USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 784 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ -148:sc= 0 (180deg=-0.592) USER MOD Single : A 14 LYS NZ :NH3+ 169:sc= -0.398! (180deg=-0.548!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 44:sc= 0.861 USER MOD Single : A 28 ASN : amide:sc= -2.78! C(o=-2.8!,f=-6.2!) USER MOD Single : A 29 THR OG1 : rot -44:sc= 0.756 USER MOD Single : A 31 GLN : amide:sc= -0.369 K(o=-0.37,f=-1.6) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 44 SER OG : rot 180:sc= -0.567 USER MOD Single : A 46 HIS : no HD1:sc= -0.551 K(o=-0.55,f=-1.4) USER MOD Single : A 47 ASN : amide:sc= -0.0721 K(o=-0.072,f=-2.7!) USER MOD Single : A 48 CYS SG : rot 180:sc= -0.727 USER MOD Single : A 50 GLN : amide:sc= -0.0179 X(o=-0.018,f=-0.018) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 HIS : no HD1:sc= -1.12 K(o=-1.1,f=-2!) USER MOD Single : A 61 ASN :FLIP amide:sc= 0.145 F(o=-4.5!,f=0.14) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0.0577 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS : no HD1:sc= -4.57! X(o=-4.6!,f=-4.3) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 86:sc= 0.514 USER MOD Single : A 97 ASN : amide:sc= -0.461 K(o=-0.46,f=-2.1!) USER MOD Single : A 98 SER OG : rot 8:sc= 0.83 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.758 16.332 6.198 1.00 0.00 N ATOM 2 CA GLY A 1 2.576 15.881 7.565 1.00 0.00 C ATOM 3 C GLY A 1 3.886 15.779 8.321 1.00 0.00 C ATOM 4 O GLY A 1 4.894 15.334 7.772 1.00 0.00 O ATOM 0 H1 GLY A 1 1.834 16.385 5.724 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.201 17.273 6.199 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.370 15.662 5.690 1.00 0.00 H new ATOM 0 HA2 GLY A 1 1.912 16.570 8.086 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.086 14.908 7.561 1.00 0.00 H new ATOM 8 N SER A 2 3.873 16.194 9.583 1.00 0.00 N ATOM 9 CA SER A 2 5.070 16.153 10.414 1.00 0.00 C ATOM 10 C SER A 2 5.255 14.771 11.033 1.00 0.00 C ATOM 11 O SER A 2 6.285 14.125 10.840 1.00 0.00 O ATOM 12 CB SER A 2 4.988 17.211 11.517 1.00 0.00 C ATOM 13 OG SER A 2 6.134 17.169 12.349 1.00 0.00 O ATOM 0 H SER A 2 3.046 16.563 10.053 1.00 0.00 H new ATOM 0 HA SER A 2 5.930 16.366 9.779 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.895 18.201 11.070 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.093 17.047 12.117 1.00 0.00 H new ATOM 0 HG SER A 2 6.059 17.855 13.045 1.00 0.00 H new ATOM 19 N SER A 3 4.248 14.323 11.777 1.00 0.00 N ATOM 20 CA SER A 3 4.300 13.019 12.427 1.00 0.00 C ATOM 21 C SER A 3 4.507 11.908 11.402 1.00 0.00 C ATOM 22 O SER A 3 3.955 11.951 10.303 1.00 0.00 O ATOM 23 CB SER A 3 3.013 12.767 13.215 1.00 0.00 C ATOM 24 OG SER A 3 3.047 13.426 14.470 1.00 0.00 O ATOM 0 H SER A 3 3.387 14.844 11.944 1.00 0.00 H new ATOM 0 HA SER A 3 5.146 13.017 13.115 1.00 0.00 H new ATOM 0 HB2 SER A 3 2.156 13.117 12.640 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.879 11.696 13.366 1.00 0.00 H new ATOM 0 HG SER A 3 2.213 13.251 14.954 1.00 0.00 H new ATOM 30 N GLY A 4 5.308 10.912 11.771 1.00 0.00 N ATOM 31 CA GLY A 4 5.575 9.804 10.873 1.00 0.00 C ATOM 32 C GLY A 4 7.017 9.343 10.934 1.00 0.00 C ATOM 33 O GLY A 4 7.939 10.152 10.835 1.00 0.00 O ATOM 0 H GLY A 4 5.776 10.853 12.675 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.919 8.970 11.125 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.335 10.102 9.852 1.00 0.00 H new ATOM 37 N SER A 5 7.214 8.039 11.100 1.00 0.00 N ATOM 38 CA SER A 5 8.555 7.472 11.180 1.00 0.00 C ATOM 39 C SER A 5 9.111 7.193 9.787 1.00 0.00 C ATOM 40 O SER A 5 9.042 6.067 9.293 1.00 0.00 O ATOM 41 CB SER A 5 8.538 6.182 12.003 1.00 0.00 C ATOM 42 OG SER A 5 8.503 6.463 13.391 1.00 0.00 O ATOM 0 H SER A 5 6.462 7.355 11.182 1.00 0.00 H new ATOM 0 HA SER A 5 9.202 8.199 11.671 1.00 0.00 H new ATOM 0 HB2 SER A 5 7.670 5.583 11.728 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.422 5.587 11.771 1.00 0.00 H new ATOM 0 HG SER A 5 8.491 5.622 13.895 1.00 0.00 H new ATOM 48 N SER A 6 9.662 8.226 9.158 1.00 0.00 N ATOM 49 CA SER A 6 10.226 8.095 7.820 1.00 0.00 C ATOM 50 C SER A 6 9.197 7.523 6.850 1.00 0.00 C ATOM 51 O SER A 6 9.486 6.596 6.095 1.00 0.00 O ATOM 52 CB SER A 6 11.466 7.199 7.853 1.00 0.00 C ATOM 53 OG SER A 6 12.523 7.816 8.565 1.00 0.00 O ATOM 0 H SER A 6 9.730 9.164 9.554 1.00 0.00 H new ATOM 0 HA SER A 6 10.512 9.088 7.474 1.00 0.00 H new ATOM 0 HB2 SER A 6 11.217 6.246 8.319 1.00 0.00 H new ATOM 0 HB3 SER A 6 11.788 6.981 6.835 1.00 0.00 H new ATOM 0 HG SER A 6 13.303 7.222 8.573 1.00 0.00 H new ATOM 59 N GLY A 7 7.992 8.085 6.877 1.00 0.00 N ATOM 60 CA GLY A 7 6.937 7.619 5.996 1.00 0.00 C ATOM 61 C GLY A 7 6.009 8.737 5.561 1.00 0.00 C ATOM 62 O GLY A 7 5.681 9.624 6.350 1.00 0.00 O ATOM 0 H GLY A 7 7.728 8.854 7.493 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.382 7.156 5.115 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.358 6.847 6.504 1.00 0.00 H new ATOM 66 N THR A 8 5.585 8.696 4.302 1.00 0.00 N ATOM 67 CA THR A 8 4.692 9.714 3.763 1.00 0.00 C ATOM 68 C THR A 8 3.287 9.159 3.557 1.00 0.00 C ATOM 69 O THR A 8 3.041 8.396 2.622 1.00 0.00 O ATOM 70 CB THR A 8 5.215 10.267 2.424 1.00 0.00 C ATOM 71 OG1 THR A 8 6.454 10.955 2.628 1.00 0.00 O ATOM 72 CG2 THR A 8 4.202 11.213 1.796 1.00 0.00 C ATOM 0 H THR A 8 5.846 7.968 3.636 1.00 0.00 H new ATOM 0 HA THR A 8 4.657 10.523 4.493 1.00 0.00 H new ATOM 0 HB THR A 8 5.373 9.427 1.747 1.00 0.00 H new ATOM 0 HG1 THR A 8 6.780 11.302 1.772 1.00 0.00 H new ATOM 0 HG21 THR A 8 4.594 11.591 0.852 1.00 0.00 H new ATOM 0 HG22 THR A 8 3.269 10.679 1.614 1.00 0.00 H new ATOM 0 HG23 THR A 8 4.016 12.048 2.472 1.00 0.00 H new ATOM 80 N LEU A 9 2.369 9.547 4.434 1.00 0.00 N ATOM 81 CA LEU A 9 0.986 9.090 4.348 1.00 0.00 C ATOM 82 C LEU A 9 0.355 9.511 3.025 1.00 0.00 C ATOM 83 O LEU A 9 0.322 10.695 2.690 1.00 0.00 O ATOM 84 CB LEU A 9 0.170 9.646 5.516 1.00 0.00 C ATOM 85 CG LEU A 9 -1.067 8.840 5.914 1.00 0.00 C ATOM 86 CD1 LEU A 9 -2.152 8.970 4.857 1.00 0.00 C ATOM 87 CD2 LEU A 9 -0.704 7.378 6.132 1.00 0.00 C ATOM 0 H LEU A 9 2.557 10.177 5.214 1.00 0.00 H new ATOM 0 HA LEU A 9 0.985 8.001 4.399 1.00 0.00 H new ATOM 0 HB2 LEU A 9 0.823 9.724 6.385 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -0.146 10.658 5.263 1.00 0.00 H new ATOM 0 HG LEU A 9 -1.452 9.241 6.851 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -3.024 8.390 5.158 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -2.432 10.018 4.750 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -1.778 8.596 3.904 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -1.597 6.820 6.415 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -0.293 6.964 5.211 1.00 0.00 H new ATOM 0 HD23 LEU A 9 0.038 7.302 6.927 1.00 0.00 H new ATOM 99 N VAL A 10 -0.148 8.534 2.277 1.00 0.00 N ATOM 100 CA VAL A 10 -0.782 8.804 0.993 1.00 0.00 C ATOM 101 C VAL A 10 -2.249 8.388 1.006 1.00 0.00 C ATOM 102 O VAL A 10 -2.568 7.200 1.055 1.00 0.00 O ATOM 103 CB VAL A 10 -0.062 8.069 -0.154 1.00 0.00 C ATOM 104 CG1 VAL A 10 -0.730 8.374 -1.486 1.00 0.00 C ATOM 105 CG2 VAL A 10 1.410 8.449 -0.187 1.00 0.00 C ATOM 0 H VAL A 10 -0.128 7.548 2.539 1.00 0.00 H new ATOM 0 HA VAL A 10 -0.713 9.879 0.826 1.00 0.00 H new ATOM 0 HB VAL A 10 -0.133 6.996 0.023 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -0.208 7.846 -2.284 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.770 8.048 -1.455 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -0.692 9.447 -1.675 1.00 0.00 H new ATOM 0 HG21 VAL A 10 1.904 7.921 -1.003 1.00 0.00 H new ATOM 0 HG22 VAL A 10 1.505 9.524 -0.340 1.00 0.00 H new ATOM 0 HG23 VAL A 10 1.878 8.175 0.758 1.00 0.00 H new ATOM 115 N ARG A 11 -3.138 9.375 0.961 1.00 0.00 N ATOM 116 CA ARG A 11 -4.572 9.112 0.968 1.00 0.00 C ATOM 117 C ARG A 11 -5.079 8.819 -0.441 1.00 0.00 C ATOM 118 O ARG A 11 -5.082 9.696 -1.306 1.00 0.00 O ATOM 119 CB ARG A 11 -5.328 10.305 1.555 1.00 0.00 C ATOM 120 CG ARG A 11 -6.799 10.025 1.817 1.00 0.00 C ATOM 121 CD ARG A 11 -7.377 10.991 2.839 1.00 0.00 C ATOM 122 NE ARG A 11 -6.724 10.867 4.140 1.00 0.00 N ATOM 123 CZ ARG A 11 -6.797 11.793 5.090 1.00 0.00 C ATOM 124 NH1 ARG A 11 -7.491 12.904 4.886 1.00 0.00 N ATOM 125 NH2 ARG A 11 -6.175 11.607 6.248 1.00 0.00 N ATOM 0 H ARG A 11 -2.891 10.364 0.919 1.00 0.00 H new ATOM 0 HA ARG A 11 -4.751 8.235 1.590 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -4.851 10.602 2.489 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -5.244 11.150 0.871 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -7.357 10.104 0.884 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -6.918 9.002 2.174 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -7.268 12.012 2.475 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -8.445 10.805 2.950 1.00 0.00 H new ATOM 0 HE ARG A 11 -6.183 10.024 4.329 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -7.971 13.050 3.998 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -7.545 13.613 5.617 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -5.641 10.753 6.409 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -6.231 12.318 6.977 1.00 0.00 H new ATOM 139 N VAL A 12 -5.505 7.580 -0.666 1.00 0.00 N ATOM 140 CA VAL A 12 -6.015 7.172 -1.970 1.00 0.00 C ATOM 141 C VAL A 12 -7.530 7.008 -1.941 1.00 0.00 C ATOM 142 O VAL A 12 -8.055 6.087 -1.315 1.00 0.00 O ATOM 143 CB VAL A 12 -5.375 5.849 -2.433 1.00 0.00 C ATOM 144 CG1 VAL A 12 -5.952 5.417 -3.772 1.00 0.00 C ATOM 145 CG2 VAL A 12 -3.862 5.990 -2.515 1.00 0.00 C ATOM 0 H VAL A 12 -5.507 6.842 0.038 1.00 0.00 H new ATOM 0 HA VAL A 12 -5.752 7.961 -2.674 1.00 0.00 H new ATOM 0 HB VAL A 12 -5.606 5.077 -1.699 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.488 4.481 -4.083 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -7.028 5.274 -3.675 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.754 6.186 -4.519 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -3.426 5.047 -2.843 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -3.608 6.775 -3.227 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -3.467 6.250 -1.533 1.00 0.00 H new ATOM 155 N LYS A 13 -8.230 7.908 -2.624 1.00 0.00 N ATOM 156 CA LYS A 13 -9.686 7.863 -2.680 1.00 0.00 C ATOM 157 C LYS A 13 -10.162 6.697 -3.540 1.00 0.00 C ATOM 158 O LYS A 13 -9.436 6.215 -4.409 1.00 0.00 O ATOM 159 CB LYS A 13 -10.236 9.179 -3.236 1.00 0.00 C ATOM 160 CG LYS A 13 -11.631 9.514 -2.738 1.00 0.00 C ATOM 161 CD LYS A 13 -12.701 8.978 -3.675 1.00 0.00 C ATOM 162 CE LYS A 13 -13.074 10.000 -4.738 1.00 0.00 C ATOM 163 NZ LYS A 13 -13.982 9.423 -5.768 1.00 0.00 N ATOM 0 H LYS A 13 -7.812 8.678 -3.147 1.00 0.00 H new ATOM 0 HA LYS A 13 -10.059 7.719 -1.666 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -9.559 9.989 -2.966 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -10.251 9.126 -4.325 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -11.774 9.093 -1.743 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -11.735 10.595 -2.645 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -12.343 8.067 -4.154 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -13.587 8.709 -3.101 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -13.557 10.855 -4.266 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -12.169 10.371 -5.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -13.798 9.876 -6.