USER MOD reduce.3.24.130724 H: found=0, std=0, add=802, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 803 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: C 16 GLN : amide:sc= -5.01! C(o=-5!,f=-6!) USER MOD Set 1.2: C 85 MET CE :methyl -147:sc= -0.0176 (180deg=-0.858) USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 5 TYR OH : rot 180:sc= 0 USER MOD Single : C 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 13 THR OG1 : rot 180:sc= 0.15 USER MOD Single : C 17 LYS NZ :NH3+ -151:sc= -1.93 (180deg=-3.24!) USER MOD Single : C 18 ASN : amide:sc= -0.332 X(o=-0.33,f=-0.71) USER MOD Single : C 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 35 CYS SG : rot 180:sc= 0 USER MOD Single : C 37 SER OG : rot 180:sc= -1.6! USER MOD Single : C 38 THR OG1 : rot -78:sc= 0.00293 USER MOD Single : C 39 LYS NZ :NH3+ -167:sc= -1.34 (180deg=-1.84) USER MOD Single : C 43 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.246) USER MOD Single : C 45 MET CE :methyl 143:sc= -6.62! (180deg=-11.3!) USER MOD Single : C 47 MET CE :methyl -112:sc= -1.85 (180deg=-5.94!) USER MOD Single : C 50 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : C 51 ASN :FLIP amide:sc= -0.0916 F(o=-1.3,f=-0.092) USER MOD Single : C 53 THR OG1 : rot 180:sc= 0.126 USER MOD Single : C 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 60 MET CE :methyl -161:sc= -0.0106 (180deg=-0.123) USER MOD Single : C 71 THR OG1 : rot 180:sc= 0.00226 USER MOD Single : C 80 MET CE :methyl 166:sc= -0.217 (180deg=-0.951) USER MOD Single : C 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 84 CYS SG : rot -45:sc= -0.0295 USER MOD Single : C 86 LYS NZ :NH3+ -153:sc= -0.492 (180deg=-2.83!) USER MOD Single : C 89 SER OG : rot 180:sc= 0 USER MOD Single : I 1 ARG N :NH3+ -111:sc= 0.00707 (180deg=-0.123) USER MOD Single : I 3 SER OG : rot 180:sc= 0 USER MOD Single : I 7 MET CE :methyl 180:sc= -10.7! (180deg=-10.7!) USER MOD Single : I 8 MET CE :methyl 168:sc= -8.95! (180deg=-9.14!) USER MOD Single : I 9 GLN : amide:sc= -0.155 X(o=-0.15,f=-0.012) USER MOD Single : I 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 64.069 -10.796 16.283 1.00 0.00 N ATOM 2 CA MET C 1 63.220 -10.924 17.504 1.00 0.00 C ATOM 3 C MET C 1 61.755 -11.139 17.112 1.00 0.00 C ATOM 4 O MET C 1 61.181 -12.180 17.363 1.00 0.00 O ATOM 5 CB MET C 1 63.387 -9.598 18.243 1.00 0.00 C ATOM 6 CG MET C 1 62.794 -9.720 19.649 1.00 0.00 C ATOM 7 SD MET C 1 61.313 -8.688 19.771 1.00 0.00 S ATOM 8 CE MET C 1 60.423 -9.707 20.974 1.00 0.00 C ATOM 0 H1 MET C 1 65.060 -10.651 16.563 1.00 0.00 H new ATOM 0 H2 MET C 1 63.993 -11.664 15.715 1.00 0.00 H new ATOM 0 H3 MET C 1 63.746 -9.984 15.719 1.00 0.00 H new ATOM 0 HA MET C 1 63.511 -11.774 18.121 1.00 0.00 H new ATOM 0 HB2 MET C 1 64.443 -9.333 18.304 1.00 0.00 H new ATOM 0 HB3 MET C 1 62.889 -8.798 17.695 1.00 0.00 H new ATOM 0 HG2 MET C 1 62.544 -10.760 19.861 1.00 0.00 H new ATOM 0 HG3 MET C 1 63.528 -9.411 20.393 1.00 0.00 H new ATOM 0 HE1 MET C 1 59.461 -9.247 21.199 1.00 0.00 H new ATOM 0 HE2 MET C 1 60.262 -10.702 20.559 1.00 0.00 H new ATOM 0 HE3 MET C 1 61.010 -9.786 21.889 1.00 0.00 H new ATOM 20 N ASP C 2 61.145 -10.160 16.502 1.00 0.00 N ATOM 21 CA ASP C 2 59.716 -10.309 16.098 1.00 0.00 C ATOM 22 C ASP C 2 59.529 -11.583 15.269 1.00 0.00 C ATOM 23 O ASP C 2 60.443 -12.057 14.625 1.00 0.00 O ATOM 24 CB ASP C 2 59.408 -9.069 15.257 1.00 0.00 C ATOM 25 CG ASP C 2 59.689 -7.811 16.081 1.00 0.00 C ATOM 26 OD1 ASP C 2 60.843 -7.585 16.403 1.00 0.00 O ATOM 27 OD2 ASP C 2 58.745 -7.097 16.376 1.00 0.00 O ATOM 0 H ASP C 2 61.572 -9.265 16.266 1.00 0.00 H new ATOM 0 HA ASP C 2 59.051 -10.391 16.958 1.00 0.00 H new ATOM 0 HB2 ASP C 2 60.018 -9.069 14.354 1.00 0.00 H new ATOM 0 HB3 ASP C 2 58.366 -9.082 14.938 1.00 0.00 H new ATOM 32 N ASP C 3 58.349 -12.143 15.283 1.00 0.00 N ATOM 33 CA ASP C 3 58.103 -13.387 14.498 1.00 0.00 C ATOM 34 C ASP C 3 56.672 -13.395 13.953 1.00 0.00 C ATOM 35 O ASP C 3 56.087 -14.437 13.731 1.00 0.00 O ATOM 36 CB ASP C 3 58.302 -14.529 15.496 1.00 0.00 C ATOM 37 CG ASP C 3 59.223 -15.587 14.887 1.00 0.00 C ATOM 38 OD1 ASP C 3 59.039 -15.905 13.723 1.00 0.00 O ATOM 39 OD2 ASP C 3 60.096 -16.063 15.593 1.00 0.00 O ATOM 0 H ASP C 3 57.545 -11.793 15.804 1.00 0.00 H new ATOM 0 HA ASP C 3 58.770 -13.473 13.640 1.00 0.00 H new ATOM 0 HB2 ASP C 3 58.733 -14.146 16.421 1.00 0.00 H new ATOM 0 HB3 ASP C 3 57.340 -14.973 15.752 1.00 0.00 H new ATOM 44 N ILE C 4 56.102 -12.240 13.739 1.00 0.00 N ATOM 45 CA ILE C 4 54.708 -12.184 13.212 1.00 0.00 C ATOM 46 C ILE C 4 54.692 -11.553 11.817 1.00 0.00 C ATOM 47 O ILE C 4 53.799 -11.790 11.029 1.00 0.00 O ATOM 48 CB ILE C 4 53.946 -11.305 14.204 1.00 0.00 C ATOM 49 CG1 ILE C 4 52.531 -11.052 13.678 1.00 0.00 C ATOM 50 CG2 ILE C 4 54.673 -9.969 14.367 1.00 0.00 C ATOM 51 CD1 ILE C 4 51.685 -10.408 14.777 1.00 0.00 C ATOM 0 H ILE C 4 56.540 -11.334 13.906 1.00 0.00 H new ATOM 0 HA ILE C 4 54.264 -13.175 13.117 1.00 0.00 H new ATOM 0 HB ILE C 4 53.892 -11.810 15.169 1.00 0.00 H new ATOM 0 HG12 ILE C 4 52.567 -10.401 12.804 1.00 0.00 H new ATOM 0 HG13 ILE C 4 52.077 -11.990 13.358 1.00 0.00 H new ATOM 0 HG21 ILE C 4 54.129 -9.343 15.074 1.00 0.00 H new ATOM 0 HG22 ILE C 4 55.681 -10.147 14.740 1.00 0.00 H new ATOM 0 HG23 ILE C 4 54.727 -9.464 13.402 1.00 0.00 H new ATOM 0 HD11 ILE C 4 50.677 -10.228 14.402 1.00 0.00 H new ATOM 0 HD12 ILE C 4 51.638 -11.075 15.638 1.00 0.00 H new ATOM 0 HD13 ILE C 4 52.136 -9.461 15.075 1.00 0.00 H new ATOM 63 N TYR C 5 55.672 -10.749 11.506 1.00 0.00 N ATOM 64 CA TYR C 5 55.705 -10.104 10.162 1.00 0.00 C ATOM 65 C TYR C 5 56.231 -11.086 9.115 1.00 0.00 C ATOM 66 O TYR C 5 55.677 -11.214 8.042 1.00 0.00 O ATOM 67 CB TYR C 5 56.657 -8.918 10.313 1.00 0.00 C ATOM 68 CG TYR C 5 55.916 -7.764 10.945 1.00 0.00 C ATOM 69 CD1 TYR C 5 55.186 -6.877 10.144 1.00 0.00 C ATOM 70 CD2 TYR C 5 55.956 -7.583 12.332 1.00 0.00 C ATOM 71 CE1 TYR C 5 54.497 -5.810 10.731 1.00 0.00 C ATOM 72 CE2 TYR C 5 55.268 -6.515 12.919 1.00 0.00 C ATOM 73 CZ TYR C 5 54.537 -5.629 12.118 1.00 0.00 C ATOM 74 OH TYR C 5 53.857 -4.577 12.698 1.00 0.00 O ATOM 0 H TYR C 5 56.449 -10.511 12.122 1.00 0.00 H new ATOM 0 HA TYR C 5 54.715 -9.791 9.832 1.00 0.00 H new ATOM 0 HB2 TYR C 5 57.511 -9.198 10.929 1.00 0.00 H new ATOM 0 HB3 TYR C 5 57.049 -8.625 9.339 1.00 0.00 H new ATOM 0 HD1 TYR C 5 55.155 -7.017 9.074 1.00 0.00 H new ATOM 0 HD2 TYR C 5 56.518 -8.268 12.950 1.00 0.00 H new ATOM 0 HE1 TYR C 5 53.934 -5.126 10.113 1.00 0.00 H new ATOM 0 HE2 TYR C 5 55.301 -6.374 13.989 1.00 0.00 H new ATOM 0 HH TYR C 5 53.989 -4.598 13.669 1.00 0.00 H new ATOM 84 N LYS C 6 57.294 -11.782 9.420 1.00 0.00 N ATOM 85 CA LYS C 6 57.846 -12.760 8.439 1.00 0.00 C ATOM 86 C LYS C 6 56.700 -13.541 7.794 1.00 0.00 C ATOM 87 O LYS C 6 56.789 -13.983 6.666 1.00 0.00 O ATOM 88 CB LYS C 6 58.735 -13.692 9.266 1.00 0.00 C ATOM 89 CG LYS C 6 60.206 -13.355 9.014 1.00 0.00 C ATOM 90 CD LYS C 6 60.852 -14.470 8.187 1.00 0.00 C ATOM 91 CE LYS C 6 62.237 -14.020 7.714 1.00 0.00 C ATOM 92 NZ LYS C 6 62.089 -13.797 6.249 1.00 0.00 N ATOM 0 H LYS C 6 57.802 -11.716 10.302 1.00 0.00 H new ATOM 0 HA LYS C 6 58.404 -12.280 7.635 1.00 0.00 H new ATOM 0 HB2 LYS C 6 58.504 -13.586 10.326 1.00 0.00 H new ATOM 0 HB3 LYS C 6 58.538 -14.730 8.999 1.00 0.00 H new ATOM 0 HG2 LYS C 6 60.287 -12.404 8.488 1.00 0.00 H new ATOM 0 HG3 LYS C 6 60.731 -13.240 9.962 1.00 0.00 H new ATOM 0 HD2 LYS C 6 60.938 -15.377 8.785 1.00 0.00 H new ATOM 0 HD3 LYS C 6 60.224 -14.711 7.329 1.00 0.00 H new ATOM 0 HE2 LYS C 6 62.551 -13.108 8.222 1.00 0.00 H new ATOM 0 HE3 LYS C 6 62.992 -14.778 7.924 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 62.998 -13.486 5.852 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 61.796 -14.683 5.791 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 61.369 -13.066 6.080 1.00 0.00 H new ATOM 106 N ALA C 7 55.619 -13.706 8.507 1.00 0.00 N ATOM 107 CA ALA C 7 54.455 -14.449 7.946 1.00 0.00 C ATOM 108 C ALA C 7 53.623 -13.531 7.045 1.00 0.00 C ATOM 109 O ALA C 7 53.377 -13.832 5.894 1.00 0.00 O ATOM 110 CB ALA C 7 53.643 -14.888 9.164 1.00 0.00 C ATOM 0 H ALA C 7 55.492 -13.357 9.457 1.00 0.00 H new ATOM 0 HA ALA C 7 54.762 -15.297 7.334 1.00 0.00 H new ATOM 0 HB1 ALA C 7 52.765 -15.444 8.835 1.00 0.00 H new ATOM 0 HB2 ALA C 7 54.258 -15.524 9.801 1.00 0.00 H new ATOM 0 HB3 ALA C 7 53.327 -14.009 9.726 1.00 0.00 H new ATOM 116 N ALA C 8 53.187 -12.413 7.561 1.00 0.00 N ATOM 117 CA ALA C 8 52.369 -11.478 6.735 1.00 0.00 C ATOM 118 C ALA C 8 53.007 -11.291 5.356 1.00 0.00 C ATOM 119 O ALA C 8 52.328 -11.246 4.350 1.00 0.00 O ATOM 120 CB ALA C 8 52.371 -10.160 7.510 1.00 0.00 C ATOM 0 H ALA C 8 53.362 -12.107 8.518 1.00 0.00 H new ATOM 0 HA ALA C 8 51.359 -11.852 6.568 1.00 0.00 H new ATOM 0 HB1 ALA C 8 51.788 -9.417 6.966 1.00 0.00 H new ATOM 0 HB2 ALA C 8 51.931 -10.316 8.495 1.00 0.00 H new ATOM 0 HB3 ALA C 8 53.396 -9.806 7.623 1.00 0.00 H new ATOM 126 N VAL C 9 54.306 -11.184 5.302 1.00 0.00 N ATOM 127 CA VAL C 9 54.986 -11.001 3.987 1.00 0.00 C ATOM 128 C VAL C 9 54.695 -12.194 3.073 1.00 0.00 C ATOM 129 O VAL C 9 54.055 -12.065 2.048 1.00 0.00 O ATOM 130 CB VAL C 9 56.476 -10.939 4.318 1.00 0.00 C ATOM 131 CG1 VAL C 9 57.278 -10.722 3.032 1.00 0.00 C ATOM 132 CG2 VAL C 9 56.737 -9.781 5.282 1.00 0.00 C ATOM 0 H VAL C 9 54.927 -11.215 6.111 1.00 0.00 H new ATOM 0 HA VAL C 9 54.644 -10.106 3.467 1.00 0.00 H new ATOM 0 HB VAL C 9 56.783 -11.876 4.783 1.00 0.00 H new ATOM 0 HG11 VAL C 9 58.341 -10.678 3.269 1.00 0.00 H new ATOM 0 HG12 VAL C 9 57.094 -11.547 2.345 1.00 0.00 H new ATOM 0 HG13 VAL C 9 56.971 -9.786 2.565 1.00 0.00 H new ATOM 0 HG21 VAL C 9 57.800 -9.737 5.518 1.00 0.00 H new ATOM 0 HG22 VAL C 9 56.429 -8.844 4.817 1.00 0.00 H new ATOM 0 HG23 VAL C 9 56.168 -9.935 6.199 1.00 0.00 H new ATOM 142 N GLU C 10 55.168 -13.353 3.438 1.00 0.00 N ATOM 143 CA GLU C 10 54.930 -14.561 2.594 1.00 0.00 C ATOM 144 C GLU C 10 53.428 -14.817 2.428 1.00 0.00 C ATOM 145 O GLU C 10 53.001 -15.457 1.489 1.00 0.00 O ATOM 146 CB GLU C 10 55.587 -15.711 3.357 1.00 0.00 C ATOM 147 CG GLU C 10 56.717 -16.303 2.512 1.00 0.00 C ATOM 148 CD GLU C 10 57.987 -16.407 3.357 1.00 0.00 C ATOM 149 OE1 GLU C 10 58.590 -15.378 3.612 1.00 0.00 O ATOM 150 OE2 GLU C 10 58.336 -17.514 3.732 1.00 0.00 O ATOM 0 H GLU C 10 55.710 -13.518 4.286 1.00 0.00 H new ATOM 0 HA GLU C 10 55.340 -14.445 1.591 1.00 0.00 H new ATOM 0 HB2 GLU C 10 55.979 -15.353 4.309 1.00 0.00 H new ATOM 0 HB3 GLU C 10 54.848 -16.479 3.585 1.00 0.00 H new ATOM 0 HG2 GLU C 10 56.431 -17.288 2.143 1.00 0.00 H new ATOM 0 HG3 GLU C 10 56.899 -15.676 1.639 1.00 0.00 H new ATOM 157 N GLN C 11 52.624 -14.328 3.332 1.00 0.00 N ATOM 158 CA GLN C 11 51.154 -14.556 3.219 1.00 0.00 C ATOM 159 C GLN C 11 50.544 -13.617 2.174 1.00 0.00 C ATOM 160 O GLN C 11 49.404 -13.770 1.780 1.00 0.00 O ATOM 161 CB GLN C 11 50.594 -14.248 4.608 1.00 0.00 C ATOM 162 CG GLN C 11 49.317 -15.062 4.831 1.00 0.00 C ATOM 163 CD GLN C 11 48.967 -15.071 6.321 1.00 0.00 C ATOM 164 OE1 GLN C 11 48.805 -16.121 6.912 1.00 0.00 O ATOM 165 NE2 GLN C 11 48.840 -13.939 6.955 1.00 0.00 N ATOM 0 H GLN C 11 52.919 -13.782 4.142 1.00 0.00 H new ATOM 0 HA GLN C 11 50.922 -15.573 2.902 1.00 0.00 H new ATOM 0 HB2 GLN C 11 51.332 -14.491 5.372 1.00 0.00 H new ATOM 0 HB3 GLN C 11 50.380 -13.183 4.699 1.00 0.00 H new ATOM 0 HG2 GLN C 11 48.496 -14.633 4.257 1.00 0.00 H new ATOM 0 HG3 GLN C 11 49.457 -16.082 