USER MOD reduce.3.24.130724 H: found=0, std=0, add=1050, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1050 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 85 GLN : amide:sc= -1.26 K(o=-1.8,f=-2.7!) USER MOD Set 1.2: A 117 GLN : amide:sc= -0.58 X(o=-1.8,f=-1.5) USER MOD Set 2.1: A 26 TYR OH : rot -179:sc= 0.145 USER MOD Set 2.2: A 28 MET CE :methyl 134:sc= -1.01 (180deg=-0.704) USER MOD Set 2.3: A 56 LYS NZ :NH3+ 176:sc= 1.08 (180deg=0.933) USER MOD Single : A 7 THR OG1 : rot 180:sc= -0.101 USER MOD Single : A 11 SER OG : rot 84:sc= 0.744 USER MOD Single : A 21 MET CE :methyl 160:sc= -0.122 (180deg=-0.681) USER MOD Single : A 22 LYS NZ :NH3+ -164:sc= 1.73 (180deg=1.44!) USER MOD Single : A 23 LYS NZ :NH3+ 172:sc= -1.02 (180deg=-1.1!) USER MOD Single : A 24 SER OG : rot 63:sc= 1.24 USER MOD Single : A 29 MET CE :methyl -173:sc= -1.6 (180deg=-1.77) USER MOD Single : A 30 CYS SG : rot -58:sc= 0.0929 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 163:sc= 1.25 (180deg=1.11) USER MOD Single : A 41 THR OG1 : rot -100:sc= -0.133 USER MOD Single : A 47 SER OG : rot 78:sc= 1.12 USER MOD Single : A 49 ASN : amide:sc= 0.22 K(o=0.22,f=-3.2!) USER MOD Single : A 50 TYR OH : rot -125:sc= 1.96 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 168:sc= 1.69 (180deg=1.55) USER MOD Single : A 58 SER OG : rot 180:sc= 0.0408 USER MOD Single : A 59 THR OG1 : rot -93:sc= 1.22 USER MOD Single : A 61 LYS NZ :NH3+ 176:sc= 1.23 (180deg=1.15) USER MOD Single : A 63 CYS SG : rot 94:sc= -1.96 USER MOD Single : A 64 TYR OH : rot 171:sc= -2.45! USER MOD Single : A 71 TYR OH : rot 49:sc= 2.28 USER MOD Single : A 72 ASN : amide:sc= -0.0589 K(o=-0.059,f=-5.4!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -116:sc= 1.06 (180deg=0.732) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0.0286 USER MOD Single : A 96 LYS NZ :NH3+ -143:sc= 1.03 (180deg=0.234) USER MOD Single : A 97 MET CE :methyl -161:sc= -0.19 (180deg=-0.679) USER MOD Single : A 98 MET CE :methyl 162:sc= -0.17 (180deg=-0.626) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 82:sc= 1.2 USER MOD Single : A 102 SER OG : rot 85:sc= 0.723 USER MOD Single : A 107 SER OG : rot 62:sc= 1.23 USER MOD Single : A 108 SER OG : rot 79:sc= 1.25 USER MOD Single : A 110 SER OG : rot -77:sc= 1.16 USER MOD Single : A 113 TYR OH : rot 17:sc= 0.415 USER MOD Single : A 119 ASN : amide:sc= -1.04! X(o=-1!,f=-0.59) USER MOD Single : A 122 SER OG : rot 180:sc= 0.071 USER MOD Single : A 132 LYS NZ :NH3+ -125:sc= -0.0283 (180deg=-1.42!) USER MOD Single : A 136 HIS : no HD1:sc= 0 X(o=0,f=-0.0015) USER MOD ----------------------------------------------------------------- ATOM 58 N GLY A 5 -7.612 -16.717 -8.643 1.00 1.43 N ATOM 59 CA GLY A 5 -7.577 -15.990 -9.869 1.00 21.32 C ATOM 60 C GLY A 5 -7.941 -14.593 -9.518 1.00 74.43 C ATOM 61 O GLY A 5 -9.079 -14.158 -9.736 1.00 22.00 O ATOM 0 HA2 GLY A 5 -6.587 -16.035 -10.323 1.00 21.32 H new ATOM 0 HA3 GLY A 5 -8.278 -16.407 -10.592 1.00 21.32 H new ATOM 65 N VAL A 6 -7.001 -13.933 -8.885 1.00 70.44 N ATOM 66 CA VAL A 6 -7.205 -12.631 -8.296 1.00 63.15 C ATOM 67 C VAL A 6 -7.568 -11.562 -9.325 1.00 43.53 C ATOM 68 O VAL A 6 -7.089 -11.570 -10.465 1.00 52.42 O ATOM 69 CB VAL A 6 -5.977 -12.189 -7.451 1.00 42.44 C ATOM 70 CG1 VAL A 6 -4.758 -11.905 -8.324 1.00 13.22 C ATOM 71 CG2 VAL A 6 -6.317 -11.004 -6.557 1.00 32.41 C ATOM 0 H VAL A 6 -6.054 -14.293 -8.762 1.00 70.44 H new ATOM 0 HA VAL A 6 -8.062 -12.733 -7.631 1.00 63.15 H new ATOM 0 HB VAL A 6 -5.714 -13.024 -6.802 1.00 42.44 H new ATOM 0 HG11 VAL A 6 -3.923 -11.599 -7.694 1.00 13.22 H new ATOM 0 HG12 VAL A 6 -4.487 -12.806 -8.874 1.00 13.22 H new ATOM 0 HG13 VAL A 6 -4.993 -11.107 -9.028 1.00 13.22 H new ATOM 0 HG21 VAL A 6 -5.437 -10.720 -5.980 1.00 32.41 H new ATOM 0 HG22 VAL A 6 -6.634 -10.163 -7.173 1.00 32.41 H new ATOM 0 HG23 VAL A 6 -7.123 -11.280 -5.878 1.00 32.41 H new ATOM 81 N THR A 7 -8.464 -10.710 -8.936 1.00 44.53 N ATOM 82 CA THR A 7 -8.899 -9.597 -9.723 1.00 51.45 C ATOM 83 C THR A 7 -9.338 -8.510 -8.721 1.00 33.10 C ATOM 84 O THR A 7 -9.581 -8.833 -7.547 1.00 54.20 O ATOM 85 CB THR A 7 -10.115 -10.039 -10.593 1.00 3.30 C ATOM 86 OG1 THR A 7 -9.793 -11.261 -11.290 1.00 3.42 O ATOM 87 CG2 THR A 7 -10.483 -8.985 -11.618 1.00 74.50 C ATOM 0 H THR A 7 -8.929 -10.772 -8.030 1.00 44.53 H new ATOM 0 HA THR A 7 -8.115 -9.229 -10.385 1.00 51.45 H new ATOM 0 HB THR A 7 -10.962 -10.186 -9.923 1.00 3.30 H new ATOM 0 HG1 THR A 7 -10.559 -11.538 -11.835 1.00 3.42 H new ATOM 0 HG21 THR A 7 -11.335 -9.330 -12.205 1.00 74.50 H new ATOM 0 HG22 THR A 7 -10.745 -8.058 -11.108 1.00 74.50 H new ATOM 0 HG23 THR A 7 -9.635 -8.808 -12.279 1.00 74.50 H new ATOM 95 N LEU A 8 -9.371 -7.256 -9.117 1.00 73.12 N ATOM 96 CA LEU A 8 -9.906 -6.239 -8.233 1.00 3.00 C ATOM 97 C LEU A 8 -11.356 -6.037 -8.529 1.00 42.12 C ATOM 98 O LEU A 8 -11.790 -6.200 -9.680 1.00 20.13 O ATOM 99 CB LEU A 8 -9.237 -4.873 -8.371 1.00 62.22 C ATOM 100 CG LEU A 8 -7.773 -4.717 -8.001 1.00 30.10 C ATOM 101 CD1 LEU A 8 -7.522 -3.262 -7.725 1.00 12.24 C ATOM 102 CD2 LEU A 8 -7.412 -5.540 -6.788 1.00 2.23 C ATOM 0 H LEU A 8 -9.043 -6.920 -10.022 1.00 73.12 H new ATOM 0 HA LEU A 8 -9.722 -6.608 -7.224 1.00 3.00 H new ATOM 0 HB2 LEU A 8 -9.347 -4.559 -9.409 1.00 62.22 H new ATOM 0 HB3 LEU A 8 -9.804 -4.168 -7.763 1.00 62.22 H new ATOM 0 HG LEU A 8 -7.154 -5.072 -8.825 1.00 30.10 H new ATOM 0 HD11 LEU A 8 -6.476 -3.118 -7.456 1.00 12.24 H new ATOM 0 HD12 LEU A 8 -7.751 -2.678 -8.616 1.00 12.24 H new ATOM 0 HD13 LEU A 8 -8.157 -2.933 -6.902 1.00 12.24 H new ATOM 0 HD21 LEU A 8 -6.356 -5.401 -6.555 1.00 2.23 H new ATOM 0 HD22 LEU A 8 -8.016 -5.220 -5.939 1.00 2.23 H new ATOM 0 HD23 LEU A 8 -7.603 -6.593 -6.993 1.00 2.23 H new ATOM 114 N GLU A 9 -12.112 -5.688 -7.532 1.00 35.34 N ATOM 115 CA GLU A 9 -13.475 -5.362 -7.760 1.00 11.23 C ATOM 116 C GLU A 9 -13.627 -3.828 -7.814 1.00 23.20 C ATOM 117 O GLU A 9 -12.630 -3.108 -7.661 1.00 2.13 O ATOM 118 CB GLU A 9 -14.428 -6.118 -6.795 1.00 72.30 C ATOM 119 CG GLU A 9 -14.260 -5.873 -5.304 1.00 3.13 C ATOM 120 CD GLU A 9 -14.677 -4.498 -4.904 1.00 65.21 C ATOM 121 OE1 GLU A 9 -15.888 -4.157 -5.047 1.00 35.52 O ATOM 122 OE2 GLU A 9 -13.836 -3.732 -4.450 1.00 33.02 O ATOM 0 H GLU A 9 -11.805 -5.624 -6.561 1.00 35.34 H new ATOM 0 HA GLU A 9 -13.798 -5.725 -8.736 1.00 11.23 H new ATOM 0 HB2 GLU A 9 -15.452 -5.860 -7.064 1.00 72.30 H new ATOM 0 HB3 GLU A 9 -14.310 -7.187 -6.975 1.00 72.30 H new ATOM 0 HG2 GLU A 9 -14.849 -6.604 -4.750 1.00 3.13 H new ATOM 0 HG3 GLU A 9 -13.217 -6.028 -5.028 1.00 3.13 H new ATOM 129 N GLU A 10 -14.815 -3.336 -8.050 1.00 73.21 N ATOM 130 CA GLU A 10 -14.991 -1.917 -8.306 1.00 74.45 C ATOM 131 C GLU A 10 -14.736 -1.012 -7.077 1.00 70.43 C ATOM 132 O GLU A 10 -14.174 0.080 -7.214 1.00 31.32 O ATOM 133 CB GLU A 10 -16.354 -1.635 -8.932 1.00 33.54 C ATOM 134 CG GLU A 10 -16.446 -0.259 -9.576 1.00 63.23 C ATOM 135 CD GLU A 10 -15.409 -0.083 -10.674 1.00 14.33 C ATOM 136 OE1 GLU A 10 -15.690 -0.419 -11.840 1.00 64.44 O ATOM 137 OE2 GLU A 10 -14.280 0.373 -10.392 1.00 0.12 O ATOM 0 H GLU A 10 -15.674 -3.886 -8.072 1.00 73.21 H new ATOM 0 HA GLU A 10 -14.214 -1.652 -9.023 1.00 74.45 H new ATOM 0 HB2 GLU A 10 -16.565 -2.395 -9.684 1.00 33.54 H new ATOM 0 HB3 GLU A 10 -17.124 -1.722 -8.165 1.00 33.54 H new ATOM 0 HG2 GLU A 10 -17.444 -0.117 -9.991 1.00 63.23 H new ATOM 0 HG3 GLU A 10 -16.305 0.509 -8.816 1.00 63.23 H new ATOM 144 N SER A 11 -15.094 -1.471 -5.895 1.00 54.02 N ATOM 145 CA SER A 11 -15.003 -0.645 -4.699 1.00 31.22 C ATOM 146 C SER A 11 -13.547 -0.279 -4.368 1.00 11.13 C ATOM 147 O SER A 11 -13.252 0.880 -4.039 1.00 45.42 O ATOM 148 CB SER A 11 -15.669 -1.349 -3.524 1.00 3.14 C ATOM 149 OG SER A 11 -16.968 -1.806 -3.892 1.00 73.31 O ATOM 0 H SER A 11 -15.452 -2.412 -5.733 1.00 54.02 H new ATOM 0 HA SER A 11 -15.531 0.289 -4.894 1.00 31.22 H new ATOM 0 HB2 SER A 11 -15.057 -2.192 -3.202 1.00 3.14 H new ATOM 0 HB3 SER A 11 -15.743 -0.667 -2.677 1.00 3.14 H new ATOM 0 HG SER A 11 -16.894 -2.670 -4.349 1.00 73.31 H new ATOM 155 N VAL A 12 -12.637 -1.244 -4.482 1.00 4.35 N ATOM 156 CA VAL A 12 -11.228 -0.969 -4.228 1.00 63.22 C ATOM 157 C VAL A 12 -10.650 0.028 -5.223 1.00 41.31 C ATOM 158 O VAL A 12 -9.846 0.874 -4.849 1.00 3.13 O ATOM 159 CB VAL A 12 -10.330 -2.233 -4.138 1.00 11.53 C ATOM 160 CG1 VAL A 12 -10.713 -3.063 -2.947 1.00 41.54 C ATOM 161 CG2 VAL A 12 -10.405 -3.068 -5.396 1.00 4.42 C ATOM 0 H VAL A 12 -12.846 -2.207 -4.744 1.00 4.35 H new ATOM 0 HA VAL A 12 -11.217 -0.520 -3.235 1.00 63.22 H new ATOM 0 HB VAL A 12 -9.300 -1.893 -4.025 1.00 11.53 H new ATOM 0 HG11 VAL A 12 -10.075 -3.945 -2.898 1.00 41.54 H new ATOM 0 HG12 VAL A 12 -10.589 -2.474 -2.038 1.00 41.54 H new ATOM 0 HG13 VAL A 12 -11.754 -3.373 -3.039 1.00 41.54 H new ATOM 0 HG21 VAL A 12 -9.762 -3.942 -5.291 1.00 4.42 H new ATOM 0 HG22 VAL A 12 -11.433 -3.391 -5.558 1.00 4.42 H new ATOM 0 HG23 VAL A 12 -10.073 -2.474 -6.247 1.00 4.42 H new ATOM 171 N ARG A 13 -11.107 -0.023 -6.481 1.00 62.42 N ATOM 172 CA ARG A 13 -10.620 0.926 -7.479 1.00 12.42 C ATOM 173 C ARG A 13 -11.104 2.323 -7.139 1.00 15.32 C ATOM 174 O ARG A 13 -10.371 3.314 -7.314 1.00 0.23 O ATOM 175 CB ARG A 13 -11.022 0.556 -8.916 1.00 44.14 C ATOM 176 CG ARG A 13 -10.529 -0.804 -9.373 1.00 3.31 C ATOM 177 CD ARG A 13 -10.569 -0.942 -10.894 1.00 43.24 C ATOM 178 NE ARG A 13 -11.904 -0.739 -11.480 1.00 25.44 N ATOM 179 CZ ARG A 13 -12.172 -0.787 -12.801 1.00 21.14 C ATOM 180 NH1 ARG A 13 -11.189 -0.904 -13.690 1.00 54.03 N ATOM 181 NH2 ARG A 13 -13.409 -0.678 -13.227 1.00 42.33 N ATOM 0 H ARG A 13 -11.795 -0.694 -6.822 1.00 62.42 H new ATOM 0 HA ARG A 13 -9.531 0.890 -7.446 1.00 12.42 H new ATOM 0 HB2 ARG A 13 -12.109 0.580 -8.994 1.00 44.14 H new ATOM 0 HB3 ARG A 13 -10.637 1.316 -9.596 1.00 44.14 H new ATOM 0 HG2 ARG A 13 -9.509 -0.958 -9.021 1.00 3.31 H new ATOM 0 HG3 ARG A 13 -11.143 -1.583 -8.921 1.00 3.31 H new ATOM 0 HD2 ARG A 13 -9.878 -0.222 -11.332 1.00 43.24 H new ATOM 0 HD3 ARG A 13 -10.211 -1.934 -11.168 1.00 43.24 H new ATOM 0 HE ARG A 13 -12.679 -0.549 -10.844 1.00 25.44 H new ATOM 0 HH11 ARG A 13 -10.220 -0.958 -13.375 1.00 54.03 H new ATOM 0 HH12 ARG A 13 -11.404 -0.939 -14.686 1.00 54.03 H new ATOM 0 HH21 ARG A 13 -14.170 -0.557 -12.559 1.00 42.33 H new ATOM 0 HH22 ARG A 13 -13.609 -0.715 -14.226 1.00 42.33 H new ATOM 195 N GLY A 14 -12.323 2.392 -6.619 1.00 65.11 N ATOM 196 CA GLY A 14 -12.889 3.640 -6.179 1.00 75.21 C ATOM 197 C GLY A 14 -12.097 4.224 -5.037 1.00 71.34 C ATOM 198 O GLY A 14 -11.834 5.422 -5.009 1.00 71.14 O ATOM 0 H GLY A 14 -12.935 1.586 -6.495 1.00 65.11 H new ATOM 0 HA2 GLY A 14 -12.910 4.346 -7.009 1.00 75.21 H new ATOM 0 HA3 GLY A 14 -13.922 3.484 -5.867 1.00 75.21 H new ATOM 202 N ALA A 15 -11.693 3.369 -4.111 1.00 32.43 N ATOM 203 CA ALA A 15 -10.891 3.779 -2.968 1.00 73.15 C ATOM 204 C ALA A 15 -9.507 4.259 -3.422 1.00 63.31 C ATOM 205 O ALA A 15 -8.992 5.264 -2.923 1.00 1.31 O ATOM 206 CB ALA A 15 -10.773 2.642 -1.971 1.00 54.41 C ATOM 0 H ALA A 15 -11.911 2.373 -4.130 1.00 32.43 H new ATOM 0 HA ALA A 15 -11.390 4.614 -2.475 1.00 73.15 H new ATOM 0 HB1 ALA A 15 -10.170 2.964 -1.122 1.00 54.41 H new ATOM 0 HB2 ALA A 15 -11.766 2.358 -1.624 1.00 54.41 H new ATOM 0 HB3 ALA A 15 -10.297 1.786 -2.450 1.00 54.41 H new ATOM 212 N ILE A 16 -8.930 3.546 -4.395 1.00 51.13 N ATOM 213 CA ILE A 16 -7.641 3.911 -4.985 1.00 10.23 C ATOM 214 C ILE A 16 -7.690 5.335 -5.549 1.00 12.04 C ATOM 215 O ILE A 16 -6.798 6.145 -5.302 1.00 31.44 O ATOM 216 CB ILE A 16 -7.219 2.906 -6.118 1.00 3.50 C ATOM 217 CG1 ILE A 16 -6.901 1.511 -5.548 1.00 5.33 C ATOM 218 CG2 ILE A 16 -6.048 3.428 -6.954 1.00 2.25 C ATOM 219 CD1 ILE A 16 -5.750 1.480 -4.562 1.00 74.12 C ATOM 0 H ILE A 16 -9.343 2.703 -4.794 1.00 51.13 H new ATOM 0 HA ILE A 16 -6.895 3.864 -4.191 1.00 10.23 H new ATOM 0 HB ILE A 16 -8.078 2.815 -6.783 1.00 3.50 H new ATOM 0 HG12 ILE A 16 -7.793 1.121 -5.058 1.00 5.33 H new ATOM 0 HG13 ILE A 16 -6.672 0.839 -6.375 1.00 5.33 H new ATOM 0 HG21 ILE A 16 -5.795 2.697 -7.722 1.00 2.25 H new ATOM 0 HG22 ILE A 16 -6.329 4.369 -7.427 1.00 2.25 H new ATOM 0 HG23 ILE A 16 -5.184 3.590 -6.309 1.00 2.25 H new ATOM 0 HD11 ILE A 16 -5.597 0.459 -4.213 1.00 74.12 H new ATOM 0 HD12 ILE A 16 -4.843 1.836 -5.050 1.00 74.12 H new ATOM 0 HD13 ILE A 16 -5.981 2.123 -3.713 1.00 74.12 H new ATOM 231 N ASP A 17 -8.748 5.641 -6.260 1.00 2.23 N ATOM 232 CA ASP A 17 -8.889 6.954 -6.882 1.00 63.32 C ATOM 233 C ASP A 17 -9.302 8.009 -5.864 1.00 2.44 C ATOM 234 O ASP A 17 -8.964 9.181 -5.992 1.00 42.33 O ATOM 235 CB ASP A 17 -9.884 6.897 -8.027 1.00 54.25 C ATOM 236 CG ASP A 17 -10.043 8.219 -8.738 1.00 65.21 C ATOM 237 OD1 ASP A 17 -9.147 8.597 -9.529 1.00 31.34 O ATOM 238 OD2 ASP A 17 -11.071 8.884 -8.547 1.00 63.23 O ATOM 0 H ASP A 17 -9.528 5.006 -6.428 1.00 2.23 H new ATOM 0 HA ASP A 17 -7.916 7.241 -7.281 1.00 63.32 H new ATOM 0 HB2 ASP A 17 -9.561 6.142 -8.744 1.00 54.25 H new ATOM 0 HB3 ASP A 17 -10.853 6.579 -7.643 1.00 54.25 H new ATOM 243 N ASP A 18 -9.979 7.574 -4.830 1.00 41.15 N ATOM 244 CA ASP A 18 -10.448 8.458 -3.762 1.00 4.32 C ATOM 245 C ASP A 18 -9.249 9.023 -3.004 1.00 34.23 C ATOM 246 O ASP A 18 -9.250 10.178 -2.537 1.00 24.24 O ATOM 247 CB ASP A 18 -11.315 7.671 -2.798 1.00 24.41 C ATOM 248 CG ASP A 18 -12.269 8.537 -2.046 1.00 51.33 C ATOM 249 OD1 ASP A 18 -11.868 9.226 -1.098 1.00 5.20 O ATOM 250 OD2 ASP A 18 -13.469 8.543 -2.400 1.00 24.21 O ATOM 0 H ASP A 18 -10.227 6.594 -4.694 1.00 41.15 H new ATOM 0 HA ASP A 18 -11.026 9.273 -4.198 1.00 4.32 H new ATOM 0 HB2 ASP A 18 -11.874 6.916 -3.351 1.00 24.41 H new ATOM 0 HB3 ASP A 18 -10.677 7.141 -2.091 1.00 24.41 H new ATOM 255 N LEU A 19 -8.222 8.199 -2.898 1.00 15.33 N ATOM 256 CA LEU A 19 -6.967 8.569 -2.270 1.00 60.34 C ATOM 257 C LEU A 19 -6.228 9.550 -3.192 1.00 72.20 C ATOM 258 O LEU A 19 -5.559 10.480 -2.734 1.00 53.31 O ATOM 259 CB LEU A 19 -6.153 7.277 -2.001 1.00 4.31 C ATOM 260 CG LEU A 19 -4.865 7.352 -1.139 1.00 32.32 C ATOM 261 CD1 LEU A 19 -4.454 5.966 -0.767 1.00 60.20 C ATOM 262 CD2 LEU A 19 -3.710 8.020 -1.871 1.00 4.12 C ATOM 0 H LEU A 19 -8.237 7.242 -3.250 1.00 15.33 H new ATOM 0 HA LEU A 19 -7.124 9.069 -1.314 1.00 60.34 H new ATOM 0 HB2 LEU A 19 -6.824 6.561 -1.525 1.00 4.31 H new ATOM 0 HB3 LEU A 19 -5.875 6.859 -2.968 1.00 4.31 H new ATOM 0 HG LEU A 19 -5.093 7.953 -0.259 1.00 32.32 H new ATOM 0 HD11 LEU A 19 -3.549 6.005 -0.161 1.00 60.20 H new ATOM 0 HD12 LEU A 19 -5.252 5.490 -0.197 1.00 60.20 H new ATOM 0 HD13 LEU A 19 -4.260 5.389 -1.671 1.00 60.20 H new ATOM 0 HD21 LEU A 19 -2.834 8.046 -1.222 1.00 4.12 H new ATOM 0 HD22 LEU A 19 -3.476 7.456 -2.774 1.00 4.12 H new ATOM 0 HD23 LEU A 19 -3.991 9.038 -2.142 1.00 4.12 H new ATOM 274 N ARG A 20 -6.408 9.376 -4.499 1.00 64.41 N ATOM 275 CA ARG A 20 -5.801 10.275 -5.478 1.00 51.43 C ATOM 276 C ARG A 20 -6.469 11.644 -5.404 1.00 15.22 C ATOM 277 O ARG A 20 -5.862 12.669 -5.689 1.00 64.05 O ATOM 278 CB ARG A 20 -5.870 9.711 -6.904 1.00 61.41 C ATOM 279 CG ARG A 20 -5.250 8.332 -7.038 