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -13.812 8.400 -5.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -14.971 9.589 -5.492 1.00 0.00 H new ATOM 177 N LYS A 14 -11.388 6.248 -3.293 1.00 0.00 N ATOM 178 CA LYS A 14 -11.964 5.140 -4.045 1.00 0.00 C ATOM 179 C LYS A 14 -12.396 5.593 -5.436 1.00 0.00 C ATOM 180 O LYS A 14 -13.516 5.321 -5.868 1.00 0.00 O ATOM 181 CB LYS A 14 -13.161 4.553 -3.294 1.00 0.00 C ATOM 182 CG LYS A 14 -12.905 4.342 -1.812 1.00 0.00 C ATOM 183 CD LYS A 14 -12.300 2.975 -1.540 1.00 0.00 C ATOM 184 CE LYS A 14 -11.697 2.900 -0.145 1.00 0.00 C ATOM 185 NZ LYS A 14 -12.746 2.888 0.912 1.00 0.00 N ATOM 0 H LYS A 14 -12.002 6.635 -2.577 1.00 0.00 H new ATOM 0 HA LYS A 14 -11.199 4.371 -4.153 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -14.017 5.217 -3.415 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -13.431 3.599 -3.747 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -12.234 5.118 -1.444 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -13.841 4.443 -1.262 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -13.067 2.208 -1.648 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -11.531 2.762 -2.282 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -11.086 2.001 -0.061 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -11.034 3.751 0.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -12.314 2.650 1.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -13.189 3.827 0.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -13.469 2.178 0.676 1.00 0.00 H new ATOM 199 N SER A 15 -11.500 6.285 -6.133 1.00 0.00 N ATOM 200 CA SER A 15 -11.790 6.779 -7.474 1.00 0.00 C ATOM 201 C SER A 15 -12.061 5.622 -8.431 1.00 0.00 C ATOM 202 O SER A 15 -13.115 5.558 -9.063 1.00 0.00 O ATOM 203 CB SER A 15 -10.624 7.622 -7.993 1.00 0.00 C ATOM 204 OG SER A 15 -11.052 8.513 -9.010 1.00 0.00 O ATOM 0 H SER A 15 -10.567 6.516 -5.791 1.00 0.00 H new ATOM 0 HA SER A 15 -12.683 7.401 -7.421 1.00 0.00 H new ATOM 0 HB2 SER A 15 -10.185 8.187 -7.171 1.00 0.00 H new ATOM 0 HB3 SER A 15 -9.843 6.968 -8.382 1.00 0.00 H new ATOM 0 HG SER A 15 -10.289 9.042 -9.324 1.00 0.00 H new ATOM 210 N ALA A 16 -11.101 4.709 -8.533 1.00 0.00 N ATOM 211 CA ALA A 16 -11.235 3.553 -9.411 1.00 0.00 C ATOM 212 C ALA A 16 -12.336 2.618 -8.922 1.00 0.00 C ATOM 213 O ALA A 16 -12.715 2.647 -7.752 1.00 0.00 O ATOM 214 CB ALA A 16 -9.912 2.808 -9.509 1.00 0.00 C ATOM 0 H ALA A 16 -10.221 4.747 -8.018 1.00 0.00 H new ATOM 0 HA ALA A 16 -11.512 3.911 -10.403 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -10.027 1.947 -10.168 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -9.149 3.474 -9.912 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -9.611 2.469 -8.518 1.00 0.00 H new ATOM 220 N ALA A 17 -12.848 1.789 -9.827 1.00 0.00 N ATOM 221 CA ALA A 17 -13.905 0.845 -9.488 1.00 0.00 C ATOM 222 C ALA A 17 -13.335 -0.395 -8.808 1.00 0.00 C ATOM 223 O ALA A 17 -13.992 -1.016 -7.971 1.00 0.00 O ATOM 224 CB ALA A 17 -14.684 0.454 -10.735 1.00 0.00 C ATOM 0 H ALA A 17 -12.547 1.753 -10.801 1.00 0.00 H new ATOM 0 HA ALA A 17 -14.583 1.333 -8.788 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -15.470 -0.252 -10.467 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -15.131 1.344 -11.179 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -14.010 -0.011 -11.454 1.00 0.00 H new ATOM 230 N THR A 18 -12.107 -0.754 -9.173 1.00 0.00 N ATOM 231 CA THR A 18 -11.450 -1.921 -8.599 1.00 0.00 C ATOM 232 C THR A 18 -9.963 -1.664 -8.383 1.00 0.00 C ATOM 233 O THR A 18 -9.189 -1.599 -9.339 1.00 0.00 O ATOM 234 CB THR A 18 -11.620 -3.160 -9.499 1.00 0.00 C ATOM 235 OG1 THR A 18 -11.032 -2.918 -10.782 1.00 0.00 O ATOM 236 CG2 THR A 18 -13.091 -3.509 -9.667 1.00 0.00 C ATOM 0 H THR A 18 -11.548 -0.253 -9.864 1.00 0.00 H new ATOM 0 HA THR A 18 -11.926 -2.111 -7.637 1.00 0.00 H new ATOM 0 HB THR A 18 -11.116 -4.000 -9.022 1.00 0.00 H new ATOM 0 HG1 THR A 18 -10.161 -2.484 -10.666 1.00 0.00 H new ATOM 0 HG21 THR A 18 -13.186 -4.387 -10.306 1.00 0.00 H new ATOM 0 HG22 THR A 18 -13.528 -3.721 -8.691 1.00 0.00 H new ATOM 0 HG23 THR A 18 -13.614 -2.669 -10.124 1.00 0.00 H new ATOM 244 N LEU A 19 -9.569 -1.520 -7.123 1.00 0.00 N ATOM 245 CA LEU A 19 -8.173 -1.270 -6.781 1.00 0.00 C ATOM 246 C LEU A 19 -7.239 -2.010 -7.733 1.00 0.00 C ATOM 247 O LEU A 19 -7.474 -3.169 -8.074 1.00 0.00 O ATOM 248 CB LEU A 19 -7.896 -1.700 -5.340 1.00 0.00 C ATOM 249 CG LEU A 19 -6.438 -1.622 -4.885 1.00 0.00 C ATOM 250 CD1 LEU A 19 -6.060 -0.188 -4.547 1.00 0.00 C ATOM 251 CD2 LEU A 19 -6.204 -2.533 -3.688 1.00 0.00 C ATOM 0 H LEU A 19 -10.197 -1.572 -6.321 1.00 0.00 H new ATOM 0 HA LEU A 19 -7.987 -0.200 -6.877 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -8.497 -1.080 -4.675 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -8.240 -2.727 -5.216 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.803 -1.960 -5.704 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -5.019 -0.152 -4.225 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -6.189 0.440 -5.429 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -6.701 0.178 -3.744 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -5.161 -2.465 -3.377 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -6.849 -2.225 -2.865 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -6.434 -3.562 -3.964 1.00 0.00 H new ATOM 263 N GLY A 20 -6.177 -1.333 -8.158 1.00 0.00 N ATOM 264 CA GLY A 20 -5.222 -1.942 -9.065 1.00 0.00 C ATOM 265 C GLY A 20 -3.786 -1.692 -8.649 1.00 0.00 C ATOM 266 O GLY A 20 -3.118 -0.815 -9.196 1.00 0.00 O ATOM 0 H GLY A 20 -5.961 -0.373 -7.890 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -5.402 -3.016 -9.110 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -5.379 -1.550 -10.070 1.00 0.00 H new ATOM 270 N ILE A 21 -3.310 -2.464 -7.677 1.00 0.00 N ATOM 271 CA ILE A 21 -1.945 -2.321 -7.188 1.00 0.00 C ATOM 272 C ILE A 21 -1.305 -3.683 -6.938 1.00 0.00 C ATOM 273 O ILE A 21 -1.948 -4.597 -6.424 1.00 0.00 O ATOM 274 CB ILE A 21 -1.896 -1.497 -5.888 1.00 0.00 C ATOM 275 CG1 ILE A 21 -2.731 -2.173 -4.799 1.00 0.00 C ATOM 276 CG2 ILE A 21 -2.390 -0.081 -6.139 1.00 0.00 C ATOM 277 CD1 ILE A 21 -2.590 -1.525 -3.439 1.00 0.00 C ATOM 0 H ILE A 21 -3.850 -3.195 -7.213 1.00 0.00 H new ATOM 0 HA ILE A 21 -1.386 -1.796 -7.962 1.00 0.00 H new ATOM 0 HB ILE A 21 -0.862 -1.445 -5.547 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -3.780 -2.155 -5.094 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -2.438 -3.220 -4.726 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -2.349 0.489 -5.211 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -1.758 0.398 -6.887 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -3.418 -0.113 -6.500 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -3.210 -2.056 -2.717 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -1.548 -1.566 -3.123 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -2.911 -0.485 -3.497 1.00 0.00 H new ATOM 289 N ALA A 22 -0.034 -3.809 -7.305 1.00 0.00 N ATOM 290 CA ALA A 22 0.695 -5.057 -7.117 1.00 0.00 C ATOM 291 C ALA A 22 1.868 -4.870 -6.161 1.00 0.00 C ATOM 292 O ALA A 22 2.529 -3.831 -6.170 1.00 0.00 O ATOM 293 CB ALA A 22 1.184 -5.590 -8.456 1.00 0.00 C ATOM 0 H ALA A 22 0.512 -3.062 -7.734 1.00 0.00 H new ATOM 0 HA ALA A 22 0.013 -5.784 -6.676 1.00 0.00 H new ATOM 0 HB1 ALA A 22 1.727 -6.522 -8.300 1.00 0.00 H new ATOM 0 HB2 ALA A 22 0.330 -5.772 -9.109 1.00 0.00 H new ATOM 0 HB3 ALA A 22 1.846 -4.858 -8.919 1.00 0.00 H new ATOM 299 N ILE A 23 2.120 -5.881 -5.336 1.00 0.00 N ATOM 300 CA ILE A 23 3.213 -5.827 -4.374 1.00 0.00 C ATOM 301 C ILE A 23 3.942 -7.164 -4.294 1.00 0.00 C ATOM 302 O ILE A 23 3.564 -8.128 -4.958 1.00 0.00 O ATOM 303 CB ILE A 23 2.709 -5.445 -2.970 1.00 0.00 C ATOM 304 CG1 ILE A 23 1.306 -6.009 -2.736 1.00 0.00 C ATOM 305 CG2 ILE A 23 2.713 -3.933 -2.799 1.00 0.00 C ATOM 306 CD1 ILE A 23 0.962 -6.186 -1.274 1.00 0.00 C ATOM 0 H ILE A 23 1.582 -6.747 -5.315 1.00 0.00 H new ATOM 0 HA ILE A 23 3.904 -5.060 -4.724 1.00 0.00 H new ATOM 0 HB ILE A 23 3.382 -5.877 -2.229 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.575 -5.344 -3.195 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.222 -6.972 -3.240 1.00 0.00 H new ATOM 0 HG21 ILE A 23 2.354 -3.679 -1.802 1.00 0.00 H new ATOM 0 HG22 ILE A 23 3.727 -3.555 -2.927 1.00 0.00 H new ATOM 0 HG23 ILE A 23 2.060 -3.481 -3.546 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -0.047 -6.589 -1.184 1.00 0.00 H new ATOM 0 HD12 ILE A 23 1.671 -6.875 -0.814 1.00 0.00 H new ATOM 0 HD13 ILE A 23 1.014 -5.222 -0.769 1.00 0.00 H new ATOM 318 N GLU A 24 4.987 -7.214 -3.474 1.00 0.00 N ATOM 319 CA GLU A 24 5.768 -8.434 -3.306 1.00 0.00 C ATOM 320 C GLU A 24 6.524 -8.419 -1.981 1.00 0.00 C ATOM 321 O GLU A 24 6.548 -7.408 -1.279 1.00 0.00 O ATOM 322 CB GLU A 24 6.753 -8.599 -4.466 1.00 0.00 C ATOM 323 CG GLU A 24 7.901 -7.605 -4.435 1.00 0.00 C ATOM 324 CD GLU A 24 9.059 -8.023 -5.320 1.00 0.00 C ATOM 325 OE1 GLU A 24 8.836 -8.832 -6.245 1.00 0.00 O ATOM 326 OE2 GLU A 24 10.188 -7.543 -5.088 1.00 0.00 O ATOM 0 H GLU A 24 5.312 -6.424 -2.916 1.00 0.00 H new ATOM 0 HA GLU A 24 5.078 -9.278 -3.301 1.00 0.00 H new ATOM 0 HB2 GLU A 24 7.159 -9.611 -4.446 1.00 0.00 H new ATOM 0 HB3 GLU A 24 6.214 -8.490 -5.407 1.00 0.00 H new ATOM 0 HG2 GLU A 24 7.539 -6.628 -4.754 1.00 0.00 H new ATOM 0 HG3 GLU A 24 8.254 -7.495 -3.410 1.00 0.00 H new ATOM 333 N GLY A 25 7.140 -9.548 -1.644 1.00 0.00 N ATOM 334 CA GLY A 25 7.888 -9.644 -0.404 1.00 0.00 C ATOM 335 C GLY A 25 7.138 -10.411 0.667 1.00 0.00 C ATOM 336 O GLY A 25 6.480 -11.410 0.379 1.00 0.00 O ATOM 0 H GLY A 25 7.134 -10.398 -2.208 1.00 0.00 H new ATOM 0 HA2 GLY A 25 8.843 -10.134 -0.596 1.00 0.00 H new ATOM 0 HA3 GLY A 25 8.112 -8.641 -0.039 1.00 0.00 H new ATOM 340 N GLY A 26 7.239 -9.944 1.908 1.00 0.00 N ATOM 341 CA GLY A 26 6.562 -10.607 3.007 1.00 0.00 C ATOM 342 C GLY A 26 7.491 -10.900 4.168 1.00 0.00 C ATOM 343 O GLY A 26 8.690 -11.101 3.977 1.00 0.00 O ATOM 0 H GLY A 26 7.777 -9.119 2.172 1.00 0.00 H new ATOM 0 HA2 GLY A 26 5.739 -9.982 3.353 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.125 -11.540 2.651 1.00 0.00 H new ATOM 347 N ALA A 27 6.937 -10.924 5.376 1.00 0.00 N ATOM 348 CA ALA A 27 7.725 -11.195 6.573 1.00 0.00 C ATOM 349 C ALA A 27 8.731 -12.314 6.325 1.00 0.00 C ATOM 350 O ALA A 27 9.932 -12.136 6.525 1.00 0.00 O ATOM 351 CB ALA A 27 6.811 -11.551 7.736 1.00 0.00 C ATOM 0 H ALA A 27 5.946 -10.759 5.552 1.00 0.00 H new ATOM 0 HA ALA A 27 8.281 -10.292 6.826 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.412 -11.751 8.623 1.00 0.00 H new ATOM 0 HB2 ALA A 27 6.135 -10.719 7.935 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.230 -12.438 7.484 1.00 0.00 H new ATOM 357 N ASN A 28 8.232 -13.466 5.891 1.00 0.00 N ATOM 358 CA ASN A 28 9.089 -14.615 5.618 1.00 0.00 C ATOM 359 C ASN A 28 10.286 -14.210 4.764 1.00 0.00 C ATOM 360 O ASN A 28 11.412 -14.647 5.005 1.00 0.00 O ATOM 361 CB ASN A 28 8.293 -15.714 4.911 1.00 0.00 C ATOM 362 CG ASN A 28 9.169 -16.873 4.476 1.00 0.00 C ATOM 363 OD1 ASN A 28 10.376 -16.718 4.291 1.00 0.00 O ATOM 364 ND2 ASN A 28 8.562 -18.043 4.310 1.00 0.00 N ATOM 0 H ASN A 28 7.240 -13.630 5.721 1.00 0.00 H new ATOM 0 HA ASN A 28 9.457 -14.997 6.570 1.00 0.00 H new ATOM 