4.474 1.00 0.00 H new ATOM 0 HE21 GLN C 11 48.976 -13.058 6.459 1.00 0.00 H new ATOM 0 HE22 GLN C 11 48.605 -13.934 7.947 1.00 0.00 H new ATOM 174 N LEU C 12 51.290 -12.648 1.721 1.00 0.00 N ATOM 175 CA LEU C 12 50.746 -11.705 0.700 1.00 0.00 C ATOM 176 C LEU C 12 50.067 -12.483 -0.431 1.00 0.00 C ATOM 177 O LEU C 12 50.324 -13.654 -0.632 1.00 0.00 O ATOM 178 CB LEU C 12 51.964 -10.944 0.173 1.00 0.00 C ATOM 179 CG LEU C 12 52.457 -9.967 1.242 1.00 0.00 C ATOM 180 CD1 LEU C 12 53.879 -9.514 0.902 1.00 0.00 C ATOM 181 CD2 LEU C 12 51.532 -8.749 1.284 1.00 0.00 C ATOM 0 H LEU C 12 52.251 -12.467 2.012 1.00 0.00 H new ATOM 0 HA LEU C 12 49.996 -11.033 1.117 1.00 0.00 H new ATOM 0 HB2 LEU C 12 52.758 -11.644 -0.089 1.00 0.00 H new ATOM 0 HB3 LEU C 12 51.703 -10.403 -0.736 1.00 0.00 H new ATOM 0 HG LEU C 12 52.455 -10.460 2.214 1.00 0.00 H new ATOM 0 HD11 LEU C 12 54.231 -8.818 1.663 1.00 0.00 H new ATOM 0 HD12 LEU C 12 54.539 -10.381 0.870 1.00 0.00 H new ATOM 0 HD13 LEU C 12 53.881 -9.020 -0.070 1.00 0.00 H new ATOM 0 HD21 LEU C 12 51.882 -8.052 2.045 1.00 0.00 H new ATOM 0 HD22 LEU C 12 51.535 -8.256 0.312 1.00 0.00 H new ATOM 0 HD23 LEU C 12 50.519 -9.070 1.525 1.00 0.00 H new ATOM 193 N THR C 13 49.204 -11.843 -1.171 1.00 0.00 N ATOM 194 CA THR C 13 48.511 -12.549 -2.288 1.00 0.00 C ATOM 195 C THR C 13 49.264 -12.326 -3.603 1.00 0.00 C ATOM 196 O THR C 13 49.957 -11.343 -3.773 1.00 0.00 O ATOM 197 CB THR C 13 47.117 -11.921 -2.355 1.00 0.00 C ATOM 198 OG1 THR C 13 47.115 -10.695 -1.636 1.00 0.00 O ATOM 199 CG2 THR C 13 46.095 -12.877 -1.739 1.00 0.00 C ATOM 0 H THR C 13 48.948 -10.863 -1.052 1.00 0.00 H new ATOM 0 HA THR C 13 48.464 -13.626 -2.127 1.00 0.00 H new ATOM 0 HB THR C 13 46.854 -11.732 -3.396 1.00 0.00 H new ATOM 0 HG1 THR C 13 46.223 -10.291 -1.680 1.00 0.00 H new ATOM 0 HG21 THR C 13 45.103 -12.429 -1.787 1.00 0.00 H new ATOM 0 HG22 THR C 13 46.096 -13.816 -2.292 1.00 0.00 H new ATOM 0 HG23 THR C 13 46.357 -13.068 -0.698 1.00 0.00 H new ATOM 207 N GLU C 14 49.132 -13.231 -4.532 1.00 0.00 N ATOM 208 CA GLU C 14 49.838 -13.074 -5.836 1.00 0.00 C ATOM 209 C GLU C 14 49.663 -11.648 -6.365 1.00 0.00 C ATOM 210 O GLU C 14 50.578 -11.061 -6.908 1.00 0.00 O ATOM 211 CB GLU C 14 49.169 -14.079 -6.775 1.00 0.00 C ATOM 212 CG GLU C 14 47.652 -13.876 -6.748 1.00 0.00 C ATOM 213 CD GLU C 14 46.955 -15.193 -7.091 1.00 0.00 C ATOM 214 OE1 GLU C 14 47.168 -15.685 -8.187 1.00 0.00 O ATOM 215 OE2 GLU C 14 46.220 -15.688 -6.253 1.00 0.00 O ATOM 0 H GLU C 14 48.565 -14.074 -4.445 1.00 0.00 H new ATOM 0 HA GLU C 14 50.910 -13.251 -5.747 1.00 0.00 H new ATOM 0 HB2 GLU C 14 49.545 -13.950 -7.790 1.00 0.00 H new ATOM 0 HB3 GLU C 14 49.415 -15.096 -6.471 1.00 0.00 H new ATOM 0 HG2 GLU C 14 47.338 -13.532 -5.763 1.00 0.00 H new ATOM 0 HG3 GLU C 14 47.365 -13.104 -7.462 1.00 0.00 H new ATOM 222 N GLU C 15 48.495 -11.087 -6.214 1.00 0.00 N ATOM 223 CA GLU C 15 48.266 -9.700 -6.710 1.00 0.00 C ATOM 224 C GLU C 15 49.085 -8.701 -5.890 1.00 0.00 C ATOM 225 O GLU C 15 49.953 -8.024 -6.404 1.00 0.00 O ATOM 226 CB GLU C 15 46.770 -9.452 -6.516 1.00 0.00 C ATOM 227 CG GLU C 15 46.123 -9.152 -7.868 1.00 0.00 C ATOM 228 CD GLU C 15 44.690 -9.686 -7.878 1.00 0.00 C ATOM 229 OE1 GLU C 15 44.423 -10.622 -7.142 1.00 0.00 O ATOM 230 OE2 GLU C 15 43.884 -9.150 -8.620 1.00 0.00 O ATOM 0 H GLU C 15 47.690 -11.528 -5.769 1.00 0.00 H new ATOM 0 HA GLU C 15 48.569 -9.580 -7.750 1.00 0.00 H new ATOM 0 HB2 GLU C 15 46.302 -10.326 -6.063 1.00 0.00 H new ATOM 0 HB3 GLU C 15 46.615 -8.617 -5.833 1.00 0.00 H new ATOM 0 HG2 GLU C 15 46.123 -8.078 -8.053 1.00 0.00 H new ATOM 0 HG3 GLU C 15 46.700 -9.613 -8.669 1.00 0.00 H new ATOM 237 N GLN C 16 48.815 -8.603 -4.617 1.00 0.00 N ATOM 238 CA GLN C 16 49.577 -7.647 -3.762 1.00 0.00 C ATOM 239 C GLN C 16 51.081 -7.814 -3.996 1.00 0.00 C ATOM 240 O GLN C 16 51.830 -6.856 -3.992 1.00 0.00 O ATOM 241 CB GLN C 16 49.212 -8.025 -2.325 1.00 0.00 C ATOM 242 CG GLN C 16 50.220 -7.399 -1.359 1.00 0.00 C ATOM 243 CD GLN C 16 49.550 -7.158 -0.006 1.00 0.00 C ATOM 244 OE1 GLN C 16 48.807 -7.990 0.475 1.00 0.00 O ATOM 245 NE2 GLN C 16 49.782 -6.044 0.634 1.00 0.00 N ATOM 0 H GLN C 16 48.099 -9.144 -4.131 1.00 0.00 H new ATOM 0 HA GLN C 16 49.334 -6.608 -3.984 1.00 0.00 H new ATOM 0 HB2 GLN C 16 48.205 -7.678 -2.091 1.00 0.00 H new ATOM 0 HB3 GLN C 16 49.210 -9.109 -2.213 1.00 0.00 H new ATOM 0 HG2 GLN C 16 51.081 -8.057 -1.238 1.00 0.00 H new ATOM 0 HG3 GLN C 16 50.592 -6.458 -1.765 1.00 0.00 H new ATOM 0 HE21 GLN C 16 50.406 -5.345 0.231 1.00 0.00 H new ATOM 0 HE22 GLN C 16 49.340 -5.873 1.537 1.00 0.00 H new ATOM 254 N LYS C 17 51.530 -9.022 -4.195 1.00 0.00 N ATOM 255 CA LYS C 17 52.986 -9.250 -4.425 1.00 0.00 C ATOM 256 C LYS C 17 53.503 -8.315 -5.522 1.00 0.00 C ATOM 257 O LYS C 17 54.413 -7.538 -5.311 1.00 0.00 O ATOM 258 CB LYS C 17 53.093 -10.709 -4.869 1.00 0.00 C ATOM 259 CG LYS C 17 54.216 -11.399 -4.090 1.00 0.00 C ATOM 260 CD LYS C 17 53.685 -11.860 -2.732 1.00 0.00 C ATOM 261 CE LYS C 17 54.547 -13.011 -2.209 1.00 0.00 C ATOM 262 NZ LYS C 17 54.687 -12.754 -0.748 1.00 0.00 N ATOM 0 H LYS C 17 50.952 -9.862 -4.208 1.00 0.00 H new ATOM 0 HA LYS C 17 53.580 -9.050 -3.533 1.00 0.00 H new ATOM 0 HB2 LYS C 17 52.147 -11.223 -4.696 1.00 0.00 H new ATOM 0 HB3 LYS C 17 53.293 -10.761 -5.939 1.00 0.00 H new ATOM 0 HG2 LYS C 17 54.593 -12.252 -4.654 1.00 0.00 H new ATOM 0 HG3 LYS C 17 55.052 -10.713 -3.952 1.00 0.00 H new ATOM 0 HD2 LYS C 17 53.699 -11.031 -2.024 1.00 0.00 H new ATOM 0 HD3 LYS C 17 52.648 -12.182 -2.826 1.00 0.00 H new ATOM 0 HE2 LYS C 17 54.074 -13.975 -2.397 1.00 0.00 H new ATOM 0 HE3 LYS C 17 55.519 -13.031 -2.701 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 55.590 -13.145 -0.412 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 54.667 -11.729 -0.572 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 53.902 -13.208 -0.239 1.00 0.00 H new ATOM 276 N ASN C 18 52.931 -8.383 -6.692 1.00 0.00 N ATOM 277 CA ASN C 18 53.392 -7.497 -7.801 1.00 0.00 C ATOM 278 C ASN C 18 53.103 -6.030 -7.468 1.00 0.00 C ATOM 279 O ASN C 18 53.522 -5.131 -8.168 1.00 0.00 O ATOM 280 CB ASN C 18 52.583 -7.940 -9.022 1.00 0.00 C ATOM 281 CG ASN C 18 52.869 -9.414 -9.314 1.00 0.00 C ATOM 282 OD1 ASN C 18 53.823 -9.736 -9.994 1.00 0.00 O ATOM 283 ND2 ASN C 18 52.076 -10.329 -8.827 1.00 0.00 N ATOM 0 H ASN C 18 52.165 -9.013 -6.930 1.00 0.00 H new ATOM 0 HA ASN C 18 54.466 -7.575 -7.971 1.00 0.00 H new ATOM 0 HB2 ASN C 18 51.518 -7.794 -8.839 1.00 0.00 H new ATOM 0 HB3 ASN C 18 52.844 -7.329 -9.886 1.00 0.00 H new ATOM 0 HD21 ASN C 18 52.257 -11.315 -9.017 1.00 0.00 H new ATOM 0 HD22 ASN C 18 51.275 -10.059 -8.256 1.00 0.00 H new ATOM 290 N GLU C 19 52.389 -5.782 -6.404 1.00 0.00 N ATOM 291 CA GLU C 19 52.072 -4.374 -6.029 1.00 0.00 C ATOM 292 C GLU C 19 53.292 -3.695 -5.398 1.00 0.00 C ATOM 293 O GLU C 19 53.782 -2.698 -5.891 1.00 0.00 O ATOM 294 CB GLU C 19 50.936 -4.485 -5.012 1.00 0.00 C ATOM 295 CG GLU C 19 49.797 -3.547 -5.412 1.00 0.00 C ATOM 296 CD GLU C 19 48.475 -4.314 -5.399 1.00 0.00 C ATOM 297 OE1 GLU C 19 48.105 -4.801 -4.342 1.00 0.00 O ATOM 298 OE2 GLU C 19 47.853 -4.402 -6.445 1.00 0.00 O ATOM 0 H GLU C 19 52.011 -6.493 -5.778 1.00 0.00 H new ATOM 0 HA GLU C 19 51.793 -3.773 -6.894 1.00 0.00 H new ATOM 0 HB2 GLU C 19 50.575 -5.512 -4.965 1.00 0.00 H new ATOM 0 HB3 GLU C 19 51.299 -4.229 -4.017 1.00 0.00 H new ATOM 0 HG2 GLU C 19 49.747 -2.704 -4.723 1.00 0.00 H new ATOM 0 HG3 GLU C 19 49.982 -3.137 -6.405 1.00 0.00 H new ATOM 305 N PHE C 20 53.783 -4.221 -4.306 1.00 0.00 N ATOM 306 CA PHE C 20 54.965 -3.594 -3.644 1.00 0.00 C ATOM 307 C PHE C 20 56.205 -3.703 -4.542 1.00 0.00 C ATOM 308 O PHE C 20 57.092 -2.873 -4.492 1.00 0.00 O ATOM 309 CB PHE C 20 55.152 -4.373 -2.335 1.00 0.00 C ATOM 310 CG PHE C 20 55.947 -5.636 -2.582 1.00 0.00 C ATOM 311 CD1 PHE C 20 55.299 -6.800 -3.013 1.00 0.00 C ATOM 312 CD2 PHE C 20 57.331 -5.643 -2.376 1.00 0.00 C ATOM 313 CE1 PHE C 20 56.036 -7.969 -3.239 1.00 0.00 C ATOM 314 CE2 PHE C 20 58.069 -6.811 -2.602 1.00 0.00 C ATOM 315 CZ PHE C 20 57.421 -7.975 -3.033 1.00 0.00 C ATOM 0 H PHE C 20 53.418 -5.055 -3.845 1.00 0.00 H new ATOM 0 HA PHE C 20 54.818 -2.530 -3.457 1.00 0.00 H new ATOM 0 HB2 PHE C 20 55.666 -3.749 -1.604 1.00 0.00 H new ATOM 0 HB3 PHE C 20 54.179 -4.625 -1.912 1.00 0.00 H new ATOM 0 HD1 PHE C 20 54.231 -6.796 -3.171 1.00 0.00 H new ATOM 0 HD2 PHE C 20 57.831 -4.746 -2.042 1.00 0.00 H new ATOM 0 HE1 PHE C 20 55.536 -8.866 -3.572 1.00 0.00 H new ATOM 0 HE2 PHE C 20 59.137 -6.814 -2.444 1.00 0.00 H new ATOM 0 HZ PHE C 20 57.989 -8.877 -3.206 1.00 0.00 H new ATOM 325 N LYS C 21 56.274 -4.717 -5.362 1.00 0.00 N ATOM 326 CA LYS C 21 57.458 -4.867 -6.258 1.00 0.00 C ATOM 327 C LYS C 21 57.669 -3.584 -7.064 1.00 0.00 C ATOM 328 O LYS C 21 58.784 -3.201 -7.359 1.00 0.00 O ATOM 329 CB LYS C 21 57.113 -6.035 -7.184 1.00 0.00 C ATOM 330 CG LYS C 21 57.249 -7.354 -6.419 1.00 0.00 C ATOM 331 CD LYS C 21 58.083 -8.339 -7.242 1.00 0.00 C ATOM 332 CE LYS C 21 57.156 -9.328 -7.952 1.00 0.00 C ATOM 333 NZ LYS C 21 56.945 -10.431 -6.973 1.00 0.00 N ATOM 0 H LYS C 21 55.565 -5.445 -5.451 1.00 0.00 H new ATOM 0 HA LYS C 21 58.378 -5.051 -5.703 1.00 0.00 H new ATOM 0 HB2 LYS C 21 56.096 -5.925 -7.562 1.00 0.00 H new ATOM 0 HB3 LYS C 21 57.776 -6.035 -8.049 1.00 0.00 H new ATOM 0 HG2 LYS C 21 57.722 -7.179 -5.453 1.00 0.00 H new ATOM 0 HG3 LYS C 21 56.263 -7.774 -6.219 1.00 0.00 H new ATOM 0 HD2 LYS C 21 58.684 -7.799 -7.974 1.00 0.00 H new ATOM 0 HD3 LYS C 21 58.776 -8.875 -6.593 1.00 0.00 H new ATOM 0 HE2 LYS C 21 56.212 -8.857 -8.225 1.00 0.00 H new ATOM 0 HE3 LYS C 21 57.606 -9.699 -8.873 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 56.318 -11.149 -7.389 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 57.860 -10.865 -6.737 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 56.509 -10.050 -6.109 1.00 0.00 H new ATOM 347 N ALA C 22 56.606 -2.915 -7.420 1.00 0.00 N ATOM 348 CA ALA C 22 56.746 -1.654 -8.203 1.00 0.00 C ATOM 349 C ALA C 22 57.496 -0.605 -7.379 1.00 0.00 C ATOM 350 O ALA C 22 58.564 -0.159 -7.747 1.00 0.00 O ATOM 351 CB ALA C 22 55.313 -1.197 -8.479 1.00 0.00 C ATOM 0 H ALA C 22 55.647 -3.187 -7.203 1.00 0.00 H new ATOM 0 HA ALA C 22 57.310 -1.799 -9.124 1.00 0.00 H new ATOM 0 HB1 ALA C 22 55.331 -0.271 -9.054 1.00 0.00 H new ATOM 0 HB2 ALA C 22 54.789 -1.966 -9.046 1.00 0.00 H new ATOM 0 HB3 ALA C 22 54.797 -1.028 -7.534 1.00 0.00 H new ATOM 357 N ALA C 23 56.945 -0.210 -6.263 1.00 0.00 N ATOM 358 CA ALA C 23 57.629 0.806 -5.413 1.00 0.00 C ATOM 359 C ALA C 23 59.092 0.409 -5.201 1.00 0.00 C ATOM 360 O ALA C 23 59.996 1.191 -5.419 1.00 0.00 O ATOM 361 CB ALA C 23 56.868 0.792 -4.088 1.00 0.00 C ATOM 0 H ALA C 23 56.052 -0.547 -5.904 1.00 0.00 H new ATOM 0 HA ALA C 23 57.630 1.797 -5.867 1.00 0.00 H new ATOM 0 HB1 ALA C 23 57.313 1.516 -3.405 1.00 0.00 H new ATOM 0 HB2 ALA C 23 55.825 1.053 -4.265 1.00 0.00 H new ATOM 0 HB3 ALA C 23 56.923 -0.203 -3.647 1.00 0.00 H new ATOM 367 N PHE C 24 59.331 -0.804 -4.780 1.00 0.00 N ATOM 368 CA PHE C 24 60.736 -1.252 -4.558 1.00 0.00 C ATOM 369 C PHE C 24 61.618 -0.805 -5.728 1.00 0.00 C ATOM 370 O PHE C 24 62.702 -0.290 -5.538 1.00 0.00 O ATOM 371 CB PHE C 24 60.659 -2.778 -4.495 1.00 0.00 C ATOM 372 CG PHE C 24 62.026 -3.343 -4.193 1.00 0.00 C ATOM 373 CD1 PHE C 24 62.584 -3.186 -2.918 1.00 0.00 C ATOM 374 CD2 PHE C 24 62.736 -4.026 -5.187 1.00 0.00 C ATOM 375 CE1 PHE C 24 63.851 -3.711 -2.638 1.00 0.00 C ATOM 376 CE2 PHE C 24 64.003 -4.553 -4.908 1.00 0.00 C ATOM 377 CZ PHE C 24 64.561 -4.395 -3.633 1.00 0.00 C ATOM 0 H PHE C 24 58.615 -1.503 -4.581 1.00 0.00 H new ATOM 0 HA PHE C 24 61.170 -0.830 -3.651 1.00 0.00 H new ATOM 0 HB2 PHE C 24 59.950 -3.085 -3.726 1.00 0.00 H new ATOM 0 HB3 PHE C 24 60.293 -3.173 -5.443 1.00 0.00 H new ATOM 0 HD1 PHE C 24 62.036 -2.660 -2.150 1.00 0.00 H new ATOM 0 HD2 PHE C 24 62.306 -4.147 -6.170 1.00 0.00 H new ATOM 0 HE1 PHE C 24 64.281 -3.589 -1.655 1.00 0.00 H new ATOM 0 HE2 PHE C 24 64.550 -5.081 -5.675 1.00 0.00 H new ATOM 0 HZ PHE C 24 65.538 -4.800 -3.417 1.00 0.00 H new ATOM 387 N ASP C 25 61.160 -0.999 -6.934 1.00 0.00 N ATOM 388 CA ASP C 25 61.972 -0.584 -8.114 1.00 0.00 C ATOM 389 C ASP C 25 62.216 0.927 -8.080 1.00 0.00 C ATOM 390 O ASP C 25 63.343 1.384 -8.069 1.00 0.00 O ATOM 391 CB ASP C 25 61.128 -0.966 -9.331 1.00 0.00 C ATOM 392 CG ASP C 25 62.043 -1.477 -10.446 1.00 0.00 C ATOM 393 OD1 ASP C 25 63.136 -0.951 -10.578 1.00 0.00 O ATOM 394 OD2 ASP C 25 61.637 -2.388 -11.149 1.00 0.00 O ATOM 0 H ASP C 25 60.260 -1.426 -7.154 1.00 0.00 H new ATOM 0 HA ASP C 25 62.951 -1.063 -8.133 1.00 0.00 H new ATOM 0 HB2 ASP C 25 60.405 -1.735 -9.059 1.00 0.00 H new ATOM 0 HB3 ASP C 25 60.560 -0.103 -9.679 1.00 0.00 H new ATOM 399 N ILE C 26 61.169 1.708 -8.062 1.00 0.00 N ATOM 400 CA ILE C 26 61.346 3.189 -8.025 1.00 0.00 C ATOM 401 C ILE C 26 62.249 3.576 -6.849 1.00 0.00 C ATOM 402 O ILE C 26 62.915 4.592 -6.874 1.00 0.00 O ATOM 403 CB ILE C 26 59.935 3.753 -7.838 1.00 0.00 C ATOM 404 CG1 ILE C 26 59.144 3.586 -9.136 1.00 0.00 C ATOM 405 CG2 ILE C 26 60.014 5.240 -7.487 1.00 0.00 C ATOM 406 CD1 ILE C 26 58.401 2.250 -9.114 1.00 0.00 C ATOM 0 H ILE C 26 60.201 1.386 -8.071 1.00 0.00 H new ATOM 0 HA ILE C 26 61.817 3.577 -8.928 1.00 0.00 H new ATOM 0 HB ILE C 26 59.439 3.215 -7.031 1.00 0.00 H new ATOM 0 HG12 ILE C 26 58.435 4.406 -9.250 1.00 0.00 H new ATOM 0 HG13 ILE C 26 59.818 3.625 -9.992 1.00 0.00 H new ATOM 0 HG21 ILE C 26 59.007 5.637 -7.355 1.00 0.00 H new ATOM 0 HG22 ILE C 26 60.578 5.366 -6.563 1.00 0.00 H new ATOM 0 HG23 ILE C 26 60.513 5.778 -8.293 1.00 0.00 H new ATOM 0 HD11 ILE C 26 57.837 2.132 -10.040 1.00 0.00 H new ATOM 0 HD12 ILE C 26 59.119 1.436 -9.020 1.00 0.00 H new ATOM 0 HD13 ILE C 26 57.716 2.229 -8.267 1.00 0.00 H new ATOM 418 N PHE C 27 62.277 2.770 -5.823 1.00 0.00 N ATOM 419 CA PHE C 27 63.139 3.089 -4.649 1.00 0.00 C ATOM 420 C PHE C 27 64.610 2.845 -4.997 1.00 0.00 C ATOM 421 O PHE C 27 65.494 3.526 -4.516 1.00 0.00 O ATOM 422 CB PHE C 27 62.680 2.131 -3.550 1.00 0.00 C ATOM 423 CG PHE C 27 61.497 2.729 -2.827 1.00 0.00 C ATOM 424 CD1 PHE C 27 60.581 3.525 -3.525 1.00 0.00 C ATOM 425 CD2 PHE C 27 61.317 2.487 -1.460 1.00 0.00 C ATOM 426 CE1 PHE C 27 59.485 4.081 -2.855 1.00 0.00 C ATOM 427 CE2 PHE C 27 60.220 3.043 -0.790 1.00 0.00 C ATOM 428 CZ PHE C 27 59.303 3.839 -1.487 1.00 0.00 C ATOM 0 H PHE C 27 61.741 1.905 -5.747 1.00 0.00 H new ATOM 0 HA PHE C 27 63.053 4.131 -4.341 1.00 0.00 H new ATOM 0 HB2 PHE C 27 62.408 1.168 -3.982 1.00 0.00 H new ATOM 0 HB3 PHE C 27 63.494 1.947 -2.849 1.00 0.00 H new ATOM 0 HD1 PHE C 27 60.720 3.710 -4.580 1.00 0.00 H new ATOM 0 HD2 PHE C 27 62.024 1.872 -0.922 1.00 0.00 H new ATOM 0 HE1 PHE C 27 58.779 4.697 -3.393 1.00 0.00 H new ATOM 0 HE2 PHE C 27 60.081 2.858 0.265 1.00 0.00 H new ATOM 0 HZ PHE C 27 58.456 4.266 -0.971 1.00 0.00 H new ATOM 438 N VAL C 28 64.877 1.881 -5.835 1.00 0.00 N ATOM 439 CA VAL C 28 66.288 1.595 -6.222 1.00 0.00 C ATOM 440 C VAL C 28 66.552 2.098 -7.644 1.00 0.00 C ATOM 441 O VAL C 28 67.554 1.778 -8.251 1.00 0.00 O ATOM 442 CB VAL C 28 66.420 0.073 -6.159 1.00 0.00 C ATOM 443 CG1 VAL C 28 65.894 -0.434 -4.814 1.00 0.00 C ATOM 444 CG2 VAL C 28 65.608 -0.557 -7.292 1.00 0.00 C ATOM 0 H VAL C 28 64.178 1.278 -6.269 1.00 0.00 H new ATOM 0 HA VAL C 28 67.005 2.090 -5.567 1.00 0.00 H new ATOM 0 HB VAL C 28 67.469 -0.203 -6.265 1.00 0.00 H new ATOM 0 HG11 VAL C 28 65.989 -1.519 -4.772 1.00 0.00 H new ATOM 0 HG12 VAL C 28 66.472 0.013 -4.005 1.00 0.00 H new ATOM 0 HG13 VAL C 28 64.845 -0.157 -4.706 1.00 0.00 H new ATOM 0 HG21 VAL C 28 65.702 -1.642 -7.247 1.00 0.00 H new ATOM 0 HG22 VAL C 28 64.559 -0.279 -7.186 1.00 0.00 H new ATOM 0 HG23 VAL C 28 65.983 -0.200 -8.251 1.00 0.00 H new ATOM 454 N LEU C 29 65.658 2.883 -8.179 1.00 0.00 N ATOM 455 CA LEU C 29 65.852 3.406 -9.562 1.00 0.00 C ATOM 456 C LEU C 29 67.270 3.962 -9.728 1.00 0.00 C ATOM 457 O LEU C 29 67.534 5.111 -9.432 1.00 0.00 O ATOM 458 CB LEU C 29 64.819 4.524 -9.711 1.00 0.00 C ATOM 459 CG LEU C 29 64.089 4.370 -11.045 1.00 0.00 C ATOM 460 CD1 LEU C 29 63.250 5.622 -11.314 1.00 0.00 C ATOM 461 CD2 LEU C 29 65.111 4.195 -12.170 1.00 0.00 C ATOM 0 H LEU C 29 64.800 3.186 -7.718 1.00 0.00 H new ATOM 0 HA LEU C 29 65.727 2.629 -10.316 1.00 0.00 H new ATOM 0 HB2 LEU C 29 64.106 4.486 -8.888 1.00 0.00 H new ATOM 0 HB3 LEU C 29 65.310 5.496 -9.663 1.00 0.00 H new ATOM 0 HG LEU C 29 63.439 3.496 -11.003 1.00 0.00 H new ATOM 0 HD11 LEU C 29 62.729 5.513 -12.265 1.00 0.00 H new ATOM 0 HD12 LEU C 29 62.521 5.751 -10.514 1.00 0.00 H new ATOM 0 HD13 LEU C 29 63.902 6.495 -11.355 1.00 0.00 H new ATOM 0 HD21 LEU C 29 64.590 4.085 -13.121 1.00 0.00 H new ATOM 0 HD22 LEU C 29 65.760 5.069 -12.211 1.00 0.00 H new ATOM 0 HD23 LEU C 29 65.712 3.305 -11.981 1.00 0.00 H new ATOM 473 N GLY C 30 68.183 3.159 -10.204 1.00 0.00 N ATOM 474 CA GLY C 30 69.579 3.649 -10.392 1.00 0.00 C ATOM 475 C GLY C 30 70.555 2.725 -9.662 1.00 0.00 C ATOM 476 O GLY C 30 71.695 2.576 -10.056 1.00 0.00 O ATOM 0 H GLY C 30 68.023 2.187 -10.470 1.00 0.00 H new ATOM 0 HA2 GLY C 30 69.822 3.684 -11.454 1.00 0.00 H new ATOM 0 HA3 GLY C 30 69.672 4.666 -10.010 1.00 0.00 H new ATOM 480 N ALA C 31 70.121 2.106 -8.599 1.00 0.00 N ATOM 481 CA ALA C 31 71.029 1.195 -7.843 1.00 0.00 C ATOM 482 C ALA C 31 71.749 0.241 -8.801 1.00 0.00 C ATOM 483 O ALA C 31 71.326 0.036 -9.922 1.00 0.00 O ATOM 484 CB ALA C 31 70.112 0.415 -6.901 1.00 0.00 C ATOM 0 H ALA C 31 69.178 2.191 -8.221 1.00 0.00 H new ATOM 0 HA ALA C 31 71.802 1.742 -7.303 1.00 0.00 H new ATOM 0 HB1 ALA C 31 70.706 -0.280 -6.307 1.00 0.00 H new ATOM 0 HB2 ALA C 31 69.596 1.109 -6.238 1.00 0.00 H new ATOM 0 HB3 ALA C 31 69.379 -0.142 -7.485 1.00 0.00 H new ATOM 490 N GLU C 32 72.831 -0.345 -8.367 1.00 0.00 N ATOM 491 CA GLU C 32 73.577 -1.287 -9.251 1.00 0.00 C ATOM 492 C GLU C 32 72.998 -2.699 -9.122 1.00 0.00 C ATOM 493 O GLU C 32 72.715 -3.356 -10.104 1.00 0.00 O ATOM 494 CB GLU C 32 75.019 -1.251 -8.742 1.00 0.00 C ATOM 495 CG GLU C 32 75.975 -1.066 -9.923 1.00 0.00 C ATOM 496 CD GLU C 32 77.418 -1.250 -9.448 1.00 0.00 C ATOM 497 OE1 GLU C 32 77.632 -2.069 -8.570 1.00 0.00 O ATOM 498 OE2 GLU C 32 78.285 -0.568 -9.970 1.00 0.00 O ATOM 0 H GLU C 32 73.231 -0.213 -7.438 1.00 0.00 H new ATOM 0 HA GLU C 32 73.510 -1.009 -10.303 1.00 0.00 H new ATOM 0 HB2 GLU C 32 75.144 -0.436 -8.029 1.00 0.00 H new ATOM 0 HB3 GLU C 32 75.252 -2.175 -8.213 1.00 0.00 H new ATOM 0 HG2 GLU C 32 75.745 -1.787 -10.707 1.00 0.00 H new ATOM 0 HG3 GLU C 32 75.847 -0.074 -10.355 1.00 0.00 H new ATOM 505 N ASP C 33 72.821 -3.170 -7.918 1.00 0.00 N ATOM 506 CA ASP C 33 72.262 -4.539 -7.724 1.00 0.00 C ATOM 507 C ASP C 33 70.741 -4.472 -7.554 1.00 0.00 C ATOM 508 O ASP C 33 70.050 -5.466 -7.662 1.00 0.00 O ATOM 509 CB ASP C 33 72.917 -5.057 -6.444 1.00 0.00 C ATOM 510 CG ASP C 33 73.685 -6.345 -6.744 1.00 0.00 C ATOM 511 OD1 ASP C 33 73.912 -6.618 -7.911 1.00 0.00 O ATOM 512 OD2 ASP C 33 74.033 -7.036 -5.801 1.00 0.00 O ATOM 0 H ASP C 33 73.040 -2.666 -7.059 1.00 0.00 H new ATOM 0 HA ASP C 33 72.459 -5.188 -8.577 1.00 0.00 H new ATOM 0 HB2 ASP C 33 73.594 -4.304 -6.040 1.00 0.00 H new ATOM 0 HB3 ASP C 33 72.157 -5.243 -5.685 1.00 0.00 H new ATOM 517 N GLY C 34 70.216 -3.308 -7.286 1.00 0.00 N ATOM 518 CA GLY C 34 68.741 -3.179 -7.108 1.00 0.00 C ATOM 519 C GLY C 34 68.421 -2.925 -5.634 1.00 0.00 C ATOM 520 O GLY C 34 67.292 -3.049 -5.204 1.00 0.00 O ATOM 0 H GLY C 34 70.744 -2.441 -7.183 1.00 0.00 H new ATOM 0 HA2 GLY C 34 68.361 -2.360 -7.719 1.00 0.00 H new ATOM 0 HA3 GLY C 34 68.243 -4.087 -7.447 1.00 0.00 H new ATOM 524 N CYS C 35 69.406 -2.569 -4.855 1.00 0.00 N ATOM 525 CA CYS C 35 69.153 -2.305 -3.408 1.00 0.00 C ATOM 526 C CYS C 35 68.981 -0.803 -3.171 1.00 0.00 C ATOM 527 O CYS C 35 69.202 0.002 -4.054 1.00 0.00 O ATOM 528 CB CYS C 35 70.394 -2.826 -2.684 1.00 0.00 C ATOM 529 SG CYS C 35 70.173 -4.579 -2.292 1.00 0.00 S ATOM 0 H CYS C 35 70.373 -2.450 -5.156 1.00 0.00 H new ATOM 0 HA CYS C 35 68.244 -2.790 -3.052 1.00 0.00 H new ATOM 0 HB2 CYS C 35 71.276 -2.691 -3.309 1.00 0.00 H new ATOM 0 HB3 CYS C 35 70.561 -2.256 -1.770 1.00 0.00 H new ATOM 0 HG CYS C 35 71.229 -5.023 -1.678 1.00 0.00 H new ATOM 535 N ILE C 36 68.587 -0.419 -1.988 1.00 0.00 N ATOM 536 CA ILE C 36 68.401 1.033 -1.703 1.00 0.00 C ATOM 537 C ILE C 36 69.584 1.575 -0.896 1.00 0.00 C ATOM 538 O ILE C 36 70.251 0.851 -0.183 1.00 0.00 O ATOM 539 CB ILE C 36 67.114 1.117 -0.886 1.00 0.00 C ATOM 540 CG1 ILE C 36 65.942 0.617 -1.734 1.00 0.00 C ATOM 541 CG2 ILE C 36 66.863 2.569 -0.476 1.00 0.00 C ATOM 542 CD1 ILE C 36 64.772 0.251 -0.822 1.00 0.00 C ATOM 0 H ILE C 36 68.386 -1.045 -1.208 1.00 0.00 H new ATOM 0 HA ILE C 36 68.344 1.625 -2.616 1.00 0.00 H new ATOM 0 HB ILE C 36 67.208 0.500 0.007 1.00 0.00 H new ATOM 0 HG12 ILE C 36 65.637 1.387 -2.442 1.00 0.00 H new ATOM 0 HG13 ILE C 36 66.247 -0.251 -2.318 1.00 0.00 H new ATOM 0 HG21 ILE C 36 65.944 2.629 0.107 1.00 0.00 H new ATOM 0 HG22 ILE C 36 67.699 2.927 0.126 1.00 0.00 H new ATOM 0 HG23 ILE C 36 66.767 3.188 -1.368 1.00 0.00 H new ATOM 0 HD11 ILE C 36 63.937 -0.105 -1.426 1.00 0.00 H new ATOM 0 HD12 ILE C 36 65.081 -0.534 -0.131 1.00 0.00 H new ATOM 0 HD13 ILE C 36 64.462 1.130 -0.257 1.00 0.00 H new ATOM 554 N SER C 37 69.847 2.846 -1.009 1.00 0.00 N ATOM 555 CA SER C 37 70.983 3.452 -0.259 1.00 0.00 C ATOM 556 C SER C 37 70.702 4.934 -0.022 1.00 0.00 C ATOM 557 O SER C 37 71.594 5.754 -0.026 1.00 0.00 O ATOM 558 CB SER C 37 72.183 3.286 -1.176 1.00 0.00 C ATOM 559 OG SER C 37 73.037 2.272 -0.659 1.00 0.00 O ATOM 0 H SER C 37 69.321 3.496 -1.593 1.00 0.00 H new ATOM 0 HA SER C 37 71.143 2.987 0.714 1.00 0.00 H new ATOM 0 HB2 SER C 37 71.853 3.021 -2.181 1.00 0.00 H new ATOM 0 HB3 SER C 37 72.726 4.228 -1.257 1.00 0.00 H new ATOM 0 HG SER C 37 73.811 2.163 -1.251 1.00 0.00 H new ATOM 565 N THR C 38 69.457 5.266 0.162 1.00 0.00 N ATOM 566 CA THR C 38 69.048 6.692 0.382 1.00 0.00 C ATOM 567 C THR C 38 69.139 7.466 -0.936 1.00 0.00 C ATOM 568 O THR C 38 68.198 8.114 -1.347 1.00 0.00 O ATOM 569 CB THR C 38 70.007 7.286 1.430 1.00 0.00 C ATOM 570 OG1 THR C 38 71.147 7.832 0.784 1.00 0.00 O ATOM 571 CG2 THR C 38 70.442 6.209 2.429 1.00 0.00 C ATOM 0 H THR C 38 68.685 4.600 0.170 1.00 0.00 H new ATOM 0 HA THR C 38 68.019 6.756 0.734 1.00 0.00 H new ATOM 0 HB THR C 38 69.487 8.075 1.972 1.00 0.00 H new ATOM 0 HG1 THR C 38 71.756 7.108 0.527 1.00 0.00 H new ATOM 0 HG21 THR C 38 71.120 6.646 3.163 1.00 0.00 H new ATOM 0 HG22 THR C 38 69.565 5.809 2.938 1.00 0.00 H new ATOM 0 HG23 THR C 38 70.952 5.405 1.898 1.00 0.00 H new ATOM 579 N LYS C 39 70.255 7.394 -1.611 1.00 0.00 N ATOM 580 CA LYS C 39 70.381 8.118 -2.906 1.00 0.00 C ATOM 581 C LYS C 39 69.174 7.797 -3.791 1.00 0.00 C ATOM 582 O LYS C 39 68.652 8.649 -4.483 1.00 0.00 O ATOM 583 CB LYS C 39 71.665 7.583 -3.539 1.00 0.00 C ATOM 584 CG LYS