USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1236 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 128 CYS SG : rot -79:sc= 0.226 USER MOD Set 1.2: A 129 GLN : amide:sc= -7.59! C(o=-7.4!,f=-8.2!) USER MOD Set 2.1: A 19 CYS SG : rot 180:sc= -0.116 USER MOD Set 2.2: A 106 TYR OH : rot 172:sc= 0.0322 USER MOD Set 3.1: A 87 TYR OH : rot 180:sc= -0.817 USER MOD Set 3.2: A 92 LYS NZ :NH3+ -131:sc= -0.373 (180deg=0) USER MOD Set 3.3: A 94 LYS NZ :NH3+ -154:sc= -1.81! (180deg=-0.233) USER MOD Set 4.1: A 86 ASN :FLIP amide:sc= -5.47! C(o=-14!,f=-5.5!) USER MOD Set 4.2: A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -138:sc= -4.63! (180deg=-8.13!) USER MOD Single : A 5 SER OG : rot -18:sc= 0.867 USER MOD Single : A 6 MET CE :methyl -118:sc= -0.0409 (180deg=-0.56) USER MOD Single : A 11 CYS SG : rot -100:sc= -10.3! USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc=-0.00328 K(o=-0.0033,f=-1.3) USER MOD Single : A 27 ASN :FLIP amide:sc= -0.0205 F(o=-0.53,f=-0.02) USER MOD Single : A 35 GLN : amide:sc= -2.69! C(o=-2.7!,f=-2.6!) USER MOD Single : A 37 SER OG : rot -19:sc= 0.288 USER MOD Single : A 41 HIS :FLIP no HD1:sc= -4.73! C(o=-7.3!,f=-4.7!) USER MOD Single : A 42 HIS : no HD1:sc= -7.9! C(o=-7.9!,f=-10!) USER MOD Single : A 44 THR OG1 : rot 180:sc= -1.03 USER MOD Single : A 47 LYS NZ :NH3+ -148:sc= 0.812 (180deg=-0.191) USER MOD Single : A 49 HIS :FLIP no HD1:sc= -10! C(o=-12!,f=-10!) USER MOD Single : A 59 THR OG1 : rot 79:sc= -4.52! USER MOD Single : A 64 THR OG1 : rot 66:sc= -5.1! USER MOD Single : A 65 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 74 GLN :FLIP amide:sc= -10.9! C(o=-12!,f=-11!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -0.184 K(o=-0.18,f=-2.7!) USER MOD Single : A 98 TYR OH : rot 165:sc= -0.712 USER MOD Single : A 104 LYS NZ :NH3+ -164:sc= 0.804 (180deg=0.616) USER MOD Single : A 113 SER OG : rot 108:sc= 0.0499 USER MOD Single : A 114 HIS :FLIP no HD1:sc= -1.56! C(o=-2.7!,f=-1.6!) USER MOD Single : A 116 HIS : no HD1:sc= -5.97! C(o=-6!,f=-8.2!) USER MOD Single : A 117 GLN :FLIP amide:sc= -1.54 F(o=-2.3,f=-1.5) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 GLN : amide:sc= -0.392 K(o=-0.39,f=-1.1) USER MOD Single : A 134 LYS NZ :NH3+ -154:sc= -0.0929 (180deg=-0.804) USER MOD Single : A 136 MET CE :methyl -118:sc= -4.98! (180deg=-9.98!) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 GLN :FLIP amide:sc=-0.00983 F(o=-1.5!,f=-0.0098) USER MOD Single : A 144 HIS : no HE2:sc= -13.7! C(o=-14!,f=-22!) USER MOD Single : A 145 GLN : amide:sc= -0.093 K(o=-0.093,f=-1.2!) USER MOD Single : A 148 CYS SG : rot 77:sc= 0.0646 USER MOD Single : A 149 SER OG : rot -33:sc= 0.0593 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.158 -13.771 -6.058 1.00 0.00 N ATOM 2 CA GLY A 1 12.047 -14.890 -5.818 1.00 0.00 C ATOM 3 C GLY A 1 12.389 -15.583 -7.129 1.00 0.00 C ATOM 4 O GLY A 1 13.560 -15.810 -7.427 1.00 0.00 O ATOM 0 H1 GLY A 1 11.454 -12.962 -5.476 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.196 -13.507 -7.063 1.00 0.00 H new ATOM 0 H3 GLY A 1 10.185 -14.040 -5.807 1.00 0.00 H new ATOM 0 HA2 GLY A 1 12.959 -14.541 -5.334 1.00 0.00 H new ATOM 0 HA3 GLY A 1 11.576 -15.598 -5.137 1.00 0.00 H new ATOM 8 N PRO A 2 11.363 -15.920 -7.913 1.00 0.00 N ATOM 9 CA PRO A 2 11.497 -16.577 -9.195 1.00 0.00 C ATOM 10 C PRO A 2 12.047 -15.594 -10.218 1.00 0.00 C ATOM 11 O PRO A 2 12.824 -15.973 -11.091 1.00 0.00 O ATOM 12 CB PRO A 2 10.079 -17.013 -9.562 1.00 0.00 C ATOM 13 CG PRO A 2 9.214 -15.951 -8.886 1.00 0.00 C ATOM 14 CD PRO A 2 9.974 -15.673 -7.591 1.00 0.00 C ATOM 0 HA PRO A 2 12.182 -17.424 -9.168 1.00 0.00 H new ATOM 0 HB2 PRO A 2 9.928 -17.031 -10.641 1.00 0.00 H new ATOM 0 HB3 PRO A 2 9.855 -18.013 -9.192 1.00 0.00 H new ATOM 0 HG2 PRO A 2 9.119 -15.055 -9.500 1.00 0.00 H new ATOM 0 HG3 PRO A 2 8.204 -16.314 -8.693 1.00 0.00 H new ATOM 0 HD2 PRO A 2 9.823 -14.647 -7.257 1.00 0.00 H new ATOM 0 HD3 PRO A 2 9.633 -16.324 -6.786 1.00 0.00 H new ATOM 22 N LEU A 3 11.681 -14.350 -10.154 1.00 0.00 N ATOM 23 CA LEU A 3 12.199 -13.360 -11.138 1.00 0.00 C ATOM 24 C LEU A 3 13.529 -12.794 -10.630 1.00 0.00 C ATOM 25 O LEU A 3 13.636 -12.353 -9.502 1.00 0.00 O ATOM 26 CB LEU A 3 11.187 -12.219 -11.292 1.00 0.00 C ATOM 27 CG LEU A 3 9.808 -12.787 -11.637 1.00 0.00 C ATOM 28 CD1 LEU A 3 8.857 -11.642 -11.993 1.00 0.00 C ATOM 29 CD2 LEU A 3 9.924 -13.736 -12.832 1.00 0.00 C ATOM 0 H LEU A 3 11.040 -13.970 -9.457 1.00 0.00 H new ATOM 0 HA LEU A 3 12.350 -13.845 -12.102 1.00 0.00 H new ATOM 0 HB2 LEU A 3 11.132 -11.643 -10.368 1.00 0.00 H new ATOM 0 HB3 LEU A 3 11.514 -11.535 -12.075 1.00 0.00 H new ATOM 0 HG LEU A 3 9.420 -13.332 -10.776 1.00 0.00 H new ATOM 0 HD11 LEU A 3 7.875 -12.047 -12.239 1.00 0.00 H new ATOM 0 HD12 LEU A 3 8.768 -10.965 -11.143 1.00 0.00 H new ATOM 0 HD13 LEU A 3 9.249 -11.097 -12.851 1.00 0.00 H new ATOM 0 HD21 LEU A 3 8.940 -14.138 -13.074 1.00 0.00 H new ATOM 0 HD22 LEU A 3 10.316 -13.192 -13.692 1.00 0.00 H new ATOM 0 HD23 LEU A 3 10.599 -14.555 -12.582 1.00 0.00 H new ATOM 41 N GLY A 4 14.539 -12.799 -11.454 1.00 0.00 N ATOM 42 CA GLY A 4 15.861 -12.259 -11.022 1.00 0.00 C ATOM 43 C GLY A 4 16.159 -12.710 -9.590 1.00 0.00 C ATOM 44 O GLY A 4 16.583 -13.825 -9.352 1.00 0.00 O ATOM 0 H GLY A 4 14.507 -13.154 -12.410 1.00 0.00 H new ATOM 0 HA2 GLY A 4 16.645 -12.608 -11.694 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.856 -11.170 -11.077 1.00 0.00 H new ATOM 48 N SER A 5 15.938 -11.848 -8.634 1.00 0.00 N ATOM 49 CA SER A 5 16.206 -12.221 -7.214 1.00 0.00 C ATOM 50 C SER A 5 15.366 -11.331 -6.296 1.00 0.00 C ATOM 51 O SER A 5 15.578 -10.138 -6.210 1.00 0.00 O ATOM 52 CB SER A 5 17.690 -12.017 -6.903 1.00 0.00 C ATOM 53 OG SER A 5 18.467 -12.851 -7.754 1.00 0.00 O ATOM 0 H SER A 5 15.584 -10.902 -8.774 1.00 0.00 H new ATOM 0 HA SER A 5 15.944 -13.267 -7.053 1.00 0.00 H new ATOM 0 HB2 SER A 5 17.964 -10.972 -7.050 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.891 -12.256 -5.859 1.00 0.00 H new ATOM 0 HG SER A 5 17.897 -13.552 -8.133 1.00 0.00 H new ATOM 59 N MET A 6 14.412 -11.901 -5.609 1.00 0.00 N ATOM 60 CA MET A 6 13.555 -11.081 -4.705 1.00 0.00 C ATOM 61 C MET A 6 12.994 -9.898 -5.492 1.00 0.00 C ATOM 62 O MET A 6 13.463 -9.578 -6.566 1.00 0.00 O ATOM 63 CB MET A 6 14.398 -10.550 -3.544 1.00 0.00 C ATOM 64 CG MET A 6 15.030 -11.719 -2.780 1.00 0.00 C ATOM 65 SD MET A 6 15.888 -11.093 -1.311 1.00 0.00 S ATOM 66 CE MET A 6 14.422 -10.776 -0.297 1.00 0.00 C ATOM 0 H MET A 6 14.190 -12.896 -5.635 1.00 0.00 H new ATOM 0 HA MET A 6 12.742 -11.694 -4.316 1.00 0.00 H new ATOM 0 HB2 MET A 6 15.177 -9.888 -3.922 1.00 0.00 H new ATOM 0 HB3 MET A 6 13.776 -9.959 -2.872 1.00 0.00 H new ATOM 0 HG2 MET A 6 14.261 -12.434 -2.487 1.00 0.00 H new ATOM 0 HG3 MET A 6 15.731 -12.251 -3.424 1.00 0.00 H new ATOM 0 HE1 MET A 6 14.362 -9.712 -0.066 1.00 0.00 H new ATOM 0 HE2 MET A 6 13.529 -11.080 -0.843 1.00 0.00 H new ATOM 0 HE3 MET A 6 14.491 -11.345 0.630 1.00 0.00 H new ATOM 76 N ALA A 7 11.997 -9.242 -4.973 1.00 0.00 N ATOM 77 CA ALA A 7 11.428 -8.084 -5.708 1.00 0.00 C ATOM 78 C ALA A 7 12.106 -6.800 -5.242 1.00 0.00 C ATOM 79 O ALA A 7 12.001 -6.400 -4.099 1.00 0.00 O ATOM 80 CB ALA A 7 9.926 -7.998 -5.453 1.00 0.00 C ATOM 0 H ALA A 7 11.555 -9.456 -4.079 1.00 0.00 H new ATOM 0 HA ALA A 7 11.601 -8.215 -6.776 1.00 0.00 H new ATOM 0 HB1 ALA A 7 9.513 -7.147 -5.994 1.00 0.00 H new ATOM 0 HB2 ALA A 7 9.446 -8.914 -5.797 1.00 0.00 H new ATOM 0 HB3 ALA A 7 9.745 -7.872 -4.386 1.00 0.00 H new ATOM 86 N LEU A 8 12.789 -6.150 -6.135 1.00 0.00 N ATOM 87 CA LEU A 8 13.476 -4.882 -5.782 1.00 0.00 C ATOM 88 C LEU A 8 12.491 -3.747 -6.017 1.00 0.00 C ATOM 89 O LEU A 8 11.930 -3.182 -5.098 1.00 0.00 O ATOM 90 CB LEU A 8 14.694 -4.692 -6.693 1.00 0.00 C ATOM 91 CG LEU A 8 14.929 -5.968 -7.511 1.00 0.00 C ATOM 92 CD1 LEU A 8 15.935 -5.687 -8.625 1.00 0.00 C ATOM 93 CD2 LEU A 8 15.469 -7.071 -6.599 1.00 0.00 C ATOM 0 H LEU A 8 12.902 -6.445 -7.105 1.00 0.00 H new ATOM 0 HA LEU A 8 13.808 -4.899 -4.744 1.00 0.00 H new ATOM 0 HB2 LEU A 8 14.533 -3.845 -7.360 1.00 0.00 H new ATOM 0 HB3 LEU A 8 15.576 -4.464 -6.095 1.00 0.00 H new ATOM 0 HG LEU A 8 13.986 -6.292 -7.951 1.00 0.00 H new ATOM 0 HD11 LEU A 8 16.100 -6.596 -9.204 1.00 0.00 H new ATOM 0 HD12 LEU A 8 15.546 -4.906 -9.278 1.00 0.00 H new ATOM 0 HD13 LEU A 8 16.878 -5.359 -8.189 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.635 -7.977 -7.182 1.00 0.00 H new ATOM 0 HD22 LEU A 8 16.410 -6.748 -6.155 1.00 0.00 H new ATOM 0 HD23 LEU A 8 14.747 -7.276 -5.809 1.00 0.00 H new ATOM 105 N ARG A 9 12.260 -3.435 -7.258 1.00 0.00 N ATOM 106 CA ARG A 9 11.290 -2.368 -7.599 1.00 0.00 C ATOM 107 C ARG A 9 10.271 -2.953 -8.578 1.00 0.00 C ATOM 108 O ARG A 9 10.621 -3.443 -9.633 1.00 0.00 O ATOM 109 CB ARG A 9 12.023 -1.175 -8.230 1.00 0.00 C ATOM 110 CG ARG A 9 12.105 -1.341 -9.751 1.00 0.00 C ATOM 111 CD ARG A 9 12.915 -0.185 -10.343 1.00 0.00 C ATOM 112 NE ARG A 9 14.352 -0.337 -9.973 1.00 0.00 N ATOM 113 CZ ARG A 9 15.112 0.719 -9.845 1.00 0.00 C ATOM 114 NH1 ARG A 9 14.615 1.912 -10.030 1.00 0.00 N ATOM 115 NH2 ARG A 9 16.371 0.581 -9.532 1.00 0.00 N ATOM 0 H ARG A 9 12.708 -3.880 -8.059 1.00 0.00 H new ATOM 0 HA ARG A 9 10.782 -2.012 -6.703 1.00 0.00 H new ATOM 0 HB2 ARG A 9 11.501 -0.250 -7.987 1.00 0.00 H new ATOM 0 HB3 ARG A 9 13.026 -1.094 -7.812 1.00 0.00 H new ATOM 0 HG2 ARG A 9 12.573 -2.293 -10.000 1.00 0.00 H new ATOM 0 HG3 ARG A 9 11.104 -1.356 -10.181 1.00 0.00 H new ATOM 0 HD2 ARG A 9 12.808 -0.171 -11.428 1.00 0.00 H new ATOM 0 HD3 ARG A 9 12.533 0.766 -9.973 1.00 0.00 H new ATOM 0 HE ARG A 9 14.742 -1.267 -9.820 1.00 0.00 H new ATOM 0 HH11 ARG A 9 13.631 2.022 -10.275 1.00 0.00 H new ATOM 0 HH12 ARG A 9 15.211 2.734 -9.929 1.00 0.00 H new ATOM 0 HH21 ARG A 9 16.761 -0.350 -9.387 1.00 0.00 H new ATOM 0 HH22 ARG A 9 16.965 1.404 -9.432 1.00 0.00 H new ATOM 129 N ALA A 10 9.015 -2.922 -8.234 1.00 0.00 N ATOM 130 CA ALA A 10 7.980 -3.489 -9.144 1.00 0.00 C ATOM 131 C ALA A 10 7.226 -2.343 -9.808 1.00 0.00 C ATOM 132 O ALA A 10 7.394 -1.194 -9.454 1.00 0.00 O ATOM 133 CB ALA A 10 7.004 -4.351 -8.339 1.00 0.00 C ATOM 0 H ALA A 10 8.659 -2.529 -7.363 1.00 0.00 H new ATOM 0 HA ALA A 10 8.456 -4.107 -9.905 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.248 -4.765 -9.006 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.548 -5.164 -7.859 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.520 -3.739 -7.578 1.00 0.00 H new ATOM 139 N CYS A 11 6.415 -2.634 -10.780 1.00 0.00 N ATOM 140 CA CYS A 11 5.679 -1.542 -11.464 1.00 0.00 C ATOM 141 C CYS A 11 4.244 -1.983 -11.765 1.00 0.00 C ATOM 142 O CYS A 11 3.976 -3.145 -11.996 1.00 0.00 O ATOM 143 CB CYS A 11 6.417 -1.194 -12.754 1.00 0.00 C ATOM 144 SG CYS A 11 8.022 -2.033 -12.773 1.00 0.00 S ATOM 0 H CYS A 11 6.230 -3.574 -11.129 1.00 0.00 H new ATOM 0 HA CYS A 11 5.632 -0.662 -10.822 1.00 0.00 H new ATOM 0 HB2 CYS A 11 5.825 -1.497 -13.618 1.00 0.00 H new ATOM 0 HB3 CYS A 11 6.557 -0.115 -12.826 1.00 0.00 H new ATOM 0 HG CYS A 11 8.953 -1.196 -12.424 1.00 0.00 H new ATOM 150 N GLY A 12 3.316 -1.060 -11.751 1.00 0.00 N ATOM 151 CA GLY A 12 1.892 -1.422 -12.022 1.00 0.00 C ATOM 152 C GLY A 12 1.219 -0.314 -12.830 1.00 0.00 C ATOM 153 O GLY A 12 1.793 0.728 -13.075 1.00 0.00 O ATOM 0 H GLY A 12 3.483 -0.071 -11.564 1.00 0.00 H new ATOM 0 HA2 GLY A 12 1.845 -2.363 -12.569 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.361 -1.573 -11.082 1.00 0.00 H new ATOM 157 N LEU A 13 -0.003 -0.530 -13.240 1.00 0.00 N ATOM 158 CA LEU A 13 -0.720 0.513 -14.026 1.00 0.00 C ATOM 159 C LEU A 13 -2.018 0.913 -13.341 1.00 0.00 C ATOM 160 O LEU A 13 -2.873 0.089 -13.086 1.00 0.00 O ATOM 161 CB LEU A 13 -1.113 -0.029 -15.402 1.00 0.00 C ATOM 162 CG LEU A 13 0.104 -0.250 -16.288 1.00 0.00 C ATOM 163 CD1 LEU A 13 -0.381 -0.551 -17.704 1.00 0.00 C ATOM 164 CD2 LEU A 13 0.954 1.010 -16.330 1.00 0.00 C ATOM 0 H LEU A 13 -0.534 -1.383 -13.064 1.00 0.00 H new ATOM 0 HA LEU A 13 -0.044 1.364 -14.111 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -1.652 -0.969 -15.283 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.795 0.670 -15.887 1.00 0.00 H new ATOM 0 HG LEU A 13 0.697 -1.075 -15.892 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.477 -0.713 -18.356 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.002 -1.447 -17.693 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -0.965 0.291 -18.075 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.823 0.842 -16.967 1.00 0.00 H new ATOM 0 HD22 LEU A 13 0.364 1.834 -16.732 1.00 0.00 H new ATOM 0 HD23 LEU A 13 1.286 1.259 -15.322 1.00 0.00 H new ATOM 176 N ILE A 14 -2.220 2.180 -13.123 1.00 0.00 N ATOM 177 CA ILE A 14 -3.517 2.604 -12.552 1.00 0.00 C ATOM 178 C ILE A 14 -4.518 2.486 -13.693 1.00 0.00 C ATOM 179 O ILE A 14 -4.721 3.417 -14.445 1.00 0.00 O ATOM 180 CB ILE A 14 -3.431 4.062 -12.093 1.00 0.00 C ATOM 181 CG1 ILE A 14 -2.507 4.170 -10.881 1.00 0.00 C ATOM 182 CG2 ILE A 14 -4.821 4.584 -11.732 1.00 0.00 C ATOM 183 CD1 ILE A 14 -3.008 3.251 -9.766 1.00 0.00 C ATOM 0 H ILE A 14 -1.552 2.927 -13.313 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.801 1.998 -11.691 1.00 0.00 H new ATOM 0 HB ILE A 14 -3.028 4.665 -12.907 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.490 3.896 -11.162 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -2.473 5.201 -10.528 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -4.747 5.622 -11.407 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.471 4.523 -12.605 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -5.238 3.980 -10.926 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.346 3.331 -8.904 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -4.017 3.545 -9.478 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -3.018 2.220 -10.121 1.00 0.00 H new ATOM 195 N ILE A 15 -5.123 1.342 -13.855 1.00 0.00 N ATOM 196 CA ILE A 15 -6.074 1.184 -14.981 1.00 0.00 C ATOM 197 C ILE A 15 -7.425 1.755 -14.605 1.00 0.00 C ATOM 198 O ILE A 15 -7.921 1.565 -13.513 1.00 0.00 O ATOM 199 CB ILE A 15 -6.244 -0.286 -15.350 1.00 0.00 C ATOM 200 CG1 ILE A 15 -4.938 -0.833 -15.933 1.00 0.00 C ATOM 201 CG2 ILE A 15 -7.366 -0.401 -16.384 1.00 0.00 C ATOM 202 CD1 ILE A 15 -5.141 -2.293 -16.345 1.00 0.00 C ATOM 0 H ILE A 15 -5.000 0.521 -13.262 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.669 1.721 -15.838 1.00 0.00 H new ATOM 0 HB ILE A 15 -6.496 -0.866 -14.462 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.634 -0.239 -16.795 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.138 -0.759 -15.196 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.501 -1.447 -16.659 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -8.293 -0.015 -15.960 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -7.104 0.177 -17.271 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.213 -2.686 -16.761 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -5.426 -2.881 -15.472 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -5.929 -2.353 -17.096 1.00 0.00 H new ATOM 214 N PHE A 16 -8.022 2.454 -15.518 1.00 0.00 N ATOM 215 CA PHE A 16 -9.347 3.049 -15.252 1.00 0.00 C ATOM 216 C PHE A 16 -10.073 3.254 -16.583 1.00 0.00 C ATOM 217 O PHE A 16 -9.459 3.366 -17.624 1.00 0.00 O ATOM 218 CB PHE A 16 -9.162 4.401 -14.569 1.00 0.00 C ATOM 219 CG PHE A 16 -8.565 5.370 -15.552 1.00 0.00 C ATOM 220 CD1 PHE A 16 -9.397 6.060 -16.438 1.00 0.00 C ATOM 221 CD2 PHE A 16 -7.178 5.573 -15.588 1.00 0.00 C ATOM 222 CE1 PHE A 16 -8.848 6.955 -17.358 1.00 0.00 C ATOM 223 CE2 PHE A 16 -6.628 6.471 -16.509 1.00 0.00 C ATOM 224 CZ PHE A 16 -7.466 7.162 -17.395 1.00 0.00 C ATOM 0 H PHE A 16 -7.643 2.640 -16.447 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.929 2.389 -14.608 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -10.120 4.774 -14.208 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -8.512 4.298 -13.700 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -10.465 5.901 -16.411 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.535 5.037 -14.906 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.492 7.488 -18.042 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.560 6.631 -16.537 1.00 0.00 H new ATOM 0 HZ PHE A 16 -7.043 7.855 -18.107 1.00 0.00 H new ATOM 234 N ARG A 17 -11.369 3.320 -16.551 1.00 0.00 N ATOM 235 CA ARG A 17 -12.141 3.542 -17.807 1.00 0.00 C ATOM 236 C ARG A 17 -13.117 4.689 -17.583 1.00 0.00 C ATOM 237 O ARG A 17 -13.798 4.746 -16.579 1.00 0.00 O ATOM 238 CB ARG A 17 -12.913 2.271 -18.182 1.00 0.00 C ATOM 239 CG ARG A 17 -13.900 2.572 -19.320 1.00 0.00 C ATOM 240 CD ARG A 17 -13.148 3.077 -20.557 1.00 0.00 C ATOM 241 NE ARG A 17 -14.108 3.267 -21.678 1.00 0.00 N ATOM 242 CZ ARG A 17 -13.691 3.743 -22.821 1.00 0.00 C ATOM 243 NH1 ARG A 17 -12.433 4.053 -22.980 1.00 0.00 N ATOM 244 NH2 ARG A 17 -14.531 3.912 -23.806 1.00 0.00 N ATOM 0 H ARG A 17 -11.934 3.230 -15.707 1.00 0.00 H new ATOM 0 HA ARG A 17 -11.457 3.787 -18.620 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -12.217 1.491 -18.490 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -13.452 1.893 -17.313 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -14.463 1.672 -19.570 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -14.623 3.320 -18.995 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -12.645 4.017 -20.331 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -12.375 2.363 -20.843 1.00 0.00 H new ATOM 0 HE ARG A 17 -15.091 3.026 -21.554 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -11.775 3.924 -22.212 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -12.108 4.425 -23.873 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -15.515 3.672 -23.684 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -14.203 4.284 -24.698 1.00 0.00 H new ATOM 258 N ARG A 18 -13.192 5.612 -18.499 1.00 0.00 N ATOM 259 CA ARG A 18 -14.126 6.749 -18.309 1.00 0.00 C ATOM 260 C ARG A 18 -15.376 6.554 -19.167 1.00 0.00 C ATOM 261 O ARG A 18 -15.302 6.207 -20.328 1.00 0.00 O ATOM 262 CB ARG A 18 -13.437 8.062 -18.682 1.00 0.00 C ATOM 263 CG ARG A 18 -13.066 8.052 -20.161 1.00 0.00 C ATOM 264 CD ARG A 18 -12.145 9.238 -20.463 1.00 0.00 C ATOM 265 NE ARG A 18 -12.969 10.412 -20.868 1.00 0.00 N ATOM 266 CZ ARG A 18 -13.283 10.582 -22.123 1.00 0.00 C ATOM 267 NH1 ARG A 18 -12.873 9.725 -23.016 1.00 0.00 N ATOM 268 NH2 ARG A 18 -14.005 11.608 -22.484 1.00 0.00 N ATOM 0 H ARG A 18 -12.651 5.627 -19.364 1.00 0.00 H new ATOM 0 HA ARG A 18 -14.421 6.789 -17.260 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.098 8.903 -18.470 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -12.542 8.199 -18.075 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.568 7.117 -20.416 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -13.966 8.111 -20.773 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -11.549 9.483 -19.584 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -11.447 