 0.00 C ATOM 698 CG GLU A 47 24.164 7.073 1.310 1.00 0.00 C ATOM 699 CD GLU A 47 23.024 8.051 1.019 1.00 0.00 C ATOM 700 OE1 GLU A 47 22.631 8.827 1.918 1.00 0.00 O ATOM 701 OE2 GLU A 47 22.428 7.939 -0.080 1.00 0.00 O ATOM 0 H GLU A 47 22.722 3.884 3.717 1.00 0.00 H new ATOM 0 HA GLU A 47 21.822 6.503 2.576 1.00 0.00 H new ATOM 0 HB2 GLU A 47 24.085 6.760 3.435 1.00 0.00 H new ATOM 0 HB3 GLU A 47 24.599 5.354 2.525 1.00 0.00 H new ATOM 0 HG2 GLU A 47 25.084 7.634 1.473 1.00 0.00 H new ATOM 0 HG3 GLU A 47 24.326 6.442 0.436 1.00 0.00 H new ATOM 708 N TYR A 48 21.430 5.317 0.410 1.00 0.00 N ATOM 709 CA TYR A 48 20.887 4.591 -0.723 1.00 0.00 C ATOM 710 C TYR A 48 21.986 4.317 -1.765 1.00 0.00 C ATOM 711 O TYR A 48 21.804 3.502 -2.658 1.00 0.00 O ATOM 712 CB TYR A 48 19.728 5.427 -1.285 1.00 0.00 C ATOM 713 CG TYR A 48 18.850 4.738 -2.310 1.00 0.00 C ATOM 714 CD1 TYR A 48 19.175 4.848 -3.672 1.00 0.00 C ATOM 715 CD2 TYR A 48 17.672 4.068 -1.926 1.00 0.00 C ATOM 716 CE1 TYR A 48 18.346 4.283 -4.655 1.00 0.00 C ATOM 717 CE2 TYR A 48 16.837 3.496 -2.905 1.00 0.00 C ATOM 718 CZ TYR A 48 17.176 3.596 -4.274 1.00 0.00 C ATOM 719 OH TYR A 48 16.417 2.978 -5.216 1.00 0.00 O ATOM 0 H TYR A 48 21.289 6.326 0.353 1.00 0.00 H new ATOM 0 HA TYR A 48 20.510 3.612 -0.427 1.00 0.00 H new ATOM 0 HB2 TYR A 48 19.100 5.747 -0.454 1.00 0.00 H new ATOM 0 HB3 TYR A 48 20.142 6.328 -1.737 1.00 0.00 H new ATOM 0 HD1 TYR A 48 20.072 5.373 -3.967 1.00 0.00 H new ATOM 0 HD2 TYR A 48 17.409 3.993 -0.881 1.00 0.00 H new ATOM 0 HE1 TYR A 48 18.604 4.375 -5.700 1.00 0.00 H new ATOM 0 HE2 TYR A 48 15.936 2.980 -2.609 1.00 0.00 H new ATOM 0 HH TYR A 48 16.605 3.368 -6.095 1.00 0.00 H new ATOM 729 N GLN A 49 23.178 4.900 -1.617 1.00 0.00 N ATOM 730 CA GLN A 49 24.325 4.641 -2.483 1.00 0.00 C ATOM 731 C GLN A 49 24.682 3.142 -2.460 1.00 0.00 C ATOM 732 O GLN A 49 25.060 2.568 -3.484 1.00 0.00 O ATOM 733 CB GLN A 49 25.474 5.520 -1.974 1.00 0.00 C ATOM 734 CG GLN A 49 26.734 5.466 -2.837 1.00 0.00 C ATOM 735 CD GLN A 49 27.786 6.447 -2.328 1.00 0.00 C ATOM 736 OE1 GLN A 49 28.843 6.052 -1.854 1.00 0.00 O ATOM 737 NE2 GLN A 49 27.520 7.743 -2.379 1.00 0.00 N ATOM 0 H GLN A 49 23.374 5.576 -0.879 1.00 0.00 H new ATOM 0 HA GLN A 49 24.109 4.887 -3.523 1.00 0.00 H new ATOM 0 HB2 GLN A 49 25.129 6.553 -1.918 1.00 0.00 H new ATOM 0 HB3 GLN A 49 25.729 5.214 -0.959 1.00 0.00 H new ATOM 0 HG2 GLN A 49 27.141 4.455 -2.830 1.00 0.00 H new ATOM 0 HG3 GLN A 49 26.482 5.701 -3.871 1.00 0.00 H new ATOM 0 HE21 GLN A 49 26.638 8.067 -2.775 1.00 0.00 H new ATOM 0 HE22 GLN A 49 28.197 8.417 -2.022 1.00 0.00 H new ATOM 746 N HIS A 50 24.552 2.505 -1.298 1.00 0.00 N ATOM 747 CA HIS A 50 24.760 1.071 -1.119 1.00 0.00 C ATOM 748 C HIS A 50 23.566 0.282 -1.666 1.00 0.00 C ATOM 749 O HIS A 50 23.743 -0.827 -2.167 1.00 0.00 O ATOM 750 CB HIS A 50 25.001 0.789 0.370 1.00 0.00 C ATOM 751 CG HIS A 50 26.024 1.719 0.983 1.00 0.00 C ATOM 752 ND1 HIS A 50 25.832 2.520 2.089 1.00 0.00 N ATOM 753 CD2 HIS A 50 27.260 2.013 0.469 1.00 0.00 C ATOM 754 CE1 HIS A 50 26.926 3.286 2.229 1.00 0.00 C ATOM 755 NE2 HIS A 50 27.819 3.022 1.260 1.00 0.00 N ATOM 0 H HIS A 50 24.293 2.983 -0.435 1.00 0.00 H new ATOM 0 HA HIS A 50 25.636 0.746 -1.681 1.00 0.00 H new ATOM 0 HB2 HIS A 50 24.059 0.885 0.911 1.00 0.00 H new ATOM 0 HB3 HIS A 50 25.335 -0.242 0.491 1.00 0.00 H new ATOM 0 HD2 HIS A 50 27.719 1.549 -0.391 1.00 0.00 H new ATOM 0 HE1 HIS A 50 27.069 4.015 3.013 1.00 0.00 H new ATOM 0 HE2 HIS A 50 28.726 3.469 1.127 1.00 0.00 H new ATOM 763 N PHE A 51 22.357 0.859 -1.649 1.00 0.00 N ATOM 764 CA PHE A 51 21.157 0.218 -2.177 1.00 0.00 C ATOM 765 C PHE A 51 21.284 -0.095 -3.660 1.00 0.00 C ATOM 766 O PHE A 51 20.741 -1.094 -4.135 1.00 0.00 O ATOM 767 CB PHE A 51 19.939 1.123 -2.013 1.00 0.00 C ATOM 768 CG PHE A 51 18.650 0.363 -2.185 1.00 0.00 C ATOM 769 CD1 PHE A 51 18.240 -0.563 -1.214 1.00 0.00 C ATOM 770 CD2 PHE A 51 17.889 0.542 -3.351 1.00 0.00 C ATOM 771 CE1 PHE A 51 17.059 -1.293 -1.410 1.00 0.00 C ATOM 772 CE2 PHE A 51 16.676 -0.138 -3.514 1.00 0.00 C ATOM 773 CZ PHE A 51 16.260 -1.062 -2.548 1.00 0.00 C ATOM 0 H PHE A 51 22.189 1.789 -1.265 1.00 0.00 H new ATOM 0 HA PHE A 51 21.037 -0.706 -1.612 1.00 0.00 H new ATOM 0 HB2 PHE A 51 19.960 1.585 -1.026 1.00 0.00 H new ATOM 0 HB3 PHE A 51 19.985 1.930 -2.744 1.00 0.00 H new ATOM 0 HD1 PHE A 51 18.830 -0.713 -0.322 1.00 0.00 H new ATOM 0 HD2 PHE A 51 18.241 1.207 -4.126 1.00 0.00 H new ATOM 0 HE1 PHE A 51 16.760 -2.036 -0.685 1.00 0.00 H new ATOM 0 HE2 PHE A 51 16.063 0.050 -4.383 1.00 0.00 H new ATOM 0 HZ PHE A 51 15.330 -1.596 -2.674 1.00 0.00 H new ATOM 783 N ILE A 52 22.007 0.748 -4.399 1.00 0.00 N ATOM 784 CA ILE A 52 22.199 0.550 -5.829 1.00 0.00 C ATOM 785 C ILE A 52 22.839 -0.832 -6.051 1.00 0.00 C ATOM 786 O ILE A 52 22.477 -1.535 -6.991 1.00 0.00 O ATOM 787 CB ILE A 52 23.027 1.696 -6.454 1.00 0.00 C ATOM 788 CG1 ILE A 52 22.718 3.106 -5.912 1.00 0.00 C ATOM 789 CG2 ILE A 52 22.816 1.717 -7.977 1.00 0.00 C ATOM 790 CD1 ILE A 52 21.253 3.540 -5.932 1.00 0.00 C ATOM 0 H ILE A 52 22.469 1.577 -4.025 1.00 0.00 H new ATOM 0 HA ILE A 52 21.236 0.574 -6.338 1.00 0.00 H new ATOM 0 HB ILE A 52 24.058 1.476 -6.177 1.00 0.00 H new ATOM 0 HG12 ILE A 52 23.076 3.162 -4.884 1.00 0.00 H new ATOM 0 HG13 ILE A 52 23.295 3.827 -6.490 1.00 0.00 H new ATOM 0 HG21 ILE A 52 23.401 2.526 -8.414 1.00 0.00 H new ATOM 0 HG22 ILE A 52 23.137 0.766 -8.402 1.00 0.00 H new ATOM 0 HG23 ILE A 52 21.760 1.874 -8.196 1.00 0.00 H new ATOM 0 HD11 ILE A 52 21.167 4.548 -5.526 1.00 0.00 H new ATOM 0 HD12 ILE A 52 20.884 3.529 -6.958 1.00 0.00 H new ATOM 0 HD13 ILE A 52 20.662 2.853 -5.326 1.00 0.00 H new ATOM 802 N GLN A 53 23.726 -1.259 -5.144 1.00 0.00 N ATOM 803 CA GLN A 53 24.405 -2.550 -5.172 1.00 0.00 C ATOM 804 C GLN A 53 23.462 -3.713 -4.832 1.00 0.00 C ATOM 805 O GLN A 53 23.744 -4.860 -5.187 1.00 0.00 O ATOM 806 CB GLN A 53 25.599 -2.537 -4.201 1.00 0.00 C ATOM 807 CG GLN A 53 26.509 -1.295 -4.257 1.00 0.00 C ATOM 808 CD GLN A 53 26.916 -0.873 -5.667 1.00 0.00 C ATOM 809 OE1 GLN A 53 27.137 -1.685 -6.555 1.00 0.00 O ATOM 810 NE2 GLN A 53 27.022 0.425 -5.915 1.00 0.00 N ATOM 0 H GLN A 53 23.997 -0.690 -4.342 1.00 0.00 H new ATOM 0 HA GLN A 53 24.760 -2.709 -6.190 1.00 0.00 H new ATOM 0 HB2 GLN A 53 25.216 -2.635 -3.185 1.00 0.00 H new ATOM 0 HB3 GLN A 53 26.210 -3.418 -4.397 1.00 0.00 H new ATOM 0 HG2 GLN A 53 25.996 -0.462 -3.776 1.00 0.00 H new ATOM 0 HG3 GLN A 53 27.410 -1.493 -3.676 1.00 0.00 H new ATOM 0 HE21 GLN A 53 26.838 1.102 -5.175 1.00 0.00 H new ATOM 0 HE22 GLN A 53 27.288 0.746 -6.846 1.00 0.00 H new ATOM 819 N GLN A 54 22.357 -3.468 -4.114 1.00 0.00 N ATOM 820 CA GLN A 54 21.382 -4.516 -3.829 1.00 0.00 C ATOM 821 C GLN A 54 20.717 -5.001 -5.119 1.00 0.00 C ATOM 822 O GLN A 54 20.399 -6.190 -5.223 1.00 0.00 O ATOM 823 CB GLN A 54 20.298 -4.057 -2.834 1.00 0.00 C ATOM 824 CG GLN A 54 20.802 -3.830 -1.403 1.00 0.00 C ATOM 825 CD GLN A 54 21.323 -5.113 -0.745 1.00 0.00 C ATOM 826 OE1 GLN A 54 20.728 -6.195 -0.851 1.00 0.00 O ATOM 827 NE2 GLN A 54 22.454 -5.010 -0.078 1.00 0.00 N ATOM 0 H GLN A 54 22.122 -2.555 -3.724 1.00 0.00 H new ATOM 0 HA GLN A 54 21.933 -5.336 -3.368 1.00 0.00 H new ATOM 0 HB2 GLN A 54 19.855 -3.131 -3.201 1.00 0.00 H new ATOM 0 HB3 GLN A 54 19.504 -4.803 -2.812 1.00 0.00 H new ATOM 0 HG2 GLN A 54 21.598 -3.085 -1.417 1.00 0.00 H new ATOM 0 HG3 GLN A 54 19.993 -3.420 -0.799 1.00 0.00 H new ATOM 0 HE21 GLN A 54 22.923 -4.107 -0.006 1.00 0.00 H new ATOM 0 HE22 GLN A 54 22.861 -5.833 0.367 1.00 0.00 H new ATOM 836 N CYS A 55 20.504 -4.101 -6.082 1.00 0.00 N ATOM 837 CA CYS A 55 19.810 -4.396 -7.322 1.00 0.00 C ATOM 838 C CYS A 55 20.795 -5.054 -8.287 1.00 0.00 C ATOM 839 O CYS A 55 21.688 -4.401 -8.830 1.00 0.00 O ATOM 840 CB CYS A 55 19.250 -3.085 -7.878 1.00 0.00 C ATOM 841 SG CYS A 55 18.153 -2.370 -6.617 1.00 0.00 S ATOM 0 H CYS A 55 20.817 -3.133 -6.014 1.00 0.00 H new ATOM 0 HA CYS A 55 18.980 -5.086 -7.168 1.00 0.00 H new ATOM 0 HB2 CYS A 55 20.059 -2.395 -8.116 1.00 0.00 H new ATOM 0 HB3 CYS A 55 18.702 -3.265 -8.803 1.00 0.00 H new ATOM 0 HG CYS A 55 18.704 -1.304 -6.117 1.00 0.00 H new ATOM 847 N THR A 56 20.558 -6.326 -8.583 1.00 0.00 N ATOM 848 CA THR A 56 21.404 -7.179 -9.397 1.00 0.00 C ATOM 849 C THR A 56 20.733 -7.593 -10.716 1.00 0.00 C ATOM 850 O THR A 56 19.565 -7.296 -10.938 1.00 0.00 O ATOM 851 CB THR A 56 21.906 -8.296 -8.461 1.00 0.00 C ATOM 852 OG1 THR A 56 20.899 -8.720 -7.562 1.00 0.00 O ATOM 853 CG2 THR A 56 23.057 -7.793 -7.589 1.00 0.00 C ATOM 0 H THR A 56 19.728 -6.811 -8.243 1.00 0.00 H new ATOM 0 HA THR A 56 22.282 -6.665 -9.789 1.00 0.00 H new ATOM 0 HB THR A 56 22.215 -9.115 -9.111 1.00 0.00 H new ATOM 0 HG1 THR A 56 21.253 -9.430 -6.986 1.00 0.00 H new ATOM 0 HG21 THR A 56 23.397 -8.597 -6.936 1.00 0.00 H new ATOM 0 HG22 THR A 56 23.881 -7.470 -8.225 1.00 0.00 H new ATOM 0 HG23 THR A 56 22.715 -6.954 -6.984 1.00 0.00 H new ATOM 861 N ASP A 57 21.484 -8.249 -11.600 1.00 0.00 N ATOM 862 CA ASP A 57 21.120 -8.655 -12.960 1.00 0.00 C ATOM 863 C ASP A 57 19.756 -9.328 -13.178 1.00 0.00 C ATOM 864 O ASP A 57 18.880 -8.747 -13.815 1.00 0.00 O ATOM 865 CB ASP A 57 22.274 -9.463 -13.600 1.00 0.00 C ATOM 866 CG ASP A 57 22.444 -10.901 -13.090 1.00 0.00 C ATOM 867 OD1 ASP A 57 22.228 -11.160 -11.881 1.00 0.00 O ATOM 868 OD2 ASP A 57 22.788 -11.789 -13.895 1.00 0.00 O ATOM 0 H ASP A 57 22.436 -8.533 -11.368 1.00 0.00 H new ATOM 0 HA ASP A 57 20.972 -7.707 -13.477 1.00 0.00 H new ATOM 0 HB2 ASP A 57 22.115 -9.496 -14.678 1.00 0.00 H new ATOM 0 HB3 ASP A 57 23.207 -8.925 -13.431 1.00 0.00 H new ATOM 873 N ASP A 58 19.588 -10.566 -12.729 1.00 0.00 N ATOM 874 CA ASP A 58 18.407 -11.390 -12.935 1.00 0.00 C ATOM 875 C ASP A 58 17.521 -11.576 -11.715 1.00 0.00 C ATOM 876 O ASP A 58 16.313 -11.741 -11.856 1.00 0.00 O ATOM 877 CB ASP A 58 18.867 -12.739 -13.494 1.00 0.00 C ATOM 878 CG ASP A 58 17.859 -13.878 -13.298 1.00 0.00 C ATOM 879 OD1 ASP A 58 17.898 -14.512 -12.216 1.00 0.00 O ATOM 880 OD2 ASP A 58 17.095 -14.211 -14.234 1.00 0.00 O ATOM 0 H ASP A 58 20.307 -11.044 -12.186 1.00 0.00 H new ATOM 0 HA ASP A 58 17.765 -10.860 -13.638 1.00 0.00 H new ATOM 0 HB2 ASP A 58 19.070 -12.628 -14.559 1.00 0.00 H new ATOM 0 HB3 ASP A 58 19.808 -13.015 -13.017 1.00 0.00 H new ATOM 885 N VAL A 59 18.075 -11.582 -10.510 1.00 0.00 N ATOM 886 CA VAL A 59 17.261 -11.851 -9.353 1.00 0.00 C ATOM 887 C VAL A 59 16.323 -10.686 -9.066 1.00 0.00 C ATOM 888 O VAL A 59 16.607 -9.524 -9.366 1.00 0.00 O ATOM 889 CB VAL A 59 18.164 -12.209 -8.171 1.00 0.00 C ATOM 890 CG1 VAL A 59 19.000 -13.445 -8.505 1.00 0.00 C ATOM 891 CG2 VAL A 59 19.102 -11.088 -7.731 1.00 0.00 C ATOM 0 H VAL A 59 19.062 -11.407 -10.319 1.00 0.00 H new ATOM 0 HA VAL A 59 16.616 -12.709 -9.541 1.00 0.00 H new ATOM 0 HB VAL A 59 17.487 -12.399 -7.338 1.00 0.00 H new ATOM 0 HG11 VAL A 59 19.639 -13.692 -7.657 1.00 0.00 H new ATOM 0 HG12 VAL A 59 18.339 -14.285 -8.717 1.00 0.00 H new ATOM 0 HG13 VAL A 59 19.619 -13.241 -9.379 1.00 0.00 H new ATOM 0 HG21 VAL A 59 19.705 -11.428 -6.889 1.00 0.00 H new ATOM 0 HG22 VAL A 59 19.756 -10.815 -8.559 1.00 0.00 H new ATOM 0 HG23 VAL A 59 