C 39 72.805 8.576 -3.298 1.00 0.00 C ATOM 585 CD LYS C 39 73.688 8.069 -2.157 1.00 0.00 C ATOM 586 CE LYS C 39 74.893 7.325 -2.736 1.00 0.00 C ATOM 587 NZ LYS C 39 74.310 6.199 -3.518 1.00 0.00 N ATOM 0 H LYS C 39 71.080 6.868 -1.323 1.00 0.00 H new ATOM 0 HA LYS C 39 70.415 9.200 -2.779 1.00 0.00 H new ATOM 0 HB2 LYS C 39 71.917 6.613 -3.111 1.00 0.00 H new ATOM 0 HB3 LYS C 39 71.520 7.432 -4.609 1.00 0.00 H new ATOM 0 HG2 LYS C 39 73.397 8.694 -4.206 1.00 0.00 H new ATOM 0 HG3 LYS C 39 72.401 9.558 -3.051 1.00 0.00 H new ATOM 0 HD2 LYS C 39 74.024 8.905 -1.544 1.00 0.00 H new ATOM 0 HD3 LYS C 39 73.116 7.407 -1.507 1.00 0.00 H new ATOM 0 HE2 LYS C 39 75.492 7.978 -3.371 1.00 0.00 H new ATOM 0 HE3 LYS C 39 75.548 6.959 -1.946 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 75.060 5.520 -3.761 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 73.582 5.722 -2.949 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 73.881 6.568 -4.391 1.00 0.00 H new ATOM 601 N GLU C 40 68.724 6.571 -3.765 1.00 0.00 N ATOM 602 CA GLU C 40 67.547 6.189 -4.595 1.00 0.00 C ATOM 603 C GLU C 40 66.259 6.394 -3.794 1.00 0.00 C ATOM 604 O GLU C 40 65.278 6.908 -4.294 1.00 0.00 O ATOM 605 CB GLU C 40 67.749 4.707 -4.913 1.00 0.00 C ATOM 606 CG GLU C 40 69.190 4.471 -5.373 1.00 0.00 C ATOM 607 CD GLU C 40 69.392 5.091 -6.756 1.00 0.00 C ATOM 608 OE1 GLU C 40 68.428 5.598 -7.303 1.00 0.00 O ATOM 609 OE2 GLU C 40 70.510 5.046 -7.245 1.00 0.00 O ATOM 0 H GLU C 40 69.122 5.818 -3.204 1.00 0.00 H new ATOM 0 HA GLU C 40 67.463 6.790 -5.501 1.00 0.00 H new ATOM 0 HB2 GLU C 40 67.535 4.103 -4.031 1.00 0.00 H new ATOM 0 HB3 GLU C 40 67.053 4.394 -5.691 1.00 0.00 H new ATOM 0 HG2 GLU C 40 69.887 4.911 -4.660 1.00 0.00 H new ATOM 0 HG3 GLU C 40 69.402 3.402 -5.407 1.00 0.00 H new ATOM 616 N LEU C 41 66.258 5.998 -2.551 1.00 0.00 N ATOM 617 CA LEU C 41 65.039 6.173 -1.713 1.00 0.00 C ATOM 618 C LEU C 41 64.624 7.647 -1.699 1.00 0.00 C ATOM 619 O LEU C 41 63.588 8.013 -2.218 1.00 0.00 O ATOM 620 CB LEU C 41 65.453 5.714 -0.313 1.00 0.00 C ATOM 621 CG LEU C 41 64.207 5.424 0.525 1.00 0.00 C ATOM 622 CD1 LEU C 41 63.321 6.670 0.572 1.00 0.00 C ATOM 623 CD2 LEU C 41 63.425 4.266 -0.103 1.00 0.00 C ATOM 0 H LEU C 41 67.049 5.560 -2.079 1.00 0.00 H new ATOM 0 HA LEU C 41 64.188 5.606 -2.089 1.00 0.00 H new ATOM 0 HB2 LEU C 41 66.073 4.820 -0.382 1.00 0.00 H new ATOM 0 HB3 LEU C 41 66.056 6.484 0.169 1.00 0.00 H new ATOM 0 HG LEU C 41 64.507 5.153 1.537 1.00 0.00 H new ATOM 0 HD11 LEU C 41 62.433 6.463 1.169 1.00 0.00 H new ATOM 0 HD12 LEU C 41 63.876 7.494 1.020 1.00 0.00 H new ATOM 0 HD13 LEU C 41 63.022 6.942 -0.440 1.00 0.00 H new ATOM 0 HD21 LEU C 41 62.537 4.060 0.495 1.00 0.00 H new ATOM 0 HD22 LEU C 41 63.126 4.536 -1.116 1.00 0.00 H new ATOM 0 HD23 LEU C 41 64.055 3.377 -0.136 1.00 0.00 H new ATOM 635 N GLY C 42 65.426 8.494 -1.113 1.00 0.00 N ATOM 636 CA GLY C 42 65.078 9.943 -1.073 1.00 0.00 C ATOM 637 C GLY C 42 64.566 10.375 -2.447 1.00 0.00 C ATOM 638 O GLY C 42 63.662 11.179 -2.562 1.00 0.00 O ATOM 0 H GLY C 42 66.306 8.246 -0.661 1.00 0.00 H new ATOM 0 HA2 GLY C 42 64.317 10.126 -0.314 1.00 0.00 H new ATOM 0 HA3 GLY C 42 65.952 10.532 -0.796 1.00 0.00 H new ATOM 642 N LYS C 43 65.139 9.844 -3.491 1.00 0.00 N ATOM 643 CA LYS C 43 64.697 10.210 -4.863 1.00 0.00 C ATOM 644 C LYS C 43 63.169 10.217 -4.957 1.00 0.00 C ATOM 645 O LYS C 43 62.583 11.030 -5.642 1.00 0.00 O ATOM 646 CB LYS C 43 65.279 9.115 -5.754 1.00 0.00 C ATOM 647 CG LYS C 43 65.605 9.695 -7.127 1.00 0.00 C ATOM 648 CD LYS C 43 64.608 9.161 -8.154 1.00 0.00 C ATOM 649 CE LYS C 43 64.015 10.328 -8.946 1.00 0.00 C ATOM 650 NZ LYS C 43 65.146 10.854 -9.760 1.00 0.00 N ATOM 0 H LYS C 43 65.901 9.167 -3.451 1.00 0.00 H new ATOM 0 HA LYS C 43 65.030 11.207 -5.152 1.00 0.00 H new ATOM 0 HB2 LYS C 43 66.179 8.702 -5.299 1.00 0.00 H new ATOM 0 HB3 LYS C 43 64.567 8.296 -5.853 1.00 0.00 H new ATOM 0 HG2 LYS C 43 65.561 10.784 -7.094 1.00 0.00 H new ATOM 0 HG3 LYS C 43 66.621 9.425 -7.416 1.00 0.00 H new ATOM 0 HD2 LYS C 43 65.104 8.464 -8.830 1.00 0.00 H new ATOM 0 HD3 LYS C 43 63.814 8.608 -7.652 1.00 0.00 H new ATOM 0 HE2 LYS C 43 63.192 9.997 -9.580 1.00 0.00 H new ATOM 0 HE3 LYS C 43 63.617 11.095 -8.281 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 64.773 11.421 -10.548 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 65.756 11.449 -9.164 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 65.701 10.060 -10.138 1.00 0.00 H new ATOM 664 N VAL C 44 62.519 9.309 -4.283 1.00 0.00 N ATOM 665 CA VAL C 44 61.030 9.257 -4.343 1.00 0.00 C ATOM 666 C VAL C 44 60.413 10.307 -3.418 1.00 0.00 C ATOM 667 O VAL C 44 59.339 10.816 -3.670 1.00 0.00 O ATOM 668 CB VAL C 44 60.674 7.852 -3.868 1.00 0.00 C ATOM 669 CG1 VAL C 44 59.170 7.770 -3.609 1.00 0.00 C ATOM 670 CG2 VAL C 44 61.061 6.843 -4.950 1.00 0.00 C ATOM 0 H VAL C 44 62.954 8.600 -3.693 1.00 0.00 H new ATOM 0 HA VAL C 44 60.652 9.466 -5.344 1.00 0.00 H new ATOM 0 HB VAL C 44 61.213 7.627 -2.948 1.00 0.00 H new ATOM 0 HG11 VAL C 44 58.913 6.767 -3.269 1.00 0.00 H new ATOM 0 HG12 VAL C 44 58.893 8.494 -2.843 1.00 0.00 H new ATOM 0 HG13 VAL C 44 58.630 7.991 -4.530 1.00 0.00 H new ATOM 0 HG21 VAL C 44 60.809 5.837 -4.616 1.00 0.00 H new ATOM 0 HG22 VAL C 44 60.518 7.067 -5.868 1.00 0.00 H new ATOM 0 HG23 VAL C 44 62.133 6.905 -5.138 1.00 0.00 H new ATOM 680 N MET C 45 61.078 10.632 -2.346 1.00 0.00 N ATOM 681 CA MET C 45 60.521 11.646 -1.405 1.00 0.00 C ATOM 682 C MET C 45 60.152 12.925 -2.161 1.00 0.00 C ATOM 683 O MET C 45 59.107 13.506 -1.938 1.00 0.00 O ATOM 684 CB MET C 45 61.642 11.913 -0.401 1.00 0.00 C ATOM 685 CG MET C 45 62.009 10.609 0.311 1.00 0.00 C ATOM 686 SD MET C 45 60.512 9.844 0.986 1.00 0.00 S ATOM 687 CE MET C 45 60.101 8.839 -0.463 1.00 0.00 C ATOM 0 H MET C 45 61.982 10.241 -2.080 1.00 0.00 H new ATOM 0 HA MET C 45 59.612 11.299 -0.914 1.00 0.00 H new ATOM 0 HB2 MET C 45 62.515 12.318 -0.913 1.00 0.00 H new ATOM 0 HB3 MET C 45 61.323 12.660 0.326 1.00 0.00 H new ATOM 0 HG2 MET C 45 62.496 9.927 -0.386 1.00 0.00 H new ATOM 0 HG3 MET C 45 62.721 10.808 1.112 1.00 0.00 H new ATOM 0 HE1 MET C 45 59.698 7.880 -0.138 1.00 0.00 H new ATOM 0 HE2 MET C 45 59.358 9.359 -1.068 1.00 0.00 H new ATOM 0 HE3 MET C 45 61.000 8.672 -1.057 1.00 0.00 H new ATOM 697 N ARG C 46 60.993 13.371 -3.053 1.00 0.00 N ATOM 698 CA ARG C 46 60.670 14.611 -3.814 1.00 0.00 C ATOM 699 C ARG C 46 59.496 14.352 -4.761 1.00 0.00 C ATOM 700 O ARG C 46 58.805 15.261 -5.173 1.00 0.00 O ATOM 701 CB ARG C 46 61.945 14.956 -4.593 1.00 0.00 C ATOM 702 CG ARG C 46 62.154 13.961 -5.740 1.00 0.00 C ATOM 703 CD ARG C 46 62.950 14.637 -6.858 1.00 0.00 C ATOM 704 NE ARG C 46 64.357 14.660 -6.372 1.00 0.00 N ATOM 705 CZ ARG C 46 65.323 14.983 -7.187 1.00 0.00 C ATOM 706 NH1 ARG C 46 65.253 14.651 -8.447 1.00 0.00 N ATOM 707 NH2 ARG C 46 66.361 15.638 -6.743 1.00 0.00 N ATOM 0 H ARG C 46 61.884 12.934 -3.287 1.00 0.00 H new ATOM 0 HA ARG C 46 60.373 15.432 -3.162 1.00 0.00 H new ATOM 0 HB2 ARG C 46 61.874 15.969 -4.990 1.00 0.00 H new ATOM 0 HB3 ARG C 46 62.805 14.935 -3.924 1.00 0.00 H new ATOM 0 HG2 ARG C 46 62.686 13.081 -5.380 1.00 0.00 H new ATOM 0 HG3 ARG C 46 61.191 13.618 -6.119 1.00 0.00 H new ATOM 0 HD2 ARG C 46 62.865 14.083 -7.793 1.00 0.00 H new ATOM 0 HD3 ARG C 46 62.582 15.645 -7.050 1.00 0.00 H new ATOM 0 HE ARG C 46 64.566 14.423 -5.402 1.00 0.00 H new ATOM 0 HH11 ARG C 46 64.443 14.139 -8.795 1.00 0.00 H new ATOM 0 HH12 ARG C 46 66.009 14.904 -9.084 1.00 0.00 H new ATOM 0 HH21 ARG C 46 66.417 15.898 -5.758 1.00 0.00 H new ATOM 0 HH22 ARG C 46 67.116 15.890 -7.381 1.00 0.00 H new ATOM 721 N MET C 47 59.263 13.113 -5.101 1.00 0.00 N ATOM 722 CA MET C 47 58.130 12.792 -6.015 1.00 0.00 C ATOM 723 C MET C 47 56.835 12.658 -5.210 1.00 0.00 C ATOM 724 O MET C 47 55.774 13.052 -5.652 1.00 0.00 O ATOM 725 CB MET C 47 58.506 11.458 -6.662 1.00 0.00 C ATOM 726 CG MET C 47 59.455 11.707 -7.836 1.00 0.00 C ATOM 727 SD MET C 47 60.605 10.317 -7.991 1.00 0.00 S ATOM 728 CE MET C 47 59.383 9.058 -8.436 1.00 0.00 C ATOM 0 H MET C 47 59.808 12.310 -4.786 1.00 0.00 H new ATOM 0 HA MET C 47 57.963 13.568 -6.762 1.00 0.00 H new ATOM 0 HB2 MET C 47 58.982 10.808 -5.928 1.00 0.00 H new ATOM 0 HB3 MET C 47 57.609 10.945 -7.009 1.00 0.00 H new ATOM 0 HG2 MET C 47 58.886 11.826 -8.758 1.00 0.00 H new ATOM 0 HG3 MET C 47 60.007 12.634 -7.680 1.00 0.00 H new ATOM 0 HE1 MET C 47 59.293 8.336 -7.625 1.00 0.00 H new ATOM 0 HE2 MET C 47 58.417 9.533 -8.608 1.00 0.00 H new ATOM 0 HE3 MET C 47 59.702 8.546 -9.344 1.00 0.00 H new ATOM 738 N LEU C 48 56.914 12.107 -4.028 1.00 0.00 N ATOM 739 CA LEU C 48 55.688 11.955 -3.194 1.00 0.00 C ATOM 740 C LEU C 48 55.272 13.313 -2.622 1.00 0.00 C ATOM 741 O LEU C 48 54.156 13.496 -2.179 1.00 0.00 O ATOM 742 CB LEU C 48 56.086 11.000 -2.066 1.00 0.00 C ATOM 743 CG LEU C 48 56.386 9.614 -2.643 1.00 0.00 C ATOM 744 CD1 LEU C 48 56.458 8.593 -1.506 1.00 0.00 C ATOM 745 CD2 LEU C 48 55.274 9.212 -3.614 1.00 0.00 C ATOM 0 H LEU C 48 57.773 11.756 -3.605 1.00 0.00 H new ATOM 0 HA LEU C 48 54.843 11.575 -3.768 1.00 0.00 H new ATOM 0 HB2 LEU C 48 56.962 11.384 -1.544 1.00 0.00 H new ATOM 0 HB3 LEU C 48 55.282 10.933 -1.333 1.00 0.00 H new ATOM 0 HG LEU C 48 57.339 9.641 -3.171 1.00 0.00 H new ATOM 0 HD11 LEU C 48 56.672 7.606 -1.916 1.00 0.00 H new ATOM 0 HD12 LEU C 48 57.249 8.876 -0.812 1.00 0.00 H new ATOM 0 HD13 LEU C 48 55.504 8.568 -0.978 1.00 0.00 H new ATOM 0 HD21 LEU C 48 55.488 8.225 -4.024 1.00 0.00 H new ATOM 0 HD22 LEU C 48 54.321 9.186 -3.085 1.00 0.00 H new ATOM 0 HD23 LEU C 48 55.219 9.938 -4.425 1.00 0.00 H new ATOM 757 N GLY C 49 56.165 14.265 -2.630 1.00 0.00 N ATOM 758 CA GLY C 49 55.826 15.610 -2.087 1.00 0.00 C ATOM 759 C GLY C 49 56.617 15.855 -0.802 1.00 0.00 C ATOM 760 O GLY C 49 56.228 16.644 0.036 1.00 0.00 O ATOM 0 H GLY C 49 57.115 14.169 -2.989 1.00 0.00 H new ATOM 0 HA2 GLY C 49 56.059 16.380 -2.822 1.00 0.00 H new ATOM 0 HA3 GLY C 49 54.757 15.674 -1.886 1.00 0.00 H new ATOM 764 N GLN C 50 57.725 15.185 -0.637 1.00 0.00 N ATOM 765 CA GLN C 50 58.537 15.381 0.599 1.00 0.00 C ATOM 766 C GLN C 50 60.030 15.374 0.263 1.00 0.00 C ATOM 767 O GLN C 50 60.422 15.209 -0.875 1.00 0.00 O ATOM 768 CB GLN C 50 58.184 14.192 1.494 1.00 0.00 C ATOM 769 CG GLN C 50 57.156 14.626 2.539 1.00 0.00 C ATOM 770 CD GLN C 50 56.877 13.465 3.495 1.00 0.00 C ATOM 771 OE1 GLN C 50 57.122 12.243 3.107 1.00 0.00 O flip ATOM 772 NE2 GLN C 50 56.435 13.670 4.607 1.00 0.00 N flip ATOM 0 H GLN C 50 58.103 14.511 -1.303 1.00 0.00 H new ATOM 0 HA GLN C 50 58.328 16.335 1.083 1.00 0.00 H new ATOM 0 HB2 GLN C 50 57.784 13.376 0.892 1.00 0.00 H new ATOM 0 HB3 GLN C 50 59.081 13.815 1.986 1.00 0.00 H new ATOM 0 HG2 GLN C 50 57.528 15.487 3.095 1.00 0.00 H new ATOM 0 HG3 GLN C 50 56.233 14.937 2.049 1.00 0.00 H new ATOM 0 HE21 GLN C 50 56.243 14.624 4.912 1.00 0.00 H new ATOM 0 HE22 GLN C 50 56.256 12.888 5.237 1.00 0.00 H new ATOM 781 N ASN C 51 60.866 15.552 1.249 1.00 0.00 N ATOM 782 CA ASN C 51 62.336 15.554 0.998 1.00 0.00 C ATOM 783 C ASN C 51 63.092 15.479 2.326 1.00 0.00 C ATOM 784 O ASN C 51 63.463 16.490 2.889 1.00 0.00 O ATOM 785 CB ASN C 51 62.618 16.881 0.291 1.00 0.00 C ATOM 786 CG ASN C 51 63.368 16.613 -1.014 1.00 0.00 C ATOM 787 OD1 ASN C 51 62.719 16.653 -2.146 1.00 0.00 O flip ATOM 788 ND2 ASN C 51 64.557 16.363 -1.005 1.00 0.00 N flip ATOM 0 H ASN C 51 60.594 15.697 2.221 1.00 0.00 H new ATOM 0 HA ASN C 51 