USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=27 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 35 GLN : amide:sc= -3.45! C(o=-4.3!,f=-5.5!) USER MOD Set 1.2: A 117 GLN : amide:sc= -0.891 K(o=-4.3,f=-4.9!) USER MOD Single : A 1 GLY N :NH3+ 157:sc= -8.67! (180deg=-11.6!) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 MET CE :methyl 175:sc= -0.0259 (180deg=-0.0355) USER MOD Single : A 11 CYS SG : rot 29:sc= -3.15 USER MOD Single : A 19 CYS SG : rot 133:sc= 0.3 USER MOD Single : A 23 LYS NZ :NH3+ 149:sc= -0.906 (180deg=-1.89) USER MOD Single : A 26 ASN : amide:sc= -0.0635 K(o=-0.063,f=-1.8!) USER MOD Single : A 27 ASN : amide:sc= -1.39! C(o=-1.4!,f=-6.5!) USER MOD Single : A 37 SER OG : rot -145:sc= 0.0745 USER MOD Single : A 41 HIS : no HD1:sc= -0.19 X(o=-0.19,f=-0.19) USER MOD Single : A 42 HIS : no HD1:sc= 0.782 K(o=0.78,f=-4.4!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.157) USER MOD Single : A 49 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 59 THR OG1 : rot 76:sc= -2.31! USER MOD Single : A 64 THR OG1 : rot 77:sc= -6.12! USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 GLN : amide:sc= 0.427 K(o=0.43,f=-0.65) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.117 USER MOD Single : A 82 LYS NZ :NH3+ 144:sc= -0.0754 (180deg=-0.712) USER MOD Single : A 86 ASN : amide:sc= -0.0972 K(o=-0.097,f=-0.63!) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= -0.325 K(o=-0.33,f=-2.6!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -138:sc= -5.54! (180deg=-7.99!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 172:sc= -0.556 USER MOD Single : A 104 LYS NZ :NH3+ 153:sc= -0.375 (180deg=-1.42!) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 38:sc= -1.39! USER MOD Single : A 114 HIS : no HD1:sc= -0.797 K(o=-0.8,f=-2.2!) USER MOD Single : A 116 HIS : no HE2:sc= -2.62 K(o=-2.6,f=-5.9!) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 CYS SG : rot 180:sc= -2.33 USER MOD Single : A 129 GLN : amide:sc= -6.89! C(o=-6.9!,f=-9.5!) USER MOD Single : A 132 GLN : amide:sc= -5.32! C(o=-5.3!,f=-3.9!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 MET CE :methyl -151:sc= -1.13 (180deg=-3.44) USER MOD Single : A 137 LYS NZ :NH3+ -171:sc= -5.78! (180deg=-6.69!) USER MOD Single : A 141 GLN : amide:sc= -3.8! K(o=-3.8!,f=-0.73) USER MOD Single : A 144 HIS : no HD1:sc= -0.293 K(o=-0.29,f=-1.1) USER MOD Single : A 145 GLN : amide:sc= -0.111 K(o=-0.11,f=-0.96) USER MOD Single : A 148 CYS SG : rot 13:sc= 0.874 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 12.072 -5.192 -6.378 1.00 0.00 N ATOM 2 CA GLY A 1 11.202 -6.350 -6.318 1.00 0.00 C ATOM 3 C GLY A 1 11.955 -7.597 -6.759 1.00 0.00 C ATOM 4 O GLY A 1 11.358 -8.528 -7.297 1.00 0.00 O ATOM 0 H1 GLY A 1 11.497 -4.330 -6.462 1.00 0.00 H new ATOM 0 H2 GLY A 1 12.645 -5.143 -5.511 1.00 0.00 H new ATOM 0 H3 GLY A 1 12.699 -5.271 -7.204 1.00 0.00 H new ATOM 0 HA2 GLY A 1 10.829 -6.482 -5.302 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.334 -6.195 -6.958 1.00 0.00 H new ATOM 8 N PRO A 2 13.270 -7.614 -6.530 1.00 0.00 N ATOM 9 CA PRO A 2 14.145 -8.712 -6.880 1.00 0.00 C ATOM 10 C PRO A 2 13.895 -9.884 -5.941 1.00 0.00 C ATOM 11 O PRO A 2 12.920 -9.885 -5.193 1.00 0.00 O ATOM 12 CB PRO A 2 15.557 -8.160 -6.702 1.00 0.00 C ATOM 13 CG PRO A 2 15.378 -7.126 -5.591 1.00 0.00 C ATOM 14 CD PRO A 2 14.003 -6.538 -5.899 1.00 0.00 C ATOM 0 HA PRO A 2 13.983 -9.077 -7.894 1.00 0.00 H new ATOM 0 HB2 PRO A 2 16.264 -8.940 -6.419 1.00 0.00 H new ATOM 0 HB3 PRO A 2 15.933 -7.707 -7.619 1.00 0.00 H new ATOM 0 HG2 PRO A 2 15.410 -7.584 -4.602 1.00 0.00 H new ATOM 0 HG3 PRO A 2 16.159 -6.366 -5.616 1.00 0.00 H new ATOM 0 HD2 PRO A 2 13.505 -6.201 -4.990 1.00 0.00 H new ATOM 0 HD3 PRO A 2 14.082 -5.674 -6.559 1.00 0.00 H new ATOM 22 N LEU A 3 14.729 -10.879 -5.949 1.00 0.00 N ATOM 23 CA LEU A 3 14.524 -12.050 -5.050 1.00 0.00 C ATOM 24 C LEU A 3 15.125 -11.748 -3.675 1.00 0.00 C ATOM 25 O LEU A 3 16.127 -11.070 -3.559 1.00 0.00 O ATOM 26 CB LEU A 3 15.213 -13.277 -5.648 1.00 0.00 C ATOM 27 CG LEU A 3 14.728 -13.489 -7.082 1.00 0.00 C ATOM 28 CD1 LEU A 3 15.329 -14.780 -7.639 1.00 0.00 C ATOM 29 CD2 LEU A 3 13.200 -13.593 -7.093 1.00 0.00 C ATOM 0 H LEU A 3 15.555 -10.935 -6.545 1.00 0.00 H new ATOM 0 HA LEU A 3 13.457 -12.246 -4.946 1.00 0.00 H new ATOM 0 HB2 LEU A 3 16.294 -13.142 -5.635 1.00 0.00 H new ATOM 0 HB3 LEU A 3 14.995 -14.159 -5.045 1.00 0.00 H new ATOM 0 HG LEU A 3 15.041 -12.647 -7.699 1.00 0.00 H new ATOM 0 HD11 LEU A 3 14.983 -14.931 -8.662 1.00 0.00 H new ATOM 0 HD12 LEU A 3 16.417 -14.708 -7.631 1.00 0.00 H new ATOM 0 HD13 LEU A 3 15.016 -15.623 -7.022 1.00 0.00 H new ATOM 0 HD21 LEU A 3 12.853 -13.744 -8.115 1.00 0.00 H new ATOM 0 HD22 LEU A 3 12.888 -14.435 -6.476 1.00 0.00 H new ATOM 0 HD23 LEU A 3 12.770 -12.673 -6.696 1.00 0.00 H new ATOM 41 N GLY A 4 14.521 -12.251 -2.630 1.00 0.00 N ATOM 42 CA GLY A 4 15.061 -11.992 -1.265 1.00 0.00 C ATOM 43 C GLY A 4 14.629 -10.603 -0.794 1.00 0.00 C ATOM 44 O GLY A 4 15.393 -9.877 -0.189 1.00 0.00 O ATOM 0 H GLY A 4 13.680 -12.828 -2.664 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.700 -12.751 -0.571 1.00 0.00 H new ATOM 0 HA3 GLY A 4 16.149 -12.061 -1.275 1.00 0.00 H new ATOM 48 N SER A 5 13.409 -10.225 -1.063 1.00 0.00 N ATOM 49 CA SER A 5 12.936 -8.883 -0.625 1.00 0.00 C ATOM 50 C SER A 5 13.007 -8.797 0.902 1.00 0.00 C ATOM 51 O SER A 5 12.742 -9.754 1.599 1.00 0.00 O ATOM 52 CB SER A 5 11.490 -8.677 -1.080 1.00 0.00 C ATOM 53 OG SER A 5 11.084 -7.350 -0.767 1.00 0.00 O ATOM 0 H SER A 5 12.722 -10.786 -1.566 1.00 0.00 H new ATOM 0 HA SER A 5 13.567 -8.111 -1.066 1.00 0.00 H new ATOM 0 HB2 SER A 5 11.406 -8.852 -2.153 1.00 0.00 H new ATOM 0 HB3 SER A 5 10.835 -9.396 -0.587 1.00 0.00 H new ATOM 0 HG SER A 5 10.158 -7.214 -1.059 1.00 0.00 H new ATOM 59 N MET A 6 13.372 -7.657 1.424 1.00 0.00 N ATOM 60 CA MET A 6 13.469 -7.516 2.901 1.00 0.00 C ATOM 61 C MET A 6 12.164 -6.949 3.457 1.00 0.00 C ATOM 62 O MET A 6 11.599 -6.017 2.921 1.00 0.00 O ATOM 63 CB MET A 6 14.612 -6.563 3.256 1.00 0.00 C ATOM 64 CG MET A 6 14.868 -6.622 4.763 1.00 0.00 C ATOM 65 SD MET A 6 15.563 -5.048 5.322 1.00 0.00 S ATOM 66 CE MET A 6 14.005 -4.284 5.843 1.00 0.00 C ATOM 0 H MET A 6 13.606 -6.820 0.891 1.00 0.00 H new ATOM 0 HA MET A 6 13.657 -8.498 3.335 1.00 0.00 H new ATOM 0 HB2 MET A 6 15.514 -6.840 2.711 1.00 0.00 H new ATOM 0 HB3 MET A 6 14.359 -5.546 2.958 1.00 0.00 H new ATOM 0 HG2 MET A 6 13.938 -6.829 5.292 1.00 0.00 H new ATOM 0 HG3 MET A 6 15.554 -7.437 4.994 1.00 0.00 H new ATOM 0 HE1 MET A 6 14.211 -3.321 6.311 1.00 0.00 H new ATOM 0 HE2 MET A 6 13.364 -4.135 4.974 1.00 0.00 H new ATOM 0 HE3 MET A 6 13.502 -4.935 6.558 1.00 0.00 H new ATOM 76 N ALA A 7 11.690 -7.499 4.538 1.00 0.00 N ATOM 77 CA ALA A 7 10.432 -6.988 5.148 1.00 0.00 C ATOM 78 C ALA A 7 9.226 -7.528 4.390 1.00 0.00 C ATOM 79 O ALA A 7 9.331 -7.998 3.276 1.00 0.00 O ATOM 80 CB ALA A 7 10.422 -5.458 5.099 1.00 0.00 C ATOM 0 H ALA A 7 12.121 -8.283 5.027 1.00 0.00 H new ATOM 0 HA ALA A 7 10.380 -7.321 6.185 1.00 0.00 H new ATOM 0 HB1 ALA A 7 9.500 -5.086 5.546 1.00 0.00 H new ATOM 0 HB2 ALA A 7 11.277 -5.071 5.654 1.00 0.00 H new ATOM 0 HB3 ALA A 7 10.482 -5.127 4.062 1.00 0.00 H new ATOM 86 N LEU A 8 8.079 -7.463 4.999 1.00 0.00 N ATOM 87 CA LEU A 8 6.848 -7.972 4.333 1.00 0.00 C ATOM 88 C LEU A 8 6.079 -6.801 3.722 1.00 0.00 C ATOM 89 O LEU A 8 5.994 -5.734 4.296 1.00 0.00 O ATOM 90 CB LEU A 8 5.957 -8.672 5.361 1.00 0.00 C ATOM 91 CG LEU A 8 6.824 -9.392 6.399 1.00 0.00 C ATOM 92 CD1 LEU A 8 7.480 -8.368 7.324 1.00 0.00 C ATOM 93 CD2 LEU A 8 5.939 -10.318 7.232 1.00 0.00 C ATOM 0 H LEU A 8 7.938 -7.078 5.933 1.00 0.00 H new ATOM 0 HA LEU A 8 7.129 -8.678 3.552 1.00 0.00 H new ATOM 0 HB2 LEU A 8 5.314 -7.943 5.854 1.00 0.00 H new ATOM 0 HB3 LEU A 8 5.303 -9.387 4.862 1.00 0.00 H new ATOM 0 HG LEU A 8 7.596 -9.968 5.889 1.00 0.00 H new ATOM 0 HD11 LEU A 8 8.095 -8.885 8.060 1.00 0.00 H new ATOM 0 HD12 LEU A 8 8.105 -7.695 6.737 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.708 -7.793 7.836 1.00 0.00 H new ATOM 0 HD21 LEU A 8 6.549 -10.834 7.973 1.00 0.00 H new ATOM 0 HD22 LEU A 8 5.173 -9.731 7.738 1.00 0.00 H new ATOM 0 HD23 LEU A 8 5.463 -11.050 6.580 1.00 0.00 H new ATOM 105 N ARG A 9 5.507 -6.993 2.566 1.00 0.00 N ATOM 106 CA ARG A 9 4.732 -5.893 1.927 1.00 0.00 C ATOM 107 C ARG A 9 3.306 -5.905 2.477 1.00 0.00 C ATOM 108 O ARG A 9 2.692 -6.945 2.608 1.00 0.00 O ATOM 109 CB ARG A 9 4.695 -6.109 0.414 1.00 0.00 C ATOM 110 CG ARG A 9 4.065 -4.889 -0.261 1.00 0.00 C ATOM 111 CD ARG A 9 3.968 -5.139 -1.768 1.00 0.00 C ATOM 112 NE ARG A 9 5.331 -5.400 -2.312 1.00 0.00 N ATOM 113 CZ ARG A 9 5.566 -5.241 -3.584 1.00 0.00 C ATOM 114 NH1 ARG A 9 4.610 -4.853 -4.382 1.00 0.00 N ATOM 115 NH2 ARG A 9 6.760 -5.470 -4.059 1.00 0.00 N ATOM 0 H ARG A 9 5.543 -7.864 2.036 1.00 0.00 H new ATOM 0 HA ARG A 9 5.204 -4.935 2.144 1.00 0.00 H new ATOM 0 HB2 ARG A 9 5.704 -6.267 0.034 1.00 0.00 H new ATOM 0 HB3 ARG A 9 4.121 -7.005 0.178 1.00 0.00 H new ATOM 0 HG2 ARG A 9 3.074 -4.701 0.153 1.00 0.00 H new ATOM 0 HG3 ARG A 9 4.665 -4.000 -0.066 1.00 0.00 H new ATOM 0 HD2 ARG A 9 3.316 -5.990 -1.966 1.00 0.00 H new ATOM 0 HD3 ARG A 9 3.525 -4.275 -2.264 1.00 0.00 H new ATOM 0 HE ARG A 9 6.080 -5.703 -1.689 1.00 0.00 H new ATOM 0 HH11 ARG A 9 3.677 -4.674 -4.011 1.00 0.00 H new ATOM 0 HH12 ARG A 9 4.795 -4.729 -5.377 1.00 0.00 H new ATOM 0 HH21 ARG A 9 7.508 -5.773 -3.435 1.00 0.00 H new ATOM 0 HH22 ARG A 9 6.945 -5.346 -5.054 1.00 0.00 H new ATOM 129 N ALA A 10 2.772 -4.763 2.803 1.00 0.00 N ATOM 130 CA ALA A 10 1.384 -4.722 3.344 1.00 0.00 C ATOM 131 C ALA A 10 0.685 -3.454 2.865 1.00 0.00 C ATOM 132 O ALA A 10 1.311 -2.442 2.619 1.00 0.00 O ATOM 133 CB ALA A 10 1.430 -4.715 4.869 1.00 0.00 C ATOM 0 H ALA A 10 3.234 -3.857 2.719 1.00 0.00 H new ATOM 0 HA ALA A 10 0.838 -5.599 2.994 1.00 0.00 H new ATOM 0 HB1 ALA A 10 0.414 -4.685 5.264 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.930 -5.617 5.222 1.00 0.00 H new ATOM 0 HB3 ALA A 10 1.979 -3.838 5.212 1.00 0.00 H new ATOM 139 N CYS A 11 -0.611 -3.496 2.744 1.00 0.00 N ATOM 140 CA CYS A 11 -1.347 -2.287 2.297 1.00 0.00 C ATOM 141 C CYS A 11 -2.685 -2.210 3.030 1.00 0.00 C ATOM 142 O CYS A 11 -3.490 -3.119 2.976 1.00 0.00 O ATOM 143 CB CYS A 11 -1.589 -2.363 0.792 1.00 0.00 C ATOM 144 SG CYS A 11 -0.311 -1.412 -0.069 1.00 0.00 S ATOM 0 H CYS A 11 -1.190 -4.314 2.935 1.00 0.00 H new ATOM 0 HA CYS A 11 -0.758 -1.397 2.521 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -1.571 -3.401 0.461 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -2.576 -1.969 0.551 1.00 0.00 H new ATOM 0 HG CYS A 11 0.783 -1.421 0.633 1.00 0.00 H new ATOM 150 N GLY A 12 -2.931 -1.123 3.704 1.00 0.00 N ATOM 151 CA GLY A 12 -4.220 -0.966 4.435 1.00 0.00 C ATOM 152 C GLY A 12 -4.909 0.303 3.947 1.00 0.00 C ATOM 153 O GLY A 12 -4.387 1.010 3.105 1.00 0.00 O ATOM 0 H GLY A 12 -2.292 -0.332 3.781 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -4.859 -1.832 4.264 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -4.041 -0.909 5.509 1.00 0.00 H new ATOM 157 N LEU A 13 -6.079 0.602 4.443 1.00 0.00 N ATOM 158 CA LEU A 13 -6.775 1.828 3.968 1.00 0.00 C ATOM 159 C LEU A 13 -7.141 2.737 5.136 1.00 0.00 C ATOM 160 O LEU A 13 -7.950 2.389 5.975 1.00 0.00 O ATOM 161 CB LEU A 13 -8.073 1.431 3.246 1.00 0.00 C ATOM 162 CG LEU A 13 -8.040 1.919 1.795 1.00 0.00 C ATOM 163 CD1 LEU A 13 -9.418 1.751 1.153 1.00 0.00 C ATOM 164 CD2 LEU A 13 -7.647 3.394 1.750 1.00 0.00 C ATOM 0 H LEU A 13 -6.577 0.057 5.147 1.00 0.00 H new ATOM 0 HA LEU A 13 -6.102 2.359 3.295 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.195 0.348 3.271 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.931 1.860 3.763 1.00 0.00 H new ATOM 0 HG LEU A 13 -7.307 1.327 1.246 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -9.384 2.101 0.121 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -9.701 0.699 1.170 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -10.152 2.334 1.710 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -7.626 3.733 0.714 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -8.375 3.982 2.310 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -6.660 3.521 2.194 1.00 0.00 H new ATOM 176 N ILE A 14 -6.612 3.929 5.165 1.00 0.00 N ATOM 177 CA ILE A 14 -7.007 4.869 6.242 1.00 0.00 C ATOM 178 C ILE A 14 -8.270 5.563 5.755 1.00 0.00 C ATOM 179 O ILE A 14 -8.251 6.345 4.828 1.00 0.00 O ATOM 180 CB ILE A 14 -5.894 5.884 6.515 1.00 0.00 C ATOM 181 CG1 ILE A 14 -4.721 5.166 7.185 1.00 0.00 C ATOM 182 CG2 ILE A 14 -6.414 6.980 7.446 1.00 0.00 C ATOM 183 CD1 ILE A 14 -3.539 6.126 7.335 1.00 0.00 C ATOM 0 H ILE A 14 -5.931 4.287 4.496 1.00 0.00 H new ATOM 0 HA ILE A 14 -7.183 4.344 7.181 1.00 0.00 H new ATOM 0 HB ILE A 14 -5.569 6.333 5.576 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -5.023 4.792 8.163 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -4.425 4.301 6.591 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -5.620 7.701 7.639 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -7.258 7.486 6.977 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -6.736 6.535 8.387 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.708 5.608 7.813 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.229 6.479 6.351 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -3.837 6.977 7.948 1.00 0.00 H new ATOM 195 N ILE A 15 -9.375 5.226 6.338 1.00 0.00 N ATOM 196 CA ILE A 15 -10.670 5.791 5.885 1.00 0.00 C ATOM 197 C ILE A 15 -11.058 6.993 6.735 1.00 0.00 C ATOM 198 O ILE A 15 -10.908 6.994 7.938 1.00 0.00 O ATOM 199 CB ILE A 15 -11.708 4.683 6.024 1.00 0.00 C ATOM 200 CG1 ILE A 15 -11.317 3.538 5.087 1.00 0.00 C ATOM 201 CG2 ILE A 15 -13.106 5.188 5.670 1.00 0.00 C ATOM 202 CD1 ILE A 15 -11.988 2.241 5.535 1.00 0.00 C ATOM 0 H ILE A 15 -9.440 4.574 7.120 1.00 0.00 H new ATOM 0 HA ILE A 15 -10.602 6.135 4.853 1.00 0.00 H new ATOM 0 HB ILE A 15 -11.732 4.341 7.059 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -11.614 3.776 4.066 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -10.234 3.414 5.084 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -13.825 4.376 5.778 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -13.378 6.005 6.339 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -13.114 5.544 4.640 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -11.703 1.433 4.862 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -11.670 1.998 6.549 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -13.071 2.366 5.515 1.00 0.00 H new ATOM 214 N PHE A 16 -11.558 8.018 6.104 1.00 0.00 N ATOM 215 CA PHE A 16 -11.965 9.230 6.857 1.00 0.00 C ATOM 216 C PHE A 16 -13.278 9.763 6.284 1.00 0.00 C ATOM 217 O PHE A 16 -13.368 10.083 5.117 1.00 0.00 O ATOM 218 CB PHE A 16 -10.883 10.296 6.711 1.00 0.00 C ATOM 219 CG PHE A 16 -10.865 10.797 5.287 1.00 0.00 C ATOM 220 CD1 PHE A 16 -10.151 10.098 4.306 1.00 0.00 C ATOM 221 CD2 PHE A 16 -11.563 11.962 4.946 1.00 0.00 C ATOM 222 CE1 PHE A 16 -10.138 10.562 2.985 1.00 0.00 C ATOM 223 CE2 PHE A 16 -11.549 12.426 3.627 1.00 0.00 C ATOM 224 CZ PHE A 16 -10.837 11.728 2.646 1.00 0.00 C ATOM 0 H PHE A 16 -11.702 8.066 5.095 1.00 0.00 H new ATOM 0 HA PHE A 16 -12.099 8.982 7.910 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.075 11.121 7.397 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -9.910 9.882 6.975 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.610 9.201 4.568 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -12.113 12.503 5.702 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.589 10.021 2.228 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -12.089 13.324 3.365 1.00 0.00 H new ATOM 0 HZ PHE A 16 -10.826 12.088 1.628 1.00 0.00 H new ATOM 234 N ARG A 17 -14.292 9.882 7.094 1.00 0.00 N ATOM 235 CA ARG A 17 -15.582 10.411 6.576 1.00 0.00 C ATOM 236 C ARG A 17 -15.538 11.940 6.641 1.00 0.00 C ATOM 237 O ARG A 17 -15.349 12.519 7.691 1.00 0.00 O ATOM 238 CB ARG A 17 -16.738 9.886 7.430 1.00 0.00 C ATOM 239 CG ARG A 17 -16.728 10.575 8.795 1.00 0.00 C ATOM 240 CD ARG A 17 -17.644 9.810 9.750 1.00 0.00 C ATOM 241 NE ARG A 17 -17.848 10.610 10.989 1.00 0.00 N ATOM 242 CZ ARG A 17 -18.673 11.621 10.979 1.00 0.00 C ATOM 243 NH1 ARG A 17 -19.309 11.933 9.884 1.00 0.00 N ATOM 244 NH2 ARG A 17 -18.860 12.321 12.065 1.00 0.00 N ATOM 0 H ARG A 17 -14.284 9.638 8.084 1.00 0.00 H new ATOM 0 HA ARG A 17 -15.734 10.086 5.547 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -17.687 10.070 6.926 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -16.648 8.807 7.556 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -15.713 10.607 9.192 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -17.065 11.607 8.697 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -18.603 9.611 9.271 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -17.204 8.843 9.997 1.00 0.00 H new ATOM 0 HE ARG A 17 -17.345 10.369 11.843 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -19.162 11.387 9.035 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -19.954 12.723 9.876 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -18.361 12.078 12.921 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -19.505 13.111 12.058 1.00 0.00 H new ATOM 258 N ARG A 18 -15.688 12.599 5.525 1.00 0.00 N ATOM 259 CA ARG A 18 -15.631 14.088 5.530 1.00 0.00 C ATOM 260 C ARG A 18 -17.034 14.666 5.724 1.00 0.00 C ATOM 261 O ARG A 18 -17.997 14.200 5.144 1.00 0.00 O ATOM 262 CB ARG A 18 -15.045 14.578 4.205 1.00 0.00 C ATOM 263 CG ARG A 18 -14.831 16.091 4.265 1.00 0.00 C ATOM 264 CD ARG A 18 -13.992 16.533 3.063 1.00 0.00 C ATOM 265 NE ARG A 18 -14.739 16.251 1.803 1.00 0.00 N ATOM 266 CZ ARG A 18 -15.749 16.999 1.459 1.00 0.00 C ATOM 267 NH1 ARG A 18 -16.110 17.997 2.218 1.00 0.00 N ATOM 268 NH2 ARG A 18 -16.397 16.751 0.353 1.00 0.00 N ATOM 0 H ARG A 18 -15.847 12.172 4.612 1.00 0.00 H new ATOM 0 HA ARG A 18 -14.998 14.421 6.352 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.099 14.075 4.006 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -15.717 14.328 3.384 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -15.792 16.606 4.261 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -14.328 16.362 5.193 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -13.768 17.597 3.135 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -13.038 16.006 3.058 1.00 0.00 H new ATOM 0 HE ARG A 18 -14.458 15.471 1.209 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -15.602 18.192 3.081 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -16.901 18.583 1.949 