USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1131 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 78 LYS NZ :NH3+ 137:sc= 1.11 (180deg=0.0156) USER MOD Set 1.2: A 140 TYR OH : rot 130:sc= 0.944 USER MOD Set 2.1: A 105 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000483) USER MOD Set 2.2: A 109 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Set 3.1: A 83 THR OG1 : rot 120:sc=-0.00349 USER MOD Set 3.2: A 101 LYS NZ :NH3+ 164:sc= 1.27 (180deg=1.06) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 MET CE :methyl 158:sc= -0.0362 (180deg=-0.572) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ -155:sc= 0.968 (180deg=-0.0882) USER MOD Single : A 13 CYS SG : rot 84:sc= 0.328 USER MOD Single : A 17 TYR OH : rot 180:sc= 0.501 USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 25 SER OG : rot -96:sc= 0.00159 USER MOD Single : A 31 THR OG1 : rot -49:sc= 0.778 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 35:sc= 1.72 USER MOD Single : A 37 SER OG : rot 180:sc= 0.0611 USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.0527 USER MOD Single : A 44 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 48 TYR OH : rot -26:sc= 1.25 USER MOD Single : A 49 GLN : amide:sc= 0.599 K(o=0.6,f=0) USER MOD Single : A 50 HIS : no HD1:sc= -0.117 K(o=-0.12,f=-4.4!) USER MOD Single : A 53 GLN : amide:sc= -0.07 K(o=-0.07,f=-1) USER MOD Single : A 54 GLN : amide:sc= 0.534 K(o=0.53,f=-1.1) USER MOD Single : A 55 CYS SG : rot 75:sc= 0.352 USER MOD Single : A 56 THR OG1 : rot -160:sc= -1.46! USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot -130:sc= 0 USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= 0.733 K(o=0.73,f=-4.9!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot -75:sc= 0.0196 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 ASN : amide:sc= 0.187 X(o=0.19,f=-0.057) USER MOD Single : A 113 LYS NZ :NH3+ 139:sc= 1.15 (180deg=0.0409) USER MOD Single : A 118 SER OG : rot 104:sc= 1.25 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= -0.124 K(o=-0.12,f=-0.89) USER MOD Single : A 143 GLN : amide:sc= 0.536 K(o=0.54,f=-0.064) USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.867 -10.413 -2.928 1.00 0.00 N ATOM 2 CA GLY A 1 -4.101 -11.204 -2.948 1.00 0.00 C ATOM 3 C GLY A 1 -4.114 -12.178 -1.789 1.00 0.00 C ATOM 4 O GLY A 1 -3.187 -12.972 -1.653 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.868 -9.748 -3.727 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.810 -9.882 -2.036 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.047 -11.047 -3.007 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.966 -10.544 -2.888 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.179 -11.747 -3.890 1.00 0.00 H new ATOM 7 N ILE A 2 -5.153 -12.160 -0.951 1.00 0.00 N ATOM 8 CA ILE A 2 -5.294 -13.100 0.163 1.00 0.00 C ATOM 9 C ILE A 2 -5.855 -14.401 -0.431 1.00 0.00 C ATOM 10 O ILE A 2 -7.061 -14.650 -0.386 1.00 0.00 O ATOM 11 CB ILE A 2 -6.167 -12.489 1.293 1.00 0.00 C ATOM 12 CG1 ILE A 2 -5.595 -11.137 1.791 1.00 0.00 C ATOM 13 CG2 ILE A 2 -6.262 -13.463 2.487 1.00 0.00 C ATOM 14 CD1 ILE A 2 -6.598 -10.298 2.591 1.00 0.00 C ATOM 0 H ILE A 2 -5.921 -11.493 -1.026 1.00 0.00 H new ATOM 0 HA ILE A 2 -4.340 -13.316 0.645 1.00 0.00 H new ATOM 0 HB ILE A 2 -7.158 -12.316 0.874 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -4.720 -11.330 2.412 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -5.255 -10.558 0.932 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -6.877 -13.020 3.270 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -6.713 -14.399 2.158 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -5.263 -13.659 2.877 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -6.125 -9.368 2.905 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -7.463 -10.073 1.967 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -6.920 -10.856 3.470 1.00 0.00 H new ATOM 26 N ARG A 3 -5.020 -15.202 -1.096 1.00 0.00 N ATOM 27 CA ARG A 3 -5.440 -16.444 -1.765 1.00 0.00 C ATOM 28 C ARG A 3 -4.260 -17.411 -1.897 1.00 0.00 C ATOM 29 O ARG A 3 -4.280 -18.288 -2.765 1.00 0.00 O ATOM 30 CB ARG A 3 -6.027 -16.080 -3.156 1.00 0.00 C ATOM 31 CG ARG A 3 -7.480 -16.548 -3.320 1.00 0.00 C ATOM 32 CD ARG A 3 -7.994 -16.210 -4.727 1.00 0.00 C ATOM 33 NE ARG A 3 -9.298 -15.522 -4.693 1.00 0.00 N ATOM 34 CZ ARG A 3 -9.637 -14.436 -5.400 1.00 0.00 C ATOM 35 NH1 ARG A 3 -8.833 -13.943 -6.338 1.00 0.00 N ATOM 36 NH2 ARG A 3 -10.801 -13.851 -5.152 1.00 0.00 N ATOM 0 H ARG A 3 -4.023 -15.009 -1.189 1.00 0.00 H new ATOM 0 HA ARG A 3 -6.203 -16.947 -1.171 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -5.978 -15.000 -3.296 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -5.413 -16.531 -3.936 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -7.544 -17.623 -3.151 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -8.110 -16.069 -2.571 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -7.265 -15.579 -5.236 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -8.084 -17.127 -5.309 1.00 0.00 H new ATOM 0 HE ARG A 3 -10.009 -15.910 -4.073 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -7.938 -14.393 -6.531 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -9.111 -13.115 -6.864 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -11.419 -14.229 -4.434 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -11.078 -13.023 -5.679 1.00 0.00 H new ATOM 50 N MET A 4 -3.248 -17.281 -1.043 1.00 0.00 N ATOM 51 CA MET A 4 -2.024 -18.061 -1.109 1.00 0.00 C ATOM 52 C MET A 4 -1.871 -18.958 0.110 1.00 0.00 C ATOM 53 O MET A 4 -2.683 -18.916 1.037 1.00 0.00 O ATOM 54 CB MET A 4 -0.836 -17.096 -1.289 1.00 0.00 C ATOM 55 CG MET A 4 -0.750 -16.577 -2.726 1.00 0.00 C ATOM 56 SD MET A 4 -1.977 -15.330 -3.207 1.00 0.00 S ATOM 57 CE MET A 4 -2.585 -15.988 -4.780 1.00 0.00 C ATOM 0 H MET A 4 -3.260 -16.615 -0.271 1.00 0.00 H new ATOM 0 HA MET A 4 -2.058 -18.734 -1.966 1.00 0.00 H new ATOM 0 HB2 MET A 4 -0.941 -16.256 -0.603 1.00 0.00 H new ATOM 0 HB3 MET A 4 0.091 -17.606 -1.029 1.00 0.00 H new ATOM 0 HG2 MET A 4 0.244 -16.155 -2.878 1.00 0.00 H new ATOM 0 HG3 MET A 4 -0.843 -17.427 -3.402 1.00 0.00 H new ATOM 0 HE1 MET A 4 -3.571 -15.574 -4.991 1.00 0.00 H new ATOM 0 HE2 MET A 4 -1.897 -15.713 -5.580 1.00 0.00 H new ATOM 0 HE3 MET A 4 -2.654 -17.074 -4.718 1.00 0.00 H new ATOM 67 N ALA A 5 -0.828 -19.785 0.070 1.00 0.00 N ATOM 68 CA ALA A 5 -0.403 -20.683 1.121 1.00 0.00 C ATOM 69 C ALA A 5 1.125 -20.611 1.193 1.00 0.00 C ATOM 70 O ALA A 5 1.822 -21.541 0.797 1.00 0.00 O ATOM 71 CB ALA A 5 -0.935 -22.094 0.842 1.00 0.00 C ATOM 0 H ALA A 5 -0.226 -19.843 -0.751 1.00 0.00 H new ATOM 0 HA ALA A 5 -0.806 -20.399 2.093 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -0.613 -22.768 1.636 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -2.024 -22.071 0.805 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -0.547 -22.447 -0.113 1.00 0.00 H new ATOM 77 N THR A 6 1.645 -19.469 1.631 1.00 0.00 N ATOM 78 CA THR A 6 3.063 -19.202 1.860 1.00 0.00 C ATOM 79 C THR A 6 3.141 -18.468 3.211 1.00 0.00 C ATOM 80 O THR A 6 2.100 -18.053 3.743 1.00 0.00 O ATOM 81 CB THR A 6 3.621 -18.355 0.701 1.00 0.00 C ATOM 82 OG1 THR A 6 3.098 -18.731 -0.562 1.00 0.00 O ATOM 83 CG2 THR A 6 5.145 -18.479 0.572 1.00 0.00 C ATOM 0 H THR A 6 1.059 -18.662 1.847 1.00 0.00 H new ATOM 0 HA THR A 6 3.664 -20.111 1.894 1.00 0.00 H new ATOM 0 HB THR A 6 3.323 -17.337 0.954 1.00 0.00 H new ATOM 0 HG1 THR A 6 3.484 -18.161 -1.259 1.00 0.00 H new ATOM 0 HG21 THR A 6 5.491 -17.864 -0.259 1.00 0.00 H new ATOM 0 HG22 THR A 6 5.617 -18.141 1.495 1.00 0.00 H new ATOM 0 HG23 THR A 6 5.411 -19.520 0.388 1.00 0.00 H new ATOM 91 N LYS A 7 4.324 -18.285 3.801 1.00 0.00 N ATOM 92 CA LYS A 7 4.440 -17.617 5.104 1.00 0.00 C ATOM 93 C LYS A 7 5.545 -16.574 5.131 1.00 0.00 C ATOM 94 O LYS A 7 6.169 -16.287 4.114 1.00 0.00 O ATOM 95 CB LYS A 7 4.537 -18.665 6.227 1.00 0.00 C ATOM 96 CG LYS A 7 5.760 -19.583 6.128 1.00 0.00 C ATOM 97 CD LYS A 7 5.822 -20.509 7.344 1.00 0.00 C ATOM 98 CE LYS A 7 6.992 -21.472 7.176 1.00 0.00 C ATOM 99 NZ LYS A 7 7.202 -22.325 8.363 1.00 0.00 N ATOM 0 H LYS A 7 5.213 -18.587 3.402 1.00 0.00 H new ATOM 0 HA LYS A 7 3.531 -17.043 5.283 1.00 0.00 H new ATOM 0 HB2 LYS A 7 4.560 -18.150 7.188 1.00 0.00 H new ATOM 0 HB3 LYS A 7 3.635 -19.278 6.215 1.00 0.00 H new ATOM 0 HG2 LYS A 7 5.708 -20.174 5.214 1.00 0.00 H new ATOM 0 HG3 LYS A 7 6.669 -18.985 6.070 1.00 0.00 H new ATOM 0 HD2 LYS A 7 5.943 -19.925 8.256 1.00 0.00 H new ATOM 0 HD3 LYS A 7 4.889 -21.064 7.443 1.00 0.00 H new ATOM 0 HE2 LYS A 7 6.815 -22.104 6.306 1.00 0.00 H new ATOM 0 HE3 LYS A 7 7.900 -20.903 6.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 8.008 -22.960 8.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 7.398 -21.726 9.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 6.347 -22.890 8.540 1.00 0.00 H new ATOM 113 N ILE A 8 5.724 -15.958 6.294 1.00 0.00 N ATOM 114 CA ILE A 8 6.747 -14.963 6.547 1.00 0.00 C ATOM 115 C ILE A 8 7.406 -15.262 7.884 1.00 0.00 C ATOM 116 O ILE A 8 6.762 -15.826 8.777 1.00 0.00 O ATOM 117 CB ILE A 8 6.155 -13.532 6.555 1.00 0.00 C ATOM 118 CG1 ILE A 8 5.375 -13.094 7.815 1.00 0.00 C ATOM 119 CG2 ILE A 8 5.310 -13.255 5.312 1.00 0.00 C ATOM 120 CD1 ILE A 8 4.050 -13.810 8.120 1.00 0.00 C ATOM 0 H ILE A 8 5.140 -16.147 7.109 1.00 0.00 H new ATOM 0 HA ILE A 8 7.485 -15.009 5.746 1.00 0.00 H new ATOM 0 HB ILE A 8 7.056 -12.919 6.559 1.00 0.00 H new ATOM 0 HG12 ILE A 8 6.031 -13.221 8.676 1.00 0.00 H new ATOM 0 HG13 ILE A 8 5.167 -12.028 7.727 1.00 0.00 H new ATOM 0 HG21 ILE A 8 4.915 -12.240 5.359 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.928 -13.362 4.421 1.00 0.00 H new ATOM 0 HG23 ILE A 8 4.484 -13.965 5.268 1.00 0.00 H new ATOM 0 HD11 ILE A 8 3.616 -13.399 9.031 1.00 0.00 H new ATOM 0 HD12 ILE A 8 3.358 -13.664 7.291 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.235 -14.876 8.255 1.00 0.00 H new ATOM 132 N ASP A 9 8.672 -14.884 8.034 1.00 0.00 N ATOM 133 CA ASP A 9 9.371 -15.018 9.305 1.00 0.00 C ATOM 134 C ASP A 9 9.146 -13.650 9.932 1.00 0.00 C ATOM 135 O ASP A 9 9.998 -12.758 9.868 1.00 0.00 O ATOM 136 CB ASP A 9 10.852 -15.353 9.152 1.00 0.00 C ATOM 137 CG ASP A 9 11.576 -15.360 10.506 1.00 0.00 C ATOM 138 OD1 ASP A 9 10.939 -15.211 11.581 1.00 0.00 O ATOM 139 OD2 ASP A 9 12.808 -15.571 10.484 1.00 0.00 O ATOM 0 H ASP A 9 9.236 -14.481 7.286 1.00 0.00 H new ATOM 0 HA ASP A 9 9.002 -15.848 9.908 1.00 0.00 H new ATOM 0 HB2 ASP A 9 10.957 -16.329 8.678 1.00 0.00 H new ATOM 0 HB3 ASP A 9 11.323 -14.625 8.491 1.00 0.00 H new ATOM 144 N LYS A 10 7.940 -13.444 10.461 1.00 0.00 N ATOM 145 CA LYS A 10 7.540 -12.163 11.001 1.00 0.00 C ATOM 146 C LYS A 10 8.410 -11.714 12.153 1.00 0.00 C ATOM 147 O LYS A 10 8.476 -10.519 12.388 1.00 0.00 O ATOM 148 CB LYS A 10 6.072 -12.206 11.443 1.00 0.00 C ATOM 149 CG LYS A 10 5.420 -10.834 11.223 1.00 0.00 C ATOM 150 CD LYS A 10 4.410 -10.429 12.300 1.00 0.00 C ATOM 151 CE LYS A 10 5.073 -9.928 13.596 1.00 0.00 C ATOM 152 NZ LYS A 10 5.263 -10.971 14.622 1.00 0.00 N ATOM 0 H LYS A 10 7.221 -14.164 10.523 1.00 0.00 H new ATOM 0 HA LYS A 10 7.664 -11.434 10.200 1.00 0.00 H new ATOM 0 HB2 LYS A 10 5.535 -12.968 10.878 1.00 0.00 H new ATOM 0 HB3 LYS A 10 6.008 -12.484 12.495 1.00 0.00 H new ATOM 0 HG2 LYS A 10 6.203 -10.078 11.175 1.00 0.00 H new ATOM 0 HG3 LYS A 10 4.919 -10.835 10.255 1.00 0.00 H new ATOM 0 HD2 LYS A 10 3.762 -9.647 11.905 1.00 0.00 H new ATOM 0 HD3 LYS A 10 3.774 -11.283 12.532 1.00 0.00 H new ATOM 0 HE2 LYS A 10 6.043 -9.495 13.351 1.00 0.00 H new ATOM 0 HE3 LYS A 10 4.464 -9.128 14.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 5.302 -10.529 15.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 4.468 -11.641 14.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 6.152 -11.479 14.440 1.00 0.00 H new ATOM 166 N GLU A 11 9.063 -12.614 12.869 1.00 0.00 N ATOM 167 CA GLU A 11 9.838 -12.254 14.040 1.00 0.00 C ATOM 168 C GLU A 11 11.079 -11.488 13.601 1.00 0.00 C ATOM 169 O GLU A 11 11.262 -10.332 13.993 1.00 0.00 O ATOM 170 CB GLU A 11 10.155 -13.533 14.832 1.00 0.00 C ATOM 171 CG GLU A 11 8.912 -14.379 15.156 1.00 0.00 C ATOM 172 CD GLU A 11 7.852 -13.552 15.875 1.00 0.00 C ATOM 173 OE1 GLU A 11 7.064 -12.847 15.211 1.00 0.00 O ATOM 174 OE2 GLU A 11 7.847 -13.544 17.126 1.00 0.00 O ATOM 0 H GLU A 11 9.070 -13.611 12.654 1.00 0.00 H new ATOM 0 HA GLU A 11 9.281 -11.593 14.705 1.00 0.00 H new ATOM 0 HB2 GLU A 11 10.858 -14.139 14.261 1.00 0.00 H new ATOM 0 HB3 GLU A 11 10.652 -13.260 15.763 1.00 0.00 H new ATOM 0 HG2 GLU A 11 8.496 -14.786 14.234 1.00 0.00 H new ATOM 0 HG3 GLU A 11 9.199 -15.227 15.778 1.00 0.00 H new ATOM 181 N ALA A 12 11.884 -12.100 12.729 1.00 0.00 N ATOM 182 CA ALA A 12 13.062 -11.461 12.172 1.00 0.00 C ATOM 183 C ALA A 12 12.666 -10.243 11.338 1.00 0.00 C ATOM 184 O ALA A 12 13.246 -9.168 11.492 1.00 0.00 O ATOM 185 CB ALA A 12 13.837 -12.474 11.329 1.00 0.00 C ATOM 0 H ALA A 12 11.731 -13.051 12.394 1.00 0.00 H new ATOM 0 HA ALA A 12 13.703 -11.113 12.982 1.00 0.00 H new ATOM 0 HB1 ALA A 12 14.722 -11.997 10.909 1.00 0.00 H new ATOM 0 HB2 ALA A 12 14.140 -13.313 11.956 1.00 0.00 H new ATOM 0 HB3 ALA A 12 13.202 -12.836 10.520 1.00 0.00 H new ATOM 191 N CYS A 13 11.661 -10.381 10.468 1.00 0.00 N ATOM 192 CA CYS A 13 11.279 -9.285 9.593 1.00 0.00 C ATOM 193 C CYS A 13 10.733 -8.095 10.389 1.00 0.00 C ATOM 194 O CYS A 13 11.007 -6.953 10.018 1.00 0.00 O ATOM 195 CB CYS A 13 10.279 -9.755 8.529 1.00 0.00 C ATOM 196 SG CYS A 13 11.004 -11.054 7.485 1.00 0.00 S ATOM 0 H CYS A 13 11.108 -11.231 10.356 1.00 0.00 H new ATOM 0 HA CYS A 13 12.177 -8.943 9.078 1.00 0.00 H new ATOM 0 HB2 CYS A 13 9.378 -10.132 9.013 1.00 0.00 H new ATOM 0 HB3 CYS A 13 9.978 -8.911 7.909 1.00 0.00 H new ATOM 0 HG CYS A 13 10.863 -12.208 8.067 1.00 0.00 H new ATOM 202 N ARG A 14 9.998 -8.329 11.486 1.00 0.00 N ATOM 203 CA ARG A 14 9.501 -7.256 12.344 1.00 0.00 C ATOM 204 C ARG A 14 10.666 -6.472 12.928 1.00 0.00 C ATOM 205 O ARG A 14 10.521 -5.264 13.066 1.00 0.00 O ATOM 206 CB ARG A 14 8.579 -7.797 13.452 1.00 0.00 C ATOM 207 CG ARG A 14 7.910 -6.716 14.322 1.00 0.00 C ATOM 208 CD ARG A 14 7.598 -7.239 15.726 1.00 0.00 C ATOM 209 NE ARG A 14 8.827 -7.342 16.531 1.00 0.00 N ATOM 210 CZ ARG A 14 9.159 -6.651 17.628 1.00 0.00 C ATOM 211 NH1 ARG A 14 8.285 -5.860 18.242 1.00 0.00 N ATOM 212 NH2 ARG A 14 10.399 -6.767 18.075 1.00 0.00 N ATOM 0 H ARG A 14 9.735 -9.264 11.798 1.00 0.00 H new ATOM 0 HA ARG A 14 8.901 -6.581 11.733 1.00 0.00 H new ATOM 0 HB2 ARG A 14 7.801 -8.406 12.992 1.00 0.00 H new ATOM 0 HB3 ARG A 14 9.159 -8.456 14.098 1.00 0.00 H new ATOM 0 HG2 ARG A 14 8.565 -5.848 14.393 1.00 0.00 H new ATOM 0 HG3 ARG A 14 6.989 -6.382 13.844 1.00 0.00 H new ATOM 0 HD2 ARG A 14 6.890 -6.572 16.218 1.00 0.00 H new ATOM 0 HD3 ARG A 14 7.120 -8.216 15.657 1.00 0.00 H new ATOM 0 HE ARG A 14 9.512 -8.027 16.212 1.00 0.00 H new ATOM 0 HH11 ARG A 14 7.336 -5.769 17.878 1.00 0.00 H new ATOM 0 HH12 ARG A 14 8.563 -5.344 19.077 1.00 0.00 H new ATOM 0 HH21 ARG A 14 11.063 -7.367 17.586 1.00 0.00 H new ATOM 0 HH22 ARG A 14 10.691 -6.256 18.908 1.00 0.00 H new ATOM 226 N ALA A 15 11.803 -7.095 13.248 1.00 0.00 N ATOM 227 CA ALA A 15 12.905 -6.365 13.842 1.00 0.00 C ATOM 228 C ALA A 15 13.402 -5.277 12.891 1.00 0.00 C ATOM 229 O ALA A 15 13.451 -4.113 13.279 1.00 0.00 O ATOM 230 CB ALA A 15 14.038 -7.315 14.236 1.00 0.00 C ATOM 0 H ALA A 15 11.975 -8.090 13.105 1.00 0.00 H new ATOM 0 HA ALA A 15 12.547 -5.881 14.751 1.00 0.00 H new ATOM 0 HB1 ALA A 15 14.854 -6.744 14.680 1.00 0.00 H new ATOM 0 HB2 ALA A 15 13.668 -8.042 14.959 1.00 0.00 H new ATOM 0 HB3 ALA A 15 14.400 -7.837 13.350 1.00 0.00 H new ATOM 236 N ALA A 16 13.733 -5.617 11.643 1.00 0.00 N ATOM 237 CA ALA A 16 14.191 -4.611 10.690 1.00 0.00 C ATOM 238 C ALA A 16 13.086 -3.598 10.378 1.00 0.00 C ATOM 239 O ALA A 16 13.341 -2.399 10.283 1.00 0.00 O ATOM 240 CB ALA A 16 14.617 -5.283 9.393 1.00 0.00 C ATOM 0 H ALA A 16 13.693 -6.568 11.275 1.00 0.00 H new ATOM 0 HA ALA A 16 15.034 -4.087 11.140 1.00 0.00 H new ATOM 0 HB1 ALA A 16 14.958 -4.526 8.686 1.00 0.00 H new ATOM 0 HB2 ALA A 16 15.428 -5.982 9.595 1.00 0.00 H new ATOM 0 HB3 ALA A 16 13.771 -5.822 8.968 1.00 0.00 H new ATOM 246 N TYR A 17 11.850 -4.083 10.222 