1.00 13.13 C ATOM 280 CD ARG A 20 -4.982 7.952 -8.477 1.00 61.34 C ATOM 281 NE ARG A 20 -6.176 7.973 -9.324 1.00 2.11 N ATOM 282 CZ ARG A 20 -6.175 7.660 -10.618 1.00 53.51 C ATOM 283 NH1 ARG A 20 -5.051 7.262 -11.204 1.00 21.50 N ATOM 284 NH2 ARG A 20 -7.298 7.742 -11.307 1.00 24.51 N ATOM 0 H ARG A 20 -6.966 8.625 -4.904 1.00 64.41 H new ATOM 0 HA ARG A 20 -4.744 10.375 -5.230 1.00 51.43 H new ATOM 0 HB2 ARG A 20 -6.913 9.664 -7.218 1.00 61.41 H new ATOM 0 HB3 ARG A 20 -5.363 10.397 -7.583 1.00 61.41 H new ATOM 0 HG2 ARG A 20 -4.315 8.302 -6.478 1.00 13.13 H new ATOM 0 HG3 ARG A 20 -5.914 7.594 -6.589 1.00 13.13 H new ATOM 0 HD2 ARG A 20 -4.241 8.635 -8.892 1.00 61.34 H new ATOM 0 HD3 ARG A 20 -4.545 6.954 -8.505 1.00 61.34 H new ATOM 0 HE ARG A 20 -7.062 8.244 -8.897 1.00 2.11 H new ATOM 0 HH11 ARG A 20 -4.189 7.196 -10.662 1.00 21.50 H new ATOM 0 HH12 ARG A 20 -5.050 7.022 -12.195 1.00 21.50 H new ATOM 0 HH21 ARG A 20 -8.157 8.043 -10.848 1.00 24.51 H new ATOM 0 HH22 ARG A 20 -7.306 7.504 -12.299 1.00 24.51 H new ATOM 298 N MET A 21 -7.719 11.645 -4.976 1.00 0.10 N ATOM 299 CA MET A 21 -8.473 12.877 -4.770 1.00 11.54 C ATOM 300 C MET A 21 -8.156 13.473 -3.406 1.00 45.55 C ATOM 301 O MET A 21 -8.675 14.525 -3.049 1.00 73.25 O ATOM 302 CB MET A 21 -9.980 12.635 -4.871 1.00 12.21 C ATOM 303 CG MET A 21 -10.455 12.162 -6.226 1.00 0.54 C ATOM 304 SD MET A 21 -12.249 11.943 -6.304 1.00 74.34 S ATOM 305 CE MET A 21 -12.825 13.617 -5.987 1.00 23.21 C ATOM 0 H MET A 21 -8.242 10.796 -4.761 1.00 0.10 H new ATOM 0 HA MET A 21 -8.177 13.573 -5.555 1.00 11.54 H new ATOM 0 HB2 MET A 21 -10.266 11.896 -4.123 1.00 12.21 H new ATOM 0 HB3 MET A 21 -10.500 13.560 -4.621 1.00 12.21 H new ATOM 0 HG2 MET A 21 -10.148 12.882 -6.985 1.00 0.54 H new ATOM 0 HG3 MET A 21 -9.968 11.217 -6.467 1.00 0.54 H new ATOM 0 HE1 MET A 21 -13.849 13.723 -6.344 1.00 23.21 H new ATOM 0 HE2 MET A 21 -12.792 13.816 -4.916 1.00 23.21 H new ATOM 0 HE3 MET A 21 -12.183 14.327 -6.508 1.00 23.21 H new ATOM 315 N LYS A 22 -7.323 12.764 -2.637 1.00 34.40 N ATOM 316 CA LYS A 22 -6.880 13.184 -1.300 1.00 21.20 C ATOM 317 C LYS A 22 -8.009 13.227 -0.277 1.00 52.05 C ATOM 318 O LYS A 22 -7.891 13.864 0.774 1.00 73.43 O ATOM 319 CB LYS A 22 -6.074 14.505 -1.353 1.00 71.13 C ATOM 320 CG LYS A 22 -4.672 14.332 -1.940 1.00 24.43 C ATOM 321 CD LYS A 22 -3.783 13.547 -1.004 1.00 24.33 C ATOM 322 CE LYS A 22 -3.352 14.381 0.194 1.00 41.33 C ATOM 323 NZ LYS A 22 -1.889 14.527 0.218 1.00 11.20 N ATOM 0 H LYS A 22 -6.931 11.869 -2.929 1.00 34.40 H new ATOM 0 HA LYS A 22 -6.201 12.409 -0.945 1.00 21.20 H new ATOM 0 HB2 LYS A 22 -6.623 15.234 -1.949 1.00 71.13 H new ATOM 0 HB3 LYS A 22 -5.991 14.913 -0.346 1.00 71.13 H new ATOM 0 HG2 LYS A 22 -4.737 13.820 -2.900 1.00 24.43 H new ATOM 0 HG3 LYS A 22 -4.231 15.310 -2.130 1.00 24.43 H new ATOM 0 HD2 LYS A 22 -4.313 12.659 -0.658 1.00 24.33 H new ATOM 0 HD3 LYS A 22 -2.901 13.202 -1.544 1.00 24.33 H new ATOM 0 HE2 LYS A 22 -3.821 15.364 0.148 1.00 41.33 H new ATOM 0 HE3 LYS A 22 -3.692 13.908 1.115 1.00 41.33 H new ATOM 0 HZ1 LYS A 22 -1.588 14.853 1.159 1.00 11.20 H new ATOM 0 HZ2 LYS A 22 -1.445 13.609 0.011 1.00 11.20 H new ATOM 0 HZ3 LYS A 22 -1.598 15.222 -0.499 1.00 11.20 H new ATOM 337 N LYS A 23 -9.081 12.510 -0.549 1.00 73.44 N ATOM 338 CA LYS A 23 -10.166 12.442 0.402 1.00 63.22 C ATOM 339 C LYS A 23 -9.877 11.298 1.354 1.00 25.41 C ATOM 340 O LYS A 23 -9.988 11.435 2.581 1.00 11.53 O ATOM 341 CB LYS A 23 -11.526 12.279 -0.285 1.00 72.11 C ATOM 342 CG LYS A 23 -11.820 13.357 -1.326 1.00 45.43 C ATOM 343 CD LYS A 23 -13.274 13.359 -1.855 1.00 11.41 C ATOM 344 CE LYS A 23 -13.730 12.041 -2.497 1.00 50.13 C ATOM 345 NZ LYS A 23 -14.061 10.986 -1.506 1.00 72.32 N ATOM 0 H LYS A 23 -9.221 11.975 -1.406 1.00 73.44 H new ATOM 0 HA LYS A 23 -10.229 13.380 0.954 1.00 63.22 H new ATOM 0 HB2 LYS A 23 -11.566 11.302 -0.766 1.00 72.11 H new ATOM 0 HB3 LYS A 23 -12.310 12.294 0.472 1.00 72.11 H new ATOM 0 HG2 LYS A 23 -11.604 14.333 -0.891 1.00 45.43 H new ATOM 0 HG3 LYS A 23 -11.141 13.226 -2.168 1.00 45.43 H new ATOM 0 HD2 LYS A 23 -13.945 13.595 -1.029 1.00 11.41 H new ATOM 0 HD3 LYS A 23 -13.377 14.158 -2.589 1.00 11.41 H new ATOM 0 HE2 LYS A 23 -14.604 12.232 -3.119 1.00 50.13 H new ATOM 0 HE3 LYS A 23 -12.943 11.675 -3.157 1.00 50.13 H new ATOM 0 HZ1 LYS A 23 -14.488 10.173 -1.994 1.00 72.32 H new ATOM 0 HZ2 LYS A 23 -13.193 10.681 -1.020 1.00 72.32 H new ATOM 0 HZ3 LYS A 23 -14.734 11.364 -0.808 1.00 72.32 H new ATOM 359 N SER A 24 -9.470 10.190 0.793 1.00 21.10 N ATOM 360 CA SER A 24 -9.031 9.074 1.567 1.00 41.32 C ATOM 361 C SER A 24 -7.510 9.142 1.705 1.00 21.14 C ATOM 362 O SER A 24 -6.821 9.611 0.801 1.00 5.20 O ATOM 363 CB SER A 24 -9.475 7.768 0.909 1.00 25.33 C ATOM 364 OG SER A 24 -10.899 7.728 0.805 1.00 0.52 O ATOM 0 H SER A 24 -9.436 10.042 -0.216 1.00 21.10 H new ATOM 0 HA SER A 24 -9.478 9.106 2.561 1.00 41.32 H new ATOM 0 HB2 SER A 24 -9.028 7.681 -0.081 1.00 25.33 H new ATOM 0 HB3 SER A 24 -9.122 6.919 1.494 1.00 25.33 H new ATOM 0 HG SER A 24 -11.205 8.456 0.225 1.00 0.52 H new ATOM 370 N ARG A 25 -7.015 8.752 2.848 1.00 2.22 N ATOM 371 CA ARG A 25 -5.585 8.766 3.120 1.00 21.33 C ATOM 372 C ARG A 25 -5.064 7.355 3.151 1.00 64.15 C ATOM 373 O ARG A 25 -3.967 7.064 2.678 1.00 1.14 O ATOM 374 CB ARG A 25 -5.344 9.363 4.498 1.00 10.14 C ATOM 375 CG ARG A 25 -3.884 9.427 4.929 1.00 30.24 C ATOM 376 CD ARG A 25 -3.212 10.675 4.427 1.00 33.23 C ATOM 377 NE ARG A 25 -1.753 10.608 4.524 1.00 63.32 N ATOM 378 CZ ARG A 25 -0.990 11.054 5.529 1.00 11.21 C ATOM 379 NH1 ARG A 25 -1.527 11.421 6.692 1.00 5.33 N ATOM 380 NH2 ARG A 25 0.326 11.071 5.376 1.00 72.31 N ATOM 0 H ARG A 25 -7.584 8.414 3.624 1.00 2.22 H new ATOM 0 HA ARG A 25 -5.085 9.347 2.345 1.00 21.33 H new ATOM 0 HB2 ARG A 25 -5.757 10.372 4.517 1.00 10.14 H new ATOM 0 HB3 ARG A 25 -5.898 8.778 5.232 1.00 10.14 H new ATOM 0 HG2 ARG A 25 -3.824 9.393 6.017 1.00 30.24 H new ATOM 0 HG3 ARG A 25 -3.354 8.552 4.553 1.00 30.24 H new ATOM 0 HD2 ARG A 25 -3.496 10.843 3.388 1.00 33.23 H new ATOM 0 HD3 ARG A 25 -3.571 11.531 4.998 1.00 33.23 H new ATOM 0 HE ARG A 25 -1.265 10.174 3.740 1.00 63.32 H new ATOM 0 HH11 ARG A 25 -2.536 11.365 6.828 1.00 5.33 H new ATOM 0 HH12 ARG A 25 -0.929 11.758 7.446 1.00 5.33 H new ATOM 0 HH21 ARG A 25 0.742 10.747 4.503 1.00 72.31 H new ATOM 0 HH22 ARG A 25 0.923 11.408 6.131 1.00 72.31 H new ATOM 394 N TYR A 26 -5.860 6.497 3.723 1.00 63.24 N ATOM 395 CA TYR A 26 -5.467 5.154 3.987 1.00 32.01 C ATOM 396 C TYR A 26 -6.530 4.224 3.479 1.00 31.42 C ATOM 397 O TYR A 26 -7.719 4.509 3.622 1.00 4.52 O ATOM 398 CB TYR A 26 -5.365 5.107 5.517 1.00 45.41 C ATOM 399 CG TYR A 26 -5.287 3.778 6.229 1.00 45.31 C ATOM 400 CD1 TYR A 26 -4.109 3.059 6.310 1.00 25.51 C ATOM 401 CD2 TYR A 26 -6.398 3.298 6.910 1.00 73.33 C ATOM 402 CE1 TYR A 26 -4.042 1.896 7.049 1.00 3.12 C ATOM 403 CE2 TYR A 26 -6.342 2.136 7.631 1.00 54.31 C ATOM 404 CZ TYR A 26 -5.162 1.440 7.701 1.00 32.00 C ATOM 405 OH TYR A 26 -5.088 0.309 8.468 1.00 72.44 O ATOM 0 H TYR A 26 -6.810 6.719 4.020 1.00 63.24 H new ATOM 0 HA TYR A 26 -4.535 4.857 3.506 1.00 32.01 H new ATOM 0 HB2 TYR A 26 -4.481 5.679 5.800 1.00 45.41 H new ATOM 0 HB3 TYR A 26 -6.229 5.638 5.916 1.00 45.41 H new ATOM 0 HD1 TYR A 26 -3.231 3.412 5.789 1.00 25.51 H new ATOM 0 HD2 TYR A 26 -7.324 3.852 6.870 1.00 73.33 H new ATOM 0 HE1 TYR A 26 -3.114 1.347 7.115 1.00 3.12 H new ATOM 0 HE2 TYR A 26 -7.221 1.770 8.141 1.00 54.31 H new ATOM 0 HH TYR A 26 -5.970 0.113 8.848 1.00 72.44 H new ATOM 415 N VAL A 27 -6.108 3.100 2.939 1.00 20.50 N ATOM 416 CA VAL A 27 -7.002 2.073 2.435 1.00 73.00 C ATOM 417 C VAL A 27 -6.295 0.729 2.570 1.00 4.43 C ATOM 418 O VAL A 27 -5.369 0.435 1.812 1.00 54.30 O ATOM 419 CB VAL A 27 -7.351 2.241 0.904 1.00 53.43 C ATOM 420 CG1 VAL A 27 -8.445 1.272 0.495 1.00 2.22 C ATOM 421 CG2 VAL A 27 -7.729 3.668 0.508 1.00 73.33 C ATOM 0 H VAL A 27 -5.120 2.869 2.835 1.00 20.50 H new ATOM 0 HA VAL A 27 -7.926 2.146 3.009 1.00 73.00 H new ATOM 0 HB VAL A 27 -6.434 2.009 0.363 1.00 53.43 H new ATOM 0 HG11 VAL A 27 -8.671 1.404 -0.563 1.00 2.22 H new ATOM 0 HG12 VAL A 27 -8.110 0.250 0.670 1.00 2.22 H new ATOM 0 HG13 VAL A 27 -9.341 1.466 1.084 1.00 2.22 H new ATOM 0 HG21 VAL A 27 -7.955 3.702 -0.558 1.00 73.33 H new ATOM 0 HG22 VAL A 27 -8.605 3.983 1.075 1.00 73.33 H new ATOM 0 HG23 VAL A 27 -6.897 4.338 0.724 1.00 73.33 H new ATOM 431 N MET A 28 -6.676 -0.056 3.530 1.00 25.14 N ATOM 432 CA MET A 28 -6.102 -1.370 3.671 1.00 72.21 C ATOM 433 C MET A 28 -7.010 -2.352 2.970 1.00 12.11 C ATOM 434 O MET A 28 -8.195 -2.477 3.316 1.00 52.45 O ATOM 435 CB MET A 28 -5.882 -1.752 5.144 1.00 62.02 C ATOM 436 CG MET A 28 -5.274 -3.145 5.337 1.00 72.03 C ATOM 437 SD MET A 28 -4.873 -3.531 7.061 1.00 45.05 S ATOM 438 CE MET A 28 -3.595 -2.322 7.411 1.00 3.14 C ATOM 0 H MET A 28 -7.379 0.184 4.229 1.00 25.14 H new ATOM 0 HA MET A 28 -5.113 -1.385 3.214 1.00 72.21 H new ATOM 0 HB2 MET A 28 -5.228 -1.013 5.608 1.00 62.02 H new ATOM 0 HB3 MET A 28 -6.837 -1.707 5.668 1.00 62.02 H new ATOM 0 HG2 MET A 28 -5.972 -3.892 4.959 1.00 72.03 H new ATOM 0 HG3 MET A 28 -4.368 -3.223 4.736 1.00 72.03 H new ATOM 0 HE1 MET A 28 -3.793 -1.851 8.374 1.00 3.14 H new ATOM 0 HE2 MET A 28 -2.624 -2.817 7.442 1.00 3.14 H new ATOM 0 HE3 MET A 28 -3.589 -1.562 6.630 1.00 3.14 H new ATOM 448 N MET A 29 -6.485 -2.986 1.960 1.00 30.11 N ATOM 449 CA MET A 29 -7.240 -3.905 1.139 1.00 4.32 C ATOM 450 C MET A 29 -6.699 -5.292 1.333 1.00 74.14 C ATOM 451 O MET A 29 -5.494 -5.500 1.261 1.00 12.25 O ATOM 452 CB MET A 29 -7.090 -3.503 -0.326 1.00 30.24 C ATOM 453 CG MET A 29 -7.643 -2.130 -0.650 1.00 31.40 C ATOM 454 SD MET A 29 -7.124 -1.519 -2.265 1.00 11.24 S ATOM 455 CE MET A 29 -5.361 -1.341 -1.989 1.00 44.11 C ATOM 0 H MET A 29 -5.511 -2.882 1.676 1.00 30.11 H new ATOM 0 HA MET A 29 -8.293 -3.879 1.421 1.00 4.32 H new ATOM 0 HB2 MET A 29 -6.033 -3.530 -0.593 1.00 30.24 H new ATOM 0 HB3 MET A 29 -7.595 -4.242 -0.948 1.00 30.24 H new ATOM 0 HG2 MET A 29 -8.732 -2.166 -0.615 1.00 31.40 H new ATOM 0 HG3 MET A 29 -7.323 -1.426 0.118 1.00 31.40 H new ATOM 0 HE1 MET A 29 -4.905 -0.854 -2.851 1.00 44.11 H new ATOM 0 HE2 MET A 29 -5.191 -0.736 -1.099 1.00 44.11 H new ATOM 0 HE3 MET A 29 -4.913 -2.325 -1.849 1.00 44.11 H new ATOM 465 N CYS A 30 -7.562 -6.220 1.600 1.00 42.34 N ATOM 466 CA CYS A 30 -7.181 -7.586 1.813 1.00 61.52 C ATOM 467 C CYS A 30 -7.673 -8.418 0.664 1.00 31.24 C ATOM 468 O CYS A 30 -8.647 -8.068 -0.008 1.00 52.14 O ATOM 469 CB CYS A 30 -7.752 -8.107 3.136 1.00 21.03 C ATOM 470 SG CYS A 30 -7.229 -9.775 3.611 1.00 60.53 S ATOM 0 H CYS A 30 -8.565 -6.051 1.678 1.00 42.34 H new ATOM 0 HA CYS A 30 -6.094 -7.652 1.870 1.00 61.52 H new ATOM 0 HB2 CYS A 30 -7.468 -7.417 3.930 1.00 21.03 H new ATOM 0 HB3 CYS A 30 -8.840 -8.091 3.073 1.00 21.03 H new ATOM 0 HG CYS A 30 -7.557 -10.616 2.675 1.00 60.53 H new ATOM 476 N ILE A 31 -7.012 -9.502 0.437 1.00 51.44 N ATOM 477 CA ILE A 31 -7.351 -10.375 -0.632 1.00 52.12 C ATOM 478 C ILE A 31 -8.274 -11.430 -0.070 1.00 10.05 C ATOM 479 O ILE A 31 -8.080 -11.862 1.076 1.00 51.33 O ATOM 480 CB ILE A 31 -6.081 -11.071 -1.184 1.00 55.42 C ATOM 481 CG1 ILE A 31 -4.956 -10.037 -1.392 1.00 42.20 C ATOM 482 CG2 ILE A 31 -6.402 -11.794 -2.498 1.00 21.42 C ATOM 483 CD1 ILE A 31 -3.650 -10.629 -1.847 1.00 74.14 C ATOM 0 H ILE A 31 -6.214 -9.809 0.994 1.00 51.44 H new ATOM 0 HA ILE A 31 -7.821 -9.814 -1.440 1.00 52.12 H new ATOM 0 HB ILE A 31 -5.740 -11.810 -0.459 1.00 55.42 H new ATOM 0 HG12 ILE A 31 -5.285 -9.302 -2.127 1.00 42.20 H new ATOM 0 HG13 ILE A 31 -4.793 -9.501 -0.457 1.00 42.20 H new ATOM 0 HG21 ILE A 31 -5.502 -12.279 -2.876 1.00 21.42 H new ATOM 0 HG22 ILE A 31 -7.172 -12.545 -2.321 1.00 21.42 H new ATOM 0 HG23 ILE A 31 -6.761 -11.072 -3.232 1.00 21.42 H new ATOM 0 HD11 ILE A 31 -2.913 -9.835 -1.969 1.00 74.14 H new ATOM 0 HD12 ILE A 31 -3.295 -11.342 -1.103 1.00 74.14 H new ATOM 0 HD13 ILE A 31 -3.794 -11.140 -2.799 1.00 74.14 H new ATOM 495 N GLY A 32 -9.307 -11.786 -0.811 1.00 72.23 N ATOM 496 CA GLY A 32 -10.153 -12.876 -0.401 1.00 45.11 C ATOM 497 C GLY A 32 -9.325 -14.133 -0.284 1.00 12.24 C ATOM 498 O GLY A 32 -8.527 -14.416 -1.183 1.00 24.14 O ATOM 0 H GLY A 32 -9.573 -11.339 -1.688 1.00 72.23 H new ATOM 0 HA2 GLY A 32 -10.624 -12.646 0.555 1.00 45.11 H new ATOM 0 HA3 GLY A 32 -10.955 -13.021 -1.125 1.00 45.11 H new ATOM 502 N ALA A 33 -9.500 -14.868 0.803 1.00 31.22 N ATOM 503 CA ALA A 33 -8.687 -16.055 1.121 1.00 74.22 C ATOM 504 C ALA A 33 -8.734 -17.126 0.035 1.00 31.44 C ATOM 505 O ALA A 33 -7.824 -17.947 -0.074 1.00 24.20 O ATOM 506 CB ALA A 33 -9.112 -16.641 2.457 1.00 71.21 C ATOM 0 H ALA A 33 -10.214 -14.664 1.502 1.00 31.22 H new ATOM 0 HA ALA A 33 -7.652 -15.717 1.179 1.00 74.22 H new ATOM 0 HB1 ALA A 33 -8.503 -17.517 2.680 1.00 71.21 H new ATOM 0 HB2 ALA A 33 -8.976 -15.896 3.241 1.00 71.21 H new ATOM 0 HB3 ALA A 33 -10.162 -16.931 2.410 1.00 71.21 H new ATOM 512 N ASP A 34 -9.777 -17.103 -0.776 1.00 23.40 N ATOM 513 CA ASP A 34 -9.921 -18.086 -1.845 1.00 71.15 C ATOM 514 C ASP A 34 -9.056 -17.697 -3.041 1.00 34.32 C ATOM 515 O ASP A 34 -8.725 -18.522 -3.899 1.00 42.22 O ATOM 516 CB ASP A 34 -11.400 -18.237 -2.243 1.00 74.40 C ATOM 517 CG ASP A 34 -11.656 -19.377 -3.210 1.00 12.05 C ATOM 518 OD1 ASP A 34 -11.293 -20.530 -2.891 1.00 51.51 O ATOM 519 OD2 ASP A 34 -12.234 -19.156 -4.276 1.00 60.23 O ATOM 0 H ASP A 34 -10.534 -16.421 -0.719 1.00 23.40 H new ATOM 0 HA ASP A 34 -9.576 -19.055 -1.484 1.00 71.15 H new ATOM 0 HB2 ASP A 34 -11.995 -18.394 -1.344 1.00 74.40 H new ATOM 0 HB3 ASP A 34 -11.743 -17.306 -2.694 1.00 74.40 H new ATOM 524 N GLY A 35 -8.615 -16.455 -3.033 1.00 74.51 N ATOM 525 CA GLY A 35 -7.819 -15.929 -4.107 1.00 50.34 C ATOM 526 C GLY A 35 -8.675 -15.378 -5.206 1.00 35.43 C ATOM 527 O GLY A 35 -8.263 -15.327 -6.356 1.00 43.33 O ATOM 0 H GLY A 35 -8.801 -15.790 -2.282 1.00 74.51 H new ATOM 0 HA2 GLY A 35 -7.165 -15.145 -3.726 1.00 50.34 H new ATOM 0 HA3 GLY A 35 -7.177 -16.715 -4.504 1.00 50.34 H new ATOM 531 N LYS A 36 -9.872 -14.969 -4.854 1.00 43.31 N ATOM 532 CA LYS A 36 -10.810 -14.452 -5.830 1.00 20.24 C ATOM 533 C LYS A 36 -10.588 -12.975 -6.128 1.00 42.41 C ATOM 534 O LYS A 36 -10.127 -12.609 -7.212 1.00 30.24 O ATOM 535 CB LYS A 36 -12.252 -14.711 -5.401 1.00 51.03 C ATOM 536 CG LYS A 36 -12.652 -16.179 -5.435 1.00 13.13 C ATOM 537 CD LYS A 36 -14.100 -16.389 -4.999 1.00 4.13 C ATOM 538 CE LYS A 36 -14.306 -16.048 -3.531 1.00 62.23 C ATOM 539 NZ LYS A 36 -15.716 -16.186 -3.123 1.00 71.42 N ATOM 0 H LYS A 36 -10.222 -14.983 -3.896 1.00 43.31 H new ATOM 0 HA LYS A 36 -10.625 -14.994 -6.757 1.00 20.24 H new ATOM 0 HB2 LYS A 36 -12.394 -14.329 -4.390 1.00 51.03 H new ATOM 0 HB3 LYS A 36 -12.921 -14.147 -6.051 1.00 51.03 H new ATOM 0 HG2 LYS A 36 -12.518 -16.568 -6.444 1.00 13.13 H new ATOM 0 HG3 LYS A 36 -11.991 -16.750 -4.783 1.00 13.13 H new ATOM 0 HD2 LYS A 36 -14.757 -15.770 -5.611 1.00 4.13 H new ATOM 0 HD3 LYS A 36 -14.385 -17.426 -5.174 1.00 