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -16.113 15.972 -0.241 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -17.188 17.336 0.083 1.00 0.00 H new ATOM 282 N CYS A 19 -17.153 15.682 6.533 1.00 0.00 N ATOM 283 CA CYS A 19 -18.489 16.304 6.767 1.00 0.00 C ATOM 284 C CYS A 19 -18.788 17.287 5.636 1.00 0.00 C ATOM 285 O CYS A 19 -17.899 17.729 4.936 1.00 0.00 O ATOM 286 CB CYS A 19 -18.474 17.052 8.102 1.00 0.00 C ATOM 287 SG CYS A 19 -17.112 18.245 8.109 1.00 0.00 S ATOM 0 H CYS A 19 -16.381 16.110 7.044 1.00 0.00 H new ATOM 0 HA CYS A 19 -19.256 15.530 6.794 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -19.423 17.566 8.254 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -18.358 16.347 8.925 1.00 0.00 H new ATOM 0 HG CYS A 19 -17.545 19.395 8.534 1.00 0.00 H new ATOM 293 N LEU A 20 -20.032 17.630 5.443 1.00 0.00 N ATOM 294 CA LEU A 20 -20.375 18.579 4.351 1.00 0.00 C ATOM 295 C LEU A 20 -19.569 19.865 4.534 1.00 0.00 C ATOM 296 O LEU A 20 -19.055 20.428 3.587 1.00 0.00 O ATOM 297 CB LEU A 20 -21.869 18.901 4.409 1.00 0.00 C ATOM 298 CG LEU A 20 -22.663 17.597 4.430 1.00 0.00 C ATOM 299 CD1 LEU A 20 -24.161 17.910 4.392 1.00 0.00 C ATOM 300 CD2 LEU A 20 -22.291 16.750 3.212 1.00 0.00 C ATOM 0 H LEU A 20 -20.822 17.294 5.993 1.00 0.00 H new ATOM 0 HA LEU A 20 -20.138 18.132 3.386 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -22.092 19.491 5.298 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -22.157 19.503 3.547 1.00 0.00 H new ATOM 0 HG LEU A 20 -22.428 17.046 5.341 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -24.728 16.979 4.407 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -24.429 18.512 5.260 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -24.394 18.462 3.482 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -22.859 15.820 3.229 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -22.524 17.301 2.301 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -21.225 16.525 3.237 1.00 0.00 H new ATOM 312 N ILE A 21 -19.442 20.330 5.749 1.00 0.00 N ATOM 313 CA ILE A 21 -18.656 21.574 5.987 1.00 0.00 C ATOM 314 C ILE A 21 -18.003 21.518 7.376 1.00 0.00 C ATOM 315 O ILE A 21 -18.508 20.885 8.279 1.00 0.00 O ATOM 316 CB ILE A 21 -19.573 22.801 5.897 1.00 0.00 C ATOM 317 CG1 ILE A 21 -20.441 22.910 7.158 1.00 0.00 C ATOM 318 CG2 ILE A 21 -20.477 22.680 4.669 1.00 0.00 C ATOM 319 CD1 ILE A 21 -21.295 21.650 7.321 1.00 0.00 C ATOM 0 H ILE A 21 -19.847 19.904 6.583 1.00 0.00 H new ATOM 0 HA ILE A 21 -17.880 21.653 5.226 1.00 0.00 H new ATOM 0 HB ILE A 21 -18.955 23.695 5.811 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -19.807 23.045 8.034 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -21.084 23.788 7.092 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -21.127 23.553 4.608 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -19.864 22.621 3.770 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -21.086 21.780 4.753 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -21.907 21.739 8.219 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -21.942 21.534 6.451 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -20.645 20.779 7.409 1.00 0.00 H new ATOM 331 N PRO A 22 -16.887 22.187 7.547 1.00 0.00 N ATOM 332 CA PRO A 22 -16.159 22.219 8.853 1.00 0.00 C ATOM 333 C PRO A 22 -17.010 22.821 9.973 1.00 0.00 C ATOM 334 O PRO A 22 -17.883 23.634 9.738 1.00 0.00 O ATOM 335 CB PRO A 22 -14.939 23.107 8.596 1.00 0.00 C ATOM 336 CG PRO A 22 -14.802 23.202 7.112 1.00 0.00 C ATOM 337 CD PRO A 22 -16.191 22.981 6.522 1.00 0.00 C ATOM 0 HA PRO A 22 -15.899 21.212 9.180 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -15.075 24.094 9.039 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -14.043 22.677 9.044 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -14.410 24.177 6.822 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -14.102 22.454 6.741 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -16.701 23.926 6.334 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -16.142 22.451 5.571 1.00 0.00 H new ATOM 345 N LYS A 23 -16.754 22.433 11.192 1.00 0.00 N ATOM 346 CA LYS A 23 -17.536 22.985 12.331 1.00 0.00 C ATOM 347 C LYS A 23 -16.568 23.443 13.423 1.00 0.00 C ATOM 348 O LYS A 23 -16.227 24.606 13.519 1.00 0.00 O ATOM 349 CB LYS A 23 -18.462 21.899 12.886 1.00 0.00 C ATOM 350 CG LYS A 23 -19.901 22.419 12.911 1.00 0.00 C ATOM 351 CD LYS A 23 -20.464 22.422 11.488 1.00 0.00 C ATOM 352 CE LYS A 23 -21.166 23.755 11.217 1.00 0.00 C ATOM 353 NZ LYS A 23 -22.019 23.628 10.002 1.00 0.00 N ATOM 0 H LYS A 23 -16.035 21.756 11.448 1.00 0.00 H new ATOM 0 HA LYS A 23 -18.136 23.831 11.994 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -18.399 21.002 12.269 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -18.148 21.617 13.891 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -20.515 21.791 13.556 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -19.928 23.426 13.327 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -19.660 22.270 10.768 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -21.166 21.598 11.362 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -21.776 24.038 12.075 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -20.428 24.545 11.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -22.845 24.254 10.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -21.469 23.898 9.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -22.339 22.643 9.904 1.00 0.00 H new ATOM 367 N VAL A 24 -16.121 22.535 14.241 1.00 0.00 N ATOM 368 CA VAL A 24 -15.167 22.906 15.325 1.00 0.00 C ATOM 369 C VAL A 24 -13.736 22.725 14.817 1.00 0.00 C ATOM 370 O VAL A 24 -12.781 22.923 15.541 1.00 0.00 O ATOM 371 CB VAL A 24 -15.393 22.005 16.539 1.00 0.00 C ATOM 372 CG1 VAL A 24 -14.505 22.471 17.692 1.00 0.00 C ATOM 373 CG2 VAL A 24 -16.862 22.083 16.964 1.00 0.00 C ATOM 0 H VAL A 24 -16.375 21.548 14.207 1.00 0.00 H new ATOM 0 HA VAL A 24 -15.328 23.945 15.613 1.00 0.00 H new ATOM 0 HB VAL A 24 -15.142 20.976 16.280 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -14.666 21.829 18.558 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -13.459 22.418 17.390 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -14.756 23.499 17.952 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -17.025 21.441 17.830 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -17.112 23.112 17.223 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -17.497 21.752 16.142 1.00 0.00 H new ATOM 383 N ASP A 25 -13.583 22.334 13.580 1.00 0.00 N ATOM 384 CA ASP A 25 -12.215 22.120 13.027 1.00 0.00 C ATOM 385 C ASP A 25 -11.496 21.068 13.873 1.00 0.00 C ATOM 386 O ASP A 25 -10.332 21.201 14.195 1.00 0.00 O ATOM 387 CB ASP A 25 -11.429 23.434 13.058 1.00 0.00 C ATOM 388 CG ASP A 25 -12.085 24.444 12.117 1.00 0.00 C ATOM 389 OD1 ASP A 25 -12.921 24.034 11.330 1.00 0.00 O ATOM 390 OD2 ASP A 25 -11.740 25.612 12.199 1.00 0.00 O ATOM 0 H ASP A 25 -14.347 22.154 12.929 1.00 0.00 H new ATOM 0 HA ASP A 25 -12.287 21.777 11.995 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -11.403 23.830 14.073 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -10.396 23.259 12.758 1.00 0.00 H new ATOM 396 N ASN A 26 -12.189 20.025 14.233 1.00 0.00 N ATOM 397 CA ASN A 26 -11.568 18.952 15.058 1.00 0.00 C ATOM 398 C ASN A 26 -12.315 17.645 14.812 1.00 0.00 C ATOM 399 O ASN A 26 -11.774 16.688 14.295 1.00 0.00 O ATOM 400 CB ASN A 26 -11.670 19.321 16.538 1.00 0.00 C ATOM 401 CG ASN A 26 -10.719 18.442 17.350 1.00 0.00 C ATOM 402 OD1 ASN A 26 -9.689 18.027 16.861 1.00 0.00 O ATOM 403 ND2 ASN A 26 -11.027 18.134 18.581 1.00 0.00 N ATOM 0 H ASN A 26 -13.167 19.868 13.989 1.00 0.00 H new ATOM 0 HA ASN A 26 -10.519 18.839 14.785 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -11.420 20.373 16.679 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -12.694 19.187 16.887 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -10.402 17.545 19.131 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -11.893 18.483 18.993 1.00 0.00 H new ATOM 410 N ASN A 27 -13.561 17.608 15.180 1.00 0.00 N ATOM 411 CA ASN A 27 -14.370 16.374 14.973 1.00 0.00 C ATOM 412 C ASN A 27 -15.000 16.412 13.581 1.00 0.00 C ATOM 413 O ASN A 27 -15.816 15.581 13.237 1.00 0.00 O ATOM 414 CB ASN A 27 -15.474 16.308 16.031 1.00 0.00 C ATOM 415 CG ASN A 27 -16.589 17.288 15.667 1.00 0.00 C ATOM 416 OD1 ASN A 27 -16.405 18.157 14.838 1.00 0.00 O ATOM 417 ND2 ASN A 27 -17.752 17.185 16.254 1.00 0.00 N ATOM 0 H ASN A 27 -14.059 18.383 15.618 1.00 0.00 H new ATOM 0 HA ASN A 27 -13.730 15.496 15.060 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -15.872 15.295 16.094 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -15.067 16.552 17.012 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -18.503 17.833 16.016 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -17.909 16.456 16.950 1.00 0.00 H new ATOM 424 N ALA A 28 -14.630 17.373 12.778 1.00 0.00 N ATOM 425 CA ALA A 28 -15.210 17.465 11.409 1.00 0.00 C ATOM 426 C ALA A 28 -14.892 16.189 10.631 1.00 0.00 C ATOM 427 O ALA A 28 -15.681 15.726 9.830 1.00 0.00 O ATOM 428 CB ALA A 28 -14.601 18.663 10.678 1.00 0.00 C ATOM 0 H ALA A 28 -13.951 18.098 13.012 1.00 0.00 H new ATOM 0 HA ALA A 28 -16.290 17.588 11.483 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -15.025 18.732 9.676 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -14.823 19.577 11.229 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -13.521 18.535 10.607 1.00 0.00 H new ATOM 434 N ILE A 29 -13.740 15.616 10.857 1.00 0.00 N ATOM 435 CA ILE A 29 -13.370 14.373 10.126 1.00 0.00 C ATOM 436 C ILE A 29 -13.166 13.218 11.102 1.00 0.00 C ATOM 437 O ILE A 29 -12.517 13.350 12.120 1.00 0.00 O ATOM 438 CB ILE A 29 -12.081 14.611 9.340 1.00 0.00 C ATOM 439 CG1 ILE A 29 -12.385 15.527 8.155 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.538 13.277 8.832 1.00 0.00 C ATOM 441 CD1 ILE A 29 -11.107 16.242 7.715 1.00 0.00 C ATOM 0 H ILE A 29 -13.040 15.956 11.517 1.00 0.00 H new ATOM 0 HA ILE A 29 -14.178 14.114 9.442 1.00 0.00 H new ATOM 0 HB ILE A 29 -11.336 15.077 9.984 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -12.791 14.945 7.328 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.145 16.258 8.433 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -10.619 13.448 8.272 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.330 12.623 9.679 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -12.277 12.807 8.183 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.327 16.894 6.870 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -10.720 16.838 8.542 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -10.361 15.504 7.419 1.00 0.00 H new ATOM 453 N GLU A 30 -13.708 12.078 10.779 1.00 0.00 N ATOM 454 CA GLU A 30 -13.546 10.887 11.662 1.00 0.00 C ATOM 455 C GLU A 30 -12.949 9.751 10.835 1.00 0.00 C ATOM 456 O GLU A 30 -13.052 9.740 9.629 1.00 0.00 O ATOM 457 CB GLU A 30 -14.905 10.460 12.217 1.00 0.00 C ATOM 458 CG GLU A 30 -15.501 11.598 13.044 1.00 0.00 C ATOM 459 CD GLU A 30 -16.809 11.131 13.685 1.00 0.00 C ATOM 460 OE1 GLU A 30 -17.265 10.054 13.337 1.00 0.00 O ATOM 461 OE2 GLU A 30 -17.333 11.859 14.513 1.00 0.00 O ATOM 0 H GLU A 30 -14.260 11.918 9.936 1.00 0.00 H new ATOM 0 HA GLU A 30 -12.889 11.131 12.497 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -15.578 10.200 11.400 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.793 9.568 12.834 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -14.796 11.909 13.815 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -15.684 12.466 12.410 1.00 0.00 H new ATOM 469 N PHE A 31 -12.310 8.805 11.468 1.00 0.00 N ATOM 470 CA PHE A 31 -11.694 7.687 10.698 1.00 0.00 C ATOM 471 C PHE A 31 -12.330 6.352 11.093 1.00 0.00 C ATOM 472 O PHE A 31 -12.831 6.189 12.189 1.00 0.00 O ATOM 473 CB PHE A 31 -10.193 7.634 10.997 1.00 0.00 C ATOM 474 CG PHE A 31 -9.547 8.948 10.620 1.00 0.00 C ATOM 475 CD1 PHE A 31 -9.051 9.141 9.324 1.00 0.00 C ATOM 476 CD2 PHE A 31 -9.438 9.971 11.571 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.449 10.358 8.980 1.00 0.00 C ATOM 478 CE2 PHE A 31 -8.835 11.185 11.227 1.00 0.00 C ATOM 479 CZ PHE A 31 -8.340 11.380 9.932 1.00 0.00 C ATOM 0 H PHE A 31 -12.188 8.758 12.480 1.00 0.00 H new ATOM 0 HA PHE A 31 -11.860 7.859 9.635 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.031 7.430 12.055 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -9.731 6.819 10.440 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -9.133 8.352 8.591 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -9.820 9.822 12.570 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -8.069 10.509 7.980 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -8.751 11.973 11.961 1.00 0.00 H new ATOM 0 HZ PHE A 31 -7.874 12.318 9.667 1.00 0.00 H new ATOM 489 N LEU A 32 -12.293 5.387 10.210 1.00 0.00 N ATOM 490 CA LEU A 32 -12.871 4.054 10.538 1.00 0.00 C ATOM 491 C LEU A 32 -11.827 3.249 11.307 1.00 0.00 C ATOM 492 O LEU A 32 -10.703 3.097 10.871 1.00 0.00 O ATOM 493 CB LEU A 32 -13.238 3.308 9.248 1.00 0.00 C ATOM 494 CG LEU A 32 -13.658 1.873 9.581 1.00 0.00 C ATOM 495 CD1 LEU A 32 -14.857 1.888 10.525 1.00 0.00 C ATOM 496 CD2 LEU A 32 -14.043 1.145 8.293 1.00 0.00 C ATOM 0 H LEU A 32 -11.887 5.467 9.278 1.00 0.00 H new ATOM 0 HA LEU A 32 -13.771 4.182 11.140 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -14.050 3.825 8.736 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.387 3.299 8.567 1.00 0.00 H new ATOM 0 HG LEU A 32 -12.825 1.360 10.062 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.150 0.864 10.757 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.589 2.406 11.446 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.690 2.404 10.047 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.342 0.124 8.528 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -14.873 1.665 7.815 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.189 1.126 7.616 1.00 0.00 H new ATOM 508 N LEU A 33 -12.187 2.735 12.446 1.00 0.00 N ATOM 509 CA LEU A 33 -11.214 1.944 13.244 1.00 0.00 C ATOM 510 C LEU A 33 -11.813 0.579 13.569 1.00 0.00 C ATOM 511 O LEU A 33 -12.944 0.471 13.999 1.00 0.00 O ATOM 512 CB LEU A 33 -10.889 2.691 14.540 1.00 0.00 C ATOM 513 CG LEU A 33 -9.741 3.669 14.287 1.00 0.00 C ATOM 514 CD1 LEU A 33 -9.699 4.716 15.401 1.00 0.00 C ATOM 515 CD2 LEU A 33 -8.417 2.901 14.264 1.00 0.00 C ATOM 0 H LEU A 33 -13.115 2.828 12.860 1.00 0.00 H new ATOM 0 HA LEU A 33 -10.298 1.806 12.670 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -11.769 3.229 14.893 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -10.613 1.983 15.322 1.00 0.00 H new ATOM 0 HG LEU A 33 -9.895 4.167 13.330 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.880 5.411 15.217 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.641 5.264 15.421 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -9.546 4.221 16.360 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -7.597 3.596 14.084 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -8.268 2.404 15.223 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -8.443 2.156 13.469 1.00 0.00 H new ATOM 527 N LEU A 34 -11.060 -0.464 13.364 1.00 0.00 N ATOM 528 CA LEU A 34 -11.576 -1.828 13.655 1.00 0.00 C ATOM 529 C LEU A 34 -10.928 -2.342 14.944 1.00 0.00 C ATOM 530 O LEU A 34 -9.764 -2.107 15.202 1.00 0.00 O ATOM 531 CB LEU A 34 -11.230 -2.752 12.487 1.00 0.00 C ATOM 532 CG LEU A 34 -11.753 -2.137 11.186 1.00 0.00 C ATOM 533 CD1 LEU A 34 -11.501 -3.098 10.025 1.00 0.00 C ATOM 534 CD2 LEU A 34 -13.254 -1.881 11.308 1.00 0.00 C ATOM 0 H LEU A 34 -10.106 -0.430 13.006 1.00 0.00 H new ATOM 0 HA LEU A 34 -12.658 -1.803 13.783 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -10.151 -2.894 12.428 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -11.673 -3.736 12.642 1.00 0.00 H new ATOM 0 HG LEU A 34 -11.234 -1.196 11.001 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.874 -2.658 9.100 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -10.431 -3.284 9.932 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -12.018 -4.039 10.213 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -13.625 -1.443 10.381 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -13.770 -2.823 11.496 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.440 -1.194 12.134 1.00 0.00 H new ATOM 546 N GLN A 35 -11.674 -3.030 15.763 1.00 0.00 N ATOM 547 CA GLN A 35 -11.102 -3.544 17.041 1.00 0.00 C ATOM 548 C GLN A 35 -10.608 -4.978 16.853 1.00 0.00 C ATOM 549 O GLN A 35 -11.330 -5.841 16.393 1.00 0.00 O ATOM 550 CB GLN A 35 -12.180 -3.523 18.125 1.00 0.00 C ATOM 551 CG GLN A 35 -11.567 -3.938 19.463 1.00 0.00 C ATOM 552 CD GLN A 35 -12.646 -3.923 20.548 1.00 0.00 C ATOM 553 OE1 GLN A 35 -13.745 -3.459 20.320 1.00 0.00 O ATOM 554 NE2 GLN A 35 -12.378 -4.417 21.725 1.00 0.00 N ATOM 0 H GLN A 35 -12.655 -3.259 15.603 1.00 0.00 H new ATOM 0 HA GLN A 35 -10.266 -2.910 17.337 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -12.611 -2.525 18.205 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -12.991 -4.201 17.859 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -11.132 -4.934 19.382 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -10.758 -3.258 19.731 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -11.455 -4.807 21.916 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -13.091 -4.414 22.454 1.00 0.00 H new ATOM 563 N ALA A 36 -9.381 -5.242 17.213 1.00 0.00 N ATOM 564 CA ALA A 36 -8.843 -6.624 17.066 1.00 0.00 C ATOM 565 C ALA A 36 -9.695 -7.585 17.897 1.00 0.00 C ATOM 566 O ALA A 36 -10.191 -7.235 18.950 1.00 0.00 O ATOM 567 CB ALA A 36 -7.396 -6.665 17.563 1.00 0.00 C ATOM 0 H ALA A 36 -8.729 -4.561 17.602 1.00 0.00 H new ATOM 0 HA ALA A 36 -8.873 -6.919 16.017 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.003 -7.676 17.455 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -6.790 -5.975 16.976 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -7.363 -6.373 18.613 1.00 0.00 H new ATOM 573 N SER A 37 -9.875 -8.788 17.432 1.00 0.00 N ATOM 574 CA SER A 37 -10.701 -9.763 18.198 1.00 0.00 C ATOM 575 C SER A 37 -9.859 -10.378 19.319 1.00 0.00 C ATOM 576 O SER A 37 -10.339 -11.174 20.100 1.00 0.00 O ATOM 577 CB SER A 37 -11.185 -10.867 17.256 1.00 0.00 C ATOM 578 OG SER A 37 -10.101 -11.730 16.945 1.00 0.00 O ATOM 0 H SER A 37 -9.487 -9.139 16.556 1.00 0.00 H new ATOM 0 HA SER A 37 -11.560 -9.252 18.632 1.00 0.00 H new ATOM 0 HB2 SER A 37 -11.991 -11.432 17.724 1.00 0.00 H new ATOM 0 HB3 SER A 37 -11.590 -10.430 16.343 1.00 0.00 H new ATOM 0 HG SER A 37 -10.188 -12.045 16.021 1.00 0.00 H new ATOM 584 N ASP A 