1.00 0.00 N ATOM 247 CA TYR A 17 10.671 -3.262 9.983 1.00 0.00 C ATOM 248 C TYR A 17 10.510 -2.233 11.108 1.00 0.00 C ATOM 249 O TYR A 17 10.150 -1.088 10.841 1.00 0.00 O ATOM 250 CB TYR A 17 9.472 -4.220 9.847 1.00 0.00 C ATOM 251 CG TYR A 17 8.078 -3.627 9.787 1.00 0.00 C ATOM 252 CD1 TYR A 17 7.742 -2.702 8.786 1.00 0.00 C ATOM 253 CD2 TYR A 17 7.093 -4.043 10.704 1.00 0.00 C ATOM 254 CE1 TYR A 17 6.457 -2.136 8.732 1.00 0.00 C ATOM 255 CE2 TYR A 17 5.794 -3.511 10.638 1.00 0.00 C ATOM 256 CZ TYR A 17 5.469 -2.553 9.649 1.00 0.00 C ATOM 257 OH TYR A 17 4.215 -2.038 9.566 1.00 0.00 O ATOM 0 H TYR A 17 11.643 -5.081 10.260 1.00 0.00 H new ATOM 0 HA TYR A 17 10.755 -2.679 9.066 1.00 0.00 H new ATOM 0 HB2 TYR A 17 9.620 -4.811 8.943 1.00 0.00 H new ATOM 0 HB3 TYR A 17 9.503 -4.912 10.689 1.00 0.00 H new ATOM 0 HD1 TYR A 17 8.480 -2.422 8.049 1.00 0.00 H new ATOM 0 HD2 TYR A 17 7.337 -4.774 11.461 1.00 0.00 H new ATOM 0 HE1 TYR A 17 6.226 -1.385 7.991 1.00 0.00 H new ATOM 0 HE2 TYR A 17 5.043 -3.834 11.343 1.00 0.00 H new ATOM 0 HH TYR A 17 3.654 -2.428 10.268 1.00 0.00 H new ATOM 267 N ASN A 18 10.781 -2.611 12.360 1.00 0.00 N ATOM 268 CA ASN A 18 10.738 -1.760 13.544 1.00 0.00 C ATOM 269 C ASN A 18 11.829 -0.692 13.484 1.00 0.00 C ATOM 270 O ASN A 18 11.523 0.466 13.749 1.00 0.00 O ATOM 271 CB ASN A 18 10.899 -2.637 14.801 1.00 0.00 C ATOM 272 CG ASN A 18 11.146 -1.850 16.078 1.00 0.00 C ATOM 273 OD1 ASN A 18 12.254 -1.874 16.614 1.00 0.00 O ATOM 274 ND2 ASN A 18 10.134 -1.201 16.614 1.00 0.00 N ATOM 0 H ASN A 18 11.050 -3.569 12.583 1.00 0.00 H new ATOM 0 HA ASN A 18 9.777 -1.246 13.584 1.00 0.00 H new ATOM 0 HB2 ASN A 18 10.001 -3.241 14.927 1.00 0.00 H new ATOM 0 HB3 ASN A 18 11.728 -3.327 14.646 1.00 0.00 H new ATOM 0 HD21 ASN A 18 10.257 -0.702 17.495 1.00 0.00 H new ATOM 0 HD22 ASN A 18 9.226 -1.197 16.149 1.00 0.00 H new ATOM 281 N LEU A 19 13.070 -1.057 13.140 1.00 0.00 N ATOM 282 CA LEU A 19 14.166 -0.106 12.965 1.00 0.00 C ATOM 283 C LEU A 19 13.852 0.937 11.900 1.00 0.00 C ATOM 284 O LEU A 19 13.973 2.124 12.167 1.00 0.00 O ATOM 285 CB LEU A 19 15.507 -0.793 12.655 1.00 0.00 C ATOM 286 CG LEU A 19 16.287 -1.331 13.868 1.00 0.00 C ATOM 287 CD1 LEU A 19 15.564 -2.293 14.812 1.00 0.00 C ATOM 288 CD2 LEU A 19 17.542 -2.027 13.342 1.00 0.00 C ATOM 0 H LEU A 19 13.340 -2.027 12.975 1.00 0.00 H new ATOM 0 HA LEU A 19 14.270 0.401 13.924 1.00 0.00 H new ATOM 0 HB2 LEU A 19 15.318 -1.622 11.973 1.00 0.00 H new ATOM 0 HB3 LEU A 19 16.142 -0.083 12.126 1.00 0.00 H new ATOM 0 HG LEU A 19 16.476 -0.452 14.484 1.00 0.00 H new ATOM 0 HD11 LEU A 19 16.237 -2.587 15.617 1.00 0.00 H new ATOM 0 HD12 LEU A 19 14.688 -1.800 15.233 1.00 0.00 H new ATOM 0 HD13 LEU A 19 15.251 -3.179 14.259 1.00 0.00 H new ATOM 0 HD21 LEU A 19 18.118 -2.420 14.180 1.00 0.00 H new ATOM 0 HD22 LEU A 19 17.255 -2.846 12.683 1.00 0.00 H new ATOM 0 HD23 LEU A 19 18.150 -1.312 12.788 1.00 0.00 H new ATOM 300 N VAL A 20 13.464 0.526 10.696 1.00 0.00 N ATOM 301 CA VAL A 20 13.153 1.462 9.617 1.00 0.00 C ATOM 302 C VAL A 20 11.945 2.335 9.990 1.00 0.00 C ATOM 303 O VAL A 20 11.904 3.528 9.671 1.00 0.00 O ATOM 304 CB VAL A 20 12.988 0.638 8.330 1.00 0.00 C ATOM 305 CG1 VAL A 20 12.321 1.358 7.170 1.00 0.00 C ATOM 306 CG2 VAL A 20 14.376 0.238 7.839 1.00 0.00 C ATOM 0 H VAL A 20 13.357 -0.456 10.441 1.00 0.00 H new ATOM 0 HA VAL A 20 13.956 2.179 9.448 1.00 0.00 H new ATOM 0 HB VAL A 20 12.343 -0.196 8.607 1.00 0.00 H new ATOM 0 HG11 VAL A 20 12.255 0.686 6.314 1.00 0.00 H new ATOM 0 HG12 VAL A 20 11.319 1.671 7.464 1.00 0.00 H new ATOM 0 HG13 VAL A 20 12.910 2.234 6.899 1.00 0.00 H new ATOM 0 HG21 VAL A 20 14.284 -0.349 6.925 1.00 0.00 H new ATOM 0 HG22 VAL A 20 14.963 1.134 7.637 1.00 0.00 H new ATOM 0 HG23 VAL A 20 14.875 -0.358 8.604 1.00 0.00 H new ATOM 316 N ARG A 21 10.962 1.760 10.690 1.00 0.00 N ATOM 317 CA ARG A 21 9.814 2.508 11.180 1.00 0.00 C ATOM 318 C ARG A 21 10.260 3.561 12.190 1.00 0.00 C ATOM 319 O ARG A 21 9.658 4.633 12.234 1.00 0.00 O ATOM 320 CB ARG A 21 8.827 1.549 11.865 1.00 0.00 C ATOM 321 CG ARG A 21 7.586 2.280 12.385 1.00 0.00 C ATOM 322 CD ARG A 21 6.690 1.395 13.244 1.00 0.00 C ATOM 323 NE ARG A 21 5.429 1.033 12.596 1.00 0.00 N ATOM 324 CZ ARG A 21 4.330 1.792 12.612 1.00 0.00 C ATOM 325 NH1 ARG A 21 4.387 3.106 12.813 1.00 0.00 N ATOM 326 NH2 ARG A 21 3.163 1.188 12.454 1.00 0.00 N ATOM 0 H ARG A 21 10.945 0.768 10.929 1.00 0.00 H new ATOM 0 HA ARG A 21 9.332 2.999 10.334 1.00 0.00 H new ATOM 0 HB2 ARG A 21 8.523 0.776 11.159 1.00 0.00 H new ATOM 0 HB3 ARG A 21 9.326 1.046 12.694 1.00 0.00 H new ATOM 0 HG2 ARG A 21 7.899 3.146 12.968 1.00 0.00 H new ATOM 0 HG3 ARG A 21 7.012 2.657 11.539 1.00 0.00 H new ATOM 0 HD2 ARG A 21 7.231 0.484 13.500 1.00 0.00 H new ATOM 0 HD3 ARG A 21 6.473 1.911 14.179 1.00 0.00 H new ATOM 0 HE ARG A 21 5.386 0.143 12.100 1.00 0.00 H new ATOM 0 HH11 ARG A 21 5.288 3.561 12.960 1.00 0.00 H new ATOM 0 HH12 ARG A 21 3.530 3.659 12.820 1.00 0.00 H new ATOM 0 HH21 ARG A 21 3.125 0.177 12.326 1.00 0.00 H new ATOM 0 HH22 ARG A 21 2.301 1.734 12.460 1.00 0.00 H new ATOM 340 N ASP A 22 11.243 3.251 13.028 1.00 0.00 N ATOM 341 CA ASP A 22 11.707 4.114 14.099 1.00 0.00 C ATOM 342 C ASP A 22 12.561 5.282 13.604 1.00 0.00 C ATOM 343 O ASP A 22 13.357 5.158 12.678 1.00 0.00 O ATOM 344 CB ASP A 22 12.462 3.283 15.139 1.00 0.00 C ATOM 345 CG ASP A 22 12.958 4.196 16.246 1.00 0.00 C ATOM 346 OD1 ASP A 22 12.121 4.882 16.877 1.00 0.00 O ATOM 347 OD2 ASP A 22 14.185 4.291 16.431 1.00 0.00 O ATOM 0 H ASP A 22 11.750 2.368 12.977 1.00 0.00 H new ATOM 0 HA ASP A 22 10.827 4.563 14.558 1.00 0.00 H new ATOM 0 HB2 ASP A 22 11.808 2.514 15.551 1.00 0.00 H new ATOM 0 HB3 ASP A 22 13.302 2.770 14.671 1.00 0.00 H new ATOM 352 N ASP A 23 12.359 6.440 14.229 1.00 0.00 N ATOM 353 CA ASP A 23 13.027 7.704 13.947 1.00 0.00 C ATOM 354 C ASP A 23 14.354 7.855 14.694 1.00 0.00 C ATOM 355 O ASP A 23 15.086 8.803 14.429 1.00 0.00 O ATOM 356 CB ASP A 23 12.094 8.863 14.332 1.00 0.00 C ATOM 357 CG ASP A 23 10.950 9.026 13.346 1.00 0.00 C ATOM 358 OD1 ASP A 23 9.955 8.270 13.436 1.00 0.00 O ATOM 359 OD2 ASP A 23 11.074 9.821 12.388 1.00 0.00 O ATOM 0 H ASP A 23 11.685 6.524 14.990 1.00 0.00 H new ATOM 0 HA ASP A 23 13.254 7.721 12.881 1.00 0.00 H new ATOM 0 HB2 ASP A 23 11.691 8.687 15.329 1.00 0.00 H new ATOM 0 HB3 ASP A 23 12.667 9.789 14.379 1.00 0.00 H new ATOM 364 N GLY A 24 14.665 7.001 15.672 1.00 0.00 N ATOM 365 CA GLY A 24 15.929 7.052 16.403 1.00 0.00 C ATOM 366 C GLY A 24 16.987 6.224 15.682 1.00 0.00 C ATOM 367 O GLY A 24 18.165 6.585 15.669 1.00 0.00 O ATOM 0 H GLY A 24 14.043 6.253 15.979 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.264 8.085 16.493 1.00 0.00 H new ATOM 0 HA3 GLY A 24 15.788 6.673 17.415 1.00 0.00 H new ATOM 371 N SER A 25 16.558 5.112 15.087 1.00 0.00 N ATOM 372 CA SER A 25 17.358 4.223 14.272 1.00 0.00 C ATOM 373 C SER A 25 18.018 5.038 13.158 1.00 0.00 C ATOM 374 O SER A 25 17.389 5.916 12.559 1.00 0.00 O ATOM 375 CB SER A 25 16.399 3.172 13.704 1.00 0.00 C ATOM 376 OG SER A 25 16.999 2.323 12.742 1.00 0.00 O ATOM 0 H SER A 25 15.591 4.798 15.170 1.00 0.00 H new ATOM 0 HA SER A 25 18.150 3.735 14.840 1.00 0.00 H new ATOM 0 HB2 SER A 25 16.012 2.565 14.522 1.00 0.00 H new ATOM 0 HB3 SER A 25 15.546 3.677 13.250 1.00 0.00 H new ATOM 0 HG SER A 25 16.811 2.664 11.843 1.00 0.00 H new ATOM 382 N ALA A 26 19.291 4.750 12.879 1.00 0.00 N ATOM 383 CA ALA A 26 20.007 5.382 11.780 1.00 0.00 C ATOM 384 C ALA A 26 19.539 4.767 10.455 1.00 0.00 C ATOM 385 O ALA A 26 19.463 5.464 9.445 1.00 0.00 O ATOM 386 CB ALA A 26 21.515 5.178 11.965 1.00 0.00 C ATOM 0 H ALA A 26 19.847 4.077 13.407 1.00 0.00 H new ATOM 0 HA ALA A 26 19.800 6.452 11.767 1.00 0.00 H new ATOM 0 HB1 ALA A 26 22.050 5.651 11.142 1.00 0.00 H new ATOM 0 HB2 ALA A 26 21.830 5.626 12.908 1.00 0.00 H new ATOM 0 HB3 ALA A 26 21.739 4.111 11.977 1.00 0.00 H new ATOM 392 N VAL A 27 19.244 3.464 10.466 1.00 0.00 N ATOM 393 CA VAL A 27 18.812 2.676 9.322 1.00 0.00 C ATOM 394 C VAL A 27 17.470 3.201 8.801 1.00 0.00 C ATOM 395 O VAL A 27 16.498 3.289 9.560 1.00 0.00 O ATOM 396 CB VAL A 27 18.766 1.190 9.742 1.00 0.00 C ATOM 397 CG1 VAL A 27 17.966 0.288 8.802 1.00 0.00 C ATOM 398 CG2 VAL A 27 20.186 0.619 9.833 1.00 0.00 C ATOM 0 H VAL A 27 19.305 2.908 11.319 1.00 0.00 H new ATOM 0 HA VAL A 27 19.514 2.766 8.493 1.00 0.00 H new ATOM 0 HB VAL A 27 18.261 1.191 10.708 1.00 0.00 H new ATOM 0 HG11 VAL A 27 17.988 -0.736 9.174 1.00 0.00 H new ATOM 0 HG12 VAL A 27 16.934 0.635 8.756 1.00 0.00 H new ATOM 0 HG13 VAL A 27 18.405 0.321 7.805 1.00 0.00 H new ATOM 0 HG21 VAL A 27 20.139 -0.429 10.130 1.00 0.00 H new ATOM 0 HG22 VAL A 27 20.673 0.699 8.861 1.00 0.00 H new ATOM 0 HG23 VAL A 27 20.757 1.180 10.573 1.00 0.00 H new ATOM 408 N ILE A 28 17.419 3.491 7.498 1.00 0.00 N ATOM 409 CA ILE A 28 16.262 3.995 6.766 1.00 0.00 C ATOM 410 C ILE A 28 15.767 2.991 5.719 1.00 0.00 C ATOM 411 O ILE A 28 14.602 3.065 5.332 1.00 0.00 O ATOM 412 CB ILE A 28 16.561 5.368 6.118 1.00 0.00 C ATOM 413 CG1 ILE A 28 17.459 5.302 4.856 1.00 0.00 C ATOM 414 CG2 ILE A 28 17.149 6.350 7.137 1.00 0.00 C ATOM 415 CD1 ILE A 28 16.635 5.351 3.563 1.00 0.00 C ATOM 0 H ILE A 28 18.233 3.372 6.894 1.00 0.00 H new ATOM 0 HA ILE A 28 15.460 4.132 7.491 1.00 0.00 H new ATOM 0 HB ILE A 28 15.591 5.732 5.778 1.00 0.00 H new ATOM 0 HG12 ILE A 28 18.164 6.133 4.869 1.00 0.00 H new ATOM 0 HG13 ILE A 28 18.047 4.385 4.877 1.00 0.00 H new ATOM 0 HG21 ILE A 28 17.348 7.305 6.650 1.00 0.00 H new ATOM 0 HG22 ILE A 28 16.439 6.499 7.951 1.00 0.00 H new ATOM 0 HG23 ILE A 28 18.079 5.946 7.537 1.00 0.00 H new ATOM 0 HD11 ILE A 28 17.304 5.302 2.703 1.00 0.00 H new ATOM 0 HD12 ILE A 28 15.948 4.505 3.537 1.00 0.00 H new ATOM 0 HD13 ILE A 28 16.067 6.281 3.529 1.00 0.00 H new ATOM 427 N TRP A 29 16.611 2.075 5.232 1.00 0.00 N ATOM 428 CA TRP A 29 16.220 1.091 4.233 1.00 0.00 C ATOM 429 C TRP A 29 16.565 -0.299 4.745 1.00 0.00 C ATOM 430 O TRP A 29 17.543 -0.488 5.470 1.00 0.00 O ATOM 431 CB TRP A 29 16.888 1.381 2.878 1.00 0.00 C ATOM 432 CG TRP A 29 18.364 1.153 2.824 1.00 0.00 C ATOM 433 CD1 TRP A 29 19.314 2.108 2.930 1.00 0.00 C ATOM 434 CD2 TRP A 29 19.075 -0.112 2.655 1.00 0.00 C ATOM 435 NE1 TRP A 29 20.553 1.505 2.954 1.00 0.00 N ATOM 436 CE2 TRP A 29 20.463 0.139 2.822 1.00 0.00 C ATOM 437 CE3 TRP A 29 18.699 -1.448 2.396 1.00 0.00 C ATOM 438 CZ2 TRP A 29 21.420 -0.882 2.821 1.00 0.00 C ATOM 439 CZ3 TRP A 29 19.659 -2.477 2.334 1.00 0.00 C ATOM 440 CH2 TRP A 29 21.017 -2.203 2.570 1.00 0.00 C ATOM 0 H TRP A 29 17.585 2.000 5.524 1.00 0.00 H new ATOM 0 HA TRP A 29 15.144 1.148 4.069 1.00 0.00 H new ATOM 0 HB2 TRP A 29 16.414 0.758 2.119 1.00 0.00 H new ATOM 0 HB3 TRP A 29 16.689 2.418 2.609 1.00 0.00 H new ATOM 0 HD1 TRP A 29 19.132 3.171 2.987 1.00 0.00 H new ATOM 0 HE1 TRP A 29 21.432 2.012 3.057 1.00 0.00 H new ATOM 0 HE3 TRP A 29 17.657 -1.685 2.243 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 22.459 -0.656 3.012 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 19.349 -3.485 2.103 1.00 0.00 H new ATOM 0 HH2 TRP A 29 21.744 -3.002 2.558 1.00 0.00 H new ATOM 451 N VAL A 30 15.762 -1.271 4.334 1.00 0.00 N ATOM 452 CA VAL A 30 15.893 -2.696 4.599 1.00 0.00 C ATOM 453 C VAL A 30 15.520 -3.415 3.313 1.00 0.00 C ATOM 454 O VAL A 30 14.848 -2.858 2.446 1.00 0.00 O ATOM 455 CB VAL A 30 14.940 -3.071 5.757 1.00 0.00 C ATOM 456 CG1 VAL A 30 14.532 -4.548 5.893 1.00 0.00 C ATOM 457 CG2 VAL A 30 15.550 -2.661 7.100 1.00 0.00 C ATOM 0 H VAL A 30 14.941 -1.068 3.764 1.00 0.00 H new ATOM 0 HA VAL A 30 16.904 -2.976 4.895 1.00 0.00 H new ATOM 0 HB VAL A 30 14.033 -2.527 5.495 1.00 0.00 H new ATOM 0 HG11 VAL A 30 13.863 -4.664 6.746 1.00 0.00 H new ATOM 0 HG12 VAL A 30 14.021 -4.869 4.985 1.00 0.00 H new ATOM 0 HG13 VAL A 30 15.422 -5.159 6.044 1.00 0.00 H new ATOM 0 HG21 VAL A 30 14.868 -2.931 7.907 1.00 0.00 H new ATOM 0 HG22 VAL A 30 16.500 -3.176 7.240 1.00 0.00 H new ATOM 0 HG23 VAL A 30 15.716 -1.584 7.110 1.00 0.00 H new ATOM 467 N THR A 31 15.927 -4.670 3.204 1.00 0.00 N ATOM 468 CA THR A 31 15.587 -5.544 2.100 1.00 0.00 C ATOM 469 C THR A 31 14.930 -6.796 2.676 1.00 0.00 C ATOM 470 O THR A 31 15.128 -7.130 3.847 1.00 0.00 O ATOM 471 CB THR A 31 16.791 -5.802 1.177 1.00 0.00 C ATOM 472 OG1 THR A 31 17.963 -6.132 1.889 1.00 0.00 O ATOM 473 CG2 THR A 31 17.097 -4.594 0.291 1.00 0.00 C ATOM 0 H THR A 31 16.520 -5.118 3.903 1.00 0.00 H new ATOM 0 HA THR A 31 14.864 -5.071 1.435 1.00 0.00 H new ATOM 0 HB THR A 31 16.499 -6.652 0.560 1.00 0.00 H new ATOM 0 HG1 THR A 31 18.100 -5.484 2.612 1.00 0.00 H new ATOM 0 HG21 THR A 31 17.953 -4.817 -0.345 1.00 0.00 H new ATOM 0 HG22 THR A 31 16.231 -4.371 -0.332 1.00 0.00 H new ATOM 0 HG23 THR A 31 17.325 -3.732 0.918 1.00 0.00 H new ATOM 481 N PHE A 32 14.136 -7.481 1.860 1.00 0.00 N ATOM 482 CA PHE A 32 13.471 -8.724 2.200 1.00 0.00 C ATOM 483 C PHE A 32 13.725 -9.668 1.036 1.00 0.00 C ATOM 484 O PHE A 32 13.480 -9.308 -0.120 1.00 0.00 O ATOM 485 CB PHE A 32 11.973 -8.487 2.458 1.00 0.00 C ATOM 486 CG PHE A 32 11.674 -7.756 3.757 1.00 0.00 C ATOM 487 CD1 PHE A 32 12.114 -8.306 4.976 1.00 0.00 C ATOM 488 CD2 PHE A 32 10.968 -6.536 3.766 1.00 0.00 C ATOM 489 CE1 PHE A 32 11.902 -7.622 6.183 1.00 0.00 C ATOM 490 CE2 PHE A 32 10.717 -5.875 4.984 1.00 0.00 C ATOM 491 CZ PHE A 32 11.195 -6.409 6.192 1.00 0.00 C ATOM 0 H PHE A 32 13.933 -7.170 0.910 1.00 0.00 H new ATOM 0 HA PHE A 32 13.857 -9.157 3.123 1.00 0.00 H new ATOM 0 HB2 PHE A 32 11.559 -7.915 1.628 1.00 0.00 H new ATOM 0 HB3 PHE A 32 11.461 -9.449 2.469 1.00 0.00 H new ATOM 0 HD1 PHE A 32 12.618 -9.261 4.982 1.00 0.00 H new ATOM 0 HD2 PHE A 32 10.619 -6.108 2.838 1.00 0.00 H new ATOM 0 HE1 PHE A 32 12.284 -8.030 7.107 1.00 0.00 H new ATOM 0 HE2 PHE A 32 10.154 -4.953 4.989 1.00 0.00 H new ATOM 0 HZ PHE A 32 11.020 -5.889 7.122 1.00 0.00 H new ATOM 501 N LYS A 33 14.285 -10.838 1.331 1.00 0.00 N ATOM 502 CA LYS A 33 14.673 -11.840 0.346 1.00 0.00 C ATOM 503 C LYS A 33 13.724 -13.017 0.503 1.00 0.00 C ATOM 504 O LYS A 33 12.842 -13.004 1.367 1.00 0.00 O ATOM 505 CB LYS A 33 16.157 -12.241 0.476 1.00 0.00 C ATOM 506 CG LYS A 33 17.104 -11.060 0.735 1.00 0.00 C ATOM 507 CD LYS A 33 18.475 -11.245 0.067 1.00 0.00 C ATOM 508 CE LYS A 33 19.372 -10.034 0.356 1.00 0.00 C ATOM 509 NZ LYS A 33 20.681 -10.129 -0.323 1.00 0.00 N ATOM 0 H LYS A 33 14.487 -11.122 2.290 1.00 0.00 H new ATOM 0 HA LYS A 33 14.590 -11.435 -0.662 1.00 0.00 H new ATOM 0 HB2 LYS A 33 16.258 -12.960 1.289 1.00 0.00 H new ATOM 0 HB3 LYS A 33 16.467 -12.748 -0.438 1.00 0.00 H new ATOM 0 HG2 LYS A 33 16.645 -10.143 0.366 1.00 0.00 H new ATOM 0 HG3 LYS A 33 17.241 -10.938 1.809 1.00 0.00 H new ATOM 0 HD2 LYS A 33 18.949 -12.154 0.437 1.00 0.00 H new ATOM 0 HD3 LYS A 33 18.350 -11.366 -1.009 1.00 0.00 H new ATOM 0 HE2 LYS A 33 18.864 -9.124 0.035 1.00 0.00 H new ATOM 0 HE3 LYS A 33 19.529 -9.949 1.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 21.251 -9.289 -0.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 21.179 -10.982 0.