0 HB2 ASN A 28 7.514 -16.082 5.579 1.00 0.00 H new ATOM 0 HB3 ASN A 28 7.793 -15.293 4.039 1.00 0.00 H new ATOM 0 HD21 ASN A 28 9.099 -18.859 4.018 1.00 0.00 H new ATOM 0 HD22 ASN A 28 7.559 -18.125 4.475 1.00 0.00 H new ATOM 371 N THR A 29 10.037 -13.370 3.764 1.00 0.00 N ATOM 372 CA THR A 29 11.093 -12.906 2.873 1.00 0.00 C ATOM 373 C THR A 29 11.883 -11.765 3.506 1.00 0.00 C ATOM 374 O THR A 29 11.359 -11.019 4.333 1.00 0.00 O ATOM 375 CB THR A 29 10.522 -12.433 1.523 1.00 0.00 C ATOM 376 OG1 THR A 29 9.761 -11.234 1.706 1.00 0.00 O ATOM 377 CG2 THR A 29 9.644 -13.508 0.901 1.00 0.00 C ATOM 0 H THR A 29 9.112 -12.997 3.551 1.00 0.00 H new ATOM 0 HA THR A 29 11.757 -13.753 2.701 1.00 0.00 H new ATOM 0 HB THR A 29 11.356 -12.234 0.850 1.00 0.00 H new ATOM 0 HG1 THR A 29 9.190 -11.326 2.497 1.00 0.00 H new ATOM 0 HG21 THR A 29 9.252 -13.151 -0.052 1.00 0.00 H new ATOM 0 HG22 THR A 29 10.234 -14.409 0.736 1.00 0.00 H new ATOM 0 HG23 THR A 29 8.816 -13.735 1.572 1.00 0.00 H new ATOM 385 N ARG A 30 13.145 -11.636 3.110 1.00 0.00 N ATOM 386 CA ARG A 30 14.007 -10.586 3.639 1.00 0.00 C ATOM 387 C ARG A 30 13.220 -9.299 3.865 1.00 0.00 C ATOM 388 O ARG A 30 13.429 -8.599 4.856 1.00 0.00 O ATOM 389 CB ARG A 30 15.172 -10.323 2.683 1.00 0.00 C ATOM 390 CG ARG A 30 16.061 -9.166 3.109 1.00 0.00 C ATOM 391 CD ARG A 30 17.207 -8.955 2.132 1.00 0.00 C ATOM 392 NE ARG A 30 18.213 -8.037 2.659 1.00 0.00 N ATOM 393 CZ ARG A 30 19.411 -7.866 2.111 1.00 0.00 C ATOM 394 NH1 ARG A 30 19.750 -8.547 1.025 1.00 0.00 N ATOM 395 NH2 ARG A 30 20.272 -7.011 2.648 1.00 0.00 N ATOM 0 H ARG A 30 13.593 -12.245 2.425 1.00 0.00 H new ATOM 0 HA ARG A 30 14.402 -10.923 4.597 1.00 0.00 H new ATOM 0 HB2 ARG A 30 15.778 -11.226 2.605 1.00 0.00 H new ATOM 0 HB3 ARG A 30 14.776 -10.118 1.688 1.00 0.00 H new ATOM 0 HG2 ARG A 30 15.467 -8.255 3.177 1.00 0.00 H new ATOM 0 HG3 ARG A 30 16.461 -9.360 4.104 1.00 0.00 H new ATOM 0 HD2 ARG A 30 17.674 -9.914 1.908 1.00 0.00 H new ATOM 0 HD3 ARG A 30 16.816 -8.564 1.193 1.00 0.00 H new ATOM 0 HE ARG A 30 17.983 -7.498 3.494 1.00 0.00 H new ATOM 0 HH11 ARG A 30 19.090 -9.204 0.608 1.00 0.00 H new ATOM 0 HH12 ARG A 30 20.670 -8.414 0.606 1.00 0.00 H new ATOM 0 HH21 ARG A 30 20.014 -6.484 3.483 1.00 0.00 H new ATOM 0 HH22 ARG A 30 21.192 -6.881 2.226 1.00 0.00 H new ATOM 409 N GLN A 31 12.317 -8.993 2.940 1.00 0.00 N ATOM 410 CA GLN A 31 11.500 -7.789 3.038 1.00 0.00 C ATOM 411 C GLN A 31 10.318 -8.009 3.976 1.00 0.00 C ATOM 412 O GLN A 31 9.440 -8.834 3.725 1.00 0.00 O ATOM 413 CB GLN A 31 10.998 -7.374 1.654 1.00 0.00 C ATOM 414 CG GLN A 31 10.612 -5.906 1.562 1.00 0.00 C ATOM 415 CD GLN A 31 11.781 -4.978 1.831 1.00 0.00 C ATOM 416 OE1 GLN A 31 12.939 -5.395 1.805 1.00 0.00 O ATOM 417 NE2 GLN A 31 11.482 -3.710 2.090 1.00 0.00 N ATOM 0 H GLN A 31 12.132 -9.562 2.114 1.00 0.00 H new ATOM 0 HA GLN A 31 12.120 -6.991 3.446 1.00 0.00 H new ATOM 0 HB2 GLN A 31 11.773 -7.584 0.917 1.00 0.00 H new ATOM 0 HB3 GLN A 31 10.135 -7.985 1.391 1.00 0.00 H new ATOM 0 HG2 GLN A 31 10.211 -5.701 0.569 1.00 0.00 H new ATOM 0 HG3 GLN A 31 9.816 -5.698 2.277 1.00 0.00 H new ATOM 0 HE21 GLN A 31 10.508 -3.408 2.101 1.00 0.00 H new ATOM 0 HE22 GLN A 31 12.227 -3.039 2.278 1.00 0.00 H new ATOM 426 N PRO A 32 10.293 -7.253 5.084 1.00 0.00 N ATOM 427 CA PRO A 32 9.224 -7.347 6.083 1.00 0.00 C ATOM 428 C PRO A 32 7.897 -6.803 5.564 1.00 0.00 C ATOM 429 O PRO A 32 6.864 -7.468 5.653 1.00 0.00 O ATOM 430 CB PRO A 32 9.741 -6.485 7.238 1.00 0.00 C ATOM 431 CG PRO A 32 10.675 -5.517 6.599 1.00 0.00 C ATOM 432 CD PRO A 32 11.307 -6.249 5.448 1.00 0.00 C ATOM 0 HA PRO A 32 9.017 -8.380 6.364 1.00 0.00 H new ATOM 0 HB2 PRO A 32 8.924 -5.971 7.745 1.00 0.00 H new ATOM 0 HB3 PRO A 32 10.250 -7.091 7.987 1.00 0.00 H new ATOM 0 HG2 PRO A 32 10.142 -4.631 6.253 1.00 0.00 H new ATOM 0 HG3 PRO A 32 11.430 -5.178 7.308 1.00 0.00 H new ATOM 0 HD2 PRO A 32 11.525 -5.579 4.617 1.00 0.00 H new ATOM 0 HD3 PRO A 32 12.249 -6.716 5.737 1.00 0.00 H new ATOM 440 N LEU A 33 7.932 -5.591 5.021 1.00 0.00 N ATOM 441 CA LEU A 33 6.732 -4.957 4.487 1.00 0.00 C ATOM 442 C LEU A 33 6.642 -5.147 2.976 1.00 0.00 C ATOM 443 O LEU A 33 7.645 -5.340 2.289 1.00 0.00 O ATOM 444 CB LEU A 33 6.725 -3.465 4.826 1.00 0.00 C ATOM 445 CG LEU A 33 6.422 -3.109 6.282 1.00 0.00 C ATOM 446 CD1 LEU A 33 5.142 -3.788 6.742 1.00 0.00 C ATOM 447 CD2 LEU A 33 7.587 -3.498 7.180 1.00 0.00 C ATOM 0 H LEU A 33 8.778 -5.028 4.939 1.00 0.00 H new ATOM 0 HA LEU A 33 5.865 -5.432 4.947 1.00 0.00 H new ATOM 0 HB2 LEU A 33 7.699 -3.049 4.566 1.00 0.00 H new ATOM 0 HB3 LEU A 33 5.988 -2.972 4.192 1.00 0.00 H new ATOM 0 HG LEU A 33 6.281 -2.030 6.350 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.942 -3.523 7.780 1.00 0.00 H new ATOM 0 HD12 LEU A 33 4.311 -3.459 6.118 1.00 0.00 H new ATOM 0 HD13 LEU A 33 5.253 -4.869 6.658 1.00 0.00 H new ATOM 0 HD21 LEU A 33 7.354 -3.237 8.212 1.00 0.00 H new ATOM 0 HD22 LEU A 33 7.760 -4.572 7.107 1.00 0.00 H new ATOM 0 HD23 LEU A 33 8.483 -2.964 6.865 1.00 0.00 H new ATOM 459 N PRO A 34 5.412 -5.090 2.445 1.00 0.00 N ATOM 460 CA PRO A 34 5.161 -5.251 1.009 1.00 0.00 C ATOM 461 C PRO A 34 5.674 -4.068 0.195 1.00 0.00 C ATOM 462 O PRO A 34 5.571 -2.918 0.621 1.00 0.00 O ATOM 463 CB PRO A 34 3.636 -5.339 0.923 1.00 0.00 C ATOM 464 CG PRO A 34 3.146 -4.618 2.131 1.00 0.00 C ATOM 465 CD PRO A 34 4.170 -4.864 3.204 1.00 0.00 C ATOM 0 HA PRO A 34 5.675 -6.121 0.600 1.00 0.00 H new ATOM 0 HB2 PRO A 34 3.264 -4.877 0.008 1.00 0.00 H new ATOM 0 HB3 PRO A 34 3.299 -6.376 0.917 1.00 0.00 H new ATOM 0 HG2 PRO A 34 3.038 -3.552 1.932 1.00 0.00 H new ATOM 0 HG3 PRO A 34 2.166 -4.987 2.435 1.00 0.00 H new ATOM 0 HD2 PRO A 34 4.260 -4.011 3.877 1.00 0.00 H new ATOM 0 HD3 PRO A 34 3.911 -5.727 3.817 1.00 0.00 H new ATOM 473 N ARG A 35 6.227 -4.358 -0.978 1.00 0.00 N ATOM 474 CA ARG A 35 6.757 -3.318 -1.851 1.00 0.00 C ATOM 475 C ARG A 35 6.016 -3.299 -3.185 1.00 0.00 C ATOM 476 O ARG A 35 5.850 -4.335 -3.829 1.00 0.00 O ATOM 477 CB ARG A 35 8.252 -3.535 -2.089 1.00 0.00 C ATOM 478 CG ARG A 35 8.822 -2.675 -3.206 1.00 0.00 C ATOM 479 CD ARG A 35 10.340 -2.617 -3.144 1.00 0.00 C ATOM 480 NE ARG A 35 10.884 -1.578 -4.016 1.00 0.00 N ATOM 481 CZ ARG A 35 10.905 -1.668 -5.341 1.00 0.00 C ATOM 482 NH1 ARG A 35 10.414 -2.742 -5.944 1.00 0.00 N ATOM 483 NH2 ARG A 35 11.416 -0.681 -6.066 1.00 0.00 N ATOM 0 H ARG A 35 6.320 -5.305 -1.346 1.00 0.00 H new ATOM 0 HA ARG A 35 6.610 -2.356 -1.359 1.00 0.00 H new ATOM 0 HB2 ARG A 35 8.793 -3.323 -1.167 1.00 0.00 H new ATOM 0 HB3 ARG A 35 8.425 -4.585 -2.326 1.00 0.00 H new ATOM 0 HG2 ARG A 35 8.511 -3.076 -4.171 1.00 0.00 H new ATOM 0 HG3 ARG A 35 8.415 -1.666 -3.134 1.00 0.00 H new ATOM 0 HD2 ARG A 35 10.654 -2.430 -2.117 1.00 0.00 H new ATOM 0 HD3 ARG A 35 10.752 -3.584 -3.432 1.00 0.00 H new ATOM 0 HE ARG A 35 11.268 -0.738 -3.584 1.00 0.00 H new ATOM 0 HH11 ARG A 35 10.019 -3.502 -5.390 1.00 0.00 H new ATOM 0 HH12 ARG A 35 10.431 -2.808 -6.962 1.00 0.00 H new ATOM 0 HH21 ARG A 35 11.793 0.148 -5.606 1.00 0.00 H new ATOM 0 HH22 ARG A 35 11.432 -0.751 -7.083 1.00 0.00 H new ATOM 497 N ILE A 36 5.573 -2.114 -3.593 1.00 0.00 N ATOM 498 CA ILE A 36 4.851 -1.961 -4.850 1.00 0.00 C ATOM 499 C ILE A 36 5.751 -2.268 -6.042 1.00 0.00 C ATOM 500 O ILE A 36 6.731 -1.565 -6.291 1.00 0.00 O ATOM 501 CB ILE A 36 4.283 -0.537 -5.003 1.00 0.00 C ATOM 502 CG1 ILE A 36 3.372 -0.198 -3.821 1.00 0.00 C ATOM 503 CG2 ILE A 36 3.527 -0.406 -6.316 1.00 0.00 C ATOM 504 CD1 ILE A 36 2.771 1.188 -3.899 1.00 0.00 C ATOM 0 H ILE A 36 5.701 -1.247 -3.072 1.00 0.00 H new ATOM 0 HA ILE A 36 4.026 -2.673 -4.828 1.00 0.00 H new ATOM 0 HB ILE A 36 5.113 0.170 -5.012 1.00 0.00 H new ATOM 0 HG12 ILE A 36 2.567 -0.932 -3.771 1.00 0.00 H new ATOM 0 HG13 ILE A 36 3.942 -0.286 -2.896 1.00 0.00 H new ATOM 0 HG21 ILE A 36 3.132 0.606 -6.409 1.00 0.00 H new ATOM 0 HG22 ILE A 36 4.203 -0.610 -7.147 1.00 0.00 H new ATOM 0 HG23 ILE A 36 2.704 -1.120 -6.335 1.00 0.00 H new ATOM 0 HD11 ILE A 36 2.137 1.359 -3.029 1.00 0.00 H new ATOM 0 HD12 ILE A 36 3.569 1.930 -3.918 1.00 0.00 H new ATOM 0 HD13 ILE A 36 2.173 1.275 -4.806 1.00 0.00 H new ATOM 516 N VAL A 37 5.410 -3.321 -6.778 1.00 0.00 N ATOM 517 CA VAL A 37 6.185 -3.720 -7.946 1.00 0.00 C ATOM 518 C VAL A 37 5.536 -3.222 -9.233 1.00 0.00 C ATOM 519 O VAL A 37 6.222 -2.880 -10.196 1.00 0.00 O ATOM 520 CB VAL A 37 6.340 -5.251 -8.021 1.00 0.00 C ATOM 521 CG1 VAL A 37 7.355 -5.736 -6.998 1.00 0.00 C ATOM 522 CG2 VAL A 37 4.996 -5.932 -7.816 1.00 0.00 C ATOM 0 H VAL A 37 4.602 -3.913 -6.586 1.00 0.00 H new ATOM 0 HA VAL A 37 7.171 -3.267 -7.841 1.00 0.00 H new ATOM 0 HB VAL A 37 6.707 -5.514 -9.013 1.00 0.00 H new ATOM 0 HG11 VAL A 37 7.451 -6.820 -7.066 1.00 0.00 H new ATOM 0 HG12 VAL A 37 8.322 -5.273 -7.197 1.00 0.00 H new ATOM 0 HG13 VAL A 37 7.021 -5.463 -5.997 1.00 0.00 H new ATOM 0 HG21 VAL A 37 5.124 -7.013 -7.872 1.00 0.00 H new ATOM 0 HG22 VAL A 37 4.598 -5.664 -6.837 1.00 0.00 H new ATOM 0 HG23 VAL A 37 4.302 -5.608 -8.591 1.00 0.00 H new ATOM 532 N THR A 38 4.207 -3.184 -9.242 1.00 0.00 N ATOM 533 CA THR A 38 3.464 -2.728 -10.410 1.00 0.00 C ATOM 534 C THR A 38 2.163 -2.046 -10.002 1.00 0.00 C ATOM 535 O THR A 38 1.504 -2.465 -9.050 1.00 0.00 O ATOM 536 CB THR A 38 3.142 -3.896 -11.361 1.00 0.00 C ATOM 537 OG1 THR A 38 4.353 -4.435 -11.903 1.00 0.00 O ATOM 538 CG2 THR A 38 2.234 -3.438 -12.493 1.00 0.00 C ATOM 0 H THR A 38 3.623 -3.464 -8.454 1.00 0.00 H new ATOM 0 HA THR A 38 4.099 -2.011 -10.929 1.00 0.00 H new ATOM 0 HB THR A 38 2.625 -4.667 -10.791 1.00 0.00 H new ATOM 0 HG1 THR A 38 4.140 -5.178 -12.505 1.00 0.00 H new ATOM 0 HG21 THR A 38 2.020 -4.280 -13.152 1.00 0.00 H new ATOM 0 HG22 THR A 38 1.301 -3.055 -12.079 1.00 0.00 H new ATOM 0 HG23 THR A 38 2.729 -2.650 -13.060 1.00 0.00 H new ATOM 546 N ILE A 39 1.799 -0.994 -10.728 1.00 0.00 N ATOM 547 CA ILE A 39 0.575 -0.256 -10.442 1.00 0.00 C ATOM 548 C ILE A 39 -0.398 -0.329 -11.614 1.00 0.00 C ATOM 549 O ILE A 39 -0.253 0.395 -12.598 1.00 0.00 O ATOM 550 CB ILE A 39 0.870 1.222 -10.125 1.00 0.00 C ATOM 551 CG1 ILE A 39 1.696 1.337 -8.842 1.00 0.00 C ATOM 552 CG2 ILE A 39 -0.427 2.006 -9.999 1.00 0.00 C ATOM 553 CD1 ILE A 39 2.100 2.756 -8.509 1.00 0.00 C ATOM 0 H ILE A 39 2.334 -0.634 -11.518 1.00 0.00 H new ATOM 0 HA ILE A 39 0.122 -0.723 -9.568 1.00 0.00 H new ATOM 0 HB ILE A 39 1.449 1.645 -10.946 1.00 0.00 H new ATOM 0 HG12 ILE A 39 1.121 0.927 -8.011 1.00 0.00 H new ATOM 0 HG13 ILE A 39 2.593 0.726 -8.941 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.202 3.049 -9.775 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -0.980 1.948 -10.937 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -1.030 1.584 -9.195 1.00 0.00 H new ATOM 0 HD11 ILE A 39 2.683 2.762 -7.588 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.702 3.163 -9.321 1.00 0.00 H new ATOM 0 HD13 ILE A 39 1.207 3.367 -8.377 1.00 0.00 H new ATOM 565 N GLN A 40 -1.389 -1.207 -11.499 1.00 0.00 N ATOM 566 CA GLN A 40 -2.387 -1.373 -12.549 1.00 0.00 C ATOM 567 C GLN A 40 -3.031 -0.037 -12.905 1.00 0.00 C ATOM 568 O GLN A 40 -3.280 0.794 -12.032 1.00 0.00 O ATOM 569 CB GLN A 40 -3.461 -2.369 -12.108 1.00 0.00 C ATOM 570 CG GLN A 40 -2.999 -3.817 -12.143 1.00 0.00 C ATOM 571 CD GLN A 40 -4.146 -4.791 -12.325 1.00 0.00 C ATOM 572 OE1 GLN A 40 -5.263 -4.546 -11.866 