8.978 -21.259 1.00 0.00 H new ATOM 0 HE ARG A 18 -13.287 11.081 -20.166 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -12.308 8.924 -22.733 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -13.117 9.855 -23.998 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -14.324 12.278 -21.785 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -14.250 11.739 -23.465 1.00 0.00 H new ATOM 282 N CYS A 19 -16.529 6.779 -18.600 1.00 0.00 N ATOM 283 CA CYS A 19 -17.786 6.613 -19.376 1.00 0.00 C ATOM 284 C CYS A 19 -18.095 7.910 -20.119 1.00 0.00 C ATOM 285 O CYS A 19 -17.359 8.873 -20.041 1.00 0.00 O ATOM 286 CB CYS A 19 -18.945 6.291 -18.434 1.00 0.00 C ATOM 287 SG CYS A 19 -18.484 4.917 -17.350 1.00 0.00 S ATOM 0 H CYS A 19 -16.653 7.071 -17.631 1.00 0.00 H new ATOM 0 HA CYS A 19 -17.660 5.795 -20.086 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -19.197 7.168 -17.838 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -19.833 6.031 -19.010 1.00 0.00 H new ATOM 0 HG CYS A 19 -19.471 4.646 -16.549 1.00 0.00 H new ATOM 293 N LEU A 20 -19.176 7.938 -20.841 1.00 0.00 N ATOM 294 CA LEU A 20 -19.538 9.167 -21.595 1.00 0.00 C ATOM 295 C LEU A 20 -19.623 10.353 -20.632 1.00 0.00 C ATOM 296 O LEU A 20 -19.219 11.454 -20.947 1.00 0.00 O ATOM 297 CB LEU A 20 -20.905 8.960 -22.250 1.00 0.00 C ATOM 298 CG LEU A 20 -20.935 7.604 -22.954 1.00 0.00 C ATOM 299 CD1 LEU A 20 -22.354 7.322 -23.446 1.00 0.00 C ATOM 300 CD2 LEU A 20 -19.975 7.621 -24.147 1.00 0.00 C ATOM 0 H LEU A 20 -19.828 7.160 -20.942 1.00 0.00 H new ATOM 0 HA LEU A 20 -18.782 9.367 -22.354 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -21.692 9.008 -21.497 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -21.101 9.758 -22.967 1.00 0.00 H new ATOM 0 HG LEU A 20 -20.627 6.826 -22.256 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -22.379 6.355 -23.949 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -23.037 7.307 -22.597 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -22.659 8.102 -24.144 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -19.999 6.653 -24.647 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -20.279 8.399 -24.848 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -18.963 7.824 -23.797 1.00 0.00 H new ATOM 312 N ILE A 21 -20.156 10.135 -19.462 1.00 0.00 N ATOM 313 CA ILE A 21 -20.282 11.246 -18.477 1.00 0.00 C ATOM 314 C ILE A 21 -20.631 10.668 -17.098 1.00 0.00 C ATOM 315 O ILE A 21 -21.037 9.528 -16.988 1.00 0.00 O ATOM 316 CB ILE A 21 -21.400 12.182 -18.947 1.00 0.00 C ATOM 317 CG1 ILE A 21 -20.931 13.640 -18.928 1.00 0.00 C ATOM 318 CG2 ILE A 21 -22.630 12.031 -18.045 1.00 0.00 C ATOM 319 CD1 ILE A 21 -20.936 14.185 -20.356 1.00 0.00 C ATOM 0 H ILE A 21 -20.511 9.233 -19.145 1.00 0.00 H new ATOM 0 HA ILE A 21 -19.344 11.796 -18.402 1.00 0.00 H new ATOM 0 HB ILE A 21 -21.663 11.909 -19.969 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -21.587 14.238 -18.295 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -19.929 13.707 -18.503 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -23.418 12.701 -18.389 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -22.986 11.002 -18.085 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -22.362 12.283 -17.019 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -20.603 15.223 -20.350 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -20.263 13.591 -20.974 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -21.946 14.130 -20.763 1.00 0.00 H new ATOM 331 N PRO A 22 -20.493 11.450 -16.057 1.00 0.00 N ATOM 332 CA PRO A 22 -20.819 11.004 -14.666 1.00 0.00 C ATOM 333 C PRO A 22 -22.285 10.583 -14.537 1.00 0.00 C ATOM 334 O PRO A 22 -23.153 11.123 -15.192 1.00 0.00 O ATOM 335 CB PRO A 22 -20.531 12.237 -13.800 1.00 0.00 C ATOM 336 CG PRO A 22 -19.640 13.106 -14.625 1.00 0.00 C ATOM 337 CD PRO A 22 -20.006 12.836 -16.081 1.00 0.00 C ATOM 0 HA PRO A 22 -20.236 10.132 -14.370 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -21.453 12.757 -13.538 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -20.047 11.955 -12.865 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -19.784 14.157 -14.377 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -18.591 12.875 -14.439 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -20.772 13.525 -16.437 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -19.145 12.948 -16.740 1.00 0.00 H new ATOM 345 N LYS A 23 -22.565 9.613 -13.709 1.00 0.00 N ATOM 346 CA LYS A 23 -23.975 9.153 -13.560 1.00 0.00 C ATOM 347 C LYS A 23 -24.441 9.319 -12.113 1.00 0.00 C ATOM 348 O LYS A 23 -24.756 10.403 -11.664 1.00 0.00 O ATOM 349 CB LYS A 23 -24.078 7.677 -13.947 1.00 0.00 C ATOM 350 CG LYS A 23 -23.691 7.499 -15.415 1.00 0.00 C ATOM 351 CD LYS A 23 -23.936 6.046 -15.833 1.00 0.00 C ATOM 352 CE LYS A 23 -23.388 5.824 -17.242 1.00 0.00 C ATOM 353 NZ LYS A 23 -24.494 5.385 -18.141 1.00 0.00 N ATOM 0 H LYS A 23 -21.882 9.122 -13.132 1.00 0.00 H new ATOM 0 HA LYS A 23 -24.606 9.756 -14.213 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -23.423 7.079 -13.314 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -25.094 7.319 -13.783 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -24.276 8.173 -16.041 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -22.642 7.759 -15.560 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -23.451 5.367 -15.131 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -25.003 5.823 -15.806 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -22.941 6.744 -17.619 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -22.600 5.071 -17.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -24.122 5.234 -19.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -24.901 4.497 -17.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -25.232 6.118 -18.167 1.00 0.00 H new ATOM 367 N VAL A 24 -24.505 8.235 -11.395 1.00 0.00 N ATOM 368 CA VAL A 24 -24.972 8.292 -9.977 1.00 0.00 C ATOM 369 C VAL A 24 -23.827 8.709 -9.055 1.00 0.00 C ATOM 370 O VAL A 24 -24.011 9.442 -8.103 1.00 0.00 O ATOM 371 CB VAL A 24 -25.458 6.901 -9.571 1.00 0.00 C ATOM 372 CG1 VAL A 24 -26.554 6.447 -10.537 1.00 0.00 C ATOM 373 CG2 VAL A 24 -24.284 5.920 -9.635 1.00 0.00 C ATOM 0 H VAL A 24 -24.253 7.305 -11.728 1.00 0.00 H new ATOM 0 HA VAL A 24 -25.776 9.022 -9.890 1.00 0.00 H new ATOM 0 HB VAL A 24 -25.856 6.930 -8.557 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -26.903 5.455 -10.251 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -27.386 7.150 -10.499 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -26.154 6.412 -11.550 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -24.625 4.926 -9.346 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -23.891 5.888 -10.651 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -23.499 6.247 -8.953 1.00 0.00 H new ATOM 383 N ASP A 25 -22.649 8.240 -9.337 1.00 0.00 N ATOM 384 CA ASP A 25 -21.470 8.581 -8.497 1.00 0.00 C ATOM 385 C ASP A 25 -20.251 7.903 -9.113 1.00 0.00 C ATOM 386 O ASP A 25 -19.208 7.784 -8.501 1.00 0.00 O ATOM 387 CB ASP A 25 -21.681 8.072 -7.066 1.00 0.00 C ATOM 388 CG ASP A 25 -20.497 8.490 -6.190 1.00 0.00 C ATOM 389 OD1 ASP A 25 -19.663 7.643 -5.909 1.00 0.00 O ATOM 390 OD2 ASP A 25 -20.443 9.650 -5.814 1.00 0.00 O ATOM 0 H ASP A 25 -22.448 7.625 -10.126 1.00 0.00 H new ATOM 0 HA ASP A 25 -21.329 9.661 -8.459 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -22.608 8.476 -6.659 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -21.780 6.987 -7.067 1.00 0.00 H new ATOM 396 N ASN A 26 -20.390 7.456 -10.329 1.00 0.00 N ATOM 397 CA ASN A 26 -19.264 6.775 -11.018 1.00 0.00 C ATOM 398 C ASN A 26 -18.305 7.832 -11.565 1.00 0.00 C ATOM 399 O ASN A 26 -17.225 7.528 -12.030 1.00 0.00 O ATOM 400 CB ASN A 26 -19.829 5.941 -12.169 1.00 0.00 C ATOM 401 CG ASN A 26 -20.742 4.853 -11.603 1.00 0.00 C ATOM 402 OD1 ASN A 26 -20.615 4.473 -10.456 1.00 0.00 O ATOM 403 ND2 ASN A 26 -21.665 4.329 -12.363 1.00 0.00 N ATOM 0 H ASN A 26 -21.245 7.535 -10.879 1.00 0.00 H new ATOM 0 HA ASN A 26 -18.728 6.127 -10.325 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -20.386 6.578 -12.856 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -19.017 5.490 -12.740 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -22.278 3.602 -11.994 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -21.773 4.647 -13.326 1.00 0.00 H new ATOM 410 N ASN A 27 -18.692 9.075 -11.497 1.00 0.00 N ATOM 411 CA ASN A 27 -17.805 10.161 -11.997 1.00 0.00 C ATOM 412 C ASN A 27 -17.327 9.822 -13.406 1.00 0.00 C ATOM 413 O ASN A 27 -16.279 10.257 -13.839 1.00 0.00 O ATOM 414 CB ASN A 27 -16.600 10.294 -11.072 1.00 0.00 C ATOM 415 CG ASN A 27 -17.068 10.219 -9.618 1.00 0.00 C ATOM 416 OD1 ASN A 27 -18.205 10.763 -9.279 1.00 0.00 O flip ATOM 417 ND2 ASN A 27 -16.393 9.653 -8.779 1.00 0.00 N flip ATOM 0 H ASN A 27 -19.586 9.386 -11.116 1.00 0.00 H new ATOM 0 HA ASN A 27 -18.357 11.101 -12.018 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -15.881 9.500 -11.276 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -16.090 11.240 -11.254 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -15.504 9.227 -9.042 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -16.716 9.604 -7.813 1.00 0.00 H new ATOM 424 N ALA A 28 -18.084 9.044 -14.126 1.00 0.00 N ATOM 425 CA ALA A 28 -17.671 8.676 -15.502 1.00 0.00 C ATOM 426 C ALA A 28 -16.338 7.922 -15.456 1.00 0.00 C ATOM 427 O ALA A 28 -15.965 7.270 -16.404 1.00 0.00 O ATOM 428 CB ALA A 28 -17.505 9.944 -16.342 1.00 0.00 C ATOM 0 H ALA A 28 -18.972 8.648 -13.818 1.00 0.00 H new ATOM 0 HA ALA A 28 -18.434 8.038 -15.948 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.201 9.673 -17.353 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.452 10.482 -16.379 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -16.743 10.581 -15.893 1.00 0.00 H new ATOM 434 N ILE A 29 -15.621 8.007 -14.364 1.00 0.00 N ATOM 435 CA ILE A 29 -14.309 7.298 -14.272 1.00 0.00 C ATOM 436 C ILE A 29 -14.384 6.160 -13.251 1.00 0.00 C ATOM 437 O ILE A 29 -14.923 6.311 -12.173 1.00 0.00 O ATOM 438 CB ILE A 29 -13.227 8.289 -13.845 1.00 0.00 C ATOM 439 CG1 ILE A 29 -13.149 9.430 -14.868 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.881 7.565 -13.753 1.00 0.00 C ATOM 441 CD1 ILE A 29 -11.804 9.400 -15.602 1.00 0.00 C ATOM 0 H ILE A 29 -15.887 8.536 -13.533 1.00 0.00 H new ATOM 0 HA ILE A 29 -14.067 6.879 -15.249 1.00 0.00 H new ATOM 0 HB ILE A 29 -13.472 8.706 -12.868 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.964 9.339 -15.586 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.274 10.388 -14.364 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -11.108 8.271 -13.448 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.949 6.762 -13.019 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -11.626 7.146 -14.726 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.765 10.216 -16.324 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -10.994 9.514 -14.882 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.695 8.449 -16.123 1.00 0.00 H new ATOM 453 N GLU A 30 -13.835 5.021 -13.587 1.00 0.00 N ATOM 454 CA GLU A 30 -13.858 3.867 -12.643 1.00 0.00 C ATOM 455 C GLU A 30 -12.467 3.231 -12.581 1.00 0.00 C ATOM 456 O GLU A 30 -11.681 3.349 -13.497 1.00 0.00 O ATOM 457 CB GLU A 30 -14.873 2.830 -13.126 1.00 0.00 C ATOM 458 CG GLU A 30 -16.270 3.452 -13.143 1.00 0.00 C ATOM 459 CD GLU A 30 -17.295 2.395 -13.555 1.00 0.00 C ATOM 460 OE1 GLU A 30 -18.477 2.688 -13.496 1.00 0.00 O ATOM 461 OE2 GLU A 30 -16.879 1.309 -13.923 1.00 0.00 O ATOM 0 H GLU A 30 -13.371 4.841 -14.477 1.00 0.00 H new ATOM 0 HA GLU A 30 -14.143 4.216 -11.650 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -14.606 2.482 -14.124 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.859 1.959 -12.470 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -16.516 3.847 -12.157 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -16.298 4.291 -13.838 1.00 0.00 H new ATOM 469 N PHE A 31 -12.156 2.552 -11.507 1.00 0.00 N ATOM 470 CA PHE A 31 -10.817 1.910 -11.395 1.00 0.00 C ATOM 471 C PHE A 31 -10.959 0.393 -11.452 1.00 0.00 C ATOM 472 O PHE A 31 -11.917 -0.178 -10.972 1.00 0.00 O ATOM 473 CB PHE A 31 -10.161 2.286 -10.071 1.00 0.00 C ATOM 474 CG PHE A 31 -9.818 3.755 -10.063 1.00 0.00 C ATOM 475 CD1 PHE A 31 -8.848 4.252 -10.937 1.00 0.00 C ATOM 476 CD2 PHE A 31 -10.462 4.616 -9.170 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.522 5.613 -10.922 1.00 0.00 C ATOM 478 CE2 PHE A 31 -10.134 5.973 -9.153 1.00 0.00 C ATOM 479 CZ PHE A 31 -9.166 6.475 -10.027 1.00 0.00 C ATOM 0 H PHE A 31 -12.772 2.416 -10.705 1.00 0.00 H new ATOM 0 HA PHE A 31 -10.201 2.258 -12.224 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.834 2.057 -9.245 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -9.259 1.693 -9.921 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -8.349 3.585 -11.625 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -11.212 4.232 -8.494 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -7.775 5.998 -11.600 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -10.630 6.638 -8.461 1.00 0.00 H new ATOM 0 HZ PHE A 31 -8.915 7.525 -10.012 1.00 0.00 H new ATOM 489 N LEU A 32 -9.999 -0.255 -12.038 1.00 0.00 N ATOM 490 CA LEU A 32 -10.041 -1.733 -12.144 1.00 0.00 C ATOM 491 C LEU A 32 -8.975 -2.329 -11.210 1.00 0.00 C ATOM 492 O LEU A 32 -7.789 -2.196 -11.439 1.00 0.00 O ATOM 493 CB LEU A 32 -9.789 -2.085 -13.614 1.00 0.00 C ATOM 494 CG LEU A 32 -9.176 -3.475 -13.773 1.00 0.00 C ATOM 495 CD1 LEU A 32 -10.250 -4.548 -13.606 1.00 0.00 C ATOM 496 CD2 LEU A 32 -8.584 -3.576 -15.174 1.00 0.00 C ATOM 0 H LEU A 32 -9.176 0.182 -12.453 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.003 -2.145 -11.840 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.729 -2.038 -14.164 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -9.124 -1.343 -14.056 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.407 -3.627 -13.015 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.800 -5.534 -13.722 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.695 -4.466 -12.614 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.022 -4.411 -14.363 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.140 -4.562 -15.311 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.371 -3.427 -15.913 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.817 -2.812 -15.301 1.00 0.00 H new ATOM 508 N LEU A 33 -9.399 -2.971 -10.151 1.00 0.00 N ATOM 509 CA LEU A 33 -8.430 -3.568 -9.178 1.00 0.00 C ATOM 510 C LEU A 33 -8.527 -5.091 -9.220 1.00 0.00 C ATOM 511 O LEU A 33 -9.458 -5.644 -9.768 1.00 0.00 O ATOM 512 CB LEU A 33 -8.775 -3.105 -7.764 1.00 0.00 C ATOM 513 CG LEU A 33 -8.359 -1.649 -7.564 1.00 0.00 C ATOM 514 CD1 LEU A 33 -9.153 -1.068 -6.399 1.00 0.00 C ATOM 515 CD2 LEU A 33 -6.864 -1.575 -7.239 1.00 0.00 C ATOM 0 H LEU A 33 -10.382 -3.109 -9.916 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.422 -3.250 -9.445 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.846 -3.211 -7.591 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.270 -3.738 -7.034 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.556 -1.084 -8.475 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.865 -0.028 -6.245 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.218 -1.121 -6.623 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -8.944 -1.640 -5.495 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.574 -0.534 -7.098 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.662 -2.135 -6.326 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.291 -2.003 -8.062 1.00 0.00 H new ATOM 527 N LEU A 34 -7.570 -5.778 -8.646 1.00 0.00 N ATOM 528 CA LEU A 34 -7.623 -7.268 -8.658 1.00 0.00 C ATOM 529 C LEU A 34 -7.475 -7.830 -7.242 1.00 0.00 C ATOM 530 O LEU A 34 -6.626 -7.410 -6.479 1.00 0.00 O ATOM 531 CB LEU A 34 -6.488 -7.823 -9.520 1.00 0.00 C ATOM 532 CG LEU A 34 -6.488 -7.171 -10.904 1.00 0.00 C ATOM 533 CD1 LEU A 34 -5.541 -7.949 -11.816 1.00 0.00 C ATOM 534 CD2 LEU A 34 -7.890 -7.201 -11.507 1.00 0.00 C ATOM 0 H LEU A 34 -6.762 -5.373 -8.174 1.00 0.00 H new ATOM 0 HA LEU A 34 -8.589 -7.565 -9.066 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.531 -7.644 -9.029 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.597 -8.903 -9.622 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.164 -6.135 -10.809 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -5.533 -7.493 -12.806 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.534 -7.928 -11.398 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.879 -8.982 -11.895 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.873 -6.733 -12.491 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -8.223 -8.234 -11.602 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -8.577 -6.657 -10.859 1.00 0.00 H new ATOM 546 N GLN A 35 -8.273 -8.813 -6.901 1.00 0.00 N ATOM 547 CA GLN A 35 -8.149 -9.436 -5.554 1.00 0.00 C ATOM 548 C GLN A 35 -7.454 -10.785 -5.725 1.00 0.00 C ATOM 549 O GLN A 35 -7.973 -11.684 -6.357 1.00 0.00 O ATOM 550 CB GLN A 35 -9.529 -9.652 -4.930 1.00 0.00 C ATOM 551 CG GLN A 35 -9.410 -9.599 -3.403 1.00 0.00 C ATOM 552 CD GLN A 35 -10.760 -9.937 -2.764 1.00 0.00 C ATOM 553 OE1 GLN A 35 -11.297 -11.004 -2.980 1.00 0.00 O ATOM 554 NE2 GLN A 35 -11.332 -9.065 -1.979 1.00 0.00 N ATOM 0 H GLN A 35 -9.001 -9.207 -7.497 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.576 -8.781 -4.897 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -10.222 -8.886 -5.279 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -9.935 -10.615 -5.241 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -8.651 -10.303 -3.064 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -9.087 -8.606 -3.089 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -10.880 -8.169 -1.798 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -12.231 -9.280 -1.547 1.00 0.00 H new ATOM 563 N ALA A 36 -6.276 -10.932 -5.190 1.00 0.00 N ATOM 564 CA ALA A 36 -5.546 -12.219 -5.350 1.00 0.00 C ATOM 565 C ALA A 36 -6.179 -13.304 -4.478 1.00 0.00 C ATOM 566 O ALA A 36 -6.408 -13.117 -3.300 1.00 0.00 O ATOM 567 CB ALA A 36 -4.085 -12.021 -4.950 1.00 0.00 C ATOM 0 H ALA A 36 -5.787 -10.218 -4.650 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.604 -12.535 -6.392 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.546 -12.961 -5.065 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.633 -11.262 -5.589 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.033 -11.698 -3.910 1.00 0.00 H new ATOM 573 N SER A 37 -6.456 -14.443 -5.053 1.00 0.00 N ATOM 574 CA SER A 37 -7.068 -15.550 -4.265 1.00 0.00 C ATOM 575 C SER A 37 -5.970 -16.501 -3.781 1.00 0.00 C ATOM 576 O SER A 37 -6.199 -17.360 -2.951 1.00 0.00 O ATOM 577 CB SER A 37 -8.056 -16.319 -5.144 1.00 0.00 C ATOM 578 OG SER A 37 -8.585 -17.414 -4.407 1.00 0.00 O ATOM 0 H SER A 37 -6.284 -14.655 -6.036 1.00 