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 20.536 -10.183 -1.351 1.00 0.00 H new ATOM 523 N TYR A 34 13.858 -14.018 -0.353 1.00 0.00 N ATOM 524 CA TYR A 34 12.974 -15.168 -0.360 1.00 0.00 C ATOM 525 C TYR A 34 13.806 -16.419 -0.194 1.00 0.00 C ATOM 526 O TYR A 34 14.844 -16.570 -0.844 1.00 0.00 O ATOM 527 CB TYR A 34 12.217 -15.228 -1.693 1.00 0.00 C ATOM 528 CG TYR A 34 11.178 -14.143 -1.844 1.00 0.00 C ATOM 529 CD1 TYR A 34 11.561 -12.808 -2.069 1.00 0.00 C ATOM 530 CD2 TYR A 34 9.821 -14.462 -1.686 1.00 0.00 C ATOM 531 CE1 TYR A 34 10.599 -11.788 -2.056 1.00 0.00 C ATOM 532 CE2 TYR A 34 8.852 -13.453 -1.751 1.00 0.00 C ATOM 533 CZ TYR A 34 9.233 -12.105 -1.908 1.00 0.00 C ATOM 534 OH TYR A 34 8.286 -11.132 -1.886 1.00 0.00 O ATOM 0 H TYR A 34 14.587 -14.054 -1.065 1.00 0.00 H new ATOM 0 HA TYR A 34 12.254 -15.088 0.455 1.00 0.00 H new ATOM 0 HB2 TYR A 34 12.932 -15.152 -2.512 1.00 0.00 H new ATOM 0 HB3 TYR A 34 11.732 -16.200 -1.783 1.00 0.00 H new ATOM 0 HD1 TYR A 34 12.598 -12.568 -2.252 1.00 0.00 H new ATOM 0 HD2 TYR A 34 9.524 -15.486 -1.514 1.00 0.00 H new ATOM 0 HE1 TYR A 34 10.905 -10.757 -2.160 1.00 0.00 H new ATOM 0 HE2 TYR A 34 7.805 -13.710 -1.680 1.00 0.00 H new ATOM 0 HH TYR A 34 8.550 -10.405 -2.487 1.00 0.00 H new ATOM 544 N ASP A 35 13.345 -17.338 0.645 1.00 0.00 N ATOM 545 CA ASP A 35 13.998 -18.615 0.829 1.00 0.00 C ATOM 546 C ASP A 35 12.930 -19.642 1.164 1.00 0.00 C ATOM 547 O ASP A 35 12.178 -19.466 2.130 1.00 0.00 O ATOM 548 CB ASP A 35 15.006 -18.518 1.968 1.00 0.00 C ATOM 549 CG ASP A 35 15.726 -19.848 2.153 1.00 0.00 C ATOM 550 OD1 ASP A 35 16.151 -20.449 1.140 1.00 0.00 O ATOM 551 OD2 ASP A 35 15.801 -20.317 3.308 1.00 0.00 O ATOM 0 H ASP A 35 12.508 -17.213 1.214 1.00 0.00 H new ATOM 0 HA ASP A 35 14.530 -18.907 -0.077 1.00 0.00 H new ATOM 0 HB2 ASP A 35 15.730 -17.731 1.756 1.00 0.00 H new ATOM 0 HB3 ASP A 35 14.496 -18.241 2.891 1.00 0.00 H new ATOM 556 N GLY A 36 12.860 -20.716 0.381 1.00 0.00 N ATOM 557 CA GLY A 36 11.931 -21.808 0.610 1.00 0.00 C ATOM 558 C GLY A 36 10.494 -21.293 0.691 1.00 0.00 C ATOM 559 O GLY A 36 10.025 -20.567 -0.189 1.00 0.00 O ATOM 0 H GLY A 36 13.455 -20.849 -0.437 1.00 0.00 H new ATOM 0 HA2 GLY A 36 12.015 -22.538 -0.195 1.00 0.00 H new ATOM 0 HA3 GLY A 36 12.190 -22.323 1.535 1.00 0.00 H new ATOM 563 N SER A 37 9.773 -21.663 1.745 1.00 0.00 N ATOM 564 CA SER A 37 8.364 -21.326 1.929 1.00 0.00 C ATOM 565 C SER A 37 8.128 -19.964 2.604 1.00 0.00 C ATOM 566 O SER A 37 6.980 -19.674 2.949 1.00 0.00 O ATOM 567 CB SER A 37 7.654 -22.486 2.650 1.00 0.00 C ATOM 568 OG SER A 37 8.480 -23.157 3.584 1.00 0.00 O ATOM 0 H SER A 37 10.159 -22.216 2.510 1.00 0.00 H new ATOM 0 HA SER A 37 7.921 -21.201 0.941 1.00 0.00 H new ATOM 0 HB2 SER A 37 6.775 -22.100 3.165 1.00 0.00 H new ATOM 0 HB3 SER A 37 7.300 -23.202 1.909 1.00 0.00 H new ATOM 0 HG SER A 37 7.973 -23.880 4.009 1.00 0.00 H new ATOM 574 N THR A 38 9.151 -19.116 2.790 1.00 0.00 N ATOM 575 CA THR A 38 8.965 -17.860 3.509 1.00 0.00 C ATOM 576 C THR A 38 9.780 -16.686 2.962 1.00 0.00 C ATOM 577 O THR A 38 10.595 -16.825 2.041 1.00 0.00 O ATOM 578 CB THR A 38 9.267 -18.149 4.994 1.00 0.00 C ATOM 579 OG1 THR A 38 8.869 -17.110 5.856 1.00 0.00 O ATOM 580 CG2 THR A 38 10.741 -18.417 5.302 1.00 0.00 C ATOM 0 H THR A 38 10.101 -19.279 2.455 1.00 0.00 H new ATOM 0 HA THR A 38 7.937 -17.523 3.374 1.00 0.00 H new ATOM 0 HB THR A 38 8.683 -19.052 5.173 1.00 0.00 H new ATOM 0 HG1 THR A 38 9.085 -17.352 6.781 1.00 0.00 H new ATOM 0 HG21 THR A 38 10.861 -18.610 6.368 1.00 0.00 H new ATOM 0 HG22 THR A 38 11.079 -19.285 4.736 1.00 0.00 H new ATOM 0 HG23 THR A 38 11.335 -17.547 5.022 1.00 0.00 H new ATOM 588 N ILE A 39 9.471 -15.512 3.515 1.00 0.00 N ATOM 589 CA ILE A 39 10.133 -14.238 3.287 1.00 0.00 C ATOM 590 C ILE A 39 11.203 -14.240 4.382 1.00 0.00 C ATOM 591 O ILE A 39 10.891 -14.608 5.524 1.00 0.00 O ATOM 592 CB ILE A 39 9.183 -13.032 3.515 1.00 0.00 C ATOM 593 CG1 ILE A 39 7.907 -13.047 2.653 1.00 0.00 C ATOM 594 CG2 ILE A 39 9.923 -11.694 3.324 1.00 0.00 C ATOM 595 CD1 ILE A 39 8.136 -13.060 1.150 1.00 0.00 C ATOM 0 H ILE A 39 8.700 -15.426 4.177 1.00 0.00 H new ATOM 0 HA ILE A 39 10.502 -14.137 2.266 1.00 0.00 H new ATOM 0 HB ILE A 39 8.855 -13.134 4.549 1.00 0.00 H new ATOM 0 HG12 ILE A 39 7.318 -13.924 2.921 1.00 0.00 H new ATOM 0 HG13 ILE A 39 7.308 -12.172 2.905 1.00 0.00 H new ATOM 0 HG21 ILE A 39 9.231 -10.868 3.490 1.00 0.00 H new ATOM 0 HG22 ILE A 39 10.745 -11.628 4.037 1.00 0.00 H new ATOM 0 HG23 ILE A 39 10.317 -11.638 2.309 1.00 0.00 H new ATOM 0 HD11 ILE A 39 7.175 -13.070 0.636 1.00 0.00 H new ATOM 0 HD12 ILE A 39 8.694 -12.170 0.859 1.00 0.00 H new ATOM 0 HD13 ILE A 39 8.703 -13.949 0.876 1.00 0.00 H new ATOM 607 N VAL A 40 12.421 -13.824 4.052 1.00 0.00 N ATOM 608 CA VAL A 40 13.518 -13.695 5.011 1.00 0.00 C ATOM 609 C VAL A 40 14.038 -12.253 5.027 1.00 0.00 C ATOM 610 O VAL A 40 13.827 -11.523 4.052 1.00 0.00 O ATOM 611 CB VAL A 40 14.624 -14.721 4.704 1.00 0.00 C ATOM 612 CG1 VAL A 40 14.067 -16.134 4.568 1.00 0.00 C ATOM 613 CG2 VAL A 40 15.384 -14.422 3.418 1.00 0.00 C ATOM 0 H VAL A 40 12.680 -13.563 3.100 1.00 0.00 H new ATOM 0 HA VAL A 40 13.153 -13.916 6.014 1.00 0.00 H new ATOM 0 HB VAL A 40 15.302 -14.647 5.555 1.00 0.00 H new ATOM 0 HG11 VAL A 40 14.880 -16.826 4.352 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.581 -16.425 5.499 1.00 0.00 H new ATOM 0 HG13 VAL A 40 13.341 -16.162 3.756 1.00 0.00 H new ATOM 0 HG21 VAL A 40 16.148 -15.183 3.262 1.00 0.00 H new ATOM 0 HG22 VAL A 40 14.691 -14.425 2.577 1.00 0.00 H new ATOM 0 HG23 VAL A 40 15.857 -13.443 3.494 1.00 0.00 H new ATOM 623 N PRO A 41 14.723 -11.807 6.093 1.00 0.00 N ATOM 624 CA PRO A 41 15.313 -10.479 6.106 1.00 0.00 C ATOM 625 C PRO A 41 16.514 -10.426 5.156 1.00 0.00 C ATOM 626 O PRO A 41 17.158 -11.442 4.861 1.00 0.00 O ATOM 627 CB PRO A 41 15.731 -10.230 7.557 1.00 0.00 C ATOM 628 CG PRO A 41 16.017 -11.640 8.069 1.00 0.00 C ATOM 629 CD PRO A 41 14.942 -12.471 7.372 1.00 0.00 C ATOM 0 HA PRO A 41 14.617 -9.713 5.765 1.00 0.00 H new ATOM 0 HB2 PRO A 41 16.611 -9.590 7.621 1.00 0.00 H new ATOM 0 HB3 PRO A 41 14.940 -9.744 8.129 1.00 0.00 H new ATOM 0 HG2 PRO A 41 17.021 -11.972 7.804 1.00 0.00 H new ATOM 0 HG3 PRO A 41 15.937 -11.701 9.154 1.00 0.00 H new ATOM 0 HD2 PRO A 41 15.269 -13.501 7.231 1.00 0.00 H new ATOM 0 HD3 PRO A 41 14.026 -12.505 7.961 1.00 0.00 H new ATOM 637 N GLY A 42 16.801 -9.221 4.679 1.00 0.00 N ATOM 638 CA GLY A 42 17.922 -8.854 3.837 1.00 0.00 C ATOM 639 C GLY A 42 18.781 -7.828 4.565 1.00 0.00 C ATOM 640 O GLY A 42 18.601 -7.582 5.759 1.00 0.00 O ATOM 0 H GLY A 42 16.209 -8.418 4.889 1.00 0.00 H new ATOM 0 HA2 GLY A 42 18.515 -9.736 3.595 1.00 0.00 H new ATOM 0 HA3 GLY A 42 17.564 -8.442 2.893 1.00 0.00 H new ATOM 644 N GLU A 43 19.752 -7.253 3.862 1.00 0.00 N ATOM 645 CA GLU A 43 20.593 -6.193 4.400 1.00 0.00 C ATOM 646 C GLU A 43 19.758 -4.948 4.694 1.00 0.00 C ATOM 647 O GLU A 43 18.602 -4.834 4.266 1.00 0.00 O ATOM 648 CB GLU A 43 21.723 -5.868 3.423 1.00 0.00 C ATOM 649 CG GLU A 43 22.693 -7.045 3.307 1.00 0.00 C ATOM 650 CD GLU A 43 24.018 -6.570 2.726 1.00 0.00 C ATOM 651 OE1 GLU A 43 24.840 -6.013 3.494 1.00 0.00 O ATOM 652 OE2 GLU A 43 24.237 -6.737 1.505 1.00 0.00 O ATOM 0 H GLU A 43 19.977 -7.511 2.901 1.00 0.00 H new ATOM 0 HA GLU A 43 21.034 -6.536 5.336 1.00 0.00 H new ATOM 0 HB2 GLU A 43 21.307 -5.635 2.443 1.00 0.00 H new ATOM 0 HB3 GLU A 43 22.259 -4.981 3.761 1.00 0.00 H new ATOM 0 HG2 GLU A 43 22.855 -7.492 4.288 1.00 0.00 H new ATOM 0 HG3 GLU A 43 22.264 -7.820 2.671 1.00 0.00 H new ATOM 659 N GLN A 44 20.365 -4.016 5.423 1.00 0.00 N ATOM 660 CA GLN A 44 19.755 -2.776 5.863 1.00 0.00 C ATOM 661 C GLN A 44 20.835 -1.702 5.974 1.00 0.00 C ATOM 662 O GLN A 44 22.021 -2.037 6.054 1.00 0.00 O ATOM 663 CB GLN A 44 19.038 -3.044 7.194 1.00 0.00 C ATOM 664 CG GLN A 44 19.960 -3.390 8.372 1.00 0.00 C ATOM 665 CD GLN A 44 19.155 -3.896 9.566 1.00 0.00 C ATOM 666 OE1 GLN A 44 18.652 -3.121 10.372 1.00 0.00 O ATOM 667 NE2 GLN A 44 19.036 -5.203 9.733 1.00 0.00 N ATOM 0 H GLN A 44 21.332 -4.112 5.733 1.00 0.00 H new ATOM 0 HA GLN A 44 19.015 -2.411 5.151 1.00 0.00 H new ATOM 0 HB2 GLN A 44 18.453 -2.163 7.457 1.00 0.00 H new ATOM 0 HB3 GLN A 44 18.334 -3.864 7.051 1.00 0.00 H new ATOM 0 HG2 GLN A 44 20.679 -4.150 8.065 1.00 0.00 H new ATOM 0 HG3 GLN A 44 20.532 -2.509 8.662 1.00 0.00 H new ATOM 0 HE21 GLN A 44 19.456 -5.844 9.060 1.00 0.00 H new ATOM 0 HE22 GLN A 44 18.524 -5.570 10.535 1.00 0.00 H new ATOM 676 N GLY A 45 20.449 -0.429 6.007 1.00 0.00 N ATOM 677 CA GLY A 45 21.400 0.669 6.036 1.00 0.00 C ATOM 678 C GLY A 45 20.712 2.025 6.136 1.00 0.00 C ATOM 679 O GLY A 45 19.481 2.120 6.138 1.00 0.00 O ATOM 0 H GLY A 45 19.472 -0.135 6.014 1.00 0.00 H new ATOM 0 HA2 GLY A 45 22.073 0.542 6.884 1.00 0.00 H new ATOM 0 HA3 GLY A 45 22.013 0.640 5.135 1.00 0.00 H new ATOM 683 N ALA A 46 21.514 3.085 6.223 1.00 0.00 N ATOM 684 CA ALA A 46 21.071 4.462 6.416 1.00 0.00 C ATOM 685 C ALA A 46 21.201 5.333 5.162 1.00 0.00 C ATOM 686 O ALA A 46 20.723 6.465 5.168 1.00 0.00 O ATOM 687 CB ALA A 46 21.906 5.069 7.549 1.00 0.00 C ATOM 0 H ALA A 46 22.529 3.003 6.158 1.00 0.00 H new ATOM 0 HA ALA A 46 20.008 4.438 6.657 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.597 6.101 7.716 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.755 4.492 8.461 1.00 0.00 H new ATOM 0 HB3 ALA A 46 22.961 5.046 7.276 1.00 0.00 H new ATOM 693 N GLU A 47 21.817 4.841 4.088 1.00 0.00 N ATOM 694 CA GLU A 47 22.089 5.595 2.865 1.00 0.00 C ATOM 695 C GLU A 47 21.689 4.741 1.655 1.00 0.00 C ATOM 696 O GLU A 47 21.920 3.536 1.649 1.00 0.00 O ATOM 697 CB GLU A 47 23.573 6.011 2.943 1.00 0.00 C ATOM 698 CG GLU A 47 24.269 6.364 1.624 1.00 0.00 C ATOM 699 CD GLU A 47 25.161 5.212 1.149 1.00 0.00 C ATOM 700 OE1 GLU A 47 24.638 4.108 0.877 1.00 0.00 O ATOM 701 OE2 GLU A 47 26.371 5.430 0.931 1.00 0.00 O ATOM 0 H GLU A 47 22.150 3.878 4.044 1.00 0.00 H new ATOM 0 HA GLU A 47 21.504 6.508 2.753 1.00 0.00 H new ATOM 0 HB2 GLU A 47 23.648 6.873 3.606 1.00 0.00 H new ATOM 0 HB3 GLU A 47 24.128 5.198 3.412 1.00 0.00 H new ATOM 0 HG2 GLU A 47 23.522 6.588 0.863 1.00 0.00 H new ATOM 0 HG3 GLU A 47 24.870 7.264 1.755 1.00 0.00 H new ATOM 708 N TYR A 48 21.046 5.336 0.644 1.00 0.00 N ATOM 709 CA TYR A 48 20.528 4.618 -0.528 1.00 0.00 C ATOM 710 C TYR A 48 21.591 4.402 -1.631 1.00 0.00 C ATOM 711 O TYR A 48 21.358 3.644 -2.567 1.00 0.00 O ATOM 712 CB TYR A 48 19.303 5.403 -1.052 1.00 0.00 C ATOM 713 CG TYR A 48 18.433 4.747 -2.127 1.00 0.00 C ATOM 714 CD1 TYR A 48 18.727 4.967 -3.483 1.00 0.00 C ATOM 715 CD2 TYR A 48 17.262 4.032 -1.794 1.00 0.00 C ATOM 716 CE1 TYR A 48 17.884 4.480 -4.501 1.00 0.00 C ATOM 717 CE2 TYR A 48 16.420 3.521 -2.809 1.00 0.00 C ATOM 718 CZ TYR A 48 16.732 3.737 -4.174 1.00 0.00 C ATOM 719 OH TYR A 48 15.959 3.187 -5.159 1.00 0.00 O ATOM 0 H TYR A 48 20.868 6.340 0.615 1.00 0.00 H new ATOM 0 HA TYR A 48 20.237 3.611 -0.230 1.00 0.00 H new ATOM 0 HB2 TYR A 48 18.664 5.632 -0.199 1.00 0.00 H new ATOM 0 HB3 TYR A 48 19.660 6.354 -1.447 1.00 0.00 H new ATOM 0 HD1 TYR A 48 19.616 5.520 -3.750 1.00 0.00 H new ATOM 0 HD2 TYR A 48 17.007 3.874 -0.756 1.00 0.00 H new ATOM 0 HE1 TYR A 48 18.121 4.677 -5.536 1.00 0.00 H new ATOM 0 HE2 TYR A 48 15.535 2.963 -2.542 1.00 0.00 H new ATOM 0 HH TYR A 48 16.064 3.705 -5.984 1.00 0.00 H new ATOM 729 N GLN A 49 22.767 5.033 -1.563 1.00 0.00 N ATOM 730 CA GLN A 49 23.788 4.935 -2.610 1.00 0.00 C ATOM 731 C GLN A 49 24.277 3.498 -2.797 1.00 0.00 C ATOM 732 O GLN A 49 24.439 3.059 -3.935 1.00 0.00 O ATOM 733 CB GLN A 49 24.945 5.855 -2.223 1.00 0.00 C ATOM 734 CG GLN A 49 26.169 5.836 -3.141 1.00 0.00 C ATOM 735 CD GLN A 49 27.289 6.741 -2.608 1.00 0.00 C ATOM 736 OE1 GLN A 49 27.867 7.525 -3.353 1.00 0.00 O ATOM 737 NE2 GLN A 49 27.634 6.678 -1.327 1.00 0.00 N ATOM 0 H GLN A 49 23.038 5.627 -0.779 1.00 0.00 H new ATOM 0 HA GLN A 49 23.359 5.240 -3.564 1.00 0.00 H new ATOM 0 HB2 GLN A 49 24.568 6.877 -2.178 1.00 0.00 H new ATOM 0 HB3 GLN A 49 25.269 5.590 -1.217 1.00 0.00 H new ATOM 0 HG2 GLN A 49 26.539 4.815 -3.234 1.00 0.00 H new ATOM 0 HG3 GLN A 49 25.880 6.163 -4.140 1.00 0.00 H new ATOM 0 HE21 GLN A 49 27.157 6.028 -0.702 1.00 0.00 H new ATOM 0 HE22 GLN A 49 28.376 7.280 -0.968 1.00 0.00 H new ATOM 746 N HIS A 50 24.518 2.753 -1.721 1.00 0.00 N ATOM 747 CA HIS A 50 24.950 1.365 -1.857 1.00 0.00 C ATOM 748 C HIS A 50 23.822 0.478 -2.411 1.00 0.00 C ATOM 749 O HIS A 50 24.099 -0.533 -3.059 1.00 0.00 O ATOM 750 CB HIS A 50 25.540 0.856 -0.538 1.00 0.00 C ATOM 751 CG HIS A 50 26.881 1.476 -0.241 1.00 0.00 C ATOM 752 ND1 HIS A 50 27.094 2.714 0.319 1.00 0.00 N ATOM 753 CD2 HIS A 50 28.108 0.938 -0.525 1.00 0.00 C ATOM 754 CE1 HIS A 50 28.419 2.915 0.375 1.00 0.00 C ATOM 755 NE2 HIS A 50 29.081 1.853 -0.114 1.00 0.00 N ATOM 0 H HIS A 50 24.423 3.081 -0.760 1.00 0.00 H new ATOM 0 HA HIS A 50 25.750 1.313 -2.595 1.00 0.00 H new ATOM 0 HB2 HIS A 50 24.850 1.077 0.277 1.00 0.00 H new ATOM 0 HB3 HIS A 50 25.644 -0.228 -0.582 1.00 0.00 H new ATOM 0 HD2 HIS A 50 28.291 -0.022 -0.985 1.00 0.00 H new ATOM 0 HE1 HIS A 50 28.889 3.808 0.760 1.00 0.00 H new ATOM 0 HE2 HIS A 50 30.093 1.738 -0.173 1.00 0.00 H new ATOM 763 N PHE A 51 22.550 0.872 -2.271 1.00 0.00 N ATOM 764 CA PHE A 51 21.398 0.137 -2.793 1.00 0.00 C ATOM 765 C PHE A 51 21.442 0.023 -4.310 1.00 0.00 C ATOM 766 O PHE A 51 20.975 -0.965 -4.884 1.00 0.00 O ATOM 767 CB PHE A 51 20.106 0.857 -2.430 1.00 0.00 C ATOM 768 CG PHE A 51 18.832 0.086 -2.707 1.00 0.00 C ATOM 769 CD1 PHE A 51 18.529 -1.141 -2.084 1.00 0.00 C ATOM 770 CD2 PHE A 51 17.911 0.652 -3.600 1.00 0.00 C ATOM 771 CE1 PHE A 51 17.299 -1.775 -2.362 1.00 0.00 C ATOM 772 CE2 PHE A 51 16.675 0.042 -3.851 1.00 0.00 C ATOM 773 CZ PHE A 51 16.365 -1.180 -3.241 1.00 0.00 C ATOM 0 H PHE A 51 22.291 1.728 -1.781 1.00 0.00 H new ATOM 0 HA PHE A 51 21.433 -0.858 -2.349 1.00 0.00 H new ATOM 0 HB2 PHE A 51 20.135 1.108 -1.370 1.00 0.00 H new ATOM 0 HB3 PHE A 51 20.068 1.798 -2.979 1.00 0.00 H new ATOM 0 HD1 PHE A 51 19.232 -1.592 -1.400 1.00 0.00 H new ATOM 0 HD2 PHE A 51 18.159 1.575 -4.103 1.00 0.00 H new ATOM 0 HE1 PHE A 51 17.069 -2.723 -1.899 1.00 0.00 H new ATOM 0 HE2 PHE A 51 15.963 0.513 -4.513 1.00 0.00 H new ATOM 0 HZ PHE A 51 15.420 -1.664 -3.440 1.00 0.00 H new ATOM 783 N ILE A 52 22.017 1.033 -4.959 1.00 0.00 N ATOM 784 CA ILE A 52 22.135 1.043 -6.405 1.00 0.00 C ATOM 785 C ILE A 52 23.004 -0.158 -6.814 1.00 0.00 C ATOM 786 O ILE A 52 22.754 -0.760 -7.854 1.00 0.00 O ATOM 787 CB ILE A 52 22.674 2.391 -6.932 1.00 0.00 C ATOM 788 CG1 ILE A 52 22.149 3.645 -6.201 1.00 0.00 C ATOM 789 CG2 ILE A 52 22.325 2.505 -8.428 1.00 0.00 C ATOM 790 CD1 ILE A 52 20.641 3.816 -6.093 1.00 0.00 C ATOM 0 H ILE A 52 22.408 1.855 -4.499 1.00 0.00 H new ATOM 0 HA ILE A 52 21.152 0.943 -6.865 1.00 0.00 H new ATOM 0 HB ILE A 52 23.748 2.375 -6.749 1.00 0.00 H new ATOM 0 HG12 ILE A 52 22.560 3.643 -5.192 1.00 0.00 H new ATOM 0 HG13 ILE A 52 22.552 4.522 -6.707 1.00 0.00 H new ATOM 0 HG21 ILE A 52 22.698 3.452 -8.818 1.00 0.00 H new ATOM 0 HG22 ILE A 52 22.786 1.681 -8.973 1.00 0.00 H new ATOM 0 HG23 ILE A 52 21.243 2.462 -8.553 1.00 0.00 H new ATOM 0 HD11 ILE A 52 20.417 4.738 -5.556 1.00 0.00 H new ATOM 0 HD12 ILE A 52 20.208 3.863 -7.092 1.00 0.00 H new ATOM 0 HD13 ILE A 52 20.217 2.970 -5.553 1.00 0.00 H new ATOM 802 N GLN A 53 24.006 -0.532 -6.004 1.00 0.00 N ATOM 803 CA GLN A 53 24.824 -1.708 -6.247 1.00 0.00 C ATOM 804 C GLN A 53 24.115 -2.961 -5.720 1.00 0.00 C ATOM 805 O GLN A 53 24.287 -4.013 -6.325 1.00 0.00 O ATOM 806 CB GLN A 53 26.223 -1.600 -5.616 1.00 0.00 C ATOM 807 CG GLN A 53 27.084 -0.449 -6.163 1.00 0.00 C ATOM 808 CD GLN A 53 26.916 0.813 -5.326 1.00 0.00 C ATOM 809 OE1 GLN A 53 27.455 0.909 -4.235 1.00 0.00 O ATOM 810 NE2 GLN A 53 26.150 1.781 -5.797 1.00 0.00 N ATOM 0 H GLN A 53 24.265 -0.019 -5.161 1.00 0.00 H new ATOM 0 HA GLN A 53 24.960 -1.781 -7.326 1.00 0.00 H new ATOM 0 HB2 GLN A 53 26.113 -1.474 -4.539 1.00 0.00 H new ATOM 0 HB3 GLN A 53 26.752 -2.540 -5.774 1.00 0.00 H new ATOM 0 HG2 GLN A 53 28.132 -0.747 -6.169 1.00 0.00 H new ATOM 0 HG3 GLN A 53 26.805 -0.243 -7.196 1.00 0.00 H new ATOM 0 HE21 GLN A 53 25.708 1.683 -6.711 1.00 0.00 H new ATOM 0 HE22 GLN A 53 26.001 2.627 -5.247 1.00 0.00 H new ATOM 819 N GLN A 54 23.327 -2.881 -4.632 1.00 0.00 N ATOM 820 CA GLN A 54 22.595 -4.020 -4.058 1.00 0.00 C ATOM 821 C GLN A 54 21.733 -4.704 -5.111 1.00 0.00 C ATOM 822 O GLN A 54 21.676 -5.938 -5.143 1.00 0.00 O ATOM 823 CB GLN A 54 21.650 -3.594 -2.919 1.00 0.00 C ATOM 824 CG GLN A 54 22.347 -3.218 -1.609 1.00 0.00 C ATOM 825 CD GLN A 54 22.805 -4.428 -0.805 1.00 0.00 C ATOM 826 OE1 GLN A 54 22.457 -5.571 -1.095 1.00 0.00 O ATOM 827 NE2 GLN A 54 23.577 -4.194 0.234 1.00 0.00 N ATOM 0 H GLN A 54 23.180 -2.010 -4.121 1.00 0.00 H new ATOM 0 HA GLN A 54 23.360 -4.695 -3.674 1.00 0.00 H new ATOM 0 HB2 GLN A 54 21.059 -2.743 -3.256 1.00 0.00 H new ATOM 0 HB3 GLN A 54 20.953 -4.408 -2.722 1.00 0.00 H new ATOM 0 HG2 GLN A 54 23.210 -2.590 -1.831 1.00 0.00 H new ATOM 0 HG3 GLN A 54 21.667 -2.622 -1.001 1.00 0.00 H new ATOM 0 HE21 GLN A 54 23.855 -3.238 0.458 1.00 0.00 H new ATOM 0 HE22 GLN A 54 23.898 -4.968 0.816 1.00 0.00 H new ATOM 836 N CYS A 55 21.050 -3.913 -5.939 1.00 0.00 N ATOM 837 CA CYS A 55 20.166 -4.428 -6.967 1.00 0.00 C ATOM 838 C CYS A 55 20.995 -5.282 -7.928 1.00 0.00 C ATOM 839 O CYS A 55 21.831 -4.757 -8.667 1.00 0.00 O ATOM 840 CB CYS A 55 19.490 -3.248 -7.672 1.00 0.00 C ATOM 841 SG CYS A 55 18.450 -2.351 -6.485 1.00 