18.516 -10.220 -7.431 1.00 0.00 H new ATOM 901 N ARG A 60 15.202 -11.010 -8.429 1.00 0.00 N ATOM 902 CA ARG A 60 14.230 -10.034 -7.983 1.00 0.00 C ATOM 903 C ARG A 60 14.433 -9.910 -6.478 1.00 0.00 C ATOM 904 O ARG A 60 14.829 -10.885 -5.826 1.00 0.00 O ATOM 905 CB ARG A 60 12.806 -10.383 -8.450 1.00 0.00 C ATOM 906 CG ARG A 60 12.138 -11.620 -7.833 1.00 0.00 C ATOM 907 CD ARG A 60 12.133 -12.884 -8.712 1.00 0.00 C ATOM 908 NE ARG A 60 13.438 -13.558 -8.824 1.00 0.00 N ATOM 909 CZ ARG A 60 14.120 -14.149 -7.837 1.00 0.00 C ATOM 910 NH1 ARG A 60 13.672 -14.177 -6.583 1.00 0.00 N ATOM 911 NH2 ARG A 60 15.291 -14.692 -8.117 1.00 0.00 N ATOM 0 H ARG A 60 14.946 -11.972 -8.208 1.00 0.00 H new ATOM 0 HA ARG A 60 14.375 -9.052 -8.434 1.00 0.00 H new ATOM 0 HB2 ARG A 60 12.167 -9.522 -8.252 1.00 0.00 H new ATOM 0 HB3 ARG A 60 12.831 -10.519 -9.531 1.00 0.00 H new ATOM 0 HG2 ARG A 60 12.643 -11.854 -6.896 1.00 0.00 H new ATOM 0 HG3 ARG A 60 11.107 -11.368 -7.585 1.00 0.00 H new ATOM 0 HD2 ARG A 60 11.408 -13.590 -8.307 1.00 0.00 H new ATOM 0 HD3 ARG A 60 11.791 -12.614 -9.711 1.00 0.00 H new ATOM 0 HE ARG A 60 13.866 -13.576 -9.750 1.00 0.00 H new ATOM 0 HH11 ARG A 60 12.781 -13.738 -6.350 1.00 0.00 H new ATOM 0 HH12 ARG A 60 14.220 -14.637 -5.856 1.00 0.00 H new ATOM 0 HH21 ARG A 60 15.656 -14.655 -9.069 1.00 0.00 H new ATOM 0 HH22 ARG A 60 15.830 -15.149 -7.381 1.00 0.00 H new ATOM 925 N LEU A 61 14.194 -8.731 -5.923 1.00 0.00 N ATOM 926 CA LEU A 61 14.428 -8.418 -4.523 1.00 0.00 C ATOM 927 C LEU A 61 13.372 -7.438 -4.039 1.00 0.00 C ATOM 928 O LEU A 61 12.691 -6.812 -4.847 1.00 0.00 O ATOM 929 CB LEU A 61 15.861 -7.863 -4.418 1.00 0.00 C ATOM 930 CG LEU A 61 16.315 -7.354 -3.046 1.00 0.00 C ATOM 931 CD1 LEU A 61 16.254 -8.479 -2.020 1.00 0.00 C ATOM 932 CD2 LEU A 61 17.770 -6.890 -3.113 1.00 0.00 C ATOM 0 H LEU A 61 13.821 -7.943 -6.451 1.00 0.00 H new ATOM 0 HA LEU A 61 14.345 -9.296 -3.882 1.00 0.00 H new ATOM 0 HB2 LEU A 61 16.551 -8.646 -4.733 1.00 0.00 H new ATOM 0 HB3 LEU A 61 15.960 -7.045 -5.132 1.00 0.00 H new ATOM 0 HG LEU A 61 15.656 -6.533 -2.761 1.00 0.00 H new ATOM 0 HD11 LEU A 61 16.579 -8.104 -1.049 1.00 0.00 H new ATOM 0 HD12 LEU A 61 15.231 -8.846 -1.943 1.00 0.00 H new ATOM 0 HD13 LEU A 61 16.909 -9.292 -2.333 1.00 0.00 H new ATOM 0 HD21 LEU A 61 18.083 -6.530 -2.133 1.00 0.00 H new ATOM 0 HD22 LEU A 61 18.404 -7.724 -3.413 1.00 0.00 H new ATOM 0 HD23 LEU A 61 17.862 -6.084 -3.841 1.00 0.00 H new ATOM 944 N PHE A 62 13.224 -7.316 -2.724 1.00 0.00 N ATOM 945 CA PHE A 62 12.294 -6.368 -2.114 1.00 0.00 C ATOM 946 C PHE A 62 13.036 -5.529 -1.075 1.00 0.00 C ATOM 947 O PHE A 62 13.999 -6.021 -0.475 1.00 0.00 O ATOM 948 CB PHE A 62 11.133 -7.125 -1.457 1.00 0.00 C ATOM 949 CG PHE A 62 10.138 -7.813 -2.376 1.00 0.00 C ATOM 950 CD1 PHE A 62 10.516 -8.883 -3.211 1.00 0.00 C ATOM 951 CD2 PHE A 62 8.784 -7.443 -2.311 1.00 0.00 C ATOM 952 CE1 PHE A 62 9.554 -9.571 -3.970 1.00 0.00 C ATOM 953 CE2 PHE A 62 7.816 -8.160 -3.030 1.00 0.00 C ATOM 954 CZ PHE A 62 8.199 -9.231 -3.850 1.00 0.00 C ATOM 0 H PHE A 62 13.747 -7.873 -2.048 1.00 0.00 H new ATOM 0 HA PHE A 62 11.888 -5.709 -2.882 1.00 0.00 H new ATOM 0 HB2 PHE A 62 11.555 -7.879 -0.793 1.00 0.00 H new ATOM 0 HB3 PHE A 62 10.583 -6.422 -0.832 1.00 0.00 H new ATOM 0 HD1 PHE A 62 11.554 -9.177 -3.268 1.00 0.00 H new ATOM 0 HD2 PHE A 62 8.487 -6.601 -1.703 1.00 0.00 H new ATOM 0 HE1 PHE A 62 9.857 -10.359 -4.643 1.00 0.00 H new ATOM 0 HE2 PHE A 62 6.774 -7.887 -2.952 1.00 0.00 H new ATOM 0 HZ PHE A 62 7.451 -9.794 -4.389 1.00 0.00 H new ATOM 964 N ALA A 63 12.584 -4.297 -0.813 1.00 0.00 N ATOM 965 CA ALA A 63 13.164 -3.445 0.207 1.00 0.00 C ATOM 966 C ALA A 63 12.127 -2.574 0.879 1.00 0.00 C ATOM 967 O ALA A 63 11.220 -2.082 0.224 1.00 0.00 O ATOM 968 CB ALA A 63 14.221 -2.560 -0.430 1.00 0.00 C ATOM 0 H ALA A 63 11.802 -3.870 -1.310 1.00 0.00 H new ATOM 0 HA ALA A 63 13.603 -4.088 0.970 1.00 0.00 H new ATOM 0 HB1 ALA A 63 14.663 -1.916 0.330 1.00 0.00 H new ATOM 0 HB2 ALA A 63 14.998 -3.183 -0.874 1.00 0.00 H new ATOM 0 HB3 ALA A 63 13.762 -1.945 -1.205 1.00 0.00 H new ATOM 974 N PHE A 64 12.293 -2.348 2.174 1.00 0.00 N ATOM 975 CA PHE A 64 11.452 -1.474 2.975 1.00 0.00 C ATOM 976 C PHE A 64 12.335 -0.277 3.300 1.00 0.00 C ATOM 977 O PHE A 64 13.415 -0.460 3.865 1.00 0.00 O ATOM 978 CB PHE A 64 10.972 -2.280 4.186 1.00 0.00 C ATOM 979 CG PHE A 64 10.111 -1.537 5.184 1.00 0.00 C ATOM 980 CD1 PHE A 64 8.856 -1.029 4.800 1.00 0.00 C ATOM 981 CD2 PHE A 64 10.547 -1.391 6.513 1.00 0.00 C ATOM 982 CE1 PHE A 64 8.060 -0.348 5.737 1.00 0.00 C ATOM 983 CE2 PHE A 64 9.760 -0.684 7.437 1.00 0.00 C ATOM 984 CZ PHE A 64 8.529 -0.144 7.044 1.00 0.00 C ATOM 0 H PHE A 64 13.042 -2.783 2.713 1.00 0.00 H new ATOM 0 HA PHE A 64 10.547 -1.109 2.490 1.00 0.00 H new ATOM 0 HB2 PHE A 64 10.411 -3.141 3.824 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.847 -2.666 4.709 1.00 0.00 H new ATOM 0 HD1 PHE A 64 8.505 -1.162 3.787 1.00 0.00 H new ATOM 0 HD2 PHE A 64 11.487 -1.823 6.823 1.00 0.00 H new ATOM 0 HE1 PHE A 64 7.085 0.019 5.451 1.00 0.00 H new ATOM 0 HE2 PHE A 64 10.105 -0.557 8.452 1.00 0.00 H new ATOM 0 HZ PHE A 64 7.941 0.429 7.746 1.00 0.00 H new ATOM 994 N VAL A 65 11.897 0.935 2.955 1.00 0.00 N ATOM 995 CA VAL A 65 12.701 2.140 3.120 1.00 0.00 C ATOM 996 C VAL A 65 11.899 3.265 3.768 1.00 0.00 C ATOM 997 O VAL A 65 10.723 3.460 3.446 1.00 0.00 O ATOM 998 CB VAL A 65 13.168 2.578 1.708 1.00 0.00 C ATOM 999 CG1 VAL A 65 14.100 3.795 1.713 1.00 0.00 C ATOM 1000 CG2 VAL A 65 13.864 1.433 0.950 1.00 0.00 C ATOM 0 H VAL A 65 10.975 1.105 2.554 1.00 0.00 H new ATOM 0 HA VAL A 65 13.547 1.929 3.774 1.00 0.00 H new ATOM 0 HB VAL A 65 12.248 2.860 1.197 1.00 0.00 H new ATOM 0 HG11 VAL A 65 14.383 4.040 0.690 1.00 0.00 H new ATOM 0 HG12 VAL A 65 13.586 4.645 2.161 1.00 0.00 H new ATOM 0 HG13 VAL A 65 14.995 3.566 2.292 1.00 0.00 H new ATOM 0 HG21 VAL A 65 14.175 1.784 -0.034 1.00 0.00 H new ATOM 0 HG22 VAL A 65 14.739 1.104 1.511 1.00 0.00 H new ATOM 0 HG23 VAL A 65 13.172 0.599 0.836 1.00 0.00 H new ATOM 1010 N ARG A 66 12.533 3.996 4.689 1.00 0.00 N ATOM 1011 CA ARG A 66 11.964 5.170 5.336 1.00 0.00 C ATOM 1012 C ARG A 66 12.151 6.282 4.320 1.00 0.00 C ATOM 1013 O ARG A 66 13.289 6.550 3.930 1.00 0.00 O ATOM 1014 CB ARG A 66 12.681 5.525 6.653 1.00 0.00 C ATOM 1015 CG ARG A 66 12.008 6.728 7.353 1.00 0.00 C ATOM 1016 CD ARG A 66 12.974 7.581 8.185 1.00 0.00 C ATOM 1017 NE ARG A 66 13.843 8.406 7.328 1.00 0.00 N ATOM 1018 CZ ARG A 66 14.187 9.687 7.497 1.00 0.00 C ATOM 1019 NH1 ARG A 66 13.743 10.416 8.516 1.00 0.00 N ATOM 1020 NH2 ARG A 66 15.006 10.230 6.610 1.00 0.00 N ATOM 0 H ARG A 66 13.477 3.779 5.009 1.00 0.00 H new ATOM 0 HA ARG A 66 10.923 5.003 5.611 1.00 0.00 H new ATOM 0 HB2 ARG A 66 12.671 4.662 7.319 1.00 0.00 H new ATOM 0 HB3 ARG A 66 13.726 5.758 6.449 1.00 0.00 H new ATOM 0 HG2 ARG A 66 11.539 7.359 6.598 1.00 0.00 H new ATOM 0 HG3 ARG A 66 11.212 6.361 8.001 1.00 0.00 H new ATOM 0 HD2 ARG A 66 12.406 8.225 8.856 1.00 0.00 H new ATOM 0 HD3 ARG A 66 13.588 6.932 8.810 1.00 0.00 H new ATOM 0 HE ARG A 66 14.230 7.943 6.505 1.00 0.00 H new ATOM 0 HH11 ARG A 66 13.116 10.001 9.205 1.00 0.00 H new ATOM 0 HH12 ARG A 66 14.029 11.391 8.609 1.00 0.00 H new ATOM 0 HH21 ARG A 66 15.353 9.673 5.829 1.00 0.00 H new ATOM 0 HH22 ARG A 66 15.290 11.205 6.708 1.00 0.00 H new ATOM 1034 N PHE A 67 11.070 6.908 3.874 1.00 0.00 N ATOM 1035 CA PHE A 67 11.135 7.950 2.869 1.00 0.00 C ATOM 1036 C PHE A 67 10.225 9.107 3.293 1.00 0.00 C ATOM 1037 O PHE A 67 9.369 8.948 4.165 1.00 0.00 O ATOM 1038 CB PHE A 67 10.780 7.309 1.522 1.00 0.00 C ATOM 1039 CG PHE A 67 11.094 8.175 0.331 1.00 0.00 C ATOM 1040 CD1 PHE A 67 12.384 8.170 -0.223 1.00 0.00 C ATOM 1041 CD2 PHE A 67 10.088 8.978 -0.226 1.00 0.00 C ATOM 1042 CE1 PHE A 67 12.660 8.976 -1.336 1.00 0.00 C ATOM 1043 CE2 PHE A 67 10.367 9.791 -1.339 1.00 0.00 C ATOM 1044 CZ PHE A 67 11.657 9.779 -1.892 1.00 0.00 C ATOM 0 H PHE A 67 10.126 6.705 4.201 1.00 0.00 H new ATOM 0 HA PHE A 67 12.129 8.386 2.764 1.00 0.00 H new ATOM 0 HB2 PHE A 67 11.320 6.367 1.426 1.00 0.00 H new ATOM 0 HB3 PHE A 67 9.717 7.069 1.514 1.00 0.00 H new ATOM 0 HD1 PHE A 67 13.158 7.550 0.205 1.00 0.00 H new ATOM 0 HD2 PHE A 67 9.096 8.972 0.201 1.00 0.00 H new ATOM 0 HE1 PHE A 67 13.651 8.978 -1.766 1.00 0.00 H new ATOM 0 HE2 PHE A 67 9.597 10.418 -1.764 1.00 0.00 H new ATOM 0 HZ PHE A 67 11.877 10.393 -2.752 1.00 0.00 H new ATOM 1054 N THR A 68 10.382 10.280 2.686 1.00 0.00 N ATOM 1055 CA THR A 68 9.650 11.482 3.035 1.00 0.00 C ATOM 1056 C THR A 68 8.795 11.885 1.838 1.00 0.00 C ATOM 1057 O THR A 68 9.308 12.121 0.741 1.00 0.00 O ATOM 1058 CB THR A 68 10.657 12.561 3.462 1.00 0.00 C ATOM 1059 OG1 THR A 68 11.358 12.132 4.615 1.00 0.00 O ATOM 1060 CG2 THR A 68 9.967 13.880 3.805 1.00 0.00 C ATOM 0 H THR A 68 11.040 10.419 1.919 1.00 0.00 H new ATOM 0 HA THR A 68 8.975 11.327 3.877 1.00 0.00 H new ATOM 0 HB THR A 68 11.333 12.718 2.621 1.00 0.00 H new ATOM 0 HG1 THR A 68 12.000 12.822 4.883 1.00 0.00 H new ATOM 0 HG21 THR A 68 10.715 14.615 4.102 1.00 0.00 H new ATOM 0 HG22 THR A 68 9.425 14.245 2.932 1.00 0.00 H new ATOM 0 HG23 THR A 68 9.268 13.722 4.626 1.00 0.00 H new ATOM 1068 N THR A 69 7.476 11.888 2.005 1.00 0.00 N ATOM 1069 CA THR A 69 6.531 12.339 0.993 1.00 0.00 C ATOM 1070 C THR A 69 5.296 12.848 1.737 1.00 0.00 C ATOM 1071 O THR A 69 5.048 12.436 2.872 1.00 0.00 O ATOM 1072 CB THR A 69 6.176 11.219 -0.005 1.00 0.00 C ATOM 1073 OG1 THR A 69 7.295 10.443 -0.368 1.00 0.00 O ATOM 1074 CG2 THR A 69 5.578 11.751 -1.306 1.00 0.00 C ATOM 0 H THR A 69 7.027 11.571 2.864 1.00 0.00 H new ATOM 0 HA THR A 69 6.970 13.133 0.390 1.00 0.00 H new ATOM 0 HB THR A 69 5.444 10.613 0.529 1.00 0.00 H new ATOM 0 HG1 THR A 69 8.081 11.022 -0.453 1.00 0.00 H new ATOM 0 HG21 THR A 69 5.348 10.917 -1.969 1.00 0.00 H new ATOM 0 HG22 THR A 69 4.664 12.303 -1.087 1.00 0.00 H new ATOM 0 HG23 THR A 69 6.294 12.414 -1.792 1.00 0.00 H new ATOM 1082 N GLY A 70 4.505 13.694 1.083 1.00 0.00 N ATOM 1083 CA GLY A 70 3.314 14.313 1.630 1.00 0.00 C ATOM 1084 C GLY A 70 3.669 15.376 2.657 1.00 0.00 C ATOM 1085 O GLY A 70 4.791 15.440 3.163 1.00 0.00 O ATOM 0 H GLY A 70 4.689 13.974 0.120 1.00 0.00 H new ATOM 0 HA2 GLY A 70 2.732 14.761 0.825 1.00 0.00 H new ATOM 0 HA3 GLY A 70 2.685 13.552 2.093 1.00 0.00 H new ATOM 1089 N ASP A 71 2.692 16.213 2.986 1.00 0.00 N ATOM 1090 CA ASP A 71 2.822 17.241 4.005 1.00 0.00 C ATOM 1091 C ASP A 71 1.517 17.360 4.764 1.00 0.00 C ATOM 1092 O ASP A 71 0.452 16.972 4.282 1.00 0.00 O ATOM 1093 CB ASP A 71 3.249 18.595 3.419 1.00 0.00 C ATOM 1094 CG ASP A 71 4.755 18.640 3.201 1.00 0.00 C ATOM 1095 OD1 ASP A 71 5.466 18.838 4.212 1.00 0.00 O ATOM 1096 OD2 ASP A 71 5.213 18.478 2.048 1.00 0.00 O ATOM 0 H ASP A 71 1.773 16.194 2.543 1.00 0.00 H new ATOM 0 HA ASP A 71 3.615 16.943 4.690 1.00 0.00 H new ATOM 0 HB2 ASP A 71 2.735 18.765 2.473 1.00 0.00 H new ATOM 0 HB3 ASP A 71 2.951 19.398 4.093 1.00 0.00 H new ATOM 1101 N ALA A 72 1.639 17.845 5.991 1.00 0.00 N ATOM 1102 CA ALA A 72 0.605 18.159 6.954 1.00 0.00 C ATOM 1103 C ALA A 72 1.125 19.373 7.733 1.00 0.00 C ATOM 1104 