0.00 H new ATOM 0 HA SER A 37 -7.594 -15.134 -3.406 1.00 0.00 H new ATOM 0 HB2 SER A 37 -8.862 -15.660 -5.468 1.00 0.00 H new ATOM 0 HB3 SER A 37 -7.557 -16.678 -6.044 1.00 0.00 H new ATOM 0 HG SER A 37 -7.998 -17.611 -3.648 1.00 0.00 H new ATOM 584 N ASP A 38 -4.778 -16.355 -4.293 1.00 0.00 N ATOM 585 CA ASP A 38 -3.667 -17.251 -3.866 1.00 0.00 C ATOM 586 C ASP A 38 -2.946 -16.637 -2.665 1.00 0.00 C ATOM 587 O ASP A 38 -1.921 -17.124 -2.231 1.00 0.00 O ATOM 588 CB ASP A 38 -2.676 -17.415 -5.021 1.00 0.00 C ATOM 589 CG ASP A 38 -3.347 -18.175 -6.166 1.00 0.00 C ATOM 590 OD1 ASP A 38 -4.388 -18.766 -5.929 1.00 0.00 O ATOM 591 OD2 ASP A 38 -2.810 -18.152 -7.262 1.00 0.00 O ATOM 0 H ASP A 38 -4.526 -15.653 -4.989 1.00 0.00 H new ATOM 0 HA ASP A 38 -4.072 -18.224 -3.588 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -2.340 -16.438 -5.367 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -1.792 -17.954 -4.682 1.00 0.00 H new ATOM 597 N GLY A 39 -3.469 -15.567 -2.127 1.00 0.00 N ATOM 598 CA GLY A 39 -2.806 -14.919 -0.959 1.00 0.00 C ATOM 599 C GLY A 39 -3.790 -14.795 0.203 1.00 0.00 C ATOM 600 O GLY A 39 -4.447 -15.743 0.585 1.00 0.00 O ATOM 0 H GLY A 39 -4.326 -15.115 -2.446 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -1.940 -15.505 -0.651 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.439 -13.932 -1.241 1.00 0.00 H new ATOM 604 N ILE A 40 -3.885 -13.627 0.769 1.00 0.00 N ATOM 605 CA ILE A 40 -4.811 -13.413 1.914 1.00 0.00 C ATOM 606 C ILE A 40 -6.108 -12.777 1.417 1.00 0.00 C ATOM 607 O ILE A 40 -6.992 -12.463 2.188 1.00 0.00 O ATOM 608 CB ILE A 40 -4.144 -12.489 2.927 1.00 0.00 C ATOM 609 CG1 ILE A 40 -2.933 -11.804 2.285 1.00 0.00 C ATOM 610 CG2 ILE A 40 -3.675 -13.326 4.114 1.00 0.00 C ATOM 611 CD1 ILE A 40 -3.350 -11.085 0.998 1.00 0.00 C ATOM 0 H ILE A 40 -3.356 -12.803 0.485 1.00 0.00 H new ATOM 0 HA ILE A 40 -5.041 -14.370 2.383 1.00 0.00 H new ATOM 0 HB ILE A 40 -4.853 -11.729 3.255 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -2.498 -11.090 2.984 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -2.163 -12.543 2.064 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -3.195 -12.679 4.848 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -4.532 -13.821 4.571 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.963 -14.076 3.771 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -2.480 -10.603 0.552 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -3.764 -11.808 0.295 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -4.103 -10.332 1.230 1.00 0.00 H new ATOM 623 N HIS A 41 -6.223 -12.607 0.127 1.00 0.00 N ATOM 624 CA HIS A 41 -7.458 -12.012 -0.454 1.00 0.00 C ATOM 625 C HIS A 41 -7.417 -10.487 -0.316 1.00 0.00 C ATOM 626 O HIS A 41 -8.330 -9.874 0.201 1.00 0.00 O ATOM 627 CB HIS A 41 -8.691 -12.573 0.263 1.00 0.00 C ATOM 628 CG HIS A 41 -8.537 -14.060 0.477 1.00 0.00 C ATOM 629 ND1 HIS A 41 -7.448 -14.908 0.427 1.00 0.00 N flip ATOM 630 CD2 HIS A 41 -9.621 -14.862 0.809 1.00 0.00 C flip ATOM 631 CE1 HIS A 41 -7.859 -16.203 0.725 1.00 0.00 C flip ATOM 632 NE2 HIS A 41 -9.171 -16.124 0.946 1.00 0.00 N flip ATOM 0 H HIS A 41 -5.506 -12.858 -0.554 1.00 0.00 H new ATOM 0 HA HIS A 41 -7.516 -12.269 -1.512 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -8.823 -12.072 1.222 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -9.586 -12.374 -0.327 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -10.642 -14.533 0.935 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -7.243 -17.089 0.768 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -9.761 -16.920 1.189 1.00 0.00 H new ATOM 641 N HIS A 42 -6.368 -9.869 -0.793 1.00 0.00 N ATOM 642 CA HIS A 42 -6.267 -8.383 -0.711 1.00 0.00 C ATOM 643 C HIS A 42 -6.631 -7.788 -2.070 1.00 0.00 C ATOM 644 O HIS A 42 -6.751 -8.496 -3.046 1.00 0.00 O ATOM 645 CB HIS A 42 -4.832 -7.978 -0.359 1.00 0.00 C ATOM 646 CG HIS A 42 -3.867 -8.624 -1.323 1.00 0.00 C ATOM 647 ND1 HIS A 42 -2.716 -9.274 -0.893 1.00 0.00 N ATOM 648 CD2 HIS A 42 -3.863 -8.735 -2.695 1.00 0.00 C ATOM 649 CE1 HIS A 42 -2.080 -9.741 -1.981 1.00 0.00 C ATOM 650 NE2 HIS A 42 -2.737 -9.440 -3.100 1.00 0.00 N ATOM 0 H HIS A 42 -5.575 -10.332 -1.237 1.00 0.00 H new ATOM 0 HA HIS A 42 -6.946 -8.015 0.058 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -4.730 -6.894 -0.400 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -4.599 -8.282 0.662 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -4.619 -8.335 -3.355 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -1.152 -10.292 -1.952 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -2.469 -9.678 -4.055 1.00 0.00 H new ATOM 659 N TRP A 43 -6.802 -6.499 -2.148 1.00 0.00 N ATOM 660 CA TRP A 43 -7.150 -5.873 -3.456 1.00 0.00 C ATOM 661 C TRP A 43 -5.976 -5.029 -3.955 1.00 0.00 C ATOM 662 O TRP A 43 -5.347 -4.314 -3.200 1.00 0.00 O ATOM 663 CB TRP A 43 -8.369 -4.972 -3.293 1.00 0.00 C ATOM 664 CG TRP A 43 -9.624 -5.770 -3.442 1.00 0.00 C ATOM 665 CD1 TRP A 43 -10.430 -6.151 -2.426 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.238 -6.277 -4.661 1.00 0.00 C ATOM 667 NE1 TRP A 43 -11.498 -6.863 -2.945 1.00 0.00 N ATOM 668 CE2 TRP A 43 -11.422 -6.967 -4.318 1.00 0.00 C ATOM 669 CE3 TRP A 43 -9.880 -6.204 -6.018 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.223 -7.568 -5.288 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -10.681 -6.808 -6.998 1.00 0.00 C ATOM 672 CH2 TRP A 43 -11.852 -7.489 -6.631 1.00 0.00 C ATOM 0 H TRP A 43 -6.716 -5.851 -1.365 1.00 0.00 H new ATOM 0 HA TRP A 43 -7.370 -6.663 -4.174 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.348 -4.493 -2.314 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -8.345 -4.176 -4.038 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -10.267 -5.935 -1.380 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -12.249 -7.262 -2.381 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -8.982 -5.679 -6.308 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -13.124 -8.091 -5.002 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.396 -6.749 -8.038 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -12.467 -7.952 -7.389 1.00 0.00 H new ATOM 683 N THR A 44 -5.680 -5.097 -5.224 1.00 0.00 N ATOM 684 CA THR A 44 -4.556 -4.286 -5.770 1.00 0.00 C ATOM 685 C THR A 44 -4.600 -4.306 -7.297 1.00 0.00 C ATOM 686 O THR A 44 -5.044 -5.261 -7.902 1.00 0.00 O ATOM 687 CB THR A 44 -3.221 -4.868 -5.300 1.00 0.00 C ATOM 688 OG1 THR A 44 -2.186 -4.439 -6.174 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.293 -6.394 -5.305 1.00 0.00 C ATOM 0 H THR A 44 -6.168 -5.679 -5.906 1.00 0.00 H new ATOM 0 HA THR A 44 -4.653 -3.261 -5.414 1.00 0.00 H new ATOM 0 HB THR A 44 -3.012 -4.522 -4.288 1.00 0.00 H new ATOM 0 HG1 THR A 44 -1.330 -4.809 -5.874 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.340 -6.804 -4.970 1.00 0.00 H new ATOM 0 HG22 THR A 44 -4.086 -6.723 -4.634 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.504 -6.745 -6.315 1.00 0.00 H new ATOM 697 N PRO A 45 -4.124 -3.259 -7.914 1.00 0.00 N ATOM 698 CA PRO A 45 -4.085 -3.151 -9.396 1.00 0.00 C ATOM 699 C PRO A 45 -3.087 -4.136 -9.990 1.00 0.00 C ATOM 700 O PRO A 45 -2.236 -4.664 -9.300 1.00 0.00 O ATOM 701 CB PRO A 45 -3.637 -1.712 -9.655 1.00 0.00 C ATOM 702 CG PRO A 45 -2.905 -1.311 -8.423 1.00 0.00 C ATOM 703 CD PRO A 45 -3.570 -2.064 -7.269 1.00 0.00 C ATOM 0 HA PRO A 45 -5.047 -3.382 -9.853 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -2.995 -1.650 -10.534 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.491 -1.059 -9.837 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -1.848 -1.567 -8.497 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -2.962 -0.233 -8.269 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -2.851 -2.324 -6.492 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -4.349 -1.466 -6.795 1.00 0.00 H new ATOM 711 N PRO A 46 -3.200 -4.393 -11.254 1.00 0.00 N ATOM 712 CA PRO A 46 -2.300 -5.346 -11.955 1.00 0.00 C ATOM 713 C PRO A 46 -0.840 -4.875 -11.974 1.00 0.00 C ATOM 714 O PRO A 46 -0.423 -4.148 -12.853 1.00 0.00 O ATOM 715 CB PRO A 46 -2.866 -5.410 -13.374 1.00 0.00 C ATOM 716 CG PRO A 46 -3.722 -4.201 -13.545 1.00 0.00 C ATOM 717 CD PRO A 46 -4.193 -3.793 -12.155 1.00 0.00 C ATOM 0 HA PRO A 46 -2.274 -6.314 -11.454 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -2.063 -5.424 -14.111 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -3.448 -6.320 -13.519 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -3.161 -3.394 -14.015 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -4.572 -4.418 -14.193 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -4.227 -2.709 -12.047 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.196 -4.165 -11.948 1.00 0.00 H new ATOM 725 N LYS A 47 -0.053 -5.292 -11.012 1.00 0.00 N ATOM 726 CA LYS A 47 1.380 -4.875 -10.982 1.00 0.00 C ATOM 727 C LYS A 47 2.267 -6.092 -10.695 1.00 0.00 C ATOM 728 O LYS A 47 1.891 -6.990 -9.965 1.00 0.00 O ATOM 729 CB LYS A 47 1.585 -3.793 -9.908 1.00 0.00 C ATOM 730 CG LYS A 47 1.909 -4.422 -8.549 1.00 0.00 C ATOM 731 CD LYS A 47 3.427 -4.567 -8.403 1.00 0.00 C ATOM 732 CE LYS A 47 3.745 -5.467 -7.209 1.00 0.00 C ATOM 733 NZ LYS A 47 3.651 -6.894 -7.628 1.00 0.00 N ATOM 0 H LYS A 47 -0.343 -5.902 -10.248 1.00 0.00 H new ATOM 0 HA LYS A 47 1.658 -4.461 -11.951 1.00 0.00 H new ATOM 0 HB2 LYS A 47 2.395 -3.128 -10.207 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.686 -3.183 -9.825 1.00 0.00 H new ATOM 0 HG2 LYS A 47 1.513 -3.801 -7.745 1.00 0.00 H new ATOM 0 HG3 LYS A 47 1.430 -5.397 -8.464 1.00 0.00 H new ATOM 0 HD2 LYS A 47 3.851 -4.991 -9.313 1.00 0.00 H new ATOM 0 HD3 LYS A 47 3.884 -3.587 -8.264 1.00 0.00 H new ATOM 0 HE2 LYS A 47 4.745 -5.252 -6.833 1.00 0.00 H new ATOM 0 HE3 LYS A 47 3.049 -5.269 -6.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 3.328 -7.471 -6.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 2.974 -6.982 -8.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 4.586 -7.227 -7.939 1.00 0.00 H new ATOM 747 N GLY A 48 3.444 -6.132 -11.267 1.00 0.00 N ATOM 748 CA GLY A 48 4.353 -7.292 -11.027 1.00 0.00 C ATOM 749 C GLY A 48 5.790 -6.798 -10.821 1.00 0.00 C ATOM 750 O GLY A 48 6.107 -5.653 -11.078 1.00 0.00 O ATOM 0 H GLY A 48 3.814 -5.413 -11.889 1.00 0.00 H new ATOM 0 HA2 GLY A 48 4.022 -7.849 -10.150 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.313 -7.977 -11.874 1.00 0.00 H new ATOM 754 N HIS A 49 6.661 -7.659 -10.358 1.00 0.00 N ATOM 755 CA HIS A 49 8.082 -7.255 -10.125 1.00 0.00 C ATOM 756 C HIS A 49 8.793 -7.040 -11.463 1.00 0.00 C ATOM 757 O HIS A 49 8.303 -7.427 -12.506 1.00 0.00 O ATOM 758 CB HIS A 49 8.798 -8.351 -9.334 1.00 0.00 C ATOM 759 CG HIS A 49 10.289 -8.176 -9.446 1.00 0.00 C ATOM 760 ND1 HIS A 49 11.124 -7.137 -9.108 1.00 0.00 N flip ATOM 761 CD2 HIS A 49 11.109 -9.167 -9.963 1.00 0.00 C flip ATOM 762 CE1 HIS A 49 12.437 -7.482 -9.408 1.00 0.00 C flip ATOM 763 NE2 HIS A 49 12.375 -8.712 -9.918 1.00 0.00 N flip ATOM 0 H HIS A 49 6.448 -8.630 -10.130 1.00 0.00 H new ATOM 0 HA HIS A 49 8.101 -6.323 -9.560 1.00 0.00 H new ATOM 0 HB2 HIS A 49 8.497 -8.312 -8.287 1.00 0.00 H new ATOM 0 HB3 HIS A 49 8.509 -9.332 -9.712 1.00 0.00 H new ATOM 0 HD2 HIS A 49 10.790 -10.130 -10.335 1.00 0.00 H new ATOM 0 HE1 HIS A 49 13.321 -6.880 -9.259 1.00 0.00 H new ATOM 0 HE2 HIS A 49 13.186 -9.243 -10.235 1.00 0.00 H new ATOM 772 N VAL A 50 9.941 -6.420 -11.443 1.00 0.00 N ATOM 773 CA VAL A 50 10.675 -6.174 -12.717 1.00 0.00 C ATOM 774 C VAL A 50 11.760 -7.236 -12.918 1.00 0.00 C ATOM 775 O VAL A 50 12.587 -7.466 -12.059 1.00 0.00 O ATOM 776 CB VAL A 50 11.316 -4.776 -12.664 1.00 0.00 C ATOM 777 CG1 VAL A 50 12.830 -4.885 -12.446 1.00 0.00 C ATOM 778 CG2 VAL A 50 11.053 -4.039 -13.977 1.00 0.00 C ATOM 0 H VAL A 50 10.402 -6.074 -10.602 1.00 0.00 H new ATOM 0 HA VAL A 50 9.977 -6.229 -13.553 1.00 0.00 H new ATOM 0 HB VAL A 50 10.875 -4.226 -11.833 1.00 0.00 H new ATOM 0 HG11 VAL A 50 13.265 -3.886 -12.411 1.00 0.00 H new ATOM 0 HG12 VAL A 50 13.026 -5.399 -11.505 1.00 0.00 H new ATOM 0 HG13 VAL A 50 13.276 -5.447 -13.266 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.508 -3.049 -13.936 1.00 0.00 H new ATOM 0 HG22 VAL A 50 11.485 -4.603 -14.804 1.00 0.00 H new ATOM 0 HG23 VAL A 50 9.978 -3.938 -14.129 1.00 0.00 H new ATOM 788 N GLU A 51 11.778 -7.871 -14.059 1.00 0.00 N ATOM 789 CA GLU A 51 12.826 -8.894 -14.323 1.00 0.00 C ATOM 790 C GLU A 51 14.060 -8.174 -14.867 1.00 0.00 C ATOM 791 O GLU A 51 13.993 -7.016 -15.232 1.00 0.00 O ATOM 792 CB GLU A 51 12.325 -9.912 -15.360 1.00 0.00 C ATOM 793 CG GLU A 51 12.184 -11.297 -14.719 1.00 0.00 C ATOM 794 CD GLU A 51 12.490 -12.376 -15.762 1.00 0.00 C ATOM 795 OE1 GLU A 51 13.440 -12.200 -16.506 1.00 0.00 O ATOM 796 OE2 GLU A 51 11.767 -13.358 -15.795 1.00 0.00 O ATOM 0 H GLU A 51 11.112 -7.725 -14.818 1.00 0.00 H new ATOM 0 HA GLU A 51 13.066 -9.429 -13.404 1.00 0.00 H new ATOM 0 HB2 GLU A 51 11.364 -9.590 -15.761 1.00 0.00 H new ATOM 0 HB3 GLU A 51 13.020 -9.960 -16.198 1.00 0.00 H new ATOM 0 HG2 GLU A 51 12.866 -11.389 -13.874 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.174 -11.428 -14.330 1.00 0.00 H new ATOM 804 N PRO A 52 15.175 -8.841 -14.918 1.00 0.00 N ATOM 805 CA PRO A 52 16.436 -8.234 -15.423 1.00 0.00 C ATOM 806 C PRO A 52 16.391 -8.006 -16.934 1.00 0.00 C ATOM 807 O PRO A 52 17.389 -7.715 -17.562 1.00 0.00 O ATOM 808 CB PRO A 52 17.511 -9.257 -15.057 1.00 0.00 C ATOM 809 CG PRO A 52 16.796 -10.560 -14.926 1.00 0.00 C ATOM 810 CD PRO A 52 15.362 -10.240 -14.506 1.00 0.00 C ATOM 0 HA PRO A 52 16.620 -7.251 -14.989 1.00 0.00 H new ATOM 0 HB2 PRO A 52 18.282 -9.308 -15.826 1.00 0.00 H new ATOM 0 HB3 PRO A 52 18.008 -8.987 -14.125 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.809 -11.104 -15.870 1.00 0.00 H new ATOM 0 HG3 PRO A 52 17.283 -11.195 -14.185 1.00 0.00 H new ATOM 0 HD2 PRO A 52 14.646 -10.900 -14.996 1.00 0.00 H new ATOM 0 HD3 PRO A 52 15.224 -10.362 -13.432 1.00 0.00 H new ATOM 818 N GLY A 53 15.234 -8.142 -17.522 1.00 0.00 N ATOM 819 CA GLY A 53 15.117 -7.941 -18.994 1.00 0.00 C ATOM 820 C GLY A 53 13.989 -6.952 -19.312 1.00 0.00 C ATOM 821 O GLY A 53 13.992 -6.312 -20.345 1.00 0.00 O ATOM 0 H GLY A 53 14.365 -8.384 -17.047 1.00 0.00 H new ATOM 0 HA2 GLY A 53 16.060 -7.567 -19.392 1.00 0.00 H new ATOM 0 HA3 GLY A 53 14.921 -8.895 -19.483 1.00 0.00 H new ATOM 825 N GLU A 54 13.016 -6.823 -18.446 1.00 0.00 N ATOM 826 CA GLU A 54 11.895 -5.876 -18.728 1.00 0.00 C ATOM 827 C GLU A 54 12.191 -4.506 -18.111 1.00 0.00 C ATOM 828 O GLU A 54 13.005 -4.374 -17.218 1.00 0.00 O ATOM 829 CB GLU A 54 10.591 -6.416 -18.137 1.00 0.00 C ATOM 830 CG GLU A 54 10.896 -7.356 -16.969 1.00 0.00 C ATOM 831 CD GLU A 54 9.583 -7.764 -16.294 1.00 0.00 C ATOM 832 OE1 GLU A 54 8.539 -7.427 -16.825 1.00 0.00 O ATOM 833 OE2 GLU A 54 9.642 -8.398 -15.253 1.00 0.00 O ATOM 0 H GLU A 54 12.949 -7.328 -17.562 1.00 0.00 H new ATOM 0 HA GLU A 54 11.794 -5.774 -19.809 1.00 0.00 H new ATOM 0 HB2 GLU A 54 9.967 -5.590 -17.796 1.00 0.00 H new ATOM 0 HB3 GLU A 54 10.027 -6.947 -18.904 1.00 0.00 H new ATOM 0 HG2 GLU A 54 11.425 -8.240 -17.326 1.00 0.00 H new ATOM 0 HG3 GLU A 54 11.550 -6.862 -16.250 1.00 0.00 H new ATOM 841 N ASP A 55 11.525 -3.484 -18.583 1.00 0.00 N ATOM 842 CA ASP A 55 11.747 -2.116 -18.033 1.00 0.00 C ATOM 843 C ASP A 55 10.764 -1.870 -16.887 1.00 0.00 C ATOM 844 O ASP A 55 9.928 -2.698 -16.593 1.00 0.00 O ATOM 845 CB ASP A 55 11.504 -1.079 -19.130 1.00 0.00 C ATOM 846 CG ASP A 55 12.297 0.194 -18.827 1.00 0.00 C ATOM 847 OD1 ASP A 55 13.115 0.161 -17.922 1.00 0.00 O ATOM 848 OD2 ASP A 55 12.070 1.183 -19.504 1.00 0.00 O ATOM 0 H ASP A 55 10.833 -3.540 -19.330 1.00 0.00 H new ATOM 0 HA ASP A 55 12.771 -2.031 -17.670 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.803 -1.483 -20.097 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.441 -0.849 -19.196 1.00 0.00 H new ATOM 854 N ASP A 56 10.856 -0.741 -16.239 1.00 0.00 N ATOM 855 CA ASP A 56 9.920 -0.457 -15.114 1.00 0.00 C ATOM 856 C ASP A 56 8.483 -0.396 -15.644 1.00 0.00 C ATOM 857 O ASP A 56 7.641 -1.179 -15.255 1.00 0.00 O ATOM 858 CB ASP A 56 10.293 0.881 -14.471 1.00 0.00 C ATOM 859 CG ASP A 56 11.679 0.769 -13.832 1.00 0.00 C ATOM 860 OD1 ASP A 56 12.279 1.800 -13.581 1.00 0.00 O ATOM 861 OD2 ASP A 56 12.116 -0.348 -13.604 1.00 0.00 O ATOM 0 H ASP A 56 11.535 -0.006 -16.438 1.00 0.00 H new ATOM 0 HA ASP A 56 9.992 -1.249 -14.369 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.289 1.671 -15.222 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.554 1.154 -13.718 1.00 0.00 H new ATOM 867 N LEU A 57 8.188 0.513 -16.541 1.00 0.00 N ATOM 868 CA LEU A 57 6.800 0.577 -17.085 1.00 0.00 C ATOM 869 C LEU A 57 6.542 -0.659 -17.936 1.00 0.00 C ATOM 870 O LEU A 57 5.485 -1.259 -17.871 1.00 0.00 O ATOM 871 CB LEU A 57 6.612 1.832 -17.942 1.00 0.00 C ATOM 872 CG LEU A 57 5.260 1.758 -18.670 1.00 0.00 C ATOM 873 CD1 LEU A 57 4.117 2.032 -17.694 1.00 0.00 C ATOM 874 CD2 LEU A 57 5.219 2.796 -19.790 1.00 0.00 C ATOM 0 H LEU A 57 8.839 1.203 -16.914 1.00 0.00 H new ATOM 0 HA LEU A 57 6.096 0.616 -16.253 1.00 0.00 H new ATOM 0 HB2 LEU A 57 6.651 2.723 -17.315 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.423 1.916 -18.666 1.00 0.00 H new ATOM 0 HG LEU A 57 5.145 0.758 -19.088 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.166 1.976 -18.223 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.133 1.289 -16.897 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.236 3.027 -17.265 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.259 2.740 -20.303 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.347 3.793 -19.367 1.00 0.00 H new ATOM 0 HD23 LEU A 57 6.022 2.597 -20.500 1.00 0.00 H new ATOM 886 N GLU A 58 7.495 -1.059 -18.725 1.00 0.00 N ATOM 887 CA GLU A 58 7.285 -2.265 -19.559 1.00 0.00 C ATOM 888 C GLU A 58 6.868 -3.394 -18.625 1.00 0.00 C ATOM 889 O GLU A 58 6.062 -4.238 -18.963 1.00 0.00 O ATOM 890 CB GLU A 58 8.587 -2.620 -20.280 1.00 0.00 C ATOM 891 CG GLU A 58 8.943 -1.500 -21.264 1.00 0.00 C ATOM 892 CD GLU A 58 7.874 -1.418 -22.355 1.00 0.00 C ATOM 893 OE1 GLU A 58 7.827 -0.405 -23.034 1.00 0.00 O ATOM 894 OE2 GLU A 58 7.125 -2.370 -22.497 1.00 0.00 O ATOM 0 H GLU A 58 8.403 -0.606 -18.827 1.00 0.00 H new ATOM 0 HA GLU A 58 6.516 -2.095 -20.313 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.392 -2.754 -19.557 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.476 -3.565 -20.812 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.014 -0.548 -20.738 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.919 -1.691 -21.710 1.00 0.00 H new ATOM 902 N THR A 59 7.393 -3.389 -17.428 1.00 0.00 N ATOM 903 CA THR A 59 7.009 -4.429 -16.439 1.00 0.00 C ATOM 904 C THR A 59 5.556 -4.192 -16.035 1.00 0.00 C ATOM 905 O THR A 59 4.749 -5.100 -16.008 1.00 0.00 O ATOM 906 CB THR A 59 7.902 -4.315 -15.208 1.00 0.00 C ATOM 907 OG1 THR A 59 8.939 -5.282 -15.291 