4.13 H new ATOM 0 HE2 LYS A 36 -13.686 -16.701 -2.917 1.00 62.23 H new ATOM 0 HE3 LYS A 36 -13.974 -15.026 -3.346 1.00 62.23 H new ATOM 0 HZ1 LYS A 36 -15.811 -15.944 -2.116 1.00 71.42 H new ATOM 0 HZ2 LYS A 36 -16.306 -15.545 -3.690 1.00 71.42 H new ATOM 0 HZ3 LYS A 36 -16.027 -17.167 -3.274 1.00 71.42 H new ATOM 553 N LYS A 37 -10.900 -12.129 -5.186 1.00 61.42 N ATOM 554 CA LYS A 37 -10.756 -10.719 -5.401 1.00 42.24 C ATOM 555 C LYS A 37 -10.302 -10.005 -4.164 1.00 13.32 C ATOM 556 O LYS A 37 -10.450 -10.522 -3.048 1.00 73.20 O ATOM 557 CB LYS A 37 -12.028 -10.086 -6.053 1.00 52.03 C ATOM 558 CG LYS A 37 -13.387 -10.380 -5.397 1.00 31.14 C ATOM 559 CD LYS A 37 -13.614 -9.655 -4.074 1.00 4.14 C ATOM 560 CE LYS A 37 -15.024 -9.929 -3.569 1.00 12.03 C ATOM 561 NZ LYS A 37 -15.335 -9.226 -2.309 1.00 4.41 N ATOM 0 H LYS A 37 -11.254 -12.391 -4.266 1.00 61.42 H new ATOM 0 HA LYS A 37 -9.957 -10.585 -6.131 1.00 42.24 H new ATOM 0 HB2 LYS A 37 -11.892 -9.005 -6.073 1.00 52.03 H new ATOM 0 HB3 LYS A 37 -12.076 -10.421 -7.089 1.00 52.03 H new ATOM 0 HG2 LYS A 37 -14.180 -10.102 -6.091 1.00 31.14 H new ATOM 0 HG3 LYS A 37 -13.472 -11.454 -5.229 1.00 31.14 H new ATOM 0 HD2 LYS A 37 -12.883 -9.988 -3.337 1.00 4.14 H new ATOM 0 HD3 LYS A 37 -13.468 -8.583 -4.207 1.00 4.14 H new ATOM 0 HE2 LYS A 37 -15.742 -9.628 -4.332 1.00 12.03 H new ATOM 0 HE3 LYS A 37 -15.148 -11.002 -3.420 1.00 12.03 H new ATOM 0 HZ1 LYS A 37 -16.365 -9.210 -2.165 1.00 4.41 H new ATOM 0 HZ2 LYS A 37 -14.882 -9.721 -1.514 1.00 4.41 H new ATOM 0 HZ3 LYS A 37 -14.977 -8.251 -2.358 1.00 4.41 H new ATOM 575 N ILE A 38 -9.709 -8.862 -4.366 1.00 2.01 N ATOM 576 CA ILE A 38 -9.237 -8.037 -3.287 1.00 33.42 C ATOM 577 C ILE A 38 -10.337 -7.069 -2.932 1.00 1.31 C ATOM 578 O ILE A 38 -11.014 -6.550 -3.827 1.00 62.31 O ATOM 579 CB ILE A 38 -7.947 -7.266 -3.691 1.00 71.40 C ATOM 580 CG1 ILE A 38 -6.864 -8.258 -4.141 1.00 24.55 C ATOM 581 CG2 ILE A 38 -7.439 -6.389 -2.543 1.00 34.44 C ATOM 582 CD1 ILE A 38 -5.526 -7.632 -4.498 1.00 10.20 C ATOM 0 H ILE A 38 -9.538 -8.472 -5.293 1.00 2.01 H new ATOM 0 HA ILE A 38 -8.984 -8.661 -2.430 1.00 33.42 H new ATOM 0 HB ILE A 38 -8.189 -6.605 -4.524 1.00 71.40 H new ATOM 0 HG12 ILE A 38 -6.706 -8.986 -3.345 1.00 24.55 H new ATOM 0 HG13 ILE A 38 -7.233 -8.807 -5.007 1.00 24.55 H new ATOM 0 HG21 ILE A 38 -6.537 -5.864 -2.858 1.00 34.44 H new ATOM 0 HG22 ILE A 38 -8.206 -5.663 -2.273 1.00 34.44 H new ATOM 0 HG23 ILE A 38 -7.212 -7.015 -1.680 1.00 34.44 H new ATOM 0 HD11 ILE A 38 -4.829 -8.413 -4.803 1.00 10.20 H new ATOM 0 HD12 ILE A 38 -5.662 -6.926 -5.318 1.00 10.20 H new ATOM 0 HD13 ILE A 38 -5.126 -7.108 -3.630 1.00 10.20 H new ATOM 594 N GLU A 39 -10.543 -6.866 -1.663 1.00 1.21 N ATOM 595 CA GLU A 39 -11.582 -6.011 -1.199 1.00 44.50 C ATOM 596 C GLU A 39 -11.091 -5.149 -0.049 1.00 1.15 C ATOM 597 O GLU A 39 -10.124 -5.499 0.637 1.00 51.41 O ATOM 598 CB GLU A 39 -12.810 -6.828 -0.808 1.00 11.22 C ATOM 599 CG GLU A 39 -12.568 -7.882 0.255 1.00 72.31 C ATOM 600 CD GLU A 39 -13.808 -8.669 0.523 1.00 43.03 C ATOM 601 OE1 GLU A 39 -14.681 -8.190 1.269 1.00 55.01 O ATOM 602 OE2 GLU A 39 -13.967 -9.766 -0.054 1.00 41.31 O ATOM 0 H GLU A 39 -9.989 -7.294 -0.922 1.00 1.21 H new ATOM 0 HA GLU A 39 -11.874 -5.342 -2.008 1.00 44.50 H new ATOM 0 HB2 GLU A 39 -13.583 -6.146 -0.453 1.00 11.22 H new ATOM 0 HB3 GLU A 39 -13.201 -7.317 -1.700 1.00 11.22 H new ATOM 0 HG2 GLU A 39 -11.771 -8.552 -0.067 1.00 72.31 H new ATOM 0 HG3 GLU A 39 -12.231 -7.405 1.175 1.00 72.31 H new ATOM 609 N VAL A 40 -11.728 -4.026 0.136 1.00 64.24 N ATOM 610 CA VAL A 40 -11.353 -3.098 1.171 1.00 30.53 C ATOM 611 C VAL A 40 -11.713 -3.640 2.559 1.00 2.33 C ATOM 612 O VAL A 40 -12.843 -4.105 2.806 1.00 13.33 O ATOM 613 CB VAL A 40 -11.951 -1.664 0.940 1.00 64.02 C ATOM 614 CG1 VAL A 40 -13.478 -1.660 0.941 1.00 14.01 C ATOM 615 CG2 VAL A 40 -11.404 -0.664 1.954 1.00 43.34 C ATOM 0 H VAL A 40 -12.524 -3.726 -0.427 1.00 64.24 H new ATOM 0 HA VAL A 40 -10.269 -2.993 1.122 1.00 30.53 H new ATOM 0 HB VAL A 40 -11.632 -1.352 -0.054 1.00 64.02 H new ATOM 0 HG11 VAL A 40 -13.839 -0.645 0.777 1.00 14.01 H new ATOM 0 HG12 VAL A 40 -13.844 -2.308 0.145 1.00 14.01 H new ATOM 0 HG13 VAL A 40 -13.842 -2.024 1.902 1.00 14.01 H new ATOM 0 HG21 VAL A 40 -11.838 0.318 1.767 1.00 43.34 H new ATOM 0 HG22 VAL A 40 -11.663 -0.989 2.962 1.00 43.34 H new ATOM 0 HG23 VAL A 40 -10.320 -0.606 1.859 1.00 43.34 H new ATOM 625 N THR A 41 -10.742 -3.638 3.422 1.00 74.21 N ATOM 626 CA THR A 41 -10.906 -4.066 4.769 1.00 1.02 C ATOM 627 C THR A 41 -11.230 -2.848 5.639 1.00 43.11 C ATOM 628 O THR A 41 -12.179 -2.859 6.416 1.00 22.35 O ATOM 629 CB THR A 41 -9.601 -4.724 5.243 1.00 63.13 C ATOM 630 OG1 THR A 41 -9.218 -5.707 4.280 1.00 5.12 O ATOM 631 CG2 THR A 41 -9.774 -5.393 6.592 1.00 51.04 C ATOM 0 H THR A 41 -9.795 -3.331 3.199 1.00 74.21 H new ATOM 0 HA THR A 41 -11.720 -4.787 4.845 1.00 1.02 H new ATOM 0 HB THR A 41 -8.837 -3.953 5.345 1.00 63.13 H new ATOM 0 HG1 THR A 41 -9.480 -6.596 4.598 1.00 5.12 H new ATOM 0 HG21 THR A 41 -8.831 -5.848 6.896 1.00 51.04 H new ATOM 0 HG22 THR A 41 -10.073 -4.650 7.331 1.00 51.04 H new ATOM 0 HG23 THR A 41 -10.542 -6.163 6.520 1.00 51.04 H new ATOM 639 N GLU A 42 -10.456 -1.790 5.467 1.00 63.23 N ATOM 640 CA GLU A 42 -10.638 -0.569 6.226 1.00 70.13 C ATOM 641 C GLU A 42 -10.066 0.622 5.459 1.00 35.42 C ATOM 642 O GLU A 42 -8.985 0.531 4.869 1.00 52.54 O ATOM 643 CB GLU A 42 -9.998 -0.703 7.621 1.00 52.21 C ATOM 644 CG GLU A 42 -8.540 -1.138 7.601 1.00 14.03 C ATOM 645 CD GLU A 42 -7.971 -1.310 8.977 1.00 45.35 C ATOM 646 OE1 GLU A 42 -7.460 -0.320 9.545 1.00 51.22 O ATOM 647 OE2 GLU A 42 -8.025 -2.428 9.520 1.00 32.34 O ATOM 0 H GLU A 42 -9.686 -1.755 4.799 1.00 63.23 H new ATOM 0 HA GLU A 42 -11.705 -0.394 6.366 1.00 70.13 H new ATOM 0 HB2 GLU A 42 -10.072 0.255 8.136 1.00 52.21 H new ATOM 0 HB3 GLU A 42 -10.572 -1.423 8.204 1.00 52.21 H new ATOM 0 HG2 GLU A 42 -8.452 -2.078 7.056 1.00 14.03 H new ATOM 0 HG3 GLU A 42 -7.951 -0.398 7.058 1.00 14.03 H new ATOM 654 N VAL A 43 -10.797 1.707 5.441 1.00 2.53 N ATOM 655 CA VAL A 43 -10.393 2.916 4.740 1.00 25.31 C ATOM 656 C VAL A 43 -10.529 4.118 5.678 1.00 72.33 C ATOM 657 O VAL A 43 -11.529 4.239 6.396 1.00 74.04 O ATOM 658 CB VAL A 43 -11.211 3.106 3.404 1.00 63.35 C ATOM 659 CG1 VAL A 43 -12.711 3.019 3.645 1.00 34.21 C ATOM 660 CG2 VAL A 43 -10.867 4.423 2.720 1.00 74.21 C ATOM 0 H VAL A 43 -11.698 1.785 5.914 1.00 2.53 H new ATOM 0 HA VAL A 43 -9.347 2.828 4.447 1.00 25.31 H new ATOM 0 HB VAL A 43 -10.924 2.289 2.743 1.00 63.35 H new ATOM 0 HG11 VAL A 43 -13.240 3.155 2.701 1.00 34.21 H new ATOM 0 HG12 VAL A 43 -12.957 2.042 4.061 1.00 34.21 H new ATOM 0 HG13 VAL A 43 -13.013 3.798 4.345 1.00 34.21 H new ATOM 0 HG21 VAL A 43 -11.449 4.520 1.804 1.00 74.21 H new ATOM 0 HG22 VAL A 43 -11.101 5.252 3.388 1.00 74.21 H new ATOM 0 HG23 VAL A 43 -9.804 4.441 2.478 1.00 74.21 H new ATOM 670 N GLY A 44 -9.537 4.984 5.690 1.00 41.21 N ATOM 671 CA GLY A 44 -9.527 6.073 6.638 1.00 5.23 C ATOM 672 C GLY A 44 -9.159 7.413 6.037 1.00 62.03 C ATOM 673 O GLY A 44 -8.605 7.487 4.916 1.00 2.51 O ATOM 0 H GLY A 44 -8.736 4.954 5.060 1.00 41.21 H new ATOM 0 HA2 GLY A 44 -10.513 6.151 7.096 1.00 5.23 H new ATOM 0 HA3 GLY A 44 -8.822 5.839 7.436 1.00 5.23 H new ATOM 677 N GLU A 45 -9.430 8.463 6.792 1.00 3.32 N ATOM 678 CA GLU A 45 -9.205 9.829 6.359 1.00 52.50 C ATOM 679 C GLU A 45 -7.785 10.337 6.670 1.00 15.51 C ATOM 680 O GLU A 45 -6.941 9.585 7.152 1.00 25.53 O ATOM 681 CB GLU A 45 -10.323 10.769 6.874 1.00 71.44 C ATOM 682 CG GLU A 45 -10.629 10.712 8.375 1.00 2.22 C ATOM 683 CD GLU A 45 -9.495 11.156 9.238 1.00 41.14 C ATOM 684 OE1 GLU A 45 -9.024 12.294 9.066 1.00 60.32 O ATOM 685 OE2 GLU A 45 -9.027 10.378 10.075 1.00 42.02 O ATOM 0 H GLU A 45 -9.817 8.389 7.733 1.00 3.32 H new ATOM 0 HA GLU A 45 -9.264 9.835 5.271 1.00 52.50 H new ATOM 0 HB2 GLU A 45 -10.051 11.793 6.620 1.00 71.44 H new ATOM 0 HB3 GLU A 45 -11.239 10.539 6.330 1.00 71.44 H new ATOM 0 HG2 GLU A 45 -11.498 11.336 8.583 1.00 2.22 H new ATOM 0 HG3 GLU A 45 -10.899 9.690 8.643 1.00 2.22 H new ATOM 692 N ARG A 46 -7.555 11.629 6.427 1.00 13.41 N ATOM 693 CA ARG A 46 -6.216 12.252 6.468 1.00 42.04 C ATOM 694 C ARG A 46 -5.513 12.190 7.825 1.00 32.03 C ATOM 695 O ARG A 46 -4.285 12.341 7.884 1.00 60.25 O ATOM 696 CB ARG A 46 -6.223 13.704 5.945 1.00 33.32 C ATOM 697 CG ARG A 46 -6.551 13.901 4.447 1.00 11.20 C ATOM 698 CD ARG A 46 -8.015 13.614 4.114 1.00 24.43 C ATOM 699 NE ARG A 46 -8.925 14.461 4.898 1.00 52.33 N ATOM 700 CZ ARG A 46 -10.241 14.250 5.087 1.00 51.54 C ATOM 701 NH1 ARG A 46 -10.864 13.233 4.485 1.00 3.40 N ATOM 702 NH2 ARG A 46 -10.934 15.077 5.864 1.00 12.03 N ATOM 0 H ARG A 46 -8.299 12.287 6.192 1.00 13.41 H new ATOM 0 HA ARG A 46 -5.630 11.630 5.792 1.00 42.04 H new ATOM 0 HB2 ARG A 46 -6.946 14.273 6.529 1.00 33.32 H new ATOM 0 HB3 ARG A 46 -5.243 14.140 6.139 1.00 33.32 H new ATOM 0 HG2 ARG A 46 -6.313 14.925 4.160 1.00 11.20 H new ATOM 0 HG3 ARG A 46 -5.914 13.247 3.852 1.00 11.20 H new ATOM 0 HD2 ARG A 46 -8.186 13.782 3.051 1.00 24.43 H new ATOM 0 HD3 ARG A 46 -8.234 12.564 4.310 1.00 24.43 H new ATOM 0 HE ARG A 46 -8.521 15.287 5.341 1.00 52.33 H new ATOM 0 HH11 ARG A 46 -10.342 12.605 3.874 1.00 3.40 H new ATOM 0 HH12 ARG A 46 -11.862 13.084 4.637 1.00 3.40 H new ATOM 0 HH21 ARG A 46 -10.468 15.866 6.313 1.00 12.03 H new ATOM 0 HH22 ARG A 46 -11.931 14.923 6.011 1.00 12.03 H new ATOM 716 N SER A 47 -6.252 11.979 8.895 1.00 2.40 N ATOM 717 CA SER A 47 -5.651 11.896 10.217 1.00 4.35 C ATOM 718 C SER A 47 -4.901 10.573 10.418 1.00 53.43 C ATOM 719 O SER A 47 -4.091 10.445 11.344 1.00 70.15 O ATOM 720 CB SER A 47 -6.709 12.088 11.291 1.00 21.02 C ATOM 721 OG SER A 47 -7.421 13.298 11.060 1.00 20.30 O ATOM 0 H SER A 47 -7.265 11.862 8.879 1.00 2.40 H new ATOM 0 HA SER A 47 -4.918 12.698 10.301 1.00 4.35 H new ATOM 0 HB2 SER A 47 -7.399 11.244 11.289 1.00 21.02 H new ATOM 0 HB3 SER A 47 -6.240 12.114 12.275 1.00 21.02 H new ATOM 0 HG SER A 47 -8.079 13.159 10.347 1.00 20.30 H new ATOM 727 N VAL A 48 -5.163 9.597 9.560 1.00 64.42 N ATOM 728 CA VAL A 48 -4.451 8.340 9.633 1.00 10.14 C ATOM 729 C VAL A 48 -3.033 8.567 9.140 1.00 20.35 C ATOM 730 O VAL A 48 -2.817 8.925 7.980 1.00 41.24 O ATOM 731 CB VAL A 48 -5.123 7.221 8.798 1.00 15.03 C ATOM 732 CG1 VAL A 48 -4.384 5.903 8.980 1.00 11.34 C ATOM 733 CG2 VAL A 48 -6.584 7.066 9.180 1.00 42.35 C ATOM 0 H VAL A 48 -5.857 9.655 8.815 1.00 64.42 H new ATOM 0 HA VAL A 48 -4.460 8.004 10.670 1.00 10.14 H new ATOM 0 HB VAL A 48 -5.073 7.505 7.747 1.00 15.03 H new ATOM 0 HG11 VAL A 48 -4.870 5.129 8.386 1.00 11.34 H new ATOM 0 HG12 VAL A 48 -3.351 6.017 8.652 1.00 11.34 H new ATOM 0 HG13 VAL A 48 -4.402 5.618 10.032 1.00 11.34 H new ATOM 0 HG21 VAL A 48 -7.035 6.275 8.581 1.00 42.35 H new ATOM 0 HG22 VAL A 48 -6.658 6.808 10.236 1.00 42.35 H new ATOM 0 HG23 VAL A 48 -7.109 8.003 8.997 1.00 42.35 H new ATOM 743 N ASN A 49 -2.093 8.407 10.030 1.00 0.53 N ATOM 744 CA ASN A 49 -0.699 8.653 9.739 1.00 64.15 C ATOM 745 C ASN A 49 0.089 7.350 9.646 1.00 44.05 C ATOM 746 O ASN A 49 -0.454 6.266 9.874 1.00 11.22 O ATOM 747 CB ASN A 49 -0.082 9.627 10.755 1.00 32.24 C ATOM 748 CG ASN A 49 -0.645 11.052 10.658 1.00 61.20 C ATOM 749 OD1 ASN A 49 -1.010 11.536 9.575 1.00 52.23 O ATOM 750 ND2 ASN A 49 -0.735 11.723 11.775 1.00 42.05 N ATOM 0 H ASN A 49 -2.269 8.100 10.987 1.00 0.53 H new ATOM 0 HA ASN A 49 -0.642 9.130 8.760 1.00 64.15 H new ATOM 0 HB2 ASN A 49 -0.252 9.245 11.762 1.00 32.24 H new ATOM 0 HB3 ASN A 49 0.997 9.660 10.605 1.00 32.24 H new ATOM 0 HD21 ASN A 49 -1.113 12.670 11.772 1.00 42.05 H new ATOM 0 HD22 ASN A 49 -0.427 11.300 12.650 1.00 42.05 H new ATOM 757 N TYR A 50 1.370 7.466 9.319 1.00 45.13 N ATOM 758 CA TYR A 50 2.271 6.322 9.040 1.00 22.23 C ATOM 759 C TYR A 50 2.345 5.348 10.209 1.00 73.32 C ATOM 760 O TYR A 50 2.360 4.131 10.022 1.00 62.35 O ATOM 761 CB TYR A 50 3.680 6.842 8.716 1.00 73.34 C ATOM 762 CG TYR A 50 3.651 7.973 7.729 1.00 33.44 C ATOM 763 CD1 TYR A 50 3.342 7.743 6.411 1.00 12.40 C ATOM 764 CD2 TYR A 50 3.883 9.282 8.133 1.00 21.34 C ATOM 765 CE1 TYR A 50 3.254 8.774 5.521 1.00 44.11 C ATOM 766 CE2 TYR A 50 3.810 10.320 7.238 1.00 3.53 C ATOM 767 CZ TYR A 50 3.489 10.055 5.932 1.00 32.43 C ATOM 768 OH TYR A 50 3.375 11.075 5.034 1.00 71.22 O ATOM 0 H TYR A 50 1.834 8.370 9.235 1.00 45.13 H new ATOM 0 HA TYR A 50 1.861 5.782 8.186 1.00 22.23 H new ATOM 0 HB2 TYR A 50 4.163 7.175 9.635 1.00 73.34 H new ATOM 0 HB3 TYR A 50 4.284 6.027 8.316 1.00 73.34 H new ATOM 0 HD1 TYR A 50 3.166 6.732 6.074 1.00 12.40 H new ATOM 0 HD2 TYR A 50 4.124 9.486 9.166 1.00 21.34 H new ATOM 0 HE1 TYR A 50 2.998 8.577 4.490 1.00 44.11 H new ATOM 0 HE2 TYR A 50 4.003 11.333 7.559 1.00 3.53 H new ATOM 0 HH TYR A 50 4.207 11.593 5.020 1.00 71.22 H new ATOM 778 N THR A 51 2.364 5.884 11.397 1.00 13.23 N ATOM 779 CA THR A 51 2.451 5.089 12.588 1.00 53.21 C ATOM 780 C THR A 51 1.152 4.275 12.803 1.00 30.12 C ATOM 781 O THR A 51 1.184 3.189 13.377 1.00 34.14 O ATOM 782 CB THR A 51 2.777 5.986 13.834 1.00 3.12 C ATOM 783 OG1 THR A 51 3.032 5.185 14.989 1.00 60.43 O ATOM 784 CG2 THR A 51 1.636 6.953 14.139 1.00 23.25 C ATOM 0 H THR A 51 2.319 6.889 11.566 1.00 13.23 H new ATOM 0 HA THR A 51 3.270 4.380 12.467 1.00 53.21 H new ATOM 0 HB THR A 51 3.670 6.560 13.587 1.00 3.12 H new ATOM 0 HG1 THR A 51 3.234 5.766 15.752 1.00 60.43 H new ATOM 0 HG21 THR A 51 1.895 7.559 15.007 1.00 23.25 H new ATOM 0 HG22 THR A 51 1.470 7.603 13.280 1.00 23.25 H new ATOM 0 HG23 THR A 51 0.727 6.389 14.348 1.00 23.25 H new ATOM 792 N ASP A 52 0.039 4.762 12.254 1.00 0.43 N ATOM 793 CA ASP A 52 -1.255 4.116 12.447 1.00 14.24 C ATOM 794 C ASP A 52 -1.342 2.881 11.587 1.00 42.41 C ATOM 795 O ASP A 52 -1.874 1.863 12.009 1.00 52.01 O ATOM 796 CB ASP A 52 -2.408 5.059 12.100 1.00 61.10 C ATOM 797 CG ASP A 52 -3.762 4.541 12.562 1.00 42.44 C ATOM 798 OD1 ASP A 52 -4.421 3.764 11.829 1.00 23.24 O ATOM 799 OD2 ASP A 52 -4.202 4.941 13.665 1.00 74.12 O ATOM 0 H ASP A 52 0.010 5.600 11.674 1.00 0.43 H new ATOM 0 HA ASP A 52 -1.340 3.844 13.499 1.00 14.24 H new ATOM 0 HB2 ASP A 52 -2.223 6.032 12.555 1.00 61.10 H new ATOM 0 HB3 ASP A 52 -2.433 5.211 11.021 1.00 61.10 H new ATOM 804 N LEU A 53 -0.773 2.950 10.383 1.00 14.11 N ATOM 805 CA LEU A 53 -0.796 1.798 9.490 1.00 52.03 C ATOM 806 C LEU A 53 0.100 0.693 10.032 1.00 55.33 C ATOM 807 O LEU A 53 -0.199 -0.487 9.895 1.00 63.02 O ATOM 808 CB LEU A 53 -0.476 2.181 8.003 1.00 35.42 C ATOM 809 CG LEU A 53 0.928 2.733 7.641 1.00 1.33 C ATOM 810 CD1 LEU A 53 1.976 1.628 7.530 1.00 34.53 C ATOM 811 CD2 LEU A 53 0.873 3.525 6.355 1.00 3.14 C ATOM 0 H LEU A 53 -0.301 3.774 10.012 1.00 14.11 H new ATOM 0 HA LEU A 53 -1.814 1.409 9.464 1.00 52.03 H new ATOM 0 HB2 LEU A 53 -0.645 1.293 7.394 1.00 35.42 H new ATOM 0 HB3 LEU A 53 -1.209 2.925 7.692 1.00 35.42 H new ATOM 0 HG LEU A 53 1.230 3.390 8.457 1.00 1.33 H new ATOM 0 HD11 LEU A 53 2.941 2.066 7.275 1.00 34.53 H new ATOM 0 HD12 LEU A 53 