0.00 S ATOM 0 H CYS A 55 21.099 -2.895 -5.910 1.00 0.00 H new ATOM 0 HA CYS A 55 19.380 -5.056 -6.547 1.00 0.00 H new ATOM 0 HB2 CYS A 55 20.243 -2.580 -8.090 1.00 0.00 H new ATOM 0 HB3 CYS A 55 18.885 -3.606 -8.505 1.00 0.00 H new ATOM 0 HG CYS A 55 19.204 -1.657 -5.685 1.00 0.00 H new ATOM 847 N THR A 56 20.733 -6.584 -7.946 1.00 0.00 N ATOM 848 CA THR A 56 21.450 -7.578 -8.728 1.00 0.00 C ATOM 849 C THR A 56 20.910 -7.641 -10.159 1.00 0.00 C ATOM 850 O THR A 56 19.982 -6.918 -10.529 1.00 0.00 O ATOM 851 CB THR A 56 21.422 -8.918 -7.962 1.00 0.00 C ATOM 852 OG1 THR A 56 20.168 -9.098 -7.348 1.00 0.00 O ATOM 853 CG2 THR A 56 22.461 -9.030 -6.859 1.00 0.00 C ATOM 0 H THR A 56 19.981 -6.991 -7.390 1.00 0.00 H new ATOM 0 HA THR A 56 22.498 -7.304 -8.848 1.00 0.00 H new ATOM 0 HB THR A 56 21.636 -9.674 -8.717 1.00 0.00 H new ATOM 0 HG1 THR A 56 20.248 -9.757 -6.627 1.00 0.00 H new ATOM 0 HG21 THR A 56 22.372 -10.001 -6.372 1.00 0.00 H new ATOM 0 HG22 THR A 56 23.458 -8.929 -7.287 1.00 0.00 H new ATOM 0 HG23 THR A 56 22.299 -8.240 -6.125 1.00 0.00 H new ATOM 861 N ASP A 57 21.520 -8.466 -10.999 1.00 0.00 N ATOM 862 CA ASP A 57 21.215 -8.586 -12.421 1.00 0.00 C ATOM 863 C ASP A 57 19.898 -9.269 -12.816 1.00 0.00 C ATOM 864 O ASP A 57 19.100 -8.658 -13.526 1.00 0.00 O ATOM 865 CB ASP A 57 22.411 -9.260 -13.117 1.00 0.00 C ATOM 866 CG ASP A 57 22.513 -10.769 -12.875 1.00 0.00 C ATOM 867 OD1 ASP A 57 22.345 -11.227 -11.720 1.00 0.00 O ATOM 868 OD2 ASP A 57 22.759 -11.502 -13.857 1.00 0.00 O ATOM 0 H ASP A 57 22.267 -9.093 -10.700 1.00 0.00 H new ATOM 0 HA ASP A 57 21.051 -7.563 -12.760 1.00 0.00 H new ATOM 0 HB2 ASP A 57 22.341 -9.080 -14.190 1.00 0.00 H new ATOM 0 HB3 ASP A 57 23.330 -8.786 -12.774 1.00 0.00 H new ATOM 873 N ASP A 58 19.660 -10.521 -12.421 1.00 0.00 N ATOM 874 CA ASP A 58 18.503 -11.328 -12.817 1.00 0.00 C ATOM 875 C ASP A 58 17.418 -11.549 -11.771 1.00 0.00 C ATOM 876 O ASP A 58 16.243 -11.611 -12.124 1.00 0.00 O ATOM 877 CB ASP A 58 19.051 -12.682 -13.278 1.00 0.00 C ATOM 878 CG ASP A 58 17.967 -13.722 -13.543 1.00 0.00 C ATOM 879 OD1 ASP A 58 17.462 -13.775 -14.687 1.00 0.00 O ATOM 880 OD2 ASP A 58 17.702 -14.573 -12.657 1.00 0.00 O ATOM 0 H ASP A 58 20.291 -11.020 -11.793 1.00 0.00 H new ATOM 0 HA ASP A 58 17.988 -10.762 -13.593 1.00 0.00 H new ATOM 0 HB2 ASP A 58 19.634 -12.538 -14.187 1.00 0.00 H new ATOM 0 HB3 ASP A 58 19.733 -13.066 -12.519 1.00 0.00 H new ATOM 885 N VAL A 59 17.787 -11.683 -10.500 1.00 0.00 N ATOM 886 CA VAL A 59 16.842 -11.995 -9.444 1.00 0.00 C ATOM 887 C VAL A 59 15.861 -10.847 -9.187 1.00 0.00 C ATOM 888 O VAL A 59 15.988 -9.729 -9.692 1.00 0.00 O ATOM 889 CB VAL A 59 17.614 -12.375 -8.158 1.00 0.00 C ATOM 890 CG1 VAL A 59 18.870 -13.220 -8.416 1.00 0.00 C ATOM 891 CG2 VAL A 59 17.999 -11.149 -7.326 1.00 0.00 C ATOM 0 H VAL A 59 18.749 -11.578 -10.178 1.00 0.00 H new ATOM 0 HA VAL A 59 16.239 -12.845 -9.765 1.00 0.00 H new ATOM 0 HB VAL A 59 16.910 -12.988 -7.595 1.00 0.00 H new ATOM 0 HG11 VAL A 59 19.357 -13.447 -7.468 1.00 0.00 H new ATOM 0 HG12 VAL A 59 18.588 -14.150 -8.910 1.00 0.00 H new ATOM 0 HG13 VAL A 59 19.558 -12.664 -9.054 1.00 0.00 H new ATOM 0 HG21 VAL A 59 18.538 -11.469 -6.435 1.00 0.00 H new ATOM 0 HG22 VAL A 59 18.635 -10.492 -7.919 1.00 0.00 H new ATOM 0 HG23 VAL A 59 17.098 -10.612 -7.031 1.00 0.00 H new ATOM 901 N ARG A 60 14.888 -11.134 -8.326 1.00 0.00 N ATOM 902 CA ARG A 60 13.902 -10.175 -7.857 1.00 0.00 C ATOM 903 C ARG A 60 14.231 -9.956 -6.378 1.00 0.00 C ATOM 904 O ARG A 60 14.524 -10.927 -5.675 1.00 0.00 O ATOM 905 CB ARG A 60 12.478 -10.682 -8.151 1.00 0.00 C ATOM 906 CG ARG A 60 12.070 -11.851 -7.241 1.00 0.00 C ATOM 907 CD ARG A 60 11.017 -12.771 -7.864 1.00 0.00 C ATOM 908 NE ARG A 60 10.831 -13.967 -7.028 1.00 0.00 N ATOM 909 CZ ARG A 60 11.743 -14.922 -6.813 1.00 0.00 C ATOM 910 NH1 ARG A 60 12.816 -15.057 -7.595 1.00 0.00 N ATOM 911 NH2 ARG A 60 11.583 -15.714 -5.767 1.00 0.00 N ATOM 0 H ARG A 60 14.764 -12.065 -7.927 1.00 0.00 H new ATOM 0 HA ARG A 60 13.938 -9.214 -8.371 1.00 0.00 H new ATOM 0 HB2 ARG A 60 11.771 -9.863 -8.024 1.00 0.00 H new ATOM 0 HB3 ARG A 60 12.416 -10.998 -9.192 1.00 0.00 H new ATOM 0 HG2 ARG A 60 12.956 -12.438 -6.998 1.00 0.00 H new ATOM 0 HG3 ARG A 60 11.684 -11.453 -6.303 1.00 0.00 H new ATOM 0 HD2 ARG A 60 10.072 -12.238 -7.965 1.00 0.00 H new ATOM 0 HD3 ARG A 60 11.327 -13.064 -8.867 1.00 0.00 H new ATOM 0 HE ARG A 60 9.926 -14.078 -6.571 1.00 0.00 H new ATOM 0 HH11 ARG A 60 12.957 -14.422 -8.381 1.00 0.00 H new ATOM 0 HH12 ARG A 60 13.495 -15.795 -7.407 1.00 0.00 H new ATOM 0 HH21 ARG A 60 10.781 -15.588 -5.150 1.00 0.00 H new ATOM 0 HH22 ARG A 60 12.262 -16.451 -5.577 1.00 0.00 H new ATOM 925 N LEU A 61 14.227 -8.720 -5.901 1.00 0.00 N ATOM 926 CA LEU A 61 14.483 -8.362 -4.509 1.00 0.00 C ATOM 927 C LEU A 61 13.423 -7.354 -4.105 1.00 0.00 C ATOM 928 O LEU A 61 12.729 -6.796 -4.950 1.00 0.00 O ATOM 929 CB LEU A 61 15.925 -7.837 -4.355 1.00 0.00 C ATOM 930 CG LEU A 61 16.397 -7.431 -2.944 1.00 0.00 C ATOM 931 CD1 LEU A 61 16.304 -8.604 -1.963 1.00 0.00 C ATOM 932 CD2 LEU A 61 17.864 -6.983 -2.989 1.00 0.00 C ATOM 0 H LEU A 61 14.039 -7.909 -6.491 1.00 0.00 H new ATOM 0 HA LEU A 61 14.414 -9.222 -3.843 1.00 0.00 H new ATOM 0 HB2 LEU A 61 16.603 -8.606 -4.726 1.00 0.00 H new ATOM 0 HB3 LEU A 61 16.037 -6.971 -5.008 1.00 0.00 H new ATOM 0 HG LEU A 61 15.749 -6.621 -2.610 1.00 0.00 H new ATOM 0 HD11 LEU A 61 16.644 -8.283 -0.979 1.00 0.00 H new ATOM 0 HD12 LEU A 61 15.270 -8.942 -1.897 1.00 0.00 H new ATOM 0 HD13 LEU A 61 16.932 -9.423 -2.315 1.00 0.00 H new ATOM 0 HD21 LEU A 61 18.188 -6.698 -1.988 1.00 0.00 H new ATOM 0 HD22 LEU A 61 18.484 -7.803 -3.352 1.00 0.00 H new ATOM 0 HD23 LEU A 61 17.963 -6.129 -3.659 1.00 0.00 H new ATOM 944 N PHE A 62 13.238 -7.168 -2.810 1.00 0.00 N ATOM 945 CA PHE A 62 12.241 -6.244 -2.279 1.00 0.00 C ATOM 946 C PHE A 62 12.929 -5.397 -1.219 1.00 0.00 C ATOM 947 O PHE A 62 13.819 -5.908 -0.531 1.00 0.00 O ATOM 948 CB PHE A 62 11.046 -7.008 -1.687 1.00 0.00 C ATOM 949 CG PHE A 62 10.104 -7.726 -2.647 1.00 0.00 C ATOM 950 CD1 PHE A 62 10.553 -8.739 -3.519 1.00 0.00 C ATOM 951 CD2 PHE A 62 8.724 -7.462 -2.573 1.00 0.00 C ATOM 952 CE1 PHE A 62 9.648 -9.479 -4.297 1.00 0.00 C ATOM 953 CE2 PHE A 62 7.814 -8.229 -3.318 1.00 0.00 C ATOM 954 CZ PHE A 62 8.273 -9.239 -4.176 1.00 0.00 C ATOM 0 H PHE A 62 13.775 -7.653 -2.091 1.00 0.00 H new ATOM 0 HA PHE A 62 11.845 -5.610 -3.073 1.00 0.00 H new ATOM 0 HB2 PHE A 62 11.437 -7.748 -0.988 1.00 0.00 H new ATOM 0 HB3 PHE A 62 10.454 -6.301 -1.105 1.00 0.00 H new ATOM 0 HD1 PHE A 62 11.610 -8.949 -3.590 1.00 0.00 H new ATOM 0 HD2 PHE A 62 8.363 -6.665 -1.940 1.00 0.00 H new ATOM 0 HE1 PHE A 62 10.010 -10.229 -4.985 1.00 0.00 H new ATOM 0 HE2 PHE A 62 6.754 -8.040 -3.230 1.00 0.00 H new ATOM 0 HZ PHE A 62 7.568 -9.830 -4.742 1.00 0.00 H new ATOM 964 N ALA A 63 12.524 -4.134 -1.064 1.00 0.00 N ATOM 965 CA ALA A 63 13.125 -3.215 -0.120 1.00 0.00 C ATOM 966 C ALA A 63 12.060 -2.377 0.564 1.00 0.00 C ATOM 967 O ALA A 63 11.203 -1.806 -0.104 1.00 0.00 O ATOM 968 CB ALA A 63 14.146 -2.325 -0.832 1.00 0.00 C ATOM 0 H ALA A 63 11.760 -3.725 -1.601 1.00 0.00 H new ATOM 0 HA ALA A 63 13.643 -3.790 0.648 1.00 0.00 H new ATOM 0 HB1 ALA A 63 14.593 -1.637 -0.114 1.00 0.00 H new ATOM 0 HB2 ALA A 63 14.926 -2.946 -1.273 1.00 0.00 H new ATOM 0 HB3 ALA A 63 13.648 -1.757 -1.617 1.00 0.00 H new ATOM 974 N PHE A 64 12.068 -2.362 1.892 1.00 0.00 N ATOM 975 CA PHE A 64 11.176 -1.528 2.678 1.00 0.00 C ATOM 976 C PHE A 64 12.045 -0.310 2.953 1.00 0.00 C ATOM 977 O PHE A 64 13.126 -0.462 3.528 1.00 0.00 O ATOM 978 CB PHE A 64 10.763 -2.276 3.949 1.00 0.00 C ATOM 979 CG PHE A 64 9.974 -1.452 4.947 1.00 0.00 C ATOM 980 CD1 PHE A 64 8.746 -0.875 4.571 1.00 0.00 C ATOM 981 CD2 PHE A 64 10.451 -1.275 6.259 1.00 0.00 C ATOM 982 CE1 PHE A 64 7.995 -0.142 5.506 1.00 0.00 C ATOM 983 CE2 PHE A 64 9.715 -0.506 7.179 1.00 0.00 C ATOM 984 CZ PHE A 64 8.488 0.060 6.803 1.00 0.00 C ATOM 0 H PHE A 64 12.699 -2.933 2.454 1.00 0.00 H new ATOM 0 HA PHE A 64 10.236 -1.259 2.196 1.00 0.00 H new ATOM 0 HB2 PHE A 64 10.168 -3.144 3.665 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.661 -2.652 4.440 1.00 0.00 H new ATOM 0 HD1 PHE A 64 8.380 -0.996 3.562 1.00 0.00 H new ATOM 0 HD2 PHE A 64 11.383 -1.730 6.560 1.00 0.00 H new ATOM 0 HE1 PHE A 64 7.036 0.267 5.225 1.00 0.00 H new ATOM 0 HE2 PHE A 64 10.096 -0.351 8.178 1.00 0.00 H new ATOM 0 HZ PHE A 64 7.924 0.650 7.511 1.00 0.00 H new ATOM 994 N VAL A 65 11.587 0.881 2.576 1.00 0.00 N ATOM 995 CA VAL A 65 12.391 2.087 2.702 1.00 0.00 C ATOM 996 C VAL A 65 11.547 3.213 3.282 1.00 0.00 C ATOM 997 O VAL A 65 10.387 3.390 2.907 1.00 0.00 O ATOM 998 CB VAL A 65 12.942 2.451 1.304 1.00 0.00 C ATOM 999 CG1 VAL A 65 13.932 3.620 1.341 1.00 0.00 C ATOM 1000 CG2 VAL A 65 13.641 1.254 0.631 1.00 0.00 C ATOM 0 H VAL A 65 10.660 1.034 2.180 1.00 0.00 H new ATOM 0 HA VAL A 65 13.228 1.924 3.381 1.00 0.00 H new ATOM 0 HB VAL A 65 12.066 2.745 0.725 1.00 0.00 H new ATOM 0 HG11 VAL A 65 14.285 3.830 0.331 1.00 0.00 H new ATOM 0 HG12 VAL A 65 13.437 4.504 1.743 1.00 0.00 H new ATOM 0 HG13 VAL A 65 14.780 3.359 1.975 1.00 0.00 H new ATOM 0 HG21 VAL A 65 14.013 1.554 -0.349 1.00 0.00 H new ATOM 0 HG22 VAL A 65 14.475 0.924 1.251 1.00 0.00 H new ATOM 0 HG23 VAL A 65 12.930 0.436 0.514 1.00 0.00 H new ATOM 1010 N ARG A 66 12.121 3.947 4.228 1.00 0.00 N ATOM 1011 CA ARG A 66 11.546 5.126 4.859 1.00 0.00 C ATOM 1012 C ARG A 66 11.665 6.266 3.856 1.00 0.00 C ATOM 1013 O ARG A 66 12.741 6.473 3.300 1.00 0.00 O ATOM 1014 CB ARG A 66 12.326 5.393 6.151 1.00 0.00 C ATOM 1015 CG ARG A 66 12.059 6.757 6.793 1.00 0.00 C ATOM 1016 CD ARG A 66 12.910 6.892 8.061 1.00 0.00 C ATOM 1017 NE ARG A 66 12.168 6.482 9.266 1.00 0.00 N ATOM 1018 CZ ARG A 66 11.575 7.311 10.130 1.00 0.00 C ATOM 1019 NH1 ARG A 66 11.660 8.632 9.989 1.00 0.00 N ATOM 1020 NH2 ARG A 66 10.852 6.836 11.131 1.00 0.00 N ATOM 0 H ARG A 66 13.047 3.723 4.593 1.00 0.00 H new ATOM 0 HA ARG A 66 10.496 5.005 5.125 1.00 0.00 H new ATOM 0 HB2 ARG A 66 12.083 4.614 6.873 1.00 0.00 H new ATOM 0 HB3 ARG A 66 13.392 5.310 5.939 1.00 0.00 H new ATOM 0 HG2 ARG A 66 12.300 7.556 6.092 1.00 0.00 H new ATOM 0 HG3 ARG A 66 11.002 6.856 7.038 1.00 0.00 H new ATOM 0 HD2 ARG A 66 13.808 6.282 7.962 1.00 0.00 H new ATOM 0 HD3 ARG A 66 13.237 7.926 8.170 1.00 0.00 H new ATOM 0 HE ARG A 66 12.101 5.482 9.457 1.00 0.00 H new ATOM 0 HH11 ARG A 66 12.185 9.029 9.210 1.00 0.00 H new ATOM 0 HH12 ARG A 66 11.200 9.247 10.660 1.00 0.00 H new ATOM 0 HH21 ARG A 66 10.743 5.829 11.249 1.00 0.00 H new ATOM 0 HH22 ARG A 66 10.403 7.477 11.785 1.00 0.00 H new ATOM 1034 N PHE A 67 10.573 6.985 3.618 1.00 0.00 N ATOM 1035 CA PHE A 67 10.503 8.072 2.656 1.00 0.00 C ATOM 1036 C PHE A 67 9.745 9.252 3.275 1.00 0.00 C ATOM 1037 O PHE A 67 8.926 9.050 4.171 1.00 0.00 O ATOM 1038 CB PHE A 67 9.842 7.539 1.377 1.00 0.00 C ATOM 1039 CG PHE A 67 10.074 8.435 0.185 1.00 0.00 C ATOM 1040 CD1 PHE A 67 11.242 8.289 -0.590 1.00 0.00 C ATOM 1041 CD2 PHE A 67 9.158 9.459 -0.109 1.00 0.00 C ATOM 1042 CE1 PHE A 67 11.516 9.201 -1.622 1.00 0.00 C ATOM 1043 CE2 PHE A 67 9.432 10.368 -1.142 1.00 0.00 C ATOM 1044 CZ PHE A 67 10.616 10.250 -1.882 1.00 0.00 C ATOM 0 H PHE A 67 9.691 6.821 4.103 1.00 0.00 H new ATOM 0 HA PHE A 67 11.495 8.440 2.393 1.00 0.00 H new ATOM 0 HB2 PHE A 67 10.230 6.544 1.160 1.00 0.00 H new ATOM 0 HB3 PHE A 67 8.770 7.433 1.544 1.00 0.00 H new ATOM 0 HD1 PHE A 67 11.925 7.477 -0.390 1.00 0.00 H new ATOM 0 HD2 PHE A 67 8.244 9.546 0.460 1.00 0.00 H new ATOM 0 HE1 PHE A 67 12.414 9.097 -2.213 1.00 0.00 H new ATOM 0 HE2 PHE A 67 8.731 11.158 -1.367 1.00 0.00 H new ATOM 0 HZ PHE A 67 10.839 10.969 -2.657 1.00 0.00 H new ATOM 1054 N THR A 68 9.930 10.475 2.785 1.00 0.00 N ATOM 1055 CA THR A 68 9.322 11.667 3.354 1.00 0.00 C ATOM 1056 C THR A 68 8.361 12.299 2.341 1.00 0.00 C ATOM 1057 O THR A 68 8.814 12.818 1.319 1.00 0.00 O ATOM 1058 CB THR A 68 10.460 12.629 3.740 1.00 0.00 C ATOM 1059 OG1 THR A 68 11.516 11.960 4.410 1.00 0.00 O ATOM 1060 CG2 THR A 68 9.947 13.736 4.651 1.00 0.00 C ATOM 0 H THR A 68 10.515 10.665 1.971 1.00 0.00 H new ATOM 0 HA THR A 68 8.735 11.426 4.241 1.00 0.00 H new ATOM 0 HB THR A 68 10.837 13.049 2.808 1.00 0.00 H new ATOM 0 HG1 THR A 68 12.219 12.604 4.637 1.00 0.00 H new ATOM 0 HG21 THR A 68 10.769 14.404 4.911 1.00 0.00 H new ATOM 0 HG22 THR A 68 9.170 14.300 4.136 1.00 0.00 H new ATOM 0 HG23 THR A 68 9.535 13.298 5.560 1.00 0.00 H new ATOM 1068 N THR A 69 7.054 12.291 2.637 1.00 0.00 N ATOM 1069 CA THR A 69 6.007 12.928 1.832 1.00 0.00 C ATOM 1070 C THR A 69 4.848 13.314 2.762 1.00 0.00 C ATOM 1071 O THR A 69 4.663 12.705 3.822 1.00 0.00 O ATOM 1072 CB THR A 69 5.513 11.997 0.696 1.00 0.00 C ATOM 1073 OG1 THR A 69 6.577 11.523 -0.095 1.00 0.00 O ATOM 1074 CG2 THR A 69 4.562 12.699 -0.282 1.00 0.00 C ATOM 0 H THR A 69 6.687 11.827 3.468 1.00 0.00 H new ATOM 0 HA THR A 69 6.415 13.818 1.353 1.00 0.00 H new ATOM 0 HB THR A 69 5.003 11.188 1.219 1.00 0.00 H new ATOM 0 HG1 THR A 69 6.226 10.938 -0.799 1.00 0.00 H new ATOM 0 HG21 THR A 69 4.251 11.996 -1.055 1.00 0.00 H new ATOM 0 HG22 THR A 69 3.685 13.058 0.257 1.00 0.00 H new ATOM 0 HG23 THR A 69 5.074 13.543 -0.745 1.00 0.00 H new ATOM 1082 N GLY A 70 4.032 14.278 2.333 1.00 0.00 N ATOM 1083 CA GLY A 70 2.837 14.744 3.015 1.00 0.00 C ATOM 1084 C GLY A 70 3.129 15.980 3.848 1.00 0.00 C ATOM 1085 O GLY A 70 4.278 16.249 4.207 1.00 0.00 O ATOM 0 H GLY A 70 4.200 14.775 1.458 1.00 0.00 H new ATOM 0 HA2 GLY A 70 2.062 14.970 2.283 1.00 0.00 H new ATOM 0 HA3 GLY A 70 2.449 13.953 3.656 1.00 0.00 H new ATOM 1089 N ASP A 71 2.075 16.707 4.211 1.00 0.00 N ATOM 1090 CA ASP A 71 2.156 17.948 4.971 1.00 0.00 C ATOM 1091 C ASP A 71 1.053 17.953 6.015 1.00 0.00 C ATOM 1092 O ASP A 71 -0.050 17.469 5.762 1.00 0.00 O ATOM 1093 CB ASP A 71 1.948 19.170 4.074 1.00 0.00 C ATOM 1094 CG ASP A 71 3.179 19.615 3.292 1.00 0.00 C ATOM 1095 OD1 ASP A 71 3.627 18.916 2.355 1.00 0.00 O ATOM 1096 OD2 ASP A 71 3.655 20.742 3.569 1.00 0.00 O ATOM 0 H ASP A 71 1.118 16.441 3.978 1.00 0.00 H new ATOM 0 HA ASP A 71 3.146 18.001 5.424 1.00 0.00 H new ATOM 0 HB2 ASP A 71 1.147 18.951 3.367 1.00 0.00 H new ATOM 0 HB3 ASP A 71 1.609 20.001 4.692 1.00 0.00 H new ATOM 1101 N ALA A 72 1.400 18.422 7.204 1.00 0.00 N ATOM 1102 CA ALA A 72 0.582 18.654 8.380 1.00 0.00 C ATOM 1103 C ALA A 72 1.214 19.879 9.052 1.00 0.00 C ATOM 1104 O ALA A 72 2.114 20.501 8.477 1.00 0.00 O ATOM 1105 CB ALA A 72 0.599 17.417 9.285 1.00 0.00 C ATOM 0 H ALA A 72 2.371 18.677 7.386 1.00 0.00 H new ATOM 0 HA ALA A 72 -0.468 18.833 8.148 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.018 17.601 10.165 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.204 16.561 8.738 1.00 0.00 H new ATOM 0 HB3 ALA A 72 1.622 17.208 9.597 1.00 0.00 H new ATOM 1111 N MET A 73 0.764 20.281 10.243 1.00 0.00 N ATOM 1112 CA MET A 73 1.397 21.372 10.976 1.00 0.00 C ATOM 1113 C MET A 73 2.804 20.944 11.455 1.00 0.00 C ATOM 1114 O MET A 73 3.553 21.738 12.031 1.00 0.00 O ATOM 1115 CB MET A 73 0.531 21.791 12.175 1.00 0.00 C ATOM 1116 CG MET A 73 -0.854 22.307 11.763 1.00 0.00 C ATOM 1117 SD MET A 73 -2.025 22.476 13.137 1.00 0.00 S ATOM 1118 CE MET A 73 -1.342 23.915 14.002 1.00 0.00 C ATOM 0 H MET A 73 -0.037 19.865 10.718 1.00 0.00 H new ATOM 0 HA MET A 73 1.497 22.228 10.308 1.00 0.00 H new ATOM 0 HB2 MET A 73 0.411 20.939 12.845 1.00 0.00 H new ATOM 0 HB3 MET A 73 1.050 22.568 12.737 1.00 0.00 H new ATOM 0 HG2 MET A 73 -0.738 23.276 11.278 1.00 0.00 H new ATOM 0 HG3 MET A 73 -1.276 21.628 11.022 1.00 0.00 H new ATOM 0 HE1 MET A 73 -1.957 24.142 14.873 1.00 0.00 H new ATOM 0 HE2 MET A 73 -0.324 23.697 14.324 1.00 0.00 H new ATOM 0 HE3 MET A 73 -1.334 24.773 13.330 1.00 0.00 H new ATOM 1128 N SER A 74 3.168 19.681 11.220 1.00 0.00 N ATOM 1129 CA SER A 74 4.376 19.003 11.633 1.00 0.00 C ATOM 1130 C SER A 74 4.924 18.174 10.467 1.00 0.00 C ATOM 1131 O SER A 74 4.231 17.976 9.462 1.00 0.00 O ATOM 1132 CB SER A 74 3.998 18.065 12.787 1.00 0.00 C ATOM 1133 OG SER A 74 3.052 18.624 13.689 1.00 0.00 O ATOM 0 H SER A 74 2.561 19.059 10.686 1.00 0.00 H new ATOM 0 HA SER A 74 5.136 19.720 11.942 1.00 0.00 H new ATOM 0 HB2 SER A 74 3.592 17.141 12.375 1.00 0.00 H new ATOM 0 HB3 SER A 74 4.900 17.799 13.338 1.00 0.00 H new ATOM 0 HG SER A 74 2.853 17.977 14.398 1.00 0.00 H new ATOM 1139 N LYS A 75 6.161 17.675 10.585 1.00 0.00 N ATOM 1140 CA LYS A 75 6.720 16.792 9.563 1.00 0.00 C ATOM 1141 C LYS A 75 6.007 15.448 9.644 1.00 0.00 C ATOM 1142 O LYS A 75 5.333 15.123 10.630 1.00 0.00 O ATOM 1143 CB LYS A 75 8.239 16.610 9.733 1.00 0.00 C ATOM 1144 CG LYS A 75 9.085 17.755 9.159 1.00 0.00 C ATOM 1145 CD LYS A 75 9.085 17.741 7.625 1.00 0.00 C ATOM 1146 CE LYS A 75 10.002 18.826 7.058 1.00 0.00 C ATOM 1147 NZ LYS A 75 9.820 18.979 5.600 1.00 0.00 N ATOM 0 H LYS A 75 6.784 17.867 11.369 1.00 0.00 H new ATOM 0 HA LYS A 75 6.565 17.242 8.583 1.00 0.00 H new ATOM 0 HB2 LYS A 75 8.463 16.506 10.795 1.00 0.00 H new ATOM 0 HB3 LYS A 75 8.537 15.678 9.252 1.00 0.00 H new ATOM 0 HG2 LYS A 75 8.697 18.709 9.515 1.00 0.00 H new ATOM 0 HG3 LYS A 75 10.108 17.671 9.524 1.00 0.00 H new ATOM 0 HD2 LYS A 75 9.411 16.764 7.268 1.00 0.00 H new ATOM 0 HD3 LYS A 75 8.070 17.892 7.258 1.00 0.00 H new ATOM 0 HE2 LYS A 75 9.795 19.775 7.553 1.00 0.00 H new ATOM 0 HE3 LYS A 75 11.041 18.575 7.