1.00 0.00 O ATOM 908 CG2 THR A 59 7.075 -4.550 -13.943 1.00 0.00 C ATOM 0 H THR A 59 8.073 -2.706 -17.095 1.00 0.00 H new ATOM 0 HA THR A 59 7.124 -5.422 -16.873 1.00 0.00 H new ATOM 0 HB THR A 59 8.337 -3.316 -15.166 1.00 0.00 H new ATOM 0 HG1 THR A 59 9.637 -4.962 -15.901 1.00 0.00 H new ATOM 0 HG21 THR A 59 7.718 -4.467 -13.067 1.00 0.00 H new ATOM 0 HG22 THR A 59 6.282 -3.804 -13.883 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.634 -5.546 -13.976 1.00 0.00 H new ATOM 916 N ALA A 60 5.209 -2.968 -15.739 1.00 0.00 N ATOM 917 CA ALA A 60 3.804 -2.678 -15.364 1.00 0.00 C ATOM 918 C ALA A 60 2.929 -3.094 -16.536 1.00 0.00 C ATOM 919 O ALA A 60 1.911 -3.734 -16.373 1.00 0.00 O ATOM 920 CB ALA A 60 3.633 -1.182 -15.104 1.00 0.00 C ATOM 0 H ALA A 60 5.837 -2.164 -15.742 1.00 0.00 H new ATOM 0 HA ALA A 60 3.528 -3.219 -14.459 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.598 -0.976 -14.829 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.292 -0.876 -14.291 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.886 -0.625 -16.006 1.00 0.00 H new ATOM 926 N LEU A 61 3.345 -2.760 -17.726 1.00 0.00 N ATOM 927 CA LEU A 61 2.567 -3.165 -18.921 1.00 0.00 C ATOM 928 C LEU A 61 2.539 -4.690 -18.970 1.00 0.00 C ATOM 929 O LEU A 61 1.536 -5.297 -19.285 1.00 0.00 O ATOM 930 CB LEU A 61 3.235 -2.594 -20.176 1.00 0.00 C ATOM 931 CG LEU A 61 2.932 -1.094 -20.266 1.00 0.00 C ATOM 932 CD1 LEU A 61 3.890 -0.422 -21.249 1.00 0.00 C ATOM 933 CD2 LEU A 61 1.498 -0.893 -20.758 1.00 0.00 C ATOM 0 H LEU A 61 4.191 -2.224 -17.919 1.00 0.00 H new ATOM 0 HA LEU A 61 1.547 -2.783 -18.872 1.00 0.00 H new ATOM 0 HB2 LEU A 61 4.312 -2.759 -20.137 1.00 0.00 H new ATOM 0 HB3 LEU A 61 2.866 -3.106 -21.065 1.00 0.00 H new ATOM 0 HG LEU A 61 3.055 -0.650 -19.278 1.00 0.00 H new ATOM 0 HD11 LEU A 61 3.666 0.643 -21.305 1.00 0.00 H new ATOM 0 HD12 LEU A 61 4.916 -0.559 -20.908 1.00 0.00 H new ATOM 0 HD13 LEU A 61 3.772 -0.870 -22.236 1.00 0.00 H new ATOM 0 HD21 LEU A 61 1.282 0.173 -20.822 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.384 -1.346 -21.743 1.00 0.00 H new ATOM 0 HD23 LEU A 61 0.805 -1.362 -20.060 1.00 0.00 H new ATOM 945 N ARG A 62 3.633 -5.312 -18.621 1.00 0.00 N ATOM 946 CA ARG A 62 3.679 -6.801 -18.603 1.00 0.00 C ATOM 947 C ARG A 62 2.702 -7.317 -17.548 1.00 0.00 C ATOM 948 O ARG A 62 1.896 -8.188 -17.803 1.00 0.00 O ATOM 949 CB ARG A 62 5.099 -7.246 -18.245 1.00 0.00 C ATOM 950 CG ARG A 62 5.148 -8.760 -18.052 1.00 0.00 C ATOM 951 CD ARG A 62 6.494 -9.134 -17.430 1.00 0.00 C ATOM 952 NE ARG A 62 6.543 -10.603 -17.188 1.00 0.00 N ATOM 953 CZ ARG A 62 7.024 -11.400 -18.098 1.00 0.00 C ATOM 954 NH1 ARG A 62 7.442 -10.918 -19.238 1.00 0.00 N ATOM 955 NH2 ARG A 62 7.080 -12.682 -17.874 1.00 0.00 N ATOM 0 H ARG A 62 4.500 -4.850 -18.347 1.00 0.00 H new ATOM 0 HA ARG A 62 3.403 -7.198 -19.580 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.790 -6.951 -19.035 1.00 0.00 H new ATOM 0 HB3 ARG A 62 5.425 -6.746 -17.333 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.331 -9.085 -17.408 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.020 -9.267 -19.009 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.307 -8.837 -18.093 1.00 0.00 H new ATOM 0 HD3 ARG A 62 6.635 -8.596 -16.492 1.00 0.00 H new ATOM 0 HE ARG A 62 6.199 -10.985 -16.307 1.00 0.00 H new ATOM 0 HH11 ARG A 62 7.392 -9.915 -19.417 1.00 0.00 H new ATOM 0 HH12 ARG A 62 7.818 -11.545 -19.949 1.00 0.00 H new ATOM 0 HH21 ARG A 62 6.747 -13.060 -16.987 1.00 0.00 H new ATOM 0 HH22 ARG A 62 7.457 -13.308 -18.586 1.00 0.00 H new ATOM 969 N ALA A 63 2.762 -6.775 -16.360 1.00 0.00 N ATOM 970 CA ALA A 63 1.832 -7.223 -15.291 1.00 0.00 C ATOM 971 C ALA A 63 0.421 -6.787 -15.657 1.00 0.00 C ATOM 972 O ALA A 63 -0.531 -7.519 -15.496 1.00 0.00 O ATOM 973 CB ALA A 63 2.232 -6.585 -13.963 1.00 0.00 C ATOM 0 H ALA A 63 3.416 -6.042 -16.087 1.00 0.00 H new ATOM 0 HA ALA A 63 1.875 -8.308 -15.194 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.549 -6.915 -13.180 1.00 0.00 H new ATOM 0 HB2 ALA A 63 3.248 -6.884 -13.707 1.00 0.00 H new ATOM 0 HB3 ALA A 63 2.185 -5.500 -14.052 1.00 0.00 H new ATOM 979 N THR A 64 0.284 -5.600 -16.170 1.00 0.00 N ATOM 980 CA THR A 64 -1.063 -5.123 -16.563 1.00 0.00 C ATOM 981 C THR A 64 -1.674 -6.162 -17.489 1.00 0.00 C ATOM 982 O THR A 64 -2.813 -6.563 -17.339 1.00 0.00 O ATOM 983 CB THR A 64 -0.917 -3.789 -17.285 1.00 0.00 C ATOM 984 OG1 THR A 64 -0.198 -2.895 -16.453 1.00 0.00 O ATOM 985 CG2 THR A 64 -2.291 -3.204 -17.581 1.00 0.00 C ATOM 0 H THR A 64 1.046 -4.942 -16.333 1.00 0.00 H new ATOM 0 HA THR A 64 -1.704 -4.985 -15.693 1.00 0.00 H new ATOM 0 HB THR A 64 -0.385 -3.940 -18.224 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.717 -3.225 -16.332 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.177 -2.251 -18.097 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.852 -3.894 -18.212 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.829 -3.048 -16.646 1.00 0.00 H new ATOM 993 N GLN A 65 -0.907 -6.620 -18.430 1.00 0.00 N ATOM 994 CA GLN A 65 -1.400 -7.660 -19.364 1.00 0.00 C ATOM 995 C GLN A 65 -1.416 -9.016 -18.657 1.00 0.00 C ATOM 996 O GLN A 65 -2.388 -9.734 -18.688 1.00 0.00 O ATOM 997 CB GLN A 65 -0.461 -7.729 -20.564 1.00 0.00 C ATOM 998 CG GLN A 65 -1.012 -8.716 -21.590 1.00 0.00 C ATOM 999 CD GLN A 65 -0.095 -8.744 -22.813 1.00 0.00 C ATOM 1000 OE1 GLN A 65 0.798 -7.928 -22.935 1.00 0.00 O ATOM 1001 NE2 GLN A 65 -0.275 -9.657 -23.730 1.00 0.00 N ATOM 0 H GLN A 65 0.052 -6.314 -18.594 1.00 0.00 H new ATOM 0 HA GLN A 65 -2.409 -7.412 -19.693 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.357 -6.742 -21.014 1.00 0.00 H new ATOM 0 HB3 GLN A 65 0.533 -8.040 -20.243 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -1.082 -9.712 -21.152 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -2.020 -8.426 -21.885 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -1.024 -10.342 -23.628 1.00 0.00 H new ATOM 0 HE22 GLN A 65 0.334 -9.685 -24.548 1.00 0.00 H new ATOM 1010 N GLU A 66 -0.329 -9.376 -18.035 1.00 0.00 N ATOM 1011 CA GLU A 66 -0.263 -10.698 -17.347 1.00 0.00 C ATOM 1012 C GLU A 66 -1.192 -10.740 -16.129 1.00 0.00 C ATOM 1013 O GLU A 66 -1.748 -11.769 -15.805 1.00 0.00 O ATOM 1014 CB GLU A 66 1.176 -10.962 -16.898 1.00 0.00 C ATOM 1015 CG GLU A 66 2.047 -11.249 -18.122 1.00 0.00 C ATOM 1016 CD GLU A 66 3.473 -11.573 -17.673 1.00 0.00 C ATOM 1017 OE1 GLU A 66 3.747 -11.435 -16.492 1.00 0.00 O ATOM 1018 OE2 GLU A 66 4.265 -11.951 -18.518 1.00 0.00 O ATOM 0 H GLU A 66 0.519 -8.812 -17.972 1.00 0.00 H new ATOM 0 HA GLU A 66 -0.587 -11.466 -18.049 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.564 -10.099 -16.357 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.205 -11.808 -16.211 1.00 0.00 H new ATOM 0 HG2 GLU A 66 1.634 -12.085 -18.687 1.00 0.00 H new ATOM 0 HG3 GLU A 66 2.052 -10.386 -18.788 1.00 0.00 H new ATOM 1026 N GLU A 67 -1.348 -9.649 -15.430 1.00 0.00 N ATOM 1027 CA GLU A 67 -2.220 -9.672 -14.218 1.00 0.00 C ATOM 1028 C GLU A 67 -3.704 -9.562 -14.596 1.00 0.00 C ATOM 1029 O GLU A 67 -4.467 -10.486 -14.394 1.00 0.00 O ATOM 1030 CB GLU A 67 -1.847 -8.504 -13.308 1.00 0.00 C ATOM 1031 CG GLU A 67 -0.407 -8.658 -12.825 1.00 0.00 C ATOM 1032 CD GLU A 67 -0.280 -9.921 -11.972 1.00 0.00 C ATOM 1033 OE1 GLU A 67 -1.304 -10.454 -11.579 1.00 0.00 O ATOM 1034 OE2 GLU A 67 0.841 -10.329 -11.719 1.00 0.00 O ATOM 0 H GLU A 67 -0.915 -8.750 -15.641 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.066 -10.621 -13.704 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.960 -7.563 -13.846 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -2.524 -8.467 -12.454 1.00 0.00 H new ATOM 0 HG2 GLU A 67 0.269 -8.715 -13.678 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.113 -7.784 -12.244 1.00 0.00 H new ATOM 1042 N ALA A 68 -4.128 -8.445 -15.124 1.00 0.00 N ATOM 1043 CA ALA A 68 -5.573 -8.304 -15.479 1.00 0.00 C ATOM 1044 C ALA A 68 -5.816 -8.806 -16.902 1.00 0.00 C ATOM 1045 O ALA A 68 -6.940 -8.879 -17.354 1.00 0.00 O ATOM 1046 CB ALA A 68 -5.989 -6.840 -15.381 1.00 0.00 C ATOM 0 H ALA A 68 -3.545 -7.632 -15.324 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.165 -8.898 -14.783 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.043 -6.743 -15.641 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.832 -6.485 -14.363 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.389 -6.245 -16.069 1.00 0.00 H new ATOM 1052 N GLY A 69 -4.783 -9.169 -17.609 1.00 0.00 N ATOM 1053 CA GLY A 69 -4.984 -9.682 -18.993 1.00 0.00 C ATOM 1054 C GLY A 69 -5.174 -8.520 -19.968 1.00 0.00 C ATOM 1055 O GLY A 69 -5.651 -8.711 -21.069 1.00 0.00 O ATOM 0 H GLY A 69 -3.814 -9.133 -17.292 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.125 -10.281 -19.294 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -5.855 -10.336 -19.022 1.00 0.00 H new ATOM 1059 N ILE A 70 -4.817 -7.320 -19.591 1.00 0.00 N ATOM 1060 CA ILE A 70 -5.009 -6.187 -20.534 1.00 0.00 C ATOM 1061 C ILE A 70 -3.669 -5.800 -21.160 1.00 0.00 C ATOM 1062 O ILE A 70 -2.730 -5.448 -20.474 1.00 0.00 O ATOM 1063 CB ILE A 70 -5.562 -4.975 -19.796 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -6.754 -5.381 -18.932 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -6.032 -3.952 -20.825 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -7.088 -4.233 -17.983 1.00 0.00 C ATOM 0 H ILE A 70 -4.408 -7.081 -18.687 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.710 -6.500 -21.308 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.783 -4.555 -19.159 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -7.614 -5.613 -19.560 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -6.520 -6.283 -18.366 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.431 -3.077 -20.312 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.191 -3.653 -21.451 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -6.810 -4.394 -21.448 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -7.938 -4.511 -17.360 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.227 -4.023 -17.349 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.338 -3.344 -18.562 1.00 0.00 H new ATOM 1078 N GLU A 71 -3.575 -5.846 -22.461 1.00 0.00 N ATOM 1079 CA GLU A 71 -2.299 -5.470 -23.127 1.00 0.00 C ATOM 1080 C GLU A 71 -2.277 -3.966 -23.374 1.00 0.00 C ATOM 1081 O GLU A 71 -3.299 -3.309 -23.364 1.00 0.00 O ATOM 1082 CB GLU A 71 -2.177 -6.203 -24.463 1.00 0.00 C ATOM 1083 CG GLU A 71 -3.297 -5.750 -25.402 1.00 0.00 C ATOM 1084 CD GLU A 71 -3.202 -6.518 -26.721 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -2.227 -7.231 -26.899 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -4.102 -6.379 -27.532 1.00 0.00 O ATOM 0 H GLU A 71 -4.327 -6.128 -23.090 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.464 -5.748 -22.484 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.206 -5.999 -24.914 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -2.235 -7.280 -24.305 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -4.268 -5.924 -24.937 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -3.219 -4.679 -25.587 1.00 0.00 H new ATOM 1094 N ALA A 72 -1.122 -3.413 -23.599 1.00 0.00 N ATOM 1095 CA ALA A 72 -1.039 -1.951 -23.851 1.00 0.00 C ATOM 1096 C ALA A 72 -1.746 -1.632 -25.166 1.00 0.00 C ATOM 1097 O ALA A 72 -2.163 -0.514 -25.408 1.00 0.00 O ATOM 1098 CB ALA A 72 0.423 -1.519 -23.937 1.00 0.00 C ATOM 0 H ALA A 72 -0.231 -3.910 -23.619 1.00 0.00 H new ATOM 0 HA ALA A 72 -1.518 -1.413 -23.033 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.475 -0.446 -24.122 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.927 -1.750 -22.998 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.912 -2.052 -24.752 1.00 0.00 H new ATOM 1104 N GLY A 73 -1.884 -2.608 -26.020 1.00 0.00 N ATOM 1105 CA GLY A 73 -2.564 -2.371 -27.323 1.00 0.00 C ATOM 1106 C GLY A 73 -3.937 -1.745 -27.079 1.00 0.00 C ATOM 1107 O GLY A 73 -4.416 -0.956 -27.868 1.00 0.00 O ATOM 0 H GLY A 73 -1.554 -3.562 -25.871 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -1.959 -1.713 -27.946 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -2.673 -3.311 -27.864 1.00 0.00 H new ATOM 1111 N GLN A 74 -4.581 -2.090 -25.993 1.00 0.00 N ATOM 1112 CA GLN A 74 -5.924 -1.509 -25.714 1.00 0.00 C ATOM 1113 C GLN A 74 -5.814 -0.439 -24.622 1.00 0.00 C ATOM 1114 O GLN A 74 -6.791 0.181 -24.252 1.00 0.00 O ATOM 1115 CB GLN A 74 -6.886 -2.615 -25.280 1.00 0.00 C ATOM 1116 CG GLN A 74 -6.303 -3.382 -24.096 1.00 0.00 C ATOM 1117 CD GLN A 74 -7.160 -4.619 -23.833 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -6.624 -5.663 -23.267 1.00 0.00 O flip ATOM 1119 NE2 GLN A 74 -8.331 -4.640 -24.159 1.00 0.00 N flip ATOM 0 H GLN A 74 -4.235 -2.746 -25.292 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.310 -1.043 -26.621 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.849 -2.183 -25.005 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -7.068 -3.297 -26.111 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.274 -3.675 -24.307 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -6.278 -2.746 -23.211 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -8.752 -3.823 -24.602 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -8.893 -5.474 -23.989 1.00 0.00 H new ATOM 1128 N LEU A 75 -4.632 -0.207 -24.113 1.00 0.00 N ATOM 1129 CA LEU A 75 -4.469 0.838 -23.059 1.00 0.00 C ATOM 1130 C LEU A 75 -3.667 2.016 -23.603 1.00 0.00 C ATOM 1131 O LEU A 75 -2.755 1.859 -24.391 1.00 0.00 O ATOM 1132 CB LEU A 75 -3.682 0.295 -21.863 1.00 0.00 C ATOM 1133 CG LEU A 75 -4.400 -0.883 -21.216 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -3.446 -1.556 -20.227 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -5.626 -0.365 -20.460 1.00 0.00 C ATOM 0 H LEU A 75 -3.776 -0.693 -24.380 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.471 1.142 -22.756 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -2.690 -0.016 -22.189 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.542 1.087 -21.127 1.00 0.00 H new ATOM 0 HG LEU A 75 -4.713 -1.598 -21.977 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -3.947 -2.402 -19.756 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.561 -1.908 -20.757 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.149 -0.838 -19.462 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -6.146 -1.202 -19.994 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -5.309 0.339 -19.691 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.298 0.137 -21.156 1.00 0.00 H new ATOM 1147 N THR A 76 -3.963 3.185 -23.126 1.00 0.00 N ATOM 1148 CA THR A 76 -3.191 4.383 -23.527 1.00 0.00 C ATOM 1149 C THR A 76 -2.646 4.974 -22.229 1.00 0.00 C ATOM 1150 O THR A 76 -3.392 5.267 -21.318 1.00 0.00 O ATOM 1151 CB THR A 76 -4.102 5.385 -24.253 1.00 0.00 C ATOM 1152 OG1 THR A 76 -3.409 5.924 -25.370 1.00 0.00 O ATOM 1153 CG2 THR A 76 -4.502 6.519 -23.309 1.00 0.00 C ATOM 0 H THR A 76 -4.719 3.364 -22.465 1.00 0.00 H new ATOM 0 HA THR A 76 -2.384 4.138 -24.218 1.00 0.00 H new ATOM 0 HB THR A 76 -5.002 4.869 -24.587 1.00 0.00 H new ATOM 0 HG1 THR A 76 -3.988 6.563 -25.837 1.00 0.00 H new ATOM 0 HG21 THR A 76 -5.147 7.221 -23.837 1.00 0.00 H new ATOM 0 HG22 THR A 76 -5.037 6.108 -22.453 1.00 0.00 H new ATOM 0 HG23 THR A 76 -3.608 7.037 -22.963 1.00 0.00 H new ATOM 1161 N ILE A 77 -1.359 5.109 -22.099 1.00 0.00 N ATOM 1162 CA ILE A 77 -0.826 5.633 -20.814 1.00 0.00 C ATOM 1163 C ILE A 77 -0.956 7.145 -20.757 1.00 0.00 C ATOM 1164 O ILE A 77 -0.234 7.871 -21.412 1.00 0.00 O ATOM 1165 CB ILE A 77 0.644 5.260 -20.647 1.00 0.00 C ATOM 1166 CG1 ILE A 77 0.814 3.747 -20.829 1.00 0.00 C ATOM 1167 CG2 ILE A 77 1.099 5.679 -19.239 1.00 0.00 C ATOM 1168 CD1 ILE A 77 1.267 3.113 -19.514 1.00 0.00 C ATOM 0 H ILE A 77 -0.664 4.884 -22.811 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.409 5.186 -20.009 1.00 0.00 H new ATOM 0 HB ILE A 77 1.250 5.771 -21.395 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.127 3.303 -21.152 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.546 3.546 -21.611 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.149 5.419 -19.103 1.00 0.00 H new ATOM 0 HG22 ILE A 77 0.974 6.755 -19.121 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.497 5.160 -18.493 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.386 2.038 -19.650 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.219 3.548 -19.210 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.520 3.301 -18.743 1.00 0.00 H new ATOM 1180 N ILE A 78 -1.840 7.629 -19.936 1.00 0.00 N ATOM 1181 CA ILE A 78 -1.976 9.096 -19.792 1.00 0.00 C ATOM 1182 C ILE A 78 -0.656 9.607 -19.252 1.00 0.00 C ATOM 1183 O ILE A 78 -0.260 10.733 -19.475 1.00 0.00 O ATOM 1184 CB ILE A 78 -3.071 9.420 -18.776 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -4.447 9.230 -19.411 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -2.908 10.864 -18.306 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -4.600 7.773 -19.839 1.00 0.00 C ATOM 0 H ILE A 78 -2.472 7.072 -19.361 1.00 0.00 H new ATOM 0 HA ILE A 78 -2.231 9.553 -20.748 1.00 0.00 H new ATOM 0 HB ILE A 78 -2.985 8.747 -17.923 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -5.229 9.498 -18.701 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -4.559 9.889 -20.272 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.687 11.101 -17.581 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -1.930 10.987 -17.841 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -2.991 11.536 -19.160 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -5.580 7.628 -20.294 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.824 7.523 -20.562 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.505 7.126 -18.967 1.00 0.00 H new ATOM 1199 N GLU A 79 0.004 8.769 -18.509 1.00 0.00 N ATOM 1200 CA GLU A 79 1.294 9.161 -17.894 1.00 0.00 C ATOM 1201 C GLU A 79 1.017 10.299 -16.931 1.00 0.00 C ATOM 1202 O GLU A 79 0.232 10.166 -16.014 1.00 0.00 O ATOM 1203 CB GLU A 79 2.288 9.614 -18.970 1.00 0.00 C ATOM 1204 CG GLU A 79 2.653 8.421 -19.849 1.00 0.00 C ATOM 1205 CD GLU A 79 3.736 8.829 -20.849 1.00 0.00 C ATOM 1206 OE1 GLU A 79 4.004 10.014 -20.949 1.00 0.00 O ATOM 1207 OE2 GLU A 79 4.280 7.949 -21.496 1.00 0.00 O ATOM 0 H GLU A 79 -0.300 7.818 -18.300 1.00 0.00 H new ATOM 0 HA GLU A 79 1.734 8.312 -17.371 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.850 10.407 -19.576 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.184 10.026 -18.505 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.008 7.596 -19.231 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.770 8.065 -20.380 1.00 0.00 H new ATOM 1215 N GLY A 80 1.630 11.419 -17.134 1.00 0.00 N ATOM 1216 CA GLY A 80 1.376 12.566 -16.225 1.00 0.00 C ATOM 1217 C GLY A 80 1.774 12.184 -14.800 1.00 0.00 C ATOM 1218 O GLY A 80 2.631 12.802 -14.201 1.00 0.00 O ATOM 0 H GLY A 80 2.295 11.595 -17.887 1.00 0.00 H new ATOM 0 HA2 GLY A 80 1.945 13.436 -16.552 1.00 0.00 H new ATOM 0 HA3 GLY A 80 0.322 12.844 -16.258 1.00 0.00 H new ATOM 1222 N PHE A 81 1.155 11.172 -14.245 1.00 0.00 N ATOM 1223 CA PHE A 81 1.509 10.764 -12.858 1.00 0.00 C ATOM 1224 C PHE A 81 2.358 9.488 -12.895 1.00 0.00 C ATOM 1225 O PHE A 81 1.929 8.458 -13.373 1.00 0.00 O ATOM 1226 CB PHE A 81 0.228 10.490 -12.064 1.00 0.00 C ATOM 1227 CG PHE A 81 0.568 10.327 -10.602 1.00 0.00 C ATOM 1228 CD1 PHE A 81 0.938 9.072 -10.105 1.00 0.00 C ATOM 1229 CD2 PHE A 81 0.513 11.431 -9.745 1.00 0.00 C ATOM 1230 CE1 PHE A 81 1.254 8.922 -8.748 1.00 0.00 C ATOM 1231 CE2 PHE A 81 0.827 11.283 -8.391 1.00 0.00 C ATOM 1232 CZ PHE A 81 1.199 10.028 -7.891 1.00 0.00 C ATOM 0 H PHE A 81 0.425 10.616 -14.691 1.00 0.00 H new ATOM 0 HA PHE A 81 2.075 11.565 -12.382 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -0.477 11.311 -12.195 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -0.259 9.589 -12.438 1.00 0.00 H new ATOM 0 HD1 PHE A 81 0.980 8.220 -10.767 1.00 0.00 H new ATOM 0 HD2 PHE A 81 0.228 12.399 -10.130 1.00 0.00 H new ATOM 0 HE1 PHE A 81 1.540 7.954 -8.363 1.00 0.00 H new ATOM 0 HE2 PHE A 81 0.783 12.136 -7.730 1.00 0.00 H new ATOM 0 HZ PHE A 81 1.443 9.914 -6.845 1.00 0.00 H new ATOM 1242 N LYS A 82 3.551 9.548 -12.369 1.00 0.00 N ATOM 1243 CA LYS A 82 4.430 8.345 -12.346 1.00 0.00 C ATOM 1244 C LYS A 82 5.340 8.428 -11.133 1.00 0.00 C ATOM 1245 O LYS A 82 6.190 9.288 -11.049 1.00 0.00 O ATOM 1246 CB LYS A 82 5.295 8.286 -13.608 1.00 0.00 C ATOM 1247 CG LYS A 82 6.281 7.108 -13.518 1.00 0.00 C ATOM 1248 CD LYS A 82 7.502 7.490 -12.667 1.00 0.00 C ATOM 1249 CE LYS A 82 8.656 6.534 -12.975 1.00 0.00 C ATOM 1250 NZ LYS A 82 9.902 7.038 -12.335 1.00 0.00 N ATOM 0 H LYS A 82 3.957 10.385 -11.951 1.00 0.00 H new ATOM 0 HA LYS A 82 3.807 7.452 -12.302 1.00 0.00 H new ATOM 0 HB2 LYS A 82 4.661 8.174 -14.488 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.843 9.221 -13.727 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.783 6.242 -13.082 1.00 0.00 H new ATOM 0 HG3 LYS A 82 6.604 6.819 -14.518 1.00 0.00 H new ATOM 0 HD2 LYS A 82 7.800 8.517 -12.879 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.250 7.443 -11.608 1.00 0.00 H new ATOM 0 HE2 LYS A 82 8.423 5.535 -12.606 1.00 0.00 H new ATOM 0 HE3 LYS A 82 8.796 6.451 -14.