1.00 0.00 O ATOM 573 NE2 GLN A 40 -3.877 -5.905 -12.997 1.00 0.00 N ATOM 0 H GLN A 40 -1.522 -1.814 -10.690 1.00 0.00 H new ATOM 0 HA GLN A 40 -1.884 -1.760 -13.435 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -3.780 -2.122 -11.095 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -4.333 -2.259 -12.752 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -2.285 -3.947 -12.956 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -2.474 -4.049 -11.217 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -2.938 -6.067 -13.360 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -4.610 -6.598 -13.150 1.00 0.00 H new ATOM 582 N ARG A 41 -3.297 0.162 -14.192 1.00 0.00 N ATOM 583 CA ARG A 41 -3.910 1.397 -14.663 1.00 0.00 C ATOM 584 C ARG A 41 -5.298 1.581 -14.057 1.00 0.00 C ATOM 585 O ARG A 41 -5.684 2.688 -13.686 1.00 0.00 O ATOM 586 CB ARG A 41 -4.004 1.395 -16.190 1.00 0.00 C ATOM 587 CG ARG A 41 -2.707 1.782 -16.881 1.00 0.00 C ATOM 588 CD ARG A 41 -2.771 1.514 -18.376 1.00 0.00 C ATOM 589 NE ARG A 41 -3.005 0.102 -18.670 1.00 0.00 N ATOM 590 CZ ARG A 41 -4.215 -0.439 -18.758 1.00 0.00 C ATOM 591 NH1 ARG A 41 -5.294 0.309 -18.576 1.00 0.00 N ATOM 592 NH2 ARG A 41 -4.346 -1.732 -19.028 1.00 0.00 N ATOM 0 H ARG A 41 -3.097 -0.517 -14.927 1.00 0.00 H new ATOM 0 HA ARG A 41 -3.281 2.229 -14.346 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -4.302 0.402 -16.526 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -4.790 2.085 -16.498 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -2.503 2.839 -16.708 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -1.880 1.222 -16.445 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -3.567 2.113 -18.818 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -1.838 1.831 -18.841 1.00 0.00 H new ATOM 0 HE ARG A 41 -2.195 -0.501 -18.816 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -5.196 1.303 -18.368 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -6.222 -0.109 -18.644 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -3.517 -2.310 -19.168 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -5.275 -2.147 -19.096 1.00 0.00 H new ATOM 606 N GLY A 42 -6.046 0.485 -13.961 1.00 0.00 N ATOM 607 CA GLY A 42 -7.383 0.547 -13.401 1.00 0.00 C ATOM 608 C GLY A 42 -7.387 0.395 -11.892 1.00 0.00 C ATOM 609 O GLY A 42 -8.192 -0.352 -11.339 1.00 0.00 O ATOM 0 H GLY A 42 -5.749 -0.444 -14.261 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.842 1.499 -13.668 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.996 -0.238 -13.844 1.00 0.00 H new ATOM 613 N GLY A 43 -6.483 1.107 -11.225 1.00 0.00 N ATOM 614 CA GLY A 43 -6.402 1.032 -9.778 1.00 0.00 C ATOM 615 C GLY A 43 -6.495 2.395 -9.121 1.00 0.00 C ATOM 616 O GLY A 43 -5.992 3.384 -9.654 1.00 0.00 O ATOM 0 H GLY A 43 -5.806 1.734 -11.661 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -7.205 0.397 -9.405 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -5.462 0.558 -9.494 1.00 0.00 H new ATOM 620 N SER A 44 -7.142 2.448 -7.961 1.00 0.00 N ATOM 621 CA SER A 44 -7.304 3.701 -7.234 1.00 0.00 C ATOM 622 C SER A 44 -5.957 4.385 -7.021 1.00 0.00 C ATOM 623 O SER A 44 -5.894 5.572 -6.701 1.00 0.00 O ATOM 624 CB SER A 44 -7.979 3.448 -5.884 1.00 0.00 C ATOM 625 OG SER A 44 -7.259 2.491 -5.126 1.00 0.00 O ATOM 0 H SER A 44 -7.562 1.638 -7.505 1.00 0.00 H new ATOM 0 HA SER A 44 -7.935 4.359 -7.831 1.00 0.00 H new ATOM 0 HB2 SER A 44 -8.046 4.382 -5.327 1.00 0.00 H new ATOM 0 HB3 SER A 44 -8.999 3.098 -6.044 1.00 0.00 H new ATOM 0 HG SER A 44 -7.709 2.348 -4.267 1.00 0.00 H new ATOM 631 N ALA A 45 -4.881 3.627 -7.202 1.00 0.00 N ATOM 632 CA ALA A 45 -3.534 4.159 -7.033 1.00 0.00 C ATOM 633 C ALA A 45 -3.119 4.997 -8.237 1.00 0.00 C ATOM 634 O ALA A 45 -3.023 6.221 -8.151 1.00 0.00 O ATOM 635 CB ALA A 45 -2.543 3.026 -6.810 1.00 0.00 C ATOM 0 H ALA A 45 -4.915 2.642 -7.466 1.00 0.00 H new ATOM 0 HA ALA A 45 -3.534 4.806 -6.156 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -1.542 3.438 -6.685 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -2.821 2.471 -5.914 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -2.556 2.357 -7.670 1.00 0.00 H new ATOM 641 N HIS A 46 -2.874 4.330 -9.361 1.00 0.00 N ATOM 642 CA HIS A 46 -2.469 5.014 -10.583 1.00 0.00 C ATOM 643 C HIS A 46 -3.293 6.281 -10.795 1.00 0.00 C ATOM 644 O HIS A 46 -2.745 7.365 -10.986 1.00 0.00 O ATOM 645 CB HIS A 46 -2.622 4.085 -11.788 1.00 0.00 C ATOM 646 CG HIS A 46 -1.721 4.434 -12.932 1.00 0.00 C ATOM 647 ND1 HIS A 46 -1.213 3.494 -13.804 1.00 0.00 N ATOM 648 CD2 HIS A 46 -1.238 5.629 -13.346 1.00 0.00 C ATOM 649 CE1 HIS A 46 -0.456 4.096 -14.704 1.00 0.00 C ATOM 650 NE2 HIS A 46 -0.454 5.391 -14.448 1.00 0.00 N ATOM 0 H HIS A 46 -2.949 3.317 -9.450 1.00 0.00 H new ATOM 0 HA HIS A 46 -1.421 5.296 -10.482 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -2.418 3.061 -11.475 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -3.657 4.114 -12.129 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -1.433 6.590 -12.894 1.00 0.00 H new ATOM 0 HE1 HIS A 46 0.072 3.611 -15.512 1.00 0.00 H new ATOM 0 HE2 HIS A 46 0.048 6.100 -14.982 1.00 0.00 H new ATOM 659 N ASN A 47 -4.614 6.134 -10.762 1.00 0.00 N ATOM 660 CA ASN A 47 -5.514 7.266 -10.952 1.00 0.00 C ATOM 661 C ASN A 47 -5.029 8.483 -10.170 1.00 0.00 C ATOM 662 O ASN A 47 -4.998 9.598 -10.693 1.00 0.00 O ATOM 663 CB ASN A 47 -6.932 6.896 -10.514 1.00 0.00 C ATOM 664 CG ASN A 47 -7.581 5.891 -11.445 1.00 0.00 C ATOM 665 OD1 ASN A 47 -6.903 5.059 -12.049 1.00 0.00 O ATOM 666 ND2 ASN A 47 -8.902 5.963 -11.567 1.00 0.00 N ATOM 0 H ASN A 47 -5.085 5.243 -10.606 1.00 0.00 H new ATOM 0 HA ASN A 47 -5.523 7.517 -12.013 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -6.902 6.486 -9.505 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -7.544 7.797 -10.474 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -9.394 5.313 -12.180 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -9.424 6.668 -11.048 1.00 0.00 H new ATOM 673 N CYS A 48 -4.652 8.262 -8.916 1.00 0.00 N ATOM 674 CA CYS A 48 -4.169 9.340 -8.061 1.00 0.00 C ATOM 675 C CYS A 48 -2.794 9.819 -8.515 1.00 0.00 C ATOM 676 O CYS A 48 -2.550 11.020 -8.630 1.00 0.00 O ATOM 677 CB CYS A 48 -4.105 8.876 -6.605 1.00 0.00 C ATOM 678 SG CYS A 48 -3.713 10.190 -5.427 1.00 0.00 S ATOM 0 H CYS A 48 -4.671 7.346 -8.468 1.00 0.00 H new ATOM 0 HA CYS A 48 -4.868 10.172 -8.139 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -5.064 8.434 -6.334 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -3.355 8.090 -6.518 1.00 0.00 H new ATOM 0 HG CYS A 48 -3.684 9.699 -4.224 1.00 0.00 H new ATOM 684 N GLY A 49 -1.897 8.872 -8.770 1.00 0.00 N ATOM 685 CA GLY A 49 -0.556 9.217 -9.207 1.00 0.00 C ATOM 686 C GLY A 49 0.356 9.576 -8.051 1.00 0.00 C ATOM 687 O GLY A 49 1.566 9.361 -8.117 1.00 0.00 O ATOM 0 H GLY A 49 -2.075 7.871 -8.682 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -0.129 8.378 -9.756 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -0.608 10.057 -9.899 1.00 0.00 H new ATOM 691 N GLN A 50 -0.225 10.125 -6.989 1.00 0.00 N ATOM 692 CA GLN A 50 0.545 10.516 -5.815 1.00 0.00 C ATOM 693 C GLN A 50 1.539 9.426 -5.427 1.00 0.00 C ATOM 694 O GLN A 50 2.533 9.690 -4.749 1.00 0.00 O ATOM 695 CB GLN A 50 -0.390 10.811 -4.641 1.00 0.00 C ATOM 696 CG GLN A 50 0.239 11.681 -3.565 1.00 0.00 C ATOM 697 CD GLN A 50 0.340 13.137 -3.976 1.00 0.00 C ATOM 698 OE1 GLN A 50 1.401 13.606 -4.389 1.00 0.00 O ATOM 699 NE2 GLN A 50 -0.768 13.861 -3.866 1.00 0.00 N ATOM 0 H GLN A 50 -1.226 10.309 -6.918 1.00 0.00 H new ATOM 0 HA GLN A 50 1.103 11.419 -6.062 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -1.287 11.304 -5.017 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -0.708 9.869 -4.195 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -0.351 11.605 -2.651 1.00 0.00 H new ATOM 0 HG3 GLN A 50 1.235 11.303 -3.334 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -1.626 13.431 -3.519 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -0.761 14.847 -4.129 1.00 0.00 H new ATOM 708 N LEU A 51 1.264 8.201 -5.861 1.00 0.00 N ATOM 709 CA LEU A 51 2.134 7.070 -5.559 1.00 0.00 C ATOM 710 C LEU A 51 2.975 6.690 -6.774 1.00 0.00 C ATOM 711 O LEU A 51 2.726 7.158 -7.885 1.00 0.00 O ATOM 712 CB LEU A 51 1.302 5.869 -5.105 1.00 0.00 C ATOM 713 CG LEU A 51 0.464 6.071 -3.842 1.00 0.00 C ATOM 714 CD1 LEU A 51 -0.704 5.098 -3.814 1.00 0.00 C ATOM 715 CD2 LEU A 51 1.326 5.909 -2.598 1.00 0.00 C ATOM 0 H LEU A 51 0.446 7.966 -6.423 1.00 0.00 H new ATOM 0 HA LEU A 51 2.806 7.365 -4.753 1.00 0.00 H new ATOM 0 HB2 LEU A 51 0.634 5.587 -5.919 1.00 0.00 H new ATOM 0 HB3 LEU A 51 1.975 5.028 -4.939 1.00 0.00 H new ATOM 0 HG LEU A 51 0.064 7.085 -3.853 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.288 5.257 -2.908 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.336 5.263 -4.687 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -0.326 4.076 -3.827 1.00 0.00 H new ATOM 0 HD21 LEU A 51 0.713 6.056 -1.709 1.00 0.00 H new ATOM 0 HD22 LEU A 51 1.756 4.907 -2.581 1.00 0.00 H new ATOM 0 HD23 LEU A 51 2.128 6.647 -2.612 1.00 0.00 H new ATOM 727 N LYS A 52 3.970 5.838 -6.554 1.00 0.00 N ATOM 728 CA LYS A 52 4.847 5.392 -7.631 1.00 0.00 C ATOM 729 C LYS A 52 5.237 3.929 -7.444 1.00 0.00 C ATOM 730 O LYS A 52 5.058 3.362 -6.366 1.00 0.00 O ATOM 731 CB LYS A 52 6.104 6.263 -7.687 1.00 0.00 C ATOM 732 CG LYS A 52 5.839 7.732 -7.408 1.00 0.00 C ATOM 733 CD LYS A 52 6.886 8.621 -8.058 1.00 0.00 C ATOM 734 CE LYS A 52 6.483 9.015 -9.471 1.00 0.00 C ATOM 735 NZ LYS A 52 5.611 10.222 -9.483 1.00 0.00 N ATOM 0 H LYS A 52 4.190 5.442 -5.640 1.00 0.00 H new ATOM 0 HA LYS A 52 4.304 5.488 -8.571 1.00 0.00 H new ATOM 0 HB2 LYS A 52 6.828 5.889 -6.963 1.00 0.00 H new ATOM 0 HB3 LYS A 52 6.560 6.165 -8.672 1.00 0.00 H new ATOM 0 HG2 LYS A 52 4.850 8.001 -7.780 1.00 0.00 H new ATOM 0 HG3 LYS A 52 5.832 7.903 -6.332 1.00 0.00 H new ATOM 0 HD2 LYS A 52 7.028 9.518 -7.455 1.00 0.00 H new ATOM 0 HD3 LYS A 52 7.843 8.099 -8.083 1.00 0.00 H new ATOM 0 HE2 LYS A 52 7.378 9.207 -10.063 1.00 0.00 H new ATOM 0 HE3 LYS A 52 5.960 8.184 -9.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 5.358 10.458 -10.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 4.746 10.030 -8.