USER MOD reduce.3.24.130724 H: found=0, std=0, add=1019, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1015 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 Single : A 1 MET CE :methyl 176:sc= -0.388 (180deg=-0.403) USER MOD Single : A 1 MET N :NH3+ -103:sc= -0.0354 (180deg=-0.757) USER MOD Single : A 2 LYS NZ :NH3+ -121:sc= 0 (180deg=-0.0273) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= -0.0646 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 GLN : amide:sc= -4.84! C(o=-4.8!,f=-3.9!) USER MOD Single : A 17 THR OG1 : rot 60:sc= -1.43! USER MOD Single : A 26 SER OG : rot 90:sc= -0.153 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 HIS : no HD1:sc= -0.741 K(o=-0.74,f=0) USER MOD Single : A 38 HIS : no HE2:sc= -5.62! K(o=-5.6!,f=-4.5) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= -0.122 USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.0224 USER MOD Single : A 52 HIS : no HD1:sc= -7.73! C(o=-7.7!,f=-7.2!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -0.728 K(o=-0.73,f=-0.0051) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= 0.367 X(o=0.37,f=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 MET CE :methyl 169:sc= 0 (180deg=-0.109) USER MOD Single : A 100 THR OG1 : rot 170:sc= -0.566 USER MOD Single : A 102 GLN : amide:sc= -2.73! C(o=-2.7!,f=-1.4!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 HIS : no HE2:sc= -5.94! C(o=-5.9!,f=-11!) USER MOD Single : A 129 ASN : amide:sc= -1.96 K(o=-2,f=-0.62) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= -1.3 K(o=-1.3,f=-0.77) USER MOD Single : A 143 THR OG1 : rot 180:sc= 0.0454 USER MOD Single : A 149 HIS : no HD1:sc= -1.59! K(o=-1.6!,f=-0.67) USER MOD Single : A 151 HIS : no HD1:sc= -8.76! C(o=-8.8!,f=-5.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.070 -19.636 26.500 1.00 0.00 N ATOM 2 CA MET A 1 4.088 -18.650 26.966 1.00 0.00 C ATOM 3 C MET A 1 3.534 -17.227 26.856 1.00 0.00 C ATOM 4 O MET A 1 2.667 -16.948 26.052 1.00 0.00 O ATOM 5 CB MET A 1 5.279 -18.837 26.025 1.00 0.00 C ATOM 6 CG MET A 1 4.947 -18.242 24.655 1.00 0.00 C ATOM 7 SD MET A 1 6.147 -18.834 23.435 1.00 0.00 S ATOM 8 CE MET A 1 6.973 -17.252 23.141 1.00 0.00 C ATOM 0 H1 MET A 1 2.630 -20.095 27.323 1.00 0.00 H new ATOM 0 H2 MET A 1 2.340 -19.145 25.945 1.00 0.00 H new ATOM 0 H3 MET A 1 3.530 -20.356 25.907 1.00 0.00 H new ATOM 0 HA MET A 1 4.365 -18.803 28.009 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.163 -18.352 26.439 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.514 -19.897 25.926 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.938 -18.528 24.357 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.969 -17.153 24.704 1.00 0.00 H new ATOM 0 HE1 MET A 1 7.811 -17.400 22.460 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.266 -16.549 22.700 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.340 -16.852 24.086 1.00 0.00 H new ATOM 20 N LYS A 2 4.028 -16.324 27.658 1.00 0.00 N ATOM 21 CA LYS A 2 3.530 -14.920 27.599 1.00 0.00 C ATOM 22 C LYS A 2 4.604 -14.002 27.009 1.00 0.00 C ATOM 23 O LYS A 2 5.774 -14.332 26.989 1.00 0.00 O ATOM 24 CB LYS A 2 3.240 -14.540 29.051 1.00 0.00 C ATOM 25 CG LYS A 2 2.071 -15.376 29.575 1.00 0.00 C ATOM 26 CD LYS A 2 0.752 -14.691 29.217 1.00 0.00 C ATOM 27 CE LYS A 2 -0.263 -15.741 28.759 1.00 0.00 C ATOM 28 NZ LYS A 2 -0.693 -16.429 30.009 1.00 0.00 N ATOM 0 H LYS A 2 4.755 -16.498 28.352 1.00 0.00 H new ATOM 0 HA LYS A 2 2.647 -14.822 26.968 1.00 0.00 H new ATOM 0 HB2 LYS A 2 4.125 -14.708 29.665 1.00 0.00 H new ATOM 0 HB3 LYS A 2 3.001 -13.479 29.119 1.00 0.00 H new ATOM 0 HG2 LYS A 2 2.103 -16.376 29.142 1.00 0.00 H new ATOM 0 HG3 LYS A 2 2.150 -15.494 30.656 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.366 -14.149 30.080 1.00 0.00 H new ATOM 0 HD3 LYS A 2 0.914 -13.958 28.427 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -1.109 -15.278 28.252 1.00 0.00 H new ATOM 0 HE3 LYS A 2 0.185 -16.443 28.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -0.480 -17.444 29.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -0.183 -16.025 30.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -1.716 -16.298 30.143 1.00 0.00 H new ATOM 42 N VAL A 3 4.216 -12.853 26.527 1.00 0.00 N ATOM 43 CA VAL A 3 5.217 -11.915 25.941 1.00 0.00 C ATOM 44 C VAL A 3 6.377 -11.706 26.916 1.00 0.00 C ATOM 45 O VAL A 3 6.230 -11.860 28.111 1.00 0.00 O ATOM 46 CB VAL A 3 4.448 -10.608 25.716 1.00 0.00 C ATOM 47 CG1 VAL A 3 4.858 -9.569 26.763 1.00 0.00 C ATOM 48 CG2 VAL A 3 4.759 -10.070 24.318 1.00 0.00 C ATOM 0 H VAL A 3 3.251 -12.523 26.513 1.00 0.00 H new ATOM 0 HA VAL A 3 5.651 -12.293 25.015 1.00 0.00 H new ATOM 0 HB VAL A 3 3.380 -10.803 25.807 1.00 0.00 H new ATOM 0 HG11 VAL A 3 4.306 -8.645 26.594 1.00 0.00 H new ATOM 0 HG12 VAL A 3 4.633 -9.949 27.760 1.00 0.00 H new ATOM 0 HG13 VAL A 3 5.927 -9.373 26.682 1.00 0.00 H new ATOM 0 HG21 VAL A 3 4.213 -9.141 24.156 1.00 0.00 H new ATOM 0 HG22 VAL A 3 5.829 -9.882 24.230 1.00 0.00 H new ATOM 0 HG23 VAL A 3 4.457 -10.803 23.570 1.00 0.00 H new ATOM 58 N ALA A 4 7.526 -11.353 26.416 1.00 0.00 N ATOM 59 CA ALA A 4 8.687 -11.132 27.321 1.00 0.00 C ATOM 60 C ALA A 4 9.673 -10.142 26.693 1.00 0.00 C ATOM 61 O ALA A 4 9.739 -9.996 25.489 1.00 0.00 O ATOM 62 CB ALA A 4 9.335 -12.507 27.480 1.00 0.00 C ATOM 0 H ALA A 4 7.712 -11.208 25.424 1.00 0.00 H new ATOM 0 HA ALA A 4 8.385 -10.710 28.280 1.00 0.00 H new ATOM 0 HB1 ALA A 4 10.202 -12.427 28.136 1.00 0.00 H new ATOM 0 HB2 ALA A 4 8.615 -13.201 27.913 1.00 0.00 H new ATOM 0 HB3 ALA A 4 9.651 -12.875 26.504 1.00 0.00 H new ATOM 68 N LYS A 5 10.439 -9.461 27.501 1.00 0.00 N ATOM 69 CA LYS A 5 11.421 -8.481 26.953 1.00 0.00 C ATOM 70 C LYS A 5 12.196 -9.102 25.789 1.00 0.00 C ATOM 71 O LYS A 5 11.955 -8.797 24.637 1.00 0.00 O ATOM 72 CB LYS A 5 12.361 -8.169 28.118 1.00 0.00 C ATOM 73 CG LYS A 5 12.217 -6.697 28.512 1.00 0.00 C ATOM 74 CD LYS A 5 13.273 -5.866 27.782 1.00 0.00 C ATOM 75 CE LYS A 5 14.609 -5.974 28.521 1.00 0.00 C ATOM 76 NZ LYS A 5 14.976 -4.571 28.857 1.00 0.00 N ATOM 0 H LYS A 5 10.428 -9.541 28.518 1.00 0.00 H new ATOM 0 HA LYS A 5 10.937 -7.583 26.568 1.00 0.00 H new ATOM 0 HB2 LYS A 5 12.127 -8.809 28.969 1.00 0.00 H new ATOM 0 HB3 LYS A 5 13.392 -8.381 27.834 1.00 0.00 H new ATOM 0 HG2 LYS A 5 11.219 -6.338 28.260 1.00 0.00 H new ATOM 0 HG3 LYS A 5 12.333 -6.585 29.590 1.00 0.00 H new ATOM 0 HD2 LYS A 5 13.383 -6.218 26.756 1.00 0.00 H new ATOM 0 HD3 LYS A 5 12.958 -4.824 27.729 1.00 0.00 H new ATOM 0 HE2 LYS A 5 14.515 -6.584 29.420 1.00 0.00 H new ATOM 0 HE3 LYS A 5 15.369 -6.442 27.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 15.883 -4.562 29.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 15.065 -4.016 27.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 14.237 -4.153 29.458 1.00 0.00 H new ATOM 90 N ASP A 6 13.128 -9.969 26.080 1.00 0.00 N ATOM 91 CA ASP A 6 13.920 -10.608 24.991 1.00 0.00 C ATOM 92 C ASP A 6 13.012 -11.478 24.116 1.00 0.00 C ATOM 93 O ASP A 6 13.146 -12.685 24.075 1.00 0.00 O ATOM 94 CB ASP A 6 14.956 -11.473 25.711 1.00 0.00 C ATOM 95 CG ASP A 6 14.243 -12.572 26.501 1.00 0.00 C ATOM 96 OD1 ASP A 6 13.168 -12.304 27.012 1.00 0.00 O ATOM 97 OD2 ASP A 6 14.784 -13.662 26.583 1.00 0.00 O ATOM 0 H ASP A 6 13.375 -10.262 27.025 1.00 0.00 H new ATOM 0 HA ASP A 6 14.386 -9.873 24.334 1.00 0.00 H new ATOM 0 HB2 ASP A 6 15.641 -11.916 24.988 1.00 0.00 H new ATOM 0 HB3 ASP A 6 15.555 -10.858 26.383 1.00 0.00 H new ATOM 102 N LEU A 7 12.089 -10.874 23.418 1.00 0.00 N ATOM 103 CA LEU A 7 11.174 -11.669 22.550 1.00 0.00 C ATOM 104 C LEU A 7 10.472 -10.754 21.542 1.00 0.00 C ATOM 105 O LEU A 7 9.613 -9.971 21.894 1.00 0.00 O ATOM 106 CB LEU A 7 10.157 -12.287 23.510 1.00 0.00 C ATOM 107 CG LEU A 7 10.375 -13.799 23.582 1.00 0.00 C ATOM 108 CD1 LEU A 7 11.119 -14.148 24.871 1.00 0.00 C ATOM 109 CD2 LEU A 7 9.019 -14.510 23.570 1.00 0.00 C ATOM 0 H LEU A 7 11.929 -9.867 23.411 1.00 0.00 H new ATOM 0 HA LEU A 7 11.706 -12.427 21.974 1.00 0.00 H new ATOM 0 HB2 LEU A 7 10.263 -11.846 24.501 1.00 0.00 H new ATOM 0 HB3 LEU A 7 9.144 -12.071 23.171 1.00 0.00 H new ATOM 0 HG LEU A 7 10.965 -14.121 22.724 1.00 0.00 H new ATOM 0 HD11 LEU A 7 11.274 -15.226 24.921 1.00 0.00 H new ATOM 0 HD12 LEU A 7 12.084 -13.642 24.882 1.00 0.00 H new ATOM 0 HD13 LEU A 7 10.530 -13.826 25.730 1.00 0.00 H new ATOM 0 HD21 LEU A 7 9.173 -15.588 23.621 1.00 0.00 H new ATOM 0 HD22 LEU A 7 8.431 -14.186 24.429 1.00 0.00 H new ATOM 0 HD23 LEU A 7 8.487 -14.263 22.652 1.00 0.00 H new ATOM 121 N VAL A 8 10.830 -10.849 20.291 1.00 0.00 N ATOM 122 CA VAL A 8 10.179 -9.986 19.264 1.00 0.00 C ATOM 123 C VAL A 8 8.667 -10.223 19.260 1.00 0.00 C ATOM 124 O VAL A 8 8.207 -11.346 19.326 1.00 0.00 O ATOM 125 CB VAL A 8 10.790 -10.419 17.932 1.00 0.00 C ATOM 126 CG1 VAL A 8 10.372 -11.858 17.622 1.00 0.00 C ATOM 127 CG2 VAL A 8 10.292 -9.495 16.819 1.00 0.00 C ATOM 0 H VAL A 8 11.544 -11.485 19.936 1.00 0.00 H new ATOM 0 HA VAL A 8 10.337 -8.925 19.458 1.00 0.00 H new ATOM 0 HB VAL A 8 11.877 -10.361 17.996 1.00 0.00 H new ATOM 0 HG11 VAL A 8 10.808 -12.167 16.672 1.00 0.00 H new ATOM 0 HG12 VAL A 8 10.725 -12.518 18.415 1.00 0.00 H new ATOM 0 HG13 VAL A 8 9.285 -11.916 17.558 1.00 0.00 H new ATOM 0 HG21 VAL A 8 10.727 -9.803 15.868 1.00 0.00 H new ATOM 0 HG22 VAL A 8 9.205 -9.554 16.756 1.00 0.00 H new ATOM 0 HG23 VAL A 8 10.588 -8.469 17.038 1.00 0.00 H new ATOM 137 N VAL A 9 7.891 -9.178 19.186 1.00 0.00 N ATOM 138 CA VAL A 9 6.411 -9.352 19.181 1.00 0.00 C ATOM 139 C VAL A 9 5.756 -8.325 18.254 1.00 0.00 C ATOM 140 O VAL A 9 5.905 -7.133 18.431 1.00 0.00 O ATOM 141 CB VAL A 9 5.981 -9.115 20.628 1.00 0.00 C ATOM 142 CG1 VAL A 9 4.454 -9.136 20.717 1.00 0.00 C ATOM 143 CG2 VAL A 9 6.558 -10.216 21.520 1.00 0.00 C ATOM 0 H VAL A 9 8.216 -8.213 19.129 1.00 0.00 H new ATOM 0 HA VAL A 9 6.114 -10.337 18.821 1.00 0.00 H new ATOM 0 HB VAL A 9 6.352 -8.146 20.962 1.00 0.00 H new ATOM 0 HG11 VAL A 9 4.147 -8.967 21.749 1.00 0.00 H new ATOM 0 HG12 VAL A 9 4.042 -8.351 20.083 1.00 0.00 H new ATOM 0 HG13 VAL A 9 4.083 -10.105 20.382 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.251 -10.046 22.552 1.00 0.00 H new ATOM 0 HG22 VAL A 9 6.189 -11.186 21.186 1.00 0.00 H new ATOM 0 HG23 VAL A 9 7.646 -10.201 21.458 1.00 0.00 H new ATOM 153 N SER A 10 5.025 -8.780 17.275 1.00 0.00 N ATOM 154 CA SER A 10 4.353 -7.829 16.346 1.00 0.00 C ATOM 155 C SER A 10 2.974 -7.463 16.897 1.00 0.00 C ATOM 156 O SER A 10 2.082 -8.284 16.957 1.00 0.00 O ATOM 157 CB SER A 10 4.221 -8.587 15.025 1.00 0.00 C ATOM 158 OG SER A 10 5.339 -8.290 14.200 1.00 0.00 O ATOM 0 H SER A 10 4.864 -9.768 17.078 1.00 0.00 H new ATOM 0 HA SER A 10 4.910 -6.900 16.222 1.00 0.00 H new ATOM 0 HB2 SER A 10 4.167 -9.660 15.212 1.00 0.00 H new ATOM 0 HB3 SER A 10 3.297 -8.304 14.521 1.00 0.00 H new ATOM 0 HG SER A 10 5.259 -8.776 13.353 1.00 0.00 H new ATOM 164 N LEU A 11 2.795 -6.240 17.315 1.00 0.00 N ATOM 165 CA LEU A 11 1.475 -5.834 17.875 1.00 0.00 C ATOM 166 C LEU A 11 0.841 -4.736 17.017 1.00 0.00 C ATOM 167 O LEU A 11 1.315 -3.618 16.970 1.00 0.00 O ATOM 168 CB LEU A 11 1.789 -5.302 19.274 1.00 0.00 C ATOM 169 CG LEU A 11 1.049 -6.138 20.319 1.00 0.00 C ATOM 170 CD1 LEU A 11 1.866 -7.390 20.642 1.00 0.00 C ATOM 171 CD2 LEU A 11 0.863 -5.310 21.593 1.00 0.00 C ATOM 0 H LEU A 11 3.503 -5.506 17.293 1.00 0.00 H new ATOM 0 HA LEU A 11 0.767 -6.663 17.897 1.00 0.00 H new ATOM 0 HB2 LEU A 11 2.863 -5.341 19.456 1.00 0.00 H new ATOM 0 HB3 LEU A 11 1.490 -4.257 19.352 1.00 0.00 H new ATOM 0 HG LEU A 11 0.075 -6.430 19.928 1.00 0.00 H new ATOM 0 HD11 LEU A 11 1.339 -7.986 21.387 1.00 0.00 H new ATOM 0 HD12 LEU A 11 2.002 -7.980 19.735 1.00 0.00 H new ATOM 0 HD13 LEU A 11 2.840 -7.098 21.034 1.00 0.00 H new ATOM 0 HD21 LEU A 11 0.336 -5.904 22.339 1.00 0.00 H new ATOM 0 HD22 LEU A 11 1.838 -5.019 21.984 1.00 0.00 H new ATOM 0 HD23 LEU A 11 0.283 -4.416 21.365 1.00 0.00 H new ATOM 183 N ALA A 12 -0.234 -5.045 16.345 1.00 0.00 N ATOM 184 CA ALA A 12 -0.906 -4.017 15.501 1.00 0.00 C ATOM 185 C ALA A 12 -1.964 -3.285 16.330 1.00 0.00 C ATOM 186 O ALA A 12 -2.666 -3.884 17.120 1.00 0.00 O ATOM 187 CB ALA A 12 -1.559 -4.801 14.363 1.00 0.00 C ATOM 0 H ALA A 12 -0.676 -5.964 16.344 1.00 0.00 H new ATOM 0 HA ALA A 12 -0.213 -3.265 15.124 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -2.076 -4.111 13.696 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -0.793 -5.339 13.805 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -2.275 -5.512 14.775 1.00 0.00 H new ATOM 193 N TYR A 13 -2.082 -1.996 16.166 1.00 0.00 N ATOM 194 CA TYR A 13 -3.093 -1.243 16.961 1.00 0.00 C ATOM 195 C TYR A 13 -3.494 0.047 16.241 1.00 0.00 C ATOM 196 O TYR A 13 -2.699 0.665 15.562 1.00 0.00 O ATOM 197 CB TYR A 13 -2.392 -0.920 18.281 1.00 0.00 C ATOM 198 CG TYR A 13 -1.338 0.135 18.043 1.00 0.00 C ATOM 199 CD1 TYR A 13 -0.224 -0.157 17.248 1.00 0.00 C ATOM 200 CD2 TYR A 13 -1.475 1.404 18.617 1.00 0.00 C ATOM 201 CE1 TYR A 13 0.754 0.821 17.026 1.00 0.00 C ATOM 202 CE2 TYR A 13 -0.499 2.382 18.395 1.00 0.00 C ATOM 203 CZ TYR A 13 0.616 2.090 17.600 1.00 0.00 C ATOM 204 OH TYR A 13 1.579 3.054 17.381 1.00 0.00 O ATOM 0 H TYR A 13 -1.526 -1.435 15.521 1.00 0.00 H new ATOM 0 HA TYR A 13 -4.008 -1.817 17.108 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -3.117 -0.567 19.014 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -1.935 -1.820 18.693 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -0.118 -1.137 16.806 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -2.334 1.629 19.232 1.00 0.00 H new ATOM 0 HE1 TYR A 13 1.614 0.596 16.412 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -0.606 3.362 18.837 1.00 0.00 H new ATOM 0 HH TYR A 13 1.330 3.878 17.850 1.00 0.00 H new ATOM 214 N GLN A 14 -4.723 0.460 16.393 1.00 0.00 N ATOM 215 CA GLN A 14 -5.179 1.713 15.729 1.00 0.00 C ATOM 216 C GLN A 14 -5.292 2.835 16.764 1.00 0.00 C ATOM 217 O GLN A 14 -5.798 2.639 17.851 1.00 0.00 O ATOM 218 CB GLN A 14 -6.553 1.377 15.147 1.00 0.00 C ATOM 219 CG GLN A 14 -7.031 2.532 14.266 1.00 0.00 C ATOM 220 CD GLN A 14 -7.539 1.980 12.933 1.00 0.00 C ATOM 221 OE1 GLN A 14 -8.658 2.245 12.540 1.00 0.00 O ATOM 222 NE2 GLN A 14 -6.760 1.219 12.216 1.00 0.00 N ATOM 0 H GLN A 14 -5.432 -0.018 16.950 1.00 0.00 H new ATOM 0 HA GLN A 14 -4.487 2.054 14.959 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -6.497 0.459 14.562 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -7.267 1.200 15.951 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -7.825 3.083 14.770 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -6.215 3.234 14.094 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -5.821 0.996 12.545 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -7.090 0.846 11.326 1.00 0.00 H new ATOM 231 N VAL A 15 -4.820 4.009 16.441 1.00 0.00 N ATOM 232 CA VAL A 15 -4.901 5.132 17.420 1.00 0.00 C ATOM 233 C VAL A 15 -5.885 6.197 16.932 1.00 