USER MOD reduce.3.24.130724 H: found=0, std=0, add=989, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 988 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 2 LYS NZ :NH3+ 144:sc= 2.4 (180deg=0.118) USER MOD Set 1.2: A 127 TYR OH : rot 30:sc= 0.149 USER MOD Single : A 1 VAL N :NH3+ -161:sc= -0.0794 (180deg=-0.603) USER MOD Single : A 5 CYS SG : rot 114:sc= -5.11! USER MOD Single : A 9 THR OG1 : rot 152:sc= 1.57 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -150:sc= 2.28 (180deg=1.3) USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.0132 USER MOD Single : A 38 LYS NZ :NH3+ 160:sc= 1.23 (180deg=-0.0557) USER MOD Single : A 41 CYS SG : rot 180:sc= -1.92 USER MOD Single : A 44 LYS NZ :NH3+ 153:sc= -3.13! (180deg=-4.91!) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= -0.326 K(o=-0.33,f=-2!) USER MOD Single : A 73 LYS NZ :NH3+ -167:sc= -0.0287 (180deg=-0.326) USER MOD Single : A 74 ASN : amide:sc= 0.88 K(o=0.88,f=-0.2!) USER MOD Single : A 79 LYS NZ :NH3+ -109:sc= 0.499 (180deg=0.00496) USER MOD Single : A 83 ASN :FLIP amide:sc= 0.0809 F(o=-1.9!,f=0.081) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot -110:sc= -0.166 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.0334 USER MOD Single : A 96 MET CE :methyl -131:sc= 0 (180deg=-0.391) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0.0422! (180deg=0.0422!) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0.315 USER MOD Single : A 122 ASN : amide:sc= 0.507 K(o=0.51,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 5.757 15.401 -11.697 1.00 0.00 N ATOM 2 CA VAL A 1 5.223 15.629 -10.364 1.00 0.00 C ATOM 3 C VAL A 1 5.821 14.623 -9.386 1.00 0.00 C ATOM 4 O VAL A 1 5.883 13.429 -9.678 1.00 0.00 O ATOM 5 CB VAL A 1 3.683 15.511 -10.344 1.00 0.00 C ATOM 6 CG1 VAL A 1 3.128 15.926 -8.989 1.00 0.00 C ATOM 7 CG2 VAL A 1 3.067 16.343 -11.459 1.00 0.00 C ATOM 0 H1 VAL A 1 5.614 16.251 -12.278 1.00 0.00 H new ATOM 0 H2 VAL A 1 6.774 15.192 -11.633 1.00 0.00 H new ATOM 0 H3 VAL A 1 5.265 14.596 -12.135 1.00 0.00 H new ATOM 0 HA VAL A 1 5.493 16.642 -10.066 1.00 0.00 H new ATOM 0 HB VAL A 1 3.418 14.467 -10.512 1.00 0.00 H new ATOM 0 HG11 VAL A 1 2.042 15.835 -8.997 1.00 0.00 H new ATOM 0 HG12 VAL A 1 3.540 15.280 -8.214 1.00 0.00 H new ATOM 0 HG13 VAL A 1 3.404 16.960 -8.784 1.00 0.00 H new ATOM 0 HG21 VAL A 1 1.982 16.247 -11.428 1.00 0.00 H new ATOM 0 HG22 VAL A 1 3.342 17.389 -11.327 1.00 0.00 H new ATOM 0 HG23 VAL A 1 3.435 15.990 -12.422 1.00 0.00 H new ATOM 17 N LYS A 2 6.270 15.105 -8.238 1.00 0.00 N ATOM 18 CA LYS A 2 6.905 14.247 -7.250 1.00 0.00 C ATOM 19 C LYS A 2 6.576 14.700 -5.834 1.00 0.00 C ATOM 20 O LYS A 2 6.372 15.889 -5.583 1.00 0.00 O ATOM 21 CB LYS A 2 8.421 14.230 -7.463 1.00 0.00 C ATOM 22 CG LYS A 2 9.047 15.615 -7.561 1.00 0.00 C ATOM 23 CD LYS A 2 10.558 15.525 -7.700 1.00 0.00 C ATOM 24 CE LYS A 2 10.959 14.700 -8.915 1.00 0.00 C ATOM 25 NZ LYS A 2 12.393 14.317 -8.880 1.00 0.00 N ATOM 0 H LYS A 2 6.206 16.086 -7.967 1.00 0.00 H new ATOM 0 HA LYS A 2 6.516 13.237 -7.379 1.00 0.00 H new ATOM 0 HB2 LYS A 2 8.887 13.689 -6.640 1.00 0.00 H new ATOM 0 HB3 LYS A 2 8.644 13.676 -8.375 1.00 0.00 H new ATOM 0 HG2 LYS A 2 8.631 16.145 -8.418 1.00 0.00 H new ATOM 0 HG3 LYS A 2 8.794 16.195 -6.673 1.00 0.00 H new ATOM 0 HD2 LYS A 2 10.977 16.528 -7.786 1.00 0.00 H new ATOM 0 HD3 LYS A 2 10.981 15.079 -6.800 1.00 0.00 H new ATOM 0 HE2 LYS A 2 10.345 13.801 -8.961 1.00 0.00 H new ATOM 0 HE3 LYS A 2 10.758 15.270 -9.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 12.507 13.364 -9.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 12.947 14.996 -9.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 12.730 14.323 -7.896 1.00 0.00 H new ATOM 39 N PHE A 3 6.519 13.740 -4.921 1.00 0.00 N ATOM 40 CA PHE A 3 6.234 14.014 -3.518 1.00 0.00 C ATOM 41 C PHE A 3 7.173 13.208 -2.629 1.00 0.00 C ATOM 42 O PHE A 3 7.658 12.147 -3.029 1.00 0.00 O ATOM 43 CB PHE A 3 4.783 13.658 -3.172 1.00 0.00 C ATOM 44 CG PHE A 3 3.752 14.430 -3.947 1.00 0.00 C ATOM 45 CD1 PHE A 3 3.421 15.724 -3.584 1.00 0.00 C ATOM 46 CD2 PHE A 3 3.106 13.857 -5.031 1.00 0.00 C ATOM 47 CE1 PHE A 3 2.467 16.433 -4.289 1.00 0.00 C ATOM 48 CE2 PHE A 3 2.153 14.562 -5.740 1.00 0.00 C ATOM 49 CZ PHE A 3 1.833 15.851 -5.368 1.00 0.00 C ATOM 0 H PHE A 3 6.668 12.753 -5.130 1.00 0.00 H new ATOM 0 HA PHE A 3 6.385 15.080 -3.346 1.00 0.00 H new ATOM 0 HB2 PHE A 3 4.631 12.593 -3.349 1.00 0.00 H new ATOM 0 HB3 PHE A 3 4.624 13.830 -2.108 1.00 0.00 H new ATOM 0 HD1 PHE A 3 3.914 16.185 -2.741 1.00 0.00 H new ATOM 0 HD2 PHE A 3 3.351 12.847 -5.325 1.00 0.00 H new ATOM 0 HE1 PHE A 3 2.218 17.442 -3.996 1.00 0.00 H new ATOM 0 HE2 PHE A 3 1.659 14.105 -6.584 1.00 0.00 H new ATOM 0 HZ PHE A 3 1.088 16.404 -5.920 1.00 0.00 H new ATOM 59 N ALA A 4 7.435 13.716 -1.435 1.00 0.00 N ATOM 60 CA ALA A 4 8.244 12.999 -0.459 1.00 0.00 C ATOM 61 C ALA A 4 7.399 12.630 0.757 1.00 0.00 C ATOM 62 O ALA A 4 6.930 13.505 1.489 1.00 0.00 O ATOM 63 CB ALA A 4 9.451 13.832 -0.047 1.00 0.00 C ATOM 0 H ALA A 4 7.099 14.625 -1.117 1.00 0.00 H new ATOM 0 HA ALA A 4 8.609 12.080 -0.917 1.00 0.00 H new ATOM 0 HB1 ALA A 4 10.043 13.279 0.683 1.00 0.00 H new ATOM 0 HB2 ALA A 4 10.063 14.045 -0.924 1.00 0.00 H new ATOM 0 HB3 ALA A 4 9.113 14.769 0.396 1.00 0.00 H new ATOM 69 N CYS A 5 7.194 11.336 0.958 1.00 0.00 N ATOM 70 CA CYS A 5 6.371 10.847 2.053 1.00 0.00 C ATOM 71 C CYS A 5 7.196 9.944 2.972 1.00 0.00 C ATOM 72 O CYS A 5 8.365 9.680 2.700 1.00 0.00 O ATOM 73 CB CYS A 5 5.164 10.115 1.480 1.00 0.00 C ATOM 74 SG CYS A 5 4.143 11.166 0.420 1.00 0.00 S ATOM 0 H CYS A 5 7.590 10.601 0.372 1.00 0.00 H new ATOM 0 HA CYS A 5 6.015 11.683 2.654 1.00 0.00 H new ATOM 0 HB2 CYS A 5 5.506 9.253 0.907 1.00 0.00 H new ATOM 0 HB3 CYS A 5 4.555 9.732 2.299 1.00 0.00 H new ATOM 0 HG CYS A 5 4.198 10.731 -0.804 1.00 0.00 H new ATOM 80 N ARG A 6 6.603 9.467 4.056 1.00 0.00 N ATOM 81 CA ARG A 6 7.371 8.729 5.052 1.00 0.00 C ATOM 82 C ARG A 6 7.287 7.228 4.808 1.00 0.00 C ATOM 83 O ARG A 6 6.211 6.642 4.822 1.00 0.00 O ATOM 84 CB ARG A 6 6.890 9.074 6.464 1.00 0.00 C ATOM 85 CG ARG A 6 7.690 8.412 7.581 1.00 0.00 C ATOM 86 CD ARG A 6 9.181 8.703 7.464 1.00 0.00 C ATOM 87 NE ARG A 6 9.926 7.539 6.977 1.00 0.00 N ATOM 88 CZ ARG A 6 11.078 7.602 6.305 1.00 0.00 C ATOM 89 NH1 ARG A 6 11.612 8.773 5.984 1.00 0.00 N ATOM 90 NH2 ARG A 6 11.692 6.482 5.951 1.00 0.00 N ATOM 0 H ARG A 6 5.611 9.574 4.268 1.00 0.00 H new ATOM 0 HA ARG A 6 8.416 9.025 4.960 1.00 0.00 H new ATOM 0 HB2 ARG A 6 6.932 10.155 6.595 1.00 0.00 H new ATOM 0 HB3 ARG A 6 5.844 8.782 6.560 1.00 0.00 H new ATOM 0 HG2 ARG A 6 7.326 8.765 8.546 1.00 0.00 H new ATOM 0 HG3 ARG A 6 7.528 7.335 7.554 1.00 0.00 H new ATOM 0 HD2 ARG A 6 9.335 9.543 6.786 1.00 0.00 H new ATOM 0 HD3 ARG A 6 9.570 9.003 8.437 1.00 0.00 H new ATOM 0 HE ARG A 6 9.537 6.615 7.165 1.00 0.00 H new ATOM 0 HH11 ARG A 6 11.142 9.638 6.251 1.00 0.00 H new ATOM 0 HH12 ARG A 6 12.493 8.808 5.470 1.00 0.00 H new ATOM 0 HH21 ARG A 6 11.284 5.579 6.192 1.00 0.00 H new ATOM 0 HH22 ARG A 6 12.572 6.523 5.437 1.00 0.00 H new ATOM 104 N ALA A 7 8.437 6.618 4.581 1.00 0.00 N ATOM 105 CA ALA A 7 8.513 5.188 4.327 1.00 0.00 C ATOM 106 C ALA A 7 8.608 4.402 5.629 1.00 0.00 C ATOM 107 O ALA A 7 9.262 4.836 6.581 1.00 0.00 O ATOM 108 CB ALA A 7 9.710 4.879 3.449 1.00 0.00 C ATOM 0 H ALA A 7 9.339 7.095 4.567 1.00 0.00 H new ATOM 0 HA ALA A 7 7.600 4.887 3.813 1.00 0.00 H new ATOM 0 HB1 ALA A 7 9.758 3.806 3.264 1.00 0.00 H new ATOM 0 HB2 ALA A 7 9.611 5.406 2.500 1.00 0.00 H new ATOM 0 HB3 ALA A 7 10.622 5.202 3.950 1.00 0.00 H new ATOM 114 N ILE A 8 7.953 3.253 5.662 1.00 0.00 N ATOM 115 CA ILE A 8 8.021 2.363 6.812 1.00 0.00 C ATOM 116 C ILE A 8 8.896 1.164 6.462 1.00 0.00 C ATOM 117 O ILE A 8 9.869 0.862 7.155 1.00 0.00 O ATOM 118 CB ILE A 8 6.619 1.884 7.271 1.00 0.00 C ATOM 119 CG1 ILE A 8 5.778 3.051 7.819 1.00 0.00 C ATOM 120 CG2 ILE A 8 6.741 0.793 8.327 1.00 0.00 C ATOM 121 CD1 ILE A 8 5.241 3.997 6.761 1.00 0.00 C ATOM 0 H ILE A 8 7.365 2.912 4.902 1.00 0.00 H new ATOM 0 HA ILE A 8 8.454 2.919 7.644 1.00 0.00 H new ATOM 0 HB ILE A 8 6.111 1.477 6.397 1.00 0.00 H new ATOM 0 HG12 ILE A 8 4.939 2.643 8.382 1.00 0.00 H new ATOM 0 HG13 ILE A 8 6.386 3.621 8.522 1.00 0.00 H new ATOM 0 HG21 ILE A 8 5.746 0.472 8.635 1.00 0.00 H new ATOM 0 HG22 ILE A 8 7.284 -0.056 7.912 1.00 0.00 H new ATOM 0 HG23 ILE A 8 7.280 1.182 9.191 1.00 0.00 H new ATOM 0 HD11 ILE A 8 4.662 4.787 7.239 1.00 0.00 H new ATOM 0 HD12 ILE A 8 6.073 4.439 6.212 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.603 3.446 6.071 1.00 0.00 H new ATOM 133 N THR A 9 8.550 0.490 5.377 1.00 0.00 N ATOM 134 CA THR A 9 9.409 -0.536 4.816 1.00 0.00 C ATOM 135 C THR A 9 10.194 0.070 3.663 1.00 0.00 C ATOM 136 O THR A 9 9.810 1.117 3.139 1.00 0.00 O ATOM 137 CB THR A 9 8.601 -1.751 4.327 1.00 0.00 C ATOM 138 OG1 THR A 9 7.540 -1.317 3.472 1.00 0.00 O ATOM 139 CG2 THR A 9 8.028 -2.529 5.501 1.00 0.00 C ATOM 0 H THR A 9 7.678 0.637 4.868 1.00 0.00 H new ATOM 0 HA THR A 9 10.086 -0.892 5.593 1.00 0.00 H new ATOM 0 HB THR A 9 9.271 -2.407 3.772 1.00 0.00 H new ATOM 0 HG1 THR A 9 7.325 -2.027 2.831 1.00 0.00 H new ATOM 0 HG21 THR A 9 7.461 -3.383 5.130 1.00 0.00 H new ATOM 0 HG22 THR A 9 8.841 -2.881 6.136 1.00 0.00 H new ATOM 0 HG23 THR A 9 7.370 -1.881 6.081 1.00 0.00 H new ATOM 147 N ARG A 10 11.286 -0.560 3.262 1.00 0.00 N ATOM 148 CA ARG A 10 12.130 0.044 2.242 1.00 0.00 C ATOM 149 C ARG A 10 12.336 -0.861 1.042 1.00 0.00 C ATOM 150 O ARG A 10 11.756 -1.942 0.953 1.00 0.00 O ATOM 151 CB ARG A 10 13.468 0.493 2.823 1.00 0.00 C ATOM 152 CG ARG A 10 13.330 1.709 3.721 1.00 0.00 C ATOM 153 CD ARG A 10 14.648 2.435 3.905 1.00 0.00 C ATOM 154 NE ARG A 10 15.486 1.817 4.922 1.00 0.00 N ATOM 155 CZ ARG A 10 16.711 2.236 5.220 1.00 0.00 C ATOM 156 NH1 ARG A 10 17.303 3.168 4.475 1.00 0.00 N ATOM 157 NH2 ARG A 10 17.358 1.702 6.242 1.00 0.00 N ATOM 0 H ARG A 10 11.603 -1.463 3.614 1.00 0.00 H new ATOM 0 HA ARG A 10 11.598 0.926 1.885 1.00 0.00 H new ATOM 0 HB2 ARG A 10 13.908 -0.327 3.391 1.00 0.00 H new ATOM 0 HB3 ARG A 10 14.156 0.722 2.009 1.00 0.00 H new ATOM 0 HG2 ARG A 10 12.597 2.393 3.294 1.00 0.00 H new ATOM 0 HG3 ARG A 10 12.948 1.399 4.694 1.00 0.00 H new ATOM 0 HD2 ARG A 10 15.185 2.452 2.957 1.00 0.00 H new ATOM 0 HD3 ARG A 10 14.453 3.472 4.180 1.00 0.00 H new ATOM 0 HE ARG A 10 15.112 1.018 5.434 1.00 0.00 H new ATOM 0 HH11 ARG A 10 16.816 3.564 3.671 1.00 0.00 H new ATOM 0 HH12 ARG A 10 18.244 3.486 4.708 1.00 0.00 H new ATOM 0 HH21 ARG A 10 16.916 0.970 6.799 1.00 0.00 H new ATOM 0 HH22 ARG A 10 18.299 2.022 6.473 1.00 0.00 H new ATOM 171 N GLY A 11 13.166 -0.391 0.126 1.00 0.00 N ATOM 172 CA GLY A 11 13.290 -1.010 -1.167 1.00 0.00 C ATOM 173 C GLY A 11 12.948 -0.011 -2.251 1.00 0.00 C ATOM 174 O GLY A 11 12.890 1.192 -1.983 1.00 0.00 O ATOM 0 H GLY A 11 13.765 0.423 0.263 1.00 0.00 H new ATOM 0 HA2 GLY A 11 14.306 -1.379 -1.307 1.00 0.00 H new ATOM 0 HA3 GLY A 11 12.626 -1.872 -1.232 1.00 0.00 H new ATOM 178 N ARG A 12 12.714 -0.480 -3.460 1.00 0.00 N ATOM 179 CA ARG A 12 12.332 0.411 -4.545 1.00 0.00 C ATOM 180 C ARG A 12 11.422 -0.321 -5.515 1.00 0.00 C ATOM 181 O ARG A 12 11.614 -1.510 -5.769 1.00 0.00 O ATOM 182 CB ARG A 12 13.569 0.925 -5.283 1.00 0.00 C ATOM 183 CG ARG A 12 13.312 2.191 -6.082 1.00 0.00 C ATOM 184 CD ARG A 12 14.339 2.373 -7.182 1.00 0.00 C ATOM 185 NE ARG A 12 14.161 1.388 -8.246 1.00 0.00 N ATOM 186 CZ ARG A 12 14.351 1.642 -9.537 1.00 0.00 C ATOM 187 NH1 ARG A 12 14.813 2.825 -9.929 1.00 0.00 N ATOM 188 NH2 ARG A 12 14.096 0.699 -10.435 1.00 0.00 N ATOM 0 H ARG A 12 12.780 -1.465 -3.718 1.00 0.00 H new ATOM 0 HA ARG A 12 11.801 1.264 -4.122 1.00 0.00 H new ATOM 0 HB2 ARG A 12 14.362 1.116 -4.559 1.00 0.00 H new ATOM 0 HB3 ARG A 12 13.931 0.147 -5.955 1.00 0.00 H new ATOM 0 HG2 ARG A 12 12.314 2.151 -6.518 1.00 0.00 H new ATOM 0 HG3 ARG A 12 13.334 3.053 -5.416 1.00 0.00 H new ATOM 0 HD2 ARG A 12 14.256 3.378 -7.597 1.00 0.00 H new ATOM 0 HD3 ARG A 12 15.342 2.282 -6.764 1.00 0.00 H new ATOM 0 HE ARG A 12 13.873 0.446 -7.982 1.00 0.00 H new ATOM 0 HH11 ARG A 12 15.024 3.545 -9.238 1.00 0.00 H new ATOM 0 HH12 ARG A 12 14.956 3.013 -10.921 1.00 0.00 H new ATOM 0 HH21 ARG A 12 13.756 -0.214 -10.133 1.00 0.00 H new ATOM 0 HH22 ARG A 12 14.240 0.887 -11.427 1.00 0.00 H new ATOM 202 N ALA A 13 10.441 0.383 -6.063 1.00 0.00 N ATOM 203 CA ALA A 13 9.501 -0.225 -6.988 1.00 0.00 C ATOM 204 C ALA A 13 8.910 0.815 -7.924 1.00 0.00 C ATOM 205 O ALA A 13 8.815 1.990 -7.577 1.00 0.00 O ATOM 206 CB ALA A 13 8.397 -0.934 -6.225 1.00 0.00 C ATOM 0 H ALA A 13 10.277 1.373 -5.882 1.00 0.00 H new ATOM 0 HA ALA A 13 10.040 -0.956 -7.590 1.00 0.00 H new ATOM 0 HB1 ALA A 13 7.699 -1.385 -6.930 1.00 0.00 H new ATOM 0 HB2 ALA A 13 8.831 -1.711 -5.596 1.00 0.00 H new ATOM 0 HB3 ALA A 13 7.867 -0.215 -5.600 1.00 0.00 H new ATOM 212 N GLU A 14 8.524 0.381 -9.111 1.00 0.00 N ATOM 213 CA GLU A 14 7.920 1.270 -10.089 1.00 0.00 C ATOM 214 C GLU A 14 6.907 0.518 -10.938 1.00 0.00 C ATOM 215 O GLU A 14 6.908 -0.711 -10.971 1.00 0.00 O ATOM 216 CB GLU A 14 9.003 1.912 -10.974 1.00 0.00 C ATOM 217 CG GLU A 14 10.056 0.943 -11.510 1.00 0.00 C ATOM 218 CD GLU A 14 9.500 -0.072 -12.491 1.00 0.00 C ATOM 219 OE1 GLU A 14 9.095 0.329 -13.604 1.00 0.00 O ATOM 220 OE2 GLU A 14 9.462 -1.276 -12.159 1.00 0.00 O ATOM 0 H GLU A 14 8.618 -0.586 -9.422 1.00 0.00 H new ATOM 0 HA GLU A 14 7.397 2.065 -9.558 1.00 0.00 H new ATOM 0 HB2 GLU A 14 8.518 2.402 -11.818 1.00 0.00 H new ATOM 0 HB3 GLU A 14 9.506 2.690 -10.400 1.00 0.00 H new ATOM 0 HG2 GLU A 14 10.847 1.512 -11.998 1.00 0.00 H new ATOM 0 HG3 GLU A 14 10.512 0.415 -10.673 1.00 0.00 H new ATOM 227 N GLY A 15 6.022 1.248 -11.589 1.00 0.00 N ATOM 228 CA GLY A 15 5.141 0.631 -12.554 1.00 0.00 C ATOM 229 C GLY A 15 3.798 1.305 -12.619 1.00 0.00 C ATOM 230 O GLY A 15 3.655 2.458 -12.207 1.00 0.00 O ATOM 0 H GLY A 15 5.897 2.253 -11.469 1.00 0.00 H new ATOM 0 HA2 GLY A 15 5.607 0.661 -13.539 1.00 0.00 H new ATOM 0 HA3 GLY A 15 5.005 -0.420 -12.298 1.00 0.00 H new ATOM 234 N GLU A 16 2.821 0.590 -13.155 1.00 0.00 N ATOM 235 CA GLU A 16 1.459 1.083 -13.235 1.00 0.00 C ATOM 236 C GLU A 16 0.878 1.273 -11.837 1.00 0.00 C ATOM 237 O GLU A 16 0.861 0.345 -11.025 1.00 0.00 O ATOM 238 CB GLU A 16 0.602 0.107 -14.041 