USER MOD reduce.3.24.130724 H: found=0, std=0, add=803, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 804 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 31 MET CE :methyl 146:sc= -3.03! (180deg=-5!) USER MOD Set 1.2: A 105 THR OG1 : rot -63:sc= 0.435 USER MOD Set 2.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.189) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= -0.109 USER MOD Single : A 14 SER OG : rot -60:sc= -0.454 USER MOD Single : A 17 SER OG : rot -33:sc= 0.413 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 MET CE :methyl 173:sc= 0 (180deg=-0.101) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= -0.0442 K(o=-0.044,f=-1.5) USER MOD Single : A 38 SER OG : rot 160:sc= -0.899 USER MOD Single : A 39 SER OG : rot 37:sc= 0.453 USER MOD Single : A 44 ASN : amide:sc= -0.227 X(o=-0.23,f=-0.053) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= -0.168 K(o=-0.17,f=-0.94) USER MOD Single : A 63 ASN : amide:sc= -0.37 K(o=-0.37,f=-3.5!) USER MOD Single : A 64 ASN : amide:sc= -0.494 K(o=-0.49,f=-3.5!) USER MOD Single : A 67 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0862) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 58:sc= 0.526 USER MOD Single : A 77 ASN : amide:sc= -1.35 K(o=-1.3,f=-0.025) USER MOD Single : A 83 ASN : amide:sc= -1.36 K(o=-1.4,f=-0.42) USER MOD Single : A 90 TYR OH : rot -38:sc= 0.488 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 140:sc= -0.0561 USER MOD Single : A 100 ASN : amide:sc= -0.365 K(o=-0.36,f=-2.1!) USER MOD Single : A 102 LYS NZ :NH3+ -153:sc= -0.112 (180deg=-0.616) USER MOD Single : A 108 ASN : amide:sc= -0.307 K(o=-0.31,f=-1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.534 1.299 -4.277 1.00 0.00 N ATOM 2 CA MET A 1 7.343 1.428 -5.164 1.00 0.00 C ATOM 3 C MET A 1 6.080 1.074 -4.378 1.00 0.00 C ATOM 4 O MET A 1 5.877 -0.058 -3.987 1.00 0.00 O ATOM 5 CB MET A 1 7.487 0.475 -6.353 1.00 0.00 C ATOM 6 CG MET A 1 7.944 1.259 -7.585 1.00 0.00 C ATOM 7 SD MET A 1 9.748 1.186 -7.710 1.00 0.00 S ATOM 8 CE MET A 1 9.915 2.222 -9.185 1.00 0.00 C ATOM 0 H1 MET A 1 9.393 1.540 -4.812 1.00 0.00 H new ATOM 0 H2 MET A 1 8.437 1.946 -3.469 1.00 0.00 H new ATOM 0 H3 MET A 1 8.605 0.321 -3.931 1.00 0.00 H new ATOM 0 HA MET A 1 7.270 2.453 -5.526 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.208 -0.308 -6.119 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.536 -0.018 -6.555 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.489 0.843 -8.484 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.615 2.296 -7.512 1.00 0.00 H new ATOM 0 HE1 MET A 1 10.969 2.314 -9.447 1.00 0.00 H new ATOM 0 HE2 MET A 1 9.373 1.766 -10.013 1.00 0.00 H new ATOM 0 HE3 MET A 1 9.503 3.211 -8.984 1.00 0.00 H new ATOM 20 N LYS A 2 5.225 2.034 -4.146 1.00 0.00 N ATOM 21 CA LYS A 2 3.974 1.751 -3.389 1.00 0.00 C ATOM 22 C LYS A 2 2.951 1.112 -4.329 1.00 0.00 C ATOM 23 O LYS A 2 2.822 1.498 -5.474 1.00 0.00 O ATOM 24 CB LYS A 2 3.409 3.060 -2.831 1.00 0.00 C ATOM 25 CG LYS A 2 3.750 3.168 -1.343 1.00 0.00 C ATOM 26 CD LYS A 2 4.292 4.567 -1.043 1.00 0.00 C ATOM 27 CE LYS A 2 5.713 4.695 -1.595 1.00 0.00 C ATOM 28 NZ LYS A 2 6.028 6.134 -1.823 1.00 0.00 N ATOM 0 H LYS A 2 5.340 3.001 -4.448 1.00 0.00 H new ATOM 0 HA LYS A 2 4.189 1.070 -2.565 1.00 0.00 H new ATOM 0 HB2 LYS A 2 3.825 3.909 -3.373 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.328 3.091 -2.971 1.00 0.00 H new ATOM 0 HG2 LYS A 2 2.863 2.974 -0.741 1.00 0.00 H new ATOM 0 HG3 LYS A 2 4.490 2.414 -1.073 1.00 0.00 H new ATOM 0 HD2 LYS A 2 3.647 5.322 -1.492 1.00 0.00 H new ATOM 0 HD3 LYS A 2 4.291 4.746 0.032 1.00 0.00 H new ATOM 0 HE2 LYS A 2 6.427 4.262 -0.895 1.00 0.00 H new ATOM 0 HE3 LYS A 2 5.804 4.139 -2.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 7.058 6.256 -1.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 5.575 6.453 -2.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 5.672 6.698 -1.025 1.00 0.00 H new ATOM 42 N ILE A 3 2.227 0.131 -3.862 1.00 0.00 N ATOM 43 CA ILE A 3 1.222 -0.531 -4.741 1.00 0.00 C ATOM 44 C ILE A 3 -0.188 -0.287 -4.200 1.00 0.00 C ATOM 45 O ILE A 3 -0.551 -0.764 -3.144 1.00 0.00 O ATOM 46 CB ILE A 3 1.501 -2.034 -4.787 1.00 0.00 C ATOM 47 CG1 ILE A 3 2.809 -2.285 -5.540 1.00 0.00 C ATOM 48 CG2 ILE A 3 0.354 -2.746 -5.510 1.00 0.00 C ATOM 49 CD1 ILE A 3 3.669 -3.277 -4.755 1.00 0.00 C ATOM 0 H ILE A 3 2.288 -0.239 -2.914 1.00 0.00 H new ATOM 0 HA ILE A 3 1.293 -0.114 -5.746 1.00 0.00 H new ATOM 0 HB ILE A 3 1.584 -2.419 -3.771 1.00 0.00 H new ATOM 0 HG12 ILE A 3 2.598 -2.678 -6.535 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.349 -1.348 -5.675 1.00 0.00 H new ATOM 0 HG21 ILE A 3 0.554 -3.817 -5.542 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.579 -2.567 -4.976 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.270 -2.362 -6.527 1.00 0.00 H new ATOM 0 HD11 ILE A 3 4.601 -3.455 -5.292 1.00 0.00 H new ATOM 0 HD12 ILE A 3 3.891 -2.866 -3.770 1.00 0.00 H new ATOM 0 HD13 ILE A 3 3.129 -4.217 -4.643 1.00 0.00 H new ATOM 61 N ALA A 4 -0.984 0.448 -4.925 1.00 0.00 N ATOM 62 CA ALA A 4 -2.374 0.722 -4.468 1.00 0.00 C ATOM 63 C ALA A 4 -3.351 -0.067 -5.342 1.00 0.00 C ATOM 64 O ALA A 4 -3.405 0.110 -6.543 1.00 0.00 O ATOM 65 CB ALA A 4 -2.668 2.218 -4.595 1.00 0.00 C ATOM 0 H ALA A 4 -0.730 0.872 -5.817 1.00 0.00 H new ATOM 0 HA ALA A 4 -2.486 0.421 -3.426 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -3.686 2.418 -4.260 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -1.966 2.780 -3.979 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -2.562 2.523 -5.636 1.00 0.00 H new ATOM 71 N ILE A 5 -4.119 -0.943 -4.754 1.00 0.00 N ATOM 72 CA ILE A 5 -5.082 -1.745 -5.558 1.00 0.00 C ATOM 73 C ILE A 5 -6.475 -1.119 -5.477 1.00 0.00 C ATOM 74 O ILE A 5 -6.926 -0.715 -4.423 1.00 0.00 O ATOM 75 CB ILE A 5 -5.134 -3.173 -5.011 1.00 0.00 C ATOM 76 CG1 ILE A 5 -3.712 -3.732 -4.922 1.00 0.00 C ATOM 77 CG2 ILE A 5 -5.968 -4.049 -5.948 1.00 0.00 C ATOM 78 CD1 ILE A 5 -3.255 -3.728 -3.463 1.00 0.00 C ATOM 0 H ILE A 5 -4.121 -1.137 -3.753 1.00 0.00 H new ATOM 0 HA ILE A 5 -4.756 -1.761 -6.598 1.00 0.00 H new ATOM 0 HB ILE A 5 -5.588 -3.168 -4.020 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -3.682 -4.746 -5.321 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -3.035 -3.131 -5.528 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -6.005 -5.066 -5.558 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -6.980 -3.649 -6.015 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -5.514 -4.056 -6.939 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -2.242 -4.126 -3.398 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -3.269 -2.708 -3.080 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -3.927 -4.348 -2.869 1.00 0.00 H new ATOM 90 N ALA A 6 -7.163 -1.041 -6.583 1.00 0.00 N ATOM 91 CA ALA A 6 -8.529 -0.448 -6.573 1.00 0.00 C ATOM 92 C ALA A 6 -9.553 -1.552 -6.304 1.00 0.00 C ATOM 93 O ALA A 6 -9.635 -2.524 -7.028 1.00 0.00 O ATOM 94 CB ALA A 6 -8.816 0.193 -7.931 1.00 0.00 C ATOM 0 H ALA A 6 -6.837 -1.363 -7.494 1.00 0.00 H new ATOM 0 HA ALA A 6 -8.594 0.311 -5.794 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -9.816 0.627 -7.924 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -8.082 0.975 -8.127 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -8.755 -0.565 -8.711 1.00 0.00 H new ATOM 100 N SER A 7 -10.334 -1.415 -5.266 1.00 0.00 N ATOM 101 CA SER A 7 -11.345 -2.463 -4.958 1.00 0.00 C ATOM 102 C SER A 7 -12.628 -1.808 -4.448 1.00 0.00 C ATOM 103 O SER A 7 -12.671 -0.624 -4.181 1.00 0.00 O ATOM 104 CB SER A 7 -10.792 -3.402 -3.886 1.00 0.00 C ATOM 105 OG SER A 7 -9.421 -3.103 -3.662 1.00 0.00 O ATOM 0 H SER A 7 -10.315 -0.625 -4.621 1.00 0.00 H new ATOM 0 HA SER A 7 -11.565 -3.030 -5.863 1.00 0.00 H new ATOM 0 HB2 SER A 7 -11.357 -3.289 -2.961 1.00 0.00 H new ATOM 0 HB3 SER A 7 -10.903 -4.439 -4.202 1.00 0.00 H new ATOM 0 HG SER A 7 -9.064 -3.702 -2.974 1.00 0.00 H new ATOM 111 N SER A 8 -13.676 -2.574 -4.307 1.00 0.00 N ATOM 112 CA SER A 8 -14.959 -2.000 -3.813 1.00 0.00 C ATOM 113 C SER A 8 -15.316 -2.641 -2.470 1.00 0.00 C ATOM 114 O SER A 8 -16.466 -2.706 -2.088 1.00 0.00 O ATOM 115 CB SER A 8 -16.068 -2.287 -4.825 1.00 0.00 C ATOM 116 OG SER A 8 -16.452 -3.652 -4.726 1.00 0.00 O ATOM 0 H SER A 8 -13.698 -3.573 -4.513 1.00 0.00 H new ATOM 0 HA SER A 8 -14.853 -0.923 -3.687 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.925 -1.641 -4.635 1.00 0.00 H new ATOM 0 HB3 SER A 8 -15.721 -2.067 -5.835 1.00 0.00 H new ATOM 0 HG SER A 8 -17.164 -3.839 -5.372 1.00 0.00 H new ATOM 122 N GLY A 9 -14.335 -3.118 -1.752 1.00 0.00 N ATOM 123 CA GLY A 9 -14.617 -3.757 -0.436 1.00 0.00 C ATOM 124 C GLY A 9 -13.326 -3.834 0.381 1.00 0.00 C ATOM 125 O GLY A 9 -12.482 -2.962 0.313 1.00 0.00 O ATOM 0 H GLY A 9 -13.351 -3.092 -2.020 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -15.369 -3.183 0.105 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -15.026 -4.756 -0.585 1.00 0.00 H new ATOM 129 N THR A 10 -13.165 -4.873 1.154 1.00 0.00 N ATOM 130 CA THR A 10 -11.929 -5.005 1.976 1.00 0.00 C ATOM 131 C THR A 10 -11.563 -6.484 2.115 1.00 0.00 C ATOM 132 O THR A 10 -10.872 -6.879 3.034 1.00 0.00 O ATOM 133 CB THR A 10 -12.175 -4.409 3.363 1.00 0.00 C ATOM 134 OG1 THR A 10 -13.271 -3.507 3.301 1.00 0.00 O ATOM 135 CG2 THR A 10 -10.923 -3.662 3.828 1.00 0.00 C ATOM 0 H THR A 10 -13.835 -5.636 1.252 1.00 0.00 H new ATOM 0 HA THR A 10 -11.111 -4.473 1.490 1.00 0.00 H new ATOM 0 HB THR A 10 -12.401 -5.209 4.068 1.00 0.00 H new ATOM 0 HG1 THR A 10 -13.431 -3.125 4.189 1.00 0.00 H new ATOM 0 HG21 THR A 10 -11.099 -3.237 4.816 1.00 0.00 H new ATOM 0 HG22 THR A 10 -10.082 -4.354 3.875 1.00 0.00 H new ATOM 0 HG23 THR A 10 -10.695 -2.861 3.125 1.00 0.00 H new ATOM 143 N ASP A 11 -12.021 -7.307 1.211 1.00 0.00 N ATOM 144 CA ASP A 11 -11.699 -8.758 1.294 1.00 0.00 C ATOM 145 C ASP A 11 -11.599 -9.343 -0.116 1.00 0.00 C ATOM 146 O ASP A 11 -11.751 -8.647 -1.101 1.00 0.00 O ATOM 147 CB ASP A 11 -12.801 -9.484 2.068 1.00 0.00 C ATOM 148 CG ASP A 11 -12.401 -9.598 3.540 1.00 0.00 C ATOM 149 OD1 ASP A 11 -12.509 -8.607 4.241 1.00 0.00 O ATOM 150 OD2 ASP A 11 -11.993 -10.676 3.940 1.00 0.00 O ATOM 0 H ASP A 11 -12.604 -7.036 0.419 1.00 0.00 H new ATOM 0 HA ASP A 11 -10.747 -8.887 1.809 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -13.742 -8.941 1.977 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -12.963 -10.476 1.646 1.00 0.00 H new ATOM 155 N LEU A 12 -11.347 -10.618 -0.219 1.00 0.00 N ATOM 156 CA LEU A 12 -11.237 -11.252 -1.561 1.00 0.00 C ATOM 157 C LEU A 12 -12.588 -11.173 -2.278 1.00 0.00 C ATOM 158 O LEU A 12 -12.684 -11.388 -3.470 1.00 0.00 O ATOM 159 CB LEU A 12 -10.835 -12.719 -1.393 1.00 0.00 C ATOM 160 CG LEU A 12 -10.463 -13.309 -2.752 1.00 0.00 C ATOM 161 CD1 LEU A 12 -9.268 -14.249 -2.590 1.00 0.00 C ATOM 162 CD2 LEU A 12 -11.655 -14.092 -3.308 1.00 0.00 C ATOM 0 H LEU A 12 -11.212 -11.249 0.571 1.00 0.00 H new ATOM 0 HA LEU A 12 -10.484 -10.730 -2.151 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -9.991 -12.799 -0.708 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -11.657 -13.283 -0.953 1.00 0.00 H new ATOM 0 HG LEU A 12 -10.201 -12.505 -3.439 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -9.002 -14.670 -3.560 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -8.419 -13.693 -2.191 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.529 -15.055 -1.904 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -11.392 -14.514 -4.278 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -11.914 -14.897 -2.620 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -12.508 -13.423 -3.422 1.00 0.00 H new ATOM 174 N GLY A 13 -13.633 -10.865 -1.561 1.00 0.00 N ATOM 175 CA GLY A 13 -14.979 -10.773 -2.198 1.00 0.00 C ATOM 176 C GLY A 13 -14.939 -9.761 -3.345 1.00 0.00 C ATOM 177 O GLY A 13 -15.330 -10.055 -4.457 1.00 0.00 O ATOM 0 H GLY A 13 -13.614 -10.673 -0.560 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -15.282 -11.751 -2.573 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -15.722 -10.471 -1.459 1.00 0.00 H new ATOM 181 N SER A 14 -14.470 -8.572 -3.083 1.00 0.00 N ATOM 182 CA SER A 14 -14.403 -7.537 -4.152 1.00 0.00 C ATOM 183 C SER A 14 -13.415 -7.983 -5.229 1.00 0.00 C ATOM 184 O SER A 14 -12.249 -7.643 -5.196 1.00 0.00 O ATOM 185 CB SER A 14 -13.936 -6.211 -3.552 1.00 0.00 C ATOM 186 OG SER A 14 -14.148 -6.230 -2.147 1.00 0.00 O ATOM 0 H SER A 14 -14.129 -8.272 -2.170 1.00 0.00 H new ATOM 0 HA SER A 14 -15.391 -7.407 -4.594 1.00 0.00 H new ATOM 0 HB2 SER A 14 -12.880 -6.052 -3.770 1.00 0.00 H new ATOM 0 HB3 SER A 14 -14.482 -5.382 -4.003 1.00 0.00 H new ATOM 0 HG SER A 14 -15.102 -6.354 -1.962 1.00 0.00 H new ATOM 192 N GLU A 15 -13.874 -8.744 -6.179 1.00 0.00 N ATOM 193 CA GLU A 15 -12.970 -9.219 -7.265 1.00 0.00 C ATOM 194 C GLU A 15 -12.656 -8.059 -8.214 1.00 0.00 C ATOM 195 O GLU A 15 -13.250 -7.925 -9.265 1.00 0.00 O ATOM 196 CB GLU A 15 -13.658 -10.342 -8.044 1.00 0.00 C ATOM 197 CG GLU A 15 -15.083 -9.917 -8.402 1.00 0.00 C ATOM 198 CD GLU A 15 -15.293 -10.045 -9.912 1.00 0.00 C ATOM 199 OE1 GLU A 15 -14.344 -9.815 -10.643 1.00 0.00 O ATOM 200 OE2 GLU A 15 -16.400 -10.369 -10.312 1.00 0.00 O ATOM 0 H GLU A 15 -14.841 -9.060 -6.253 1.00 0.00 H new ATOM 0 HA GLU A 15 -12.043 -9.592 -6.829 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -13.096 -10.567 -8.950 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -13.678 -11.254 -7.447 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -15.803 -10.539 -7.871 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -15.257 -8.888 -8.086 1.00 0.00 H new ATOM 207 N VAL A 16 -11.724 -7.221 -7.852 1.00 0.00 N ATOM 208 CA VAL A 16 -11.370 -6.072 -8.732 1.00 0.00 C ATOM 209 C VAL A 16 -12.628 -5.260 -9.050 1.00 0.00 C ATOM 210 O VAL A 16 -12.739 -4.659 -10.100 1.00 0.00 O ATOM 211 CB VAL A 16 -10.761 -6.600 -10.033 1.00 0.00 C ATOM 212 CG1 VAL A 16 -10.356 -5.425 -10.923 1.00 0.00 C ATOM 213 CG2 VAL A 16 -9.527 -7.444 -9.709 1.00 0.00 C ATOM 0 H VAL A 16 -11.192 -7.282 -6.984 1.00 0.00 H new ATOM 0 HA VAL A 16 -10.649 -5.433 -8.222 1.00 0.00 H new ATOM 0 HB VAL A 16 -11.495 -7.213 -10.556 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -9.922 -5.803 -11.849 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -11.235 -4.823 -11.153 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -9.621 -4.811 -10.403 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -9.091 -7.821 -10.634 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -8.793 -6.830 -9.186 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -9.816 -8.283 -9.075 1.00 0.00 H new ATOM 223 N SER A 17 -13.573 -5.234 -8.152 1.00 0.00 N ATOM 224 CA SER A 17 -14.820 -4.458 -8.406 1.00 0.00 C ATOM 225 C SER A 17 -15.326 -4.756 -9.818 1.00 0.00 C ATOM 226 O SER A 17 -14.967 -5.749 -10.420 1.00 0.00 O ATOM 227 CB SER A 17 -14.525 -2.963 -8.276 1.00 0.00 C ATOM 228 OG SER A 17 -13.877 -2.508 -9.457 1.00 0.00 O ATOM 0 H SER A 17 -13.536 -5.716 -7.254 1.00 0.00 H new ATOM 0 HA SER A 17 -15.580 -4.743 -7.679 1.00 0.00 H new ATOM 0 HB2 SER A 17 -15.451 -2.410 -8.119 1.00 0.00 H new ATOM 0 HB3 SER A 17 -13.893 -2.779 -7.407 1.00 0.00 H new ATOM 0 HG SER A 17 -13.316 -3.225 -9.819 1.00 0.00 H new ATOM 234 N ARG A 18 -16.158 -3.904 -10.352 1.00 0.00 N ATOM 235 CA ARG A 18 -16.685 -4.140 -11.726 1.00 0.00 C ATOM 236 C ARG A 18 -15.874 -3.315 -12.730 1.00 0.00 C ATOM 237 O ARG A 18 -15.456 -3.809 -13.758 1.00 0.00 O ATOM 238 CB ARG A 18 -18.153 -3.717 -11.788 1.00 0.00 C ATOM 239 CG ARG A 18 -19.030 -4.827 -11.204 1.00 0.00 C ATOM 240 CD ARG A 18 -20.167 -4.204 -10.393 1.00 0.00 C ATOM 241 NE ARG A 18 -20.856 -5.265 -9.605 1.00 0.00 N ATOM 242 CZ ARG A 18 -21.309 -6.332 -10.202 1.00 0.00 C ATOM 243 NH1 ARG A 18 -20.491 -7.294 -10.530 1.00 0.00 N ATOM 244 NH2 ARG A 18 -22.583 -6.440 -10.470 1.00 0.00 N ATOM 0 H ARG A 18 -16.495 -3.056 -9.897 1.00 0.00 H new ATOM 0 HA ARG A 18 -16.601 -5.199 -11.972 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -18.300 -2.792 -11.230 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -18.441 -3.516 -12.820 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -19.436 -5.444 -12.006 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -18.432 -5.482 -10.569 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -19.774 -3.438 -9.725 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -20.876 -3.713 -11.059 1.00 0.00 H new ATOM 0 HE ARG A 18 -20.973 -5.156 -8.598 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -19.496 -7.212 -10.319 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -20.846 -8.128 -10.997 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -23.224 -5.689 -10.212 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -22.937 -7.275 -10.937 1.00 0.00 H new ATOM 258 N PHE A 19 -15.650 -2.063 -12.438 1.00 0.00 N ATOM 259 CA PHE A 19 -14.866 -1.209 -13.375 1.00 0.00 C ATOM 260 C PHE A 19 -14.126 -0.130 -12.582 1.00 0.00 C ATOM 261 O PHE A 19 -14.724 0.651 -11.867 1.00 0.00 O ATOM 262 CB PHE A 19 -15.806 -0.542 -14.385 1.00 0.00 C ATOM 263 CG PHE A 19 -17.179 -0.372 -13.779 1.00 0.00 C ATOM 264 CD1 PHE A 19 -17.439 0.705 -12.923 1.00 0.00 C ATOM 265 CD2 PHE A 19 -18.193 -1.294 -14.075 1.00 0.00 C ATOM 266 CE1 PHE A 19 -18.715 0.862 -12.362 1.00 0.00 C ATOM 267 CE2 PHE A 19 -19.467 -1.136 -13.514 1.00 0.00 C ATOM 268 CZ PHE A 19 -19.729 -0.058 -12.659 1.00 0.00 C ATOM 0 H PHE A 19 -15.975 -1.595 -11.592 1.00 0.00 H new ATOM 0 HA PHE A 19 -14.148 -1.831 -13.909 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -15.407 0.429 -14.680 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -15.871 -1.148 -15.289 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -16.657 1.415 -12.695 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -17.992 -2.125 -14.735 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -18.916 1.692 -11.701 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -20.248 -1.846 -13.741 1.00 0.00 H new ATOM 0 HZ PHE A 19 -20.712 0.064 -12.229 1.00 0.00 H new ATOM 278 N PHE A 20 -12.828 -0.078 -12.704 1.00 0.00 N ATOM 279 CA PHE A 20 -12.050 0.951 -11.958 1.00 0.00 C ATOM 280 C PHE A 20 -12.558 2.344 -12.335 1.00 0.00 C ATOM 281 O PHE A 20 -12.594 2.710 -13.493 1.00 0.00 O ATOM 282 CB PHE A 20 -10.568 0.829 -12.324 1.00 0.00 C ATOM 283 CG PHE A 20 -9.779 1.904 -11.613 1.00 0.00 C ATOM 284 CD1 PHE A 20 -10.235 2.420 -10.393 1.00 0.00 C ATOM 285 CD2 PHE A 20 -8.589 2.384 -12.176 1.00 0.00 C ATOM 286 CE1 PHE A 20 -9.501 3.415 -9.735 1.00 0.00 C ATOM 287 CE2 PHE A 20 -7.855 3.381 -11.518 1.00 0.00 C ATOM 288 CZ PHE A 20 -8.311 3.897 -10.297 1.00 0.00 C ATOM 0 H PHE A 20 -12.273 -0.703 -13.288 1.00 0.00 H new ATOM 0 HA PHE A 20 -12.174 0.798 -10.886 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -10.194 -0.156 -12.044 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -10.441 0.924 -13.402 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -11.153 2.050 -9.960 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -8.237 1.986 -13.116 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -9.852 3.811 -8.794 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -6.938 3.752 -11.952 1.00 0.00 H new ATOM 0 HZ PHE A 20 -7.746 4.665 -9.790 1.00 0.00 H new ATOM 298 N GLY A 21 -12.952 3.125 -11.367 1.00 0.00 N ATOM 299 CA GLY A 21 -13.457 4.494 -11.671 1.00 0.00 C ATOM 300 C GLY A 21 -13.662 5.266 -10.365 1.00 0.00 C ATOM 301 O GLY A 21 -13.216 6.385 -10.219 1.00 0.00 O ATOM 0 H GLY A 21 -12.946 2.874 -10.378 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -12.748 5.021 -12.310 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -14.396 4.433 -12.221 1.00 0.00 H new ATOM 305 N ARG A 22 -14.334 4.675 -9.415 1.00 0.00 N ATOM 306 CA ARG A 22 -14.566 5.374 -8.121 1.00 0.00 C ATOM 307 C ARG A 22 -14.513 4.359 -6.977 1.00 0.00 C ATOM 308 O ARG A 22 -15.348 4.360 -6.094 1.00 0.00 O ATOM 309 CB ARG A 22 -15.940 6.049 -8.143 1.00 0.00 C ATOM 310 CG ARG A 22 -17.033 4.982 -8.228 1.00 0.00 C ATOM 311 CD ARG A 22 -17.991 5.140 -7.047 1.00 0.00 C ATOM 312 NE ARG A 22 -19.333 5.554 -7.545 1.00 0.00 N ATOM 313 CZ ARG A 22 -20.411 5.082 -6.983 1.00 0.00 C ATOM 314 NH1 ARG A 22 -20.532 3.800 -6.776 1.00 0.00 N ATOM 315 NH2 ARG A 22 -21.370 5.894 -6.629 1.00 0.00 N ATOM 0 H ARG A 22 -14.732 3.738 -9.480 1.00 0.00 H new ATOM 0 HA ARG A 22 -13.794 6.129 -7.973 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -16.075 6.652 -7.245 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -16.011 6.726 -8.995 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -17.578 5.078 -9.167 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -16.587 3.987 -8.218 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -18.069 4.200 -6.500 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -17.605 5.884 -6.350 1.00 0.00 H new ATOM 0 HE ARG A 22 -19.408 6.206 -8.325 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -19.783 3.166 -7.054 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -21.376 3.432 -6.336 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -21.276 6.896 -6.792 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -22.214 5.526 -6.189 1.00 0.00 H new ATOM 329 N ALA A 23 -13.537 3.494 -6.987 1.00 0.00 N ATOM 330 CA ALA A 23 -13.427 2.478 -5.902 1.00 0.00 C ATOM 331 C ALA A 23 -13.413 3.183 -4.539 1.00 0.00 C ATOM 332 O ALA A 23 -12.471 3.881 -4.220 1.00 0.00 O ATOM 333 CB ALA A 23 -12.126 1.691 -6.079 1.00 0.00 C ATOM 0 H ALA A 23 -12.810 3.447 -7.701 1.00 0.00 H new ATOM 0 HA ALA A 23 -14.278 1.799 -5.950 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -12.041 0.946 -5.288 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -12.132 1.192 -7.048 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -11.278 2.374 -6.028 1.00 0.00 H new ATOM 339 N PRO A 24 -14.457 2.980 -3.770 1.00 0.00 N ATOM 340 CA PRO A 24 -14.588 3.586 -2.430 1.00 0.00 C ATOM 341 C PRO A 24 -13.790 2.791 -1.388 1.00 0.00 C ATOM 342 O PRO A 24 -14.043 2.882 -0.203 1.00 0.00 O ATOM 343 CB PRO A 24 -16.089 3.490 -2.142 1.00 0.00 C ATOM 344 CG PRO A 24 -16.634 2.350 -3.036 1.00 0.00 C ATOM 345 CD PRO A 24 -15.605 2.138 -4.162 1.00 0.00 C ATOM 0 HA PRO A 24 -14.206 4.606 -2.388 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -16.269 3.277 -1.088 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -16.589 4.432 -2.367 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -16.768 1.436 -2.458 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -17.609 2.613 -3.447 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -15.319 1.090 -4.247 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -16.007 2.438 -5.130 1.00 0.00 H new ATOM 353 N TYR A 25 -12.829 2.015 -1.814 1.00 0.00 N ATOM 354 CA TYR A 25 -12.024 1.223 -0.845 1.00 0.00 C ATOM 355 C TYR A 25 -10.655 0.931 -1.459 1.00 0.00 C ATOM 356 O TYR A 25 -10.345 -0.189 -1.812 1.00 0.00 O ATOM 357 CB TYR A 25 -12.739 -0.095 -0.539 1.00 0.00 C ATOM 358 CG TYR A 25 -13.687 0.099 0.622 1.00 0.00 C ATOM 359 CD1 TYR A 25 -13.213 0.613 1.836 1.00 0.00 C ATOM 360 CD2 TYR A 25 -15.042 -0.236 0.484 1.00 0.00 C ATOM 361 CE1 TYR A 25 -14.093 0.791 2.913 1.00 0.00 C ATOM 362 CE2 TYR A 25 -15.921 -0.057 1.560 1.00 0.00 C ATOM 363 CZ TYR A 25 -15.446 0.456 2.775 1.00 0.00 C ATOM 364 OH TYR A 25 -16.312 0.631 3.835 1.00 0.00 O ATOM 0 H TYR A 25 -12.568 1.897 -2.793 1.00 0.00 H new ATOM 0 HA TYR A 25 -11.902 1.787 0.080 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -13.288 -0.435 -1.417 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -12.010 -0.869 -0.300 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -12.170 0.872 1.942 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -15.408 -0.632 -0.452 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -13.727 1.186 3.849 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -16.965 -0.314 1.453 1.00 0.00 H new ATOM 0 HH TYR A 25 -17.213 0.351 3.571 1.00 0.00 H new ATOM 374 N PHE A 26 -9.838 1.937 -1.600 1.00 0.00 N ATOM 375 CA PHE A 26 -8.491 1.726 -2.203 1.00 0.00 C ATOM 376 C PHE A 26 -7.544 1.133 -1.157 1.00 0.00 C ATOM 377 O PHE A 26 -7.366 1.677 -0.085 1.00 0.00 O ATOM 378 CB PHE A 