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 10.456 19.722 5.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 10.041 18.080 5.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 8.834 19.243 5.399 1.00 0.00 H new ATOM 1161 N ARG A 76 6.171 14.645 8.599 1.00 0.00 N ATOM 1162 CA ARG A 76 5.528 13.344 8.456 1.00 0.00 C ATOM 1163 C ARG A 76 6.603 12.343 8.053 1.00 0.00 C ATOM 1164 O ARG A 76 7.718 12.743 7.708 1.00 0.00 O ATOM 1165 CB ARG A 76 4.397 13.425 7.409 1.00 0.00 C ATOM 1166 CG ARG A 76 3.565 14.726 7.446 1.00 0.00 C ATOM 1167 CD ARG A 76 2.101 14.518 7.058 1.00 0.00 C ATOM 1168 NE ARG A 76 1.285 14.244 8.250 1.00 0.00 N ATOM 1169 CZ ARG A 76 0.261 13.400 8.364 1.00 0.00 C ATOM 1170 NH1 ARG A 76 -0.022 12.561 7.379 1.00 0.00 N ATOM 1171 NH2 ARG A 76 -0.480 13.390 9.465 1.00 0.00 N ATOM 0 H ARG A 76 6.769 14.886 7.809 1.00 0.00 H new ATOM 0 HA ARG A 76 5.069 13.025 9.392 1.00 0.00 H new ATOM 0 HB2 ARG A 76 4.833 13.319 6.416 1.00 0.00 H new ATOM 0 HB3 ARG A 76 3.726 12.578 7.555 1.00 0.00 H new ATOM 0 HG2 ARG A 76 3.611 15.150 8.449 1.00 0.00 H new ATOM 0 HG3 ARG A 76 4.013 15.455 6.771 1.00 0.00 H new ATOM 0 HD2 ARG A 76 1.724 15.405 6.549 1.00 0.00 H new ATOM 0 HD3 ARG A 76 2.019 13.688 6.356 1.00 0.00 H new ATOM 0 HE ARG A 76 1.533 14.763 9.092 1.00 0.00 H new ATOM 0 HH11 ARG A 76 0.545 12.560 6.531 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -0.807 11.916 7.469 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -0.266 14.031 10.229 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -1.263 12.742 9.547 1.00 0.00 H new ATOM 1185 N SER A 77 6.291 11.054 8.091 1.00 0.00 N ATOM 1186 CA SER A 77 7.197 10.010 7.644 1.00 0.00 C ATOM 1187 C SER A 77 6.347 8.914 7.024 1.00 0.00 C ATOM 1188 O SER A 77 5.303 8.528 7.563 1.00 0.00 O ATOM 1189 CB SER A 77 8.068 9.510 8.800 1.00 0.00 C ATOM 1190 OG SER A 77 9.183 8.805 8.297 1.00 0.00 O ATOM 0 H SER A 77 5.397 10.704 8.435 1.00 0.00 H new ATOM 0 HA SER A 77 7.897 10.385 6.898 1.00 0.00 H new ATOM 0 HB2 SER A 77 8.403 10.353 9.404 1.00 0.00 H new ATOM 0 HB3 SER A 77 7.483 8.863 9.453 1.00 0.00 H new ATOM 0 HG SER A 77 9.259 7.942 8.756 1.00 0.00 H new ATOM 1196 N LYS A 78 6.767 8.463 5.850 1.00 0.00 N ATOM 1197 CA LYS A 78 6.115 7.471 5.018 1.00 0.00 C ATOM 1198 C LYS A 78 7.110 6.357 4.774 1.00 0.00 C ATOM 1199 O LYS A 78 8.271 6.416 5.170 1.00 0.00 O ATOM 1200 CB LYS A 78 5.657 8.086 3.683 1.00 0.00 C ATOM 1201 CG LYS A 78 4.571 9.155 3.810 1.00 0.00 C ATOM 1202 CD LYS A 78 3.356 8.736 4.652 1.00 0.00 C ATOM 1203 CE LYS A 78 2.134 9.620 4.390 1.00 0.00 C ATOM 1204 NZ LYS A 78 1.384 9.187 3.193 1.00 0.00 N ATOM 0 H LYS A 78 7.630 8.806 5.429 1.00 0.00 H new ATOM 0 HA LYS A 78 5.225 7.089 5.518 1.00 0.00 H new ATOM 0 HB2 LYS A 78 6.522 8.524 3.185 1.00 0.00 H new ATOM 0 HB3 LYS A 78 5.288 7.288 3.039 1.00 0.00 H new ATOM 0 HG2 LYS A 78 5.010 10.050 4.250 1.00 0.00 H new ATOM 0 HG3 LYS A 78 4.228 9.426 2.812 1.00 0.00 H new ATOM 0 HD2 LYS A 78 3.105 7.698 4.432 1.00 0.00 H new ATOM 0 HD3 LYS A 78 3.616 8.784 5.709 1.00 0.00 H new ATOM 0 HE2 LYS A 78 1.476 9.596 5.259 1.00 0.00 H new ATOM 0 HE3 LYS A 78 2.455 10.654 4.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 0.364 9.213 3.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 1.597 9.825 2.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 1.662 8.217 2.941 1.00 0.00 H new ATOM 1218 N PHE A 79 6.627 5.332 4.091 1.00 0.00 N ATOM 1219 CA PHE A 79 7.440 4.201 3.690 1.00 0.00 C ATOM 1220 C PHE A 79 6.988 3.789 2.309 1.00 0.00 C ATOM 1221 O PHE A 79 5.792 3.850 2.008 1.00 0.00 O ATOM 1222 CB PHE A 79 7.345 3.040 4.694 1.00 0.00 C ATOM 1223 CG PHE A 79 7.570 3.496 6.117 1.00 0.00 C ATOM 1224 CD1 PHE A 79 6.509 4.083 6.830 1.00 0.00 C ATOM 1225 CD2 PHE A 79 8.877 3.575 6.620 1.00 0.00 C ATOM 1226 CE1 PHE A 79 6.767 4.835 7.986 1.00 0.00 C ATOM 1227 CE2 PHE A 79 9.130 4.329 7.775 1.00 0.00 C ATOM 1228 CZ PHE A 79 8.082 4.966 8.462 1.00 0.00 C ATOM 0 H PHE A 79 5.652 5.263 3.798 1.00 0.00 H new ATOM 0 HA PHE A 79 8.493 4.484 3.673 1.00 0.00 H new ATOM 0 HB2 PHE A 79 6.363 2.573 4.615 1.00 0.00 H new ATOM 0 HB3 PHE A 79 8.082 2.279 4.437 1.00 0.00 H new ATOM 0 HD1 PHE A 79 5.493 3.954 6.487 1.00 0.00 H new ATOM 0 HD2 PHE A 79 9.683 3.058 6.121 1.00 0.00 H new ATOM 0 HE1 PHE A 79 5.953 5.314 8.511 1.00 0.00 H new ATOM 0 HE2 PHE A 79 10.142 4.421 8.141 1.00 0.00 H new ATOM 0 HZ PHE A 79 8.286 5.550 9.347 1.00 0.00 H new ATOM 1238 N ALA A 80 7.932 3.367 1.485 1.00 0.00 N ATOM 1239 CA ALA A 80 7.703 2.875 0.147 1.00 0.00 C ATOM 1240 C ALA A 80 8.218 1.446 0.113 1.00 0.00 C ATOM 1241 O ALA A 80 9.291 1.159 0.649 1.00 0.00 O ATOM 1242 CB ALA A 80 8.422 3.791 -0.854 1.00 0.00 C ATOM 0 H ALA A 80 8.918 3.360 1.746 1.00 0.00 H new ATOM 0 HA ALA A 80 6.648 2.879 -0.129 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.254 3.426 -1.867 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.032 4.805 -0.764 1.00 0.00 H new ATOM 0 HB3 ALA A 80 9.491 3.793 -0.642 1.00 0.00 H new ATOM 1248 N LEU A 81 7.417 0.540 -0.447 1.00 0.00 N ATOM 1249 CA LEU A 81 7.843 -0.838 -0.627 1.00 0.00 C ATOM 1250 C LEU A 81 8.313 -0.894 -2.066 1.00 0.00 C ATOM 1251 O LEU A 81 7.519 -0.772 -2.996 1.00 0.00 O ATOM 1252 CB LEU A 81 6.686 -1.803 -0.330 1.00 0.00 C ATOM 1253 CG LEU A 81 7.007 -3.305 -0.490 1.00 0.00 C ATOM 1254 CD1 LEU A 81 6.912 -3.809 -1.935 1.00 0.00 C ATOM 1255 CD2 LEU A 81 8.343 -3.730 0.131 1.00 0.00 C ATOM 0 H LEU A 81 6.474 0.739 -0.781 1.00 0.00 H new ATOM 0 HA LEU A 81 8.637 -1.143 0.055 1.00 0.00 H new ATOM 0 HB2 LEU A 81 6.346 -1.630 0.691 1.00 0.00 H new ATOM 0 HB3 LEU A 81 5.854 -1.556 -0.989 1.00 0.00 H new ATOM 0 HG LEU A 81 6.215 -3.788 0.082 1.00 0.00 H new ATOM 0 HD11 LEU A 81 7.151 -4.872 -1.966 1.00 0.00 H new ATOM 0 HD12 LEU A 81 5.900 -3.654 -2.309 1.00 0.00 H new ATOM 0 HD13 LEU A 81 7.617 -3.260 -2.559 1.00 0.00 H new ATOM 0 HD21 LEU A 81 8.493 -4.798 -0.025 1.00 0.00 H new ATOM 0 HD22 LEU A 81 9.156 -3.177 -0.340 1.00 0.00 H new ATOM 0 HD23 LEU A 81 8.331 -3.517 1.200 1.00 0.00 H new ATOM 1267 N ILE A 82 9.598 -1.095 -2.267 1.00 0.00 N ATOM 1268 CA ILE A 82 10.206 -1.131 -3.580 1.00 0.00 C ATOM 1269 C ILE A 82 10.361 -2.594 -3.928 1.00 0.00 C ATOM 1270 O ILE A 82 10.641 -3.431 -3.068 1.00 0.00 O ATOM 1271 CB ILE A 82 11.530 -0.335 -3.586 1.00 0.00 C ATOM 1272 CG1 ILE A 82 11.225 1.179 -3.472 1.00 0.00 C ATOM 1273 CG2 ILE A 82 12.387 -0.602 -4.834 1.00 0.00 C ATOM 1274 CD1 ILE A 82 11.533 1.682 -2.066 1.00 0.00 C ATOM 0 H ILE A 82 10.262 -1.241 -1.507 1.00 0.00 H new ATOM 0 HA ILE A 82 9.595 -0.647 -4.342 1.00 0.00 H new ATOM 0 HB ILE A 82 12.111 -0.673 -2.727 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.819 1.731 -4.200 1.00 0.00 H new ATOM 0 HG13 ILE A 82 10.177 1.364 -3.709 1.00 0.00 H new ATOM 0 HG21 ILE A 82 13.303 -0.014 -4.779 1.00 0.00 H new ATOM 0 HG22 ILE A 82 12.638 -1.662 -4.883 1.00 0.00 H new ATOM 0 HG23 ILE A 82 11.828 -0.320 -5.726 1.00 0.00 H new ATOM 0 HD11 ILE A 82 11.313 2.748 -2.004 1.00 0.00 H new ATOM 0 HD12 ILE A 82 10.920 1.142 -1.344 1.00 0.00 H new ATOM 0 HD13 ILE A 82 12.587 1.516 -1.843 1.00 0.00 H new ATOM 1286 N THR A 83 10.176 -2.898 -5.203 1.00 0.00 N ATOM 1287 CA THR A 83 10.368 -4.222 -5.727 1.00 0.00 C ATOM 1288 C THR A 83 11.354 -4.046 -6.871 1.00 0.00 C ATOM 1289 O THR A 83 11.125 -3.241 -7.774 1.00 0.00 O ATOM 1290 CB THR A 83 9.028 -4.789 -6.212 1.00 0.00 C ATOM 1291 OG1 THR A 83 7.950 -4.434 -5.361 1.00 0.00 O ATOM 1292 CG2 THR A 83 9.114 -6.312 -6.232 1.00 0.00 C ATOM 0 H THR A 83 9.885 -2.217 -5.904 1.00 0.00 H new ATOM 0 HA THR A 83 10.746 -4.925 -4.985 1.00 0.00 H new ATOM 0 HB THR A 83 8.841 -4.374 -7.202 1.00 0.00 H new ATOM 0 HG1 THR A 83 7.287 -3.921 -5.869 1.00 0.00 H new ATOM 0 HG21 THR A 83 8.166 -6.725 -6.576 1.00 0.00 H new ATOM 0 HG22 THR A 83 9.911 -6.623 -6.907 1.00 0.00 H new ATOM 0 HG23 THR A 83 9.326 -6.678 -5.227 1.00 0.00 H new ATOM 1300 N TRP A 84 12.462 -4.760 -6.805 1.00 0.00 N ATOM 1301 CA TRP A 84 13.479 -4.810 -7.823 1.00 0.00 C ATOM 1302 C TRP A 84 13.219 -6.108 -8.569 1.00 0.00 C ATOM 1303 O TRP A 84 13.027 -7.144 -7.928 1.00 0.00 O ATOM 1304 CB TRP A 84 14.866 -4.830 -7.172 1.00 0.00 C ATOM 1305 CG TRP A 84 15.946 -5.186 -8.139 1.00 0.00 C ATOM 1306 CD1 TRP A 84 16.588 -6.375 -8.222 1.00 0.00 C ATOM 1307 CD2 TRP A 84 16.397 -4.404 -9.279 1.00 0.00 C ATOM 1308 NE1 TRP A 84 17.390 -6.381 -9.345 1.00 0.00 N ATOM 1309 CE2 TRP A 84 17.266 -5.214 -10.062 1.00 0.00 C ATOM 1310 CE3 TRP A 84 16.120 -3.104 -9.748 1.00 0.00 C ATOM 1311 CZ2 TRP A 84 17.795 -4.776 -11.282 1.00 0.00 C ATOM 1312 CZ3 TRP A 84 16.671 -2.643 -10.954 1.00 0.00 C ATOM 1313 CH2 TRP A 84 17.484 -3.487 -11.731 1.00 0.00 C ATOM 0 H TRP A 84 12.682 -5.346 -6.000 1.00 0.00 H new ATOM 0 HA TRP A 84 13.450 -3.947 -8.488 1.00 0.00 H new ATOM 0 HB2 TRP A 84 15.076 -3.851 -6.742 1.00 0.00 H new ATOM 0 HB3 TRP A 84 14.868 -5.546 -6.350 1.00 0.00 H new ATOM 0 HD1 TRP A 84 16.488 -7.190 -7.520 1.00 0.00 H new ATOM 0 HE1 TRP A 84 17.999 -7.155 -9.610 1.00 0.00 H new ATOM 0 HE3 TRP A 84 15.476 -2.455 -9.173 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 18.433 -5.422 -11.867 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 16.470 -1.635 -11.287 1.00 0.00 H new ATOM 0 HH2 TRP A 84 17.870 -3.140 -12.678 1.00 0.00 H new ATOM 1324 N ILE A 85 13.188 -6.080 -9.895 1.00 0.00 N ATOM 1325 CA ILE A 85 13.038 -7.279 -10.702 1.00 0.00 C ATOM 1326 C ILE A 85 14.045 -7.130 -11.831 1.00 0.00 C ATOM 1327 O ILE A 85 13.849 -6.267 -12.681 1.00 0.00 O ATOM 1328 CB ILE A 85 11.583 -7.476 -11.198 1.00 0.00 C ATOM 1329 CG1 ILE A 85 10.569 -7.493 -10.029 1.00 0.00 C ATOM 1330 CG2 ILE A 85 11.514 -8.799 -11.975 1.00 0.00 C ATOM 1331 CD1 ILE A 85 9.176 -8.033 -10.378 1.00 0.00 C ATOM 0 H ILE A 85 13.267 -5.222 -10.441 1.00 0.00 H new ATOM 0 HA ILE A 85 13.235 -8.183 -10.126 1.00 0.00 H new ATOM 0 HB ILE A 85 11.314 -6.637 -11.839 1.00 0.00 H new ATOM 0 HG12 ILE A 85 10.982 -8.096 -9.220 1.00 0.00 H new ATOM 0 HG13 ILE A 85 10.462 -6.478 -9.648 1.00 0.00 H new ATOM 0 HG21 ILE A 85 10.497 -8.958 -12.334 1.00 0.00 H new ATOM 0 HG22 ILE A 85 12.196 -8.758 -12.824 1.00 0.00 H new ATOM 0 HG23 ILE A 85 11.800 -9.621 -11.319 1.00 0.00 H new ATOM 0 HD11 ILE A 85 8.542 -8.003 -9.492 1.00 0.00 H new ATOM 0 HD12 ILE A 85 8.734 -7.419 -11.162 1.00 0.00 H new ATOM 0 HD13 ILE A 85 9.262 -9.062 -10.728 1.00 0.00 H new ATOM 1343 N GLY A 86 15.123 -7.920 -11.820 1.00 0.00 N ATOM 1344 CA GLY A 86 16.100 -7.922 -12.897 1.00 0.00 C ATOM 1345 C GLY A 86 15.355 -8.038 -14.224 1.00 0.00 C ATOM 1346 O GLY A 86 14.466 -8.879 -14.366 1.00 0.00 O ATOM 0 H GLY A 86 15.336 -8.571 -11.065 1.00 0.00 H new ATOM 0 HA2 GLY A 86 16.692 -7.007 -12.873 1.00 0.00 H new ATOM 0 HA3 GLY A 86 16.794 -8.754 -12.778 1.00 0.00 H new ATOM 1350 N GLU A 87 15.713 -7.236 -15.227 1.00 0.00 N ATOM 1351 CA GLU A 87 14.974 -7.226 -16.489 1.00 0.00 C ATOM 1352 C GLU A 87 15.065 -8.561 -17.254 1.00 0.00 C ATOM 1353 O GLU A 87 14.395 -8.753 -18.272 1.00 0.00 O ATOM 1354 CB GLU A 87 15.427 -6.026 -17.338 1.00 0.00 C ATOM 1355 CG GLU A 87 14.398 -5.608 -18.404 1.00 0.00 C ATOM 1356 CD GLU A 87 13.123 -5.072 -17.739 1.00 0.00 C ATOM 1357 OE1 GLU A 87 12.224 -5.874 -17.392 1.00 0.00 O ATOM 1358 OE2 GLU A 87 13.041 -3.849 -17.486 1.00 0.00 O ATOM 0 H GLU A 87 16.502 -6.591 -15.191 1.00 0.00 H new ATOM 0 HA GLU A 87 13.914 -7.111 -16.260 1.00 0.00 H new ATOM 0 HB2 GLU A 87 15.623 -5.179 -16.681 1.00 0.00 H new ATOM 0 HB3 GLU A 87 16.368 -6.273 -17.829 1.00 0.00 H new ATOM 0 HG2 GLU A 87 14.827 -4.843 -19.052 1.00 0.00 H new ATOM 0 HG3 GLU A 87 14.154 -6.461 -19.037 1.00 0.00 H new ATOM 1365 N ASN A 88 15.884 -9.510 -16.802 1.00 0.00 N ATOM 1366 CA ASN A 88 15.980 -10.827 -17.416 1.00 0.00 C ATOM 1367 C ASN A 88 14.907 -11.789 -16.928 1.00 0.00 C ATOM 1368 O ASN A 88 14.612 -12.737 -17.661 1.00 0.00 O ATOM 1369 CB ASN A 88 17.352 -11.453 -17.154 1.00 0.00 C ATOM 1370 CG ASN A 88 18.432 -10.950 -18.097 1.00 0.00 C ATOM 1371 OD1 ASN A 88 18.331 -9.879 -18.703 1.00 0.00 O ATOM 1372 ND2 ASN A 88 19.483 -11.729 -18.257 1.00 0.00 N ATOM 0 H ASN A 88 16.499 -9.384 -15.998 1.00 0.00 H new ATOM 0 HA ASN A 88 15.834 -10.667 -18.484 1.00 0.00 H new ATOM 0 HB2 ASN A 88 17.649 -11.243 -16.127 1.00 0.00 H new ATOM 0 HB3 ASN A 88 17.273 -12.536 -17.248 1.00 0.00 H new ATOM 0 HD21 ASN A 88 20.232 -11.451 -18.891 1.00 0.00 H new ATOM 0 HD22 ASN A 88 19.547 -12.610 -17.747 1.00 0.00 H new ATOM 1379 N VAL A 89 14.309 -11.610 -15.740 1.00 0.00 N ATOM 1380 CA VAL A 89 13.359 -12.616 -15.297 1.00 0.00 C ATOM 1381 C VAL A 89 11.965 -12.335 -15.855 1.00 0.00 C ATOM 1382 O VAL A 89 11.362 -11.284 -15.646 1.00 0.00 O ATOM 1383 CB VAL A 89 13.456 -12.790 -13.770 1.00 0.00 C ATOM 1384 CG1 VAL A 89 13.067 -11.591 -12.907 1.00 0.00 C ATOM 1385 CG2 VAL A 89 12.615 -13.987 -13.325 1.00 0.00 C ATOM 0 H VAL A 89 14.459 -10.824 -15.108 1.00 0.00 H new ATOM 0 HA VAL A 89 13.610 -13.594 -15.709 1.00 0.00 H new ATOM 0 HB VAL A 89 14.524 -12.932 -13.603 1.00 0.00 H new ATOM 0 HG11 VAL A 89 13.181 -11.848 -11.854 1.00 0.00 H new ATOM 0 HG12 VAL A 89 13.713 -10.746 -13.146 1.00 0.00 H new ATOM 0 HG13 VAL A 89 12.029 -11.322 -13.105 1.00 0.00 H new ATOM 0 HG21 VAL A 89 12.690 -14.102 -12.244 1.00 0.00 H new ATOM 0 HG22 VAL A 89 11.573 -13.823 -13.601 1.00 0.00 H new ATOM 0 HG23 VAL A 89 12.981 -14.890 -13.812 1.00 0.00 H new ATOM 1395 N SER A 90 11.444 -13.330 -16.566 1.00 0.00 N ATOM 1396 CA SER A 90 10.118 -13.390 -17.131 1.00 0.00 C ATOM 1397 C SER A 90 9.756 -14.871 -17.053 1.00 0.00 C ATOM 1398 O SER A 90 10.509 -15.714 -17.554 1.00 0.00 O ATOM 1399 CB SER A 90 10.105 -12.789 -18.541 1.00 0.00 C ATOM 1400 OG SER A 90 8.774 -12.735 -19.018 1.00 0.00 O ATOM 0 H SER A 90 11.983 -14.171 -16.772 1.00 0.00 H new ATOM 0 HA SER A 90 9.372 -12.796 -16.603 1.00 0.00 H new ATOM 0 HB2 SER A 90 10.538 -11.789 -18.526 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.719 -13.392 -19.211 1.00 0.00 H new ATOM 0 HG SER A 90 8.765 -12.349 -19.919 1.00 0.00 H new ATOM 1406 N GLY A 91 8.643 -15.205 -16.414 1.00 0.00 N ATOM 1407 CA GLY A 91 8.202 -16.570 -16.170 1.00 0.00 C ATOM 1408 C GLY A 91 7.520 -16.596 -14.810 1.00 0.00 C ATOM 1409 O GLY A 91 7.252 -15.528 -14.240 1.00 0.00 O ATOM 0 H GLY A 91 8.000 -14.508 -16.038 1.00 0.00 H new ATOM 0 HA2 GLY A 91 7.514 -16.895 -16.950 1.00 0.00 H new ATOM 0 HA3 GLY A 91 9.050 -17.255 -16.187 1.00 0.00 H new ATOM 1413 N LEU A 92 7.266 -17.791 -14.258 1.00 0.00 N ATOM 1414 CA LEU A 92 6.690 -17.894 -12.918 1.00 0.00 C ATOM 1415 C LEU A 92 7.533 -17.100 -11.929 1.00 0.00 C ATOM 1416 O LEU A 92 6.962 -16.418 -11.094 1.00 0.00 O ATOM 1417 CB LEU A 92 6.506 -19.353 -12.460 1.00 0.00 C ATOM 1418 CG LEU A 92 6.140 -19.475 -10.955 1.00 0.00 C ATOM 1419 CD1 LEU A 92 5.012 -20.470 -10.690 1.00 0.00 C ATOM 1420 CD2 LEU A 92 7.368 -19.885 -10.132 1.00 0.00 C ATOM 0 H LEU A 92 7.448 -18.685 -14.714 1.00 0.00 H new ATOM 0 HA LEU A 92 5.689 -17.464 -12.955 1.00 0.00 H new ATOM 0 HB2 LEU A 92 5.723 -19.820 -13.058 1.00 0.00 H new ATOM 0 HB3 LEU A 92 7.425 -19.907 -12.651 1.00 0.00 H new ATOM 0 HG LEU A 92 5.791 -18.488 -10.651 1.00 0.00 H new ATOM 0 HD11 LEU A 92 4.805 -20.509 -9.621 