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 6.119 11.022 -9.054 1.00 0.00 H new ATOM 749 N VAL A 53 5.772 3.324 -8.500 1.00 0.00 N ATOM 750 CA VAL A 53 6.190 1.928 -8.451 1.00 0.00 C ATOM 751 C VAL A 53 7.527 1.780 -7.733 1.00 0.00 C ATOM 752 O VAL A 53 8.529 2.368 -8.137 1.00 0.00 O ATOM 753 CB VAL A 53 6.309 1.328 -9.864 1.00 0.00 C ATOM 754 CG1 VAL A 53 6.836 -0.097 -9.797 1.00 0.00 C ATOM 755 CG2 VAL A 53 4.966 1.376 -10.577 1.00 0.00 C ATOM 0 H VAL A 53 5.926 3.779 -9.400 1.00 0.00 H new ATOM 0 HA VAL A 53 5.422 1.387 -7.898 1.00 0.00 H new ATOM 0 HB VAL A 53 7.020 1.925 -10.435 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.913 -0.504 -10.805 1.00 0.00 H new ATOM 0 HG12 VAL A 53 7.820 -0.099 -9.328 1.00 0.00 H new ATOM 0 HG13 VAL A 53 6.153 -0.710 -9.209 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.068 0.948 -11.574 1.00 0.00 H new ATOM 0 HG22 VAL A 53 4.232 0.803 -10.010 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.634 2.411 -10.659 1.00 0.00 H new ATOM 765 N GLY A 54 7.535 0.988 -6.665 1.00 0.00 N ATOM 766 CA GLY A 54 8.754 0.775 -5.908 1.00 0.00 C ATOM 767 C GLY A 54 8.605 1.158 -4.449 1.00 0.00 C ATOM 768 O GLY A 54 9.528 0.977 -3.655 1.00 0.00 O ATOM 0 H GLY A 54 6.718 0.490 -6.311 1.00 0.00 H new ATOM 0 HA2 GLY A 54 9.043 -0.274 -5.977 1.00 0.00 H new ATOM 0 HA3 GLY A 54 9.561 1.358 -6.353 1.00 0.00 H new ATOM 772 N HIS A 55 7.440 1.690 -4.095 1.00 0.00 N ATOM 773 CA HIS A 55 7.173 2.100 -2.721 1.00 0.00 C ATOM 774 C HIS A 55 6.989 0.885 -1.816 1.00 0.00 C ATOM 775 O HIS A 55 6.970 -0.253 -2.285 1.00 0.00 O ATOM 776 CB HIS A 55 5.928 2.986 -2.663 1.00 0.00 C ATOM 777 CG HIS A 55 6.179 4.401 -3.084 1.00 0.00 C ATOM 778 ND1 HIS A 55 5.235 5.175 -3.725 1.00 0.00 N ATOM 779 CD2 HIS A 55 7.277 5.183 -2.951 1.00 0.00 C ATOM 780 CE1 HIS A 55 5.741 6.371 -3.970 1.00 0.00 C ATOM 781 NE2 HIS A 55 6.979 6.402 -3.509 1.00 0.00 N ATOM 0 H HIS A 55 6.666 1.847 -4.740 1.00 0.00 H new ATOM 0 HA HIS A 55 8.032 2.669 -2.365 1.00 0.00 H new ATOM 0 HB2 HIS A 55 5.157 2.557 -3.303 1.00 0.00 H new ATOM 0 HB3 HIS A 55 5.537 2.982 -1.646 1.00 0.00 H new ATOM 0 HD2 HIS A 55 8.213 4.900 -2.492 1.00 0.00 H new ATOM 0 HE1 HIS A 55 5.230 7.185 -4.463 1.00 0.00 H new ATOM 0 HE2 HIS A 55 7.611 7.201 -3.559 1.00 0.00 H new ATOM 790 N VAL A 56 6.855 1.135 -0.518 1.00 0.00 N ATOM 791 CA VAL A 56 6.673 0.062 0.452 1.00 0.00 C ATOM 792 C VAL A 56 5.552 0.391 1.432 1.00 0.00 C ATOM 793 O VAL A 56 5.703 1.254 2.296 1.00 0.00 O ATOM 794 CB VAL A 56 7.968 -0.207 1.242 1.00 0.00 C ATOM 795 CG1 VAL A 56 7.768 -1.353 2.221 1.00 0.00 C ATOM 796 CG2 VAL A 56 9.120 -0.499 0.293 1.00 0.00 C ATOM 0 H VAL A 56 6.869 2.071 -0.114 1.00 0.00 H new ATOM 0 HA VAL A 56 6.408 -0.832 -0.112 1.00 0.00 H new ATOM 0 HB VAL A 56 8.217 0.687 1.814 1.00 0.00 H new ATOM 0 HG11 VAL A 56 8.693 -1.528 2.770 1.00 0.00 H new ATOM 0 HG12 VAL A 56 6.973 -1.098 2.922 1.00 0.00 H new ATOM 0 HG13 VAL A 56 7.494 -2.255 1.674 1.00 0.00 H new ATOM 0 HG21 VAL A 56 10.027 -0.687 0.868 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.883 -1.377 -0.308 1.00 0.00 H new ATOM 0 HG23 VAL A 56 9.277 0.357 -0.363 1.00 0.00 H new ATOM 806 N ILE A 57 4.428 -0.304 1.291 1.00 0.00 N ATOM 807 CA ILE A 57 3.282 -0.087 2.164 1.00 0.00 C ATOM 808 C ILE A 57 3.520 -0.690 3.544 1.00 0.00 C ATOM 809 O ILE A 57 3.596 -1.910 3.696 1.00 0.00 O ATOM 810 CB ILE A 57 1.996 -0.690 1.567 1.00 0.00 C ATOM 811 CG1 ILE A 57 1.761 -0.149 0.156 1.00 0.00 C ATOM 812 CG2 ILE A 57 0.804 -0.388 2.462 1.00 0.00 C ATOM 813 CD1 ILE A 57 0.942 -1.074 -0.717 1.00 0.00 C ATOM 0 H ILE A 57 4.287 -1.022 0.580 1.00 0.00 H new ATOM 0 HA ILE A 57 3.157 0.992 2.258 1.00 0.00 H new ATOM 0 HB ILE A 57 2.114 -1.772 1.506 1.00 0.00 H new ATOM 0 HG12 ILE A 57 1.256 0.815 0.224 1.00 0.00 H new ATOM 0 HG13 ILE A 57 2.725 0.029 -0.321 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -0.097 -0.821 2.027 1.00 0.00 H new ATOM 0 HG22 ILE A 57 0.972 -0.818 3.449 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.681 0.691 2.552 1.00 0.00 H new ATOM 0 HD11 ILE A 57 0.815 -0.626 -1.703 1.00 0.00 H new ATOM 0 HD12 ILE A 57 1.456 -2.030 -0.816 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -0.036 -1.233 -0.262 1.00 0.00 H new ATOM 825 N LEU A 58 3.635 0.172 4.549 1.00 0.00 N ATOM 826 CA LEU A 58 3.863 -0.276 5.918 1.00 0.00 C ATOM 827 C LEU A 58 2.553 -0.332 6.698 1.00 0.00 C ATOM 828 O LEU A 58 2.358 -1.209 7.539 1.00 0.00 O ATOM 829 CB LEU A 58 4.849 0.657 6.623 1.00 0.00 C ATOM 830 CG LEU A 58 5.880 1.345 5.728 1.00 0.00 C ATOM 831 CD1 LEU A 58 6.546 2.495 6.466 1.00 0.00 C ATOM 832 CD2 LEU A 58 6.920 0.344 5.246 1.00 0.00 C ATOM 0 H LEU A 58 3.574 1.184 4.441 1.00 0.00 H new ATOM 0 HA LEU A 58 4.285 -1.280 5.880 1.00 0.00 H new ATOM 0 HB2 LEU A 58 4.280 1.426 7.145 1.00 0.00 H new ATOM 0 HB3 LEU A 58 5.381 0.084 7.382 1.00 0.00 H new ATOM 0 HG LEU A 58 5.364 1.750 4.858 1.00 0.00 H new ATOM 0 HD11 LEU A 58 7.276 2.972 5.813 1.00 0.00 H new ATOM 0 HD12 LEU A 58 5.791 3.224 6.760 1.00 0.00 H new ATOM 0 HD13 LEU A 58 7.049 2.114 7.355 1.00 0.00 H new ATOM 0 HD21 LEU A 58 7.646 0.851 4.610 1.00 0.00 H new ATOM 0 HD22 LEU A 58 7.431 -0.091 6.105 1.00 0.00 H new ATOM 0 HD23 LEU A 58 6.429 -0.446 4.677 1.00 0.00 H new ATOM 844 N GLU A 59 1.658 0.607 6.410 1.00 0.00 N ATOM 845 CA GLU A 59 0.366 0.663 7.083 1.00 0.00 C ATOM 846 C GLU A 59 -0.757 0.933 6.085 1.00 0.00 C ATOM 847 O GLU A 59 -0.585 1.692 5.131 1.00 0.00 O ATOM 848 CB GLU A 59 0.375 1.746 8.164 1.00 0.00 C ATOM 849 CG GLU A 59 -1.007 2.082 8.700 1.00 0.00 C ATOM 850 CD GLU A 59 -0.957 3.014 9.895 1.00 0.00 C ATOM 851 OE1 GLU A 59 -0.759 4.230 9.691 1.00 0.00 O ATOM 852 OE2 GLU A 59 -1.117 2.528 11.034 1.00 0.00 O ATOM 0 H GLU A 59 1.804 1.339 5.715 1.00 0.00 H new ATOM 0 HA GLU A 59 0.187 -0.305 7.551 1.00 0.00 H new ATOM 0 HB2 GLU A 59 1.006 1.418 8.990 1.00 0.00 H new ATOM 0 HB3 GLU A 59 0.827 2.650 7.757 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -1.598 2.543 7.908 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -1.517 1.161 8.983 1.00 0.00 H new ATOM 859 N VAL A 60 -1.907 0.307 6.313 1.00 0.00 N ATOM 860 CA VAL A 60 -3.058 0.480 5.436 1.00 0.00 C ATOM 861 C VAL A 60 -4.351 0.576 6.238 1.00 0.00 C ATOM 862 O VAL A 60 -4.713 -0.348 6.964 1.00 0.00 O ATOM 863 CB VAL A 60 -3.177 -0.681 4.430 1.00 0.00 C ATOM 864 CG1 VAL A 60 -4.483 -0.585 3.656 1.00 0.00 C ATOM 865 CG2 VAL A 60 -1.986 -0.688 3.483 1.00 0.00 C ATOM 0 H VAL A 60 -2.066 -0.325 7.098 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.902 1.410 4.890 1.00 0.00 H new ATOM 0 HB VAL A 60 -3.179 -1.620 4.983 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.549 -1.413 2.950 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.322 -0.632 4.350 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -4.515 0.359 3.112 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.086 -1.514 2.779 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -1.951 0.254 2.935 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.066 -0.808 4.056 1.00 0.00 H new ATOM 875 N ASN A 61 -5.044 1.703 6.101 1.00 0.00 N ATOM 876 CA ASN A 61 -6.297 1.920 6.813 1.00 0.00 C ATOM 877 C ASN A 61 -6.085 1.846 8.322 1.00 0.00 C ATOM 878 O ASN A 61 -6.974 1.431 9.065 1.00 0.00 O ATOM 879 CB ASN A 61 -7.340 0.886 6.382 1.00 0.00 C ATOM 880 CG ASN A 61 -8.759 1.363 6.621 1.00 0.00 C ATOM 881 OD1 ASN A 61 -9.492 1.603 5.540 1.00 0.00 O flip ATOM 882 ND2 ASN A 61 -9.192 1.513 7.764 1.00 0.00 N flip ATOM 0 H ASN A 61 -4.758 2.479 5.504 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.659 2.917 6.563 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -7.209 0.661 5.324 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -7.175 -0.043 6.928 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -8.593 1.317 8.566 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -10.149 1.834 7.909 1.00 0.00 H new ATOM 889 N GLY A 62 -4.901 2.253 8.769 1.00 0.00 N ATOM 890 CA GLY A 62 -4.593 2.225 10.187 1.00 0.00 C ATOM 891 C GLY A 62 -3.950 0.921 10.615 1.00 0.00 C ATOM 892 O GLY A 62 -3.224 0.875 11.609 1.00 0.00 O ATOM 0 H GLY A 62 -4.149 2.602 8.174 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -3.925 3.052 10.427 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -5.509 2.379 10.758 1.00 0.00 H new ATOM 896 N LEU A 63 -4.217 -0.143 9.866 1.00 0.00 N ATOM 897 CA LEU A 63 -3.659 -1.455 10.174 1.00 0.00 C ATOM 898 C LEU A 63 -2.186 -1.527 9.785 1.00 0.00 C ATOM 899 O LEU A 63 -1.779 -0.999 8.750 1.00 0.00 O ATOM 900 CB LEU A 63 -4.444 -2.548 9.446 1.00 0.00 C ATOM 901 CG LEU A 63 -5.728 -3.021 10.130 1.00 0.00 C ATOM 902 CD1 LEU A 63 -6.892 -2.114 9.765 1.00 0.00 C ATOM 903 CD2 LEU A 63 -6.033 -4.463 9.750 1.00 0.00 C ATOM 0 H LEU A 63 -4.816 -0.123 9.041 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.739 -1.612 11.250 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -4.699 -2.183 8.451 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.789 -3.409 9.311 1.00 0.00 H new ATOM 0 HG LEU A 63 -5.582 -2.973 11.209 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -7.797 -2.466 10.261 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -6.675 -1.096 10.087 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -7.040 -2.129 8.685 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -6.950 -4.784 10.245 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -6.160 -4.536 8.670 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -5.208 -5.104 10.063 1.00 0.00 H new ATOM 915 N THR A 64 -1.390 -2.185 10.621 1.00 0.00 N ATOM 916 CA THR A 64 0.038 -2.327 10.365 1.00 0.00 C ATOM 917 C THR A 64 0.331 -3.596 9.573 1.00 0.00 C ATOM 918 O THR A 64 -0.236 -4.655 9.845 1.00 0.00 O ATOM 919 CB THR A 64 0.844 -2.358 11.677 1.00 0.00 C ATOM 920 OG1 THR A 64 0.048 -2.916 12.729 1.00 0.00 O ATOM 921 CG2 THR A 64 1.297 -0.959 12.066 1.00 0.00 C ATOM 0 H THR A 64 -1.710 -2.628 11.482 1.00 0.00 H new ATOM 0 HA THR A 64 0.342 -1.458 9.781 1.00 0.00 H new ATOM 0 HB THR A 64 1.726 -2.979 11.521 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.569 -2.934 13.559 1.00 0.00 H new ATOM 0 HG21 THR A 64 1.864 -1.006 12.996 1.00 0.00 H new ATOM 0 HG22 THR A 64 1.927 -0.548 11.277 1.00 0.00 H new ATOM 0 HG23 THR A 64 0.425 -0.320 12.205 1.00 0.00 H new ATOM 929 N LEU A 65 1.220 -3.483 8.592 1.00 0.00 N ATOM 930 CA LEU A 65 1.589 -4.623 7.760 1.00 0.00 C ATOM 931 C LEU A 65 2.853 -5.295 8.286 1.00 0.00 C ATOM 932 O LEU A 65 3.293 -6.315 7.755 1.00 0.00 O ATOM 933 CB LEU A 65 1.801 -4.175 6.312 1.00 0.00 C ATOM 934 CG LEU A 65 0.563 -3.652 5.584 1.00 0.00 C ATOM 935 CD1 LEU A 65 0.899 -3.303 4.142 1.00 0.00 C ATOM 936 CD2 LEU A 65 -0.561 -4.676 5.638 1.00 0.00 C ATOM 0 H LEU A 65 1.698 -2.614 8.353 1.00 0.00 H new ATOM 0 HA LEU A 65 0.774 -5.346 7.795 1.00 0.00 H new ATOM 0 HB2 LEU A 65 2.561 -3.394 6.302 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.202 -5.017 5.747 1.00 0.00 H new ATOM 0 HG LEU A 65 0.226 -2.746 6.087 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.005 -2.932 3.640 1.00 0.00 H new ATOM 0 HD12 LEU A 65 1.671 -2.533 4.124 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.262 -4.193 3.627 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -1.434 -4.286 5.115 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.235 -5.600 5.161 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.821 -4.877 6.677 1.00 0.00 H new ATOM 948 N ARG A 66 3.431 -4.718 9.335 1.00 0.00 N ATOM 949 CA ARG A 66 4.643 -5.262 9.934 1.00 0.00 C ATOM 950 C ARG A 66 4.438 -6.714 10.356 1.00 0.00 C ATOM 951 O ARG A 66 3.509 -7.029 11.100 1.00 0.00 O ATOM 952 CB ARG A 66 5.061 -4.422 11.143 1.00 0.00 C ATOM 953 CG ARG A 66 6.072 -3.338 10.811 1.00 0.00 C ATOM 954 CD ARG A 66 6.022 -2.202 11.821 1.00 0.00 C ATOM 955 NE ARG A 66 7.259 -1.425 11.833 1.00 0.00 N ATOM 956 CZ ARG A 66 7.611 -0.619 12.828 1.00 0.00 C ATOM 957 NH1 ARG A 66 6.824 -0.484 13.887 1.00 0.00 N ATOM 958 NH2 ARG A 66 8.753 0.055 12.766 1.00 0.00 N ATOM 0 H ARG A 66 3.079 -3.874 9.787 1.00 0.00 H new ATOM 0 HA ARG A 66 5.434 -5.228 9.185 1.00 0.00 H new ATOM 0 HB2 ARG A 66 4.175 -3.960 11.577 1.00 0.00 H new ATOM 0 HB3 ARG A 66 5.483 -5.080 11.903 1.00 0.00 H new ATOM 0 HG2 ARG A 66 7.074 -3.767 10.793 1.00 0.00 H new ATOM 0 HG3 ARG A 66 5.874 -2.948 9.813 1.00 0.00 H new ATOM 0 HD2 ARG A 66 5.184 -1.546 11.587 1.00 0.00 H new ATOM 0 HD3 ARG A 66 5.840 -2.609 12.816 1.00 0.00 H new ATOM 0 