62.657 14.702 0.399 1.00 0.00 H new ATOM 0 HB2 ASN C 51 61.683 17.402 0.085 1.00 0.00 H new ATOM 0 HB3 ASN C 51 63.209 17.531 0.936 1.00 0.00 H new ATOM 0 HD21 ASN C 51 65.065 16.332 -0.121 1.00 0.00 H new ATOM 0 HD22 ASN C 51 65.047 16.185 -1.881 1.00 0.00 H new ATOM 795 N PRO C 52 63.288 14.274 2.785 1.00 0.00 N ATOM 796 CA PRO C 52 64.000 14.048 4.068 1.00 0.00 C ATOM 797 C PRO C 52 65.498 14.331 3.913 1.00 0.00 C ATOM 798 O PRO C 52 66.112 13.965 2.931 1.00 0.00 O ATOM 799 CB PRO C 52 63.754 12.569 4.357 1.00 0.00 C ATOM 800 CG PRO C 52 63.493 11.951 3.021 1.00 0.00 C ATOM 801 CD PRO C 52 62.869 13.015 2.156 1.00 0.00 C ATOM 0 HA PRO C 52 63.652 14.700 4.869 1.00 0.00 H new ATOM 0 HB2 PRO C 52 64.618 12.113 4.841 1.00 0.00 H new ATOM 0 HB3 PRO C 52 62.905 12.434 5.027 1.00 0.00 H new ATOM 0 HG2 PRO C 52 64.420 11.588 2.577 1.00 0.00 H new ATOM 0 HG3 PRO C 52 62.828 11.093 3.117 1.00 0.00 H new ATOM 0 HD2 PRO C 52 63.218 12.948 1.126 1.00 0.00 H new ATOM 0 HD3 PRO C 52 61.783 12.923 2.131 1.00 0.00 H new ATOM 809 N THR C 53 66.089 14.979 4.879 1.00 0.00 N ATOM 810 CA THR C 53 67.547 15.285 4.793 1.00 0.00 C ATOM 811 C THR C 53 68.352 13.986 4.698 1.00 0.00 C ATOM 812 O THR C 53 67.817 12.911 4.878 1.00 0.00 O ATOM 813 CB THR C 53 67.873 16.023 6.094 1.00 0.00 C ATOM 814 OG1 THR C 53 67.026 15.547 7.130 1.00 0.00 O ATOM 815 CG2 THR C 53 67.655 17.525 5.903 1.00 0.00 C ATOM 0 H THR C 53 65.626 15.310 5.725 1.00 0.00 H new ATOM 0 HA THR C 53 67.795 15.879 3.914 1.00 0.00 H new ATOM 0 HB THR C 53 68.914 15.843 6.362 1.00 0.00 H new ATOM 0 HG1 THR C 53 67.234 16.017 7.964 1.00 0.00 H new ATOM 0 HG21 THR C 53 67.888 18.047 6.831 1.00 0.00 H new ATOM 0 HG22 THR C 53 68.306 17.889 5.108 1.00 0.00 H new ATOM 0 HG23 THR C 53 66.615 17.710 5.633 1.00 0.00 H new ATOM 823 N PRO C 54 69.619 14.132 4.420 1.00 0.00 N ATOM 824 CA PRO C 54 70.513 12.954 4.305 1.00 0.00 C ATOM 825 C PRO C 54 70.742 12.324 5.681 1.00 0.00 C ATOM 826 O PRO C 54 71.107 11.171 5.795 1.00 0.00 O ATOM 827 CB PRO C 54 71.809 13.541 3.749 1.00 0.00 C ATOM 828 CG PRO C 54 71.783 14.979 4.155 1.00 0.00 C ATOM 829 CD PRO C 54 70.335 15.393 4.194 1.00 0.00 C ATOM 0 HA PRO C 54 70.106 12.164 3.674 1.00 0.00 H new ATOM 0 HB2 PRO C 54 72.681 13.031 4.157 1.00 0.00 H new ATOM 0 HB3 PRO C 54 71.857 13.437 2.665 1.00 0.00 H new ATOM 0 HG2 PRO C 54 72.250 15.114 5.130 1.00 0.00 H new ATOM 0 HG3 PRO C 54 72.341 15.591 3.447 1.00 0.00 H new ATOM 0 HD2 PRO C 54 70.145 16.110 4.993 1.00 0.00 H new ATOM 0 HD3 PRO C 54 70.028 15.866 3.261 1.00 0.00 H new ATOM 837 N GLU C 55 70.523 13.073 6.727 1.00 0.00 N ATOM 838 CA GLU C 55 70.722 12.517 8.094 1.00 0.00 C ATOM 839 C GLU C 55 69.521 11.654 8.487 1.00 0.00 C ATOM 840 O GLU C 55 69.649 10.686 9.212 1.00 0.00 O ATOM 841 CB GLU C 55 70.829 13.739 9.009 1.00 0.00 C ATOM 842 CG GLU C 55 72.292 13.954 9.405 1.00 0.00 C ATOM 843 CD GLU C 55 72.549 13.319 10.772 1.00 0.00 C ATOM 844 OE1 GLU C 55 71.694 13.447 11.633 1.00 0.00 O ATOM 845 OE2 GLU C 55 73.596 12.714 10.935 1.00 0.00 O ATOM 0 H GLU C 55 70.215 14.045 6.694 1.00 0.00 H new ATOM 0 HA GLU C 55 71.606 11.883 8.160 1.00 0.00 H new ATOM 0 HB2 GLU C 55 70.446 14.623 8.499 1.00 0.00 H new ATOM 0 HB3 GLU C 55 70.218 13.594 9.900 1.00 0.00 H new ATOM 0 HG2 GLU C 55 72.951 13.512 8.657 1.00 0.00 H new ATOM 0 HG3 GLU C 55 72.518 15.020 9.439 1.00 0.00 H new ATOM 852 N GLU C 56 68.355 11.994 8.011 1.00 0.00 N ATOM 853 CA GLU C 56 67.146 11.192 8.353 1.00 0.00 C ATOM 854 C GLU C 56 66.941 10.082 7.319 1.00 0.00 C ATOM 855 O GLU C 56 66.209 9.139 7.543 1.00 0.00 O ATOM 856 CB GLU C 56 65.985 12.188 8.311 1.00 0.00 C ATOM 857 CG GLU C 56 66.086 13.140 9.503 1.00 0.00 C ATOM 858 CD GLU C 56 65.817 12.370 10.797 1.00 0.00 C ATOM 859 OE1 GLU C 56 64.683 11.967 10.998 1.00 0.00 O ATOM 860 OE2 GLU C 56 66.750 12.197 11.565 1.00 0.00 O ATOM 0 H GLU C 56 68.187 12.793 7.400 1.00 0.00 H new ATOM 0 HA GLU C 56 67.231 10.708 9.326 1.00 0.00 H new ATOM 0 HB2 GLU C 56 66.009 12.752 7.379 1.00 0.00 H new ATOM 0 HB3 GLU C 56 65.034 11.656 8.337 1.00 0.00 H new ATOM 0 HG2 GLU C 56 67.077 13.593 9.537 1.00 0.00 H new ATOM 0 HG3 GLU C 56 65.367 13.952 9.395 1.00 0.00 H new ATOM 867 N LEU C 57 67.585 10.184 6.188 1.00 0.00 N ATOM 868 CA LEU C 57 67.427 9.130 5.146 1.00 0.00 C ATOM 869 C LEU C 57 67.899 7.781 5.692 1.00 0.00 C ATOM 870 O LEU C 57 67.207 6.786 5.602 1.00 0.00 O ATOM 871 CB LEU C 57 68.318 9.579 3.988 1.00 0.00 C ATOM 872 CG LEU C 57 67.453 9.861 2.758 1.00 0.00 C ATOM 873 CD1 LEU C 57 68.353 10.095 1.545 1.00 0.00 C ATOM 874 CD2 LEU C 57 66.541 8.662 2.491 1.00 0.00 C ATOM 0 H LEU C 57 68.212 10.950 5.941 1.00 0.00 H new ATOM 0 HA LEU C 57 66.389 9.006 4.836 1.00 0.00 H new ATOM 0 HB2 LEU C 57 68.873 10.474 4.268 1.00 0.00 H new ATOM 0 HB3 LEU C 57 69.053 8.807 3.760 1.00 0.00 H new ATOM 0 HG LEU C 57 66.845 10.748 2.937 1.00 0.00 H new ATOM 0 HD11 LEU C 57 67.737 10.296 0.668 1.00 0.00 H new ATOM 0 HD12 LEU C 57 69.004 10.948 1.734 1.00 0.00 H new ATOM 0 HD13 LEU C 57 68.960 9.208 1.366 1.00 0.00 H new ATOM 0 HD21 LEU C 57 65.924 8.862 1.615 1.00 0.00 H new ATOM 0 HD22 LEU C 57 67.149 7.775 2.312 1.00 0.00 H new ATOM 0 HD23 LEU C 57 65.899 8.493 3.356 1.00 0.00 H new ATOM 886 N GLN C 58 69.074 7.741 6.258 1.00 0.00 N ATOM 887 CA GLN C 58 69.593 6.459 6.811 1.00 0.00 C ATOM 888 C GLN C 58 68.609 5.890 7.837 1.00 0.00 C ATOM 889 O GLN C 58 68.519 4.695 8.029 1.00 0.00 O ATOM 890 CB GLN C 58 70.915 6.826 7.484 1.00 0.00 C ATOM 891 CG GLN C 58 72.002 5.843 7.045 1.00 0.00 C ATOM 892 CD GLN C 58 71.741 4.476 7.679 1.00 0.00 C ATOM 893 OE1 GLN C 58 72.107 4.239 8.813 1.00 0.00 O ATOM 894 NE2 GLN C 58 71.118 3.560 6.990 1.00 0.00 N ATOM 0 H GLN C 58 69.697 8.542 6.361 1.00 0.00 H new ATOM 0 HA GLN C 58 69.724 5.699 6.041 1.00 0.00 H new ATOM 0 HB2 GLN C 58 71.201 7.843 7.217 1.00 0.00 H new ATOM 0 HB3 GLN C 58 70.803 6.800 8.568 1.00 0.00 H new ATOM 0 HG2 GLN C 58 72.011 5.756 5.959 1.00 0.00 H new ATOM 0 HG3 GLN C 58 72.983 6.213 7.343 1.00 0.00 H new ATOM 0 HE21 GLN C 58 70.811 3.759 6.038 1.00 0.00 H new ATOM 0 HE22 GLN C 58 70.938 2.645 7.403 1.00 0.00 H new ATOM 903 N GLU C 59 67.869 6.739 8.497 1.00 0.00 N ATOM 904 CA GLU C 59 66.892 6.242 9.508 1.00 0.00 C ATOM 905 C GLU C 59 65.869 5.320 8.841 1.00 0.00 C ATOM 906 O GLU C 59 65.459 4.322 9.402 1.00 0.00 O ATOM 907 CB GLU C 59 66.208 7.497 10.050 1.00 0.00 C ATOM 908 CG GLU C 59 65.173 7.097 11.102 1.00 0.00 C ATOM 909 CD GLU C 59 64.248 8.282 11.386 1.00 0.00 C ATOM 910 OE1 GLU C 59 64.547 9.367 10.915 1.00 0.00 O ATOM 911 OE2 GLU C 59 63.258 8.084 12.069 1.00 0.00 O ATOM 0 H GLU C 59 67.898 7.752 8.381 1.00 0.00 H new ATOM 0 HA GLU C 59 67.372 5.667 10.300 1.00 0.00 H new ATOM 0 HB2 GLU C 59 66.948 8.167 10.488 1.00 0.00 H new ATOM 0 HB3 GLU C 59 65.726 8.041 9.238 1.00 0.00 H new ATOM 0 HG2 GLU C 59 64.592 6.245 10.750 1.00 0.00 H new ATOM 0 HG3 GLU C 59 65.673 6.785 12.019 1.00 0.00 H new ATOM 918 N MET C 60 65.455 5.644 7.647 1.00 0.00 N ATOM 919 CA MET C 60 64.460 4.786 6.943 1.00 0.00 C ATOM 920 C MET C 60 65.035 3.382 6.730 1.00 0.00 C ATOM 921 O MET C 60 64.390 2.389 6.999 1.00 0.00 O ATOM 922 CB MET C 60 64.219 5.481 5.602 1.00 0.00 C ATOM 923 CG MET C 60 63.459 6.789 5.835 1.00 0.00 C ATOM 924 SD MET C 60 61.684 6.444 5.950 1.00 0.00 S ATOM 925 CE MET C 60 61.125 7.769 4.851 1.00 0.00 C ATOM 0 H MET C 60 65.763 6.466 7.128 1.00 0.00 H new ATOM 0 HA MET C 60 63.537 4.668 7.510 1.00 0.00 H new ATOM 0 HB2 MET C 60 65.170 5.683 5.109 1.00 0.00 H new ATOM 0 HB3 MET C 60 63.649 4.830 4.940 1.00 0.00 H new ATOM 0 HG2 MET C 60 63.808 7.266 6.751 1.00 0.00 H new ATOM 0 HG3 MET C 60 63.653 7.485 5.019 1.00 0.00 H new ATOM 0 HE1 MET C 60 60.068 7.967 5.028 1.00 0.00 H new ATOM 0 HE2 MET C 60 61.701 8.673 5.048 1.00 0.00 H new ATOM 0 HE3 MET C 60 61.269 7.466 3.814 1.00 0.00 H new ATOM 935 N ILE C 61 66.247 3.293 6.253 1.00 0.00 N ATOM 936 CA ILE C 61 66.864 1.954 6.029 1.00 0.00 C ATOM 937 C ILE C 61 67.076 1.245 7.371 1.00 0.00 C ATOM 938 O ILE C 61 67.001 0.036 7.463 1.00 0.00 O ATOM 939 CB ILE C 61 68.203 2.248 5.346 1.00 0.00 C ATOM 940 CG1 ILE C 61 67.967 2.491 3.854 1.00 0.00 C ATOM 941 CG2 ILE C 61 69.150 1.058 5.520 1.00 0.00 C ATOM 942 CD1 ILE C 61 67.777 3.988 3.603 1.00 0.00 C ATOM 0 H ILE C 61 66.836 4.089 6.009 1.00 0.00 H new ATOM 0 HA ILE C 61 66.238 1.299 5.423 1.00 0.00 H new ATOM 0 HB ILE C 61 68.650 3.133 5.800 1.00 0.00 H new ATOM 0 HG12 ILE C 61 68.813 2.119 3.276 1.00 0.00 H new ATOM 0 HG13 ILE C 61 67.087 1.941 3.520 1.00 0.00 H new ATOM 0 HG21 ILE C 61 70.100 1.275 5.032 1.00 0.00 H new ATOM 0 HG22 ILE C 61 69.320 0.881 6.582 1.00 0.00 H new ATOM 0 HG23 ILE C 61 68.705 0.170 5.071 1.00 0.00 H new ATOM 0 HD11 ILE C 61 67.609 4.160 2.540 1.00 0.00 H new ATOM 0 HD12 ILE C 61 66.917 4.346 4.169 1.00 0.00 H new ATOM 0 HD13 ILE C 61 68.670 4.526 3.921 1.00 0.00 H new ATOM 954 N ASP C 62 67.340 1.988 8.410 1.00 0.00 N ATOM 955 CA ASP C 62 67.556 1.354 9.742 1.00 0.00 C ATOM 956 C ASP C 62 66.216 0.917 10.345 1.00 0.00 C ATOM 957 O ASP C 62 66.170 0.174 11.305 1.00 0.00 O ATOM 958 CB ASP C 62 68.200 2.442 10.602 1.00 0.00 C ATOM 959 CG ASP C 62 69.259 1.814 11.511 1.00 0.00 C ATOM 960 OD1 ASP C 62 68.877 1.154 12.463 1.00 0.00 O ATOM 961 OD2 ASP C 62 70.432 2.003 11.238 1.00 0.00 O ATOM 0 H ASP C 62 67.416 3.005 8.395 1.00 0.00 H new ATOM 0 HA ASP C 62 68.181 0.463 9.677 1.00 0.00 H new ATOM 0 HB2 ASP C 62 68.655 3.201 9.966 1.00 0.00 H new ATOM 0 HB3 ASP C 62 67.441 2.943 11.203 1.00 0.00 H new ATOM 966 N GLU C 63 65.126 1.371 9.788 1.00 0.00 N ATOM 967 CA GLU C 63 63.794 0.978 10.331 1.00 0.00 C ATOM 968 C GLU C 63 63.528 -0.505 10.061 1.00 0.00 C ATOM 969 O GLU C 63 62.768 -1.147 10.757 1.00 0.00 O ATOM 970 CB GLU C 63 62.784 1.848 9.580 1.00 0.00 C ATOM 971 CG GLU C 63 61.791 2.454 10.576 1.00 0.00 C ATOM 972 CD GLU C 63 60.735 3.262 9.819 1.00 0.00 C ATOM 973 OE1 GLU C 63 61.085 4.299 9.282 1.00 0.00 O ATOM 974 OE2 GLU C 63 59.595 2.829 9.789 1.00 0.00 O ATOM 0 H GLU C 63 65.100 1.996 8.982 1.00 0.00 H new ATOM 0 HA GLU C 63 63.732 1.121 11.410 1.00 0.00 H new ATOM 0 HB2 GLU C 63 63.302 2.640 9.039 1.00 0.00 H new ATOM 0 HB3 GLU C 63 62.253 1.250 8.839 1.00 0.00 H new ATOM 0 HG2 GLU C 63 61.313 1.664 11.155 1.00 0.00 H new ATOM 0 HG3 GLU C 63 62.316 3.095 11.284 1.00 0.00 H new ATOM 981 N VAL C 64 64.149 -1.056 9.052 1.00 0.00 N ATOM 982 CA VAL C 64 63.928 -2.497 8.738 1.00 0.00 C ATOM 983 C VAL C 64 65.257 -3.173 8.387 1.00 0.00 C ATOM 984 O VAL C 64 65.357 -3.900 7.417 1.00 0.00 O ATOM 985 CB VAL C 64 62.989 -2.499 7.532 1.00 0.00 C ATOM 986 CG1 VAL C 64 61.578 -2.119 7.980 1.00 0.00 C ATOM 987 CG2 VAL C 64 63.486 -1.483 6.500 1.00 0.00 C ATOM 0 H VAL C 64 64.799 -0.571 8.433 1.00 0.00 H new ATOM 0 HA VAL C 64 63.508 -3.044 9.582 1.00 0.00 H new ATOM 0 HB VAL C 64 62.972 -3.494 7.087 1.00 0.00 H new ATOM 0 HG11 VAL C 64 60.910 -2.121 7.119 1.00 0.00 H new ATOM 0 HG12 VAL C 64 61.223 -2.840 8.716 1.00 0.00 H new ATOM 0 HG13 VAL C 64 61.593 -1.124 8.425 1.00 0.00 H new ATOM 0 HG21 VAL C 64 62.818 -1.483 5.639 1.00 0.00 H new ATOM 0 HG22 VAL C 64 63.503 -0.489 6.947 1.00 0.00 H new ATOM 0 HG23 VAL C 64 64.492 -1.753 6.179 1.00 0.00 H new ATOM 997 N ASP C 65 66.278 -2.942 9.166 1.00 0.00 N ATOM 998 CA ASP C 65 67.597 -3.574 8.875 1.00 0.00 C ATOM 999 C ASP C 65 68.006 -4.495 10.026 1.00 0.00 C ATOM 1000 O ASP C 65 68.552 -4.059 11.021 1.00 0.00 O ATOM 1001 CB ASP C 65 68.575 -2.406 8.748 1.00 0.00 