0.00 C ATOM 234 O VAL A 15 -5.824 6.647 15.806 1.00 0.00 O ATOM 235 CB VAL A 15 -3.483 5.707 17.492 1.00 0.00 C ATOM 236 CG1 VAL A 15 -3.284 6.404 18.839 1.00 0.00 C ATOM 237 CG2 VAL A 15 -2.460 4.575 17.354 1.00 0.00 C ATOM 0 H VAL A 15 -4.384 4.239 15.548 1.00 0.00 H new ATOM 0 HA VAL A 15 -5.255 4.797 18.395 1.00 0.00 H new ATOM 0 HB VAL A 15 -3.344 6.424 16.683 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -2.275 6.814 18.891 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.009 7.211 18.942 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -3.426 5.684 19.645 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -1.452 4.987 17.406 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -2.600 3.857 18.162 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -2.599 4.074 16.396 1.00 0.00 H new ATOM 247 N ARG A 16 -6.793 6.604 17.778 1.00 0.00 N ATOM 248 CA ARG A 16 -7.783 7.643 17.371 1.00 0.00 C ATOM 249 C ARG A 16 -7.925 8.691 18.478 1.00 0.00 C ATOM 250 O ARG A 16 -7.975 8.368 19.649 1.00 0.00 O ATOM 251 CB ARG A 16 -9.096 6.885 17.176 1.00 0.00 C ATOM 252 CG ARG A 16 -9.406 6.067 18.431 1.00 0.00 C ATOM 253 CD ARG A 16 -9.165 4.583 18.146 1.00 0.00 C ATOM 254 NE ARG A 16 -10.507 3.947 18.256 1.00 0.00 N ATOM 255 CZ ARG A 16 -11.045 3.758 19.430 1.00 0.00 C ATOM 256 NH1 ARG A 16 -10.669 2.748 20.164 1.00 0.00 N ATOM 257 NH2 ARG A 16 -11.959 4.579 19.869 1.00 0.00 N ATOM 0 H ARG A 16 -6.892 6.262 18.734 1.00 0.00 H new ATOM 0 HA ARG A 16 -7.483 8.172 16.466 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -9.907 7.586 16.977 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -9.023 6.228 16.310 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -8.776 6.396 19.257 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -10.440 6.226 18.735 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -8.739 4.436 17.154 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -8.464 4.152 18.861 1.00 0.00 H new ATOM 0 HE ARG A 16 -11.006 3.659 17.414 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -9.955 2.106 19.821 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -11.089 2.600 21.082 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -12.253 5.369 19.295 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -12.379 4.431 20.787 1.00 0.00 H new ATOM 271 N THR A 17 -7.989 9.943 18.119 1.00 0.00 N ATOM 272 CA THR A 17 -8.124 11.010 19.154 1.00 0.00 C ATOM 273 C THR A 17 -9.595 11.196 19.534 1.00 0.00 C ATOM 274 O THR A 17 -10.488 10.943 18.749 1.00 0.00 O ATOM 275 CB THR A 17 -7.574 12.274 18.492 1.00 0.00 C ATOM 276 OG1 THR A 17 -7.948 12.289 17.121 1.00 0.00 O ATOM 277 CG2 THR A 17 -6.048 12.287 18.607 1.00 0.00 C ATOM 0 H THR A 17 -7.954 10.275 17.155 1.00 0.00 H new ATOM 0 HA THR A 17 -7.590 10.766 20.072 1.00 0.00 H new ATOM 0 HB THR A 17 -7.982 13.154 18.990 1.00 0.00 H new ATOM 0 HG1 THR A 17 -8.925 12.282 17.048 1.00 0.00 H new ATOM 0 HG21 THR A 17 -5.655 13.188 18.135 1.00 0.00 H new ATOM 0 HG22 THR A 17 -5.762 12.274 19.659 1.00 0.00 H new ATOM 0 HG23 THR A 17 -5.638 11.408 18.109 1.00 0.00 H new ATOM 285 N GLU A 18 -9.854 11.636 20.736 1.00 0.00 N ATOM 286 CA GLU A 18 -11.266 11.838 21.172 1.00 0.00 C ATOM 287 C GLU A 18 -12.030 12.668 20.135 1.00 0.00 C ATOM 288 O GLU A 18 -13.236 12.581 20.025 1.00 0.00 O ATOM 289 CB GLU A 18 -11.167 12.595 22.496 1.00 0.00 C ATOM 290 CG GLU A 18 -12.124 11.971 23.514 1.00 0.00 C ATOM 291 CD GLU A 18 -11.807 12.511 24.911 1.00 0.00 C ATOM 292 OE1 GLU A 18 -10.976 13.400 25.006 1.00 0.00 O ATOM 293 OE2 GLU A 18 -12.399 12.025 25.860 1.00 0.00 O ATOM 0 H GLU A 18 -9.148 11.865 21.436 1.00 0.00 H new ATOM 0 HA GLU A 18 -11.802 10.895 21.279 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -10.145 12.559 22.872 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -11.414 13.646 22.346 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -13.156 12.202 23.249 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -12.028 10.885 23.502 1.00 0.00 H new ATOM 300 N ASP A 19 -11.337 13.473 19.377 1.00 0.00 N ATOM 301 CA ASP A 19 -12.027 14.307 18.351 1.00 0.00 C ATOM 302 C ASP A 19 -12.631 13.414 17.263 1.00 0.00 C ATOM 303 O ASP A 19 -13.360 13.870 16.405 1.00 0.00 O ATOM 304 CB ASP A 19 -10.934 15.201 17.767 1.00 0.00 C ATOM 305 CG ASP A 19 -9.948 14.348 16.967 1.00 0.00 C ATOM 306 OD1 ASP A 19 -10.105 13.139 16.966 1.00 0.00 O ATOM 307 OD2 ASP A 19 -9.051 14.920 16.368 1.00 0.00 O ATOM 0 H ASP A 19 -10.325 13.590 19.423 1.00 0.00 H new ATOM 0 HA ASP A 19 -12.846 14.889 18.774 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -11.377 15.962 17.125 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -10.412 15.724 18.568 1.00 0.00 H new ATOM 312 N GLY A 20 -12.333 12.143 17.292 1.00 0.00 N ATOM 313 CA GLY A 20 -12.889 11.223 16.260 1.00 0.00 C ATOM 314 C GLY A 20 -11.945 11.176 15.057 1.00 0.00 C ATOM 315 O GLY A 20 -12.369 11.012 13.929 1.00 0.00 O ATOM 0 H GLY A 20 -11.729 11.703 17.986 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -13.013 10.224 16.677 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -13.876 11.563 15.948 1.00 0.00 H new ATOM 319 N VAL A 21 -10.669 11.319 15.286 1.00 0.00 N ATOM 320 CA VAL A 21 -9.699 11.283 14.154 1.00 0.00 C ATOM 321 C VAL A 21 -8.680 10.159 14.362 1.00 0.00 C ATOM 322 O VAL A 21 -8.374 9.785 15.477 1.00 0.00 O ATOM 323 CB VAL A 21 -9.008 12.645 14.183 1.00 0.00 C ATOM 324 CG1 VAL A 21 -7.762 12.604 13.295 1.00 0.00 C ATOM 325 CG2 VAL A 21 -9.969 13.715 13.661 1.00 0.00 C ATOM 0 H VAL A 21 -10.255 11.459 16.208 1.00 0.00 H new ATOM 0 HA VAL A 21 -10.188 11.093 13.198 1.00 0.00 H new ATOM 0 HB VAL A 21 -8.718 12.883 15.206 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -7.269 13.576 13.315 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.077 11.841 13.665 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -8.052 12.366 12.272 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -9.477 14.687 13.681 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -10.258 13.476 12.638 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -10.858 13.745 14.292 1.00 0.00 H new ATOM 335 N LEU A 22 -8.153 9.619 13.298 1.00 0.00 N ATOM 336 CA LEU A 22 -7.155 8.520 13.436 1.00 0.00 C ATOM 337 C LEU A 22 -5.734 9.081 13.326 1.00 0.00 C ATOM 338 O LEU A 22 -5.329 9.574 12.292 1.00 0.00 O ATOM 339 CB LEU A 22 -7.447 7.571 12.273 1.00 0.00 C ATOM 340 CG LEU A 22 -7.862 6.204 12.820 1.00 0.00 C ATOM 341 CD1 LEU A 22 -9.377 6.043 12.695 1.00 0.00 C ATOM 342 CD2 LEU A 22 -7.164 5.103 12.018 1.00 0.00 C ATOM 0 H LEU A 22 -8.370 9.891 12.339 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.225 8.017 14.400 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -8.240 7.980 11.647 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -6.564 7.469 11.643 1.00 0.00 H new ATOM 0 HG LEU A 22 -7.575 6.129 13.869 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -9.673 5.069 13.085 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -9.875 6.828 13.264 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -9.665 6.117 11.646 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -7.458 4.128 12.406 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -7.452 5.178 10.969 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -6.084 5.218 12.106 1.00 0.00 H new ATOM 354 N VAL A 23 -4.974 9.008 14.385 1.00 0.00 N ATOM 355 CA VAL A 23 -3.580 9.538 14.339 1.00 0.00 C ATOM 356 C VAL A 23 -2.628 8.474 13.787 1.00 0.00 C ATOM 357 O VAL A 23 -1.818 8.742 12.921 1.00 0.00 O ATOM 358 CB VAL A 23 -3.234 9.867 15.791 1.00 0.00 C ATOM 359 CG1 VAL A 23 -1.734 10.143 15.908 1.00 0.00 C ATOM 360 CG2 VAL A 23 -4.015 11.107 16.231 1.00 0.00 C ATOM 0 H VAL A 23 -5.257 8.605 15.278 1.00 0.00 H new ATOM 0 HA VAL A 23 -3.490 10.410 13.691 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.499 9.023 16.428 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -1.487 10.378 16.943 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -1.176 9.261 15.593 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -1.469 10.987 15.271 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -3.770 11.343 17.266 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.748 11.950 15.594 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -5.084 10.912 16.147 1.00 0.00 H new ATOM 370 N ASP A 24 -2.717 7.269 14.281 1.00 0.00 N ATOM 371 CA ASP A 24 -1.814 6.192 13.781 1.00 0.00 C ATOM 372 C ASP A 24 -2.568 4.862 13.696 1.00 0.00 C ATOM 373 O ASP A 24 -3.484 4.606 14.452 1.00 0.00 O ATOM 374 CB ASP A 24 -0.691 6.107 14.816 1.00 0.00 C ATOM 375 CG ASP A 24 0.642 6.459 14.154 1.00 0.00 C ATOM 376 OD1 ASP A 24 0.951 5.862 13.136 1.00 0.00 O ATOM 377 OD2 ASP A 24 1.331 7.320 14.676 1.00 0.00 O ATOM 0 H ASP A 24 -3.374 6.984 15.007 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.434 6.403 12.781 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.891 6.790 15.641 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -0.646 5.103 15.237 1.00 0.00 H new ATOM 382 N GLU A 25 -2.185 4.013 12.781 1.00 0.00 N ATOM 383 CA GLU A 25 -2.877 2.698 12.646 1.00 0.00 C ATOM 384 C GLU A 25 -1.897 1.636 12.138 1.00 0.00 C ATOM 385 O GLU A 25 -1.275 1.797 11.108 1.00 0.00 O ATOM 386 CB GLU A 25 -3.988 2.938 11.623 1.00 0.00 C ATOM 387 CG GLU A 25 -3.367 3.263 10.263 1.00 0.00 C ATOM 388 CD GLU A 25 -4.191 4.352 9.572 1.00 0.00 C ATOM 389 OE1 GLU A 25 -5.186 4.011 8.954 1.00 0.00 O ATOM 390 OE2 GLU A 25 -3.815 5.507 9.674 1.00 0.00 O ATOM 0 H GLU A 25 -1.424 4.172 12.121 1.00 0.00 H new ATOM 0 HA GLU A 25 -3.271 2.338 13.596 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -4.621 2.054 11.544 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -4.626 3.759 11.949 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -2.338 3.598 10.392 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -3.335 2.367 9.643 1.00 0.00 H new ATOM 397 N SER A 26 -1.757 0.553 12.851 1.00 0.00 N ATOM 398 CA SER A 26 -0.818 -0.516 12.404 1.00 0.00 C ATOM 399 C SER A 26 -1.600 -1.750 11.946 1.00 0.00 C ATOM 400 O SER A 26 -2.208 -2.434 12.746 1.00 0.00 O ATOM 401 CB SER A 26 0.026 -0.843 13.635 1.00 0.00 C ATOM 402 OG SER A 26 1.395 -0.919 13.260 1.00 0.00 O ATOM 0 H SER A 26 -2.251 0.361 13.723 1.00 0.00 H new ATOM 0 HA SER A 26 -0.203 -0.199 11.561 1.00 0.00 H new ATOM 0 HB2 SER A 26 -0.112 -0.077 14.398 1.00 0.00 H new ATOM 0 HB3 SER A 26 -0.297 -1.789 14.070 1.00 0.00 H new ATOM 0 HG SER A 26 1.807 -0.034 13.345 1.00 0.00 H new ATOM 408 N PRO A 27 -1.557 -1.993 10.664 1.00 0.00 N ATOM 409 CA PRO A 27 -2.271 -3.156 10.082 1.00 0.00 C ATOM 410 C PRO A 27 -1.553 -4.460 10.443 1.00 0.00 C ATOM 411 O PRO A 27 -0.398 -4.459 10.821 1.00 0.00 O ATOM 412 CB PRO A 27 -2.209 -2.899 8.579 1.00 0.00 C ATOM 413 CG PRO A 27 -1.011 -2.025 8.385 1.00 0.00 C ATOM 414 CD PRO A 27 -0.846 -1.213 9.644 1.00 0.00 C ATOM 0 HA PRO A 27 -3.292 -3.260 10.450 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -2.112 -3.831 8.023 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -3.116 -2.410 8.224 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -0.122 -2.627 8.195 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.145 -1.374 7.521 1.00 0.00 H new ATOM 0 HD2 PRO A 27 0.205 -1.084 9.901 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -1.272 -0.216 9.535 1.00 0.00 H new ATOM 422 N VAL A 28 -2.228 -5.571 10.330 1.00 0.00 N ATOM 423 CA VAL A 28 -1.583 -6.873 10.666 1.00 0.00 C ATOM 424 C VAL A 28 -0.540 -7.235 9.605 1.00 0.00 C ATOM 425 O VAL A 28 0.357 -8.019 9.846 1.00 0.00 O ATOM 426 CB VAL A 28 -2.723 -7.890 10.668 1.00 0.00 C ATOM 427 CG1 VAL A 28 -3.262 -8.057 9.246 1.00 0.00 C ATOM 428 CG2 VAL A 28 -2.201 -9.237 11.175 1.00 0.00 C ATOM 0 H VAL A 28 -3.198 -5.634 10.020 1.00 0.00 H new ATOM 0 HA VAL A 28 -1.063 -6.843 11.624 1.00 0.00 H new ATOM 0 HB VAL A 28 -3.522 -7.538 11.320 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -4.075 -8.783 9.248 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -3.632 -7.098 8.882 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.463 -8.409 8.593 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.013 -9.964 11.177 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -1.402 -9.587 10.521 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -1.816 -9.120 12.188 1.00 0.00 H new ATOM 438 N SER A 29 -0.651 -6.673 8.433 1.00 0.00 N ATOM 439 CA SER A 29 0.335 -6.986 7.359 1.00 0.00 C ATOM 440 C SER A 29 1.588 -6.120 7.521 1.00 0.00 C ATOM 441 O SER A 29 2.629 -6.409 6.966 1.00 0.00 O ATOM 442 CB SER A 29 -0.381 -6.650 6.052 1.00 0.00 C ATOM 443 OG SER A 29 0.571 -6.202 5.096 1.00 0.00 O ATOM 0 H SER A 29 -1.381 -6.011 8.172 1.00 0.00 H new ATOM 0 HA SER A 29 0.661 -8.026 7.390 1.00 0.00 H new ATOM 0 HB2 SER A 29 -0.906 -7.528 5.676 1.00 0.00 H new ATOM 0 HB3 SER A 29 -1.132 -5.879 6.223 1.00 0.00 H new ATOM 0 HG SER A 29 0.115 -5.987 4.256 1.00 0.00 H new ATOM 449 N ALA A 30 1.496 -5.062 8.279 1.00 0.00 N ATOM 450 CA ALA A 30 2.682 -4.181 8.477 1.00 0.00 C ATOM 451 C ALA A 30 2.735 -3.681 9.923 1.00 0.00 C ATOM 452 O ALA A 30 2.872 -2.498 10.168 1.00 0.00 O ATOM 453 CB ALA A 30 2.473 -3.013 7.512 1.00 0.00 C ATOM 0 H ALA A 30 0.651 -4.769 8.770 1.00 0.00 H new ATOM 0 HA ALA A 30 3.620 -4.703 8.288 1.00 0.00 H new ATOM 0 HB1 ALA A 30 3.307 -2.317 7.597 1.00 0.00 H new ATOM 0 HB2 ALA A 30 2.418 -3.390 6.491 1.00 0.00 H new ATOM 0 HB3 ALA A 30 1.544 -2.499 7.759 1.00 0.00 H new ATOM 459 N PRO A 31 2.620 -4.608 10.834 1.00 0.00 N ATOM 460 CA PRO A 31 2.653 -4.269 12.279 1.00 0.00 C ATOM 461 C PRO A 31 4.078 -3.911 12.713 1.00 0.00 C ATOM 462 O PRO A 31 5.036 -4.186 12.018 1.00 0.00 O ATOM 463 CB PRO A 31 2.182 -5.552 12.957 1.00 0.00 C ATOM 464 CG PRO A 31 2.507 -6.645 11.990 1.00 0.00 C ATOM 465 CD PRO A 31 2.452 -6.046 10.607 1.00 0.00 C ATOM 0 HA PRO A 31 2.035 -3.407 12.532 1.00 0.00 H new ATOM 0 HB2 PRO A 31 2.690 -5.704 13.909 1.00 0.00 H new ATOM 0 HB3 PRO A 31 1.113 -5.517 13.168 1.00 0.00 H new ATOM 0 HG2 PRO A 31 3.496 -7.056 12.192 1.00 0.00 H new ATOM 0 HG3 PRO A 31 1.795 -7.465 12.083 1.00 0.00 H new ATOM 0 HD2 PRO A 31 3.241 -6.444 9.969 1.00 0.00 H new ATOM 0 HD3 PRO A 31 1.504 -6.264 10.115 1.00 0.00 H new ATOM 473 N LEU A 32 4.224 -3.301 13.857 1.00 0.00 N ATOM 474 CA LEU A 32 5.586 -2.928 14.335 1.00 0.00 C ATOM 475 C LEU A 32 6.199 -4.077 15.138 1.00 0.00 C ATOM 476 O LEU A 32 5.900 -4.262 16.302 1.00 0.00 O ATOM 477 CB LEU A 32 5.373 -1.703 15.226 1.00 0.00 C ATOM 478 CG LEU A 32 4.654 -0.611 14.432 1.00 0.00 C ATOM 479 CD1 LEU A 32 4.727 0.711 15.200 1.00 0.00 C ATOM 480 CD2 LEU A 32 5.329 -0.444 13.069 1.00 0.00 C ATOM 0 H LEU A 32 3.459 -3.045 14.482 1.00 0.00 H new ATOM 0 HA LEU A 32 6.269 -2.718 13.512 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.786 -1.976 16.103 1.00 0.00 H new ATOM 0 HB3 LEU A 32 6.332 -1.332 15.588 1.00 0.00 H new ATOM 0 HG LEU A 32 3.611 -0.893 14.290 1.00 0.00 H new ATOM 0 HD11 LEU A 32 4.215 1.489 14.634 