1.00 0.00 C ATOM 239 CG GLU A 16 -0.864 0.491 -14.128 1.00 0.00 C ATOM 240 CD GLU A 16 -1.680 -0.541 -14.875 1.00 0.00 C ATOM 241 OE1 GLU A 16 -2.055 -1.568 -14.266 1.00 0.00 O ATOM 242 OE2 GLU A 16 -1.929 -0.344 -16.079 1.00 0.00 O ATOM 0 H GLU A 16 2.951 -0.344 -13.544 1.00 0.00 H new ATOM 0 HA GLU A 16 1.462 2.050 -13.738 1.00 0.00 H new ATOM 0 HB2 GLU A 16 1.007 0.033 -15.050 1.00 0.00 H new ATOM 0 HB3 GLU A 16 0.681 -0.884 -13.593 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -1.267 0.612 -13.122 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -0.956 1.456 -14.627 1.00 0.00 H new ATOM 249 N ALA A 17 0.421 2.482 -11.566 1.00 0.00 N ATOM 250 CA ALA A 17 -0.170 2.806 -10.286 1.00 0.00 C ATOM 251 C ALA A 17 -1.614 2.343 -10.242 1.00 0.00 C ATOM 252 O ALA A 17 -2.448 2.794 -11.032 1.00 0.00 O ATOM 253 CB ALA A 17 -0.078 4.301 -10.021 1.00 0.00 C ATOM 0 H ALA A 17 0.450 3.261 -12.224 1.00 0.00 H new ATOM 0 HA ALA A 17 0.384 2.286 -9.504 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -0.527 4.527 -9.054 1.00 0.00 H new ATOM 0 HB2 ALA A 17 0.969 4.606 -10.015 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.609 4.843 -10.804 1.00 0.00 H new ATOM 259 N LEU A 18 -1.893 1.424 -9.338 1.00 0.00 N ATOM 260 CA LEU A 18 -3.240 0.926 -9.146 1.00 0.00 C ATOM 261 C LEU A 18 -3.880 1.686 -7.993 1.00 0.00 C ATOM 262 O LEU A 18 -3.503 1.499 -6.836 1.00 0.00 O ATOM 263 CB LEU A 18 -3.201 -0.575 -8.834 1.00 0.00 C ATOM 264 CG LEU A 18 -4.505 -1.336 -9.074 1.00 0.00 C ATOM 265 CD1 LEU A 18 -4.789 -1.427 -10.563 1.00 0.00 C ATOM 266 CD2 LEU A 18 -4.429 -2.726 -8.460 1.00 0.00 C ATOM 0 H LEU A 18 -1.198 1.005 -8.721 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.825 1.075 -10.053 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.418 -1.033 -9.439 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.914 -0.703 -7.790 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.321 -0.794 -8.595 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -5.720 -1.971 -10.723 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -4.879 -0.423 -10.978 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -3.972 -1.952 -11.058 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.365 -3.255 -8.640 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.607 -3.280 -8.913 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.261 -2.641 -7.386 1.00 0.00 H new ATOM 278 N VAL A 19 -4.835 2.546 -8.303 1.00 0.00 N ATOM 279 CA VAL A 19 -5.430 3.407 -7.296 1.00 0.00 C ATOM 280 C VAL A 19 -6.833 2.939 -6.940 1.00 0.00 C ATOM 281 O VAL A 19 -7.751 2.986 -7.760 1.00 0.00 O ATOM 282 CB VAL A 19 -5.480 4.879 -7.765 1.00 0.00 C ATOM 283 CG1 VAL A 19 -6.066 5.777 -6.687 1.00 0.00 C ATOM 284 CG2 VAL A 19 -4.094 5.358 -8.159 1.00 0.00 C ATOM 0 H VAL A 19 -5.214 2.666 -9.242 1.00 0.00 H new ATOM 0 HA VAL A 19 -4.797 3.347 -6.410 1.00 0.00 H new ATOM 0 HB VAL A 19 -6.130 4.933 -8.639 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -6.089 6.807 -7.044 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -7.080 5.451 -6.453 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -5.450 5.718 -5.790 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -4.147 6.396 -8.487 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.425 5.282 -7.302 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -3.713 4.740 -8.972 1.00 0.00 H new ATOM 294 N THR A 20 -6.984 2.471 -5.716 1.00 0.00 N ATOM 295 CA THR A 20 -8.276 2.061 -5.203 1.00 0.00 C ATOM 296 C THR A 20 -8.662 2.959 -4.034 1.00 0.00 C ATOM 297 O THR A 20 -8.163 2.795 -2.924 1.00 0.00 O ATOM 298 CB THR A 20 -8.246 0.587 -4.749 1.00 0.00 C ATOM 299 OG1 THR A 20 -7.705 -0.228 -5.796 1.00 0.00 O ATOM 300 CG2 THR A 20 -9.643 0.094 -4.393 1.00 0.00 C ATOM 0 H THR A 20 -6.217 2.365 -5.052 1.00 0.00 H new ATOM 0 HA THR A 20 -9.015 2.155 -5.998 1.00 0.00 H new ATOM 0 HB THR A 20 -7.619 0.516 -3.860 1.00 0.00 H new ATOM 0 HG1 THR A 20 -7.685 -1.164 -5.505 1.00 0.00 H new ATOM 0 HG21 THR A 20 -9.592 -0.948 -4.077 1.00 0.00 H new ATOM 0 HG22 THR A 20 -10.047 0.700 -3.582 1.00 0.00 H new ATOM 0 HG23 THR A 20 -10.291 0.177 -5.265 1.00 0.00 H new ATOM 308 N LYS A 21 -9.535 3.926 -4.294 1.00 0.00 N ATOM 309 CA LYS A 21 -9.906 4.906 -3.278 1.00 0.00 C ATOM 310 C LYS A 21 -10.817 4.294 -2.222 1.00 0.00 C ATOM 311 O LYS A 21 -11.061 4.896 -1.177 1.00 0.00 O ATOM 312 CB LYS A 21 -10.599 6.109 -3.914 1.00 0.00 C ATOM 313 CG LYS A 21 -9.748 6.845 -4.936 1.00 0.00 C ATOM 314 CD LYS A 21 -10.403 8.147 -5.363 1.00 0.00 C ATOM 315 CE LYS A 21 -11.793 7.917 -5.934 1.00 0.00 C ATOM 316 NZ LYS A 21 -12.514 9.196 -6.154 1.00 0.00 N ATOM 0 H LYS A 21 -9.997 4.053 -5.194 1.00 0.00 H new ATOM 0 HA LYS A 21 -8.986 5.235 -2.795 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -11.517 5.773 -4.396 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.888 6.806 -3.128 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -8.765 7.051 -4.513 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -9.593 6.210 -5.808 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -10.468 8.819 -4.507 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -9.780 8.640 -6.109 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -11.714 7.377 -6.877 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -12.367 7.288 -5.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -13.458 9.000 -6.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -12.611 9.700 -5.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -11.979 9.786 -6.823 1.00 0.00 H new ATOM 330 N GLU A 22 -11.322 3.104 -2.501 1.00 0.00 N ATOM 331 CA GLU A 22 -12.206 2.419 -1.577 1.00 0.00 C ATOM 332 C GLU A 22 -11.422 1.921 -0.374 1.00 0.00 C ATOM 333 O GLU A 22 -10.374 1.286 -0.516 1.00 0.00 O ATOM 334 CB GLU A 22 -12.913 1.261 -2.278 1.00 0.00 C ATOM 335 CG GLU A 22 -13.627 1.683 -3.552 1.00 0.00 C ATOM 336 CD GLU A 22 -14.546 2.870 -3.340 1.00 0.00 C ATOM 337 OE1 GLU A 22 -15.692 2.667 -2.897 1.00 0.00 O ATOM 338 OE2 GLU A 22 -14.116 4.014 -3.599 1.00 0.00 O ATOM 0 H GLU A 22 -11.133 2.592 -3.363 1.00 0.00 H new ATOM 0 HA GLU A 22 -12.964 3.121 -1.229 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -12.183 0.488 -2.517 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -13.636 0.816 -1.594 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -12.887 1.932 -4.313 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -14.207 0.843 -3.934 1.00 0.00 H new ATOM 345 N TYR A 23 -11.925 2.223 0.811 1.00 0.00 N ATOM 346 CA TYR A 23 -11.249 1.859 2.047 1.00 0.00 C ATOM 347 C TYR A 23 -11.469 0.386 2.388 1.00 0.00 C ATOM 348 O TYR A 23 -12.179 0.046 3.333 1.00 0.00 O ATOM 349 CB TYR A 23 -11.705 2.767 3.199 1.00 0.00 C ATOM 350 CG TYR A 23 -13.160 3.185 3.112 1.00 0.00 C ATOM 351 CD1 TYR A 23 -14.176 2.362 3.581 1.00 0.00 C ATOM 352 CD2 TYR A 23 -13.512 4.410 2.557 1.00 0.00 C ATOM 353 CE1 TYR A 23 -15.501 2.742 3.489 1.00 0.00 C ATOM 354 CE2 TYR A 23 -14.834 4.798 2.467 1.00 0.00 C ATOM 355 CZ TYR A 23 -15.823 3.962 2.935 1.00 0.00 C ATOM 356 OH TYR A 23 -17.139 4.344 2.835 1.00 0.00 O ATOM 0 H TYR A 23 -12.804 2.722 0.944 1.00 0.00 H new ATOM 0 HA TYR A 23 -10.179 2.004 1.901 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -11.542 2.249 4.144 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -11.081 3.660 3.214 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -13.926 1.410 4.025 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -12.739 5.069 2.190 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -16.280 2.087 3.849 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -15.091 5.752 2.032 1.00 0.00 H new ATOM 0 HH TYR A 23 -17.192 5.231 2.422 1.00 0.00 H new ATOM 366 N ILE A 24 -10.861 -0.483 1.596 1.00 0.00 N ATOM 367 CA ILE A 24 -10.924 -1.914 1.843 1.00 0.00 C ATOM 368 C ILE A 24 -9.899 -2.311 2.883 1.00 0.00 C ATOM 369 O ILE A 24 -8.874 -1.648 3.061 1.00 0.00 O ATOM 370 CB ILE A 24 -10.710 -2.738 0.555 1.00 0.00 C ATOM 371 CG1 ILE A 24 -9.383 -2.359 -0.109 1.00 0.00 C ATOM 372 CG2 ILE A 24 -11.871 -2.522 -0.408 1.00 0.00 C ATOM 373 CD1 ILE A 24 -9.055 -3.177 -1.340 1.00 0.00 C ATOM 0 H ILE A 24 -10.317 -0.221 0.774 1.00 0.00 H new ATOM 0 HA ILE A 24 -11.926 -2.134 2.212 1.00 0.00 H new ATOM 0 HB ILE A 24 -10.671 -3.795 0.820 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -9.414 -1.305 -0.384 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -8.579 -2.476 0.617 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -11.708 -3.109 -1.312 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -12.800 -2.837 0.066 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -11.936 -1.465 -0.668 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -8.101 -2.848 -1.752 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -8.990 -4.231 -1.070 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -9.838 -3.042 -2.086 1.00 0.00 H new ATOM 385 N SER A 25 -10.199 -3.375 3.584 1.00 0.00 N ATOM 386 CA SER A 25 -9.403 -3.795 4.697 1.00 0.00 C ATOM 387 C SER A 25 -8.774 -5.165 4.445 1.00 0.00 C ATOM 388 O SER A 25 -9.034 -5.804 3.424 1.00 0.00 O ATOM 389 CB SER A 25 -10.301 -3.832 5.922 1.00 0.00 C ATOM 390 OG SER A 25 -10.944 -2.584 6.119 1.00 0.00 O ATOM 0 H SER A 25 -11.004 -3.972 3.395 1.00 0.00 H new ATOM 0 HA SER A 25 -8.582 -3.095 4.849 1.00 0.00 H new ATOM 0 HB2 SER A 25 -11.049 -4.616 5.805 1.00 0.00 H new ATOM 0 HB3 SER A 25 -9.710 -4.084 6.803 1.00 0.00 H new ATOM 0 HG SER A 25 -11.518 -2.633 6.912 1.00 0.00 H new ATOM 396 N PHE A 26 -7.930 -5.594 5.373 1.00 0.00 N ATOM 397 CA PHE A 26 -7.327 -6.916 5.317 1.00 0.00 C ATOM 398 C PHE A 26 -8.286 -7.951 5.894 1.00 0.00 C ATOM 399 O PHE A 26 -9.481 -7.683 6.014 1.00 0.00 O ATOM 400 CB PHE A 26 -5.995 -6.934 6.067 1.00 0.00 C ATOM 401 CG PHE A 26 -4.906 -6.156 5.378 1.00 0.00 C ATOM 402 CD1 PHE A 26 -4.759 -4.794 5.597 1.00 0.00 C ATOM 403 CD2 PHE A 26 -4.030 -6.788 4.509 1.00 0.00 C ATOM 404 CE1 PHE A 26 -3.759 -4.080 4.964 1.00 0.00 C ATOM 405 CE2 PHE A 26 -3.028 -6.079 3.874 1.00 0.00 C ATOM 406 CZ PHE A 26 -2.894 -4.723 4.100 1.00 0.00 C ATOM 0 H PHE A 26 -7.646 -5.039 6.180 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.129 -7.167 4.275 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -6.145 -6.526 7.067 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -5.670 -7.967 6.190 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -5.434 -4.286 6.270 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -4.132 -7.847 4.326 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -3.654 -3.020 5.145 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -2.351 -6.585 3.202 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.114 -4.166 3.602 1.00 0.00 H new ATOM 416 N LEU A 27 -7.759 -9.134 6.227 1.00 0.00 N ATOM 417 CA LEU A 27 -8.569 -10.243 6.727 1.00 0.00 C ATOM 418 C LEU A 27 -9.406 -10.835 5.582 1.00 0.00 C ATOM 419 O LEU A 27 -10.345 -11.601 5.790 1.00 0.00 O ATOM 420 CB LEU A 27 -9.446 -9.779 7.907 1.00 0.00 C ATOM 421 CG LEU A 27 -10.397 -10.824 8.490 1.00 0.00 C ATOM 422 CD1 LEU A 27 -9.631 -12.019 9.031 1.00 0.00 C ATOM 423 CD2 LEU A 27 -11.264 -10.207 9.578 1.00 0.00 C ATOM 0 H LEU A 27 -6.764 -9.346 6.157 1.00 0.00 H new ATOM 0 HA LEU A 27 -7.916 -11.031 7.103 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.791 -9.429 8.704 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -10.036 -8.923 7.580 1.00 0.00 H new ATOM 0 HG LEU A 27 -11.045 -11.176 7.687 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.333 -12.746 9.439 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -9.059 -12.479 8.226 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -8.951 -11.690 9.817 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -11.935 -10.965 9.982 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -10.628 -9.823 10.376 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -11.851 -9.391 9.157 1.00 0.00 H new ATOM 435 N GLY A 28 -9.036 -10.480 4.358 1.00 0.00 N ATOM 436 CA GLY A 28 -9.707 -11.023 3.197 1.00 0.00 C ATOM 437 C GLY A 28 -10.057 -9.964 2.172 1.00 0.00 C ATOM 438 O GLY A 28 -11.172 -9.943 1.654 1.00 0.00 O ATOM 0 H GLY A 28 -8.282 -9.825 4.150 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -9.069 -11.775 2.733 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -10.618 -11.530 3.514 1.00 0.00 H new ATOM 442 N GLY A 29 -9.113 -9.075 1.891 1.00 0.00 N ATOM 443 CA GLY A 29 -9.311 -8.088 0.845 1.00 0.00 C ATOM 444 C GLY A 29 -8.770 -8.585 -0.476 1.00 0.00 C ATOM 445 O GLY A 29 -9.529 -8.925 -1.385 1.00 0.00 O ATOM 0 H GLY A 29 -8.213 -9.019 2.368 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -10.373 -7.865 0.747 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -8.814 -7.157 1.119 1.00 0.00 H new ATOM 449 N ILE A 30 -7.452 -8.622 -0.583 1.00 0.00 N ATOM 450 CA ILE A 30 -6.794 -9.259 -1.710 1.00 0.00 C ATOM 451 C ILE A 30 -6.647 -10.743 -1.403 1.00 0.00 C ATOM 452 O ILE A 30 -6.250 -11.110 -0.294 1.00 0.00 O ATOM 453 CB ILE A 30 -5.398 -8.645 -1.995 1.00 0.00 C ATOM 454 CG1 ILE A 30 -5.497 -7.151 -2.331 1.00 0.00 C ATOM 455 CG2 ILE A 30 -4.708 -9.383 -3.130 1.00 0.00 C ATOM 456 CD1 ILE A 30 -5.690 -6.250 -1.128 1.00 0.00 C ATOM 0 H ILE A 30 -6.814 -8.216 0.102 1.00 0.00 H new ATOM 0 HA ILE A 30 -7.403 -9.102 -2.600 1.00 0.00 H new ATOM 0 HB ILE A 30 -4.805 -8.752 -1.086 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -4.590 -6.848 -2.855 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.328 -7.000 -3.020 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.731 -8.936 -3.313 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -4.583 -10.431 -2.859 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.315 -9.311 -4.033 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -5.750 -5.212 -1.456 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -6.612 -6.522 -0.614 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -4.847 -6.367 -0.447 1.00 0.00 H new ATOM 468 N ASP A 31 -6.992 -11.594 -2.357 1.00 0.00 N ATOM 469 CA ASP A 31 -6.975 -13.030 -2.121 1.00 0.00 C ATOM 470 C ASP A 31 -5.552 -13.567 -2.054 1.00 0.00 C ATOM 471 O ASP A 31 -4.665 -13.114 -2.771 1.00 0.00 O ATOM 472 CB ASP A 31 -7.760 -13.782 -3.191 1.00 0.00 C ATOM 473 CG ASP A 31 -7.858 -15.256 -2.869 1.00 0.00 C ATOM 474 OD1 ASP A 31 -8.655 -15.622 -1.978 1.00 0.00 O ATOM 475 OD2 ASP A 31 -7.128 -16.053 -3.484 1.00 0.00 O ATOM 0 H ASP A 31 -7.285 -11.319 -3.295 1.00 0.00 H new ATOM 0 HA ASP A 31 -7.455 -13.196 -1.157 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -8.761 -13.359 -3.275 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -7.276 -13.651 -4.159 1.00 0.00 H new ATOM 480 N LYS A 32 -5.372 -14.573 -1.213 1.00 0.00 N ATOM 481 CA LYS A 32 -4.060 -15.123 -0.902 1.00 0.00 C ATOM 482 C LYS A 32 -3.602 -16.135 -1.950 1.00 0.00 C ATOM 483 O LYS A 32 -2.441 -16.550 -1.959 1.00 0.00 O ATOM 484 CB LYS A 32 -4.089 -15.801 0.478 1.00 0.00 C ATOM 485 CG LYS A 32 -5.218 -16.818 0.644 1.00 0.00 C ATOM 486 CD LYS A 32 -6.437 -16.209 1.330 1.00 0.00 C ATOM 487 CE LYS A 32 -7.630 -17.161 1.333 1.00 0.00 C ATOM 488 NZ LYS A 32 -8.151 -17.442 -0.037 1.00 0.00 N ATOM 0 H LYS A 32 -6.138 -15.035 -0.723 1.00 0.00 H new ATOM 0 HA LYS A 32 -3.352 -14.294 -0.899 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -3.135 -16.301 0.647 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -4.188 -15.035 1.247 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -5.507 -17.203 -0.334 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -4.859 -17.666 1.227 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -6.181 -15.946 2.356 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -6.713 -15.284 0.823 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -7.339 -18.099 1.805 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -8.428 -16.733 1.