O ALA A 72 2.172 19.933 7.394 1.00 0.00 O ATOM 1105 CB ALA A 72 0.370 16.943 7.863 1.00 0.00 C ATOM 0 H ALA A 72 2.563 18.048 6.371 1.00 0.00 H new ATOM 0 HA ALA A 72 -0.354 18.390 6.491 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.408 17.177 8.589 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.058 16.092 7.258 1.00 0.00 H new ATOM 0 HB3 ALA A 72 1.293 16.697 8.387 1.00 0.00 H new ATOM 1111 N MET A 73 0.422 19.798 8.787 1.00 0.00 N ATOM 1112 CA MET A 73 0.864 20.878 9.669 1.00 0.00 C ATOM 1113 C MET A 73 2.142 20.487 10.456 1.00 0.00 C ATOM 1114 O MET A 73 2.555 21.172 11.386 1.00 0.00 O ATOM 1115 CB MET A 73 -0.271 21.295 10.621 1.00 0.00 C ATOM 1116 CG MET A 73 -1.499 21.815 9.861 1.00 0.00 C ATOM 1117 SD MET A 73 -2.819 22.483 10.910 1.00 0.00 S ATOM 1118 CE MET A 73 -2.066 24.041 11.454 1.00 0.00 C ATOM 0 H MET A 73 -0.478 19.397 9.053 1.00 0.00 H new ATOM 0 HA MET A 73 1.121 21.735 9.046 1.00 0.00 H new ATOM 0 HB2 MET A 73 -0.560 20.443 11.236 1.00 0.00 H new ATOM 0 HB3 MET A 73 0.090 22.069 11.298 1.00 0.00 H new ATOM 0 HG2 MET A 73 -1.177 22.592 9.168 1.00 0.00 H new ATOM 0 HG3 MET A 73 -1.908 21.002 9.261 1.00 0.00 H new ATOM 0 HE1 MET A 73 -2.801 24.627 12.006 1.00 0.00 H new ATOM 0 HE2 MET A 73 -1.214 23.827 12.099 1.00 0.00 H new ATOM 0 HE3 MET A 73 -1.730 24.606 10.584 1.00 0.00 H new ATOM 1128 N SER A 74 2.749 19.342 10.150 1.00 0.00 N ATOM 1129 CA SER A 74 3.984 18.787 10.663 1.00 0.00 C ATOM 1130 C SER A 74 4.640 18.023 9.500 1.00 0.00 C ATOM 1131 O SER A 74 4.128 18.024 8.375 1.00 0.00 O ATOM 1132 CB SER A 74 3.657 17.909 11.871 1.00 0.00 C ATOM 1133 OG SER A 74 3.164 18.726 12.915 1.00 0.00 O ATOM 0 H SER A 74 2.334 18.717 9.459 1.00 0.00 H new ATOM 0 HA SER A 74 4.687 19.542 11.014 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.916 17.157 11.600 1.00 0.00 H new ATOM 0 HB3 SER A 74 4.548 17.375 12.200 1.00 0.00 H new ATOM 0 HG SER A 74 2.950 18.169 13.693 1.00 0.00 H new ATOM 1139 N LYS A 75 5.839 17.471 9.682 1.00 0.00 N ATOM 1140 CA LYS A 75 6.464 16.658 8.633 1.00 0.00 C ATOM 1141 C LYS A 75 5.830 15.268 8.595 1.00 0.00 C ATOM 1142 O LYS A 75 4.918 14.961 9.368 1.00 0.00 O ATOM 1143 CB LYS A 75 7.989 16.663 8.787 1.00 0.00 C ATOM 1144 CG LYS A 75 8.577 18.051 8.468 1.00 0.00 C ATOM 1145 CD LYS A 75 8.420 18.495 6.996 1.00 0.00 C ATOM 1146 CE LYS A 75 7.591 19.782 6.817 1.00 0.00 C ATOM 1147 NZ LYS A 75 6.131 19.553 6.691 1.00 0.00 N ATOM 0 H LYS A 75 6.393 17.568 10.533 1.00 0.00 H new ATOM 0 HA LYS A 75 6.273 17.095 7.653 1.00 0.00 H new ATOM 0 HB2 LYS A 75 8.255 16.378 9.805 1.00 0.00 H new ATOM 0 HB3 LYS A 75 8.427 15.918 8.122 1.00 0.00 H new ATOM 0 HG2 LYS A 75 8.097 18.790 9.110 1.00 0.00 H new ATOM 0 HG3 LYS A 75 9.637 18.049 8.722 1.00 0.00 H new ATOM 0 HD2 LYS A 75 9.410 18.649 6.566 1.00 0.00 H new ATOM 0 HD3 LYS A 75 7.949 17.690 6.432 1.00 0.00 H new ATOM 0 HE2 LYS A 75 7.772 20.439 7.668 1.00 0.00 H new ATOM 0 HE3 LYS A 75 7.943 20.307 5.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 5.652 20.458 6.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 5.949 18.898 5.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 5.766 19.142 7.574 1.00 0.00 H new ATOM 1161 N ARG A 76 6.247 14.463 7.624 1.00 0.00 N ATOM 1162 CA ARG A 76 5.703 13.140 7.371 1.00 0.00 C ATOM 1163 C ARG A 76 6.852 12.185 7.096 1.00 0.00 C ATOM 1164 O ARG A 76 7.951 12.614 6.738 1.00 0.00 O ATOM 1165 CB ARG A 76 4.754 13.196 6.154 1.00 0.00 C ATOM 1166 CG ARG A 76 3.559 14.157 6.251 1.00 0.00 C ATOM 1167 CD ARG A 76 2.377 13.549 6.994 1.00 0.00 C ATOM 1168 NE ARG A 76 2.624 13.310 8.422 1.00 0.00 N ATOM 1169 CZ ARG A 76 1.842 12.560 9.210 1.00 0.00 C ATOM 1170 NH1 ARG A 76 0.624 12.179 8.834 1.00 0.00 N ATOM 1171 NH2 ARG A 76 2.292 12.177 10.395 1.00 0.00 N ATOM 0 H ARG A 76 6.991 14.722 6.977 1.00 0.00 H new ATOM 0 HA ARG A 76 5.140 12.793 8.238 1.00 0.00 H new ATOM 0 HB2 ARG A 76 5.341 13.471 5.278 1.00 0.00 H new ATOM 0 HB3 ARG A 76 4.369 12.192 5.977 1.00 0.00 H new ATOM 0 HG2 ARG A 76 3.872 15.070 6.758 1.00 0.00 H new ATOM 0 HG3 ARG A 76 3.245 14.442 5.247 1.00 0.00 H new ATOM 0 HD2 ARG A 76 1.517 14.211 6.891 1.00 0.00 H new ATOM 0 HD3 ARG A 76 2.110 12.605 6.519 1.00 0.00 H new ATOM 0 HE ARG A 76 3.446 13.744 8.842 1.00 0.00 H new ATOM 0 HH11 ARG A 76 0.261 12.458 7.922 1.00 0.00 H new ATOM 0 HH12 ARG A 76 0.053 11.608 9.457 1.00 0.00 H new ATOM 0 HH21 ARG A 76 3.225 12.453 10.700 1.00 0.00 H new ATOM 0 HH22 ARG A 76 1.705 11.606 11.003 1.00 0.00 H new ATOM 1185 N SER A 77 6.569 10.899 7.228 1.00 0.00 N ATOM 1186 CA SER A 77 7.457 9.796 6.937 1.00 0.00 C ATOM 1187 C SER A 77 6.525 8.728 6.385 1.00 0.00 C ATOM 1188 O SER A 77 5.514 8.371 7.009 1.00 0.00 O ATOM 1189 CB SER A 77 8.207 9.363 8.194 1.00 0.00 C ATOM 1190 OG SER A 77 9.036 8.264 7.901 1.00 0.00 O ATOM 0 H SER A 77 5.658 10.584 7.561 1.00 0.00 H new ATOM 0 HA SER A 77 8.247 10.035 6.226 1.00 0.00 H new ATOM 0 HB2 SER A 77 8.806 10.191 8.574 1.00 0.00 H new ATOM 0 HB3 SER A 77 7.498 9.096 8.978 1.00 0.00 H new ATOM 0 HG SER A 77 9.516 7.991 8.711 1.00 0.00 H new ATOM 1196 N LYS A 78 6.824 8.266 5.179 1.00 0.00 N ATOM 1197 CA LYS A 78 6.031 7.320 4.420 1.00 0.00 C ATOM 1198 C LYS A 78 6.978 6.264 3.919 1.00 0.00 C ATOM 1199 O LYS A 78 7.938 6.564 3.217 1.00 0.00 O ATOM 1200 CB LYS A 78 5.345 8.092 3.284 1.00 0.00 C ATOM 1201 CG LYS A 78 4.094 8.781 3.845 1.00 0.00 C ATOM 1202 CD LYS A 78 3.488 9.787 2.862 1.00 0.00 C ATOM 1203 CE LYS A 78 2.189 9.273 2.248 1.00 0.00 C ATOM 1204 NZ LYS A 78 1.865 9.985 0.997 1.00 0.00 N ATOM 0 H LYS A 78 7.667 8.557 4.683 1.00 0.00 H new ATOM 0 HA LYS A 78 5.251 6.835 5.007 1.00 0.00 H new ATOM 0 HB2 LYS A 78 6.027 8.831 2.863 1.00 0.00 H new ATOM 0 HB3 LYS A 78 5.073 7.413 2.476 1.00 0.00 H new ATOM 0 HG2 LYS A 78 3.348 8.026 4.093 1.00 0.00 H new ATOM 0 HG3 LYS A 78 4.350 9.293 4.772 1.00 0.00 H new ATOM 0 HD2 LYS A 78 3.298 10.728 3.377 1.00 0.00 H new ATOM 0 HD3 LYS A 78 4.206 9.997 2.069 1.00 0.00 H new ATOM 0 HE2 LYS A 78 2.277 8.205 2.048 1.00 0.00 H new ATOM 0 HE3 LYS A 78 1.374 9.398 2.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 0.977 9.612 0.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 1.757 11.001 1.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 2.632 9.845 0.309 1.00 0.00 H new ATOM 1218 N PHE A 79 6.676 5.024 4.266 1.00 0.00 N ATOM 1219 CA PHE A 79 7.557 3.923 3.922 1.00 0.00 C ATOM 1220 C PHE A 79 7.220 3.436 2.529 1.00 0.00 C ATOM 1221 O PHE A 79 6.051 3.172 2.233 1.00 0.00 O ATOM 1222 CB PHE A 79 7.505 2.805 4.958 1.00 0.00 C ATOM 1223 CG PHE A 79 7.814 3.313 6.346 1.00 0.00 C ATOM 1224 CD1 PHE A 79 9.154 3.395 6.759 1.00 0.00 C ATOM 1225 CD2 PHE A 79 6.791 3.840 7.157 1.00 0.00 C ATOM 1226 CE1 PHE A 79 9.476 4.052 7.953 1.00 0.00 C ATOM 1227 CE2 PHE A 79 7.119 4.503 8.351 1.00 0.00 C ATOM 1228 CZ PHE A 79 8.463 4.618 8.746 1.00 0.00 C ATOM 0 H PHE A 79 5.837 4.757 4.780 1.00 0.00 H new ATOM 0 HA PHE A 79 8.588 4.277 3.927 1.00 0.00 H new ATOM 0 HB2 PHE A 79 6.516 2.348 4.950 1.00 0.00 H new ATOM 0 HB3 PHE A 79 8.218 2.026 4.689 1.00 0.00 H new ATOM 0 HD1 PHE A 79 9.934 2.952 6.157 1.00 0.00 H new ATOM 0 HD2 PHE A 79 5.757 3.735 6.862 1.00 0.00 H new ATOM 0 HE1 PHE A 79 10.507 4.124 8.266 1.00 0.00 H new ATOM 0 HE2 PHE A 79 6.338 4.925 8.966 1.00 0.00 H new ATOM 0 HZ PHE A 79 8.717 5.140 9.657 1.00 0.00 H new ATOM 1238 N ALA A 80 8.241 3.322 1.690 1.00 0.00 N ATOM 1239 CA ALA A 80 8.117 2.834 0.335 1.00 0.00 C ATOM 1240 C ALA A 80 8.646 1.413 0.305 1.00 0.00 C ATOM 1241 O ALA A 80 9.747 1.149 0.798 1.00 0.00 O ATOM 1242 CB ALA A 80 8.910 3.738 -0.617 1.00 0.00 C ATOM 0 H ALA A 80 9.196 3.573 1.944 1.00 0.00 H new ATOM 0 HA ALA A 80 7.077 2.845 0.010 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.813 3.366 -1.637 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.520 4.754 -0.563 1.00 0.00 H new ATOM 0 HB3 ALA A 80 9.961 3.737 -0.329 1.00 0.00 H new ATOM 1248 N LEU A 81 7.824 0.491 -0.193 1.00 0.00 N ATOM 1249 CA LEU A 81 8.244 -0.888 -0.376 1.00 0.00 C ATOM 1250 C LEU A 81 8.695 -0.912 -1.830 1.00 0.00 C ATOM 1251 O LEU A 81 7.890 -0.738 -2.740 1.00 0.00 O ATOM 1252 CB LEU A 81 7.103 -1.863 -0.048 1.00 0.00 C ATOM 1253 CG LEU A 81 7.351 -3.359 -0.350 1.00 0.00 C ATOM 1254 CD1 LEU A 81 7.139 -3.759 -1.816 1.00 0.00 C ATOM 1255 CD2 LEU A 81 8.699 -3.898 0.131 1.00 0.00 C ATOM 0 H LEU A 81 6.862 0.679 -0.476 1.00 0.00 H new ATOM 0 HA LEU A 81 9.042 -1.212 0.292 1.00 0.00 H new ATOM 0 HB2 LEU A 81 6.868 -1.766 1.012 1.00 0.00 H new ATOM 0 HB3 LEU A 81 6.218 -1.548 -0.601 1.00 0.00 H new ATOM 0 HG LEU A 81 6.571 -3.833 0.246 1.00 0.00 H new ATOM 0 HD11 LEU A 81 7.335 -4.825 -1.934 1.00 0.00 H new ATOM 0 HD12 LEU A 81 6.110 -3.545 -2.106 1.00 0.00 H new ATOM 0 HD13 LEU A 81 7.821 -3.192 -2.450 1.00 0.00 H new ATOM 0 HD21 LEU A 81 8.781 -4.954 -0.126 1.00 0.00 H new ATOM 0 HD22 LEU A 81 9.505 -3.344 -0.350 1.00 0.00 H new ATOM 0 HD23 LEU A 81 8.773 -3.781 1.212 1.00 0.00 H new ATOM 1267 N ILE A 82 9.975 -1.107 -2.067 1.00 0.00 N ATOM 1268 CA ILE A 82 10.540 -1.161 -3.402 1.00 0.00 C ATOM 1269 C ILE A 82 10.599 -2.620 -3.779 1.00 0.00 C ATOM 1270 O ILE A 82 10.888 -3.475 -2.936 1.00 0.00 O ATOM 1271 CB ILE A 82 11.928 -0.487 -3.427 1.00 0.00 C ATOM 1272 CG1 ILE A 82 11.756 1.047 -3.366 1.00 0.00 C ATOM 1273 CG2 ILE A 82 12.787 -0.883 -4.641 1.00 0.00 C ATOM 1274 CD1 ILE A 82 12.112 1.551 -1.972 1.00 0.00 C ATOM 0 H ILE A 82 10.665 -1.235 -1.326 1.00 0.00 H new ATOM 0 HA ILE A 82 9.933 -0.616 -4.125 1.00 0.00 H new ATOM 0 HB ILE A 82 12.469 -0.844 -2.551 1.00 0.00 H new ATOM 0 HG12 ILE A 82 12.395 1.524 -4.109 1.00 0.00 H new ATOM 0 HG13 ILE A 82 10.728 1.317 -3.609 1.00 0.00 H new ATOM 0 HG21 ILE A 82 13.747 -0.370 -4.590 1.00 0.00 H new ATOM 0 HG22 ILE A 82 12.950 -1.961 -4.635 1.00 0.00 H new ATOM 0 HG23 ILE A 82 12.272 -0.599 -5.559 1.00 0.00 H new ATOM 0 HD11 ILE A 82 11.989 2.633 -1.934 1.00 0.00 H new ATOM 0 HD12 ILE A 82 11.455 1.085 -1.238 1.00 0.00 H new ATOM 0 HD13 ILE A 82 13.147 1.295 -1.746 1.00 0.00 H new ATOM 1286 N THR A 83 10.349 -2.894 -5.048 1.00 0.00 N ATOM 1287 CA THR A 83 10.465 -4.224 -5.574 1.00 0.00 C ATOM 1288 C THR A 83 11.417 -4.037 -6.747 1.00 0.00 C ATOM 1289 O THR A 83 11.156 -3.226 -7.638 1.00 0.00 O ATOM 1290 CB THR A 83 9.076 -4.726 -6.004 1.00 0.00 C ATOM 1291 OG1 THR A 83 8.044 -4.313 -5.123 1.00 0.00 O ATOM 1292 CG2 THR A 83 9.081 -6.250 -5.941 1.00 0.00 C ATOM 0 H THR A 83 10.061 -2.196 -5.733 1.00 0.00 H new ATOM 0 HA THR A 83 10.834 -4.969 -4.870 1.00 0.00 H new ATOM 0 HB THR A 83 8.887 -4.323 -6.999 1.00 0.00 H new ATOM 0 HG1 THR A 83 7.850 -3.364 -5.269 1.00 0.00 H new ATOM 0 HG21 THR A 83 8.105 -6.630 -6.242 1.00 0.00 H new ATOM 0 HG22 THR A 83 9.845 -6.639 -6.614 1.00 0.00 H new ATOM 0 HG23 THR A 83 9.297 -6.571 -4.922 1.00 0.00 H new ATOM 1300 N TRP A 84 12.522 -4.766 -6.740 1.00 0.00 N ATOM 1301 CA TRP A 84 13.502 -4.793 -7.801 1.00 0.00 C ATOM 1302 C TRP A 84 13.170 -6.055 -8.577 1.00 0.00 C ATOM 1303 O TRP A 84 13.099 -7.131 -7.982 1.00 0.00 O ATOM 1304 CB TRP A 84 14.920 -4.864 -7.219 1.00 0.00 C ATOM 1305 CG TRP A 84 15.931 -5.280 -8.239 1.00 0.00 C ATOM 1306 CD1 TRP A 84 16.469 -6.514 -8.369 1.00 