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 10.687 6.388 -12.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 10.126 7.983 -12.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 9.765 7.095 -11.306 1.00 0.00 H new ATOM 1264 N ARG A 83 5.184 7.536 -10.201 1.00 0.00 N ATOM 1265 CA ARG A 83 6.062 7.557 -8.999 1.00 0.00 C ATOM 1266 C ARG A 83 6.196 6.140 -8.452 1.00 0.00 C ATOM 1267 O ARG A 83 5.545 5.226 -8.912 1.00 0.00 O ATOM 1268 CB ARG A 83 5.473 8.475 -7.922 1.00 0.00 C ATOM 1269 CG ARG A 83 5.589 9.941 -8.357 1.00 0.00 C ATOM 1270 CD ARG A 83 7.062 10.306 -8.562 1.00 0.00 C ATOM 1271 NE ARG A 83 7.365 11.589 -7.872 1.00 0.00 N ATOM 1272 CZ ARG A 83 8.531 12.154 -8.034 1.00 0.00 C ATOM 1273 NH1 ARG A 83 9.419 11.604 -8.817 1.00 0.00 N ATOM 1274 NH2 ARG A 83 8.809 13.269 -7.415 1.00 0.00 N ATOM 0 H ARG A 83 4.487 6.792 -10.217 1.00 0.00 H new ATOM 0 HA ARG A 83 7.044 7.939 -9.280 1.00 0.00 H new ATOM 0 HB2 ARG A 83 4.427 8.221 -7.749 1.00 0.00 H new ATOM 0 HB3 ARG A 83 5.998 8.325 -6.979 1.00 0.00 H new ATOM 0 HG2 ARG A 83 5.033 10.101 -9.281 1.00 0.00 H new ATOM 0 HG3 ARG A 83 5.146 10.590 -7.602 1.00 0.00 H new ATOM 0 HD2 ARG A 83 7.700 9.513 -8.172 1.00 0.00 H new ATOM 0 HD3 ARG A 83 7.279 10.395 -9.626 1.00 0.00 H new ATOM 0 HE ARG A 83 6.664 12.026 -7.274 1.00 0.00 H new ATOM 0 HH11 ARG A 83 9.202 10.733 -9.302 1.00 0.00 H new ATOM 0 HH12 ARG A 83 10.330 12.045 -8.944 1.00 0.00 H new ATOM 0 HH21 ARG A 83 8.115 13.700 -6.804 1.00 0.00 H new ATOM 0 HH22 ARG A 83 9.720 13.709 -7.542 1.00 0.00 H new ATOM 1288 N GLU A 84 7.041 5.948 -7.484 1.00 0.00 N ATOM 1289 CA GLU A 84 7.221 4.584 -6.929 1.00 0.00 C ATOM 1290 C GLU A 84 6.215 4.327 -5.805 1.00 0.00 C ATOM 1291 O GLU A 84 6.431 4.698 -4.668 1.00 0.00 O ATOM 1292 CB GLU A 84 8.641 4.442 -6.375 1.00 0.00 C ATOM 1293 CG GLU A 84 9.648 4.384 -7.525 1.00 0.00 C ATOM 1294 CD GLU A 84 11.065 4.262 -6.957 1.00 0.00 C ATOM 1295 OE1 GLU A 84 11.982 4.075 -7.740 1.00 0.00 O ATOM 1296 OE2 GLU A 84 11.206 4.350 -5.749 1.00 0.00 O ATOM 0 H GLU A 84 7.613 6.674 -7.054 1.00 0.00 H new ATOM 0 HA GLU A 84 7.057 3.858 -7.725 1.00 0.00 H new ATOM 0 HB2 GLU A 84 8.871 5.283 -5.721 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.715 3.539 -5.770 1.00 0.00 H new ATOM 0 HG2 GLU A 84 9.429 3.534 -8.171 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.567 5.281 -8.139 1.00 0.00 H new ATOM 1304 N LEU A 85 5.143 3.646 -6.107 1.00 0.00 N ATOM 1305 CA LEU A 85 4.152 3.311 -5.050 1.00 0.00 C ATOM 1306 C LEU A 85 4.809 2.241 -4.187 1.00 0.00 C ATOM 1307 O LEU A 85 5.362 1.294 -4.701 1.00 0.00 O ATOM 1308 CB LEU A 85 2.886 2.736 -5.699 1.00 0.00 C ATOM 1309 CG LEU A 85 1.666 2.964 -4.788 1.00 0.00 C ATOM 1310 CD1 LEU A 85 0.741 4.019 -5.395 1.00 0.00 C ATOM 1311 CD2 LEU A 85 0.875 1.661 -4.637 1.00 0.00 C ATOM 0 H LEU A 85 4.912 3.308 -7.041 1.00 0.00 H new ATOM 0 HA LEU A 85 3.871 4.188 -4.466 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.719 3.209 -6.667 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.016 1.670 -5.883 1.00 0.00 H new ATOM 0 HG LEU A 85 2.025 3.301 -3.816 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.117 4.170 -4.740 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.283 4.958 -5.505 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.397 3.682 -6.373 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.014 1.831 -3.991 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.534 1.327 -5.617 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.514 0.896 -4.196 1.00 0.00 H new ATOM 1323 N ASN A 86 4.810 2.384 -2.895 1.00 0.00 N ATOM 1324 CA ASN A 86 5.496 1.359 -2.060 1.00 0.00 C ATOM 1325 C ASN A 86 4.585 0.854 -0.942 1.00 0.00 C ATOM 1326 O ASN A 86 3.939 1.617 -0.252 1.00 0.00 O ATOM 1327 CB ASN A 86 6.755 1.980 -1.464 1.00 0.00 C ATOM 1328 CG ASN A 86 7.645 2.479 -2.604 1.00 0.00 C ATOM 1329 OD1 ASN A 86 7.362 2.130 -3.831 1.00 0.00 O flip ATOM 1330 ND2 ASN A 86 8.604 3.192 -2.378 1.00 0.00 N flip ATOM 0 H ASN A 86 4.374 3.152 -2.385 1.00 0.00 H new ATOM 0 HA ASN A 86 5.754 0.506 -2.687 1.00 0.00 H new ATOM 0 HB2 ASN A 86 6.492 2.805 -0.802 1.00 0.00 H new ATOM 0 HB3 ASN A 86 7.289 1.245 -0.862 1.00 0.00 H new ATOM 0 HD21 ASN A 86 8.823 3.463 -1.419 1.00 0.00 H new ATOM 0 HD22 ASN A 86 9.189 3.519 -3.147 1.00 0.00 H new ATOM 1337 N TYR A 87 4.545 -0.438 -0.758 1.00 0.00 N ATOM 1338 CA TYR A 87 3.698 -1.026 0.316 1.00 0.00 C ATOM 1339 C TYR A 87 4.208 -2.425 0.668 1.00 0.00 C ATOM 1340 O TYR A 87 4.996 -3.007 -0.051 1.00 0.00 O ATOM 1341 CB TYR A 87 2.247 -1.084 -0.162 1.00 0.00 C ATOM 1342 CG TYR A 87 2.134 -1.985 -1.367 1.00 0.00 C ATOM 1343 CD1 TYR A 87 2.452 -1.493 -2.639 1.00 0.00 C ATOM 1344 CD2 TYR A 87 1.692 -3.306 -1.219 1.00 0.00 C ATOM 1345 CE1 TYR A 87 2.327 -2.320 -3.762 1.00 0.00 C ATOM 1346 CE2 TYR A 87 1.571 -4.133 -2.343 1.00 0.00 C ATOM 1347 CZ TYR A 87 1.887 -3.639 -3.613 1.00 0.00 C ATOM 1348 OH TYR A 87 1.760 -4.452 -4.720 1.00 0.00 O ATOM 0 H TYR A 87 5.068 -1.116 -1.312 1.00 0.00 H new ATOM 0 HA TYR A 87 3.750 -0.406 1.211 1.00 0.00 H new ATOM 0 HB2 TYR A 87 1.606 -1.453 0.639 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.898 -0.082 -0.413 1.00 0.00 H new ATOM 0 HD1 TYR A 87 2.794 -0.475 -2.754 1.00 0.00 H new ATOM 0 HD2 TYR A 87 1.445 -3.687 -0.239 1.00 0.00 H new ATOM 0 HE1 TYR A 87 2.570 -1.939 -4.743 1.00 0.00 H new ATOM 0 HE2 TYR A 87 1.234 -5.153 -2.229 1.00 0.00 H new ATOM 0 HH TYR A 87 1.444 -5.337 -4.441 1.00 0.00 H new ATOM 1358 N VAL A 88 3.780 -2.960 1.780 1.00 0.00 N ATOM 1359 CA VAL A 88 4.258 -4.310 2.189 1.00 0.00 C ATOM 1360 C VAL A 88 3.142 -5.342 2.013 1.00 0.00 C ATOM 1361 O VAL A 88 3.367 -6.529 2.121 1.00 0.00 O ATOM 1362 CB VAL A 88 4.674 -4.270 3.660 1.00 0.00 C ATOM 1363 CG1 VAL A 88 5.603 -3.080 3.906 1.00 0.00 C ATOM 1364 CG2 VAL A 88 3.427 -4.124 4.533 1.00 0.00 C ATOM 0 H VAL A 88 3.120 -2.520 2.422 1.00 0.00 H new ATOM 0 HA VAL A 88 5.106 -4.591 1.565 1.00 0.00 H new ATOM 0 HB VAL A 88 5.197 -5.193 3.911 1.00 0.00 H new ATOM 0 HG11 VAL A 88 5.895 -3.058 4.956 1.00 0.00 H new ATOM 0 HG12 VAL A 88 6.492 -3.178 3.284 1.00 0.00 H new ATOM 0 HG13 VAL A 88 5.084 -2.155 3.654 1.00 0.00 H new ATOM 0 HG21 VAL A 88 3.719 -4.095 5.583 1.00 0.00 H new ATOM 0 HG22 VAL A 88 2.908 -3.201 4.275 1.00 0.00 H new ATOM 0 HG23 VAL A 88 2.763 -4.972 4.364 1.00 0.00 H new ATOM 1374 N ALA A 89 1.941 -4.900 1.747 1.00 0.00 N ATOM 1375 CA ALA A 89 0.809 -5.857 1.570 1.00 0.00 C ATOM 1376 C ALA A 89 0.982 -7.051 2.513 1.00 0.00 C ATOM 1377 O ALA A 89 0.483 -7.058 3.621 1.00 0.00 O ATOM 1378 CB ALA A 89 0.782 -6.352 0.123 1.00 0.00 C ATOM 0 H ALA A 89 1.695 -3.916 1.644 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.127 -5.350 1.802 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -0.044 -7.051 -0.007 1.00 0.00 H new ATOM 0 HB2 ALA A 89 0.649 -5.504 -0.549 1.00 0.00 H new ATOM 0 HB3 ALA A 89 1.722 -6.854 -0.107 1.00 0.00 H new ATOM 1384 N ARG A 90 1.685 -8.065 2.083 1.00 0.00 N ATOM 1385 CA ARG A 90 1.889 -9.260 2.951 1.00 0.00 C ATOM 1386 C ARG A 90 3.243 -9.161 3.659 1.00 0.00 C ATOM 1387 O ARG A 90 3.985 -10.118 3.735 1.00 0.00 O ATOM 1388 CB ARG A 90 1.852 -10.525 2.091 1.00 0.00 C ATOM 1389 CG ARG A 90 0.476 -10.655 1.435 1.00 0.00 C ATOM 1390 CD ARG A 90 0.463 -11.875 0.513 1.00 0.00 C ATOM 1391 NE ARG A 90 0.494 -13.121 1.330 1.00 0.00 N ATOM 1392 CZ ARG A 90 0.496 -14.287 0.741 1.00 0.00 C ATOM 1393 NH1 ARG A 90 0.481 -14.357 -0.563 1.00 0.00 N ATOM 1394 NH2 ARG A 90 0.513 -15.378 1.456 1.00 0.00 N ATOM 0 H ARG A 90 2.128 -8.117 1.165 1.00 0.00 H new ATOM 0 HA ARG A 90 1.096 -9.303 3.698 1.00 0.00 H new ATOM 0 HB2 ARG A 90 2.628 -10.481 1.327 1.00 0.00 H new ATOM 0 HB3 ARG A 90 2.058 -11.402 2.705 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -0.295 -10.755 2.199 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.246 -9.754 0.866 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.429 -11.861 -0.113 1.00 0.00 H new ATOM 0 HD3 ARG A 90 1.322 -11.846 -0.157 1.00 0.00 H new ATOM 0 HE ARG A 90 0.514 -13.063 2.348 1.00 0.00 H new ATOM 0 HH11 ARG A 90 0.468 -13.502 -1.119 1.00 0.00 H new ATOM 0 HH12 ARG A 90 0.483 -15.266 -1.025 1.00 0.00 H new ATOM 0 HH21 ARG A 90 0.525 -15.320 2.474 1.00 0.00 H new ATOM 0 HH22 ARG A 90 0.515 -16.289 0.997 1.00 0.00 H new ATOM 1408 N ASN A 91 3.566 -8.008 4.180 1.00 0.00 N ATOM 1409 CA ASN A 91 4.868 -7.841 4.889 1.00 0.00 C ATOM 1410 C ASN A 91 6.028 -7.940 3.892 1.00 0.00 C ATOM 1411 O ASN A 91 7.052 -8.527 4.179 1.00 0.00 O ATOM 1412 CB ASN A 91 5.016 -8.939 5.943 1.00 0.00 C ATOM 1413 CG ASN A 91 5.981 -8.476 7.035 1.00 0.00 C ATOM 1414 OD1 ASN A 91 6.278 -7.303 7.144 1.00 0.00 O ATOM 1415 ND2 ASN A 91 6.484 -9.355 7.858 1.00 0.00 N ATOM 0 H ASN A 91 2.983 -7.172 4.145 1.00 0.00 H new ATOM 0 HA ASN A 91 4.889 -6.862 5.367 1.00 0.00 H new ATOM 0 HB2 ASN A 91 4.044 -9.173 6.378 1.00 0.00 H new ATOM 0 HB3 ASN A 91 5.387 -9.854 5.480 1.00 0.00 H new ATOM 0 HD21 ASN A 91 7.126 -9.057 8.592 1.00 0.00 H new ATOM 0 HD22 ASN A 91 6.235 -10.340 7.767 1.00 0.00 H new ATOM 1422 N LYS A 92 5.883 -7.359 2.731 1.00 0.00 N ATOM 1423 CA LYS A 92 6.988 -7.410 1.729 1.00 0.00 C ATOM 1424 C LYS A 92 7.287 -5.990 1.238 1.00 0.00 C ATOM 1425 O LYS A 92 6.925 -5.621 0.139 1.00 0.00 O ATOM 1426 CB LYS A 92 6.571 -8.287 0.541 1.00 0.00 C ATOM 1427 CG LYS A 92 5.370 -7.666 -0.176 1.00 0.00 C ATOM 1428 CD LYS A 92 4.408 -8.772 -0.615 1.00 0.00 C ATOM 1429 CE LYS A 92 5.061 -9.614 -1.713 1.00 0.00 C ATOM 1430 NZ LYS A 92 4.618 -9.119 -3.047 1.00 0.00 N ATOM 0 H LYS A 92 5.049 -6.852 2.433 1.00 0.00 H new ATOM 0 HA LYS A 92 7.879 -7.835 2.191 1.00 0.00 H new ATOM 0 HB2 LYS A 92 7.404 -8.392 -0.154 1.00 0.00 H new ATOM 0 HB3 LYS A 92 6.318 -9.288 0.889 1.00 0.00 H new ATOM 0 HG2 LYS A 92 4.859 -6.967 0.487 1.00 0.00 H new ATOM 0 HG3 LYS A 92 5.705 -7.096 -1.043 1.00 0.00 H new ATOM 0 HD2 LYS A 92 4.150 -9.403 0.236 1.00 0.00 H new ATOM 0 HD3 LYS A 92 3.479 -8.335 -0.981 1.00 0.00 H new ATOM 0 HE2 LYS A 92 6.147 -9.556 -1.634 1.00 0.00 H new ATOM 0 HE3 LYS A 92 4.788 -10.662 -1.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 4.300 -9.922 -3.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 3.833 -8.447 -2.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 5.411 -8.642 -3.521 1.00 0.00 H new ATOM 1444 N PRO A 93 7.935 -5.192 2.051 1.00 0.00 N ATOM 1445 CA PRO A 93 8.271 -3.785 1.685 1.00 0.00 C ATOM 1446 C PRO A 93 9.107 -3.706 0.408 1.00 0.00 C ATOM 1447 O PRO A 93 10.277 -4.030 0.394 1.00 0.00 O ATOM 1448 CB PRO A 93 9.074 -3.252 2.879 1.00 0.00 C ATOM 1449 CG PRO A 93 9.428 -4.440 3.716 1.00 0.00 C ATOM 1450 CD PRO A 93 8.417 -5.539 3.393 1.00 0.00 C ATOM 0 HA PRO A 93 7.370 -3.205 1.485 1.00 0.00 H new ATOM 0 HB2 PRO A 93 9.972 -2.733 2.542 1.00 0.00 H new ATOM 0 HB3 PRO A 93 8.487 -2.534 3.452 1.00 0.00 H new ATOM 0 HG2 PRO A 93 10.442 -4.775 3.499 1.00 0.00 H new ATOM 0 HG3 PRO A 93 9.396 -4.187 4.776 1.00 0.00 H new ATOM 0 HD2 PRO A 93 8.881 -6.525 3.408 1.00 0.00 H new ATOM 0 HD3 PRO A 93 7.603 -5.558 4.117 1.00 0.00 H new ATOM 1458 N LYS A 94 8.508 -3.274 -0.664 1.00 0.00 N ATOM 1459 CA LYS A 94 9.251 -3.163 -1.949 1.00 0.00 C ATOM 1460 C LYS A 94 8.747 -1.930 -2.694 1.00 0.00 C ATOM 1461 O LYS A 94 7.781 -1.313 -2.296 1.00 0.00 O ATOM 1462 CB LYS A 94 8.998 -4.416 -2.786 1.00 0.00 C ATOM 1463 CG LYS A 94 7.517 -4.485 -3.160 1.00 0.00 C ATOM 1464 CD LYS A 94 7.222 -5.820 -3.845 1.00 0.00 C ATOM 1465 CE LYS A 94 5.800 -5.796 -4.408 1.00 0.00 C ATOM 1466 NZ LYS A 94 4.833 -6.149 -3.328 1.00 0.00 N ATOM 0 H LYS A 94 7.529 -2.991 -0.706 1.00 0.00 H new ATOM 0 HA LYS A 94 10.321 -3.070 -1.763 1.00 0.00 H new ATOM 0 HB2 LYS A 94 9.612 -4.395 -3.687 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.285 -5.306 -2.225 1.00 0.00 H new ATOM 0 HG2 LYS A 94 6.901 -4.379 -2.267 1.00 0.00 H new ATOM 0 HG3 LYS A 94 7.260 -3.660 -3.824 1.00 0.00 H new ATOM 0 HD2 LYS A 94 7.940 -5.997 -4.646 1.00 0.00 H new ATOM 0 HD3 LYS A 94 7.330 -6.639 -3.133 1.00 0.00 H new ATOM 0 HE2 LYS A 94 5.572 -4.808 -4.807 1.00 0.00 H new ATOM 0 HE3 LYS A 94 5.712 -6.501 -5.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 3.975 -6.558 -3.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 5.268 -6.842 -2.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 4.581 -5.293 -2.794 1.00 0.00 H new ATOM 1480 N THR A 95 9.379 -1.558 -3.773 1.00 0.00 N ATOM 1481 CA THR A 95 8.899 -0.362 -4.510 1.00 0.00 C ATOM 1482 C THR A 95 7.962 -0.786 -5.634 1.00 0.00 C ATOM 1483 O THR A 95 8.192 -1.755 -6.330 1.00 0.00 O ATOM 1484 CB THR A 95 10.076 0.413 -5.107 1.00 0.00 C ATOM 1485 OG1 THR A 95 10.542 1.365 -4.162 1.00 0.00 O ATOM 1486 CG2 THR A 95 9.616 1.133 -6.381 1.00 0.00 C ATOM 0 H THR A 95 10.195 -2.024 -4.170 1.00 0.00 H new ATOM 0 HA THR A 95 8.368 0.280 -3.808 1.00 0.00 H new ATOM 0 HB THR A 95 10.883 -0.277 -5.352 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.297 1.861 -4.542 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.452 1.686 -6.809 1.00 0.00 H new ATOM 0 HG22 THR A 95 9.258 0.400 -7.104 1.00 0.00 H new ATOM 0 HG23 THR A 95 8.810 1.825 -6.137 1.00 0.00 H new ATOM 1494 N VAL A 96 6.911 -0.046 -5.813 1.00 0.00 N ATOM 1495 CA VAL A 96 5.935 -0.355 -6.889 1.00 0.00 C ATOM 1496 C VAL A 96 5.650 0.933 -7.655 1.00 0.00 C ATOM 1497 O VAL A 96 5.343 1.944 -7.067 1.00 0.00 O ATOM 1498 CB VAL A 96 4.646 -0.877 -6.257 1.00 0.00 C ATOM 1499 CG1 VAL A 96 3.553 -0.966 -7.322 1.00 0.00 C ATOM 1500 CG2 VAL A 96 4.900 -2.266 -5.666 1.00 0.00 C ATOM 0 H VAL A 96 6.682 0.774 -5.251 1.00 0.00 H new ATOM 0 HA VAL A 96 6.332 -1.111 -7.566 1.00 0.00 H new ATOM 0 HB VAL A 96 4.325 -0.197 -5.468 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.634 -1.339 -6.870 1.00 0.00 H new ATOM 0 HG12 VAL A 96 3.375 0.023 -7.744 1.00 0.00 H new ATOM 0 HG13 VAL A 96 3.870 -1.646 -8.113 1.00 0.00 H new ATOM 0 HG21 VAL A 96 3.982 -2.642 -5.214 1.00 0.00 H new ATOM 0 HG22 VAL A 96 5.220 -2.945 -6.457 1.00 0.00 H new ATOM 0 HG23 VAL A 96 5.679 -2.201 -4.906 1.00 0.00 H new ATOM 1510 N ILE A 97 5.744 0.922 -8.954 1.00 0.00 N ATOM 1511 CA ILE A 97 5.470 2.177 -9.708 1.00 0.00 C ATOM 1512 C ILE A 97 4.083 2.086 -10.335 1.00 0.00 C ATOM 1513 O ILE A 97 3.724 1.095 -10.935 1.00 0.00 O ATOM 1514 CB ILE A 97 6.526 2.379 -10.793 1.00 0.00 C ATOM 1515 CG1 ILE A 97 7.904 2.043 -10.216 1.00 0.00 C ATOM 1516 CG2 ILE A 97 6.508 3.842 -11.247 1.00 0.00 C ATOM 1517 CD1 ILE A 97 8.985 2.772 -11.016 1.00 0.00 C ATOM 0 H ILE A 97 5.995 0.112 -9.520 1.00 0.00 H new ATOM 0 HA ILE A 97 5.508 3.028 -9.028 1.00 0.00 H new ATOM 0 HB ILE A 97 6.314 1.730 -11.643 1.00 0.00 H new ATOM 0 HG12 ILE A 97 7.952 2.337 -9.168 1.00 0.00 H new ATOM 0 HG13 ILE A 97 8.073 0.967 -10.253 1.00 0.00 H new ATOM 0 HG21 ILE A 97 7.260 3.992 -12.022 1.00 0.00 H new ATOM 0 HG22 ILE A 97 5.523 4.087 -11.645 1.00 0.00 H new ATOM 0 HG23 ILE A 97 6.728 4.489 -10.398 1.00 0.00 H new ATOM 0 HD11 ILE A 97 9.966 2.532 -10.605 1.00 0.00 H new ATOM 0 HD12 ILE A 97 8.942 2.456 -12.058 1.00 0.00 H new ATOM 0 HD13 ILE A 97 8.819 3.848 -10.956 1.00 0.00 H new ATOM 1529 N TYR A 98 3.297 3.114 -10.175 1.00 0.00 N ATOM 1530 CA TYR A 98 1.912 3.102 -10.722 1.00 0.00 C ATOM 1531 C TYR A 98 1.764 4.171 -11.811 1.00 0.00 C ATOM 1532 O TYR A 98 2.073 5.328 -11.612 1.00 0.00 O ATOM 1533 CB TYR A 98 0.943 3.405 -9.570 1.00 0.00 C ATOM 1534 CG TYR A 98 0.560 2.146 -8.807 1.00 0.00 C ATOM 1535 CD1 TYR A 98 1.167 0.905 -9.076 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.425 2.233 -7.818 1.00 0.00 C ATOM 1537 CE1 TYR A 98 0.783 -0.234 -8.353 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.805 1.096 -7.099 1.00 0.00 C ATOM 1539 CZ TYR A 98 -0.201 -0.136 -7.365 1.00 0.00 C ATOM 1540 OH TYR A 98 -0.576 -1.259 -6.655 1.00 0.00 O ATOM 0 H TYR A 98 3.558 3.969 -9.684 1.00 0.00 H new ATOM 0 HA TYR A 98 1.694 2.129 -11.161 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.403 4.118 -8.886 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.044 3.877 -9.966 1.00 0.00 H new ATOM 0 HD1 TYR A 98 1.928 0.830 -9.839 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.894 3.183 -7.609 1.00 0.00 H new ATOM 0 HE1 TYR A 98 1.248 -1.187 -8.560 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.567 1.170 -6.337 1.00 0.00 H new ATOM 0 HH TYR A 98 -1.082 -0.990 -5.860 1.00 0.00 H new ATOM 1550 N TRP A 99 1.281 3.775 -12.960 1.00 0.00 N ATOM 1551 CA TRP A 99 1.090 4.740 -14.083 1.00 0.00 C ATOM 1552 C TRP A 99 -0.403 4.873 -14.385 1.00 0.00 C ATOM 1553 O TRP A 99 -1.188 4.006 -14.064 1.00 0.00 O ATOM 1554 CB TRP A 99 1.786 4.219 -15.341 1.00 0.00 C ATOM 1555 CG TRP A 99 