26 -7.936 3.069 -2.683 1.00 0.00 C ATOM 379 CG PHE A 26 -7.848 3.071 -4.190 1.00 0.00 C ATOM 380 CD1 PHE A 26 -6.716 2.546 -4.827 1.00 0.00 C ATOM 381 CD2 PHE A 26 -8.900 3.600 -4.952 1.00 0.00 C ATOM 382 CE1 PHE A 26 -6.635 2.550 -6.226 1.00 0.00 C ATOM 383 CE2 PHE A 26 -8.817 3.604 -6.352 1.00 0.00 C ATOM 384 CZ PHE A 26 -7.685 3.080 -6.988 1.00 0.00 C ATOM 0 H PHE A 26 -10.044 2.897 -1.324 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.576 1.039 -3.045 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.579 3.881 -2.345 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -6.950 3.242 -2.251 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -5.906 2.138 -4.240 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -9.773 4.004 -4.461 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -5.763 2.144 -6.717 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -9.626 4.011 -6.940 1.00 0.00 H new ATOM 0 HZ PHE A 26 -7.621 3.084 -8.066 1.00 0.00 H new ATOM 394 N MET A 27 -6.934 0.019 -1.462 1.00 0.00 N ATOM 395 CA MET A 27 -5.997 -0.611 -0.489 1.00 0.00 C ATOM 396 C MET A 27 -4.584 -0.073 -0.724 1.00 0.00 C ATOM 397 O MET A 27 -3.958 -0.361 -1.725 1.00 0.00 O ATOM 398 CB MET A 27 -6.005 -2.130 -0.682 1.00 0.00 C ATOM 399 CG MET A 27 -7.389 -2.683 -0.335 1.00 0.00 C ATOM 400 SD MET A 27 -7.333 -4.491 -0.324 1.00 0.00 S ATOM 401 CE MET A 27 -7.853 -4.726 1.394 1.00 0.00 C ATOM 0 H MET A 27 -7.045 -0.482 -2.344 1.00 0.00 H new ATOM 0 HA MET A 27 -6.313 -0.374 0.527 1.00 0.00 H new ATOM 0 HB2 MET A 27 -5.751 -2.377 -1.713 1.00 0.00 H new ATOM 0 HB3 MET A 27 -5.248 -2.592 -0.048 1.00 0.00 H new ATOM 0 HG2 MET A 27 -7.706 -2.313 0.640 1.00 0.00 H new ATOM 0 HG3 MET A 27 -8.123 -2.336 -1.062 1.00 0.00 H new ATOM 0 HE1 MET A 27 -8.008 -5.788 1.585 1.00 0.00 H new ATOM 0 HE2 MET A 27 -7.081 -4.346 2.063 1.00 0.00 H new ATOM 0 HE3 MET A 27 -8.784 -4.186 1.570 1.00 0.00 H new ATOM 411 N ILE A 28 -4.076 0.708 0.190 1.00 0.00 N ATOM 412 CA ILE A 28 -2.705 1.265 0.019 1.00 0.00 C ATOM 413 C ILE A 28 -1.693 0.350 0.711 1.00 0.00 C ATOM 414 O ILE A 28 -1.613 0.302 1.923 1.00 0.00 O ATOM 415 CB ILE A 28 -2.641 2.660 0.644 1.00 0.00 C ATOM 416 CG1 ILE A 28 -3.708 3.554 0.008 1.00 0.00 C ATOM 417 CG2 ILE A 28 -1.259 3.267 0.402 1.00 0.00 C ATOM 418 CD1 ILE A 28 -3.601 3.470 -1.516 1.00 0.00 C ATOM 0 H ILE A 28 -4.552 0.984 1.049 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.469 1.331 -1.043 1.00 0.00 H new ATOM 0 HB ILE A 28 -2.821 2.584 1.716 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -4.701 3.240 0.331 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -3.577 4.585 0.336 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -1.215 4.261 0.848 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -0.498 2.632 0.856 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -1.077 3.342 -0.670 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -4.361 4.106 -1.970 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.612 3.805 -1.830 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -3.754 2.439 -1.835 1.00 0.00 H new ATOM 430 N VAL A 29 -0.919 -0.376 -0.048 1.00 0.00 N ATOM 431 CA VAL A 29 0.085 -1.285 0.570 1.00 0.00 C ATOM 432 C VAL A 29 1.493 -0.819 0.194 1.00 0.00 C ATOM 433 O VAL A 29 1.869 -0.815 -0.961 1.00 0.00 O ATOM 434 CB VAL A 29 -0.135 -2.710 0.059 1.00 0.00 C ATOM 435 CG1 VAL A 29 0.773 -3.674 0.823 1.00 0.00 C ATOM 436 CG2 VAL A 29 -1.598 -3.106 0.277 1.00 0.00 C ATOM 0 H VAL A 29 -0.939 -0.379 -1.068 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.026 -1.267 1.654 1.00 0.00 H new ATOM 0 HB VAL A 29 0.102 -2.756 -1.004 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.615 -4.689 0.458 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.815 -3.391 0.670 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.537 -3.630 1.886 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.758 -4.121 -0.086 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.833 -3.060 1.340 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.246 -2.419 -0.268 1.00 0.00 H new ATOM 446 N GLU A 30 2.273 -0.421 1.162 1.00 0.00 N ATOM 447 CA GLU A 30 3.654 0.050 0.860 1.00 0.00 C ATOM 448 C GLU A 30 4.662 -1.038 1.243 1.00 0.00 C ATOM 449 O GLU A 30 4.816 -1.377 2.400 1.00 0.00 O ATOM 450 CB GLU A 30 3.941 1.322 1.664 1.00 0.00 C ATOM 451 CG GLU A 30 5.440 1.625 1.633 1.00 0.00 C ATOM 452 CD GLU A 30 6.137 0.872 2.768 1.00 0.00 C ATOM 453 OE1 GLU A 30 5.781 1.104 3.912 1.00 0.00 O ATOM 454 OE2 GLU A 30 7.014 0.077 2.474 1.00 0.00 O ATOM 0 H GLU A 30 2.014 -0.402 2.148 1.00 0.00 H new ATOM 0 HA GLU A 30 3.743 0.264 -0.205 1.00 0.00 H new ATOM 0 HB2 GLU A 30 3.382 2.160 1.248 1.00 0.00 H new ATOM 0 HB3 GLU A 30 3.607 1.196 2.694 1.00 0.00 H new ATOM 0 HG2 GLU A 30 5.862 1.328 0.673 1.00 0.00 H new ATOM 0 HG3 GLU A 30 5.607 2.697 1.737 1.00 0.00 H new ATOM 461 N MET A 31 5.351 -1.588 0.278 1.00 0.00 N ATOM 462 CA MET A 31 6.347 -2.651 0.586 1.00 0.00 C ATOM 463 C MET A 31 7.748 -2.160 0.211 1.00 0.00 C ATOM 464 O MET A 31 7.905 -1.236 -0.561 1.00 0.00 O ATOM 465 CB MET A 31 6.015 -3.913 -0.215 1.00 0.00 C ATOM 466 CG MET A 31 5.982 -3.578 -1.707 1.00 0.00 C ATOM 467 SD MET A 31 5.998 -5.110 -2.671 1.00 0.00 S ATOM 468 CE MET A 31 4.554 -5.880 -1.896 1.00 0.00 C ATOM 0 H MET A 31 5.266 -1.346 -0.709 1.00 0.00 H new ATOM 0 HA MET A 31 6.315 -2.881 1.651 1.00 0.00 H new ATOM 0 HB2 MET A 31 6.759 -4.685 -0.022 1.00 0.00 H new ATOM 0 HB3 MET A 31 5.051 -4.313 0.100 1.00 0.00 H new ATOM 0 HG2 MET A 31 5.089 -2.998 -1.941 1.00 0.00 H new ATOM 0 HG3 MET A 31 6.841 -2.961 -1.971 1.00 0.00 H new ATOM 0 HE1 MET A 31 4.016 -6.472 -2.636 1.00 0.00 H new ATOM 0 HE2 MET A 31 4.880 -6.527 -1.081 1.00 0.00 H new ATOM 0 HE3 MET A 31 3.896 -5.105 -1.503 1.00 0.00 H new ATOM 478 N LYS A 32 8.767 -2.769 0.755 1.00 0.00 N ATOM 479 CA LYS A 32 10.155 -2.332 0.429 1.00 0.00 C ATOM 480 C LYS A 32 10.843 -3.400 -0.427 1.00 0.00 C ATOM 481 O LYS A 32 10.704 -3.424 -1.634 1.00 0.00 O ATOM 482 CB LYS A 32 10.941 -2.127 1.726 1.00 0.00 C ATOM 483 CG LYS A 32 10.791 -0.678 2.191 1.00 0.00 C ATOM 484 CD LYS A 32 12.175 -0.077 2.436 1.00 0.00 C ATOM 485 CE LYS A 32 12.172 0.689 3.760 1.00 0.00 C ATOM 486 NZ LYS A 32 12.756 -0.168 4.829 1.00 0.00 N ATOM 0 H LYS A 32 8.699 -3.548 1.409 1.00 0.00 H new ATOM 0 HA LYS A 32 10.120 -1.395 -0.126 1.00 0.00 H new ATOM 0 HB2 LYS A 32 10.576 -2.807 2.496 1.00 0.00 H new ATOM 0 HB3 LYS A 32 11.993 -2.362 1.567 1.00 0.00 H new ATOM 0 HG2 LYS A 32 10.258 -0.097 1.439 1.00 0.00 H new ATOM 0 HG3 LYS A 32 10.198 -0.637 3.105 1.00 0.00 H new ATOM 0 HD2 LYS A 32 12.926 -0.866 2.462 1.00 0.00 H new ATOM 0 HD3 LYS A 32 12.443 0.591 1.618 1.00 0.00 H new ATOM 0 HE2 LYS A 32 12.748 1.609 3.662 1.00 0.00 H new ATOM 0 HE3 LYS A 32 11.154 0.976 4.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 12.755 0.352 5.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 12.189 -1.034 4.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 13.733 -0.421 4.577 1.00 0.00 H new ATOM 500 N LYS A 33 11.586 -4.284 0.185 1.00 0.00 N ATOM 501 CA LYS A 33 12.278 -5.347 -0.600 1.00 0.00 C ATOM 502 C LYS A 33 11.360 -6.563 -0.725 1.00 0.00 C ATOM 503 O LYS A 33 11.671 -7.637 -0.251 1.00 0.00 O ATOM 504 CB LYS A 33 13.568 -5.754 0.116 1.00 0.00 C ATOM 505 CG LYS A 33 14.716 -4.851 -0.341 1.00 0.00 C ATOM 506 CD LYS A 33 16.033 -5.360 0.250 1.00 0.00 C ATOM 507 CE LYS A 33 16.657 -6.384 -0.698 1.00 0.00 C ATOM 508 NZ LYS A 33 16.937 -7.644 0.047 1.00 0.00 N ATOM 0 H LYS A 33 11.743 -4.316 1.192 1.00 0.00 H new ATOM 0 HA LYS A 33 12.519 -4.967 -1.593 1.00 0.00 H new ATOM 0 HB2 LYS A 33 13.437 -5.675 1.195 1.00 0.00 H new ATOM 0 HB3 LYS A 33 13.803 -6.796 -0.101 1.00 0.00 H new ATOM 0 HG2 LYS A 33 14.774 -4.841 -1.429 1.00 0.00 H new ATOM 0 HG3 LYS A 33 14.535 -3.825 -0.022 1.00 0.00 H new ATOM 0 HD2 LYS A 33 16.719 -4.528 0.406 1.00 0.00 H new ATOM 0 HD3 LYS A 33 15.855 -5.813 1.225 1.00 0.00 H new ATOM 0 HE2 LYS A 33 15.982 -6.583 -1.530 1.00 0.00 H new ATOM 0 HE3 LYS A 33 17.579 -5.988 -1.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 17.362 -8.341 -0.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 17.596 -7.447 0.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 16.049 -8.024 0.432 1.00 0.00 H new ATOM 522 N GLY A 34 10.229 -6.403 -1.356 1.00 0.00 N ATOM 523 CA GLY A 34 9.293 -7.552 -1.507 1.00 0.00 C ATOM 524 C GLY A 34 8.820 -8.002 -0.124 1.00 0.00 C ATOM 525 O GLY A 34 8.621 -9.176 0.124 1.00 0.00 O ATOM 0 H GLY A 34 9.913 -5.527 -1.773 1.00 0.00 H new ATOM 0 HA2 GLY A 34 8.439 -7.263 -2.120 1.00 0.00 H new ATOM 0 HA3 GLY A 34 9.789 -8.376 -2.020 1.00 0.00 H new ATOM 529 N ASN A 35 8.640 -7.078 0.780 1.00 0.00 N ATOM 530 CA ASN A 35 8.183 -7.450 2.148 1.00 0.00 C ATOM 531 C ASN A 35 7.146 -6.436 2.632 1.00 0.00 C ATOM 532 O ASN A 35 7.464 -5.494 3.332 1.00 0.00 O ATOM 533 CB ASN A 35 9.381 -7.449 3.101 1.00 0.00 C ATOM 534 CG ASN A 35 8.928 -7.883 4.497 1.00 0.00 C ATOM 535 OD1 ASN A 35 7.900 -8.514 4.646 1.00 0.00 O ATOM 536 ND2 ASN A 35 9.657 -7.569 5.532 1.00 0.00 N ATOM 0 H ASN A 35 8.790 -6.080 0.629 1.00 0.00 H new ATOM 0 HA ASN A 35 7.736 -8.444 2.126 1.00 0.00 H new ATOM 0 HB2 ASN A 35 10.153 -8.125 2.732 1.00 0.00 H new ATOM 0 HB3 ASN A 35 9.823 -6.454 3.144 1.00 0.00 H new ATOM 0 HD21 ASN A 35 9.364 -7.853 6.467 1.00 0.00 H new ATOM 0 HD22 ASN A 35 10.520 -7.039 5.406 1.00 0.00 H new ATOM 543 N ILE A 36 5.907 -6.620 2.268 1.00 0.00 N ATOM 544 CA ILE A 36 4.851 -5.664 2.709 1.00 0.00 C ATOM 545 C ILE A 36 5.025 -5.366 4.199 1.00 0.00 C ATOM 546 O ILE A 36 4.815 -6.216 5.041 1.00 0.00 O ATOM 547 CB ILE A 36 3.472 -6.280 2.469 1.00 0.00 C ATOM 548 CG1 ILE A 36 3.221 -6.396 0.964 1.00 0.00 C ATOM 549 CG2 ILE A 36 2.398 -5.391 3.096 1.00 0.00 C ATOM 550 CD1 ILE A 36 1.823 -6.965 0.720 1.00 0.00 C ATOM 0 H ILE A 36 5.580 -7.390 1.685 1.00 0.00 H new ATOM 0 HA ILE A 36 4.938 -4.738 2.140 1.00 0.00 H new ATOM 0 HB ILE A 36 3.434 -7.270 2.923 1.00 0.00 H new ATOM 0 HG12 ILE A 36 3.314 -5.417 0.493 1.00 0.00 H new ATOM 0 HG13 ILE A 36 3.972 -7.041 0.508 1.00 0.00 H new ATOM 0 HG21 ILE A 36 1.416 -5.831 2.924 1.00 0.00 H new ATOM 0 HG22 ILE A 36 2.576 -5.307 4.168 1.00 0.00 H new ATOM 0 HG23 ILE A 36 2.436 -4.400 2.643 1.00 0.00 H new ATOM 0 HD11 ILE A 36 1.646 -7.047 -0.352 1.00 0.00 H new ATOM 0 HD12 ILE A 36 1.747 -7.952 1.177 1.00 0.00 H new ATOM 0 HD13 ILE A 36 1.078 -6.302 1.161 1.00 0.00 H new ATOM 562 N GLU A 37 5.410 -4.164 4.532 1.00 0.00 N ATOM 563 CA GLU A 37 5.598 -3.812 5.967 1.00 0.00 C ATOM 564 C GLU A 37 4.522 -2.811 6.392 1.00 0.00 C ATOM 565 O GLU A 37 4.572 -2.252 7.470 1.00 0.00 O ATOM 566 CB GLU A 37 6.981 -3.188 6.161 1.00 0.00 C ATOM 567 CG GLU A 37 7.548 -3.611 7.518 1.00 0.00 C ATOM 568 CD GLU A 37 8.772 -2.757 7.851 1.00 0.00 C ATOM 569 OE1 GLU A 37 9.061 -1.846 7.091 1.00 0.00 O ATOM 570 OE2 GLU A 37 9.401 -3.027 8.861 1.00 0.00 O ATOM 0 H GLU A 37 5.602 -3.411 3.872 1.00 0.00 H new ATOM 0 HA GLU A 37 5.517 -4.712 6.576 1.00 0.00 H new ATOM 0 HB2 GLU A 37 7.650 -3.505 5.361 1.00 0.00 H new ATOM 0 HB3 GLU A 37 6.912 -2.102 6.107 1.00 0.00 H new ATOM 0 HG2 GLU A 37 6.790 -3.495 8.292 1.00 0.00 H new ATOM 0 HG3 GLU A 37 7.823 -4.666 7.496 1.00 0.00 H new ATOM 577 N SER A 38 3.548 -2.578 5.554 1.00 0.00 N ATOM 578 CA SER A 38 2.473 -1.613 5.912 1.00 0.00 C ATOM 579 C SER A 38 1.310 -1.755 4.926 1.00 0.00 C ATOM 580 O SER A 38 1.481 -1.647 3.729 1.00 0.00 O ATOM 581 CB SER A 38 3.027 -0.189 5.848 1.00 0.00 C ATOM 582 OG SER A 38 2.661 0.404 4.610 1.00 0.00 O ATOM 0 H SER A 38 3.452 -3.015 4.637 1.00 0.00 H new ATOM 0 HA SER A 38 2.119 -1.820 6.922 1.00 0.00 H new ATOM 0 HB2 SER A 38 2.637 0.402 6.677 1.00 0.00 H new ATOM 0 HB3 SER A 38 4.112 -0.204 5.950 1.00 0.00 H new ATOM 0 HG SER A 38 2.722 1.379 4.684 1.00 0.00 H new ATOM 588 N SER A 39 0.129 -2.000 5.422 1.00 0.00 N ATOM 589 CA SER A 39 -1.044 -2.151 4.514 1.00 0.00 C ATOM 590 C SER A 39 -2.291 -1.576 5.191 1.00 0.00 C ATOM 591 O SER A 39 -2.822 -2.148 6.122 1.00 0.00 O ATOM 592 CB SER A 39 -1.269 -3.632 4.211 1.00 0.00 C ATOM 593 OG SER A 39 -1.267 -4.365 