0.00 C ATOM 1307 CD2 TRP A 84 16.374 -4.525 -9.401 1.00 0.00 C ATOM 1308 NE1 TRP A 84 17.192 -6.581 -9.543 1.00 0.00 N ATOM 1309 CE2 TRP A 84 17.128 -5.391 -10.244 1.00 0.00 C ATOM 1310 CE3 TRP A 84 16.173 -3.202 -9.842 1.00 0.00 C ATOM 1311 CZ2 TRP A 84 17.593 -4.976 -11.501 1.00 0.00 C ATOM 1312 CZ3 TRP A 84 16.658 -2.771 -11.090 1.00 0.00 C ATOM 1313 CH2 TRP A 84 17.326 -3.669 -11.939 1.00 0.00 C ATOM 0 H TRP A 84 12.765 -5.378 -5.961 1.00 0.00 H new ATOM 0 HA TRP A 84 13.474 -3.901 -8.427 1.00 0.00 H new ATOM 0 HB2 TRP A 84 15.194 -3.889 -6.815 1.00 0.00 H new ATOM 0 HB3 TRP A 84 14.934 -5.569 -6.388 1.00 0.00 H new ATOM 0 HD1 TRP A 84 16.351 -7.323 -7.663 1.00 0.00 H new ATOM 0 HE1 TRP A 84 17.708 -7.404 -9.854 1.00 0.00 H new ATOM 0 HE3 TRP A 84 15.638 -2.507 -9.211 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 18.152 -5.656 -12.127 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 16.516 -1.745 -11.397 1.00 0.00 H new ATOM 0 HH2 TRP A 84 17.633 -3.355 -12.926 1.00 0.00 H new ATOM 1324 N ILE A 85 12.936 -5.944 -9.879 1.00 0.00 N ATOM 1325 CA ILE A 85 12.630 -7.068 -10.739 1.00 0.00 C ATOM 1326 C ILE A 85 13.403 -6.815 -12.034 1.00 0.00 C ATOM 1327 O ILE A 85 12.810 -6.321 -12.991 1.00 0.00 O ATOM 1328 CB ILE A 85 11.117 -7.263 -10.954 1.00 0.00 C ATOM 1329 CG1 ILE A 85 10.299 -7.011 -9.676 1.00 0.00 C ATOM 1330 CG2 ILE A 85 10.927 -8.711 -11.440 1.00 0.00 C ATOM 1331 CD1 ILE A 85 8.824 -7.268 -9.923 1.00 0.00 C ATOM 0 H ILE A 85 12.955 -5.051 -10.371 1.00 0.00 H new ATOM 0 HA ILE A 85 12.937 -8.010 -10.285 1.00 0.00 H new ATOM 0 HB ILE A 85 10.753 -6.539 -11.683 1.00 0.00 H new ATOM 0 HG12 ILE A 85 10.657 -7.659 -8.876 1.00 0.00 H new ATOM 0 HG13 ILE A 85 10.443 -5.983 -9.343 1.00 0.00 H new ATOM 0 HG21 ILE A 85 9.867 -8.902 -11.608 1.00 0.00 H new ATOM 0 HG22 ILE A 85 11.474 -8.857 -12.371 1.00 0.00 H new ATOM 0 HG23 ILE A 85 11.305 -9.401 -10.685 1.00 0.00 H new ATOM 0 HD11 ILE A 85 8.264 -7.084 -9.006 1.00 0.00 H new ATOM 0 HD12 ILE A 85 8.465 -6.602 -10.707 1.00 0.00 H new ATOM 0 HD13 ILE A 85 8.682 -8.303 -10.233 1.00 0.00 H new ATOM 1343 N GLY A 86 14.714 -7.087 -12.053 1.00 0.00 N ATOM 1344 CA GLY A 86 15.583 -6.821 -13.201 1.00 0.00 C ATOM 1345 C GLY A 86 14.910 -7.219 -14.510 1.00 0.00 C ATOM 1346 O GLY A 86 14.290 -8.279 -14.580 1.00 0.00 O ATOM 0 H GLY A 86 15.205 -7.503 -11.261 1.00 0.00 H new ATOM 0 HA2 GLY A 86 15.839 -5.762 -13.229 1.00 0.00 H new ATOM 0 HA3 GLY A 86 16.517 -7.371 -13.088 1.00 0.00 H new ATOM 1350 N GLU A 87 15.024 -6.402 -15.553 1.00 0.00 N ATOM 1351 CA GLU A 87 14.351 -6.621 -16.834 1.00 0.00 C ATOM 1352 C GLU A 87 14.801 -7.930 -17.522 1.00 0.00 C ATOM 1353 O GLU A 87 14.263 -8.302 -18.561 1.00 0.00 O ATOM 1354 CB GLU A 87 14.556 -5.384 -17.725 1.00 0.00 C ATOM 1355 CG GLU A 87 13.507 -5.245 -18.844 1.00 0.00 C ATOM 1356 CD GLU A 87 12.115 -4.957 -18.269 1.00 0.00 C ATOM 1357 OE1 GLU A 87 11.948 -3.910 -17.607 1.00 0.00 O ATOM 1358 OE2 GLU A 87 11.162 -5.742 -18.477 1.00 0.00 O ATOM 0 H GLU A 87 15.594 -5.556 -15.534 1.00 0.00 H new ATOM 0 HA GLU A 87 13.284 -6.750 -16.654 1.00 0.00 H new ATOM 0 HB2 GLU A 87 14.530 -4.490 -17.102 1.00 0.00 H new ATOM 0 HB3 GLU A 87 15.548 -5.431 -18.173 1.00 0.00 H new ATOM 0 HG2 GLU A 87 13.797 -4.441 -19.520 1.00 0.00 H new ATOM 0 HG3 GLU A 87 13.477 -6.161 -19.433 1.00 0.00 H new ATOM 1365 N ASN A 88 15.771 -8.661 -16.963 1.00 0.00 N ATOM 1366 CA ASN A 88 16.239 -9.924 -17.518 1.00 0.00 C ATOM 1367 C ASN A 88 15.324 -11.055 -17.074 1.00 0.00 C ATOM 1368 O ASN A 88 15.054 -11.946 -17.880 1.00 0.00 O ATOM 1369 CB ASN A 88 17.676 -10.214 -17.056 1.00 0.00 C ATOM 1370 CG ASN A 88 18.696 -9.285 -17.706 1.00 0.00 C ATOM 1371 OD1 ASN A 88 18.384 -8.539 -18.634 1.00 0.00 O ATOM 1372 ND2 ASN A 88 19.934 -9.302 -17.246 1.00 0.00 N ATOM 0 H ASN A 88 16.253 -8.386 -16.107 1.00 0.00 H new ATOM 0 HA ASN A 88 16.225 -9.851 -18.605 1.00 0.00 H new ATOM 0 HB2 ASN A 88 17.734 -10.111 -15.972 1.00 0.00 H new ATOM 0 HB3 ASN A 88 17.929 -11.248 -17.292 1.00 0.00 H new ATOM 0 HD21 ASN A 88 20.640 -8.694 -17.660 1.00 0.00 H new ATOM 0 HD22 ASN A 88 20.184 -9.923 -16.477 1.00 0.00 H new ATOM 1379 N VAL A 89 14.788 -11.036 -15.852 1.00 0.00 N ATOM 1380 CA VAL A 89 13.842 -12.046 -15.432 1.00 0.00 C ATOM 1381 C VAL A 89 12.470 -11.725 -16.028 1.00 0.00 C ATOM 1382 O VAL A 89 11.911 -10.646 -15.801 1.00 0.00 O ATOM 1383 CB VAL A 89 13.864 -12.146 -13.903 1.00 0.00 C ATOM 1384 CG1 VAL A 89 13.716 -10.848 -13.102 1.00 0.00 C ATOM 1385 CG2 VAL A 89 12.799 -13.123 -13.414 1.00 0.00 C ATOM 0 H VAL A 89 14.998 -10.331 -15.145 1.00 0.00 H new ATOM 0 HA VAL A 89 14.110 -13.035 -15.805 1.00 0.00 H new ATOM 0 HB VAL A 89 14.881 -12.488 -13.709 1.00 0.00 H new ATOM 0 HG11 VAL A 89 13.750 -11.073 -12.036 1.00 0.00 H new ATOM 0 HG12 VAL A 89 14.530 -10.169 -13.356 1.00 0.00 H new ATOM 0 HG13 VAL A 89 12.763 -10.378 -13.344 1.00 0.00 H new ATOM 0 HG21 VAL A 89 12.830 -13.181 -12.326 1.00 0.00 H new ATOM 0 HG22 VAL A 89 11.815 -12.777 -13.731 1.00 0.00 H new ATOM 0 HG23 VAL A 89 12.990 -14.110 -13.835 1.00 0.00 H new ATOM 1395 N SER A 90 11.903 -12.675 -16.768 1.00 0.00 N ATOM 1396 CA SER A 90 10.573 -12.572 -17.333 1.00 0.00 C ATOM 1397 C SER A 90 9.966 -13.971 -17.333 1.00 0.00 C ATOM 1398 O SER A 90 10.527 -14.897 -17.928 1.00 0.00 O ATOM 1399 CB SER A 90 10.689 -11.928 -18.718 1.00 0.00 C ATOM 1400 OG SER A 90 9.445 -11.445 -19.187 1.00 0.00 O ATOM 0 H SER A 90 12.371 -13.553 -16.992 1.00 0.00 H new ATOM 0 HA SER A 90 9.904 -11.934 -16.756 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.404 -11.106 -18.676 1.00 0.00 H new ATOM 0 HB3 SER A 90 11.084 -12.658 -19.425 1.00 0.00 H new ATOM 0 HG SER A 90 9.564 -11.041 -20.072 1.00 0.00 H new ATOM 1406 N GLY A 91 8.803 -14.122 -16.698 1.00 0.00 N ATOM 1407 CA GLY A 91 8.126 -15.398 -16.521 1.00 0.00 C ATOM 1408 C GLY A 91 7.657 -15.575 -15.081 1.00 0.00 C ATOM 1409 O GLY A 91 7.319 -14.594 -14.401 1.00 0.00 O ATOM 0 H GLY A 91 8.297 -13.339 -16.284 1.00 0.00 H new ATOM 0 HA2 GLY A 91 7.271 -15.456 -17.195 1.00 0.00 H new ATOM 0 HA3 GLY A 91 8.800 -16.211 -16.790 1.00 0.00 H new ATOM 1413 N LEU A 92 7.583 -16.831 -14.639 1.00 0.00 N ATOM 1414 CA LEU A 92 7.090 -17.257 -13.335 1.00 0.00 C ATOM 1415 C LEU A 92 7.748 -16.475 -12.201 1.00 0.00 C ATOM 1416 O LEU A 92 7.053 -16.086 -11.271 1.00 0.00 O ATOM 1417 CB LEU A 92 7.272 -18.785 -13.218 1.00 0.00 C ATOM 1418 CG LEU A 92 6.709 -19.505 -11.973 1.00 0.00 C ATOM 1419 CD1 LEU A 92 7.691 -19.534 -10.799 1.00 0.00 C ATOM 1420 CD2 LEU A 92 5.339 -18.990 -11.524 1.00 0.00 C ATOM 0 H LEU A 92 7.882 -17.618 -15.214 1.00 0.00 H new ATOM 0 HA LEU A 92 6.027 -17.035 -13.244 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.817 -19.241 -14.097 1.00 0.00 H new ATOM 0 HB3 LEU A 92 8.340 -18.995 -13.267 1.00 0.00 H new ATOM 0 HG LEU A 92 6.563 -20.533 -12.306 1.00 0.00 H new ATOM 0 HD11 LEU A 92 7.235 -20.053 -9.956 1.00 0.00 H new ATOM 0 HD12 LEU A 92 8.600 -20.056 -11.098 1.00 0.00 H new ATOM 0 HD13 LEU A 92 7.938 -18.514 -10.506 1.00 0.00 H new ATOM 0 HD21 LEU A 92 5.012 -19.545 -10.645 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.411 -17.931 -11.278 1.00 0.00 H new ATOM 0 HD23 LEU A 92 4.617 -19.127 -12.329 1.00 0.00 H new ATOM 1432 N GLN A 93 9.042 -16.156 -12.269 1.00 0.00 N ATOM 1433 CA GLN A 93 9.716 -15.416 -11.203 1.00 0.00 C ATOM 1434 C GLN A 93 9.092 -14.023 -11.002 1.00 0.00 C ATOM 1435 O GLN A 93 8.965 -13.580 -9.858 1.00 0.00 O ATOM 1436 CB GLN A 93 11.216 -15.328 -11.504 1.00 0.00 C ATOM 1437 CG GLN A 93 12.036 -16.574 -11.141 1.00 0.00 C ATOM 1438 CD GLN A 93 11.498 -17.872 -11.736 1.00 0.00 C ATOM 1439 OE1 GLN A 93 11.535 -18.083 -12.944 1.00 0.00 O ATOM 1440 NE2 GLN A 93 10.978 -18.763 -10.916 1.00 0.00 N ATOM 0 H GLN A 93 9.645 -16.400 -13.055 1.00 0.00 H new ATOM 0 HA GLN A 93 9.583 -15.954 -10.265 1.00 0.00 H new ATOM 0 HB2 GLN A 93 11.344 -15.127 -12.568 1.00 0.00 H new ATOM 0 HB3 GLN A 93 11.628 -14.474 -10.966 1.00 0.00 H new ATOM 0 HG2 GLN A 93 13.062 -16.431 -11.479 1.00 0.00 H new ATOM 0 HG3 GLN A 93 12.068 -16.671 -10.056 1.00 0.00 H new ATOM 0 HE21 GLN A 93 10.952 -18.579 -9.913 1.00 0.00 H new ATOM 0 HE22 GLN A 93 10.602 -19.637 -11.284 1.00 0.00 H new ATOM 1449 N ARG A 94 8.680 -13.317 -12.068 1.00 0.00 N ATOM 1450 CA ARG A 94 7.995 -12.028 -11.890 1.00 0.00 C ATOM 1451 C ARG A 94 6.594 -12.300 -11.335 1.00 0.00 C ATOM 1452 O ARG A 94 6.109 -11.548 -10.486 1.00 0.00 O ATOM 1453 CB ARG A 94 7.913 -11.211 -13.199 1.00 0.00 C ATOM 1454 CG ARG A 94 7.496 -9.741 -12.945 1.00 0.00 C ATOM 1455 CD ARG A 94 6.398 -9.181 -13.855 1.00 0.00 C ATOM 1456 NE ARG A 94 6.945 -8.731 -15.142 1.00 0.00 N ATOM 1457 CZ ARG A 94 6.313 -8.010 -16.070 1.00 0.00 C ATOM 1458 NH1 ARG A 94 5.061 -7.610 -15.879 1.00 0.00 N ATOM 1459 NH2 ARG A 94 6.935 -7.703 -17.204 1.00 0.00 N ATOM 0 H ARG A 94 8.805 -13.608 -13.038 1.00 0.00 H new ATOM 0 HA ARG A 94 8.574 -11.423 -11.192 1.00 0.00 H new ATOM 0 HB2 ARG A 94 8.881 -11.231 -13.699 1.00 0.00 H new ATOM 0 HB3 ARG A 94 7.196 -11.679 -13.873 1.00 0.00 H new ATOM 0 HG2 ARG A 94 7.161 -9.654 -11.911 1.00 0.00 H new ATOM 0 HG3 ARG A 94 8.380 -9.112 -13.048 1.00 0.00 H new ATOM 0 HD2 ARG A 94 5.641 -9.946 -14.027 1.00 0.00 H new ATOM 0 HD3 ARG A 94 5.901 -8.348 -13.358 1.00 0.00 H new ATOM 0 HE ARG A 94 7.908 -8.997 -15.348 1.00 0.00 H new ATOM 0 HH11 ARG A 94 4.574 -7.854 -15.017 1.00 0.00 H new ATOM 0 HH12 ARG A 94 4.587 -7.059 -16.595 1.00 0.00 H new ATOM 0 HH21 ARG A 94 7.892 -8.018 -17.362 1.00 0.00 H new ATOM 0 HH22 ARG A 94 6.455 -7.152 -17.916 1.00 0.00 H new ATOM 1473 N ALA A 95 5.942 -13.378 -11.782 1.00 0.00 N ATOM 1474 CA ALA A 95 4.624 -13.745 -11.289 1.00 0.00 C ATOM 1475 C ALA A 95 4.649 -14.089 -9.795 1.00 0.00 C ATOM 1476 O ALA A 95 3.664 -13.819 -9.108 1.00 0.00 O ATOM 1477 CB ALA A 95 4.025 -14.878 -12.125 1.00 0.00 C ATOM 0 H ALA A 95 6.314 -14.011 -12.489 1.00 0.00 H new ATOM 0 HA ALA A 95 3.976 -12.875 -11.398 1.00 0.00 H new ATOM 0 HB1 ALA A 95 3.039 -15.135 -11.737 1.00 0.00 H new ATOM 0 HB2 ALA A 95 3.934 -14.556 -13.162 1.00 0.00 H new ATOM 0 HB3 ALA A 95 4.675 -15.752 -12.072 1.00 0.00 H new ATOM 1483 N LYS A 96 5.749 -14.641 -9.264 1.00 0.00 N ATOM 1484 CA LYS A 96 5.896 -14.926 -7.835 1.00 0.00 C ATOM 1485 C LYS A 96 5.758 -13.633 -7.076 1.00 0.00 C ATOM 1486 O LYS A 96 4.865 -13.541 -6.250 1.00 0.00 O ATOM 1487 CB LYS A 96 7.249 -15.584 -7.504 1.00 0.00 C ATOM 1488 CG LYS A 96 7.409 -16.992 -8.081 1.00 0.00 C ATOM 1489 CD LYS A 96 6.911 -18.117 -7.170 1.00 0.00 C ATOM 1490 CE LYS A 96 8.011 -18.534 -6.191 1.00 0.00 C ATOM 1491 NZ LYS A 96 7.655 -19.767 -5.465 1.00 0.00 N ATOM 0 H LYS A 96 6.564 -14.903 -9.819 1.00 0.00 H new ATOM 0 HA LYS A 96 5.120 -15.634 -7.545 1.00 0.00 H new ATOM 0 HB2 LYS A 96 8.052 -14.952 -7.884 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.365 -15.630 -6.421 1.00 0.00 H new ATOM 0 HG2 LYS A 96 6.872 -17.045 -9.028 1.00 0.00 H new ATOM 0 HG3 LYS A 96 8.463 -17.162 -8.302 1.00 0.00 H new ATOM 0 HD2 LYS A 96 6.031 -17.785 -6.619 1.00 0.00 H new ATOM 0 HD3 LYS A 96 6.606 -18.973 -7.772 1.00 0.00 H new ATOM 0 HE2 LYS A 96 8.943 -18.688 -6.735 1.00 0.00 H new ATOM 0 HE3 LYS A 96 8.187 -17.729 -5.