C ATOM 1002 CG ASP C 65 69.278 -2.476 7.391 1.00 0.00 C ATOM 1003 OD1 ASP C 65 70.268 -3.182 7.295 1.00 0.00 O ATOM 1004 OD2 ASP C 65 68.815 -1.821 6.472 1.00 0.00 O ATOM 0 H ASP C 65 66.256 -2.343 9.991 1.00 0.00 H new ATOM 0 HA ASP C 65 67.573 -4.185 7.973 1.00 0.00 H new ATOM 0 HB2 ASP C 65 68.043 -1.460 8.846 1.00 0.00 H new ATOM 0 HB3 ASP C 65 69.309 -2.443 9.553 1.00 0.00 H new ATOM 1009 N GLU C 66 67.747 -5.768 9.899 1.00 0.00 N ATOM 1010 CA GLU C 66 68.119 -6.720 10.986 1.00 0.00 C ATOM 1011 C GLU C 66 69.610 -7.060 10.909 1.00 0.00 C ATOM 1012 O GLU C 66 70.104 -7.895 11.641 1.00 0.00 O ATOM 1013 CB GLU C 66 67.273 -7.966 10.725 1.00 0.00 C ATOM 1014 CG GLU C 66 66.739 -8.510 12.051 1.00 0.00 C ATOM 1015 CD GLU C 66 67.911 -8.841 12.977 1.00 0.00 C ATOM 1016 OE1 GLU C 66 68.519 -7.914 13.486 1.00 0.00 O ATOM 1017 OE2 GLU C 66 68.179 -10.018 13.163 1.00 0.00 O ATOM 0 H GLU C 66 67.294 -6.191 9.089 1.00 0.00 H new ATOM 0 HA GLU C 66 67.941 -6.303 11.977 1.00 0.00 H new ATOM 0 HB2 GLU C 66 66.444 -7.723 10.060 1.00 0.00 H new ATOM 0 HB3 GLU C 66 67.872 -8.726 10.223 1.00 0.00 H new ATOM 0 HG2 GLU C 66 66.087 -7.774 12.522 1.00 0.00 H new ATOM 0 HG3 GLU C 66 66.138 -9.402 11.875 1.00 0.00 H new ATOM 1024 N ASP C 67 70.330 -6.423 10.027 1.00 0.00 N ATOM 1025 CA ASP C 67 71.788 -6.714 9.906 1.00 0.00 C ATOM 1026 C ASP C 67 72.591 -5.411 9.903 1.00 0.00 C ATOM 1027 O ASP C 67 73.797 -5.414 9.754 1.00 0.00 O ATOM 1028 CB ASP C 67 71.936 -7.438 8.567 1.00 0.00 C ATOM 1029 CG ASP C 67 71.655 -6.461 7.423 1.00 0.00 C ATOM 1030 OD1 ASP C 67 71.003 -5.461 7.671 1.00 0.00 O ATOM 1031 OD2 ASP C 67 72.097 -6.732 6.319 1.00 0.00 O ATOM 0 H ASP C 67 69.973 -5.715 9.386 1.00 0.00 H new ATOM 0 HA ASP C 67 72.160 -7.312 10.738 1.00 0.00 H new ATOM 0 HB2 ASP C 67 72.942 -7.846 8.472 1.00 0.00 H new ATOM 0 HB3 ASP C 67 71.245 -8.279 8.518 1.00 0.00 H new ATOM 1036 N GLY C 68 71.932 -4.298 10.069 1.00 0.00 N ATOM 1037 CA GLY C 68 72.659 -2.996 10.077 1.00 0.00 C ATOM 1038 C GLY C 68 73.673 -2.969 8.931 1.00 0.00 C ATOM 1039 O GLY C 68 74.855 -2.782 9.141 1.00 0.00 O ATOM 0 H GLY C 68 70.922 -4.233 10.199 1.00 0.00 H new ATOM 0 HA2 GLY C 68 71.953 -2.173 9.971 1.00 0.00 H new ATOM 0 HA3 GLY C 68 73.169 -2.858 11.031 1.00 0.00 H new ATOM 1043 N SER C 69 73.220 -3.154 7.721 1.00 0.00 N ATOM 1044 CA SER C 69 74.159 -3.137 6.562 1.00 0.00 C ATOM 1045 C SER C 69 74.218 -1.734 5.951 1.00 0.00 C ATOM 1046 O SER C 69 75.220 -1.326 5.401 1.00 0.00 O ATOM 1047 CB SER C 69 73.573 -4.133 5.563 1.00 0.00 C ATOM 1048 OG SER C 69 72.350 -3.620 5.051 1.00 0.00 O ATOM 0 H SER C 69 72.241 -3.316 7.484 1.00 0.00 H new ATOM 0 HA SER C 69 75.177 -3.401 6.850 1.00 0.00 H new ATOM 0 HB2 SER C 69 74.277 -4.306 4.749 1.00 0.00 H new ATOM 0 HB3 SER C 69 73.403 -5.094 6.048 1.00 0.00 H new ATOM 1054 N GLY C 70 73.147 -0.994 6.044 1.00 0.00 N ATOM 1055 CA GLY C 70 73.138 0.381 5.469 1.00 0.00 C ATOM 1056 C GLY C 70 72.321 0.387 4.177 1.00 0.00 C ATOM 1057 O GLY C 70 71.919 1.424 3.688 1.00 0.00 O ATOM 0 H GLY C 70 72.278 -1.282 6.493 1.00 0.00 H new ATOM 0 HA2 GLY C 70 72.711 1.083 6.185 1.00 0.00 H new ATOM 0 HA3 GLY C 70 74.158 0.710 5.269 1.00 0.00 H new ATOM 1061 N THR C 71 72.071 -0.767 3.619 1.00 0.00 N ATOM 1062 CA THR C 71 71.280 -0.832 2.359 1.00 0.00 C ATOM 1063 C THR C 71 70.048 -1.722 2.553 1.00 0.00 C ATOM 1064 O THR C 71 70.015 -2.571 3.422 1.00 0.00 O ATOM 1065 CB THR C 71 72.229 -1.444 1.328 1.00 0.00 C ATOM 1066 OG1 THR C 71 72.971 -2.493 1.935 1.00 0.00 O ATOM 1067 CG2 THR C 71 73.190 -0.369 0.815 1.00 0.00 C ATOM 0 H THR C 71 72.381 -1.668 3.983 1.00 0.00 H new ATOM 0 HA THR C 71 70.917 0.147 2.047 1.00 0.00 H new ATOM 0 HB THR C 71 71.652 -1.841 0.493 1.00 0.00 H new ATOM 0 HG1 THR C 71 73.579 -2.888 1.275 1.00 0.00 H new ATOM 0 HG21 THR C 71 73.866 -0.806 0.080 1.00 0.00 H new ATOM 0 HG22 THR C 71 72.621 0.436 0.351 1.00 0.00 H new ATOM 0 HG23 THR C 71 73.769 0.030 1.648 1.00 0.00 H new ATOM 1075 N VAL C 72 69.035 -1.536 1.750 1.00 0.00 N ATOM 1076 CA VAL C 72 67.806 -2.371 1.887 1.00 0.00 C ATOM 1077 C VAL C 72 67.546 -3.143 0.592 1.00 0.00 C ATOM 1078 O VAL C 72 67.851 -2.680 -0.490 1.00 0.00 O ATOM 1079 CB VAL C 72 66.679 -1.374 2.158 1.00 0.00 C ATOM 1080 CG1 VAL C 72 65.327 -2.074 2.009 1.00 0.00 C ATOM 1081 CG2 VAL C 72 66.813 -0.830 3.581 1.00 0.00 C ATOM 0 H VAL C 72 69.005 -0.841 1.004 1.00 0.00 H new ATOM 0 HA VAL C 72 67.893 -3.111 2.683 1.00 0.00 H new ATOM 0 HB VAL C 72 66.743 -0.553 1.444 1.00 0.00 H new ATOM 0 HG11 VAL C 72 64.525 -1.362 2.203 1.00 0.00 H new ATOM 0 HG12 VAL C 72 65.229 -2.464 0.996 1.00 0.00 H new ATOM 0 HG13 VAL C 72 65.262 -2.896 2.722 1.00 0.00 H new ATOM 0 HG21 VAL C 72 66.010 -0.119 3.776 1.00 0.00 H new ATOM 0 HG22 VAL C 72 66.749 -1.653 4.293 1.00 0.00 H new ATOM 0 HG23 VAL C 72 67.775 -0.330 3.690 1.00 0.00 H new ATOM 1091 N ASP C 73 66.987 -4.319 0.690 1.00 0.00 N ATOM 1092 CA ASP C 73 66.713 -5.118 -0.538 1.00 0.00 C ATOM 1093 C ASP C 73 65.233 -5.498 -0.611 1.00 0.00 C ATOM 1094 O ASP C 73 64.452 -5.167 0.259 1.00 0.00 O ATOM 1095 CB ASP C 73 67.584 -6.366 -0.399 1.00 0.00 C ATOM 1096 CG ASP C 73 67.107 -7.194 0.795 1.00 0.00 C ATOM 1097 OD1 ASP C 73 66.440 -6.634 1.650 1.00 0.00 O ATOM 1098 OD2 ASP C 73 67.418 -8.373 0.836 1.00 0.00 O ATOM 0 H ASP C 73 66.709 -4.760 1.566 1.00 0.00 H new ATOM 0 HA ASP C 73 66.937 -4.563 -1.449 1.00 0.00 H new ATOM 0 HB2 ASP C 73 67.533 -6.961 -1.311 1.00 0.00 H new ATOM 0 HB3 ASP C 73 68.627 -6.081 -0.263 1.00 0.00 H new ATOM 1103 N PHE C 74 64.844 -6.193 -1.644 1.00 0.00 N ATOM 1104 CA PHE C 74 63.416 -6.599 -1.779 1.00 0.00 C ATOM 1105 C PHE C 74 62.949 -7.318 -0.512 1.00 0.00 C ATOM 1106 O PHE C 74 61.768 -7.438 -0.252 1.00 0.00 O ATOM 1107 CB PHE C 74 63.392 -7.553 -2.974 1.00 0.00 C ATOM 1108 CG PHE C 74 62.383 -7.073 -3.988 1.00 0.00 C ATOM 1109 CD1 PHE C 74 61.182 -6.494 -3.561 1.00 0.00 C ATOM 1110 CD2 PHE C 74 62.649 -7.204 -5.356 1.00 0.00 C ATOM 1111 CE1 PHE C 74 60.246 -6.050 -4.502 1.00 0.00 C ATOM 1112 CE2 PHE C 74 61.714 -6.760 -6.297 1.00 0.00 C ATOM 1113 CZ PHE C 74 60.512 -6.182 -5.871 1.00 0.00 C ATOM 0 H PHE C 74 65.454 -6.498 -2.402 1.00 0.00 H new ATOM 0 HA PHE C 74 62.754 -5.745 -1.922 1.00 0.00 H new ATOM 0 HB2 PHE C 74 64.381 -7.607 -3.429 1.00 0.00 H new ATOM 0 HB3 PHE C 74 63.138 -8.560 -2.643 1.00 0.00 H new ATOM 0 HD1 PHE C 74 60.978 -6.390 -2.506 1.00 0.00 H new ATOM 0 HD2 PHE C 74 63.577 -7.648 -5.685 1.00 0.00 H new ATOM 0 HE1 PHE C 74 59.318 -5.606 -4.173 1.00 0.00 H new ATOM 0 HE2 PHE C 74 61.919 -6.863 -7.352 1.00 0.00 H new ATOM 0 HZ PHE C 74 59.790 -5.838 -6.597 1.00 0.00 H new ATOM 1123 N ASP C 75 63.869 -7.802 0.278 1.00 0.00 N ATOM 1124 CA ASP C 75 63.478 -8.516 1.528 1.00 0.00 C ATOM 1125 C ASP C 75 63.220 -7.514 2.656 1.00 0.00 C ATOM 1126 O ASP C 75 62.100 -7.333 3.094 1.00 0.00 O ATOM 1127 CB ASP C 75 64.675 -9.406 1.862 1.00 0.00 C ATOM 1128 CG ASP C 75 64.284 -10.875 1.692 1.00 0.00 C ATOM 1129 OD1 ASP C 75 63.320 -11.133 0.990 1.00 0.00 O ATOM 1130 OD2 ASP C 75 64.954 -11.717 2.267 1.00 0.00 O ATOM 0 H ASP C 75 64.873 -7.734 0.112 1.00 0.00 H new ATOM 0 HA ASP C 75 62.561 -9.092 1.405 1.00 0.00 H new ATOM 0 HB2 ASP C 75 65.514 -9.164 1.210 1.00 0.00 H new ATOM 0 HB3 ASP C 75 65.004 -9.222 2.885 1.00 0.00 H new ATOM 1135 N GLU C 76 64.246 -6.863 3.131 1.00 0.00 N ATOM 1136 CA GLU C 76 64.059 -5.875 4.231 1.00 0.00 C ATOM 1137 C GLU C 76 63.005 -4.834 3.840 1.00 0.00 C ATOM 1138 O GLU C 76 62.436 -4.170 4.682 1.00 0.00 O ATOM 1139 CB GLU C 76 65.427 -5.215 4.406 1.00 0.00 C ATOM 1140 CG GLU C 76 66.466 -6.276 4.775 1.00 0.00 C ATOM 1141 CD GLU C 76 67.733 -5.592 5.293 1.00 0.00 C ATOM 1142 OE1 GLU C 76 68.199 -4.676 4.635 1.00 0.00 O ATOM 1143 OE2 GLU C 76 68.216 -5.997 6.337 1.00 0.00 O ATOM 0 H GLU C 76 65.206 -6.973 2.805 1.00 0.00 H new ATOM 0 HA GLU C 76 63.711 -6.344 5.151 1.00 0.00 H new ATOM 0 HB2 GLU C 76 65.719 -4.711 3.485 1.00 0.00 H new ATOM 0 HB3 GLU C 76 65.378 -4.454 5.185 1.00 0.00 H new ATOM 0 HG2 GLU C 76 66.064 -6.945 5.536 1.00 0.00 H new ATOM 0 HG3 GLU C 76 66.701 -6.889 3.904 1.00 0.00 H new ATOM 1150 N PHE C 77 62.744 -4.685 2.570 1.00 0.00 N ATOM 1151 CA PHE C 77 61.727 -3.684 2.130 1.00 0.00 C ATOM 1152 C PHE C 77 60.312 -4.204 2.401 1.00 0.00 C ATOM 1153 O PHE C 77 59.478 -3.506 2.942 1.00 0.00 O ATOM 1154 CB PHE C 77 61.958 -3.519 0.627 1.00 0.00 C ATOM 1155 CG PHE C 77 60.855 -2.672 0.037 1.00 0.00 C ATOM 1156 CD1 PHE C 77 59.679 -3.275 -0.426 1.00 0.00 C ATOM 1157 CD2 PHE C 77 61.009 -1.283 -0.046 1.00 0.00 C ATOM 1158 CE1 PHE C 77 58.657 -2.488 -0.972 1.00 0.00 C ATOM 1159 CE2 PHE C 77 59.989 -0.496 -0.593 1.00 0.00 C ATOM 1160 CZ PHE C 77 58.812 -1.099 -1.055 1.00 0.00 C ATOM 0 H PHE C 77 63.189 -5.211 1.818 1.00 0.00 H new ATOM 0 HA PHE C 77 61.823 -2.739 2.665 1.00 0.00 H new ATOM 0 HB2 PHE C 77 62.926 -3.052 0.446 1.00 0.00 H new ATOM 0 HB3 PHE C 77 61.980 -4.495 0.142 1.00 0.00 H new ATOM 0 HD1 PHE C 77 59.560 -4.347 -0.362 1.00 0.00 H new ATOM 0 HD2 PHE C 77 61.916 -0.818 0.312 1.00 0.00 H new ATOM 0 HE1 PHE C 77 57.750 -2.953 -1.329 1.00 0.00 H new ATOM 0 HE2 PHE C 77 60.109 0.575 -0.659 1.00 0.00 H new ATOM 0 HZ PHE C 77 58.024 -0.492 -1.475 1.00 0.00 H new ATOM 1170 N LEU C 78 60.035 -5.423 2.024 1.00 0.00 N ATOM 1171 CA LEU C 78 58.673 -5.985 2.254 1.00 0.00 C ATOM 1172 C LEU C 78 58.237 -5.760 3.706 1.00 0.00 C ATOM 1173 O LEU C 78 57.169 -5.246 3.971 1.00 0.00 O ATOM 1174 CB LEU C 78 58.808 -7.480 1.960 1.00 0.00 C ATOM 1175 CG LEU C 78 58.459 -7.745 0.493 1.00 0.00 C ATOM 1176 CD1 LEU C 78 58.988 -9.119 0.078 1.00 0.00 C ATOM 1177 CD2 LEU C 78 56.939 -7.711 0.319 1.00 0.00 C ATOM 0 H LEU C 78 60.693 -6.054 1.567 1.00 0.00 H new ATOM 0 HA LEU C 78 57.921 -5.509 1.624 1.00 0.00 H new ATOM 0 HB2 LEU C 78 59.825 -7.812 2.169 1.00 0.00 H new ATOM 0 HB3 LEU C 78 58.146 -8.051 2.611 1.00 0.00 H new ATOM 0 HG LEU C 78 58.917 -6.978 -0.132 1.00 0.00 H new ATOM 0 HD11 LEU C 78 58.738 -9.305 -0.967 1.00 0.00 H new ATOM 0 HD12 LEU C 78 60.071 -9.145 0.202 1.00 0.00 H new ATOM 0 HD13 LEU C 78 58.533 -9.888 0.702 1.00 0.00 H new ATOM 0 HD21 LEU C 78 56.688 -7.899 -0.725 1.00 0.00 H new ATOM 0 HD22 LEU C 78 56.484 -8.478 0.946 1.00 0.00 H new ATOM 0 HD23 LEU C 78 56.561 -6.731 0.612 1.00 0.00 H new ATOM 1189 N VAL C 79 59.053 -6.145 4.648 1.00 0.00 N ATOM 1190 CA VAL C 79 58.683 -5.957 6.080 1.00 0.00 C ATOM 1191 C VAL C 79 58.349 -4.490 6.361 1.00 0.00 C ATOM 1192 O VAL C 79 57.714 -4.166 7.344 1.00 0.00 O ATOM 1193 CB VAL C 79 59.923 -6.380 6.866 1.00 0.00 C ATOM 1194 CG1 VAL C 79 59.718 -6.069 8.348 1.00 0.00 C ATOM 1195 CG2 VAL C 79 60.152 -7.882 6.685 1.00 0.00 C ATOM 0 H VAL C 79 59.961 -6.582 4.488 1.00 0.00 H new ATOM 0 HA VAL C 79 57.803 -6.538 6.355 1.00 0.00 H new ATOM 0 HB VAL C 79 60.791 -5.833 6.498 1.00 0.00 H new ATOM 0 HG11 VAL C 79 60.603 -6.371 8.909 1.00 0.00 H new ATOM 0 HG12 VAL C 79 59.555 -4.999 8.476 1.00 0.00 H new ATOM 0 HG13 VAL C 79 58.850 -6.615 8.718 1.00 0.00 H new ATOM 0 HG21 VAL C 79 61.036 -8.185 7.245 1.00 0.00 H new ATOM 0 HG22 VAL C 79 59.284 -8.429 7.053 1.00 0.00 H new ATOM 0 HG23 VAL C 79 60.299 -8.103 5.628 1.00 0.00 H new ATOM 1205 N MET C 80 58.777 -3.600 5.508 1.00 0.00 N ATOM 1206 CA MET C 80 58.486 -2.155 5.733 1.00 0.00 C ATOM 1207 C MET C 80 57.042 -1.829 5.333 1.00 0.00 C ATOM 1208 O MET C 80 56.442 -0.905 5.845 1.00 0.00 O ATOM 1209 CB MET C 80 59.472 -1.410 4.833 1.00 0.00 C ATOM 1210 CG MET C 80 59.671 0.011 5.360 