2.055 1.105 8.483 1.00 34.53 H new ATOM 0 HD13 LEU A 53 1.681 0.923 6.753 1.00 34.53 H new ATOM 0 HD21 LEU A 53 1.867 3.904 6.118 1.00 3.14 H new ATOM 0 HD22 LEU A 53 0.528 2.882 5.546 1.00 3.14 H new ATOM 0 HD23 LEU A 53 0.184 4.362 6.472 1.00 3.14 H new ATOM 823 N LYS A 54 1.180 1.091 10.697 1.00 33.43 N ATOM 824 CA LYS A 54 2.086 0.137 11.306 1.00 10.45 C ATOM 825 C LYS A 54 1.472 -0.451 12.552 1.00 50.35 C ATOM 826 O LYS A 54 1.688 -1.600 12.869 1.00 74.14 O ATOM 827 CB LYS A 54 3.427 0.761 11.650 1.00 54.54 C ATOM 828 CG LYS A 54 4.266 1.175 10.453 1.00 13.14 C ATOM 829 CD LYS A 54 5.619 1.718 10.892 1.00 11.23 C ATOM 830 CE LYS A 54 6.414 0.677 11.683 1.00 61.41 C ATOM 831 NZ LYS A 54 7.708 1.202 12.143 1.00 34.21 N ATOM 0 H LYS A 54 1.445 2.068 10.825 1.00 33.43 H new ATOM 0 HA LYS A 54 2.259 -0.651 10.573 1.00 10.45 H new ATOM 0 HB2 LYS A 54 3.254 1.637 12.274 1.00 54.54 H new ATOM 0 HB3 LYS A 54 3.999 0.051 12.248 1.00 54.54 H new ATOM 0 HG2 LYS A 54 4.411 0.319 9.793 1.00 13.14 H new ATOM 0 HG3 LYS A 54 3.735 1.934 9.878 1.00 13.14 H new ATOM 0 HD2 LYS A 54 6.190 2.024 10.016 1.00 11.23 H new ATOM 0 HD3 LYS A 54 5.473 2.608 11.504 1.00 11.23 H new ATOM 0 HE2 LYS A 54 5.829 0.351 12.543 1.00 61.41 H new ATOM 0 HE3 LYS A 54 6.581 -0.202 11.060 1.00 61.41 H new ATOM 0 HZ1 LYS A 54 8.121 0.547 12.837 1.00 34.21 H new ATOM 0 HZ2 LYS A 54 8.352 1.298 11.332 1.00 34.21 H new ATOM 0 HZ3 LYS A 54 7.568 2.133 12.586 1.00 34.21 H new ATOM 845 N GLU A 55 0.658 0.346 13.217 1.00 10.21 N ATOM 846 CA GLU A 55 -0.036 -0.041 14.446 1.00 55.12 C ATOM 847 C GLU A 55 -1.025 -1.195 14.163 1.00 70.44 C ATOM 848 O GLU A 55 -1.513 -1.866 15.069 1.00 12.40 O ATOM 849 CB GLU A 55 -0.795 1.190 14.983 1.00 40.52 C ATOM 850 CG GLU A 55 -1.435 1.024 16.348 1.00 31.14 C ATOM 851 CD GLU A 55 -0.422 0.843 17.444 1.00 22.52 C ATOM 852 OE1 GLU A 55 -0.009 -0.296 17.709 1.00 31.31 O ATOM 853 OE2 GLU A 55 -0.033 1.845 18.079 1.00 2.31 O ATOM 0 H GLU A 55 0.452 1.299 12.919 1.00 10.21 H new ATOM 0 HA GLU A 55 0.685 -0.388 15.186 1.00 55.12 H new ATOM 0 HB2 GLU A 55 -0.102 2.030 15.027 1.00 40.52 H new ATOM 0 HB3 GLU A 55 -1.573 1.455 14.267 1.00 40.52 H new ATOM 0 HG2 GLU A 55 -2.048 1.898 16.566 1.00 31.14 H new ATOM 0 HG3 GLU A 55 -2.103 0.163 16.330 1.00 31.14 H new ATOM 860 N LYS A 56 -1.287 -1.426 12.897 1.00 64.31 N ATOM 861 CA LYS A 56 -2.232 -2.422 12.456 1.00 21.22 C ATOM 862 C LYS A 56 -1.604 -3.806 12.275 1.00 32.10 C ATOM 863 O LYS A 56 -2.105 -4.599 11.463 1.00 62.31 O ATOM 864 CB LYS A 56 -2.891 -1.961 11.156 1.00 52.30 C ATOM 865 CG LYS A 56 -3.651 -0.657 11.285 1.00 11.51 C ATOM 866 CD LYS A 56 -4.830 -0.780 12.235 1.00 62.23 C ATOM 867 CE LYS A 56 -5.497 0.561 12.457 1.00 33.12 C ATOM 868 NZ LYS A 56 -5.929 1.186 11.196 1.00 54.13 N ATOM 0 H LYS A 56 -0.841 -0.918 12.133 1.00 64.31 H new ATOM 0 HA LYS A 56 -2.982 -2.526 13.240 1.00 21.22 H new ATOM 0 HB2 LYS A 56 -2.123 -1.849 10.390 1.00 52.30 H new ATOM 0 HB3 LYS A 56 -3.575 -2.737 10.811 1.00 52.30 H new ATOM 0 HG2 LYS A 56 -2.977 0.122 11.642 1.00 11.51 H new ATOM 0 HG3 LYS A 56 -4.007 -0.346 10.303 1.00 11.51 H new ATOM 0 HD2 LYS A 56 -5.554 -1.487 11.830 1.00 62.23 H new ATOM 0 HD3 LYS A 56 -4.491 -1.183 13.189 1.00 62.23 H new ATOM 0 HE2 LYS A 56 -6.360 0.431 13.110 1.00 33.12 H new ATOM 0 HE3 LYS A 56 -4.805 1.228 12.972 1.00 33.12 H new ATOM 0 HZ1 LYS A 56 -6.439 2.068 11.403 1.00 54.13 H new ATOM 0 HZ2 LYS A 56 -5.096 1.397 10.610 1.00 54.13 H new ATOM 0 HZ3 LYS A 56 -6.557 0.535 10.683 1.00 54.13 H new ATOM 882 N PHE A 57 -0.506 -4.099 13.006 1.00 21.25 N ATOM 883 CA PHE A 57 0.048 -5.466 13.030 1.00 63.14 C ATOM 884 C PHE A 57 -1.059 -6.434 13.459 1.00 25.23 C ATOM 885 O PHE A 57 -1.544 -6.381 14.601 1.00 61.31 O ATOM 886 CB PHE A 57 1.229 -5.615 14.013 1.00 30.21 C ATOM 887 CG PHE A 57 2.480 -4.840 13.687 1.00 30.52 C ATOM 888 CD1 PHE A 57 3.226 -5.137 12.559 1.00 62.21 C ATOM 889 CD2 PHE A 57 2.923 -3.834 14.530 1.00 71.03 C ATOM 890 CE1 PHE A 57 4.386 -4.438 12.273 1.00 60.52 C ATOM 891 CE2 PHE A 57 4.086 -3.134 14.252 1.00 71.33 C ATOM 892 CZ PHE A 57 4.817 -3.438 13.121 1.00 65.14 C ATOM 0 H PHE A 57 0.003 -3.422 13.575 1.00 21.25 H new ATOM 0 HA PHE A 57 0.418 -5.686 12.029 1.00 63.14 H new ATOM 0 HB2 PHE A 57 0.889 -5.312 15.003 1.00 30.21 H new ATOM 0 HB3 PHE A 57 1.489 -6.672 14.075 1.00 30.21 H new ATOM 0 HD1 PHE A 57 2.899 -5.923 11.895 1.00 62.21 H new ATOM 0 HD2 PHE A 57 2.354 -3.592 15.416 1.00 71.03 H new ATOM 0 HE1 PHE A 57 4.954 -4.675 11.386 1.00 60.52 H new ATOM 0 HE2 PHE A 57 4.420 -2.352 14.918 1.00 71.33 H new ATOM 0 HZ PHE A 57 5.724 -2.895 12.900 1.00 65.14 H new ATOM 902 N SER A 58 -1.476 -7.264 12.549 1.00 50.32 N ATOM 903 CA SER A 58 -2.558 -8.163 12.779 1.00 50.42 C ATOM 904 C SER A 58 -2.063 -9.568 13.154 1.00 4.32 C ATOM 905 O SER A 58 -0.875 -9.754 13.508 1.00 23.23 O ATOM 906 CB SER A 58 -3.418 -8.181 11.519 1.00 70.11 C ATOM 907 OG SER A 58 -2.609 -8.373 10.369 1.00 42.43 O ATOM 0 H SER A 58 -1.067 -7.333 11.617 1.00 50.32 H new ATOM 0 HA SER A 58 -3.150 -7.825 13.629 1.00 50.42 H new ATOM 0 HB2 SER A 58 -4.158 -8.978 11.588 1.00 70.11 H new ATOM 0 HB3 SER A 58 -3.967 -7.243 11.433 1.00 70.11 H new ATOM 0 HG SER A 58 -3.175 -8.384 9.569 1.00 42.43 H new ATOM 913 N THR A 59 -2.985 -10.525 13.112 1.00 24.54 N ATOM 914 CA THR A 59 -2.748 -11.916 13.421 1.00 15.15 C ATOM 915 C THR A 59 -1.513 -12.491 12.686 1.00 2.35 C ATOM 916 O THR A 59 -0.608 -13.042 13.333 1.00 22.24 O ATOM 917 CB THR A 59 -4.047 -12.760 13.181 1.00 63.14 C ATOM 918 OG1 THR A 59 -3.814 -14.154 13.369 1.00 51.13 O ATOM 919 CG2 THR A 59 -4.662 -12.502 11.805 1.00 54.31 C ATOM 0 H THR A 59 -3.953 -10.337 12.851 1.00 24.54 H new ATOM 0 HA THR A 59 -2.503 -11.983 14.481 1.00 15.15 H new ATOM 0 HB THR A 59 -4.766 -12.430 13.931 1.00 63.14 H new ATOM 0 HG1 THR A 59 -3.583 -14.566 12.510 1.00 51.13 H new ATOM 0 HG21 THR A 59 -5.559 -13.110 11.688 1.00 54.31 H new ATOM 0 HG22 THR A 59 -4.924 -11.448 11.715 1.00 54.31 H new ATOM 0 HG23 THR A 59 -3.942 -12.764 11.030 1.00 54.31 H new ATOM 927 N GLU A 60 -1.454 -12.362 11.366 1.00 22.42 N ATOM 928 CA GLU A 60 -0.268 -12.795 10.659 1.00 71.41 C ATOM 929 C GLU A 60 0.538 -11.575 10.328 1.00 11.55 C ATOM 930 O GLU A 60 1.572 -11.310 10.934 1.00 42.22 O ATOM 931 CB GLU A 60 -0.614 -13.522 9.327 1.00 1.41 C ATOM 932 CG GLU A 60 -1.258 -14.897 9.434 1.00 13.23 C ATOM 933 CD GLU A 60 -2.576 -14.910 10.165 1.00 24.33 C ATOM 934 OE1 GLU A 60 -3.612 -14.569 9.557 1.00 65.24 O ATOM 935 OE2 GLU A 60 -2.595 -15.292 11.352 1.00 55.52 O ATOM 0 H GLU A 60 -2.194 -11.972 10.782 1.00 22.42 H new ATOM 0 HA GLU A 60 0.277 -13.493 11.294 1.00 71.41 H new ATOM 0 HB2 GLU A 60 -1.283 -12.879 8.755 1.00 1.41 H new ATOM 0 HB3 GLU A 60 0.304 -13.623 8.748 1.00 1.41 H new ATOM 0 HG2 GLU A 60 -1.409 -15.294 8.430 1.00 13.23 H new ATOM 0 HG3 GLU A 60 -0.567 -15.570 9.942 1.00 13.23 H new ATOM 942 N LYS A 61 0.032 -10.836 9.383 1.00 44.25 N ATOM 943 CA LYS A 61 0.564 -9.595 8.943 1.00 44.10 C ATOM 944 C LYS A 61 -0.458 -9.049 7.972 1.00 61.12 C ATOM 945 O LYS A 61 -1.165 -9.856 7.342 1.00 43.11 O ATOM 946 CB LYS A 61 1.955 -9.797 8.309 1.00 13.53 C ATOM 947 CG LYS A 61 2.670 -8.522 7.885 1.00 74.21 C ATOM 948 CD LYS A 61 4.174 -8.719 7.746 1.00 1.12 C ATOM 949 CE LYS A 61 4.817 -8.953 9.113 1.00 75.52 C ATOM 950 NZ LYS A 61 6.271 -9.145 9.027 1.00 50.15 N ATOM 0 H LYS A 61 -0.811 -11.106 8.875 1.00 44.25 H new ATOM 0 HA LYS A 61 0.727 -8.890 9.758 1.00 44.10 H new ATOM 0 HB2 LYS A 61 2.587 -10.328 9.021 1.00 13.53 H new ATOM 0 HB3 LYS A 61 1.848 -10.441 7.436 1.00 13.53 H new ATOM 0 HG2 LYS A 61 2.262 -8.179 6.934 1.00 74.21 H new ATOM 0 HG3 LYS A 61 2.475 -7.739 8.617 1.00 74.21 H new ATOM 0 HD2 LYS A 61 4.376 -9.569 7.094 1.00 1.12 H new ATOM 0 HD3 LYS A 61 4.619 -7.842 7.275 1.00 1.12 H new ATOM 0 HE2 LYS A 61 4.604 -8.103 9.761 1.00 75.52 H new ATOM 0 HE3 LYS A 61 4.365 -9.829 9.578 1.00 75.52 H new ATOM 0 HZ1 LYS A 61 6.667 -9.232 9.985 1.00 50.15 H new ATOM 0 HZ2 LYS A 61 6.476 -10.010 8.488 1.00 50.15 H new ATOM 0 HZ3 LYS A 61 6.701 -8.329 8.547 1.00 50.15 H new ATOM 964 N PRO A 62 -0.640 -7.734 7.881 1.00 24.21 N ATOM 965 CA PRO A 62 -1.579 -7.155 6.936 1.00 15.33 C ATOM 966 C PRO A 62 -1.245 -7.423 5.454 1.00 35.04 C ATOM 967 O PRO A 62 -0.233 -8.022 5.090 1.00 71.45 O ATOM 968 CB PRO A 62 -1.519 -5.648 7.227 1.00 33.44 C ATOM 969 CG PRO A 62 -0.960 -5.551 8.593 1.00 64.12 C ATOM 970 CD PRO A 62 -0.017 -6.698 8.722 1.00 3.14 C ATOM 0 HA PRO A 62 -2.565 -7.602 7.068 1.00 15.33 H new ATOM 0 HB2 PRO A 62 -0.889 -5.130 6.504 1.00 33.44 H new ATOM 0 HB3 PRO A 62 -2.508 -5.194 7.171 1.00 33.44 H new ATOM 0 HG2 PRO A 62 -0.445 -4.602 8.739 1.00 64.12 H new ATOM 0 HG3 PRO A 62 -1.748 -5.605 9.344 1.00 64.12 H new ATOM 0 HD2 PRO A 62 0.982 -6.440 8.371 1.00 3.14 H new ATOM 0 HD3 PRO A 62 0.083 -7.024 9.757 1.00 3.14 H new ATOM 978 N CYS A 63 -2.137 -6.983 4.666 1.00 45.22 N ATOM 979 CA CYS A 63 -2.136 -7.005 3.249 1.00 0.43 C ATOM 980 C CYS A 63 -1.759 -5.583 2.791 1.00 63.13 C ATOM 981 O CYS A 63 -1.552 -4.724 3.650 1.00 52.42 O ATOM 982 CB CYS A 63 -3.512 -7.435 2.844 1.00 64.42 C ATOM 983 SG CYS A 63 -4.767 -6.631 3.864 1.00 63.33 S ATOM 0 H CYS A 63 -2.985 -6.548 5.031 1.00 45.22 H new ATOM 0 HA CYS A 63 -1.424 -7.692 2.793 1.00 0.43 H new ATOM 0 HB2 CYS A 63 -3.679 -7.191 1.795 1.00 64.42 H new ATOM 0 HB3 CYS A 63 -3.601 -8.517 2.937 1.00 64.42 H new ATOM 0 HG CYS A 63 -5.178 -5.548 3.273 1.00 63.33 H new ATOM 989 N TYR A 64 -1.706 -5.281 1.501 1.00 41.01 N ATOM 990 CA TYR A 64 -1.123 -4.059 1.092 1.00 53.32 C ATOM 991 C TYR A 64 -2.112 -2.927 1.103 1.00 21.43 C ATOM 992 O TYR A 64 -3.269 -3.030 0.683 1.00 44.14 O ATOM 993 CB TYR A 64 -0.570 -4.159 -0.340 1.00 64.52 C ATOM 994 CG TYR A 64 -0.787 -5.462 -1.081 1.00 63.23 C ATOM 995 CD1 TYR A 64 -1.971 -5.708 -1.760 1.00 54.12 C ATOM 996 CD2 TYR A 64 0.210 -6.422 -1.141 1.00 33.14 C ATOM 997 CE1 TYR A 64 -2.153 -6.873 -2.468 1.00 1.02 C ATOM 998 CE2 TYR A 64 0.040 -7.577 -1.854 1.00 50.11 C ATOM 999 CZ TYR A 64 -1.142 -7.800 -2.516 1.00 33.32 C ATOM 1000 OH TYR A 64 -1.308 -8.946 -3.236 1.00 12.12 O ATOM 0 H TYR A 64 -2.060 -5.870 0.747 1.00 41.01 H new ATOM 0 HA TYR A 64 -0.323 -3.861 1.806 1.00 53.32 H new ATOM 0 HB2 TYR A 64 -1.015 -3.358 -0.930 1.00 64.52 H new ATOM 0 HB3 TYR A 64 0.502 -3.968 -0.301 1.00 64.52 H new ATOM 0 HD1 TYR A 64 -2.762 -4.973 -1.732 1.00 54.12 H new ATOM 0 HD2 TYR A 64 1.139 -6.255 -0.615 1.00 33.14 H new ATOM 0 HE1 TYR A 64 -3.085 -7.057 -2.982 1.00 1.02 H new ATOM 0 HE2 TYR A 64 0.832 -8.310 -1.896 1.00 50.11 H new ATOM 0 HH TYR A 64 -0.457 -9.430 -3.282 1.00 12.12 H new ATOM 1010 N VAL A 65 -1.601 -1.858 1.651 1.00 55.23 N ATOM 1011 CA VAL A 65 -2.312 -0.659 1.957 1.00 54.43 C ATOM 1012 C VAL A 65 -1.974 0.425 0.960 1.00 10.40 C ATOM 1013 O VAL A 65 -0.804 0.652 0.661 1.00 22.54 O ATOM 1014 CB VAL A 65 -1.877 -0.141 3.362 1.00 21.13 C ATOM 1015 CG1 VAL A 65 -2.685 1.066 3.800 1.00 24.02 C ATOM 1016 CG2 VAL A 65 -1.929 -1.240 4.407 1.00 1.32 C ATOM 0 H VAL A 65 -0.616 -1.804 1.909 1.00 55.23 H new ATOM 0 HA VAL A 65 -3.379 -0.882 1.928 1.00 54.43 H new ATOM 0 HB VAL A 65 -0.839 0.179 3.268 1.00 21.13 H new ATOM 0 HG11 VAL A 65 -2.348 1.392 4.784 1.00 24.02 H new ATOM 0 HG12 VAL A 65 -2.548 1.875 3.083 1.00 24.02 H new ATOM 0 HG13 VAL A 65 -3.741 0.799 3.849 1.00 24.02 H new ATOM 0 HG21 VAL A 65 -1.619 -0.839 5.372 1.00 1.32 H new ATOM 0 HG22 VAL A 65 -2.947 -1.622 4.483 1.00 1.32 H new ATOM 0 HG23 VAL A 65 -1.258 -2.049 4.118 1.00 1.32 H new ATOM 1026 N ALA A 66 -2.977 1.062 0.451 1.00 45.14 N ATOM 1027 CA ALA A 66 -2.799 2.224 -0.363 1.00 62.54 C ATOM 1028 C ALA A 66 -2.731 3.384 0.599 1.00 63.42 C ATOM 1029 O ALA A 66 -3.626 3.532 1.452 1.00 51.12 O ATOM 1030 CB ALA A 66 -3.972 2.371 -1.318 1.00 21.15 C ATOM 0 H ALA A 66 -3.951 0.791 0.588 1.00 45.14 H new ATOM 0 HA ALA A 66 -1.899 2.168 -0.975 1.00 62.54 H new ATOM 0 HB1 ALA A 66 -3.830 3.258 -1.935 1.00 21.15 H new ATOM 0 HB2 ALA A 66 -4.033 1.490 -1.957 1.00 21.15 H new ATOM 0 HB3 ALA A 66 -4.895 2.470 -0.747 1.00 21.15 H new ATOM 1036 N PHE A 67 -1.674 4.161 0.543 1.00 51.30 N ATOM 1037 CA PHE A 67 -1.531 5.229 1.493 1.00 12.54 C ATOM 1038 C PHE A 67 -0.932 6.483 0.850 1.00 32.21 C ATOM 1039 O PHE A 67 -0.046 6.402 -0.012 1.00 20.12 O ATOM 1040 CB PHE A 67 -0.669 4.750 2.670 1.00 24.43 C ATOM 1041 CG PHE A 67 -0.716 5.641 3.873 1.00 53.13 C ATOM 1042 CD1 PHE A 67 -1.777 5.563 4.751 1.00 33.44 C ATOM 1043 CD2 PHE A 67 0.289 6.545 4.130 1.00 42.13 C ATOM 1044 CE1 PHE A 67 -1.835 6.369 5.863 1.00 21.25 C ATOM 1045 CE2 PHE A 67 0.232 7.353 5.242 1.00 52.44 C ATOM 1046 CZ PHE A 67 -0.829 7.265 6.106 1.00 5.11 C ATOM 0 H PHE A 67 -0.918 4.074 -0.136 1.00 51.30 H new ATOM 0 HA PHE A 67 -2.521 5.503 1.858 1.00 12.54 H new ATOM 0 HB2 PHE A 67 -0.994 3.751 2.960 1.00 24.43 H new ATOM 0 HB3 PHE A 67 0.365 4.664 2.336 1.00 24.43 H new ATOM 0 HD1 PHE A 67 -2.574 4.859 4.562 1.00 33.44 H new ATOM 0 HD2 PHE A 67 1.128 6.621 3.454 1.00 42.13 H new ATOM 0 HE1 PHE A 67 -2.671 6.296 6.543 1.00 21.25 H new ATOM 0 HE2 PHE A 67 1.026 8.059 5.435 1.00 52.44 H new ATOM 0 HZ PHE A 67 -0.871 7.902 6.977 1.00 5.11 H new ATOM 1056 N ASP A 68 -1.453 7.614 1.250 1.00 64.31 N ATOM 1057 CA ASP A 68 -0.972 8.925 0.817 1.00 31.20 C ATOM 1058 C ASP A 68 0.222 9.355 1.654 1.00 11.32 C ATOM 1059 O ASP A 68 0.119 9.532 2.866 1.00 41.34 O ATOM 1060 CB ASP A 68 -2.108 9.947 0.912 1.00 5.41 C ATOM 1061 CG ASP A 68 -1.656 11.392 0.853 1.00 44.11 C ATOM 1062 OD1 ASP A 68 -1.260 11.861 -0.214 1.00 74.34 O ATOM 1063 OD2 ASP A 68 -1.770 12.105 1.874 1.00 34.24 O ATOM 0 H ASP A 68 -2.239 7.664 1.898 1.00 64.31 H new ATOM 0 HA ASP A 68 -0.646 8.864 -0.221 1.00 31.20 H new ATOM 0 HB2 ASP A 68 -2.812 9.766 0.100 1.00 5.41 H new ATOM 0 HB3 ASP A 68 -2.648 9.786 1.845 1.00 5.41 H new ATOM 1068 N PHE A 69 1.338 9.501 1.020 1.00 75.34 N ATOM 1069 CA PHE A 69 2.565 9.839 1.686 1.00 13.33 C ATOM 1070 C PHE A 69 2.899 11.297 1.442 1.00 24.45 C ATOM 1071 O PHE A 69 3.026 11.718 0.308 1.00 64.00 O ATOM 1072 CB PHE A 69 3.695 8.939 1.157 1.00 40.01 C ATOM 1073 CG PHE A 69 5.027 9.139 1.822 1.00 62.54 C ATOM 1074 CD1 PHE A 69 5.316 8.501 3.008 1.00 32.02 C ATOM 1075 CD2 PHE A 69 5.987 9.967 1.263 1.00 60.21 C ATOM 1076 CE1 PHE A 69 6.526 8.678 3.632 1.00 35.12 C ATOM 1077 CE2 PHE A 69 7.202 10.144 1.883 1.00 33.32 C ATOM 1078 CZ PHE A 69 7.466 9.498 3.070 1.00 14.13 C ATOM 0 H PHE A 69 1.431 9.389 0.010 1.00 75.34 H new ATOM 0 HA PHE A 69 2.453 9.682 2.759 1.00 13.33 H new ATOM 0 HB2 PHE A 69 3.397 7.898 1.279 1.00 40.01 H new ATOM 0 HB3 PHE A 69 3.809 9.115 0.087 1.00 40.01 H new ATOM 0 HD1 PHE A 69 4.578 7.851 3.455 1.00 32.02 H new ATOM 0 HD2 PHE A 69 5.780 10.477 0.334 1.00 60.21 H new ATOM 0 HE1 PHE A 69 6.735 8.172 4.563 1.00 35.12 H new ATOM 0 HE2 PHE A 69 7.947 10.788 1.440 1.00 33.32 H new ATOM 0 HZ PHE A 69 8.418 9.639 3.559 1.00 14.13 H new ATOM 1088 N GLU A 70 3.046 12.049 2.490 1.00 41.43 N ATOM 1089 CA GLU A 70 3.407 13.441 2.379 1.00 42.43 C ATOM 1090 C GLU