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -9.172 -17.633 0.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -7.982 -16.618 -0.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -7.663 -18.272 -0.431 1.00 0.00 H new ATOM 502 N GLU A 33 -4.511 -16.543 -2.820 1.00 0.00 N ATOM 503 CA GLU A 33 -4.219 -17.592 -3.783 1.00 0.00 C ATOM 504 C GLU A 33 -4.142 -17.042 -5.200 1.00 0.00 C ATOM 505 O GLU A 33 -3.265 -17.425 -5.975 1.00 0.00 O ATOM 506 CB GLU A 33 -5.288 -18.678 -3.689 1.00 0.00 C ATOM 507 CG GLU A 33 -5.372 -19.302 -2.309 1.00 0.00 C ATOM 508 CD GLU A 33 -6.620 -20.127 -2.110 1.00 0.00 C ATOM 509 OE1 GLU A 33 -7.653 -19.553 -1.709 1.00 0.00 O ATOM 510 OE2 GLU A 33 -6.571 -21.353 -2.332 1.00 0.00 O ATOM 0 H GLU A 33 -5.456 -16.164 -2.879 1.00 0.00 H new ATOM 0 HA GLU A 33 -3.244 -18.018 -3.546 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -6.257 -18.251 -3.949 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -5.075 -19.456 -4.422 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.497 -19.932 -2.147 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -5.341 -18.513 -1.557 1.00 0.00 H new ATOM 517 N THR A 34 -5.052 -16.142 -5.533 1.00 0.00 N ATOM 518 CA THR A 34 -5.104 -15.578 -6.873 1.00 0.00 C ATOM 519 C THR A 34 -4.474 -14.191 -6.940 1.00 0.00 C ATOM 520 O THR A 34 -4.050 -13.746 -8.004 1.00 0.00 O ATOM 521 CB THR A 34 -6.554 -15.496 -7.370 1.00 0.00 C ATOM 522 OG1 THR A 34 -7.357 -14.770 -6.430 1.00 0.00 O ATOM 523 CG2 THR A 34 -7.128 -16.887 -7.568 1.00 0.00 C ATOM 0 H THR A 34 -5.764 -15.786 -4.896 1.00 0.00 H new ATOM 0 HA THR A 34 -4.529 -16.245 -7.515 1.00 0.00 H new ATOM 0 HB THR A 34 -6.561 -14.974 -8.327 1.00 0.00 H new ATOM 0 HG1 THR A 34 -8.280 -14.722 -6.757 1.00 0.00 H new ATOM 0 HG21 THR A 34 -8.157 -16.809 -7.920 1.00 0.00 H new ATOM 0 HG22 THR A 34 -6.532 -17.425 -8.305 1.00 0.00 H new ATOM 0 HG23 THR A 34 -7.109 -17.427 -6.621 1.00 0.00 H new ATOM 531 N GLY A 35 -4.415 -13.514 -5.801 1.00 0.00 N ATOM 532 CA GLY A 35 -3.926 -12.148 -5.780 1.00 0.00 C ATOM 533 C GLY A 35 -4.953 -11.182 -6.331 1.00 0.00 C ATOM 534 O GLY A 35 -4.637 -10.046 -6.690 1.00 0.00 O ATOM 0 H GLY A 35 -4.696 -13.884 -4.893 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -3.672 -11.867 -4.758 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -3.010 -12.080 -6.366 1.00 0.00 H new ATOM 538 N ILE A 36 -6.189 -11.647 -6.402 1.00 0.00 N ATOM 539 CA ILE A 36 -7.289 -10.851 -6.910 1.00 0.00 C ATOM 540 C ILE A 36 -8.087 -10.269 -5.744 1.00 0.00 C ATOM 541 O ILE A 36 -8.233 -10.915 -4.707 1.00 0.00 O ATOM 542 CB ILE A 36 -8.221 -11.712 -7.796 1.00 0.00 C ATOM 543 CG1 ILE A 36 -7.437 -12.329 -8.963 1.00 0.00 C ATOM 544 CG2 ILE A 36 -9.400 -10.900 -8.316 1.00 0.00 C ATOM 545 CD1 ILE A 36 -6.736 -11.307 -9.832 1.00 0.00 C ATOM 0 H ILE A 36 -6.456 -12.587 -6.109 1.00 0.00 H new ATOM 0 HA ILE A 36 -6.880 -10.041 -7.515 1.00 0.00 H new ATOM 0 HB ILE A 36 -8.617 -12.517 -7.177 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -6.697 -13.024 -8.565 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -8.121 -12.911 -9.581 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -10.034 -11.535 -8.935 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -9.978 -10.519 -7.475 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -9.032 -10.065 -8.912 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -6.203 -11.816 -10.635 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.472 -10.627 -10.260 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -6.027 -10.741 -9.228 1.00 0.00 H new ATOM 557 N VAL A 37 -8.579 -9.051 -5.905 1.00 0.00 N ATOM 558 CA VAL A 37 -9.401 -8.421 -4.883 1.00 0.00 C ATOM 559 C VAL A 37 -10.744 -9.142 -4.760 1.00 0.00 C ATOM 560 O VAL A 37 -11.542 -9.149 -5.699 1.00 0.00 O ATOM 561 CB VAL A 37 -9.648 -6.932 -5.201 1.00 0.00 C ATOM 562 CG1 VAL A 37 -10.419 -6.261 -4.073 1.00 0.00 C ATOM 563 CG2 VAL A 37 -8.332 -6.210 -5.455 1.00 0.00 C ATOM 0 H VAL A 37 -8.423 -8.478 -6.734 1.00 0.00 H new ATOM 0 HA VAL A 37 -8.861 -8.490 -3.939 1.00 0.00 H new ATOM 0 HB VAL A 37 -10.250 -6.874 -6.108 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -10.582 -5.211 -4.318 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -11.381 -6.757 -3.944 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -9.847 -6.333 -3.148 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -8.529 -5.161 -5.677 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -7.701 -6.281 -4.569 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -7.822 -6.670 -6.301 1.00 0.00 H new ATOM 573 N LYS A 38 -10.976 -9.753 -3.604 1.00 0.00 N ATOM 574 CA LYS A 38 -12.218 -10.476 -3.340 1.00 0.00 C ATOM 575 C LYS A 38 -13.324 -9.518 -2.920 1.00 0.00 C ATOM 576 O LYS A 38 -14.512 -9.795 -3.115 1.00 0.00 O ATOM 577 CB LYS A 38 -12.004 -11.521 -2.242 1.00 0.00 C ATOM 578 CG LYS A 38 -11.274 -12.771 -2.705 1.00 0.00 C ATOM 579 CD LYS A 38 -12.135 -13.591 -3.651 1.00 0.00 C ATOM 580 CE LYS A 38 -11.468 -14.903 -4.035 1.00 0.00 C ATOM 581 NZ LYS A 38 -11.183 -15.759 -2.853 1.00 0.00 N ATOM 0 H LYS A 38 -10.315 -9.763 -2.827 1.00 0.00 H new ATOM 0 HA LYS A 38 -12.516 -10.977 -4.261 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -11.441 -11.066 -1.428 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -12.974 -11.809 -1.837 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -10.347 -12.490 -3.204 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -11.000 -13.376 -1.841 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -13.096 -13.797 -3.180 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -12.339 -13.011 -4.551 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -12.111 -15.446 -4.727 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -10.537 -14.694 -4.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -11.053 -16.744 -3.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -10.317 -15.426 -2.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -11.979 -15.707 -2.186 1.00 0.00 H new ATOM 595 N GLU A 39 -12.920 -8.396 -2.343 1.00 0.00 N ATOM 596 CA GLU A 39 -13.854 -7.393 -1.856 1.00 0.00 C ATOM 597 C GLU A 39 -14.591 -6.731 -3.013 1.00 0.00 C ATOM 598 O GLU A 39 -14.033 -6.555 -4.100 1.00 0.00 O ATOM 599 CB GLU A 39 -13.107 -6.342 -1.032 1.00 0.00 C ATOM 600 CG GLU A 39 -13.639 -6.193 0.385 1.00 0.00 C ATOM 601 CD GLU A 39 -15.035 -5.609 0.427 1.00 0.00 C ATOM 602 OE1 GLU A 39 -15.994 -6.299 0.018 1.00 0.00 O ATOM 603 OE2 GLU A 39 -15.186 -4.462 0.891 1.00 0.00 O ATOM 0 H GLU A 39 -11.939 -8.156 -2.200 1.00 0.00 H new ATOM 0 HA GLU A 39 -14.591 -7.886 -1.222 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -12.051 -6.608 -0.989 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -13.173 -5.380 -1.540 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -13.643 -7.168 0.872 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -12.965 -5.554 0.956 1.00 0.00 H new ATOM 610 N ASP A 40 -15.843 -6.366 -2.775 1.00 0.00 N ATOM 611 CA ASP A 40 -16.675 -5.771 -3.813 1.00 0.00 C ATOM 612 C ASP A 40 -16.303 -4.312 -4.024 1.00 0.00 C ATOM 613 O ASP A 40 -16.080 -3.567 -3.066 1.00 0.00 O ATOM 614 CB ASP A 40 -18.161 -5.891 -3.465 1.00 0.00 C ATOM 615 CG ASP A 40 -19.065 -5.415 -4.592 1.00 0.00 C ATOM 616 OD1 ASP A 40 -19.402 -4.211 -4.632 1.00 0.00 O ATOM 617 OD2 ASP A 40 -19.445 -6.245 -5.451 1.00 0.00 O ATOM 0 H ASP A 40 -16.306 -6.471 -1.872 1.00 0.00 H new ATOM 0 HA ASP A 40 -16.496 -6.318 -4.739 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -18.393 -6.930 -3.232 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -18.368 -5.309 -2.567 1.00 0.00 H new ATOM 622 N CYS A 41 -16.230 -3.922 -5.282 1.00 0.00 N ATOM 623 CA CYS A 41 -15.836 -2.582 -5.662 1.00 0.00 C ATOM 624 C CYS A 41 -16.207 -2.362 -7.122 1.00 0.00 C ATOM 625 O CYS A 41 -16.549 -3.319 -7.817 1.00 0.00 O ATOM 626 CB CYS A 41 -14.325 -2.411 -5.454 1.00 0.00 C ATOM 627 SG CYS A 41 -13.679 -0.777 -5.881 1.00 0.00 S ATOM 0 H CYS A 41 -16.444 -4.530 -6.072 1.00 0.00 H new ATOM 0 HA CYS A 41 -16.351 -1.846 -5.045 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -14.091 -2.617 -4.409 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -13.804 -3.159 -6.051 1.00 0.00 H new ATOM 0 HG CYS A 41 -12.398 -0.747 -5.664 1.00 0.00 H new ATOM 633 N GLU A 42 -16.157 -1.121 -7.585 1.00 0.00 N ATOM 634 CA GLU A 42 -16.410 -0.833 -8.990 1.00 0.00 C ATOM 635 C GLU A 42 -15.338 -1.496 -9.845 1.00 0.00 C ATOM 636 O GLU A 42 -15.607 -1.988 -10.940 1.00 0.00 O ATOM 637 CB GLU A 42 -16.432 0.674 -9.242 1.00 0.00 C ATOM 638 CG GLU A 42 -16.710 1.035 -10.690 1.00 0.00 C ATOM 639 CD GLU A 42 -16.823 2.526 -10.909 1.00 0.00 C ATOM 640 OE1 GLU A 42 -17.893 3.089 -10.606 1.00 0.00 O ATOM 641 OE2 GLU A 42 -15.847 3.138 -11.395 1.00 0.00 O ATOM 0 H GLU A 42 -15.945 -0.303 -7.014 1.00 0.00 H new ATOM 0 HA GLU A 42 -17.387 -1.233 -9.260 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -17.192 1.131 -8.608 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -15.473 1.099 -8.946 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -15.912 0.639 -11.318 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -17.635 0.554 -11.009 1.00 0.00 H new ATOM 648 N ILE A 43 -14.121 -1.515 -9.324 1.00 0.00 N ATOM 649 CA ILE A 43 -13.016 -2.192 -9.979 1.00 0.00 C ATOM 650 C ILE A 43 -12.645 -3.460 -9.217 1.00 0.00 C ATOM 651 O ILE A 43 -11.501 -3.664 -8.828 1.00 0.00 O ATOM 652 CB ILE A 43 -11.779 -1.274 -10.120 1.00 0.00 C ATOM 653 CG1 ILE A 43 -11.469 -0.573 -8.791 1.00 0.00 C ATOM 654 CG2 ILE A 43 -11.999 -0.254 -11.229 1.00 0.00 C ATOM 655 CD1 ILE A 43 -10.220 0.282 -8.829 1.00 0.00 C ATOM 0 H ILE A 43 -13.874 -1.065 -8.443 1.00 0.00 H new ATOM 0 HA ILE A 43 -13.345 -2.459 -10.983 1.00 0.00 H new ATOM 0 HB ILE A 43 -10.920 -1.891 -10.385 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -12.318 0.052 -8.514 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -11.359 -1.326 -8.011 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -11.120 0.384 -11.316 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -12.165 -0.773 -12.173 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -12.870 0.358 -10.993 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -10.066 0.745 -7.854 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -9.360 -0.341 -9.075 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -10.333 1.058 -9.586 1.00 0.00 H new ATOM 667 N LYS A 44 -13.636 -4.306 -8.990 1.00 0.00 N ATOM 668 CA LYS A 44 -13.416 -5.572 -8.316 1.00 0.00 C ATOM 669 C LYS A 44 -12.805 -6.567 -9.290 1.00 0.00 C ATOM 670 O LYS A 44 -13.269 -6.706 -10.422 1.00 0.00 O ATOM 671 CB LYS A 44 -14.743 -6.094 -7.739 1.00 0.00 C ATOM 672 CG LYS A 44 -14.676 -7.478 -7.100 1.00 0.00 C ATOM 673 CD LYS A 44 -14.810 -8.612 -8.118 1.00 0.00 C ATOM 674 CE LYS A 44 -16.228 -8.749 -8.667 1.00 0.00 C ATOM 675 NZ LYS A 44 -16.645 -7.588 -9.507 1.00 0.00 N ATOM 0 H LYS A 44 -14.604 -4.137 -9.264 1.00 0.00 H new ATOM 0 HA LYS A 44 -12.721 -5.434 -7.488 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -15.100 -5.384 -6.993 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -15.484 -6.116 -8.538 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -13.729 -7.582 -6.570 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -15.468 -7.568 -6.357 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -14.121 -8.436 -8.944 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -14.514 -9.551 -7.650 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -16.295 -9.661 -9.260 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -16.924 -8.857 -7.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -17.360 -7.897 -10.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -17.048 -6.846 -8.