HE ARG A 66 7.887 -1.506 11.033 1.00 0.00 H new ATOM 0 HH11 ARG A 66 5.946 -1.000 13.939 1.00 0.00 H new ATOM 0 HH12 ARG A 66 7.097 0.136 14.650 1.00 0.00 H new ATOM 0 HH21 ARG A 66 9.361 -0.046 11.953 1.00 0.00 H new ATOM 0 HH22 ARG A 66 9.022 0.674 13.531 1.00 0.00 H new ATOM 972 N GLY A 67 5.311 -7.594 9.876 1.00 0.00 N ATOM 973 CA GLY A 67 5.207 -9.002 10.213 1.00 0.00 C ATOM 974 C GLY A 67 4.152 -9.718 9.394 1.00 0.00 C ATOM 975 O GLY A 67 3.736 -10.826 9.735 1.00 0.00 O ATOM 0 H GLY A 67 6.089 -7.357 9.260 1.00 0.00 H new ATOM 0 HA2 GLY A 67 6.173 -9.482 10.055 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.970 -9.102 11.272 1.00 0.00 H new ATOM 979 N LYS A 68 3.715 -9.085 8.311 1.00 0.00 N ATOM 980 CA LYS A 68 2.701 -9.667 7.440 1.00 0.00 C ATOM 981 C LYS A 68 3.299 -10.051 6.089 1.00 0.00 C ATOM 982 O LYS A 68 4.187 -9.369 5.578 1.00 0.00 O ATOM 983 CB LYS A 68 1.547 -8.684 7.238 1.00 0.00 C ATOM 984 CG LYS A 68 0.849 -8.291 8.528 1.00 0.00 C ATOM 985 CD LYS A 68 -0.126 -9.364 8.984 1.00 0.00 C ATOM 986 CE LYS A 68 -1.106 -8.825 10.015 1.00 0.00 C ATOM 987 NZ LYS A 68 -1.675 -9.911 10.860 1.00 0.00 N ATOM 0 H LYS A 68 4.048 -8.167 8.015 1.00 0.00 H new ATOM 0 HA LYS A 68 2.321 -10.569 7.919 1.00 0.00 H new ATOM 0 HB2 LYS A 68 1.927 -7.785 6.752 1.00 0.00 H new ATOM 0 HB3 LYS A 68 0.817 -9.128 6.561 1.00 0.00 H new ATOM 0 HG2 LYS A 68 1.592 -8.119 9.307 1.00 0.00 H new ATOM 0 HG3 LYS A 68 0.316 -7.352 8.383 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -0.675 -9.747 8.124 1.00 0.00 H new ATOM 0 HD3 LYS A 68 0.426 -10.202 9.409 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -0.601 -8.097 10.650 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -1.914 -8.299 9.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -2.338 -9.503 11.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -2.179 -10.592 10.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -0.906 -10.397 11.364 1.00 0.00 H new ATOM 1001 N GLU A 69 2.804 -11.144 5.517 1.00 0.00 N ATOM 1002 CA GLU A 69 3.290 -11.616 4.226 1.00 0.00 C ATOM 1003 C GLU A 69 2.561 -10.917 3.082 1.00 0.00 C ATOM 1004 O GLU A 69 1.372 -10.612 3.182 1.00 0.00 O ATOM 1005 CB GLU A 69 3.108 -13.131 4.110 1.00 0.00 C ATOM 1006 CG GLU A 69 3.539 -13.892 5.353 1.00 0.00 C ATOM 1007 CD GLU A 69 3.536 -15.394 5.147 1.00 0.00 C ATOM 1008 OE1 GLU A 69 3.581 -15.832 3.979 1.00 0.00 O ATOM 1009 OE2 GLU A 69 3.489 -16.131 6.154 1.00 0.00 O ATOM 0 H GLU A 69 2.068 -11.719 5.927 1.00 0.00 H new ATOM 0 HA GLU A 69 4.352 -11.378 4.157 1.00 0.00 H new ATOM 0 HB2 GLU A 69 2.059 -13.348 3.906 1.00 0.00 H new ATOM 0 HB3 GLU A 69 3.680 -13.493 3.256 1.00 0.00 H new ATOM 0 HG2 GLU A 69 4.539 -13.571 5.643 1.00 0.00 H new ATOM 0 HG3 GLU A 69 2.872 -13.641 6.178 1.00 0.00 H new ATOM 1016 N HIS A 70 3.283 -10.664 1.995 1.00 0.00 N ATOM 1017 CA HIS A 70 2.706 -10.001 0.831 1.00 0.00 C ATOM 1018 C HIS A 70 1.247 -10.407 0.642 1.00 0.00 C ATOM 1019 O HIS A 70 0.373 -9.556 0.474 1.00 0.00 O ATOM 1020 CB HIS A 70 3.508 -10.339 -0.426 1.00 0.00 C ATOM 1021 CG HIS A 70 2.697 -10.300 -1.684 1.00 0.00 C ATOM 1022 ND1 HIS A 70 2.598 -9.179 -2.481 1.00 0.00 N ATOM 1023 CD2 HIS A 70 1.944 -11.253 -2.282 1.00 0.00 C ATOM 1024 CE1 HIS A 70 1.819 -9.444 -3.515 1.00 0.00 C ATOM 1025 NE2 HIS A 70 1.409 -10.696 -3.417 1.00 0.00 N ATOM 0 H HIS A 70 4.268 -10.908 1.896 1.00 0.00 H new ATOM 0 HA HIS A 70 2.747 -8.925 1.000 1.00 0.00 H new ATOM 0 HB2 HIS A 70 4.338 -9.638 -0.517 1.00 0.00 H new ATOM 0 HB3 HIS A 70 3.941 -11.333 -0.314 1.00 0.00 H new ATOM 0 HD2 HIS A 70 1.792 -12.263 -1.931 1.00 0.00 H new ATOM 0 HE1 HIS A 70 1.561 -8.755 -4.305 1.00 0.00 H new ATOM 0 HE2 HIS A 70 0.794 -11.172 -4.078 1.00 0.00 H new ATOM 1034 N ARG A 71 0.993 -11.711 0.669 1.00 0.00 N ATOM 1035 CA ARG A 71 -0.359 -12.229 0.499 1.00 0.00 C ATOM 1036 C ARG A 71 -1.289 -11.688 1.581 1.00 0.00 C ATOM 1037 O ARG A 71 -2.399 -11.242 1.292 1.00 0.00 O ATOM 1038 CB ARG A 71 -0.351 -13.759 0.536 1.00 0.00 C ATOM 1039 CG ARG A 71 -1.702 -14.383 0.230 1.00 0.00 C ATOM 1040 CD ARG A 71 -2.525 -14.577 1.494 1.00 0.00 C ATOM 1041 NE ARG A 71 -3.556 -15.598 1.325 1.00 0.00 N ATOM 1042 CZ ARG A 71 -4.269 -16.095 2.329 1.00 0.00 C ATOM 1043 NH1 ARG A 71 -4.066 -15.667 3.567 1.00 0.00 N ATOM 1044 NH2 ARG A 71 -5.190 -17.022 2.095 1.00 0.00 N ATOM 0 H ARG A 71 1.705 -12.428 0.807 1.00 0.00 H new ATOM 0 HA ARG A 71 -0.728 -11.898 -0.472 1.00 0.00 H new ATOM 0 HB2 ARG A 71 0.381 -14.127 -0.183 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -0.023 -14.088 1.522 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -2.248 -13.747 -0.467 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -1.557 -15.345 -0.262 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -1.867 -14.859 2.315 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -2.993 -13.632 1.771 1.00 0.00 H new ATOM 0 HE ARG A 71 -3.738 -15.948 0.385 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -3.360 -14.954 3.751 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -4.615 -16.051 4.336 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -5.350 -17.353 1.144 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -5.737 -17.403 2.867 1.00 0.00 H new ATOM 1058 N GLU A 72 -0.828 -11.733 2.827 1.00 0.00 N ATOM 1059 CA GLU A 72 -1.619 -11.249 3.952 1.00 0.00 C ATOM 1060 C GLU A 72 -1.992 -9.781 3.763 1.00 0.00 C ATOM 1061 O GLU A 72 -3.133 -9.384 3.997 1.00 0.00 O ATOM 1062 CB GLU A 72 -0.848 -11.426 5.261 1.00 0.00 C ATOM 1063 CG GLU A 72 -1.740 -11.485 6.490 1.00 0.00 C ATOM 1064 CD GLU A 72 -1.089 -12.215 7.648 1.00 0.00 C ATOM 1065 OE1 GLU A 72 0.153 -12.347 7.643 1.00 0.00 O ATOM 1066 OE2 GLU A 72 -1.820 -12.655 8.560 1.00 0.00 O ATOM 0 H GLU A 72 0.089 -12.100 3.083 1.00 0.00 H new ATOM 0 HA GLU A 72 -2.536 -11.837 3.997 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -0.260 -12.342 5.205 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -0.144 -10.601 5.373 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -1.992 -10.471 6.800 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -2.675 -11.982 6.232 1.00 0.00 H new ATOM 1073 N ALA A 73 -1.020 -8.980 3.338 1.00 0.00 N ATOM 1074 CA ALA A 73 -1.245 -7.557 3.117 1.00 0.00 C ATOM 1075 C ALA A 73 -2.258 -7.329 2.000 1.00 0.00 C ATOM 1076 O ALA A 73 -3.206 -6.560 2.156 1.00 0.00 O ATOM 1077 CB ALA A 73 0.068 -6.859 2.792 1.00 0.00 C ATOM 0 H ALA A 73 -0.069 -9.293 3.140 1.00 0.00 H new ATOM 0 HA ALA A 73 -1.652 -7.132 4.034 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -0.115 -5.797 2.629 1.00 0.00 H new ATOM 0 HB2 ALA A 73 0.762 -6.984 3.623 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.499 -7.295 1.891 1.00 0.00 H new ATOM 1083 N ALA A 74 -2.049 -8.001 0.872 1.00 0.00 N ATOM 1084 CA ALA A 74 -2.945 -7.872 -0.271 1.00 0.00 C ATOM 1085 C ALA A 74 -4.404 -7.961 0.163 1.00 0.00 C ATOM 1086 O ALA A 74 -5.269 -7.281 -0.390 1.00 0.00 O ATOM 1087 CB ALA A 74 -2.634 -8.941 -1.308 1.00 0.00 C ATOM 0 H ALA A 74 -1.267 -8.640 0.726 1.00 0.00 H new ATOM 0 HA ALA A 74 -2.786 -6.891 -0.718 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -3.310 -8.833 -2.156 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -1.605 -8.829 -1.648 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.764 -9.928 -0.864 1.00 0.00 H new ATOM 1093 N ARG A 75 -4.672 -8.805 1.155 1.00 0.00 N ATOM 1094 CA ARG A 75 -6.027 -8.984 1.661 1.00 0.00 C ATOM 1095 C ARG A 75 -6.449 -7.795 2.518 1.00 0.00 C ATOM 1096 O ARG A 75 -7.558 -7.278 2.377 1.00 0.00 O ATOM 1097 CB ARG A 75 -6.123 -10.275 2.477 1.00 0.00 C ATOM 1098 CG ARG A 75 -7.508 -10.533 3.048 1.00 0.00 C ATOM 1099 CD ARG A 75 -7.444 -11.405 4.292 1.00 0.00 C ATOM 1100 NE ARG A 75 -8.758 -11.918 4.669 1.00 0.00 N ATOM 1101 CZ ARG A 75 -9.430 -12.813 3.954 1.00 0.00 C ATOM 1102 NH1 ARG A 75 -8.914 -13.292 2.830 1.00 0.00 N ATOM 1103 NH2 ARG A 75 -10.621 -13.232 4.362 1.00 0.00 N ATOM 0 H ARG A 75 -3.968 -9.375 1.624 1.00 0.00 H new ATOM 0 HA ARG A 75 -6.701 -9.051 0.807 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -5.837 -11.116 1.845 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -5.404 -10.232 3.295 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -7.985 -9.584 3.292 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -8.129 -11.017 2.294 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -6.766 -12.240 4.115 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -7.030 -10.828 5.118 1.00 0.00 H new ATOM 0 HE ARG A 75 -9.183 -11.570 5.528 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -7.999 -12.973 2.513 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -9.433 -13.979 2.283 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -11.022 -12.867 5.226 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -11.136 -13.919 3.812 1.00 0.00 H new ATOM 1117 N ILE A 76 -5.559 -7.366 3.406 1.00 0.00 N ATOM 1118 CA ILE A 76 -5.839 -6.238 4.285 1.00 0.00 C ATOM 1119 C ILE A 76 -6.261 -5.010 3.486 1.00 0.00 C ATOM 1120 O ILE A 76 -7.290 -4.396 3.770 1.00 0.00 O ATOM 1121 CB ILE A 76 -4.615 -5.879 5.148 1.00 0.00 C ATOM 1122 CG1 ILE A 76 -4.309 -7.009 6.133 1.00 0.00 C ATOM 1123 CG2 ILE A 76 -4.854 -4.572 5.889 1.00 0.00 C ATOM 1124 CD1 ILE A 76 -2.895 -6.977 6.669 1.00 0.00 C ATOM 0 H ILE A 76 -4.637 -7.783 3.536 1.00 0.00 H new ATOM 0 HA ILE A 76 -6.657 -6.543 4.938 1.00 0.00 H new ATOM 0 HB ILE A 76 -3.753 -5.750 4.494 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -5.007 -6.951 6.968 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -4.481 -7.966 5.640 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -3.980 -4.332 6.494 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -5.028 -3.772 5.169 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -5.726 -4.674 6.535 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -2.749 -7.807 7.361 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -2.190 -7.066 5.842 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -2.725 -6.035 7.191 1.00 0.00 H new ATOM 1136 N ILE A 77 -5.462 -4.659 2.484 1.00 0.00 N ATOM 1137 CA ILE A 77 -5.755 -3.507 1.641 1.00 0.00 C ATOM 1138 C ILE A 77 -7.115 -3.649 0.968 1.00 0.00 C ATOM 1139 O ILE A 77 -7.970 -2.771 1.079 1.00 0.00 O ATOM 1140 CB ILE A 77 -4.676 -3.312 0.559 1.00 0.00 C ATOM 1141 CG1 ILE A 77 -3.302 -3.129 1.205 1.00 0.00 C ATOM 1142 CG2 ILE A 77 -5.018 -2.118 -0.320 1.00 0.00 C ATOM 1143 CD1 ILE A 77 -2.152 -3.496 0.294 1.00 0.00 C ATOM 0 H ILE A 77 -4.607 -5.156 2.236 1.00 0.00 H new ATOM 0 HA ILE A 77 -5.766 -2.634 2.293 1.00 0.00 H new ATOM 0 HB ILE A 77 -4.645 -4.203 -0.068 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.191 -2.090 1.516 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.249 -3.739 2.107 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -4.247 -1.993 -1.080 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -5.980 -2.286 -0.804 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.073 -1.219 0.293 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -1.209 -3.341 0.818 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.238 -4.543 0.003 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -2.179 -2.869 -0.597 1.00 0.00 H new ATOM 1155 N ALA A 78 -7.310 -4.764 0.270 1.00 0.00 N ATOM 1156 CA ALA A 78 -8.568 -5.024 -0.419 1.00 0.00 C ATOM 1157 C ALA A 78 -9.756 -4.836 0.518 1.00 0.00 C ATOM 1158 O