5.429 1.00 0.00 O ATOM 0 H SER A 39 -0.075 -2.102 6.416 1.00 0.00 H new ATOM 0 HA SER A 39 -0.853 -1.615 3.584 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.218 -3.769 3.692 1.00 0.00 H new ATOM 0 HB3 SER A 39 -0.487 -4.003 3.549 1.00 0.00 H new ATOM 0 HG SER A 39 -1.692 -3.832 6.133 1.00 0.00 H new ATOM 599 N GLU A 40 -2.762 -0.449 4.731 1.00 0.00 N ATOM 600 CA GLU A 40 -3.974 0.160 5.349 1.00 0.00 C ATOM 601 C GLU A 40 -5.046 0.366 4.277 1.00 0.00 C ATOM 602 O GLU A 40 -4.745 0.610 3.125 1.00 0.00 O ATOM 603 CB GLU A 40 -3.608 1.511 5.970 1.00 0.00 C ATOM 604 CG GLU A 40 -4.781 2.023 6.808 1.00 0.00 C ATOM 605 CD GLU A 40 -5.066 3.482 6.449 1.00 0.00 C ATOM 606 OE1 GLU A 40 -4.195 4.111 5.870 1.00 0.00 O ATOM 607 OE2 GLU A 40 -6.152 3.946 6.758 1.00 0.00 O ATOM 0 H GLU A 40 -2.360 0.076 3.954 1.00 0.00 H new ATOM 0 HA GLU A 40 -4.358 -0.504 6.124 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -2.720 1.408 6.593 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -3.366 2.229 5.187 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -5.666 1.413 6.625 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -4.548 1.937 7.869 1.00 0.00 H new ATOM 614 N VAL A 41 -6.294 0.270 4.646 1.00 0.00 N ATOM 615 CA VAL A 41 -7.383 0.460 3.647 1.00 0.00 C ATOM 616 C VAL A 41 -8.016 1.840 3.837 1.00 0.00 C ATOM 617 O VAL A 41 -8.254 2.277 4.945 1.00 0.00 O ATOM 618 CB VAL A 41 -8.448 -0.620 3.843 1.00 0.00 C ATOM 619 CG1 VAL A 41 -9.551 -0.448 2.797 1.00 0.00 C ATOM 620 CG2 VAL A 41 -7.808 -2.001 3.684 1.00 0.00 C ATOM 0 H VAL A 41 -6.606 0.068 5.596 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.970 0.386 2.641 1.00 0.00 H new ATOM 0 HB VAL A 41 -8.877 -0.529 4.841 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -10.309 -1.218 2.938 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -10.008 0.535 2.908 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -9.123 -0.538 1.799 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -8.566 -2.772 3.824 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.379 -2.090 2.686 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -7.022 -2.126 4.429 1.00 0.00 H new ATOM 630 N ILE A 42 -8.293 2.529 2.763 1.00 0.00 N ATOM 631 CA ILE A 42 -8.912 3.879 2.882 1.00 0.00 C ATOM 632 C ILE A 42 -9.984 4.044 1.803 1.00 0.00 C ATOM 633 O ILE A 42 -9.787 3.686 0.659 1.00 0.00 O ATOM 634 CB ILE A 42 -7.836 4.950 2.698 1.00 0.00 C ATOM 635 CG1 ILE A 42 -8.501 6.319 2.533 1.00 0.00 C ATOM 636 CG2 ILE A 42 -7.009 4.633 1.450 1.00 0.00 C ATOM 637 CD1 ILE A 42 -7.708 7.370 3.309 1.00 0.00 C ATOM 0 H ILE A 42 -8.117 2.215 1.809 1.00 0.00 H new ATOM 0 HA ILE A 42 -9.367 3.985 3.867 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.185 4.964 3.572 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -8.546 6.588 1.478 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -9.528 6.282 2.896 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -6.242 5.396 1.318 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -6.535 3.658 1.565 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -7.660 4.619 0.576 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -8.182 8.344 3.191 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -7.686 7.103 4.365 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -6.689 7.414 2.925 1.00 0.00 H new ATOM 649 N GLU A 43 -11.118 4.585 2.157 1.00 0.00 N ATOM 650 CA GLU A 43 -12.200 4.774 1.151 1.00 0.00 C ATOM 651 C GLU A 43 -12.150 6.204 0.613 1.00 0.00 C ATOM 652 O GLU A 43 -12.270 7.159 1.353 1.00 0.00 O ATOM 653 CB GLU A 43 -13.557 4.524 1.812 1.00 0.00 C ATOM 654 CG GLU A 43 -13.632 5.294 3.132 1.00 0.00 C ATOM 655 CD GLU A 43 -13.490 4.318 4.302 1.00 0.00 C ATOM 656 OE1 GLU A 43 -14.268 3.381 4.362 1.00 0.00 O ATOM 657 OE2 GLU A 43 -12.607 4.526 5.117 1.00 0.00 O ATOM 0 H GLU A 43 -11.341 4.904 3.100 1.00 0.00 H new ATOM 0 HA GLU A 43 -12.061 4.072 0.329 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -14.361 4.841 1.148 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -13.695 3.458 1.992 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -12.842 6.044 3.173 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -14.581 5.826 3.201 1.00 0.00 H new ATOM 664 N ASN A 44 -11.972 6.361 -0.670 1.00 0.00 N ATOM 665 CA ASN A 44 -11.913 7.733 -1.250 1.00 0.00 C ATOM 666 C ASN A 44 -13.237 8.456 -0.980 1.00 0.00 C ATOM 667 O ASN A 44 -14.280 7.838 -0.933 1.00 0.00 O ATOM 668 CB ASN A 44 -11.680 7.641 -2.759 1.00 0.00 C ATOM 669 CG ASN A 44 -10.648 8.690 -3.179 1.00 0.00 C ATOM 670 OD1 ASN A 44 -10.883 9.461 -4.087 1.00 0.00 O ATOM 671 ND2 ASN A 44 -9.506 8.753 -2.549 1.00 0.00 N ATOM 0 H ASN A 44 -11.865 5.600 -1.341 1.00 0.00 H new ATOM 0 HA ASN A 44 -11.094 8.287 -0.791 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -11.329 6.643 -3.024 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -12.616 7.802 -3.293 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -8.812 9.450 -2.820 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -9.308 8.106 -1.786 1.00 0.00 H new ATOM 769 N GLY A 54 -13.715 9.994 -12.490 1.00 0.00 N ATOM 770 CA GLY A 54 -13.115 8.725 -11.991 1.00 0.00 C ATOM 771 C GLY A 54 -11.723 8.544 -12.598 1.00 0.00 C ATOM 772 O GLY A 54 -10.813 8.058 -11.956 1.00 0.00 O ATOM 0 HA2 GLY A 54 -13.049 8.745 -10.903 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.751 7.881 -12.256 1.00 0.00 H new ATOM 776 N ILE A 55 -11.549 8.928 -13.834 1.00 0.00 N ATOM 777 CA ILE A 55 -10.215 8.773 -14.479 1.00 0.00 C ATOM 778 C ILE A 55 -9.240 9.790 -13.882 1.00 0.00 C ATOM 779 O ILE A 55 -8.086 9.492 -13.645 1.00 0.00 O ATOM 780 CB ILE A 55 -10.347 9.017 -15.983 1.00 0.00 C ATOM 781 CG1 ILE A 55 -11.409 8.076 -16.562 1.00 0.00 C ATOM 782 CG2 ILE A 55 -9.003 8.751 -16.664 1.00 0.00 C ATOM 783 CD1 ILE A 55 -10.874 6.643 -16.573 1.00 0.00 C ATOM 0 H ILE A 55 -12.272 9.341 -14.423 1.00 0.00 H new ATOM 0 HA ILE A 55 -9.841 7.764 -14.305 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.644 10.051 -16.158 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.321 8.130 -15.967 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -11.670 8.385 -17.574 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -9.097 8.925 -17.736 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -8.248 9.421 -16.253 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -8.705 7.717 -16.489 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -11.631 5.975 -16.985 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -9.975 6.595 -17.187 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -10.635 6.336 -15.555 1.00 0.00 H new ATOM 795 N ARG A 56 -9.693 10.989 -13.637 1.00 0.00 N ATOM 796 CA ARG A 56 -8.791 12.023 -13.057 1.00 0.00 C ATOM 797 C ARG A 56 -8.380 11.609 -11.643 1.00 0.00 C ATOM 798 O ARG A 56 -7.495 12.188 -11.048 1.00 0.00 O ATOM 799 CB ARG A 56 -9.523 13.364 -13.004 1.00 0.00 C ATOM 800 CG ARG A 56 -10.213 13.622 -14.345 1.00 0.00 C ATOM 801 CD ARG A 56 -9.463 14.719 -15.103 1.00 0.00 C ATOM 802 NE ARG A 56 -9.255 15.888 -14.204 1.00 0.00 N ATOM 803 CZ ARG A 56 -10.248 16.692 -13.937 1.00 0.00 C ATOM 804 NH1 ARG A 56 -10.905 17.262 -14.910 1.00 0.00 N ATOM 805 NH2 ARG A 56 -10.585 16.924 -12.698 1.00 0.00 N ATOM 0 H ARG A 56 -10.649 11.297 -13.814 1.00 0.00 H new ATOM 0 HA ARG A 56 -7.901 12.119 -13.679 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -10.259 13.357 -12.200 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -8.819 14.166 -12.785 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.235 12.707 -14.937 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -11.248 13.921 -14.182 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -8.503 14.342 -15.455 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -10.030 15.020 -15.984 1.00 0.00 H new ATOM 0 HE ARG A 56 -8.336 16.060 -13.797 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -10.642 17.079 -15.879 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -11.681 17.890 -14.702 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -10.072 16.477 -11.938 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.361 17.552 -12.490 1.00 0.00 H new ATOM 819 N THR A 57 -9.017 10.608 -11.100 1.00 0.00 N ATOM 820 CA THR A 57 -8.662 10.158 -9.725 1.00 0.00 C ATOM 821 C THR A 57 -7.287 9.489 -9.751 1.00 0.00 C ATOM 822 O THR A 57 -6.525 9.576 -8.808 1.00 0.00 O ATOM 823 CB THR A 57 -9.710 9.158 -9.231 1.00 0.00 C ATOM 824 OG1 THR A 57 -11.003 9.744 -9.329 1.00 0.00 O ATOM 825 CG2 THR A 57 -9.415 8.787 -7.776 1.00 0.00 C ATOM 0 H THR A 57 -9.767 10.083 -11.549 1.00 0.00 H new ATOM 0 HA THR A 57 -8.636 11.016 -9.053 1.00 0.00 H new ATOM 0 HB THR A 57 -9.676 8.257 -9.843 1.00 0.00 H new ATOM 0 HG1 THR A 57 -11.676 9.105 -9.015 1.00 0.00 H new ATOM 0 HG21 THR A 57 -10.161 8.075 -7.424 1.00 0.00 H new ATOM 0 HG22 THR A 57 -8.424 8.338 -7.709 1.00 0.00 H new ATOM 0 HG23 THR A 57 -9.449 9.684 -7.158 1.00 0.00 H new ATOM 833 N ALA A 58 -6.962 8.823 -10.824 1.00 0.00 N ATOM 834 CA ALA A 58 -5.636 8.151 -10.911 1.00 0.00 C ATOM 835 C ALA A 58 -4.536 9.152 -10.547 1.00 0.00 C ATOM 836 O ALA A 58 -3.457 8.781 -10.132 1.00 0.00 O ATOM 837 CB ALA A 58 -5.415 7.645 -12.338 1.00 0.00 C ATOM 0 H ALA A 58 -7.558 8.715 -11.645 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.606 7.309 -10.219 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -4.445 7.153 -12.403 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -6.200 6.935 -12.598 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.442 8.486 -13.031 1.00 0.00 H new ATOM 843 N GLN A 59 -4.803 10.421 -10.700 1.00 0.00 N ATOM 844 CA GLN A 59 -3.775 11.445 -10.363 1.00 0.00 C ATOM 845 C GLN A 59 -3.592 11.504 -8.846 1.00 0.00 C ATOM 846 O GLN A 59 -2.489 11.424 -8.342 1.00 0.00 O ATOM 847 CB GLN A 59 -4.227 12.814 -10.875 1.00 0.00 C ATOM 848 CG GLN A 59 -3.057 13.507 -11.576 1.00 0.00 C ATOM 849 CD GLN A 59 -2.271 14.335 -10.557 1.00 0.00 C ATOM 850 OE1 GLN A 59 -2.851 14.996 -9.718 1.00 0.00 O ATOM 851 NE2 GLN A 59 -0.967 14.327 -10.594 1.00 0.00 N ATOM 0 H GLN A 59 -5.689 10.792 -11.044 1.00 0.00 H new ATOM 0 HA GLN A 59 -2.829 11.176 -10.834 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -5.062 12.698 -11.566 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -4.582 13.426 -10.045 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -2.405 12.766 -12.039 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -3.427 14.149 -12.375 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -0.480 13.772 -11.298 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -0.434 14.875 -9.919 1.00 0.00 H new ATOM 860 N ILE A 60 -4.662 11.645 -8.113 1.00 0.00 N ATOM 861 CA ILE A 60 -4.543 11.709 -6.629 1.00 0.00 C ATOM 862 C ILE A 60 -3.885 10.427 -6.116 1.00 0.00 C ATOM 863 O ILE A 60 -3.155 10.438 -5.145 1.00 0.00 O ATOM 864 CB ILE A 60 -5.933 11.854 -6.008 1.00 0.00 C ATOM 865 CG1 ILE A 60 -5.827 11.718 -4.487 1.00 0.00 C ATOM 866 CG2 ILE A 60 -6.853 10.761 -6.553 1.00 0.00 C ATOM 867 CD1 ILE A 60 -6.194 13.047 -3.828 1.00 0.00 C ATOM 0 H ILE A 60 -5.612 11.719 -8.477 1.00 0.00 H new ATOM 0 HA ILE A 60 -3.933 12.568 -6.351 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.343 12.832 -6.260 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -6.492 10.930 -4.135 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -4.814 11.429 -4.207 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -7.844 10.865 -6.110 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.928 10.855 -7.636 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -6.444 9.782 -6.302 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -6.118 12.949 -2.745 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -5.511 13.824 -4.171 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -7.215 13.317 -4.097 1.00 0.00 H new ATOM 879 N ILE A 61 -4.135 9.320 -6.762 1.00 0.00 N ATOM 880 CA ILE A 61 -3.521 8.039 -6.312 1.00 0.00 C ATOM 881 C ILE A 61 -2.009 8.099 -6.537 1.00 0.00 C ATOM 882 O ILE A 61 -1.231 7.658 -5.714 1.00 0.00 O ATOM 883 CB ILE A 61 -4.110 6.879 -7.117 1.00 0.00 C ATOM 884 CG1 ILE A 61 -5.594 