38 -8.609 -10.013 19.403 1.00 0.00 N ATOM 585 CA ASP A 38 -7.739 -10.575 20.475 1.00 0.00 C ATOM 586 C ASP A 38 -6.591 -9.608 20.767 1.00 0.00 C ATOM 587 O ASP A 38 -6.511 -8.535 20.202 1.00 0.00 O ATOM 588 CB ASP A 38 -7.166 -11.920 20.021 1.00 0.00 C ATOM 589 CG ASP A 38 -6.274 -11.709 18.795 1.00 0.00 C ATOM 590 OD1 ASP A 38 -5.936 -10.570 18.521 1.00 0.00 O ATOM 591 OD2 ASP A 38 -5.945 -12.691 18.151 1.00 0.00 O ATOM 0 H ASP A 38 -8.153 -9.350 18.776 1.00 0.00 H new ATOM 0 HA ASP A 38 -8.332 -10.718 21.378 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -6.591 -12.373 20.828 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -7.975 -12.609 19.780 1.00 0.00 H new ATOM 597 N GLY A 39 -5.701 -9.980 21.645 1.00 0.00 N ATOM 598 CA GLY A 39 -4.557 -9.082 21.973 1.00 0.00 C ATOM 599 C GLY A 39 -5.024 -7.991 22.939 1.00 0.00 C ATOM 600 O GLY A 39 -6.025 -8.136 23.612 1.00 0.00 O ATOM 0 H GLY A 39 -5.716 -10.866 22.150 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.747 -9.657 22.421 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -4.162 -8.631 21.062 1.00 0.00 H new ATOM 604 N ILE A 40 -4.313 -6.900 23.007 1.00 0.00 N ATOM 605 CA ILE A 40 -4.726 -5.803 23.925 1.00 0.00 C ATOM 606 C ILE A 40 -5.987 -5.141 23.373 1.00 0.00 C ATOM 607 O ILE A 40 -6.462 -4.153 23.894 1.00 0.00 O ATOM 608 CB ILE A 40 -3.600 -4.765 24.032 1.00 0.00 C ATOM 609 CG1 ILE A 40 -3.550 -3.911 22.759 1.00 0.00 C ATOM 610 CG2 ILE A 40 -2.262 -5.485 24.211 1.00 0.00 C ATOM 611 CD1 ILE A 40 -2.510 -2.799 22.930 1.00 0.00 C ATOM 0 H ILE A 40 -3.466 -6.721 22.468 1.00 0.00 H new ATOM 0 HA ILE A 40 -4.928 -6.210 24.916 1.00 0.00 H new ATOM 0 HB ILE A 40 -3.790 -4.119 24.889 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -3.295 -4.533 21.901 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -4.531 -3.479 22.559 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -1.461 -4.750 24.287 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -2.291 -6.086 25.120 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.080 -6.133 23.353 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -2.474 -2.192 22.025 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -2.785 -2.171 23.778 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -1.530 -3.242 23.109 1.00 0.00 H new ATOM 623 N HIS A 41 -6.524 -5.678 22.310 1.00 0.00 N ATOM 624 CA HIS A 41 -7.748 -5.084 21.702 1.00 0.00 C ATOM 625 C HIS A 41 -7.409 -3.705 21.142 1.00 0.00 C ATOM 626 O HIS A 41 -8.210 -2.791 21.174 1.00 0.00 O ATOM 627 CB HIS A 41 -8.846 -4.955 22.762 1.00 0.00 C ATOM 628 CG HIS A 41 -8.967 -6.250 23.514 1.00 0.00 C ATOM 629 ND1 HIS A 41 -9.413 -7.418 22.910 1.00 0.00 N ATOM 630 CD2 HIS A 41 -8.703 -6.582 24.820 1.00 0.00 C ATOM 631 CE1 HIS A 41 -9.404 -8.387 23.841 1.00 0.00 C ATOM 632 NE2 HIS A 41 -8.979 -7.931 25.021 1.00 0.00 N ATOM 0 H HIS A 41 -6.165 -6.506 21.835 1.00 0.00 H new ATOM 0 HA HIS A 41 -8.106 -5.729 20.899 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -8.610 -4.143 23.450 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -9.796 -4.706 22.289 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -8.338 -5.901 25.575 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -9.704 -9.408 23.657 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -8.878 -8.460 25.887 1.00 0.00 H new ATOM 641 N HIS A 42 -6.223 -3.551 20.622 1.00 0.00 N ATOM 642 CA HIS A 42 -5.820 -2.236 20.054 1.00 0.00 C ATOM 643 C HIS A 42 -6.671 -1.936 18.821 1.00 0.00 C ATOM 644 O HIS A 42 -7.225 -2.827 18.206 1.00 0.00 O ATOM 645 CB HIS A 42 -4.343 -2.281 19.659 1.00 0.00 C ATOM 646 CG HIS A 42 -4.091 -3.489 18.802 1.00 0.00 C ATOM 647 ND1 HIS A 42 -4.115 -4.781 19.315 1.00 0.00 N ATOM 648 CD2 HIS A 42 -3.803 -3.623 17.465 1.00 0.00 C ATOM 649 CE1 HIS A 42 -3.848 -5.624 18.301 1.00 0.00 C ATOM 650 NE2 HIS A 42 -3.650 -4.969 17.155 1.00 0.00 N ATOM 0 H HIS A 42 -5.514 -4.282 20.566 1.00 0.00 H new ATOM 0 HA HIS A 42 -5.970 -1.455 20.799 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -4.073 -1.375 19.117 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -3.718 -2.318 20.551 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -3.710 -2.808 16.763 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -3.800 -6.698 18.402 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -3.432 -5.372 16.243 1.00 0.00 H new ATOM 659 N TRP A 43 -6.784 -0.691 18.455 1.00 0.00 N ATOM 660 CA TRP A 43 -7.605 -0.338 17.264 1.00 0.00 C ATOM 661 C TRP A 43 -6.688 -0.058 16.074 1.00 0.00 C ATOM 662 O TRP A 43 -5.721 0.668 16.181 1.00 0.00 O ATOM 663 CB TRP A 43 -8.424 0.913 17.572 1.00 0.00 C ATOM 664 CG TRP A 43 -9.301 0.654 18.754 1.00 0.00 C ATOM 665 CD1 TRP A 43 -8.886 0.652 20.042 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.726 0.365 18.783 1.00 0.00 C ATOM 667 NE1 TRP A 43 -9.966 0.377 20.860 1.00 0.00 N ATOM 668 CE2 TRP A 43 -11.123 0.192 20.131 1.00 0.00 C ATOM 669 CE3 TRP A 43 -11.705 0.235 17.782 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.444 -0.098 20.472 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -13.034 -0.058 18.122 1.00 0.00 C ATOM 672 CH2 TRP A 43 -13.404 -0.224 19.465 1.00 0.00 C ATOM 0 H TRP A 43 -6.344 0.098 18.929 1.00 0.00 H new ATOM 0 HA TRP A 43 -8.271 -1.167 17.023 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -7.761 1.754 17.775 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -9.030 1.186 16.708 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -7.876 0.835 20.376 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -9.914 0.318 21.877 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -11.432 0.362 16.745 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -12.723 -0.224 21.508 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -13.777 -0.156 17.345 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -14.429 -0.449 19.720 1.00 0.00 H new ATOM 683 N THR A 44 -6.991 -0.621 14.939 1.00 0.00 N ATOM 684 CA THR A 44 -6.145 -0.380 13.738 1.00 0.00 C ATOM 685 C THR A 44 -7.026 -0.414 12.488 1.00 0.00 C ATOM 686 O THR A 44 -8.058 -1.054 12.467 1.00 0.00 O ATOM 687 CB THR A 44 -5.078 -1.475 13.638 1.00 0.00 C ATOM 688 OG1 THR A 44 -5.542 -2.649 14.294 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.785 -0.996 14.300 1.00 0.00 C ATOM 0 H THR A 44 -7.789 -1.239 14.791 1.00 0.00 H new ATOM 0 HA THR A 44 -5.660 0.593 13.820 1.00 0.00 H new ATOM 0 HB THR A 44 -4.884 -1.697 12.589 1.00 0.00 H new ATOM 0 HG1 THR A 44 -4.861 -3.351 14.229 1.00 0.00 H new ATOM 0 HG21 THR A 44 -3.028 -1.777 14.227 1.00 0.00 H new ATOM 0 HG22 THR A 44 -3.429 -0.098 13.796 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.975 -0.772 15.350 1.00 0.00 H new ATOM 697 N PRO A 45 -6.616 0.265 11.451 1.00 0.00 N ATOM 698 CA PRO A 45 -7.379 0.309 10.171 1.00 0.00 C ATOM 699 C PRO A 45 -7.370 -1.046 9.460 1.00 0.00 C ATOM 700 O PRO A 45 -6.479 -1.850 9.653 1.00 0.00 O ATOM 701 CB PRO A 45 -6.646 1.358 9.333 1.00 0.00 C ATOM 702 CG PRO A 45 -5.273 1.452 9.910 1.00 0.00 C ATOM 703 CD PRO A 45 -5.386 1.065 11.386 1.00 0.00 C ATOM 0 HA PRO A 45 -8.429 0.551 10.333 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -6.610 1.065 8.284 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -7.156 2.320 9.378 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -4.587 0.785 9.387 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -4.878 2.462 9.804 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -4.519 0.492 11.716 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -5.448 1.945 12.026 1.00 0.00 H new ATOM 711 N PRO A 46 -8.356 -1.298 8.643 1.00 0.00 N ATOM 712 CA PRO A 46 -8.466 -2.580 7.891 1.00 0.00 C ATOM 713 C PRO A 46 -7.251 -2.814 6.991 1.00 0.00 C ATOM 714 O PRO A 46 -7.154 -2.273 5.907 1.00 0.00 O ATOM 715 CB PRO A 46 -9.741 -2.419 7.052 1.00 0.00 C ATOM 716 CG PRO A 46 -10.076 -0.962 7.072 1.00 0.00 C ATOM 717 CD PRO A 46 -9.468 -0.387 8.347 1.00 0.00 C ATOM 0 HA PRO A 46 -8.505 -3.441 8.559 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -9.581 -2.767 6.032 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -10.557 -3.011 7.467 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -9.673 -0.461 6.192 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -11.156 -0.813 7.058 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -9.120 0.635 8.199 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -10.193 -0.362 9.161 1.00 0.00 H new ATOM 725 N LYS A 47 -6.317 -3.614 7.436 1.00 0.00 N ATOM 726 CA LYS A 47 -5.102 -3.876 6.614 1.00 0.00 C ATOM 727 C LYS A 47 -4.840 -5.379 6.524 1.00 0.00 C ATOM 728 O LYS A 47 -5.355 -6.161 7.300 1.00 0.00 O ATOM 729 CB LYS A 47 -3.896 -3.187 7.253 1.00 0.00 C ATOM 730 CG LYS A 47 -3.567 -3.861 8.587 1.00 0.00 C ATOM 731 CD LYS A 47 -2.446 -3.092 9.287 1.00 0.00 C ATOM 732 CE LYS A 47 -1.919 -3.913 10.463 1.00 0.00 C ATOM 733 NZ LYS A 47 -2.990 -4.048 11.492 1.00 0.00 N ATOM 0 H LYS A 47 -6.345 -4.097 8.334 1.00 0.00 H new ATOM 0 HA LYS A 47 -5.262 -3.483 5.610 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -3.037 -3.242 6.585 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -4.110 -2.130 7.411 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.454 -3.889 9.221 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.263 -4.894 8.419 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -1.639 -2.885 8.584 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -2.816 -2.129 9.639 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -1.602 -4.898 10.120 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -1.043 -3.429 10.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -2.588 -4.456 12.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -3.389 -3.111 11.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -3.741 -4.671 11.132 1.00 0.00 H new ATOM 747 N GLY A 48 -4.037 -5.785 5.581 1.00 0.00 N ATOM 748 CA GLY A 48 -3.725 -7.234 5.427 1.00 0.00 C ATOM 749 C GLY A 48 -2.447 -7.385 4.603 1.00 0.00 C ATOM 750 O GLY A 48 -1.733 -6.429 4.366 1.00 0.00 O ATOM 0 H GLY A 48 -3.580 -5.172 4.906 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -3.599 -7.698 6.405 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -4.552 -7.747 4.936 1.00 0.00 H new ATOM 754 N HIS A 49 -2.148 -8.574 4.158 1.00 0.00 N ATOM 755 CA HIS A 49 -0.914 -8.771 3.347 1.00 0.00 C ATOM 756 C HIS A 49 -1.284 -8.742 1.863 1.00 0.00 C ATOM 757 O HIS A 49 -2.272 -9.314 1.449 1.00 0.00 O ATOM 758 CB HIS A 49 -0.281 -10.121 3.694 1.00 0.00 C ATOM 759 CG HIS A 49 0.245 -10.081 5.102 1.00 0.00 C ATOM 760 ND1 HIS A 49 -0.529 -10.448 6.194 1.00 0.00 N ATOM 761 CD2 HIS A 49 1.466 -9.720 5.614 1.00 0.00 C ATOM 762 CE1 HIS A 49 0.227 -10.299 7.297 1.00 0.00 C ATOM 763 NE2 HIS A 49 1.450 -9.859 6.997 1.00 0.00 N ATOM 0 H HIS A 49 -2.702 -9.415 4.320 1.00 0.00 H new ATOM 0 HA HIS A 49 -0.200 -7.976 3.563 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -1.018 -10.917 3.592 1.00 0.00 H new ATOM 0 HB3 HIS A 49 0.528 -10.345 2.998 1.00 0.00 H new ATOM 0 HD2 HIS A 49 2.310 -9.380 5.032 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -0.114 -10.509 8.300 1.00 0.00 H new ATOM 0 HE2 HIS A 49 2.213 -9.665 7.646 1.00 0.00 H new ATOM 772 N VAL A 50 -0.504 -8.072 1.060 1.00 0.00 N ATOM 773 CA VAL A 50 -0.823 -8.000 -0.391 1.00 0.00 C ATOM 774 C VAL A 50 -0.234 -9.214 -1.109 1.00 0.00 C ATOM 775 O VAL A 50 0.900 -9.595 -0.891 1.00 0.00 O ATOM 776 CB VAL A 50 -0.244 -6.708 -0.980 1.00 0.00 C ATOM 777 CG1 VAL A 50 0.500 -5.934 0.106 1.00 0.00 C ATOM 778 CG2 VAL A 50 0.719 -7.033 -2.128 1.00 0.00 C ATOM 0 H VAL A 50 0.338 -7.573 1.346 1.00 0.00 H new ATOM 0 HA VAL A 50 -1.905 -8.000 -0.526 1.00 0.00 H new ATOM 0 HB VAL A 50 -1.063 -6.100 -1.365 1.00 0.00 H new ATOM 0 HG11 VAL A 50 0.910 -5.017 -0.317 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.190 -5.685 0.913 1.00 0.00 H new ATOM 0 HG13 VAL A 50 1.312 -6.547 0.498 1.00 0.00 H new ATOM 0 HG21 VAL A 50 1.123 -6.107 -2.537 1.00 0.00 H new ATOM 0 HG22 VAL A 50 1.535 -7.651 -1.754 1.00 0.00 H new ATOM 0 HG23 VAL A 50 0.184 -7.572 -2.910 1.00 0.00 H new ATOM 788 N GLU A 51 -1.001 -9.818 -1.970 1.00 0.00 N ATOM 789 CA GLU A 51 -0.504 -11.003 -2.720 1.00 0.00 C ATOM 790 C GLU A 51 0.731 -10.583 -3.533 1.00 0.00 C ATOM 791 O GLU A 51 1.184 -9.462 -3.430 1.00 0.00 O ATOM 792 CB GLU A 51 -1.620 -11.490 -3.651 1.00 0.00 C ATOM 793 CG GLU A 51 -1.989 -12.946 -3.331 1.00 0.00 C ATOM 794 CD GLU A 51 -3.157 -12.969 -2.344 1.00 0.00 C ATOM 795 OE1 GLU A 51 -4.216 -12.476 -2.699 1.00 0.00 O ATOM 796 OE2 GLU A 51 -2.973 -13.476 -1.251 1.00 0.00 O ATOM 0 H GLU A 51 -1.958 -9.540 -2.188 1.00 0.00 H new ATOM 0 HA GLU A 51 -0.226 -11.810 -2.042 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -2.498 -10.853 -3.541 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.297 -11.410 -4.689 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -2.261 -13.473 -4.245 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.130 -13.466 -2.907 1.00 0.00 H new ATOM 804 N PRO A 52 1.284 -11.469 -4.321 1.00 0.00 N ATOM 805 CA PRO A 52 2.493 -11.157 -5.135 1.00 0.00 C ATOM 806 C PRO A 52 2.170 -10.268 -6.341 1.00 0.00 C ATOM 807 O PRO A 52 2.566 -9.120 -6.399 1.00 0.00 O ATOM 808 CB PRO A 52 2.992 -12.529 -5.593 1.00 0.00 C ATOM 809 CG PRO A 52 1.794 -13.422 -5.564 1.00 0.00 C ATOM 810 CD PRO A 52 0.827 -12.853 -4.523 1.00 0.00 C ATOM 0 HA PRO A 52 3.232 -10.598 -4.561 1.00 0.00 H new ATOM 0 HB2 PRO A 52 3.418 -12.477 -6.595 1.00 0.00 H new ATOM 0 HB3 PRO A 52 3.775 -12.902 -4.933 1.00 0.00 H new ATOM 0 HG2 PRO A 52 1.321 -13.463 -6.545 1.00 0.00 H new ATOM 0 HG3 PRO A 52 2.081 -14.441 -5.305 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -0.203 -12.884 -4.878 1.00 0.00 H new ATOM 0 HD3 PRO A 52 0.861 -13.423 -3.594 1.00 0.00 H new ATOM 818 N GLY A 53 1.453 -10.783 -7.300 1.00 0.00 N ATOM 819 CA GLY A 53 1.107 -9.961 -8.494 1.00 0.00 C ATOM 820 C GLY A 53 -0.096 -9.076 -8.167 1.00 0.00 C ATOM 821 O GLY A 53 -0.788 -8.599 -9.046 1.00 0.00 O ATOM 0 H GLY A 53 1.092 -11.737 -7.309 1.00 0.00 H new ATOM 0 HA2 GLY A 53 1.958 -9.345 -8.785 1.00 0.00 H new ATOM 0 HA3 GLY A 53 0.878 -10.608 -9.341 1.00 0.00 H new ATOM 825 N GLU A 54 -0.358 -8.860 -6.907 1.00 0.00 N ATOM 826 CA GLU A 54 -1.521 -8.018 -6.514 1.00 0.00 C ATOM 827 C GLU A 54 -1.096 -6.555 -6.408 1.00 0.00 C ATOM 828 O GLU A 54 0.022 -6.245 -6.049 1.00 0.00 O ATOM 829 CB GLU A 54 -2.049 -8.486 -5.159 1.00 0.00 C ATOM 830 CG GLU A 54 -3.345 -7.745 -4.832 1.00 0.00 C ATOM 831 CD GLU A 54 -3.812 -8.127 -3.425 1.00 0.00 C ATOM 832 OE1 GLU A 54 -3.084 -8.840 -2.753 1.00 0.00 O ATOM 833 OE2 GLU A 54 -4.890 -7.703 -3.046 1.00 0.00 O ATOM 0 H GLU A 54 0.187 -9.233 -6.130 1.00 0.00 H new ATOM 0 HA GLU A 54 -2.301 -8.112 -7.270 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -2.228 -9.561 -5.178 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -1.306 -8.300 -4.384 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -3.186 -6.668 -4.894 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -4.114 -7.996 -5.562 1.00 0.00 H new ATOM 841 N ASP A 55 -1.985 -5.651 -6.712 1.00 0.00 N ATOM 842 CA ASP A 55 -1.643 -4.205 -6.627 1.00 0.00 C ATOM 843 C ASP A 55 -1.512 -3.795 -5.169 1.00 0.00 C ATOM 844 O ASP A 55 -2.006 -4.452 -4.272 1.00 0.00 O ATOM 845 CB ASP A 55 -2.748 -3.365 -7.246 1.00 0.00 C ATOM 846 CG ASP A 55 -2.247 -1.935 -7.463 1.00 0.00 C ATOM 847 OD1 ASP A 55 -1.667 -1.684 -8.506 1.00 0.00 O ATOM 848 OD2 ASP A 55 -2.452 -1.118 -6.580 1.00 0.00 O ATOM 0 H ASP A 55 -2.937 -5.853 -7.017 1.00 0.00 H new ATOM 0 HA ASP A 55 -0.706 -4.044 -7.160 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.060 -3.800 -8.196 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -3.622 -3.360 -6.595 1.00 0.00 H new ATOM 854 N ASP A 56 -0.869 -2.697 -4.931 1.00 0.00 N ATOM 855 CA ASP A 56 -0.713 -2.214 -3.534 1.00 0.00 C ATOM 856 C ASP A 56 -2.038 -1.608 -3.053 1.00 0.00 C ATOM 857 O ASP A 56 -2.521 -1.917 -1.981 1.00 0.00 O ATOM 858 CB ASP A 56 0.383 -1.149 -3.487 1.00 0.00 C ATOM 859 CG ASP A 56 1.720 -1.774 -3.891 1.00 0.00 C ATOM 860 OD1 ASP A 56 2.626 -1.027 -4.218 1.00 0.00 O ATOM 861 OD2 ASP A 56 1.814 -2.991 -3.867 1.00 0.00 O ATOM 0 H ASP A 56 -0.441 -2.107 -5.645 1.00 0.00 H new ATOM 0 HA ASP A 56 -0.439 -3.047 -2.887 1.00 0.00 H new ATOM 0 HB2 ASP A 56 0.136 -0.328 -4.159 1.00 0.00 H new ATOM 0 HB3 ASP A 56 0.454 -0.729 -2.484 1.00 0.00 H new ATOM 867 N LEU A 57 -2.626 -0.737 -3.836 1.00 0.00 N ATOM 868 CA LEU A 57 -3.911 -0.108 -3.416 1.00 0.00 C ATOM 869 C LEU A 57 -5.054 -1.125 -3.463 1.00 0.00 C ATOM 870 O LEU A 57 -5.845 -1.213 -2.547 1.00 0.00 O ATOM 871 CB LEU A 57 -4.243 1.067 -4.342 1.00 0.00 C ATOM 872 CG LEU A 57 -5.591 1.675 -3.936 1.00 0.00 C ATOM 873 CD1 LEU A 57 -5.520 2.187 -2.496 1.00 0.00 C ATOM 874 CD2 LEU A 57 -5.927 2.842 -4.864 1.00 0.00 C ATOM 0 H LEU A 57 -2.271 -0.437 -4.744 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.798 0.249 -2.392 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -3.459 1.822 -4.284 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -4.282 0.728 -5.377 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.362 0.908 -4.012 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -6.481 2.617 -2.215 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -5.283 1.360 -1.827 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.745 2.949 -2.419 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -6.885 3.273 -4.574 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -5.150 3.602 -4.789 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -5.986 2.484 -5.892 1.00 0.00 H new ATOM 886 N GLU A 58 -5.156 -1.892 -4.515 1.00 0.00 N ATOM 887 CA GLU A 58 -6.266 -2.885 -4.586 1.00 0.00 C ATOM 888 C GLU A 58 -6.228 -3.746 -3.328 1.00 0.00 C ATOM 889 O GLU A 58 -7.252 -4.089 -2.770 1.00 0.00 O ATOM 890 CB GLU A 58 -6.109 -3.770 -5.828 1.00 0.00 C ATOM 891 CG GLU A 58 -6.468 -2.975 -7.093 1.00 0.00 C ATOM 892 CD GLU A 58 -5.295 -2.091 -7.526 1.00 0.00 C ATOM 893 OE1 GLU A 58 -4.740 -1.415 -6.678 1.00 0.00 O ATOM 894 OE2 GLU A 58 -4.971 -2.109 -8.703 1.00 0.00 O ATOM 0 H GLU A 58 -4.528 -1.875 -5.318 1.00 0.00 H new ATOM 0 HA GLU A 58 -7.221 -2.364 -4.654 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -5.084 -4.134 -5.897 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -6.753 -4.645 -5.744 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -6.729 -3.661 -7.898 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -7.346 -2.357 -6.904 1.00 0.00 H new ATOM 902 N THR A 59 -5.057 -4.078 -2.851 1.00 0.00 N ATOM 903 CA THR A 59 -4.986 -4.883 -1.606 1.00 0.00 C ATOM 904 C THR A 59 -5.693 -4.107 -0.504 1.00 0.00 C ATOM 905 O THR A 59 -6.462 -4.652 0.263 1.00 0.00 O