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 8.423 -20.019 -4.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 6.779 -19.612 -4.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 7.511 -20.541 -6.145 1.00 0.00 H new ATOM 1505 N THR A 97 6.543 -12.611 -7.411 1.00 0.00 N ATOM 1506 CA THR A 97 6.418 -11.301 -6.792 1.00 0.00 C ATOM 1507 C THR A 97 4.968 -10.812 -6.867 1.00 0.00 C ATOM 1508 O THR A 97 4.446 -10.302 -5.875 1.00 0.00 O ATOM 1509 CB THR A 97 7.390 -10.352 -7.504 1.00 0.00 C ATOM 1510 OG1 THR A 97 8.708 -10.684 -7.122 1.00 0.00 O ATOM 1511 CG2 THR A 97 7.129 -8.878 -7.215 1.00 0.00 C ATOM 0 H THR A 97 7.278 -12.671 -8.115 1.00 0.00 H new ATOM 0 HA THR A 97 6.674 -11.343 -5.733 1.00 0.00 H new ATOM 0 HB THR A 97 7.241 -10.483 -8.576 1.00 0.00 H new ATOM 0 HG1 THR A 97 8.916 -10.261 -6.263 1.00 0.00 H new ATOM 0 HG21 THR A 97 7.855 -8.268 -7.752 1.00 0.00 H new ATOM 0 HG22 THR A 97 6.122 -8.616 -7.541 1.00 0.00 H new ATOM 0 HG23 THR A 97 7.223 -8.695 -6.145 1.00 0.00 H new ATOM 1519 N GLY A 98 4.291 -11.026 -7.999 1.00 0.00 N ATOM 1520 CA GLY A 98 2.903 -10.622 -8.173 1.00 0.00 C ATOM 1521 C GLY A 98 1.950 -11.244 -7.158 1.00 0.00 C ATOM 1522 O GLY A 98 0.925 -10.641 -6.832 1.00 0.00 O ATOM 0 H GLY A 98 4.694 -11.484 -8.816 1.00 0.00 H new ATOM 0 HA2 GLY A 98 2.838 -9.536 -8.101 1.00 0.00 H new ATOM 0 HA3 GLY A 98 2.578 -10.894 -9.177 1.00 0.00 H new ATOM 1526 N THR A 99 2.282 -12.403 -6.603 1.00 0.00 N ATOM 1527 CA THR A 99 1.467 -13.097 -5.608 1.00 0.00 C ATOM 1528 C THR A 99 2.182 -13.182 -4.247 1.00 0.00 C ATOM 1529 O THR A 99 1.564 -13.565 -3.256 1.00 0.00 O ATOM 1530 CB THR A 99 0.980 -14.417 -6.221 1.00 0.00 C ATOM 1531 OG1 THR A 99 0.310 -14.115 -7.433 1.00 0.00 O ATOM 1532 CG2 THR A 99 -0.039 -15.149 -5.358 1.00 0.00 C ATOM 0 H THR A 99 3.143 -12.899 -6.835 1.00 0.00 H new ATOM 0 HA THR A 99 0.567 -12.535 -5.357 1.00 0.00 H new ATOM 0 HB THR A 99 1.860 -15.049 -6.340 1.00 0.00 H new ATOM 0 HG1 THR A 99 -0.010 -14.944 -7.845 1.00 0.00 H new ATOM 0 HG21 THR A 99 -0.339 -16.073 -5.853 1.00 0.00 H new ATOM 0 HG22 THR A 99 0.405 -15.383 -4.391 1.00 0.00 H new ATOM 0 HG23 THR A 99 -0.914 -14.516 -5.212 1.00 0.00 H new ATOM 1540 N ASP A 100 3.396 -12.648 -4.142 1.00 0.00 N ATOM 1541 CA ASP A 100 4.238 -12.675 -2.951 1.00 0.00 C ATOM 1542 C ASP A 100 4.191 -11.307 -2.287 1.00 0.00 C ATOM 1543 O ASP A 100 4.415 -11.226 -1.082 1.00 0.00 O ATOM 1544 CB ASP A 100 5.695 -13.065 -3.248 1.00 0.00 C ATOM 1545 CG ASP A 100 5.929 -14.558 -3.506 1.00 0.00 C ATOM 1546 OD1 ASP A 100 5.071 -15.395 -3.153 1.00 0.00 O ATOM 1547 OD2 ASP A 100 7.020 -14.923 -4.000 1.00 0.00 O ATOM 0 H ASP A 100 3.839 -12.162 -4.922 1.00 0.00 H new ATOM 0 HA ASP A 100 3.844 -13.444 -2.287 1.00 0.00 H new ATOM 0 HB2 ASP A 100 6.035 -12.504 -4.119 1.00 0.00 H new ATOM 0 HB3 ASP A 100 6.316 -12.756 -2.407 1.00 0.00 H new ATOM 1552 N LYS A 101 3.865 -10.218 -3.007 1.00 0.00 N ATOM 1553 CA LYS A 101 3.698 -8.897 -2.387 1.00 0.00 C ATOM 1554 C LYS A 101 2.703 -8.974 -1.222 1.00 0.00 C ATOM 1555 O LYS A 101 2.734 -8.134 -0.332 1.00 0.00 O ATOM 1556 CB LYS A 101 3.222 -7.833 -3.396 1.00 0.00 C ATOM 1557 CG LYS A 101 4.330 -7.234 -4.271 1.00 0.00 C ATOM 1558 CD LYS A 101 3.750 -6.173 -5.214 1.00 0.00 C ATOM 1559 CE LYS A 101 4.866 -5.525 -6.042 1.00 0.00 C ATOM 1560 NZ LYS A 101 4.316 -4.644 -7.094 1.00 0.00 N ATOM 0 H LYS A 101 3.713 -10.230 -4.016 1.00 0.00 H new ATOM 0 HA LYS A 101 4.678 -8.596 -2.018 1.00 0.00 H new ATOM 0 HB2 LYS A 101 2.468 -8.279 -4.044 1.00 0.00 H new ATOM 0 HB3 LYS A 101 2.735 -7.026 -2.849 1.00 0.00 H new ATOM 0 HG2 LYS A 101 5.099 -6.788 -3.641 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.810 -8.022 -4.851 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.015 -6.630 -5.877 1.00 0.00 H new ATOM 0 HD3 LYS A 101 3.228 -5.410 -4.636 1.00 0.00 H new ATOM 0 HE2 LYS A 101 5.519 -4.948 -5.387 1.00 0.00 H new ATOM 0 HE3 LYS A 101 5.479 -6.301 -6.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 4.664 -4.955 -8.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 3.277 -4.692 -7.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 4.620 -3.665 -6.920 1.00 0.00 H new ATOM 1574 N THR A 102 1.797 -9.951 -1.219 1.00 0.00 N ATOM 1575 CA THR A 102 0.856 -10.173 -0.139 1.00 0.00 C ATOM 1576 C THR A 102 1.595 -10.552 1.154 1.00 0.00 C ATOM 1577 O THR A 102 1.280 -10.045 2.222 1.00 0.00 O ATOM 1578 CB THR A 102 -0.154 -11.234 -0.607 1.00 0.00 C ATOM 1579 OG1 THR A 102 -1.327 -11.150 0.147 1.00 0.00 O ATOM 1580 CG2 THR A 102 0.356 -12.667 -0.499 1.00 0.00 C ATOM 0 H THR A 102 1.700 -10.619 -1.984 1.00 0.00 H new ATOM 0 HA THR A 102 0.306 -9.263 0.103 1.00 0.00 H new ATOM 0 HB THR A 102 -0.329 -11.016 -1.661 1.00 0.00 H new ATOM 0 HG1 THR A 102 -1.254 -11.732 0.932 1.00 0.00 H new ATOM 0 HG21 THR A 102 -0.414 -13.355 -0.848 1.00 0.00 H new ATOM 0 HG22 THR A 102 1.250 -12.782 -1.112 1.00 0.00 H new ATOM 0 HG23 THR A 102 0.597 -12.890 0.540 1.00 0.00 H new ATOM 1588 N LEU A 103 2.615 -11.406 1.062 1.00 0.00 N ATOM 1589 CA LEU A 103 3.370 -11.935 2.181 1.00 0.00 C ATOM 1590 C LEU A 103 4.066 -10.793 2.890 1.00 0.00 C ATOM 1591 O LEU A 103 3.800 -10.500 4.052 1.00 0.00 O ATOM 1592 CB LEU A 103 4.375 -12.965 1.653 1.00 0.00 C ATOM 1593 CG LEU A 103 3.756 -14.289 1.179 1.00 0.00 C ATOM 1594 CD1 LEU A 103 4.854 -15.346 1.097 1.00 0.00 C ATOM 1595 CD2 LEU A 103 2.621 -14.847 2.050 1.00 0.00 C ATOM 0 H LEU A 103 2.946 -11.758 0.164 1.00 0.00 H new ATOM 0 HA LEU A 103 2.713 -12.429 2.897 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.926 -12.521 0.824 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.099 -13.180 2.439 1.00 0.00 H new ATOM 0 HG LEU A 103 3.306 -14.061 0.213 1.00 0.00 H new ATOM 0 HD11 LEU A 103 4.426 -16.290 0.761 1.00 0.00 H new ATOM 0 HD12 LEU A 103 5.618 -15.023 0.390 1.00 0.00 H new ATOM 0 HD13 LEU A 103 5.303 -15.481 2.081 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.260 -15.782 1.622 1.00 0.00 H new ATOM 0 HD22 LEU A 103 2.992 -15.029 3.059 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.804 -14.126 2.089 1.00 0.00 H new ATOM 1607 N VAL A 104 4.953 -10.125 2.168 1.00 0.00 N ATOM 1608 CA VAL A 104 5.640 -8.961 2.686 1.00 0.00 C ATOM 1609 C VAL A 104 4.629 -7.881 3.124 1.00 0.00 C ATOM 1610 O VAL A 104 4.902 -7.220 4.124 1.00 0.00 O ATOM 1611 CB VAL A 104 6.766 -8.551 1.708 1.00 0.00 C ATOM 1612 CG1 VAL A 104 6.385 -8.692 0.224 1.00 0.00 C ATOM 1613 CG2 VAL A 104 7.328 -7.151 1.986 1.00 0.00 C ATOM 0 H VAL A 104 5.213 -10.375 1.214 1.00 0.00 H new ATOM 0 HA VAL A 104 6.169 -9.173 3.615 1.00 0.00 H new ATOM 0 HB VAL A 104 7.558 -9.274 1.904 1.00 0.00 H new ATOM 0 HG11 VAL A 104 7.226 -8.386 -0.398 1.00 0.00 H new ATOM 0 HG12 VAL A 104 6.135 -9.731 0.010 1.00 0.00 H new ATOM 0 HG13 VAL A 104 5.524 -8.059 0.008 1.00 0.00 H new ATOM 0 HG21 VAL A 104 8.114 -6.925 1.265 1.00 0.00 H new ATOM 0 HG22 VAL A 104 6.530 -6.414 1.896 1.00 0.00 H new ATOM 0 HG23 VAL A 104 7.740 -7.118 2.994 1.00 0.00 H new ATOM 1623 N LYS A 105 3.443 -7.742 2.501 1.00 0.00 N ATOM 1624 CA LYS A 105 2.429 -6.780 2.966 1.00 0.00 C ATOM 1625 C LYS A 105 2.004 -7.125 4.390 1.00 0.00 C ATOM 1626 O LYS A 105 1.991 -6.227 5.229 1.00 0.00 O ATOM 1627 CB LYS A 105 1.243 -6.718 1.981 1.00 0.00 C ATOM 1628 CG LYS A 105 -0.107 -6.174 2.507 1.00 0.00 C ATOM 1629 CD LYS A 105 -1.247 -7.159 2.181 1.00 0.00 C ATOM 1630 CE LYS A 105 -2.553 -6.848 2.919 1.00 0.00 C ATOM 1631 NZ LYS A 105 -2.494 -7.230 4.344 1.00 0.00 N ATOM 0 H LYS A 105 3.166 -8.280 1.680 1.00 0.00 H new ATOM 0 HA LYS A 105 2.858 -5.778 2.991 1.00 0.00 H new ATOM 0 HB2 LYS A 105 1.544 -6.103 1.133 1.00 0.00 H new ATOM 0 HB3 LYS A 105 1.072 -7.725 1.599 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -0.049 -6.019 3.584 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -0.316 -5.204 2.056 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -1.433 -7.144 1.107 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -0.927 -8.170 2.435 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -2.768 -5.782 2.839 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -3.375 -7.377 2.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -3.416 -7.048 4.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -2.264 -8.241 4.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -1.761 -6.670 4.823 1.00 0.00 H new ATOM 1645 N GLU A 106 1.698 -8.395 4.678 1.00 0.00 N ATOM 1646 CA GLU A 106 1.264 -8.856 6.000 1.00 0.00 C ATOM 1647 C GLU A 106 2.269 -8.455 7.097 1.00 0.00 C ATOM 1648 O GLU A 106 1.911 -8.416 8.279 1.00 0.00 O ATOM 1649 CB GLU A 106 1.005 -10.375 5.981 1.00 0.00 C ATOM 1650 CG GLU A 106 -0.128 -10.811 5.033 1.00 0.00 C ATOM 1651 CD GLU A 106 -1.524 -10.680 5.632 1.00 0.00 C ATOM 1652 OE1 GLU A 106 -2.004 -9.538 5.789 1.00 0.00 O ATOM 1653 OE2 GLU A 106 -2.177 -11.720 5.903 1.00 0.00 O ATOM 0 H GLU A 106 1.746 -9.143 3.987 1.00 0.00 H new ATOM 0 HA GLU A 106 0.324 -8.361 6.244 1.00 0.00 H new ATOM 0 HB2 GLU A 106 1.923 -10.885 5.690 1.00 0.00 H new ATOM 0 HB3 GLU A 106 0.764 -10.704 6.992 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -0.077 -10.213 4.123 1.00 0.00 H new ATOM 0 HG3 GLU A 106 0.035 -11.849 4.742 1.00 0.00 H new ATOM 1660 N VAL A 107 3.538 -8.227 6.745 1.00 0.00 N ATOM 1661 CA VAL A 107 4.574 -7.747 7.648 1.00 0.00 C ATOM 1662 C VAL A 107 4.506 -6.209 7.677 1.00 0.00 C ATOM 1663 O VAL A 107 4.199 -5.611 8.710 1.00 0.00 O ATOM 1664 CB VAL A 107 5.969 -8.237 7.192 1.00 0.00 C ATOM 1665 CG1 VAL A 107 7.046 -7.754 8.177 1.00 0.00 C ATOM 1666 CG2 VAL A 107 6.060 -9.762 7.022 1.00 0.00 C ATOM 0 H VAL A 107 3.877 -8.378 5.795 1.00 0.00 H new ATOM 0 HA VAL A 107 4.411 -8.141 8.651 1.00 0.00 H new ATOM 0 HB VAL A 107 6.139 -7.805 6.206 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.024 -8.104 7.847 1.00 0.00 H new ATOM 0 HG12 VAL A 107 7.044 -6.665 8.213 1.00 0.00 H new ATOM 0 HG13 VAL A 107 6.835 -8.150 9.170 1.00 0.00 H new ATOM 0 HG21 VAL A 107 7.066 -10.033 6.701 1.00 0.00 H new ATOM 0 HG22 VAL A 107 5.839 -10.248 7.972 1.00 0.00 H new ATOM 0 HG23 VAL A 107 5.340 -10.088 6.272 1.00 0.00 H new ATOM 1676 N VAL A 108 4.803 -5.591 6.531 1.00 0.00 N ATOM 1677 CA VAL A 108 4.936 -4.173 6.189 1.00 0.00 C ATOM 1678 C VAL A 108 3.617 -3.376 6.314 1.00 0.00 C ATOM 1679 O VAL A 108 3.466 -2.332 5.694 1.00 0.00 O ATOM 1680 CB VAL A 108 5.641 -4.138 4.796 1.00 0.00 C ATOM 1681 CG1 VAL A 108 5.842 -2.772 4.129 1.00 0.00 C ATOM 1682 CG2 VAL A 108 7.060 -4.738 4.922 1.00 0.00 C ATOM 0 H VAL A 108 4.981 -6.159 5.702 1.00 0.00 H new ATOM 0 HA VAL A 108 5.551 -3.636 6.911 1.00 0.00 H new ATOM 0 HB VAL A 108 4.946 -4.697 4.169 1.00 0.00 H new ATOM 0 HG11 VAL A 108 6.343 -2.905 3.170 1.00 0.00 H new ATOM 0 HG12 VAL A 108 4.873 -2.299 3.969 1.00 0.00 H new ATOM 0 HG13 VAL A 108 6.453 -2.139 4.773 1.00 0.00 H new ATOM 0 HG21 VAL A 108 7.553 -4.714 3.950 1.00 0.00 H new ATOM 0 HG22 VAL A 108 7.640 -4.154 5.637 1.00 0.00 H new ATOM 0 HG23 VAL A 108 6.990 -5.769 5.268 1.00 0.00 H new ATOM 1692 N GLN A 109 2.673 -3.799 7.155 1.00 0.00 N ATOM 1693 CA GLN A 109 1.347 -3.202 7.321 1.00 0.00 C ATOM 1694 C GLN A 109 1.326 -1.680 7.516 1.00 0.00 C