1.00 0.00 H new ATOM 0 HD12 LEU A 32 4.248 0.594 16.172 1.00 0.00 H new ATOM 0 HD13 LEU A 32 5.770 0.993 15.341 1.00 0.00 H new ATOM 0 HD21 LEU A 32 4.817 0.334 12.502 1.00 0.00 H new ATOM 0 HD22 LEU A 32 6.372 -0.162 13.212 1.00 0.00 H new ATOM 0 HD23 LEU A 32 5.279 -1.385 12.521 1.00 0.00 H new ATOM 492 N ASP A 33 7.055 -4.850 14.528 1.00 0.00 N ATOM 493 CA ASP A 33 7.687 -5.985 15.259 1.00 0.00 C ATOM 494 C ASP A 33 8.887 -5.487 16.069 1.00 0.00 C ATOM 495 O ASP A 33 9.780 -4.851 15.547 1.00 0.00 O ATOM 496 CB ASP A 33 8.141 -6.957 14.169 1.00 0.00 C ATOM 497 CG ASP A 33 8.461 -8.315 14.797 1.00 0.00 C ATOM 498 OD1 ASP A 33 7.847 -8.642 15.798 1.00 0.00 O ATOM 499 OD2 ASP A 33 9.316 -9.004 14.264 1.00 0.00 O ATOM 0 H ASP A 33 7.344 -4.745 13.555 1.00 0.00 H new ATOM 0 HA ASP A 33 7.001 -6.456 15.963 1.00 0.00 H new ATOM 0 HB2 ASP A 33 7.360 -7.067 13.417 1.00 0.00 H new ATOM 0 HB3 ASP A 33 9.021 -6.564 13.660 1.00 0.00 H new ATOM 504 N TYR A 34 8.912 -5.770 17.343 1.00 0.00 N ATOM 505 CA TYR A 34 10.053 -5.310 18.186 1.00 0.00 C ATOM 506 C TYR A 34 10.110 -6.123 19.482 1.00 0.00 C ATOM 507 O TYR A 34 9.191 -6.842 19.817 1.00 0.00 O ATOM 508 CB TYR A 34 9.756 -3.841 18.490 1.00 0.00 C ATOM 509 CG TYR A 34 10.130 -2.993 17.297 1.00 0.00 C ATOM 510 CD1 TYR A 34 11.476 -2.826 16.950 1.00 0.00 C ATOM 511 CD2 TYR A 34 9.130 -2.373 16.540 1.00 0.00 C ATOM 512 CE1 TYR A 34 11.822 -2.038 15.846 1.00 0.00 C ATOM 513 CE2 TYR A 34 9.475 -1.585 15.435 1.00 0.00 C ATOM 514 CZ TYR A 34 10.822 -1.419 15.088 1.00 0.00 C ATOM 515 OH TYR A 34 11.163 -0.642 13.999 1.00 0.00 O ATOM 0 H TYR A 34 8.193 -6.299 17.836 1.00 0.00 H new ATOM 0 HA TYR A 34 11.013 -5.436 17.686 1.00 0.00 H new ATOM 0 HB2 TYR A 34 8.699 -3.714 18.723 1.00 0.00 H new ATOM 0 HB3 TYR A 34 10.317 -3.520 19.368 1.00 0.00 H new ATOM 0 HD1 TYR A 34 12.248 -3.305 17.534 1.00 0.00 H new ATOM 0 HD2 TYR A 34 8.092 -2.502 16.808 1.00 0.00 H new ATOM 0 HE1 TYR A 34 12.860 -1.908 15.579 1.00 0.00 H new ATOM 0 HE2 TYR A 34 8.703 -1.106 14.851 1.00 0.00 H new ATOM 0 HH TYR A 34 10.350 -0.287 13.583 1.00 0.00 H new ATOM 525 N LEU A 35 11.185 -6.012 20.215 1.00 0.00 N ATOM 526 CA LEU A 35 11.299 -6.778 21.489 1.00 0.00 C ATOM 527 C LEU A 35 10.568 -6.040 22.615 1.00 0.00 C ATOM 528 O LEU A 35 10.579 -4.827 22.685 1.00 0.00 O ATOM 529 CB LEU A 35 12.798 -6.844 21.779 1.00 0.00 C ATOM 530 CG LEU A 35 13.309 -8.258 21.503 1.00 0.00 C ATOM 531 CD1 LEU A 35 13.809 -8.350 20.060 1.00 0.00 C ATOM 532 CD2 LEU A 35 14.458 -8.579 22.462 1.00 0.00 C ATOM 0 H LEU A 35 11.988 -5.425 19.987 1.00 0.00 H new ATOM 0 HA LEU A 35 10.854 -7.770 21.416 1.00 0.00 H new ATOM 0 HB2 LEU A 35 13.331 -6.125 21.157 1.00 0.00 H new ATOM 0 HB3 LEU A 35 12.991 -6.572 22.817 1.00 0.00 H new ATOM 0 HG LEU A 35 12.499 -8.972 21.651 1.00 0.00 H new ATOM 0 HD11 LEU A 35 14.173 -9.359 19.865 1.00 0.00 H new ATOM 0 HD12 LEU A 35 12.992 -8.120 19.376 1.00 0.00 H new ATOM 0 HD13 LEU A 35 14.619 -7.636 19.909 1.00 0.00 H new ATOM 0 HD21 LEU A 35 14.824 -9.587 22.267 1.00 0.00 H new ATOM 0 HD22 LEU A 35 15.267 -7.864 22.313 1.00 0.00 H new ATOM 0 HD23 LEU A 35 14.102 -8.515 23.490 1.00 0.00 H new ATOM 544 N HIS A 36 9.933 -6.764 23.496 1.00 0.00 N ATOM 545 CA HIS A 36 9.203 -6.102 24.615 1.00 0.00 C ATOM 546 C HIS A 36 10.182 -5.304 25.482 1.00 0.00 C ATOM 547 O HIS A 36 11.291 -5.730 25.735 1.00 0.00 O ATOM 548 CB HIS A 36 8.586 -7.248 25.417 1.00 0.00 C ATOM 549 CG HIS A 36 7.929 -6.698 26.654 1.00 0.00 C ATOM 550 ND1 HIS A 36 6.611 -6.269 26.663 1.00 0.00 N ATOM 551 CD2 HIS A 36 8.395 -6.503 27.930 1.00 0.00 C ATOM 552 CE1 HIS A 36 6.332 -5.840 27.907 1.00 0.00 C ATOM 553 NE2 HIS A 36 7.385 -5.960 28.720 1.00 0.00 N ATOM 0 H HIS A 36 9.888 -7.783 23.490 1.00 0.00 H new ATOM 0 HA HIS A 36 8.447 -5.401 24.261 1.00 0.00 H new ATOM 0 HB2 HIS A 36 7.854 -7.779 24.809 1.00 0.00 H new ATOM 0 HB3 HIS A 36 9.355 -7.970 25.691 1.00 0.00 H new ATOM 0 HD2 HIS A 36 9.393 -6.735 28.270 1.00 0.00 H new ATOM 0 HE1 HIS A 36 5.373 -5.446 28.211 1.00 0.00 H new ATOM 0 HE2 HIS A 36 7.438 -5.708 29.707 1.00 0.00 H new ATOM 561 N GLY A 37 9.780 -4.149 25.937 1.00 0.00 N ATOM 562 CA GLY A 37 10.688 -3.325 26.784 1.00 0.00 C ATOM 563 C GLY A 37 11.948 -2.975 25.991 1.00 0.00 C ATOM 564 O GLY A 37 12.938 -2.534 26.541 1.00 0.00 O ATOM 0 H GLY A 37 8.863 -3.740 25.759 1.00 0.00 H new ATOM 0 HA2 GLY A 37 10.180 -2.414 27.101 1.00 0.00 H new ATOM 0 HA3 GLY A 37 10.955 -3.872 27.688 1.00 0.00 H new ATOM 568 N HIS A 38 11.919 -3.163 24.699 1.00 0.00 N ATOM 569 CA HIS A 38 13.115 -2.840 23.870 1.00 0.00 C ATOM 570 C HIS A 38 12.750 -1.808 22.799 1.00 0.00 C ATOM 571 O HIS A 38 12.401 -2.150 21.687 1.00 0.00 O ATOM 572 CB HIS A 38 13.518 -4.164 23.221 1.00 0.00 C ATOM 573 CG HIS A 38 14.491 -4.885 24.112 1.00 0.00 C ATOM 574 ND1 HIS A 38 15.693 -4.318 24.505 1.00 0.00 N ATOM 575 CD2 HIS A 38 14.456 -6.128 24.692 1.00 0.00 C ATOM 576 CE1 HIS A 38 16.326 -5.211 25.289 1.00 0.00 C ATOM 577 NE2 HIS A 38 15.615 -6.332 25.435 1.00 0.00 N ATOM 0 H HIS A 38 11.118 -3.526 24.182 1.00 0.00 H new ATOM 0 HA HIS A 38 13.925 -2.414 24.462 1.00 0.00 H new ATOM 0 HB2 HIS A 38 12.636 -4.782 23.053 1.00 0.00 H new ATOM 0 HB3 HIS A 38 13.969 -3.981 22.246 1.00 0.00 H new ATOM 0 HD1 HIS A 38 16.036 -3.393 24.247 1.00 0.00 H new ATOM 0 HD2 HIS A 38 13.651 -6.840 24.588 1.00 0.00 H new ATOM 0 HE1 HIS A 38 17.291 -5.042 25.744 1.00 0.00 H new ATOM 585 N GLY A 39 12.828 -0.547 23.126 1.00 0.00 N ATOM 586 CA GLY A 39 12.485 0.504 22.127 1.00 0.00 C ATOM 587 C GLY A 39 11.778 1.665 22.828 1.00 0.00 C ATOM 588 O GLY A 39 11.595 2.726 22.264 1.00 0.00 O ATOM 0 H GLY A 39 13.114 -0.199 24.041 1.00 0.00 H new ATOM 0 HA2 GLY A 39 13.389 0.860 21.633 1.00 0.00 H new ATOM 0 HA3 GLY A 39 11.842 0.088 21.352 1.00 0.00 H new ATOM 592 N SER A 40 11.378 1.473 24.056 1.00 0.00 N ATOM 593 CA SER A 40 10.684 2.567 24.795 1.00 0.00 C ATOM 594 C SER A 40 9.341 2.883 24.130 1.00 0.00 C ATOM 595 O SER A 40 8.966 4.030 23.980 1.00 0.00 O ATOM 596 CB SER A 40 11.624 3.767 24.700 1.00 0.00 C ATOM 597 OG SER A 40 11.660 4.435 25.955 1.00 0.00 O ATOM 0 H SER A 40 11.502 0.606 24.579 1.00 0.00 H new ATOM 0 HA SER A 40 10.471 2.297 25.829 1.00 0.00 H new ATOM 0 HB2 SER A 40 12.625 3.438 24.421 1.00 0.00 H new ATOM 0 HB3 SER A 40 11.284 4.449 23.921 1.00 0.00 H new ATOM 0 HG SER A 40 12.264 5.205 25.899 1.00 0.00 H new ATOM 603 N LEU A 41 8.612 1.875 23.734 1.00 0.00 N ATOM 604 CA LEU A 41 7.294 2.120 23.081 1.00 0.00 C ATOM 605 C LEU A 41 6.346 2.828 24.056 1.00 0.00 C ATOM 606 O LEU A 41 6.733 3.743 24.756 1.00 0.00 O ATOM 607 CB LEU A 41 6.763 0.731 22.726 1.00 0.00 C ATOM 608 CG LEU A 41 5.842 0.830 21.509 1.00 0.00 C ATOM 609 CD1 LEU A 41 6.667 1.190 20.272 1.00 0.00 C ATOM 610 CD2 LEU A 41 5.147 -0.516 21.284 1.00 0.00 C ATOM 0 H LEU A 41 8.872 0.894 23.834 1.00 0.00 H new ATOM 0 HA LEU A 41 7.379 2.758 22.202 1.00 0.00 H new ATOM 0 HB2 LEU A 41 7.593 0.057 22.513 1.00 0.00 H new ATOM 0 HB3 LEU A 41 6.220 0.311 23.573 1.00 0.00 H new ATOM 0 HG LEU A 41 5.092 1.602 21.683 1.00 0.00 H new ATOM 0 HD11 LEU A 41 6.011 1.261 19.405 1.00 0.00 H new ATOM 0 HD12 LEU A 41 7.162 2.148 20.431 1.00 0.00 H new ATOM 0 HD13 LEU A 41 7.417 0.418 20.098 1.00 0.00 H new ATOM 0 HD21 LEU A 41 4.490 -0.446 20.417 1.00 0.00 H new ATOM 0 HD22 LEU A 41 5.897 -1.288 21.110 1.00 0.00 H new ATOM 0 HD23 LEU A 41 4.559 -0.773 22.165 1.00 0.00 H new ATOM 622 N ILE A 42 5.110 2.413 24.107 1.00 0.00 N ATOM 623 CA ILE A 42 4.144 3.064 25.036 1.00 0.00 C ATOM 624 C ILE A 42 4.166 2.361 26.398 1.00 0.00 C ATOM 625 O ILE A 42 3.860 1.191 26.507 1.00 0.00 O ATOM 626 CB ILE A 42 2.780 2.898 24.366 1.00 0.00 C ATOM 627 CG1 ILE A 42 2.764 3.679 23.049 1.00 0.00 C ATOM 628 CG2 ILE A 42 1.685 3.433 25.289 1.00 0.00 C ATOM 629 CD1 ILE A 42 1.326 3.795 22.541 1.00 0.00 C ATOM 0 H ILE A 42 4.728 1.652 23.546 1.00 0.00 H new ATOM 0 HA ILE A 42 4.384 4.112 25.217 1.00 0.00 H new ATOM 0 HB ILE A 42 2.599 1.842 24.168 1.00 0.00 H new ATOM 0 HG12 ILE A 42 3.189 4.671 23.197 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.383 3.174 22.307 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.714 3.313 24.809 1.00 0.00 H new ATOM 0 HG22 ILE A 42 1.697 2.878 26.227 1.00 0.00 H new ATOM 0 HG23 ILE A 42 1.863 4.489 25.490 1.00 0.00 H new ATOM 0 HD11 ILE A 42 1.315 4.351 21.604 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.917 2.798 22.377 1.00 0.00 H new ATOM 0 HD13 ILE A 42 0.720 4.319 23.280 1.00 0.00 H new ATOM 641 N SER A 43 4.528 3.067 27.435 1.00 0.00 N ATOM 642 CA SER A 43 4.574 2.438 28.787 1.00 0.00 C ATOM 643 C SER A 43 3.168 2.022 29.230 1.00 0.00 C ATOM 644 O SER A 43 2.955 0.920 29.695 1.00 0.00 O ATOM 645 CB SER A 43 5.126 3.524 29.709 1.00 0.00 C ATOM 646 OG SER A 43 4.457 3.461 30.961 1.00 0.00 O ATOM 0 H SER A 43 4.794 4.051 27.405 1.00 0.00 H new ATOM 0 HA SER A 43 5.188 1.538 28.801 1.00 0.00 H new ATOM 0 HB2 SER A 43 6.198 3.388 29.849 1.00 0.00 H new ATOM 0 HB3 SER A 43 4.986 4.506 29.258 1.00 0.00 H new ATOM 0 HG SER A 43 4.810 4.155 31.556 1.00 0.00 H new ATOM 652 N GLY A 44 2.208 2.895 29.091 1.00 0.00 N ATOM 653 CA GLY A 44 0.819 2.545 29.506 1.00 0.00 C ATOM 654 C GLY A 44 0.359 1.298 28.751 1.00 0.00 C ATOM 655 O GLY A 44 -0.363 0.473 29.276 1.00 0.00 O ATOM 0 H GLY A 44 2.324 3.834 28.709 1.00 0.00 H new ATOM 0 HA2 GLY A 44 0.784 2.366 30.581 1.00 0.00 H new ATOM 0 HA3 GLY A 44 0.146 3.377 29.299 1.00 0.00 H new ATOM 659 N LEU A 45 0.772 1.153 27.522 1.00 0.00 N ATOM 660 CA LEU A 45 0.359 -0.042 26.732 1.00 0.00 C ATOM 661 C LEU A 45 1.327 -1.200 26.985 1.00 0.00 C ATOM 662 O LEU A 45 0.939 -2.351 27.023 1.00 0.00 O ATOM 663 CB LEU A 45 0.428 0.410 25.271 1.00 0.00 C ATOM 664 CG LEU A 45 0.062 -0.755 24.349 1.00 0.00 C ATOM 665 CD1 LEU A 45 1.249 -1.713 24.238 1.00 0.00 C ATOM 666 CD2 LEU A 45 -1.146 -1.503 24.920 1.00 0.00 C ATOM 0 H LEU A 45 1.378 1.810 27.030 1.00 0.00 H new ATOM 0 HA LEU A 45 -0.636 -0.396 27.002 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -0.254 1.244 25.106 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.431 0.768 25.039 1.00 0.00 H new ATOM 0 HG LEU A 45 -0.186 -0.368 23.361 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.987 -2.542 23.581 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.108 -1.182 23.827 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.499 -2.098 25.226 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -1.405 -2.332 24.262 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.901 -1.888 25.910 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -1.993 -0.822 24.996 1.00 0.00 H new ATOM 678 N GLU A 46 2.586 -0.905 27.163 1.00 0.00 N ATOM 679 CA GLU A 46 3.578 -1.988 27.417 1.00 0.00 C ATOM 680 C GLU A 46 3.094 -2.889 28.555 1.00 0.00 C ATOM 681 O GLU A 46 2.961 -4.087 28.399 1.00 0.00 O ATOM 682 CB GLU A 46 4.863 -1.262 27.816 1.00 0.00 C ATOM 683 CG GLU A 46 5.765 -1.108 26.588 1.00 0.00 C ATOM 684 CD GLU A 46 7.178 -0.729 27.037 1.00 0.00 C ATOM 685 OE1 GLU A 46 7.295 -0.030 28.031 1.00 0.00 O ATOM 686 OE2 GLU A 46 8.117 -1.144 26.380 1.00 0.00 O ATOM 0 H GLU A 46 2.970 0.040 27.143 1.00 0.00 H new ATOM 0 HA GLU A 46 3.726 -2.627 26.546 1.00 0.00 H new ATOM 0 HB2 GLU A 46 4.626 -0.283 28.231 1.00 0.00 H new ATOM 0 HB3 GLU A 46 5.383 -1.821 28.594 1.00 0.00 H new ATOM 0 HG2 GLU A 46 5.789 -2.039 26.022 1.00 0.00 H new ATOM 0 HG3 GLU A 46 5.365 -0.342 25.924 1.00 0.00 H new ATOM 693 N THR A 47 2.828 -2.322 29.701 1.00 0.00 N ATOM 694 CA THR A 47 2.352 -3.148 30.848 1.00 0.00 C ATOM 695 C THR A 47 1.225 -4.079 30.393 1.00 0.00 C ATOM 696 O THR A 47 1.246 -5.266 30.651 1.00 0.00 O ATOM 697 CB THR A 47 1.833 -2.140 31.873 1.00 0.00 C ATOM 698 OG1 THR A 47 1.009 -1.185 31.220 1.00 0.00 O ATOM 699 CG2 THR A 47 3.016 -1.428 32.534 1.00 0.00 C ATOM 0 H THR A 47 2.920 -1.324 29.892 1.00 0.00 H new ATOM 0 HA THR A 47 3.140 -3.778 31.260 1.00 0.00 H new ATOM 0 HB THR A 47 1.253 -2.661 32.635 1.00 0.00 H new ATOM 0 HG1 THR A 47 0.674 -0.539 31.876 1.00 0.00 H new ATOM 0 HG21 THR A 47 2.646 -0.709 33.265 1.00 0.00 H new ATOM 0 HG22 THR A 47 3.649 -2.161 33.034 1.00 0.00 H new ATOM 0 HG23 THR A 47 3.597 -0.906 31.774 1.00 0.00 H new ATOM 707 N ALA A 48 0.242 -3.550 29.718 1.00 0.00 N ATOM 708 CA ALA A 48 -0.884 -4.406 29.246 1.00 0.00 C ATOM 709 C ALA A 48 -0.360 -5.501 28.313 1.00 0.00 C ATOM 710 O ALA A 48 -0.972 -6.539 28.152 1.00 0.00 O ATOM 711 CB ALA A 48 -1.814 -3.456 28.490 1.00 0.00 C ATOM 0 H ALA A 48 0.169 -2.563 29.473 1.00 0.00 H new ATOM 0 HA ALA A 48 -1.395 -4.907 30.068 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -2.671 -4.012 28.110 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -2.160 -2.672 29.164 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -1.275 -3.006 27.657 1.00 0.00 H new ATOM 717 N LEU A 49 0.769 -5.278 27.697 1.00 0.00 N ATOM 718 CA LEU A 49 1.332 -6.306 26.776 1.00 0.00 C ATOM 719 C LEU A 49 1.858 -7.501 27.575 1.00 0.00 C ATOM 720 O LEU A 49 1.698 -8.641 27.184 1.00 0.00 O ATOM 721 CB LEU A 49 2.477 -5.602 26.047 1.00 0.00 C ATOM 722 CG LEU A 49 2.234 -5.656 24.538 1.00 0.00 C ATOM 723 CD1 LEU A 49 3.425 -5.036 23.806 1.00 0.00 C ATOM 724 CD2 LEU A 49 2.072 -7.114 24.103 1.00 0.00 C ATOM 0 H LEU A 49 1.326 -4.429 27.792 1.00 0.00 H new ATOM 0 HA LEU A 49 0.585 -6.692 26.083 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.549 -4.566 26.377 1.00 0.00 H new ATOM 0 HB3 LEU A 49 3.425 -6.081 26.290 1.00 0.00 H new ATOM 0 HG LEU A 49 1.329 -5.099 24.295 1.00 0.00 H new ATOM 0 HD11 LEU A 49 3.251 -5.075 22.731 1.00 0.00 H new ATOM 0 HD12 LEU A 49 3.543 -3.998 24.117 1.00 0.00 H new ATOM 0 HD13 LEU A 49 4.330 -5.593 24.048 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.899 -7.156 23.028 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.978 -7.669 24.346 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.224 -7.557 24.625 1.00 0.00 H new ATOM 736 N GLU A 50 2.485 -7.251 28.692 1.00 0.00 N ATOM 737 CA GLU A 50 3.020 -8.374 29.514 1.00 0.00 C ATOM 738 C GLU A 50 1.875 -9.266 30.001 1.00 0.00 C ATOM 739 O GLU A 50 0.883 -8.793 30.516 1.00 0.00 O ATOM 740 CB GLU A 50 3.716 -7.700 30.698 1.00 0.00 C ATOM 741 CG GLU A 50 4.305 -8.771 31.618 1.00 0.00 C ATOM 742 CD GLU A 50 4.426 -8.212 33.038 1.00 0.00 C ATOM 743 OE1 GLU A 50 4.831 -7.069 33.171 1.00 0.00 O ATOM 744 OE2 GLU A 50 4.112 -8.937 33.967 1.00 0.00 O ATOM 0 H GLU A 50 2.650 -6.318 29.071 1.00 0.00 H new ATOM 0 HA GLU A 50 3.700 -9.012 28.950 1.00 0.00 H new ATOM 0 HB2 GLU A 50 4.505 -7.038 30.341 1.00 0.00 H new ATOM 0 HB3 GLU A 50 3.006 -7.083 31.248 1.00 0.00 H new ATOM 0 HG2 GLU A 50 3.669 -9.656 31.617 1.00 0.00 H new ATOM 0 HG3 GLU A 50 5.284 -9.081 31.253 1.00 0.00 H new ATOM 751 N GLY A 51 2.005 -10.554 29.839 1.00 0.00 N ATOM 752 CA GLY A 51 0.924 -11.474 30.291 1.00 0.00 C ATOM 753 C GLY A 51 -0.311 -11.282 29.411 1.00 0.00 C ATOM 754 O GLY A 51 -1.430 -11.277 29.887 1.00 0.00 O ATOM 0 H GLY A 51 2.813 -11.009 