ATOM 906 CB THR A 59 -3.526 -5.126 -1.224 1.00 0.00 C ATOM 907 OG1 THR A 59 -2.883 -5.824 -2.280 1.00 0.00 O ATOM 908 CG2 THR A 59 -3.466 -5.952 0.062 1.00 0.00 C ATOM 0 H THR A 59 -4.160 -3.828 -3.267 1.00 0.00 H new ATOM 0 HA THR A 59 -5.466 -5.851 -1.752 1.00 0.00 H new ATOM 0 HB THR A 59 -3.021 -4.174 -1.057 1.00 0.00 H new ATOM 0 HG1 THR A 59 -2.701 -5.205 -3.018 1.00 0.00 H new ATOM 0 HG21 THR A 59 -2.425 -6.126 0.335 1.00 0.00 H new ATOM 0 HG22 THR A 59 -3.966 -5.411 0.865 1.00 0.00 H new ATOM 0 HG23 THR A 59 -3.964 -6.909 -0.096 1.00 0.00 H new ATOM 916 N ALA A 60 -5.463 -2.823 -0.438 1.00 0.00 N ATOM 917 CA ALA A 60 -6.149 -2.004 0.592 1.00 0.00 C ATOM 918 C ALA A 60 -7.645 -2.011 0.280 1.00 0.00 C ATOM 919 O ALA A 60 -8.475 -2.168 1.151 1.00 0.00 O ATOM 920 CB ALA A 60 -5.617 -0.572 0.548 1.00 0.00 C ATOM 0 H ALA A 60 -4.831 -2.311 -1.053 1.00 0.00 H new ATOM 0 HA ALA A 60 -5.968 -2.412 1.586 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -6.122 0.027 1.305 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.545 -0.576 0.744 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -5.804 -0.145 -0.437 1.00 0.00 H new ATOM 926 N LEU A 61 -7.989 -1.862 -0.972 1.00 0.00 N ATOM 927 CA LEU A 61 -9.425 -1.876 -1.367 1.00 0.00 C ATOM 928 C LEU A 61 -10.044 -3.208 -0.949 1.00 0.00 C ATOM 929 O LEU A 61 -11.067 -3.256 -0.296 1.00 0.00 O ATOM 930 CB LEU A 61 -9.519 -1.751 -2.886 1.00 0.00 C ATOM 931 CG LEU A 61 -8.852 -0.458 -3.341 1.00 0.00 C ATOM 932 CD1 LEU A 61 -8.876 -0.399 -4.867 1.00 0.00 C ATOM 933 CD2 LEU A 61 -9.612 0.741 -2.767 1.00 0.00 C ATOM 0 H LEU A 61 -7.332 -1.731 -1.741 1.00 0.00 H new ATOM 0 HA LEU A 61 -9.950 -1.051 -0.886 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -9.037 -2.606 -3.361 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -10.564 -1.761 -3.197 1.00 0.00 H new ATOM 0 HG LEU A 61 -7.821 -0.429 -2.987 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -8.401 0.523 -5.203 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -8.336 -1.254 -5.273 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -9.908 -0.423 -5.216 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -9.134 1.665 -3.093 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -10.643 0.721 -3.121 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -9.601 0.691 -1.678 1.00 0.00 H new ATOM 945 N ARG A 62 -9.419 -4.288 -1.323 1.00 0.00 N ATOM 946 CA ARG A 62 -9.950 -5.629 -0.956 1.00 0.00 C ATOM 947 C ARG A 62 -9.972 -5.776 0.566 1.00 0.00 C ATOM 948 O ARG A 62 -10.930 -6.253 1.139 1.00 0.00 O ATOM 949 CB ARG A 62 -9.049 -6.709 -1.557 1.00 0.00 C ATOM 950 CG ARG A 62 -9.622 -8.091 -1.236 1.00 0.00 C ATOM 951 CD ARG A 62 -8.660 -9.172 -1.727 1.00 0.00 C ATOM 952 NE ARG A 62 -9.256 -10.515 -1.475 1.00 0.00 N ATOM 953 CZ ARG A 62 -8.490 -11.529 -1.171 1.00 0.00 C ATOM 954 NH1 ARG A 62 -7.196 -11.372 -1.097 1.00 0.00 N ATOM 955 NH2 ARG A 62 -9.018 -12.700 -0.943 1.00 0.00 N ATOM 0 H ARG A 62 -8.558 -4.300 -1.870 1.00 0.00 H new ATOM 0 HA ARG A 62 -10.963 -5.736 -1.343 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.975 -6.576 -2.636 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -8.040 -6.620 -1.155 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -9.779 -8.190 -0.162 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -10.595 -8.212 -1.713 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -8.463 -9.043 -2.791 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -7.703 -9.084 -1.213 1.00 0.00 H new ATOM 0 HE ARG A 62 -10.266 -10.643 -1.540 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -6.782 -10.457 -1.277 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -6.599 -12.164 -0.860 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -10.029 -12.824 -1.002 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -8.420 -13.492 -0.706 1.00 0.00 H new ATOM 969 N ALA A 63 -8.923 -5.373 1.226 1.00 0.00 N ATOM 970 CA ALA A 63 -8.890 -5.496 2.710 1.00 0.00 C ATOM 971 C ALA A 63 -9.917 -4.543 3.322 1.00 0.00 C ATOM 972 O ALA A 63 -10.521 -4.831 4.337 1.00 0.00 O ATOM 973 CB ALA A 63 -7.492 -5.141 3.222 1.00 0.00 C ATOM 0 H ALA A 63 -8.089 -4.965 0.804 1.00 0.00 H new ATOM 0 HA ALA A 63 -9.130 -6.520 2.996 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.468 -5.231 4.308 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -6.761 -5.822 2.785 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.250 -4.117 2.938 1.00 0.00 H new ATOM 979 N THR A 64 -10.113 -3.405 2.714 1.00 0.00 N ATOM 980 CA THR A 64 -11.094 -2.424 3.259 1.00 0.00 C ATOM 981 C THR A 64 -12.485 -3.058 3.326 1.00 0.00 C ATOM 982 O THR A 64 -13.173 -2.964 4.323 1.00 0.00 O ATOM 983 CB THR A 64 -11.141 -1.204 2.336 1.00 0.00 C ATOM 984 OG1 THR A 64 -9.826 -0.701 2.155 1.00 0.00 O ATOM 985 CG2 THR A 64 -12.016 -0.120 2.959 1.00 0.00 C ATOM 0 H THR A 64 -9.635 -3.112 1.862 1.00 0.00 H new ATOM 0 HA THR A 64 -10.789 -2.125 4.262 1.00 0.00 H new ATOM 0 HB THR A 64 -11.559 -1.496 1.373 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.340 -1.275 1.526 1.00 0.00 H new ATOM 0 HG21 THR A 64 -12.047 0.747 2.299 1.00 0.00 H new ATOM 0 HG22 THR A 64 -13.026 -0.504 3.101 1.00 0.00 H new ATOM 0 HG23 THR A 64 -11.601 0.173 3.923 1.00 0.00 H new ATOM 993 N GLN A 65 -12.904 -3.703 2.272 1.00 0.00 N ATOM 994 CA GLN A 65 -14.254 -4.338 2.277 1.00 0.00 C ATOM 995 C GLN A 65 -14.208 -5.670 3.029 1.00 0.00 C ATOM 996 O GLN A 65 -15.110 -6.003 3.770 1.00 0.00 O ATOM 997 CB GLN A 65 -14.714 -4.558 0.832 1.00 0.00 C ATOM 998 CG GLN A 65 -15.368 -5.933 0.693 1.00 0.00 C ATOM 999 CD GLN A 65 -16.006 -6.055 -0.691 1.00 0.00 C ATOM 1000 OE1 GLN A 65 -17.139 -5.663 -0.887 1.00 0.00 O ATOM 1001 NE2 GLN A 65 -15.322 -6.583 -1.668 1.00 0.00 N ATOM 0 H GLN A 65 -12.372 -3.818 1.409 1.00 0.00 H new ATOM 0 HA GLN A 65 -14.962 -3.682 2.784 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -15.421 -3.780 0.545 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -13.863 -4.481 0.155 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -14.624 -6.717 0.833 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -16.124 -6.068 1.467 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -14.371 -6.912 -1.505 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -15.738 -6.666 -2.595 1.00 0.00 H new ATOM 1010 N GLU A 66 -13.171 -6.437 2.847 1.00 0.00 N ATOM 1011 CA GLU A 66 -13.085 -7.745 3.556 1.00 0.00 C ATOM 1012 C GLU A 66 -13.025 -7.515 5.068 1.00 0.00 C ATOM 1013 O GLU A 66 -13.589 -8.262 5.842 1.00 0.00 O ATOM 1014 CB GLU A 66 -11.819 -8.479 3.111 1.00 0.00 C ATOM 1015 CG GLU A 66 -11.957 -8.909 1.652 1.00 0.00 C ATOM 1016 CD GLU A 66 -13.065 -9.955 1.530 1.00 0.00 C ATOM 1017 OE1 GLU A 66 -13.520 -10.182 0.421 1.00 0.00 O ATOM 1018 OE2 GLU A 66 -13.442 -10.512 2.547 1.00 0.00 O ATOM 0 H GLU A 66 -12.381 -6.217 2.240 1.00 0.00 H new ATOM 0 HA GLU A 66 -13.965 -8.341 3.315 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -10.951 -7.830 3.228 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -11.652 -9.351 3.743 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -12.187 -8.046 1.028 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -11.014 -9.320 1.292 1.00 0.00 H new ATOM 1026 N GLU A 67 -12.335 -6.494 5.495 1.00 0.00 N ATOM 1027 CA GLU A 67 -12.227 -6.225 6.957 1.00 0.00 C ATOM 1028 C GLU A 67 -13.193 -5.112 7.375 1.00 0.00 C ATOM 1029 O GLU A 67 -13.158 -4.642 8.496 1.00 0.00 O ATOM 1030 CB GLU A 67 -10.792 -5.805 7.283 1.00 0.00 C ATOM 1031 CG GLU A 67 -9.846 -6.980 7.035 1.00 0.00 C ATOM 1032 CD GLU A 67 -10.192 -8.125 7.988 1.00 0.00 C ATOM 1033 OE1 GLU A 67 -9.782 -9.241 7.717 1.00 0.00 O ATOM 1034 OE2 GLU A 67 -10.857 -7.862 8.976 1.00 0.00 O ATOM 0 H GLU A 67 -11.841 -5.834 4.895 1.00 0.00 H new ATOM 0 HA GLU A 67 -12.486 -7.132 7.504 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -10.502 -4.955 6.666 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -10.724 -5.483 8.322 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.929 -7.316 6.001 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -8.813 -6.667 7.186 1.00 0.00 H new ATOM 1042 N ALA A 68 -14.055 -4.680 6.495 1.00 0.00 N ATOM 1043 CA ALA A 68 -15.009 -3.594 6.873 1.00 0.00 C ATOM 1044 C ALA A 68 -16.270 -3.681 6.014 1.00 0.00 C ATOM 1045 O ALA A 68 -17.326 -3.237 6.408 1.00 0.00 O ATOM 1046 CB ALA A 68 -14.347 -2.234 6.652 1.00 0.00 C ATOM 0 H ALA A 68 -14.141 -5.027 5.540 1.00 0.00 H new ATOM 0 HA ALA A 68 -15.279 -3.710 7.923 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -15.043 -1.442 6.928 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -13.451 -2.161 7.269 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -14.074 -2.128 5.602 1.00 0.00 H new ATOM 1052 N GLY A 69 -16.169 -4.237 4.844 1.00 0.00 N ATOM 1053 CA GLY A 69 -17.370 -4.336 3.969 1.00 0.00 C ATOM 1054 C GLY A 69 -17.442 -3.099 3.074 1.00 0.00 C ATOM 1055 O GLY A 69 -18.333 -2.960 2.260 1.00 0.00 O ATOM 0 H GLY A 69 -15.311 -4.627 4.454 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -17.318 -5.238 3.360 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -18.272 -4.414 4.576 1.00 0.00 H new ATOM 1059 N ILE A 70 -16.508 -2.198 3.218 1.00 0.00 N ATOM 1060 CA ILE A 70 -16.522 -0.974 2.375 1.00 0.00 C ATOM 1061 C ILE A 70 -15.440 -1.103 1.297 1.00 0.00 C ATOM 1062 O ILE A 70 -14.289 -1.352 1.590 1.00 0.00 O ATOM 1063 CB ILE A 70 -16.228 0.256 3.242 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -17.021 0.191 4.550 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -16.667 1.500 2.479 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -16.372 1.105 5.594 1.00 0.00 C ATOM 0 H ILE A 70 -15.737 -2.259 3.883 1.00 0.00 H new ATOM 0 HA ILE A 70 -17.502 -0.860 1.911 1.00 0.00 H new ATOM 0 HB ILE A 70 -15.162 0.286 3.468 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -18.053 0.497 4.376 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -17.050 -0.834 4.918 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -16.465 2.386 3.081 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -16.115 1.565 1.541 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -17.735 1.440 2.268 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -16.939 1.056 6.523 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -15.348 0.779 5.776 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -16.366 2.131 5.226 1.00 0.00 H new ATOM 1078 N GLU A 71 -15.803 -0.944 0.051 1.00 0.00 N ATOM 1079 CA GLU A 71 -14.794 -1.066 -1.041 1.00 0.00 C ATOM 1080 C GLU A 71 -14.604 0.285 -1.736 1.00 0.00 C ATOM 1081 O GLU A 71 -15.352 1.216 -1.518 1.00 0.00 O ATOM 1082 CB GLU A 71 -15.265 -2.103 -2.063 1.00 0.00 C ATOM 1083 CG GLU A 71 -16.468 -1.556 -2.830 1.00 0.00 C ATOM 1084 CD GLU A 71 -17.007 -2.637 -3.770 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -18.032 -2.400 -4.385 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -16.383 -3.683 -3.857 1.00 0.00 O ATOM 0 H GLU A 71 -16.753 -0.735 -0.257 1.00 0.00 H new ATOM 0 HA GLU A 71 -13.844 -1.382 -0.610 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -14.457 -2.340 -2.755 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -15.534 -3.031 -1.558 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -17.246 -1.244 -2.133 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -16.179 -0.674 -3.401 1.00 0.00 H new ATOM 1094 N ALA A 72 -13.606 0.396 -2.574 1.00 0.00 N ATOM 1095 CA ALA A 72 -13.363 1.686 -3.283 1.00 0.00 C ATOM 1096 C ALA A 72 -14.685 2.226 -3.817 1.00 0.00 C ATOM 1097 O ALA A 72 -14.942 3.412 -3.788 1.00 0.00 O ATOM 1098 CB ALA A 72 -12.394 1.452 -4.439 1.00 0.00 C ATOM 0 H ALA A 72 -12.949 -0.352 -2.798 1.00 0.00 H new ATOM 0 HA ALA A 72 -12.932 2.411 -2.593 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -12.214 2.393 -4.959 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -11.451 1.066 -4.051 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -12.824 0.730 -5.133 1.00 0.00 H new ATOM 1104 N GLY A 73 -15.535 1.362 -4.286 1.00 0.00 N ATOM 1105 CA GLY A 73 -16.851 1.823 -4.801 1.00 0.00 C ATOM 1106 C GLY A 73 -17.612 2.519 -3.670 1.00 0.00 C ATOM 1107 O GLY A 73 -18.421 3.394 -3.900 1.00 0.00 O ATOM 0 H GLY A 73 -15.376 0.356 -4.336 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -16.709 2.508 -5.637 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -17.426 0.977 -5.177 1.00 0.00 H new ATOM 1111 N GLN A 74 -17.365 2.125 -2.448 1.00 0.00 N ATOM 1112 CA GLN A 74 -18.084 2.756 -1.306 1.00 0.00 C ATOM 1113 C GLN A 74 -17.234 3.861 -0.669 1.00 0.00 C ATOM 1114 O GLN A 74 -17.712 4.603 0.166 1.00 0.00 O ATOM 1115 CB GLN A 74 -18.416 1.690 -0.262 1.00 0.00 C ATOM 1116 CG GLN A 74 -19.394 0.677 -0.857 1.00 0.00 C ATOM 1117 CD GLN A 74 -19.824 -0.315 0.223 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -20.709 -0.030 1.007 1.00 0.00 O ATOM 1119 NE2 GLN A 74 -19.232 -1.475 0.304 1.00 0.00 N ATOM 0 H GLN A 74 -16.699 1.396 -2.194 1.00 0.00 H new ATOM 0 HA GLN A 74 -19.005 3.205 -1.679 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -17.505 1.185 0.060 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -18.852 2.156 0.622 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -20.266 1.192 -1.260 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -18.925 0.147 -1.686 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -18.490 -1.716 -0.353 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -19.512 -2.141 1.024 1.00 0.00 H new ATOM 1128 N LEU A 75 -15.995 4.012 -1.061 1.00 0.00 N ATOM 1129 CA LEU A 75 -15.174 5.116 -0.475 1.00 0.00 C ATOM 1130 C LEU A 75 -14.506 5.896 -1.598 1.00 0.00 C ATOM 1131 O LEU A 75 -14.713 5.638 -2.766 1.00 0.00 O ATOM 1132 CB LEU A 75 -14.081 4.621 0.491 1.00 0.00 C ATOM 1133 CG LEU A 75 -14.028 3.099 0.564 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -12.782 2.608 -0.168 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -13.940 2.672 2.030 1.00 0.00 C ATOM 0 H LEU A 75 -15.521 3.429 -1.751 1.00 0.00 H new ATOM 0 HA LEU A 75 -15.858 5.741 0.099 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -13.112 5.002 0.168 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -14.267 5.025 1.486 1.00 0.00 H new ATOM 0 HG LEU A 75 -14.922 2.676 0.105 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -12.737 1.520 -0.120 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -12.824 2.924 -1.210 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -11.894 3.029 0.303 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -13.902 1.584 2.090 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -13.040 3.092 2.478 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -14.816 3.035 2.568 1.00 0.00 H new ATOM 1147 N THR A 76 -13.701 6.851 -1.241 1.00 0.00 N ATOM 1148 CA THR A 76 -12.999 7.665 -2.263 1.00 0.00 C ATOM 1149 C THR A 76 -11.525 7.752 -1.887 1.00 0.00 C ATOM 1150 O THR A 76 -11.155 8.418 -0.942 1.00 0.00 O ATOM 1151 CB THR A 76 -13.610 9.069 -2.292 1.00 0.00 C ATOM 1152 OG1 THR A 76 -14.915 9.005 -2.850 1.00 0.00 O ATOM 1153 CG2 THR A 76 -12.736 10.000 -3.134 1.00 0.00 C ATOM 0 H THR A 76 -13.497 7.105 -0.274 1.00 0.00 H new ATOM 0 HA THR A 76 -13.101 7.209 -3.248 1.00 0.00 H new ATOM 0 HB THR A 76 -13.667 9.458 -1.275 1.00 0.00 H new ATOM 0 HG1 THR A 76 -15.308 9.903 -2.868 1.00 0.00 H new ATOM 0 HG21 THR A 76 -13.177 10.997 -3.150 1.00 0.00 H new ATOM 0 HG22 THR A 76 -11.737 10.052 -2.701 1.00 0.00 H new ATOM 0 HG23 THR A 76 -12.671 9.616 -4.152 1.00 0.00 H new ATOM 1161 N ILE A 77 -10.676 7.083 -2.615 1.00 0.00 N ATOM 1162 CA ILE A 77 -9.229 7.131 -2.284 1.00 0.00 C ATOM 1163 C ILE A 77 -8.683 8.499 -2.685 1.00 0.00 C ATOM 1164 O ILE A 77 -8.865 8.946 -3.800 1.00 0.00 O ATOM 1165 CB ILE A 77 -8.484 6.036 -3.053 1.00 0.00 C ATOM 1166 CG1 ILE A 77 -9.314 4.743 -3.065 1.00 0.00 C ATOM 1167 CG2 ILE A 77 -7.140 5.766 -2.372 1.00 0.00 C ATOM 1168 CD1 ILE A 77 -9.405 4.157 -1.653 1.00 0.00 C ATOM 0 H ILE A 77 -10.922 6.508 -3.421 1.00 0.00 H new ATOM 0 HA ILE A 77 -9.088 6.970 -1.215 1.00 0.00 H new ATOM 0 HB ILE A 77 -8.322 6.367 -4.079 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -10.314 4.948 -3.446 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -8.859 4.017 -3.739 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -6.606 4.987 -2.916 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -6.544 6.679 -2.368 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -7.311 5.440 -1.346 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -9.996 3.241 -1.676 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -8.403 3.933 -1.287 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -9.881 4.879 -0.989 1.00 0.00 H new ATOM 1180 N ILE A 78 -8.024 9.177 -1.786 1.00 0.00 N ATOM 1181 CA ILE A 78 -7.485 10.520 -2.128 1.00 0.00 C ATOM 1182 C ILE A 78 -6.109 10.368 -2.770 1.00 0.00 C ATOM 1183 O ILE A 78 -5.289 9.583 -2.341 1.00 0.00 O ATOM 1184 CB ILE A 78 -7.384 11.375 -0.864 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -8.427 12.490 -0.931 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -5.986 11.992 -0.754 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -9.829 11.880 -0.858 1.00 0.00 C ATOM 0 H ILE A 78 -7.837 8.860 -0.835 1.00 0.00 H new ATOM 0 HA ILE A 78 -8.156 11.012 -2.833 1.00 0.00 H new ATOM 0 HB ILE A 78 -7.563 10.748 0.009 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -8.280 13.190 -0.109 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -8.312 13.055 -1.856 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -5.926 12.599 0.150 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -5.240 11.198 -0.708 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -5.795 12.619 -1.625 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -10.574 12.674 -0.906 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -9.973 11.197 -1.695 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -9.940 11.334 0.079 1.00 0.00 H new ATOM 1199 N GLU A 79 -5.863 11.115 -3.804 1.00 0.00 N ATOM 1200 CA GLU A 79 -4.549 11.024 -4.497 1.00 0.00 C ATOM 1201 C GLU A 79 -3.638 12.162 -4.030 1.00 0.00 C ATOM 1202 O GLU A 79 -4.094 13.222 -3.651 1.00 0.00 O ATOM 1203 CB GLU A 79 -4.764 11.127 -6.006 1.00 0.00 C ATOM 1204 CG GLU A 79 -5.644 9.964 -6.472 1.00 0.00 C ATOM 1205 CD GLU A 79 -5.826 10.037 -7.988 1.00 0.00 C ATOM 1206 OE1 GLU A 79 -6.335 9.081 -8.551 1.00 0.00 O ATOM 1207 OE2 GLU A 79 -5.459 11.048 -8.561 1.00 0.00 O ATOM 0 H GLU A 79 -6.517 11.789 -4.203 1.00 0.00 H new ATOM 0 HA GLU A 79 -4.080 10.069 -4.259 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -5.236 12.078 -6.254 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -3.805 11.103 -6.524 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.186 9.014 -6.195 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -6.614 10.007 -5.976 1.00 0.00 H new ATOM 1215 N GLY A 80 -2.352 11.944 -4.051 1.00 0.00 N ATOM 1216 CA GLY A 80 -1.405 13.004 -3.608 1.00 0.00 C ATOM 1217 C GLY A 80 -0.866 12.653 -2.225 1.00 0.00 C ATOM 1218 O GLY A 80 0.191 13.104 -1.827 1.00 0.00 O ATOM 0 H GLY A 80 -1.916 11.074 -4.357 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -0.584 13.094 -4.319 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.910 13.970 -3.580 1.00 0.00 H new ATOM 1222 N PHE A 81 -1.576 11.844 -1.487 1.00 0.00 N ATOM 1223 CA PHE A 81 -1.095 11.458 -0.132 1.00 0.00 C ATOM 1224 C PHE A 81 -0.634 10.002 -0.136 1.00 0.00 C ATOM 1225 O PHE A 81 -1.354 9.116 -0.549 1.00 0.00 O ATOM 1226 CB PHE A 81 -2.223 11.608 0.884 1.00 0.00 C ATOM 1227 CG PHE A 81 -1.750 11.079 2.216 1.00 0.00 C ATOM 1228 CD1 PHE A 81 -1.822 9.708 2.486 1.00 0.00 C ATOM 1229 CD2 PHE A 81 -1.227 11.953 3.172 1.00 0.00 C ATOM 1230 CE1 PHE A 81 -1.373 9.210 3.715 1.00 0.00 C ATOM 1231 CE2 PHE A 81 -0.777 11.457 4.401 1.00 0.00 C ATOM 1232 CZ PHE A 81 -0.850 10.087 4.673 1.00 0.00 C ATOM 0 H PHE A 81 -2.468 11.434 -1.764 1.00 0.00 H new ATOM 0 HA PHE A 81 -0.264 12.109 0.138 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -2.513 12.655 0.975 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -3.105 11.061 0.552 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -2.225 9.033 1.745 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -1.170 13.011 2.963 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -1.430 8.152 3.924 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -0.373 12.133 5.140 1.00 0.00 H new ATOM 0 HZ PHE A 81 -0.503 9.706 5.622 1.00 0.00 H new ATOM 1242 N LYS A 82 0.548 9.742 0.345 1.00 0.00 N ATOM 1243 CA LYS A 82 1.029 8.337 0.390 1.00 0.00 C ATOM 1244 C LYS A 82 2.115 8.202 1.453 1.00 0.00 C ATOM 1245 O LYS A 82 3.165 8.805 1.369 1.00 0.00 O ATOM 1246 CB LYS A 82 1.616 7.926 -0.951 1.00 0.00 C ATOM 1247 CG LYS A 82 1.198 6.488 -1.264 1.00 0.00 C ATOM 1248 CD LYS A 82 1.883 6.024 -2.551 1.00 0.00 C ATOM 1249 CE LYS A 82 3.375 5.798 -2.291 1.00 0.00 C ATOM 1250 NZ LYS A 82 4.154 6.945 -2.840 1.00 0.00 N ATOM 0 H LYS A 82 1.199 10.439 0.707 1.00 0.00 H new ATOM 0 HA LYS A 82 0.181 7.694 0.626 1.00 0.00 H new ATOM 0 HB2 LYS A 82 1.267 8.598 -1.735 1.00 0.00 H new ATOM 0 HB3 LYS A 82 2.703 8.004 -0.925 1.00 0.00 H new ATOM 0 HG2 LYS A 82 1.470 5.831 -0.438 1.00 0.00 H new ATOM 0 HG3 LYS A 82 0.115 6.429 -1.375 1.00 0.00 H new ATOM 0 HD2 LYS A 82 1.423 5.102 -2.907 1.00 0.00 H new ATOM 0 HD3 LYS A 82 1.750 6.770 -3.334 1.00 0.00 H new ATOM 0 HE2 LYS A 82 3.558 5.699 -1.221 1.00 0.00 H new ATOM 0 HE3 LYS A 82 3.700 4.868 -2.