3.201 4.674 -15.381 1.00 0.00 C ATOM 1556 CD1 TRP A 99 3.614 5.904 -15.756 1.00 0.00 C ATOM 1557 CD2 TRP A 99 4.398 3.918 -15.058 1.00 0.00 C ATOM 1558 NE1 TRP A 99 4.994 5.951 -15.682 1.00 0.00 N ATOM 1559 CE2 TRP A 99 5.523 4.749 -15.256 1.00 0.00 C ATOM 1560 CE3 TRP A 99 4.611 2.603 -14.620 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 6.820 4.288 -15.023 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 5.910 2.137 -14.385 1.00 0.00 C ATOM 1563 CH2 TRP A 99 7.014 2.975 -14.587 1.00 0.00 C ATOM 0 H TRP A 99 1.008 2.815 -13.170 1.00 0.00 H new ATOM 0 HA TRP A 99 1.511 5.704 -13.796 1.00 0.00 H new ATOM 0 HB2 TRP A 99 1.748 3.130 -15.360 1.00 0.00 H new ATOM 0 HB3 TRP A 99 1.259 4.572 -16.228 1.00 0.00 H new ATOM 0 HD1 TRP A 99 2.972 6.717 -16.063 1.00 0.00 H new ATOM 0 HE1 TRP A 99 5.552 6.773 -15.914 1.00 0.00 H new ATOM 0 HE3 TRP A 99 3.768 1.946 -14.463 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.666 4.941 -15.178 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 6.062 1.123 -14.045 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.013 2.607 -14.406 1.00 0.00 H new ATOM 1574 N LEU A 100 -0.793 5.936 -15.026 1.00 0.00 N ATOM 1575 CA LEU A 100 -2.229 6.096 -15.373 1.00 0.00 C ATOM 1576 C LEU A 100 -2.478 5.450 -16.733 1.00 0.00 C ATOM 1577 O LEU A 100 -1.766 5.693 -17.686 1.00 0.00 O ATOM 1578 CB LEU A 100 -2.591 7.584 -15.424 1.00 0.00 C ATOM 1579 CG LEU A 100 -2.662 8.141 -14.002 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -2.854 9.660 -14.051 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -3.854 7.512 -13.276 1.00 0.00 C ATOM 0 H LEU A 100 -0.183 6.698 -15.323 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.849 5.614 -14.617 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.847 8.131 -16.003 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.548 7.719 -15.927 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.737 7.907 -13.476 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.904 10.053 -13.036 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.015 10.116 -14.576 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.780 9.893 -14.576 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.910 7.905 -12.261 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.773 7.753 -13.810 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.728 6.430 -13.240 1.00 0.00 H new ATOM 1593 N ALA A 101 -3.477 4.617 -16.825 1.00 0.00 N ATOM 1594 CA ALA A 101 -3.768 3.940 -18.118 1.00 0.00 C ATOM 1595 C ALA A 101 -5.281 3.901 -18.337 1.00 0.00 C ATOM 1596 O ALA A 101 -6.049 3.742 -17.409 1.00 0.00 O ATOM 1597 CB ALA A 101 -3.221 2.510 -18.076 1.00 0.00 C ATOM 0 H ALA A 101 -4.105 4.376 -16.059 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.295 4.486 -18.934 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.433 2.012 -19.022 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.144 2.537 -17.913 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -3.697 1.962 -17.263 1.00 0.00 H new ATOM 1603 N GLU A 102 -5.709 4.045 -19.558 1.00 0.00 N ATOM 1604 CA GLU A 102 -7.167 4.016 -19.848 1.00 0.00 C ATOM 1605 C GLU A 102 -7.456 2.934 -20.883 1.00 0.00 C ATOM 1606 O GLU A 102 -6.753 2.802 -21.862 1.00 0.00 O ATOM 1607 CB GLU A 102 -7.603 5.372 -20.406 1.00 0.00 C ATOM 1608 CG GLU A 102 -9.111 5.359 -20.662 1.00 0.00 C ATOM 1609 CD GLU A 102 -9.526 6.667 -21.335 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -10.697 6.802 -21.648 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -8.666 7.511 -21.526 1.00 0.00 O ATOM 0 H GLU A 102 -5.109 4.182 -20.371 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.715 3.803 -18.930 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -7.350 6.165 -19.702 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.068 5.585 -21.332 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.376 4.512 -21.295 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.649 5.235 -19.722 1.00 0.00 H new ATOM 1619 N VAL A 103 -8.489 2.165 -20.690 1.00 0.00 N ATOM 1620 CA VAL A 103 -8.809 1.109 -21.688 1.00 0.00 C ATOM 1621 C VAL A 103 -9.721 1.698 -22.759 1.00 0.00 C ATOM 1622 O VAL A 103 -10.818 2.135 -22.484 1.00 0.00 O ATOM 1623 CB VAL A 103 -9.522 -0.067 -21.011 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -8.586 -0.757 -20.022 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -10.739 0.445 -20.255 1.00 0.00 C ATOM 0 H VAL A 103 -9.121 2.221 -19.891 1.00 0.00 H new ATOM 0 HA VAL A 103 -7.883 0.750 -22.136 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.826 -0.779 -21.779 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.106 -1.590 -19.549 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.709 -1.130 -20.551 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.273 -0.044 -19.259 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.246 -0.391 -19.773 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.422 1.162 -19.498 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -11.422 0.931 -20.952 1.00 0.00 H new ATOM 1635 N LYS A 104 -9.280 1.698 -23.984 1.00 0.00 N ATOM 1636 CA LYS A 104 -10.127 2.245 -25.076 1.00 0.00 C ATOM 1637 C LYS A 104 -11.273 1.272 -25.324 1.00 0.00 C ATOM 1638 O LYS A 104 -12.197 1.548 -26.066 1.00 0.00 O ATOM 1639 CB LYS A 104 -9.287 2.402 -26.343 1.00 0.00 C ATOM 1640 CG LYS A 104 -8.758 1.035 -26.783 1.00 0.00 C ATOM 1641 CD LYS A 104 -7.664 1.230 -27.836 1.00 0.00 C ATOM 1642 CE LYS A 104 -6.454 1.904 -27.186 1.00 0.00 C ATOM 1643 NZ LYS A 104 -5.202 1.377 -27.798 1.00 0.00 N ATOM 0 H LYS A 104 -8.370 1.343 -24.276 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.524 3.221 -24.798 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -9.889 2.843 -27.138 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -8.456 3.082 -26.158 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.360 0.493 -25.925 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -9.569 0.433 -27.192 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -7.375 0.268 -28.260 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -8.038 1.841 -28.657 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -6.510 2.984 -27.321 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.453 1.716 -26.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -4.392 1.617 -27.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -5.270 0.343 -27.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -5.070 1.802 -28.738 1.00 0.00 H new ATOM 1657 N ASP A 105 -11.221 0.135 -24.687 1.00 0.00 N ATOM 1658 CA ASP A 105 -12.302 -0.871 -24.851 1.00 0.00 C ATOM 1659 C ASP A 105 -13.168 -0.874 -23.595 1.00 0.00 C ATOM 1660 O ASP A 105 -12.818 -1.454 -22.586 1.00 0.00 O ATOM 1661 CB ASP A 105 -11.686 -2.257 -25.048 1.00 0.00 C ATOM 1662 CG ASP A 105 -11.234 -2.421 -26.499 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -11.482 -1.520 -27.283 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -10.650 -3.449 -26.803 1.00 0.00 O ATOM 0 H ASP A 105 -10.469 -0.140 -24.055 1.00 0.00 H new ATOM 0 HA ASP A 105 -12.910 -0.621 -25.721 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.837 -2.387 -24.376 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -12.414 -3.028 -24.795 1.00 0.00 H new ATOM 1670 N TYR A 106 -14.301 -0.237 -23.650 1.00 0.00 N ATOM 1671 CA TYR A 106 -15.196 -0.205 -22.465 1.00 0.00 C ATOM 1672 C TYR A 106 -15.491 -1.646 -22.045 1.00 0.00 C ATOM 1673 O TYR A 106 -15.690 -1.943 -20.883 1.00 0.00 O ATOM 1674 CB TYR A 106 -16.500 0.507 -22.836 1.00 0.00 C ATOM 1675 CG TYR A 106 -17.318 0.770 -21.594 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -18.087 -0.253 -21.029 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -17.316 2.045 -21.017 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -18.853 -0.004 -19.886 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -18.080 2.295 -19.873 1.00 0.00 C ATOM 1680 CZ TYR A 106 -18.850 1.271 -19.306 1.00 0.00 C ATOM 1681 OH TYR A 106 -19.605 1.519 -18.178 1.00 0.00 O ATOM 0 H TYR A 106 -14.647 0.265 -24.468 1.00 0.00 H new ATOM 0 HA TYR A 106 -14.721 0.331 -21.643 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -16.279 1.447 -23.342 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -17.071 -0.104 -23.535 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -18.089 -1.236 -21.476 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -16.725 2.835 -21.455 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -19.447 -0.794 -19.451 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -18.077 3.278 -19.426 1.00 0.00 H new ATOM 0 HH TYR A 106 -19.390 2.410 -17.830 1.00 0.00 H new ATOM 1691 N ASP A 107 -15.519 -2.541 -22.995 1.00 0.00 N ATOM 1692 CA ASP A 107 -15.798 -3.972 -22.683 1.00 0.00 C ATOM 1693 C ASP A 107 -14.491 -4.771 -22.741 1.00 0.00 C ATOM 1694 O ASP A 107 -14.488 -5.953 -23.020 1.00 0.00 O ATOM 1695 CB ASP A 107 -16.786 -4.528 -23.713 1.00 0.00 C ATOM 1696 CG ASP A 107 -18.136 -3.825 -23.560 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -18.348 -3.213 -22.527 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -18.935 -3.910 -24.479 1.00 0.00 O ATOM 0 H ASP A 107 -15.359 -2.340 -23.982 1.00 0.00 H new ATOM 0 HA ASP A 107 -16.227 -4.054 -21.684 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -16.399 -4.379 -24.721 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -16.906 -5.602 -23.574 1.00 0.00 H new ATOM 1704 N VAL A 108 -13.379 -4.133 -22.494 1.00 0.00 N ATOM 1705 CA VAL A 108 -12.078 -4.860 -22.548 1.00 0.00 C ATOM 1706 C VAL A 108 -12.210 -6.205 -21.838 1.00 0.00 C ATOM 1707 O VAL A 108 -13.005 -6.365 -20.934 1.00 0.00 O ATOM 1708 CB VAL A 108 -10.991 -4.034 -21.864 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -11.428 -3.679 -20.444 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -9.702 -4.851 -21.809 1.00 0.00 C ATOM 0 H VAL A 108 -13.315 -3.143 -22.258 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.807 -5.022 -23.591 1.00 0.00 H new ATOM 0 HB VAL A 108 -10.824 -3.116 -22.427 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -10.649 -3.090 -19.960 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -12.351 -3.100 -20.481 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -11.597 -4.594 -19.876 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.921 -4.267 -21.322 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -9.876 -5.767 -21.244 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -9.388 -5.103 -22.822 1.00 0.00 H new ATOM 1720 N GLU A 109 -11.434 -7.174 -22.239 1.00 0.00 N ATOM 1721 CA GLU A 109 -11.515 -8.504 -21.583 1.00 0.00 C ATOM 1722 C GLU A 109 -10.500 -8.570 -20.452 1.00 0.00 C ATOM 1723 O GLU A 109 -9.307 -8.668 -20.667 1.00 0.00 O ATOM 1724 CB GLU A 109 -11.219 -9.611 -22.597 1.00 0.00 C ATOM 1725 CG GLU A 109 -11.434 -10.973 -21.930 1.00 0.00 C ATOM 1726 CD GLU A 109 -12.923 -11.176 -21.649 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -13.725 -10.584 -22.353 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -13.239 -11.918 -20.734 1.00 0.00 O ATOM 0 H GLU A 109 -10.749 -7.100 -22.991 1.00 0.00 H new ATOM 0 HA GLU A 109 -12.520 -8.645 -21.187 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -11.871 -9.510 -23.465 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -10.194 -9.526 -22.957 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -11.064 -11.769 -22.577 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -10.867 -11.028 -21.001 1.00 0.00 H new ATOM 1736 N ILE A 110 -10.977 -8.521 -19.249 1.00 0.00 N ATOM 1737 CA ILE A 110 -10.067 -8.582 -18.073 1.00 0.00 C ATOM 1738 C ILE A 110 -9.651 -10.025 -17.820 1.00 0.00 C ATOM 1739 O ILE A 110 -10.297 -10.747 -17.086 1.00 0.00 O ATOM 1740 CB ILE A 110 -10.796 -8.048 -16.839 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -11.179 -6.580 -17.053 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -9.889 -8.166 -15.612 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -9.925 -5.735 -17.156 1.00 0.00 C ATOM 0 H ILE A 110 -11.968 -8.440 -19.023 1.00 0.00 H new ATOM 0 HA ILE A 110 -9.182 -7.977 -18.271 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.700 -8.635 -16.679 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -11.774 -6.478 -17.961 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.797 -6.231 -16.226 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -10.412 -7.785 -14.735 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -9.627 -9.212 -15.452 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -8.981 -7.586 -15.774 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.201 -4.692 -17.308 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.348 -5.827 -16.236 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.323 -6.078 -17.998 1.00 0.00 H new ATOM 1755 N ARG A 111 -8.575 -10.455 -18.412 1.00 0.00 N ATOM 1756 CA ARG A 111 -8.131 -11.855 -18.182 1.00 0.00 C ATOM 1757 C ARG A 111 -7.266 -11.906 -16.929 1.00 0.00 C ATOM 1758 O ARG A 111 -6.447 -11.046 -16.696 1.00 0.00 O ATOM 1759 CB ARG A 111 -7.310 -12.351 -19.367 1.00 0.00 C ATOM 1760 CG ARG A 111 -7.888 -13.675 -19.863 1.00 0.00 C ATOM 1761 CD ARG A 111 -7.691 -14.749 -18.792 1.00 0.00 C ATOM 1762 NE ARG A 111 -8.104 -16.072 -19.336 1.00 0.00 N ATOM 1763 CZ ARG A 111 -9.361 -16.417 -19.327 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -10.257 -15.605 -18.834 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -9.723 -17.573 -19.808 1.00 0.00 N ATOM 0 H ARG A 111 -7.989 -9.904 -19.039 1.00 0.00 H new ATOM 0 HA ARG A 111 -9.010 -12.489 -18.063 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -7.324 -11.612 -20.168 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -6.269 -12.483 -19.073 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -8.948 -13.560 -20.088 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -7.397 -13.975 -20.789 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -6.647 -14.781 -18.481 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -8.280 -14.508 -17.907 1.00 0.00 H new ATOM 0 HE ARG A 111 -7.403 -16.708 -19.716 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -9.973 -14.701 -18.456 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -11.241 -15.875 -18.827 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -9.023 -18.208 -20.191 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -10.707 -17.843 -19.801 1.00 0.00 H new ATOM 1779 N LEU A 112 -7.435 -12.911 -16.127 1.00 0.00 N ATOM 1780 CA LEU A 112 -6.609 -13.007 -14.896 1.00 0.00 C ATOM 1781 C LEU A 112 -5.732 -14.256 -14.979 1.00 0.00 C ATOM 1782 O LEU A 112 -6.142 -15.343 -14.625 1.00 0.00 O ATOM 1783 CB LEU A 112 -7.522 -13.094 -13.674 1.00 0.00 C ATOM 1784 CG LEU A 112 -8.656 -12.071 -13.801 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -9.546 -12.143 -12.560 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -8.074 -10.659 -13.927 1.00 0.00 C ATOM 0 H LEU A 112 -8.105 -13.668 -16.267 1.00 0.00 H new ATOM 0 HA LEU A 112 -5.977 -12.124 -14.805 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.934 -14.099 -13.587 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.949 -12.905 -12.766 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.244 -12.297 -14.690 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.353 -11.416 -12.649 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.968 -13.144 -12.472 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.953 -11.920 -11.673 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.886 -9.937 -14.017 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.481 -10.430 -13.042 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.440 -10.604 -14.812 1.00 0.00 H new ATOM 1798 N SER A 113 -4.524 -14.104 -15.445 1.00 0.00 N ATOM 1799 CA SER A 113 -3.615 -15.281 -15.553 1.00 0.00 C ATOM 1800 C SER A 113 -3.320 -15.817 -14.153 1.00 0.00 C ATOM 1801 O SER A 113 -3.588 -15.167 -13.163 1.00 0.00 O ATOM 1802 CB SER A 113 -2.304 -14.857 -16.214 1.00 0.00 C ATOM 1803 OG SER A 113 -2.586 -14.231 -17.460 1.00 0.00 O ATOM 0 H SER A 113 -4.126 -13.217 -15.756 1.00 0.00 H new ATOM 0 HA SER A 113 -4.092 -16.055 -16.154 1.00 0.00 H new ATOM 0 HB2 SER A 113 -1.761 -14.171 -15.564 1.00 0.00 H new ATOM 0 HB3 SER A 113 -1.663 -15.725 -16.367 1.00 0.00 H new ATOM 0 HG SER A 113 -2.430 -13.267 -17.384 1.00 0.00 H new ATOM 1809 N HIS A 114 -2.769 -16.998 -14.059 1.00 0.00 N ATOM 1810 CA HIS A 114 -2.460 -17.563 -12.717 1.00 0.00 C ATOM 1811 C HIS A 114 -1.915 -16.449 -11.821 1.00 0.00 C ATOM 1812 O HIS A 114 -0.759 -16.087 -11.897 1.00 0.00 O ATOM 1813 CB HIS A 114 -1.410 -18.670 -12.847 1.00 0.00 C ATOM 1814 CG HIS A 114 -0.383 -18.509 -11.762 1.00 0.00 C ATOM 1815 ND1 HIS A 114 0.880 -17.973 -11.772 1.00 0.00 N flip ATOM 1816 CD2 HIS A 114 -0.614 -18.915 -10.456 1.00 0.00 C flip ATOM 1817 CE1 HIS A 114 1.423 -18.046 -10.495 1.00 0.00 C flip ATOM 1818 NE2 HIS A 114 0.486 -18.620 -9.740 1.00 0.00 N flip ATOM 0 H HIS A 114 -2.521 -17.592 -14.850 1.00 0.00 H new ATOM 0 HA HIS A 114 -3.367 -17.981 -12.281 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -1.885 -19.648 -12.772 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -0.933 -18.621 -13.826 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -1.513 -19.383 -10.082 1.00 0.00 H new ATOM 0 HE1 HIS A 114 2.399 -17.709 -10.180 1.00 0.00 H new ATOM 0 HE2 HIS A 114 0.590 -18.812 -8.744 1.00 0.00 H new ATOM 1827 N GLU A 115 -2.740 -15.890 -10.983 1.00 0.00 N ATOM 1828 CA GLU A 115 -2.264 -14.792 -10.095 1.00 0.00 C ATOM 1829 C GLU A 115 -3.459 -14.144 -9.405 1.00 0.00 C ATOM 1830 O GLU A 115 -3.537 -14.087 -8.193 1.00 0.00 O ATOM 1831 CB GLU A 115 -1.536 -13.739 -10.933 1.00 0.00 C ATOM 1832 CG GLU A 115 -0.068 -13.673 -10.514 1.00 0.00 C ATOM 1833 CD GLU A 115 0.704 -12.814 -11.513 1.00 0.00 C ATOM 1834 OE1 GLU A 115 0.120 -12.447 -12.520 1.00 0.00 O ATOM 1835 OE2 GLU A 115 1.863 -12.536 -11.257 1.00 0.00 O ATOM 0 H GLU A 115 -3.722 -16.144 -10.873 1.00 0.00 H new ATOM 0 HA GLU A 115 -1.584 -15.200 -9.347 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -1.611 -13.987 -11.992 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -2.007 -12.765 -10.800 1.00 0.00 H new ATOM 0 HG2 GLU A 115 0.018 -13.252 -9.512 1.00 0.00 H new ATOM 0 HG3 GLU A 115 0.356 -14.676 -10.475 1.00 0.00 H new ATOM 1843 N HIS A 116 -4.392 -13.653 -10.168 1.00 0.00 N ATOM 1844 CA HIS A 116 -5.586 -13.002 -9.564 1.00 0.00 C ATOM 1845 C HIS A 116 -6.854 -13.734 -10.003 1.00 0.00 C ATOM 1846 O HIS A 116 -6.954 -14.212 -11.114 1.00 0.00 O ATOM 1847 CB HIS A 116 -5.662 -11.547 -10.024 1.00 0.00 C ATOM 1848 CG HIS A 116 -4.503 -10.780 -9.449 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -3.214 -10.908 -9.946 1.00 0.00 N ATOM 1850 CD2 HIS A 116 -4.420 -9.878 -8.416 1.00 0.00 C ATOM 1851 CE1 HIS A 116 -2.417 -10.106 -9.217 1.00 0.00 C ATOM 1852 NE2 HIS A 116 -3.103 -9.456 -8.274 1.00 0.00 N ATOM 0 H HIS A 116 -4.380 -13.674 -11.188 1.00 0.00 H new ATOM 0 HA HIS A 116 -5.502 -13.041 -8.478 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -5.641 -11.497 -11.113 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -6.603 -11.101 -9.702 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -5.250 -9.548 -7.808 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -1.354 -10.001 -9.375 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -2.738 -8.790 -7.593 1.00 0.00 H new ATOM 1861 N GLN A 117 -7.824 -13.819 -9.137 1.00 0.00 N ATOM 1862 CA GLN A 117 -9.092 -14.509 -9.501 1.00 0.00 C ATOM 1863 C GLN A 117 -10.262 -13.562 -9.246 1.00 0.00 C ATOM 1864 O GLN A 117 -11.407 -13.968 -9.209 1.00 0.00 O ATOM 1865 CB GLN A 117 -9.256 -15.766 -8.650 1.00 0.00 C ATOM 1866 CG GLN A 117 -7.975 -16.601 -8.725 1.00 0.00 C ATOM 1867 CD GLN A 117 -7.627 -16.872 -10.190 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -6.399 -16.699 -10.600 1.00 0.00 O flip ATOM 1869 NE2 GLN A 117 -8.479 -17.249 -10.970 1.00 0.00 N flip ATOM 0 H GLN A 117 -7.793 -13.440 -8.191 1.00 0.00 H new ATOM 0 HA GLN A 117 -9.068 -14.792 -10.553 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -9.466 -15.494 -7.616 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -10.105 -16.350 -9.004 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -7.155 -16.073 -8.237 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -8.110 -17.542 -8.192 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -9.438 -17.385 -10.651 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -8.235 -17.430 -11.944 1.00 0.00 H new ATOM 1878 N ALA A 118 -9.985 -12.301 -9.060 1.00 0.00 N ATOM 1879 CA ALA A 118 -11.085 -11.334 -8.797 1.00 0.00 C ATOM 1880 C ALA A 118 -10.727 -9.967 -9.375 1.00 0.00 C ATOM 1881 O ALA A 118 -9.635 -9.471 -9.190 1.00 0.00 O ATOM 1882 CB ALA A 118 -11.281 -11.199 -7.287 1.00 0.00 C ATOM 0 H ALA A 118 -9.047 -11.900 -9.079 1.00 0.00 H new ATOM 0 HA ALA A 118 -12.001 -11.695 -9.265 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -12.086 -10.492 -7.086 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.538 -12.171 -6.865 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -10.359 -10.838 -6.831 1.00 0.00 H new ATOM 1888 N TYR A 119 -11.648 -9.344 -10.057 1.00 0.00 N ATOM 1889 CA TYR A 119 -11.373 -7.995 -10.622 1.00 0.00 C ATOM 1890 C TYR A 119 -12.690 -7.231 -10.746 1.00 0.00 C ATOM 1891 O TYR A 119 -13.718 -7.798 -11.062 1.00 0.00 O ATOM 1892 CB TYR A 119 -10.697 -8.124 -11.989 1.00 0.00 C ATOM 1893 CG TYR A 119 -11.699 -8.494 -13.043 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -12.091 -9.824 -13.189 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -12.217 -7.510 -13.891 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -13.004 -10.179 -14.185 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -13.135 -7.859 -14.885 1.00 0.00 C ATOM 1898 CZ TYR A 119 -13.530 -9.196 -15.034 1.00 0.00 C ATOM 1899 OH TYR A 119 -14.429 -9.546 -16.019 1.00 0.00 O ATOM 0 H TYR A 119 -12.580 -9.712 -10.247 1.00 0.00 H new ATOM 0 HA TYR A 119 -10.700 -7.449 -9.961 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -10.215 -7.182 -12.252 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -9.914 -8.881 -11.943 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -11.688 -10.580 -12.532 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -11.908 -6.481 -13.778 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -13.304 -11.210 -14.301 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -13.540 -7.100 -15.538 1.00 0.00 H new ATOM 0 HH TYR A 119 -14.696 -8.746 -16.518 1.00 0.00 H new ATOM 1909 N ARG A 120 -12.681 -5.951 -10.483 1.00 0.00 N ATOM 1910 CA ARG A 120 -13.951 -5.173 -10.571 1.00 0.00 C ATOM 1911 C ARG A 120 -13.682 -3.771 -11.117 1.00 0.00 C ATOM 1912 O ARG A 120 -12.619 -3.217 -10.938 1.00 0.00 O ATOM 1913 CB ARG A 120 -14.549 -4.997 -9.173 1.00 0.00 C ATOM 1914 CG ARG A 120 -14.558 -6.322 -8.415 1.00 0.00 C ATOM 1915 CD ARG A 120 -14.879 -6.051 -6.940 1.00 0.00 C ATOM 1916 NE ARG A 120 -16.336 -5.779 -6.783 1.00 0.00 N ATOM 1917 CZ ARG A 120 -16.792 -5.283 -5.662 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -15.972 -5.002 -4.688 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -18.070 -5.064 -5.519 1.00 0.00 N ATOM 0 H ARG A 120 -11.857 -5.414 -10.213 1.00 0.00 H new ATOM 0 HA ARG A 120 -14.630 -5.718 -11.227 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -13.972 -4.259 -8.616 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.566 -4.612 -9.253 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -15.299 -6.996 -8.844 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -13.590 -6.814 -8.505 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -14.592 -6.909 -6.332 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -14.300 -5.199 -6.583 1.00 0.00 H new ATOM 0 HE ARG A 120 -16.978 -5.980 -7.550 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -14.972 -5.169 -4.799 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -16.331 -4.615 -3.815 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -18.713 -5.280 -6.281 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -18.427 -4.677 -4.645 1.00 0.00 H new ATOM 1933 N TRP A 121 -14.667 -3.177 -11.725 1.00 0.00 N ATOM 1934 CA TRP A 121 -14.514 -1.786 -12.226 1.00 0.00 C ATOM 1935 C TRP A 121 -15.296 -0.884 -11.263 1.00 0.00 C ATOM 1936 O TRP A 121 -16.510 -0.854 -11.283 1.00 0.00 O ATOM 1937 CB TRP A 121 -15.094 -1.677 -13.637 1.00 0.00 C ATOM 1938 CG TRP A 121 -14.117 -2.229 -14.630 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -14.122 -3.490 -15.122 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -12.997 -1.549 -15.261 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -13.077 -3.623 -16.019 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -12.356 -2.454 -16.140 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -12.483 -0.248 -15.160 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -11.242 -2.075 -16.890 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -11.363 0.132 -15.912 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -10.744 -0.778 -16.776 1.00 0.00 C ATOM 0 H TRP A 121 -15.579 -3.599 -11.898 1.00 0.00 H new ATOM 0 HA TRP A 121 -13.465 -1.494 -12.271 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -16.035 -2.223 -13.697 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -15.315 -0.635 -13.870 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -14.826 -4.265 -14.858 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -12.866 -4.481 -16.529 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -12.953 0.465 -14.499 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -10.768 -2.782 -17.555 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -10.974 1.136 -15.824 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -9.882 -0.476 -17.353 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.616 -0.187 -10.387 1.00 0.00 N ATOM 1958 CA LEU A 122 -15.343 0.658 -9.387 1.00 0.00 C ATOM 1959 C LEU A 122 -14.886 2.116 -9.460 1.00 0.00 C ATOM 1960 O LEU A 122 -13.995 2.468 -10.202 1.00 0.00 O ATOM 1961 CB LEU A 122 -15.065 0.139 -7.976 1.00 0.00 C ATOM 1962 CG LEU A 122 -14.581 -1.311 -8.020 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -13.217 -1.407 -7.341 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -15.578 -2.207 -7.283 1.00 0.00 C ATOM 0 H LEU A 122 -13.598 -0.165 -10.320 1.00 0.00 H new ATOM 0 HA LEU A 122 -16.407 0.604 -9.615 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -14.313 0.764 -7.495 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -15.970 0.207 -7.373 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.500 -1.636 -9.057 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.868 -2.439 -7.370 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.505 -0.768 -7.863 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -13.303 -1.082 -6.304 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -15.232 -3.240 -7.315 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -15.660 -1.884 -6.245 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -16.554 -2.136 -7.763 1.00 0.00 H new ATOM 1976 N GLY A 123 -15.506 2.964 -8.678 1.00 0.00 N ATOM 1977 CA GLY A 123 -15.133 4.408 -8.670 1.00 0.00 C ATOM 1978 C GLY A 123 -14.010 4.647 -7.656 1.00 0.00 C ATOM 1979 O GLY A 123 -13.504 3.728 -7.044 1.00 0.00 O ATOM 0 H GLY A 123 -16.261 2.713 -8.040 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -14.809 4.715 -9.664 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -16.001 5.016 -8.415 1.00 0.00 H new ATOM 1983 N LEU A 124 -13.616 5.879 -7.484 1.00 0.00 N ATOM 1984 CA LEU A 124 -12.520 6.202 -6.523 1.00 0.00 C ATOM 1985 C LEU A 124 -12.866 5.719 -5.112 1.00 0.00 C ATOM 1986 O LEU A 124 -12.076 5.066 -4.461 1.00 0.00 O ATOM 1987 CB LEU A 124 -12.320 7.719 -6.492 1.00 0.00 C ATOM 1988 CG LEU A 124 -11.356 8.096 -5.365 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -10.102 7.222 -5.438 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -10.956 9.565 -5.512 1.00 0.00 C ATOM 0 H LEU A 124 -14.009 6.684 -7.972 1.00 0.00 H new ATOM 0 HA LEU A 124 -11.610 5.698 -6.850 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -11.926 8.062 -7.449 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -13.278 8.218 -6.345 1.00 0.00 H new ATOM 0 HG LEU A 124 -11.848 7.940 -4.405 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -9.420 7.496 -4.633 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -10.383 6.174 -5.335 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -9.609 7.373 -6.398 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -10.269 9.837 -4.711 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -10.468 9.714 -6.475 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -11.846 10.192 -5.455 1.00 0.00 H new ATOM 2002 N GLU A 125 -14.027 6.048 -4.624 1.00 0.00 N ATOM 2003 CA GLU A 125 -14.388 5.621 -3.245 1.00 0.00 C ATOM 2004 C GLU A 125 -14.305 4.101 -3.119 1.00 0.00 C ATOM 2005 O GLU A 125 -13.605 3.584 -2.271 1.00 0.00 O ATOM 2006 CB GLU A 125 -15.806 6.096 -2.923 1.00 0.00 C ATOM 2007 CG GLU A 125 -16.558 5.017 -2.140 1.00 0.00 C ATOM 2008 CD GLU A 125 -17.882 5.587 -1.636 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -18.186 6.717 -1.981 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -18.570 4.886 -0.914 1.00 0.00 O ATOM 0 H GLU A 125 -14.738 6.590 -5.116 1.00 0.00 H new ATOM 0 HA GLU A 125 -13.686 6.064 -2.539 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -15.766 7.017 -2.341 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -16.339 6.325 -3.846 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -16.741 4.151 -2.776 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -15.954 4.674 -1.300 1.00 0.00 H new ATOM 2018 N GLU A 126 -14.998 3.376 -3.947 1.00 0.00 N ATOM 2019 CA GLU A 126 -14.931 1.894 -3.844 1.00 0.00 C ATOM 2020 C GLU A 126 -13.501 1.441 -4.113 1.00 0.00 C ATOM 2021 O GLU A 126 -13.016 0.498 -3.527 1.00 0.00 O ATOM 2022 CB GLU A 126 -15.875 1.252 -4.854 1.00 0.00 C ATOM 2023 CG GLU A 126 -15.857 -0.259 -4.657 1.00 0.00 C ATOM 2024 CD GLU A 126 -17.138 -0.865 -5.229 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -17.428 -2.003 -4.902 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -17.812 -0.177 -5.976 1.00 0.00 O ATOM 0 H GLU A 126 -15.602 3.740 -4.684 1.00 0.00 H new ATOM 0 HA GLU A 126 -15.233 1.587 -2.843 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -16.886 1.637 -4.722 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.568 1.503 -5.869 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -14.986 -0.690 -5.151 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -15.772 -0.497 -3.597 1.00 0.00 H new ATOM 2034 N ALA A 127 -12.814 2.108 -4.991 1.00 0.00 N ATOM 2035 CA ALA A 127 -11.412 1.716 -5.272 1.00 0.00 C ATOM 2036 C ALA A 127 -10.550 2.081 -4.061 1.00 0.00 C ATOM 2037 O ALA A 127 -9.530 1.475 -3.797 1.00 0.00 O ATOM 2038 CB ALA A 127 -10.918 2.471 -6.502 1.00 0.00 C ATOM 0 H ALA A 127 -13.161 2.905 -5.524 1.00 0.00 H new ATOM 0 HA ALA A 127 -11.349 0.644 -5.459 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.887 2.187 -6.714 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.546 2.223 -7.358 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.967 3.544 -6.315 1.00 0.00 H new ATOM 2044 N CYS A 128 -10.961 3.081 -3.326 1.00 0.00 N ATOM 2045 CA CYS A 128 -10.183 3.514 -2.130 1.00 0.00 C ATOM 2046 C CYS A 128 -10.280 2.456 -1.024 1.00 0.00 C ATOM 2047 O CYS A 128 -9.305 2.158 -0.361 1.00 0.00 O ATOM 2048 CB CYS A 128 -10.739 4.847 -1.618 1.00 0.00 C ATOM 2049 SG CYS A 128 -11.054 4.732 0.161 1.00 0.00 S ATOM 0 H CYS A 128 -11.809 3.619 -3.505 1.00 0.00 H new ATOM 0 HA CYS A 128 -9.137 3.636 -2.410 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -10.030 5.650 -1.821 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -11.660 5.095 -2.145 1.00 0.00 H new ATOM 0 HG CYS A 128 -12.178 4.111 0.363 1.00 0.00 H new ATOM 2055 N GLN A 129 -11.437 1.883 -0.813 1.00 0.00 N ATOM 2056 CA GLN A 129 -11.559 0.849 0.263 1.00 0.00 C ATOM 2057 C GLN A 129 -10.736 -0.378 -0.125 1.00 0.00 C ATOM 2058 O GLN A 129 -9.929 -0.869 0.641 1.00 0.00 O ATOM 2059 CB GLN A 129 -13.022 0.425 0.459 1.00 0.00 C ATOM 2060 CG GLN A 129 -13.868 0.827 -0.751 1.00 0.00 C ATOM 2061 CD GLN A 129 -14.568 2.159 -0.467 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -13.943 3.106 -0.038 1.00 0.00 O ATOM 2063 NE2 GLN A 129 -15.849 2.271 -0.693 1.00 0.00 N ATOM 0 H GLN A 129 -12.293 2.081 -1.331 1.00 0.00 H new ATOM 0 HA GLN A 129 -11.192 1.278 1.195 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -13.077 -0.654 0.605 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -13.423 0.889 1.360 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -13.237 0.917 -1.635 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -14.607 0.054 -0.964 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -16.375 1.475 -1.054 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -16.324 3.155 -0.509 1.00 0.00 H new ATOM 2072 N LEU A 130 -10.939 -0.878 -1.310 1.00 0.00 N ATOM 2073 CA LEU A 130 -10.178 -2.076 -1.757 1.00 0.00 C ATOM 2074 C LEU A 130 -8.679 -1.748 -1.802 1.00 0.00 C ATOM 2075 O LEU A 130 -7.843 -2.552 -1.439 1.00 0.00 O ATOM 2076 CB LEU A 130 -10.640 -2.452 -3.164 1.00 0.00 C ATOM 2077 CG LEU A 130 -12.167 -2.522 -3.232 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -12.581 -2.787 -4.676 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -12.693 -3.659 -2.357 1.00 0.00 C ATOM 0 H LEU A 130 -11.602 -0.507 -1.991 1.00 0.00 H new ATOM 0 HA LEU A 130 -10.351 -2.900 -1.064 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -10.273 -1.718 -3.881 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -10.214 -3.415 -3.447 1.00 0.00 H new ATOM 0 HG LEU A 130 -12.581 -1.579 -2.875 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -13.668 -2.839 -4.739 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -12.219 -1.979 -5.312 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -12.152 -3.732 -5.010 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -13.781 -3.692 -2.419 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -12.281 -4.606 -2.705 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -12.393 -3.491 -1.323 1.00 0.00 H new ATOM 2091 N ALA A 131 -8.333 -0.573 -2.259 1.00 0.00 N ATOM 2092 CA ALA A 131 -6.893 -0.191 -2.347 1.00 0.00 C ATOM 2093 C ALA A 131 -6.244 -0.288 -0.960 1.00 0.00 C ATOM 2094 O ALA A 131 -5.154 -0.803 -0.808 1.00 0.00 O ATOM 2095 CB ALA A 131 -6.797 1.237 -2.878 1.00 0.00 C ATOM 0 H ALA A 131 -8.989 0.141 -2.576 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.368 -0.867 -3.022 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.749 1.530 -2.948 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -7.255 1.289 -3.866 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -7.318 1.913 -2.200 1.00 0.00 H new ATOM 2101 N GLN A 132 -6.925 0.174 0.054 1.00 0.00 N ATOM 2102 CA GLN A 132 -6.384 0.081 1.447 1.00 0.00 C ATOM 2103 C GLN A 132 -5.058 0.842 1.614 1.00 0.00 C ATOM 2104 O GLN A 132 -4.933 1.687 2.478 1.00 0.00 O ATOM 2105 CB GLN A 132 -6.178 -1.400 1.800 1.00 0.00 C ATOM 2106 CG GLN A 132 -5.119 -1.549 2.898 1.00 0.00 C ATOM 2107 CD GLN A 132 -5.568 -0.803 4.155 1.00 0.00 C ATOM 2108 OE1 GLN A 132 -6.742 -0.760 4.461 1.00 0.00 O ATOM 2109 NE2 GLN A 132 -4.676 -0.212 4.902 1.00 0.00 N ATOM 0 H GLN A 132 -7.841 0.616 -0.021 1.00 0.00 H new ATOM 0 HA GLN A 132 -7.106 0.544 2.120 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -7.120 -1.835 2.134 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -5.870 -1.952 0.912 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -4.964 -2.604 3.126 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -4.164 -1.154 2.551 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -3.690 -0.249 4.644 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -4.965 0.286 5.744 1.00 0.00 H new ATOM 2118 N PHE A 133 -4.053 0.529 0.839 1.00 0.00 N ATOM 2119 CA PHE A 133 -2.738 1.220 1.023 1.00 0.00 C ATOM 2120 C PHE A 133 -2.889 2.736 0.805 1.00 0.00 C ATOM 2121 O PHE A 133 -3.618 3.184 -0.059 1.00 0.00 O ATOM 2122 CB PHE A 133 -1.715 0.635 0.046 1.00 0.00 C ATOM 2123 CG PHE A 133 -2.085 -0.798 -0.263 1.00 0.00 C ATOM 2124 CD1 PHE A 133 -2.139 -1.738 0.772 1.00 0.00 C ATOM 2125 CD2 PHE A 133 -2.386 -1.187 -1.579 1.00 0.00 C ATOM 2126 CE1 PHE A 133 -2.488 -3.065 0.498 1.00 0.00 C ATOM 2127 CE2 PHE A 133 -2.737 -2.513 -1.850 1.00 0.00 C ATOM 2128 CZ PHE A 133 -2.789 -3.452 -0.813 1.00 0.00 C ATOM 0 H PHE A 133 -4.082 -0.167 0.094 1.00 0.00 H new ATOM 0 HA PHE A 133 -2.390 1.060 2.043 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -1.693 1.223 -0.871 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -0.715 0.680 0.478 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -1.911 -1.439 1.784 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -2.346 -0.463 -2.380 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -2.525 -3.790 1.298 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -2.968 -2.813 -2.861 1.00 0.00 H new ATOM 0 HZ PHE A 133 -3.061 -4.475 -1.025 1.00 0.00 H new ATOM 2138 N LYS A 134 -2.212 3.523 1.609 1.00 0.00 N ATOM 2139 CA LYS A 134 -2.314 5.014 1.490 1.00 0.00 C ATOM 2140 C LYS A 134 -1.774 5.486 0.140 1.00 0.00 C ATOM 2141 O LYS A 134 -2.446 6.186 -0.592 1.00 0.00 O ATOM 2142 CB LYS A 134 -1.497 5.661 2.610 1.00 0.00 C ATOM 2143 CG LYS A 134 -1.669 7.185 2.571 1.00 0.00 C ATOM 2144 CD LYS A 134 -3.024 7.568 3.174 1.00 0.00 C ATOM 2145 CE LYS A 134 -3.119 9.090 3.287 1.00 0.00 C ATOM 2146 NZ LYS A 134 -2.061 9.587 4.213 1.00 0.00 N ATOM 0 H LYS A 134 -1.589 3.194 2.347 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.362 5.302 1.569 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -1.820 5.275 3.577 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -0.444 5.403 2.499 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -0.864 7.666 3.127 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -1.604 7.542 1.543 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -3.833 7.188 2.550 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -3.139 7.112 4.157 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -3.001 9.546 2.304 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -4.104 9.377 3.