29.413 1.00 0.00 H new ATOM 0 HA2 GLY A 51 1.265 -12.508 30.236 1.00 0.00 H new ATOM 0 HA3 GLY A 51 0.675 -11.275 31.333 1.00 0.00 H new ATOM 758 N HIS A 52 -0.121 -11.123 28.131 1.00 0.00 N ATOM 759 CA HIS A 52 -1.286 -10.931 27.221 1.00 0.00 C ATOM 760 C HIS A 52 -1.599 -12.238 26.482 1.00 0.00 C ATOM 761 O HIS A 52 -1.813 -13.267 27.092 1.00 0.00 O ATOM 762 CB HIS A 52 -0.845 -9.845 26.240 1.00 0.00 C ATOM 763 CG HIS A 52 -2.052 -9.271 25.550 1.00 0.00 C ATOM 764 ND1 HIS A 52 -3.334 -9.734 25.798 1.00 0.00 N ATOM 765 CD2 HIS A 52 -2.188 -8.273 24.617 1.00 0.00 C ATOM 766 CE1 HIS A 52 -4.179 -9.021 25.029 1.00 0.00 C ATOM 767 NE2 HIS A 52 -3.531 -8.117 24.290 1.00 0.00 N ATOM 0 H HIS A 52 0.791 -11.118 27.675 1.00 0.00 H new ATOM 0 HA HIS A 52 -2.192 -10.648 27.758 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -0.307 -9.058 26.770 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -0.157 -10.262 25.505 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -1.375 -7.696 24.200 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -5.249 -9.163 25.012 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -3.934 -7.454 23.628 1.00 0.00 H new ATOM 775 N GLU A 53 -1.628 -12.207 25.177 1.00 0.00 N ATOM 776 CA GLU A 53 -1.928 -13.451 24.411 1.00 0.00 C ATOM 777 C GLU A 53 -1.794 -13.191 22.908 1.00 0.00 C ATOM 778 O GLU A 53 -2.283 -12.205 22.393 1.00 0.00 O ATOM 779 CB GLU A 53 -3.373 -13.799 24.769 1.00 0.00 C ATOM 780 CG GLU A 53 -3.392 -15.044 25.657 1.00 0.00 C ATOM 781 CD GLU A 53 -4.385 -14.838 26.803 1.00 0.00 C ATOM 782 OE1 GLU A 53 -4.268 -13.836 27.488 1.00 0.00 O ATOM 783 OE2 GLU A 53 -5.244 -15.687 26.975 1.00 0.00 O ATOM 0 H GLU A 53 -1.458 -11.377 24.609 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.242 -14.262 24.655 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -3.842 -12.963 25.287 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -3.951 -13.977 23.862 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -3.674 -15.918 25.070 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -2.395 -15.235 26.055 1.00 0.00 H new ATOM 790 N VAL A 54 -1.135 -14.068 22.202 1.00 0.00 N ATOM 791 CA VAL A 54 -0.970 -13.871 20.733 1.00 0.00 C ATOM 792 C VAL A 54 -2.317 -13.965 20.030 1.00 0.00 C ATOM 793 O VAL A 54 -2.986 -14.979 20.068 1.00 0.00 O ATOM 794 CB VAL A 54 -0.046 -15.000 20.281 1.00 0.00 C ATOM 795 CG1 VAL A 54 -0.737 -16.346 20.500 1.00 0.00 C ATOM 796 CG2 VAL A 54 0.278 -14.829 18.796 1.00 0.00 C ATOM 0 H VAL A 54 -0.704 -14.912 22.578 1.00 0.00 H new ATOM 0 HA VAL A 54 -0.559 -12.890 20.494 1.00 0.00 H new ATOM 0 HB VAL A 54 0.876 -14.968 20.861 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.077 -17.151 20.177 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.968 -16.469 21.558 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.660 -16.380 19.921 1.00 0.00 H new ATOM 0 HG21 VAL A 54 0.937 -15.634 18.472 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.645 -14.860 18.216 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.772 -13.870 18.640 1.00 0.00 H new ATOM 806 N GLY A 55 -2.714 -12.909 19.382 1.00 0.00 N ATOM 807 CA GLY A 55 -4.012 -12.925 18.666 1.00 0.00 C ATOM 808 C GLY A 55 -5.078 -12.232 19.517 1.00 0.00 C ATOM 809 O GLY A 55 -6.152 -11.917 19.046 1.00 0.00 O ATOM 0 H GLY A 55 -2.193 -12.034 19.318 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -3.915 -12.420 17.705 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -4.311 -13.952 18.457 1.00 0.00 H new ATOM 813 N ASP A 56 -4.790 -11.995 20.767 1.00 0.00 N ATOM 814 CA ASP A 56 -5.790 -11.324 21.647 1.00 0.00 C ATOM 815 C ASP A 56 -5.628 -9.803 21.568 1.00 0.00 C ATOM 816 O ASP A 56 -4.529 -9.285 21.588 1.00 0.00 O ATOM 817 CB ASP A 56 -5.477 -11.825 23.057 1.00 0.00 C ATOM 818 CG ASP A 56 -6.737 -11.739 23.921 1.00 0.00 C ATOM 819 OD1 ASP A 56 -7.754 -12.269 23.505 1.00 0.00 O ATOM 820 OD2 ASP A 56 -6.662 -11.145 24.984 1.00 0.00 O ATOM 0 H ASP A 56 -3.907 -12.236 21.217 1.00 0.00 H new ATOM 0 HA ASP A 56 -6.815 -11.549 21.354 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -5.120 -12.854 23.018 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -4.679 -11.227 23.498 1.00 0.00 H new ATOM 825 N LYS A 57 -6.713 -9.085 21.480 1.00 0.00 N ATOM 826 CA LYS A 57 -6.620 -7.599 21.398 1.00 0.00 C ATOM 827 C LYS A 57 -6.944 -6.973 22.758 1.00 0.00 C ATOM 828 O LYS A 57 -7.767 -7.470 23.501 1.00 0.00 O ATOM 829 CB LYS A 57 -7.663 -7.192 20.359 1.00 0.00 C ATOM 830 CG LYS A 57 -9.064 -7.505 20.889 1.00 0.00 C ATOM 831 CD LYS A 57 -10.103 -6.730 20.076 1.00 0.00 C ATOM 832 CE LYS A 57 -11.255 -6.308 20.991 1.00 0.00 C ATOM 833 NZ LYS A 57 -11.659 -4.960 20.503 1.00 0.00 N ATOM 0 H LYS A 57 -7.660 -9.462 21.461 1.00 0.00 H new ATOM 0 HA LYS A 57 -5.620 -7.263 21.124 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -7.576 -6.128 20.139 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -7.489 -7.726 19.425 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -9.259 -8.575 20.822 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -9.135 -7.234 21.942 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -9.644 -5.851 19.622 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -10.479 -7.349 19.262 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -12.084 -7.014 20.933 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -10.939 -6.272 22.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -12.446 -4.603 21.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -10.852 -4.308 20.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -11.962 -5.027 19.510 1.00 0.00 H new ATOM 847 N PHE A 58 -6.301 -5.887 23.090 1.00 0.00 N ATOM 848 CA PHE A 58 -6.572 -5.230 24.400 1.00 0.00 C ATOM 849 C PHE A 58 -6.671 -3.714 24.219 1.00 0.00 C ATOM 850 O PHE A 58 -5.744 -3.071 23.766 1.00 0.00 O ATOM 851 CB PHE A 58 -5.374 -5.588 25.279 1.00 0.00 C ATOM 852 CG PHE A 58 -5.800 -5.604 26.727 1.00 0.00 C ATOM 853 CD1 PHE A 58 -6.157 -4.410 27.365 1.00 0.00 C ATOM 854 CD2 PHE A 58 -5.836 -6.813 27.433 1.00 0.00 C ATOM 855 CE1 PHE A 58 -6.550 -4.425 28.709 1.00 0.00 C ATOM 856 CE2 PHE A 58 -6.230 -6.829 28.776 1.00 0.00 C ATOM 857 CZ PHE A 58 -6.587 -5.635 29.414 1.00 0.00 C ATOM 0 H PHE A 58 -5.599 -5.426 22.510 1.00 0.00 H new ATOM 0 HA PHE A 58 -7.513 -5.560 24.841 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -4.979 -6.563 24.994 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -4.572 -4.864 25.132 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -6.129 -3.478 26.821 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -5.560 -7.734 26.941 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -6.824 -3.504 29.202 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -6.259 -7.762 29.320 1.00 0.00 H new ATOM 0 HZ PHE A 58 -6.891 -5.647 30.450 1.00 0.00 H new ATOM 867 N ASP A 59 -7.788 -3.136 24.568 1.00 0.00 N ATOM 868 CA ASP A 59 -7.942 -1.661 24.414 1.00 0.00 C ATOM 869 C ASP A 59 -7.424 -0.941 25.661 1.00 0.00 C ATOM 870 O ASP A 59 -7.847 -1.212 26.767 1.00 0.00 O ATOM 871 CB ASP A 59 -9.445 -1.435 24.249 1.00 0.00 C ATOM 872 CG ASP A 59 -10.169 -1.862 25.526 1.00 0.00 C ATOM 873 OD1 ASP A 59 -9.738 -2.829 26.133 1.00 0.00 O ATOM 874 OD2 ASP A 59 -11.142 -1.215 25.878 1.00 0.00 O ATOM 0 H ASP A 59 -8.599 -3.620 24.952 1.00 0.00 H new ATOM 0 HA ASP A 59 -7.376 -1.273 23.567 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -9.644 -0.384 24.039 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -9.818 -2.006 23.399 1.00 0.00 H new ATOM 879 N VAL A 60 -6.513 -0.023 25.492 1.00 0.00 N ATOM 880 CA VAL A 60 -5.969 0.715 26.668 1.00 0.00 C ATOM 881 C VAL A 60 -5.799 2.198 26.326 1.00 0.00 C ATOM 882 O VAL A 60 -5.024 2.561 25.465 1.00 0.00 O ATOM 883 CB VAL A 60 -4.612 0.070 26.946 1.00 0.00 C ATOM 884 CG1 VAL A 60 -4.063 0.588 28.277 1.00 0.00 C ATOM 885 CG2 VAL A 60 -4.776 -1.450 27.019 1.00 0.00 C ATOM 0 H VAL A 60 -6.121 0.249 24.590 1.00 0.00 H new ATOM 0 HA VAL A 60 -6.630 0.661 27.533 1.00 0.00 H new ATOM 0 HB VAL A 60 -3.918 0.323 26.144 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -3.095 0.128 28.475 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -3.946 1.671 28.226 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -4.756 0.335 29.079 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -3.809 -1.911 27.217 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -5.470 -1.703 27.821 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -5.167 -1.820 26.071 1.00 0.00 H new ATOM 895 N ALA A 61 -6.521 3.057 26.993 1.00 0.00 N ATOM 896 CA ALA A 61 -6.399 4.515 26.705 1.00 0.00 C ATOM 897 C ALA A 61 -5.109 5.068 27.313 1.00 0.00 C ATOM 898 O ALA A 61 -4.814 4.852 28.472 1.00 0.00 O ATOM 899 CB ALA A 61 -7.621 5.152 27.367 1.00 0.00 C ATOM 0 H ALA A 61 -7.189 2.813 27.724 1.00 0.00 H new ATOM 0 HA ALA A 61 -6.360 4.723 25.636 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -7.605 6.229 27.200 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -8.529 4.731 26.936 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -7.601 4.950 28.438 1.00 0.00 H new ATOM 905 N VAL A 62 -4.336 5.780 26.539 1.00 0.00 N ATOM 906 CA VAL A 62 -3.063 6.345 27.075 1.00 0.00 C ATOM 907 C VAL A 62 -2.401 7.244 26.028 1.00 0.00 C ATOM 908 O VAL A 62 -2.409 6.952 24.849 1.00 0.00 O ATOM 909 CB VAL A 62 -2.188 5.128 27.374 1.00 0.00 C ATOM 910 CG1 VAL A 62 -2.030 4.287 26.106 1.00 0.00 C ATOM 911 CG2 VAL A 62 -0.811 5.595 27.850 1.00 0.00 C ATOM 0 H VAL A 62 -4.529 5.995 25.561 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.222 6.959 27.961 1.00 0.00 H new ATOM 0 HB VAL A 62 -2.658 4.526 28.152 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -1.406 3.419 26.320 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -3.010 3.954 25.766 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -1.561 4.888 25.327 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.186 4.728 28.063 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -0.342 6.197 27.072 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -0.922 6.193 28.754 1.00 0.00 H new ATOM 921 N GLY A 63 -1.827 8.338 26.450 1.00 0.00 N ATOM 922 CA GLY A 63 -1.165 9.255 25.480 1.00 0.00 C ATOM 923 C GLY A 63 -0.141 10.121 26.215 1.00 0.00 C ATOM 924 O GLY A 63 1.047 9.878 26.159 1.00 0.00 O ATOM 0 H GLY A 63 -1.788 8.636 27.425 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -0.674 8.679 24.696 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -1.909 9.886 24.994 1.00 0.00 H new ATOM 928 N ALA A 64 -0.596 11.130 26.905 1.00 0.00 N ATOM 929 CA ALA A 64 0.349 12.013 27.646 1.00 0.00 C ATOM 930 C ALA A 64 0.666 11.409 29.017 1.00 0.00 C ATOM 931 O ALA A 64 1.515 11.894 29.738 1.00 0.00 O ATOM 932 CB ALA A 64 -0.392 13.341 27.799 1.00 0.00 C ATOM 0 H ALA A 64 -1.581 11.382 26.988 1.00 0.00 H new ATOM 0 HA ALA A 64 1.299 12.136 27.127 1.00 0.00 H new ATOM 0 HB1 ALA A 64 0.238 14.049 28.337 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.629 13.741 26.813 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.315 13.181 28.356 1.00 0.00 H new ATOM 938 N ASN A 65 -0.010 10.355 29.380 1.00 0.00 N ATOM 939 CA ASN A 65 0.253 9.718 30.702 1.00 0.00 C ATOM 940 C ASN A 65 1.483 8.808 30.615 1.00 0.00 C ATOM 941 O ASN A 65 2.257 8.706 31.546 1.00 0.00 O ATOM 942 CB ASN A 65 -1.002 8.898 31.004 1.00 0.00 C ATOM 943 CG ASN A 65 -1.143 8.717 32.517 1.00 0.00 C ATOM 944 OD1 ASN A 65 -2.227 8.486 33.013 1.00 0.00 O ATOM 945 ND2 ASN A 65 -0.086 8.814 33.275 1.00 0.00 N ATOM 0 H ASN A 65 -0.734 9.906 28.819 1.00 0.00 H new ATOM 0 HA ASN A 65 0.456 10.452 31.482 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -1.882 9.401 30.604 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -0.940 7.926 30.515 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -0.170 8.696 34.285 1.00 0.00 H new ATOM 0 HD22 ASN A 65 0.824 9.008 32.858 1.00 0.00 H new ATOM 952 N ASP A 66 1.666 8.147 29.505 1.00 0.00 N ATOM 953 CA ASP A 66 2.844 7.242 29.361 1.00 0.00 C ATOM 954 C ASP A 66 3.164 7.020 27.880 1.00 0.00 C ATOM 955 O ASP A 66 4.287 7.181 27.446 1.00 0.00 O ATOM 956 CB ASP A 66 2.413 5.929 30.013 1.00 0.00 C ATOM 957 CG ASP A 66 2.258 6.133 31.521 1.00 0.00 C ATOM 958 OD1 ASP A 66 3.226 6.533 32.148 1.00 0.00 O ATOM 959 OD2 ASP A 66 1.174 5.887 32.024 1.00 0.00 O ATOM 0 H ASP A 66 1.052 8.194 28.692 1.00 0.00 H new ATOM 0 HA ASP A 66 3.741 7.656 29.823 1.00 0.00 H new ATOM 0 HB2 ASP A 66 1.471 5.589 29.583 1.00 0.00 H new ATOM 0 HB3 ASP A 66 3.152 5.153 29.815 1.00 0.00 H new ATOM 964 N ALA A 67 2.183 6.644 27.106 1.00 0.00 N ATOM 965 CA ALA A 67 2.422 6.403 25.654 1.00 0.00 C ATOM 966 C ALA A 67 3.360 7.467 25.084 1.00 0.00 C ATOM 967 O ALA A 67 4.541 7.240 24.911 1.00 0.00 O ATOM 968 CB ALA A 67 1.040 6.507 25.007 1.00 0.00 C ATOM 0 H ALA A 67 1.223 6.493 27.417 1.00 0.00 H new ATOM 0 HA ALA A 67 2.892 5.437 25.468 1.00 0.00 H new ATOM 0 HB1 ALA A 67 1.128 6.341 23.933 1.00 0.00 H new ATOM 0 HB2 ALA A 67 0.379 5.755 25.437 1.00 0.00 H new ATOM 0 HB3 ALA A 67 0.627 7.499 25.189 1.00 0.00 H new ATOM 974 N TYR A 68 2.844 8.628 24.790 1.00 0.00 N ATOM 975 CA TYR A 68 3.705 9.705 24.230 1.00 0.00 C ATOM 976 C TYR A 68 4.085 10.697 25.332 1.00 0.00 C ATOM 977 O TYR A 68 4.945 11.536 25.156 1.00 0.00 O ATOM 978 CB TYR A 68 2.843 10.383 23.163 1.00 0.00 C ATOM 979 CG TYR A 68 2.531 9.392 22.067 1.00 0.00 C ATOM 980 CD1 TYR A 68 1.722 8.280 22.337 1.00 0.00 C ATOM 981 CD2 TYR A 68 3.051 9.581 20.782 1.00 0.00 C ATOM 982 CE1 TYR A 68 1.435 7.359 21.324 1.00 0.00 C ATOM 983 CE2 TYR A 68 2.765 8.660 19.768 1.00 0.00 C ATOM 984 CZ TYR A 68 1.956 7.549 20.038 1.00 0.00 C ATOM 985 OH TYR A 68 1.673 6.641 19.038 1.00 0.00 O ATOM 0 H TYR A 68 1.863 8.877 24.914 1.00 0.00 H new ATOM 0 HA TYR A 68 4.637 9.322 23.814 1.00 0.00 H new ATOM 0 HB2 TYR A 68 1.919 10.754 23.607 1.00 0.00 H new ATOM 0 HB3 TYR A 68 3.367 11.245 22.751 1.00 0.00 H new ATOM 0 HD1 TYR A 68 1.320 8.134 23.329 1.00 0.00 H new ATOM 0 HD2 TYR A 68 3.674 10.438 20.572 1.00 0.00 H new ATOM 0 HE1 TYR A 68 0.812 6.502 21.533 1.00 0.00 H new ATOM 0 HE2 TYR A 68 3.168 8.806 18.777 1.00 0.00 H new ATOM 0 HH TYR A 68 2.111 6.922 18.208 1.00 0.00 H new ATOM 1100 N VAL A 76 13.290 15.231 18.786 1.00 0.00 N ATOM 1101 CA VAL A 76 12.794 14.752 17.461 1.00 0.00 C ATOM 1102 C VAL A 76 12.705 13.224 17.452 1.00 0.00 C ATOM 1103 O VAL A 76 13.390 12.548 18.194 1.00 0.00 O ATOM 1104 CB VAL A 76 13.834 15.233 16.450 1.00 0.00 C ATOM 1105 CG1 VAL A 76 14.154 16.708 16.700 1.00 0.00 C ATOM 1106 CG2 VAL A 76 15.111 14.403 16.599 1.00 0.00 C ATOM 0 HA VAL A 76 11.798 15.131 17.232 1.00 0.00 H new ATOM 0 HB VAL A 76 13.437 15.116 15.442 1.00 0.00 H new ATOM 0 HG11 VAL A 76 14.896 17.047 15.977 1.00 0.00 H new ATOM 0 HG12 VAL A 76 13.246 17.301 16.593 1.00 0.00 H new ATOM 0 HG13 VAL A 76 14.549 16.829 17.709 1.00 0.00 H new ATOM 0 HG21 VAL A 76 15.854 14.745 15.878 1.00 0.00 H new ATOM 0 HG22 VAL A 76 15.505 14.519 17.609 1.00 0.00 H