A 70 4.698 13.665 3.111 1.00 65.11 C ATOM 1091 O GLU A 70 4.925 13.086 4.189 1.00 33.04 O ATOM 1092 CB GLU A 70 2.333 14.354 2.964 1.00 24.21 C ATOM 1093 CG GLU A 70 0.970 14.199 2.335 1.00 23.30 C ATOM 1094 CD GLU A 70 -0.018 15.175 2.890 1.00 21.13 C ATOM 1095 OE1 GLU A 70 -0.241 15.194 4.108 1.00 72.32 O ATOM 1096 OE2 GLU A 70 -0.631 15.932 2.120 1.00 1.44 O ATOM 0 H GLU A 70 2.921 11.721 3.448 1.00 41.43 H new ATOM 0 HA GLU A 70 3.512 13.684 1.322 1.00 42.43 H new ATOM 0 HB2 GLU A 70 2.250 14.158 4.033 1.00 24.21 H new ATOM 0 HB3 GLU A 70 2.655 15.390 2.854 1.00 24.21 H new ATOM 0 HG2 GLU A 70 1.050 14.338 1.257 1.00 23.30 H new ATOM 0 HG3 GLU A 70 0.608 13.184 2.499 1.00 23.30 H new ATOM 1103 N TYR A 71 5.547 14.460 2.554 1.00 20.20 N ATOM 1104 CA TYR A 71 6.809 14.754 3.188 1.00 2.42 C ATOM 1105 C TYR A 71 7.259 16.119 2.741 1.00 64.10 C ATOM 1106 O TYR A 71 6.576 16.758 1.916 1.00 73.10 O ATOM 1107 CB TYR A 71 7.876 13.680 2.838 1.00 71.04 C ATOM 1108 CG TYR A 71 8.382 13.716 1.404 1.00 63.11 C ATOM 1109 CD1 TYR A 71 7.561 13.388 0.330 1.00 0.24 C ATOM 1110 CD2 TYR A 71 9.691 14.082 1.136 1.00 12.51 C ATOM 1111 CE1 TYR A 71 8.034 13.434 -0.962 1.00 13.15 C ATOM 1112 CE2 TYR A 71 10.169 14.128 -0.151 1.00 50.42 C ATOM 1113 CZ TYR A 71 9.339 13.807 -1.195 1.00 31.21 C ATOM 1114 OH TYR A 71 9.814 13.858 -2.482 1.00 44.03 O ATOM 0 H TYR A 71 5.399 14.925 1.658 1.00 20.20 H new ATOM 0 HA TYR A 71 6.684 14.741 4.271 1.00 2.42 H new ATOM 0 HB2 TYR A 71 8.726 13.802 3.510 1.00 71.04 H new ATOM 0 HB3 TYR A 71 7.454 12.694 3.033 1.00 71.04 H new ATOM 0 HD1 TYR A 71 6.538 13.093 0.512 1.00 0.24 H new ATOM 0 HD2 TYR A 71 10.348 14.336 1.955 1.00 12.51 H new ATOM 0 HE1 TYR A 71 7.386 13.179 -1.787 1.00 13.15 H new ATOM 0 HE2 TYR A 71 11.193 14.415 -0.340 1.00 50.42 H new ATOM 0 HH TYR A 71 9.189 14.364 -3.042 1.00 44.03 H new ATOM 1124 N ASN A 72 8.373 16.572 3.260 1.00 13.52 N ATOM 1125 CA ASN A 72 8.917 17.842 2.861 1.00 21.22 C ATOM 1126 C ASN A 72 9.602 17.694 1.511 1.00 64.31 C ATOM 1127 O ASN A 72 10.749 17.247 1.410 1.00 25.11 O ATOM 1128 CB ASN A 72 9.888 18.382 3.902 1.00 55.43 C ATOM 1129 CG ASN A 72 10.402 19.751 3.543 1.00 24.34 C ATOM 1130 OD1 ASN A 72 9.717 20.527 2.901 1.00 64.11 O ATOM 1131 ND2 ASN A 72 11.590 20.060 3.962 1.00 32.33 N ATOM 0 H ASN A 72 8.921 16.076 3.963 1.00 13.52 H new ATOM 0 HA ASN A 72 8.102 18.561 2.776 1.00 21.22 H new ATOM 0 HB2 ASN A 72 9.392 18.425 4.872 1.00 55.43 H new ATOM 0 HB3 ASN A 72 10.728 17.695 4.004 1.00 55.43 H new ATOM 0 HD21 ASN A 72 11.980 20.980 3.756 1.00 32.33 H new ATOM 0 HD22 ASN A 72 12.134 19.383 4.497 1.00 32.33 H new ATOM 1138 N ASP A 73 8.875 18.023 0.497 1.00 53.40 N ATOM 1139 CA ASP A 73 9.288 17.899 -0.876 1.00 72.33 C ATOM 1140 C ASP A 73 9.693 19.275 -1.374 1.00 10.11 C ATOM 1141 O ASP A 73 8.835 20.136 -1.606 1.00 44.32 O ATOM 1142 CB ASP A 73 8.098 17.371 -1.702 1.00 0.14 C ATOM 1143 CG ASP A 73 8.424 17.002 -3.137 1.00 43.10 C ATOM 1144 OD1 ASP A 73 8.794 17.877 -3.939 1.00 10.33 O ATOM 1145 OD2 ASP A 73 8.297 15.805 -3.494 1.00 34.13 O ATOM 0 H ASP A 73 7.934 18.403 0.598 1.00 53.40 H new ATOM 0 HA ASP A 73 10.127 17.210 -0.972 1.00 72.33 H new ATOM 0 HB2 ASP A 73 7.689 16.493 -1.201 1.00 0.14 H new ATOM 0 HB3 ASP A 73 7.315 18.129 -1.707 1.00 0.14 H new ATOM 1150 N ALA A 74 10.996 19.513 -1.412 1.00 51.34 N ATOM 1151 CA ALA A 74 11.597 20.764 -1.910 1.00 35.11 C ATOM 1152 C ALA A 74 11.239 21.980 -1.047 1.00 15.51 C ATOM 1153 O ALA A 74 11.423 23.125 -1.467 1.00 34.44 O ATOM 1154 CB ALA A 74 11.232 21.009 -3.372 1.00 13.21 C ATOM 0 H ALA A 74 11.688 18.835 -1.093 1.00 51.34 H new ATOM 0 HA ALA A 74 12.677 20.635 -1.840 1.00 35.11 H new ATOM 0 HB1 ALA A 74 11.690 21.939 -3.710 1.00 13.21 H new ATOM 0 HB2 ALA A 74 11.596 20.182 -3.982 1.00 13.21 H new ATOM 0 HB3 ALA A 74 10.149 21.082 -3.469 1.00 13.21 H new ATOM 1160 N GLY A 75 10.823 21.735 0.174 1.00 61.33 N ATOM 1161 CA GLY A 75 10.449 22.818 1.058 1.00 62.11 C ATOM 1162 C GLY A 75 8.944 22.987 1.167 1.00 54.20 C ATOM 1163 O GLY A 75 8.455 23.857 1.889 1.00 3.43 O ATOM 0 H GLY A 75 10.735 20.802 0.577 1.00 61.33 H new ATOM 0 HA2 GLY A 75 10.863 22.633 2.049 1.00 62.11 H new ATOM 0 HA3 GLY A 75 10.890 23.747 0.696 1.00 62.11 H new ATOM 1167 N SER A 76 8.206 22.159 0.470 1.00 72.11 N ATOM 1168 CA SER A 76 6.769 22.180 0.537 1.00 52.42 C ATOM 1169 C SER A 76 6.271 20.783 0.874 1.00 71.34 C ATOM 1170 O SER A 76 6.932 19.813 0.576 1.00 12.12 O ATOM 1171 CB SER A 76 6.214 22.594 -0.811 1.00 22.00 C ATOM 1172 OG SER A 76 6.803 23.801 -1.257 1.00 23.11 O ATOM 0 H SER A 76 8.586 21.452 -0.159 1.00 72.11 H new ATOM 0 HA SER A 76 6.443 22.886 1.301 1.00 52.42 H new ATOM 0 HB2 SER A 76 6.397 21.805 -1.541 1.00 22.00 H new ATOM 0 HB3 SER A 76 5.133 22.718 -0.740 1.00 22.00 H new ATOM 0 HG SER A 76 6.429 24.045 -2.129 1.00 23.11 H new ATOM 1178 N LYS A 77 5.141 20.668 1.504 1.00 64.43 N ATOM 1179 CA LYS A 77 4.593 19.353 1.740 1.00 52.34 C ATOM 1180 C LYS A 77 3.825 18.901 0.526 1.00 3.14 C ATOM 1181 O LYS A 77 2.795 19.472 0.187 1.00 11.22 O ATOM 1182 CB LYS A 77 3.736 19.269 3.016 1.00 4.13 C ATOM 1183 CG LYS A 77 4.523 18.958 4.300 1.00 34.13 C ATOM 1184 CD LYS A 77 5.538 20.031 4.687 1.00 61.01 C ATOM 1185 CE LYS A 77 4.865 21.329 5.094 1.00 23.44 C ATOM 1186 NZ LYS A 77 5.841 22.321 5.583 1.00 12.40 N ATOM 0 H LYS A 77 4.585 21.446 1.860 1.00 64.43 H new ATOM 0 HA LYS A 77 5.430 18.676 1.911 1.00 52.34 H new ATOM 0 HB2 LYS A 77 3.212 20.215 3.148 1.00 4.13 H new ATOM 0 HB3 LYS A 77 2.976 18.500 2.877 1.00 4.13 H new ATOM 0 HG2 LYS A 77 3.819 18.827 5.122 1.00 34.13 H new ATOM 0 HG3 LYS A 77 5.045 18.009 4.172 1.00 34.13 H new ATOM 0 HD2 LYS A 77 6.153 19.668 5.510 1.00 61.01 H new ATOM 0 HD3 LYS A 77 6.207 20.217 3.847 1.00 61.01 H new ATOM 0 HE2 LYS A 77 4.324 21.741 4.242 1.00 23.44 H new ATOM 0 HE3 LYS A 77 4.129 21.129 5.873 1.00 23.44 H new ATOM 0 HZ1 LYS A 77 5.344 23.194 5.851 1.00 12.40 H new ATOM 0 HZ2 LYS A 77 6.340 21.938 6.411 1.00 12.40 H new ATOM 0 HZ3 LYS A 77 6.528 22.531 4.831 1.00 12.40 H new ATOM 1200 N ARG A 78 4.363 17.930 -0.157 1.00 53.20 N ATOM 1201 CA ARG A 78 3.744 17.395 -1.348 1.00 33.45 C ATOM 1202 C ARG A 78 3.528 15.916 -1.144 1.00 70.30 C ATOM 1203 O ARG A 78 4.266 15.279 -0.357 1.00 21.41 O ATOM 1204 CB ARG A 78 4.620 17.647 -2.594 1.00 55.33 C ATOM 1205 CG ARG A 78 4.906 19.125 -2.895 1.00 43.41 C ATOM 1206 CD ARG A 78 3.628 19.894 -3.206 1.00 13.12 C ATOM 1207 NE ARG A 78 3.873 21.319 -3.484 1.00 62.14 N ATOM 1208 CZ ARG A 78 2.907 22.224 -3.740 1.00 43.15 C ATOM 1209 NH1 ARG A 78 1.632 21.850 -3.770 1.00 31.14 N ATOM 1210 NH2 ARG A 78 3.216 23.496 -3.957 1.00 72.23 N ATOM 0 H ARG A 78 5.245 17.483 0.093 1.00 53.20 H new ATOM 0 HA ARG A 78 2.790 17.895 -1.518 1.00 33.45 H new ATOM 0 HB2 ARG A 78 5.569 17.128 -2.464 1.00 55.33 H new ATOM 0 HB3 ARG A 78 4.130 17.203 -3.461 1.00 55.33 H new ATOM 0 HG2 ARG A 78 5.406 19.580 -2.040 1.00 43.41 H new ATOM 0 HG3 ARG A 78 5.590 19.199 -3.741 1.00 43.41 H new ATOM 0 HD2 ARG A 78 3.136 19.440 -4.066 1.00 13.12 H new ATOM 0 HD3 ARG A 78 2.942 19.806 -2.364 1.00 13.12 H new ATOM 0 HE ARG A 78 4.840 21.644 -3.483 1.00 62.14 H new ATOM 0 HH11 ARG A 78 1.382 20.876 -3.599 1.00 31.14 H new ATOM 0 HH12 ARG A 78 0.903 22.537 -3.964 1.00 31.14 H new ATOM 0 HH21 ARG A 78 4.191 23.796 -3.931 1.00 72.23 H new ATOM 0 HH22 ARG A 78 2.479 24.174 -4.150 1.00 72.23 H new ATOM 1224 N GLU A 79 2.552 15.364 -1.831 1.00 2.11 N ATOM 1225 CA GLU A 79 2.210 13.971 -1.668 1.00 23.52 C ATOM 1226 C GLU A 79 2.831 13.073 -2.710 1.00 43.22 C ATOM 1227 O GLU A 79 3.342 13.536 -3.743 1.00 55.43 O ATOM 1228 CB GLU A 79 0.697 13.714 -1.612 1.00 51.21 C ATOM 1229 CG GLU A 79 -0.129 14.217 -2.783 1.00 45.01 C ATOM 1230 CD GLU A 79 -0.285 15.692 -2.752 1.00 31.54 C ATOM 1231 OE1 GLU A 79 -1.030 16.195 -1.883 1.00 71.12 O ATOM 1232 OE2 GLU A 79 0.348 16.387 -3.575 1.00 15.00 O ATOM 0 H GLU A 79 1.979 15.863 -2.511 1.00 2.11 H new ATOM 0 HA GLU A 79 2.636 13.715 -0.698 1.00 23.52 H new ATOM 0 HB2 GLU A 79 0.539 12.639 -1.522 1.00 51.21 H new ATOM 0 HB3 GLU A 79 0.309 14.171 -0.702 1.00 51.21 H new ATOM 0 HG2 GLU A 79 0.347 13.921 -3.718 1.00 45.01 H new ATOM 0 HG3 GLU A 79 -1.112 13.747 -2.763 1.00 45.01 H new ATOM 1239 N LYS A 80 2.839 11.810 -2.373 1.00 25.41 N ATOM 1240 CA LYS A 80 3.250 10.692 -3.188 1.00 62.21 C ATOM 1241 C LYS A 80 2.340 9.554 -2.769 1.00 51.31 C ATOM 1242 O LYS A 80 1.983 9.462 -1.605 1.00 14.21 O ATOM 1243 CB LYS A 80 4.715 10.299 -2.898 1.00 73.15 C ATOM 1244 CG LYS A 80 5.736 11.396 -3.163 1.00 63.11 C ATOM 1245 CD LYS A 80 5.834 11.750 -4.640 1.00 3.21 C ATOM 1246 CE LYS A 80 6.783 12.916 -4.857 1.00 2.15 C ATOM 1247 NZ LYS A 80 6.295 14.157 -4.208 1.00 40.14 N ATOM 0 H LYS A 80 2.534 11.511 -1.447 1.00 25.41 H new ATOM 0 HA LYS A 80 3.184 10.930 -4.250 1.00 62.21 H new ATOM 0 HB2 LYS A 80 4.794 9.993 -1.855 1.00 73.15 H new ATOM 0 HB3 LYS A 80 4.970 9.431 -3.505 1.00 73.15 H new ATOM 0 HG2 LYS A 80 5.465 12.286 -2.596 1.00 63.11 H new ATOM 0 HG3 LYS A 80 6.713 11.074 -2.803 1.00 63.11 H new ATOM 0 HD2 LYS A 80 6.181 10.884 -5.203 1.00 3.21 H new ATOM 0 HD3 LYS A 80 4.846 12.004 -5.023 1.00 3.21 H new ATOM 0 HE2 LYS A 80 7.766 12.662 -4.461 1.00 2.15 H new ATOM 0 HE3 LYS A 80 6.905 13.090 -5.926 1.00 2.15 H new ATOM 0 HZ1 LYS A 80 6.095 14.873 -4.935 1.00 40.14 H new ATOM 0 HZ2 LYS A 80 5.426 13.951 -3.675 1.00 40.14 H new ATOM 0 HZ3 LYS A 80 7.022 14.518 -3.558 1.00 40.14 H new ATOM 1261 N LEU A 81 1.944 8.734 -3.670 1.00 23.22 N ATOM 1262 CA LEU A 81 1.026 7.668 -3.352 1.00 5.14 C ATOM 1263 C LEU A 81 1.779 6.363 -3.251 1.00 61.55 C ATOM 1264 O LEU A 81 2.354 5.903 -4.220 1.00 72.13 O ATOM 1265 CB LEU A 81 -0.099 7.571 -4.404 1.00 13.00 C ATOM 1266 CG LEU A 81 -1.042 8.793 -4.556 1.00 24.33 C ATOM 1267 CD1 LEU A 81 -0.352 10.003 -5.176 1.00 2.34 C ATOM 1268 CD2 LEU A 81 -2.242 8.422 -5.372 1.00 3.34 C ATOM 0 H LEU A 81 2.236 8.769 -4.647 1.00 23.22 H new ATOM 0 HA LEU A 81 0.559 7.884 -2.391 1.00 5.14 H new ATOM 0 HB2 LEU A 81 0.362 7.379 -5.373 1.00 13.00 H new ATOM 0 HB3 LEU A 81 -0.711 6.701 -4.164 1.00 13.00 H new ATOM 0 HG LEU A 81 -1.348 9.078 -3.549 1.00 24.33 H new ATOM 0 HD11 LEU A 81 -1.063 10.826 -5.256 1.00 2.34 H new ATOM 0 HD12 LEU A 81 0.485 10.307 -4.547 1.00 2.34 H new ATOM 0 HD13 LEU A 81 0.016 9.743 -6.169 1.00 2.34 H new ATOM 0 HD21 LEU A 81 -2.896 9.288 -5.472 1.00 3.34 H new ATOM 0 HD22 LEU A 81 -1.922 8.093 -6.361 1.00 3.34 H new ATOM 0 HD23 LEU A 81 -2.782 7.614 -4.878 1.00 3.34 H new ATOM 1280 N ILE A 82 1.787 5.766 -2.094 1.00 51.02 N ATOM 1281 CA ILE A 82 2.553 4.556 -1.889 1.00 31.11 C ATOM 1282 C ILE A 82 1.651 3.346 -1.682 1.00 62.31 C ATOM 1283 O ILE A 82 0.569 3.451 -1.091 1.00 62.23 O ATOM 1284 CB ILE A 82 3.570 4.697 -0.717 1.00 23.33 C ATOM 1285 CG1 ILE A 82 2.855 5.094 0.592 1.00 72.24 C ATOM 1286 CG2 ILE A 82 4.665 5.703 -1.077 1.00 62.31 C ATOM 1287 CD1 ILE A 82 3.778 5.297 1.777 1.00 42.20 C ATOM 0 H ILE A 82 1.274 6.092 -1.275 1.00 51.02 H new ATOM 0 HA ILE A 82 3.126 4.394 -2.802 1.00 31.11 H new ATOM 0 HB ILE A 82 4.041 3.728 -0.553 1.00 23.33 H new ATOM 0 HG12 ILE A 82 2.296 6.014 0.421 1.00 72.24 H new ATOM 0 HG13 ILE A 82 2.128 4.322 0.842 1.00 72.24 H new ATOM 0 HG21 ILE A 82 5.367 5.789 -0.247 1.00 62.31 H new ATOM 0 HG22 ILE A 82 5.195 5.362 -1.966 1.00 62.31 H new ATOM 0 HG23 ILE A 82 4.215 6.676 -1.274 1.00 62.31 H new ATOM 0 HD11 ILE A 82 3.191 5.573 2.653 1.00 42.20 H new ATOM 0 HD12 ILE A 82 4.318 4.372 1.980 1.00 42.20 H new ATOM 0 HD13 ILE A 82 4.490 6.091 1.552 1.00 42.20 H new ATOM 1299 N LEU A 83 2.076 2.220 -2.205 1.00 44.45 N ATOM 1300 CA LEU A 83 1.337 0.987 -2.082 1.00 44.22 C ATOM 1301 C LEU A 83 2.163 0.060 -1.176 1.00 11.31 C ATOM 1302 O LEU A 83 3.135 -0.555 -1.630 1.00 3.41 O ATOM 1303 CB LEU A 83 1.156 0.387 -3.503 1.00 14.34 C ATOM 1304 CG LEU A 83 0.065 -0.681 -3.735 1.00 3.33 C ATOM 1305 CD1 LEU A 83 0.039 -1.070 -5.200 1.00 25.33 C ATOM 1306 CD2 LEU A 83 0.281 -1.919 -2.895 1.00 64.44 C ATOM 0 H LEU A 83 2.947 2.134 -2.729 1.00 44.45 H new ATOM 0 HA LEU A 83 0.348 1.130 -1.647 1.00 44.22 H new ATOM 0 HB2 LEU A 83 0.957 1.213 -4.185 1.00 14.34 H new ATOM 0 HB3 LEU A 83 2.110 -0.049 -3.800 1.00 14.34 H new ATOM 0 HG LEU A 83 -0.887 -0.242 -3.437 1.00 3.33 H new ATOM 0 HD11 LEU A 83 -0.731 -1.824 -5.363 1.00 25.33 H new ATOM 0 HD12 LEU A 83 -0.180 -0.191 -5.806 1.00 25.33 H new ATOM 0 HD13 LEU A 83 1.010 -1.475 -5.486 1.00 25.33 H new ATOM 0 HD21 LEU A 83 -0.513 -2.638 -3.096 1.00 64.44 H new ATOM 0 HD22 LEU A 83 1.245 -2.364 -3.144 1.00 64.44 H new ATOM 0 HD23 LEU A 83 0.268 -1.649 -1.839 1.00 64.44 H new ATOM 1318 N ILE A 84 1.776 -0.023 0.087 1.00 23.51 N ATOM 1319 CA ILE A 84 2.540 -0.750 1.105 1.00 50.12 C ATOM 1320 C ILE A 84 2.241 -2.231 1.072 1.00 70.23 C ATOM 1321 O ILE A 84 1.242 -2.665 1.598 1.00 2.21 O ATOM 1322 CB ILE A 84 2.207 -0.240 2.537 1.00 22.25 C ATOM 1323 CG1 ILE A 84 2.477 1.264 2.687 1.00 13.43 C ATOM 1324 CG2 ILE A 84 2.978 -1.035 3.591 1.00 11.04 C ATOM 1325 CD1 ILE A 84 3.922 1.661 2.457 1.00 0.44 C ATOM 0 H ILE A 84 0.923 0.410 0.442 1.00 23.51 H new ATOM 0 HA ILE A 84 3.591 -0.574 0.875 1.00 50.12 H new ATOM 0 HB ILE A 84 1.140 -0.397 2.696 1.00 22.25 H new ATOM 0 HG12 ILE A 84 1.846 1.807 1.983 1.00 13.43 H new ATOM 0 HG13 ILE A 84 2.181 1.577 3.688 1.00 13.43 H new ATOM 0 HG21 ILE A 84 2.729 -0.660 4.584 1.00 11.04 H new ATOM 0 HG22 ILE A 84 2.707 -2.089 3.522 1.00 11.04 H new ATOM 0 HG23 ILE A 84 4.049 -0.924 3.419 1.00 11.04 H new ATOM 0 HD11 ILE A 84 4.028 2.739 2.582 1.00 0.44 H new ATOM 0 HD12 ILE A 84 4.559 1.148 3.177 1.00 0.44 H new ATOM 0 HD13 ILE A 84 4.220 1.382 1.446 1.00 0.44 H new ATOM 1337 N GLN A 85 3.108 -2.971 0.470 1.00 4.42 N ATOM 1338 CA GLN A 85 3.027 -4.395 0.385 1.00 54.12 C ATOM 1339 C GLN A 85 3.771 -5.044 1.515 1.00 42.21 C ATOM 1340 O GLN A 85 4.995 -5.087 1.512 1.00 33.10 O ATOM 1341 CB GLN A 85 3.621 -4.848 -0.926 1.00 72.11 C ATOM 1342 CG GLN A 85 2.875 -4.344 -2.125 1.00 32.32 C ATOM 1343 CD GLN A 85 3.645 -4.519 -3.390 1.00 33.44 C ATOM 1344 OE1 GLN A 85 4.469 -5.418 -3.520 1.00 14.02 O ATOM 1345 NE2 GLN A 85 3.384 -3.675 -4.333 1.00 23.24 N ATOM 0 H GLN A 85 3.929 -2.587 0.003 1.00 4.42 H new ATOM 0 HA GLN A 85 1.979 -4.687 0.447 1.00 54.12 H new ATOM 0 HB2 GLN A 85 4.656 -4.510 -0.983 1.00 72.11 H new ATOM 0 HB3 GLN A 85 3.639 -5.938 -0.951 1.00 72.11 H new ATOM 0 HG2 GLN A 85 1.924 -4.871 -2.206 1.00 32.32 H new ATOM 0 HG3 GLN A 85 2.643 -3.288 -1.987 1.00 32.32 H new ATOM 0 HE21 GLN A 85 2.691 -2.942 -4.184 1.00 23.24 H new ATOM 0 HE22 GLN A 85 3.871 -3.742 -5.227 1.00 23.24 H new ATOM 1354 N TRP A 86 3.027 -5.504 2.468 1.00 62.14 N ATOM 1355 CA TRP A 86 3.557 -6.270 3.574 1.00 43.24 C ATOM 1356 C TRP A 86 3.759 -7.707 3.084 1.00 54.11 C ATOM 1357 O TRP A 86 2.807 -8.345 2.624 1.00 52.25 O ATOM 1358 CB TRP A 86 2.553 -6.334 4.734 1.00 21.13 C ATOM 1359 CG TRP A 86 2.060 -5.031 5.314 1.00 52.20 C ATOM 1360 CD1 TRP A 86 1.253 -4.115 4.715 1.00 4.40 C ATOM 1361 CD2 TRP A 86 2.277 -4.553 6.649 1.00 