1.00 0.00 C ATOM 1211 SD MET C 80 61.169 0.722 4.632 1.00 0.00 S ATOM 1212 CE MET C 80 60.586 0.769 2.919 1.00 0.00 C ATOM 0 H MET C 80 59.314 -3.810 4.667 1.00 0.00 H new ATOM 0 HA MET C 80 58.592 -1.873 6.781 1.00 0.00 H new ATOM 0 HB2 MET C 80 60.426 -1.936 4.807 1.00 0.00 H new ATOM 0 HB3 MET C 80 59.096 -1.381 3.810 1.00 0.00 H new ATOM 0 HG2 MET C 80 58.806 0.626 5.112 1.00 0.00 H new ATOM 0 HG3 MET C 80 59.753 -0.001 6.447 1.00 0.00 H new ATOM 0 HE1 MET C 80 61.250 1.398 2.326 1.00 0.00 H new ATOM 0 HE2 MET C 80 60.581 -0.241 2.509 1.00 0.00 H new ATOM 0 HE3 MET C 80 59.576 1.178 2.889 1.00 0.00 H new ATOM 1222 N MET C 81 56.483 -2.577 4.422 1.00 0.00 N ATOM 1223 CA MET C 81 55.081 -2.304 3.990 1.00 0.00 C ATOM 1224 C MET C 81 54.086 -2.971 4.945 1.00 0.00 C ATOM 1225 O MET C 81 52.983 -2.498 5.137 1.00 0.00 O ATOM 1226 CB MET C 81 54.972 -2.915 2.593 1.00 0.00 C ATOM 1227 CG MET C 81 55.534 -1.936 1.560 1.00 0.00 C ATOM 1228 SD MET C 81 54.505 -0.447 1.515 1.00 0.00 S ATOM 1229 CE MET C 81 55.409 0.416 0.205 1.00 0.00 C ATOM 0 H MET C 81 56.935 -3.365 3.958 1.00 0.00 H new ATOM 0 HA MET C 81 54.852 -1.238 3.991 1.00 0.00 H new ATOM 0 HB2 MET C 81 55.520 -3.856 2.553 1.00 0.00 H new ATOM 0 HB3 MET C 81 53.931 -3.143 2.365 1.00 0.00 H new ATOM 0 HG2 MET C 81 56.561 -1.673 1.814 1.00 0.00 H new ATOM 0 HG3 MET C 81 55.558 -2.404 0.576 1.00 0.00 H new ATOM 0 HE1 MET C 81 54.937 1.379 0.011 1.00 0.00 H new ATOM 0 HE2 MET C 81 56.441 0.575 0.519 1.00 0.00 H new ATOM 0 HE3 MET C 81 55.394 -0.185 -0.704 1.00 0.00 H new ATOM 1239 N VAL C 82 54.464 -4.067 5.544 1.00 0.00 N ATOM 1240 CA VAL C 82 53.535 -4.763 6.482 1.00 0.00 C ATOM 1241 C VAL C 82 53.362 -3.944 7.764 1.00 0.00 C ATOM 1242 O VAL C 82 52.370 -4.060 8.457 1.00 0.00 O ATOM 1243 CB VAL C 82 54.209 -6.101 6.790 1.00 0.00 C ATOM 1244 CG1 VAL C 82 53.189 -7.055 7.414 1.00 0.00 C ATOM 1245 CG2 VAL C 82 54.749 -6.711 5.495 1.00 0.00 C ATOM 0 H VAL C 82 55.375 -4.511 5.425 1.00 0.00 H new ATOM 0 HA VAL C 82 52.542 -4.895 6.053 1.00 0.00 H new ATOM 0 HB VAL C 82 55.031 -5.940 7.487 1.00 0.00 H new ATOM 0 HG11 VAL C 82 53.669 -8.009 7.633 1.00 0.00 H new ATOM 0 HG12 VAL C 82 52.803 -6.622 8.337 1.00 0.00 H new ATOM 0 HG13 VAL C 82 52.367 -7.215 6.717 1.00 0.00 H new ATOM 0 HG21 VAL C 82 55.229 -7.665 5.715 1.00 0.00 H new ATOM 0 HG22 VAL C 82 53.927 -6.871 4.798 1.00 0.00 H new ATOM 0 HG23 VAL C 82 55.476 -6.033 5.049 1.00 0.00 H new ATOM 1255 N ARG C 83 54.321 -3.122 8.086 1.00 0.00 N ATOM 1256 CA ARG C 83 54.214 -2.298 9.327 1.00 0.00 C ATOM 1257 C ARG C 83 53.393 -1.031 9.066 1.00 0.00 C ATOM 1258 O ARG C 83 53.063 -0.299 9.978 1.00 0.00 O ATOM 1259 CB ARG C 83 55.654 -1.934 9.685 1.00 0.00 C ATOM 1260 CG ARG C 83 56.308 -3.102 10.425 1.00 0.00 C ATOM 1261 CD ARG C 83 57.748 -2.733 10.787 1.00 0.00 C ATOM 1262 NE ARG C 83 57.811 -2.835 12.271 1.00 0.00 N ATOM 1263 CZ ARG C 83 58.969 -2.901 12.872 1.00 0.00 C ATOM 1264 NH1 ARG C 83 59.715 -1.836 12.967 1.00 0.00 N ATOM 1265 NH2 ARG C 83 59.377 -4.032 13.376 1.00 0.00 N ATOM 0 H ARG C 83 55.175 -2.984 7.545 1.00 0.00 H new ATOM 0 HA ARG C 83 53.712 -2.836 10.131 1.00 0.00 H new ATOM 0 HB2 ARG C 83 56.217 -1.702 8.781 1.00 0.00 H new ATOM 0 HB3 ARG C 83 55.670 -1.040 10.309 1.00 0.00 H new ATOM 0 HG2 ARG C 83 55.743 -3.337 11.327 1.00 0.00 H new ATOM 0 HG3 ARG C 83 56.296 -3.995 9.800 1.00 0.00 H new ATOM 0 HD2 ARG C 83 58.460 -3.410 10.314 1.00 0.00 H new ATOM 0 HD3 ARG C 83 57.994 -1.726 10.450 1.00 0.00 H new ATOM 0 HE ARG C 83 56.950 -2.853 12.818 1.00 0.00 H new ATOM 0 HH11 ARG C 83 59.394 -0.952 12.572 1.00 0.00 H new ATOM 0 HH12 ARG C 83 60.619 -1.887 13.436 1.00 0.00 H new ATOM 0 HH21 ARG C 83 58.792 -4.864 13.301 1.00 0.00 H new ATOM 0 HH22 ARG C 83 60.281 -4.085 13.845 1.00 0.00 H new ATOM 1279 N CYS C 84 53.065 -0.761 7.833 1.00 0.00 N ATOM 1280 CA CYS C 84 52.272 0.466 7.530 1.00 0.00 C ATOM 1281 C CYS C 84 50.914 0.093 6.928 1.00 0.00 C ATOM 1282 O CYS C 84 50.163 0.945 6.496 1.00 0.00 O ATOM 1283 CB CYS C 84 53.113 1.242 6.516 1.00 0.00 C ATOM 1284 SG CYS C 84 52.566 2.966 6.473 1.00 0.00 S ATOM 0 H CYS C 84 53.310 -1.333 7.025 1.00 0.00 H new ATOM 0 HA CYS C 84 52.067 1.052 8.426 1.00 0.00 H new ATOM 0 HB2 CYS C 84 54.168 1.190 6.787 1.00 0.00 H new ATOM 0 HB3 CYS C 84 53.015 0.793 5.527 1.00 0.00 H new ATOM 0 HG CYS C 84 51.267 3.008 6.437 1.00 0.00 H new ATOM 1290 N MET C 85 50.590 -1.170 6.897 1.00 0.00 N ATOM 1291 CA MET C 85 49.279 -1.587 6.323 1.00 0.00 C ATOM 1292 C MET C 85 48.570 -2.558 7.273 1.00 0.00 C ATOM 1293 O MET C 85 47.862 -2.150 8.173 1.00 0.00 O ATOM 1294 CB MET C 85 49.627 -2.276 5.003 1.00 0.00 C ATOM 1295 CG MET C 85 50.243 -1.256 4.042 1.00 0.00 C ATOM 1296 SD MET C 85 49.515 -1.460 2.398 1.00 0.00 S ATOM 1297 CE MET C 85 49.969 -3.195 2.161 1.00 0.00 C ATOM 0 H MET C 85 51.175 -1.930 7.244 1.00 0.00 H new ATOM 0 HA MET C 85 48.604 -0.744 6.174 1.00 0.00 H new ATOM 0 HB2 MET C 85 50.326 -3.093 5.180 1.00 0.00 H new ATOM 0 HB3 MET C 85 48.731 -2.713 4.561 1.00 0.00 H new ATOM 0 HG2 MET C 85 50.066 -0.244 4.407 1.00 0.00 H new ATOM 0 HG3 MET C 85 51.323 -1.393 3.993 1.00 0.00 H new ATOM 0 HE1 MET C 85 50.167 -3.378 1.105 1.00 0.00 H new ATOM 0 HE2 MET C 85 50.864 -3.420 2.742 1.00 0.00 H new ATOM 0 HE3 MET C 85 49.151 -3.834 2.493 1.00 0.00 H new ATOM 1307 N LYS C 86 48.752 -3.837 7.084 1.00 0.00 N ATOM 1308 CA LYS C 86 48.086 -4.823 7.983 1.00 0.00 C ATOM 1309 C LYS C 86 46.632 -4.413 8.236 1.00 0.00 C ATOM 1310 O LYS C 86 46.204 -4.274 9.365 1.00 0.00 O ATOM 1311 CB LYS C 86 48.890 -4.777 9.283 1.00 0.00 C ATOM 1312 CG LYS C 86 49.028 -6.191 9.849 1.00 0.00 C ATOM 1313 CD LYS C 86 47.660 -6.689 10.321 1.00 0.00 C ATOM 1314 CE LYS C 86 47.715 -8.203 10.540 1.00 0.00 C ATOM 1315 NZ LYS C 86 48.292 -8.753 9.282 1.00 0.00 N ATOM 0 H LYS C 86 49.331 -4.241 6.348 1.00 0.00 H new ATOM 0 HA LYS C 86 48.062 -5.824 7.552 1.00 0.00 H new ATOM 0 HB2 LYS C 86 49.876 -4.350 9.098 1.00 0.00 H new ATOM 0 HB3 LYS C 86 48.394 -4.131 10.007 1.00 0.00 H new ATOM 0 HG2 LYS C 86 49.428 -6.861 9.088 1.00 0.00 H new ATOM 0 HG3 LYS C 86 49.734 -6.194 10.679 1.00 0.00 H new ATOM 0 HD2 LYS C 86 47.378 -6.187 11.247 1.00 0.00 H new ATOM 0 HD3 LYS C 86 46.897 -6.445 9.581 1.00 0.00 H new ATOM 0 HE2 LYS C 86 48.334 -8.455 11.401 1.00 0.00 H new ATOM 0 HE3 LYS C 86 46.722 -8.611 10.730 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 47.959 -9.729 9.145 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 47.990 -8.168 8.477 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 49.330 -8.747 9.345 1.00 0.00 H new ATOM 1329 N ASP C 87 45.871 -4.217 7.194 1.00 0.00 N ATOM 1330 CA ASP C 87 44.446 -3.815 7.377 1.00 0.00 C ATOM 1331 C ASP C 87 43.518 -4.851 6.733 1.00 0.00 C ATOM 1332 O ASP C 87 43.545 -5.063 5.537 1.00 0.00 O ATOM 1333 CB ASP C 87 44.322 -2.467 6.668 1.00 0.00 C ATOM 1334 CG ASP C 87 44.780 -2.609 5.216 1.00 0.00 C ATOM 1335 OD1 ASP C 87 45.970 -2.788 5.005 1.00 0.00 O ATOM 1336 OD2 ASP C 87 43.937 -2.537 4.339 1.00 0.00 O ATOM 0 H ASP C 87 46.173 -4.317 6.225 1.00 0.00 H new ATOM 0 HA ASP C 87 44.166 -3.749 8.428 1.00 0.00 H new ATOM 0 HB2 ASP C 87 43.289 -2.120 6.702 1.00 0.00 H new ATOM 0 HB3 ASP C 87 44.927 -1.718 7.179 1.00 0.00 H new ATOM 1341 N ASP C 88 42.700 -5.499 7.517 1.00 0.00 N ATOM 1342 CA ASP C 88 41.774 -6.523 6.948 1.00 0.00 C ATOM 1343 C ASP C 88 40.376 -5.930 6.745 1.00 0.00 C ATOM 1344 O ASP C 88 39.421 -6.642 6.504 1.00 0.00 O ATOM 1345 CB ASP C 88 41.732 -7.642 7.988 1.00 0.00 C ATOM 1346 CG ASP C 88 42.146 -8.961 7.335 1.00 0.00 C ATOM 1347 OD1 ASP C 88 41.369 -9.482 6.552 1.00 0.00 O ATOM 1348 OD2 ASP C 88 43.235 -9.428 7.628 1.00 0.00 O ATOM 0 H ASP C 88 42.632 -5.365 8.526 1.00 0.00 H new ATOM 0 HA ASP C 88 42.109 -6.880 5.974 1.00 0.00 H new ATOM 0 HB2 ASP C 88 42.401 -7.408 8.816 1.00 0.00 H new ATOM 0 HB3 ASP C 88 40.728 -7.729 8.404 1.00 0.00 H new ATOM 1353 N SER C 89 40.247 -4.635 6.838 1.00 0.00 N ATOM 1354 CA SER C 89 38.908 -4.007 6.649 1.00 0.00 C ATOM 1355 C SER C 89 38.363 -4.332 5.255 1.00 0.00 C ATOM 1356 O SER C 89 37.306 -4.937 5.180 1.00 0.00 O ATOM 1357 CB SER C 89 39.149 -2.504 6.793 1.00 0.00 C ATOM 1358 OG SER C 89 37.944 -1.807 6.510 1.00 0.00 O ATOM 1359 OXT SER C 89 39.014 -3.972 4.288 1.00 0.00 O ATOM 0 H SER C 89 41.008 -3.986 7.036 1.00 0.00 H new ATOM 0 HA SER C 89 38.176 -4.373 7.370 1.00 0.00 H new ATOM 0 HB2 SER C 89 39.488 -2.273 7.803 1.00 0.00 H new ATOM 0 HB3 SER C 89 39.937 -2.183 6.112 1.00 0.00 H new ATOM 0 HG SER C 89 38.094 -0.843 6.603 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 1 58.356 9.661 7.259 1.00 0.00 N ATOM 1367 CA ARG I 1 57.921 8.252 7.035 1.00 0.00 C ATOM 1368 C ARG I 1 57.274 8.112 5.656 1.00 0.00 C ATOM 1369 O ARG I 1 56.558 8.983 5.205 1.00 0.00 O ATOM 1370 CB ARG I 1 56.899 7.972 8.137 1.00 0.00 C ATOM 1371 CG ARG I 1 57.630 7.705 9.455 1.00 0.00 C ATOM 1372 CD ARG I 1 56.865 8.367 10.604 1.00 0.00 C ATOM 1373 NE ARG I 1 55.484 7.815 10.514 1.00 0.00 N ATOM 1374 CZ ARG I 1 55.070 6.947 11.397 1.00 0.00 C ATOM 1375 NH1 ARG I 1 55.524 5.723 11.370 1.00 0.00 N ATOM 1376 NH2 ARG I 1 54.201 7.301 12.303 1.00 0.00 N ATOM 0 H1 ARG I 1 59.395 9.707 7.265 1.00 0.00 H new ATOM 0 H2 ARG I 1 57.988 10.264 6.496 1.00 0.00 H new ATOM 0 H3 ARG I 1 57.989 9.997 8.172 1.00 0.00 H new ATOM 0 HA ARG I 1 58.756 7.552 7.067 1.00 0.00 H new ATOM 0 HB2 ARG I 1 56.226 8.822 8.248 1.00 0.00 H new ATOM 0 HB3 ARG I 1 56.285 7.112 7.869 1.00 0.00 H new ATOM 0 HG2 ARG I 1 57.711 6.632 9.628 1.00 0.00 H new ATOM 0 HG3 ARG I 1 58.646 8.097 9.406 1.00 0.00 H new ATOM 0 HD2 ARG I 1 57.321 8.136 11.567 1.00 0.00 H new ATOM 0 HD3 ARG I 1 56.864 9.452 10.504 1.00 0.00 H new ATOM 0 HE ARG I 1 54.862 8.115 9.763 1.00 0.00 H new ATOM 0 HH11 ARG I 1 56.201 5.446 10.660 1.00 0.00 H new ATOM 0 HH12 ARG I 1 55.201 5.044 12.059 1.00 0.00 H new ATOM 0 HH21 ARG I 1 53.844 8.256 12.322 1.00 0.00 H new ATOM 0 HH22 ARG I 1 53.878 6.622 12.993 1.00 0.00 H new ATOM 1392 N ILE I 2 57.518 7.021 4.983 1.00 0.00 N ATOM 1393 CA ILE I 2 56.913 6.827 3.634 1.00 0.00 C ATOM 1394 C ILE I 2 55.393 6.697 3.753 1.00 0.00 C ATOM 1395 O ILE I 2 54.886 5.945 4.560 1.00 0.00 O ATOM 1396 CB ILE I 2 57.524 5.530 3.107 1.00 0.00 C ATOM 1397 CG1 ILE I 2 59.051 5.621 3.173 1.00 0.00 C ATOM 1398 CG2 ILE I 2 57.092 5.314 1.655 1.00 0.00 C ATOM 1399 CD1 ILE I 2 59.666 4.435 2.431 1.00 0.00 C ATOM 0 H ILE I 2 58.109 6.256 5.308 1.00 0.00 H new ATOM 0 HA ILE I 2 57.109 7.667 2.968 1.00 0.00 H new ATOM 0 HB ILE I 2 57.181 4.695 3.717 1.00 0.00 H new ATOM 0 HG12 ILE I 2 59.389 6.557 2.728 1.00 0.00 H new ATOM 0 HG13 ILE I 2 59.381 5.624 4.212 1.00 0.00 H new ATOM 0 HG21 ILE I 2 57.528 4.388 1.279 1.00 0.00 H new ATOM 0 HG22 ILE I 2 56.005 5.249 1.605 1.00 0.00 H new ATOM 0 HG23 ILE I 2 57.435 6.150 1.045 1.00 0.00 H new ATOM 0 HD11 ILE I 2 60.753 4.500 2.478 1.00 0.00 H new ATOM 0 HD12 ILE I 2 59.338 3.505 2.896 1.00 0.00 H new ATOM 0 HD13 ILE I 2 59.346 4.452 1.389 1.00 0.00 H new ATOM 1411 N SER I 3 54.663 7.427 2.956 1.00 0.00 N ATOM 1412 CA SER I 3 53.174 7.348 3.025 1.00 0.00 C ATOM 1413 C SER I 3 52.681 6.041 2.399 1.00 0.00 C ATOM 1414 O SER I 3 53.455 5.252 1.893 1.00 0.00 O ATOM 1415 CB SER I 3 52.679 8.550 2.220 1.00 0.00 C ATOM 1416 OG SER I 3 51.968 9.438 3.078 1.00 0.00 O ATOM 0 H SER I 3 55.031 8.075 2.260 1.00 0.00 H new ATOM 0 HA SER I 3 52.806 7.363 4.051 1.00 0.00 H new ATOM 0 HB2 SER I 3 53.523 9.067 1.763 1.00 0.00 H new ATOM 0 HB3 SER I 