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -15.818 -7.210 -10.012 1.00 0.00 H new ATOM 689 N GLY A 45 -11.762 -7.247 -8.850 1.00 0.00 N ATOM 690 CA GLY A 45 -11.118 -8.234 -9.693 1.00 0.00 C ATOM 691 C GLY A 45 -9.788 -7.756 -10.237 1.00 0.00 C ATOM 692 O GLY A 45 -9.191 -8.414 -11.094 1.00 0.00 O ATOM 0 H GLY A 45 -11.348 -7.135 -7.925 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -10.965 -9.150 -9.122 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.778 -8.483 -10.524 1.00 0.00 H new ATOM 696 N GLU A 46 -9.323 -6.616 -9.745 1.00 0.00 N ATOM 697 CA GLU A 46 -8.044 -6.072 -10.177 1.00 0.00 C ATOM 698 C GLU A 46 -6.904 -7.002 -9.798 1.00 0.00 C ATOM 699 O GLU A 46 -6.954 -7.692 -8.776 1.00 0.00 O ATOM 700 CB GLU A 46 -7.812 -4.685 -9.578 1.00 0.00 C ATOM 701 CG GLU A 46 -8.804 -3.644 -10.065 1.00 0.00 C ATOM 702 CD GLU A 46 -8.911 -3.602 -11.572 1.00 0.00 C ATOM 703 OE1 GLU A 46 -7.996 -3.062 -12.222 1.00 0.00 O ATOM 704 OE2 GLU A 46 -9.903 -4.130 -12.121 1.00 0.00 O ATOM 0 H GLU A 46 -9.811 -6.052 -9.049 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.071 -5.981 -11.263 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.871 -4.752 -8.492 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.802 -4.356 -9.823 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.785 -3.856 -9.641 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -8.504 -2.662 -9.698 1.00 0.00 H new ATOM 711 N SER A 47 -5.885 -7.024 -10.638 1.00 0.00 N ATOM 712 CA SER A 47 -4.733 -7.880 -10.432 1.00 0.00 C ATOM 713 C SER A 47 -3.536 -7.051 -9.978 1.00 0.00 C ATOM 714 O SER A 47 -2.945 -6.311 -10.761 1.00 0.00 O ATOM 715 CB SER A 47 -4.419 -8.629 -11.727 1.00 0.00 C ATOM 716 OG SER A 47 -5.578 -9.293 -12.208 1.00 0.00 O ATOM 0 H SER A 47 -5.833 -6.450 -11.480 1.00 0.00 H new ATOM 0 HA SER A 47 -4.954 -8.607 -9.651 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.054 -7.930 -12.479 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.623 -9.353 -11.552 1.00 0.00 H new ATOM 0 HG SER A 47 -5.363 -9.767 -13.038 1.00 0.00 H new ATOM 722 N VAL A 48 -3.181 -7.181 -8.707 1.00 0.00 N ATOM 723 CA VAL A 48 -2.122 -6.364 -8.124 1.00 0.00 C ATOM 724 C VAL A 48 -0.733 -6.927 -8.428 1.00 0.00 C ATOM 725 O VAL A 48 0.277 -6.356 -8.024 1.00 0.00 O ATOM 726 CB VAL A 48 -2.294 -6.230 -6.598 1.00 0.00 C ATOM 727 CG1 VAL A 48 -3.588 -5.501 -6.266 1.00 0.00 C ATOM 728 CG2 VAL A 48 -2.272 -7.595 -5.925 1.00 0.00 C ATOM 0 H VAL A 48 -3.609 -7.843 -8.060 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.205 -5.379 -8.583 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.456 -5.646 -6.217 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.691 -5.417 -5.184 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.568 -4.505 -6.707 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -4.433 -6.059 -6.668 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.395 -7.472 -4.849 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.085 -8.207 -6.316 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -1.320 -8.085 -6.128 1.00 0.00 H new ATOM 738 N ALA A 49 -0.696 -8.026 -9.169 1.00 0.00 N ATOM 739 CA ALA A 49 0.543 -8.724 -9.464 1.00 0.00 C ATOM 740 C ALA A 49 1.430 -7.913 -10.397 1.00 0.00 C ATOM 741 O ALA A 49 1.324 -8.005 -11.624 1.00 0.00 O ATOM 742 CB ALA A 49 0.253 -10.090 -10.067 1.00 0.00 C ATOM 0 H ALA A 49 -1.524 -8.456 -9.581 1.00 0.00 H new ATOM 0 HA ALA A 49 1.080 -8.859 -8.525 1.00 0.00 H new ATOM 0 HB1 ALA A 49 1.192 -10.600 -10.282 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.328 -10.683 -9.361 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.313 -9.967 -10.990 1.00 0.00 H new ATOM 748 N GLY A 50 2.263 -7.081 -9.804 1.00 0.00 N ATOM 749 CA GLY A 50 3.246 -6.334 -10.562 1.00 0.00 C ATOM 750 C GLY A 50 2.915 -4.857 -10.669 1.00 0.00 C ATOM 751 O GLY A 50 3.575 -4.123 -11.402 1.00 0.00 O ATOM 0 H GLY A 50 2.279 -6.905 -8.799 1.00 0.00 H new ATOM 0 HA2 GLY A 50 4.223 -6.449 -10.092 1.00 0.00 H new ATOM 0 HA3 GLY A 50 3.322 -6.757 -11.564 1.00 0.00 H new ATOM 755 N ARG A 51 1.906 -4.417 -9.934 1.00 0.00 N ATOM 756 CA ARG A 51 1.493 -3.018 -9.973 1.00 0.00 C ATOM 757 C ARG A 51 1.969 -2.272 -8.733 1.00 0.00 C ATOM 758 O ARG A 51 2.509 -2.875 -7.803 1.00 0.00 O ATOM 759 CB ARG A 51 -0.032 -2.892 -10.078 1.00 0.00 C ATOM 760 CG ARG A 51 -0.586 -3.035 -11.488 1.00 0.00 C ATOM 761 CD ARG A 51 -0.426 -4.443 -12.029 1.00 0.00 C ATOM 762 NE ARG A 51 -0.989 -4.573 -13.369 1.00 0.00 N ATOM 763 CZ ARG A 51 -0.896 -5.671 -14.116 1.00 0.00 C ATOM 764 NH1 ARG A 51 -0.246 -6.737 -13.664 1.00 0.00 N ATOM 765 NH2 ARG A 51 -1.444 -5.700 -15.323 1.00 0.00 N ATOM 0 H ARG A 51 1.358 -5.004 -9.305 1.00 0.00 H new ATOM 0 HA ARG A 51 1.950 -2.575 -10.858 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -0.490 -3.651 -9.444 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -0.331 -1.922 -9.681 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -1.642 -2.765 -11.490 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -0.076 -2.334 -12.149 1.00 0.00 H new ATOM 0 HD2 ARG A 51 0.631 -4.706 -12.051 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -0.916 -5.149 -11.358 1.00 0.00 H new ATOM 0 HE ARG A 51 -1.485 -3.771 -13.758 1.00 0.00 H new ATOM 0 HH11 ARG A 51 0.185 -6.717 -12.740 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -0.178 -7.575 -14.241 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -1.937 -4.881 -15.679 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -1.373 -6.541 -15.895 1.00 0.00 H new ATOM 779 N ILE A 52 1.783 -0.961 -8.739 1.00 0.00 N ATOM 780 CA ILE A 52 2.020 -0.151 -7.555 1.00 0.00 C ATOM 781 C ILE A 52 0.682 0.133 -6.886 1.00 0.00 C ATOM 782 O ILE A 52 -0.103 0.945 -7.366 1.00 0.00 O ATOM 783 CB ILE A 52 2.731 1.181 -7.896 1.00 0.00 C ATOM 784 CG1 ILE A 52 4.073 0.917 -8.587 1.00 0.00 C ATOM 785 CG2 ILE A 52 2.935 2.017 -6.637 1.00 0.00 C ATOM 786 CD1 ILE A 52 5.047 0.121 -7.747 1.00 0.00 C ATOM 0 H ILE A 52 1.468 -0.434 -9.554 1.00 0.00 H new ATOM 0 HA ILE A 52 2.677 -0.704 -6.883 1.00 0.00 H new ATOM 0 HB ILE A 52 2.096 1.740 -8.583 1.00 0.00 H new ATOM 0 HG12 ILE A 52 3.892 0.383 -9.520 1.00 0.00 H new ATOM 0 HG13 ILE A 52 4.530 1.871 -8.849 1.00 0.00 H new ATOM 0 HG21 ILE A 52 3.436 2.949 -6.897 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.967 2.238 -6.186 1.00 0.00 H new ATOM 0 HG23 ILE A 52 3.547 1.462 -5.927 1.00 0.00 H new ATOM 0 HD11 ILE A 52 5.973 -0.025 -8.304 1.00 0.00 H new ATOM 0 HD12 ILE A 52 5.259 0.662 -6.825 1.00 0.00 H new ATOM 0 HD13 ILE A 52 4.612 -0.849 -7.506 1.00 0.00 H new ATOM 798 N LEU A 53 0.415 -0.561 -5.793 1.00 0.00 N ATOM 799 CA LEU A 53 -0.900 -0.529 -5.171 1.00 0.00 C ATOM 800 C LEU A 53 -1.032 0.650 -4.212 1.00 0.00 C ATOM 801 O LEU A 53 -0.355 0.709 -3.188 1.00 0.00 O ATOM 802 CB LEU A 53 -1.153 -1.851 -4.441 1.00 0.00 C ATOM 803 CG LEU A 53 -2.536 -2.002 -3.811 1.00 0.00 C ATOM 804 CD1 LEU A 53 -3.629 -1.855 -4.861 1.00 0.00 C ATOM 805 CD2 LEU A 53 -2.651 -3.349 -3.117 1.00 0.00 C ATOM 0 H LEU A 53 1.093 -1.156 -5.316 1.00 0.00 H new ATOM 0 HA LEU A 53 -1.650 -0.400 -5.951 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -1.003 -2.669 -5.146 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -0.403 -1.963 -3.658 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.664 -1.211 -3.072 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -4.605 -1.966 -4.388 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -3.560 -0.870 -5.323 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.506 -2.623 -5.624 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -3.641 -3.445 -2.672 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -2.501 -4.147 -3.844 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -1.893 -3.422 -2.337 1.00 0.00 H new ATOM 817 N VAL A 54 -1.902 1.593 -4.556 1.00 0.00 N ATOM 818 CA VAL A 54 -2.140 2.760 -3.718 1.00 0.00 C ATOM 819 C VAL A 54 -3.601 2.815 -3.281 1.00 0.00 C ATOM 820 O VAL A 54 -4.495 3.093 -4.082 1.00 0.00 O ATOM 821 CB VAL A 54 -1.783 4.073 -4.453 1.00 0.00 C ATOM 822 CG1 VAL A 54 -1.964 5.273 -3.536 1.00 0.00 C ATOM 823 CG2 VAL A 54 -0.363 4.024 -5.000 1.00 0.00 C ATOM 0 H VAL A 54 -2.455 1.571 -5.413 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.496 2.664 -2.844 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.466 4.181 -5.295 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.707 6.185 -4.075 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.002 5.326 -3.207 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.313 5.169 -2.668 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.138 4.960 -5.512 1.00 0.00 H new ATOM 0 HG22 VAL A 54 0.339 3.882 -4.178 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -0.272 3.195 -5.702 1.00 0.00 H new ATOM 833 N PHE A 55 -3.836 2.514 -2.015 1.00 0.00 N ATOM 834 CA PHE A 55 -5.168 2.599 -1.438 1.00 0.00 C ATOM 835 C PHE A 55 -5.093 3.241 -0.055 1.00 0.00 C ATOM 836 O PHE A 55 -4.075 3.122 0.628 1.00 0.00 O ATOM 837 CB PHE A 55 -5.820 1.209 -1.358 1.00 0.00 C ATOM 838 CG PHE A 55 -5.077 0.220 -0.501 1.00 0.00 C ATOM 839 CD1 PHE A 55 -3.961 -0.437 -0.984 1.00 0.00 C ATOM 840 CD2 PHE A 55 -5.504 -0.057 0.788 1.00 0.00 C ATOM 841 CE1 PHE A 55 -3.283 -1.351 -0.200 1.00 0.00 C ATOM 842 CE2 PHE A 55 -4.830 -0.968 1.577 1.00 0.00 C ATOM 843 CZ PHE A 55 -3.717 -1.616 1.083 1.00 0.00 C ATOM 0 H PHE A 55 -3.115 2.206 -1.362 1.00 0.00 H new ATOM 0 HA PHE A 55 -5.789 3.221 -2.082 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -6.833 1.318 -0.970 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -5.907 0.804 -2.366 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -3.615 -0.234 -1.986 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -6.375 0.446 1.181 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -2.413 -1.858 -0.591 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -5.174 -1.173 2.580 1.00 0.00 H new ATOM 0 HZ PHE A 55 -3.187 -2.328 1.698 1.00 0.00 H new ATOM 853 N PRO A 56 -6.147 3.953 0.374 1.00 0.00 N ATOM 854 CA PRO A 56 -6.233 4.469 1.742 1.00 0.00 C ATOM 855 C PRO A 56 -6.282 3.320 2.743 1.00 0.00 C ATOM 856 O PRO A 56 -5.523 3.287 3.716 1.00 0.00 O ATOM 857 CB PRO A 56 -7.547 5.262 1.758 1.00 0.00 C ATOM 858 CG PRO A 56 -7.877 5.500 0.323 1.00 0.00 C ATOM 859 CD PRO A 56 -7.316 4.328 -0.428 1.00 0.00 C ATOM 0 HA PRO A 56 -5.373 5.080 2.019 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -8.339 4.703 2.257 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -7.433 6.202 2.297 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -8.954 5.577 0.178 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -7.440 6.435 -0.028 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -8.035 3.512 -0.499 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -7.037 4.597 -1.447 1.00 0.00 H new ATOM 867 N GLY A 57 -7.174 2.370 2.478 1.00 0.00 N ATOM 868 CA GLY A 57 -7.265 1.175 3.291 1.00 0.00 C ATOM 869 C GLY A 57 -8.027 1.392 4.581 1.00 0.00 C ATOM 870 O GLY A 57 -7.874 2.421 5.236 1.00 0.00 O ATOM 0 H GLY A 57 -7.840 2.410 1.707 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -7.752 0.388 2.716 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -6.260 0.824 3.524 1.00 0.00 H new ATOM 969 N TYR A 66 1.142 -11.427 7.669 1.00 0.00 N ATOM 970 CA TYR A 66 1.305 -12.757 7.060 1.00 0.00 C ATOM 971 C TYR A 66 0.800 -12.798 5.616 1.00 0.00 C ATOM 972 O TYR A 66 1.473 -13.341 4.739 1.00 0.00 O ATOM 973 CB TYR A 66 0.615 -13.851 7.890 1.00 0.00 C ATOM 974 CG TYR A 66 1.167 -13.992 9.289 1.00 0.00 C ATOM 975 CD1 TYR A 66 2.440 -14.503 9.503 1.00 0.00 C ATOM 976 CD2 TYR A 66 0.416 -13.616 10.394 1.00 0.00 C ATOM 977 CE1 TYR A 66 2.951 -14.633 10.780 1.00 0.00 C ATOM 978 CE2 TYR A 66 0.918 -13.742 11.675 1.00 0.00 C ATOM 979 CZ TYR A 66 2.187 -14.249 11.863 1.00 0.00 C ATOM 980 OH TYR A 66 2.690 -14.378 13.139 1.00 0.00 O ATOM 0 HA TYR A 66 2.377 -12.956 7.048 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -0.451 -13.631 7.950 1.00 0.00 H new ATOM 0 HB3 TYR A 66 0.715 -14.805 7.372 1.00 0.00 H new ATOM 0 HD1 TYR A 66 3.041 -14.804 8.657 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -0.578 -13.218 10.250 1.00 0.00 H new ATOM 0 HE1 TYR A 66 3.943 -15.033 10.930 1.00 0.00 H new ATOM 0 HE2 TYR A 66 0.320 -13.445 12.524 1.00 0.00 H new ATOM 0 HH TYR A 66 2.026 -14.061 13.786 1.00 0.00 H new ATOM 990 N VAL A 67 -0.369 -12.215 5.376 1.00 0.00 N ATOM 991 CA VAL A 67 -0.995 -12.225 4.054 1.00 0.00 C ATOM 992 C VAL A 67 -0.051 -11.681 2.981 1.00 0.00 C ATOM 993 O VAL A 67 0.096 -12.274 1.913 1.00 0.00 O ATOM 994 CB VAL A 67 -2.295 -11.393 4.048 1.00 0.00 C ATOM 995 CG1 VAL A 67 -2.987 -11.470 2.695 1.00 0.00 C ATOM 996 CG2 VAL A 67 -3.233 -11.852 5.154 1.00 0.00 C ATOM 0 H VAL A 67 -0.910 -11.723 6.088 1.00 0.00 H new ATOM 0 HA VAL A 67 -1.229 -13.265 3.825 1.00 0.00 H new ATOM 0 HB VAL A 67 -2.028 -10.353 4.233 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.900 -10.875 2.719 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -2.322 -11.083 1.923 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -3.236 -12.508 2.472 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -4.143 -11.252 5.132 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -3.486 -12.901 5.004 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -2.743 -11.732 6.120 1.00 0.00 H new ATOM 1006 N LEU A 68 0.600 -10.564 3.284 1.00 0.00 N ATOM 1007 CA LEU A 68 1.503 -9.918 2.336 1.00 0.00 C ATOM 1008 C LEU A 68 2.670 -10.832 1.956 1.00 0.00 C ATOM 1009 O LEU A 68 3.110 -10.843 0.807 1.00 0.00 O ATOM 1010 CB LEU A 68 2.019 -8.598 2.917 1.00 0.00 C ATOM 1011 CG LEU A 68 0.943 -7.527 3.135 1.00 0.00 C ATOM 1012 CD1 LEU A 68 1.554 -6.259 3.711 1.00 0.00 C ATOM 1013 CD2 LEU A 68 0.218 -7.224 1.829 1.00 0.00 C ATOM 0 H LEU A 68 0.520 -10.085 4.181 1.00 0.00 H new ATOM 0 HA LEU A 68 0.942 -9.710 1.425 1.00 0.00 H new ATOM 0 HB2 LEU A 68 2.506 -8.803 3.870 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.781 -8.197 2.249 1.00 0.00 H new ATOM 0 HG LEU A 68 0.218 -7.913 3.851 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.773 -5.513 3.858 1.00 0.00 H new ATOM 0 HD12 LEU A 68 2.025 -6.484 4.668 1.00 0.00 H new ATOM 0 HD13 LEU A 68 2.303 -5.870 3.021 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.542 -6.462 2.003 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.934 -6.861 1.091 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -0.257 -8.132 1.457 1.00 0.00 H new ATOM 1025 N LEU A 69 3.151 -11.611 2.919 1.00 0.00 N ATOM 1026 CA LEU A 69 4.239 -12.556 2.669 1.00 0.00 C ATOM 1027 C LEU A 69 3.745 -13.697 1.786 1.00 0.00 C ATOM 1028 O LEU A 69 4.450 -14.146 0.878 1.00 0.00 O ATOM 1029 CB LEU A 69 4.784 -13.098 4.000 1.00 0.00 C ATOM 1030 CG LEU A 69 5.930 -14.109 3.882 1.00 0.00 C ATOM 1031 CD1 LEU A 69 7.127 -13.486 3.182 1.00 0.00 C ATOM 1032 CD2 LEU A 69 6.326 -14.624 5.258 1.00 0.00 C ATOM 0 H LEU A 69 2.807 -11.609 3.879 1.00 0.00 H new ATOM 0 HA LEU A 69 5.047 -12.041 2.150 1.00 0.00 H new ATOM 0 HB2 LEU A 69 5.126 -12.256 4.602 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.964 -13.567 4.544 1.00 0.00 H new ATOM 0 HG LEU A 69 5.584 -14.951 3.282 1.00 0.00 H new ATOM 0 HD11 LEU A 69 7.929 -14.221 3.109 1.00 0.00 H new ATOM 0 HD12 LEU A 69 6.837 -13.165 2.182 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.475 -12.625 3.753 1.00 0.00 H new ATOM 0 HD21 LEU A 69 7.141 -15.341 5.158 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.651 -13.789 5.879 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.470 -15.111 5.725 1.00 0.00 H new ATOM 1044 N ASN A 70 2.522 -14.143 2.048 1.00 0.00 N ATOM 1045 CA ASN A 70 1.889 -15.186 1.249 1.00 0.00 C ATOM 1046 C ASN A 70 1.784 -14.734 -0.205 1.00 0.00 C ATOM 1047 O ASN A 70 2.182 -15.454 -1.121 1.00 0.00 O ATOM 1048 CB ASN A 70 0.501 -15.497 1.807 1.00 0.00 C ATOM 1049 CG ASN A 70 -0.102 -16.756 1.213 1.00 0.00 C ATOM 1050 OD1 ASN A 70 0.098 -17.082 0.043 1.00 0.00 O ATOM 1051 ND2 ASN A 70 -0.833 -17.488 2.027 1.00 0.00 N ATOM 0 H ASN A 70 1.945 -13.795 2.814 1.00 0.00 H new ATOM 0 HA ASN A 70 2.497 -16.090 1.293 1.00 0.00 H new ATOM 0 HB2 ASN A 70 0.566 -15.606 2.890 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -0.162 -14.654 1.611 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -1.254 -18.355 1.694 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -0.978 -17.188 2.991 1.00 0.00 H new ATOM 1058 N LEU A 71 1.280 -13.517 -0.398 1.00 0.00 N ATOM 1059 CA LEU A 71 1.110 -12.944 -1.729 1.00 0.00 C ATOM 1060 C LEU A 71 2.435 -12.894 -2.489 1.00 0.00 C ATOM 1061 O LEU A 71 2.489 -13.183 -3.687 1.00 0.00 O ATOM 1062 CB LEU A 71 0.530 -11.530 -1.623 1.00 0.00 C ATOM 1063 CG LEU A 71 -0.832 -11.431 -0.937 1.00 0.00 C ATOM 1064 CD1 LEU A 71 -1.305 -9.986 -0.895 1.00 0.00 C ATOM 1065 CD2 LEU A 71 -1.848 -12.304 -1.647 1.00 0.00 C ATOM 0 H LEU A 71 0.980 -12.904 0.360 1.00 0.00 H new ATOM 0 HA LEU A 71 0.422 -13.585 -2.280 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.238 -10.905 -1.079 1.00 0.00 H new ATOM 0 HB3 LEU A 71 0.443 -11.115 -2.627 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.728 -11.787 0.088 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -2.276 -9.935 -0.403 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -0.585 -9.384 -0.340 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -1.393 -9.602 -1.911 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.812 -12.222 -1.145 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -1.948 -11.977 -2.682 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.515 -13.342 -1.625 1.00 0.00 H new ATOM 1077 N ARG A 72 3.502 -12.529 -1.790 1.00 0.00 N ATOM 1078 CA ARG A 72 4.812 -12.409 -2.411 1.00 0.00 C ATOM 1079 C ARG A 72 5.390 -13.776 -2.752 1.00 0.00 C ATOM 1080 O ARG A 72 5.972 -13.954 -3.822 1.00 0.00 O ATOM 1081 CB ARG A 72 5.754 -11.617 -1.505 1.00 0.00 C ATOM 1082 CG ARG A 72 6.069 -10.223 -2.022 1.00 0.00 C ATOM 1083 CD ARG A 72 7.241 -10.208 -2.988 1.00 0.00 C ATOM 1084 NE ARG A 72 6.982 -10.951 -4.222 1.00 0.00 N ATOM 1085 CZ ARG A 72 6.447 -10.415 -5.322 1.00 0.00 C ATOM 1086 NH1 ARG A 72 6.074 -9.140 -5.338 1.00 0.00 N ATOM 1087 NH2 ARG A 72 6.303 -11.156 -6.414 1.00 0.00 N ATOM 0 H ARG A 72 3.485 -12.311 -0.794 1.00 0.00 H new ATOM 0 HA ARG A 72 4.700 -11.865 -3.349 1.00 0.00 H new ATOM 0 HB2 ARG A 72 5.308 -11.535 -0.514 1.00 0.00 H new ATOM 0 HB3 ARG A 72 6.685 -12.172 -1.390 1.00 0.00 H new ATOM 0 HG2 ARG A 72 5.188 -9.817 -2.519 1.00 0.00 H new ATOM 0 HG3 ARG A 72 6.290 -9.568 -1.179 1.00 0.00 H new ATOM 0 HD2 ARG A 72 7.484 -9.175 -3.238 1.00 0.00 H new ATOM 0 HD3 ARG A 72 8.116 -10.631 -2.494 1.00 0.00 H new ATOM 0 HE ARG A 72 7.226 -11.941 -4.243 1.00 0.00 H new ATOM 0 HH11 ARG A 72 6.195 -8.563 -4.506 1.00 0.00 H new ATOM 0 HH12 ARG A 72 5.666 -8.738 -6.182 1.00 0.00 H new ATOM 0 HH21 ARG A 72 6.601 -12.132 -6.411 1.00 0.00 H new ATOM 0 HH22 ARG A 72 5.895 -10.750 -7.256 1.00 0.00 H new ATOM 1101 N LYS A 73 5.208 -14.747 -1.861 1.00 0.00 N ATOM 1102 CA LYS A 73 5.630 -16.117 -2.141 1.00 0.00 C ATOM 1103 C LYS A 73 4.860 -16.665 -3.336 1.00 0.00 C ATOM 1104 O LYS A 73 5.396 -17.419 -4.151 1.00 0.00 O ATOM 1105 CB LYS A 73 5.404 -17.022 -0.927 1.00 0.00 C ATOM 1106 CG LYS A 73 6.281 -16.680 0.267 1.00 0.00 C ATOM 1107 CD LYS A 73 6.044 -17.646 1.413 1.00 0.00 C ATOM 1108 CE LYS A 73 6.961 -17.354 2.589 1.00 0.00 C ATOM 1109 NZ LYS A 73 8.397 -17.452 2.216 1.00 0.00 N ATOM 0 H LYS A 73 4.775 -14.613 -0.947 1.00 0.00 H new ATOM 0 HA LYS A 73 6.696 -16.102 -2.368 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.358 -16.957 -0.628 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.589 -18.056 -1.217 1.00 0.00 H new ATOM 0 HG2 LYS A 73 7.330 -16.711 -0.028 1.00 0.00 H new ATOM 0 HG3 LYS A 73 6.072 -15.662 0.596 1.00 0.00 H new ATOM 0 HD2 LYS A 73 5.005 -17.580 1.736 1.00 0.00 H new ATOM 0 HD3 LYS A 73 6.207 -18.667 1.069 1.00 0.00 H new ATOM 0 HE2 LYS A 73 6.753 -16.354 2.971 1.00 0.00 H new ATOM 0 HE3 LYS A 73 6.748 -18.054 3.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 8.979 -17.465 3.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 8.557 -18.327 1.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 8.661 -16.633 1.632 1.00 0.00 H new ATOM 1123 N ASN A 74 3.604 -16.252 -3.440 1.00 0.00 N ATOM 1124 CA ASN A 74 2.733 -16.680 -4.524 1.00 0.00 C ATOM 1125 C ASN A 74 3.158 -16.011 -5.832 1.00 0.00 C ATOM 1126 O ASN A 74 3.081 -16.607 -6.908 1.00 0.00 O ATOM 1127 CB ASN A 74 1.282 -16.318 -4.176 1.00 0.00 C ATOM 1128 CG ASN A 74 0.246 -17.041 -5.020 1.00 0.00 C ATOM 1129 OD1 ASN A 74 0.487 -17.402 -6.172 1.00 0.00 O ATOM 1130 ND2 ASN A 74 -0.924 -17.264 -4.444 1.00 0.00 N ATOM 0 H ASN A 74 3.163 -15.614 -2.778 1.00 0.00 H new ATOM 0 HA ASN A 74 2.809 -17.760 -4.654 1.00 0.00 H new ATOM 0 HB2 ASN A 74 1.103 -16.546 -3.125 1.00 0.00 H new ATOM 0 HB3 ASN A 74 1.148 -15.243 -4.296 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -1.661 -17.749 -4.956 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -1.089 -16.951 -3.487 1.00 0.00 H new ATOM 1137 N GLY A 75 3.640 -14.777 -5.720 1.00 0.00 N ATOM 1138 CA GLY A 75 4.082 -14.037 -6.887 1.00 0.00 C ATOM 1139 C GLY A 75 3.016 -13.094 -7.400 1.00 0.00 C ATOM 1140 O GLY A 75 3.177 -12.467 -8.445 1.00 0.00 O ATOM 0 H GLY A 75 3.732 -14.275 -4.837 1.00 0.00 H new ATOM 0 HA2 GLY A 75 4.978 -13.469 -6.638 1.00 0.00 H new ATOM 0 HA3 GLY A 75 4.357 -14.736 -7.676 1.00 0.00 H new ATOM 1144 N VAL A 76 1.933 -12.981 -6.646 1.00 0.00 N ATOM 1145 CA VAL A 76 0.798 -12.162 -7.047 1.00 0.00 C ATOM 1146 C VAL A 76 0.770 -10.843 -6.280 1.00 0.00 C ATOM 1147 O VAL A 76 -0.200 -10.092 -6.347 1.00 0.00 O ATOM 1148 CB VAL A 76 -0.534 -12.912 -6.826 1.00 0.00 C ATOM 1149 CG1 VAL A 76 -0.618 -14.135 -7.729 1.00 0.00 C ATOM 1150 CG2 VAL A 76 -0.689 -13.313 -5.366 1.00 0.00 C ATOM 0 H VAL A 76 1.816 -13.449 -5.747 1.00 0.00 H new ATOM 0 HA VAL A 76 0.915 -11.950 -8.110 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.351 -12.239 -7.084 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -1.564 -14.649 -7.558 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -0.558 -13.822 -8.771 1.00 0.00 H new ATOM 0 HG13 VAL A 76 0.208 -14.810 -7.505 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -1.634 -13.840 -5.232 1.00 0.00 H new ATOM 0 HG22 VAL A 76 0.135 -13.966 -5.079 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -0.679 -12.420 -4.741 1.00 0.00 H new ATOM 1160 N ALA A 77 1.846 -10.563 -5.560 1.00 0.00 N ATOM 1161 CA ALA A 77 1.932 -9.352 -4.760 1.00 0.00 C ATOM 1162 C ALA A 77 2.394 -8.169 -5.602 1.00 0.00 C ATOM 1163 O ALA A 77 3.173 -8.333 -6.543 1.00 0.00 O ATOM 1164 CB ALA A 77 2.879 -9.558 -3.590 1.00 0.00 C ATOM 0 H ALA A 77 2.672 -11.159 -5.514 1.00 0.00 H new ATOM 0 HA ALA A 77 0.935 -9.131 -4.378 1.00 0.00 H new ATOM 0 HB1 ALA A 77 2.933 -8.643 -3.000 1.00 0.00 H new ATOM 0 HB2 ALA A 77 2.513 -10.372 -2.964 1.00 0.00 H new ATOM 0 HB3 ALA A 77 3.872 -9.807 -3.965 1.00 0.00 H new ATOM 1170 N PRO A 78 1.909 -6.962 -5.278 1.00 0.00 N ATOM 1171 CA PRO A 78 2.337 -5.737 -5.950 1.00 0.00 C ATOM 1172 C PRO A 78 3.791 -5.402 -5.638 1.00 0.00 C ATOM 1173 O PRO A 78 4.349 -5.883 -4.650 1.00 0.00 O ATOM 1174 CB PRO A 78 1.403 -4.664 -5.382 1.00 0.00 C ATOM 1175 CG PRO A 78 0.948 -5.206 -4.074 1.00 0.00 C ATOM 1176 CD PRO A 78 0.902 -6.699 -4.237 1.00 0.00 C ATOM 0 HA PRO A 78 2.283 -5.823 -7.035 1.00 0.00 H new ATOM 0 HB2 PRO A 78 1.923 -3.714 -5.257 1.00 0.00 H new ATOM 0 HB3 PRO A 78 0.560 -4.481 -6.048 1.00 0.00 H new ATOM 0 HG2 PRO A 78 1.632 -4.922 -3.275 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -0.033 -4.812 -3.809 1.00 0.00 H new ATOM 0 HD2 PRO A 78 1.144 -7.212 -3.306 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -0.088 -7.039 -4.541 1.00 0.00 H new ATOM 1184 N LYS A 79 4.401 -4.579 -6.478 1.00 0.00 N ATOM 1185 CA LYS A 79 5.784 -4.190 -6.285 1.00 0.00 C ATOM 1186 C LYS A 79 5.913 -3.289 -5.062 1.00 0.00 C ATOM 1187 O LYS A 79 6.874 -3.389 -4.301 1.00 0.00 O ATOM 1188 CB LYS A 79 6.308 -3.470 -7.525 1.00 0.00 C ATOM 1189 CG LYS A 79 6.339 -4.324 -8.782 1.00 0.00 C ATOM 1190 CD LYS A 79 7.031 -3.589 -9.918 1.00 0.00 C ATOM 1191 CE LYS A 79 7.041 -4.401 -11.204 1.00 0.00 C ATOM 1192 NZ LYS A 79 7.756 -3.696 -12.303 1.00 0.00 N ATOM 0 H LYS A 79 3.957 -4.169 -7.300 1.00 0.00 H new ATOM 0 HA LYS A 79 6.379 -5.089 -6.123 1.00 0.00 H new ATOM 0 HB2 LYS A 79 5.687 -2.594 -7.711 1.00 0.00 H new ATOM 0 HB3 LYS A 79 7.316 -3.108 -7.321 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.859 -5.260 -8.578 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.322 -4.582 -9.077 1.00 0.00 H new ATOM 0 HD2 LYS A 79 6.527 -2.639 -10.094 1.00 0.00 H new ATOM 0 HD3 LYS A 79 8.056 -3.358 -9.628 1.00 0.00 H new ATOM 0 HE2 LYS A 79 7.517 -5.364 -11.021 1.00 0.00 H new ATOM 0 HE3 LYS A 79 6.016 -4.606 -11.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 7.069 -3.375 -13.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 8.263 -2.874 -11.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 8.436 -4.345 -12.747 1.00 0.00 H new ATOM 1206 N ALA A 80 4.931 -2.418 -4.877 1.00 0.00 N ATOM 1207 CA ALA A 80 4.915 -1.508 -3.743 1.00 0.00 C ATOM 1208 C ALA A 80 3.485 -1.209 -3.321 1.00 0.00 C ATOM 1209 O ALA A 80 2.550 -1.374 -4.111 1.00 0.00 O ATOM 1210 CB ALA A 80 5.642 -0.215 -4.083 1.00 0.00 C ATOM 0 H ALA A 80 4.131 -2.323 -5.502 1.00 0.00 H new ATOM 0 HA ALA A 80 5.432 -1.989 -2.913 1.00 0.00 H new ATOM 0 HB1 ALA A 80 5.619 0.453 -3.222 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.677 -0.437 -4.342 1.00 0.00 H new ATOM 0 HB3 ALA A 80 5.151 0.267 -4.929 1.00 0.00 H new ATOM 1216 N ILE A 81 3.325 -0.770 -2.082 1.00 0.00 N ATOM 1217 CA ILE A 81 2.015 -0.414 -1.550 1.00 0.00 C ATOM 1218 C ILE A 81 2.093 0.930 -0.838 1.00 0.00 C ATOM 1219 O ILE A 81 2.845 1.092 0.118 1.00 0.00 O ATOM 1220 CB ILE A 81 1.485 -1.488 -0.567 1.00 0.00 C ATOM 1221 CG1 ILE A 81 1.287 -2.826 -1.287 1.00 0.00 C ATOM 1222 CG2 ILE A 81 0.179 -1.029 0.070 1.00 0.00 C ATOM 1223 CD1 ILE A 81 0.808 -3.939 -0.381 1.00 0.00 C ATOM 0 H ILE A 81 4.092 -0.650 -1.420 1.00 0.00 H new ATOM 0 HA ILE A 81 1.323 -0.352 -2.390 1.00 0.00 H new ATOM 0 HB ILE A 81 2.225 -1.627 0.221 1.00 0.00 H new ATOM 0 HG12 ILE A 81 0.567 -2.691 -2.094 1.00 0.00 H new ATOM 0 HG13 ILE A 81 2.229 -3.124 -1.747 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -0.179 -1.795 0.758 1.00 0.00 H new ATOM 0 HG22 ILE A 81 0.347 -0.101 0.616 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -0.566 -0.862 -0.708 1.00 0.00 H new ATOM 0 HD11 ILE A 81 0.691 -4.855 -0.960 1.00 0.00 H new ATOM 0 HD12 ILE A 81 1.538 -4.102 0.412 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -0.150 -3.663 0.059 1.00 0.00 H new ATOM 1235 N ILE A 82 1.329 1.898 -1.312 1.00 0.00 N ATOM 1236 CA ILE A 82 1.356 3.234 -0.730 1.00 0.00 C ATOM 1237 C ILE A 82 0.007 3.536 -0.082 1.00 0.00 C ATOM 1238 O ILE A 82 -1.028 3.490 -0.744 1.00 0.00 O ATOM 1239 CB ILE A 82 1.682 4.314 -1.795 1.00 0.00 C ATOM 1240 CG1 ILE A 82 2.764 3.813 -2.761 1.00 0.00 C ATOM 1241 CG2 ILE A 82 2.145 5.606 -1.128 1.00 0.00 C ATOM 1242 CD1 ILE A 82 4.090 3.498 -2.097 1.00 0.00 C ATOM 0 H ILE A 82 0.684 1.788 -2.095 1.00 0.00 H new ATOM 0 HA ILE A 82 2.144 3.260 0.023 1.00 0.00 H new ATOM 0 HB ILE A 82 0.771 4.515 -2.359 1.00 0.00 H new ATOM 0 HG12 ILE A 82 2.400 2.917 -3.264 1.00 0.00 H new ATOM 0 HG13 ILE A 82 2.926 4.567 -3.531 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.369 6.350 -1.892 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.357 5.981 -0.476 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.041 5.411 -0.539 1.00 0.00 H new ATOM 0 HD11 ILE A 82 4.799 3.150 -2.848 1.00 0.00 H new ATOM 0 HD12 ILE A 82 4.480 4.396 -1.618 1.00 0.00 H new ATOM 0 HD13 ILE A 82 3.946 2.720 -1.347 1.00 0.00 H new ATOM 1254 N ASN A 83 0.015 3.800 1.221 1.00 0.00 N ATOM 1255 CA ASN A 83 -1.218 4.101 1.955 1.00 0.00 C ATOM 1256 C ASN A 83 -1.167 5.507 2.524 1.00 0.00 C ATOM 1257 O ASN A 83 -0.136 6.173 2.462 1.00 0.00 O ATOM 1258 CB ASN A 83 -1.447 3.119 3.117 1.00 0.00 C ATOM 1259 CG ASN A 83 -2.074 1.798 2.705 1.00 0.00 C ATOM 1260 OD1 ASN A 83 -1.773 1.335 1.503 1.00 0.00 O flip ATOM 1261 ND2 ASN A 83 -2.828 1.195 3.475 1.00 0.00 N flip ATOM 0 H ASN A 83 0.859 3.813 1.794 1.00 0.00 H new ATOM 0 HA ASN A 83 -2.038 4.007 1.243 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -0.491 2.919 3.602 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -2.087 3.596 3.859 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -3.036 1.585 4.394 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -3.243 0.307 3.192 1.00 0.00 H new ATOM 1268 N LYS A 84 -2.286 5.951 3.080 1.00 0.00 N ATOM 1269 CA LYS A 84 -2.326 7.219 3.793 1.00 0.00 C ATOM 1270 C LYS A 84 -2.042 6.982 5.271 1.00 0.00 C ATOM 1271 O LYS A 84 -1.285 7.721 5.904 1.00 0.00 O ATOM 1272 CB LYS A 84 -3.686 7.905 3.623 1.00 0.00 C ATOM 1273 CG LYS A 84 -3.755 9.274 4.282 1.00 0.00 C ATOM 1274 CD LYS A 84 -5.115 9.924 4.097 1.00 0.00 C ATOM 1275 CE LYS A 84 -5.169 11.278 4.784 1.00 0.00 C ATOM 1276 NZ LYS A 84 -6.507 11.913 4.660 1.00 0.00 N ATOM 0 H LYS A 84 -3.176 5.453 3.051 1.00 0.00 H new ATOM 0 HA LYS A 84 -1.563 7.875 3.375 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -3.902 8.010 2.560 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -4.462 7.267 4.045 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -3.541 9.176 5.346 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -2.984 9.919 3.860 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -5.324 10.043 3.034 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -5.891 9.275 4.503 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -4.920 11.159 5.839 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -4.415 11.935 4.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -6.500 12.834 5.