25.34 C ATOM 1362 NE1 TRP A 86 0.967 -3.093 5.583 1.00 23.23 N ATOM 1363 CE2 TRP A 86 1.582 -3.336 6.776 1.00 1.24 C ATOM 1364 CE3 TRP A 86 2.996 -5.032 7.745 1.00 5.21 C ATOM 1365 CZ2 TRP A 86 1.579 -2.599 7.956 1.00 12.43 C ATOM 1366 CZ3 TRP A 86 2.993 -4.302 8.913 1.00 20.12 C ATOM 1367 CH2 TRP A 86 2.289 -3.099 9.013 1.00 12.31 C ATOM 0 H TRP A 86 2.018 -5.362 2.510 1.00 62.14 H new ATOM 0 HA TRP A 86 4.480 -5.802 3.916 1.00 43.24 H new ATOM 0 HB2 TRP A 86 1.685 -6.898 4.394 1.00 21.13 H new ATOM 0 HB3 TRP A 86 3.010 -6.907 5.541 1.00 21.13 H new ATOM 0 HD1 TRP A 86 0.889 -4.183 3.700 1.00 4.40 H new ATOM 0 HE1 TRP A 86 0.387 -2.281 5.371 1.00 23.23 H new ATOM 0 HE3 TRP A 86 3.545 -5.959 7.678 1.00 5.21 H new ATOM 0 HZ2 TRP A 86 1.037 -1.668 8.034 1.00 12.43 H new ATOM 0 HZ3 TRP A 86 3.545 -4.666 9.767 1.00 20.12 H new ATOM 0 HH2 TRP A 86 2.306 -2.553 9.944 1.00 12.31 H new ATOM 1378 N ILE A 87 4.971 -8.192 3.135 1.00 15.00 N ATOM 1379 CA ILE A 87 5.245 -9.562 2.732 1.00 21.02 C ATOM 1380 C ILE A 87 5.684 -10.388 3.959 1.00 5.54 C ATOM 1381 O ILE A 87 6.837 -10.291 4.416 1.00 15.35 O ATOM 1382 CB ILE A 87 6.328 -9.646 1.605 1.00 73.32 C ATOM 1383 CG1 ILE A 87 5.933 -8.788 0.375 1.00 43.24 C ATOM 1384 CG2 ILE A 87 6.563 -11.101 1.181 1.00 24.40 C ATOM 1385 CD1 ILE A 87 4.632 -9.199 -0.308 1.00 14.20 C ATOM 0 H ILE A 87 5.788 -7.668 3.449 1.00 15.00 H new ATOM 0 HA ILE A 87 4.324 -9.975 2.320 1.00 21.02 H new ATOM 0 HB ILE A 87 7.256 -9.246 2.014 1.00 73.32 H new ATOM 0 HG12 ILE A 87 5.848 -7.748 0.689 1.00 43.24 H new ATOM 0 HG13 ILE A 87 6.740 -8.835 -0.356 1.00 43.24 H new ATOM 0 HG21 ILE A 87 7.319 -11.134 0.397 1.00 24.40 H new ATOM 0 HG22 ILE A 87 6.905 -11.679 2.039 1.00 24.40 H new ATOM 0 HG23 ILE A 87 5.632 -11.525 0.805 1.00 24.40 H new ATOM 0 HD11 ILE A 87 4.442 -8.540 -1.155 1.00 14.20 H new ATOM 0 HD12 ILE A 87 4.715 -10.228 -0.659 1.00 14.20 H new ATOM 0 HD13 ILE A 87 3.809 -9.123 0.402 1.00 14.20 H new ATOM 1397 N PRO A 88 4.756 -11.162 4.547 1.00 35.10 N ATOM 1398 CA PRO A 88 5.037 -11.973 5.720 1.00 12.34 C ATOM 1399 C PRO A 88 5.555 -13.365 5.380 1.00 63.13 C ATOM 1400 O PRO A 88 4.898 -14.131 4.661 1.00 0.33 O ATOM 1401 CB PRO A 88 3.672 -12.108 6.384 1.00 4.44 C ATOM 1402 CG PRO A 88 2.660 -11.946 5.283 1.00 21.14 C ATOM 1403 CD PRO A 88 3.363 -11.306 4.106 1.00 42.44 C ATOM 0 HA PRO A 88 5.811 -11.514 6.335 1.00 12.34 H new ATOM 0 HB2 PRO A 88 3.568 -13.078 6.870 1.00 4.44 H new ATOM 0 HB3 PRO A 88 3.536 -11.349 7.155 1.00 4.44 H new ATOM 0 HG2 PRO A 88 2.243 -12.913 5.001 1.00 21.14 H new ATOM 0 HG3 PRO A 88 1.828 -11.325 5.616 1.00 21.14 H new ATOM 0 HD2 PRO A 88 3.291 -11.928 3.214 1.00 42.44 H new ATOM 0 HD3 PRO A 88 2.923 -10.340 3.858 1.00 42.44 H new ATOM 1411 N ASP A 89 6.710 -13.717 5.903 1.00 23.40 N ATOM 1412 CA ASP A 89 7.212 -15.068 5.690 1.00 73.42 C ATOM 1413 C ASP A 89 6.542 -16.056 6.641 1.00 22.41 C ATOM 1414 O ASP A 89 6.434 -17.243 6.360 1.00 73.02 O ATOM 1415 CB ASP A 89 8.732 -15.170 5.816 1.00 10.40 C ATOM 1416 CG ASP A 89 9.221 -16.572 5.469 1.00 43.21 C ATOM 1417 OD1 ASP A 89 9.237 -16.930 4.268 1.00 25.34 O ATOM 1418 OD2 ASP A 89 9.590 -17.341 6.376 1.00 63.51 O ATOM 0 H ASP A 89 7.308 -13.111 6.464 1.00 23.40 H new ATOM 0 HA ASP A 89 6.958 -15.325 4.662 1.00 73.42 H new ATOM 0 HB2 ASP A 89 9.204 -14.443 5.155 1.00 10.40 H new ATOM 0 HB3 ASP A 89 9.033 -14.918 6.833 1.00 10.40 H new ATOM 1423 N THR A 90 6.013 -15.530 7.716 1.00 72.33 N ATOM 1424 CA THR A 90 5.500 -16.336 8.818 1.00 65.10 C ATOM 1425 C THR A 90 4.007 -16.624 8.694 1.00 4.31 C ATOM 1426 O THR A 90 3.345 -17.041 9.660 1.00 12.35 O ATOM 1427 CB THR A 90 5.792 -15.625 10.144 1.00 10.41 C ATOM 1428 OG1 THR A 90 5.368 -14.252 10.045 1.00 41.22 O ATOM 1429 CG2 THR A 90 7.276 -15.672 10.455 1.00 54.31 C ATOM 0 H THR A 90 5.921 -14.525 7.862 1.00 72.33 H new ATOM 0 HA THR A 90 6.008 -17.300 8.785 1.00 65.10 H new ATOM 0 HB THR A 90 5.250 -16.128 10.945 1.00 10.41 H new ATOM 0 HG1 THR A 90 5.550 -13.792 10.891 1.00 41.22 H new ATOM 0 HG21 THR A 90 7.466 -15.163 11.400 1.00 54.31 H new ATOM 0 HG22 THR A 90 7.599 -16.710 10.531 1.00 54.31 H new ATOM 0 HG23 THR A 90 7.831 -15.177 9.658 1.00 54.31 H new ATOM 1437 N ALA A 91 3.492 -16.447 7.517 1.00 3.13 N ATOM 1438 CA ALA A 91 2.101 -16.681 7.255 1.00 55.41 C ATOM 1439 C ALA A 91 1.956 -18.010 6.540 1.00 41.33 C ATOM 1440 O ALA A 91 2.960 -18.668 6.260 1.00 23.51 O ATOM 1441 CB ALA A 91 1.535 -15.547 6.418 1.00 32.53 C ATOM 0 H ALA A 91 4.025 -16.135 6.705 1.00 3.13 H new ATOM 0 HA ALA A 91 1.543 -16.718 8.190 1.00 55.41 H new ATOM 0 HB1 ALA A 91 0.479 -15.731 6.223 1.00 32.53 H new ATOM 0 HB2 ALA A 91 1.646 -14.606 6.957 1.00 32.53 H new ATOM 0 HB3 ALA A 91 2.074 -15.489 5.472 1.00 32.53 H new ATOM 1447 N ARG A 92 0.733 -18.423 6.269 1.00 54.53 N ATOM 1448 CA ARG A 92 0.503 -19.662 5.518 1.00 24.35 C ATOM 1449 C ARG A 92 1.003 -19.459 4.105 1.00 25.24 C ATOM 1450 O ARG A 92 0.949 -18.323 3.610 1.00 51.44 O ATOM 1451 CB ARG A 92 -1.001 -20.066 5.437 1.00 65.32 C ATOM 1452 CG ARG A 92 -1.664 -20.568 6.715 1.00 50.33 C ATOM 1453 CD ARG A 92 -1.865 -19.488 7.739 1.00 52.30 C ATOM 1454 NE ARG A 92 -2.686 -18.376 7.231 1.00 11.13 N ATOM 1455 CZ ARG A 92 -3.291 -17.495 8.021 1.00 52.44 C ATOM 1456 NH1 ARG A 92 -3.417 -17.748 9.319 1.00 44.34 N ATOM 1457 NH2 ARG A 92 -3.812 -16.380 7.521 1.00 61.54 N ATOM 0 H ARG A 92 -0.115 -17.931 6.550 1.00 54.53 H new ATOM 0 HA ARG A 92 1.031 -20.458 6.043 1.00 24.35 H new ATOM 0 HB2 ARG A 92 -1.563 -19.202 5.083 1.00 65.32 H new ATOM 0 HB3 ARG A 92 -1.100 -20.843 4.679 1.00 65.32 H new ATOM 0 HG2 ARG A 92 -2.629 -21.009 6.467 1.00 50.33 H new ATOM 0 HG3 ARG A 92 -1.053 -21.360 7.147 1.00 50.33 H new ATOM 0 HD2 ARG A 92 -2.341 -19.913 8.622 1.00 52.30 H new ATOM 0 HD3 ARG A 92 -0.894 -19.105 8.054 1.00 52.30 H new ATOM 0 HE ARG A 92 -2.796 -18.277 6.222 1.00 11.13 H new ATOM 0 HH11 ARG A 92 -3.050 -18.617 9.707 1.00 44.34 H new ATOM 0 HH12 ARG A 92 -3.881 -17.073 9.927 1.00 44.34 H new ATOM 0 HH21 ARG A 92 -3.750 -16.192 6.520 1.00 61.54 H new ATOM 0 HH22 ARG A 92 -4.274 -15.712 8.138 1.00 61.54 H new ATOM 1471 N PRO A 93 1.512 -20.528 3.445 1.00 34.44 N ATOM 1472 CA PRO A 93 1.961 -20.481 2.040 1.00 51.45 C ATOM 1473 C PRO A 93 0.982 -19.717 1.148 1.00 32.34 C ATOM 1474 O PRO A 93 1.389 -18.918 0.306 1.00 50.14 O ATOM 1475 CB PRO A 93 1.990 -21.955 1.646 1.00 34.45 C ATOM 1476 CG PRO A 93 2.339 -22.669 2.903 1.00 61.44 C ATOM 1477 CD PRO A 93 1.743 -21.869 4.033 1.00 51.31 C ATOM 0 HA PRO A 93 2.916 -19.967 1.926 1.00 51.45 H new ATOM 0 HB2 PRO A 93 1.025 -22.282 1.259 1.00 34.45 H new ATOM 0 HB3 PRO A 93 2.727 -22.143 0.865 1.00 34.45 H new ATOM 0 HG2 PRO A 93 1.941 -23.684 2.895 1.00 61.44 H new ATOM 0 HG3 PRO A 93 3.420 -22.751 3.015 1.00 61.44 H new ATOM 0 HD2 PRO A 93 0.814 -22.313 4.389 1.00 51.31 H new ATOM 0 HD3 PRO A 93 2.420 -21.819 4.886 1.00 51.31 H new ATOM 1485 N ARG A 94 -0.312 -19.942 1.390 1.00 1.11 N ATOM 1486 CA ARG A 94 -1.392 -19.282 0.665 1.00 4.45 C ATOM 1487 C ARG A 94 -1.270 -17.748 0.735 1.00 74.33 C ATOM 1488 O ARG A 94 -1.292 -17.092 -0.279 1.00 23.25 O ATOM 1489 CB ARG A 94 -2.730 -19.696 1.269 1.00 51.44 C ATOM 1490 CG ARG A 94 -3.945 -19.109 0.572 1.00 51.12 C ATOM 1491 CD ARG A 94 -5.211 -19.442 1.327 1.00 52.31 C ATOM 1492 NE ARG A 94 -5.249 -18.810 2.650 1.00 22.11 N ATOM 1493 CZ ARG A 94 -5.942 -19.240 3.706 1.00 2.40 C ATOM 1494 NH1 ARG A 94 -6.486 -20.460 3.718 1.00 41.31 N ATOM 1495 NH2 ARG A 94 -6.036 -18.461 4.773 1.00 11.01 N ATOM 0 H ARG A 94 -0.639 -20.595 2.103 1.00 1.11 H new ATOM 0 HA ARG A 94 -1.328 -19.585 -0.380 1.00 4.45 H new ATOM 0 HB2 ARG A 94 -2.804 -20.783 1.246 1.00 51.44 H new ATOM 0 HB3 ARG A 94 -2.749 -19.398 2.317 1.00 51.44 H new ATOM 0 HG2 ARG A 94 -3.837 -18.027 0.493 1.00 51.12 H new ATOM 0 HG3 ARG A 94 -4.010 -19.498 -0.444 1.00 51.12 H new ATOM 0 HD2 ARG A 94 -6.074 -19.118 0.746 1.00 52.31 H new ATOM 0 HD3 ARG A 94 -5.291 -20.523 1.440 1.00 52.31 H new ATOM 0 HE ARG A 94 -4.694 -17.963 2.774 1.00 22.11 H new ATOM 0 HH11 ARG A 94 -6.374 -21.076 2.913 1.00 41.31 H new ATOM 0 HH12 ARG A 94 -7.013 -20.775 4.532 1.00 41.31 H new ATOM 0 HH21 ARG A 94 -5.582 -17.547 4.779 1.00 11.01 H new ATOM 0 HH22 ARG A 94 -6.562 -18.775 5.589 1.00 11.01 H new ATOM 1509 N GLU A 95 -1.053 -17.222 1.933 1.00 3.12 N ATOM 1510 CA GLU A 95 -0.989 -15.781 2.187 1.00 64.44 C ATOM 1511 C GLU A 95 0.261 -15.253 1.541 1.00 60.02 C ATOM 1512 O GLU A 95 0.216 -14.307 0.765 1.00 11.41 O ATOM 1513 CB GLU A 95 -0.863 -15.539 3.693 1.00 12.31 C ATOM 1514 CG GLU A 95 -1.796 -16.360 4.560 1.00 62.33 C ATOM 1515 CD GLU A 95 -3.244 -16.079 4.333 1.00 74.24 C ATOM 1516 OE1 GLU A 95 -3.854 -16.744 3.516 1.00 1.24 O ATOM 1517 OE2 GLU A 95 -3.803 -15.241 5.048 1.00 50.24 O ATOM 0 H GLU A 95 -0.914 -17.788 2.770 1.00 3.12 H new ATOM 0 HA GLU A 95 -1.882 -15.294 1.796 1.00 64.44 H new ATOM 0 HB2 GLU A 95 0.164 -15.748 3.993 1.00 12.31 H new ATOM 0 HB3 GLU A 95 -1.045 -14.483 3.891 1.00 12.31 H new ATOM 0 HG2 GLU A 95 -1.609 -17.418 4.376 1.00 62.33 H new ATOM 0 HG3 GLU A 95 -1.560 -16.172 5.608 1.00 62.33 H new ATOM 1524 N LYS A 96 1.370 -15.942 1.826 1.00 1.30 N ATOM 1525 CA LYS A 96 2.698 -15.566 1.355 1.00 1.42 C ATOM 1526 C LYS A 96 2.704 -15.412 -0.166 1.00 5.11 C ATOM 1527 O LYS A 96 3.105 -14.364 -0.704 1.00 12.32 O ATOM 1528 CB LYS A 96 3.698 -16.664 1.732 1.00 12.22 C ATOM 1529 CG LYS A 96 3.769 -16.965 3.221 1.00 34.51 C ATOM 1530 CD LYS A 96 4.750 -18.091 3.530 1.00 41.02 C ATOM 1531 CE LYS A 96 6.164 -17.704 3.163 1.00 75.22 C ATOM 1532 NZ LYS A 96 7.156 -18.726 3.547 1.00 1.12 N ATOM 0 H LYS A 96 1.366 -16.787 2.398 1.00 1.30 H new ATOM 0 HA LYS A 96 2.974 -14.618 1.817 1.00 1.42 H new ATOM 0 HB2 LYS A 96 3.432 -17.578 1.201 1.00 12.22 H new ATOM 0 HB3 LYS A 96 4.689 -16.371 1.385 1.00 12.22 H new ATOM 0 HG2 LYS A 96 4.068 -16.065 3.759 1.00 34.51 H new ATOM 0 HG3 LYS A 96 2.778 -17.238 3.583 1.00 34.51 H new ATOM 0 HD2 LYS A 96 4.702 -18.337 4.591 1.00 41.02 H new ATOM 0 HD3 LYS A 96 4.462 -18.988 2.981 1.00 41.02 H new ATOM 0 HE2 LYS A 96 6.222 -17.535 2.088 1.00 75.22 H new ATOM 0 HE3 LYS A 96 6.415 -16.761 3.648 1.00 75.22 H new ATOM 0 HZ1 LYS A 96 8.027 -18.260 3.870 1.00 1.12 H new ATOM 0 HZ2 LYS A 96 6.771 -19.312 4.315 1.00 1.12 H new ATOM 0 HZ3 LYS A 96 7.370 -19.328 2.726 1.00 1.12 H new ATOM 1546 N MET A 97 2.197 -16.431 -0.854 1.00 34.40 N ATOM 1547 CA MET A 97 2.178 -16.422 -2.307 1.00 50.43 C ATOM 1548 C MET A 97 1.099 -15.490 -2.842 1.00 1.22 C ATOM 1549 O MET A 97 1.298 -14.842 -3.850 1.00 51.15 O ATOM 1550 CB MET A 97 2.022 -17.840 -2.912 1.00 1.33 C ATOM 1551 CG MET A 97 0.649 -18.485 -2.722 1.00 64.31 C ATOM 1552 SD MET A 97 0.528 -20.144 -3.432 1.00 1.32 S ATOM 1553 CE MET A 97 0.932 -19.828 -5.158 1.00 2.12 C ATOM 0 H MET A 97 1.797 -17.267 -0.429 1.00 34.40 H new ATOM 0 HA MET A 97 3.151 -16.044 -2.622 1.00 50.43 H new ATOM 0 HB2 MET A 97 2.235 -17.787 -3.980 1.00 1.33 H new ATOM 0 HB3 MET A 97 2.775 -18.491 -2.468 1.00 1.33 H new ATOM 0 HG2 MET A 97 0.425 -18.537 -1.657 1.00 64.31 H new ATOM 0 HG3 MET A 97 -0.109 -17.847 -3.177 1.00 64.31 H new ATOM 0 HE1 MET A 97 0.579 -20.657 -5.772 1.00 2.12 H new ATOM 0 HE2 MET A 97 0.450 -18.905 -5.482 1.00 2.12 H new ATOM 0 HE3 MET A 97 2.012 -19.730 -5.267 1.00 2.12 H new ATOM 1563 N MET A 98 -0.033 -15.395 -2.141 1.00 73.22 N ATOM 1564 CA MET A 98 -1.150 -14.565 -2.595 1.00 71.24 C ATOM 1565 C MET A 98 -0.743 -13.107 -2.564 1.00 35.32 C ATOM 1566 O MET A 98 -1.053 -12.342 -3.480 1.00 23.54 O ATOM 1567 CB MET A 98 -2.390 -14.783 -1.718 1.00 41.31 C ATOM 1568 CG MET A 98 -3.673 -14.212 -2.284 1.00 30.03 C ATOM 1569 SD MET A 98 -4.153 -14.974 -3.852 1.00 40.22 S ATOM 1570 CE MET A 98 -4.373 -16.688 -3.352 1.00 12.54 C ATOM 0 H MET A 98 -0.200 -15.881 -1.260 1.00 73.22 H new ATOM 0 HA MET A 98 -1.403 -14.852 -3.616 1.00 71.24 H new ATOM 0 HB2 MET A 98 -2.523 -15.853 -1.560 1.00 41.31 H new ATOM 0 HB3 MET A 98 -2.210 -14.337 -0.740 1.00 41.31 H new ATOM 0 HG2 MET A 98 -4.476 -14.348 -1.559 1.00 30.03 H new ATOM 0 HG3 MET A 98 -3.554 -13.138 -2.429 1.00 30.03 H new ATOM 0 HE1 MET A 98 -4.964 -17.213 -4.103 1.00 12.54 H new ATOM 0 HE2 MET A 98 -3.399 -17.167 -3.257 1.00 12.54 H new ATOM 0 HE3 MET A 98 -4.890 -16.724 -2.393 1.00 12.54 H new ATOM 1580 N TYR A 99 -0.024 -12.734 -1.521 1.00 64.43 N ATOM 1581 CA TYR A 99 0.490 -11.391 -1.386 1.00 65.31 C ATOM 1582 C TYR A 99 1.542 -11.104 -2.453 1.00 72.10 C ATOM 1583 O TYR A 99 1.512 -10.062 -3.097 1.00 12.30 O ATOM 1584 CB TYR A 99 1.061 -11.142 0.022 1.00 71.11 C ATOM 1585 CG TYR A 99 0.033 -11.122 1.141 1.00 4.55 C ATOM 1586 CD1 TYR A 99 -1.222 -10.558 0.964 1.00 75.44 C ATOM 1587 CD2 TYR A 99 0.335 -11.654 2.385 1.00 32.33 C ATOM 1588 CE1 TYR A 99 -2.140 -10.530 1.991 1.00 13.45 C ATOM 1589 CE2 TYR A 99 -0.578 -11.631 3.418 1.00 73.31 C ATOM 1590 CZ TYR A 99 -1.811 -11.070 3.218 1.00 74.35 C ATOM 1591 OH TYR A 99 -2.724 -11.039 4.248 1.00 63.04 O ATOM 0 H TYR A 99 0.217 -13.354 -0.748 1.00 64.43 H new ATOM 0 HA TYR A 99 -0.344 -10.704 -1.530 1.00 65.31 H new ATOM 0 HB2 TYR A 99 1.798 -11.915 0.240 1.00 71.11 H new ATOM 0 HB3 TYR A 99 1.590 -10.189 0.019 1.00 71.11 H new ATOM 0 HD1 TYR A 99 -1.484 -10.134 0.006 1.00 75.44 H new ATOM 0 HD2 TYR A 99 1.307 -12.096 2.549 1.00 32.33 H new ATOM 0 HE1 TYR A 99 -3.113 -10.087 1.837 1.00 13.45 H new ATOM 0 HE2 TYR A 99 -0.322 -12.053 4.379 1.00 73.31 H new ATOM 0 HH TYR A 99 -2.335 -11.461 5.042 1.00 63.04 H new ATOM 1601 N SER A 100 2.422 -12.055 -2.667 1.00 25.41 N ATOM 1602 CA SER A 100 3.496 -11.901 -3.630 1.00 35.32 C ATOM 1603 C SER A 100 2.975 -11.903 -5.093 1.00 63.53 C ATOM 1604 O SER A 100 3.538 -11.240 -5.955 1.00 52.02 O ATOM 1605 CB SER A 100 4.541 -13.006 -3.424 1.00 71.11 C ATOM 1606 OG SER A 100 5.044 -13.010 -2.084 1.00 54.31 O ATOM 0 H SER A 100 2.417 -12.953 -2.183 1.00 25.41 H new ATOM 0 HA SER A 100 3.960 -10.929 -3.461 1.00 35.32 H new ATOM 0 HB2 SER A 100 4.096 -13.975 -3.650 1.00 71.11 H new ATOM 0 HB3 SER A 100 5.365 -12.863 -4.123 1.00 71.11 H new ATOM 0 HG SER A 100 4.420 -13.491 -1.502 1.00 54.31 H new ATOM 1612 N ALA A 101 1.928 -12.667 -5.361 1.00 21.15 N ATOM 1613 CA ALA A 101 1.371 -12.764 -6.707 1.00 10.03 C ATOM 1614 C ALA A 101 0.414 -11.618 -7.074 1.00 14.11 C ATOM 1615 O ALA A 101 0.549 -11.012 -8.137 1.00 24.11 O ATOM 1616 CB ALA A 101 0.689 -14.111 -6.914 1.00 63.35 C ATOM 0 H ALA A 101 1.443 -13.232 -4.664 1.00 21.15 H new ATOM 0 HA ALA A 101 2.221 -12.675 -7.383 1.00 10.03 H new ATOM 0 HB1 ALA A 101 0.281 -14.161 -7.924 1.00 63.35 H new ATOM 0 HB2 ALA A 101 1.416 -14.912 -6.776 1.00 63.35 H new ATOM 0 HB3 ALA A 101 -0.118 -14.225 -6.191 1.00 63.35 H new ATOM 1622 N SER A 102 -0.528 -11.305 -6.193 1.00 71.21 N ATOM 1623 CA SER A 102 -1.614 -10.360 -6.513 1.00 62.32 C ATOM 1624 C SER A 102 -1.161 -8.895 -6.546 1.00 11.22 C ATOM 1625 O SER A 102 -1.904 -8.007 -7.009 1.00 54.44 O ATOM 1626 CB SER A 102 -2.739 -10.536 -5.518 1.00 41.42 C ATOM 1627 OG SER A 102 -3.075 -11.912 -5.391 1.00 63.30 O ATOM 0 H SER A 