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.115 -20.153 -11.222 1.00 0.00 H new ATOM 0 HD13 LEU A 92 5.310 -21.459 -11.038 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.091 -19.965 -9.081 1.00 0.00 H new ATOM 0 HD22 LEU A 92 7.737 -20.848 -10.484 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.149 -19.133 -10.245 1.00 0.00 H new ATOM 1432 N GLN A 93 8.862 -17.120 -12.038 1.00 0.00 N ATOM 1433 CA GLN A 93 9.735 -16.445 -11.084 1.00 0.00 C ATOM 1434 C GLN A 93 9.405 -14.949 -10.990 1.00 0.00 C ATOM 1435 O GLN A 93 9.469 -14.381 -9.906 1.00 0.00 O ATOM 1436 CB GLN A 93 11.209 -16.646 -11.447 1.00 0.00 C ATOM 1437 CG GLN A 93 11.636 -18.083 -11.785 1.00 0.00 C ATOM 1438 CD GLN A 93 11.639 -18.316 -13.296 1.00 0.00 C ATOM 1439 OE1 GLN A 93 10.577 -18.406 -13.910 1.00 0.00 O ATOM 1440 NE2 GLN A 93 12.793 -18.384 -13.936 1.00 0.00 N ATOM 0 H GLN A 93 9.359 -17.603 -12.787 1.00 0.00 H new ATOM 0 HA GLN A 93 9.559 -16.894 -10.106 1.00 0.00 H new ATOM 0 HB2 GLN A 93 11.441 -16.010 -12.301 1.00 0.00 H new ATOM 0 HB3 GLN A 93 11.818 -16.295 -10.614 1.00 0.00 H new ATOM 0 HG2 GLN A 93 12.631 -18.274 -11.383 1.00 0.00 H new ATOM 0 HG3 GLN A 93 10.958 -18.789 -11.306 1.00 0.00 H new ATOM 0 HE21 GLN A 93 13.669 -18.308 -13.418 1.00 0.00 H new ATOM 0 HE22 GLN A 93 12.808 -18.512 -14.948 1.00 0.00 H new ATOM 1449 N ARG A 94 9.033 -14.303 -12.101 1.00 0.00 N ATOM 1450 CA ARG A 94 8.610 -12.902 -12.086 1.00 0.00 C ATOM 1451 C ARG A 94 7.218 -12.840 -11.458 1.00 0.00 C ATOM 1452 O ARG A 94 6.988 -12.049 -10.543 1.00 0.00 O ATOM 1453 CB ARG A 94 8.657 -12.331 -13.517 1.00 0.00 C ATOM 1454 CG ARG A 94 8.350 -10.828 -13.588 1.00 0.00 C ATOM 1455 CD ARG A 94 6.846 -10.512 -13.575 1.00 0.00 C ATOM 1456 NE ARG A 94 6.472 -9.561 -12.513 1.00 0.00 N ATOM 1457 CZ ARG A 94 5.230 -9.365 -12.050 1.00 0.00 C ATOM 1458 NH1 ARG A 94 4.190 -10.004 -12.578 1.00 0.00 N ATOM 1459 NH2 ARG A 94 5.015 -8.520 -11.050 1.00 0.00 N ATOM 0 H ARG A 94 9.017 -14.733 -13.026 1.00 0.00 H new ATOM 0 HA ARG A 94 9.280 -12.283 -11.488 1.00 0.00 H new ATOM 0 HB2 ARG A 94 9.645 -12.512 -13.939 1.00 0.00 H new ATOM 0 HB3 ARG A 94 7.941 -12.870 -14.138 1.00 0.00 H new ATOM 0 HG2 ARG A 94 8.826 -10.327 -12.745 1.00 0.00 H new ATOM 0 HG3 ARG A 94 8.793 -10.417 -14.495 1.00 0.00 H new ATOM 0 HD2 ARG A 94 6.557 -10.101 -14.542 1.00 0.00 H new ATOM 0 HD3 ARG A 94 6.286 -11.438 -13.442 1.00 0.00 H new ATOM 0 HE ARG A 94 7.220 -9.007 -12.096 1.00 0.00 H new ATOM 0 HH11 ARG A 94 4.330 -10.657 -13.349 1.00 0.00 H new ATOM 0 HH12 ARG A 94 3.252 -9.841 -12.212 1.00 0.00 H new ATOM 0 HH21 ARG A 94 5.797 -8.017 -10.631 1.00 0.00 H new ATOM 0 HH22 ARG A 94 4.068 -8.374 -10.701 1.00 0.00 H new ATOM 1473 N ALA A 95 6.299 -13.686 -11.934 1.00 0.00 N ATOM 1474 CA ALA A 95 4.921 -13.759 -11.464 1.00 0.00 C ATOM 1475 C ALA A 95 4.819 -14.032 -9.956 1.00 0.00 C ATOM 1476 O ALA A 95 3.821 -13.645 -9.349 1.00 0.00 O ATOM 1477 CB ALA A 95 4.158 -14.825 -12.258 1.00 0.00 C ATOM 0 H ALA A 95 6.503 -14.355 -12.677 1.00 0.00 H new ATOM 0 HA ALA A 95 4.469 -12.782 -11.632 1.00 0.00 H new ATOM 0 HB1 ALA A 95 3.129 -14.876 -11.903 1.00 0.00 H new ATOM 0 HB2 ALA A 95 4.164 -14.564 -13.316 1.00 0.00 H new ATOM 0 HB3 ALA A 95 4.638 -15.794 -12.120 1.00 0.00 H new ATOM 1483 N LYS A 96 5.840 -14.640 -9.332 1.00 0.00 N ATOM 1484 CA LYS A 96 5.907 -14.891 -7.894 1.00 0.00 C ATOM 1485 C LYS A 96 5.604 -13.618 -7.150 1.00 0.00 C ATOM 1486 O LYS A 96 4.791 -13.664 -6.244 1.00 0.00 O ATOM 1487 CB LYS A 96 7.295 -15.390 -7.450 1.00 0.00 C ATOM 1488 CG LYS A 96 7.626 -16.846 -7.799 1.00 0.00 C ATOM 1489 CD LYS A 96 6.883 -17.859 -6.927 1.00 0.00 C ATOM 1490 CE LYS A 96 7.485 -17.924 -5.526 1.00 0.00 C ATOM 1491 NZ LYS A 96 6.754 -18.891 -4.697 1.00 0.00 N ATOM 0 H LYS A 96 6.662 -14.978 -9.833 1.00 0.00 H new ATOM 0 HA LYS A 96 5.175 -15.667 -7.668 1.00 0.00 H new ATOM 0 HB2 LYS A 96 8.052 -14.748 -7.900 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.375 -15.268 -6.370 1.00 0.00 H new ATOM 0 HG2 LYS A 96 7.379 -17.027 -8.845 1.00 0.00 H new ATOM 0 HG3 LYS A 96 8.699 -17.003 -7.693 1.00 0.00 H new ATOM 0 HD2 LYS A 96 5.830 -17.584 -6.861 1.00 0.00 H new ATOM 0 HD3 LYS A 96 6.927 -18.844 -7.391 1.00 0.00 H new ATOM 0 HE2 LYS A 96 8.535 -18.209 -5.588 1.00 0.00 H new ATOM 0 HE3 LYS A 96 7.449 -16.938 -5.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 7.176 -18.923 -3.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 5.758 -18.602 -4.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 6.810 -19.834 -5.133 1.00 0.00 H new ATOM 1505 N THR A 97 6.176 -12.489 -7.551 1.00 0.00 N ATOM 1506 CA THR A 97 5.948 -11.211 -6.900 1.00 0.00 C ATOM 1507 C THR A 97 4.450 -10.888 -6.839 1.00 0.00 C ATOM 1508 O THR A 97 3.980 -10.401 -5.814 1.00 0.00 O ATOM 1509 CB THR A 97 6.727 -10.155 -7.699 1.00 0.00 C ATOM 1510 OG1 THR A 97 8.111 -10.418 -7.582 1.00 0.00 O ATOM 1511 CG2 THR A 97 6.436 -8.719 -7.272 1.00 0.00 C ATOM 0 H THR A 97 6.816 -12.438 -8.344 1.00 0.00 H new ATOM 0 HA THR A 97 6.296 -11.231 -5.867 1.00 0.00 H new ATOM 0 HB THR A 97 6.397 -10.234 -8.735 1.00 0.00 H new ATOM 0 HG1 THR A 97 8.421 -10.150 -6.692 1.00 0.00 H new ATOM 0 HG21 THR A 97 7.023 -8.032 -7.882 1.00 0.00 H new ATOM 0 HG22 THR A 97 5.375 -8.507 -7.406 1.00 0.00 H new ATOM 0 HG23 THR A 97 6.702 -8.590 -6.223 1.00 0.00 H new ATOM 1519 N GLY A 98 3.677 -11.190 -7.883 1.00 0.00 N ATOM 1520 CA GLY A 98 2.248 -10.907 -7.883 1.00 0.00 C ATOM 1521 C GLY A 98 1.477 -11.767 -6.886 1.00 0.00 C ATOM 1522 O GLY A 98 0.446 -11.343 -6.367 1.00 0.00 O ATOM 0 H GLY A 98 4.020 -11.630 -8.737 1.00 0.00 H new ATOM 0 HA2 GLY A 98 2.090 -9.855 -7.647 1.00 0.00 H new ATOM 0 HA3 GLY A 98 1.849 -11.072 -8.884 1.00 0.00 H new ATOM 1526 N THR A 99 2.003 -12.944 -6.567 1.00 0.00 N ATOM 1527 CA THR A 99 1.460 -13.891 -5.604 1.00 0.00 C ATOM 1528 C THR A 99 2.100 -13.701 -4.211 1.00 0.00 C ATOM 1529 O THR A 99 1.496 -14.052 -3.193 1.00 0.00 O ATOM 1530 CB THR A 99 1.737 -15.284 -6.214 1.00 0.00 C ATOM 1531 OG1 THR A 99 1.064 -15.408 -7.461 1.00 0.00 O ATOM 1532 CG2 THR A 99 1.332 -16.497 -5.381 1.00 0.00 C ATOM 0 H THR A 99 2.865 -13.280 -6.997 1.00 0.00 H new ATOM 0 HA THR A 99 0.393 -13.750 -5.434 1.00 0.00 H new ATOM 0 HB THR A 99 2.824 -15.307 -6.290 1.00 0.00 H new ATOM 0 HG1 THR A 99 1.245 -16.292 -7.844 1.00 0.00 H new ATOM 0 HG21 THR A 99 1.581 -17.410 -5.923 1.00 0.00 H new ATOM 0 HG22 THR A 99 1.867 -16.481 -4.431 1.00 0.00 H new ATOM 0 HG23 THR A 99 0.259 -16.468 -5.193 1.00 0.00 H new ATOM 1540 N ASP A 100 3.248 -13.027 -4.127 1.00 0.00 N ATOM 1541 CA ASP A 100 4.051 -12.837 -2.921 1.00 0.00 C ATOM 1542 C ASP A 100 3.956 -11.460 -2.293 1.00 0.00 C ATOM 1543 O ASP A 100 4.179 -11.363 -1.090 1.00 0.00 O ATOM 1544 CB ASP A 100 5.524 -13.158 -3.233 1.00 0.00 C ATOM 1545 CG ASP A 100 5.815 -14.671 -3.284 1.00 0.00 C ATOM 1546 OD1 ASP A 100 4.923 -15.488 -2.958 1.00 0.00 O ATOM 1547 OD2 ASP A 100 6.951 -15.067 -3.631 1.00 0.00 O ATOM 0 H ASP A 100 3.663 -12.576 -4.942 1.00 0.00 H new ATOM 0 HA ASP A 100 3.636 -13.523 -2.182 1.00 0.00 H new ATOM 0 HB2 ASP A 100 5.793 -12.710 -4.190 1.00 0.00 H new ATOM 0 HB3 ASP A 100 6.158 -12.697 -2.476 1.00 0.00 H new ATOM 1552 N LYS A 101 3.596 -10.399 -3.021 1.00 0.00 N ATOM 1553 CA LYS A 101 3.474 -9.068 -2.422 1.00 0.00 C ATOM 1554 C LYS A 101 2.586 -9.027 -1.184 1.00 0.00 C ATOM 1555 O LYS A 101 2.842 -8.186 -0.325 1.00 0.00 O ATOM 1556 CB LYS A 101 3.078 -7.992 -3.446 1.00 0.00 C ATOM 1557 CG LYS A 101 4.300 -7.499 -4.236 1.00 0.00 C ATOM 1558 CD LYS A 101 3.901 -6.513 -5.334 1.00 0.00 C ATOM 1559 CE LYS A 101 5.066 -5.585 -5.707 1.00 0.00 C ATOM 1560 NZ LYS A 101 4.577 -4.362 -6.375 1.00 0.00 N ATOM 0 H LYS A 101 3.385 -10.435 -4.018 1.00 0.00 H new ATOM 0 HA LYS A 101 4.478 -8.827 -2.073 1.00 0.00 H new ATOM 0 HB2 LYS A 101 2.336 -8.397 -4.134 1.00 0.00 H new ATOM 0 HB3 LYS A 101 2.611 -7.152 -2.932 1.00 0.00 H new ATOM 0 HG2 LYS A 101 5.005 -7.021 -3.556 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.814 -8.351 -4.681 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.575 -7.063 -6.217 1.00 0.00 H new ATOM 0 HD3 LYS A 101 3.053 -5.917 -4.998 1.00 0.00 H new ATOM 0 HE2 LYS A 101 5.622 -5.315 -4.809 1.00 0.00 H new ATOM 0 HE3 LYS A 101 5.758 -6.111 -6.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 5.327 -3.642 -6.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 4.313 -4.584 -7.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 3.746 -3.997 -5.867 1.00 0.00 H new ATOM 1574 N THR A 102 1.596 -9.915 -1.046 1.00 0.00 N ATOM 1575 CA THR A 102 0.796 -9.951 0.169 1.00 0.00 C ATOM 1576 C THR A 102 1.697 -10.299 1.363 1.00 0.00 C ATOM 1577 O THR A 102 1.625 -9.619 2.371 1.00 0.00 O ATOM 1578 CB THR A 102 -0.403 -10.907 0.005 1.00 0.00 C ATOM 1579 OG1 THR A 102 -1.432 -10.610 0.931 1.00 0.00 O ATOM 1580 CG2 THR A 102 -0.033 -12.388 0.105 1.00 0.00 C ATOM 0 H THR A 102 1.337 -10.605 -1.751 1.00 0.00 H new ATOM 0 HA THR A 102 0.367 -8.968 0.365 1.00 0.00 H new ATOM 0 HB THR A 102 -0.763 -10.737 -1.010 1.00 0.00 H new ATOM 0 HG1 THR A 102 -2.178 -11.232 0.801 1.00 0.00 H new ATOM 0 HG21 THR A 102 -0.929 -12.996 -0.020 1.00 0.00 H new ATOM 0 HG22 THR A 102 0.687 -12.637 -0.675 1.00 0.00 H new ATOM 0 HG23 THR A 102 0.407 -12.588 1.082 1.00 0.00 H new ATOM 1588 N LEU A 103 2.602 -11.276 1.244 1.00 0.00 N ATOM 1589 CA LEU A 103 3.466 -11.777 2.314 1.00 0.00 C ATOM 1590 C LEU A 103 4.262 -10.647 2.935 1.00 0.00 C ATOM 1591 O LEU A 103 4.093 -10.300 4.098 1.00 0.00 O ATOM 1592 CB LEU A 103 4.422 -12.830 1.750 1.00 0.00 C ATOM 1593 CG LEU A 103 3.777 -14.114 1.225 1.00 0.00 C ATOM 1594 CD1 LEU A 103 4.895 -15.135 1.058 1.00 0.00 C ATOM 1595 CD2 LEU A 103 2.697 -14.705 2.138 1.00 0.00 C ATOM 0 H LEU A 103 2.758 -11.759 0.359 1.00 0.00 H new ATOM 0 HA LEU A 103 2.840 -12.224 3.086 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.992 -12.376 0.939 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.135 -13.098 2.530 1.00 0.00 H new ATOM 0 HG LEU A 103 3.269 -13.870 0.292 1.00 0.00 H new ATOM 0 HD11 LEU A 103 4.480 -16.071 0.684 1.00 0.00 H new ATOM 0 HD12 LEU A 103 5.631 -14.756 0.350 1.00 0.00 H new ATOM 0 HD13 LEU A 103 5.375 -15.310 2.021 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.296 -15.612 1.687 1.00 0.00 H new ATOM 0 HD22 LEU A 103 3.132 -14.944 3.108 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.894 -13.979 2.269 1.00 0.00 H new ATOM 1607 N VAL A 104 5.142 -10.060 2.141 1.00 0.00 N ATOM 1608 CA VAL A 104 5.927 -8.914 2.548 1.00 0.00 C ATOM 1609 C VAL A 104 5.009 -7.744 2.948 1.00 0.00 C ATOM 1610 O VAL A 104 5.388 -6.996 3.848 1.00 0.00 O ATOM 1611 CB VAL A 104 7.046 -8.677 1.505 1.00 0.00 C ATOM 1612 CG1 VAL A 104 6.612 -8.909 0.045 1.00 0.00 C ATOM 1613 CG2 VAL A 104 7.725 -7.309 1.643 1.00 0.00 C ATOM 0 H VAL A 104 5.331 -10.371 1.188 1.00 0.00 H new ATOM 0 HA VAL A 104 6.480 -9.075 3.473 1.00 0.00 H new ATOM 0 HB VAL A 104 7.780 -9.446 1.745 1.00 0.00 H new ATOM 0 HG11 VAL A 104 7.455 -8.721 -0.619 1.00 0.00 H new ATOM 0 HG12 VAL A 104 6.277 -9.939 -0.076 1.00 0.00 H new ATOM 0 HG13 VAL A 104 5.796 -8.231 -0.204 1.00 0.00 H new ATOM 0 HG21 VAL A 104 8.499 -7.208 0.882 1.00 0.00 H new ATOM 0 HG22 VAL A 104 6.984 -6.520 1.513 1.00 0.00 H new ATOM 0 HG23 VAL A 104 8.176 -7.225 2.632 1.00 0.00 H new ATOM 1623 N LYS A 105 3.787 -7.602 2.400 1.00 0.00 N ATOM 1624 CA LYS A 105 2.882 -6.543 2.859 1.00 0.00 C ATOM 1625 C LYS A 105 2.395 -6.839 4.281 1.00 0.00 C ATOM 1626 O LYS A 105 2.233 -5.891 5.039 1.00 0.00 O ATOM 1627 CB LYS A 105 1.704 -6.314 1.893 1.00 0.00 C ATOM 1628 CG LYS A 105 0.674 -5.353 2.504 1.00 0.00 C ATOM 1629 CD LYS A 105 -0.379 -4.879 1.505 1.00 0.00 C ATOM 1630 CE LYS A 105 -1.545 -4.259 2.280 1.00 0.00 C ATOM 1631 NZ LYS A 105 -2.486 -5.292 2.755 1.00 0.00 N ATOM 0 H LYS A 105 3.415 -8.194 1.657 1.00 0.00 H new ATOM 0 HA LYS A 105 3.448 -5.611 2.873 1.00 0.00 H new ATOM 0 HB2 LYS A 105 2.074 -5.907 0.952 1.00 0.00 H new ATOM 0 HB3 LYS A 105 1.227 -7.267 1.663 1.00 0.00 H new ATOM 0 HG2 LYS A 105 0.176 -5.848 3.338 1.00 0.00 H new ATOM 0 HG3 LYS A 105 1.194 -4.486 2.912 1.00 0.00 H new ATOM 0 HD2 LYS A 105 0.051 -4.148 0.820 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -0.729 -5.715 0.900 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -1.160 -3.696 3.131 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -2.072 -3.550 1.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -3.273 -4.838 3.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -2.858 -5.823 1.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -1.991 -5.944 3.397 1.00 0.00 H new ATOM 1645 N GLU A 106 2.168 -8.100 4.669 1.00 0.00 N ATOM 1646 CA GLU A 106 1.730 -8.457 6.020 1.00 0.00 C ATOM 1647 C GLU A 106 2.734 -7.947 7.058 1.00 0.00 C ATOM 1648 O GLU A 106 2.349 -7.662 8.192 1.00 0.00 O ATOM 1649 CB GLU A 106 1.501 -9.975 6.137 1.00 0.00 C ATOM 1650 CG GLU A 106 0.370 -10.490 5.234 1.00 0.00 C ATOM 1651 CD GLU A 106 -1.034 -10.283 5.787 1.00 0.00 C ATOM 1652 OE1 GLU A 106 -1.397 -9.135 6.127 1.00 0.00 O ATOM 1653 OE2 GLU A 106 -1.817 -11.262 5.811 1.00 0.00 O ATOM 0 H GLU A 106 2.284 -8.903 4.051 1.00 0.00 H new ATOM 0 HA GLU A 106 0.775 -7.972 6.220 1.00 0.00 H new ATOM 0 HB2 GLU A 106 2.425 -10.495 5.883 1.00 0.00 H new ATOM 0 HB3 GLU A 106 1.270 -10.222 7.173 1.00 0.00 H new ATOM 0 HG2 GLU A 106 0.441 -9.992 4.267 1.00 0.00 H new ATOM 0 HG3 GLU A 106 0.522 -11.555 5.057 1.00 0.00 H new ATOM 1660 N VAL A 107 4.011 -7.838 6.676 1.00 0.00 N ATOM 1661 CA VAL A 107 5.059 -7.277 7.512 1.00 0.00 C ATOM 1662 C VAL A 107 4.908 -5.752 7.393 1.00 0.00 C ATOM 1663 O VAL A 107 4.555 -5.086 8.361 1.00 0.00 O ATOM 1664 CB VAL A 107 6.453 -7.785 7.058 1.00 0.00 C ATOM 1665 CG1 VAL A 107 7.588 -7.113 7.854 1.00 0.00 C ATOM 1666 CG2 VAL A 107 6.580 -9.310 7.213 1.00 0.00 C ATOM 0 H VAL A 107 4.343 -8.144 5.761 1.00 0.00 H new ATOM 0 HA VAL A 107 4.972 -7.584 8.554 1.00 0.00 H new ATOM 0 HB VAL A 107 6.545 -7.521 6.004 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.549 -7.493 7.509 1.00 0.00 H new ATOM 0 HG12 VAL A 107 7.549 -6.034 7.703 1.00 0.00 H new ATOM 0 HG13 VAL A 107 7.470 -7.335 8.915 1.00 0.00 H new ATOM 0 HG21 VAL A 107 7.570 -9.628 6.885 1.00 0.00 H new ATOM 0 HG22 VAL A 107 6.440 -9.582 8.259 1.00 0.00 H new ATOM 0 HG23 VAL A 107 5.821 -9.802 6.605 1.00 0.00 H new ATOM 1676 N VAL A 108 5.119 -5.219 6.193 1.00 0.00 N ATOM 1677 CA VAL A 108 5.141 -3.817 5.776 1.00 0.00 C ATOM 1678 C VAL A 108 3.767 -3.100 5.862 1.00 0.00 C ATOM 1679 O VAL A 108 3.572 -2.102 5.181 1.00 0.00 O ATOM 1680 CB VAL A 108 5.821 -3.814 4.369 1.00 0.00 C ATOM 1681 CG1 VAL A 108 5.888 -2.482 3.607 1.00 0.00 C ATOM 1682 CG2 VAL A 108 7.280 -4.311 4.494 1.00 0.00 C ATOM 0 H VAL A 108 5.300 -5.829 5.396 1.00 0.00 H new ATOM 0 HA VAL A 108 5.717 -3.204 6.470 1.00 0.00 H new ATOM 0 HB VAL A 108 5.163 -4.462 3.791 1.00 0.00 H new ATOM 0 HG11 VAL A 108 6.386 -2.635 2.650 1.00 0.00 H new ATOM 0 HG12 VAL A 108 4.878 -2.110 3.435 1.00 0.00 H new ATOM 0 HG13 VAL A 108 6.448 -1.754 4.195 1.00 0.00 H new ATOM 0 HG21 VAL A 108 7.751 -4.308 3.511 1.00 0.00 H new ATOM 0 HG22 VAL A 108 7.833 -3.652 5.164 1.00 0.00 H new ATOM 0 HG23 VAL A 108 7.286 -5.324 4.896 1.00 0.00 H new ATOM 1692 N GLN A 109 2.808 -3.505 6.707 1.00 0.00 N ATOM 1693 CA GLN A 109 1.470 -2.897 6.726 1.00 0.00 C ATOM 1694 C GLN A 109 1.446 -1.372 6.924 1.00 0.00 C ATOM 1695 O GLN A 109 0.509 -0.725 6.446 1.00 0.00 O ATOM 1696 CB GLN A 109 0.612 -3.538 7.825 1.00 0.00 C ATOM 1697 CG GLN A 109 0.030 -4.903 7.454 1.00 0.00 C ATOM 1698 CD GLN A 109 -1.156 -4.841 6.480 1.00 0.00 C ATOM 1699 OE1 GLN A 109 -1.397 -3.869 5.765 1.00 0.00 O ATOM 1700 NE2 GLN A 109 -1.979 -5.872 6.485 1.00 0.00 N ATOM 0 H GLN A 109 2.935 -4.253 7.388 1.00 0.00 H new ATOM 0 HA GLN A 109 1.069 -3.089 5.731 1.00 0.00 H new ATOM 0 HB2 GLN A 109 1.217 -3.647 8.725 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -0.207 -2.862 8.071 1.00 0.00 H new ATOM 0 HG2 GLN A 109 0.818 -5.512 7.011 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -0.289 -5.409 8.365 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -1.782 -6.679 7.077 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -2.813 -5.862 5.897 1.00 0.00 H new ATOM 1709 N ASN A 110 2.455 -0.783 7.574 1.00 0.00 N ATOM 1710 CA ASN A 110 2.570 0.662 7.728 1.00 0.00 C