ATOM 1695 O GLN A 109 0.315 -1.063 7.170 1.00 0.00 O ATOM 1696 CB GLN A 109 0.660 -3.880 8.510 1.00 0.00 C ATOM 1697 CG GLN A 109 0.176 -5.298 8.185 1.00 0.00 C ATOM 1698 CD GLN A 109 -0.923 -5.316 7.130 1.00 0.00 C ATOM 1699 OE1 GLN A 109 -0.858 -6.055 6.159 1.00 0.00 O ATOM 1700 NE2 GLN A 109 -1.959 -4.511 7.279 1.00 0.00 N ATOM 0 H GLN A 109 2.818 -4.603 7.766 1.00 0.00 H new ATOM 0 HA GLN A 109 0.820 -3.370 6.382 1.00 0.00 H new ATOM 0 HB2 GLN A 109 1.354 -3.921 9.350 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -0.189 -3.275 8.827 1.00 0.00 H new ATOM 0 HG2 GLN A 109 1.019 -5.894 7.836 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -0.193 -5.770 9.096 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -2.013 -3.894 8.090 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -2.705 -4.506 6.584 1.00 0.00 H new ATOM 1709 N ASN A 110 2.392 -1.067 8.049 1.00 0.00 N ATOM 1710 CA ASN A 110 2.493 0.383 8.177 1.00 0.00 C ATOM 1711 C ASN A 110 3.469 0.850 7.108 1.00 0.00 C ATOM 1712 O ASN A 110 4.666 1.011 7.359 1.00 0.00 O ATOM 1713 CB ASN A 110 2.917 0.873 9.564 1.00 0.00 C ATOM 1714 CG ASN A 110 2.820 2.396 9.588 1.00 0.00 C ATOM 1715 OD1 ASN A 110 1.754 2.940 9.868 1.00 0.00 O ATOM 1716 ND2 ASN A 110 3.880 3.107 9.238 1.00 0.00 N ATOM 0 H ASN A 110 3.207 -1.569 8.402 1.00 0.00 H new ATOM 0 HA ASN A 110 1.500 0.812 8.042 1.00 0.00 H new ATOM 0 HB2 ASN A 110 2.275 0.440 10.332 1.00 0.00 H new ATOM 0 HB3 ASN A 110 3.936 0.554 9.783 1.00 0.00 H new ATOM 0 HD21 ASN A 110 3.821 4.124 9.197 1.00 0.00 H new ATOM 0 HD22 ASN A 110 4.756 2.637 9.009 1.00 0.00 H new ATOM 1723 N PHE A 111 2.948 1.046 5.906 1.00 0.00 N ATOM 1724 CA PHE A 111 3.675 1.564 4.764 1.00 0.00 C ATOM 1725 C PHE A 111 2.783 2.557 4.042 1.00 0.00 C ATOM 1726 O PHE A 111 1.686 2.851 4.516 1.00 0.00 O ATOM 1727 CB PHE A 111 4.218 0.441 3.875 1.00 0.00 C ATOM 1728 CG PHE A 111 3.228 -0.209 2.923 1.00 0.00 C ATOM 1729 CD1 PHE A 111 2.064 -0.846 3.401 1.00 0.00 C ATOM 1730 CD2 PHE A 111 3.487 -0.191 1.540 1.00 0.00 C ATOM 1731 CE1 PHE A 111 1.169 -1.459 2.508 1.00 0.00 C ATOM 1732 CE2 PHE A 111 2.587 -0.795 0.649 1.00 0.00 C ATOM 1733 CZ PHE A 111 1.427 -1.428 1.127 1.00 0.00 C ATOM 0 H PHE A 111 1.972 0.840 5.695 1.00 0.00 H new ATOM 0 HA PHE A 111 4.569 2.095 5.090 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.044 0.841 3.287 1.00 0.00 H new ATOM 0 HB3 PHE A 111 4.631 -0.335 4.520 1.00 0.00 H new ATOM 0 HD1 PHE A 111 1.859 -0.863 4.461 1.00 0.00 H new ATOM 0 HD2 PHE A 111 4.379 0.288 1.164 1.00 0.00 H new ATOM 0 HE1 PHE A 111 0.285 -1.953 2.882 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.787 -0.773 -0.412 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.737 -1.889 0.436 1.00 0.00 H new ATOM 1743 N ALA A 112 3.304 3.196 3.001 1.00 0.00 N ATOM 1744 CA ALA A 112 2.601 4.231 2.269 1.00 0.00 C ATOM 1745 C ALA A 112 2.110 3.680 0.936 1.00 0.00 C ATOM 1746 O ALA A 112 0.905 3.669 0.697 1.00 0.00 O ATOM 1747 CB ALA A 112 3.530 5.431 2.144 1.00 0.00 C ATOM 0 H ALA A 112 4.239 3.004 2.641 1.00 0.00 H new ATOM 0 HA ALA A 112 1.705 4.564 2.793 1.00 0.00 H new ATOM 0 HB1 ALA A 112 3.025 6.227 1.596 1.00 0.00 H new ATOM 0 HB2 ALA A 112 3.798 5.789 3.138 1.00 0.00 H new ATOM 0 HB3 ALA A 112 4.433 5.138 1.608 1.00 0.00 H new ATOM 1753 N LYS A 113 3.031 3.261 0.067 1.00 0.00 N ATOM 1754 CA LYS A 113 2.808 2.617 -1.227 1.00 0.00 C ATOM 1755 C LYS A 113 4.068 1.823 -1.549 1.00 0.00 C ATOM 1756 O LYS A 113 5.061 1.882 -0.820 1.00 0.00 O ATOM 1757 CB LYS A 113 2.504 3.612 -2.370 1.00 0.00 C ATOM 1758 CG LYS A 113 1.047 4.092 -2.424 1.00 0.00 C ATOM 1759 CD LYS A 113 0.880 5.530 -1.930 1.00 0.00 C ATOM 1760 CE LYS A 113 -0.601 5.903 -2.014 1.00 0.00 C ATOM 1761 NZ LYS A 113 -0.986 6.848 -0.949 1.00 0.00 N ATOM 0 H LYS A 113 4.026 3.371 0.265 1.00 0.00 H new ATOM 0 HA LYS A 113 1.925 1.982 -1.152 1.00 0.00 H new ATOM 0 HB2 LYS A 113 3.155 4.479 -2.263 1.00 0.00 H new ATOM 0 HB3 LYS A 113 2.754 3.141 -3.321 1.00 0.00 H new ATOM 0 HG2 LYS A 113 0.683 4.020 -3.449 1.00 0.00 H new ATOM 0 HG3 LYS A 113 0.428 3.430 -1.818 1.00 0.00 H new ATOM 0 HD2 LYS A 113 1.236 5.622 -0.904 1.00 0.00 H new ATOM 0 HD3 LYS A 113 1.477 6.211 -2.537 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -0.810 6.347 -2.987 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -1.208 5.001 -1.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -1.962 7.170 -1.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -0.922 6.375 -0.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -0.345 7.667 -0.963 1.00 0.00 H new ATOM 1775 N GLU A 114 4.034 1.091 -2.650 1.00 0.00 N ATOM 1776 CA GLU A 114 5.144 0.325 -3.172 1.00 0.00 C ATOM 1777 C GLU A 114 5.566 0.837 -4.547 1.00 0.00 C ATOM 1778 O GLU A 114 4.874 1.665 -5.145 1.00 0.00 O ATOM 1779 CB GLU A 114 4.781 -1.162 -3.172 1.00 0.00 C ATOM 1780 CG GLU A 114 3.462 -1.495 -3.885 1.00 0.00 C ATOM 1781 CD GLU A 114 2.275 -1.493 -2.920 1.00 0.00 C ATOM 1782 OE1 GLU A 114 1.657 -0.433 -2.686 1.00 0.00 O ATOM 1783 OE2 GLU A 114 1.939 -2.592 -2.414 1.00 0.00 O ATOM 0 H GLU A 114 3.195 1.014 -3.225 1.00 0.00 H new ATOM 0 HA GLU A 114 6.014 0.452 -2.527 1.00 0.00 H new ATOM 0 HB2 GLU A 114 5.588 -1.720 -3.648 1.00 0.00 H new ATOM 0 HB3 GLU A 114 4.719 -1.508 -2.140 1.00 0.00 H new ATOM 0 HG2 GLU A 114 3.285 -0.769 -4.679 1.00 0.00 H new ATOM 0 HG3 GLU A 114 3.543 -2.473 -4.359 1.00 0.00 H new ATOM 1790 N PHE A 115 6.696 0.351 -5.061 1.00 0.00 N ATOM 1791 CA PHE A 115 7.266 0.795 -6.325 1.00 0.00 C ATOM 1792 C PHE A 115 7.826 -0.478 -6.984 1.00 0.00 C ATOM 1793 O PHE A 115 8.228 -1.410 -6.275 1.00 0.00 O ATOM 1794 CB PHE A 115 8.392 1.805 -6.004 1.00 0.00 C ATOM 1795 CG PHE A 115 8.784 2.785 -7.097 1.00 0.00 C ATOM 1796 CD1 PHE A 115 9.285 2.385 -8.346 1.00 0.00 C ATOM 1797 CD2 PHE A 115 8.636 4.161 -6.834 1.00 0.00 C ATOM 1798 CE1 PHE A 115 9.646 3.339 -9.313 1.00 0.00 C ATOM 1799 CE2 PHE A 115 9.005 5.119 -7.789 1.00 0.00 C ATOM 1800 CZ PHE A 115 9.510 4.706 -9.032 1.00 0.00 C ATOM 0 H PHE A 115 7.247 -0.374 -4.600 1.00 0.00 H new ATOM 0 HA PHE A 115 6.551 1.284 -6.986 1.00 0.00 H new ATOM 0 HB2 PHE A 115 8.090 2.380 -5.129 1.00 0.00 H new ATOM 0 HB3 PHE A 115 9.281 1.240 -5.723 1.00 0.00 H new ATOM 0 HD1 PHE A 115 9.394 1.333 -8.566 1.00 0.00 H new ATOM 0 HD2 PHE A 115 8.233 4.482 -5.885 1.00 0.00 H new ATOM 0 HE1 PHE A 115 10.028 3.019 -10.271 1.00 0.00 H new ATOM 0 HE2 PHE A 115 8.901 6.171 -7.569 1.00 0.00 H new ATOM 0 HZ PHE A 115 9.794 5.441 -9.771 1.00 0.00 H new ATOM 1810 N VAL A 116 7.865 -0.544 -8.314 1.00 0.00 N ATOM 1811 CA VAL A 116 8.452 -1.645 -9.074 1.00 0.00 C ATOM 1812 C VAL A 116 9.488 -1.004 -9.990 1.00 0.00 C ATOM 1813 O VAL A 116 9.186 -0.009 -10.650 1.00 0.00 O ATOM 1814 CB VAL A 116 7.389 -2.442 -9.856 1.00 0.00 C ATOM 1815 CG1 VAL A 116 8.027 -3.590 -10.652 1.00 0.00 C ATOM 1816 CG2 VAL A 116 6.357 -3.055 -8.901 1.00 0.00 C ATOM 0 H VAL A 116 7.478 0.188 -8.909 1.00 0.00 H new ATOM 0 HA VAL A 116 8.913 -2.381 -8.415 1.00 0.00 H new ATOM 0 HB VAL A 116 6.908 -1.740 -10.537 1.00 0.00 H new ATOM 0 HG11 VAL A 116 7.252 -4.133 -11.192 1.00 0.00 H new ATOM 0 HG12 VAL A 116 8.748 -3.184 -11.362 1.00 0.00 H new ATOM 0 HG13 VAL A 116 8.535 -4.269 -9.967 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.617 -3.613 -9.475 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.859 -3.728 -8.206 1.00 0.00 H new ATOM 0 HG23 VAL A 116 5.861 -2.261 -8.343 1.00 0.00 H new ATOM 1826 N ILE A 117 10.707 -1.535 -9.964 1.00 0.00 N ATOM 1827 CA ILE A 117 11.850 -1.061 -10.721 1.00 0.00 C ATOM 1828 C ILE A 117 12.444 -2.269 -11.446 1.00 0.00 C ATOM 1829 O ILE A 117 12.521 -3.348 -10.853 1.00 0.00 O ATOM 1830 CB ILE A 117 12.854 -0.397 -9.760 1.00 0.00 C ATOM 1831 CG1 ILE A 117 12.295 0.921 -9.184 1.00 0.00 C ATOM 1832 CG2 ILE A 117 14.156 -0.075 -10.494 1.00 0.00 C ATOM 1833 CD1 ILE A 117 12.098 0.897 -7.665 1.00 0.00 C ATOM 0 H ILE A 117 10.930 -2.345 -9.386 1.00 0.00 H new ATOM 0 HA ILE A 117 11.573 -0.308 -11.459 1.00 0.00 H new ATOM 0 HB ILE A 117 13.035 -1.101 -8.948 1.00 0.00 H new ATOM 0 HG12 ILE A 117 12.973 1.735 -9.440 1.00 0.00 H new ATOM 0 HG13 ILE A 117 11.340 1.139 -9.662 1.00 0.00 H new ATOM 0 HG21 ILE A 117 14.857 0.394 -9.803 1.00 0.00 H new ATOM 0 HG22 ILE A 117 14.591 -0.995 -10.883 1.00 0.00 H new ATOM 0 HG23 ILE A 117 13.949 0.606 -11.319 1.00 0.00 H new ATOM 0 HD11 ILE A 117 11.703 1.857 -7.334 1.00 0.00 H new ATOM 0 HD12 ILE A 117 11.396 0.106 -7.402 1.00 0.00 H new ATOM 0 HD13 ILE A 117 13.055 0.711 -7.177 1.00 0.00 H new ATOM 1845 N SER A 118 12.914 -2.090 -12.682 1.00 0.00 N ATOM 1846 CA SER A 118 13.585 -3.142 -13.452 1.00 0.00 C ATOM 1847 C SER A 118 14.856 -2.668 -14.160 1.00 0.00 C ATOM 1848 O SER A 118 15.551 -3.471 -14.786 1.00 0.00 O ATOM 1849 CB SER A 118 12.604 -3.749 -14.456 1.00 0.00 C ATOM 1850 OG SER A 118 12.035 -2.780 -15.321 1.00 0.00 O ATOM 0 H SER A 118 12.840 -1.204 -13.182 1.00 0.00 H new ATOM 0 HA SER A 118 13.908 -3.900 -12.738 1.00 0.00 H new ATOM 0 HB2 SER A 118 13.120 -4.503 -15.051 1.00 0.00 H new ATOM 0 HB3 SER A 118 11.807 -4.260 -13.915 1.00 0.00 H new ATOM 0 HG SER A 118 12.201 -3.035 -16.252 1.00 0.00 H new ATOM 1856 N ASP A 119 15.172 -1.379 -14.063 1.00 0.00 N ATOM 1857 CA ASP A 119 16.284 -0.718 -14.725 1.00 0.00 C ATOM 1858 C ASP A 119 17.066 0.109 -13.711 1.00 0.00 C ATOM 1859 O ASP A 119 16.501 0.615 -12.740 1.00 0.00 O ATOM 1860 CB ASP A 119 15.721 0.155 -15.847 1.00 0.00 C ATOM 1861 CG ASP A 119 16.704 1.248 -16.238 1.00 0.00 C ATOM 1862 OD1 ASP A 119 17.843 0.965 -16.668 1.00 0.00 O ATOM 1863 OD2 ASP A 119 16.371 2.425 -15.993 1.00 0.00 O ATOM 0 H ASP A 119 14.627 -0.736 -13.488 1.00 0.00 H new ATOM 0 HA ASP A 119 16.971 -1.447 -15.154 1.00 0.00 H new ATOM 0 HB2 ASP A 119 15.497 -0.464 -16.716 1.00 0.00 H new ATOM 0 HB3 ASP A 119 14.782 0.605 -15.525 1.00 0.00 H new ATOM 1868 N ARG A 120 18.373 0.262 -13.932 1.00 0.00 N ATOM 1869 CA ARG A 120 19.243 0.962 -12.999 1.00 0.00 C ATOM 1870 C ARG A 120 18.939 2.464 -12.981 1.00 0.00 C ATOM 1871 O ARG A 120 19.163 3.099 -11.949 1.00 0.00 O ATOM 1872 CB ARG A 120 20.710 0.697 -13.368 1.00 0.00 C ATOM 1873 CG ARG A 120 21.654 0.942 -12.186 1.00 0.00 C ATOM 1874 CD ARG A 120 23.002 1.487 -12.663 1.00 0.00 C ATOM 1875 NE ARG A 120 22.918 2.917 -13.028 1.00 0.00 N ATOM 1876 CZ ARG A 120 22.744 3.932 -12.167 1.00 0.00 C ATOM 1877 NH1 ARG A 120 22.791 3.739 -10.857 1.00 0.00 N ATOM 1878 NH2 ARG A 120 22.504 5.163 -12.599 1.00 0.00 N ATOM 0 H ARG A 120 18.851 -0.095 -14.759 1.00 0.00 H new ATOM 0 HA ARG A 120 19.059 0.584 -11.993 1.00 0.00 H new ATOM 0 HB2 ARG A 120 20.817 -0.332 -13.710 1.00 0.00 H new ATOM 0 HB3 ARG A 120 20.996 1.341 -14.200 1.00 0.00 H new ATOM 0 HG2 ARG A 120 21.198 1.648 -11.492 1.00 0.00 H new ATOM 0 HG3 ARG A 120 21.807 0.011 -11.640 1.00 0.00 H new ATOM 0 HD2 ARG A 120 23.746 1.356 -11.877 1.00 0.00 H new ATOM 0 HD3 ARG A 120 23.343 0.912 -13.524 1.00 0.00 H new ATOM 0 HE ARG A 120 22.999 3.152 -14.017 1.00 0.00 H new ATOM 0 HH11 ARG A 120 22.962 2.805 -10.485 1.00 0.00 H new ATOM 0 HH12 ARG A 120 22.656 4.525 -10.221 1.00 0.00 H new ATOM 0 HH21 ARG A 120 22.449 5.351 -13.600 1.00 0.00 H new ATOM 0 HH22 ARG A 120 22.374 5.922 -11.930 1.00 0.00 H new ATOM 1892 N LYS A 121 18.484 3.074 -14.085 1.00 0.00 N ATOM 1893 CA LYS A 121 18.104 4.477 -14.072 1.00 0.00 C ATOM 1894 C LYS A 121 16.780 4.628 -13.333 1.00 0.00 C ATOM 1895 O LYS A 121 16.629 5.595 -12.597 1.00 0.00 O ATOM 1896 CB LYS A 121 18.027 5.127 -15.457 1.00 0.00 C ATOM 1897 CG LYS A 121 19.310 5.005 -16.284 1.00 0.00 C ATOM 1898 CD LYS A 121 19.179 5.639 -17.678 1.00 0.00 C ATOM 1899 CE LYS A 121 18.898 7.153 -17.685 1.00 0.00 C ATOM 1900 NZ LYS A 121 17.461 7.493 -17.596 1.00 0.00 N ATOM 0 H LYS A 121 18.374 2.614 -14.988 1.00 0.00 H new ATOM 0 HA LYS A 121 18.900 5.012 -13.554 1.00 0.00 H new ATOM 0 HB2 LYS A 121 17.206 4.674 -16.013 1.00 0.00 H new ATOM 0 HB3 LYS A 121 17.786 6.183 -15.337 1.00 0.00 H new ATOM 0 HG2 LYS A 121 20.130 5.483 -15.748 1.00 0.00 H new ATOM 0 HG3 LYS A 121 19.570 3.952 -16.391 1.00 0.00 H new ATOM 0 HD2 LYS A 121 20.099 5.454 -18.232 1.00 0.00 H new ATOM 0 HD3 LYS A 121 18.376 5.134 -18.215 1.00 0.00 H new ATOM 0 HE2 LYS A 121 19.424 7.615 -16.849 1.00 0.00 H new ATOM 0 HE3 LYS A 121 19.308 7.585 -18.