102 -0.570 -11.687 -5.248 1.00 71.21 H new ATOM 0 HA SER A 102 -1.954 -10.594 -7.522 1.00 62.32 H new ATOM 0 HB2 SER A 102 -2.442 -10.136 -4.548 1.00 41.42 H new ATOM 0 HB3 SER A 102 -3.612 -9.970 -5.842 1.00 41.42 H new ATOM 0 HG SER A 102 -2.479 -12.336 -4.739 1.00 63.30 H new ATOM 1633 N ARG A 103 0.047 -8.647 -6.078 1.00 52.24 N ATOM 1634 CA ARG A 103 0.592 -7.304 -6.047 1.00 73.34 C ATOM 1635 C ARG A 103 0.723 -6.727 -7.456 1.00 20.21 C ATOM 1636 O ARG A 103 0.541 -5.530 -7.649 1.00 70.32 O ATOM 1637 CB ARG A 103 1.937 -7.269 -5.328 1.00 35.23 C ATOM 1638 CG ARG A 103 2.994 -8.143 -5.963 1.00 53.52 C ATOM 1639 CD ARG A 103 4.308 -8.027 -5.246 1.00 70.03 C ATOM 1640 NE ARG A 103 5.321 -8.885 -5.847 1.00 31.30 N ATOM 1641 CZ ARG A 103 6.633 -8.641 -5.827 1.00 61.22 C ATOM 1642 NH1 ARG A 103 7.094 -7.499 -5.328 1.00 64.54 N ATOM 1643 NH2 ARG A 103 7.476 -9.523 -6.347 1.00 44.53 N ATOM 0 H ARG A 103 0.673 -9.364 -5.712 1.00 52.24 H new ATOM 0 HA ARG A 103 -0.108 -6.682 -5.489 1.00 73.34 H new ATOM 0 HB2 ARG A 103 2.297 -6.241 -5.302 1.00 35.23 H new ATOM 0 HB3 ARG A 103 1.793 -7.583 -4.294 1.00 35.23 H new ATOM 0 HG2 ARG A 103 2.663 -9.182 -5.953 1.00 53.52 H new ATOM 0 HG3 ARG A 103 3.122 -7.860 -7.008 1.00 53.52 H new ATOM 0 HD2 ARG A 103 4.646 -6.991 -5.269 1.00 70.03 H new ATOM 0 HD3 ARG A 103 4.177 -8.296 -4.198 1.00 70.03 H new ATOM 0 HE ARG A 103 5.005 -9.733 -6.317 1.00 31.30 H new ATOM 0 HH11 ARG A 103 6.444 -6.805 -4.958 1.00 64.54 H new ATOM 0 HH12 ARG A 103 8.097 -7.317 -5.315 1.00 64.54 H new ATOM 0 HH21 ARG A 103 7.121 -10.385 -6.761 1.00 44.53 H new ATOM 0 HH22 ARG A 103 8.479 -9.339 -6.333 1.00 44.53 H new ATOM 1657 N ASP A 104 0.989 -7.592 -8.441 1.00 20.34 N ATOM 1658 CA ASP A 104 1.147 -7.156 -9.829 1.00 63.41 C ATOM 1659 C ASP A 104 -0.127 -6.549 -10.341 1.00 44.23 C ATOM 1660 O ASP A 104 -0.111 -5.463 -10.923 1.00 33.35 O ATOM 1661 CB ASP A 104 1.595 -8.295 -10.760 1.00 40.31 C ATOM 1662 CG ASP A 104 3.001 -8.769 -10.504 1.00 51.04 C ATOM 1663 OD1 ASP A 104 3.966 -8.163 -11.050 1.00 50.03 O ATOM 1664 OD2 ASP A 104 3.188 -9.765 -9.782 1.00 65.03 O ATOM 0 H ASP A 104 1.099 -8.596 -8.301 1.00 20.34 H new ATOM 0 HA ASP A 104 1.936 -6.404 -9.831 1.00 63.41 H new ATOM 0 HB2 ASP A 104 0.911 -9.136 -10.646 1.00 40.31 H new ATOM 0 HB3 ASP A 104 1.517 -7.959 -11.794 1.00 40.31 H new ATOM 1669 N ALA A 105 -1.234 -7.227 -10.095 1.00 1.43 N ATOM 1670 CA ALA A 105 -2.548 -6.762 -10.502 1.00 43.21 C ATOM 1671 C ALA A 105 -2.837 -5.395 -9.906 1.00 42.22 C ATOM 1672 O ALA A 105 -3.129 -4.441 -10.637 1.00 35.15 O ATOM 1673 CB ALA A 105 -3.621 -7.757 -10.082 1.00 20.55 C ATOM 0 H ALA A 105 -1.247 -8.121 -9.604 1.00 1.43 H new ATOM 0 HA ALA A 105 -2.559 -6.677 -11.589 1.00 43.21 H new ATOM 0 HB1 ALA A 105 -4.599 -7.392 -10.395 1.00 20.55 H new ATOM 0 HB2 ALA A 105 -3.427 -8.721 -10.551 1.00 20.55 H new ATOM 0 HB3 ALA A 105 -3.607 -7.871 -8.998 1.00 20.55 H new ATOM 1679 N LEU A 106 -2.677 -5.275 -8.592 1.00 24.24 N ATOM 1680 CA LEU A 106 -2.980 -4.027 -7.909 1.00 33.22 C ATOM 1681 C LEU A 106 -2.033 -2.903 -8.340 1.00 64.32 C ATOM 1682 O LEU A 106 -2.463 -1.779 -8.512 1.00 21.43 O ATOM 1683 CB LEU A 106 -2.944 -4.216 -6.388 1.00 51.54 C ATOM 1684 CG LEU A 106 -3.273 -2.984 -5.516 1.00 12.14 C ATOM 1685 CD1 LEU A 106 -4.682 -2.487 -5.765 1.00 44.12 C ATOM 1686 CD2 LEU A 106 -3.088 -3.320 -4.056 1.00 3.32 C ATOM 0 H LEU A 106 -2.342 -6.022 -7.984 1.00 24.24 H new ATOM 0 HA LEU A 106 -3.990 -3.733 -8.195 1.00 33.22 H new ATOM 0 HB2 LEU A 106 -3.645 -5.010 -6.129 1.00 51.54 H new ATOM 0 HB3 LEU A 106 -1.949 -4.568 -6.115 1.00 51.54 H new ATOM 0 HG LEU A 106 -2.586 -2.184 -5.791 1.00 12.14 H new ATOM 0 HD11 LEU A 106 -4.879 -1.620 -5.135 1.00 44.12 H new ATOM 0 HD12 LEU A 106 -4.789 -2.206 -6.813 1.00 44.12 H new ATOM 0 HD13 LEU A 106 -5.394 -3.277 -5.527 1.00 44.12 H new ATOM 0 HD21 LEU A 106 -3.322 -2.446 -3.449 1.00 3.32 H new ATOM 0 HD22 LEU A 106 -3.753 -4.139 -3.784 1.00 3.32 H new ATOM 0 HD23 LEU A 106 -2.055 -3.618 -3.879 1.00 3.32 H new ATOM 1698 N SER A 107 -0.783 -3.229 -8.609 1.00 45.03 N ATOM 1699 CA SER A 107 0.197 -2.223 -9.027 1.00 73.41 C ATOM 1700 C SER A 107 -0.064 -1.754 -10.466 1.00 2.25 C ATOM 1701 O SER A 107 0.371 -0.676 -10.876 1.00 24.32 O ATOM 1702 CB SER A 107 1.625 -2.764 -8.881 1.00 11.50 C ATOM 1703 OG SER A 107 1.862 -3.195 -7.546 1.00 50.20 O ATOM 0 H SER A 107 -0.415 -4.178 -8.548 1.00 45.03 H new ATOM 0 HA SER A 107 0.088 -1.359 -8.372 1.00 73.41 H new ATOM 0 HB2 SER A 107 1.777 -3.595 -9.570 1.00 11.50 H new ATOM 0 HB3 SER A 107 2.343 -1.990 -9.152 1.00 11.50 H new ATOM 0 HG SER A 107 1.250 -3.928 -7.325 1.00 50.20 H new ATOM 1709 N SER A 108 -0.782 -2.555 -11.224 1.00 15.03 N ATOM 1710 CA SER A 108 -1.084 -2.205 -12.591 1.00 73.41 C ATOM 1711 C SER A 108 -2.288 -1.279 -12.637 1.00 13.42 C ATOM 1712 O SER A 108 -2.323 -0.323 -13.412 1.00 3.32 O ATOM 1713 CB SER A 108 -1.322 -3.467 -13.420 1.00 44.33 C ATOM 1714 OG SER A 108 -0.208 -4.351 -13.313 1.00 53.11 O ATOM 0 H SER A 108 -1.165 -3.449 -10.916 1.00 15.03 H new ATOM 0 HA SER A 108 -0.234 -1.677 -13.022 1.00 73.41 H new ATOM 0 HB2 SER A 108 -2.227 -3.969 -13.078 1.00 44.33 H new ATOM 0 HB3 SER A 108 -1.482 -3.199 -14.464 1.00 44.33 H new ATOM 0 HG SER A 108 -0.254 -4.834 -12.461 1.00 53.11 H new ATOM 1720 N VAL A 109 -3.242 -1.531 -11.779 1.00 61.10 N ATOM 1721 CA VAL A 109 -4.451 -0.731 -11.743 1.00 22.40 C ATOM 1722 C VAL A 109 -4.291 0.548 -10.920 1.00 75.34 C ATOM 1723 O VAL A 109 -4.959 1.545 -11.198 1.00 70.13 O ATOM 1724 CB VAL A 109 -5.664 -1.531 -11.244 1.00 51.45 C ATOM 1725 CG1 VAL A 109 -6.051 -2.596 -12.246 1.00 60.42 C ATOM 1726 CG2 VAL A 109 -5.351 -2.169 -9.927 1.00 31.22 C ATOM 0 H VAL A 109 -3.210 -2.284 -11.092 1.00 61.10 H new ATOM 0 HA VAL A 109 -4.635 -0.440 -12.777 1.00 22.40 H new ATOM 0 HB VAL A 109 -6.501 -0.844 -11.123 1.00 51.45 H new ATOM 0 HG11 VAL A 109 -6.912 -3.151 -11.873 1.00 60.42 H new ATOM 0 HG12 VAL A 109 -6.306 -2.126 -13.196 1.00 60.42 H new ATOM 0 HG13 VAL A 109 -5.215 -3.279 -12.392 1.00 60.42 H new ATOM 0 HG21 VAL A 109 -6.217 -2.734 -9.581 1.00 31.22 H new ATOM 0 HG22 VAL A 109 -4.501 -2.842 -10.041 1.00 31.22 H new ATOM 0 HG23 VAL A 109 -5.107 -1.397 -9.198 1.00 31.22 H new ATOM 1736 N SER A 110 -3.418 0.535 -9.921 1.00 21.10 N ATOM 1737 CA SER A 110 -3.211 1.712 -9.113 1.00 44.25 C ATOM 1738 C SER A 110 -2.242 2.686 -9.788 1.00 5.14 C ATOM 1739 O SER A 110 -1.023 2.649 -9.594 1.00 0.35 O ATOM 1740 CB SER A 110 -2.815 1.364 -7.663 1.00 2.11 C ATOM 1741 OG SER A 110 -1.679 0.525 -7.610 1.00 14.01 O ATOM 0 H SER A 110 -2.851 -0.272 -9.659 1.00 21.10 H new ATOM 0 HA SER A 110 -4.166 2.231 -9.035 1.00 44.25 H new ATOM 0 HB2 SER A 110 -2.613 2.283 -7.112 1.00 2.11 H new ATOM 0 HB3 SER A 110 -3.652 0.872 -7.167 1.00 2.11 H new ATOM 0 HG SER A 110 -1.940 -0.393 -7.833 1.00 14.01 H new ATOM 1747 N GLU A 111 -2.802 3.487 -10.647 1.00 54.31 N ATOM 1748 CA GLU A 111 -2.074 4.474 -11.386 1.00 23.20 C ATOM 1749 C GLU A 111 -1.638 5.615 -10.471 1.00 73.11 C ATOM 1750 O GLU A 111 -2.482 6.295 -9.862 1.00 42.15 O ATOM 1751 CB GLU A 111 -2.978 4.993 -12.498 1.00 70.52 C ATOM 1752 CG GLU A 111 -2.442 6.170 -13.280 1.00 73.10 C ATOM 1753 CD GLU A 111 -3.449 6.668 -14.269 1.00 43.23 C ATOM 1754 OE1 GLU A 111 -4.553 7.112 -13.843 1.00 61.55 O ATOM 1755 OE2 GLU A 111 -3.180 6.630 -15.472 1.00 3.14 O ATOM 0 H GLU A 111 -3.800 3.471 -10.857 1.00 54.31 H new ATOM 0 HA GLU A 111 -1.173 4.033 -11.812 1.00 23.20 H new ATOM 0 HB2 GLU A 111 -3.174 4.177 -13.193 1.00 70.52 H new ATOM 0 HB3 GLU A 111 -3.936 5.276 -12.061 1.00 70.52 H new ATOM 0 HG2 GLU A 111 -2.174 6.974 -12.594 1.00 73.10 H new ATOM 0 HG3 GLU A 111 -1.530 5.879 -13.801 1.00 73.10 H new ATOM 1762 N GLY A 112 -0.338 5.824 -10.394 1.00 45.13 N ATOM 1763 CA GLY A 112 0.207 6.900 -9.603 1.00 14.52 C ATOM 1764 C GLY A 112 0.847 6.421 -8.321 1.00 54.14 C ATOM 1765 O GLY A 112 1.343 7.225 -7.536 1.00 20.11 O ATOM 0 H GLY A 112 0.361 5.257 -10.874 1.00 45.13 H new ATOM 0 HA2 GLY A 112 0.948 7.439 -10.194 1.00 14.52 H new ATOM 0 HA3 GLY A 112 -0.587 7.607 -9.365 1.00 14.52 H new ATOM 1769 N TYR A 113 0.870 5.125 -8.121 1.00 53.14 N ATOM 1770 CA TYR A 113 1.388 4.557 -6.889 1.00 61.30 C ATOM 1771 C TYR A 113 2.801 4.041 -7.027 1.00 22.30 C ATOM 1772 O TYR A 113 3.200 3.546 -8.087 1.00 42.42 O ATOM 1773 CB TYR A 113 0.468 3.451 -6.370 1.00 1.32 C ATOM 1774 CG TYR A 113 -0.826 3.962 -5.786 1.00 34.12 C ATOM 1775 CD1 TYR A 113 -1.806 4.529 -6.589 1.00 74.11 C ATOM 1776 CD2 TYR A 113 -1.059 3.884 -4.426 1.00 44.44 C ATOM 1777 CE1 TYR A 113 -2.974 5.006 -6.051 1.00 24.21 C ATOM 1778 CE2 TYR A 113 -2.228 4.352 -3.881 1.00 72.42 C ATOM 1779 CZ TYR A 113 -3.183 4.918 -4.698 1.00 10.12 C ATOM 1780 OH TYR A 113 -4.342 5.404 -4.157 1.00 43.20 O ATOM 0 H TYR A 113 0.536 4.437 -8.796 1.00 53.14 H new ATOM 0 HA TYR A 113 1.416 5.370 -6.164 1.00 61.30 H new ATOM 0 HB2 TYR A 113 0.242 2.766 -7.187 1.00 1.32 H new ATOM 0 HB3 TYR A 113 0.998 2.877 -5.610 1.00 1.32 H new ATOM 0 HD1 TYR A 113 -1.646 4.596 -7.655 1.00 74.11 H new ATOM 0 HD2 TYR A 113 -0.309 3.448 -3.782 1.00 44.44 H new ATOM 0 HE1 TYR A 113 -3.725 5.448 -6.689 1.00 24.21 H new ATOM 0 HE2 TYR A 113 -2.399 4.277 -2.817 1.00 72.42 H new ATOM 0 HH TYR A 113 -5.009 5.522 -4.865 1.00 43.20 H new ATOM 1790 N LEU A 114 3.557 4.179 -5.959 1.00 55.32 N ATOM 1791 CA LEU A 114 4.889 3.666 -5.876 1.00 2.04 C ATOM 1792 C LEU A 114 4.812 2.277 -5.303 1.00 63.34 C ATOM 1793 O LEU A 114 4.275 2.097 -4.189 1.00 60.23 O ATOM 1794 CB LEU A 114 5.783 4.513 -4.939 1.00 43.14 C ATOM 1795 CG LEU A 114 6.220 5.921 -5.385 1.00 23.30 C ATOM 1796 CD1 LEU A 114 5.050 6.882 -5.522 1.00 35.21 C ATOM 1797 CD2 LEU A 114 7.233 6.468 -4.400 1.00 60.14 C ATOM 0 H LEU A 114 3.249 4.661 -5.114 1.00 55.32 H new ATOM 0 HA LEU A 114 5.325 3.684 -6.875 1.00 2.04 H new ATOM 0 HB2 LEU A 114 5.256 4.618 -3.991 1.00 43.14 H new ATOM 0 HB3 LEU A 114 6.687 3.937 -4.739 1.00 43.14 H new ATOM 0 HG LEU A 114 6.668 5.829 -6.374 1.00 23.30 H new ATOM 0 HD11 LEU A 114 5.416 7.859 -5.839 1.00 35.21 H new ATOM 0 HD12 LEU A 114 4.350 6.499 -6.264 1.00 35.21 H new ATOM 0 HD13 LEU A 114 4.544 6.978 -4.561 1.00 35.21 H new ATOM 0 HD21 LEU A 114 7.544 7.465 -4.714 1.00 60.14 H new ATOM 0 HD22 LEU A 114 6.783 6.523 -3.409 1.00 60.14 H new ATOM 0 HD23 LEU A 114 8.102 5.810 -4.368 1.00 60.14 H new ATOM 1809 N PRO A 115 5.285 1.267 -6.025 1.00 34.32 N ATOM 1810 CA PRO A 115 5.310 -0.074 -5.502 1.00 0.50 C ATOM 1811 C PRO A 115 6.407 -0.184 -4.447 1.00 23.04 C ATOM 1812 O PRO A 115 7.601 -0.027 -4.743 1.00 1.43 O ATOM 1813 CB PRO A 115 5.646 -0.950 -6.724 1.00 22.22 C ATOM 1814 CG PRO A 115 5.598 -0.038 -7.907 1.00 50.34 C ATOM 1815 CD PRO A 115 5.825 1.343 -7.387 1.00 23.11 C ATOM 0 HA PRO A 115 4.374 -0.370 -5.029 1.00 0.50 H new ATOM 0 HB2 PRO A 115 6.632 -1.404 -6.620 1.00 22.22 H new ATOM 0 HB3 PRO A 115 4.930 -1.765 -6.829 1.00 22.22 H new ATOM 0 HG2 PRO A 115 6.362 -0.308 -8.636 1.00 50.34 H new ATOM 0 HG3 PRO A 115 4.635 -0.109 -8.413 1.00 50.34 H new ATOM 0 HD2 PRO A 115 6.882 1.608 -7.389 1.00 23.11 H new ATOM 0 HD3 PRO A 115 5.307 2.092 -7.987 1.00 23.11 H new ATOM 1823 N ILE A 116 6.019 -0.438 -3.232 1.00 55.11 N ATOM 1824 CA ILE A 116 6.955 -0.513 -2.152 1.00 52.03 C ATOM 1825 C ILE A 116 6.721 -1.772 -1.329 1.00 4.34 C ATOM 1826 O ILE A 116 5.644 -1.989 -0.761 1.00 24.51 O ATOM 1827 CB ILE A 116 6.953 0.802 -1.292 1.00 11.33 C ATOM 1828 CG1 ILE A 116 7.834 0.689 -0.039 1.00 14.54 C ATOM 1829 CG2 ILE A 116 5.549 1.267 -0.942 1.00 73.12 C ATOM 1830 CD1 ILE A 116 7.857 1.961 0.785 1.00 34.42 C ATOM 0 H ILE A 116 5.048 -0.598 -2.963 1.00 55.11 H new ATOM 0 HA ILE A 116 7.960 -0.590 -2.566 1.00 52.03 H new ATOM 0 HB ILE A 116 7.396 1.570 -1.926 1.00 11.33 H new ATOM 0 HG12 ILE A 116 7.472 -0.132 0.580 1.00 14.54 H new ATOM 0 HG13 ILE A 116 8.852 0.438 -0.338 1.00 14.54 H new ATOM 0 HG21 ILE A 116 5.605 2.179 -0.348 1.00 73.12 H new ATOM 0 HG22 ILE A 116 4.992 1.465 -1.858 1.00 73.12 H new ATOM 0 HG23 ILE A 116 5.041 0.491 -0.369 1.00 73.12 H new ATOM 0 HD11 ILE A 116 8.496 1.819 1.656 1.00 34.42 H new ATOM 0 HD12 ILE A 116 8.246 2.780 0.180 1.00 34.42 H new ATOM 0 HD13 ILE A 116 6.845 2.201 1.112 1.00 34.42 H new ATOM 1842 N GLN A 117 7.713 -2.624 -1.339 1.00 21.51 N ATOM 1843 CA GLN A 117 7.663 -3.885 -0.643 1.00 24.13 C ATOM 1844 C GLN A 117 8.235 -3.698 0.744 1.00 40.23 C ATOM 1845 O GLN A 117 9.286 -3.052 0.901 1.00 23.12 O ATOM 1846 CB GLN A 117 8.502 -4.962 -1.369 1.00 21.32 C ATOM 1847 CG GLN A 117 8.040 -5.433 -2.763 1.00 44.34 C ATOM 1848 CD GLN A 117 7.984 -4.345 -3.831 1.00 2.52 C ATOM 1849 OE1 GLN A 117 8.977 -4.043 -4.490 1.00 54.53 O ATOM 1850 NE2 GLN A 117 6.824 -3.834 -4.078 1.00 24.51 N ATOM 0 H GLN A 117 8.589 -2.461 -1.836 1.00 21.51 H new ATOM 0 HA GLN A 117 6.624 -4.213 -0.605 1.00 24.13 H new ATOM 0 HB2 GLN A 117 9.519 -4.581 -1.467 1.00 21.32 H new ATOM 0 HB3 GLN A 117 8.551 -5.838 -0.722 1.00 21.32 H new ATOM 0 HG2 GLN A 117 8.712 -6.220 -3.104 1.00 44.34 H new ATOM 0 HG3 GLN A 117 7.050 -5.878 -2.669 1.00 44.34 H new ATOM 0 HE21 GLN A 117 6.018 -4.103 -3.514 1.00 24.51 H new ATOM 0 HE22 GLN A 117 6.714 -3.161 -4.837 1.00 24.51 H new ATOM 1859 N ALA A 118 7.570 -4.226 1.725 1.00 72.14 N ATOM 1860 CA ALA A 118 8.032 -4.175 3.079 1.00 60.43 C ATOM 1861 C ALA A 118 7.730 -5.493 3.750 1.00 74.45 C ATOM 1862 O ALA A 118 6.604 -5.957 3.747 1.00 30.13 O ATOM 1863 CB ALA A 118 7.355 -3.036 3.828 1.00 61.24 C ATOM 0 H ALA A 118 6.680 -4.711 1.607 1.00 72.14 H new ATOM 0 HA ALA A 118 9.107 -3.997 3.089 1.00 60.43 H new ATOM 0 HB1 ALA A 118 7.717 -3.011 4.856 1.00 61.24 H new ATOM 0 HB2 ALA A 118 7.587 -2.090 3.338 1.00 61.24 H new ATOM 0 HB3 ALA A 118 6.276 -3.190 3.827 1.00 61.24 H new ATOM 1869 N ASN A 119 8.720 -6.103 4.297 1.00 32.50 N ATOM 1870 CA ASN A 119 8.517 -7.359 4.984 1.00 24.12 C ATOM 1871 C ASN A 119 8.308 -7.090 6.445 1.00 54.21 C ATOM 1872 O ASN A 119 7.434 -7.673 7.089 1.00 44.51 O ATOM 1873 CB ASN A 119 9.705 -8.307 4.792 1.00 21.43 C ATOM 1874 CG ASN A 119 9.928 -8.713 3.350 1.00 24.50 C ATOM 1875 OD1 ASN A 119 10.659 -8.058 2.617 1.00 13.31 O ATOM 1876 ND2 ASN A 119 9.307 -9.785 2.936 1.00 33.05 N ATOM 0 H ASN A 119 9.683 -5.766 4.291 1.00 32.50 H new ATOM 0 HA ASN A 119 7.638 -7.845 4.561 1.00 24.12 H new ATOM 0 HB2 ASN A 119 10.608 -7.826 5.169 1.00 21.43 H new ATOM 0 HB3 ASN A 119 9.546 -9.202 5.393 1.00 21.43 H new ATOM 0 HD21 ASN A 119 9.423 -10.102 1.973 1.00 33.05 H new ATOM 0 HD22 ASN A 119 8.706 -10.305 3.575 1.00 33.05 H new ATOM 1883 N ASP A 120 9.101 -6.197 6.965 1.00 62.13 N ATOM 1884 CA ASP A 120 9.036 -5.820 8.358 1.00 64.53 C ATOM 1885 C ASP A 120 9.289 -4.306 8.422 1.00 0.14 C ATOM 1886 O ASP A 120 9.221 -3.631 7.384 1.00 50.33 O ATOM 1887 CB ASP A 120 10.088 -6.625 9.165 1.00 33.23 C ATOM 1888 CG ASP A 120 9.845 -6.616 10.669 1.00 61.32 C ATOM 1889 OD1 ASP A 120 10.275 -5.667 11.350 1.00 50.25 O ATOM 1890 OD2 ASP A 120 9.222 -7.565 11.192 1.00 73.01 O ATOM 0 H ASP A 120 9.818 -5.703 6.434 1.00 62.13 H new ATOM 