new ATOM 0 HG23 VAL A 76 14.885 13.352 16.416 1.00 0.00 H new ATOM 1116 N GLN A 77 11.865 12.675 16.618 1.00 0.00 N ATOM 1117 CA GLN A 77 11.730 11.190 16.563 1.00 0.00 C ATOM 1118 C GLN A 77 12.094 10.673 15.169 1.00 0.00 C ATOM 1119 O GLN A 77 12.309 11.438 14.249 1.00 0.00 O ATOM 1120 CB GLN A 77 10.257 10.915 16.868 1.00 0.00 C ATOM 1121 CG GLN A 77 9.856 11.638 18.156 1.00 0.00 C ATOM 1122 CD GLN A 77 10.230 10.777 19.364 1.00 0.00 C ATOM 1123 OE1 GLN A 77 9.409 10.042 19.876 1.00 0.00 O ATOM 1124 NE2 GLN A 77 11.442 10.835 19.842 1.00 0.00 N ATOM 0 H GLN A 77 11.266 13.189 15.972 1.00 0.00 H new ATOM 0 HA GLN A 77 12.394 10.690 17.268 1.00 0.00 H new ATOM 0 HB2 GLN A 77 9.634 11.254 16.040 1.00 0.00 H new ATOM 0 HB3 GLN A 77 10.091 9.843 16.974 1.00 0.00 H new ATOM 0 HG2 GLN A 77 10.359 12.603 18.215 1.00 0.00 H new ATOM 0 HG3 GLN A 77 8.784 11.836 18.155 1.00 0.00 H new ATOM 0 HE21 GLN A 77 12.131 11.452 19.412 1.00 0.00 H new ATOM 0 HE22 GLN A 77 11.701 10.263 20.646 1.00 0.00 H new ATOM 1133 N ARG A 78 12.164 9.380 15.006 1.00 0.00 N ATOM 1134 CA ARG A 78 12.513 8.814 13.670 1.00 0.00 C ATOM 1135 C ARG A 78 11.268 8.221 13.005 1.00 0.00 C ATOM 1136 O ARG A 78 10.660 7.298 13.510 1.00 0.00 O ATOM 1137 CB ARG A 78 13.542 7.720 13.957 1.00 0.00 C ATOM 1138 CG ARG A 78 13.042 6.827 15.095 1.00 0.00 C ATOM 1139 CD ARG A 78 13.859 5.533 15.126 1.00 0.00 C ATOM 1140 NE ARG A 78 13.546 4.914 16.444 1.00 0.00 N ATOM 1141 CZ ARG A 78 14.445 4.905 17.390 1.00 0.00 C ATOM 1142 NH1 ARG A 78 15.376 5.818 17.414 1.00 0.00 N ATOM 1143 NH2 ARG A 78 14.412 3.982 18.313 1.00 0.00 N ATOM 0 H ARG A 78 11.995 8.691 15.739 1.00 0.00 H new ATOM 0 HA ARG A 78 12.905 9.571 12.991 1.00 0.00 H new ATOM 0 HB2 ARG A 78 13.712 7.123 13.061 1.00 0.00 H new ATOM 0 HB3 ARG A 78 14.498 8.168 14.227 1.00 0.00 H new ATOM 0 HG2 ARG A 78 13.132 7.349 16.048 1.00 0.00 H new ATOM 0 HG3 ARG A 78 11.985 6.599 14.955 1.00 0.00 H new ATOM 0 HD2 ARG A 78 13.584 4.872 14.304 1.00 0.00 H new ATOM 0 HD3 ARG A 78 14.925 5.737 15.028 1.00 0.00 H new ATOM 0 HE ARG A 78 12.629 4.497 16.607 1.00 0.00 H new ATOM 0 HH11 ARG A 78 15.402 6.539 16.693 1.00 0.00 H new ATOM 0 HH12 ARG A 78 16.078 5.811 18.153 1.00 0.00 H new ATOM 0 HH21 ARG A 78 13.684 3.268 18.295 1.00 0.00 H new ATOM 0 HH22 ARG A 78 15.115 3.975 19.052 1.00 0.00 H new ATOM 1157 N VAL A 79 10.884 8.745 11.873 1.00 0.00 N ATOM 1158 CA VAL A 79 9.679 8.212 11.173 1.00 0.00 C ATOM 1159 C VAL A 79 9.943 8.114 9.668 1.00 0.00 C ATOM 1160 O VAL A 79 10.397 9.059 9.055 1.00 0.00 O ATOM 1161 CB VAL A 79 8.575 9.230 11.458 1.00 0.00 C ATOM 1162 CG1 VAL A 79 7.260 8.743 10.847 1.00 0.00 C ATOM 1163 CG2 VAL A 79 8.405 9.386 12.971 1.00 0.00 C ATOM 0 H VAL A 79 11.352 9.519 11.402 1.00 0.00 H new ATOM 0 HA VAL A 79 9.410 7.212 11.514 1.00 0.00 H new ATOM 0 HB VAL A 79 8.846 10.191 11.020 1.00 0.00 H new ATOM 0 HG11 VAL A 79 6.473 9.469 11.051 1.00 0.00 H new ATOM 0 HG12 VAL A 79 7.379 8.630 9.769 1.00 0.00 H new ATOM 0 HG13 VAL A 79 6.989 7.782 11.285 1.00 0.00 H new ATOM 0 HG21 VAL A 79 7.618 10.112 13.176 1.00 0.00 H new ATOM 0 HG22 VAL A 79 8.135 8.425 13.408 1.00 0.00 H new ATOM 0 HG23 VAL A 79 9.341 9.733 13.408 1.00 0.00 H new ATOM 1173 N PRO A 80 9.648 6.965 9.123 1.00 0.00 N ATOM 1174 CA PRO A 80 9.855 6.734 7.672 1.00 0.00 C ATOM 1175 C PRO A 80 8.799 7.484 6.855 1.00 0.00 C ATOM 1176 O PRO A 80 7.800 7.936 7.379 1.00 0.00 O ATOM 1177 CB PRO A 80 9.687 5.225 7.523 1.00 0.00 C ATOM 1178 CG PRO A 80 8.831 4.812 8.679 1.00 0.00 C ATOM 1179 CD PRO A 80 9.099 5.784 9.799 1.00 0.00 C ATOM 0 HA PRO A 80 10.822 7.088 7.315 1.00 0.00 H new ATOM 0 HB2 PRO A 80 9.215 4.973 6.573 1.00 0.00 H new ATOM 0 HB3 PRO A 80 10.651 4.717 7.545 1.00 0.00 H new ATOM 0 HG2 PRO A 80 7.777 4.825 8.402 1.00 0.00 H new ATOM 0 HG3 PRO A 80 9.067 3.794 8.988 1.00 0.00 H new ATOM 0 HD2 PRO A 80 8.187 6.025 10.345 1.00 0.00 H new ATOM 0 HD3 PRO A 80 9.804 5.375 10.522 1.00 0.00 H new ATOM 1187 N LYS A 81 9.012 7.620 5.574 1.00 0.00 N ATOM 1188 CA LYS A 81 8.021 8.341 4.726 1.00 0.00 C ATOM 1189 C LYS A 81 6.754 7.498 4.559 1.00 0.00 C ATOM 1190 O LYS A 81 5.778 7.934 3.981 1.00 0.00 O ATOM 1191 CB LYS A 81 8.719 8.532 3.378 1.00 0.00 C ATOM 1192 CG LYS A 81 8.965 7.168 2.732 1.00 0.00 C ATOM 1193 CD LYS A 81 10.076 7.290 1.687 1.00 0.00 C ATOM 1194 CE LYS A 81 9.584 6.734 0.350 1.00 0.00 C ATOM 1195 NZ LYS A 81 10.014 5.309 0.345 1.00 0.00 N ATOM 0 H LYS A 81 9.829 7.263 5.079 1.00 0.00 H new ATOM 0 HA LYS A 81 7.715 9.290 5.166 1.00 0.00 H new ATOM 0 HB2 LYS A 81 8.105 9.151 2.723 1.00 0.00 H new ATOM 0 HB3 LYS A 81 9.665 9.056 3.517 1.00 0.00 H new ATOM 0 HG2 LYS A 81 9.245 6.439 3.492 1.00 0.00 H new ATOM 0 HG3 LYS A 81 8.050 6.805 2.264 1.00 0.00 H new ATOM 0 HD2 LYS A 81 10.369 8.334 1.573 1.00 0.00 H new ATOM 0 HD3 LYS A 81 10.961 6.745 2.016 1.00 0.00 H new ATOM 0 HE2 LYS A 81 8.501 6.820 0.261 1.00 0.00 H new ATOM 0 HE3 LYS A 81 10.017 7.280 -0.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 9.712 4.858 -0.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 11.050 5.259 0.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 9.581 4.813 1.150 1.00 0.00 H new ATOM 1209 N ASP A 82 6.761 6.293 5.062 1.00 0.00 N ATOM 1210 CA ASP A 82 5.556 5.424 4.931 1.00 0.00 C ATOM 1211 C ASP A 82 4.309 6.172 5.411 1.00 0.00 C ATOM 1212 O ASP A 82 3.208 5.908 4.972 1.00 0.00 O ATOM 1213 CB ASP A 82 5.838 4.220 5.830 1.00 0.00 C ATOM 1214 CG ASP A 82 4.639 3.271 5.804 1.00 0.00 C ATOM 1215 OD1 ASP A 82 3.539 3.729 6.070 1.00 0.00 O ATOM 1216 OD2 ASP A 82 4.839 2.102 5.517 1.00 0.00 O ATOM 0 H ASP A 82 7.548 5.873 5.557 1.00 0.00 H new ATOM 0 HA ASP A 82 5.370 5.128 3.899 1.00 0.00 H new ATOM 0 HB2 ASP A 82 6.734 3.701 5.489 1.00 0.00 H new ATOM 0 HB3 ASP A 82 6.030 4.552 6.850 1.00 0.00 H new ATOM 1221 N VAL A 83 4.475 7.104 6.310 1.00 0.00 N ATOM 1222 CA VAL A 83 3.298 7.868 6.816 1.00 0.00 C ATOM 1223 C VAL A 83 3.438 9.352 6.465 1.00 0.00 C ATOM 1224 O VAL A 83 2.717 10.189 6.969 1.00 0.00 O ATOM 1225 CB VAL A 83 3.322 7.671 8.332 1.00 0.00 C ATOM 1226 CG1 VAL A 83 4.529 8.402 8.924 1.00 0.00 C ATOM 1227 CG2 VAL A 83 2.037 8.238 8.939 1.00 0.00 C ATOM 0 H VAL A 83 5.373 7.369 6.715 1.00 0.00 H new ATOM 0 HA VAL A 83 2.362 7.525 6.374 1.00 0.00 H new ATOM 0 HB VAL A 83 3.395 6.607 8.558 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.545 8.261 10.005 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.446 8.000 8.492 1.00 0.00 H new ATOM 0 HG13 VAL A 83 4.457 9.466 8.698 1.00 0.00 H new ATOM 0 HG21 VAL A 83 2.053 8.098 10.020 1.00 0.00 H new ATOM 0 HG22 VAL A 83 1.966 9.302 8.712 1.00 0.00 H new ATOM 0 HG23 VAL A 83 1.176 7.719 8.518 1.00 0.00 H new ATOM 1237 N PHE A 84 4.361 9.683 5.603 1.00 0.00 N ATOM 1238 CA PHE A 84 4.545 11.112 5.221 1.00 0.00 C ATOM 1239 C PHE A 84 3.442 11.547 4.253 1.00 0.00 C ATOM 1240 O PHE A 84 2.722 12.495 4.501 1.00 0.00 O ATOM 1241 CB PHE A 84 5.911 11.166 4.536 1.00 0.00 C ATOM 1242 CG PHE A 84 6.922 11.776 5.479 1.00 0.00 C ATOM 1243 CD1 PHE A 84 7.266 11.111 6.662 1.00 0.00 C ATOM 1244 CD2 PHE A 84 7.515 13.006 5.169 1.00 0.00 C ATOM 1245 CE1 PHE A 84 8.202 11.677 7.535 1.00 0.00 C ATOM 1246 CE2 PHE A 84 8.452 13.571 6.043 1.00 0.00 C ATOM 1247 CZ PHE A 84 8.795 12.906 7.226 1.00 0.00 C ATOM 0 H PHE A 84 4.995 9.026 5.147 1.00 0.00 H new ATOM 0 HA PHE A 84 4.494 11.779 6.081 1.00 0.00 H new ATOM 0 HB2 PHE A 84 6.225 10.163 4.248 1.00 0.00 H new ATOM 0 HB3 PHE A 84 5.848 11.756 3.621 1.00 0.00 H new ATOM 0 HD1 PHE A 84 6.809 10.162 6.901 1.00 0.00 H new ATOM 0 HD2 PHE A 84 7.250 13.519 4.256 1.00 0.00 H new ATOM 0 HE1 PHE A 84 8.467 11.165 8.448 1.00 0.00 H new ATOM 0 HE2 PHE A 84 8.910 14.520 5.804 1.00 0.00 H new ATOM 0 HZ PHE A 84 9.517 13.342 7.900 1.00 0.00 H new ATOM 1257 N MET A 85 3.301 10.861 3.151 1.00 0.00 N ATOM 1258 CA MET A 85 2.242 11.235 2.169 1.00 0.00 C ATOM 1259 C MET A 85 2.563 12.592 1.535 1.00 0.00 C ATOM 1260 O MET A 85 2.330 13.631 2.119 1.00 0.00 O ATOM 1261 CB MET A 85 0.953 11.317 2.987 1.00 0.00 C ATOM 1262 CG MET A 85 -0.244 11.006 2.087 1.00 0.00 C ATOM 1263 SD MET A 85 -0.934 9.394 2.536 1.00 0.00 S ATOM 1264 CE MET A 85 -0.535 8.539 0.993 1.00 0.00 C ATOM 0 H MET A 85 3.873 10.058 2.888 1.00 0.00 H new ATOM 0 HA MET A 85 2.162 10.515 1.354 1.00 0.00 H new ATOM 0 HB2 MET A 85 0.991 10.611 3.817 1.00 0.00 H new ATOM 0 HB3 MET A 85 0.847 12.312 3.420 1.00 0.00 H new ATOM 0 HG2 MET A 85 -1.003 11.781 2.193 1.00 0.00 H new ATOM 0 HG3 MET A 85 0.065 11.003 1.042 1.00 0.00 H new ATOM 0 HE1 MET A 85 -0.878 7.506 1.050 1.00 0.00 H new ATOM 0 HE2 MET A 85 -1.030 9.040 0.161 1.00 0.00 H new ATOM 0 HE3 MET A 85 0.544 8.555 0.837 1.00 0.00 H new ATOM 1274 N GLY A 86 3.094 12.589 0.343 1.00 0.00 N ATOM 1275 CA GLY A 86 3.427 13.879 -0.327 1.00 0.00 C ATOM 1276 C GLY A 86 4.942 14.086 -0.320 1.00 0.00 C ATOM 1277 O GLY A 86 5.456 14.996 -0.939 1.00 0.00 O ATOM 0 H GLY A 86 3.312 11.751 -0.196 1.00 0.00 H new ATOM 0 HA2 GLY A 86 3.055 13.874 -1.352 1.00 0.00 H new ATOM 0 HA3 GLY A 86 2.935 14.705 0.187 1.00 0.00 H new ATOM 1281 N VAL A 87 5.662 13.251 0.378 1.00 0.00 N ATOM 1282 CA VAL A 87 7.146 13.404 0.424 1.00 0.00 C ATOM 1283 C VAL A 87 7.704 13.577 -0.996 1.00 0.00 C ATOM 1284 O VAL A 87 7.853 14.683 -1.480 1.00 0.00 O ATOM 1285 CB VAL A 87 7.659 12.112 1.071 1.00 0.00 C ATOM 1286 CG1 VAL A 87 6.870 10.913 0.538 1.00 0.00 C ATOM 1287 CG2 VAL A 87 9.145 11.932 0.749 1.00 0.00 C ATOM 0 H VAL A 87 5.289 12.470 0.918 1.00 0.00 H new ATOM 0 HA VAL A 87 7.459 14.283 0.988 1.00 0.00 H new ATOM 0 HB VAL A 87 7.526 12.176 2.151 1.00 0.00 H new ATOM 0 HG11 VAL A 87 7.240 9.999 1.002 1.00 0.00 H new ATOM 0 HG12 VAL A 87 5.813 11.038 0.775 1.00 0.00 H new ATOM 0 HG13 VAL A 87 6.994 10.847 -0.543 1.00 0.00 H new ATOM 0 HG21 VAL A 87 9.508 11.013 1.209 1.00 0.00 H new ATOM 0 HG22 VAL A 87 9.279 11.874 -0.331 1.00 0.00 H new ATOM 0 HG23 VAL A 87 9.707 12.780 1.139 1.00 0.00 H new ATOM 1297 N ASP A 88 8.010 12.502 -1.669 1.00 0.00 N ATOM 1298 CA ASP A 88 8.551 12.616 -3.056 1.00 0.00 C ATOM 1299 C ASP A 88 9.866 13.403 -3.063 1.00 0.00 C ATOM 1300 O ASP A 88 10.375 13.767 -4.104 1.00 0.00 O ATOM 1301 CB ASP A 88 7.475 13.367 -3.839 1.00 0.00 C ATOM 1302 CG ASP A 88 7.067 12.548 -5.065 1.00 0.00 C ATOM 1303 OD1 ASP A 88 6.881 11.351 -4.916 1.00 0.00 O ATOM 1304 OD2 ASP A 88 6.950 13.129 -6.130 1.00 0.00 O ATOM 0 H ASP A 88 7.909 11.549 -1.320 1.00 0.00 H new ATOM 0 HA ASP A 88 8.770 11.640 -3.489 1.00 0.00 H new ATOM 0 HB2 ASP A 88 6.608 13.547 -3.204 1.00 0.00 H new ATOM 0 HB3 ASP A 88 7.850 14.342 -4.149 1.00 0.00 H new ATOM 1309 N GLU A 89 10.423 13.669 -1.911 1.00 0.00 N ATOM 1310 CA GLU A 89 11.705 14.432 -1.859 1.00 0.00 C ATOM 1311 C GLU A 89 11.993 14.889 -0.426 1.00 0.00 C ATOM 1312 O GLU A 89 11.222 15.615 0.170 1.00 0.00 O ATOM 1313 CB GLU A 89 11.492 15.640 -2.773 1.00 0.00 C ATOM 1314 CG GLU A 89 12.452 15.557 -3.961 1.00 0.00 C ATOM 1315 CD GLU A 89 12.611 16.944 -4.588 1.00 0.00 C ATOM 1316 OE1 GLU A 89 11.637 17.444 -5.125 1.00 0.00 O ATOM 1317 OE2 GLU A 89 13.705 17.481 -4.521 1.00 0.00 O ATOM 0 H GLU A 89 10.046 13.391 -1.005 1.00 0.00 H new ATOM 0 HA GLU A 89 12.554 13.827 -2.177 1.00 0.00 H new ATOM 0 HB2 GLU A 89 10.461 15.665 -3.126 1.00 0.00 H new ATOM 0 HB3 GLU A 89 11.662 16.563 -2.219 1.00 0.00 H new ATOM 0 HG2 GLU A 89 13.421 15.181 -3.633 1.00 0.00 H new ATOM 0 HG3 GLU A 89 12.071 14.853 -4.701 1.00 0.00 H new ATOM 1324 N LEU A 90 13.098 14.473 0.128 1.00 0.00 N ATOM 1325 CA LEU A 90 13.435 14.886 1.522 1.00 0.00 C ATOM 1326 C LEU A 90 14.937 15.159 1.643 1.00 0.00 C ATOM 1327 O LEU A 90 15.757 14.377 1.206 1.00 0.00 O ATOM 1328 CB LEU A 90 13.035 13.697 2.397 1.00 0.00 C ATOM 1329 CG LEU A 90 11.513 13.651 2.530 1.00 0.00 C ATOM 1330 CD1 LEU A 90 11.121 12.565 3.533 1.00 0.00 C ATOM 1331 CD2 LEU A 90 11.002 15.007 3.021 1.00 0.00 C ATOM 0 H LEU A 90 13.782 13.866 -0.323 1.00 0.00 H new ATOM 0 HA LEU A 90 12.920 15.800 1.817 1.00 0.00 H new ATOM 0 HB2 LEU A 90 13.400 12.769 1.957 1.00 0.00 H new ATOM 0 HB3 LEU A 90 13.494 13.786 3.382 1.00 0.00 H new ATOM 0 HG LEU A 90 11.071 13.426 1.560 1.00 0.00 H new ATOM 0 HD11 LEU A 90 10.036 12.532 3.628 1.00 0.00 H new ATOM 0 HD12 LEU A 90 11.484 11.599 3.183 1.00 0.00 H new ATOM 0 HD13 LEU A 90 11.563 12.789 4.504 1.00 0.00 H new ATOM 0 HD21 LEU A 90 9.917 14.974 3.116 1.00 0.00 H new ATOM 0 HD22 LEU A 90 11.444 15.233 3.991 1.00 0.00 H new ATOM 0 HD23 LEU A 90 11.280 15.781 2.306 1.00 0.00 H new ATOM 1343 N GLN A 91 15.302 16.264 2.234 1.00 0.00 N ATOM 1344 CA GLN A 91 16.751 16.587 2.383 1.00 0.00 C ATOM 1345 C GLN A 91 17.084 16.859 3.853 1.00 0.00 C ATOM 1346 O GLN A 91 16.354 17.535 4.549 1.00 0.00 O ATOM 1347 CB GLN A 91 16.965 17.845 1.543 1.00 0.00 C ATOM 1348 CG GLN A 91 17.474 17.452 0.154 1.00 0.00 C ATOM 1349 CD GLN A 91 16.953 18.449 -0.883 1.00 0.00 C ATOM 1350 OE1 GLN A 91 16.037 18.150 -1.624 1.00 0.00 O ATOM 1351 NE2 GLN A 91 17.502 19.630 -0.968 1.00 0.00 N ATOM 0 H GLN A 91 14.661 16.957 2.620 1.00 0.00 H new ATOM 0 HA GLN A 91 17.392 15.767 2.059 1.00 0.00 H new ATOM 0 HB2 GLN A 91 16.031 18.400 1.456 1.00 0.00 H new ATOM 0 HB3 GLN A 91 17.683 18.504 2.032 1.00 0.00 H new ATOM 0 HG2 GLN A 91 18.564 17.438 0.145 1.00 0.00 H new ATOM 0 HG3 GLN A 91 17.141 16.445 -0.095 1.00 0.00 H new ATOM 0 HE21 GLN A 91 18.271 19.881 -0.346 1.00 0.00 H new ATOM 0 HE22 GLN A 91 17.162 20.302 -1.656 1.00 0.00 H new ATOM 1360 N VAL A 92 18.179 16.335 4.330 1.00 0.00 N ATOM 1361 CA VAL A 92 18.556 16.564 5.754 1.00 0.00 C ATOM 1362 C VAL A 92 18.804 18.054 6.004 1.00 0.00 C ATOM 1363 O VAL A 92 19.530 18.703 5.278 1.00 0.00 O ATOM 1364 CB VAL A 92 19.843 15.766 5.957 1.00 0.00 C ATOM 1365 CG1 VAL A 92 19.563 14.279 5.736 1.00 0.00 C ATOM 1366 CG2 VAL A 92 20.898 16.239 4.953 1.00 0.00 C ATOM 0 H VAL A 92 18.829 15.758 3.796 1.00 0.00 H new ATOM 0 HA VAL A 92 17.771 16.253 6.443 1.00 0.00 H new ATOM 0 HB VAL A 92 20.209 15.920 6.972 1.00 0.00 H new ATOM 0 HG11 VAL A 92 20.482 13.710 5.881 1.00 0.00 H new ATOM 0 HG12 VAL A 92 18.811 13.941 6.448 1.00 0.00 H new ATOM 0 HG13 VAL A 92 19.197 14.125 4.721 1.00 0.00 H new ATOM 0 HG21 VAL A 92 21.817 15.671 5.096 1.00 0.00 H new ATOM 0 HG22 VAL A 92 20.530 16.084 3.939 1.00 0.00 H new ATOM 0 HG23 VAL A 92 21.099 17.299 5.108 1.00 0.00 H new ATOM 1376 N GLY A 93 18.205 18.602 7.026 1.00 0.00 N ATOM 1377 CA GLY A 93 18.407 20.048 7.321 1.00 0.00 C ATOM 1378 C GLY A 93 17.341 20.874 6.598 1.00 0.00 C ATOM 1379 O GLY A 93 17.244 22.072 6.775 1.00 0.00 O ATOM 0 H GLY A 93 17.585 18.110 7.669 1.00 0.00 H new ATOM 0 HA2 GLY A 93 18.349 20.222 8.396 1.00 0.00 H new ATOM 0 HA3 GLY A 93 19.401 20.359 7.001 1.00 0.00 H new ATOM 1383 N MET A 94 16.537 20.243 5.785 1.00 0.00 N ATOM 1384 CA MET A 94 15.478 20.995 5.053 1.00 0.00 C ATOM 1385 C MET A 94 14.151 20.914 5.811 1.00 0.00 C ATOM 1386 O MET A 94 13.837 19.915 6.427 1.00 0.00 O ATOM 1387 CB MET A 94 15.363 20.298 3.696 1.00 