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 17.240 8.247 -18.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 16.891 6.651 -17.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 17.241 7.820 -16.634 1.00 0.00 H new ATOM 1914 N GLU A 122 15.840 3.700 -13.514 1.00 0.00 N ATOM 1915 CA GLU A 122 14.565 3.673 -12.798 1.00 0.00 C ATOM 1916 C GLU A 122 14.802 3.464 -11.288 1.00 0.00 C ATOM 1917 O GLU A 122 13.975 3.832 -10.464 1.00 0.00 O ATOM 1918 CB GLU A 122 13.623 2.627 -13.419 1.00 0.00 C ATOM 1919 CG GLU A 122 12.219 2.656 -12.783 1.00 0.00 C ATOM 1920 CD GLU A 122 11.240 1.664 -13.404 1.00 0.00 C ATOM 1921 OE1 GLU A 122 11.628 0.502 -13.670 1.00 0.00 O ATOM 1922 OE2 GLU A 122 10.058 2.039 -13.602 1.00 0.00 O ATOM 0 H GLU A 122 15.946 2.931 -14.176 1.00 0.00 H new ATOM 0 HA GLU A 122 14.066 4.636 -12.901 1.00 0.00 H new ATOM 0 HB2 GLU A 122 13.538 2.808 -14.491 1.00 0.00 H new ATOM 0 HB3 GLU A 122 14.055 1.634 -13.297 1.00 0.00 H new ATOM 0 HG2 GLU A 122 12.309 2.445 -11.717 1.00 0.00 H new ATOM 0 HG3 GLU A 122 11.810 3.662 -12.875 1.00 0.00 H new ATOM 1929 N LEU A 123 15.936 2.878 -10.901 1.00 0.00 N ATOM 1930 CA LEU A 123 16.334 2.684 -9.511 1.00 0.00 C ATOM 1931 C LEU A 123 16.746 3.998 -8.826 1.00 0.00 C ATOM 1932 O LEU A 123 16.773 4.056 -7.603 1.00 0.00 O ATOM 1933 CB LEU A 123 17.399 1.565 -9.465 1.00 0.00 C ATOM 1934 CG LEU A 123 17.657 0.807 -8.151 1.00 0.00 C ATOM 1935 CD1 LEU A 123 18.735 1.440 -7.276 1.00 0.00 C ATOM 1936 CD2 LEU A 123 16.390 0.480 -7.352 1.00 0.00 C ATOM 0 H LEU A 123 16.620 2.516 -11.566 1.00 0.00 H new ATOM 0 HA LEU A 123 15.482 2.356 -8.916 1.00 0.00 H new ATOM 0 HB2 LEU A 123 17.126 0.826 -10.218 1.00 0.00 H new ATOM 0 HB3 LEU A 123 18.346 2.005 -9.778 1.00 0.00 H new ATOM 0 HG LEU A 123 18.054 -0.152 -8.483 1.00 0.00 H new ATOM 0 HD11 LEU A 123 18.860 0.850 -6.368 1.00 0.00 H new ATOM 0 HD12 LEU A 123 19.677 1.468 -7.823 1.00 0.00 H new ATOM 0 HD13 LEU A 123 18.439 2.455 -7.011 1.00 0.00 H new ATOM 0 HD21 LEU A 123 16.662 -0.054 -6.441 1.00 0.00 H new ATOM 0 HD22 LEU A 123 15.876 1.405 -7.091 1.00 0.00 H new ATOM 0 HD23 LEU A 123 15.730 -0.144 -7.955 1.00 0.00 H new ATOM 1948 N GLU A 124 17.142 5.031 -9.575 1.00 0.00 N ATOM 1949 CA GLU A 124 17.634 6.296 -9.030 1.00 0.00 C ATOM 1950 C GLU A 124 16.614 7.054 -8.163 1.00 0.00 C ATOM 1951 O GLU A 124 15.572 7.501 -8.648 1.00 0.00 O ATOM 1952 CB GLU A 124 18.023 7.220 -10.195 1.00 0.00 C ATOM 1953 CG GLU A 124 19.265 6.766 -10.976 1.00 0.00 C ATOM 1954 CD GLU A 124 20.547 6.969 -10.175 1.00 0.00 C ATOM 1955 OE1 GLU A 124 20.682 8.026 -9.521 1.00 0.00 O ATOM 1956 OE2 GLU A 124 21.402 6.052 -10.209 1.00 0.00 O ATOM 0 H GLU A 124 17.129 5.010 -10.595 1.00 0.00 H new ATOM 0 HA GLU A 124 18.477 6.037 -8.389 1.00 0.00 H new ATOM 0 HB2 GLU A 124 17.181 7.291 -10.884 1.00 0.00 H new ATOM 0 HB3 GLU A 124 18.200 8.222 -9.805 1.00 0.00 H new ATOM 0 HG2 GLU A 124 19.164 5.713 -11.238 1.00 0.00 H new ATOM 0 HG3 GLU A 124 19.329 7.323 -11.911 1.00 0.00 H new ATOM 1963 N GLU A 125 16.991 7.358 -6.915 1.00 0.00 N ATOM 1964 CA GLU A 125 16.187 8.151 -5.981 1.00 0.00 C ATOM 1965 C GLU A 125 15.802 9.525 -6.525 1.00 0.00 C ATOM 1966 O GLU A 125 14.752 10.078 -6.192 1.00 0.00 O ATOM 1967 CB GLU A 125 16.968 8.415 -4.685 1.00 0.00 C ATOM 1968 CG GLU A 125 16.945 7.271 -3.673 1.00 0.00 C ATOM 1969 CD GLU A 125 15.903 7.544 -2.587 1.00 0.00 C ATOM 1970 OE1 GLU A 125 16.209 8.352 -1.665 1.00 0.00 O ATOM 1971 OE2 GLU A 125 14.775 7.031 -2.711 1.00 0.00 O ATOM 0 H GLU A 125 17.881 7.053 -6.520 1.00 0.00 H new ATOM 0 HA GLU A 125 15.288 7.558 -5.814 1.00 0.00 H new ATOM 0 HB2 GLU A 125 18.005 8.633 -4.941 1.00 0.00 H new ATOM 0 HB3 GLU A 125 16.563 9.308 -4.210 1.00 0.00 H new ATOM 0 HG2 GLU A 125 16.716 6.333 -4.179 1.00 0.00 H new ATOM 0 HG3 GLU A 125 17.930 7.157 -3.221 1.00 0.00 H new ATOM 1978 N ASP A 126 16.667 10.101 -7.355 1.00 0.00 N ATOM 1979 CA ASP A 126 16.491 11.439 -7.871 1.00 0.00 C ATOM 1980 C ASP A 126 15.168 11.679 -8.588 1.00 0.00 C ATOM 1981 O ASP A 126 14.555 12.725 -8.344 1.00 0.00 O ATOM 1982 CB ASP A 126 17.676 11.830 -8.748 1.00 0.00 C ATOM 1983 CG ASP A 126 17.530 13.292 -9.142 1.00 0.00 C ATOM 1984 OD1 ASP A 126 17.643 14.146 -8.232 1.00 0.00 O ATOM 1985 OD2 ASP A 126 17.209 13.555 -10.325 1.00 0.00 O ATOM 0 H ASP A 126 17.515 9.641 -7.686 1.00 0.00 H new ATOM 0 HA ASP A 126 16.452 12.089 -6.997 1.00 0.00 H new ATOM 0 HB2 ASP A 126 18.611 11.675 -8.210 1.00 0.00 H new ATOM 0 HB3 ASP A 126 17.712 11.201 -9.637 1.00 0.00 H new ATOM 1990 N PHE A 127 14.697 10.761 -9.441 1.00 0.00 N ATOM 1991 CA PHE A 127 13.386 10.969 -10.058 1.00 0.00 C ATOM 1992 C PHE A 127 12.316 10.240 -9.241 1.00 0.00 C ATOM 1993 O PHE A 127 11.169 10.689 -9.244 1.00 0.00 O ATOM 1994 CB PHE A 127 13.328 10.529 -11.523 1.00 0.00 C ATOM 1995 CG PHE A 127 13.110 9.052 -11.672 1.00 0.00 C ATOM 1996 CD1 PHE A 127 14.150 8.147 -11.416 1.00 0.00 C ATOM 1997 CD2 PHE A 127 11.787 8.598 -11.837 1.00 0.00 C ATOM 1998 CE1 PHE A 127 13.849 6.786 -11.319 1.00 0.00 C ATOM 1999 CE2 PHE A 127 11.494 7.233 -11.746 1.00 0.00 C ATOM 2000 CZ PHE A 127 12.527 6.327 -11.482 1.00 0.00 C ATOM 0 H PHE A 127 15.180 9.904 -9.710 1.00 0.00 H new ATOM 0 HA PHE A 127 13.198 12.043 -10.056 1.00 0.00 H new ATOM 0 HB2 PHE A 127 12.524 11.064 -12.028 1.00 0.00 H new ATOM 0 HB3 PHE A 127 14.257 10.808 -12.020 1.00 0.00 H new ATOM 0 HD1 PHE A 127 15.165 8.496 -11.296 1.00 0.00 H new ATOM 0 HD2 PHE A 127 10.996 9.306 -12.034 1.00 0.00 H new ATOM 0 HE1 PHE A 127 14.639 6.078 -11.117 1.00 0.00 H new ATOM 0 HE2 PHE A 127 10.481 6.882 -11.878 1.00 0.00 H new ATOM 0 HZ PHE A 127 12.310 5.272 -11.403 1.00 0.00 H new ATOM 2010 N ILE A 128 12.688 9.175 -8.513 1.00 0.00 N ATOM 2011 CA ILE A 128 11.804 8.425 -7.617 1.00 0.00 C ATOM 2012 C ILE A 128 11.132 9.421 -6.675 1.00 0.00 C ATOM 2013 O ILE A 128 9.936 9.300 -6.432 1.00 0.00 O ATOM 2014 CB ILE A 128 12.570 7.303 -6.876 1.00 0.00 C ATOM 2015 CG1 ILE A 128 12.736 6.074 -7.794 1.00 0.00 C ATOM 2016 CG2 ILE A 128 11.933 6.896 -5.531 1.00 0.00 C ATOM 2017 CD1 ILE A 128 13.508 4.909 -7.163 1.00 0.00 C ATOM 0 H ILE A 128 13.638 8.805 -8.535 1.00 0.00 H new ATOM 0 HA ILE A 128 11.031 7.909 -8.186 1.00 0.00 H new ATOM 0 HB ILE A 128 13.549 7.713 -6.629 1.00 0.00 H new ATOM 0 HG12 ILE A 128 11.748 5.721 -8.090 1.00 0.00 H new ATOM 0 HG13 ILE A 128 13.250 6.383 -8.704 1.00 0.00 H new ATOM 0 HG21 ILE A 128 12.526 6.105 -5.072 1.00 0.00 H new ATOM 0 HG22 ILE A 128 11.903 7.760 -4.867 1.00 0.00 H new ATOM 0 HG23 ILE A 128 10.919 6.535 -5.703 1.00 0.00 H new ATOM 0 HD11 ILE A 128 13.577 4.089 -7.878 1.00 0.00 H new ATOM 0 HD12 ILE A 128 14.511 5.241 -6.893 1.00 0.00 H new ATOM 0 HD13 ILE A 128 12.986 4.568 -6.269 1.00 0.00 H new ATOM 2029 N LYS A 129 11.856 10.438 -6.189 1.00 0.00 N ATOM 2030 CA LYS A 129 11.277 11.490 -5.359 1.00 0.00 C ATOM 2031 C LYS A 129 10.042 12.084 -6.028 1.00 0.00 C ATOM 2032 O LYS A 129 8.997 12.173 -5.392 1.00 0.00 O ATOM 2033 CB LYS A 129 12.335 12.584 -5.107 1.00 0.00 C ATOM 2034 CG LYS A 129 13.353 12.250 -4.005 1.00 0.00 C ATOM 2035 CD LYS A 129 14.530 13.241 -3.991 1.00 0.00 C ATOM 2036 CE LYS A 129 15.881 12.513 -4.024 1.00 0.00 C ATOM 2037 NZ LYS A 129 17.012 13.465 -4.068 1.00 0.00 N ATOM 0 H LYS A 129 12.855 10.550 -6.362 1.00 0.00 H new ATOM 0 HA LYS A 129 10.969 11.063 -4.405 1.00 0.00 H new ATOM 0 HB2 LYS A 129 12.874 12.771 -6.036 1.00 0.00 H new ATOM 0 HB3 LYS A 129 11.825 13.510 -4.843 1.00 0.00 H new ATOM 0 HG2 LYS A 129 12.856 12.264 -3.035 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.732 11.239 -4.155 1.00 0.00 H new ATOM 0 HD2 LYS A 129 14.455 13.909 -4.849 1.00 0.00 H new ATOM 0 HD3 LYS A 129 14.473 13.863 -3.097 1.00 0.00 H new ATOM 0 HE2 LYS A 129 15.974 11.877 -3.143 1.00 0.00 H new ATOM 0 HE3 LYS A 129 15.921 11.859 -4.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 17.908 12.938 -4.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 16.936 14.055 -4.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 16.988 14.072 -3.224 1.00 0.00 H new ATOM 2051 N SER A 130 10.147 12.512 -7.284 1.00 0.00 N ATOM 2052 CA SER A 130 9.039 13.110 -8.010 1.00 0.00 C ATOM 2053 C SER A 130 7.953 12.064 -8.294 1.00 0.00 C ATOM 2054 O SER A 130 6.771 12.352 -8.124 1.00 0.00 O ATOM 2055 CB SER A 130 9.576 13.783 -9.273 1.00 0.00 C ATOM 2056 OG SER A 130 8.684 14.760 -9.764 1.00 0.00 O ATOM 0 H SER A 130 11.009 12.452 -7.826 1.00 0.00 H new ATOM 0 HA SER A 130 8.560 13.881 -7.406 1.00 0.00 H new ATOM 0 HB2 SER A 130 10.539 14.245 -9.057 1.00 0.00 H new ATOM 0 HB3 SER A 130 9.749 13.029 -10.041 1.00 0.00 H new ATOM 0 HG SER A 130 9.060 15.171 -10.570 1.00 0.00 H new ATOM 2062 N GLU A 131 8.321 10.837 -8.660 1.00 0.00 N ATOM 2063 CA GLU A 131 7.374 9.757 -8.927 1.00 0.00 C ATOM 2064 C GLU A 131 6.543 9.420 -7.674 1.00 0.00 C ATOM 2065 O GLU A 131 5.332 9.202 -7.766 1.00 0.00 O ATOM 2066 CB GLU A 131 8.167 8.565 -9.489 1.00 0.00 C ATOM 2067 CG GLU A 131 7.347 7.307 -9.805 1.00 0.00 C ATOM 2068 CD GLU A 131 6.169 7.501 -10.754 1.00 0.00 C ATOM 2069 OE1 GLU A 131 6.082 8.522 -11.468 1.00 0.00 O ATOM 2070 OE2 GLU A 131 5.299 6.599 -10.804 1.00 0.00 O ATOM 0 H GLU A 131 9.296 10.563 -8.781 1.00 0.00 H new ATOM 0 HA GLU A 131 6.637 10.057 -9.671 1.00 0.00 H new ATOM 0 HB2 GLU A 131 8.671 8.886 -10.401 1.00 0.00 H new ATOM 0 HB3 GLU A 131 8.944 8.299 -8.772 1.00 0.00 H new ATOM 0 HG2 GLU A 131 8.015 6.560 -10.234 1.00 0.00 H new ATOM 0 HG3 GLU A 131 6.970 6.898 -8.868 1.00 0.00 H new ATOM 2077 N LEU A 132 7.163 9.430 -6.492 1.00 0.00 N ATOM 2078 CA LEU A 132 6.507 9.213 -5.206 1.00 0.00 C ATOM 2079 C LEU A 132 5.673 10.433 -4.824 1.00 0.00 C ATOM 2080 O LEU A 132 4.560 10.279 -4.316 1.00 0.00 O ATOM 2081 CB LEU A 132 7.549 8.889 -4.123 1.00 0.00 C ATOM 2082 CG LEU A 132 8.109 7.456 -4.249 1.00 0.00 C ATOM 2083 CD1 LEU A 132 9.245 7.269 -3.244 1.00 0.00 C ATOM 2084 CD2 LEU A 132 7.041 6.380 -3.997 1.00 0.00 C ATOM 0 H LEU A 132 8.166 9.595 -6.403 1.00 0.00 H new ATOM 0 HA LEU A 132 5.835 8.359 -5.291 1.00 0.00 H new ATOM 0 HB2 LEU A 132 8.370 9.603 -4.188 1.00 0.00 H new ATOM 0 HB3 LEU A 132 7.096 9.013 -3.139 1.00 0.00 H new ATOM 0 HG LEU A 132 8.465 7.336 -5.272 1.00 0.00 H new ATOM 0 HD11 LEU A 132 9.644 6.258 -3.329 1.00 0.00 H new ATOM 0 HD12 LEU A 132 10.036 7.990 -3.451 1.00 0.00 H new ATOM 0 HD13 LEU A 132 8.867 7.426 -2.234 1.00 0.00 H new ATOM 0 HD21 LEU A 132 7.489 5.392 -4.098 1.00 0.00 H new ATOM 0 HD22 LEU A 132 6.639 6.495 -2.990 1.00 0.00 H new ATOM 0 HD23 LEU A 132 6.236 6.489 -4.723 1.00 0.00 H new ATOM 2096 N LYS A 133 6.181 11.648 -5.067 1.00 0.00 N ATOM 2097 CA LYS A 133 5.444 12.892 -4.837 1.00 0.00 C ATOM 2098 C LYS A 133 4.147 12.828 -5.643 1.00 0.00 C ATOM 2099 O LYS A 133 3.083 13.145 -5.102 1.00 0.00 O ATOM 2100 CB LYS A 133 6.311 14.103 -5.227 1.00 0.00 C ATOM 2101 CG LYS A 133 7.330 14.490 -4.139 1.00 0.00 C ATOM 2102 CD LYS A 133 8.368 15.474 -4.696 1.00 0.00 C ATOM 2103 CE LYS A 133 9.647 15.559 -3.856 1.00 0.00 C ATOM 2104 NZ LYS A 133 9.483 16.285 -2.583 1.00 0.00 N ATOM 0 H LYS A 133 7.122 11.794 -5.432 1.00 0.00 H new ATOM 0 HA LYS A 133 5.199 13.010 -3.782 1.00 0.00 H new ATOM 0 HB2 LYS A 133 6.843 13.879 -6.152 1.00 0.00 H new ATOM 0 HB3 LYS A 133 5.663 14.956 -5.430 1.00 0.00 H new ATOM 0 HG2 LYS A 133 6.812 14.940 -3.292 1.00 0.00 H new ATOM 0 HG3 LYS A 133 7.831 13.596 -3.768 1.00 0.00 H new ATOM 0 HD2 LYS A 133 8.630 15.177 -5.712 1.00 0.00 H new ATOM 0 HD3 LYS A 133 7.919 16.465 -4.760 1.00 0.00 H new ATOM 0 HE2 LYS A 133 9.997 14.549 -3.644 1.00 0.00 H new ATOM 0 HE3 LYS A 133 10.423 16.049 -4.