3 52.032 8.216 1.409 1.00 0.00 H new ATOM 0 HG SER I 3 51.653 10.209 2.562 1.00 0.00 H new ATOM 1422 N ALA I 4 51.398 5.805 2.429 1.00 0.00 N ATOM 1423 CA ALA I 4 50.856 4.548 1.836 1.00 0.00 C ATOM 1424 C ALA I 4 50.006 4.869 0.603 1.00 0.00 C ATOM 1425 O ALA I 4 50.203 4.313 -0.459 1.00 0.00 O ATOM 1426 CB ALA I 4 49.993 3.929 2.936 1.00 0.00 C ATOM 0 H ALA I 4 50.701 6.428 2.838 1.00 0.00 H new ATOM 0 HA ALA I 4 51.646 3.872 1.510 1.00 0.00 H new ATOM 0 HB1 ALA I 4 49.557 2.997 2.576 1.00 0.00 H new ATOM 0 HB2 ALA I 4 50.610 3.726 3.812 1.00 0.00 H new ATOM 0 HB3 ALA I 4 49.196 4.622 3.206 1.00 0.00 H new ATOM 1432 N ASP I 5 49.062 5.760 0.737 1.00 0.00 N ATOM 1433 CA ASP I 5 48.200 6.114 -0.429 1.00 0.00 C ATOM 1434 C ASP I 5 48.875 7.196 -1.277 1.00 0.00 C ATOM 1435 O ASP I 5 48.793 7.188 -2.489 1.00 0.00 O ATOM 1436 CB ASP I 5 46.900 6.640 0.180 1.00 0.00 C ATOM 1437 CG ASP I 5 45.708 6.061 -0.584 1.00 0.00 C ATOM 1438 OD1 ASP I 5 45.824 5.896 -1.787 1.00 0.00 O ATOM 1439 OD2 ASP I 5 44.699 5.793 0.047 1.00 0.00 O ATOM 0 H ASP I 5 48.850 6.258 1.601 1.00 0.00 H new ATOM 0 HA ASP I 5 48.024 5.261 -1.085 1.00 0.00 H new ATOM 0 HB2 ASP I 5 46.841 6.362 1.232 1.00 0.00 H new ATOM 0 HB3 ASP I 5 46.880 7.729 0.136 1.00 0.00 H new ATOM 1444 N ALA I 6 49.540 8.130 -0.651 1.00 0.00 N ATOM 1445 CA ALA I 6 50.216 9.210 -1.428 1.00 0.00 C ATOM 1446 C ALA I 6 51.311 8.613 -2.317 1.00 0.00 C ATOM 1447 O ALA I 6 51.598 9.113 -3.386 1.00 0.00 O ATOM 1448 CB ALA I 6 50.827 10.136 -0.374 1.00 0.00 C ATOM 0 H ALA I 6 49.644 8.192 0.362 1.00 0.00 H new ATOM 0 HA ALA I 6 49.526 9.740 -2.084 1.00 0.00 H new ATOM 0 HB1 ALA I 6 51.344 10.959 -0.868 1.00 0.00 H new ATOM 0 HB2 ALA I 6 50.037 10.534 0.263 1.00 0.00 H new ATOM 0 HB3 ALA I 6 51.536 9.576 0.235 1.00 0.00 H new ATOM 1454 N MET I 7 51.922 7.546 -1.881 1.00 0.00 N ATOM 1455 CA MET I 7 52.998 6.914 -2.699 1.00 0.00 C ATOM 1456 C MET I 7 52.481 6.605 -4.107 1.00 0.00 C ATOM 1457 O MET I 7 53.219 6.642 -5.072 1.00 0.00 O ATOM 1458 CB MET I 7 53.343 5.621 -1.960 1.00 0.00 C ATOM 1459 CG MET I 7 54.784 5.688 -1.455 1.00 0.00 C ATOM 1460 SD MET I 7 55.687 4.226 -2.019 1.00 0.00 S ATOM 1461 CE MET I 7 56.287 4.917 -3.581 1.00 0.00 C ATOM 0 H MET I 7 51.723 7.084 -0.994 1.00 0.00 H new ATOM 0 HA MET I 7 53.865 7.564 -2.816 1.00 0.00 H new ATOM 0 HB2 MET I 7 52.660 5.475 -1.123 1.00 0.00 H new ATOM 0 HB3 MET I 7 53.219 4.766 -2.625 1.00 0.00 H new ATOM 0 HG2 MET I 7 55.268 6.592 -1.823 1.00 0.00 H new ATOM 0 HG3 MET I 7 54.797 5.740 -0.366 1.00 0.00 H new ATOM 0 HE1 MET I 7 56.881 4.169 -4.105 1.00 0.00 H new ATOM 0 HE2 MET I 7 55.438 5.206 -4.201 1.00 0.00 H new ATOM 0 HE3 MET I 7 56.903 5.793 -3.378 1.00 0.00 H new ATOM 1471 N MET I 8 51.220 6.296 -4.231 1.00 0.00 N ATOM 1472 CA MET I 8 50.656 5.980 -5.576 1.00 0.00 C ATOM 1473 C MET I 8 50.257 7.267 -6.307 1.00 0.00 C ATOM 1474 O MET I 8 50.373 7.367 -7.511 1.00 0.00 O ATOM 1475 CB MET I 8 49.424 5.122 -5.294 1.00 0.00 C ATOM 1476 CG MET I 8 49.802 3.642 -5.367 1.00 0.00 C ATOM 1477 SD MET I 8 50.678 3.166 -3.856 1.00 0.00 S ATOM 1478 CE MET I 8 52.361 3.346 -4.501 1.00 0.00 C ATOM 0 H MET I 8 50.554 6.248 -3.460 1.00 0.00 H new ATOM 0 HA MET I 8 51.377 5.468 -6.213 1.00 0.00 H new ATOM 0 HB2 MET I 8 49.023 5.357 -4.308 1.00 0.00 H new ATOM 0 HB3 MET I 8 48.640 5.344 -6.018 1.00 0.00 H new ATOM 0 HG2 MET I 8 48.906 3.033 -5.488 1.00 0.00 H new ATOM 0 HG3 MET I 8 50.432 3.459 -6.238 1.00 0.00 H new ATOM 0 HE1 MET I 8 53.073 3.307 -3.676 1.00 0.00 H new ATOM 0 HE2 MET I 8 52.571 2.537 -5.200 1.00 0.00 H new ATOM 0 HE3 MET I 8 52.453 4.303 -5.015 1.00 0.00 H new ATOM 1488 N GLN I 9 49.786 8.249 -5.589 1.00 0.00 N ATOM 1489 CA GLN I 9 49.379 9.524 -6.248 1.00 0.00 C ATOM 1490 C GLN I 9 50.569 10.149 -6.985 1.00 0.00 C ATOM 1491 O GLN I 9 50.479 10.497 -8.145 1.00 0.00 O ATOM 1492 CB GLN I 9 48.920 10.433 -5.106 1.00 0.00 C ATOM 1493 CG GLN I 9 47.452 10.813 -5.312 1.00 0.00 C ATOM 1494 CD GLN I 9 46.557 9.825 -4.560 1.00 0.00 C ATOM 1495 OE1 GLN I 9 45.730 9.163 -5.154 1.00 0.00 O ATOM 1496 NE2 GLN I 9 46.687 9.699 -3.268 1.00 0.00 N ATOM 0 H GLN I 9 49.665 8.225 -4.576 1.00 0.00 H new ATOM 0 HA GLN I 9 48.594 9.370 -6.989 1.00 0.00 H new ATOM 0 HB2 GLN I 9 49.044 9.924 -4.150 1.00 0.00 H new ATOM 0 HB3 GLN I 9 49.537 11.331 -5.071 1.00 0.00 H new ATOM 0 HG2 GLN I 9 47.274 11.827 -4.953 1.00 0.00 H new ATOM 0 HG3 GLN I 9 47.209 10.804 -6.375 1.00 0.00 H new ATOM 0 HE21 GLN I 9 47.381 10.255 -2.769 1.00 0.00 H new ATOM 0 HE22 GLN I 9 46.094 9.045 -2.757 1.00 0.00 H new ATOM 1505 N ALA I 10 51.682 10.296 -6.319 1.00 0.00 N ATOM 1506 CA ALA I 10 52.874 10.900 -6.982 1.00 0.00 C ATOM 1507 C ALA I 10 53.488 9.915 -7.981 1.00 0.00 C ATOM 1508 O ALA I 10 53.654 10.221 -9.146 1.00 0.00 O ATOM 1509 CB ALA I 10 53.851 11.189 -5.844 1.00 0.00 C ATOM 0 H ALA I 10 51.818 10.024 -5.345 1.00 0.00 H new ATOM 0 HA ALA I 10 52.621 11.799 -7.544 1.00 0.00 H new ATOM 0 HB1 ALA I 10 54.759 11.637 -6.249 1.00 0.00 H new ATOM 0 HB2 ALA I 10 53.391 11.878 -5.136 1.00 0.00 H new ATOM 0 HB3 ALA I 10 54.101 10.259 -5.334 1.00 0.00 H new ATOM 1515 N LEU I 11 53.819 8.733 -7.539 1.00 0.00 N ATOM 1516 CA LEU I 11 54.414 7.729 -8.471 1.00 0.00 C ATOM 1517 C LEU I 11 53.706 6.381 -8.317 1.00 0.00 C ATOM 1518 O LEU I 11 52.748 6.254 -7.581 1.00 0.00 O ATOM 1519 CB LEU I 11 55.897 7.617 -8.083 1.00 0.00 C ATOM 1520 CG LEU I 11 56.054 7.571 -6.559 1.00 0.00 C ATOM 1521 CD1 LEU I 11 56.897 6.356 -6.164 1.00 0.00 C ATOM 1522 CD2 LEU I 11 56.760 8.844 -6.088 1.00 0.00 C ATOM 0 H LEU I 11 53.704 8.418 -6.576 1.00 0.00 H new ATOM 0 HA LEU I 11 54.303 8.029 -9.513 1.00 0.00 H new ATOM 0 HB2 LEU I 11 56.327 6.719 -8.526 1.00 0.00 H new ATOM 0 HB3 LEU I 11 56.449 8.466 -8.485 1.00 0.00 H new ATOM 0 HG LEU I 11 55.070 7.497 -6.096 1.00 0.00 H new ATOM 0 HD11 LEU I 11 57.007 6.326 -5.080 1.00 0.00 H new ATOM 0 HD12 LEU I 11 56.404 5.445 -6.504 1.00 0.00 H new ATOM 0 HD13 LEU I 11 57.881 6.430 -6.626 1.00 0.00 H new ATOM 0 HD21 LEU I 11 56.874 8.817 -5.004 1.00 0.00 H new ATOM 0 HD22 LEU I 11 57.743 8.909 -6.555 1.00 0.00 H new ATOM 0 HD23 LEU I 11 56.167 9.714 -6.368 1.00 0.00 H new ATOM 1534 N LEU I 12 54.166 5.376 -9.012 1.00 0.00 N ATOM 1535 CA LEU I 12 53.518 4.035 -8.912 1.00 0.00 C ATOM 1536 C LEU I 12 52.036 4.136 -9.287 1.00 0.00 C ATOM 1537 O LEU I 12 51.543 5.193 -9.628 1.00 0.00 O ATOM 1538 CB LEU I 12 53.675 3.623 -7.445 1.00 0.00 C ATOM 1539 CG LEU I 12 55.075 3.048 -7.211 1.00 0.00 C ATOM 1540 CD1 LEU I 12 56.121 3.931 -7.898 1.00 0.00 C ATOM 1541 CD2 LEU I 12 55.356 3.007 -5.707 1.00 0.00 C ATOM 0 H LEU I 12 54.964 5.425 -9.646 1.00 0.00 H new ATOM 0 HA LEU I 12 53.968 3.308 -9.588 1.00 0.00 H new ATOM 0 HB2 LEU I 12 53.514 4.485 -6.797 1.00 0.00 H new ATOM 0 HB3 LEU I 12 52.920 2.882 -7.184 1.00 0.00 H new ATOM 0 HG LEU I 12 55.127 2.041 -7.626 1.00 0.00 H new ATOM 0 HD11 LEU I 12 57.115 3.517 -7.728 1.00 0.00 H new ATOM 0 HD12 LEU I 12 55.921 3.966 -8.969 1.00 0.00 H new ATOM 0 HD13 LEU I 12 56.073 4.939 -7.487 1.00 0.00 H new ATOM 0 HD21 LEU I 12 56.352 2.598 -5.534 1.00 0.00 H new ATOM 0 HD22 LEU I 12 55.302 4.016 -5.299 1.00 0.00 H new ATOM 0 HD23 LEU I 12 54.615 2.377 -5.215 1.00 0.00 H new ATOM 1553 N GLY I 13 51.322 3.044 -9.229 1.00 0.00 N ATOM 1554 CA GLY I 13 49.874 3.080 -9.583 1.00 0.00 C ATOM 1555 C GLY I 13 49.578 2.010 -10.635 1.00 0.00 C ATOM 1556 O GLY I 13 50.450 1.587 -11.367 1.00 0.00 O ATOM 0 H GLY I 13 51.679 2.129 -8.952 1.00 0.00 H new ATOM 0 HA2 GLY I 13 49.267 2.908 -8.694 1.00 0.00 H new ATOM 0 HA3 GLY I 13 49.607 4.065 -9.966 1.00 0.00 H new ATOM 1560 N ALA I 14 48.352 1.568 -10.717 1.00 0.00 N ATOM 1561 CA ALA I 14 47.998 0.525 -11.722 1.00 0.00 C ATOM 1562 C ALA I 14 47.813 1.160 -13.103 1.00 0.00 C ATOM 1563 O ALA I 14 47.217 2.210 -13.239 1.00 0.00 O ATOM 1564 CB ALA I 14 46.679 -0.070 -11.227 1.00 0.00 C ATOM 0 H ALA I 14 47.580 1.885 -10.131 1.00 0.00 H new ATOM 0 HA ALA I 14 48.776 -0.232 -11.822 1.00 0.00 H new ATOM 0 HB1 ALA I 14 46.350 -0.849 -11.915 1.00 0.00 H new ATOM 0 HB2 ALA I 14 46.823 -0.499 -10.236 1.00 0.00 H new ATOM 0 HB3 ALA I 14 45.923 0.713 -11.177 1.00 0.00 H new ATOM 1570 N ARG I 15 48.318 0.533 -14.130 1.00 0.00 N ATOM 1571 CA ARG I 15 48.166 1.104 -15.499 1.00 0.00 C ATOM 1572 C ARG I 15 48.487 0.043 -16.556 1.00 0.00 C ATOM 1573 O ARG I 15 47.631 -0.373 -17.310 1.00 0.00 O ATOM 1574 CB ARG I 15 49.173 2.255 -15.565 1.00 0.00 C ATOM 1575 CG ARG I 15 48.422 3.589 -15.580 1.00 0.00 C ATOM 1576 CD ARG I 15 49.419 4.738 -15.411 1.00 0.00 C ATOM 1577 NE ARG I 15 48.856 5.576 -14.316 1.00 0.00 N ATOM 1578 CZ ARG I 15 49.638 6.363 -13.630 1.00 0.00 C ATOM 1579 NH1 ARG I 15 50.782 5.919 -13.184 1.00 0.00 N ATOM 1580 NH2 ARG I 15 49.277 7.594 -13.392 1.00 0.00 N ATOM 0 H ARG I 15 48.829 -0.349 -14.081 1.00 0.00 H new ATOM 0 HA ARG I 15 47.149 1.444 -15.693 1.00 0.00 H new ATOM 0 HB2 ARG I 15 49.846 2.214 -14.708 1.00 0.00 H new ATOM 0 HB3 ARG I 15 49.790 2.162 -16.459 1.00 0.00 H new ATOM 0 HG2 ARG I 15 47.877 3.701 -16.517 1.00 0.00 H new ATOM 0 HG3 ARG I 15 47.684 3.612 -14.778 1.00 0.00 H new ATOM 0 HD2 ARG I 15 50.411 4.366 -15.154 1.00 0.00 H new ATOM 0 HD3 ARG I 15 49.523 5.310 -16.333 1.00 0.00 H new ATOM 0 HE ARG I 15 47.859 5.535 -14.103 1.00 0.00 H new ATOM 0 HH11 ARG I 15 51.064 4.957 -13.372 1.00 0.00 H new ATOM 0 HH12 ARG I 15 51.394 6.534 -12.648 1.00 0.00 H new ATOM 0 HH21 ARG I 15 48.384 7.940 -13.742 1.00 0.00 H new ATOM 0 HH22 ARG I 15 49.888 8.210 -12.856 1.00 0.00 H new ATOM 1594 N ALA I 16 49.714 -0.398 -16.618 1.00 0.00 N ATOM 1595 CA ALA I 16 50.083 -1.432 -17.630 1.00 0.00 C ATOM 1596 C ALA I 16 50.694 -2.657 -16.945 1.00 0.00 C ATOM 1597 O ALA I 16 50.693 -3.746 -17.484 1.00 0.00 O ATOM 1598 CB ALA I 16 51.116 -0.756 -18.531 1.00 0.00 C ATOM 0 H ALA I 16 50.476 -0.089 -16.014 1.00 0.00 H new ATOM 0 HA ALA I 16 49.216 -1.782 -18.191 1.00 0.00 H new ATOM 0 HB1 ALA I 16 51.438 -1.455 -19.303 1.00 0.00 H new ATOM 0 HB2 ALA I 16 50.672 0.123 -18.999 1.00 0.00 H new ATOM 0 HB3 ALA I 16 51.977 -0.453 -17.934 1.00 0.00 H new ATOM 1604 N LYS I 17 51.216 -2.490 -15.761 1.00 0.00 N ATOM 1605 CA LYS I 17 51.829 -3.647 -15.049 1.00 0.00 C ATOM 1606 C LYS I 17 51.382 -3.663 -13.584 1.00 0.00 C ATOM 1607 O LYS I 17 51.926 -4.452 -12.828 1.00 0.00 O ATOM 1608 CB LYS I 17 53.336 -3.419 -15.147 1.00 0.00 C ATOM 1609 CG LYS I 17 54.072 -4.541 -14.414 1.00 0.00 C ATOM 1610 CD LYS I 17 55.545 -4.540 -14.828 1.00 0.00 C ATOM 1611 CE LYS I 17 56.385 -3.900 -13.721 1.00 0.00 C ATOM 1612 NZ LYS I 17 57.795 -4.205 -14.086 1.00 0.00 N ATOM 1613 OXT LYS I 17 50.503 -2.888 -13.244 1.00 0.00 O ATOM 0 H LYS I 17 51.245 -1.604 -15.256 1.00 0.00 H new ATOM 0 HA LYS I 17 51.533 -4.603 -15.482 1.00 0.00 H new ATOM 0 HB2 LYS I 17 53.643 -3.391 -16.193 1.00 0.00 H new ATOM 0 HB3 LYS I 17 53.597 -2.454 -14.712 1.00 0.00 H new ATOM 0 HG2 LYS I 17 53.986 -4.403 -13.336 1.00 0.00 H new ATOM 0 HG3 LYS I 17 53.618 -5.503 -14.650 1.00 0.00 H new ATOM 0 HD2 LYS I 17 55.883 -5.560 -15.012 1.00 0.00 H new ATOM 0 HD3 LYS I 17 55.672 -3.989 -15.760 1.00 0.00 H new ATOM 0 HE2 LYS I 17 56.215 -2.825 -13.667 1.00 0.00 H new ATOM 0 HE3 LYS I 17 56.132 -4.312 -12.744 1.00 0.00 H new ATOM 0 HZ1 LYS I 17 58.434 -3.798 -13.373 1.00 0.00 H new ATOM 0 HZ2 LYS I 17 57.929 -5.236 -14.123 1.00 0.00 H new ATOM 0 HZ3 LYS I 17 58.009 -3.794 -15.017 1.00 0.00 H new TER 1627 LYS I 17 HETATM 1628 CA CA C 90 70.188 -4.761 5.081 1.00 0.00 CA