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 4.962 7.146 -2.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 4.501 6.706 -3.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 3.543 7.785 -2.896 1.00 0.00 H new ATOM 1264 N ARG A 83 1.867 7.398 2.437 1.00 0.00 N ATOM 1265 CA ARG A 83 2.874 7.185 3.511 1.00 0.00 C ATOM 1266 C ARG A 83 2.807 5.724 3.944 1.00 0.00 C ATOM 1267 O ARG A 83 1.738 5.174 4.117 1.00 0.00 O ATOM 1268 CB ARG A 83 2.561 8.081 4.718 1.00 0.00 C ATOM 1269 CG ARG A 83 2.710 9.557 4.335 1.00 0.00 C ATOM 1270 CD ARG A 83 4.191 9.944 4.324 1.00 0.00 C ATOM 1271 NE ARG A 83 4.439 10.921 3.227 1.00 0.00 N ATOM 1272 CZ ARG A 83 3.905 12.110 3.281 1.00 0.00 C ATOM 1273 NH1 ARG A 83 3.167 12.450 4.303 1.00 0.00 N ATOM 1274 NH2 ARG A 83 4.111 12.962 2.313 1.00 0.00 N ATOM 0 H ARG A 83 1.001 6.871 2.549 1.00 0.00 H new ATOM 0 HA ARG A 83 3.867 7.433 3.137 1.00 0.00 H new ATOM 0 HB2 ARG A 83 1.547 7.890 5.069 1.00 0.00 H new ATOM 0 HB3 ARG A 83 3.234 7.842 5.542 1.00 0.00 H new ATOM 0 HG2 ARG A 83 2.272 9.733 3.353 1.00 0.00 H new ATOM 0 HG3 ARG A 83 2.167 10.182 5.043 1.00 0.00 H new ATOM 0 HD2 ARG A 83 4.472 10.379 5.283 1.00 0.00 H new ATOM 0 HD3 ARG A 83 4.809 9.057 4.183 1.00 0.00 H new ATOM 0 HE ARG A 83 5.026 10.660 2.434 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.007 11.786 5.060 1.00 0.00 H new ATOM 0 HH12 ARG A 83 2.750 13.380 4.344 1.00 0.00 H new ATOM 0 HH21 ARG A 83 4.689 12.698 1.515 1.00 0.00 H new ATOM 0 HH22 ARG A 83 3.694 13.892 2.355 1.00 0.00 H new ATOM 1288 N GLU A 84 3.930 5.086 4.131 1.00 0.00 N ATOM 1289 CA GLU A 84 3.890 3.665 4.562 1.00 0.00 C ATOM 1290 C GLU A 84 4.536 3.525 5.933 1.00 0.00 C ATOM 1291 O GLU A 84 5.565 4.107 6.209 1.00 0.00 O ATOM 1292 CB GLU A 84 4.630 2.766 3.564 1.00 0.00 C ATOM 1293 CG GLU A 84 6.011 3.337 3.247 1.00 0.00 C ATOM 1294 CD GLU A 84 5.874 4.711 2.588 1.00 0.00 C ATOM 1295 OE1 GLU A 84 5.166 4.804 1.598 1.00 0.00 O ATOM 1296 OE2 GLU A 84 6.481 5.647 3.084 1.00 0.00 O ATOM 0 H GLU A 84 4.861 5.483 4.005 1.00 0.00 H new ATOM 0 HA GLU A 84 2.846 3.354 4.607 1.00 0.00 H new ATOM 0 HB2 GLU A 84 4.732 1.762 3.977 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.048 2.676 2.647 1.00 0.00 H new ATOM 0 HG2 GLU A 84 6.597 3.421 4.162 1.00 0.00 H new ATOM 0 HG3 GLU A 84 6.550 2.660 2.585 1.00 0.00 H new ATOM 1304 N LEU A 85 3.944 2.749 6.797 1.00 0.00 N ATOM 1305 CA LEU A 85 4.541 2.575 8.142 1.00 0.00 C ATOM 1306 C LEU A 85 5.412 1.320 8.116 1.00 0.00 C ATOM 1307 O LEU A 85 4.932 0.226 7.902 1.00 0.00 O ATOM 1308 CB LEU A 85 3.432 2.420 9.187 1.00 0.00 C ATOM 1309 CG LEU A 85 2.372 3.505 8.974 1.00 0.00 C ATOM 1310 CD1 LEU A 85 1.478 3.606 10.211 1.00 0.00 C ATOM 1311 CD2 LEU A 85 3.046 4.853 8.726 1.00 0.00 C ATOM 0 H LEU A 85 3.080 2.233 6.629 1.00 0.00 H new ATOM 0 HA LEU A 85 5.143 3.445 8.404 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.978 1.432 9.107 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.850 2.498 10.191 1.00 0.00 H new ATOM 0 HG LEU A 85 1.766 3.240 8.107 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.726 4.379 10.054 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.985 2.649 10.382 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.086 3.862 11.079 1.00 0.00 H new ATOM 0 HD21 LEU A 85 2.285 5.618 8.576 1.00 0.00 H new ATOM 0 HD22 LEU A 85 3.660 5.117 9.587 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.675 4.787 7.838 1.00 0.00 H new ATOM 1323 N ASN A 86 6.692 1.475 8.322 1.00 0.00 N ATOM 1324 CA ASN A 86 7.595 0.292 8.294 1.00 0.00 C ATOM 1325 C ASN A 86 8.228 0.100 9.669 1.00 0.00 C ATOM 1326 O ASN A 86 8.967 0.934 10.149 1.00 0.00 O ATOM 1327 CB ASN A 86 8.693 0.517 7.252 1.00 0.00 C ATOM 1328 CG ASN A 86 9.016 2.009 7.163 1.00 0.00 C ATOM 1329 OD1 ASN A 86 9.140 2.678 8.170 1.00 0.00 O ATOM 1330 ND2 ASN A 86 9.158 2.565 5.990 1.00 0.00 N ATOM 0 H ASN A 86 7.149 2.368 8.508 1.00 0.00 H new ATOM 0 HA ASN A 86 7.022 -0.598 8.033 1.00 0.00 H new ATOM 0 HB2 ASN A 86 9.587 -0.044 7.524 1.00 0.00 H new ATOM 0 HB3 ASN A 86 8.368 0.146 6.280 1.00 0.00 H new ATOM 0 HD21 ASN A 86 9.373 3.560 5.920 1.00 0.00 H new ATOM 0 HD22 ASN A 86 9.054 2.005 5.144 1.00 0.00 H new ATOM 1337 N TYR A 87 7.948 -1.005 10.303 1.00 0.00 N ATOM 1338 CA TYR A 87 8.534 -1.261 11.642 1.00 0.00 C ATOM 1339 C TYR A 87 8.500 -2.755 11.933 1.00 0.00 C ATOM 1340 O TYR A 87 7.669 -3.480 11.425 1.00 0.00 O ATOM 1341 CB TYR A 87 7.725 -0.522 12.705 1.00 0.00 C ATOM 1342 CG TYR A 87 6.273 -0.927 12.596 1.00 0.00 C ATOM 1343 CD1 TYR A 87 5.412 -0.224 11.743 1.00 0.00 C ATOM 1344 CD2 TYR A 87 5.790 -2.005 13.345 1.00 0.00 C ATOM 1345 CE1 TYR A 87 4.068 -0.601 11.641 1.00 0.00 C ATOM 1346 CE2 TYR A 87 4.445 -2.380 13.242 1.00 0.00 C ATOM 1347 CZ TYR A 87 3.583 -1.680 12.390 1.00 0.00 C ATOM 1348 OH TYR A 87 2.259 -2.050 12.291 1.00 0.00 O ATOM 0 H TYR A 87 7.337 -1.741 9.948 1.00 0.00 H new ATOM 0 HA TYR A 87 9.565 -0.908 11.658 1.00 0.00 H new ATOM 0 HB2 TYR A 87 8.107 -0.757 13.698 1.00 0.00 H new ATOM 0 HB3 TYR A 87 7.825 0.555 12.572 1.00 0.00 H new ATOM 0 HD1 TYR A 87 5.785 0.608 11.165 1.00 0.00 H new ATOM 0 HD2 TYR A 87 6.454 -2.547 14.002 1.00 0.00 H new ATOM 0 HE1 TYR A 87 3.404 -0.059 10.984 1.00 0.00 H new ATOM 0 HE2 TYR A 87 4.072 -3.211 13.821 1.00 0.00 H new ATOM 0 HH TYR A 87 2.089 -2.818 12.876 1.00 0.00 H new ATOM 1358 N VAL A 88 9.393 -3.215 12.757 1.00 0.00 N ATOM 1359 CA VAL A 88 9.413 -4.661 13.097 1.00 0.00 C ATOM 1360 C VAL A 88 8.969 -4.836 14.548 1.00 0.00 C ATOM 1361 O VAL A 88 9.708 -4.561 15.472 1.00 0.00 O ATOM 1362 CB VAL A 88 10.831 -5.206 12.922 1.00 0.00 C ATOM 1363 CG1 VAL A 88 11.778 -4.493 13.883 1.00 0.00 C ATOM 1364 CG2 VAL A 88 10.843 -6.703 13.225 1.00 0.00 C ATOM 0 H VAL A 88 10.112 -2.652 13.211 1.00 0.00 H new ATOM 0 HA VAL A 88 8.737 -5.206 12.439 1.00 0.00 H new ATOM 0 HB VAL A 88 11.156 -5.036 11.896 1.00 0.00 H new ATOM 0 HG11 VAL A 88 12.788 -4.884 13.756 1.00 0.00 H new ATOM 0 HG12 VAL A 88 11.773 -3.424 13.672 1.00 0.00 H new ATOM 0 HG13 VAL A 88 11.450 -4.662 14.909 1.00 0.00 H new ATOM 0 HG21 VAL A 88 11.854 -7.091 13.100 1.00 0.00 H new ATOM 0 HG22 VAL A 88 10.514 -6.869 14.251 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.169 -7.218 12.540 1.00 0.00 H new ATOM 1374 N ALA A 89 7.763 -5.281 14.756 1.00 0.00 N ATOM 1375 CA ALA A 89 7.273 -5.464 16.149 1.00 0.00 C ATOM 1376 C ALA A 89 7.790 -6.788 16.713 1.00 0.00 C ATOM 1377 O ALA A 89 8.775 -6.829 17.423 1.00 0.00 O ATOM 1378 CB ALA A 89 5.743 -5.467 16.155 1.00 0.00 C ATOM 0 H ALA A 89 7.096 -5.526 14.024 1.00 0.00 H new ATOM 0 HA ALA A 89 7.639 -4.645 16.768 1.00 0.00 H new ATOM 0 HB1 ALA A 89 5.383 -5.601 17.175 1.00 0.00 H new ATOM 0 HB2 ALA A 89 5.376 -4.519 15.762 1.00 0.00 H new ATOM 0 HB3 ALA A 89 5.378 -6.283 15.532 1.00 0.00 H new ATOM 1384 N ARG A 90 7.128 -7.873 16.413 1.00 0.00 N ATOM 1385 CA ARG A 90 7.579 -9.190 16.944 1.00 0.00 C ATOM 1386 C ARG A 90 9.011 -9.478 16.491 1.00 0.00 C ATOM 1387 O ARG A 90 9.893 -9.700 17.296 1.00 0.00 O ATOM 1388 CB ARG A 90 6.656 -10.286 16.414 1.00 0.00 C ATOM 1389 CG ARG A 90 7.148 -11.646 16.904 1.00 0.00 C ATOM 1390 CD ARG A 90 6.124 -12.720 16.543 1.00 0.00 C ATOM 1391 NE ARG A 90 6.095 -12.897 15.064 1.00 0.00 N ATOM 1392 CZ ARG A 90 5.468 -13.914 14.540 1.00 0.00 C ATOM 1393 NH1 ARG A 90 4.863 -14.776 15.312 1.00 0.00 N ATOM 1394 NH2 ARG A 90 5.445 -14.069 13.244 1.00 0.00 N ATOM 0 H ARG A 90 6.296 -7.904 15.824 1.00 0.00 H new ATOM 0 HA ARG A 90 7.547 -9.166 18.033 1.00 0.00 H new ATOM 0 HB2 ARG A 90 5.635 -10.112 16.754 1.00 0.00 H new ATOM 0 HB3 ARG A 90 6.637 -10.265 15.324 1.00 0.00 H new ATOM 0 HG2 ARG A 90 8.111 -11.881 16.451 1.00 0.00 H new ATOM 0 HG3 ARG A 90 7.300 -11.622 17.983 1.00 0.00 H new ATOM 0 HD2 ARG A 90 6.381 -13.662 17.028 1.00 0.00 H new ATOM 0 HD3 ARG A 90 5.137 -12.434 16.906 1.00 0.00 H new ATOM 0 HE ARG A 90 6.566 -12.223 14.461 1.00 0.00 H new ATOM 0 HH11 ARG A 90 4.881 -14.654 16.325 1.00 0.00 H new ATOM 0 HH12 ARG A 90 4.373 -15.571 14.902 1.00 0.00 H new ATOM 0 HH21 ARG A 90 5.917 -13.395 12.641 1.00 0.00 H new ATOM 0 HH22 ARG A 90 4.955 -14.864 12.834 1.00 0.00 H new ATOM 1408 N ASN A 91 9.247 -9.466 15.209 1.00 0.00 N ATOM 1409 CA ASN A 91 10.623 -9.738 14.694 1.00 0.00 C ATOM 1410 C ASN A 91 10.613 -9.672 13.168 1.00 0.00 C ATOM 1411 O ASN A 91 11.468 -10.230 12.507 1.00 0.00 O ATOM 1412 CB ASN A 91 11.076 -11.133 15.129 1.00 0.00 C ATOM 1413 CG ASN A 91 12.587 -11.260 14.927 1.00 0.00 C ATOM 1414 OD1 ASN A 91 13.266 -10.276 14.705 1.00 0.00 O ATOM 1415 ND2 ASN A 91 13.148 -12.436 14.996 1.00 0.00 N ATOM 0 H ASN A 91 8.546 -9.279 14.492 1.00 0.00 H new ATOM 0 HA ASN A 91 11.309 -8.992 15.096 1.00 0.00 H new ATOM 0 HB2 ASN A 91 10.822 -11.300 16.176 1.00 0.00 H new ATOM 0 HB3 ASN A 91 10.555 -11.894 14.549 1.00 0.00 H new ATOM 0 HD21 ASN A 91 14.155 -12.529 14.864 1.00 0.00 H new ATOM 0 HD22 ASN A 91 12.579 -13.262 15.182 1.00 0.00 H new ATOM 1422 N LYS A 92 9.653 -8.998 12.600 1.00 0.00 N ATOM 1423 CA LYS A 92 9.587 -8.897 11.117 1.00 0.00 C ATOM 1424 C LYS A 92 9.070 -7.503 10.730 1.00 0.00 C ATOM 1425 O LYS A 92 8.030 -7.073 11.189 1.00 0.00 O ATOM 1426 CB LYS A 92 8.638 -9.972 10.588 1.00 0.00 C ATOM 1427 CG LYS A 92 9.301 -10.731 9.437 1.00 0.00 C ATOM 1428 CD LYS A 92 10.310 -11.736 9.998 1.00 0.00 C ATOM 1429 CE LYS A 92 10.869 -12.590 8.861 1.00 0.00 C ATOM 1430 NZ LYS A 92 12.308 -12.882 9.121 1.00 0.00 N ATOM 0 H LYS A 92 8.909 -8.512 13.101 1.00 0.00 H new ATOM 0 HA LYS A 92 10.577 -9.045 10.685 1.00 0.00 H new ATOM 0 HB2 LYS A 92 8.376 -10.664 11.388 1.00 0.00 H new ATOM 0 HB3 LYS A 92 7.710 -9.514 10.246 1.00 0.00 H new ATOM 0 HG2 LYS A 92 8.545 -11.250 8.847 1.00 0.00 H new ATOM 0 HG3 LYS A 92 9.803 -10.032 8.768 1.00 0.00 H new ATOM 0 HD2 LYS A 92 11.120 -11.210 10.503 1.00 0.00 H new ATOM 0 HD3 LYS A 92 9.830 -12.372 10.742 1.00 0.00 H new ATOM 0 HE2 LYS A 92 10.307 -13.520 8.780 1.00 0.00 H new ATOM 0 HE3 LYS A 92 10.759 -12.067 7.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 12.690 -13.463 8.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 12.839 -11.989 9.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 12.401 -13.397 10.020 1.00 0.00 H new ATOM 1444 N PRO A 93 9.798 -6.795 9.900 1.00 0.00 N ATOM 1445 CA PRO A 93 9.418 -5.423 9.454 1.00 0.00 C ATOM 1446 C PRO A 93 8.356 -5.442 8.369 1.00 0.00 C ATOM 1447 O PRO A 93 8.499 -6.101 7.362 1.00 0.00 O ATOM 1448 CB PRO A 93 10.712 -4.864 8.889 1.00 0.00 C ATOM 1449 CG PRO A 93 11.440 -6.058 8.377 1.00 0.00 C ATOM 1450 CD PRO A 93 11.063 -7.224 9.285 1.00 0.00 C ATOM 0 HA PRO A 93 8.995 -4.838 10.271 1.00 0.00 H new ATOM 0 HB2 PRO A 93 10.520 -4.145 8.093 1.00 0.00 H new ATOM 0 HB3 PRO A 93 11.289 -4.345 9.655 1.00 0.00 H new ATOM 0 HG2 PRO A 93 11.163 -6.267 7.344 1.00 0.00 H new ATOM 0 HG3 PRO A 93 12.517 -5.890 8.390 1.00 0.00 H new ATOM 0 HD2 PRO A 93 10.940 -8.148 8.720 1.00 0.00 H new ATOM 0 HD3 PRO A 93 11.830 -7.410 10.036 1.00 0.00 H new ATOM 1458 N LYS A 94 7.301 -4.715 8.553 1.00 0.00 N ATOM 1459 CA LYS A 94 6.233 -4.693 7.518 1.00 0.00 C ATOM 1460 C LYS A 94 6.096 -3.302 6.922 1.00 0.00 C ATOM 1461 O LYS A 94 5.850 -2.342 7.622 1.00 0.00 O ATOM 1462 CB LYS A 94 4.889 -5.042 8.151 1.00 0.00 C ATOM 1463 CG LYS A 94 4.884 -6.473 8.683 1.00 0.00 C ATOM 1464 CD LYS A 94 3.587 -6.703 9.461 1.00 0.00 C ATOM 1465 CE LYS A 94 2.401 -6.183 8.642 1.00 0.00 C ATOM 1466 NZ LYS A 94 2.330 -4.699 8.758 1.00 0.00 N ATOM 0 H LYS A 94 7.127 -4.134 9.373 1.00 0.00 H new ATOM 0 HA LYS A 94 6.504 -5.414 6.747 1.00 0.00 H new ATOM 0 HB2 LYS A 94 4.676 -4.348 8.964 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.095 -4.923 7.414 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.961 -7.183 7.859 1.00 0.00 H new ATOM 0 HG3 LYS A 94 5.746 -6.639 9.329 1.00 0.00 H new ATOM 0 HD2 LYS A 94 3.460 -7.765 9.671 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.631 -6.191 10.422 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.512 -6.472 7.597 1.00 0.00 H new ATOM 0 HE3 LYS A 94 1.474 -6.631 8.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.339 -4.407 8.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.884 -4.388 9.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 2.718 -4.264 7.896 1.00 0.00 H new ATOM 1480 N THR A 95 6.181 -3.185 5.629 1.00 0.00 N ATOM 1481 CA THR A 95 5.975 -1.852 5.020 1.00 0.00 C ATOM 1482 C THR A 95 4.484 -1.730 4.750 1.00 0.00 C ATOM 1483 O THR A 95 3.924 -2.473 3.970 1.00 0.00 O ATOM 1484 CB THR A 95 6.745 -1.728 3.701 1.00 0.00 C ATOM 1485 OG1 THR A 95 8.139 -1.682 3.971 1.00 0.00 O ATOM 1486 CG2 THR A 95 6.314 -0.447 2.978 1.00 0.00 C ATOM 0 H THR A 95 6.381 -3.944 4.978 1.00 0.00 H new ATOM 0 HA THR A 95 6.335 -1.067 5.685 1.00 0.00 H new ATOM 0 HB THR A 95 6.529 -2.589 3.068 1.00 0.00 H new ATOM 0 HG1 THR A 95 8.633 -1.604 3.128 1.00 0.00 H new ATOM 0 HG21 THR A 95 6.861 -0.357 2.039 1.00 0.00 H new ATOM 0 HG22 THR A 95 5.244 -0.488 2.772 1.00 0.00 H new ATOM 0 HG23 THR A 95 6.530 0.416 3.608 1.00 0.00 H new ATOM 1494 N VAL A 96 3.830 -0.821 5.402 1.00 0.00 N ATOM 1495 CA VAL A 96 2.369 -0.685 5.193 1.00 0.00 C ATOM 1496 C VAL A 96 2.084 0.640 4.500 1.00 0.00 C ATOM 1497 O VAL A 96 2.397 1.689 5.009 1.00 0.00 O ATOM 1498 CB VAL A 96 1.671 -0.718 6.557 1.00 0.00 C ATOM 1499 CG1 VAL A 96 0.159 -0.622 6.360 1.00 0.00 C ATOM 1500 CG2 VAL A 96 2.009 -2.036 7.270 1.00 0.00 C ATOM 0 H VAL A 96 4.241 -0.167 6.069 1.00 0.00 H new ATOM 0 HA VAL A 96 1.999 -1.501 4.572 1.00 0.00 H new ATOM 0 HB VAL A 96 2.013 0.123 7.160 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -0.337 -0.646 7.331 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -0.083 0.311 5.851 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -0.184 -1.463 5.757 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.514 -2.062 8.241 1.00 0.00 H new ATOM 0 HG22 VAL A 96 1.666 -2.875 6.665 1.00 0.00 H new ATOM 0 HG23 VAL A 96 3.087 -2.107 7.411 1.00 0.00 H new ATOM 1510 N ILE A 97 1.478 0.595 3.345 1.00 0.00 N ATOM 1511 CA ILE A 97 1.161 1.854 2.617 1.00 0.00 C ATOM 1512 C ILE A 97 -0.288 2.225 2.909 1.00 0.00 C ATOM 1513 O ILE A 97 -1.184 1.418 2.764 1.00 0.00 O ATOM 1514 CB ILE A 97 1.356 1.637 1.111 1.00 0.00 C ATOM 1515 CG1 ILE A 97 2.800 1.179 0.849 1.00 0.00 C ATOM 1516 CG2 ILE A 97 1.070 2.943 0.361 1.00 0.00 C ATOM 1517 CD1 ILE A 97 3.656 2.349 0.348 1.00 0.00 C ATOM 0 H ILE A 97 1.189 -0.262 2.874 1.00 0.00 H new ATOM 0 HA ILE A 97 1.821 2.658 2.942 1.00 0.00 H new ATOM 0 HB ILE A 97 0.667 0.871 0.756 1.00 0.00 H new ATOM 0 HG12 ILE A 97 3.230 0.773 1.765 1.00 0.00 H new ATOM 0 HG13 ILE A 97 2.804 0.376 0.111 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.209 2.786 -0.709 1.00 0.00 H new ATOM 0 HG22 ILE A 97 0.043 3.255 0.551 1.00 0.00 H new ATOM 0 HG23 ILE A 97 1.754 3.718 0.706 1.00 0.00 H new ATOM 0 HD11 ILE A 97 4.674 2.004 0.169 1.00 0.00 H new ATOM 0 HD12 ILE A 97 3.235 2.736 -0.580 1.00 0.00 H new ATOM 0 HD13 ILE A 97 3.668 3.139 1.099 1.00 0.00 H new ATOM 1529 N TYR A 98 -0.524 3.430 3.348 1.00 0.00 N ATOM 1530 CA TYR A 98 -1.917 3.828 3.679 1.00 0.00 C ATOM 1531 C TYR A 98 -2.413 4.936 2.754 1.00 0.00 C ATOM 1532 O TYR A 98 -1.779 5.957 2.582 1.00 0.00 O ATOM 1533 CB TYR A 98 -1.964 4.351 5.113 1.00 0.00 C ATOM 1534 CG TYR A 98 -1.929 3.202 6.091 1.00 0.00 C ATOM 1535 CD1 TYR A 98 -3.002 2.307 6.162 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.825 3.040 6.934 1.00 0.00 C ATOM 1537 CE1 TYR A 98 -2.971 1.249 7.078 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.795 1.983 7.852 1.00 0.00 C ATOM 1539 CZ TYR A 98 -1.867 1.088 7.923 1.00 0.00 C ATOM 1540 OH TYR A 98 -1.838 0.045 8.828 1.00 0.00 O ATOM 0 H TYR A 98 0.183 4.151 3.491 1.00 0.00 H new ATOM 0 HA TYR A 98 -2.554 2.952 3.558 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -1.119 5.016 5.293 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -2.870 4.938 5.264 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -3.854 