6.725 -6.778 1.00 0.00 C ATOM 885 CG2 ILE A 61 -3.374 5.585 -6.766 1.00 0.00 C ATOM 886 CD1 ILE A 61 -6.228 5.696 -7.716 1.00 0.00 C ATOM 0 H ILE A 61 -4.738 9.248 -7.582 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.729 7.886 -5.253 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.997 7.084 -8.182 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.710 6.408 -5.742 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -6.102 7.684 -6.877 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.795 4.760 -7.340 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.316 5.692 -7.006 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -3.486 5.380 -5.701 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -7.285 5.586 -7.474 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -6.124 6.032 -8.748 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -5.727 4.736 -7.595 1.00 0.00 H new ATOM 898 N ALA A 62 -1.588 8.642 -7.646 1.00 0.00 N ATOM 899 CA ALA A 62 -0.127 8.733 -7.927 1.00 0.00 C ATOM 900 C ALA A 62 0.484 9.859 -7.090 1.00 0.00 C ATOM 901 O ALA A 62 1.680 9.916 -6.885 1.00 0.00 O ATOM 902 CB ALA A 62 0.087 9.029 -9.413 1.00 0.00 C ATOM 0 H ALA A 62 -2.193 9.027 -8.371 1.00 0.00 H new ATOM 0 HA ALA A 62 0.353 7.788 -7.671 1.00 0.00 H new ATOM 0 HB1 ALA A 62 1.155 9.096 -9.621 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -0.349 8.228 -10.010 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -0.392 9.974 -9.668 1.00 0.00 H new ATOM 908 N ASN A 63 -0.329 10.756 -6.603 1.00 0.00 N ATOM 909 CA ASN A 63 0.204 11.877 -5.780 1.00 0.00 C ATOM 910 C ASN A 63 0.583 11.354 -4.394 1.00 0.00 C ATOM 911 O ASN A 63 1.317 11.985 -3.660 1.00 0.00 O ATOM 912 CB ASN A 63 -0.869 12.959 -5.641 1.00 0.00 C ATOM 913 CG ASN A 63 -0.207 14.339 -5.634 1.00 0.00 C ATOM 914 OD1 ASN A 63 0.974 14.460 -5.894 1.00 0.00 O ATOM 915 ND2 ASN A 63 -0.923 15.390 -5.344 1.00 0.00 N ATOM 0 H ASN A 63 -1.340 10.761 -6.740 1.00 0.00 H new ATOM 0 HA ASN A 63 1.086 12.298 -6.263 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -1.579 12.889 -6.465 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -1.433 12.810 -4.720 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -0.492 16.314 -5.335 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -1.914 15.288 -5.126 1.00 0.00 H new ATOM 922 N ASN A 64 0.085 10.204 -4.029 1.00 0.00 N ATOM 923 CA ASN A 64 0.413 9.638 -2.691 1.00 0.00 C ATOM 924 C ASN A 64 1.713 8.835 -2.779 1.00 0.00 C ATOM 925 O ASN A 64 2.067 8.107 -1.873 1.00 0.00 O ATOM 926 CB ASN A 64 -0.723 8.718 -2.237 1.00 0.00 C ATOM 927 CG ASN A 64 -1.106 9.047 -0.794 1.00 0.00 C ATOM 928 OD1 ASN A 64 -0.488 9.883 -0.165 1.00 0.00 O ATOM 929 ND2 ASN A 64 -2.107 8.421 -0.238 1.00 0.00 N ATOM 0 H ASN A 64 -0.536 9.632 -4.601 1.00 0.00 H new ATOM 0 HA ASN A 64 0.536 10.449 -1.974 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -1.587 8.841 -2.890 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -0.412 7.676 -2.313 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -2.370 8.634 0.724 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -2.626 7.719 -0.766 1.00 0.00 H new ATOM 936 N GLY A 65 2.427 8.958 -3.866 1.00 0.00 N ATOM 937 CA GLY A 65 3.702 8.199 -4.010 1.00 0.00 C ATOM 938 C GLY A 65 3.417 6.826 -4.625 1.00 0.00 C ATOM 939 O GLY A 65 4.319 6.075 -4.939 1.00 0.00 O ATOM 0 H GLY A 65 2.182 9.551 -4.659 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.398 8.753 -4.640 1.00 0.00 H new ATOM 0 HA3 GLY A 65 4.178 8.081 -3.037 1.00 0.00 H new ATOM 943 N VAL A 66 2.166 6.493 -4.798 1.00 0.00 N ATOM 944 CA VAL A 66 1.815 5.170 -5.391 1.00 0.00 C ATOM 945 C VAL A 66 2.520 5.000 -6.736 1.00 0.00 C ATOM 946 O VAL A 66 1.991 5.347 -7.774 1.00 0.00 O ATOM 947 CB VAL A 66 0.300 5.098 -5.595 1.00 0.00 C ATOM 948 CG1 VAL A 66 -0.062 3.778 -6.279 1.00 0.00 C ATOM 949 CG2 VAL A 66 -0.401 5.176 -4.237 1.00 0.00 C ATOM 0 H VAL A 66 1.370 7.082 -4.554 1.00 0.00 H new ATOM 0 HA VAL A 66 2.135 4.374 -4.718 1.00 0.00 H new ATOM 0 HB VAL A 66 -0.022 5.931 -6.220 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.141 3.727 -6.424 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.437 3.721 -7.246 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.260 2.944 -5.655 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.480 5.125 -4.381 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.078 4.343 -3.613 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.144 6.116 -3.749 1.00 0.00 H new ATOM 959 N LYS A 67 3.706 4.457 -6.732 1.00 0.00 N ATOM 960 CA LYS A 67 4.432 4.256 -8.014 1.00 0.00 C ATOM 961 C LYS A 67 3.878 3.011 -8.711 1.00 0.00 C ATOM 962 O LYS A 67 4.339 2.620 -9.764 1.00 0.00 O ATOM 963 CB LYS A 67 5.925 4.064 -7.738 1.00 0.00 C ATOM 964 CG LYS A 67 6.503 5.347 -7.141 1.00 0.00 C ATOM 965 CD LYS A 67 7.271 6.112 -8.222 1.00 0.00 C ATOM 966 CE LYS A 67 8.172 7.158 -7.564 1.00 0.00 C ATOM 967 NZ LYS A 67 7.331 8.177 -6.876 1.00 0.00 N ATOM 0 H LYS A 67 4.202 4.145 -5.897 1.00 0.00 H new ATOM 0 HA LYS A 67 4.296 5.129 -8.652 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.074 3.231 -7.051 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.447 3.813 -8.661 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.701 5.968 -6.741 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.166 5.107 -6.310 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.871 5.421 -8.815 1.00 0.00 H new ATOM 0 HD3 LYS A 67 6.573 6.596 -8.905 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.840 6.679 -6.848 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.800 7.637 -8.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 7.922 8.989 -6.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 6.577 8.495 -7.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 6.907 7.759 -6.024 1.00 0.00 H new ATOM 981 N ALA A 68 2.886 2.387 -8.132 1.00 0.00 N ATOM 982 CA ALA A 68 2.298 1.173 -8.765 1.00 0.00 C ATOM 983 C ALA A 68 0.786 1.173 -8.536 1.00 0.00 C ATOM 984 O ALA A 68 0.312 1.531 -7.477 1.00 0.00 O ATOM 985 CB ALA A 68 2.913 -0.079 -8.140 1.00 0.00 C ATOM 0 H ALA A 68 2.459 2.666 -7.249 1.00 0.00 H new ATOM 0 HA ALA A 68 2.507 1.178 -9.835 1.00 0.00 H new ATOM 0 HB1 ALA A 68 2.482 -0.966 -8.604 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.991 -0.073 -8.300 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.705 -0.091 -7.070 1.00 0.00 H new ATOM 991 N VAL A 69 0.021 0.786 -9.520 1.00 0.00 N ATOM 992 CA VAL A 69 -1.460 0.779 -9.344 1.00 0.00 C ATOM 993 C VAL A 69 -2.060 -0.469 -9.996 1.00 0.00 C ATOM 994 O VAL A 69 -1.773 -0.790 -11.132 1.00 0.00 O ATOM 995 CB VAL A 69 -2.051 2.030 -10.001 1.00 0.00 C ATOM 996 CG1 VAL A 69 -3.571 1.886 -10.113 1.00 0.00 C ATOM 997 CG2 VAL A 69 -1.718 3.257 -9.149 1.00 0.00 C ATOM 0 H VAL A 69 0.354 0.476 -10.433 1.00 0.00 H new ATOM 0 HA VAL A 69 -1.695 0.772 -8.280 1.00 0.00 H new ATOM 0 HB VAL A 69 -1.626 2.149 -10.998 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -3.987 2.778 -10.581 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -3.810 1.013 -10.720 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -3.999 1.765 -9.118 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -2.138 4.148 -9.615 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -2.143 3.134 -8.153 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.636 3.363 -9.072 1.00 0.00 H new ATOM 1007 N ILE A 70 -2.901 -1.170 -9.285 1.00 0.00 N ATOM 1008 CA ILE A 70 -3.533 -2.391 -9.861 1.00 0.00 C ATOM 1009 C ILE A 70 -5.009 -2.099 -10.140 1.00 0.00 C ATOM 1010 O ILE A 70 -5.795 -1.919 -9.231 1.00 0.00 O ATOM 1011 CB ILE A 70 -3.425 -3.553 -8.868 1.00 0.00 C ATOM 1012 CG1 ILE A 70 -2.211 -3.349 -7.958 1.00 0.00 C ATOM 1013 CG2 ILE A 70 -3.269 -4.866 -9.637 1.00 0.00 C ATOM 1014 CD1 ILE A 70 -0.943 -3.269 -8.809 1.00 0.00 C ATOM 0 H ILE A 70 -3.178 -0.949 -8.328 1.00 0.00 H new ATOM 0 HA ILE A 70 -3.023 -2.664 -10.785 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.328 -3.589 -8.259 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -2.329 -2.435 -7.376 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -2.133 -4.172 -7.247 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -3.192 -5.694 -8.932 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -4.136 -5.016 -10.280 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.367 -4.825 -10.248 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -0.079 -3.124 -8.161 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -0.823 -4.195 -9.372 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.022 -2.431 -9.502 1.00 0.00 H new ATOM 1026 N ALA A 71 -5.393 -2.044 -11.385 1.00 0.00 N ATOM 1027 CA ALA A 71 -6.820 -1.754 -11.705 1.00 0.00 C ATOM 1028 C ALA A 71 -7.180 -2.346 -13.066 1.00 0.00 C ATOM 1029 O ALA A 71 -6.352 -2.909 -13.756 1.00 0.00 O ATOM 1030 CB ALA A 71 -7.034 -0.239 -11.742 1.00 0.00 C ATOM 0 H ALA A 71 -4.785 -2.186 -12.191 1.00 0.00 H new ATOM 0 HA ALA A 71 -7.455 -2.199 -10.939 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -8.077 -0.024 -11.976 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -6.785 0.187 -10.770 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -6.393 0.200 -12.506 1.00 0.00 H new ATOM 1036 N SER A 72 -8.419 -2.221 -13.453 1.00 0.00 N ATOM 1037 CA SER A 72 -8.855 -2.769 -14.766 1.00 0.00 C ATOM 1038 C SER A 72 -9.852 -1.802 -15.410 1.00 0.00 C ATOM 1039 O SER A 72 -10.878 -2.202 -15.924 1.00 0.00 O ATOM 1040 CB SER A 72 -9.524 -4.127 -14.554 1.00 0.00 C ATOM 1041 OG SER A 72 -8.868 -5.104 -15.351 1.00 0.00 O ATOM 0 H SER A 72 -9.151 -1.760 -12.913 1.00 0.00 H new ATOM 0 HA SER A 72 -7.990 -2.890 -15.418 1.00 0.00 H new ATOM 0 HB2 SER A 72 -9.477 -4.408 -13.502 1.00 0.00 H new ATOM 0 HB3 SER A 72 -10.579 -4.071 -14.822 1.00 0.00 H new ATOM 0 HG SER A 72 -9.294 -5.976 -15.216 1.00 0.00 H new ATOM 1047 N SER A 73 -9.557 -0.530 -15.383 1.00 0.00 N ATOM 1048 CA SER A 73 -10.488 0.465 -15.988 1.00 0.00 C ATOM 1049 C SER A 73 -10.946 -0.032 -17.363 1.00 0.00 C ATOM 1050 O SER A 73 -10.227 -0.744 -18.035 1.00 0.00 O ATOM 1051 CB SER A 73 -9.768 1.806 -16.146 1.00 0.00 C ATOM 1052 OG SER A 73 -8.364 1.583 -16.180 1.00 0.00 O ATOM 0 H SER A 73 -8.712 -0.137 -14.968 1.00 0.00 H new ATOM 0 HA SER A 73 -11.355 0.591 -15.340 1.00 0.00 H new ATOM 0 HB2 SER A 73 -10.092 2.300 -17.062 1.00 0.00 H new ATOM 0 HB3 SER A 73 -10.023 2.469 -15.319 1.00 0.00 H new ATOM 0 HG SER A 73 -8.147 0.978 -16.920 1.00 0.00 H new ATOM 1058 N PRO A 74 -12.137 0.362 -17.738 1.00 0.00 N ATOM 1059 CA PRO A 74 -12.732 -0.023 -19.029 1.00 0.00 C ATOM 1060 C PRO A 74 -12.133 0.816 -20.161 1.00 0.00 C ATOM 1061 O PRO A 74 -11.879 0.327 -21.244 1.00 0.00 O ATOM 1062 CB PRO A 74 -14.220 0.286 -18.845 1.00 0.00 C ATOM 1063 CG PRO A 74 -14.310 1.335 -17.710 1.00 0.00 C ATOM 1064 CD PRO A 74 -12.999 1.229 -16.909 1.00 0.00 C ATOM 0 HA PRO A 74 -12.550 -1.064 -19.294 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -14.653 0.673 -19.767 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -14.775 -0.616 -18.586 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -14.435 2.338 -18.118 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -15.171 1.142 -17.071 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -12.547 2.209 -16.754 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -13.169 0.796 -15.923 1.00 0.00 H new ATOM 1072 N GLY A 75 -11.901 2.077 -19.917 1.00 0.00 N ATOM 1073 CA GLY A 75 -11.317 2.947 -20.977 1.00 0.00 C ATOM 1074 C GLY A 75 -9.825 3.154 -20.698 1.00 0.00 C ATOM 1075 O GLY A 75 -9.413 3.212 -19.555 1.00 0.00 O ATOM 0 H GLY A 75 -12.091 2.542 -19.029 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -11.455 2.489 -21.956 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.831 3.908 -20.999 1.00 0.00 H new ATOM 1079 N PRO A 76 -9.059 3.261 -21.754 1.00 0.00 N ATOM 1080 CA PRO A 76 -7.601 3.463 -21.661 1.00 0.00 C ATOM 1081 C PRO A 76 -7.277 4.927 -21.345 1.00 0.00 C ATOM 1082 O PRO A 76 -6.133 5.338 -21.371 1.00 0.00 O ATOM 1083 CB PRO A 76 -7.100 3.082 -23.057 1.00 0.00 C ATOM 1084 CG PRO A 76 -8.306 3.236 -24.013 1.00 0.00 C