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -6.734 12.050 3.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -7.224 11.299 5.096 1.00 0.00 H new ATOM 1290 N LYS A 85 -2.652 5.935 5.816 1.00 0.00 N ATOM 1291 CA LYS A 85 -2.427 5.554 7.201 1.00 0.00 C ATOM 1292 C LYS A 85 -1.692 4.227 7.272 1.00 0.00 C ATOM 1293 O LYS A 85 -2.193 3.205 6.792 1.00 0.00 O ATOM 1294 CB LYS A 85 -3.741 5.447 7.980 1.00 0.00 C ATOM 1295 CG LYS A 85 -4.366 6.782 8.346 1.00 0.00 C ATOM 1296 CD LYS A 85 -5.458 6.597 9.387 1.00 0.00 C ATOM 1297 CE LYS A 85 -6.003 7.927 9.874 1.00 0.00 C ATOM 1298 NZ LYS A 85 -6.873 7.761 11.067 1.00 0.00 N ATOM 0 H LYS A 85 -3.308 5.335 5.316 1.00 0.00 H new ATOM 0 HA LYS A 85 -1.820 6.336 7.657 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -4.455 4.876 7.387 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -3.562 4.881 8.894 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -3.600 7.454 8.731 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -4.782 7.251 7.454 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -6.269 6.005 8.962 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -5.063 6.035 10.233 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -5.175 8.592 10.117 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -6.570 8.403 9.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -7.227 8.691 11.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -7.677 7.146 10.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -6.325 7.330 11.839 1.00 0.00 H new ATOM 1312 N THR A 86 -0.508 4.253 7.855 1.00 0.00 N ATOM 1313 CA THR A 86 0.275 3.047 8.046 1.00 0.00 C ATOM 1314 C THR A 86 -0.193 2.310 9.303 1.00 0.00 C ATOM 1315 O THR A 86 -0.827 2.900 10.182 1.00 0.00 O ATOM 1316 CB THR A 86 1.785 3.370 8.148 1.00 0.00 C ATOM 1317 OG1 THR A 86 2.547 2.160 8.270 1.00 0.00 O ATOM 1318 CG2 THR A 86 2.070 4.282 9.336 1.00 0.00 C ATOM 0 H THR A 86 -0.065 5.102 8.206 1.00 0.00 H new ATOM 0 HA THR A 86 0.125 2.405 7.178 1.00 0.00 H new ATOM 0 HB THR A 86 2.080 3.888 7.236 1.00 0.00 H new ATOM 0 HG1 THR A 86 2.921 2.099 9.174 1.00 0.00 H new ATOM 0 HG21 THR A 86 3.138 4.493 9.384 1.00 0.00 H new ATOM 0 HG22 THR A 86 1.520 5.216 9.218 1.00 0.00 H new ATOM 0 HG23 THR A 86 1.755 3.790 10.256 1.00 0.00 H new ATOM 1326 N GLU A 87 0.109 1.023 9.381 1.00 0.00 N ATOM 1327 CA GLU A 87 -0.284 0.216 10.521 1.00 0.00 C ATOM 1328 C GLU A 87 0.802 -0.815 10.807 1.00 0.00 C ATOM 1329 O GLU A 87 1.520 -1.233 9.897 1.00 0.00 O ATOM 1330 CB GLU A 87 -1.621 -0.480 10.242 1.00 0.00 C ATOM 1331 CG GLU A 87 -2.527 -0.614 11.462 1.00 0.00 C ATOM 1332 CD GLU A 87 -1.872 -1.341 12.618 1.00 0.00 C ATOM 1333 OE1 GLU A 87 -1.738 -2.577 12.550 1.00 0.00 O ATOM 1334 OE2 GLU A 87 -1.445 -0.668 13.583 1.00 0.00 O ATOM 0 H GLU A 87 0.627 0.515 8.664 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.408 0.858 11.393 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -2.152 0.076 9.469 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.423 -1.474 9.841 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -2.830 0.380 11.792 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -3.435 -1.145 11.175 1.00 0.00 H new ATOM 1341 N THR A 88 0.907 -1.209 12.066 1.00 0.00 N ATOM 1342 CA THR A 88 1.871 -2.201 12.503 1.00 0.00 C ATOM 1343 C THR A 88 1.753 -3.482 11.677 1.00 0.00 C ATOM 1344 O THR A 88 2.747 -3.997 11.168 1.00 0.00 O ATOM 1345 CB THR A 88 1.640 -2.543 13.986 1.00 0.00 C ATOM 1346 OG1 THR A 88 1.299 -1.351 14.717 1.00 0.00 O ATOM 1347 CG2 THR A 88 2.883 -3.178 14.594 1.00 0.00 C ATOM 0 H THR A 88 0.321 -0.846 12.817 1.00 0.00 H new ATOM 0 HA THR A 88 2.867 -1.781 12.367 1.00 0.00 H new ATOM 0 HB THR A 88 0.818 -3.256 14.049 1.00 0.00 H new ATOM 0 HG1 THR A 88 1.152 -1.576 15.659 1.00 0.00 H new ATOM 0 HG21 THR A 88 2.697 -3.411 15.642 1.00 0.00 H new ATOM 0 HG22 THR A 88 3.124 -4.095 14.056 1.00 0.00 H new ATOM 0 HG23 THR A 88 3.720 -2.483 14.520 1.00 0.00 H new ATOM 1355 N ILE A 89 0.526 -3.973 11.523 1.00 0.00 N ATOM 1356 CA ILE A 89 0.280 -5.234 10.832 1.00 0.00 C ATOM 1357 C ILE A 89 0.710 -5.173 9.367 1.00 0.00 C ATOM 1358 O ILE A 89 1.208 -6.157 8.814 1.00 0.00 O ATOM 1359 CB ILE A 89 -1.205 -5.647 10.920 1.00 0.00 C ATOM 1360 CG1 ILE A 89 -2.111 -4.596 10.260 1.00 0.00 C ATOM 1361 CG2 ILE A 89 -1.591 -5.851 12.378 1.00 0.00 C ATOM 1362 CD1 ILE A 89 -3.584 -4.947 10.293 1.00 0.00 C ATOM 0 H ILE A 89 -0.316 -3.514 11.869 1.00 0.00 H new ATOM 0 HA ILE A 89 0.885 -5.987 11.338 1.00 0.00 H new ATOM 0 HB ILE A 89 -1.341 -6.584 10.380 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -1.964 -3.639 10.760 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -1.802 -4.464 9.223 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.639 -6.143 12.439 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -0.970 -6.635 12.812 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.440 -4.922 12.928 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -4.157 -4.157 9.808 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -3.746 -5.888 9.767 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -3.911 -5.049 11.328 1.00 0.00 H new ATOM 1374 N ILE A 90 0.534 -4.009 8.753 1.00 0.00 N ATOM 1375 CA ILE A 90 0.926 -3.811 7.366 1.00 0.00 C ATOM 1376 C ILE A 90 2.444 -3.801 7.260 1.00 0.00 C ATOM 1377 O ILE A 90 3.026 -4.455 6.395 1.00 0.00 O ATOM 1378 CB ILE A 90 0.360 -2.492 6.794 1.00 0.00 C ATOM 1379 CG1 ILE A 90 -1.160 -2.441 6.973 1.00 0.00 C ATOM 1380 CG2 ILE A 90 0.724 -2.352 5.322 1.00 0.00 C ATOM 1381 CD1 ILE A 90 -1.783 -1.148 6.494 1.00 0.00 C ATOM 0 H ILE A 90 0.122 -3.188 9.196 1.00 0.00 H new ATOM 0 HA ILE A 90 0.515 -4.634 6.782 1.00 0.00 H new ATOM 0 HB ILE A 90 0.802 -1.660 7.342 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.609 -3.274 6.432 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -1.398 -2.581 8.027 1.00 0.00 H new ATOM 0 HG21 ILE A 90 0.318 -1.418 4.934 1.00 0.00 H new ATOM 0 HG22 ILE A 90 1.809 -2.349 5.214 1.00 0.00 H new ATOM 0 HG23 ILE A 90 0.306 -3.189 4.763 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -2.861 -1.183 6.652 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -1.361 -0.312 7.053 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -1.576 -1.016 5.432 1.00 0.00 H new ATOM 1393 N ALA A 91 3.074 -3.076 8.180 1.00 0.00 N ATOM 1394 CA ALA A 91 4.525 -2.989 8.236 1.00 0.00 C ATOM 1395 C ALA A 91 5.144 -4.368 8.435 1.00 0.00 C ATOM 1396 O ALA A 91 6.101 -4.730 7.751 1.00 0.00 O ATOM 1397 CB ALA A 91 4.951 -2.054 9.356 1.00 0.00 C ATOM 0 H ALA A 91 2.595 -2.537 8.901 1.00 0.00 H new ATOM 0 HA ALA A 91 4.881 -2.589 7.287 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.039 -1.997 9.388 1.00 0.00 H new ATOM 0 HB2 ALA A 91 4.541 -1.060 9.176 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.579 -2.433 10.308 1.00 0.00 H new ATOM 1403 N VAL A 92 4.583 -5.135 9.366 1.00 0.00 N ATOM 1404 CA VAL A 92 5.052 -6.489 9.639 1.00 0.00 C ATOM 1405 C VAL A 92 4.972 -7.356 8.384 1.00 0.00 C ATOM 1406 O VAL A 92 5.951 -7.990 7.990 1.00 0.00 O ATOM 1407 CB VAL A 92 4.234 -7.152 10.773 1.00 0.00 C ATOM 1408 CG1 VAL A 92 4.622 -8.616 10.941 1.00 0.00 C ATOM 1409 CG2 VAL A 92 4.429 -6.399 12.084 1.00 0.00 C ATOM 0 H VAL A 92 3.798 -4.839 9.947 1.00 0.00 H new ATOM 0 HA VAL A 92 6.092 -6.411 9.957 1.00 0.00 H new ATOM 0 HB VAL A 92 3.180 -7.108 10.498 1.00 0.00 H new ATOM 0 HG11 VAL A 92 4.033 -9.059 11.744 1.00 0.00 H new ATOM 0 HG12 VAL A 92 4.430 -9.152 10.012 1.00 0.00 H new ATOM 0 HG13 VAL A 92 5.681 -8.686 11.188 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.846 -6.880 12.870 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.484 -6.410 12.356 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.096 -5.368 11.964 1.00 0.00 H new ATOM 1419 N GLY A 93 3.809 -7.356 7.746 1.00 0.00 N ATOM 1420 CA GLY A 93 3.604 -8.187 6.576 1.00 0.00 C ATOM 1421 C GLY A 93 4.509 -7.804 5.422 1.00 0.00 C ATOM 1422 O GLY A 93 5.088 -8.671 4.763 1.00 0.00 O ATOM 0 H GLY A 93 3.002 -6.794 8.019 1.00 0.00 H new ATOM 0 HA2 GLY A 93 3.780 -9.230 6.840 1.00 0.00 H new ATOM 0 HA3 GLY A 93 2.564 -8.110 6.258 1.00 0.00 H new ATOM 1426 N ALA A 94 4.645 -6.506 5.189 1.00 0.00 N ATOM 1427 CA ALA A 94 5.417 -6.001 4.059 1.00 0.00 C ATOM 1428 C ALA A 94 6.916 -6.159 4.277 1.00 0.00 C ATOM 1429 O ALA A 94 7.668 -6.341 3.321 1.00 0.00 O ATOM 1430 CB ALA A 94 5.074 -4.546 3.799 1.00 0.00 C ATOM 0 H ALA A 94 4.229 -5.779 5.770 1.00 0.00 H new ATOM 0 HA ALA A 94 5.149 -6.596 3.186 1.00 0.00 H new ATOM 0 HB1 ALA A 94 5.657 -4.180 2.953 1.00 0.00 H new ATOM 0 HB2 ALA A 94 4.011 -4.457 3.573 1.00 0.00 H new ATOM 0 HB3 ALA A 94 5.307 -3.953 4.684 1.00 0.00 H new ATOM 1436 N ALA A 95 7.352 -6.087 5.529 1.00 0.00 N ATOM 1437 CA ALA A 95 8.768 -6.240 5.854 1.00 0.00 C ATOM 1438 C ALA A 95 9.248 -7.655 5.547 1.00 0.00 C ATOM 1439 O ALA A 95 10.396 -7.857 5.151 1.00 0.00 O ATOM 1440 CB ALA A 95 9.025 -5.908 7.317 1.00 0.00 C ATOM 0 H ALA A 95 6.749 -5.924 6.335 1.00 0.00 H new ATOM 0 HA ALA A 95 9.329 -5.541 5.233 1.00 0.00 H new ATOM 0 HB1 ALA A 95 10.086 -6.029 7.537 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.729 -4.878 7.514 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.445 -6.580 7.950 1.00 0.00 H new ATOM 1446 N MET A 96 8.360 -8.627 5.732 1.00 0.00 N ATOM 1447 CA MET A 96 8.678 -10.030 5.461 1.00 0.00 C ATOM 1448 C MET A 96 8.901 -10.250 3.974 1.00 0.00 C ATOM 1449 O MET A 96 9.840 -10.924 3.557 1.00 0.00 O ATOM 1450 CB MET A 96 7.532 -10.948 5.893 1.00 0.00 C ATOM 1451 CG MET A 96 7.050 -10.753 7.316 1.00 0.00 C ATOM 1452 SD MET A 96 8.259 -11.233 8.554 1.00 0.00 S ATOM 1453 CE MET A 96 7.233 -11.110 10.012 1.00 0.00 C ATOM 0 H MET A 96 7.410 -8.471 6.070 1.00 0.00 H new ATOM 0 HA MET A 96 9.581 -10.266 6.024 1.00 0.00 H new ATOM 0 HB2 MET A 96 6.691 -10.795 5.217 1.00 0.00 H new ATOM 0 HB3 MET A 96 7.852 -11.983 5.774 1.00 0.00 H new ATOM 0 HG2 MET A 96 6.788 -9.705 7.462 1.00 0.00 H new ATOM 0 HG3 MET A 96 6.139 -11.333 7.465 1.00 0.00 H new ATOM 0 HE1 MET A 96 7.754 -10.533 10.776 1.00 0.00 H new ATOM 0 HE2 MET A 96 6.297 -10.613 9.757 1.00 0.00 H new ATOM 0 HE3 MET A 96 7.022 -12.109 10.394 1.00 0.00 H new ATOM 1463 N ALA A 97 8.015 -9.669 3.188 1.00 0.00 N ATOM 1464 CA ALA A 97 7.936 -9.952 1.764 1.00 0.00 C ATOM 1465 C ALA A 97 8.717 -8.943 0.935 1.00 0.00 C ATOM 1466 O ALA A 97 8.771 -9.049 -0.291 1.00 0.00 O ATOM 1467 CB ALA A 97 6.480 -9.951 1.353 1.00 0.00 C ATOM 0 H ALA A 97 7.330 -8.988 3.516 1.00 0.00 H new ATOM 0 HA ALA A 97 8.385 -10.928 1.579 1.00 0.00 H new ATOM 0 HB1 ALA A 97 6.403 -10.162 0.286 1.00 0.00 H new ATOM 0 HB2 ALA A 97 5.943 -10.716 1.914 1.00 0.00 H new ATOM 0 HB3 ALA A 97 6.044 -8.974 1.562 1.00 0.00 H new ATOM 1473 N GLU A 98 9.327 -7.981 1.620 1.00 0.00 N ATOM 1474 CA GLU A 98 9.991 -6.852 0.972 1.00 0.00 C ATOM 1475 C GLU A 98 9.007 -6.112 0.066 1.00 0.00 C ATOM 1476 O GLU A 98 9.137 -6.104 -1.162 1.00 0.00 O ATOM 1477 CB GLU A 98 11.220 -7.294 0.177 1.00 0.00 C ATOM 1478 CG GLU A 98 12.088 -6.131 -0.280 1.00 0.00 C ATOM 1479 CD GLU A 98 13.182 -6.556 -1.232 1.00 0.00 C ATOM 1480 OE1 GLU A 98 14.212 -7.084 -0.766 1.00 0.00 O ATOM 1481 OE2 GLU A 98 13.018 -6.360 -2.455 1.00 0.00 O ATOM 0 H GLU A 98 9.376 -7.961 2.639 1.00 0.00 H new ATOM 0 HA GLU A 98 10.335 -6.176 1.755 1.00 0.00 H new ATOM 0 HB2 GLU A 98 11.819 -7.967 0.791 1.00 0.00 H new ATOM 0 HB3 GLU A 98 10.896 -7.862 -0.695 1.00 0.00 H new ATOM 0 HG2 GLU A 98 11.460 -5.384 -0.765 1.00 0.00 H new ATOM 0 HG3 GLU A 98 12.536 -5.654 0.591 1.00 0.00 H new ATOM 1488 N ILE A 99 7.997 -5.534 0.691 1.00 0.00 N ATOM 1489 CA ILE A 99 6.993 -4.749 -0.008 1.00 0.00 C ATOM 1490 C ILE A 99 7.094 -3.287 0.414 1.00 0.00 C ATOM 1491 O ILE A 99 6.513 -2.885 1.422 1.00 0.00 O ATOM 1492 CB ILE A 99 5.558 -5.265 0.248 1.00 0.00 C ATOM 1493 CG1 ILE A 99 5.446 -6.742 -0.146 1.00 0.00 C ATOM 1494 CG2 ILE A 99 4.551 -4.428 -0.533 1.00 0.00 C ATOM 1495 CD1 ILE A 99 4.068 -7.332 0.069 1.00 0.00 C ATOM 0 H ILE A 99 7.849 -5.595 1.698 1.00 0.00 H new ATOM 0 HA ILE A 99 7.191 -4.847 -1.075 1.00 0.00 H new ATOM 0 HB ILE A 99 5.337 -5.173 1.311 1.00 0.00 H new ATOM 0 HG12 ILE A 99 5.716 -6.849 -1.196 1.00 0.00 H new ATOM 0 HG13 ILE A 99 6.171 -7.317 0.430 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.544 -4.801 -0.345 1.00 0.00 H new ATOM 0 HG22 ILE A 99 4.618 -3.388 -0.215 1.00 0.00 H new ATOM 0 HG23 ILE A 99 4.770 -4.496 -1.599 1.00 0.00 H new ATOM 0 HD11 ILE A 99 4.069 -8.379 -0.233 1.00 0.00 H new ATOM 0 HD12 ILE A 99 3.801 -7.259 1.123 1.00 0.00 H new ATOM 0 HD13 ILE A 99 3.340 -6.783 -0.528 1.00 0.00 H new ATOM 1507 N PRO A 100 7.913 -2.502 -0.303 1.00 0.00 N ATOM 1508 CA PRO A 100 8.130 -1.083 0.000 1.00 0.00 C ATOM 1509 C PRO A 100 6.822 -0.313 0.168 1.00 0.00 C ATOM 1510 O PRO A 100 6.053 -0.155 -0.785 1.00 0.00 O ATOM 1511 CB PRO A 100 8.891 -0.575 -1.226 1.00 0.00 C ATOM 1512 CG PRO A 100 9.593 -1.775 -1.758 1.00 0.00 C ATOM 1513 CD PRO A 100 8.682 -2.936 -1.486 1.00 0.00 C ATOM 0 HA PRO A 100 8.662 -0.946 0.942 1.00 0.00 H new ATOM 0 HB2 PRO A 100 8.212 -0.152 -1.967 1.00 0.00 H new ATOM 0 HB3 PRO A 100 9.597 0.210 -0.957 1.00 0.00 H new ATOM 0 HG2 PRO A 100 9.788 -1.673 -2.826 1.00 0.00 H new ATOM 0 HG3 PRO A 100 10.558 -1.912 -1.270 1.00 0.00 H new ATOM 0 HD2 PRO A 100 8.030 -3.142 -2.335 1.00 0.00 H new ATOM 0 HD3 PRO A 100 9.244 -3.849 -1.287 1.00 0.00 H new ATOM 1521 N LEU A 101 6.562 0.148 1.382 1.00 0.00 N ATOM 1522 CA LEU A 101 5.358 0.908 1.657 1.00 0.00 C ATOM 1523 C LEU A 101 5.718 2.240 2.298 1.00 0.00 C ATOM 1524 O LEU A 101 6.553 2.309 3.208 1.00 0.00 O ATOM 1525 CB LEU A 101 4.390 0.102 2.551 1.00 0.00 C ATOM 1526 CG LEU A 101 4.692 0.085 4.054 1.00 0.00 C ATOM 1527 CD1 LEU A 101 3.953 1.208 4.769 1.00 0.00 C ATOM 1528 CD2 LEU A 101 4.317 -1.259 4.655 1.00 0.00 C ATOM 0 H LEU A 101 7.169 0.008 2.190 1.00 0.00 H new ATOM 0 HA LEU A 101 4.846 1.106 0.715 1.00 0.00 H new ATOM 0 HB2 LEU A 101 3.385 0.501 2.410 1.00 0.00 H new ATOM 0 HB3 LEU A 101 4.376 -0.928 2.195 1.00 0.00 H new ATOM 0 HG LEU A 101 5.762 0.242 4.187 1.00 0.00 H new ATOM 0 HD11 LEU A 101 4.183 1.175 5.834 1.00 0.00 H new ATOM 0 HD12 LEU A 101 4.266 2.168 4.360 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.879 1.086 4.626 1.00 0.00 H new ATOM 0 HD21 LEU A 101 4.538 -1.255 5.722 1.00 0.00 H new ATOM 0 HD22 