2.432 5.510 1.00 0.00 H new ATOM 0 HD2 TYR A 98 0.004 3.730 6.877 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -3.799 0.557 7.133 1.00 0.00 H new ATOM 0 HE2 TYR A 98 0.056 1.859 8.505 1.00 0.00 H new ATOM 0 HH TYR A 98 -0.953 -0.001 9.246 1.00 0.00 H new ATOM 1550 N TRP A 99 -3.577 4.751 2.200 1.00 0.00 N ATOM 1551 CA TRP A 99 -4.178 5.793 1.329 1.00 0.00 C ATOM 1552 C TRP A 99 -5.394 6.352 2.065 1.00 0.00 C ATOM 1553 O TRP A 99 -6.105 5.625 2.730 1.00 0.00 O ATOM 1554 CB TRP A 99 -4.623 5.180 0.000 1.00 0.00 C ATOM 1555 CG TRP A 99 -3.468 5.096 -0.944 1.00 0.00 C ATOM 1556 CD1 TRP A 99 -3.005 6.119 -1.698 1.00 0.00 C ATOM 1557 CD2 TRP A 99 -2.633 3.944 -1.259 1.00 0.00 C ATOM 1558 NE1 TRP A 99 -1.940 5.670 -2.457 1.00 0.00 N ATOM 1559 CE2 TRP A 99 -1.672 4.336 -2.223 1.00 0.00 C ATOM 1560 CE3 TRP A 99 -2.616 2.612 -0.809 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 -0.729 3.436 -2.721 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 -1.667 1.706 -1.310 1.00 0.00 C ATOM 1563 CH2 TRP A 99 -0.727 2.119 -2.263 1.00 0.00 C ATOM 0 H TRP A 99 -4.144 3.911 2.316 1.00 0.00 H new ATOM 0 HA TRP A 99 -3.451 6.577 1.116 1.00 0.00 H new ATOM 0 HB2 TRP A 99 -5.035 4.186 0.170 1.00 0.00 H new ATOM 0 HB3 TRP A 99 -5.417 5.784 -0.439 1.00 0.00 H new ATOM 0 HD1 TRP A 99 -3.402 7.123 -1.706 1.00 0.00 H new ATOM 0 HE1 TRP A 99 -1.416 6.253 -3.110 1.00 0.00 H new ATOM 0 HE3 TRP A 99 -3.336 2.284 -0.074 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 -0.006 3.757 -3.456 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 -1.662 0.685 -0.958 1.00 0.00 H new ATOM 0 HH2 TRP A 99 -0.000 1.417 -2.643 1.00 0.00 H new ATOM 1574 N LEU A 100 -5.650 7.624 1.975 1.00 0.00 N ATOM 1575 CA LEU A 100 -6.826 8.176 2.698 1.00 0.00 C ATOM 1576 C LEU A 100 -8.094 7.837 1.911 1.00 0.00 C ATOM 1577 O LEU A 100 -8.113 7.893 0.698 1.00 0.00 O ATOM 1578 CB LEU A 100 -6.689 9.694 2.829 1.00 0.00 C ATOM 1579 CG LEU A 100 -5.208 10.078 2.786 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -5.050 11.553 3.154 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -4.419 9.224 3.779 1.00 0.00 C ATOM 0 H LEU A 100 -5.104 8.299 1.439 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.883 7.740 3.696 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.228 10.190 2.021 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -7.136 10.031 3.764 1.00 0.00 H new ATOM 0 HG LEU A 100 -4.826 9.907 1.779 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.995 11.825 3.123 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -5.604 12.167 2.443 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.438 11.721 4.158 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.366 9.503 3.743 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.803 9.388 4.786 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -4.525 8.171 3.518 1.00 0.00 H new ATOM 1593 N ALA A 101 -9.150 7.475 2.589 1.00 0.00 N ATOM 1594 CA ALA A 101 -10.406 7.122 1.867 1.00 0.00 C ATOM 1595 C ALA A 101 -11.611 7.747 2.572 1.00 0.00 C ATOM 1596 O ALA A 101 -11.572 8.037 3.751 1.00 0.00 O ATOM 1597 CB ALA A 101 -10.565 5.600 1.838 1.00 0.00 C ATOM 0 H ALA A 101 -9.197 7.409 3.606 1.00 0.00 H new ATOM 0 HA ALA A 101 -10.352 7.506 0.848 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.483 5.340 1.311 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -9.713 5.155 1.324 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -10.613 5.220 2.858 1.00 0.00 H new ATOM 1603 N GLU A 102 -12.679 7.963 1.851 1.00 0.00 N ATOM 1604 CA GLU A 102 -13.891 8.577 2.468 1.00 0.00 C ATOM 1605 C GLU A 102 -15.129 7.750 2.119 1.00 0.00 C ATOM 1606 O GLU A 102 -15.497 7.637 0.968 1.00 0.00 O ATOM 1607 CB GLU A 102 -14.062 9.995 1.913 1.00 0.00 C ATOM 1608 CG GLU A 102 -15.257 10.672 2.586 1.00 0.00 C ATOM 1609 CD GLU A 102 -15.533 12.013 1.906 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -14.739 12.404 1.066 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -16.540 12.622 2.229 1.00 0.00 O ATOM 0 H GLU A 102 -12.764 7.740 0.859 1.00 0.00 H new ATOM 0 HA GLU A 102 -13.773 8.606 3.551 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -13.157 10.576 2.088 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -14.213 9.958 0.834 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -16.136 10.031 2.520 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -15.053 10.825 3.646 1.00 0.00 H new ATOM 1619 N VAL A 103 -15.788 7.182 3.098 1.00 0.00 N ATOM 1620 CA VAL A 103 -17.011 6.379 2.801 1.00 0.00 C ATOM 1621 C VAL A 103 -18.184 7.329 2.526 1.00 0.00 C ATOM 1622 O VAL A 103 -18.369 8.321 3.202 1.00 0.00 O ATOM 1623 CB VAL A 103 -17.316 5.445 3.976 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -16.034 4.731 4.384 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -17.833 6.233 5.177 1.00 0.00 C ATOM 0 H VAL A 103 -15.533 7.240 4.084 1.00 0.00 H new ATOM 0 HA VAL A 103 -16.849 5.764 1.916 1.00 0.00 H new ATOM 0 HB VAL A 103 -18.079 4.731 3.664 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -16.240 4.063 5.220 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -15.656 4.152 3.541 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -15.287 5.467 4.683 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -18.043 5.548 5.999 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -17.079 6.955 5.490 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -18.747 6.759 4.901 1.00 0.00 H new ATOM 1635 N LYS A 104 -18.946 7.050 1.506 1.00 0.00 N ATOM 1636 CA LYS A 104 -20.085 7.947 1.136 1.00 0.00 C ATOM 1637 C LYS A 104 -21.199 7.911 2.185 1.00 0.00 C ATOM 1638 O LYS A 104 -21.911 8.879 2.364 1.00 0.00 O ATOM 1639 CB LYS A 104 -20.675 7.503 -0.208 1.00 0.00 C ATOM 1640 CG LYS A 104 -19.693 6.590 -0.942 1.00 0.00 C ATOM 1641 CD LYS A 104 -18.356 7.309 -1.119 1.00 0.00 C ATOM 1642 CE LYS A 104 -18.104 7.558 -2.607 1.00 0.00 C ATOM 1643 NZ LYS A 104 -19.310 8.191 -3.214 1.00 0.00 N ATOM 0 H LYS A 104 -18.831 6.233 0.906 1.00 0.00 H new ATOM 0 HA LYS A 104 -19.694 8.963 1.073 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -21.617 6.979 -0.044 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -20.898 8.376 -0.821 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -19.549 5.667 -0.380 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -20.098 6.311 -1.914 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -18.365 8.255 -0.578 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -17.550 6.709 -0.698 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -17.236 8.204 -2.737 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -17.880 6.618 -3.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -19.026 8.761 -4.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -19.974 7.451 -3.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -19.772 8.803 -2.511 1.00 0.00 H new ATOM 1657 N ASP A 105 -21.395 6.807 2.846 1.00 0.00 N ATOM 1658 CA ASP A 105 -22.511 6.741 3.837 1.00 0.00 C ATOM 1659 C ASP A 105 -22.003 6.846 5.270 1.00 0.00 C ATOM 1660 O ASP A 105 -21.069 6.183 5.666 1.00 0.00 O ATOM 1661 CB ASP A 105 -23.258 5.421 3.674 1.00 0.00 C ATOM 1662 CG ASP A 105 -24.729 5.699 3.358 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -25.575 5.139 4.034 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -24.982 6.464 2.442 1.00 0.00 O ATOM 0 H ASP A 105 -20.841 5.956 2.748 1.00 0.00 H new ATOM 0 HA ASP A 105 -23.174 7.585 3.646 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -22.808 4.834 2.873 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -23.177 4.831 4.587 1.00 0.00 H new ATOM 1670 N TYR A 106 -22.648 7.658 6.060 1.00 0.00 N ATOM 1671 CA TYR A 106 -22.251 7.795 7.489 1.00 0.00 C ATOM 1672 C TYR A 106 -22.474 6.453 8.178 1.00 0.00 C ATOM 1673 O TYR A 106 -21.659 5.988 8.951 1.00 0.00 O ATOM 1674 CB TYR A 106 -23.117 8.866 8.159 1.00 0.00 C ATOM 1675 CG TYR A 106 -22.800 8.927 9.635 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -21.496 9.200 10.060 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -23.811 8.708 10.579 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -21.200 9.255 11.427 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -23.516 8.763 11.948 1.00 0.00 C ATOM 1680 CZ TYR A 106 -22.210 9.036 12.370 1.00 0.00 C ATOM 1681 OH TYR A 106 -21.920 9.091 13.719 1.00 0.00 O ATOM 0 H TYR A 106 -23.438 8.236 5.775 1.00 0.00 H new ATOM 0 HA TYR A 106 -21.204 8.087 7.564 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -22.934 9.836 7.698 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -24.173 8.638 8.013 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -20.716 9.369 9.332 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -24.818 8.497 10.252 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -20.192 9.466 11.754 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -24.296 8.595 12.676 1.00 0.00 H new ATOM 0 HH TYR A 106 -22.734 8.917 14.236 1.00 0.00 H new ATOM 1691 N ASP A 107 -23.577 5.821 7.884 1.00 0.00 N ATOM 1692 CA ASP A 107 -23.872 4.498 8.494 1.00 0.00 C ATOM 1693 C ASP A 107 -23.470 3.409 7.502 1.00 0.00 C ATOM 1694 O ASP A 107 -23.941 2.290 7.566 1.00 0.00 O ATOM 1695 CB ASP A 107 -25.367 4.392 8.798 1.00 0.00 C ATOM 1696 CG ASP A 107 -25.643 3.090 9.553 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -26.805 2.792 9.774 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -24.687 2.414 9.895 1.00 0.00 O ATOM 0 H ASP A 107 -24.290 6.169 7.243 1.00 0.00 H new ATOM 0 HA ASP A 107 -23.315 4.382 9.424 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -25.689 5.246 9.394 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -25.940 4.416 7.871 1.00 0.00 H new ATOM 1704 N VAL A 108 -22.604 3.737 6.579 1.00 0.00 N ATOM 1705 CA VAL A 108 -22.161 2.734 5.571 1.00 0.00 C ATOM 1706 C VAL A 108 -22.036 1.372 6.255 1.00 0.00 C ATOM 1707 O VAL A 108 -21.754 1.283 7.433 1.00 0.00 O ATOM 1708 CB VAL A 108 -20.812 3.171 4.998 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -19.869 3.526 6.146 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -20.197 2.044 4.168 1.00 0.00 C ATOM 0 H VAL A 108 -22.184 4.661 6.481 1.00 0.00 H new ATOM 0 HA VAL A 108 -22.884 2.660 4.758 1.00 0.00 H new ATOM 0 HB VAL A 108 -20.963 4.040 4.357 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -18.906 3.838 5.742 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -20.298 4.339 6.731 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -19.729 2.654 6.785 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -19.237 2.370 3.767 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -20.048 1.167 4.798 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -20.867 1.790 3.346 1.00 0.00 H new ATOM 1720 N GLU A 109 -22.271 0.316 5.534 1.00 0.00 N ATOM 1721 CA GLU A 109 -22.199 -1.030 6.152 1.00 0.00 C ATOM 1722 C GLU A 109 -20.791 -1.301 6.674 1.00 0.00 C ATOM 1723 O GLU A 109 -19.796 -0.933 6.079 1.00 0.00 O ATOM 1724 CB GLU A 109 -22.610 -2.102 5.130 1.00 0.00 C ATOM 1725 CG GLU A 109 -21.395 -2.603 4.341 1.00 0.00 C ATOM 1726 CD GLU A 109 -21.741 -2.675 2.851 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -22.913 -2.814 2.540 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -20.828 -2.591 2.047 1.00 0.00 O ATOM 0 H GLU A 109 -22.510 0.328 4.542 1.00 0.00 H new ATOM 0 HA GLU A 109 -22.890 -1.067 6.994 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -23.084 -2.938 5.645 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -23.350 -1.690 4.443 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -20.548 -1.935 4.496 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -21.095 -3.587 4.702 1.00 0.00 H new ATOM 1736 N ILE A 110 -20.719 -1.952 7.788 1.00 0.00 N ATOM 1737 CA ILE A 110 -19.404 -2.294 8.391 1.00 0.00 C ATOM 1738 C ILE A 110 -19.341 -3.802 8.607 1.00 0.00 C ATOM 1739 O ILE A 110 -19.978 -4.345 9.488 1.00 0.00 O ATOM 1740 CB ILE A 110 -19.238 -1.561 9.723 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -19.117 -0.056 9.464 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -17.980 -2.064 10.437 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -17.908 0.220 8.563 1.00 0.00 C ATOM 0 H ILE A 110 -21.528 -2.270 8.321 1.00 0.00 H new ATOM 0 HA ILE A 110 -18.598 -1.987 7.725 1.00 0.00 H new ATOM 0 HB ILE A 110 -20.107 -1.753 10.353 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -20.026 0.315 8.992 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -19.008 0.477 10.408 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -17.866 -1.539 11.385 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -18.071 -3.134 10.623 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -17.107 -1.877 9.811 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -17.826 1.292 8.382 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -17.001 -0.135 9.052 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -18.036 -0.300 7.613 1.00 0.00 H new ATOM 1755 N ARG A 111 -18.578 -4.486 7.806 1.00 0.00 N ATOM 1756 CA ARG A 111 -18.468 -5.960 7.955 1.00 0.00 C ATOM 1757 C ARG A 111 -17.103 -6.279 8.556 1.00 0.00 C ATOM 1758 O ARG A 111 -16.078 -6.083 7.935 1.00 0.00 O ATOM 1759 CB ARG A 111 -18.597 -6.621 6.578 1.00 0.00 C ATOM 1760 CG ARG A 111 -20.072 -6.687 6.156 1.00 0.00 C ATOM 1761 CD ARG A 111 -20.813 -5.427 6.607 1.00 0.00 C ATOM 1762 NE ARG A 111 -22.138 -5.362 5.928 1.00 0.00 N ATOM 1763 CZ ARG A 111 -23.166 -5.979 6.445 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -23.033 -6.653 7.555 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -24.325 -5.924 5.850 1.00 0.00 N ATOM 0 H ARG A 111 -18.023 -4.085 7.050 1.00 0.00 H new ATOM 0 HA ARG A 111 -19.258 -6.337 8.604 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -18.026 -6.057 5.841 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -18.175 -7.625 6.608 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -20.143 -6.790 5.073 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -20.542 -7.569 6.592 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -20.947 -5.438 7.689 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -20.225 -4.541 6.367 1.00 0.00 H new ATOM 0 HE ARG A 111 -22.242 -4.836 5.060 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -22.126 -6.698 8.019 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -23.836 -7.135 7.958 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -24.428 -5.399 4.981 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -25.129 -6.406 6.253 1.00 0.00 H new ATOM 1779 N LEU A 112 -17.082 -6.751 9.767 1.00 0.00 N ATOM 1780 CA LEU A 112 -15.783 -7.060 10.413 1.00 0.00 C ATOM 1781 C LEU A 112 -15.464 -8.544 10.237 1.00 0.00 C ATOM 1782 O LEU A 112 -16.314 -9.396 10.408 1.00 0.00 O ATOM 1783 CB LEU A 112 -15.868 -6.735 11.903 1.00 0.00 C ATOM 1784 CG LEU A 112 -16.467 -5.339 12.095 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -16.257 -4.894 13.544 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -15.790 -4.344 11.146 1.00 0.00 C ATOM 0 H LEU A 112 -17.908 -6.936 10.337 1.00 0.00 H new ATOM 0 HA LEU A 112 -14.997 -6.462 9.951 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -16.482 -7.478 12.412 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -14.876 -6.780 12.352 1.00 0.00 H new ATOM 0 HG LEU A 112 -17.534 -5.370 11.873 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -16.682 -3.900 13.685 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -16.749 -5.598 14.216 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -15.190 -4.867 13.765 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -16.222 -3.353 11.289 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -14.721 -4.308 11.358 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -15.945 -4.662 10.115 1.00 0.00 H new ATOM 1798 N SER A 113 -14.244 -8.858 9.911 1.00 0.00 N ATOM 1799 CA SER A 113 -13.866 -10.286 9.739 1.00 0.00 C ATOM 1800 C SER A 113 -13.496 -10.864 11.105 1.00 0.00 C ATOM 1801 O SER A 113 -13.430 -10.155 12.089 1.00 0.00 O ATOM 1802 CB SER A 113 -12.669 -10.393 8.796 1.00 0.00 C ATOM 1803 OG SER A 113 -12.995 -9.781 7.554 1.00 0.00 O ATOM 0 H SER A 113 -13.491 -8.187 9.756 1.00 0.00 H new ATOM 0 HA SER A 113 -14.702 -10.841 9.314 1.00 0.00 H new ATOM 0 HB2 SER A 113 -11.799 -9.907 9.237 1.00 0.00 H new ATOM 0 HB3 SER A 113 -12.405 -11.439 8.641 1.00 0.00 H new ATOM 0 HG SER A 113 -13.532 -8.977 7.716 1.00 0.00 H new ATOM 1809 N HIS A 114 -13.250 -12.141 11.178 1.00 0.00 N ATOM 1810 CA HIS A 114 -12.884 -12.745 12.487 1.00 0.00 C ATOM 1811 C HIS A 114 -11.736 -11.942 13.106 1.00 0.00 C ATOM 1812 O HIS A 114 -11.631 -11.819 14.311 1.00 0.00 O ATOM 1813 CB HIS A 114 -12.441 -14.194 12.276 1.00 0.00 C ATOM 1814 CG HIS A 114 -12.168 -14.833 13.610 1.00 0.00 C ATOM 1815 ND1 HIS A 114 -11.029 -14.545 14.349 1.00 0.00 N ATOM 1816 CD2 HIS A 114 -12.878 -15.746 14.351 1.00 0.00 C ATOM 1817 CE1 HIS A 114 -11.086 -15.272 15.482 1.00 0.00 C ATOM 1818 NE2 HIS A 114 -12.191 -16.018 15.529 1.00 0.00 N ATOM 0 H HIS A 114 -13.286 -12.790 10.392 1.00 0.00 H new ATOM 0 HA HIS A 114 -13.746 -12.727 13.154 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -13.215 -14.749 11.746 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -11.545 -14.225 11.655 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -13.822 -16.184 14.064 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -10.332 -15.253 16.255 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -12.473 -16.655 16.274 1.00 0.00 H new ATOM 1827 N GLU A 115 -10.873 -11.401 12.290 1.00 0.00 N ATOM 1828 CA GLU A 115 -9.730 -10.611 12.828 1.00 0.00 C ATOM 1829 C GLU A 115 -10.254 -9.402 13.614 1.00 0.00 C ATOM 1830 O GLU A 115 -9.668 -8.993 14.595 1.00 0.00 O ATOM 1831 CB GLU A 115 -8.864 -10.117 11.665 1.00 0.00 C ATOM 1832 CG GLU A 115 -8.239 -11.316 10.950 1.00 0.00 C ATOM 1833 CD GLU A 115 -7.311 -12.061 11.909 1.00 0.00 C ATOM 1834 OE1 GLU A 115 -6.988 -13.203 11.623 1.00 0.00 O ATOM 1835 OE2 GLU A 115 -6.935 -11.479 12.913 1.00 0.00 O ATOM 0 H GLU A 115 -10.910 -11.472 11.273 1.00 0.00 H new ATOM 0 HA GLU A 115 -9.138 -11.243 13.490 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -9.469 -9.539 10.967 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -8.083 -9.453 12.035 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -9.021 -11.986 10.591 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -7.681 -10.980 10.076 1.00 0.00 H new ATOM 1843 N HIS A 116 -11.348 -8.828 13.189 1.00 0.00 N ATOM 1844 CA HIS A 116 -11.901 -7.647 13.915 1.00 0.00 C ATOM 1845 C HIS A 116 -13.264 -8.006 14.508 1.00 0.00 C ATOM 1846 O HIS A 116 -14.045 -8.716 13.904 1.00 0.00 O ATOM 1847 CB HIS A 116 -12.054 -6.478 12.940 1.00 0.00 