ATOM 1085 CD PRO A 76 -9.572 3.187 -23.137 1.00 0.00 C ATOM 0 HA PRO A 76 -7.137 2.876 -20.869 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -6.277 3.728 -23.363 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -6.724 2.059 -23.068 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -8.249 4.177 -24.559 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -8.317 2.437 -24.755 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -10.242 4.018 -23.358 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -10.136 2.270 -23.304 1.00 0.00 H new ATOM 1093 N ASN A 77 -8.272 5.718 -21.049 1.00 0.00 N ATOM 1094 CA ASN A 77 -8.018 7.153 -20.734 1.00 0.00 C ATOM 1095 C ASN A 77 -7.175 7.258 -19.462 1.00 0.00 C ATOM 1096 O ASN A 77 -6.212 7.998 -19.404 1.00 0.00 O ATOM 1097 CB ASN A 77 -9.353 7.869 -20.520 1.00 0.00 C ATOM 1098 CG ASN A 77 -9.165 9.374 -20.718 1.00 0.00 C ATOM 1099 OD1 ASN A 77 -9.727 9.953 -21.627 1.00 0.00 O ATOM 1100 ND2 ASN A 77 -8.393 10.037 -19.901 1.00 0.00 N ATOM 0 H ASN A 77 -9.251 5.433 -21.012 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.482 7.617 -21.562 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -10.097 7.490 -21.221 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -9.728 7.668 -19.517 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -8.261 11.041 -20.025 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -7.921 9.551 -19.138 1.00 0.00 H new ATOM 1107 N ALA A 78 -7.528 6.527 -18.442 1.00 0.00 N ATOM 1108 CA ALA A 78 -6.747 6.589 -17.174 1.00 0.00 C ATOM 1109 C ALA A 78 -5.354 5.998 -17.401 1.00 0.00 C ATOM 1110 O ALA A 78 -4.353 6.598 -17.061 1.00 0.00 O ATOM 1111 CB ALA A 78 -7.469 5.786 -16.090 1.00 0.00 C ATOM 0 H ALA A 78 -8.324 5.889 -18.431 1.00 0.00 H new ATOM 0 HA ALA A 78 -6.654 7.628 -16.857 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -6.898 5.831 -15.163 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.461 6.206 -15.926 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.563 4.748 -16.408 1.00 0.00 H new ATOM 1117 N PHE A 79 -5.280 4.826 -17.971 1.00 0.00 N ATOM 1118 CA PHE A 79 -3.949 4.201 -18.214 1.00 0.00 C ATOM 1119 C PHE A 79 -3.045 5.188 -18.955 1.00 0.00 C ATOM 1120 O PHE A 79 -1.845 5.207 -18.765 1.00 0.00 O ATOM 1121 CB PHE A 79 -4.123 2.939 -19.063 1.00 0.00 C ATOM 1122 CG PHE A 79 -4.728 1.834 -18.228 1.00 0.00 C ATOM 1123 CD1 PHE A 79 -4.316 1.645 -16.902 1.00 0.00 C ATOM 1124 CD2 PHE A 79 -5.701 0.993 -18.785 1.00 0.00 C ATOM 1125 CE1 PHE A 79 -4.879 0.618 -16.132 1.00 0.00 C ATOM 1126 CE2 PHE A 79 -6.262 -0.035 -18.016 1.00 0.00 C ATOM 1127 CZ PHE A 79 -5.851 -0.222 -16.690 1.00 0.00 C ATOM 0 H PHE A 79 -6.082 4.275 -18.278 1.00 0.00 H new ATOM 0 HA PHE A 79 -3.495 3.939 -17.258 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.764 3.152 -19.919 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -3.158 2.621 -19.458 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -3.564 2.291 -16.473 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -6.018 1.137 -19.807 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -4.564 0.474 -15.109 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -7.011 -0.683 -18.446 1.00 0.00 H new ATOM 0 HZ PHE A 79 -6.284 -1.014 -16.098 1.00 0.00 H new ATOM 1137 N GLU A 80 -3.609 6.005 -19.800 1.00 0.00 N ATOM 1138 CA GLU A 80 -2.780 6.986 -20.557 1.00 0.00 C ATOM 1139 C GLU A 80 -2.196 8.022 -19.593 1.00 0.00 C ATOM 1140 O GLU A 80 -1.048 8.403 -19.700 1.00 0.00 O ATOM 1141 CB GLU A 80 -3.651 7.692 -21.597 1.00 0.00 C ATOM 1142 CG GLU A 80 -3.115 7.396 -22.998 1.00 0.00 C ATOM 1143 CD GLU A 80 -4.135 6.558 -23.769 1.00 0.00 C ATOM 1144 OE1 GLU A 80 -4.562 5.545 -23.238 1.00 0.00 O ATOM 1145 OE2 GLU A 80 -4.473 6.942 -24.876 1.00 0.00 O ATOM 0 H GLU A 80 -4.609 6.036 -20.000 1.00 0.00 H new ATOM 0 HA GLU A 80 -1.966 6.461 -21.057 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.684 7.353 -21.512 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -3.652 8.767 -21.416 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -2.919 8.328 -23.528 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -2.167 6.862 -22.931 1.00 0.00 H new ATOM 1152 N VAL A 81 -2.976 8.484 -18.655 1.00 0.00 N ATOM 1153 CA VAL A 81 -2.462 9.498 -17.691 1.00 0.00 C ATOM 1154 C VAL A 81 -1.320 8.897 -16.868 1.00 0.00 C ATOM 1155 O VAL A 81 -0.239 9.446 -16.797 1.00 0.00 O ATOM 1156 CB VAL A 81 -3.593 9.931 -16.755 1.00 0.00 C ATOM 1157 CG1 VAL A 81 -3.242 11.274 -16.114 1.00 0.00 C ATOM 1158 CG2 VAL A 81 -4.889 10.075 -17.558 1.00 0.00 C ATOM 0 H VAL A 81 -3.947 8.204 -18.514 1.00 0.00 H new ATOM 0 HA VAL A 81 -2.092 10.363 -18.241 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.726 9.181 -15.975 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -4.048 11.581 -15.448 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -2.318 11.175 -15.544 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -3.109 12.025 -16.893 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -5.696 10.383 -16.894 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -4.753 10.826 -18.337 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -5.141 9.119 -18.016 1.00 0.00 H new ATOM 1168 N LEU A 82 -1.552 7.775 -16.244 1.00 0.00 N ATOM 1169 CA LEU A 82 -0.477 7.143 -15.425 1.00 0.00 C ATOM 1170 C LEU A 82 0.726 6.818 -16.314 1.00 0.00 C ATOM 1171 O LEU A 82 1.822 6.609 -15.836 1.00 0.00 O ATOM 1172 CB LEU A 82 -1.006 5.853 -14.796 1.00 0.00 C ATOM 1173 CG LEU A 82 -2.283 6.152 -14.007 1.00 0.00 C ATOM 1174 CD1 LEU A 82 -3.013 4.843 -13.704 1.00 0.00 C ATOM 1175 CD2 LEU A 82 -1.918 6.848 -12.694 1.00 0.00 C ATOM 0 H LEU A 82 -2.437 7.269 -16.265 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.170 7.834 -14.640 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.210 5.115 -15.572 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.252 5.422 -14.137 1.00 0.00 H new ATOM 0 HG LEU A 82 -2.931 6.801 -14.596 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -3.923 5.055 -13.142 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -3.272 4.346 -14.639 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -2.366 4.193 -13.115 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -2.826 7.062 -12.131 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.271 6.198 -12.105 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -1.397 7.781 -12.909 1.00 0.00 H new ATOM 1187 N ASN A 83 0.529 6.771 -17.603 1.00 0.00 N ATOM 1188 CA ASN A 83 1.662 6.453 -18.518 1.00 0.00 C ATOM 1189 C ASN A 83 2.656 7.617 -18.533 1.00 0.00 C ATOM 1190 O ASN A 83 3.828 7.447 -18.258 1.00 0.00 O ATOM 1191 CB ASN A 83 1.123 6.225 -19.933 1.00 0.00 C ATOM 1192 CG ASN A 83 0.973 4.725 -20.186 1.00 0.00 C ATOM 1193 OD1 ASN A 83 1.904 3.968 -19.994 1.00 0.00 O ATOM 1194 ND2 ASN A 83 -0.169 4.259 -20.613 1.00 0.00 N ATOM 0 H ASN A 83 -0.366 6.939 -18.062 1.00 0.00 H new ATOM 0 HA ASN A 83 2.167 5.553 -18.169 1.00 0.00 H new ATOM 0 HB2 ASN A 83 0.160 6.723 -20.051 1.00 0.00 H new ATOM 0 HB3 ASN A 83 1.800 6.662 -20.666 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -0.280 3.260 -20.785 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -0.951 4.894 -20.774 1.00 0.00 H new ATOM 1201 N GLU A 84 2.203 8.797 -18.856 1.00 0.00 N ATOM 1202 CA GLU A 84 3.126 9.968 -18.892 1.00 0.00 C ATOM 1203 C GLU A 84 3.625 10.274 -17.479 1.00 0.00 C ATOM 1204 O GLU A 84 4.752 10.685 -17.286 1.00 0.00 O ATOM 1205 CB GLU A 84 2.383 11.185 -19.446 1.00 0.00 C ATOM 1206 CG GLU A 84 2.175 11.013 -20.951 1.00 0.00 C ATOM 1207 CD GLU A 84 1.030 11.917 -21.415 1.00 0.00 C ATOM 1208 OE1 GLU A 84 -0.112 11.517 -21.264 1.00 0.00 O ATOM 1209 OE2 GLU A 84 1.315 12.993 -21.914 1.00 0.00 O ATOM 0 H GLU A 84 1.233 9.002 -19.097 1.00 0.00 H new ATOM 0 HA GLU A 84 3.977 9.738 -19.533 1.00 0.00 H new ATOM 0 HB2 GLU A 84 1.421 11.296 -18.945 1.00 0.00 H new ATOM 0 HB3 GLU A 84 2.952 12.093 -19.248 1.00 0.00 H new ATOM 0 HG2 GLU A 84 3.091 11.264 -21.486 1.00 0.00 H new ATOM 0 HG3 GLU A 84 1.947 9.972 -21.181 1.00 0.00 H new ATOM 1216 N LEU A 85 2.799 10.078 -16.491 1.00 0.00 N ATOM 1217 CA LEU A 85 3.233 10.360 -15.093 1.00 0.00 C ATOM 1218 C LEU A 85 4.416 9.458 -14.736 1.00 0.00 C ATOM 1219 O LEU A 85 5.093 9.668 -13.748 1.00 0.00 O ATOM 1220 CB LEU A 85 2.073 10.090 -14.133 1.00 0.00 C ATOM 1221 CG LEU A 85 1.104 11.273 -14.158 1.00 0.00 C ATOM 1222 CD1 LEU A 85 -0.319 10.774 -13.898 1.00 0.00 C ATOM 1223 CD2 LEU A 85 1.497 12.277 -13.071 1.00 0.00 C ATOM 0 H LEU A 85 1.843 9.735 -16.589 1.00 0.00 H new ATOM 0 HA LEU A 85 3.535 11.404 -15.009 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.554 9.175 -14.421 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.451 9.938 -13.122 1.00 0.00 H new ATOM 0 HG LEU A 85 1.147 11.756 -15.134 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -1.009 11.617 -13.916 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -0.600 10.058 -14.670 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -0.362 10.290 -12.922 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.807 13.121 -13.088 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.454 11.793 -12.096 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.511 12.634 -13.254 1.00 0.00 H new ATOM 1235 N GLY A 86 4.673 8.455 -15.531 1.00 0.00 N ATOM 1236 CA GLY A 86 5.813 7.543 -15.236 1.00 0.00 C ATOM 1237 C GLY A 86 5.417 6.574 -14.122 1.00 0.00 C ATOM 1238 O GLY A 86 6.255 6.045 -13.420 1.00 0.00 O ATOM 0 H GLY A 86 4.142 8.228 -16.372 1.00 0.00 H new ATOM 0 HA2 GLY A 86 6.090 6.989 -16.133 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.687 8.121 -14.936 1.00 0.00 H new ATOM 1242 N ILE A 87 4.146 6.336 -13.954 1.00 0.00 N ATOM 1243 CA ILE A 87 3.698 5.400 -12.885 1.00 0.00 C ATOM 1244 C ILE A 87 3.573 3.990 -13.464 1.00 0.00 C ATOM 1245 O ILE A 87 3.189 3.806 -14.601 1.00 0.00 O ATOM 1246 CB ILE A 87 2.340 5.853 -12.345 1.00 0.00 C ATOM 1247 CG1 ILE A 87 2.285 7.381 -12.320 1.00 0.00 C ATOM 1248 CG2 ILE A 87 2.148 5.312 -10.928 1.00 0.00 C ATOM 1249 CD1 ILE A 87 3.413 7.918 -11.436 1.00 0.00 C ATOM 0 H ILE A 87 3.398 6.749 -14.511 1.00 0.00 H new ATOM 0 HA ILE A 87 4.427 5.397 -12.075 1.00 0.00 H new ATOM 0 HB ILE A 87 1.548 5.472 -12.989 1.00 0.00 H new ATOM 0 HG12 ILE A 87 2.382 7.776 -13.331 1.00 0.00 H new ATOM 0 HG13 ILE A 87 1.320 7.715 -11.939 1.00 0.00 H new ATOM 0 HG21 ILE A 87 1.181 5.635 -10.543 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.186 4.223 -10.946 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.940 5.692 -10.283 1.00 0.00 H new ATOM 0 HD11 ILE A 87 3.374 9.007 -11.418 1.00 0.00 H new ATOM 0 HD12 ILE A 87 3.295 7.534 -10.423 1.00 0.00 H new ATOM 0 HD13 ILE A 87 4.374 7.596 -11.837 1.00 0.00 H new ATOM 1261 N LYS A 88 3.895 2.991 -12.688 1.00 0.00 N ATOM 1262 CA LYS A 88 3.795 1.593 -13.190 1.00 0.00 C ATOM 1263 C LYS A 88 2.338 1.130 -13.121 1.00 0.00 C ATOM 1264 O LYS A 88 1.790 0.930 -12.055 1.00 0.00 O ATOM 1265 CB LYS A 88 4.662 0.678 -12.323 1.00 0.00 C ATOM 1266 CG LYS A 88 5.790 0.086 -13.171 1.00 0.00 C ATOM 1267 CD LYS A 88 6.471 -1.045 -12.399 1.00 0.00 C ATOM 1268 CE LYS A 88 7.386 -0.453 -11.326 1.00 0.00 C ATOM 1269 NZ LYS A 88 8.782 -0.924 -11.550 1.00 0.00 N ATOM 0 H LYS A 88 4.223 3.084 -11.727 1.00 0.00 H new ATOM 0 HA LYS A 88 4.141 1.551 -14.223 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.078 1.240 -11.487 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.054 -0.121 -11.899 1.00 0.00 H new ATOM 0 HG2 LYS A 88 5.391 -0.291 -14.113 1.00 0.00 H new ATOM 0 HG3 LYS A 88 6.517 0.860 -13.419 1.00 0.00 H new ATOM 0 HD2 LYS A 88 5.721 -1.688 -11.938 1.00 0.00 H new ATOM 0 HD3 LYS A 88 7.049 -1.668 -13.081 1.00 0.00 H new ATOM 0 HE2 LYS A 88 7.348 0.636 -11.361 1.00 0.00 H new ATOM 0 HE3 LYS A 88 7.044 -0.753 -10.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 9.405 -0.522 -10.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 8.811 -1.962 -11.