ATOM 1711 C ASN A 110 3.415 1.181 6.579 1.00 0.00 C ATOM 1712 O ASN A 110 4.630 1.359 6.721 1.00 0.00 O ATOM 1713 CB ASN A 110 3.161 1.058 9.095 1.00 0.00 C ATOM 1714 CG ASN A 110 3.114 2.576 9.290 1.00 0.00 C ATOM 1715 OD1 ASN A 110 2.279 3.080 10.040 1.00 0.00 O ATOM 1716 ND2 ASN A 110 3.956 3.329 8.610 1.00 0.00 N ATOM 0 H ASN A 110 3.217 -1.303 8.009 1.00 0.00 H new ATOM 0 HA ASN A 110 1.578 1.114 7.700 1.00 0.00 H new ATOM 0 HB2 ASN A 110 2.604 0.567 9.893 1.00 0.00 H new ATOM 0 HB3 ASN A 110 4.191 0.710 9.165 1.00 0.00 H new ATOM 0 HD21 ASN A 110 3.921 4.344 8.702 1.00 0.00 H new ATOM 0 HD22 ASN A 110 4.643 2.896 7.992 1.00 0.00 H new ATOM 1723 N PHE A 111 2.791 1.414 5.424 1.00 0.00 N ATOM 1724 CA PHE A 111 3.457 1.992 4.276 1.00 0.00 C ATOM 1725 C PHE A 111 2.475 2.852 3.492 1.00 0.00 C ATOM 1726 O PHE A 111 1.266 2.807 3.721 1.00 0.00 O ATOM 1727 CB PHE A 111 4.159 0.921 3.429 1.00 0.00 C ATOM 1728 CG PHE A 111 3.295 0.094 2.497 1.00 0.00 C ATOM 1729 CD1 PHE A 111 2.218 -0.673 2.981 1.00 0.00 C ATOM 1730 CD2 PHE A 111 3.624 0.033 1.132 1.00 0.00 C ATOM 1731 CE1 PHE A 111 1.522 -1.537 2.123 1.00 0.00 C ATOM 1732 CE2 PHE A 111 2.894 -0.796 0.268 1.00 0.00 C ATOM 1733 CZ PHE A 111 1.862 -1.602 0.765 1.00 0.00 C ATOM 0 H PHE A 111 1.806 1.203 5.267 1.00 0.00 H new ATOM 0 HA PHE A 111 4.258 2.650 4.614 1.00 0.00 H new ATOM 0 HB2 PHE A 111 4.925 1.413 2.830 1.00 0.00 H new ATOM 0 HB3 PHE A 111 4.673 0.239 4.106 1.00 0.00 H new ATOM 0 HD1 PHE A 111 1.926 -0.596 4.018 1.00 0.00 H new ATOM 0 HD2 PHE A 111 4.441 0.626 0.748 1.00 0.00 H new ATOM 0 HE1 PHE A 111 0.723 -2.153 2.509 1.00 0.00 H new ATOM 0 HE2 PHE A 111 3.129 -0.813 -0.786 1.00 0.00 H new ATOM 0 HZ PHE A 111 1.330 -2.271 0.104 1.00 0.00 H new ATOM 1743 N ALA A 112 3.017 3.662 2.589 1.00 0.00 N ATOM 1744 CA ALA A 112 2.287 4.631 1.802 1.00 0.00 C ATOM 1745 C ALA A 112 1.862 4.009 0.463 1.00 0.00 C ATOM 1746 O ALA A 112 0.672 3.783 0.250 1.00 0.00 O ATOM 1747 CB ALA A 112 3.191 5.870 1.747 1.00 0.00 C ATOM 0 H ALA A 112 4.016 3.656 2.382 1.00 0.00 H new ATOM 0 HA ALA A 112 1.333 4.943 2.226 1.00 0.00 H new ATOM 0 HB1 ALA A 112 2.703 6.651 1.164 1.00 0.00 H new ATOM 0 HB2 ALA A 112 3.374 6.232 2.759 1.00 0.00 H new ATOM 0 HB3 ALA A 112 4.140 5.608 1.279 1.00 0.00 H new ATOM 1753 N LYS A 113 2.814 3.682 -0.411 1.00 0.00 N ATOM 1754 CA LYS A 113 2.658 3.000 -1.700 1.00 0.00 C ATOM 1755 C LYS A 113 3.866 2.116 -1.958 1.00 0.00 C ATOM 1756 O LYS A 113 4.809 2.050 -1.174 1.00 0.00 O ATOM 1757 CB LYS A 113 2.372 3.956 -2.885 1.00 0.00 C ATOM 1758 CG LYS A 113 0.910 4.380 -3.029 1.00 0.00 C ATOM 1759 CD LYS A 113 0.679 5.874 -3.298 1.00 0.00 C ATOM 1760 CE LYS A 113 -0.687 6.026 -3.982 1.00 0.00 C ATOM 1761 NZ LYS A 113 -1.083 7.432 -4.194 1.00 0.00 N ATOM 0 H LYS A 113 3.792 3.904 -0.223 1.00 0.00 H new ATOM 0 HA LYS A 113 1.766 2.378 -1.630 1.00 0.00 H new ATOM 0 HB2 LYS A 113 2.985 4.850 -2.768 1.00 0.00 H new ATOM 0 HB3 LYS A 113 2.688 3.471 -3.809 1.00 0.00 H new ATOM 0 HG2 LYS A 113 0.463 3.809 -3.842 1.00 0.00 H new ATOM 0 HG3 LYS A 113 0.379 4.106 -2.117 1.00 0.00 H new ATOM 0 HD2 LYS A 113 0.703 6.438 -2.365 1.00 0.00 H new ATOM 0 HD3 LYS A 113 1.470 6.274 -3.933 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -0.662 5.514 -4.944 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -1.446 5.530 -3.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -1.520 7.532 -5.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -1.766 7.714 -3.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -0.242 8.042 -4.137 1.00 0.00 H new ATOM 1775 N GLU A 114 3.804 1.388 -3.061 1.00 0.00 N ATOM 1776 CA GLU A 114 4.865 0.508 -3.535 1.00 0.00 C ATOM 1777 C GLU A 114 5.394 0.977 -4.884 1.00 0.00 C ATOM 1778 O GLU A 114 4.775 1.841 -5.508 1.00 0.00 O ATOM 1779 CB GLU A 114 4.355 -0.933 -3.565 1.00 0.00 C ATOM 1780 CG GLU A 114 3.105 -1.105 -4.446 1.00 0.00 C ATOM 1781 CD GLU A 114 2.332 -2.365 -4.083 1.00 0.00 C ATOM 1782 OE1 GLU A 114 2.674 -3.452 -4.599 1.00 0.00 O ATOM 1783 OE2 GLU A 114 1.333 -2.252 -3.333 1.00 0.00 O ATOM 0 H GLU A 114 2.988 1.392 -3.673 1.00 0.00 H new ATOM 0 HA GLU A 114 5.711 0.545 -2.848 1.00 0.00 H new ATOM 0 HB2 GLU A 114 5.146 -1.586 -3.933 1.00 0.00 H new ATOM 0 HB3 GLU A 114 4.125 -1.253 -2.549 1.00 0.00 H new ATOM 0 HG2 GLU A 114 2.458 -0.235 -4.334 1.00 0.00 H new ATOM 0 HG3 GLU A 114 3.401 -1.149 -5.494 1.00 0.00 H new ATOM 1790 N PHE A 115 6.528 0.442 -5.339 1.00 0.00 N ATOM 1791 CA PHE A 115 7.154 0.891 -6.578 1.00 0.00 C ATOM 1792 C PHE A 115 7.798 -0.383 -7.160 1.00 0.00 C ATOM 1793 O PHE A 115 8.202 -1.268 -6.396 1.00 0.00 O ATOM 1794 CB PHE A 115 8.218 1.946 -6.198 1.00 0.00 C ATOM 1795 CG PHE A 115 8.652 2.946 -7.260 1.00 0.00 C ATOM 1796 CD1 PHE A 115 8.966 2.619 -8.592 1.00 0.00 C ATOM 1797 CD2 PHE A 115 8.607 4.306 -6.885 1.00 0.00 C ATOM 1798 CE1 PHE A 115 9.228 3.637 -9.529 1.00 0.00 C ATOM 1799 CE2 PHE A 115 8.862 5.320 -7.816 1.00 0.00 C ATOM 1800 CZ PHE A 115 9.175 4.987 -9.142 1.00 0.00 C ATOM 0 H PHE A 115 7.032 -0.306 -4.863 1.00 0.00 H new ATOM 0 HA PHE A 115 6.474 1.345 -7.299 1.00 0.00 H new ATOM 0 HB2 PHE A 115 7.838 2.510 -5.346 1.00 0.00 H new ATOM 0 HB3 PHE A 115 9.107 1.415 -5.858 1.00 0.00 H new ATOM 0 HD1 PHE A 115 9.006 1.584 -8.897 1.00 0.00 H new ATOM 0 HD2 PHE A 115 8.372 4.568 -5.864 1.00 0.00 H new ATOM 0 HE1 PHE A 115 9.471 3.379 -10.549 1.00 0.00 H new ATOM 0 HE2 PHE A 115 8.818 6.356 -7.514 1.00 0.00 H new ATOM 0 HZ PHE A 115 9.375 5.766 -9.863 1.00 0.00 H new ATOM 1810 N VAL A 116 7.896 -0.521 -8.480 1.00 0.00 N ATOM 1811 CA VAL A 116 8.562 -1.634 -9.145 1.00 0.00 C ATOM 1812 C VAL A 116 9.566 -1.009 -10.109 1.00 0.00 C ATOM 1813 O VAL A 116 9.190 -0.134 -10.889 1.00 0.00 O ATOM 1814 CB VAL A 116 7.556 -2.556 -9.858 1.00 0.00 C ATOM 1815 CG1 VAL A 116 8.276 -3.756 -10.490 1.00 0.00 C ATOM 1816 CG2 VAL A 116 6.489 -3.099 -8.895 1.00 0.00 C ATOM 0 H VAL A 116 7.503 0.157 -9.133 1.00 0.00 H new ATOM 0 HA VAL A 116 9.070 -2.279 -8.428 1.00 0.00 H new ATOM 0 HB VAL A 116 7.073 -1.950 -10.624 1.00 0.00 H new ATOM 0 HG11 VAL A 116 7.548 -4.396 -10.989 1.00 0.00 H new ATOM 0 HG12 VAL A 116 9.006 -3.401 -11.218 1.00 0.00 H new ATOM 0 HG13 VAL A 116 8.786 -4.325 -9.713 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.801 -3.744 -9.441 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.971 -3.671 -8.102 1.00 0.00 H new ATOM 0 HG23 VAL A 116 5.937 -2.267 -8.458 1.00 0.00 H new ATOM 1826 N ILE A 117 10.829 -1.417 -10.030 1.00 0.00 N ATOM 1827 CA ILE A 117 11.923 -0.932 -10.860 1.00 0.00 C ATOM 1828 C ILE A 117 12.622 -2.175 -11.422 1.00 0.00 C ATOM 1829 O ILE A 117 12.776 -3.167 -10.703 1.00 0.00 O ATOM 1830 CB ILE A 117 12.856 -0.035 -10.031 1.00 0.00 C ATOM 1831 CG1 ILE A 117 12.092 1.202 -9.499 1.00 0.00 C ATOM 1832 CG2 ILE A 117 14.012 0.450 -10.924 1.00 0.00 C ATOM 1833 CD1 ILE A 117 11.875 1.208 -7.974 1.00 0.00 C ATOM 0 H ILE A 117 11.129 -2.123 -9.358 1.00 0.00 H new ATOM 0 HA ILE A 117 11.577 -0.310 -11.685 1.00 0.00 H new ATOM 0 HB ILE A 117 13.236 -0.612 -9.188 1.00 0.00 H new ATOM 0 HG12 ILE A 117 12.641 2.101 -9.779 1.00 0.00 H new ATOM 0 HG13 ILE A 117 11.121 1.254 -9.992 1.00 0.00 H new ATOM 0 HG21 ILE A 117 14.678 1.087 -10.343 1.00 0.00 H new ATOM 0 HG22 ILE A 117 14.568 -0.410 -11.299 1.00 0.00 H new ATOM 0 HG23 ILE A 117 13.610 1.016 -11.764 1.00 0.00 H new ATOM 0 HD11 ILE A 117 11.333 2.109 -7.687 1.00 0.00 H new ATOM 0 HD12 ILE A 117 11.298 0.330 -7.685 1.00 0.00 H new ATOM 0 HD13 ILE A 117 12.841 1.190 -7.469 1.00 0.00 H new ATOM 1845 N SER A 118 13.076 -2.116 -12.676 1.00 0.00 N ATOM 1846 CA SER A 118 13.822 -3.200 -13.308 1.00 0.00 C ATOM 1847 C SER A 118 15.117 -2.747 -13.978 1.00 0.00 C ATOM 1848 O SER A 118 15.851 -3.595 -14.486 1.00 0.00 O ATOM 1849 CB SER A 118 12.910 -3.954 -14.279 1.00 0.00 C ATOM 1850 OG SER A 118 12.210 -3.067 -15.135 1.00 0.00 O ATOM 0 H SER A 118 12.934 -1.309 -13.283 1.00 0.00 H new ATOM 0 HA SER A 118 14.142 -3.877 -12.516 1.00 0.00 H new ATOM 0 HB2 SER A 118 13.506 -4.643 -14.877 1.00 0.00 H new ATOM 0 HB3 SER A 118 12.197 -4.556 -13.716 1.00 0.00 H new ATOM 0 HG SER A 118 12.620 -3.080 -16.025 1.00 0.00 H new ATOM 1856 N ASP A 119 15.448 -1.450 -13.951 1.00 0.00 N ATOM 1857 CA ASP A 119 16.704 -0.932 -14.499 1.00 0.00 C ATOM 1858 C ASP A 119 17.506 -0.280 -13.385 1.00 0.00 C ATOM 1859 O ASP A 119 17.015 0.611 -12.687 1.00 0.00 O ATOM 1860 CB ASP A 119 16.461 0.033 -15.654 1.00 0.00 C ATOM 1861 CG ASP A 119 17.747 0.358 -16.413 1.00 0.00 C ATOM 1862 OD1 ASP A 119 18.820 0.489 -15.788 1.00 0.00 O ATOM 1863 OD2 ASP A 119 17.683 0.476 -17.658 1.00 0.00 O ATOM 0 H ASP A 119 14.849 -0.730 -13.547 1.00 0.00 H new ATOM 0 HA ASP A 119 17.278 -1.763 -14.909 1.00 0.00 H new ATOM 0 HB2 ASP A 119 15.735 -0.401 -16.341 1.00 0.00 H new ATOM 0 HB3 ASP A 119 16.025 0.955 -15.270 1.00 0.00 H new ATOM 1868 N ARG A 120 18.742 -0.742 -13.201 1.00 0.00 N ATOM 1869 CA ARG A 120 19.624 -0.293 -12.133 1.00 0.00 C ATOM 1870 C ARG A 120 20.007 1.186 -12.313 1.00 0.00 C ATOM 1871 O ARG A 120 20.447 1.809 -11.353 1.00 0.00 O ATOM 1872 CB ARG A 120 20.848 -1.217 -12.106 1.00 0.00 C ATOM 1873 CG ARG A 120 21.581 -1.206 -10.761 1.00 0.00 C ATOM 1874 CD ARG A 120 23.083 -1.206 -11.006 1.00 0.00 C ATOM 1875 NE ARG A 120 23.529 0.155 -11.340 1.00 0.00 N ATOM 1876 CZ ARG A 120 24.590 0.497 -12.074 1.00 0.00 C ATOM 1877 NH1 ARG A 120 25.398 -0.424 -12.601 1.00 0.00 N ATOM 1878 NH2 ARG A 120 24.834 1.791 -12.279 1.00 0.00 N ATOM 0 H ARG A 120 19.163 -1.451 -13.802 1.00 0.00 H new ATOM 0 HA ARG A 120 19.114 -0.351 -11.171 1.00 0.00 H new ATOM 0 HB2 ARG A 120 20.532 -2.235 -12.332 1.00 0.00 H new ATOM 0 HB3 ARG A 120 21.540 -0.916 -12.892 1.00 0.00 H new ATOM 0 HG2 ARG A 120 21.295 -0.326 -10.185 1.00 0.00 H new ATOM 0 HG3 ARG A 120 21.297 -2.078 -10.172 1.00 0.00 H new ATOM 0 HD2 ARG A 120 23.606 -1.563 -10.119 1.00 0.00 H new ATOM 0 HD3 ARG A 120 23.329 -1.890 -11.818 1.00 0.00 H new ATOM 0 HE ARG A 120 22.966 0.921 -10.970 1.00 0.00 H new ATOM 0 HH11 ARG A 120 25.211 -1.415 -12.447 1.00 0.00 H new ATOM 0 HH12 ARG A 120 26.203 -0.138 -13.158 1.00 0.00 H new ATOM 0 HH21 ARG A 120 24.216 2.496 -11.878 1.00 0.00 H new ATOM 0 HH22 ARG A 120 25.639 2.076 -12.837 1.00 0.00 H new ATOM 1892 N LYS A 121 19.963 1.726 -13.536 1.00 0.00 N ATOM 1893 CA LYS A 121 20.200 3.125 -13.839 1.00 0.00 C ATOM 1894 C LYS A 121 18.980 3.956 -13.456 1.00 0.00 C ATOM 1895 O LYS A 121 19.117 5.145 -13.182 1.00 0.00 O ATOM 1896 CB LYS A 121 20.431 3.336 -15.344 1.00 0.00 C ATOM 1897 CG LYS A 121 21.708 2.707 -15.918 1.00 0.00 C ATOM 1898 CD LYS A 121 21.675 2.791 -17.453 1.00 0.00 C ATOM 1899 CE LYS A 121 20.838 1.637 -18.024 1.00 0.00 C ATOM 1900 NZ LYS A 121 20.179 1.959 -19.306 1.00 0.00 N ATOM 0 H LYS A 121 19.753 1.173 -14.367 1.00 0.00 H new ATOM 0 HA LYS A 121 21.082 3.431 -13.276 1.00 0.00 H new ATOM 0 HB2 LYS A 121 19.575 2.932 -15.884 1.00 0.00 H new ATOM 0 HB3 LYS A 121 20.456 4.408 -15.542 1.00 0.00 H new ATOM 0 HG2 LYS A 121 22.586 3.226 -15.533 1.00 0.00 H new ATOM 0 HG3 LYS A 121 21.788 1.667 -15.602 1.00 0.00 H new ATOM 0 HD2 LYS A 121 21.252 3.746 -17.764 1.00 0.00 H new ATOM 0 HD3 LYS A 121 22.689 2.747 -17.850 1.00 0.00 H new ATOM 0 HE2 LYS A 121 21.481 0.768 -18.164 1.00 0.00 H new ATOM 0 HE3 LYS A 121 20.078 1.356 -17.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 19.633 1.136 -19.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 19.540 2.769 -19.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 20.900 2.199 -20.016 1.00 0.00 H new ATOM 1914 N GLU A 122 17.785 3.382 -13.570 1.00 0.00 N ATOM 1915 CA GLU A 122 16.542 4.089 -13.315 1.00 0.00 C ATOM 1916 C GLU A 122 16.307 4.186 -11.812 1.00 0.00 C ATOM 1917 O GLU A 122 15.893 5.227 -11.342 1.00 0.00 O ATOM 1918 CB GLU A 122 15.404 3.374 -14.053 1.00 0.00 C ATOM 1919 CG GLU A 122 14.160 4.242 -14.300 1.00 0.00 C ATOM 1920 CD GLU A 122 13.845 4.302 -15.798 1.00 0.00 C ATOM 1921 OE1 GLU A 122 14.550 5.032 -16.533 1.00 0.00 O ATOM 1922 OE2 GLU A 122 12.911 3.604 -16.259 1.00 0.00 O ATOM 0 H GLU A 122 17.656 2.408 -13.844 1.00 0.00 H new ATOM 0 HA GLU A 122 16.589 5.110 -13.693 1.00 0.00 H new ATOM 0 HB2 GLU A 122 15.778 3.016 -15.012 1.00 0.00 H new ATOM 0 HB3 GLU A 122 15.110 2.496 -13.478 1.00 0.00 H new ATOM 0 HG2 GLU A 122 13.308 3.832 -13.758 1.00 0.00 H new ATOM 0 HG3 GLU A 122 14.328 5.248 -13.916 1.00 0.00 H new ATOM 1929 N LEU A 123 16.705 3.144 -11.066 1.00 0.00 N ATOM 1930 CA LEU A 123 16.625 2.904 -9.619 1.00 0.00 C ATOM 1931 C LEU A 123 17.023 4.093 -8.744 1.00 0.00 C ATOM 1932 O LEU A 123 16.672 4.119 -7.574 1.00 0.00 O ATOM 1933 CB LEU A 123 17.453 1.635 -9.364 1.00 0.00 C ATOM 1934 CG LEU A 123 17.464 0.871 -8.035 1.00 0.00 C ATOM 1935 CD1 LEU A 123 18.400 1.463 -6.996 1.00 0.00 C ATOM 1936 CD2 LEU A 123 16.055 0.589 -7.507 1.00 0.00 C ATOM 0 H LEU A 123 17.148 2.348 -11.525 1.00 0.00 H new ATOM 0 HA LEU A 123 15.587 2.764 -9.319 1.00 0.00 H new ATOM 0 HB2 LEU A 123 17.151 0.916 -10.126 1.00 0.00 H new ATOM 0 HB3 LEU A 123 18.490 1.901 -9.570 1.00 0.00 H new ATOM 0 HG LEU A 123 17.895 -0.105 -8.260 1.00 0.00 H new ATOM 0 HD11 LEU A 123 18.353 0.869 -6.083 1.00 0.00 H new ATOM 0 HD12 LEU A 123 19.420 1.458 -7.380 1.00 0.00 H new ATOM 0 HD13 LEU A 123 18.100 2.488 -6.777 1.00 0.00 H new ATOM 0 HD21 LEU A 123 16.122 0.046 -6.564 1.00 0.00 H new ATOM 0 HD22 LEU A 123 15.531 1.531 -7.347 1.00 0.00 H new ATOM 0 HD23 LEU A 123 15.508 -0.012 -8.234 1.00 0.00 H new ATOM 1948 N GLU A 124 17.820 5.005 -9.295 1.00 0.00 N ATOM 1949 CA GLU A 124 18.252 6.254 -8.694 1.00 0.00 C ATOM 1950 C GLU A 124 17.060 6.975 -8.042 1.00 0.00 C ATOM 1951 O GLU A 124 15.965 7.043 -8.611 1.00 0.00 O ATOM 1952 CB GLU A 124 18.824 7.115 -9.837 1.00 0.00 C ATOM 1953 CG GLU A 124 20.231 6.633 -10.243 1.00 0.00 C ATOM 1954 CD GLU A 124 21.218 6.953 -9.119 1.00 0.00 C ATOM 1955 OE1 GLU A 124 21.312 8.136 -8.719 1.00 0.00 O ATOM 1956 OE2 GLU A 124 21.748 5.999 -8.514 1.00 0.00 O ATOM 0 H GLU A 124 18.203 4.879 -10.232 1.00 0.00 H new ATOM 0 HA GLU A 124 18.996 6.077 -7.918 1.00 0.00 H new ATOM 0 HB2 GLU A 124 18.158 7.070 -10.699 1.00 0.00 H new ATOM 0 HB3 GLU A 124 18.870 8.158 -9.523 1.00 0.00 H new ATOM 0 HG2 GLU A 124 20.219 5.561 -10.438 1.00 0.00 H new ATOM 0 HG3 GLU A 124 20.543 7.121 -11.166 1.00 0.00 H new ATOM 1963 N GLU A 125 17.275 7.583 -6.868 1.00 0.00 N ATOM 1964 CA GLU A 125 16.177 8.256 -6.170 1.00 0.00 C ATOM 1965 C GLU A 125 15.647 9.454 -6.958 1.00 0.00 C ATOM 1966 O GLU A 125 14.573 9.965 -6.644 1.00 0.00 O ATOM 1967 CB GLU A 125 16.573 8.769 -4.770 1.00 0.00 C ATOM 1968 CG GLU A 125 16.969 7.667 -3.788 1.00 0.00 C ATOM 1969 CD GLU A 125 16.800 8.115 -2.336 1.00 0.00 C ATOM 1970 OE1 GLU A 125 15.637 8.220 -1.882 1.00 0.00 O ATOM 1971 OE2 GLU A 125 17.819 8.385 -1.660 1.00 0.00 O ATOM 0 H GLU A 125 18.177 7.622 -6.393 1.00 0.00 H new ATOM 0 HA GLU A 125 15.408 7.490 -6.071 1.00 0.00 H new ATOM 0 HB2 GLU A 125 17.405 9.465 -4.872 1.00 0.00 H new ATOM 0 HB3 GLU A 125 15.738 9.330 -4.351 1.00 0.00 H new ATOM 0 HG2 GLU A 125 16.359 6.782 -3.969 1.00 0.00 H new ATOM 0 HG3 GLU A 125 18.006 7.380 -3.962 1.00 0.00 H new ATOM 1978 N ASP A 126 16.377 9.928 -7.968 1.00 0.00 N ATOM 1979 CA ASP A 126 16.006 11.109 -8.721 1.00 0.00 C ATOM 1980 C ASP A 126 14.596 11.027 -9.290 1.00 0.00 C ATOM 1981 O ASP A 126 13.814 11.958 -9.054 1.00 0.00 O ATOM 1982 CB ASP A 126 17.017 11.431 -9.824 1.00 0.00 C ATOM 1983 CG ASP A 126 16.686 12.820 -10.367 1.00 0.00 C ATOM 1984 OD1 ASP A 126 16.988 13.806 -9.661 1.00 0.00 O ATOM 1985 OD2 ASP A 126 16.065 12.936 -11.450 1.00 0.00 O ATOM 0 H ASP A 126 17.246 9.495 -8.282 1.00 0.00 H new ATOM 0 HA ASP A 126 16.018 11.930 -8.004 1.00 0.00 H new ATOM 0 HB2 ASP A 126 18.033 11.407 -9.430 1.00 0.00 H new ATOM 0 HB3 ASP A 126 16.965 10.687 -10.619 1.00 0.00 H new ATOM 1990 N PHE A 127 14.242 9.952 -10.021 1.00 0.00 N ATOM 1991 CA PHE A 127 12.899 9.958 -10.607 1.00 0.00 C ATOM 1992 C PHE A 127 11.904 9.422 -9.577 1.00 0.00 C ATOM 1993 O PHE A 127 10.745 9.835 -9.596 1.00 0.00 O ATOM 1994 CB PHE A 127 12.748 9.133 -11.892 1.00 0.00 C ATOM 1995 CG PHE A 127 12.540 7.626 -11.791 1.00 0.00 C ATOM 1996 CD1 PHE A 127 13.368 6.770 -11.043 1.00 0.00 C ATOM 1997 CD2 PHE A 127 11.402 7.087 -12.428 1.00 0.00 C ATOM 1998 CE1 PHE A 127 13.044 5.404 -10.936 1.00 0.00 C ATOM 