LEU A 101 3.253 -1.440 4.505 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.891 -2.048 4.169 1.00 0.00 H new ATOM 1540 N VAL A 102 5.106 3.300 1.803 1.00 0.00 N ATOM 1541 CA VAL A 102 5.288 4.620 2.376 1.00 0.00 C ATOM 1542 C VAL A 102 3.921 5.213 2.697 1.00 0.00 C ATOM 1543 O VAL A 102 2.920 4.848 2.072 1.00 0.00 O ATOM 1544 CB VAL A 102 6.073 5.578 1.437 1.00 0.00 C ATOM 1545 CG1 VAL A 102 7.344 4.923 0.925 1.00 0.00 C ATOM 1546 CG2 VAL A 102 5.220 6.040 0.272 1.00 0.00 C ATOM 0 H VAL A 102 4.476 3.271 1.002 1.00 0.00 H new ATOM 0 HA VAL A 102 5.883 4.510 3.283 1.00 0.00 H new ATOM 0 HB VAL A 102 6.345 6.453 2.028 1.00 0.00 H new ATOM 0 HG11 VAL A 102 7.872 5.616 0.271 1.00 0.00 H new ATOM 0 HG12 VAL A 102 7.983 4.661 1.768 1.00 0.00 H new ATOM 0 HG13 VAL A 102 7.090 4.021 0.368 1.00 0.00 H new ATOM 0 HG21 VAL A 102 5.802 6.708 -0.363 1.00 0.00 H new ATOM 0 HG22 VAL A 102 4.899 5.176 -0.309 1.00 0.00 H new ATOM 0 HG23 VAL A 102 4.345 6.569 0.649 1.00 0.00 H new ATOM 1556 N GLU A 103 3.870 6.091 3.680 1.00 0.00 N ATOM 1557 CA GLU A 103 2.627 6.740 4.046 1.00 0.00 C ATOM 1558 C GLU A 103 2.559 8.133 3.434 1.00 0.00 C ATOM 1559 O GLU A 103 3.423 8.983 3.679 1.00 0.00 O ATOM 1560 CB GLU A 103 2.466 6.815 5.569 1.00 0.00 C ATOM 1561 CG GLU A 103 3.553 7.607 6.277 1.00 0.00 C ATOM 1562 CD GLU A 103 3.218 7.881 7.727 1.00 0.00 C ATOM 1563 OE1 GLU A 103 2.205 8.568 7.985 1.00 0.00 O ATOM 1564 OE2 GLU A 103 3.965 7.423 8.616 1.00 0.00 O ATOM 0 H GLU A 103 4.676 6.371 4.239 1.00 0.00 H new ATOM 0 HA GLU A 103 1.805 6.142 3.653 1.00 0.00 H new ATOM 0 HB2 GLU A 103 1.499 7.263 5.798 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.451 5.802 5.971 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.493 7.058 6.222 1.00 0.00 H new ATOM 0 HG3 GLU A 103 3.706 8.553 5.758 1.00 0.00 H new ATOM 1571 N VAL A 104 1.548 8.347 2.610 1.00 0.00 N ATOM 1572 CA VAL A 104 1.280 9.658 2.039 1.00 0.00 C ATOM 1573 C VAL A 104 0.206 10.346 2.871 1.00 0.00 C ATOM 1574 O VAL A 104 -0.592 9.680 3.526 1.00 0.00 O ATOM 1575 CB VAL A 104 0.817 9.575 0.564 1.00 0.00 C ATOM 1576 CG1 VAL A 104 1.881 8.916 -0.295 1.00 0.00 C ATOM 1577 CG2 VAL A 104 -0.500 8.828 0.443 1.00 0.00 C ATOM 0 H VAL A 104 0.892 7.622 2.318 1.00 0.00 H new ATOM 0 HA VAL A 104 2.209 10.228 2.055 1.00 0.00 H new ATOM 0 HB VAL A 104 0.662 10.593 0.206 1.00 0.00 H new ATOM 0 HG11 VAL A 104 1.536 8.867 -1.328 1.00 0.00 H new ATOM 0 HG12 VAL A 104 2.800 9.499 -0.247 1.00 0.00 H new ATOM 0 HG13 VAL A 104 2.072 7.907 0.072 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -0.800 8.786 -0.604 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -0.380 7.815 0.827 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -1.267 9.346 1.019 1.00 0.00 H new ATOM 1587 N ARG A 105 0.196 11.664 2.872 1.00 0.00 N ATOM 1588 CA ARG A 105 -0.745 12.399 3.702 1.00 0.00 C ATOM 1589 C ARG A 105 -1.520 13.421 2.871 1.00 0.00 C ATOM 1590 O ARG A 105 -2.571 13.908 3.284 1.00 0.00 O ATOM 1591 CB ARG A 105 0.021 13.068 4.856 1.00 0.00 C ATOM 1592 CG ARG A 105 -0.857 13.694 5.930 1.00 0.00 C ATOM 1593 CD ARG A 105 -1.210 15.133 5.601 1.00 0.00 C ATOM 1594 NE ARG A 105 -2.129 15.714 6.576 1.00 0.00 N ATOM 1595 CZ ARG A 105 -2.793 16.847 6.374 1.00 0.00 C ATOM 1596 NH1 ARG A 105 -2.674 17.484 5.215 1.00 0.00 N ATOM 1597 NH2 ARG A 105 -3.583 17.338 7.320 1.00 0.00 N ATOM 0 H ARG A 105 0.821 12.246 2.314 1.00 0.00 H new ATOM 0 HA ARG A 105 -1.479 11.711 4.121 1.00 0.00 H new ATOM 0 HB2 ARG A 105 0.667 12.325 5.323 1.00 0.00 H new ATOM 0 HB3 ARG A 105 0.670 13.840 4.443 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -1.772 13.111 6.037 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -0.341 13.657 6.889 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -0.298 15.729 5.564 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -1.660 15.177 4.609 1.00 0.00 H new ATOM 0 HE ARG A 105 -2.269 15.224 7.459 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -2.074 17.103 4.483 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -3.182 18.354 5.057 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -3.683 16.845 8.208 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -4.090 18.208 7.160 1.00 0.00 H new ATOM 1611 N ASP A 106 -1.026 13.706 1.678 1.00 0.00 N ATOM 1612 CA ASP A 106 -1.560 14.802 0.882 1.00 0.00 C ATOM 1613 C ASP A 106 -2.621 14.312 -0.100 1.00 0.00 C ATOM 1614 O ASP A 106 -2.457 13.268 -0.733 1.00 0.00 O ATOM 1615 CB ASP A 106 -0.432 15.490 0.118 1.00 0.00 C ATOM 1616 CG ASP A 106 -0.765 16.925 -0.213 1.00 0.00 C ATOM 1617 OD1 ASP A 106 -1.741 17.156 -0.949 1.00 0.00 O ATOM 1618 OD2 ASP A 106 -0.061 17.831 0.289 1.00 0.00 O ATOM 0 H ASP A 106 -0.259 13.197 1.239 1.00 0.00 H new ATOM 0 HA ASP A 106 -2.028 15.512 1.563 1.00 0.00 H new ATOM 0 HB2 ASP A 106 0.481 15.458 0.713 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -0.232 14.943 -0.803 1.00 0.00 H new ATOM 1623 N GLU A 107 -3.703 15.079 -0.227 1.00 0.00 N ATOM 1624 CA GLU A 107 -4.792 14.740 -1.139 1.00 0.00 C ATOM 1625 C GLU A 107 -4.365 14.943 -2.591 1.00 0.00 C ATOM 1626 O GLU A 107 -4.817 14.226 -3.489 1.00 0.00 O ATOM 1627 CB GLU A 107 -6.026 15.600 -0.849 1.00 0.00 C ATOM 1628 CG GLU A 107 -7.247 15.206 -1.673 1.00 0.00 C ATOM 1629 CD GLU A 107 -8.405 16.173 -1.527 1.00 0.00 C ATOM 1630 OE1 GLU A 107 -9.214 16.007 -0.590 1.00 0.00 O ATOM 1631 OE2 GLU A 107 -8.517 17.099 -2.356 1.00 0.00 O ATOM 0 H GLU A 107 -3.848 15.944 0.294 1.00 0.00 H new ATOM 0 HA GLU A 107 -5.041 13.690 -0.984 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -6.272 15.524 0.210 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -5.786 16.645 -1.046 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -6.964 15.145 -2.724 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -7.574 14.210 -1.373 1.00 0.00 H new ATOM 1638 N LYS A 108 -3.474 15.910 -2.810 1.00 0.00 N ATOM 1639 CA LYS A 108 -3.015 16.246 -4.151 1.00 0.00 C ATOM 1640 C LYS A 108 -2.352 15.043 -4.809 1.00 0.00 C ATOM 1641 O LYS A 108 -2.378 14.900 -6.029 1.00 0.00 O ATOM 1642 CB LYS A 108 -2.043 17.425 -4.097 1.00 0.00 C ATOM 1643 CG LYS A 108 -2.676 18.715 -3.590 1.00 0.00 C ATOM 1644 CD LYS A 108 -1.651 19.829 -3.438 1.00 0.00 C ATOM 1645 CE LYS A 108 -0.517 19.416 -2.515 1.00 0.00 C ATOM 1646 NZ LYS A 108 0.339 20.563 -2.122 1.00 0.00 N ATOM 0 H LYS A 108 -3.056 16.475 -2.070 1.00 0.00 H new ATOM 0 HA LYS A 108 -3.880 16.531 -4.750 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -1.204 17.164 -3.452 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -1.637 17.597 -5.094 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -3.457 19.032 -4.281 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -3.156 18.530 -2.629 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -1.249 20.091 -4.416 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -2.137 20.721 -3.043 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -0.931 18.952 -1.620 1.00 0.00 H new ATOM 0 HE3 LYS A 108 0.095 18.662 -3.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 1.098 20.231 -1.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 0.757 20.991 -2.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -0.237 21.272 -1.625 1.00 0.00 H new ATOM 1660 N PHE A 109 -1.782 14.170 -3.986 1.00 0.00 N ATOM 1661 CA PHE A 109 -1.163 12.949 -4.479 1.00 0.00 C ATOM 1662 C PHE A 109 -2.213 12.028 -5.094 1.00 0.00 C ATOM 1663 O PHE A 109 -2.049 11.551 -6.214 1.00 0.00 O ATOM 1664 CB PHE A 109 -0.427 12.229 -3.344 1.00 0.00 C ATOM 1665 CG PHE A 109 0.111 10.877 -3.728 1.00 0.00 C ATOM 1666 CD1 PHE A 109 1.246 10.763 -4.516 1.00 0.00 C ATOM 1667 CD2 PHE A 109 -0.522 9.719 -3.301 1.00 0.00 C ATOM 1668 CE1 PHE A 109 1.736 9.522 -4.870 1.00 0.00 C ATOM 1669 CE2 PHE A 109 -0.034 8.475 -3.653 1.00 0.00 C ATOM 1670 CZ PHE A 109 1.097 8.376 -4.438 1.00 0.00 C ATOM 0 H PHE A 109 -1.737 14.287 -2.974 1.00 0.00 H new ATOM 0 HA PHE A 109 -0.441 13.216 -5.251 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.398 12.855 -3.005 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -1.107 12.113 -2.500 1.00 0.00 H new ATOM 0 HD1 PHE A 109 1.752 11.654 -4.856 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -1.407 9.790 -2.686 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.620 9.447 -5.486 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -0.537 7.581 -3.314 1.00 0.00 H new ATOM 0 HZ PHE A 109 1.481 7.405 -4.714 1.00 0.00 H new ATOM 1680 N PHE A 110 -3.306 11.825 -4.368 1.00 0.00 N ATOM 1681 CA PHE A 110 -4.353 10.899 -4.788 1.00 0.00 C ATOM 1682 C PHE A 110 -5.075 11.416 -6.021 1.00 0.00 C ATOM 1683 O PHE A 110 -5.632 10.642 -6.800 1.00 0.00 O ATOM 1684 CB PHE A 110 -5.370 10.678 -3.667 1.00 0.00 C ATOM 1685 CG PHE A 110 -4.819 9.971 -2.462 1.00 0.00 C ATOM 1686 CD1 PHE A 110 -4.648 8.596 -2.470 1.00 0.00 C ATOM 1687 CD2 PHE A 110 -4.488 10.677 -1.316 1.00 0.00 C ATOM 1688 CE1 PHE A 110 -4.156 7.938 -1.359 1.00 0.00 C ATOM 1689 CE2 PHE A 110 -3.995 10.026 -0.203 1.00 0.00 C ATOM 1690 CZ PHE A 110 -3.830 8.655 -0.224 1.00 0.00 C ATOM 0 H PHE A 110 -3.492 12.292 -3.480 1.00 0.00 H new ATOM 0 HA PHE A 110 -3.871 9.951 -5.027 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -5.767 11.645 -3.357 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -6.207 10.102 -4.061 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -4.902 8.032 -3.355 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -4.617 11.749 -1.294 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -4.027 6.866 -1.378 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -3.739 10.588 0.683 1.00 0.00 H new ATOM 0 HZ PHE A 110 -3.446 8.144 0.646 1.00 0.00 H new ATOM 1700 N GLU A 111 -5.084 12.727 -6.186 1.00 0.00 N ATOM 1701 CA GLU A 111 -5.733 13.331 -7.320 1.00 0.00 C ATOM 1702 C GLU A 111 -4.822 13.367 -8.538 1.00 0.00 C ATOM 1703 O GLU A 111 -5.283 13.173 -9.663 1.00 0.00 O ATOM 1704 CB GLU A 111 -6.225 14.722 -6.957 1.00 0.00 C ATOM 1705 CG GLU A 111 -7.665 14.721 -6.469 1.00 0.00 C ATOM 1706 CD GLU A 111 -8.585 13.968 -7.412 1.00 0.00 C ATOM 1707 OE1 GLU A 111 -8.677 12.726 -7.302 1.00 0.00 O ATOM 1708 OE2 GLU A 111 -9.204 14.606 -8.286 1.00 0.00 O ATOM 0 H GLU A 111 -4.647 13.388 -5.544 1.00 0.00 H new ATOM 0 HA GLU A 111 -6.592 12.716 -7.588 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -5.582 15.141 -6.182 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -6.140 15.373 -7.827 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -7.712 14.268 -5.479 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -8.014 15.749 -6.366 1.00 0.00 H new ATOM 1715 N ALA A 112 -3.533 13.593 -8.313 1.00 0.00 N ATOM 1716 CA ALA A 112 -2.569 13.629 -9.404 1.00 0.00 C ATOM 1717 C ALA A 112 -2.406 12.248 -10.026 1.00 0.00 C ATOM 1718 O ALA A 112 -2.306 12.111 -11.248 1.00 0.00 O ATOM 1719 CB ALA A 112 -1.226 14.153 -8.917 1.00 0.00 C ATOM 0 H ALA A 112 -3.133 13.753 -7.388 1.00 0.00 H new ATOM 0 HA ALA A 112 -2.948 14.308 -10.168 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -0.520 14.172 -9.747 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -1.350 15.162 -8.523 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -0.844 13.501 -8.131 1.00 0.00 H new ATOM 1725 N VAL A 113 -2.391 11.224 -9.182 1.00 0.00 N ATOM 1726 CA VAL A 113 -2.228 9.858 -9.652 1.00 0.00 C ATOM 1727 C VAL A 113 -3.587 9.201 -9.880 1.00 0.00 C ATOM 1728 O VAL A 113 -4.530 9.414 -9.116 1.00 0.00 O ATOM 1729 CB VAL A 113 -1.390 9.006 -8.664 1.00 0.00 C ATOM 1730 CG1 VAL A 113 -2.152 8.719 -7.380 1.00 0.00 C ATOM 1731 CG2 VAL A 113 -0.937 7.712 -9.318 1.00 0.00 C ATOM 0 H VAL A 113 -2.490 11.315 -8.171 1.00 0.00 H new ATOM 0 HA VAL A 113 -1.689 9.905 -10.598 1.00 0.00 H new ATOM 0 HB VAL A 113 -0.508 9.589 -8.399 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -1.531 8.120 -6.714 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -2.407 9.659 -6.890 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -3.066 8.172 -7.614 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -0.351 7.130 -8.606 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -1.809 7.136 -9.627 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.326 7.940 -10.191 1.00 0.00 H new ATOM 1741 N LYS A 114 -3.689 8.433 -10.952 1.00 0.00 N ATOM 1742 CA LYS A 114 -4.889 7.664 -11.238 1.00 0.00 C ATOM 1743 C LYS A 114 -4.507 6.313 -11.826 1.00 0.00 C ATOM 1744 O LYS A 114 -3.422 6.160 -12.389 1.00 0.00 O ATOM 1745 CB LYS A 114 -5.823 8.421 -12.192 1.00 0.00 C ATOM 1746 CG LYS A 114 -6.577 9.572 -11.531 1.00 0.00 C ATOM 1747 CD LYS A 114 -7.491 9.068 -10.422 1.00 0.00 C ATOM 1748 CE LYS A 114 -8.214 10.206 -9.713 1.00 0.00 C ATOM 1749 NZ LYS A 114 -7.274 11.119 -9.006 1.00 0.00 N ATOM 0 H LYS A 114 -2.948 8.325 -11.644 1.00 0.00 H new ATOM 0 HA LYS A 114 -5.428 7.509 -10.303 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -5.238 8.813 -13.024 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -6.544 7.720 -12.612 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -5.865 10.289 -11.121 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -7.167 10.101 -12.280 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -8.224 8.379 -10.842 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -6.904 8.505 -9.697 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -8.792 10.776 -10.441 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -8.923 9.792 -8.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -7.812 11.877 -8.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -6.740 10.583 -8.