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 9.105 -0.617 -12.490 1.00 0.00 H new ATOM 1283 N ILE A 89 1.707 0.963 -14.250 1.00 0.00 N ATOM 1284 CA ILE A 89 0.285 0.519 -14.250 1.00 0.00 C ATOM 1285 C ILE A 89 0.223 -1.009 -14.205 1.00 0.00 C ATOM 1286 O ILE A 89 1.113 -1.691 -14.672 1.00 0.00 O ATOM 1287 CB ILE A 89 -0.405 1.021 -15.519 1.00 0.00 C ATOM 1288 CG1 ILE A 89 -0.010 2.478 -15.771 1.00 0.00 C ATOM 1289 CG2 ILE A 89 -1.921 0.926 -15.345 1.00 0.00 C ATOM 1290 CD1 ILE A 89 -0.420 2.881 -17.188 1.00 0.00 C ATOM 0 H ILE A 89 2.115 1.115 -15.173 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.221 0.926 -13.375 1.00 0.00 H new ATOM 0 HB ILE A 89 -0.098 0.409 -16.367 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -0.494 3.128 -15.042 1.00 0.00 H new ATOM 0 HG13 ILE A 89 1.065 2.601 -15.643 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.414 1.284 -16.249 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -2.202 -0.112 -15.164 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -2.229 1.538 -14.497 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -0.139 3.919 -17.367 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.085 2.238 -17.909 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -1.499 2.773 -17.299 1.00 0.00 H new ATOM 1302 N TYR A 90 -0.824 -1.551 -13.645 1.00 0.00 N ATOM 1303 CA TYR A 90 -0.945 -3.034 -13.570 1.00 0.00 C ATOM 1304 C TYR A 90 -2.362 -3.451 -13.973 1.00 0.00 C ATOM 1305 O TYR A 90 -3.337 -2.875 -13.531 1.00 0.00 O ATOM 1306 CB TYR A 90 -0.667 -3.495 -12.138 1.00 0.00 C ATOM 1307 CG TYR A 90 0.701 -4.131 -12.066 1.00 0.00 C ATOM 1308 CD1 TYR A 90 1.851 -3.335 -12.169 1.00 0.00 C ATOM 1309 CD2 TYR A 90 0.823 -5.517 -11.896 1.00 0.00 C ATOM 1310 CE1 TYR A 90 3.120 -3.925 -12.102 1.00 0.00 C ATOM 1311 CE2 TYR A 90 2.092 -6.106 -11.829 1.00 0.00 C ATOM 1312 CZ TYR A 90 3.241 -5.310 -11.932 1.00 0.00 C ATOM 1313 OH TYR A 90 4.490 -5.891 -11.867 1.00 0.00 O ATOM 0 H TYR A 90 -1.600 -1.031 -13.236 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.224 -3.493 -14.247 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -0.721 -2.647 -11.455 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.428 -4.208 -11.821 1.00 0.00 H new ATOM 0 HD1 TYR A 90 1.758 -2.267 -12.300 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -0.062 -6.131 -11.817 1.00 0.00 H new ATOM 0 HE1 TYR A 90 4.005 -3.312 -12.181 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.185 -7.174 -11.698 1.00 0.00 H new ATOM 0 HH TYR A 90 5.090 -5.448 -12.502 1.00 0.00 H new ATOM 1323 N ARG A 91 -2.485 -4.446 -14.807 1.00 0.00 N ATOM 1324 CA ARG A 91 -3.842 -4.896 -15.235 1.00 0.00 C ATOM 1325 C ARG A 91 -4.348 -5.972 -14.272 1.00 0.00 C ATOM 1326 O ARG A 91 -3.642 -6.905 -13.943 1.00 0.00 O ATOM 1327 CB ARG A 91 -3.768 -5.473 -16.650 1.00 0.00 C ATOM 1328 CG ARG A 91 -3.943 -4.348 -17.672 1.00 0.00 C ATOM 1329 CD ARG A 91 -5.129 -4.669 -18.584 1.00 0.00 C ATOM 1330 NE ARG A 91 -4.954 -6.028 -19.170 1.00 0.00 N ATOM 1331 CZ ARG A 91 -5.546 -6.338 -20.290 1.00 0.00 C ATOM 1332 NH1 ARG A 91 -6.667 -5.753 -20.619 1.00 0.00 N ATOM 1333 NH2 ARG A 91 -5.019 -7.230 -21.085 1.00 0.00 N ATOM 0 H ARG A 91 -1.707 -4.967 -15.211 1.00 0.00 H new ATOM 0 HA ARG A 91 -4.525 -4.047 -15.225 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -2.810 -5.970 -16.801 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -4.543 -6.227 -16.787 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -4.110 -3.400 -17.161 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -3.035 -4.235 -18.264 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -6.059 -4.623 -18.018 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -5.202 -3.926 -19.378 1.00 0.00 H new ATOM 0 HE ARG A 91 -4.371 -6.716 -18.695 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -7.078 -5.054 -20.000 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -7.131 -5.995 -21.495 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -4.143 -7.686 -20.830 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -5.484 -7.471 -21.960 1.00 0.00 H new ATOM 1347 N ALA A 92 -5.566 -5.852 -13.818 1.00 0.00 N ATOM 1348 CA ALA A 92 -6.113 -6.871 -12.877 1.00 0.00 C ATOM 1349 C ALA A 92 -6.674 -8.054 -13.670 1.00 0.00 C ATOM 1350 O ALA A 92 -7.862 -8.306 -13.669 1.00 0.00 O ATOM 1351 CB ALA A 92 -7.230 -6.244 -12.041 1.00 0.00 C ATOM 0 H ALA A 92 -6.205 -5.094 -14.057 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.317 -7.221 -12.220 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.631 -6.988 -11.353 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.832 -5.403 -11.474 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -8.025 -5.894 -12.700 1.00 0.00 H new ATOM 1357 N THR A 93 -5.829 -8.783 -14.349 1.00 0.00 N ATOM 1358 CA THR A 93 -6.319 -9.948 -15.139 1.00 0.00 C ATOM 1359 C THR A 93 -6.677 -11.093 -14.190 1.00 0.00 C ATOM 1360 O THR A 93 -7.525 -11.913 -14.482 1.00 0.00 O ATOM 1361 CB THR A 93 -5.225 -10.405 -16.106 1.00 0.00 C ATOM 1362 OG1 THR A 93 -5.710 -11.486 -16.890 1.00 0.00 O ATOM 1363 CG2 THR A 93 -3.993 -10.857 -15.319 1.00 0.00 C ATOM 0 H THR A 93 -4.823 -8.622 -14.390 1.00 0.00 H new ATOM 0 HA THR A 93 -7.204 -9.658 -15.705 1.00 0.00 H new ATOM 0 HB THR A 93 -4.950 -9.575 -16.757 1.00 0.00 H new ATOM 0 HG1 THR A 93 -5.011 -11.779 -17.511 1.00 0.00 H new ATOM 0 HG21 THR A 93 -3.217 -11.181 -16.012 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.620 -10.027 -14.719 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.263 -11.685 -14.664 1.00 0.00 H new ATOM 1371 N GLY A 94 -6.035 -11.155 -13.057 1.00 0.00 N ATOM 1372 CA GLY A 94 -6.335 -12.247 -12.088 1.00 0.00 C ATOM 1373 C GLY A 94 -7.810 -12.189 -11.690 1.00 0.00 C ATOM 1374 O GLY A 94 -8.683 -12.546 -12.456 1.00 0.00 O ATOM 0 H GLY A 94 -5.315 -10.497 -12.759 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -6.106 -13.215 -12.533 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -5.705 -12.146 -11.204 1.00 0.00 H new ATOM 1378 N THR A 95 -8.097 -11.744 -10.498 1.00 0.00 N ATOM 1379 CA THR A 95 -9.516 -11.665 -10.054 1.00 0.00 C ATOM 1380 C THR A 95 -9.575 -11.154 -8.614 1.00 0.00 C ATOM 1381 O THR A 95 -10.382 -10.311 -8.276 1.00 0.00 O ATOM 1382 CB THR A 95 -10.151 -13.056 -10.128 1.00 0.00 C ATOM 1383 OG1 THR A 95 -11.460 -13.006 -9.578 1.00 0.00 O ATOM 1384 CG2 THR A 95 -9.301 -14.050 -9.337 1.00 0.00 C ATOM 0 H THR A 95 -7.410 -11.432 -9.812 1.00 0.00 H new ATOM 0 HA THR A 95 -10.061 -10.980 -10.704 1.00 0.00 H new ATOM 0 HB THR A 95 -10.205 -13.376 -11.168 1.00 0.00 H new ATOM 0 HG1 THR A 95 -11.869 -13.895 -9.626 1.00 0.00 H new ATOM 0 HG21 THR A 95 -9.754 -15.040 -9.391 1.00 0.00 H new ATOM 0 HG22 THR A 95 -8.297 -14.087 -9.760 1.00 0.00 H new ATOM 0 HG23 THR A 95 -9.245 -13.733 -8.296 1.00 0.00 H new ATOM 1392 N SER A 96 -8.725 -11.659 -7.760 1.00 0.00 N ATOM 1393 CA SER A 96 -8.734 -11.202 -6.343 1.00 0.00 C ATOM 1394 C SER A 96 -7.687 -10.101 -6.156 1.00 0.00 C ATOM 1395 O SER A 96 -6.526 -10.275 -6.469 1.00 0.00 O ATOM 1396 CB SER A 96 -8.404 -12.380 -5.425 1.00 0.00 C ATOM 1397 OG SER A 96 -9.188 -13.503 -5.806 1.00 0.00 O ATOM 0 H SER A 96 -8.026 -12.367 -7.984 1.00 0.00 H new ATOM 0 HA SER A 96 -9.721 -10.812 -6.093 1.00 0.00 H new ATOM 0 HB2 SER A 96 -7.343 -12.622 -5.491 1.00 0.00 H new ATOM 0 HB3 SER A 96 -8.606 -12.116 -4.387 1.00 0.00 H new ATOM 0 HG SER A 96 -8.643 -14.316 -5.754 1.00 0.00 H new ATOM 1403 N VAL A 97 -8.088 -8.969 -5.647 1.00 0.00 N ATOM 1404 CA VAL A 97 -7.114 -7.860 -5.440 1.00 0.00 C ATOM 1405 C VAL A 97 -6.057 -8.295 -4.422 1.00 0.00 C ATOM 1406 O VAL A 97 -4.900 -7.936 -4.521 1.00 0.00 O ATOM 1407 CB VAL A 97 -7.852 -6.624 -4.918 1.00 0.00 C ATOM 1408 CG1 VAL A 97 -8.634 -5.977 -6.063 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -8.825 -7.039 -3.812 1.00 0.00 C ATOM 0 H VAL A 97 -9.047 -8.764 -5.366 1.00 0.00 H new ATOM 0 HA VAL A 97 -6.629 -7.619 -6.386 1.00 0.00 H new ATOM 0 HB VAL A 97 -7.129 -5.912 -4.520 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -9.160 -5.097 -5.693 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -7.944 -5.682 -6.853 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -9.356 -6.691 -6.460 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -9.350 -6.159 -3.440 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -9.547 -7.751 -4.211 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.271 -7.503 -2.996 1.00 0.00 H new ATOM 1419 N GLU A 98 -6.443 -9.071 -3.446 1.00 0.00 N ATOM 1420 CA GLU A 98 -5.460 -9.533 -2.427 1.00 0.00 C ATOM 1421 C GLU A 98 -4.413 -10.420 -3.101 1.00 0.00 C ATOM 1422 O GLU A 98 -3.252 -10.409 -2.744 1.00 0.00 O ATOM 1423 CB GLU A 98 -6.186 -10.331 -1.343 1.00 0.00 C ATOM 1424 CG GLU A 98 -5.317 -10.390 -0.084 1.00 0.00 C ATOM 1425 CD GLU A 98 -6.182 -10.115 1.147 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -7.212 -9.480 0.995 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -5.798 -10.545 2.223 1.00 0.00 O ATOM 0 H GLU A 98 -7.397 -9.405 -3.311 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.970 -8.671 -1.974 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -7.145 -9.866 -1.114 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -6.398 -11.339 -1.699 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -4.847 -11.370 0.000 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.514 -9.656 -0.149 1.00 0.00 H new ATOM 1434 N GLU A 99 -4.816 -11.188 -4.077 1.00 0.00 N ATOM 1435 CA GLU A 99 -3.846 -12.075 -4.776 1.00 0.00 C ATOM 1436 C GLU A 99 -2.941 -11.230 -5.675 1.00 0.00 C ATOM 1437 O GLU A 99 -1.765 -11.498 -5.818 1.00 0.00 O ATOM 1438 CB GLU A 99 -4.610 -13.091 -5.629 1.00 0.00 C ATOM 1439 CG GLU A 99 -3.640 -13.798 -6.577 1.00 0.00 C ATOM 1440 CD GLU A 99 -4.308 -15.046 -7.158 1.00 0.00 C ATOM 1441 OE1 GLU A 99 -4.955 -15.753 -6.403 1.00 0.00 O ATOM 1442 OE2 GLU A 99 -4.163 -15.272 -8.347 1.00 0.00 O ATOM 0 H GLU A 99 -5.775 -11.239 -4.420 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.237 -12.602 -4.041 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -5.104 -13.821 -4.988 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -5.390 -12.588 -6.200 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -3.345 -13.124 -7.381 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -2.731 -14.075 -6.043 1.00 0.00 H new ATOM 1449 N ASN A 100 -3.480 -10.208 -6.283 1.00 0.00 N ATOM 1450 CA ASN A 100 -2.651 -9.346 -7.170 1.00 0.00 C ATOM 1451 C ASN A 100 -1.627 -8.583 -6.326 1.00 0.00 C ATOM 1452 O ASN A 100 -0.562 -8.230 -6.793 1.00 0.00 O ATOM 1453 CB ASN A 100 -3.554 -8.350 -7.902 1.00 0.00 C ATOM 1454 CG ASN A 100 -4.396 -9.092 -8.941 1.00 0.00 C ATOM 1455 OD1 ASN A 100 -4.073 -10.200 -9.325 1.00 0.00 O ATOM 1456 ND2 ASN A 100 -5.472 -8.526 -9.417 1.00 0.00 N ATOM 0 H ASN A 100 -4.459 -9.934 -6.203 1.00 0.00 H new ATOM 0 HA ASN A 100 -2.131 -9.967 -7.899 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -4.203 -7.840 -7.190 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -2.950 -7.584 -8.388 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -6.040 -9.013 -10.110 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -5.744 -7.597 -9.096 1.00 0.00 H new ATOM 1463 N LEU A 101 -1.942 -8.329 -5.086 1.00 0.00 N ATOM 1464 CA LEU A 101 -0.989 -7.588 -4.210 1.00 0.00 C ATOM 1465 C LEU A 101 0.339 -8.346 -4.136 1.00 0.00 C ATOM 1466 O LEU A 101 1.371 -7.848 -4.539 1.00 0.00 O ATOM 1467 CB LEU A 101 -1.585 -7.463 -2.807 1.00 0.00 C ATOM 1468 CG LEU A 101 -0.533 -6.896 -1.853 1.00 0.00 C ATOM 1469 CD1 LEU A 101 0.026 -5.591 -2.424 1.00 0.00 C ATOM 1470 CD2 LEU A 101 -1.178 -6.619 -0.493 1.00 0.00 C ATOM 0 H LEU A 101 -2.818 -8.602 -4.641 1.00 0.00 H new ATOM 0 HA LEU A 101 -0.813 -6.595 -4.623 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -2.459 -6.813 -2.829 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -1.922 -8.438 -2.455 1.00 0.00 H new ATOM 0 HG LEU A 101 0.276 -7.617 -1.735 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.776 -5.188 -1.743 1.00 0.00 H new ATOM 0 HD12 LEU A 101 0.484 -5.785 -3.394 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -0.783 -4.870 -2.542 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -0.430 -6.215 0.189 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -1.986 -5.898 -0.614 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -1.578 -7.547 -0.084 1.00 0.00 H new ATOM 1482 N LYS A 102 0.324 -9.546 -3.621 1.00 0.00 N ATOM 1483 CA LYS A 102 1.591 -10.327 -3.523 1.00 0.00 C ATOM 1484 C LYS A 102 2.066 -10.705 -4.927 1.00 0.00 C ATOM 1485 O LYS A 102 3.237 -10.929 -5.157 1.00 0.00 O ATOM 1486 CB LYS A 102 1.348 -11.599 -2.706 1.00 0.00 C ATOM 1487 CG LYS A 102 2.293 -11.620 -1.501 1.00 0.00 C ATOM 1488 CD LYS A 102 2.479 -13.060 -1.021 1.00 0.00 C ATOM 1489 CE LYS A 102 3.759 -13.158 -0.187 1.00 0.00 C ATOM 1490 NZ LYS A 102 4.945 -12.988 -1.073 1.00 0.00 N ATOM 0 H LYS A 102 -0.507 -10.018 -3.265 1.00 0.00 H new ATOM 0 HA LYS A 102 2.353 -9.722 -3.032 1.00 0.00 H new ATOM 0 HB2 LYS A 102 0.312 -11.636 -2.370 1.00 0.00 H new ATOM 0 HB3 LYS A 102 1.513 -12.480 -3.327 1.00 0.00 H new ATOM 0 HG2 LYS A 102 3.256 -11.190 -1.774 1.00 0.00 H new ATOM 0 HG3 LYS A 102 1.887 -11.007 -0.696 1.00 0.00 H new ATOM 0 HD2 LYS A 102 1.620 -13.370 -0.426 1.00 0.00 H new ATOM 0 HD3 LYS A 102 2.536 -13.735 -1.875 1.00 0.00 H new ATOM 0 HE2 LYS A 102 3.759 -12.393 0.589 1.00 0.00 H new ATOM 0 HE3 LYS A 102 3.804 -14.123 0.