C ATOM 1848 CG HIS A 116 -10.697 -6.057 12.449 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -10.207 -6.439 11.206 1.00 0.00 N ATOM 1850 CD2 HIS A 116 -9.708 -5.293 13.022 1.00 0.00 C ATOM 1851 CE1 HIS A 116 -8.978 -5.910 11.074 1.00 0.00 C ATOM 1852 NE2 HIS A 116 -8.629 -5.204 12.152 1.00 0.00 N ATOM 0 H HIS A 116 -11.882 -9.125 12.372 1.00 0.00 H new ATOM 0 HA HIS A 116 -11.223 -7.361 14.719 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -12.682 -6.771 12.099 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -12.550 -5.642 13.432 1.00 0.00 H new ATOM 0 HD1 HIS A 116 -10.692 -7.016 10.519 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -9.762 -4.833 13.998 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -8.351 -6.040 10.204 1.00 0.00 H new ATOM 1861 N GLN A 117 -13.554 -7.532 15.691 1.00 0.00 N ATOM 1862 CA GLN A 117 -14.862 -7.863 16.325 1.00 0.00 C ATOM 1863 C GLN A 117 -15.712 -6.598 16.500 1.00 0.00 C ATOM 1864 O GLN A 117 -16.919 -6.671 16.617 1.00 0.00 O ATOM 1865 CB GLN A 117 -14.611 -8.494 17.695 1.00 0.00 C ATOM 1866 CG GLN A 117 -13.819 -7.521 18.571 1.00 0.00 C ATOM 1867 CD GLN A 117 -13.585 -8.147 19.947 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -13.958 -9.278 20.184 1.00 0.00 O ATOM 1869 NE2 GLN A 117 -12.978 -7.453 20.872 1.00 0.00 N ATOM 0 H GLN A 117 -12.943 -6.931 16.244 1.00 0.00 H new ATOM 0 HA GLN A 117 -15.398 -8.561 15.682 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -15.559 -8.740 18.173 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -14.060 -9.428 17.581 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -12.865 -7.285 18.100 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -14.364 -6.583 18.675 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -12.664 -6.503 20.673 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -12.817 -7.861 21.793 1.00 0.00 H new ATOM 1878 N ALA A 118 -15.104 -5.444 16.532 1.00 0.00 N ATOM 1879 CA ALA A 118 -15.908 -4.199 16.714 1.00 0.00 C ATOM 1880 C ALA A 118 -15.203 -3.008 16.061 1.00 0.00 C ATOM 1881 O ALA A 118 -14.005 -3.015 15.859 1.00 0.00 O ATOM 1882 CB ALA A 118 -16.084 -3.925 18.209 1.00 0.00 C ATOM 0 H ALA A 118 -14.097 -5.308 16.441 1.00 0.00 H new ATOM 0 HA ALA A 118 -16.881 -4.335 16.242 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -16.671 -3.017 18.346 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -16.601 -4.764 18.674 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -15.106 -3.799 18.673 1.00 0.00 H new ATOM 1888 N TYR A 119 -15.944 -1.982 15.736 1.00 0.00 N ATOM 1889 CA TYR A 119 -15.331 -0.779 15.103 1.00 0.00 C ATOM 1890 C TYR A 119 -15.960 0.485 15.693 1.00 0.00 C ATOM 1891 O TYR A 119 -17.050 0.454 16.228 1.00 0.00 O ATOM 1892 CB TYR A 119 -15.591 -0.813 13.598 1.00 0.00 C ATOM 1893 CG TYR A 119 -17.056 -0.554 13.343 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -17.970 -1.612 13.390 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -17.501 0.744 13.063 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -19.329 -1.375 13.156 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -18.860 0.980 12.828 1.00 0.00 C ATOM 1898 CZ TYR A 119 -19.774 -0.078 12.876 1.00 0.00 C ATOM 1899 OH TYR A 119 -21.115 0.157 12.645 1.00 0.00 O ATOM 0 H TYR A 119 -16.952 -1.926 15.883 1.00 0.00 H new ATOM 0 HA TYR A 119 -14.258 -0.776 15.292 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -14.983 -0.061 13.095 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -15.304 -1.782 13.189 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -17.626 -2.613 13.607 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -16.796 1.562 13.029 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -20.034 -2.192 13.191 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -19.204 1.980 12.609 1.00 0.00 H new ATOM 0 HH TYR A 119 -21.254 1.111 12.467 1.00 0.00 H new ATOM 1909 N ARG A 120 -15.288 1.601 15.590 1.00 0.00 N ATOM 1910 CA ARG A 120 -15.861 2.867 16.135 1.00 0.00 C ATOM 1911 C ARG A 120 -15.527 4.034 15.205 1.00 0.00 C ATOM 1912 O ARG A 120 -14.496 4.059 14.565 1.00 0.00 O ATOM 1913 CB ARG A 120 -15.262 3.168 17.511 1.00 0.00 C ATOM 1914 CG ARG A 120 -15.705 2.118 18.529 1.00 0.00 C ATOM 1915 CD ARG A 120 -15.187 2.514 19.912 1.00 0.00 C ATOM 1916 NE ARG A 120 -15.381 1.386 20.865 1.00 0.00 N ATOM 1917 CZ ARG A 120 -14.777 1.402 22.022 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -14.009 2.407 22.342 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -14.942 0.415 22.858 1.00 0.00 N ATOM 0 H ARG A 120 -14.370 1.691 15.154 1.00 0.00 H new ATOM 0 HA ARG A 120 -16.941 2.746 16.216 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -14.174 3.183 17.445 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.575 4.158 17.842 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -16.792 2.042 18.542 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -15.320 1.137 18.250 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -14.130 2.775 19.854 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -15.715 3.398 20.269 1.00 0.00 H new ATOM 0 HE ARG A 120 -15.984 0.603 20.614 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -13.881 3.179 21.688 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -13.537 2.420 23.246 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -15.543 -0.370 22.608 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -14.470 0.428 23.762 1.00 0.00 H new ATOM 1933 N TRP A 121 -16.382 5.016 15.161 1.00 0.00 N ATOM 1934 CA TRP A 121 -16.108 6.211 14.313 1.00 0.00 C ATOM 1935 C TRP A 121 -15.758 7.372 15.242 1.00 0.00 C ATOM 1936 O TRP A 121 -16.604 7.891 15.942 1.00 0.00 O ATOM 1937 CB TRP A 121 -17.353 6.557 13.492 1.00 0.00 C ATOM 1938 CG TRP A 121 -17.444 5.636 12.321 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -18.169 4.494 12.281 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -16.805 5.761 11.021 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -18.011 3.907 11.037 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -17.180 4.655 10.223 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -15.944 6.722 10.461 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -16.716 4.509 8.916 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -15.475 6.577 9.147 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -15.861 5.473 8.377 1.00 0.00 C ATOM 0 H TRP A 121 -17.262 5.044 15.677 1.00 0.00 H new ATOM 0 HA TRP A 121 -15.285 6.013 13.626 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -18.246 6.467 14.110 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -17.303 7.592 13.152 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -18.772 4.104 13.088 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -18.453 3.032 10.756 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -15.642 7.578 11.047 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -17.016 3.656 8.325 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -14.813 7.320 8.727 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -15.497 5.367 7.366 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.513 7.764 15.278 1.00 0.00 N ATOM 1958 CA LEU A 122 -14.115 8.870 16.196 1.00 0.00 C ATOM 1959 C LEU A 122 -13.336 9.939 15.430 1.00 0.00 C ATOM 1960 O LEU A 122 -13.005 9.775 14.273 1.00 0.00 O ATOM 1961 CB LEU A 122 -13.230 8.319 17.319 1.00 0.00 C ATOM 1962 CG LEU A 122 -13.563 6.846 17.590 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -12.441 5.958 17.048 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -13.712 6.620 19.097 1.00 0.00 C ATOM 0 H LEU A 122 -13.759 7.370 14.716 1.00 0.00 H new ATOM 0 HA LEU A 122 -15.017 9.312 16.618 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -12.180 8.416 17.044 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -13.377 8.904 18.227 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.499 6.591 17.093 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.679 4.912 17.241 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.340 6.115 15.974 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -11.504 6.214 17.542 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -13.949 5.573 19.286 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -12.779 6.877 19.598 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -14.515 7.249 19.482 1.00 0.00 H new ATOM 1976 N GLY A 123 -13.035 11.031 16.079 1.00 0.00 N ATOM 1977 CA GLY A 123 -12.274 12.120 15.406 1.00 0.00 C ATOM 1978 C GLY A 123 -10.781 11.794 15.453 1.00 0.00 C ATOM 1979 O GLY A 123 -10.374 10.768 15.961 1.00 0.00 O ATOM 0 H GLY A 123 -13.285 11.216 17.051 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -12.603 12.225 14.372 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -12.466 13.073 15.900 1.00 0.00 H new ATOM 1983 N LEU A 124 -9.961 12.659 14.926 1.00 0.00 N ATOM 1984 CA LEU A 124 -8.496 12.398 14.939 1.00 0.00 C ATOM 1985 C LEU A 124 -8.003 12.233 16.377 1.00 0.00 C ATOM 1986 O LEU A 124 -7.165 11.404 16.663 1.00 0.00 O ATOM 1987 CB LEU A 124 -7.766 13.574 14.286 1.00 0.00 C ATOM 1988 CG LEU A 124 -6.254 13.351 14.353 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -5.910 11.959 13.823 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -5.553 14.403 13.495 1.00 0.00 C ATOM 0 H LEU A 124 -10.242 13.536 14.487 1.00 0.00 H new ATOM 0 HA LEU A 124 -8.293 11.481 14.385 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -8.081 13.678 13.248 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -8.028 14.503 14.793 1.00 0.00 H new ATOM 0 HG LEU A 124 -5.923 13.434 15.388 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -4.832 11.807 13.873 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -6.412 11.205 14.429 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -6.241 11.872 12.788 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -4.475 14.249 13.539 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -5.890 14.314 12.462 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -5.793 15.398 13.871 1.00 0.00 H new ATOM 2002 N GLU A 125 -8.509 13.024 17.281 1.00 0.00 N ATOM 2003 CA GLU A 125 -8.058 12.928 18.703 1.00 0.00 C ATOM 2004 C GLU A 125 -8.306 11.519 19.246 1.00 0.00 C ATOM 2005 O GLU A 125 -7.410 10.875 19.756 1.00 0.00 O ATOM 2006 CB GLU A 125 -8.834 13.942 19.548 1.00 0.00 C ATOM 2007 CG GLU A 125 -10.320 13.560 19.593 1.00 0.00 C ATOM 2008 CD GLU A 125 -11.115 14.687 20.254 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -12.330 14.597 20.272 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -10.493 15.622 20.733 1.00 0.00 O ATOM 0 H GLU A 125 -9.217 13.735 17.099 1.00 0.00 H new ATOM 0 HA GLU A 125 -6.990 13.142 18.752 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -8.427 13.973 20.559 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -8.719 14.941 19.128 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -10.692 13.381 18.584 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -10.452 12.632 20.150 1.00 0.00 H new ATOM 2018 N GLU A 126 -9.508 11.033 19.144 1.00 0.00 N ATOM 2019 CA GLU A 126 -9.805 9.669 19.658 1.00 0.00 C ATOM 2020 C GLU A 126 -9.165 8.636 18.742 1.00 0.00 C ATOM 2021 O GLU A 126 -8.560 7.682 19.187 1.00 0.00 O ATOM 2022 CB GLU A 126 -11.315 9.461 19.678 1.00 0.00 C ATOM 2023 CG GLU A 126 -11.841 9.592 21.107 1.00 0.00 C ATOM 2024 CD GLU A 126 -11.248 10.832 21.779 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -10.202 10.706 22.395 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -11.858 11.883 21.680 1.00 0.00 O ATOM 0 H GLU A 126 -10.300 11.522 18.726 1.00 0.00 H new ATOM 0 HA GLU A 126 -9.405 9.559 20.666 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -11.800 10.195 19.034 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -11.560 8.476 19.280 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -12.929 9.661 21.097 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -11.583 8.701 21.680 1.00 0.00 H new ATOM 2034 N ALA A 127 -9.271 8.817 17.462 1.00 0.00 N ATOM 2035 CA ALA A 127 -8.644 7.843 16.544 1.00 0.00 C ATOM 2036 C ALA A 127 -7.164 7.768 16.902 1.00 0.00 C ATOM 2037 O ALA A 127 -6.536 6.732 16.818 1.00 0.00 O ATOM 2038 CB ALA A 127 -8.823 8.324 15.107 1.00 0.00 C ATOM 0 H ALA A 127 -9.761 9.592 17.015 1.00 0.00 H new ATOM 0 HA ALA A 127 -9.101 6.858 16.635 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -8.363 7.610 14.424 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -9.886 8.408 14.881 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -8.348 9.298 14.988 1.00 0.00 H new ATOM 2044 N CYS A 128 -6.617 8.869 17.336 1.00 0.00 N ATOM 2045 CA CYS A 128 -5.188 8.898 17.747 1.00 0.00 C ATOM 2046 C CYS A 128 -5.063 8.264 19.133 1.00 0.00 C ATOM 2047 O CYS A 128 -4.113 7.563 19.424 1.00 0.00 O ATOM 2048 CB CYS A 128 -4.720 10.353 17.802 1.00 0.00 C ATOM 2049 SG CYS A 128 -4.035 10.832 16.197 1.00 0.00 S ATOM 0 H CYS A 128 -7.106 9.760 17.424 1.00 0.00 H new ATOM 0 HA CYS A 128 -4.575 8.345 17.035 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -5.555 11.004 18.061 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -3.967 10.474 18.581 1.00 0.00 H new ATOM 0 HG CYS A 128 -3.640 12.070 16.246 1.00 0.00 H new ATOM 2055 N GLN A 129 -6.017 8.507 19.993 1.00 0.00 N ATOM 2056 CA GLN A 129 -5.957 7.924 21.361 1.00 0.00 C ATOM 2057 C GLN A 129 -6.078 6.400 21.278 1.00 0.00 C ATOM 2058 O GLN A 129 -5.304 5.674 21.870 1.00 0.00 O ATOM 2059 CB GLN A 129 -7.087 8.521 22.215 1.00 0.00 C ATOM 2060 CG GLN A 129 -8.335 7.638 22.186 1.00 0.00 C ATOM 2061 CD GLN A 129 -8.150 6.446 23.124 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -7.068 6.214 23.629 1.00 0.00 O ATOM 2063 NE2 GLN A 129 -9.170 5.676 23.390 1.00 0.00 N ATOM 0 H GLN A 129 -6.836 9.085 19.804 1.00 0.00 H new ATOM 0 HA GLN A 129 -5.002 8.165 21.828 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.745 8.637 23.244 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.335 9.517 21.848 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.208 8.217 22.487 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -8.520 7.288 21.171 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -10.078 5.869 22.968 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -9.059 4.882 24.020 1.00 0.00 H new ATOM 2072 N LEU A 130 -7.030 5.909 20.539 1.00 0.00 N ATOM 2073 CA LEU A 130 -7.186 4.430 20.408 1.00 0.00 C ATOM 2074 C LEU A 130 -5.971 3.865 19.674 1.00 0.00 C ATOM 2075 O LEU A 130 -5.427 2.845 20.046 1.00 0.00 O ATOM 2076 CB LEU A 130 -8.447 4.117 19.602 1.00 0.00 C ATOM 2077 CG LEU A 130 -9.689 4.522 20.398 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -10.745 5.072 19.444 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -10.258 3.299 21.113 1.00 0.00 C ATOM 0 H LEU A 130 -7.709 6.465 20.019 1.00 0.00 H new ATOM 0 HA LEU A 130 -7.267 3.982 21.398 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -8.423 4.651 18.652 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -8.485 3.053 19.369 1.00 0.00 H new ATOM 0 HG LEU A 130 -9.416 5.283 21.129 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -11.631 5.361 20.009 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -10.347 5.943 18.923 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -11.013 4.306 18.717 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -11.143 3.588 21.680 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -10.530 2.541 20.378 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -9.508 2.893 21.792 1.00 0.00 H new ATOM 2091 N ALA A 131 -5.534 4.528 18.638 1.00 0.00 N ATOM 2092 CA ALA A 131 -4.346 4.036 17.889 1.00 0.00 C ATOM 2093 C ALA A 131 -3.089 4.441 18.658 1.00 0.00 C ATOM 2094 O ALA A 131 -2.226 5.129 18.151 1.00 0.00 O ATOM 2095 CB ALA A 131 -4.330 4.649 16.489 1.00 0.00 C ATOM 0 H ALA A 131 -5.949 5.388 18.279 1.00 0.00 H new ATOM 0 HA ALA A 131 -4.384 2.951 17.790 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -3.459 4.287 15.943 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -5.237 4.363 15.956 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.283 5.735 16.568 1.00 0.00 H new ATOM 2101 N GLN A 132 -2.999 4.020 19.886 1.00 0.00 N ATOM 2102 CA GLN A 132 -1.823 4.373 20.736 1.00 0.00 C ATOM 2103 C GLN A 132 -0.548 4.375 19.896 1.00 0.00 C ATOM 2104 O GLN A 132 0.341 5.173 20.108 1.00 0.00 O ATOM 2105 CB GLN A 132 -1.664 3.342 21.857 1.00 0.00 C ATOM 2106 CG GLN A 132 -2.763 2.276 21.767 1.00 0.00 C ATOM 2107 CD GLN A 132 -4.004 2.731 22.541 1.00 0.00 C ATOM 2108 OE1 GLN A 132 -5.108 2.335 22.225 1.00 0.00 O ATOM 2109 NE2 GLN A 132 -3.871 3.544 23.552 1.00 0.00 N ATOM 0 H GLN A 132 -3.699 3.438 20.346 1.00 0.00 H new ATOM 0 HA GLN A 132 -1.988 5.364 21.159 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -0.684 2.869 21.788 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -1.710 3.839 22.826 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -3.022 2.097 20.723 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -2.398 1.332 22.172 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -2.945 3.878 23.819 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -4.693 3.846 24.075 1.00 0.00 H new ATOM 2118 N PHE A 133 -0.443 3.485 18.953 1.00 0.00 N ATOM 2119 CA PHE A 133 0.789 3.444 18.119 1.00 0.00 C ATOM 2120 C PHE A 133 1.019 4.818 17.487 1.00 0.00 C ATOM 2121 O PHE A 133 0.180 5.338 16.779 1.00 0.00 O ATOM 2122 CB PHE A 133 0.618 2.393 17.024 1.00 0.00 C ATOM 2123 CG PHE A 133 0.470 1.036 17.666 1.00 0.00 C ATOM 2124 CD1 PHE A 133 -0.773 0.633 18.165 1.00 0.00 C ATOM 2125 CD2 PHE A 133 1.576 0.182 17.765 1.00 0.00 C ATOM 2126 CE1 PHE A 133 -0.911 -0.623 18.767 1.00 0.00 C ATOM 2127 CE2 PHE A 133 1.438 -1.075 18.364 1.00 0.00 C ATOM 2128 CZ PHE A 133 0.194 -1.478 18.866 1.00 0.00 C ATOM 0 H PHE A 133 -1.151 2.788 18.723 1.00 0.00 H new ATOM 0 HA PHE A 133 1.648 3.186 18.739 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -0.259 2.620 16.417 1.00 0.00 H new ATOM 0 HB3 PHE A 133 1.479 2.402 16.356 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -1.626 1.291 18.086 1.00 0.00 H new ATOM 0 HD2 PHE A 133 2.535 0.494 17.379 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -1.870 -0.933 19.155 1.00 0.00 H new ATOM 0 HE2 PHE A 133 2.290 -1.734 18.439 1.00 0.00 H new ATOM 0 HZ PHE A 133 0.087 -2.448 19.329 1.00 0.00 H new ATOM 2138 N LYS A 134 2.158 5.403 17.737 1.00 0.00 N ATOM 2139 CA LYS A 134 2.461 6.741 17.158 1.00 0.00 C ATOM 2140 C LYS A 134 2.369 6.676 15.635 1.00 0.00 C ATOM 2141 O LYS A 134 1.984 7.625 14.981 1.00 0.00 O ATOM 2142 CB LYS A 134 3.875 7.160 17.561 1.00 0.00 C ATOM 2143 CG LYS A 134 4.202 8.523 16.950 1.00 0.00 C ATOM 2144 CD LYS A 134 5.642 8.906 17.292 1.00 0.00 C ATOM 2145 CE LYS A 134 5.947 10.295 16.731 1.00 0.00 C ATOM 2146 NZ LYS A 134 6.976 10.183 15.659 1.00 0.00 N ATOM 0 H LYS A 134 2.896 5.009 18.321 1.00 0.00 H new ATOM 0 HA LYS A 134 1.741 7.468 17.534 1.00 0.00 H new ATOM 0 HB2 LYS A 134 3.955 7.209 18.647 1.00 0.00 H new ATOM 0 HB3 LYS A 134 4.596 6.416 17.222 1.00 0.00 H new ATOM 0 HG2 LYS A 134 4.071 8.489 15.868 1.00 0.00 H new ATOM 0 HG3 LYS A 134 3.514 9.278 17.331 1.00 0.00 H new ATOM 0 HD2 LYS A 134 5.784 8.899 18.373 1.00 0.00 H new ATOM 0 HD3 LYS A 134 6.333 8.174 16.875 1.00 0.00 H new ATOM 0 HE2 LYS A 134 5.038 10.745 16.332 1.00 0.00 H new ATOM 0 HE3 LYS A 134 6.304 10.950 17.