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -2.364 10.488 4.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -1.902 8.887 4.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -1.177 9.733 3.684 1.00 0.00 H new ATOM 2160 N GLU A 135 -0.574 5.112 -0.206 1.00 0.00 N ATOM 2161 CA GLU A 135 -0.028 5.550 -1.517 1.00 0.00 C ATOM 2162 C GLU A 135 -0.991 5.075 -2.592 1.00 0.00 C ATOM 2163 O GLU A 135 -1.144 5.687 -3.628 1.00 0.00 O ATOM 2164 CB GLU A 135 1.357 4.939 -1.733 1.00 0.00 C ATOM 2165 CG GLU A 135 2.316 5.465 -0.663 1.00 0.00 C ATOM 2166 CD GLU A 135 3.713 4.894 -0.906 1.00 0.00 C ATOM 2167 OE1 GLU A 135 3.840 4.046 -1.768 1.00 0.00 O ATOM 2168 OE2 GLU A 135 4.631 5.315 -0.224 1.00 0.00 O ATOM 0 H GLU A 135 0.045 4.528 0.356 1.00 0.00 H new ATOM 0 HA GLU A 135 0.075 6.635 -1.553 1.00 0.00 H new ATOM 0 HB2 GLU A 135 1.299 3.852 -1.683 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.728 5.193 -2.726 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.347 6.554 -0.691 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.963 5.181 0.328 1.00 0.00 H new ATOM 2176 N MET A 136 -1.659 3.988 -2.328 1.00 0.00 N ATOM 2177 CA MET A 136 -2.645 3.449 -3.297 1.00 0.00 C ATOM 2178 C MET A 136 -3.826 4.414 -3.410 1.00 0.00 C ATOM 2179 O MET A 136 -4.214 4.813 -4.490 1.00 0.00 O ATOM 2180 CB MET A 136 -3.142 2.108 -2.780 1.00 0.00 C ATOM 2181 CG MET A 136 -3.503 1.206 -3.952 1.00 0.00 C ATOM 2182 SD MET A 136 -4.543 2.116 -5.119 1.00 0.00 S ATOM 2183 CE MET A 136 -4.178 1.093 -6.560 1.00 0.00 C ATOM 0 H MET A 136 -1.561 3.445 -1.470 1.00 0.00 H new ATOM 0 HA MET A 136 -2.182 3.329 -4.276 1.00 0.00 H new ATOM 0 HB2 MET A 136 -2.373 1.636 -2.169 1.00 0.00 H new ATOM 0 HB3 MET A 136 -4.012 2.254 -2.140 1.00 0.00 H new ATOM 0 HG2 MET A 136 -2.597 0.859 -4.450 1.00 0.00 H new ATOM 0 HG3 MET A 136 -4.029 0.321 -3.594 1.00 0.00 H new ATOM 0 HE1 MET A 136 -3.694 1.701 -7.324 1.00 0.00 H new ATOM 0 HE2 MET A 136 -3.514 0.279 -6.269 1.00 0.00 H new ATOM 0 HE3 MET A 136 -5.105 0.681 -6.958 1.00 0.00 H new ATOM 2193 N LYS A 137 -4.398 4.799 -2.299 1.00 0.00 N ATOM 2194 CA LYS A 137 -5.547 5.744 -2.349 1.00 0.00 C ATOM 2195 C LYS A 137 -5.095 7.026 -3.040 1.00 0.00 C ATOM 2196 O LYS A 137 -5.777 7.557 -3.893 1.00 0.00 O ATOM 2197 CB LYS A 137 -6.018 6.063 -0.925 1.00 0.00 C ATOM 2198 CG LYS A 137 -6.560 4.790 -0.267 1.00 0.00 C ATOM 2199 CD LYS A 137 -7.301 5.149 1.028 1.00 0.00 C ATOM 2200 CE LYS A 137 -6.302 5.637 2.081 1.00 0.00 C ATOM 2201 NZ LYS A 137 -6.999 5.807 3.389 1.00 0.00 N ATOM 0 H LYS A 137 -4.119 4.500 -1.364 1.00 0.00 H new ATOM 0 HA LYS A 137 -6.373 5.295 -2.901 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -5.191 6.464 -0.339 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -6.792 6.830 -0.950 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -7.234 4.275 -0.951 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -5.741 4.105 -0.050 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -8.042 5.923 0.831 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -7.841 4.279 1.402 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -5.486 4.922 2.182 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -5.860 6.583 1.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -6.320 6.138 4.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -7.763 6.505 3.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -7.401 4.896 3.689 1.00 0.00 H new ATOM 2215 N ALA A 138 -3.936 7.518 -2.693 1.00 0.00 N ATOM 2216 CA ALA A 138 -3.431 8.754 -3.345 1.00 0.00 C ATOM 2217 C ALA A 138 -3.133 8.446 -4.808 1.00 0.00 C ATOM 2218 O ALA A 138 -3.390 9.244 -5.686 1.00 0.00 O ATOM 2219 CB ALA A 138 -2.158 9.220 -2.646 1.00 0.00 C ATOM 0 H ALA A 138 -3.320 7.116 -1.987 1.00 0.00 H new ATOM 0 HA ALA A 138 -4.179 9.544 -3.277 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -1.790 10.127 -3.126 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -2.373 9.427 -1.598 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -1.399 8.440 -2.714 1.00 0.00 H new ATOM 2225 N ALA A 139 -2.609 7.282 -5.082 1.00 0.00 N ATOM 2226 CA ALA A 139 -2.321 6.923 -6.492 1.00 0.00 C ATOM 2227 C ALA A 139 -3.628 7.010 -7.272 1.00 0.00 C ATOM 2228 O ALA A 139 -3.688 7.560 -8.353 1.00 0.00 O ATOM 2229 CB ALA A 139 -1.784 5.494 -6.557 1.00 0.00 C ATOM 0 H ALA A 139 -2.370 6.570 -4.392 1.00 0.00 H new ATOM 0 HA ALA A 139 -1.577 7.599 -6.913 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.573 5.231 -7.594 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -0.868 5.423 -5.971 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -2.528 4.807 -6.153 1.00 0.00 H new ATOM 2235 N LEU A 140 -4.683 6.484 -6.713 1.00 0.00 N ATOM 2236 CA LEU A 140 -6.001 6.549 -7.396 1.00 0.00 C ATOM 2237 C LEU A 140 -6.525 7.982 -7.326 1.00 0.00 C ATOM 2238 O LEU A 140 -7.063 8.510 -8.282 1.00 0.00 O ATOM 2239 CB LEU A 140 -6.989 5.622 -6.681 1.00 0.00 C ATOM 2240 CG LEU A 140 -6.644 4.162 -6.976 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -7.194 3.274 -5.860 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -7.290 3.756 -8.298 1.00 0.00 C ATOM 0 H LEU A 140 -4.687 6.011 -5.809 1.00 0.00 H new ATOM 0 HA LEU A 140 -5.893 6.240 -8.436 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -6.957 5.802 -5.606 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -8.006 5.838 -7.010 1.00 0.00 H new ATOM 0 HG LEU A 140 -5.562 4.046 -7.037 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -6.949 2.233 -6.069 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -6.749 3.568 -4.909 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -8.277 3.388 -5.805 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -7.049 2.716 -8.516 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -8.372 3.870 -8.225 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -6.911 4.392 -9.098 1.00 0.00 H new ATOM 2254 N GLN A 141 -6.374 8.614 -6.193 1.00 0.00 N ATOM 2255 CA GLN A 141 -6.866 10.012 -6.044 1.00 0.00 C ATOM 2256 C GLN A 141 -5.982 10.962 -6.852 1.00 0.00 C ATOM 2257 O GLN A 141 -6.469 11.752 -7.635 1.00 0.00 O ATOM 2258 CB GLN A 141 -6.843 10.393 -4.557 1.00 0.00 C ATOM 2259 CG GLN A 141 -6.259 11.795 -4.377 1.00 0.00 C ATOM 2260 CD GLN A 141 -6.414 12.220 -2.915 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -7.089 11.459 -2.095 1.00 0.00 O flip ATOM 2262 NE2 GLN A 141 -5.919 13.255 -2.516 1.00 0.00 N flip ATOM 0 H GLN A 141 -5.930 8.221 -5.363 1.00 0.00 H new ATOM 0 HA GLN A 141 -7.886 10.088 -6.420 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.854 10.358 -4.150 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -6.249 9.670 -3.998 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -5.207 11.803 -4.661 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -6.771 12.502 -5.030 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -5.392 13.849 -3.157 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -6.030 13.531 -1.540 1.00 0.00 H new ATOM 2271 N GLU A 142 -4.688 10.884 -6.694 1.00 0.00 N ATOM 2272 CA GLU A 142 -3.802 11.783 -7.484 1.00 0.00 C ATOM 2273 C GLU A 142 -3.972 11.440 -8.960 1.00 0.00 C ATOM 2274 O GLU A 142 -3.969 12.301 -9.817 1.00 0.00 O ATOM 2275 CB GLU A 142 -2.345 11.574 -7.063 1.00 0.00 C ATOM 2276 CG GLU A 142 -2.163 12.042 -5.616 1.00 0.00 C ATOM 2277 CD GLU A 142 -2.439 13.544 -5.526 1.00 0.00 C ATOM 2278 OE1 GLU A 142 -2.676 14.016 -4.426 1.00 0.00 O ATOM 2279 OE2 GLU A 142 -2.406 14.198 -6.556 1.00 0.00 O ATOM 0 H GLU A 142 -4.211 10.244 -6.059 1.00 0.00 H new ATOM 0 HA GLU A 142 -4.067 12.826 -7.309 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -2.076 10.522 -7.153 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -1.680 12.131 -7.724 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -2.841 11.497 -4.959 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -1.149 11.827 -5.278 1.00 0.00 H new ATOM 2287 N GLY A 143 -4.142 10.182 -9.261 1.00 0.00 N ATOM 2288 CA GLY A 143 -4.340 9.782 -10.677 1.00 0.00 C ATOM 2289 C GLY A 143 -5.633 10.417 -11.186 1.00 0.00 C ATOM 2290 O GLY A 143 -5.681 10.976 -12.261 1.00 0.00 O ATOM 0 H GLY A 143 -4.152 9.417 -8.587 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.495 10.107 -11.284 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.393 8.696 -10.760 1.00 0.00 H new ATOM 2294 N HIS A 144 -6.679 10.350 -10.403 1.00 0.00 N ATOM 2295 CA HIS A 144 -7.971 10.963 -10.823 1.00 0.00 C ATOM 2296 C HIS A 144 -7.761 12.460 -11.055 1.00 0.00 C ATOM 2297 O HIS A 144 -8.328 13.048 -11.955 1.00 0.00 O ATOM 2298 CB HIS A 144 -9.009 10.766 -9.714 1.00 0.00 C ATOM 2299 CG HIS A 144 -10.105 9.848 -10.188 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -10.725 8.940 -9.336 1.00 0.00 N ATOM 2301 CD2 HIS A 144 -10.706 9.681 -11.413 1.00 0.00 C ATOM 2302 CE1 HIS A 144 -11.648 8.275 -10.055 1.00 0.00 C ATOM 2303 NE2 HIS A 144 -11.676 8.689 -11.321 1.00 0.00 N ATOM 0 H HIS A 144 -6.692 9.896 -9.490 1.00 0.00 H new ATOM 0 HA HIS A 144 -8.322 10.491 -11.741 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -8.531 10.348 -8.828 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -9.430 11.729 -9.424 1.00 0.00 H new ATOM 0 HD1 HIS A 144 -10.518 8.803 -8.347 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -10.463 10.234 -12.308 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -12.287 7.501 -9.655 1.00 0.00 H new ATOM 2312 N GLN A 145 -6.956 13.085 -10.239 1.00 0.00 N ATOM 2313 CA GLN A 145 -6.710 14.546 -10.399 1.00 0.00 C ATOM 2314 C GLN A 145 -6.258 14.843 -11.829 1.00 0.00 C ATOM 2315 O GLN A 145 -6.733 15.768 -12.460 1.00 0.00 O ATOM 2316 CB GLN A 145 -5.613 14.973 -9.421 1.00 0.00 C ATOM 2317 CG GLN A 145 -5.386 16.486 -9.515 1.00 0.00 C ATOM 2318 CD GLN A 145 -6.517 17.222 -8.797 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -6.992 16.778 -7.770 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -6.969 18.341 -9.294 1.00 0.00 N ATOM 0 H GLN A 145 -6.457 12.645 -9.466 1.00 0.00 H new ATOM 0 HA GLN A 145 -7.629 15.096 -10.194 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -5.896 14.702 -8.404 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -4.687 14.443 -9.646 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -4.427 16.748 -9.068 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -5.345 16.793 -10.560 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -6.571 18.714 -10.156 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -7.721 18.843 -8.821 1.00 0.00 H new ATOM 2329 N PHE A 146 -5.344 14.071 -12.345 1.00 0.00 N ATOM 2330 CA PHE A 146 -4.864 14.317 -13.733 1.00 0.00 C ATOM 2331 C PHE A 146 -6.005 14.053 -14.719 1.00 0.00 C ATOM 2332 O PHE A 146 -6.275 14.849 -15.595 1.00 0.00 O ATOM 2333 CB PHE A 146 -3.700 13.371 -14.049 1.00 0.00 C ATOM 2334 CG PHE A 146 -2.997 13.826 -15.309 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.628 13.702 -16.556 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.708 14.369 -15.232 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -2.967 14.121 -17.717 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -1.053 14.786 -16.397 1.00 0.00 C ATOM 2339 CZ PHE A 146 -1.685 14.657 -17.638 1.00 0.00 C ATOM 0 H PHE A 146 -4.909 13.282 -11.867 1.00 0.00 H new ATOM 0 HA PHE A 146 -4.530 15.351 -13.822 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -2.997 13.353 -13.216 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -4.070 12.354 -14.175 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.622 13.284 -16.620 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -1.219 14.466 -14.274 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -3.453 14.028 -18.677 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -0.060 15.207 -16.337 1.00 0.00 H new ATOM 0 HZ PHE A 146 -1.177 14.974 -18.537 1.00 0.00 H new ATOM 2349 N LEU A 147 -6.670 12.935 -14.584 1.00 0.00 N ATOM 2350 CA LEU A 147 -7.786 12.603 -15.517 1.00 0.00 C ATOM 2351 C LEU A 147 -8.767 13.773 -15.593 1.00 0.00 C ATOM 2352 O LEU A 147 -9.158 14.193 -16.663 1.00 0.00 O ATOM 2353 CB LEU A 147 -8.511 11.355 -15.011 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.498 10.222 -14.825 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.226 8.941 -14.425 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -6.735 9.991 -16.132 1.00 0.00 C ATOM 0 H LEU A 147 -6.487 12.235 -13.865 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.382 12.414 -16.512 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -9.012 11.569 -14.067 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -9.282 11.056 -15.720 1.00 0.00 H new ATOM 0 HG LEU A 147 -6.794 10.497 -14.040 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -7.502 8.137 -14.294 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.761 9.104 -13.490 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -8.935 8.667 -15.206 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -6.015 9.184 -15.995 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -7.437 9.721 -16.921 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.208 10.903 -16.412 1.00 0.00 H new ATOM 2368 N CYS A 148 -9.154 14.315 -14.473 1.00 0.00 N ATOM 2369 CA CYS A 148 -10.095 15.469 -14.496 1.00 0.00 C ATOM 2370 C CYS A 148 -9.455 16.608 -15.292 1.00 0.00 C ATOM 2371 O CYS A 148 -10.128 17.457 -15.841 1.00 0.00 O ATOM 2372 CB CYS A 148 -10.372 15.933 -13.063 1.00 0.00 C ATOM 2373 SG CYS A 148 -11.302 14.651 -12.184 1.00 0.00 S ATOM 0 H CYS A 148 -8.861 14.010 -13.545 1.00 0.00 H new ATOM 0 HA CYS A 148 -11.035 15.174 -14.962 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -9.434 16.135 -12.547 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -10.937 16.865 -13.074 1.00 0.00 H new ATOM 0 HG CYS A 148 -10.498 13.688 -11.843 1.00 0.00 H new ATOM 2379 N SER A 149 -8.149 16.632 -15.348 1.00 0.00 N ATOM 2380 CA SER A 149 -7.447 17.714 -16.096 1.00 0.00 C ATOM 2381 C SER A 149 -7.400 17.384 -17.589 1.00 0.00 C ATOM 2382 O SER A 149 -7.034 18.211 -18.401 1.00 0.00 O ATOM 2383 CB SER A 149 -6.016 17.840 -15.568 1.00 0.00 C ATOM 2384 OG SER A 149 -5.465 19.078 -15.996 1.00 0.00 O ATOM 0 H SER A 149 -7.537 15.946 -14.906 1.00 0.00 H new ATOM 0 HA SER A 149 -7.987 18.651 -15.955 1.00 0.00 H new ATOM 0 HB2 SER A 149 -6.011 17.784 -14.479 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.407 17.012 -15.933 1.00 0.00 H new ATOM 0 HG SER A 149 -5.829 19.311 -16.876 1.00 0.00 H new ATOM 2390 N ILE A 150 -7.754 16.188 -17.962 1.00 0.00 N ATOM 2391 CA ILE A 150 -7.714 15.818 -19.400 1.00 0.00 C ATOM 2392 C ILE A 150 -9.087 16.043 -20.020 1.00 0.00 C ATOM 2393 O ILE A 150 -9.802 16.963 -19.677 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.355 14.341 -19.534 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -6.193 14.019 -18.600 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -6.942 14.045 -20.971 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -5.697 12.595 -18.867 1.00 0.00 C ATOM 0 H ILE A 150 -8.070 15.451 -17.332 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.970 16.431 -19.908 1.00 0.00 H new ATOM 0 HB ILE A 150 -8.219 13.731 -19.271 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -5.382 14.732 -18.753 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -6.511 14.115 -17.562 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -6.686 12.990 -21.066 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -7.768 14.280 -21.643 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.077 14.654 -21.234 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -4.867 12.368 -18.198 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.508 11.888 -18.692 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -5.363 12.514 -19.901 1.00 0.00 H new ATOM 2409 N GLU A 151 -9.458 15.190 -20.926 1.00 0.00 N ATOM 2410 CA GLU A 151 -10.788 15.319 -21.578 1.00 0.00 C ATOM 2411 C GLU A 151 -11.812 14.542 -20.755 1.00 0.00 C ATOM 2412 O GLU A 151 -12.914 14.269 -21.183 1.00 0.00 O ATOM 2413 CB GLU A 151 -10.716 14.779 -23.009 1.00 0.00 C ATOM 2414 CG GLU A 151 -12.054 15.006 -23.707 1.00 0.00 C ATOM 2415 CD GLU A 151 -11.916 14.682 -25.196 1.00 0.00 C ATOM 2416 OE1 GLU A 151 -10.849 14.239 -25.586 1.00 0.00 O ATOM 2417 OE2 GLU A 151 -12.877 14.885 -25.920 1.00 0.00 O ATOM 0 H GLU A 151 -8.894 14.403 -21.247 1.00 0.00 H new ATOM 0 HA GLU A 151 -11.087 16.366 -21.626 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -9.918 15.279 -23.558 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -10.476 13.716 -22.996 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -12.822 14.377 -23.257 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -12.373 16.040 -23.577 1.00 0.00 H new ATOM 2425 N ALA A 152 -11.436 14.198 -19.562 1.00 0.00 N ATOM 2426 CA ALA A 152 -12.353 13.445 -18.660 1.00 0.00 C ATOM 2427 C ALA A 152 -13.532 14.340 -18.263 1.00 0.00 C ATOM 2428 O ALA A 152 -14.663 13.897 -18.197 1.00 0.00 O ATOM 2429 CB ALA A 152 -11.597 13.027 -17.398 1.00 0.00 C ATOM 0 H ALA A 152 -10.521 14.407 -19.164 1.00 0.00 H new ATOM 0 HA ALA A 152 -12.722 12.561 -19.179 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -12.267 12.476 -16.738 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -10.755 12.392 -17.672 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -11.229 13.915 -16.883 1.00 0.00 H new ATOM 2435 N LEU A 153 -13.278 15.595 -17.992 1.00 0.00 N ATOM 2436 CA LEU A 153 -14.387 16.509 -17.595 1.00 0.00 C ATOM 2437 C LEU A 153 -14.969 17.171 -18.844 1.00 0.00 C ATOM 2438 O LEU A 153 -14.528 16.905 -19.960 1.00 0.00 O ATOM 2439 CB LEU A 153 -13.844 17.588 -16.651 1.00 0.00 C ATOM 2440 CG LEU A 153 -15.013 18.320 -15.985 1.00 0.00 C ATOM 2441 CD1 LEU A 153 -15.657 17.411 -14.935 1.00 0.00 C ATOM 2442 CD2 LEU A 153 -14.499 19.591 -15.308 1.00 0.00 C ATOM 0 H LEU A 153 -12.353 16.024 -18.029 1.00 0.00 H new ATOM 0 HA LEU A 153 -15.166 15.940 -17.087 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -13.205 17.135 -15.893 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -13.227 18.295 -17.206 1.00 0.00 H new ATOM 0 HG LEU A 153 -15.753 18.582 -16.741 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -16.489 17.934 -14.462 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -16.024 16.504 -15.415 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -14.917 17.147 -14.179 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -15.331 20.112 -14.834 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -13.758 19.327 -14.553 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -14.041 20.241 -16.054 1.00 0.00 H new TER 2454 LEU A 153