0.00 C ATOM 1388 CG MET A 94 14.079 20.748 2.998 1.00 0.00 C ATOM 1389 SD MET A 94 12.712 19.673 3.502 1.00 0.00 S ATOM 1390 CE MET A 94 12.156 19.221 1.840 1.00 0.00 C ATOM 0 H MET A 94 16.568 19.241 5.596 1.00 0.00 H new ATOM 0 HA MET A 94 15.720 22.053 4.949 1.00 0.00 H new ATOM 0 HB2 MET A 94 16.228 20.537 3.078 1.00 0.00 H new ATOM 0 HB3 MET A 94 15.356 19.216 3.830 1.00 0.00 H new ATOM 0 HG2 MET A 94 13.856 21.783 3.255 1.00 0.00 H new ATOM 0 HG3 MET A 94 14.207 20.709 1.916 1.00 0.00 H new ATOM 0 HE1 MET A 94 11.437 18.404 1.906 1.00 0.00 H new ATOM 0 HE2 MET A 94 11.684 20.082 1.367 1.00 0.00 H new ATOM 0 HE3 MET A 94 13.012 18.904 1.244 1.00 0.00 H new ATOM 1400 N ARG A 95 13.370 21.959 5.773 1.00 0.00 N ATOM 1401 CA ARG A 95 12.064 21.942 6.491 1.00 0.00 C ATOM 1402 C ARG A 95 10.961 21.414 5.571 1.00 0.00 C ATOM 1403 O ARG A 95 10.771 21.898 4.473 1.00 0.00 O ATOM 1404 CB ARG A 95 11.799 23.401 6.866 1.00 0.00 C ATOM 1405 CG ARG A 95 11.545 24.216 5.596 1.00 0.00 C ATOM 1406 CD ARG A 95 11.622 25.710 5.924 1.00 0.00 C ATOM 1407 NE ARG A 95 13.078 26.006 6.029 1.00 0.00 N ATOM 1408 CZ ARG A 95 13.589 27.010 5.371 1.00 0.00 C ATOM 1409 NH1 ARG A 95 13.312 27.169 4.105 1.00 0.00 N ATOM 1410 NH2 ARG A 95 14.376 27.855 5.976 1.00 0.00 N ATOM 0 H ARG A 95 13.580 22.824 5.275 1.00 0.00 H new ATOM 0 HA ARG A 95 12.083 21.294 7.367 1.00 0.00 H new ATOM 0 HB2 ARG A 95 10.938 23.466 7.531 1.00 0.00 H new ATOM 0 HB3 ARG A 95 12.652 23.809 7.408 1.00 0.00 H new ATOM 0 HG2 ARG A 95 12.282 23.962 4.834 1.00 0.00 H new ATOM 0 HG3 ARG A 95 10.565 23.973 5.185 1.00 0.00 H new ATOM 0 HD2 ARG A 95 11.152 26.310 5.145 1.00 0.00 H new ATOM 0 HD3 ARG A 95 11.105 25.937 6.856 1.00 0.00 H new ATOM 0 HE ARG A 95 13.676 25.424 6.615 1.00 0.00 H new ATOM 0 HH11 ARG A 95 12.696 26.508 3.631 1.00 0.00 H new ATOM 0 HH12 ARG A 95 13.711 27.954 3.590 1.00 0.00 H new ATOM 0 HH21 ARG A 95 14.593 27.732 6.965 1.00 0.00 H new ATOM 0 HH22 ARG A 95 14.775 28.639 5.460 1.00 0.00 H new ATOM 1424 N PHE A 96 10.231 20.425 6.011 1.00 0.00 N ATOM 1425 CA PHE A 96 9.141 19.868 5.160 1.00 0.00 C ATOM 1426 C PHE A 96 7.777 20.137 5.802 1.00 0.00 C ATOM 1427 O PHE A 96 7.682 20.454 6.971 1.00 0.00 O ATOM 1428 CB PHE A 96 9.416 18.365 5.098 1.00 0.00 C ATOM 1429 CG PHE A 96 8.377 17.697 4.232 1.00 0.00 C ATOM 1430 CD1 PHE A 96 8.494 17.742 2.837 1.00 0.00 C ATOM 1431 CD2 PHE A 96 7.295 17.032 4.821 1.00 0.00 C ATOM 1432 CE1 PHE A 96 7.529 17.122 2.032 1.00 0.00 C ATOM 1433 CE2 PHE A 96 6.331 16.411 4.018 1.00 0.00 C ATOM 1434 CZ PHE A 96 6.448 16.457 2.623 1.00 0.00 C ATOM 0 H PHE A 96 10.342 19.979 6.922 1.00 0.00 H new ATOM 0 HA PHE A 96 9.120 20.321 4.169 1.00 0.00 H new ATOM 0 HB2 PHE A 96 10.412 18.183 4.694 1.00 0.00 H new ATOM 0 HB3 PHE A 96 9.396 17.940 6.101 1.00 0.00 H new ATOM 0 HD1 PHE A 96 9.328 18.255 2.382 1.00 0.00 H new ATOM 0 HD2 PHE A 96 7.204 16.998 5.897 1.00 0.00 H new ATOM 0 HE1 PHE A 96 7.619 17.157 0.956 1.00 0.00 H new ATOM 0 HE2 PHE A 96 5.498 15.897 4.474 1.00 0.00 H new ATOM 0 HZ PHE A 96 5.704 15.979 2.003 1.00 0.00 H new ATOM 1444 N LEU A 97 6.720 20.013 5.046 1.00 0.00 N ATOM 1445 CA LEU A 97 5.363 20.262 5.613 1.00 0.00 C ATOM 1446 C LEU A 97 4.543 18.969 5.605 1.00 0.00 C ATOM 1447 O LEU A 97 4.415 18.310 4.592 1.00 0.00 O ATOM 1448 CB LEU A 97 4.732 21.303 4.689 1.00 0.00 C ATOM 1449 CG LEU A 97 3.226 21.368 4.945 1.00 0.00 C ATOM 1450 CD1 LEU A 97 2.970 21.828 6.381 1.00 0.00 C ATOM 1451 CD2 LEU A 97 2.586 22.362 3.972 1.00 0.00 C ATOM 0 H LEU A 97 6.737 19.750 4.061 1.00 0.00 H new ATOM 0 HA LEU A 97 5.403 20.607 6.646 1.00 0.00 H new ATOM 0 HB2 LEU A 97 5.183 22.280 4.863 1.00 0.00 H new ATOM 0 HB3 LEU A 97 4.924 21.044 3.648 1.00 0.00 H new ATOM 0 HG LEU A 97 2.791 20.380 4.797 1.00 0.00 H new ATOM 0 HD11 LEU A 97 1.896 21.874 6.562 1.00 0.00 H new ATOM 0 HD12 LEU A 97 3.425 21.122 7.076 1.00 0.00 H new ATOM 0 HD13 LEU A 97 3.406 22.816 6.530 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.512 22.409 4.154 1.00 0.00 H new ATOM 0 HD22 LEU A 97 3.023 23.349 4.121 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.767 22.036 2.948 1.00 0.00 H new ATOM 1463 N ALA A 98 3.987 18.600 6.727 1.00 0.00 N ATOM 1464 CA ALA A 98 3.178 17.350 6.783 1.00 0.00 C ATOM 1465 C ALA A 98 1.683 17.686 6.806 1.00 0.00 C ATOM 1466 O ALA A 98 1.241 18.535 7.555 1.00 0.00 O ATOM 1467 CB ALA A 98 3.593 16.666 8.085 1.00 0.00 C ATOM 0 H ALA A 98 4.058 19.111 7.607 1.00 0.00 H new ATOM 0 HA ALA A 98 3.346 16.712 5.916 1.00 0.00 H new ATOM 0 HB1 ALA A 98 3.039 15.734 8.199 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.661 16.452 8.059 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.375 17.323 8.927 1.00 0.00 H new ATOM 1473 N GLU A 99 0.904 17.026 5.994 1.00 0.00 N ATOM 1474 CA GLU A 99 -0.560 17.309 5.971 1.00 0.00 C ATOM 1475 C GLU A 99 -1.349 16.038 6.299 1.00 0.00 C ATOM 1476 O GLU A 99 -1.389 15.104 5.522 1.00 0.00 O ATOM 1477 CB GLU A 99 -0.854 17.768 4.543 1.00 0.00 C ATOM 1478 CG GLU A 99 -2.261 18.365 4.478 1.00 0.00 C ATOM 1479 CD GLU A 99 -2.801 18.249 3.051 1.00 0.00 C ATOM 1480 OE1 GLU A 99 -2.015 17.959 2.164 1.00 0.00 O ATOM 1481 OE2 GLU A 99 -3.990 18.451 2.870 1.00 0.00 O ATOM 0 H GLU A 99 1.217 16.303 5.346 1.00 0.00 H new ATOM 0 HA GLU A 99 -0.846 18.060 6.707 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -0.118 18.509 4.229 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -0.772 16.926 3.855 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -2.921 17.843 5.171 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -2.238 19.411 4.785 1.00 0.00 H new ATOM 1488 N THR A 100 -1.975 15.994 7.443 1.00 0.00 N ATOM 1489 CA THR A 100 -2.760 14.783 7.819 1.00 0.00 C ATOM 1490 C THR A 100 -4.219 15.161 8.086 1.00 0.00 C ATOM 1491 O THR A 100 -4.606 16.306 7.967 1.00 0.00 O ATOM 1492 CB THR A 100 -2.097 14.262 9.094 1.00 0.00 C ATOM 1493 OG1 THR A 100 -2.905 13.239 9.661 1.00 0.00 O ATOM 1494 CG2 THR A 100 -1.943 15.407 10.097 1.00 0.00 C ATOM 0 H THR A 100 -1.977 16.744 8.134 1.00 0.00 H new ATOM 0 HA THR A 100 -2.767 14.033 7.029 1.00 0.00 H new ATOM 0 HB THR A 100 -1.113 13.859 8.854 1.00 0.00 H new ATOM 0 HG1 THR A 100 -2.411 12.794 10.381 1.00 0.00 H new ATOM 0 HG21 THR A 100 -1.470 15.034 11.005 1.00 0.00 H new ATOM 0 HG22 THR A 100 -1.324 16.191 9.662 1.00 0.00 H new ATOM 0 HG23 THR A 100 -2.925 15.813 10.340 1.00 0.00 H new ATOM 1502 N ASP A 101 -5.033 14.206 8.446 1.00 0.00 N ATOM 1503 CA ASP A 101 -6.466 14.510 8.720 1.00 0.00 C ATOM 1504 C ASP A 101 -6.603 15.283 10.034 1.00 0.00 C ATOM 1505 O ASP A 101 -7.564 15.993 10.252 1.00 0.00 O ATOM 1506 CB ASP A 101 -7.148 13.145 8.826 1.00 0.00 C ATOM 1507 CG ASP A 101 -8.600 13.333 9.270 1.00 0.00 C ATOM 1508 OD1 ASP A 101 -8.811 13.614 10.438 1.00 0.00 O ATOM 1509 OD2 ASP A 101 -9.478 13.190 8.434 1.00 0.00 O ATOM 0 H ASP A 101 -4.767 13.228 8.562 1.00 0.00 H new ATOM 0 HA ASP A 101 -6.912 15.129 7.941 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -7.114 12.634 7.864 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -6.617 12.516 9.540 1.00 0.00 H new ATOM 1514 N GLN A 102 -5.647 15.150 10.914 1.00 0.00 N ATOM 1515 CA GLN A 102 -5.724 15.877 12.214 1.00 0.00 C ATOM 1516 C GLN A 102 -5.124 17.279 12.074 1.00 0.00 C ATOM 1517 O GLN A 102 -4.775 17.915 13.049 1.00 0.00 O ATOM 1518 CB GLN A 102 -4.899 15.035 13.188 1.00 0.00 C ATOM 1519 CG GLN A 102 -3.449 14.967 12.703 1.00 0.00 C ATOM 1520 CD GLN A 102 -2.550 14.492 13.844 1.00 0.00 C ATOM 1521 OE1 GLN A 102 -1.741 15.246 14.349 1.00 0.00 O ATOM 1522 NE2 GLN A 102 -2.656 13.266 14.277 1.00 0.00 N ATOM 0 H GLN A 102 -4.817 14.570 10.789 1.00 0.00 H new ATOM 0 HA GLN A 102 -6.751 16.005 12.555 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -4.940 15.471 14.186 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -5.317 14.031 13.261 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -3.370 14.286 11.856 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -3.125 15.948 12.355 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -3.334 12.633 13.854 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -2.060 12.941 15.039 1.00 0.00 H new ATOM 1531 N GLY A 103 -4.998 17.763 10.869 1.00 0.00 N ATOM 1532 CA GLY A 103 -4.420 19.122 10.669 1.00 0.00 C ATOM 1533 C GLY A 103 -2.963 18.995 10.219 1.00 0.00 C ATOM 1534 O GLY A 103 -2.224 18.178 10.732 1.00 0.00 O ATOM 0 H GLY A 103 -5.270 17.277 10.015 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -4.996 19.668 9.922 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -4.477 19.693 11.596 1.00 0.00 H new ATOM 1538 N PRO A 104 -2.600 19.813 9.269 1.00 0.00 N ATOM 1539 CA PRO A 104 -1.216 19.796 8.736 1.00 0.00 C ATOM 1540 C PRO A 104 -0.247 20.409 9.748 1.00 0.00 C ATOM 1541 O PRO A 104 -0.594 21.302 10.494 1.00 0.00 O ATOM 1542 CB PRO A 104 -1.305 20.652 7.476 1.00 0.00 C ATOM 1543 CG PRO A 104 -2.479 21.554 7.702 1.00 0.00 C ATOM 1544 CD PRO A 104 -3.436 20.819 8.606 1.00 0.00 C ATOM 0 HA PRO A 104 -0.846 18.791 8.534 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -0.391 21.225 7.323 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -1.447 20.035 6.589 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -2.162 22.492 8.158 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -2.959 21.806 6.756 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -3.899 21.492 9.328 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -4.244 20.356 8.039 1.00 0.00 H new ATOM 1552 N VAL A 105 0.964 19.929 9.781 1.00 0.00 N ATOM 1553 CA VAL A 105 1.954 20.478 10.748 1.00 0.00 C ATOM 1554 C VAL A 105 3.342 20.554 10.103 1.00 0.00 C ATOM 1555 O VAL A 105 3.778 19.623 9.456 1.00 0.00 O ATOM 1556 CB VAL A 105 1.952 19.486 11.912 1.00 0.00 C ATOM 1557 CG1 VAL A 105 0.514 19.069 12.228 1.00 0.00 C ATOM 1558 CG2 VAL A 105 2.768 18.248 11.531 1.00 0.00 C ATOM 0 H VAL A 105 1.311 19.181 9.181 1.00 0.00 H new ATOM 0 HA VAL A 105 1.704 21.489 11.071 1.00 0.00 H new ATOM 0 HB VAL A 105 2.395 19.958 12.789 1.00 0.00 H new ATOM 0 HG11 VAL A 105 0.514 18.362 13.058 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -0.068 19.949 12.501 1.00 0.00 H new ATOM 0 HG13 VAL A 105 0.070 18.598 11.351 1.00 0.00 H new ATOM 0 HG21 VAL A 105 2.766 17.541 12.361 1.00 0.00 H new ATOM 0 HG22 VAL A 105 2.326 17.777 10.653 1.00 0.00 H new ATOM 0 HG23 VAL A 105 3.793 18.543 11.308 1.00 0.00 H new ATOM 1568 N PRO A 106 3.989 21.669 10.305 1.00 0.00 N ATOM 1569 CA PRO A 106 5.345 21.876 9.739 1.00 0.00 C ATOM 1570 C PRO A 106 6.376 21.040 10.505 1.00 0.00 C ATOM 1571 O PRO A 106 6.430 21.064 11.718 1.00 0.00 O ATOM 1572 CB PRO A 106 5.594 23.368 9.945 1.00 0.00 C ATOM 1573 CG PRO A 106 4.718 23.753 11.094 1.00 0.00 C ATOM 1574 CD PRO A 106 3.526 22.830 11.072 1.00 0.00 C ATOM 0 HA PRO A 106 5.425 21.575 8.694 1.00 0.00 H new ATOM 0 HB2 PRO A 106 6.643 23.566 10.165 1.00 0.00 H new ATOM 0 HB3 PRO A 106 5.343 23.937 9.050 1.00 0.00 H new ATOM 0 HG2 PRO A 106 5.258 23.663 12.037 1.00 0.00 H new ATOM 0 HG3 PRO A 106 4.402 24.792 11.006 1.00 0.00 H new ATOM 0 HD2 PRO A 106 3.222 22.547 12.080 1.00 0.00 H new ATOM 0 HD3 PRO A 106 2.664 23.302 10.600 1.00 0.00 H new ATOM 1582 N VAL A 107 7.192 20.300 9.805 1.00 0.00 N ATOM 1583 CA VAL A 107 8.216 19.464 10.495 1.00 0.00 C ATOM 1584 C VAL A 107 9.625 19.932 10.120 1.00 0.00 C ATOM 1585 O VAL A 107 9.798 20.816 9.304 1.00 0.00 O ATOM 1586 CB VAL A 107 7.970 18.041 9.991 1.00 0.00 C ATOM 1587 CG1 VAL A 107 6.471 17.739 10.025 1.00 0.00 C ATOM 1588 CG2 VAL A 107 8.481 17.914 8.554 1.00 0.00 C ATOM 0 H VAL A 107 7.194 20.238 8.787 1.00 0.00 H new ATOM 0 HA VAL A 107 8.140 19.531 11.580 1.00 0.00 H new ATOM 0 HB VAL A 107 8.498 17.334 10.630 1.00 0.00 H new ATOM 0 HG11 VAL A 107 6.296 16.725 9.666 1.00 0.00 H new ATOM 0 HG12 VAL A 107 6.105 17.830 11.048 1.00 0.00 H new ATOM 0 HG13 VAL A 107 5.943 18.447 9.386 1.00 0.00 H new ATOM 0 HG21 VAL A 107 8.306 16.900 8.194 1.00 0.00 H new ATOM 0 HG22 VAL A 107 7.952 18.622 7.916 1.00 0.00 H new ATOM 0 HG23 VAL A 107 9.549 18.129 8.527 1.00 0.00 H new ATOM 1598 N GLU A 108 10.632 19.346 10.709 1.00 0.00 N ATOM 1599 CA GLU A 108 12.028 19.759 10.384 1.00 0.00 C ATOM 1600 C GLU A 108 12.906 18.525 10.162 1.00 0.00 C ATOM 1601 O GLU A 108 13.144 17.750 11.068 1.00 0.00 O ATOM 1602 CB GLU A 108 12.503 20.544 11.608 1.00 0.00 C ATOM 1603 CG GLU A 108 12.764 21.998 11.213 1.00 0.00 C ATOM 1604 CD GLU A 108 12.829 22.866 12.471 1.00 0.00 C ATOM 1605 OE1 GLU A 108 13.906 22.981 13.031 1.00 0.00 O ATOM 1606 OE2 GLU A 108 11.800 23.401 12.851 1.00 0.00 O ATOM 0 H GLU A 108 10.549 18.600 11.400 1.00 0.00 H new ATOM 0 HA GLU A 108 12.082 20.354 9.472 1.00 0.00 H new ATOM 0 HB2 GLU A 108 11.751 20.500 12.396 1.00 0.00 H new ATOM 0 HB3 GLU A 108 13.412 20.097 12.010 1.00 0.00 H new ATOM 0 HG2 GLU A 108 13.699 22.073 10.658 1.00 0.00 H new ATOM 0 HG3 GLU A 108 11.973 22.354 10.553 1.00 0.00 H new ATOM 1613 N ILE A 109 13.388 18.335 8.965 1.00 0.00 N ATOM 1614 CA ILE A 109 14.249 17.150 8.686 1.00 0.00 C ATOM 1615 C ILE A 109 15.664 17.386 9.223 1.00 0.00 C ATOM 1616 O ILE A 109 16.291 18.385 8.930 1.00 0.00 O ATOM 1617 CB ILE A 109 14.267 17.025 7.164 1.00 0.00 C ATOM 1618 CG1 ILE A 109 12.837 17.134 6.628 1.00 0.00 C ATOM 1619 CG2 ILE A 109 14.857 15.669 6.770 1.00 0.00 C ATOM 1620 CD1 ILE A 109 12.810 16.713 5.158 1.00 0.00 C ATOM 0 H ILE A 109 13.223 18.949 8.167 1.00 0.00 H new ATOM 0 HA ILE A 109 13.875 16.245 9.165 1.00 0.00 H new ATOM 0 HB ILE A 109 14.877 17.823 6.740 1.00 0.00 H new ATOM 0 HG12 ILE A 109 12.169 16.500 7.211 1.00 0.00 H new ATOM 0 HG13 ILE A 109 12.476 18.157 6.731 1.00 0.00 H new ATOM 0 HG21 ILE A 109 14.870 15.580 5.684 1.00 0.00 H new ATOM 0 HG22 ILE A 109 15.875 15.590 7.153 1.00 0.00 H new ATOM 0 HG23 ILE A 109 14.247 14.870 7.193 1.00 0.00 H new ATOM 0 HD11 ILE A 109 11.792 16.790 4.776 1.00 0.00 H new ATOM 0 HD12 ILE A 109 13.465 17.366 4.581 1.00 0.00 H new ATOM 0 HD13 ILE A 109 13.154 15.683 5.068 1.00 0.00 H new ATOM 1632 N THR A 110 16.170 16.475 10.008 1.00 0.00 N ATOM 1633 CA THR A 110 17.543 16.648 10.563 1.00 0.00 C ATOM 1634 C THR A 110 18.461 15.528 10.065 1.00 0.00 C ATOM 1635 O THR A 110 19.669 15.655 10.070 1.00 0.00 O ATOM 1636 CB THR A 110 17.372 16.567 12.080 1.00 0.00 C ATOM 1637 OG1 THR A 110 18.636 16.340 12.686 1.00 0.00 O ATOM 1638 CG2 THR A 110 16.423 15.418 12.429 1.00 0.00 C ATOM 0 H THR A 110 15.693 15.619 10.289 1.00 0.00 H new ATOM 0 HA THR A 110 17.996 17.590 10.254 1.00 0.00 H new ATOM 0 HB THR A 110 16.955 17.504 12.449 1.00 0.00 H new ATOM 0 HG1 THR A 110 18.528 16.289 13.659 1.00 0.00 H new ATOM 0 HG21 THR A 110 16.302 15.362 13.511 1.00 0.00 H new ATOM 0 HG22 THR A 110 15.453 15.593 11.964 1.00 0.00 H new ATOM 0 HG23 THR A 110 16.837 14.479 12.061 1.00 0.00 H new ATOM 1646 N ALA A 111 17.897 14.432 9.636 1.00 0.00 N ATOM 1647 CA ALA A 111 18.740 13.307 9.139 1.00 0.00 C ATOM 1648 C ALA A 111 17.902 12.354 8.283 1.00 0.00 C ATOM 1649 O ALA