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 7.184 11.128 15.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 7.845 9.770 16.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 6.618 9.573 14.897 1.00 0.00 H new ATOM 2160 N GLU A 135 2.735 5.565 15.069 1.00 0.00 N ATOM 2161 CA GLU A 135 2.691 5.427 13.587 1.00 0.00 C ATOM 2162 C GLU A 135 1.280 5.716 13.096 1.00 0.00 C ATOM 2163 O GLU A 135 1.075 6.436 12.140 1.00 0.00 O ATOM 2164 CB GLU A 135 3.037 3.988 13.226 1.00 0.00 C ATOM 2165 CG GLU A 135 4.263 3.559 14.021 1.00 0.00 C ATOM 2166 CD GLU A 135 4.646 2.131 13.637 1.00 0.00 C ATOM 2167 OE1 GLU A 135 3.884 1.510 12.917 1.00 0.00 O ATOM 2168 OE2 GLU A 135 5.695 1.682 14.071 1.00 0.00 O ATOM 0 H GLU A 135 3.065 4.740 15.570 1.00 0.00 H new ATOM 0 HA GLU A 135 3.395 6.122 13.130 1.00 0.00 H new ATOM 0 HB2 GLU A 135 2.196 3.331 13.448 1.00 0.00 H new ATOM 0 HB3 GLU A 135 3.233 3.905 12.157 1.00 0.00 H new ATOM 0 HG2 GLU A 135 5.094 4.236 13.821 1.00 0.00 H new ATOM 0 HG3 GLU A 135 4.055 3.616 15.089 1.00 0.00 H new ATOM 2176 N MET A 136 0.309 5.145 13.743 1.00 0.00 N ATOM 2177 CA MET A 136 -1.092 5.365 13.320 1.00 0.00 C ATOM 2178 C MET A 136 -1.547 6.747 13.773 1.00 0.00 C ATOM 2179 O MET A 136 -2.157 7.482 13.022 1.00 0.00 O ATOM 2180 CB MET A 136 -1.960 4.280 13.941 1.00 0.00 C ATOM 2181 CG MET A 136 -1.344 2.917 13.615 1.00 0.00 C ATOM 2182 SD MET A 136 -0.993 2.815 11.843 1.00 0.00 S ATOM 2183 CE MET A 136 -2.642 3.248 11.240 1.00 0.00 C ATOM 0 H MET A 136 0.428 4.533 14.550 1.00 0.00 H new ATOM 0 HA MET A 136 -1.177 5.315 12.234 1.00 0.00 H new ATOM 0 HB2 MET A 136 -2.024 4.418 15.020 1.00 0.00 H new ATOM 0 HB3 MET A 136 -2.976 4.339 13.551 1.00 0.00 H new ATOM 0 HG2 MET A 136 -0.426 2.776 14.186 1.00 0.00 H new ATOM 0 HG3 MET A 136 -2.027 2.119 13.907 1.00 0.00 H new ATOM 0 HE1 MET A 136 -2.813 2.773 10.274 1.00 0.00 H new ATOM 0 HE2 MET A 136 -3.392 2.903 11.952 1.00 0.00 H new ATOM 0 HE3 MET A 136 -2.717 4.330 11.130 1.00 0.00 H new ATOM 2193 N LYS A 137 -1.226 7.133 14.977 1.00 0.00 N ATOM 2194 CA LYS A 137 -1.622 8.492 15.418 1.00 0.00 C ATOM 2195 C LYS A 137 -1.021 9.469 14.420 1.00 0.00 C ATOM 2196 O LYS A 137 -1.607 10.478 14.085 1.00 0.00 O ATOM 2197 CB LYS A 137 -1.078 8.768 16.823 1.00 0.00 C ATOM 2198 CG LYS A 137 -1.986 8.102 17.861 1.00 0.00 C ATOM 2199 CD LYS A 137 -1.149 7.346 18.892 1.00 0.00 C ATOM 2200 CE LYS A 137 -0.393 8.321 19.797 1.00 0.00 C ATOM 2201 NZ LYS A 137 0.142 9.454 18.990 1.00 0.00 N ATOM 0 H LYS A 137 -0.716 6.575 15.661 1.00 0.00 H new ATOM 0 HA LYS A 137 -2.707 8.592 15.457 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -0.062 8.384 16.913 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -1.030 9.842 17.002 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -2.594 8.857 18.359 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -2.673 7.415 17.366 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -1.795 6.709 19.496 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -0.441 6.691 18.383 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -1.058 8.699 20.574 1.00 0.00 H new ATOM 0 HE3 LYS A 137 0.424 7.804 20.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 0.779 10.029 19.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 0.667 9.081 18.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -0.646 10.044 18.655 1.00 0.00 H new ATOM 2215 N ALA A 138 0.143 9.147 13.918 1.00 0.00 N ATOM 2216 CA ALA A 138 0.794 10.018 12.908 1.00 0.00 C ATOM 2217 C ALA A 138 0.098 9.808 11.561 1.00 0.00 C ATOM 2218 O ALA A 138 -0.247 10.748 10.873 1.00 0.00 O ATOM 2219 CB ALA A 138 2.265 9.648 12.779 1.00 0.00 C ATOM 0 H ALA A 138 0.670 8.311 14.170 1.00 0.00 H new ATOM 0 HA ALA A 138 0.715 11.061 13.215 1.00 0.00 H new ATOM 0 HB1 ALA A 138 2.738 10.290 12.036 1.00 0.00 H new ATOM 0 HB2 ALA A 138 2.759 9.781 13.741 1.00 0.00 H new ATOM 0 HB3 ALA A 138 2.352 8.607 12.467 1.00 0.00 H new ATOM 2225 N ALA A 139 -0.121 8.572 11.186 1.00 0.00 N ATOM 2226 CA ALA A 139 -0.810 8.299 9.893 1.00 0.00 C ATOM 2227 C ALA A 139 -2.170 8.979 9.933 1.00 0.00 C ATOM 2228 O ALA A 139 -2.565 9.675 9.019 1.00 0.00 O ATOM 2229 CB ALA A 139 -1.005 6.790 9.724 1.00 0.00 C ATOM 0 H ALA A 139 0.147 7.745 11.719 1.00 0.00 H new ATOM 0 HA ALA A 139 -0.216 8.677 9.061 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.509 6.592 8.778 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -0.034 6.295 9.728 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -1.611 6.407 10.545 1.00 0.00 H new ATOM 2235 N LEU A 140 -2.874 8.803 11.013 1.00 0.00 N ATOM 2236 CA LEU A 140 -4.196 9.455 11.157 1.00 0.00 C ATOM 2237 C LEU A 140 -3.965 10.966 11.195 1.00 0.00 C ATOM 2238 O LEU A 140 -4.788 11.754 10.769 1.00 0.00 O ATOM 2239 CB LEU A 140 -4.834 8.991 12.469 1.00 0.00 C ATOM 2240 CG LEU A 140 -4.936 7.460 12.473 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -4.919 6.938 13.911 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -6.243 7.033 11.808 1.00 0.00 C ATOM 0 H LEU A 140 -2.586 8.231 11.807 1.00 0.00 H new ATOM 0 HA LEU A 140 -4.857 9.197 10.330 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -4.237 9.329 13.316 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -5.824 9.433 12.581 1.00 0.00 H new ATOM 0 HG LEU A 140 -4.088 7.049 11.926 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -4.992 5.850 13.904 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -3.989 7.236 14.395 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -5.764 7.355 14.459 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -6.315 5.945 11.811 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -7.085 7.454 12.357 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -6.263 7.395 10.780 1.00 0.00 H new ATOM 2254 N GLN A 141 -2.833 11.365 11.716 1.00 0.00 N ATOM 2255 CA GLN A 141 -2.496 12.814 11.814 1.00 0.00 C ATOM 2256 C GLN A 141 -2.107 13.366 10.442 1.00 0.00 C ATOM 2257 O GLN A 141 -2.619 14.378 10.003 1.00 0.00 O ATOM 2258 CB GLN A 141 -1.303 12.972 12.756 1.00 0.00 C ATOM 2259 CG GLN A 141 -1.783 13.450 14.126 1.00 0.00 C ATOM 2260 CD GLN A 141 -1.934 14.972 14.110 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -1.474 15.647 15.008 1.00 0.00 O ATOM 2262 NE2 GLN A 141 -2.557 15.545 13.117 1.00 0.00 N ATOM 0 H GLN A 141 -2.118 10.737 12.083 1.00 0.00 H new ATOM 0 HA GLN A 141 -3.364 13.359 12.186 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -0.779 12.022 12.856 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -0.592 13.686 12.340 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -2.736 12.982 14.373 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -1.072 13.152 14.897 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -2.944 14.978 12.362 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -2.657 16.560 13.095 1.00 0.00 H new ATOM 2271 N GLU A 142 -1.192 12.725 9.772 1.00 0.00 N ATOM 2272 CA GLU A 142 -0.760 13.234 8.441 1.00 0.00 C ATOM 2273 C GLU A 142 -1.944 13.203 7.474 1.00 0.00 C ATOM 2274 O GLU A 142 -2.117 14.093 6.668 1.00 0.00 O ATOM 2275 CB GLU A 142 0.375 12.361 7.903 1.00 0.00 C ATOM 2276 CG GLU A 142 1.573 12.440 8.851 1.00 0.00 C ATOM 2277 CD GLU A 142 2.742 11.647 8.267 1.00 0.00 C ATOM 2278 OE1 GLU A 142 2.533 10.961 7.279 1.00 0.00 O ATOM 2279 OE2 GLU A 142 3.828 11.736 8.816 1.00 0.00 O ATOM 0 H GLU A 142 -0.726 11.874 10.086 1.00 0.00 H new ATOM 0 HA GLU A 142 -0.405 14.260 8.540 1.00 0.00 H new ATOM 0 HB2 GLU A 142 0.040 11.328 7.809 1.00 0.00 H new ATOM 0 HB3 GLU A 142 0.664 12.695 6.906 1.00 0.00 H new ATOM 0 HG2 GLU A 142 1.864 13.480 9.000 1.00 0.00 H new ATOM 0 HG3 GLU A 142 1.303 12.042 9.829 1.00 0.00 H new ATOM 2287 N GLY A 143 -2.773 12.197 7.556 1.00 0.00 N ATOM 2288 CA GLY A 143 -3.948 12.142 6.644 1.00 0.00 C ATOM 2289 C GLY A 143 -4.785 13.401 6.855 1.00 0.00 C ATOM 2290 O GLY A 143 -5.158 14.079 5.920 1.00 0.00 O ATOM 0 H GLY A 143 -2.688 11.418 8.209 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.620 12.075 5.607 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.544 11.252 6.848 1.00 0.00 H new ATOM 2294 N HIS A 144 -5.067 13.731 8.086 1.00 0.00 N ATOM 2295 CA HIS A 144 -5.861 14.958 8.367 1.00 0.00 C ATOM 2296 C HIS A 144 -5.064 16.180 7.908 1.00 0.00 C ATOM 2297 O HIS A 144 -5.597 17.100 7.320 1.00 0.00 O ATOM 2298 CB HIS A 144 -6.127 15.056 9.872 1.00 0.00 C ATOM 2299 CG HIS A 144 -6.940 16.287 10.161 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -6.360 17.540 10.302 1.00 0.00 N ATOM 2301 CD2 HIS A 144 -8.288 16.476 10.348 1.00 0.00 C ATOM 2302 CE1 HIS A 144 -7.347 18.419 10.559 1.00 0.00 C ATOM 2303 NE2 HIS A 144 -8.538 17.821 10.597 1.00 0.00 N ATOM 0 H HIS A 144 -4.781 13.202 8.910 1.00 0.00 H new ATOM 0 HA HIS A 144 -6.811 14.916 7.834 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -6.658 14.168 10.216 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -5.184 15.095 10.417 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -9.038 15.700 10.308 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -7.193 19.477 10.715 1.00 0.00 H new ATOM 0 HE2 HIS A 144 -9.443 18.258 10.772 1.00 0.00 H new ATOM 2312 N GLN A 145 -3.788 16.192 8.182 1.00 0.00 N ATOM 2313 CA GLN A 145 -2.941 17.349 7.774 1.00 0.00 C ATOM 2314 C GLN A 145 -2.974 17.517 6.255 1.00 0.00 C ATOM 2315 O GLN A 145 -3.078 18.613 5.741 1.00 0.00 O ATOM 2316 CB GLN A 145 -1.497 17.090 8.211 1.00 0.00 C ATOM 2317 CG GLN A 145 -0.653 18.344 7.970 1.00 0.00 C ATOM 2318 CD GLN A 145 -1.049 19.428 8.974 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -1.297 19.143 10.129 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -1.115 20.671 8.580 1.00 0.00 N ATOM 0 H GLN A 145 -3.294 15.447 8.673 1.00 0.00 H new ATOM 0 HA GLN A 145 -3.324 18.254 8.245 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -1.469 16.818 9.266 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -1.084 16.249 7.654 1.00 0.00 H new ATOM 0 HG2 GLN A 145 0.406 18.108 8.073 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -0.801 18.705 6.952 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -0.907 20.910 7.611 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -1.375 21.403 9.242 1.00 0.00 H new ATOM 2329 N PHE A 146 -2.871 16.438 5.529 1.00 0.00 N ATOM 2330 CA PHE A 146 -2.879 16.536 4.042 1.00 0.00 C ATOM 2331 C PHE A 146 -4.285 16.856 3.522 1.00 0.00 C ATOM 2332 O PHE A 146 -4.470 17.765 2.738 1.00 0.00 O ATOM 2333 CB PHE A 146 -2.409 15.211 3.446 1.00 0.00 C ATOM 2334 CG PHE A 146 -2.405 15.319 1.942 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.582 15.085 1.227 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.229 15.662 1.264 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -3.587 15.190 -0.165 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -1.233 15.770 -0.131 1.00 0.00 C ATOM 2339 CZ PHE A 146 -2.414 15.534 -0.847 1.00 0.00 C ATOM 0 H PHE A 146 -2.782 15.493 5.901 1.00 0.00 H new ATOM 0 HA PHE A 146 -2.208 17.341 3.744 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -1.410 14.970 3.808 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -3.067 14.402 3.763 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.489 14.823 1.752 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -0.319 15.843 1.817 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -4.497 15.006 -0.716 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -0.327 16.035 -0.655 1.00 0.00 H new ATOM 0 HZ PHE A 146 -2.419 15.617 -1.924 1.00 0.00 H new ATOM 2349 N LEU A 147 -5.274 16.112 3.937 1.00 0.00 N ATOM 2350 CA LEU A 147 -6.655 16.378 3.444 1.00 0.00 C ATOM 2351 C LEU A 147 -7.030 17.835 3.713 1.00 0.00 C ATOM 2352 O LEU A 147 -7.680 18.475 2.910 1.00 0.00 O ATOM 2353 CB LEU A 147 -7.646 15.449 4.149 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.348 14.002 3.752 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.327 13.065 4.454 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -7.510 13.842 2.241 1.00 0.00 C ATOM 0 H LEU A 147 -5.186 15.336 4.593 1.00 0.00 H new ATOM 0 HA LEU A 147 -6.692 16.192 2.371 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -7.567 15.566 5.230 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -8.668 15.711 3.874 1.00 0.00 H new ATOM 0 HG LEU A 147 -6.327 13.756 4.044 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -8.112 12.035 4.169 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.223 13.172 5.534 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -9.346 13.318 4.161 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -7.297 12.811 1.959 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -8.532 14.093 1.956 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.816 14.508 1.728 1.00 0.00 H new ATOM 2368 N CYS A 148 -6.614 18.373 4.822 1.00 0.00 N ATOM 2369 CA CYS A 148 -6.941 19.794 5.116 1.00 0.00 C ATOM 2370 C CYS A 148 -6.077 20.688 4.224 1.00 0.00 C ATOM 2371 O CYS A 148 -6.286 21.881 4.130 1.00 0.00 O ATOM 2372 CB CYS A 148 -6.644 20.096 6.587 1.00 0.00 C ATOM 2373 SG CYS A 148 -6.095 21.813 6.753 1.00 0.00 S ATOM 0 H CYS A 148 -6.064 17.894 5.535 1.00 0.00 H new ATOM 0 HA CYS A 148 -7.997 19.982 4.921 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -7.536 19.928 7.191 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -5.875 19.420 6.960 1.00 0.00 H new ATOM 0 HG CYS A 148 -6.337 22.455 5.649 1.00 0.00 H new ATOM 2379 N SER A 149 -5.104 20.112 3.572 1.00 0.00 N ATOM 2380 CA SER A 149 -4.211 20.912 2.685 1.00 0.00 C ATOM 2381 C SER A 149 -4.768 20.946 1.260 1.00 0.00 C ATOM 2382 O SER A 149 -4.314 21.707 0.429 1.00 0.00 O ATOM 2383 CB SER A 149 -2.824 20.276 2.657 1.00 0.00 C ATOM 2384 OG SER A 149 -1.850 21.250 3.005 1.00 0.00 O ATOM 0 H SER A 149 -4.888 19.116 3.616 1.00 0.00 H new ATOM 0 HA SER A 149 -4.152 21.929 3.073 1.00 0.00 H new ATOM 0 HB2 SER A 149 -2.782 19.439 3.354 1.00 0.00 H new ATOM 0 HB3 SER A 149 -2.616 19.876 1.665 1.00 0.00 H new ATOM 0 HG SER A 149 -0.959 20.842 2.989 1.00 0.00 H new ATOM 2390 N ILE A 150 -5.739 20.127 0.961 1.00 0.00 N ATOM 2391 CA ILE A 150 -6.293 20.124 -0.418 1.00 0.00 C ATOM 2392 C ILE A 150 -7.246 21.307 -0.580 1.00 0.00 C ATOM 2393 O ILE A 150 -6.908 22.437 -0.289 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.047 18.817 -0.679 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -6.381 17.665 0.080 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -7.010 18.514 -2.176 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -7.227 16.397 -0.076 1.00 0.00 C ATOM 0 H ILE A 150 -6.168 19.465 1.608 1.00 0.00 H new ATOM 0 HA ILE A 150 -5.476 20.209 -1.134 1.00 0.00 H new ATOM 0 HB ILE A 150 -8.077 18.922 -0.339 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -5.376 17.494 -0.305 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -6.279 17.920 1.135 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -7.545 17.585 -2.372 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -7.484 19.328 -2.724 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -5.975 18.413 -2.501 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -6.755 15.576 0.463 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -8.223 16.572 0.330 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -7.305 16.140 -1.132 1.00 0.00 H new ATOM 2409 N GLU A 151 -8.434 21.052 -1.043 1.00 0.00 N ATOM 2410 CA GLU A 151 -9.417 22.154 -1.227 1.00 0.00 C ATOM 2411 C GLU A 151 -10.795 21.695 -0.744 1.00 0.00 C ATOM 2412 O GLU A 151 -11.171 21.916 0.389 1.00 0.00 O ATOM 2413 CB GLU A 151 -9.491 22.531 -2.709 1.00 0.00 C ATOM 2414 CG GLU A 151 -10.377 23.763 -2.883 1.00 0.00 C ATOM 2415 CD GLU A 151 -10.530 24.080 -4.373 1.00 0.00 C ATOM 2416 OE1 GLU A 151 -11.178 25.065 -4.685 1.00 0.00 O ATOM 2417 OE2 GLU A 151 -9.996 23.330 -5.174 1.00 0.00 O ATOM 0 H GLU A 151 -8.769 20.125 -1.303 1.00 0.00 H new ATOM 0 HA GLU A 151 -9.102 23.023 -0.649 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -8.491 22.733 -3.093 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -9.892 21.698 -3.286 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -11.355 23.586 -2.436 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -9.939 24.615 -2.363 1.00 0.00 H new ATOM 2425 N ALA A 152 -11.551 21.054 -1.596 1.00 0.00 N ATOM 2426 CA ALA A 152 -12.903 20.581 -1.181 1.00 0.00 C ATOM 2427 C ALA A 152 -12.866 19.075 -0.918 1.00 0.00 C ATOM 2428 O ALA A 152 -13.126 18.618 0.178 1.00 0.00 O ATOM 2429 CB ALA A 152 -13.910 20.877 -2.294 1.00 0.00 C ATOM 0 H ALA A 152 -11.291 20.838 -2.558 1.00 0.00 H new ATOM 0 HA ALA A 152 -13.201 21.099 -0.270 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -14.899 20.532 -1.992 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -13.942 21.951 -2.480 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -13.608 20.360 -3.205 1.00 0.00 H new ATOM 2435 N LEU A 153 -12.545 18.296 -1.917 1.00 0.00 N ATOM 2436 CA LEU A 153 -12.495 16.819 -1.723 1.00 0.00 C ATOM 2437 C LEU A 153 -11.123 16.423 -1.173 1.00 0.00 C ATOM 2438 O LEU A 153 -10.267 17.275 -0.945 1.00 0.00 O ATOM 2439 CB LEU A 153 -12.731 16.122 -3.066 1.00 0.00 C ATOM 2440 CG LEU A 153 -12.927 14.623 -2.837 1.00 0.00 C ATOM 2441 CD1 LEU A 153 -14.331 14.364 -2.283 1.00 0.00 C ATOM 2442 CD2 LEU A 153 -12.762 13.880 -4.163 1.00 0.00 C ATOM 0 H LEU A 153 -12.316 18.619 -2.857 1.00 0.00 H new ATOM 0 HA LEU A 153 -13.268 16.517 -1.017 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -13.608 16.543 -3.557 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -11.883 16.291 -3.729 1.00 0.00 H new ATOM 0 HG LEU A 153 -12.185 14.268 -2.122 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -14.467 13.295 -2.121 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -14.452 14.892 -1.337 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -15.075 14.720 -2.996 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -12.901 12.811 -4.001 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -13.504 14.239 -4.876 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -11.762 14.060 -4.559 1.00 0.00 H new TER 2454 LEU A 153