ALA A 78 -10.758 -4.224 0.149 1.00 0.00 O ATOM 1159 CB ALA A 78 -8.570 -6.430 -1.001 1.00 0.00 C ATOM 0 H ALA A 78 -6.613 -5.501 0.167 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.663 -4.305 -1.233 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.515 -6.611 -1.513 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -7.748 -6.531 -1.710 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -8.448 -7.156 -0.198 1.00 0.00 H new ATOM 1165 N GLU A 79 -9.637 -5.366 1.732 1.00 0.00 N ATOM 1166 CA GLU A 79 -10.703 -5.257 2.720 1.00 0.00 C ATOM 1167 C GLU A 79 -11.062 -3.795 2.974 1.00 0.00 C ATOM 1168 O GLU A 79 -12.215 -3.467 3.249 1.00 0.00 O ATOM 1169 CB GLU A 79 -10.284 -5.926 4.031 1.00 0.00 C ATOM 1170 CG GLU A 79 -10.282 -7.444 3.966 1.00 0.00 C ATOM 1171 CD GLU A 79 -10.575 -8.085 5.309 1.00 0.00 C ATOM 1172 OE1 GLU A 79 -9.980 -7.649 6.317 1.00 0.00 O ATOM 1173 OE2 GLU A 79 -11.398 -9.023 5.352 1.00 0.00 O ATOM 0 H GLU A 79 -8.813 -5.875 2.054 1.00 0.00 H new ATOM 0 HA GLU A 79 -11.583 -5.766 2.326 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -9.286 -5.581 4.302 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -10.959 -5.606 4.825 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -11.025 -7.774 3.240 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -9.312 -7.787 3.607 1.00 0.00 H new ATOM 1180 N ALA A 80 -10.064 -2.923 2.881 1.00 0.00 N ATOM 1181 CA ALA A 80 -10.273 -1.497 3.099 1.00 0.00 C ATOM 1182 C ALA A 80 -11.062 -0.876 1.951 1.00 0.00 C ATOM 1183 O ALA A 80 -11.743 0.135 2.128 1.00 0.00 O ATOM 1184 CB ALA A 80 -8.938 -0.787 3.270 1.00 0.00 C ATOM 0 H ALA A 80 -9.103 -3.179 2.656 1.00 0.00 H new ATOM 0 HA ALA A 80 -10.855 -1.376 4.013 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -9.110 0.277 3.432 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -8.411 -1.204 4.128 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -8.335 -0.925 2.372 1.00 0.00 H new ATOM 1190 N PHE A 81 -10.965 -1.486 0.775 1.00 0.00 N ATOM 1191 CA PHE A 81 -11.668 -0.992 -0.403 1.00 0.00 C ATOM 1192 C PHE A 81 -13.135 -1.410 -0.376 1.00 0.00 C ATOM 1193 O PHE A 81 -14.030 -0.596 -0.606 1.00 0.00 O ATOM 1194 CB PHE A 81 -11.001 -1.513 -1.678 1.00 0.00 C ATOM 1195 CG PHE A 81 -11.328 -0.703 -2.900 1.00 0.00 C ATOM 1196 CD1 PHE A 81 -10.933 0.621 -2.996 1.00 0.00 C ATOM 1197 CD2 PHE A 81 -12.031 -1.267 -3.952 1.00 0.00 C ATOM 1198 CE1 PHE A 81 -11.234 1.369 -4.119 1.00 0.00 C ATOM 1199 CE2 PHE A 81 -12.334 -0.524 -5.078 1.00 0.00 C ATOM 1200 CZ PHE A 81 -11.934 0.795 -5.162 1.00 0.00 C ATOM 0 H PHE A 81 -10.406 -2.324 0.612 1.00 0.00 H new ATOM 0 HA PHE A 81 -11.618 0.097 -0.394 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -9.920 -1.521 -1.536 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -11.308 -2.546 -1.843 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -10.384 1.074 -2.184 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -12.346 -2.298 -3.892 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -10.922 2.401 -4.181 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -12.883 -0.975 -5.891 1.00 0.00 H new ATOM 0 HZ PHE A 81 -12.168 1.377 -6.041 1.00 0.00 H new ATOM 1210 N LYS A 82 -13.375 -2.686 -0.094 1.00 0.00 N ATOM 1211 CA LYS A 82 -14.732 -3.216 -0.036 1.00 0.00 C ATOM 1212 C LYS A 82 -15.548 -2.504 1.039 1.00 0.00 C ATOM 1213 O LYS A 82 -16.554 -1.858 0.744 1.00 0.00 O ATOM 1214 CB LYS A 82 -14.704 -4.720 0.243 1.00 0.00 C ATOM 1215 CG LYS A 82 -14.482 -5.565 -0.999 1.00 0.00 C ATOM 1216 CD LYS A 82 -14.247 -7.024 -0.647 1.00 0.00 C ATOM 1217 CE LYS A 82 -12.801 -7.274 -0.248 1.00 0.00 C ATOM 1218 NZ LYS A 82 -12.525 -8.723 -0.041 1.00 0.00 N ATOM 0 H LYS A 82 -12.646 -3.373 0.098 1.00 0.00 H new ATOM 0 HA LYS A 82 -15.205 -3.041 -1.003 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -13.914 -4.933 0.963 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -15.646 -5.012 0.708 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -15.348 -5.483 -1.655 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -13.625 -5.181 -1.553 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -14.907 -7.313 0.171 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -14.504 -7.651 -1.500 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -12.139 -6.885 -1.021 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -12.577 -6.727 0.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -11.529 -8.851 0.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -13.139 -9.089 0.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -12.714 -9.242 -0.922 1.00 0.00 H new ATOM 1232 N THR A 83 -15.107 -2.626 2.288 1.00 0.00 N ATOM 1233 CA THR A 83 -15.796 -1.994 3.406 1.00 0.00 C ATOM 1234 C THR A 83 -16.414 -0.664 2.991 1.00 0.00 C ATOM 1235 O THR A 83 -15.885 0.035 2.126 1.00 0.00 O ATOM 1236 CB THR A 83 -14.842 -1.757 4.592 1.00 0.00 C ATOM 1237 OG1 THR A 83 -15.562 -1.195 5.695 1.00 0.00 O ATOM 1238 CG2 THR A 83 -13.706 -0.826 4.194 1.00 0.00 C ATOM 0 H THR A 83 -14.276 -3.157 2.550 1.00 0.00 H new ATOM 0 HA THR A 83 -16.587 -2.677 3.716 1.00 0.00 H new ATOM 0 HB THR A 83 -14.418 -2.717 4.887 1.00 0.00 H new ATOM 0 HG1 THR A 83 -14.949 -1.049 6.445 1.00 0.00 H new ATOM 0 HG21 THR A 83 -13.045 -0.673 5.047 1.00 0.00 H new ATOM 0 HG22 THR A 83 -13.142 -1.270 3.373 1.00 0.00 H new ATOM 0 HG23 THR A 83 -14.116 0.133 3.876 1.00 0.00 H new ATOM 1246 N LYS A 84 -17.535 -0.318 3.614 1.00 0.00 N ATOM 1247 CA LYS A 84 -18.225 0.931 3.311 1.00 0.00 C ATOM 1248 C LYS A 84 -18.047 1.939 4.442 1.00 0.00 C ATOM 1249 O LYS A 84 -18.885 2.818 4.640 1.00 0.00 O ATOM 1250 CB LYS A 84 -19.715 0.671 3.075 1.00 0.00 C ATOM 1251 CG LYS A 84 -20.341 1.605 2.055 1.00 0.00 C ATOM 1252 CD LYS A 84 -20.549 2.997 2.627 1.00 0.00 C ATOM 1253 CE LYS A 84 -21.496 3.818 1.765 1.00 0.00 C ATOM 1254 NZ LYS A 84 -20.768 4.574 0.708 1.00 0.00 N ATOM 0 H LYS A 84 -17.986 -0.885 4.332 1.00 0.00 H new ATOM 0 HA LYS A 84 -17.787 1.348 2.404 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -19.847 -0.358 2.742 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -20.247 0.771 4.021 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -19.702 1.664 1.174 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -21.298 1.199 1.727 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -20.950 2.920 3.638 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -19.589 3.508 2.703 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -22.229 3.158 1.300 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -22.049 4.515 2.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -21.448 5.121 0.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -20.086 5.222 1.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -20.261 3.908 0.091 1.00 0.00 H new ATOM 1268 N ASP A 85 -16.950 1.806 5.179 1.00 0.00 N ATOM 1269 CA ASP A 85 -16.661 2.707 6.289 1.00 0.00 C ATOM 1270 C ASP A 85 -16.115 4.038 5.780 1.00 0.00 C ATOM 1271 O ASP A 85 -16.634 5.102 6.118 1.00 0.00 O ATOM 1272 CB ASP A 85 -15.657 2.064 7.248 1.00 0.00 C ATOM 1273 CG ASP A 85 -16.329 1.187 8.286 1.00 0.00 C ATOM 1274 OD1 ASP A 85 -16.909 0.150 7.901 1.00 0.00 O ATOM 1275 OD2 ASP A 85 -16.275 1.537 9.483 1.00 0.00 O ATOM 0 H ASP A 85 -16.246 1.083 5.028 1.00 0.00 H new ATOM 0 HA ASP A 85 -17.592 2.896 6.823 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -14.945 1.467 6.678 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -15.087 2.845 7.751 1.00 0.00 H new ATOM 1280 N ARG A 86 -15.066 3.970 4.967 1.00 0.00 N ATOM 1281 CA ARG A 86 -14.449 5.169 4.414 1.00 0.00 C ATOM 1282 C ARG A 86 -14.418 5.111 2.890 1.00 0.00 C ATOM 1283 O ARG A 86 -14.483 4.033 2.298 1.00 0.00 O ATOM 1284 CB ARG A 86 -13.029 5.335 4.958 1.00 0.00 C ATOM 1285 CG ARG A 86 -12.203 4.061 4.904 1.00 0.00 C ATOM 1286 CD ARG A 86 -10.715 4.356 5.011 1.00 0.00 C ATOM 1287 NE ARG A 86 -10.294 4.546 6.397 1.00 0.00 N ATOM 1288 CZ ARG A 86 -9.043 4.818 6.754 1.00 0.00 C ATOM 1289 NH1 ARG A 86 -8.097 4.931 5.832 1.00 0.00 N ATOM 1290 NH2 ARG A 86 -8.738 4.977 8.035 1.00 0.00 N ATOM 0 H ARG A 86 -14.626 3.097 4.677 1.00 0.00 H new ATOM 0 HA ARG A 86 -15.049 6.028 4.715 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -12.520 6.112 4.389 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -13.083 5.680 5.991 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -12.503 3.397 5.715 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -12.404 3.535 3.971 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -10.150 3.535 4.570 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -10.480 5.251 4.435 1.00 0.00 H new ATOM 0 HE ARG A 86 -10.998 4.466 7.130 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -8.329 4.809 4.846 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -7.138 5.140 6.109 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -9.464 4.891 8.747 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -7.778 5.186 8.309 1.00 0.00 H new ATOM 1304 N ASP A 87 -14.319 6.277 2.260 1.00 0.00 N ATOM 1305 CA ASP A 87 -14.279 6.359 0.805 1.00 0.00 C ATOM 1306 C ASP A 87 -12.845 6.520 0.309 1.00 0.00 C ATOM 1307 O ASP A 87 -12.601 7.144 -0.724 1.00 0.00 O ATOM 1308 CB ASP A 87 -15.136 7.527 0.315 1.00 0.00 C ATOM 1309 CG ASP A 87 -14.981 8.762 1.181 1.00 0.00 C ATOM 1310 OD1 ASP A 87 -13.876 9.342 1.196 1.00 0.00 O ATOM 1311 OD2 ASP A 87 -15.967 9.148 1.844 1.00 0.00 O ATOM 0 H ASP A 87 -14.265 7.178 2.735 1.00 0.00 H new ATOM 0 HA ASP A 87 -14.681 5.430 0.402 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -14.861 7.770 -0.712 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -16.183 7.225 0.302 1.00 0.00 H new ATOM 1316 N TYR A 88 -11.901 5.955 1.052 1.00 0.00 N ATOM 1317 CA TYR A 88 -10.491 6.039 0.690 1.00 0.00 C ATOM 1318 C TYR A 88 -9.662 5.041 1.493 1.00 0.00 C ATOM 1319 O TYR A 88 -10.167 4.394 2.411 1.00 0.00 O ATOM 1320 CB TYR A 88 -9.967 7.457 0.922 1.00 0.00 C ATOM 1321 CG TYR A 88 -9.881 7.840 2.382 1.00 0.00 C ATOM 1322 CD1 TYR A 88 -8.751 7.543 3.134 1.00 0.00 C ATOM 1323 CD2 TYR A 88 -10.931 8.499 3.010 1.00 0.00 C ATOM 1324 CE1 TYR A 88 -8.669 7.891 4.468 1.00 0.00 C ATOM 1325 CE2 TYR A 88 -10.857 8.851 4.344 1.00 0.00 C ATOM 1326 CZ TYR A 88 -9.724 8.545 5.069 1.00 0.00 C ATOM 1327 OH TYR A 88 -9.646 8.893 6.398 1.00 0.00 O ATOM 0 H TYR A 88 -12.086 5.434 1.909 1.00 0.00 H new ATOM 0 HA TYR A 88 -10.398 5.793 -0.368 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -8.978 7.548 0.472 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -10.617 8.164 0.407 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -7.922 7.031 2.667 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -11.820 8.740 2.446 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -7.783 7.652 5.038 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -11.682 9.363 4.817 1.00 0.00 H new ATOM 0 HH TYR A 88 -10.472 9.348 6.666 1.00 0.00 H new ATOM 1337 N ILE A 89 -8.386 4.922 1.140 1.00 0.00 N ATOM 1338 CA ILE A 89 -7.486 4.005 1.828 1.00 0.00 C ATOM 1339 C ILE A 89 -6.129 4.653 2.082 1.00 0.00 C ATOM 1340 O ILE A 89 -5.458 5.098 1.151 1.00 0.00 O ATOM 1341 CB ILE A 89 -7.280 2.709 1.022 1.00 0.00 C ATOM 1342 CG1 ILE A 89 -8.624 2.026 0.761 1.00 0.00 C ATOM 1343 CG2 ILE A 89 -6.338 1.770 1.761 1.00 0.00 C ATOM 1344 CD1 ILE A 89 -8.547 0.910 -0.258 1.00 0.00 C ATOM 0 H ILE A 89 -7.953 5.449 0.382 