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -6.613 11.536 -9.692 1.00 0.00 H new ATOM 1763 N THR A 115 -5.394 5.339 -11.667 1.00 0.00 N ATOM 1764 CA THR A 115 -5.147 3.977 -12.115 1.00 0.00 C ATOM 1765 C THR A 115 -4.843 3.918 -13.611 1.00 0.00 C ATOM 1766 O THR A 115 -5.692 4.258 -14.438 1.00 0.00 O ATOM 1767 CB THR A 115 -6.368 3.090 -11.818 1.00 0.00 C ATOM 1768 OG1 THR A 115 -6.781 3.286 -10.461 1.00 0.00 O ATOM 1769 CG2 THR A 115 -6.042 1.624 -12.045 1.00 0.00 C ATOM 0 H THR A 115 -6.303 5.472 -11.224 1.00 0.00 H new ATOM 0 HA THR A 115 -4.276 3.612 -11.570 1.00 0.00 H new ATOM 0 HB THR A 115 -7.174 3.372 -12.495 1.00 0.00 H new ATOM 0 HG1 THR A 115 -7.560 2.722 -10.271 1.00 0.00 H new ATOM 0 HG21 THR A 115 -6.922 1.018 -11.828 1.00 0.00 H new ATOM 0 HG22 THR A 115 -5.745 1.474 -13.083 1.00 0.00 H new ATOM 0 HG23 THR A 115 -5.225 1.327 -11.387 1.00 0.00 H new ATOM 1777 N GLY A 116 -3.631 3.498 -13.950 1.00 0.00 N ATOM 1778 CA GLY A 116 -3.288 3.307 -15.344 1.00 0.00 C ATOM 1779 C GLY A 116 -1.930 3.856 -15.715 1.00 0.00 C ATOM 1780 O GLY A 116 -1.238 3.281 -16.560 1.00 0.00 O ATOM 0 H GLY A 116 -2.884 3.287 -13.288 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -3.315 2.242 -15.573 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -4.046 3.785 -15.965 1.00 0.00 H new ATOM 1784 N ASP A 117 -1.535 4.964 -15.101 1.00 0.00 N ATOM 1785 CA ASP A 117 -0.257 5.579 -15.439 1.00 0.00 C ATOM 1786 C ASP A 117 0.844 5.059 -14.520 1.00 0.00 C ATOM 1787 O ASP A 117 0.608 4.167 -13.708 1.00 0.00 O ATOM 1788 CB ASP A 117 -0.327 7.103 -15.385 1.00 0.00 C ATOM 1789 CG ASP A 117 0.463 7.734 -16.519 1.00 0.00 C ATOM 1790 OD1 ASP A 117 1.570 7.230 -16.835 1.00 0.00 O ATOM 1791 OD2 ASP A 117 -0.023 8.718 -17.110 1.00 0.00 O ATOM 0 H ASP A 117 -2.069 5.448 -14.379 1.00 0.00 H new ATOM 0 HA ASP A 117 -0.020 5.301 -16.466 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -1.367 7.423 -15.442 1.00 0.00 H new ATOM 0 HB3 ASP A 117 0.063 7.453 -14.429 1.00 0.00 H new ATOM 1796 N ARG A 118 2.041 5.618 -14.644 1.00 0.00 N ATOM 1797 CA ARG A 118 3.217 5.052 -14.014 1.00 0.00 C ATOM 1798 C ARG A 118 3.719 5.918 -12.870 1.00 0.00 C ATOM 1799 O ARG A 118 3.680 7.145 -12.935 1.00 0.00 O ATOM 1800 CB ARG A 118 4.324 4.896 -15.054 1.00 0.00 C ATOM 1801 CG ARG A 118 4.339 3.557 -15.784 1.00 0.00 C ATOM 1802 CD ARG A 118 3.001 3.222 -16.430 1.00 0.00 C ATOM 1803 NE ARG A 118 2.449 4.342 -17.195 1.00 0.00 N ATOM 1804 CZ ARG A 118 1.640 4.206 -18.243 1.00 0.00 C ATOM 1805 NH1 ARG A 118 1.360 3.000 -18.723 1.00 0.00 N ATOM 1806 NH2 ARG A 118 1.109 5.279 -18.810 1.00 0.00 N ATOM 0 H ARG A 118 2.219 6.468 -15.179 1.00 0.00 H new ATOM 0 HA ARG A 118 2.941 4.081 -13.603 1.00 0.00 H new ATOM 0 HB2 ARG A 118 4.225 5.693 -15.791 1.00 0.00 H new ATOM 0 HB3 ARG A 118 5.286 5.035 -14.562 1.00 0.00 H new ATOM 0 HG2 ARG A 118 5.113 3.575 -16.551 1.00 0.00 H new ATOM 0 HG3 ARG A 118 4.605 2.768 -15.081 1.00 0.00 H new ATOM 0 HD2 ARG A 118 3.125 2.363 -17.089 1.00 0.00 H new ATOM 0 HD3 ARG A 118 2.291 2.930 -15.656 1.00 0.00 H new ATOM 0 HE ARG A 118 2.701 5.287 -16.906 1.00 0.00 H new ATOM 0 HH11 ARG A 118 1.766 2.171 -18.288 1.00 0.00 H new ATOM 0 HH12 ARG A 118 0.739 2.902 -19.526 1.00 0.00 H new ATOM 0 HH21 ARG A 118 1.320 6.207 -18.443 1.00 0.00 H new ATOM 0 HH22 ARG A 118 0.489 5.177 -19.613 1.00 0.00 H new ATOM 1820 N VAL A 119 4.193 5.271 -11.823 1.00 0.00 N ATOM 1821 CA VAL A 119 4.803 5.980 -10.718 1.00 0.00 C ATOM 1822 C VAL A 119 6.012 5.206 -10.195 1.00 0.00 C ATOM 1823 O VAL A 119 5.999 3.974 -10.144 1.00 0.00 O ATOM 1824 CB VAL A 119 3.789 6.239 -9.578 1.00 0.00 C ATOM 1825 CG1 VAL A 119 3.436 4.962 -8.829 1.00 0.00 C ATOM 1826 CG2 VAL A 119 4.314 7.295 -8.621 1.00 0.00 C ATOM 0 H VAL A 119 4.167 4.257 -11.715 1.00 0.00 H new ATOM 0 HA VAL A 119 5.137 6.950 -11.087 1.00 0.00 H new ATOM 0 HB VAL A 119 2.873 6.610 -10.037 1.00 0.00 H new ATOM 0 HG11 VAL A 119 2.722 5.190 -8.038 1.00 0.00 H new ATOM 0 HG12 VAL A 119 2.994 4.245 -9.521 1.00 0.00 H new ATOM 0 HG13 VAL A 119 4.339 4.536 -8.391 1.00 0.00 H new ATOM 0 HG21 VAL A 119 3.585 7.461 -7.828 1.00 0.00 H new ATOM 0 HG22 VAL A 119 5.254 6.956 -8.185 1.00 0.00 H new ATOM 0 HG23 VAL A 119 4.480 8.226 -9.162 1.00 0.00 H new ATOM 1836 N VAL A 120 7.062 5.933 -9.847 1.00 0.00 N ATOM 1837 CA VAL A 120 8.273 5.332 -9.306 1.00 0.00 C ATOM 1838 C VAL A 120 8.396 5.660 -7.827 1.00 0.00 C ATOM 1839 O VAL A 120 8.459 6.831 -7.446 1.00 0.00 O ATOM 1840 CB VAL A 120 9.535 5.833 -10.045 1.00 0.00 C ATOM 1841 CG1 VAL A 120 10.781 5.133 -9.527 1.00 0.00 C ATOM 1842 CG2 VAL A 120 9.393 5.635 -11.547 1.00 0.00 C ATOM 0 H VAL A 120 7.100 6.949 -9.930 1.00 0.00 H new ATOM 0 HA VAL A 120 8.199 4.254 -9.446 1.00 0.00 H new ATOM 0 HB VAL A 120 9.640 6.900 -9.849 1.00 0.00 H new ATOM 0 HG11 VAL A 120 11.655 5.503 -10.063 1.00 0.00 H new ATOM 0 HG12 VAL A 120 10.896 5.335 -8.462 1.00 0.00 H new ATOM 0 HG13 VAL A 120 10.687 4.059 -9.684 1.00 0.00 H new ATOM 0 HG21 VAL A 120 10.292 5.994 -12.048 1.00 0.00 H new ATOM 0 HG22 VAL A 120 9.256 4.575 -11.763 1.00 0.00 H new ATOM 0 HG23 VAL A 120 8.529 6.193 -11.908 1.00 0.00 H new ATOM 1852 N VAL A 121 8.421 4.633 -6.998 1.00 0.00 N ATOM 1853 CA VAL A 121 8.486 4.820 -5.561 1.00 0.00 C ATOM 1854 C VAL A 121 9.801 4.298 -5.001 1.00 0.00 C ATOM 1855 O VAL A 121 10.086 3.097 -5.055 1.00 0.00 O ATOM 1856 CB VAL A 121 7.316 4.113 -4.842 1.00 0.00 C ATOM 1857 CG1 VAL A 121 7.376 4.368 -3.344 1.00 0.00 C ATOM 1858 CG2 VAL A 121 5.980 4.571 -5.406 1.00 0.00 C ATOM 0 H VAL A 121 8.397 3.658 -7.297 1.00 0.00 H new ATOM 0 HA VAL A 121 8.415 5.892 -5.380 1.00 0.00 H new ATOM 0 HB VAL A 121 7.410 3.041 -5.014 1.00 0.00 H new ATOM 0 HG11 VAL A 121 6.544 3.862 -2.855 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.317 3.986 -2.947 1.00 0.00 H new ATOM 0 HG13 VAL A 121 7.311 5.439 -3.154 1.00 0.00 H new ATOM 0 HG21 VAL A 121 5.171 4.060 -4.885 1.00 0.00 H new ATOM 0 HG22 VAL A 121 5.877 5.647 -5.269 1.00 0.00 H new ATOM 0 HG23 VAL A 121 5.933 4.334 -6.469 1.00 0.00 H new ATOM 1868 N ASN A 122 10.608 5.206 -4.480 1.00 0.00 N ATOM 1869 CA ASN A 122 11.829 4.825 -3.798 1.00 0.00 C ATOM 1870 C ASN A 122 11.597 4.871 -2.296 1.00 0.00 C ATOM 1871 O ASN A 122 11.625 5.939 -1.681 1.00 0.00 O ATOM 1872 CB ASN A 122 12.997 5.738 -4.185 1.00 0.00 C ATOM 1873 CG ASN A 122 14.308 5.274 -3.577 1.00 0.00 C ATOM 1874 OD1 ASN A 122 14.492 4.086 -3.308 1.00 0.00 O ATOM 1875 ND2 ASN A 122 15.231 6.198 -3.365 1.00 0.00 N ATOM 0 H ASN A 122 10.439 6.211 -4.517 1.00 0.00 H new ATOM 0 HA ASN A 122 12.094 3.812 -4.100 1.00 0.00 H new ATOM 0 HB2 ASN A 122 13.091 5.766 -5.271 1.00 0.00 H new ATOM 0 HB3 ASN A 122 12.786 6.756 -3.857 1.00 0.00 H new ATOM 0 HD21 ASN A 122 16.132 5.936 -2.966 1.00 0.00 H new ATOM 0 HD22 ASN A 122 15.041 7.172 -3.601 1.00 0.00 H new ATOM 1882 N ALA A 123 11.357 3.708 -1.709 1.00 0.00 N ATOM 1883 CA ALA A 123 11.008 3.622 -0.297 1.00 0.00 C ATOM 1884 C ALA A 123 12.231 3.800 0.589 1.00 0.00 C ATOM 1885 O ALA A 123 12.113 3.907 1.806 1.00 0.00 O ATOM 1886 CB ALA A 123 10.328 2.297 0.000 1.00 0.00 C ATOM 0 H ALA A 123 11.397 2.809 -2.189 1.00 0.00 H new ATOM 0 HA ALA A 123 10.314 4.433 -0.075 1.00 0.00 H new ATOM 0 HB1 ALA A 123 10.073 2.248 1.059 1.00 0.00 H new ATOM 0 HB2 ALA A 123 9.419 2.213 -0.596 1.00 0.00 H new ATOM 0 HB3 ALA A 123 11.003 1.478 -0.249 1.00 0.00 H new ATOM 1892 N ASP A 124 13.405 3.834 -0.024 1.00 0.00 N ATOM 1893 CA ASP A 124 14.631 4.062 0.723 1.00 0.00 C ATOM 1894 C ASP A 124 14.623 5.464 1.320 1.00 0.00 C ATOM 1895 O ASP A 124 15.072 5.678 2.446 1.00 0.00 O ATOM 1896 CB ASP A 124 15.855 3.888 -0.173 1.00 0.00 C ATOM 1897 CG ASP A 124 17.142 3.878 0.620 1.00 0.00 C ATOM 1898 OD1 ASP A 124 17.473 2.821 1.195 1.00 0.00 O ATOM 1899 OD2 ASP A 124 17.834 4.916 0.665 1.00 0.00 O ATOM 0 H ASP A 124 13.534 3.708 -1.028 1.00 0.00 H new ATOM 0 HA ASP A 124 14.684 3.327 1.526 1.00 0.00 H new ATOM 0 HB2 ASP A 124 15.766 2.956 -0.731 1.00 0.00 H new ATOM 0 HB3 ASP A 124 15.886 4.696 -0.904 1.00 0.00 H new ATOM 1904 N GLU A 125 14.091 6.409 0.553 1.00 0.00 N ATOM 1905 CA GLU A 125 13.992 7.797 0.988 1.00 0.00 C ATOM 1906 C GLU A 125 12.571 8.120 1.432 1.00 0.00 C ATOM 1907 O GLU A 125 12.349 8.982 2.284 1.00 0.00 O ATOM 1908 CB GLU A 125 14.365 8.744 -0.156 1.00 0.00 C ATOM 1909 CG GLU A 125 15.698 8.441 -0.812 1.00 0.00 C ATOM 1910 CD GLU A 125 15.966 9.346 -1.997 1.00 0.00 C ATOM 1911 OE1 GLU A 125 16.501 10.457 -1.790 1.00 0.00 O ATOM 1912 OE2 GLU A 125 15.641 8.957 -3.138 1.00 0.00 O ATOM 0 H GLU A 125 13.719 6.237 -0.381 1.00 0.00 H new ATOM 0 HA GLU A 125 14.680 7.932 1.823 1.00 0.00 H new ATOM 0 HB2 GLU A 125 13.583 8.703 -0.914 1.00 0.00 H new ATOM 0 HB3 GLU A 125 14.386 9.765 0.226 1.00 0.00 H new ATOM 0 HG2 GLU A 125 16.497 8.556 -0.080 1.00 0.00 H new ATOM 0 HG3 GLU A 125 15.713 7.401 -1.139 1.00 0.00 H new ATOM 1919 N GLY A 126 11.611 7.410 0.851 1.00 0.00 N ATOM 1920 CA GLY A 126 10.227 7.816 0.958 1.00 0.00 C ATOM 1921 C GLY A 126 9.923 8.834 -0.117 1.00 0.00 C ATOM 1922 O GLY A 126 9.565 9.974 0.162 1.00 0.00 O ATOM 0 H GLY A 126 11.769 6.561 0.308 1.00 0.00 H new ATOM 0 HA2 GLY A 126 9.573 6.951 0.852 1.00 0.00 H new ATOM 0 HA3 GLY A 126 10.036 8.241 1.943 1.00 0.00 H new ATOM 1926 N TYR A 127 10.076 8.410 -1.357 1.00 0.00 N ATOM 1927 CA TYR A 127 10.127 9.330 -2.479 1.00 0.00 C ATOM 1928 C TYR A 127 9.281 8.792 -3.621 1.00 0.00 C ATOM 1929 O TYR A 127 9.478 7.662 -4.067 1.00 0.00 O ATOM 1930 CB TYR A 127 11.594 9.482 -2.902 1.00 0.00 C ATOM 1931 CG TYR A 127 11.892 10.660 -3.803 1.00 0.00 C ATOM 1932 CD1 TYR A 127 11.714 11.963 -3.357 1.00 0.00 C ATOM 1933 CD2 TYR A 127 12.383 10.467 -5.088 1.00 0.00 C ATOM 1934 CE1 TYR A 127 12.012 13.041 -4.167 1.00 0.00 C ATOM 1935 CE2 TYR A 127 12.689 11.541 -5.902 1.00 0.00 C ATOM 1936 CZ TYR A 127 12.502 12.824 -5.437 1.00 0.00 C ATOM 1937 OH TYR A 127 12.810 13.895 -6.245 1.00 0.00 O ATOM 0 H TYR A 127 10.168 7.427 -1.615 1.00 0.00 H new ATOM 0 HA TYR A 127 9.727 10.305 -2.200 1.00 0.00 H new ATOM 0 HB2 TYR A 127 12.206 9.569 -2.004 1.00 0.00 H new ATOM 0 HB3 TYR A 127 11.904 8.569 -3.411 1.00 0.00 H new ATOM 0 HD1 TYR A 127 11.336 12.136 -2.360 1.00 0.00 H new ATOM 0 HD2 TYR A 127 12.528 9.462 -5.457 1.00 0.00 H new ATOM 0 HE1 TYR A 127 11.862 14.048 -3.808 1.00 0.00 H new ATOM 0 HE2 TYR A 127 13.073 11.375 -6.898 1.00 0.00 H new ATOM 0 HH TYR A 127 13.088 14.654 -5.691 1.00 0.00 H new ATOM 1947 N VAL A 128 8.331 9.589 -4.080 1.00 0.00 N ATOM 1948 CA VAL A 128 7.396 9.137 -5.095 1.00 0.00 C ATOM 1949 C VAL A 128 7.426 10.066 -6.303 1.00 0.00 C ATOM 1950 O VAL A 128 7.057 11.239 -6.205 1.00 0.00 O ATOM 1951 CB VAL A 128 5.956 9.066 -4.539 1.00 0.00 C ATOM 1952 CG1 VAL A 128 5.028 8.400 -5.541 1.00 0.00 C ATOM 1953 CG2 VAL A 128 5.919 8.325 -3.208 1.00 0.00 C ATOM 0 H VAL A 128 8.187 10.549 -3.767 1.00 0.00 H new ATOM 0 HA VAL A 128 7.703 8.136 -5.400 1.00 0.00 H new ATOM 0 HB VAL A 128 5.611 10.086 -4.370 1.00 0.00 H new ATOM 0 HG11 VAL A 128 4.019 8.359 -5.131 1.00 0.00 H new ATOM 0 HG12 VAL A 128 5.021 8.974 -6.467 1.00 0.00 H new ATOM 0 HG13 VAL A 128 5.378 7.388 -5.744 1.00 0.00 H new ATOM 0 HG21 VAL A 128 4.894 8.290 -2.840 1.00 0.00 H new ATOM 0 HG22 VAL A 128 6.290 7.309 -3.347 1.00 0.00 H new ATOM 0 HG23 VAL A 128 6.547 8.845 -2.485 1.00 0.00 H new ATOM 1963 N GLU A 129 7.888 9.546 -7.431 1.00 0.00 N ATOM 1964 CA GLU A 129 7.917 10.309 -8.670 1.00 0.00 C ATOM 1965 C GLU A 129 6.857 9.794 -9.635 1.00 0.00 C ATOM 1966 O GLU A 129 6.929 8.657 -10.099 1.00 0.00 O ATOM 1967 CB GLU A 129 9.295 10.229 -9.336 1.00 0.00 C ATOM 1968 CG GLU A 129 10.417 10.830 -8.511 1.00 0.00 C ATOM 1969 CD GLU A 129 11.723 10.882 -9.278 1.00 0.00 C ATOM 1970 OE1 GLU A 129 11.977 11.899 -9.959 1.00 0.00 O ATOM 1971 OE2 GLU A 129 12.502 9.911 -9.211 1.00 0.00 O ATOM 0 H GLU A 129 8.249 8.596 -7.513 1.00 0.00 H new ATOM 0 HA GLU A 129 7.708 11.350 -8.423 1.00 0.00 H new ATOM 0 HB2 GLU A 129 9.528 9.184 -9.540 1.00 0.00 H new ATOM 0 HB3 GLU A 129 9.252 10.740 -10.298 1.00 0.00 H new ATOM 0 HG2 GLU A 129 10.139 11.837 -8.201 1.00 0.00 H new ATOM 0 HG3 GLU A 129 10.553 10.243 -7.603 1.00 0.00 H new ATOM 1978 N LEU A 130 5.875 10.624 -9.928 1.00 0.00 N ATOM 1979 CA LEU A 130 4.831 10.255 -10.867 1.00 0.00 C ATOM 1980 C LEU A 130 5.285 10.571 -12.282 1.00 0.00 C ATOM 1981 O LEU A 130 5.753 11.680 -12.556 1.00 0.00 O ATOM 1982 CB LEU A 130 3.538 11.012 -10.547 1.00 0.00 C ATOM 1983 CG LEU A 130 2.349 10.682 -11.456 1.00 0.00 C ATOM 1984 CD1 LEU A 130 1.863 9.262 -11.212 1.00 0.00 C ATOM 1985 CD2 LEU A 130 1.219 11.682 -11.244 1.00 0.00 C ATOM 0 H LEU A 130 5.777 11.558 -9.530 1.00 0.00 H new ATOM 0 HA LEU A 130 4.636 9.186 -10.782 1.00 0.00 H new ATOM 0 HB2 LEU A 130 3.257 10.799 -9.516 1.00 0.00 H new ATOM 0 HB3 LEU A 130 3.737 12.082 -10.609 1.00 0.00 H new ATOM 0 HG LEU A 130 2.680 10.754 -12.492 1.00 0.00 H new ATOM 0 HD11 LEU A 130 1.019 9.049 -11.868 1.00 0.00 H new ATOM 0 HD12 LEU A 130 2.671 8.560 -11.420 1.00 0.00 H new ATOM 0 HD13 LEU A 130 1.551 9.158 -10.173 1.00 0.00 H new ATOM 0 HD21 LEU A 130 0.384 11.431 -11.898 1.00 0.00 H new ATOM 0 HD22 LEU A 130 0.890 11.645 -10.205 1.00 0.00 H new ATOM 0 HD23 LEU A 130 1.573 12.686 -11.477 1.00 0.00 H new ATOM 1997 N ILE A 131 5.168 9.603 -13.176 1.00 0.00 N ATOM 1998 CA ILE A 131 5.563 9.813 -14.550 1.00 0.00 C ATOM 1999 C ILE A 131 4.427 9.455 -15.485 1.00 0.00 C ATOM 2000 O ILE A 131 4.010 8.303 -15.599 1.00 0.00 O ATOM 2001 CB ILE A 131 6.849 9.049 -14.911 1.00 0.00 C ATOM 2002 CG1 ILE A 131 7.168 9.200 -16.401 1.00 0.00 C ATOM 2003 CG2 ILE A 131 6.744 7.582 -14.521 1.00 0.00 C ATOM 2004 CD1 ILE A 131 8.520 8.641 -16.791 1.00 0.00 C ATOM 0 H ILE A 131 4.805 8.672 -12.973 1.00 0.00 H new ATOM 0 HA ILE A 131 5.790 10.873 -14.669 1.00 0.00 H new ATOM 0 HB ILE A 131 7.671 9.484 -14.342 1.00 0.00 H new ATOM 0 HG12 ILE A 131 6.395 8.697 -16.982 1.00 0.00 H new ATOM 0 HG13 ILE A 131 7.131 10.256 -16.667 1.00 0.00 H new ATOM 0 HG21 ILE A 131 7.667 7.068 -14.788 1.00 0.00 H new ATOM 0 HG22 ILE A 131 6.582 7.502 -13.446 1.00 0.00 H new ATOM 0 HG23 ILE A 131 5.908 7.124 -15.049 1.00 0.00 H new ATOM 0 HD11 ILE A 131 8.678 8.783 -17.860 1.00 0.00 H new ATOM 0 HD12 ILE A 131 9.302 9.160 -16.237 1.00 0.00 H new ATOM 0 HD13 ILE A 131 8.555 7.577 -16.557 1.00 0.00 H new ATOM 2016 N GLU A 132 3.937 10.476 -16.139 1.00 0.00 N ATOM 2017 CA GLU A 132 2.765 10.369 -16.986 1.00 0.00 C ATOM 2018 C GLU A 132 3.183 9.964 -18.391 1.00 0.00 C ATOM 2019 O GLU A 132 3.562 10.802 -19.209 1.00 0.00 O ATOM 2020 CB GLU A 132 2.018 11.704 -16.990 1.00 0.00 C ATOM 2021 CG GLU A 132 1.673 12.193 -15.589 1.00 0.00 C ATOM 2022 CD GLU A 132 1.237 13.644 -15.556 1.00 0.00 C ATOM 2023 OE1 GLU A 132 2.115 14.532 -15.596 1.00 0.00 O ATOM 2024 OE2 GLU A 132 0.017 13.910 -15.472 1.00 0.00 O ATOM 0 H GLU A 132 4.338 11.413 -16.102 1.00 0.00 H new ATOM 0 HA GLU A 132 2.094 9.602 -16.600 1.00 0.00 H new ATOM 0 HB2 GLU A 132 2.628 12.455 -17.492 1.00 0.00 H new ATOM 0 HB3 GLU A 132 1.101 11.600 -17.569 1.00 0.00 H new ATOM 0 HG2 GLU A 132 0.877 11.571 -15.180 1.00 0.00 H new ATOM 0 HG3 GLU A 132 2.541 12.066 -14.942 1.00 0.00 H new