A 111 16.724 12.569 8.069 1.00 0.00 O ATOM 1650 CB ALA A 111 19.236 12.598 10.399 1.00 0.00 C ATOM 0 H ALA A 111 16.891 14.267 9.608 1.00 0.00 H new ATOM 0 HA ALA A 111 19.563 13.654 8.514 1.00 0.00 H new ATOM 0 HB1 ALA A 111 19.866 11.754 10.118 1.00 0.00 H new ATOM 0 HB2 ALA A 111 19.813 13.296 11.006 1.00 0.00 H new ATOM 0 HB3 ALA A 111 18.383 12.238 10.974 1.00 0.00 H new ATOM 1656 N VAL A 112 18.498 11.303 7.790 1.00 0.00 N ATOM 1657 CA VAL A 112 17.735 10.339 6.947 1.00 0.00 C ATOM 1658 C VAL A 112 18.368 8.946 7.031 1.00 0.00 C ATOM 1659 O VAL A 112 19.575 8.802 7.040 1.00 0.00 O ATOM 1660 CB VAL A 112 17.837 10.888 5.525 1.00 0.00 C ATOM 1661 CG1 VAL A 112 19.308 11.057 5.145 1.00 0.00 C ATOM 1662 CG2 VAL A 112 17.170 9.912 4.553 1.00 0.00 C ATOM 0 H VAL A 112 19.480 11.070 7.934 1.00 0.00 H new ATOM 0 HA VAL A 112 16.699 10.238 7.271 1.00 0.00 H new ATOM 0 HB VAL A 112 17.336 11.855 5.474 1.00 0.00 H new ATOM 0 HG11 VAL A 112 19.379 11.449 4.130 1.00 0.00 H new ATOM 0 HG12 VAL A 112 19.785 11.752 5.836 1.00 0.00 H new ATOM 0 HG13 VAL A 112 19.811 10.091 5.197 1.00 0.00 H new ATOM 0 HG21 VAL A 112 17.242 10.303 3.538 1.00 0.00 H new ATOM 0 HG22 VAL A 112 17.672 8.946 4.606 1.00 0.00 H new ATOM 0 HG23 VAL A 112 16.120 9.791 4.821 1.00 0.00 H new ATOM 1672 N GLU A 113 17.563 7.922 7.090 1.00 0.00 N ATOM 1673 CA GLU A 113 18.118 6.540 7.174 1.00 0.00 C ATOM 1674 C GLU A 113 17.487 5.654 6.096 1.00 0.00 C ATOM 1675 O GLU A 113 16.705 6.108 5.285 1.00 0.00 O ATOM 1676 CB GLU A 113 17.738 6.043 8.568 1.00 0.00 C ATOM 1677 CG GLU A 113 18.741 6.576 9.592 1.00 0.00 C ATOM 1678 CD GLU A 113 18.006 7.414 10.640 1.00 0.00 C ATOM 1679 OE1 GLU A 113 16.881 7.072 10.960 1.00 0.00 O ATOM 1680 OE2 GLU A 113 18.583 8.384 11.105 1.00 0.00 O ATOM 0 H GLU A 113 16.545 7.981 7.084 1.00 0.00 H new ATOM 0 HA GLU A 113 19.196 6.516 7.015 1.00 0.00 H new ATOM 0 HB2 GLU A 113 16.732 6.376 8.822 1.00 0.00 H new ATOM 0 HB3 GLU A 113 17.728 4.953 8.587 1.00 0.00 H new ATOM 0 HG2 GLU A 113 19.260 5.747 10.073 1.00 0.00 H new ATOM 0 HG3 GLU A 113 19.499 7.181 9.094 1.00 0.00 H new ATOM 1687 N ASP A 114 17.821 4.392 6.081 1.00 0.00 N ATOM 1688 CA ASP A 114 17.239 3.478 5.057 1.00 0.00 C ATOM 1689 C ASP A 114 15.739 3.292 5.305 1.00 0.00 C ATOM 1690 O ASP A 114 15.316 2.981 6.400 1.00 0.00 O ATOM 1691 CB ASP A 114 17.981 2.154 5.239 1.00 0.00 C ATOM 1692 CG ASP A 114 19.415 2.297 4.729 1.00 0.00 C ATOM 1693 OD1 ASP A 114 19.859 3.424 4.577 1.00 0.00 O ATOM 1694 OD2 ASP A 114 20.047 1.279 4.500 1.00 0.00 O ATOM 0 H ASP A 114 18.472 3.955 6.733 1.00 0.00 H new ATOM 0 HA ASP A 114 17.347 3.869 4.045 1.00 0.00 H new ATOM 0 HB2 ASP A 114 17.985 1.869 6.291 1.00 0.00 H new ATOM 0 HB3 ASP A 114 17.468 1.360 4.696 1.00 0.00 H new ATOM 1699 N ASP A 115 14.933 3.481 4.296 1.00 0.00 N ATOM 1700 CA ASP A 115 13.462 3.315 4.476 1.00 0.00 C ATOM 1701 C ASP A 115 13.017 3.954 5.793 1.00 0.00 C ATOM 1702 O ASP A 115 12.037 3.552 6.391 1.00 0.00 O ATOM 1703 CB ASP A 115 13.235 1.803 4.510 1.00 0.00 C ATOM 1704 CG ASP A 115 13.052 1.283 3.083 1.00 0.00 C ATOM 1705 OD1 ASP A 115 13.327 2.032 2.159 1.00 0.00 O ATOM 1706 OD2 ASP A 115 12.640 0.144 2.937 1.00 0.00 O ATOM 0 H ASP A 115 15.229 3.743 3.356 1.00 0.00 H new ATOM 0 HA ASP A 115 12.891 3.795 3.681 1.00 0.00 H new ATOM 0 HB2 ASP A 115 14.083 1.308 4.983 1.00 0.00 H new ATOM 0 HB3 ASP A 115 12.355 1.570 5.109 1.00 0.00 H new ATOM 1711 N HIS A 116 13.728 4.948 6.250 1.00 0.00 N ATOM 1712 CA HIS A 116 13.348 5.613 7.530 1.00 0.00 C ATOM 1713 C HIS A 116 14.097 6.940 7.677 1.00 0.00 C ATOM 1714 O HIS A 116 15.220 7.080 7.239 1.00 0.00 O ATOM 1715 CB HIS A 116 13.770 4.633 8.625 1.00 0.00 C ATOM 1716 CG HIS A 116 12.987 4.911 9.878 1.00 0.00 C ATOM 1717 ND1 HIS A 116 12.257 3.928 10.527 1.00 0.00 N ATOM 1718 CD2 HIS A 116 12.809 6.056 10.613 1.00 0.00 C ATOM 1719 CE1 HIS A 116 11.680 4.494 11.602 1.00 0.00 C ATOM 1720 NE2 HIS A 116 11.983 5.791 11.701 1.00 0.00 N ATOM 0 H HIS A 116 14.556 5.329 5.793 1.00 0.00 H new ATOM 0 HA HIS A 116 12.284 5.843 7.578 1.00 0.00 H new ATOM 0 HB2 HIS A 116 13.598 3.608 8.296 1.00 0.00 H new ATOM 0 HB3 HIS A 116 14.838 4.730 8.822 1.00 0.00 H new ATOM 0 HD1 HIS A 116 12.173 2.952 10.241 1.00 0.00 H new ATOM 0 HD2 HIS A 116 13.244 7.017 10.382 1.00 0.00 H new ATOM 0 HE1 HIS A 116 11.049 3.964 12.300 1.00 0.00 H new ATOM 1728 N VAL A 117 13.483 7.915 8.291 1.00 0.00 N ATOM 1729 CA VAL A 117 14.161 9.232 8.464 1.00 0.00 C ATOM 1730 C VAL A 117 13.707 9.893 9.769 1.00 0.00 C ATOM 1731 O VAL A 117 12.782 9.442 10.414 1.00 0.00 O ATOM 1732 CB VAL A 117 13.724 10.063 7.259 1.00 0.00 C ATOM 1733 CG1 VAL A 117 14.139 9.352 5.970 1.00 0.00 C ATOM 1734 CG2 VAL A 117 12.203 10.228 7.281 1.00 0.00 C ATOM 0 H VAL A 117 12.542 7.857 8.680 1.00 0.00 H new ATOM 0 HA VAL A 117 15.245 9.135 8.519 1.00 0.00 H new ATOM 0 HB VAL A 117 14.199 11.043 7.302 1.00 0.00 H new ATOM 0 HG11 VAL A 117 13.827 9.945 5.111 1.00 0.00 H new ATOM 0 HG12 VAL A 117 15.222 9.231 5.954 1.00 0.00 H new ATOM 0 HG13 VAL A 117 13.664 8.372 5.926 1.00 0.00 H new ATOM 0 HG21 VAL A 117 11.889 10.821 6.422 1.00 0.00 H new ATOM 0 HG22 VAL A 117 11.730 9.247 7.237 1.00 0.00 H new ATOM 0 HG23 VAL A 117 11.905 10.734 8.199 1.00 0.00 H new ATOM 1744 N VAL A 118 14.348 10.960 10.160 1.00 0.00 N ATOM 1745 CA VAL A 118 13.948 11.647 11.423 1.00 0.00 C ATOM 1746 C VAL A 118 13.377 13.034 11.114 1.00 0.00 C ATOM 1747 O VAL A 118 13.650 13.612 10.081 1.00 0.00 O ATOM 1748 CB VAL A 118 15.238 11.767 12.235 1.00 0.00 C ATOM 1749 CG1 VAL A 118 16.364 12.279 11.335 1.00 0.00 C ATOM 1750 CG2 VAL A 118 15.023 12.747 13.389 1.00 0.00 C ATOM 0 H VAL A 118 15.130 11.386 9.662 1.00 0.00 H new ATOM 0 HA VAL A 118 13.176 11.100 11.963 1.00 0.00 H new ATOM 0 HB VAL A 118 15.509 10.789 12.633 1.00 0.00 H new ATOM 0 HG11 VAL A 118 17.283 12.364 11.915 1.00 0.00 H new ATOM 0 HG12 VAL A 118 16.518 11.581 10.512 1.00 0.00 H new ATOM 0 HG13 VAL A 118 16.095 13.257 10.936 1.00 0.00 H new ATOM 0 HG21 VAL A 118 15.942 12.834 13.969 1.00 0.00 H new ATOM 0 HG22 VAL A 118 14.752 13.725 12.990 1.00 0.00 H new ATOM 0 HG23 VAL A 118 14.222 12.382 14.032 1.00 0.00 H new ATOM 1760 N VAL A 119 12.585 13.571 12.001 1.00 0.00 N ATOM 1761 CA VAL A 119 11.996 14.919 11.756 1.00 0.00 C ATOM 1762 C VAL A 119 11.458 15.511 13.062 1.00 0.00 C ATOM 1763 O VAL A 119 11.055 14.797 13.960 1.00 0.00 O ATOM 1764 CB VAL A 119 10.856 14.678 10.768 1.00 0.00 C ATOM 1765 CG1 VAL A 119 9.688 14.004 11.489 1.00 0.00 C ATOM 1766 CG2 VAL A 119 10.391 16.018 10.190 1.00 0.00 C ATOM 0 H VAL A 119 12.320 13.135 12.884 1.00 0.00 H new ATOM 0 HA VAL A 119 12.731 15.625 11.369 1.00 0.00 H new ATOM 0 HB VAL A 119 11.206 14.034 9.961 1.00 0.00 H new ATOM 0 HG11 VAL A 119 8.875 13.832 10.783 1.00 0.00 H new ATOM 0 HG12 VAL A 119 10.017 13.051 11.902 1.00 0.00 H new ATOM 0 HG13 VAL A 119 9.338 14.648 12.296 1.00 0.00 H new ATOM 0 HG21 VAL A 119 9.578 15.847 9.485 1.00 0.00 H new ATOM 0 HG22 VAL A 119 10.042 16.661 10.998 1.00 0.00 H new ATOM 0 HG23 VAL A 119 11.222 16.500 9.675 1.00 0.00 H new ATOM 1776 N ASP A 120 11.448 16.811 13.174 1.00 0.00 N ATOM 1777 CA ASP A 120 10.936 17.451 14.420 1.00 0.00 C ATOM 1778 C ASP A 120 9.705 18.306 14.104 1.00 0.00 C ATOM 1779 O ASP A 120 9.815 19.404 13.595 1.00 0.00 O ATOM 1780 CB ASP A 120 12.084 18.329 14.914 1.00 0.00 C ATOM 1781 CG ASP A 120 11.750 18.874 16.304 1.00 0.00 C ATOM 1782 OD1 ASP A 120 10.951 18.253 16.985 1.00 0.00 O ATOM 1783 OD2 ASP A 120 12.299 19.902 16.664 1.00 0.00 O ATOM 0 H ASP A 120 11.773 17.459 12.456 1.00 0.00 H new ATOM 0 HA ASP A 120 10.633 16.718 15.168 1.00 0.00 H new ATOM 0 HB2 ASP A 120 13.008 17.751 14.951 1.00 0.00 H new ATOM 0 HB3 ASP A 120 12.251 19.152 14.220 1.00 0.00 H new ATOM 1896 N ASN A 129 -3.556 13.189 25.226 1.00 0.00 N ATOM 1897 CA ASN A 129 -3.909 11.762 25.504 1.00 0.00 C ATOM 1898 C ASN A 129 -4.697 11.148 24.342 1.00 0.00 C ATOM 1899 O ASN A 129 -5.553 11.782 23.755 1.00 0.00 O ATOM 1900 CB ASN A 129 -4.773 11.810 26.765 1.00 0.00 C ATOM 1901 CG ASN A 129 -6.074 12.556 26.463 1.00 0.00 C ATOM 1902 OD1 ASN A 129 -6.206 13.723 26.778 1.00 0.00 O ATOM 1903 ND2 ASN A 129 -7.047 11.929 25.862 1.00 0.00 N ATOM 0 HA ASN A 129 -3.019 11.145 25.630 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -4.992 10.799 27.107 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -4.233 12.309 27.570 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -7.918 12.418 25.656 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -6.937 10.950 25.598 1.00 0.00 H new ATOM 1910 N LEU A 130 -4.413 9.918 24.006 1.00 0.00 N ATOM 1911 CA LEU A 130 -5.142 9.256 22.886 1.00 0.00 C ATOM 1912 C LEU A 130 -5.519 7.823 23.273 1.00 0.00 C ATOM 1913 O LEU A 130 -4.908 7.223 24.135 1.00 0.00 O ATOM 1914 CB LEU A 130 -4.155 9.250 21.718 1.00 0.00 C ATOM 1915 CG LEU A 130 -3.557 10.646 21.541 1.00 0.00 C ATOM 1916 CD1 LEU A 130 -2.294 10.773 22.397 1.00 0.00 C ATOM 1917 CD2 LEU A 130 -3.198 10.864 20.070 1.00 0.00 C ATOM 0 H LEU A 130 -3.705 9.342 24.461 1.00 0.00 H new ATOM 0 HA LEU A 130 -6.068 9.773 22.636 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -3.362 8.525 21.903 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -4.661 8.942 20.803 1.00 0.00 H new ATOM 0 HG LEU A 130 -4.285 11.395 21.853 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -1.868 11.768 22.271 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -2.548 10.617 23.446 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -1.566 10.024 22.085 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -2.772 11.859 19.943 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -2.470 10.115 19.758 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -4.096 10.774 19.459 1.00 0.00 H new ATOM 1929 N LYS A 131 -6.516 7.269 22.639 1.00 0.00 N ATOM 1930 CA LYS A 131 -6.927 5.874 22.970 1.00 0.00 C ATOM 1931 C LYS A 131 -6.719 4.964 21.756 1.00 0.00 C ATOM 1932 O LYS A 131 -7.070 5.309 20.644 1.00 0.00 O ATOM 1933 CB LYS A 131 -8.411 5.967 23.323 1.00 0.00 C ATOM 1934 CG LYS A 131 -8.912 4.599 23.791 1.00 0.00 C ATOM 1935 CD LYS A 131 -10.346 4.729 24.309 1.00 0.00 C ATOM 1936 CE LYS A 131 -10.833 3.369 24.814 1.00 0.00 C ATOM 1937 NZ LYS A 131 -12.013 3.675 25.668 1.00 0.00 N ATOM 0 H LYS A 131 -7.064 7.721 21.907 1.00 0.00 H new ATOM 0 HA LYS A 131 -6.342 5.454 23.789 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -8.563 6.709 24.107 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -8.982 6.298 22.455 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -8.875 3.885 22.968 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -8.264 4.212 24.577 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -10.388 5.463 25.113 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -11.000 5.089 23.514 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -11.104 2.715 23.986 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -10.056 2.858 25.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -12.403 2.790 26.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -11.723 4.294 26.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -12.739 4.155 25.098 1.00 0.00 H new ATOM 1951 N PHE A 132 -6.148 3.807 21.955 1.00 0.00 N ATOM 1952 CA PHE A 132 -5.919 2.885 20.806 1.00 0.00 C ATOM 1953 C PHE A 132 -6.001 1.426 21.262 1.00 0.00 C ATOM 1954 O PHE A 132 -5.668 1.094 22.382 1.00 0.00 O ATOM 1955 CB PHE A 132 -4.509 3.214 20.315 1.00 0.00 C ATOM 1956 CG PHE A 132 -3.532 3.082 21.459 1.00 0.00 C ATOM 1957 CD1 PHE A 132 -3.234 1.819 21.985 1.00 0.00 C ATOM 1958 CD2 PHE A 132 -2.925 4.224 21.993 1.00 0.00 C ATOM 1959 CE1 PHE A 132 -2.328 1.699 23.045 1.00 0.00 C ATOM 1960 CE2 PHE A 132 -2.019 4.104 23.053 1.00 0.00 C ATOM 1961 CZ PHE A 132 -1.721 2.841 23.580 1.00 0.00 C ATOM 0 H PHE A 132 -5.831 3.461 22.861 1.00 0.00 H new ATOM 0 HA PHE A 132 -6.668 3.010 20.024 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -4.229 2.541 19.504 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -4.480 4.227 19.913 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -3.703 0.938 21.573 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -3.156 5.198 21.587 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -2.097 0.725 23.450 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -1.550 4.985 23.465 1.00 0.00 H new ATOM 0 HZ PHE A 132 -1.023 2.748 24.399 1.00 0.00 H new ATOM 1971 N ASN A 133 -6.438 0.551 20.397 1.00 0.00 N ATOM 1972 CA ASN A 133 -6.535 -0.889 20.772 1.00 0.00 C ATOM 1973 C ASN A 133 -5.332 -1.655 20.216 1.00 0.00 C ATOM 1974 O ASN A 133 -4.985 -1.523 19.059 1.00 0.00 O ATOM 1975 CB ASN A 133 -7.832 -1.381 20.126 1.00 0.00 C ATOM 1976 CG ASN A 133 -7.885 -2.908 20.184 1.00 0.00 C ATOM 1977 OD1 ASN A 133 -8.000 -3.562 19.167 1.00 0.00 O ATOM 1978 ND2 ASN A 133 -7.808 -3.508 21.341 1.00 0.00 N ATOM 0 H ASN A 133 -6.732 0.772 19.446 1.00 0.00 H new ATOM 0 HA ASN A 133 -6.539 -1.039 21.852 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -8.692 -0.957 20.644 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -7.886 -1.044 19.091 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -7.844 -4.526 21.391 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -7.711 -2.959 22.195 1.00 0.00 H new ATOM 1985 N VAL A 134 -4.689 -2.447 21.030 1.00 0.00 N ATOM 1986 CA VAL A 134 -3.503 -3.209 20.541 1.00 0.00 C ATOM 1987 C VAL A 134 -3.842 -4.695 20.394 1.00 0.00 C ATOM 1988 O VAL A 134 -4.667 -5.229 21.109 1.00 0.00 O ATOM 1989 CB VAL A 134 -2.435 -3.010 21.614 1.00 0.00 C ATOM 1990 CG1 VAL A 134 -1.970 -1.551 21.609 1.00 0.00 C ATOM 1991 CG2 VAL A 134 -3.020 -3.352 22.985 1.00 0.00 C ATOM 0 H VAL A 134 -4.932 -2.600 22.009 1.00 0.00 H new ATOM 0 HA VAL A 134 -3.171 -2.864 19.562 1.00 0.00 H new ATOM 0 HB VAL A 134 -1.587 -3.663 21.406 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -1.208 -1.409 22.375 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -1.553 -1.305 20.632 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -2.818 -0.898 21.816 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -2.258 -3.210 23.751 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -3.868 -2.700 23.192 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -3.351 -4.390 22.991 1.00 0.00 H new ATOM 2001 N GLU A 135 -3.203 -5.365 19.475 1.00 0.00 N ATOM 2002 CA GLU A 135 -3.477 -6.818 19.279 1.00 0.00 C ATOM 2003 C GLU A 135 -2.160 -7.579 19.101 1.00 0.00 C ATOM 2004 O GLU A 135 -1.359 -7.259 18.246 1.00 0.00 O ATOM 2005 CB GLU A 135 -4.318 -6.895 18.003 1.00 0.00 C ATOM 2006 CG GLU A 135 -5.066 -8.229 17.964 1.00 0.00 C ATOM 2007 CD GLU A 135 -4.059 -9.377 17.889 1.00 0.00 C ATOM 2008 OE1 GLU A 135 -3.511 -9.589 16.820 1.00 0.00 O ATOM 2009 OE2 GLU A 135 -3.854 -10.026 18.903 1.00 0.00 O ATOM 0 H GLU A 135 -2.501 -4.969 18.850 1.00 0.00 H new ATOM 0 HA GLU A 135 -3.991 -7.262 20.131 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -5.027 -6.068 17.972 