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 5.761 -13.483 -0.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 4.738 -13.386 -2.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 5.165 -11.976 -1.168 1.00 0.00 H new ATOM 1504 N LEU A 103 1.165 -10.777 -5.867 1.00 0.00 N ATOM 1505 CA LEU A 103 1.567 -11.139 -7.255 1.00 0.00 C ATOM 1506 C LEU A 103 2.472 -10.045 -7.826 1.00 0.00 C ATOM 1507 O LEU A 103 3.325 -10.301 -8.652 1.00 0.00 O ATOM 1508 CB LEU A 103 0.318 -11.276 -8.128 1.00 0.00 C ATOM 1509 CG LEU A 103 0.068 -12.753 -8.435 1.00 0.00 C ATOM 1510 CD1 LEU A 103 1.317 -13.362 -9.074 1.00 0.00 C ATOM 1511 CD2 LEU A 103 -0.252 -13.497 -7.136 1.00 0.00 C ATOM 0 H LEU A 103 0.169 -10.601 -5.734 1.00 0.00 H new ATOM 0 HA LEU A 103 2.107 -12.086 -7.242 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.545 -10.849 -7.616 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.447 -10.718 -9.055 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.772 -12.842 -9.123 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.138 -14.415 -9.292 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.547 -12.834 -9.999 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.158 -13.272 -8.386 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.430 -14.550 -7.354 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.589 -13.406 -6.448 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.143 -13.065 -6.679 1.00 0.00 H new ATOM 1523 N PHE A 104 2.294 -8.825 -7.394 1.00 0.00 N ATOM 1524 CA PHE A 104 3.147 -7.720 -7.914 1.00 0.00 C ATOM 1525 C PHE A 104 4.602 -7.963 -7.507 1.00 0.00 C ATOM 1526 O PHE A 104 5.513 -7.798 -8.294 1.00 0.00 O ATOM 1527 CB PHE A 104 2.671 -6.388 -7.333 1.00 0.00 C ATOM 1528 CG PHE A 104 3.653 -5.303 -7.701 1.00 0.00 C ATOM 1529 CD1 PHE A 104 4.874 -5.202 -7.019 1.00 0.00 C ATOM 1530 CD2 PHE A 104 3.348 -4.398 -8.726 1.00 0.00 C ATOM 1531 CE1 PHE A 104 5.788 -4.199 -7.362 1.00 0.00 C ATOM 1532 CE2 PHE A 104 4.262 -3.393 -9.070 1.00 0.00 C ATOM 1533 CZ PHE A 104 5.483 -3.293 -8.387 1.00 0.00 C ATOM 0 H PHE A 104 1.596 -8.547 -6.704 1.00 0.00 H new ATOM 0 HA PHE A 104 3.074 -7.688 -9.001 1.00 0.00 H new ATOM 0 HB2 PHE A 104 1.681 -6.144 -7.718 1.00 0.00 H new ATOM 0 HB3 PHE A 104 2.583 -6.462 -6.249 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.109 -5.899 -6.228 1.00 0.00 H new ATOM 0 HD2 PHE A 104 2.408 -4.475 -9.252 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.729 -4.123 -6.837 1.00 0.00 H new ATOM 0 HE2 PHE A 104 4.026 -2.696 -9.861 1.00 0.00 H new ATOM 0 HZ PHE A 104 6.188 -2.518 -8.651 1.00 0.00 H new ATOM 1543 N THR A 105 4.829 -8.350 -6.281 1.00 0.00 N ATOM 1544 CA THR A 105 6.225 -8.600 -5.824 1.00 0.00 C ATOM 1545 C THR A 105 6.882 -9.654 -6.720 1.00 0.00 C ATOM 1546 O THR A 105 8.076 -9.635 -6.940 1.00 0.00 O ATOM 1547 CB THR A 105 6.205 -9.104 -4.379 1.00 0.00 C ATOM 1548 OG1 THR A 105 5.574 -8.136 -3.552 1.00 0.00 O ATOM 1549 CG2 THR A 105 7.637 -9.337 -3.897 1.00 0.00 C ATOM 0 H THR A 105 4.108 -8.504 -5.576 1.00 0.00 H new ATOM 0 HA THR A 105 6.794 -7.672 -5.881 1.00 0.00 H new ATOM 0 HB THR A 105 5.652 -10.042 -4.328 1.00 0.00 H new ATOM 0 HG1 THR A 105 6.099 -7.308 -3.558 1.00 0.00 H new ATOM 0 HG21 THR A 105 7.621 -9.696 -2.868 1.00 0.00 H new ATOM 0 HG22 THR A 105 8.119 -10.080 -4.533 1.00 0.00 H new ATOM 0 HG23 THR A 105 8.194 -8.401 -3.946 1.00 0.00 H new ATOM 1557 N GLU A 106 6.113 -10.573 -7.237 1.00 0.00 N ATOM 1558 CA GLU A 106 6.697 -11.628 -8.114 1.00 0.00 C ATOM 1559 C GLU A 106 6.729 -11.132 -9.561 1.00 0.00 C ATOM 1560 O GLU A 106 7.501 -11.605 -10.373 1.00 0.00 O ATOM 1561 CB GLU A 106 5.842 -12.893 -8.029 1.00 0.00 C ATOM 1562 CG GLU A 106 5.576 -13.232 -6.560 1.00 0.00 C ATOM 1563 CD GLU A 106 6.416 -14.446 -6.156 1.00 0.00 C ATOM 1564 OE1 GLU A 106 7.398 -14.713 -6.829 1.00 0.00 O ATOM 1565 OE2 GLU A 106 6.061 -15.088 -5.182 1.00 0.00 O ATOM 0 H GLU A 106 5.106 -10.639 -7.090 1.00 0.00 H new ATOM 0 HA GLU A 106 7.712 -11.851 -7.784 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.899 -12.743 -8.555 1.00 0.00 H new ATOM 0 HB3 GLU A 106 6.352 -13.723 -8.518 1.00 0.00 H new ATOM 0 HG2 GLU A 106 5.823 -12.379 -5.928 1.00 0.00 H new ATOM 0 HG3 GLU A 106 4.517 -13.443 -6.410 1.00 0.00 H new ATOM 1572 N GLY A 107 5.898 -10.183 -9.893 1.00 0.00 N ATOM 1573 CA GLY A 107 5.884 -9.661 -11.288 1.00 0.00 C ATOM 1574 C GLY A 107 5.155 -10.651 -12.201 1.00 0.00 C ATOM 1575 O GLY A 107 5.378 -10.689 -13.395 1.00 0.00 O ATOM 0 H GLY A 107 5.229 -9.747 -9.259 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.389 -8.690 -11.319 1.00 0.00 H new ATOM 0 HA3 GLY A 107 6.904 -9.510 -11.640 1.00 0.00 H new ATOM 1579 N ASN A 108 4.286 -11.454 -11.650 1.00 0.00 N ATOM 1580 CA ASN A 108 3.546 -12.438 -12.490 1.00 0.00 C ATOM 1581 C ASN A 108 2.385 -11.733 -13.193 1.00 0.00 C ATOM 1582 O ASN A 108 2.011 -12.078 -14.296 1.00 0.00 O ATOM 1583 CB ASN A 108 3.001 -13.561 -11.603 1.00 0.00 C ATOM 1584 CG ASN A 108 3.390 -14.915 -12.200 1.00 0.00 C ATOM 1585 OD1 ASN A 108 4.473 -15.071 -12.728 1.00 0.00 O ATOM 1586 ND2 ASN A 108 2.545 -15.908 -12.139 1.00 0.00 N ATOM 0 H ASN A 108 4.057 -11.471 -10.656 1.00 0.00 H new ATOM 0 HA ASN A 108 4.220 -12.861 -13.235 1.00 0.00 H new ATOM 0 HB2 ASN A 108 3.401 -13.468 -10.593 1.00 0.00 H new ATOM 0 HB3 ASN A 108 1.917 -13.484 -11.525 1.00 0.00 H new ATOM 0 HD21 ASN A 108 2.794 -16.815 -12.535 1.00 0.00 H new ATOM 0 HD22 ASN A 108 1.636 -15.777 -11.696 1.00 0.00 H new ATOM 1593 N LEU A 109 1.811 -10.746 -12.561 1.00 0.00 N ATOM 1594 CA LEU A 109 0.675 -10.017 -13.191 1.00 0.00 C ATOM 1595 C LEU A 109 1.175 -9.256 -14.421 1.00 0.00 C ATOM 1596 O LEU A 109 2.251 -9.512 -14.925 1.00 0.00 O ATOM 1597 CB LEU A 109 0.090 -9.023 -12.185 1.00 0.00 C ATOM 1598 CG LEU A 109 -1.435 -9.136 -12.181 1.00 0.00 C ATOM 1599 CD1 LEU A 109 -1.840 -10.568 -11.830 1.00 0.00 C ATOM 1600 CD2 LEU A 109 -2.013 -8.174 -11.140 1.00 0.00 C ATOM 0 H LEU A 109 2.080 -10.413 -11.635 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.092 -10.730 -13.491 1.00 0.00 H new ATOM 0 HB2 LEU A 109 0.482 -9.225 -11.188 1.00 0.00 H new ATOM 0 HB3 LEU A 109 0.389 -8.008 -12.446 1.00 0.00 H new ATOM 0 HG LEU A 109 -1.821 -8.881 -13.168 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -2.927 -10.648 -11.827 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -1.427 -11.254 -12.569 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -1.455 -10.823 -10.843 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -3.100 -8.253 -11.136 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -1.627 -8.430 -10.154 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -1.724 -7.153 -11.389 1.00 0.00 H new ATOM 1612 N GLU A 110 0.406 -8.320 -14.903 1.00 0.00 N ATOM 1613 CA GLU A 110 0.839 -7.541 -16.097 1.00 0.00 C ATOM 1614 C GLU A 110 1.151 -6.104 -15.676 1.00 0.00 C ATOM 1615 O GLU A 110 0.433 -5.505 -14.899 1.00 0.00 O ATOM 1616 CB GLU A 110 -0.282 -7.537 -17.138 1.00 0.00 C ATOM 1617 CG GLU A 110 0.134 -6.674 -18.331 1.00 0.00 C ATOM 1618 CD GLU A 110 0.130 -7.525 -19.602 1.00 0.00 C ATOM 1619 OE1 GLU A 110 -0.793 -8.307 -19.765 1.00 0.00 O ATOM 1620 OE2 GLU A 110 1.051 -7.382 -20.389 1.00 0.00 O ATOM 0 H GLU A 110 -0.504 -8.061 -14.522 1.00 0.00 H new ATOM 0 HA GLU A 110 1.730 -7.997 -16.528 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -0.491 -8.555 -17.467 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -1.201 -7.149 -16.698 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -0.551 -5.833 -18.441 1.00 0.00 H new ATOM 0 HG3 GLU A 110 1.127 -6.257 -18.163 1.00 0.00 H new ATOM 1627 N GLU A 111 2.218 -5.546 -16.179 1.00 0.00 N ATOM 1628 CA GLU A 111 2.575 -4.150 -15.803 1.00 0.00 C ATOM 1629 C GLU A 111 2.788 -3.314 -17.067 1.00 0.00 C ATOM 1630 O GLU A 111 2.934 -3.839 -18.154 1.00 0.00 O ATOM 1631 CB GLU A 111 3.863 -4.160 -14.976 1.00 0.00 C ATOM 1632 CG GLU A 111 5.052 -4.481 -15.885 1.00 0.00 C ATOM 1633 CD GLU A 111 6.304 -4.700 -15.034 1.00 0.00 C ATOM 1634 OE1 GLU A 111 6.233 -4.462 -13.839 1.00 0.00 O ATOM 1635 OE2 GLU A 111 7.312 -5.100 -15.592 1.00 0.00 O ATOM 0 H GLU A 111 2.857 -5.997 -16.834 1.00 0.00 H new ATOM 0 HA GLU A 111 1.766 -3.716 -15.215 1.00 0.00 H new ATOM 0 HB2 GLU A 111 4.008 -3.191 -14.498 1.00 0.00 H new ATOM 0 HB3 GLU A 111 3.790 -4.901 -14.179 1.00 0.00 H new ATOM 0 HG2 GLU A 111 4.841 -5.372 -16.476 1.00 0.00 H new ATOM 0 HG3 GLU A 111 5.216 -3.664 -16.588 1.00 0.00 H new ATOM 1642 N ILE A 112 2.812 -2.016 -16.933 1.00 0.00 N ATOM 1643 CA ILE A 112 3.021 -1.144 -18.122 1.00 0.00 C ATOM 1644 C ILE A 112 3.695 0.155 -17.679 1.00 0.00 C ATOM 1645 O ILE A 112 3.073 1.022 -17.098 1.00 0.00 O ATOM 1646 CB ILE A 112 1.671 -0.826 -18.768 1.00 0.00 C ATOM 1647 CG1 ILE A 112 0.991 -2.132 -19.192 1.00 0.00 C ATOM 1648 CG2 ILE A 112 1.893 0.059 -19.998 1.00 0.00 C ATOM 1649 CD1 ILE A 112 -0.177 -1.825 -20.131 1.00 0.00 C ATOM 0 H ILE A 112 2.695 -1.521 -16.049 1.00 0.00 H new ATOM 0 HA ILE A 112 3.654 -1.657 -18.846 1.00 0.00 H new ATOM 0 HB ILE A 112 1.037 -0.302 -18.053 1.00 0.00 H new ATOM 0 HG12 ILE A 112 1.710 -2.782 -19.691 1.00 0.00 H new ATOM 0 HG13 ILE A 112 0.632 -2.668 -18.313 1.00 0.00 H new ATOM 0 HG21 ILE A 112 0.933 0.287 -20.460 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.380 0.986 -19.696 1.00 0.00 H new ATOM 0 HG23 ILE A 112 2.525 -0.466 -20.714 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -0.658 -2.756 -20.430 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -0.900 -1.192 -19.617 1.00 0.00 H new ATOM 0 HD13 ILE A 112 0.194 -1.308 -21.016 1.00 0.00 H new ATOM 1661 N ARG A 113 4.966 0.293 -17.939 1.00 0.00 N ATOM 1662 CA ARG A 113 5.679 1.531 -17.522 1.00 0.00 C ATOM 1663 C ARG A 113 6.310 2.203 -18.743 1.00 0.00 C ATOM 1664 O ARG A 113 7.034 3.171 -18.623 1.00 0.00 O ATOM 1665 CB ARG A 113 6.779 1.167 -16.524 1.00 0.00 C ATOM 1666 CG ARG A 113 7.684 0.097 -17.137 1.00 0.00 C ATOM 1667 CD ARG A 113 8.847 -0.198 -16.188 1.00 0.00 C ATOM 1668 NE ARG A 113 10.124 0.237 -16.821 1.00 0.00 N ATOM 1669 CZ ARG A 113 11.127 0.617 -16.077 1.00 0.00 C ATOM 1670 NH1 ARG A 113 11.491 -0.105 -15.052 1.00 0.00 N ATOM 1671 NH2 ARG A 113 11.764 1.722 -16.356 1.00 0.00 N ATOM 0 H ARG A 113 5.540 -0.398 -18.422 1.00 0.00 H new ATOM 0 HA ARG A 113 4.969 2.217 -17.059 1.00 0.00 H new ATOM 0 HB2 ARG A 113 7.363 2.052 -16.270 1.00 0.00 H new ATOM 0 HB3 ARG A 113 6.338 0.799 -15.597 1.00 0.00 H new ATOM 0 HG2 ARG A 113 7.114 -0.813 -17.323 1.00 0.00 H new ATOM 0 HG3 ARG A 113 8.065 0.437 -18.100 1.00 0.00 H new ATOM 0 HD2 ARG A 113 8.701 0.324 -15.242 1.00 0.00 H new ATOM 0 HD3 ARG A 113 8.885 -1.264 -15.962 1.00 0.00 H new ATOM 0 HE ARG A 113 10.214 0.238 -17.837 1.00 0.00 H new ATOM 0 HH11 ARG A 113 10.992 -0.967 -14.832 1.00 0.00 H new ATOM 0 HH12 ARG A 113 12.275 0.193 -14.471 1.00 0.00 H new ATOM 0 HH21 ARG A 113 11.478 2.288 -17.155 1.00 0.00 H new ATOM 0 HH22 ARG A 113 12.548 2.019 -15.775 1.00 0.00 H new