1999 CE2 PHE A 127 11.099 5.720 -12.340 1.00 0.00 C ATOM 2000 CZ PHE A 127 11.920 4.873 -11.583 1.00 0.00 C ATOM 0 H PHE A 127 14.818 9.131 -10.208 1.00 0.00 H new ATOM 0 HA PHE A 127 12.704 10.995 -10.881 1.00 0.00 H new ATOM 0 HB2 PHE A 127 11.905 9.544 -12.448 1.00 0.00 H new ATOM 0 HB3 PHE A 127 13.640 9.301 -12.496 1.00 0.00 H new ATOM 0 HD1 PHE A 127 14.248 7.159 -10.553 1.00 0.00 H new ATOM 0 HD2 PHE A 127 10.752 7.739 -12.994 1.00 0.00 H new ATOM 0 HE1 PHE A 127 13.673 4.754 -10.345 1.00 0.00 H new ATOM 0 HE2 PHE A 127 10.236 5.322 -12.854 1.00 0.00 H new ATOM 0 HZ PHE A 127 11.689 3.821 -11.499 1.00 0.00 H new ATOM 2010 N ILE A 128 12.367 8.584 -8.640 1.00 0.00 N ATOM 2011 CA ILE A 128 11.553 7.997 -7.582 1.00 0.00 C ATOM 2012 C ILE A 128 10.950 9.135 -6.780 1.00 0.00 C ATOM 2013 O ILE A 128 9.745 9.143 -6.559 1.00 0.00 O ATOM 2014 CB ILE A 128 12.372 7.027 -6.702 1.00 0.00 C ATOM 2015 CG1 ILE A 128 12.596 5.721 -7.483 1.00 0.00 C ATOM 2016 CG2 ILE A 128 11.714 6.729 -5.342 1.00 0.00 C ATOM 2017 CD1 ILE A 128 13.525 4.734 -6.781 1.00 0.00 C ATOM 0 H ILE A 128 13.344 8.292 -8.601 1.00 0.00 H new ATOM 0 HA ILE A 128 10.755 7.391 -8.012 1.00 0.00 H new ATOM 0 HB ILE A 128 13.321 7.512 -6.475 1.00 0.00 H new ATOM 0 HG12 ILE A 128 11.632 5.241 -7.653 1.00 0.00 H new ATOM 0 HG13 ILE A 128 13.010 5.961 -8.463 1.00 0.00 H new ATOM 0 HG21 ILE A 128 12.343 6.042 -4.776 1.00 0.00 H new ATOM 0 HG22 ILE A 128 11.597 7.657 -4.783 1.00 0.00 H new ATOM 0 HG23 ILE A 128 10.735 6.277 -5.503 1.00 0.00 H new ATOM 0 HD11 ILE A 128 13.634 3.838 -7.393 1.00 0.00 H new ATOM 0 HD12 ILE A 128 14.502 5.195 -6.635 1.00 0.00 H new ATOM 0 HD13 ILE A 128 13.104 4.463 -5.813 1.00 0.00 H new ATOM 2029 N LYS A 129 11.760 10.117 -6.384 1.00 0.00 N ATOM 2030 CA LYS A 129 11.291 11.272 -5.641 1.00 0.00 C ATOM 2031 C LYS A 129 10.157 11.960 -6.387 1.00 0.00 C ATOM 2032 O LYS A 129 9.091 12.125 -5.807 1.00 0.00 O ATOM 2033 CB LYS A 129 12.466 12.214 -5.348 1.00 0.00 C ATOM 2034 CG LYS A 129 13.307 11.747 -4.150 1.00 0.00 C ATOM 2035 CD LYS A 129 14.536 12.629 -3.910 1.00 0.00 C ATOM 2036 CE LYS A 129 15.559 12.495 -5.040 1.00 0.00 C ATOM 2037 NZ LYS A 129 16.746 13.332 -4.797 1.00 0.00 N ATOM 0 H LYS A 129 12.762 10.128 -6.573 1.00 0.00 H new ATOM 0 HA LYS A 129 10.884 10.952 -4.682 1.00 0.00 H new ATOM 0 HB2 LYS A 129 13.102 12.282 -6.230 1.00 0.00 H new ATOM 0 HB3 LYS A 129 12.085 13.216 -5.152 1.00 0.00 H new ATOM 0 HG2 LYS A 129 12.686 11.745 -3.254 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.630 10.719 -4.317 1.00 0.00 H new ATOM 0 HD2 LYS A 129 14.225 13.670 -3.822 1.00 0.00 H new ATOM 0 HD3 LYS A 129 15.002 12.355 -2.963 1.00 0.00 H new ATOM 0 HE2 LYS A 129 15.862 11.452 -5.136 1.00 0.00 H new ATOM 0 HE3 LYS A 129 15.098 12.782 -5.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 17.418 13.217 -5.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 16.460 14.330 -4.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 17.199 13.041 -3.907 1.00 0.00 H new ATOM 2051 N SER A 130 10.348 12.340 -7.650 1.00 0.00 N ATOM 2052 CA SER A 130 9.317 13.026 -8.423 1.00 0.00 C ATOM 2053 C SER A 130 8.073 12.144 -8.549 1.00 0.00 C ATOM 2054 O SER A 130 6.957 12.644 -8.447 1.00 0.00 O ATOM 2055 CB SER A 130 9.892 13.443 -9.780 1.00 0.00 C ATOM 2056 OG SER A 130 8.918 13.999 -10.647 1.00 0.00 O ATOM 0 H SER A 130 11.216 12.182 -8.162 1.00 0.00 H new ATOM 0 HA SER A 130 9.002 13.934 -7.908 1.00 0.00 H new ATOM 0 HB2 SER A 130 10.688 14.171 -9.623 1.00 0.00 H new ATOM 0 HB3 SER A 130 10.344 12.575 -10.259 1.00 0.00 H new ATOM 0 HG SER A 130 9.340 14.248 -11.496 1.00 0.00 H new ATOM 2062 N GLU A 131 8.239 10.839 -8.741 1.00 0.00 N ATOM 2063 CA GLU A 131 7.123 9.925 -8.913 1.00 0.00 C ATOM 2064 C GLU A 131 6.336 9.776 -7.605 1.00 0.00 C ATOM 2065 O GLU A 131 5.112 9.879 -7.610 1.00 0.00 O ATOM 2066 CB GLU A 131 7.652 8.600 -9.488 1.00 0.00 C ATOM 2067 CG GLU A 131 6.600 7.498 -9.685 1.00 0.00 C ATOM 2068 CD GLU A 131 5.231 7.994 -10.177 1.00 0.00 C ATOM 2069 OE1 GLU A 131 5.161 8.884 -11.058 1.00 0.00 O ATOM 2070 OE2 GLU A 131 4.190 7.465 -9.725 1.00 0.00 O ATOM 0 H GLU A 131 9.153 10.388 -8.781 1.00 0.00 H new ATOM 0 HA GLU A 131 6.404 10.320 -9.630 1.00 0.00 H new ATOM 0 HB2 GLU A 131 8.124 8.804 -10.449 1.00 0.00 H new ATOM 0 HB3 GLU A 131 8.430 8.221 -8.825 1.00 0.00 H new ATOM 0 HG2 GLU A 131 6.986 6.771 -10.400 1.00 0.00 H new ATOM 0 HG3 GLU A 131 6.462 6.974 -8.739 1.00 0.00 H new ATOM 2077 N LEU A 132 7.013 9.606 -6.469 1.00 0.00 N ATOM 2078 CA LEU A 132 6.396 9.528 -5.145 1.00 0.00 C ATOM 2079 C LEU A 132 5.716 10.846 -4.774 1.00 0.00 C ATOM 2080 O LEU A 132 4.688 10.839 -4.092 1.00 0.00 O ATOM 2081 CB LEU A 132 7.447 9.135 -4.092 1.00 0.00 C ATOM 2082 CG LEU A 132 7.953 7.686 -4.241 1.00 0.00 C ATOM 2083 CD1 LEU A 132 9.046 7.396 -3.217 1.00 0.00 C ATOM 2084 CD2 LEU A 132 6.841 6.666 -4.021 1.00 0.00 C ATOM 0 H LEU A 132 8.029 9.517 -6.443 1.00 0.00 H new ATOM 0 HA LEU A 132 5.625 8.757 -5.171 1.00 0.00 H new ATOM 0 HB2 LEU A 132 8.294 9.817 -4.164 1.00 0.00 H new ATOM 0 HB3 LEU A 132 7.019 9.262 -3.098 1.00 0.00 H new ATOM 0 HG LEU A 132 8.333 7.596 -5.259 1.00 0.00 H new ATOM 0 HD11 LEU A 132 9.392 6.369 -3.335 1.00 0.00 H new ATOM 0 HD12 LEU A 132 9.880 8.080 -3.371 1.00 0.00 H new ATOM 0 HD13 LEU A 132 8.648 7.531 -2.211 1.00 0.00 H new ATOM 0 HD21 LEU A 132 7.243 5.659 -4.136 1.00 0.00 H new ATOM 0 HD22 LEU A 132 6.434 6.782 -3.016 1.00 0.00 H new ATOM 0 HD23 LEU A 132 6.050 6.826 -4.753 1.00 0.00 H new ATOM 2096 N LYS A 133 6.284 11.968 -5.223 1.00 0.00 N ATOM 2097 CA LYS A 133 5.746 13.312 -5.058 1.00 0.00 C ATOM 2098 C LYS A 133 4.450 13.409 -5.864 1.00 0.00 C ATOM 2099 O LYS A 133 3.417 13.770 -5.299 1.00 0.00 O ATOM 2100 CB LYS A 133 6.826 14.325 -5.482 1.00 0.00 C ATOM 2101 CG LYS A 133 7.869 14.529 -4.370 1.00 0.00 C ATOM 2102 CD LYS A 133 9.108 15.276 -4.872 1.00 0.00 C ATOM 2103 CE LYS A 133 8.813 16.771 -4.999 1.00 0.00 C ATOM 2104 NZ LYS A 133 9.887 17.471 -5.719 1.00 0.00 N ATOM 0 H LYS A 133 7.168 11.960 -5.732 1.00 0.00 H new ATOM 0 HA LYS A 133 5.494 13.540 -4.022 1.00 0.00 H new ATOM 0 HB2 LYS A 133 7.321 13.974 -6.388 1.00 0.00 H new ATOM 0 HB3 LYS A 133 6.358 15.279 -5.724 1.00 0.00 H new ATOM 0 HG2 LYS A 133 7.418 15.086 -3.549 1.00 0.00 H new ATOM 0 HG3 LYS A 133 8.168 13.559 -3.971 1.00 0.00 H new ATOM 0 HD2 LYS A 133 9.939 15.120 -4.184 1.00 0.00 H new ATOM 0 HD3 LYS A 133 9.415 14.876 -5.838 1.00 0.00 H new ATOM 0 HE2 LYS A 133 7.868 16.914 -5.524 1.00 0.00 H new ATOM 0 HE3 LYS A 133 8.695 17.206 -4.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 9.656 18.483 -5.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 10.783 17.354 -5.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 9.982 17.072 -6.675 1.00 0.00 H new ATOM 2118 N LYS A 134 4.451 13.039 -7.152 1.00 0.00 N ATOM 2119 CA LYS A 134 3.238 13.010 -7.983 1.00 0.00 C ATOM 2120 C LYS A 134 2.196 12.121 -7.312 1.00 0.00 C ATOM 2121 O LYS A 134 1.036 12.505 -7.202 1.00 0.00 O ATOM 2122 CB LYS A 134 3.544 12.476 -9.395 1.00 0.00 C ATOM 2123 CG LYS A 134 4.377 13.446 -10.241 1.00 0.00 C ATOM 2124 CD LYS A 134 5.120 12.783 -11.417 1.00 0.00 C ATOM 2125 CE LYS A 134 4.442 13.017 -12.771 1.00 0.00 C ATOM 2126 NZ LYS A 134 3.220 12.212 -12.969 1.00 0.00 N ATOM 0 H LYS A 134 5.294 12.751 -7.648 1.00 0.00 H new ATOM 0 HA LYS A 134 2.858 14.027 -8.082 1.00 0.00 H new ATOM 0 HB2 LYS A 134 4.076 11.529 -9.310 1.00 0.00 H new ATOM 0 HB3 LYS A 134 2.605 12.269 -9.909 1.00 0.00 H new ATOM 0 HG2 LYS A 134 3.721 14.224 -10.633 1.00 0.00 H new ATOM 0 HG3 LYS A 134 5.106 13.938 -9.597 1.00 0.00 H new ATOM 0 HD2 LYS A 134 6.139 13.168 -11.457 1.00 0.00 H new ATOM 0 HD3 LYS A 134 5.191 11.711 -11.235 1.00 0.00 H new ATOM 0 HE2 LYS A 134 4.190 14.073 -12.863 1.00 0.00 H new ATOM 0 HE3 LYS A 134 5.151 12.788 -13.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 2.815 12.420 -13.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 3.457 11.201 -12.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 2.526 12.447 -12.231 1.00 0.00 H new ATOM 2140 N ALA A 135 2.616 10.950 -6.832 1.00 0.00 N ATOM 2141 CA ALA A 135 1.774 9.980 -6.156 1.00 0.00 C ATOM 2142 C ALA A 135 1.263 10.440 -4.784 1.00 0.00 C ATOM 2143 O ALA A 135 0.501 9.690 -4.169 1.00 0.00 O ATOM 2144 CB ALA A 135 2.548 8.666 -6.014 1.00 0.00 C ATOM 0 H ALA A 135 3.587 10.646 -6.909 1.00 0.00 H new ATOM 0 HA ALA A 135 0.884 9.850 -6.772 1.00 0.00 H new ATOM 0 HB1 ALA A 135 1.925 7.929 -5.507 1.00 0.00 H new ATOM 0 HB2 ALA A 135 2.818 8.294 -7.002 1.00 0.00 H new ATOM 0 HB3 ALA A 135 3.453 8.838 -5.431 1.00 0.00 H new ATOM 2150 N GLY A 136 1.646 11.618 -4.284 1.00 0.00 N ATOM 2151 CA GLY A 136 1.224 12.163 -3.001 1.00 0.00 C ATOM 2152 C GLY A 136 -0.201 12.709 -3.059 1.00 0.00 C ATOM 2153 O GLY A 136 -0.429 13.875 -2.738 1.00 0.00 O ATOM 0 H GLY A 136 2.283 12.238 -4.785 1.00 0.00 H new ATOM 0 HA2 GLY A 136 1.285 11.387 -2.238 1.00 0.00 H new ATOM 0 HA3 GLY A 136 1.906 12.959 -2.702 1.00 0.00 H new ATOM 2157 N GLY A 137 -1.170 11.892 -3.468 1.00 0.00 N ATOM 2158 CA GLY A 137 -2.581 12.244 -3.540 1.00 0.00 C ATOM 2159 C GLY A 137 -3.318 11.676 -2.339 1.00 0.00 C ATOM 2160 O GLY A 137 -4.108 10.744 -2.493 1.00 0.00 O ATOM 0 H GLY A 137 -0.985 10.935 -3.768 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -2.693 13.328 -3.567 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -3.015 11.855 -4.461 1.00 0.00 H new ATOM 2164 N ALA A 138 -3.021 12.179 -1.139 1.00 0.00 N ATOM 2165 CA ALA A 138 -3.687 11.803 0.099 1.00 0.00 C ATOM 2166 C ALA A 138 -3.777 13.032 0.994 1.00 0.00 C ATOM 2167 O ALA A 138 -2.741 13.542 1.423 1.00 0.00 O ATOM 2168 CB ALA A 138 -2.903 10.696 0.821 1.00 0.00 C ATOM 0 H ALA A 138 -2.290 12.878 -1.003 1.00 0.00 H new ATOM 0 HA ALA A 138 -4.684 11.425 -0.128 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -3.417 10.429 1.744 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -2.835 9.819 0.177 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -1.900 11.054 1.055 1.00 0.00 H new ATOM 2174 N ASN A 139 -4.985 13.531 1.249 1.00 0.00 N ATOM 2175 CA ASN A 139 -5.171 14.645 2.174 1.00 0.00 C ATOM 2176 C ASN A 139 -4.905 14.139 3.597 1.00 0.00 C ATOM 2177 O ASN A 139 -5.140 12.960 3.894 1.00 0.00 O ATOM 2178 CB ASN A 139 -6.599 15.199 2.053 1.00 0.00 C ATOM 2179 CG ASN A 139 -6.818 16.408 2.956 1.00 0.00 C ATOM 2180 OD1 ASN A 139 -6.977 16.269 4.163 1.00 0.00 O ATOM 2181 ND2 ASN A 139 -6.824 17.610 2.412 1.00 0.00 N ATOM 0 H ASN A 139 -5.847 13.182 0.829 1.00 0.00 H new ATOM 0 HA ASN A 139 -4.478 15.452 1.936 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -6.793 15.479 1.018 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -7.314 14.418 2.312 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -6.962 18.434 2.997 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -6.691 17.715 1.406 1.00 0.00 H new ATOM 2188 N TYR A 140 -4.408 15.012 4.469 1.00 0.00 N ATOM 2189 CA TYR A 140 -4.186 14.730 5.874 1.00 0.00 C ATOM 2190 C TYR A 140 -4.575 15.984 6.635 1.00 0.00 C ATOM 2191 O TYR A 140 -3.852 16.981 6.604 1.00 0.00 O ATOM 2192 CB TYR A 140 -2.739 14.320 6.158 1.00 0.00 C ATOM 2193 CG TYR A 140 -2.370 12.978 5.563 1.00 0.00 C ATOM 2194 CD1 TYR A 140 -2.887 11.793 6.118 1.00 0.00 C ATOM 2195 CD2 TYR A 140 -1.502 12.916 4.461 1.00 0.00 C ATOM 2196 CE1 TYR A 140 -2.548 10.549 5.562 1.00 0.00 C ATOM 2197 CE2 TYR A 140 -1.169 11.679 3.886 1.00 0.00 C ATOM 2198 CZ TYR A 140 -1.704 10.490 4.431 1.00 0.00 C ATOM 2199 OH TYR A 140 -1.389 9.293 3.867 1.00 0.00 O ATOM 0 H TYR A 140 -4.143 15.961 4.205 1.00 0.00 H new ATOM 0 HA TYR A 140 -4.791 13.881 6.192 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -2.068 15.082 5.762 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -2.583 14.287 7.236 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -3.545 11.840 6.973 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -1.088 13.826 4.053 1.00 0.00 H new ATOM 0 HE1 TYR A 140 -2.932 9.639 5.998 1.00 0.00 H new ATOM 0 HE2 TYR A 140 -0.508 11.637 3.033 1.00 0.00 H new ATOM 0 HH TYR A 140 -1.548 9.335 2.901 1.00 0.00 H new ATOM 2209 N ASP A 141 -5.753 15.967 7.236 1.00 0.00 N ATOM 2210 CA ASP A 141 -6.256 17.036 8.081 1.00 0.00 C ATOM 2211 C ASP A 141 -7.155 16.412 9.140 1.00 0.00 C ATOM 2212 O ASP A 141 -7.749 15.349 8.914 1.00 0.00 O ATOM 2213 CB ASP A 141 -7.021 18.088 7.272 1.00 0.00 C ATOM 2214 CG ASP A 141 -7.561 19.168 8.209 1.00 0.00 C ATOM 2215 OD1 ASP A 141 -6.757 19.700 9.004 1.00 0.00 O ATOM 2216 OD2 ASP A 141 -8.785 19.425 8.167 1.00 0.00 O ATOM 0 H ASP A 141 -6.404 15.187 7.147 1.00 0.00 H new ATOM 0 HA ASP A 141 -5.418 17.553 8.548 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -6.364 18.536 6.526 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -7.843 17.618 6.732 1.00 0.00 H new ATOM 2221 N ALA A 142 -7.198 17.036 10.309 1.00 0.00 N ATOM 2222 CA ALA A 142 -8.018 16.703 11.453 1.00 0.00 C ATOM 2223 C ALA A 142 -8.172 17.984 12.269 1.00 0.00 C ATOM 2224 O ALA A 142 -7.199 18.731 12.418 1.00 0.00 O ATOM 2225 CB ALA A 142 -7.332 15.623 12.283 1.00 0.00 C ATOM 0 H ALA A 142 -6.612 17.851 10.490 1.00 0.00 H new ATOM 0 HA ALA A 142 -8.991 16.319 11.147 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -7.954 15.376 13.144 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -7.187 14.732 11.672 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -6.365 15.988 12.627 1.00 0.00 H new ATOM 2231 N GLN A 143 -9.384 18.262 12.736 1.00 0.00 N ATOM 2232 CA GLN A 143 -9.739 19.378 13.603 1.00 0.00 C ATOM 2233 C GLN A 143 -10.894 18.873 14.460 1.00 0.00 C ATOM 2234 O GLN A 143 -11.810 18.248 13.920 1.00 0.00 O ATOM 2235 CB GLN A 143 -10.186 20.605 12.781 1.00 0.00 C ATOM 2236 CG GLN A 143 -9.080 21.331 11.996 1.00 0.00 C ATOM 2237 CD GLN A 143 -8.087 22.053 12.908 1.00 0.00 C ATOM 2238 OE1 GLN A 143 -8.185 23.258 13.109 1.00 0.00 O ATOM 2239 NE2 GLN A 143 -7.130 21.351 13.492 1.00 0.00 N ATOM 0 H GLN A 143 -10.190 17.681 12.506 1.00 0.00 H new ATOM 0 HA GLN A 143 -8.887 19.698 14.203 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -10.954 20.285 12.076 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -10.653 21.320 13.458 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -8.543 20.609 11.380 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -9.535 22.053 11.318 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -7.055 20.348 13.320 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -6.467 21.812 14.115 1.00 0.00 H new ATOM 2248 N THR A 144 -10.902 19.217 15.750 1.00 0.00 N ATOM 2249 CA THR A 144 -11.888 18.727 16.716 1.00 0.00 C ATOM 2250 C THR A 144 -11.796 17.195 16.701 1.00 0.00 C ATOM 2251 O THR A 144 -12.766 16.479 16.458 1.00 0.00 O ATOM 2252 CB THR A 144 -13.291 19.305 16.458 1.00 0.00 C ATOM 2253 OG1 THR A 144 -13.190 20.682 16.141 1.00 0.00 O ATOM 2254 CG2 THR A 144 -14.184 19.178 17.698 1.00 0.00 C ATOM 0 H THR A 144 -10.215 19.851 16.158 1.00 0.00 H new ATOM 0 HA THR A 144 -11.673 19.075 17.726 1.00 0.00 H new ATOM 0 HB THR A 144 -13.730 18.742 15.634 1.00 0.00 H new ATOM 0 HG1 THR A 144 -14.085 21.046 15.976 1.00 0.00 H new ATOM 0 HG21 THR A 144 -15.168 19.595 17.482 1.00 0.00 H new ATOM 0 HG22 THR A 144 -14.287 18.127 17.966 1.00 0.00 H new ATOM 0 HG23 THR A 144 -13.733 19.722 18.528 1.00 0.00 H new ATOM 2262 N GLU A 145 -10.566 16.734 16.914 1.00 0.00 N ATOM 2263 CA GLU A 145 -10.074 15.375 16.884 1.00 0.00 C ATOM 2264 C GLU A 145 -10.877 14.461 17.799 1.00 0.00 C ATOM 2265 O GLU A 145 -11.594 13.585 17.259 1.00 0.00 O ATOM 2266 CB GLU A 145 -8.570 15.426 17.242 1.00 0.00 C ATOM 2267 CG GLU A 145 -7.674 16.028 16.140 1.00 0.00 C ATOM 2268 CD GLU A 145 -7.481 17.561 16.080 1.00 0.00 C ATOM 2269 OE1 GLU A 145 -8.347 18.339 16.543 1.00 0.00 O ATOM 2270 OE2 GLU A 145 -6.452 17.952 15.481 1.00 0.00 O ATOM 2271 OXT GLU A 145 -10.750 14.563 19.037 1.00 0.00 O ATOM 0 H GLU A 145 -9.812 17.384 17.136 1.00 0.00 H new ATOM 0 HA GLU A 145 -10.196 14.941 15.891 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -8.445 16.010 18.154 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -8.226 14.415 17.461 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -6.687 15.576 16.236 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -8.077 15.710 15.179 1.00 0.00 H new TER 2278 GLU A 145