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -3.677 -6.799 17.126 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -5.689 -8.335 18.852 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -5.733 -8.259 17.102 1.00 0.00 H new ATOM 2016 N VAL A 136 -1.926 -8.579 19.905 1.00 0.00 N ATOM 2017 CA VAL A 136 -0.657 -9.352 19.781 1.00 0.00 C ATOM 2018 C VAL A 136 -0.711 -10.271 18.558 1.00 0.00 C ATOM 2019 O VAL A 136 -1.717 -10.891 18.279 1.00 0.00 O ATOM 2020 CB VAL A 136 -0.564 -10.176 21.066 1.00 0.00 C ATOM 2021 CG1 VAL A 136 0.867 -10.691 21.238 1.00 0.00 C ATOM 2022 CG2 VAL A 136 -0.935 -9.297 22.263 1.00 0.00 C ATOM 0 H VAL A 136 -2.557 -8.894 20.642 1.00 0.00 H new ATOM 0 HA VAL A 136 0.208 -8.702 19.651 1.00 0.00 H new ATOM 0 HB VAL A 136 -1.251 -11.020 21.007 1.00 0.00 H new ATOM 0 HG11 VAL A 136 0.935 -11.279 22.154 1.00 0.00 H new ATOM 0 HG12 VAL A 136 1.134 -11.316 20.386 1.00 0.00 H new ATOM 0 HG13 VAL A 136 1.553 -9.846 21.298 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -0.869 -9.883 23.179 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -0.247 -8.453 22.322 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -1.953 -8.927 22.141 1.00 0.00 H new ATOM 2032 N VAL A 137 0.366 -10.361 17.825 1.00 0.00 N ATOM 2033 CA VAL A 137 0.378 -11.236 16.619 1.00 0.00 C ATOM 2034 C VAL A 137 1.306 -12.435 16.839 1.00 0.00 C ATOM 2035 O VAL A 137 0.953 -13.563 16.560 1.00 0.00 O ATOM 2036 CB VAL A 137 0.905 -10.348 15.491 1.00 0.00 C ATOM 2037 CG1 VAL A 137 0.962 -11.154 14.192 1.00 0.00 C ATOM 2038 CG2 VAL A 137 -0.032 -9.152 15.306 1.00 0.00 C ATOM 0 H VAL A 137 1.238 -9.866 18.010 1.00 0.00 H new ATOM 0 HA VAL A 137 -0.609 -11.640 16.393 1.00 0.00 H new ATOM 0 HB VAL A 137 1.904 -9.994 15.744 1.00 0.00 H new ATOM 0 HG11 VAL A 137 1.338 -10.522 13.388 1.00 0.00 H new ATOM 0 HG12 VAL A 137 1.627 -12.008 14.323 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -0.038 -11.508 13.939 1.00 0.00 H new ATOM 0 HG21 VAL A 137 0.342 -8.518 14.502 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -1.031 -9.508 15.053 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -0.076 -8.577 16.231 1.00 0.00 H new ATOM 2048 N ALA A 138 2.491 -12.201 17.336 1.00 0.00 N ATOM 2049 CA ALA A 138 3.437 -13.331 17.568 1.00 0.00 C ATOM 2050 C ALA A 138 4.452 -12.967 18.656 1.00 0.00 C ATOM 2051 O ALA A 138 4.587 -11.820 19.036 1.00 0.00 O ATOM 2052 CB ALA A 138 4.143 -13.537 16.228 1.00 0.00 C ATOM 0 H ALA A 138 2.844 -11.279 17.591 1.00 0.00 H new ATOM 0 HA ALA A 138 2.924 -14.232 17.905 1.00 0.00 H new ATOM 0 HB1 ALA A 138 4.858 -14.355 16.316 1.00 0.00 H new ATOM 0 HB2 ALA A 138 3.406 -13.780 15.462 1.00 0.00 H new ATOM 0 HB3 ALA A 138 4.668 -12.624 15.949 1.00 0.00 H new ATOM 2058 N ILE A 139 5.169 -13.936 19.155 1.00 0.00 N ATOM 2059 CA ILE A 139 6.179 -13.651 20.215 1.00 0.00 C ATOM 2060 C ILE A 139 7.329 -14.659 20.129 1.00 0.00 C ATOM 2061 O ILE A 139 7.210 -15.787 20.566 1.00 0.00 O ATOM 2062 CB ILE A 139 5.429 -13.809 21.537 1.00 0.00 C ATOM 2063 CG1 ILE A 139 4.160 -12.952 21.509 1.00 0.00 C ATOM 2064 CG2 ILE A 139 6.325 -13.353 22.690 1.00 0.00 C ATOM 2065 CD1 ILE A 139 3.588 -12.841 22.924 1.00 0.00 C ATOM 0 H ILE A 139 5.100 -14.914 18.875 1.00 0.00 H new ATOM 0 HA ILE A 139 6.614 -12.657 20.112 1.00 0.00 H new ATOM 0 HB ILE A 139 5.159 -14.856 21.678 1.00 0.00 H new ATOM 0 HG12 ILE A 139 4.387 -11.960 21.118 1.00 0.00 H new ATOM 0 HG13 ILE A 139 3.423 -13.397 20.841 1.00 0.00 H new ATOM 0 HG21 ILE A 139 5.790 -13.466 23.633 1.00 0.00 H new ATOM 0 HG22 ILE A 139 7.229 -13.961 22.711 1.00 0.00 H new ATOM 0 HG23 ILE A 139 6.595 -12.306 22.549 1.00 0.00 H new ATOM 0 HD11 ILE A 139 2.685 -12.231 22.905 1.00 0.00 H new ATOM 0 HD12 ILE A 139 3.346 -13.836 23.298 1.00 0.00 H new ATOM 0 HD13 ILE A 139 4.325 -12.377 23.579 1.00 0.00 H new ATOM 2077 N ARG A 140 8.440 -14.262 19.572 1.00 0.00 N ATOM 2078 CA ARG A 140 9.593 -15.202 19.460 1.00 0.00 C ATOM 2079 C ARG A 140 10.816 -14.628 20.181 1.00 0.00 C ATOM 2080 O ARG A 140 10.946 -13.432 20.349 1.00 0.00 O ATOM 2081 CB ARG A 140 9.862 -15.322 17.959 1.00 0.00 C ATOM 2082 CG ARG A 140 8.567 -15.697 17.236 1.00 0.00 C ATOM 2083 CD ARG A 140 8.888 -16.136 15.806 1.00 0.00 C ATOM 2084 NE ARG A 140 8.012 -15.297 14.941 1.00 0.00 N ATOM 2085 CZ ARG A 140 8.064 -15.423 13.643 1.00 0.00 C ATOM 2086 NH1 ARG A 140 7.399 -16.378 13.053 1.00 0.00 N ATOM 2087 NH2 ARG A 140 8.780 -14.592 12.935 1.00 0.00 N ATOM 0 H ARG A 140 8.600 -13.330 19.190 1.00 0.00 H new ATOM 0 HA ARG A 140 9.382 -16.170 19.915 1.00 0.00 H new ATOM 0 HB2 ARG A 140 10.247 -14.379 17.571 1.00 0.00 H new ATOM 0 HB3 ARG A 140 10.626 -16.078 17.775 1.00 0.00 H new ATOM 0 HG2 ARG A 140 8.060 -16.501 17.769 1.00 0.00 H new ATOM 0 HG3 ARG A 140 7.886 -14.846 17.222 1.00 0.00 H new ATOM 0 HD2 ARG A 140 9.941 -15.979 15.572 1.00 0.00 H new ATOM 0 HD3 ARG A 140 8.684 -17.197 15.663 1.00 0.00 H new ATOM 0 HE ARG A 140 7.372 -14.624 15.363 1.00 0.00 H new ATOM 0 HH11 ARG A 140 6.838 -17.026 13.606 1.00 0.00 H new ATOM 0 HH12 ARG A 140 7.440 -16.476 12.039 1.00 0.00 H new ATOM 0 HH21 ARG A 140 9.299 -13.845 13.396 1.00 0.00 H new ATOM 0 HH22 ARG A 140 8.821 -14.690 11.921 1.00 0.00 H new ATOM 2101 N GLU A 141 11.715 -15.474 20.607 1.00 0.00 N ATOM 2102 CA GLU A 141 12.930 -14.978 21.317 1.00 0.00 C ATOM 2103 C GLU A 141 13.977 -14.503 20.305 1.00 0.00 C ATOM 2104 O GLU A 141 13.922 -14.836 19.138 1.00 0.00 O ATOM 2105 CB GLU A 141 13.451 -16.182 22.101 1.00 0.00 C ATOM 2106 CG GLU A 141 14.491 -15.715 23.121 1.00 0.00 C ATOM 2107 CD GLU A 141 15.043 -16.924 23.879 1.00 0.00 C ATOM 2108 OE1 GLU A 141 14.366 -17.938 23.910 1.00 0.00 O ATOM 2109 OE2 GLU A 141 16.133 -16.814 24.415 1.00 0.00 O ATOM 0 H GLU A 141 11.661 -16.486 20.494 1.00 0.00 H new ATOM 0 HA GLU A 141 12.710 -14.132 21.968 1.00 0.00 H new ATOM 0 HB2 GLU A 141 12.627 -16.683 22.609 1.00 0.00 H new ATOM 0 HB3 GLU A 141 13.894 -16.909 21.420 1.00 0.00 H new ATOM 0 HG2 GLU A 141 15.301 -15.189 22.615 1.00 0.00 H new ATOM 0 HG3 GLU A 141 14.040 -15.010 23.819 1.00 0.00 H new ATOM 2116 N ALA A 142 14.929 -13.726 20.744 1.00 0.00 N ATOM 2117 CA ALA A 142 15.977 -13.230 19.805 1.00 0.00 C ATOM 2118 C ALA A 142 17.369 -13.619 20.308 1.00 0.00 C ATOM 2119 O ALA A 142 17.587 -13.799 21.489 1.00 0.00 O ATOM 2120 CB ALA A 142 15.814 -11.709 19.804 1.00 0.00 C ATOM 0 H ALA A 142 15.027 -13.413 21.710 1.00 0.00 H new ATOM 0 HA ALA A 142 15.872 -13.655 18.807 1.00 0.00 H new ATOM 0 HB1 ALA A 142 16.551 -11.265 19.135 1.00 0.00 H new ATOM 0 HB2 ALA A 142 14.812 -11.451 19.463 1.00 0.00 H new ATOM 0 HB3 ALA A 142 15.963 -11.326 20.814 1.00 0.00 H new ATOM 2126 N THR A 143 18.316 -13.748 19.417 1.00 0.00 N ATOM 2127 CA THR A 143 19.694 -14.123 19.842 1.00 0.00 C ATOM 2128 C THR A 143 20.378 -12.930 20.515 1.00 0.00 C ATOM 2129 O THR A 143 19.778 -11.892 20.715 1.00 0.00 O ATOM 2130 CB THR A 143 20.422 -14.498 18.550 1.00 0.00 C ATOM 2131 OG1 THR A 143 19.508 -15.122 17.659 1.00 0.00 O ATOM 2132 CG2 THR A 143 21.565 -15.462 18.868 1.00 0.00 C ATOM 0 H THR A 143 18.194 -13.610 18.414 1.00 0.00 H new ATOM 0 HA THR A 143 19.696 -14.942 20.561 1.00 0.00 H new ATOM 0 HB THR A 143 20.827 -13.599 18.086 1.00 0.00 H new ATOM 0 HG1 THR A 143 19.972 -15.362 16.830 1.00 0.00 H new ATOM 0 HG21 THR A 143 22.083 -15.729 17.947 1.00 0.00 H new ATOM 0 HG22 THR A 143 22.265 -14.983 19.552 1.00 0.00 H new ATOM 0 HG23 THR A 143 21.163 -16.363 19.332 1.00 0.00 H new ATOM 2140 N GLU A 144 21.628 -13.067 20.866 1.00 0.00 N ATOM 2141 CA GLU A 144 22.343 -11.938 21.524 1.00 0.00 C ATOM 2142 C GLU A 144 22.298 -10.697 20.631 1.00 0.00 C ATOM 2143 O GLU A 144 22.047 -9.600 21.089 1.00 0.00 O ATOM 2144 CB GLU A 144 23.781 -12.426 21.699 1.00 0.00 C ATOM 2145 CG GLU A 144 24.053 -12.700 23.180 1.00 0.00 C ATOM 2146 CD GLU A 144 25.516 -12.388 23.498 1.00 0.00 C ATOM 2147 OE1 GLU A 144 25.917 -11.253 23.298 1.00 0.00 O ATOM 2148 OE2 GLU A 144 26.212 -13.289 23.937 1.00 0.00 O ATOM 0 H GLU A 144 22.184 -13.911 20.726 1.00 0.00 H new ATOM 0 HA GLU A 144 21.892 -11.660 22.477 1.00 0.00 H new ATOM 0 HB2 GLU A 144 23.942 -13.333 21.115 1.00 0.00 H new ATOM 0 HB3 GLU A 144 24.478 -11.677 21.323 1.00 0.00 H new ATOM 0 HG2 GLU A 144 23.397 -12.089 23.800 1.00 0.00 H new ATOM 0 HG3 GLU A 144 23.833 -13.742 23.414 1.00 0.00 H new ATOM 2155 N GLU A 145 22.537 -10.861 19.360 1.00 0.00 N ATOM 2156 CA GLU A 145 22.504 -9.687 18.441 1.00 0.00 C ATOM 2157 C GLU A 145 21.059 -9.232 18.230 1.00 0.00 C ATOM 2158 O GLU A 145 20.772 -8.052 18.180 1.00 0.00 O ATOM 2159 CB GLU A 145 23.106 -10.188 17.129 1.00 0.00 C ATOM 2160 CG GLU A 145 24.164 -9.196 16.643 1.00 0.00 C ATOM 2161 CD GLU A 145 24.985 -9.835 15.521 1.00 0.00 C ATOM 2162 OE1 GLU A 145 25.351 -10.990 15.665 1.00 0.00 O ATOM 2163 OE2 GLU A 145 25.235 -9.158 14.538 1.00 0.00 O ATOM 0 H GLU A 145 22.753 -11.754 18.918 1.00 0.00 H new ATOM 0 HA GLU A 145 23.055 -8.834 18.838 1.00 0.00 H new ATOM 0 HB2 GLU A 145 23.553 -11.171 17.274 1.00 0.00 H new ATOM 0 HB3 GLU A 145 22.325 -10.300 16.377 1.00 0.00 H new ATOM 0 HG2 GLU A 145 23.686 -8.284 16.284 1.00 0.00 H new ATOM 0 HG3 GLU A 145 24.816 -8.910 17.468 1.00 0.00 H new ATOM 2170 N GLU A 146 20.144 -10.157 18.111 1.00 0.00 N ATOM 2171 CA GLU A 146 18.721 -9.768 17.912 1.00 0.00 C ATOM 2172 C GLU A 146 18.272 -8.862 19.060 1.00 0.00 C ATOM 2173 O GLU A 146 17.581 -7.883 18.859 1.00 0.00 O ATOM 2174 CB GLU A 146 17.943 -11.085 17.924 1.00 0.00 C ATOM 2175 CG GLU A 146 18.318 -11.909 16.691 1.00 0.00 C ATOM 2176 CD GLU A 146 18.198 -11.039 15.439 1.00 0.00 C ATOM 2177 OE1 GLU A 146 17.398 -10.118 15.455 1.00 0.00 O ATOM 2178 OE2 GLU A 146 18.910 -11.307 14.484 1.00 0.00 O ATOM 0 H GLU A 146 20.321 -11.161 18.143 1.00 0.00 H new ATOM 0 HA GLU A 146 18.561 -9.217 16.985 1.00 0.00 H new ATOM 0 HB2 GLU A 146 18.169 -11.645 18.831 1.00 0.00 H new ATOM 0 HB3 GLU A 146 16.871 -10.887 17.930 1.00 0.00 H new ATOM 0 HG2 GLU A 146 19.336 -12.286 16.788 1.00 0.00 H new ATOM 0 HG3 GLU A 146 17.664 -12.777 16.608 1.00 0.00 H new ATOM 2185 N LEU A 147 18.674 -9.174 20.263 1.00 0.00 N ATOM 2186 CA LEU A 147 18.286 -8.322 21.422 1.00 0.00 C ATOM 2187 C LEU A 147 19.113 -7.035 21.407 1.00 0.00 C ATOM 2188 O LEU A 147 18.794 -6.067 22.066 1.00 0.00 O ATOM 2189 CB LEU A 147 18.612 -9.159 22.660 1.00 0.00 C ATOM 2190 CG LEU A 147 17.317 -9.533 23.381 1.00 0.00 C ATOM 2191 CD1 LEU A 147 16.689 -10.753 22.703 1.00 0.00 C ATOM 2192 CD2 LEU A 147 17.628 -9.868 24.841 1.00 0.00 C ATOM 0 H LEU A 147 19.254 -9.981 20.492 1.00 0.00 H new ATOM 0 HA LEU A 147 17.235 -8.034 21.400 1.00 0.00 H new ATOM 0 HB2 LEU A 147 19.152 -10.060 22.370 1.00 0.00 H new ATOM 0 HB3 LEU A 147 19.264 -8.598 23.329 1.00 0.00 H new ATOM 0 HG LEU A 147 16.622 -8.695 23.338 1.00 0.00 H new ATOM 0 HD11 LEU A 147 15.766 -11.020 23.217 1.00 0.00 H new ATOM 0 HD12 LEU A 147 16.470 -10.518 21.662 1.00 0.00 H new ATOM 0 HD13 LEU A 147 17.384 -11.592 22.747 1.00 0.00 H new ATOM 0 HD21 LEU A 147 16.706 -10.135 25.357 1.00 0.00 H new ATOM 0 HD22 LEU A 147 18.323 -10.707 24.882 1.00 0.00 H new ATOM 0 HD23 LEU A 147 18.077 -9.001 25.326 1.00 0.00 H new ATOM 2204 N ALA A 148 20.178 -7.025 20.652 1.00 0.00 N ATOM 2205 CA ALA A 148 21.037 -5.810 20.579 1.00 0.00 C ATOM 2206 C ALA A 148 20.396 -4.769 19.663 1.00 0.00 C ATOM 2207 O ALA A 148 20.190 -3.633 20.041 1.00 0.00 O ATOM 2208 CB ALA A 148 22.343 -6.302 19.967 1.00 0.00 C ATOM 0 H ALA A 148 20.491 -7.810 20.080 1.00 0.00 H new ATOM 0 HA ALA A 148 21.179 -5.342 21.553 1.00 0.00 H new ATOM 0 HB1 ALA A 148 23.039 -5.468 19.876 1.00 0.00 H new ATOM 0 HB2 ALA A 148 22.778 -7.069 20.607 1.00 0.00 H new ATOM 0 HB3 ALA A 148 22.147 -6.721 18.980 1.00 0.00 H new ATOM 2214 N HIS A 149 20.070 -5.157 18.462 1.00 0.00 N ATOM 2215 CA HIS A 149 19.432 -4.202 17.517 1.00 0.00 C ATOM 2216 C HIS A 149 17.949 -4.066 17.860 1.00 0.00 C ATOM 2217 O HIS A 149 17.217 -3.325 17.234 1.00 0.00 O ATOM 2218 CB HIS A 149 19.615 -4.832 16.138 1.00 0.00 C ATOM 2219 CG HIS A 149 21.082 -4.971 15.838 1.00 0.00 C ATOM 2220 ND1 HIS A 149 21.563 -5.108 14.546 1.00 0.00 N ATOM 2221 CD2 HIS A 149 22.187 -4.999 16.653 1.00 0.00 C ATOM 2222 CE1 HIS A 149 22.903 -5.210 14.620 1.00 0.00 C ATOM 2223 NE2 HIS A 149 23.336 -5.150 15.881 1.00 0.00 N ATOM 0 H HIS A 149 20.219 -6.097 18.094 1.00 0.00 H new ATOM 0 HA HIS A 149 19.868 -3.204 17.562 1.00 0.00 H new ATOM 0 HB2 HIS A 149 19.133 -5.809 16.106 1.00 0.00 H new ATOM 0 HB3 HIS A 149 19.135 -4.215 15.378 1.00 0.00 H new ATOM 0 HD2 HIS A 149 22.168 -4.916 17.730 1.00 0.00 H new ATOM 0 HE1 HIS A 149 23.550 -5.326 13.763 1.00 0.00 H new ATOM 0 HE2 HIS A 149 24.301 -5.203 16.209 1.00 0.00 H new ATOM 2231 N GLY A 150 17.506 -4.783 18.855 1.00 0.00 N ATOM 2232 CA GLY A 150 16.071 -4.706 19.252 1.00 0.00 C ATOM 2233 C GLY A 150 15.196 -5.265 18.128 1.00 0.00 C ATOM 2234 O GLY A 150 14.202 -4.677 17.751 1.00 0.00 O ATOM 0 H GLY A 150 18.076 -5.420 19.412 1.00 0.00 H new ATOM 0 HA2 GLY A 150 15.906 -5.271 20.170 1.00 0.00 H new ATOM 0 HA3 GLY A 150 15.796 -3.672 19.460 1.00 0.00 H new ATOM 2238 N HIS A 151 15.555 -6.399 17.590 1.00 0.00 N ATOM 2239 CA HIS A 151 14.742 -6.993 16.492 1.00 0.00 C ATOM 2240 C HIS A 151 15.044 -8.488 16.358 1.00 0.00 C ATOM 2241 O HIS A 151 15.856 -9.034 17.080 1.00 0.00 O ATOM 2242 CB HIS A 151 15.171 -6.243 15.230 1.00 0.00 C ATOM 2243 CG HIS A 151 16.561 -6.667 14.843 1.00 0.00 C ATOM 2244 ND1 HIS A 151 17.110 -6.363 13.607 1.00 0.00 N ATOM 2245 CD2 HIS A 151 17.528 -7.370 15.520 1.00 0.00 C ATOM 2246 CE1 HIS A 151 18.353 -6.877 13.578 1.00 0.00 C ATOM 2247 NE2 HIS A 151 18.658 -7.501 14.719 1.00 0.00 N ATOM 0 H HIS A 151 16.376 -6.939 17.864 1.00 0.00 H new ATOM 0 HA HIS A 151 13.671 -6.902 16.676 1.00 0.00 H new ATOM 0 HB2 HIS A 151 14.476 -6.451 14.416 1.00 0.00 H new ATOM 0 HB3 HIS A 151 15.143 -5.168 15.406 1.00 0.00 H new ATOM 0 HD2 HIS A 151 17.426 -7.761 16.521 1.00 0.00 H new ATOM 0 HE1 HIS A 151 19.023 -6.795 12.735 1.00 0.00 H new ATOM 0 HE2 HIS A 151 19.532 -7.972 14.953 1.00 0.00 H new ATOM 2255 N VAL A 152 14.398 -9.155 15.442 1.00 0.00 N ATOM 2256 CA VAL A 152 14.651 -10.614 15.264 1.00 0.00 C ATOM 2257 C VAL A 152 14.903 -10.931 13.787 1.00 0.00 C ATOM 2258 O VAL A 152 14.249 -10.406 12.909 1.00 0.00 O ATOM 2259 CB VAL A 152 13.374 -11.298 15.750 1.00 0.00 C ATOM 2260 CG1 VAL A 152 12.237 -11.019 14.765 1.00 0.00 C ATOM 2261 CG2 VAL A 152 13.610 -12.808 15.841 1.00 0.00 C ATOM 0 H VAL A 152 13.706 -8.754 14.809 1.00 0.00 H new ATOM 0 HA VAL A 152 15.529 -10.952 15.814 1.00 0.00 H new ATOM 0 HB VAL A 152 13.105 -10.910 16.733 1.00 0.00 H new ATOM 0 HG11 VAL A 152 11.327 -11.507 15.112 1.00 0.00 H new ATOM 0 HG12 VAL A 152 12.069 -9.944 14.698 1.00 0.00 H new ATOM 0 HG13 VAL A 152 12.504 -11.407 13.782 1.00 0.00 H new ATOM 0 HG21 VAL A 152 12.700 -13.298 16.188 1.00 0.00 H new ATOM 0 HG22 VAL A 152 13.878 -13.194 14.858 1.00 0.00 H new ATOM 0 HG23 VAL A 152 14.420 -13.008 16.543 1.00 0.00 H new