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 10.389 16.300 -2.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 9.178 17.260 -2.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 8.766 15.807 -2.001 1.00 0.00 H new ATOM 2118 N LYS A 134 4.205 12.387 -6.903 1.00 0.00 N ATOM 2119 CA LYS A 134 3.039 12.185 -7.760 1.00 0.00 C ATOM 2120 C LYS A 134 2.131 11.125 -7.133 1.00 0.00 C ATOM 2121 O LYS A 134 0.937 11.387 -6.977 1.00 0.00 O ATOM 2122 CB LYS A 134 3.483 11.796 -9.184 1.00 0.00 C ATOM 2123 CG LYS A 134 4.137 12.969 -9.935 1.00 0.00 C ATOM 2124 CD LYS A 134 4.932 12.496 -11.157 1.00 0.00 C ATOM 2125 CE LYS A 134 5.523 13.706 -11.894 1.00 0.00 C ATOM 2126 NZ LYS A 134 6.349 13.296 -13.046 1.00 0.00 N ATOM 0 H LYS A 134 5.085 12.156 -7.364 1.00 0.00 H new ATOM 0 HA LYS A 134 2.473 13.113 -7.843 1.00 0.00 H new ATOM 0 HB2 LYS A 134 4.187 10.966 -9.128 1.00 0.00 H new ATOM 0 HB3 LYS A 134 2.619 11.444 -9.748 1.00 0.00 H new ATOM 0 HG2 LYS A 134 3.366 13.671 -10.253 1.00 0.00 H new ATOM 0 HG3 LYS A 134 4.799 13.509 -9.258 1.00 0.00 H new ATOM 0 HD2 LYS A 134 5.731 11.823 -10.844 1.00 0.00 H new ATOM 0 HD3 LYS A 134 4.284 11.931 -11.827 1.00 0.00 H new ATOM 0 HE2 LYS A 134 4.715 14.352 -12.238 1.00 0.00 H new ATOM 0 HE3 LYS A 134 6.129 14.292 -11.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 6.730 14.141 -13.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 7.134 12.700 -12.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 5.765 12.758 -13.718 1.00 0.00 H new ATOM 2140 N ALA A 135 2.671 9.970 -6.726 1.00 0.00 N ATOM 2141 CA ALA A 135 1.902 8.862 -6.151 1.00 0.00 C ATOM 2142 C ALA A 135 1.162 9.228 -4.856 1.00 0.00 C ATOM 2143 O ALA A 135 0.196 8.564 -4.487 1.00 0.00 O ATOM 2144 CB ALA A 135 2.829 7.671 -5.876 1.00 0.00 C ATOM 0 H ALA A 135 3.671 9.777 -6.788 1.00 0.00 H new ATOM 0 HA ALA A 135 1.143 8.607 -6.890 1.00 0.00 H new ATOM 0 HB1 ALA A 135 2.251 6.851 -5.449 1.00 0.00 H new ATOM 0 HB2 ALA A 135 3.288 7.344 -6.809 1.00 0.00 H new ATOM 0 HB3 ALA A 135 3.608 7.970 -5.174 1.00 0.00 H new ATOM 2150 N GLY A 136 1.607 10.264 -4.139 1.00 0.00 N ATOM 2151 CA GLY A 136 0.992 10.690 -2.890 1.00 0.00 C ATOM 2152 C GLY A 136 -0.494 11.017 -3.044 1.00 0.00 C ATOM 2153 O GLY A 136 -1.309 10.568 -2.235 1.00 0.00 O ATOM 0 H GLY A 136 2.409 10.830 -4.415 1.00 0.00 H new ATOM 0 HA2 GLY A 136 1.111 9.904 -2.145 1.00 0.00 H new ATOM 0 HA3 GLY A 136 1.516 11.568 -2.513 1.00 0.00 H new ATOM 2157 N GLY A 137 -0.855 11.779 -4.079 1.00 0.00 N ATOM 2158 CA GLY A 137 -2.239 12.110 -4.377 1.00 0.00 C ATOM 2159 C GLY A 137 -2.915 10.891 -4.987 1.00 0.00 C ATOM 2160 O GLY A 137 -2.796 10.688 -6.193 1.00 0.00 O ATOM 0 H GLY A 137 -0.186 12.183 -4.735 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -2.758 12.414 -3.468 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -2.285 12.952 -5.067 1.00 0.00 H new ATOM 2164 N ALA A 138 -3.549 10.045 -4.173 1.00 0.00 N ATOM 2165 CA ALA A 138 -4.200 8.821 -4.625 1.00 0.00 C ATOM 2166 C ALA A 138 -5.256 8.368 -3.611 1.00 0.00 C ATOM 2167 O ALA A 138 -5.236 8.798 -2.453 1.00 0.00 O ATOM 2168 CB ALA A 138 -3.144 7.728 -4.839 1.00 0.00 C ATOM 0 H ALA A 138 -3.624 10.196 -3.167 1.00 0.00 H new ATOM 0 HA ALA A 138 -4.706 9.012 -5.571 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -3.631 6.813 -5.177 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -2.427 8.057 -5.591 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -2.623 7.537 -3.901 1.00 0.00 H new ATOM 2174 N ASN A 139 -6.144 7.459 -4.019 1.00 0.00 N ATOM 2175 CA ASN A 139 -7.188 6.869 -3.178 1.00 0.00 C ATOM 2176 C ASN A 139 -6.626 5.673 -2.403 1.00 0.00 C ATOM 2177 O ASN A 139 -6.592 4.567 -2.947 1.00 0.00 O ATOM 2178 CB ASN A 139 -8.367 6.447 -4.065 1.00 0.00 C ATOM 2179 CG ASN A 139 -9.522 5.843 -3.281 1.00 0.00 C ATOM 2180 OD1 ASN A 139 -9.509 5.763 -2.056 1.00 0.00 O ATOM 2181 ND2 ASN A 139 -10.537 5.367 -3.977 1.00 0.00 N ATOM 0 H ASN A 139 -6.157 7.102 -4.974 1.00 0.00 H new ATOM 0 HA ASN A 139 -7.538 7.603 -2.452 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -8.726 7.315 -4.617 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -8.018 5.723 -4.801 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -11.322 4.927 -3.498 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -10.536 5.439 -4.994 1.00 0.00 H new ATOM 2188 N TYR A 140 -6.157 5.897 -1.171 1.00 0.00 N ATOM 2189 CA TYR A 140 -5.514 4.932 -0.292 1.00 0.00 C ATOM 2190 C TYR A 140 -5.719 5.422 1.146 1.00 0.00 C ATOM 2191 O TYR A 140 -5.279 6.522 1.495 1.00 0.00 O ATOM 2192 CB TYR A 140 -4.007 4.825 -0.580 1.00 0.00 C ATOM 2193 CG TYR A 140 -3.603 4.012 -1.798 1.00 0.00 C ATOM 2194 CD1 TYR A 140 -3.536 4.617 -3.066 1.00 0.00 C ATOM 2195 CD2 TYR A 140 -3.246 2.658 -1.658 1.00 0.00 C ATOM 2196 CE1 TYR A 140 -3.123 3.882 -4.192 1.00 0.00 C ATOM 2197 CE2 TYR A 140 -2.835 1.915 -2.778 1.00 0.00 C ATOM 2198 CZ TYR A 140 -2.764 2.524 -4.050 1.00 0.00 C ATOM 2199 OH TYR A 140 -2.365 1.790 -5.126 1.00 0.00 O ATOM 0 H TYR A 140 -6.224 6.819 -0.739 1.00 0.00 H new ATOM 0 HA TYR A 140 -5.950 3.946 -0.450 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -3.610 5.833 -0.697 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -3.523 4.391 0.295 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -3.805 5.657 -3.176 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -3.288 2.188 -0.686 1.00 0.00 H new ATOM 0 HE1 TYR A 140 -3.081 4.355 -5.162 1.00 0.00 H new ATOM 0 HE2 TYR A 140 -2.572 0.874 -2.665 1.00 0.00 H new ATOM 0 HH TYR A 140 -2.156 0.876 -4.840 1.00 0.00 H new ATOM 2209 N ASP A 141 -6.441 4.645 1.946 1.00 0.00 N ATOM 2210 CA ASP A 141 -6.690 4.870 3.375 1.00 0.00 C ATOM 2211 C ASP A 141 -6.414 3.566 4.140 1.00 0.00 C ATOM 2212 O ASP A 141 -6.455 2.484 3.545 1.00 0.00 O ATOM 2213 CB ASP A 141 -8.139 5.348 3.568 1.00 0.00 C ATOM 2214 CG ASP A 141 -8.455 5.888 4.968 1.00 0.00 C ATOM 2215 OD1 ASP A 141 -7.593 5.884 5.871 1.00 0.00 O ATOM 2216 OD2 ASP A 141 -9.580 6.410 5.148 1.00 0.00 O ATOM 0 H ASP A 141 -6.893 3.797 1.603 1.00 0.00 H new ATOM 0 HA ASP A 141 -6.028 5.642 3.766 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -8.350 6.128 2.836 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -8.812 4.518 3.353 1.00 0.00 H new ATOM 2221 N ALA A 142 -6.140 3.625 5.444 1.00 0.00 N ATOM 2222 CA ALA A 142 -5.937 2.478 6.320 1.00 0.00 C ATOM 2223 C ALA A 142 -6.299 2.863 7.760 1.00 0.00 C ATOM 2224 O ALA A 142 -5.429 3.123 8.595 1.00 0.00 O ATOM 2225 CB ALA A 142 -4.502 1.941 6.199 1.00 0.00 C ATOM 0 H ALA A 142 -6.050 4.514 5.937 1.00 0.00 H new ATOM 0 HA ALA A 142 -6.596 1.665 6.014 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -4.376 1.085 6.863 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -4.314 1.633 5.170 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -3.796 2.723 6.478 1.00 0.00 H new ATOM 2231 N GLN A 143 -7.595 2.879 8.075 1.00 0.00 N ATOM 2232 CA GLN A 143 -8.179 3.132 9.397 1.00 0.00 C ATOM 2233 C GLN A 143 -7.929 1.970 10.382 1.00 0.00 C ATOM 2234 O GLN A 143 -8.812 1.600 11.155 1.00 0.00 O ATOM 2235 CB GLN A 143 -9.681 3.454 9.216 1.00 0.00 C ATOM 2236 CG GLN A 143 -9.916 4.914 8.802 1.00 0.00 C ATOM 2237 CD GLN A 143 -9.668 5.900 9.949 1.00 0.00 C ATOM 2238 OE1 GLN A 143 -9.651 5.540 11.128 1.00 0.00 O ATOM 2239 NE2 GLN A 143 -9.432 7.165 9.638 1.00 0.00 N ATOM 0 H GLN A 143 -8.312 2.705 7.370 1.00 0.00 H new ATOM 0 HA GLN A 143 -7.686 3.991 9.852 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -10.104 2.792 8.461 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -10.209 3.253 10.148 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -9.260 5.161 7.967 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -10.940 5.026 8.446 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -9.446 7.461 8.662 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -9.236 7.843 10.374 1.00 0.00 H new ATOM 2248 N THR A 144 -6.728 1.385 10.373 1.00 0.00 N ATOM 2249 CA THR A 144 -6.288 0.313 11.273 1.00 0.00 C ATOM 2250 C THR A 144 -7.120 -0.963 11.040 1.00 0.00 C ATOM 2251 O THR A 144 -7.208 -1.841 11.899 1.00 0.00 O ATOM 2252 CB THR A 144 -6.327 0.843 12.731 1.00 0.00 C ATOM 2253 OG1 THR A 144 -5.870 2.189 12.768 1.00 0.00 O ATOM 2254 CG2 THR A 144 -5.455 0.051 13.706 1.00 0.00 C ATOM 0 H THR A 144 -6.003 1.657 9.709 1.00 0.00 H new ATOM 0 HA THR A 144 -5.258 0.022 11.065 1.00 0.00 H new ATOM 0 HB THR A 144 -7.366 0.744 13.044 1.00 0.00 H new ATOM 0 HG1 THR A 144 -5.898 2.519 13.690 1.00 0.00 H new ATOM 0 HG21 THR A 144 -5.537 0.485 14.703 1.00 0.00 H new ATOM 0 HG22 THR A 144 -5.789 -0.986 13.733 1.00 0.00 H new ATOM 0 HG23 THR A 144 -4.416 0.089 13.379 1.00 0.00 H new ATOM 2262 N GLU A 145 -7.703 -1.094 9.848 1.00 0.00 N ATOM 2263 CA GLU A 145 -8.585 -2.182 9.464 1.00 0.00 C ATOM 2264 C GLU A 145 -7.747 -3.355 8.991 1.00 0.00 C ATOM 2265 O GLU A 145 -8.180 -4.512 9.196 1.00 0.00 O ATOM 2266 CB GLU A 145 -9.547 -1.702 8.363 1.00 0.00 C ATOM 2267 CG GLU A 145 -10.403 -0.506 8.810 1.00 0.00 C ATOM 2268 CD GLU A 145 -11.489 -0.163 7.787 1.00 0.00 C ATOM 2269 OE1 GLU A 145 -11.142 0.351 6.696 1.00 0.00 O ATOM 2270 OE2 GLU A 145 -12.681 -0.404 8.085 1.00 0.00 O ATOM 2271 OXT GLU A 145 -6.686 -3.102 8.372 1.00 0.00 O ATOM 0 H GLU A 145 -7.565 -0.416 9.099 1.00 0.00 H new ATOM 0 HA GLU A 145 -9.183 -2.504 10.317 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -8.973 -1.424 7.479 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -10.201 -2.524 8.072 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -10.868 -0.731 9.770 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -9.762 0.362 8.962 1.00 0.00 H new TER 2278 GLU A 145