0 HA ASP A 120 8.065 -6.045 8.798 1.00 64.53 H new ATOM 0 HB2 ASP A 120 10.091 -7.657 8.813 1.00 33.23 H new ATOM 0 HB3 ASP A 120 11.078 -6.216 8.964 1.00 33.23 H new ATOM 1895 N GLU A 121 9.584 -3.777 9.597 1.00 74.25 N ATOM 1896 CA GLU A 121 9.866 -2.348 9.810 1.00 21.53 C ATOM 1897 C GLU A 121 11.048 -1.868 8.975 1.00 61.44 C ATOM 1898 O GLU A 121 11.213 -0.682 8.738 1.00 0.34 O ATOM 1899 CB GLU A 121 10.073 -2.031 11.270 1.00 75.11 C ATOM 1900 CG GLU A 121 8.857 -2.294 12.123 1.00 52.14 C ATOM 1901 CD GLU A 121 9.073 -1.849 13.527 1.00 14.35 C ATOM 1902 OE1 GLU A 121 9.676 -2.609 14.313 1.00 41.34 O ATOM 1903 OE2 GLU A 121 8.665 -0.719 13.873 1.00 44.10 O ATOM 0 H GLU A 121 9.638 -4.330 10.452 1.00 74.25 H new ATOM 0 HA GLU A 121 8.984 -1.803 9.473 1.00 21.53 H new ATOM 0 HB2 GLU A 121 10.906 -2.624 11.647 1.00 75.11 H new ATOM 0 HB3 GLU A 121 10.356 -0.983 11.369 1.00 75.11 H new ATOM 0 HG2 GLU A 121 7.996 -1.774 11.703 1.00 52.14 H new ATOM 0 HG3 GLU A 121 8.624 -3.359 12.109 1.00 52.14 H new ATOM 1910 N SER A 122 11.869 -2.802 8.564 1.00 65.34 N ATOM 1911 CA SER A 122 12.975 -2.555 7.676 1.00 24.45 C ATOM 1912 C SER A 122 12.501 -1.896 6.352 1.00 63.43 C ATOM 1913 O SER A 122 13.273 -1.219 5.657 1.00 1.20 O ATOM 1914 CB SER A 122 13.661 -3.880 7.426 1.00 54.51 C ATOM 1915 OG SER A 122 12.690 -4.914 7.256 1.00 62.05 O ATOM 0 H SER A 122 11.784 -3.779 8.845 1.00 65.34 H new ATOM 0 HA SER A 122 13.674 -1.852 8.128 1.00 24.45 H new ATOM 0 HB2 SER A 122 14.289 -3.811 6.538 1.00 54.51 H new ATOM 0 HB3 SER A 122 14.317 -4.121 8.262 1.00 54.51 H new ATOM 0 HG SER A 122 13.145 -5.767 7.093 1.00 62.05 H new ATOM 1921 N GLY A 123 11.244 -2.124 6.010 1.00 54.45 N ATOM 1922 CA GLY A 123 10.648 -1.471 4.885 1.00 0.14 C ATOM 1923 C GLY A 123 9.708 -0.373 5.340 1.00 53.34 C ATOM 1924 O GLY A 123 9.519 0.626 4.648 1.00 72.03 O ATOM 0 H GLY A 123 10.623 -2.763 6.507 1.00 54.45 H new ATOM 0 HA2 GLY A 123 11.426 -1.050 4.248 1.00 0.14 H new ATOM 0 HA3 GLY A 123 10.102 -2.198 4.283 1.00 0.14 H new ATOM 1928 N LEU A 124 9.143 -0.549 6.522 1.00 20.14 N ATOM 1929 CA LEU A 124 8.181 0.386 7.058 1.00 72.42 C ATOM 1930 C LEU A 124 8.735 1.310 8.129 1.00 45.31 C ATOM 1931 O LEU A 124 8.654 1.024 9.331 1.00 72.41 O ATOM 1932 CB LEU A 124 6.905 -0.305 7.539 1.00 32.11 C ATOM 1933 CG LEU A 124 5.943 -0.795 6.456 1.00 51.51 C ATOM 1934 CD1 LEU A 124 4.741 -1.425 7.095 1.00 45.41 C ATOM 1935 CD2 LEU A 124 5.522 0.375 5.583 1.00 24.11 C ATOM 0 H LEU A 124 9.340 -1.342 7.132 1.00 20.14 H new ATOM 0 HA LEU A 124 7.926 1.026 6.213 1.00 72.42 H new ATOM 0 HB2 LEU A 124 7.191 -1.159 8.153 1.00 32.11 H new ATOM 0 HB3 LEU A 124 6.366 0.387 8.186 1.00 32.11 H new ATOM 0 HG LEU A 124 6.442 -1.539 5.835 1.00 51.51 H new ATOM 0 HD11 LEU A 124 4.058 -1.773 6.320 1.00 45.41 H new ATOM 0 HD12 LEU A 124 5.055 -2.270 7.708 1.00 45.41 H new ATOM 0 HD13 LEU A 124 4.235 -0.691 7.722 1.00 45.41 H new ATOM 0 HD21 LEU A 124 4.836 0.025 4.811 1.00 24.11 H new ATOM 0 HD22 LEU A 124 5.025 1.126 6.197 1.00 24.11 H new ATOM 0 HD23 LEU A 124 6.402 0.814 5.114 1.00 24.11 H new ATOM 1947 N ASP A 125 9.307 2.386 7.672 1.00 70.23 N ATOM 1948 CA ASP A 125 9.794 3.479 8.500 1.00 52.31 C ATOM 1949 C ASP A 125 9.689 4.707 7.632 1.00 75.41 C ATOM 1950 O ASP A 125 10.092 4.646 6.475 1.00 73.04 O ATOM 1951 CB ASP A 125 11.263 3.261 8.918 1.00 3.14 C ATOM 1952 CG ASP A 125 11.787 4.348 9.851 1.00 24.24 C ATOM 1953 OD1 ASP A 125 12.086 5.474 9.390 1.00 51.34 O ATOM 1954 OD2 ASP A 125 11.936 4.097 11.061 1.00 73.51 O ATOM 0 H ASP A 125 9.458 2.543 6.676 1.00 70.23 H new ATOM 0 HA ASP A 125 9.217 3.561 9.421 1.00 52.31 H new ATOM 0 HB2 ASP A 125 11.355 2.293 9.410 1.00 3.14 H new ATOM 0 HB3 ASP A 125 11.887 3.225 8.025 1.00 3.14 H new ATOM 1959 N ALA A 126 9.143 5.792 8.152 1.00 72.41 N ATOM 1960 CA ALA A 126 8.885 7.005 7.352 1.00 42.20 C ATOM 1961 C ALA A 126 10.132 7.530 6.643 1.00 5.34 C ATOM 1962 O ALA A 126 10.075 7.858 5.457 1.00 73.22 O ATOM 1963 CB ALA A 126 8.253 8.103 8.197 1.00 63.32 C ATOM 0 H ALA A 126 8.864 5.871 9.130 1.00 72.41 H new ATOM 0 HA ALA A 126 8.179 6.708 6.577 1.00 42.20 H new ATOM 0 HB1 ALA A 126 8.076 8.982 7.578 1.00 63.32 H new ATOM 0 HB2 ALA A 126 7.306 7.749 8.604 1.00 63.32 H new ATOM 0 HB3 ALA A 126 8.924 8.365 9.015 1.00 63.32 H new ATOM 1969 N GLU A 127 11.259 7.542 7.341 1.00 24.14 N ATOM 1970 CA GLU A 127 12.499 8.069 6.780 1.00 71.51 C ATOM 1971 C GLU A 127 12.989 7.161 5.661 1.00 5.32 C ATOM 1972 O GLU A 127 13.486 7.630 4.622 1.00 11.25 O ATOM 1973 CB GLU A 127 13.559 8.189 7.861 1.00 25.21 C ATOM 1974 CG GLU A 127 13.162 9.095 9.009 1.00 42.32 C ATOM 1975 CD GLU A 127 14.191 9.123 10.103 1.00 22.12 C ATOM 1976 OE1 GLU A 127 15.155 9.905 10.010 1.00 73.24 O ATOM 1977 OE2 GLU A 127 14.042 8.376 11.089 1.00 53.42 O ATOM 0 H GLU A 127 11.342 7.194 8.296 1.00 24.14 H new ATOM 0 HA GLU A 127 12.307 9.061 6.372 1.00 71.51 H new ATOM 0 HB2 GLU A 127 13.779 7.196 8.253 1.00 25.21 H new ATOM 0 HB3 GLU A 127 14.479 8.566 7.414 1.00 25.21 H new ATOM 0 HG2 GLU A 127 13.009 10.107 8.633 1.00 42.32 H new ATOM 0 HG3 GLU A 127 12.209 8.760 9.419 1.00 42.32 H new ATOM 1984 N GLU A 128 12.805 5.867 5.864 1.00 35.22 N ATOM 1985 CA GLU A 128 13.183 4.867 4.890 1.00 20.55 C ATOM 1986 C GLU A 128 12.263 4.969 3.672 1.00 4.04 C ATOM 1987 O GLU A 128 12.715 4.840 2.537 1.00 4.41 O ATOM 1988 CB GLU A 128 13.137 3.465 5.523 1.00 40.45 C ATOM 1989 CG GLU A 128 13.503 2.313 4.589 1.00 54.11 C ATOM 1990 CD GLU A 128 14.860 2.473 3.934 1.00 65.55 C ATOM 1991 OE1 GLU A 128 15.889 2.356 4.619 1.00 43.25 O ATOM 1992 OE2 GLU A 128 14.915 2.711 2.719 1.00 0.43 O ATOM 0 H GLU A 128 12.388 5.484 6.712 1.00 35.22 H new ATOM 0 HA GLU A 128 14.207 5.042 4.559 1.00 20.55 H new ATOM 0 HB2 GLU A 128 13.815 3.448 6.377 1.00 40.45 H new ATOM 0 HB3 GLU A 128 12.133 3.292 5.910 1.00 40.45 H new ATOM 0 HG2 GLU A 128 13.488 1.380 5.153 1.00 54.11 H new ATOM 0 HG3 GLU A 128 12.742 2.229 3.813 1.00 54.11 H new ATOM 1999 N ILE A 129 10.981 5.246 3.907 1.00 70.44 N ATOM 2000 CA ILE A 129 10.039 5.413 2.815 1.00 65.52 C ATOM 2001 C ILE A 129 10.454 6.600 1.948 1.00 51.34 C ATOM 2002 O ILE A 129 10.532 6.470 0.722 1.00 55.34 O ATOM 2003 CB ILE A 129 8.560 5.553 3.285 1.00 31.23 C ATOM 2004 CG1 ILE A 129 8.140 4.310 4.089 1.00 21.40 C ATOM 2005 CG2 ILE A 129 7.638 5.722 2.071 1.00 42.32 C ATOM 2006 CD1 ILE A 129 6.734 4.379 4.663 1.00 33.14 C ATOM 0 H ILE A 129 10.579 5.358 4.838 1.00 70.44 H new ATOM 0 HA ILE A 129 10.074 4.498 2.224 1.00 65.52 H new ATOM 0 HB ILE A 129 8.476 6.433 3.923 1.00 31.23 H new ATOM 0 HG12 ILE A 129 8.214 3.434 3.445 1.00 21.40 H new ATOM 0 HG13 ILE A 129 8.846 4.165 4.906 1.00 21.40 H new ATOM 0 HG21 ILE A 129 6.606 5.819 2.409 1.00 42.32 H new ATOM 0 HG22 ILE A 129 7.925 6.617 1.518 1.00 42.32 H new ATOM 0 HG23 ILE A 129 7.727 4.851 1.422 1.00 42.32 H new ATOM 0 HD11 ILE A 129 6.521 3.463 5.214 1.00 33.14 H new ATOM 0 HD12 ILE A 129 6.657 5.233 5.336 1.00 33.14 H new ATOM 0 HD13 ILE A 129 6.015 4.490 3.852 1.00 33.14 H new ATOM 2018 N ILE A 130 10.795 7.728 2.600 1.00 41.53 N ATOM 2019 CA ILE A 130 11.278 8.939 1.900 1.00 2.42 C ATOM 2020 C ILE A 130 12.446 8.575 0.978 1.00 40.41 C ATOM 2021 O ILE A 130 12.495 8.999 -0.177 1.00 12.15 O ATOM 2022 CB ILE A 130 11.775 10.048 2.897 1.00 11.31 C ATOM 2023 CG1 ILE A 130 10.656 10.495 3.843 1.00 23.10 C ATOM 2024 CG2 ILE A 130 12.332 11.256 2.134 1.00 41.32 C ATOM 2025 CD1 ILE A 130 11.085 11.508 4.891 1.00 51.11 C ATOM 0 H ILE A 130 10.745 7.828 3.614 1.00 41.53 H new ATOM 0 HA ILE A 130 10.434 9.332 1.333 1.00 2.42 H new ATOM 0 HB ILE A 130 12.573 9.611 3.498 1.00 11.31 H new ATOM 0 HG12 ILE A 130 9.847 10.923 3.252 1.00 23.10 H new ATOM 0 HG13 ILE A 130 10.252 9.618 4.348 1.00 23.10 H new ATOM 0 HG21 ILE A 130 12.670 12.011 2.844 1.00 41.32 H new ATOM 0 HG22 ILE A 130 13.171 10.940 1.514 1.00 41.32 H new ATOM 0 HG23 ILE A 130 11.552 11.678 1.501 1.00 41.32 H new ATOM 0 HD11 ILE A 130 10.231 11.768 5.517 1.00 51.11 H new ATOM 0 HD12 ILE A 130 11.872 11.079 5.511 1.00 51.11 H new ATOM 0 HD13 ILE A 130 11.460 12.405 4.398 1.00 51.11 H new ATOM 2037 N ARG A 131 13.343 7.747 1.495 1.00 15.02 N ATOM 2038 CA ARG A 131 14.541 7.320 0.787 1.00 74.02 C ATOM 2039 C ARG A 131 14.214 6.677 -0.579 1.00 45.02 C ATOM 2040 O ARG A 131 14.785 7.087 -1.605 1.00 3.14 O ATOM 2041 CB ARG A 131 15.323 6.353 1.671 1.00 4.25 C ATOM 2042 CG ARG A 131 16.556 5.749 1.039 1.00 4.54 C ATOM 2043 CD ARG A 131 17.169 4.734 1.973 1.00 23.35 C ATOM 2044 NE ARG A 131 18.266 4.009 1.355 1.00 35.12 N ATOM 2045 CZ ARG A 131 18.502 2.702 1.517 1.00 44.04 C ATOM 2046 NH1 ARG A 131 17.674 1.942 2.254 1.00 32.25 N ATOM 2047 NH2 ARG A 131 19.553 2.155 0.926 1.00 11.43 N ATOM 0 H ARG A 131 13.258 7.348 2.430 1.00 15.02 H new ATOM 0 HA ARG A 131 15.148 8.200 0.576 1.00 74.02 H new ATOM 0 HB2 ARG A 131 15.621 6.877 2.579 1.00 4.25 H new ATOM 0 HB3 ARG A 131 14.657 5.545 1.973 1.00 4.25 H new ATOM 0 HG2 ARG A 131 16.295 5.274 0.093 1.00 4.54 H new ATOM 0 HG3 ARG A 131 17.280 6.532 0.813 1.00 4.54 H new ATOM 0 HD2 ARG A 131 17.529 5.239 2.869 1.00 23.35 H new ATOM 0 HD3 ARG A 131 16.403 4.027 2.292 1.00 23.35 H new ATOM 0 HE ARG A 131 18.902 4.534 0.755 1.00 35.12 H new ATOM 0 HH11 ARG A 131 16.856 2.361 2.697 1.00 32.25 H new ATOM 0 HH12 ARG A 131 17.864 0.947 2.371 1.00 32.25 H new ATOM 0 HH21 ARG A 131 20.173 2.729 0.354 1.00 11.43 H new ATOM 0 HH22 ARG A 131 19.743 1.160 1.042 1.00 11.43 H new ATOM 2061 N LYS A 132 13.277 5.717 -0.618 1.00 40.33 N ATOM 2062 CA LYS A 132 12.929 5.127 -1.911 1.00 1.31 C ATOM 2063 C LYS A 132 12.094 6.069 -2.761 1.00 51.13 C ATOM 2064 O LYS A 132 12.225 6.078 -3.976 1.00 42.10 O ATOM 2065 CB LYS A 132 12.351 3.672 -1.890 1.00 21.11 C ATOM 2066 CG LYS A 132 11.098 3.411 -1.065 1.00 2.34 C ATOM 2067 CD LYS A 132 11.354 3.154 0.434 1.00 12.01 C ATOM 2068 CE LYS A 132 12.109 1.835 0.742 1.00 35.21 C ATOM 2069 NZ LYS A 132 13.591 1.906 0.589 1.00 73.03 N ATOM 0 H LYS A 132 12.771 5.350 0.188 1.00 40.33 H new ATOM 0 HA LYS A 132 13.898 4.993 -2.391 1.00 1.31 H new ATOM 0 HB2 LYS A 132 12.139 3.382 -2.919 1.00 21.11 H new ATOM 0 HB3 LYS A 132 13.134 3.007 -1.526 1.00 21.11 H new ATOM 0 HG2 LYS A 132 10.430 4.267 -1.164 1.00 2.34 H new ATOM 0 HG3 LYS A 132 10.577 2.550 -1.483 1.00 2.34 H new ATOM 0 HD2 LYS A 132 11.926 3.988 0.840 1.00 12.01 H new ATOM 0 HD3 LYS A 132 10.397 3.140 0.956 1.00 12.01 H new ATOM 0 HE2 LYS A 132 11.878 1.532 1.763 1.00 35.21 H new ATOM 0 HE3 LYS A 132 11.728 1.054 0.084 1.00 35.21 H new ATOM 0 HZ1 LYS A 132 13.908 1.163 -0.066 1.00 73.03 H new ATOM 0 HZ2 LYS A 132 13.857 2.838 0.211 1.00 73.03 H new ATOM 0 HZ3 LYS A 132 14.043 1.767 1.515 1.00 73.03 H new ATOM 2083 N VAL A 133 11.261 6.883 -2.108 1.00 64.32 N ATOM 2084 CA VAL A 133 10.448 7.891 -2.802 1.00 72.10 C ATOM 2085 C VAL A 133 11.332 8.818 -3.644 1.00 24.52 C ATOM 2086 O VAL A 133 11.062 9.036 -4.835 1.00 75.43 O ATOM 2087 CB VAL A 133 9.598 8.744 -1.799 1.00 1.34 C ATOM 2088 CG1 VAL A 133 8.932 9.920 -2.497 1.00 65.54 C ATOM 2089 CG2 VAL A 133 8.533 7.888 -1.137 1.00 21.41 C ATOM 0 H VAL A 133 11.130 6.865 -1.097 1.00 64.32 H new ATOM 0 HA VAL A 133 9.764 7.352 -3.457 1.00 72.10 H new ATOM 0 HB VAL A 133 10.281 9.127 -1.041 1.00 1.34 H new ATOM 0 HG11 VAL A 133 8.350 10.491 -1.773 1.00 65.54 H new ATOM 0 HG12 VAL A 133 9.695 10.562 -2.936 1.00 65.54 H new ATOM 0 HG13 VAL A 133 8.272 9.551 -3.282 1.00 65.54 H new ATOM 0 HG21 VAL A 133 7.954 8.499 -0.444 1.00 21.41 H new ATOM 0 HG22 VAL A 133 7.871 7.477 -1.899 1.00 21.41 H new ATOM 0 HG23 VAL A 133 9.009 7.073 -0.591 1.00 21.41 H new ATOM 2099 N ARG A 134 12.394 9.312 -3.032 1.00 30.22 N ATOM 2100 CA ARG A 134 13.311 10.241 -3.685 1.00 33.25 C ATOM 2101 C ARG A 134 13.997 9.602 -4.889 1.00 45.14 C ATOM 2102 O ARG A 134 14.003 10.169 -5.988 1.00 70.02 O ATOM 2103 CB ARG A 134 14.366 10.751 -2.695 1.00 14.20 C ATOM 2104 CG ARG A 134 13.800 11.495 -1.493 1.00 42.21 C ATOM 2105 CD ARG A 134 13.020 12.729 -1.903 1.00 31.41 C ATOM 2106 NE ARG A 134 13.860 13.696 -2.602 1.00 72.52 N ATOM 2107 CZ ARG A 134 13.427 14.715 -3.335 1.00 32.34 C ATOM 2108 NH1 ARG A 134 12.133 14.929 -3.493 1.00 75.54 N ATOM 2109 NH2 ARG A 134 14.297 15.529 -3.903 1.00 42.43 N ATOM 0 H ARG A 134 12.648 9.084 -2.071 1.00 30.22 H new ATOM 0 HA ARG A 134 12.717 11.084 -4.039 1.00 33.25 H new ATOM 0 HB2 ARG A 134 14.951 9.903 -2.338 1.00 14.20 H new ATOM 0 HB3 ARG A 134 15.053 11.412 -3.224 1.00 14.20 H new ATOM 0 HG2 ARG A 134 13.151 10.827 -0.927 1.00 42.21 H new ATOM 0 HG3 ARG A 134 14.615 11.785 -0.830 1.00 42.21 H new ATOM 0 HD2 ARG A 134 12.190 12.437 -2.547 1.00 31.41 H new ATOM 0 HD3 ARG A 134 12.588 13.196 -1.018 1.00 31.41 H new ATOM 0 HE ARG A 134 14.870 13.579 -2.520 1.00 72.52 H new ATOM 0 HH11 ARG A 134 11.456 14.308 -3.050 1.00 75.54 H new ATOM 0 HH12 ARG A 134 11.811 15.715 -4.058 1.00 75.54 H new ATOM 0 HH21 ARG A 134 15.297 15.374 -3.778 1.00 42.43 H new ATOM 0 HH22 ARG A 134 13.969 16.313 -4.467 1.00 42.43 H new ATOM 2123 N LEU A 135 14.531 8.419 -4.685 1.00 73.24 N ATOM 2124 CA LEU A 135 15.279 7.719 -5.715 1.00 40.40 C ATOM 2125 C LEU A 135 14.367 7.252 -6.857 1.00 61.20 C ATOM 2126 O LEU A 135 14.639 7.509 -8.038 1.00 72.20 O ATOM 2127 CB LEU A 135 15.996 6.508 -5.097 1.00 52.53 C ATOM 2128 CG LEU A 135 16.900 5.700 -6.034 1.00 73.34 C ATOM 2129 CD1 LEU A 135 18.082 6.532 -6.495 1.00 74.14 C ATOM 2130 CD2 LEU A 135 17.374 4.427 -5.356 1.00 1.50 C ATOM 0 H LEU A 135 14.461 7.912 -3.803 1.00 73.24 H new ATOM 0 HA LEU A 135 16.009 8.413 -6.132 1.00 40.40 H new ATOM 0 HB2 LEU A 135 16.599 6.859 -4.259 1.00 52.53 H new ATOM 0 HB3 LEU A 135 15.241 5.837 -4.687 1.00 52.53 H new ATOM 0 HG LEU A 135 16.316 5.424 -6.912 1.00 73.34 H new ATOM 0 HD11 LEU A 135 18.709 5.937 -7.159 1.00 74.14 H new ATOM 0 HD12 LEU A 135 17.722 7.412 -7.028 1.00 74.14 H new ATOM 0 HD13 LEU A 135 18.666 6.846 -5.630 1.00 74.14 H new ATOM 0 HD21 LEU A 135 18.014 3.868 -6.038 1.00 1.50 H new ATOM 0 HD22 LEU A 135 17.936 4.681 -4.457 1.00 1.50 H new ATOM 0 HD23 LEU A 135 16.513 3.817 -5.085 1.00 1.50 H new ATOM 2142 N HIS A 136 13.281 6.615 -6.495 1.00 42.22 N ATOM 2143 CA HIS A 136 12.394 5.994 -7.452 1.00 24.11 C ATOM 2144 C HIS A 136 11.422 6.976 -8.101 1.00 60.01 C ATOM 2145 O HIS A 136 11.347 7.052 -9.310 1.00 12.13 O ATOM 2146 CB HIS A 136 11.640 4.818 -6.775 1.00 55.53 C ATOM 2147 CG HIS A 136 10.600 4.132 -7.620 1.00 3.31 C ATOM 2148 ND1 HIS A 136 10.876 3.154 -8.539 1.00 32.04 N ATOM 2149 CD2 HIS A 136 9.255 4.307 -7.655 1.00 23.42 C ATOM 2150 CE1 HIS A 136 9.726 2.767 -9.097 1.00 23.41 C ATOM 2151 NE2 HIS A 136 8.701 3.442 -8.591 1.00 13.10 N ATOM 0 H HIS A 136 12.985 6.511 -5.525 1.00 42.22 H new ATOM 0 HA HIS A 136 13.009 5.612 -8.267 1.00 24.11 H new ATOM 0 HB2 HIS A 136 12.373 4.075 -6.460 1.00 55.53 H new ATOM 0 HB3 HIS A 136 11.158 5.193 -5.872 1.00 55.53 H new ATOM 0 HD2 HIS A 136 8.701 5.009 -7.050 1.00 23.42 H new ATOM 0 HE1 HIS A 136 9.641 2.006 -9.859 1.00 23.41 H new ATOM 0 HE2 HIS A 136 7.716 3.346 -8.837 1.00 13.10 H new