1.00 0.00 H new ATOM 0 HA ILE A 89 -7.953 3.760 2.782 1.00 0.00 H new ATOM 0 HB ILE A 89 -6.830 2.963 0.062 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -9.007 1.625 1.699 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -9.341 2.772 0.418 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -6.202 0.858 1.179 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -5.374 2.258 1.901 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -6.762 1.520 2.733 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -9.536 0.471 -0.393 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -8.194 1.309 -1.209 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -7.855 0.144 0.093 1.00 0.00 H new ATOM 1356 N ASP A 90 -5.731 4.702 3.348 1.00 0.00 N ATOM 1357 CA ASP A 90 -4.452 5.293 3.726 1.00 0.00 C ATOM 1358 C ASP A 90 -3.297 4.364 3.366 1.00 0.00 C ATOM 1359 O ASP A 90 -3.327 3.172 3.672 1.00 0.00 O ATOM 1360 CB ASP A 90 -4.430 5.599 5.224 1.00 0.00 C ATOM 1361 CG ASP A 90 -3.840 4.464 6.038 1.00 0.00 C ATOM 1362 OD1 ASP A 90 -2.668 4.105 5.794 1.00 0.00 O ATOM 1363 OD2 ASP A 90 -4.549 3.936 6.919 1.00 0.00 O ATOM 0 H ASP A 90 -6.276 4.340 4.131 1.00 0.00 H new ATOM 0 HA ASP A 90 -4.332 6.224 3.172 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -3.851 6.506 5.398 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -5.446 5.798 5.566 1.00 0.00 H new ATOM 1368 N PHE A 91 -2.280 4.918 2.714 1.00 0.00 N ATOM 1369 CA PHE A 91 -1.115 4.139 2.311 1.00 0.00 C ATOM 1370 C PHE A 91 0.173 4.790 2.806 1.00 0.00 C ATOM 1371 O PHE A 91 0.591 5.832 2.299 1.00 0.00 O ATOM 1372 CB PHE A 91 -1.074 3.994 0.789 1.00 0.00 C ATOM 1373 CG PHE A 91 -2.104 3.043 0.249 1.00 0.00 C ATOM 1374 CD1 PHE A 91 -1.994 1.681 0.475 1.00 0.00 C ATOM 1375 CD2 PHE A 91 -3.181 3.512 -0.486 1.00 0.00 C ATOM 1376 CE1 PHE A 91 -2.940 0.803 -0.020 1.00 0.00 C ATOM 1377 CE2 PHE A 91 -4.130 2.640 -0.983 1.00 0.00 C ATOM 1378 CZ PHE A 91 -4.009 1.283 -0.751 1.00 0.00 C ATOM 0 H PHE A 91 -2.239 5.903 2.454 1.00 0.00 H new ATOM 0 HA PHE A 91 -1.197 3.150 2.761 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -1.222 4.974 0.335 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -0.083 3.651 0.491 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -1.159 1.300 1.045 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -3.280 4.571 -0.672 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -2.843 -0.257 0.165 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -4.966 3.018 -1.553 1.00 0.00 H new ATOM 0 HZ PHE A 91 -4.749 0.599 -1.140 1.00 0.00 H new ATOM 1388 N LEU A 92 0.798 4.170 3.801 1.00 0.00 N ATOM 1389 CA LEU A 92 2.039 4.688 4.367 1.00 0.00 C ATOM 1390 C LEU A 92 3.251 4.086 3.664 1.00 0.00 C ATOM 1391 O LEU A 92 3.539 2.898 3.808 1.00 0.00 O ATOM 1392 CB LEU A 92 2.103 4.389 5.866 1.00 0.00 C ATOM 1393 CG LEU A 92 3.448 4.650 6.545 1.00 0.00 C ATOM 1394 CD1 LEU A 92 3.805 6.126 6.474 1.00 0.00 C ATOM 1395 CD2 LEU A 92 3.416 4.176 7.991 1.00 0.00 C ATOM 0 H LEU A 92 0.466 3.308 4.233 1.00 0.00 H new ATOM 0 HA LEU A 92 2.055 5.768 4.217 1.00 0.00 H new ATOM 0 HB2 LEU A 92 1.343 4.987 6.368 1.00 0.00 H new ATOM 0 HB3 LEU A 92 1.838 3.343 6.019 1.00 0.00 H new ATOM 0 HG LEU A 92 4.216 4.086 6.015 1.00 0.00 H new ATOM 0 HD11 LEU A 92 4.765 6.292 6.962 1.00 0.00 H new ATOM 0 HD12 LEU A 92 3.870 6.435 5.431 1.00 0.00 H new ATOM 0 HD13 LEU A 92 3.036 6.711 6.978 1.00 0.00 H new ATOM 0 HD21 LEU A 92 4.381 4.370 8.459 1.00 0.00 H new ATOM 0 HD22 LEU A 92 2.636 4.712 8.532 1.00 0.00 H new ATOM 0 HD23 LEU A 92 3.207 3.107 8.019 1.00 0.00 H new ATOM 1407 N VAL A 93 3.960 4.915 2.904 1.00 0.00 N ATOM 1408 CA VAL A 93 5.144 4.465 2.181 1.00 0.00 C ATOM 1409 C VAL A 93 6.395 5.183 2.675 1.00 0.00 C ATOM 1410 O VAL A 93 6.322 6.300 3.189 1.00 0.00 O ATOM 1411 CB VAL A 93 4.997 4.697 0.665 1.00 0.00 C ATOM 1412 CG1 VAL A 93 3.876 3.838 0.100 1.00 0.00 C ATOM 1413 CG2 VAL A 93 4.751 6.169 0.373 1.00 0.00 C ATOM 0 H VAL A 93 3.735 5.901 2.773 1.00 0.00 H new ATOM 0 HA VAL A 93 5.244 3.396 2.370 1.00 0.00 H new ATOM 0 HB VAL A 93 5.927 4.404 0.178 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.787 4.015 -0.972 1.00 0.00 H new ATOM 0 HG12 VAL A 93 4.100 2.786 0.277 1.00 0.00 H new ATOM 0 HG13 VAL A 93 2.937 4.097 0.590 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.650 6.315 -0.702 1.00 0.00 H new ATOM 0 HG22 VAL A 93 3.836 6.491 0.871 1.00 0.00 H new ATOM 0 HG23 VAL A 93 5.591 6.758 0.741 1.00 0.00 H new ATOM 1423 N THR A 94 7.544 4.534 2.516 1.00 0.00 N ATOM 1424 CA THR A 94 8.812 5.109 2.946 1.00 0.00 C ATOM 1425 C THR A 94 9.792 5.213 1.783 1.00 0.00 C ATOM 1426 O THR A 94 10.845 5.838 1.901 1.00 0.00 O ATOM 1427 CB THR A 94 9.455 4.275 4.071 1.00 0.00 C ATOM 1428 OG1 THR A 94 10.772 4.763 4.351 1.00 0.00 O ATOM 1429 CG2 THR A 94 9.525 2.806 3.682 1.00 0.00 C ATOM 0 H THR A 94 7.622 3.609 2.092 1.00 0.00 H new ATOM 0 HA THR A 94 8.593 6.108 3.324 1.00 0.00 H new ATOM 0 HB THR A 94 8.836 4.369 4.963 1.00 0.00 H new ATOM 0 HG1 THR A 94 10.718 5.498 4.997 1.00 0.00 H new ATOM 0 HG21 THR A 94 9.982 2.237 4.491 1.00 0.00 H new ATOM 0 HG22 THR A 94 8.519 2.430 3.498 1.00 0.00 H new ATOM 0 HG23 THR A 94 10.124 2.697 2.778 1.00 0.00 H new ATOM 1437 N GLU A 95 9.437 4.597 0.660 1.00 0.00 N ATOM 1438 CA GLU A 95 10.286 4.621 -0.525 1.00 0.00 C ATOM 1439 C GLU A 95 11.746 4.373 -0.154 1.00 0.00 C ATOM 1440 O GLU A 95 12.629 5.157 -0.503 1.00 0.00 O ATOM 1441 CB GLU A 95 10.154 5.963 -1.248 1.00 0.00 C ATOM 1442 CG GLU A 95 10.682 5.942 -2.673 1.00 0.00 C ATOM 1443 CD GLU A 95 11.173 7.301 -3.133 1.00 0.00 C ATOM 1444 OE1 GLU A 95 12.161 7.800 -2.556 1.00 0.00 O ATOM 1445 OE2 GLU A 95 10.569 7.864 -4.070 1.00 0.00 O ATOM 0 H GLU A 95 8.568 4.076 0.546 1.00 0.00 H new ATOM 0 HA GLU A 95 9.957 3.823 -1.191 1.00 0.00 H new ATOM 0 HB2 GLU A 95 9.104 6.256 -1.263 1.00 0.00 H new ATOM 0 HB3 GLU A 95 10.690 6.725 -0.682 1.00 0.00 H new ATOM 0 HG2 GLU A 95 11.497 5.222 -2.744 1.00 0.00 H new ATOM 0 HG3 GLU A 95 9.894 5.598 -3.343 1.00 0.00 H new ATOM 1452 N PHE A 96 11.991 3.278 0.558 1.00 0.00 N ATOM 1453 CA PHE A 96 13.342 2.927 0.979 1.00 0.00 C ATOM 1454 C PHE A 96 14.359 3.286 -0.101 1.00 0.00 C ATOM 1455 O PHE A 96 15.327 4.001 0.156 1.00 0.00 O ATOM 1456 CB PHE A 96 13.428 1.433 1.299 1.00 0.00 C ATOM 1457 CG PHE A 96 12.935 1.085 2.674 1.00 0.00 C ATOM 1458 CD1 PHE A 96 13.334 1.826 3.775 1.00 0.00 C ATOM 1459 CD2 PHE A 96 12.072 0.019 2.867 1.00 0.00 C ATOM 1460 CE1 PHE A 96 12.883 1.508 5.042 1.00 0.00 C ATOM 1461 CE2 PHE A 96 11.617 -0.304 4.131 1.00 0.00 C ATOM 1462 CZ PHE A 96 12.022 0.442 5.220 1.00 0.00 C ATOM 0 H PHE A 96 11.272 2.619 0.855 1.00 0.00 H new ATOM 0 HA PHE A 96 13.575 3.498 1.878 1.00 0.00 H new ATOM 0 HB2 PHE A 96 12.847 0.878 0.562 1.00 0.00 H new ATOM 0 HB3 PHE A 96 14.463 1.107 1.200 1.00 0.00 H new ATOM 0 HD1 PHE A 96 14.005 2.662 3.641 1.00 0.00 H new ATOM 0 HD2 PHE A 96 11.751 -0.567 2.019 1.00 0.00 H new ATOM 0 HE1 PHE A 96 13.203 2.092 5.892 1.00 0.00 H new ATOM 0 HE2 PHE A 96 10.945 -1.139 4.267 1.00 0.00 H new ATOM 0 HZ PHE A 96 11.667 0.193 6.209 1.00 0.00 H new ATOM 1472 N ASN A 97 14.132 2.784 -1.310 1.00 0.00 N ATOM 1473 CA ASN A 97 15.028 3.050 -2.429 1.00 0.00 C ATOM 1474 C ASN A 97 14.240 3.432 -3.678 1.00 0.00 C ATOM 1475 O ASN A 97 13.050 3.135 -3.790 1.00 0.00 O ATOM 1476 CB ASN A 97 15.897 1.825 -2.716 1.00 0.00 C ATOM 1477 CG ASN A 97 16.739 1.993 -3.967 1.00 0.00 C ATOM 1478 OD1 ASN A 97 17.463 2.978 -4.113 1.00 0.00 O ATOM 1479 ND2 ASN A 97 16.648 1.029 -4.875 1.00 0.00 N ATOM 0 H ASN A 97 13.335 2.191 -1.540 1.00 0.00 H new ATOM 0 HA ASN A 97 15.671 3.887 -2.156 1.00 0.00 H new ATOM 0 HB2 ASN A 97 16.551 1.639 -1.864 1.00 0.00 H new ATOM 0 HB3 ASN A 97 15.259 0.948 -2.826 1.00 0.00 H new ATOM 0 HD21 ASN A 97 17.191 1.087 -5.736 1.00 0.00 H new ATOM 0 HD22 ASN A 97 16.035 0.231 -4.711 1.00 0.00 H new ATOM 1486 N SER A 98 14.911 4.093 -4.616 1.00 0.00 N ATOM 1487 CA SER A 98 14.273 4.519 -5.857 1.00 0.00 C ATOM 1488 C SER A 98 15.136 4.160 -7.062 1.00 0.00 C ATOM 1489 O SER A 98 16.230 4.696 -7.238 1.00 0.00 O ATOM 1490 CB SER A 98 14.014 6.026 -5.830 1.00 0.00 C ATOM 1491 OG SER A 98 15.225 6.753 -5.945 1.00 0.00 O ATOM 0 H SER A 98 15.896 4.345 -4.540 1.00 0.00 H new ATOM 0 HA SER A 98 13.321 3.996 -5.946 1.00 0.00 H new ATOM 0 HB2 SER A 98 13.344 6.298 -6.646 1.00 0.00 H new ATOM 0 HB3 SER A 98 13.511 6.295 -4.901 1.00 0.00 H new ATOM 0 HG SER A 98 15.960 6.135 -6.142 1.00 0.00 H new ATOM 1497 N GLY A 99 14.635 3.249 -7.891 1.00 0.00 N ATOM 1498 CA GLY A 99 15.373 2.833 -9.070 1.00 0.00 C ATOM 1499 C GLY A 99 15.276 1.341 -9.319 1.00 0.00 C ATOM 1500 O GLY A 99 16.214 0.585 -9.064 1.00 0.00 O ATOM 0 H GLY A 99 13.732 2.792 -7.767 1.00 0.00 H new ATOM 0 HA2 GLY A 99 14.993 3.369 -9.940 1.00 0.00 H new ATOM 0 HA3 GLY A 99 16.421 3.112 -8.956 1.00 0.00 H new ATOM 1504 N PRO A 100 14.117 0.896 -9.826 1.00 0.00 N ATOM 1505 CA PRO A 100 13.872 -0.519 -10.119 1.00 0.00 C ATOM 1506 C PRO A 100 14.695 -1.017 -11.303 1.00 0.00 C ATOM 1507 O PRO A 100 15.194 -0.224 -12.101 1.00 0.00 O ATOM 1508 CB PRO A 100 12.379 -0.560 -10.451 1.00 0.00 C ATOM 1509 CG PRO A 100 12.059 0.815 -10.928 1.00 0.00 C ATOM 1510 CD PRO A 100 12.956 1.741 -10.154 1.00 0.00 C ATOM 0 HA PRO A 100 14.155 -1.162 -9.286 1.00 0.00 H new ATOM 0 HB2 PRO A 100 12.164 -1.305 -11.217 1.00 0.00 H new ATOM 0 HB3 PRO A 100 11.786 -0.823 -9.575 1.00 0.00 H new ATOM 0 HG2 PRO A 100 12.235 0.907 -12.000 1.00 0.00 H new ATOM 0 HG3 PRO A 100 11.010 1.054 -10.755 1.00 0.00 H new ATOM 0 HD2 PRO A 100 13.245 2.609 -10.747 1.00 0.00 H new ATOM 0 HD3 PRO A 100 12.466 2.117 -9.256 1.00 0.00 H new ATOM 1518 N SER A 101 14.831 -2.334 -11.411 1.00 0.00 N ATOM 1519 CA SER A 101 15.597 -2.937 -12.496 1.00 0.00 C ATOM 1520 C SER A 101 14.864 -4.146 -13.071 1.00 0.00 C ATOM 1521 O SER A 101 14.469 -5.053 -12.338 1.00 0.00 O ATOM 1522 CB SER A 101 16.982 -3.355 -12.000 1.00 0.00 C ATOM 1523 OG SER A 101 17.653 -4.146 -12.966 1.00 0.00 O ATOM 0 H SER A 101 14.421 -3.004 -10.761 1.00 0.00 H new ATOM 0 HA SER A 101 15.711 -2.193 -13.285 1.00 0.00 H new ATOM 0 HB2 SER A 101 17.575 -2.468 -11.777 1.00 0.00 H new ATOM 0 HB3 SER A 101 16.885 -3.916 -11.070 1.00 0.00 H new ATOM 0 HG SER A 101 18.536 -4.399 -12.625 1.00 0.00 H new ATOM 1529 N SER A 102 14.687 -4.151 -14.388 1.00 0.00 N ATOM 1530 CA SER A 102 13.999 -5.245 -15.063 1.00 0.00 C ATOM 1531 C SER A 102 14.767 -6.553 -14.900 1.00 0.00 C ATOM 1532 O SER A 102 14.200 -7.576 -14.519 1.00 0.00 O ATOM 1533 CB SER A 102 13.823 -4.926 -16.549 1.00 0.00 C ATOM 1534 OG SER A 102 12.772 -5.691 -17.113 1.00 0.00 O ATOM 0 H SER A 102 15.011 -3.409 -15.009 1.00 0.00 H new ATOM 0 HA SER A 102 13.017 -5.361 -14.605 1.00 0.00 H new ATOM 0 HB2 SER A 102 13.612 -3.864 -16.674 1.00 0.00 H new ATOM 0 HB3 SER A 102 14.752 -5.131 -17.081 1.00 0.00 H new ATOM 0 HG SER A 102 12.678 -5.468 -18.063 1.00 0.00 H new ATOM 1540 N GLY A 103 16.064 -6.510 -15.190 1.00 0.00 N ATOM 1541 CA GLY A 103 16.891 -7.697 -15.070 1.00 0.00 C ATOM 1542 C GLY A 103 18.349 -7.423 -15.382 1.00 0.00 C ATOM 1543 O GLY A 103 18.707 -6.314 -15.779 1.00 0.00 O ATOM 0 H GLY A 103 16.557 -5.675 -15.506 1.00 0.00 H new ATOM 0 HA2 GLY A 103 16.808 -8.093 -14.058 1.00 0.00 H new ATOM 0 HA3 GLY A 103 16.517 -8.466 -15.745 1.00 0.00 H new TER 1547 GLY A 103