USER MOD reduce.3.24.130724 H: found=0, std=0, add=1048, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1038 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 63 SER OG : rot -46:sc= 1.24 USER MOD Set 1.2: A 66 ASN : amide:sc= 1.36 K(o=2.6,f=-3.8!) USER MOD Set 2.1: A 56 THR OG1 : rot -120:sc= -2.02 USER MOD Set 2.2: A 59 LYS NZ :NH3+ -139:sc= 0 (180deg=-0.0625) USER MOD Set 3.1: A 1 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A -1 HIS : no HD1:sc= 0 X(o=0,f=-0.072) USER MOD Single : A 0 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -2 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -5 HIS : no HD1:sc= -0.025 X(o=-0.025,f=-0.056) USER MOD Single : A -5 HIS N :NH3+ -126:sc= 0.0257 (180deg=-0.013) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 180:sc=-0.00706 USER MOD Single : A 18 LYS NZ :NH3+ -137:sc= 0 (180deg=-0.0589) USER MOD Single : A 22 GLN : amide:sc= -0.0764 X(o=-0.076,f=-0.09) USER MOD Single : A 23 HIS : no HD1:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 24 MET CE :methyl 126:sc= -0.165 (180deg=-1.01) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 5:sc= 0.576! USER MOD Single : A 58 ASN : amide:sc=-0.00693 K(o=-0.0069,f=-1.3) USER MOD Single : A 60 GLN : amide:sc= -0.804 K(o=-0.8,f=-3.2!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot -74:sc= 0.592 USER MOD Single : A 77 HIS : no HD1:sc= -1.99 K(o=-2,f=-4.2!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -0.535 K(o=-0.54,f=-1.8) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 168:sc= 0.0365 USER MOD Single : A 101 ASN : amide:sc= -0.445 K(o=-0.45,f=-5.6!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 HIS : no HD1:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 75:sc= 0.358 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 91:sc= -0.428 USER MOD Single : A 136 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 140 LYS NZ :NH3+ 151:sc= -0.797 (180deg=-2.12!) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A -5 42.415 1.883 13.933 1.00 0.00 N ATOM 2 CA HIS A -5 42.227 1.662 12.471 1.00 0.00 C ATOM 3 C HIS A -5 43.193 2.551 11.696 1.00 0.00 C ATOM 4 O HIS A -5 43.601 3.608 12.177 1.00 0.00 O ATOM 5 CB HIS A -5 40.784 2.002 12.089 1.00 0.00 C ATOM 6 CG HIS A -5 39.766 1.110 12.745 1.00 0.00 C ATOM 7 ND1 HIS A -5 39.169 1.434 13.953 1.00 0.00 N ATOM 8 CD2 HIS A -5 39.229 -0.099 12.374 1.00 0.00 C ATOM 9 CE1 HIS A -5 38.316 0.442 14.264 1.00 0.00 C ATOM 10 NE2 HIS A -5 38.312 -0.519 13.335 1.00 0.00 N ATOM 0 H1 HIS A -5 42.591 0.972 14.402 1.00 0.00 H new ATOM 0 H2 HIS A -5 43.227 2.514 14.087 1.00 0.00 H new ATOM 0 H3 HIS A -5 41.558 2.318 14.331 1.00 0.00 H new ATOM 0 HA HIS A -5 42.427 0.619 12.227 1.00 0.00 H new ATOM 0 HB2 HIS A -5 40.578 3.037 12.361 1.00 0.00 H new ATOM 0 HB3 HIS A -5 40.676 1.930 11.007 1.00 0.00 H new ATOM 0 HD2 HIS A -5 39.480 -0.641 11.474 1.00 0.00 H new ATOM 0 HE1 HIS A -5 37.708 0.424 15.156 1.00 0.00 H new ATOM 0 HE2 HIS A -5 37.757 -1.375 13.331 1.00 0.00 H new ATOM 20 N HIS A -4 43.556 2.115 10.493 1.00 0.00 N ATOM 21 CA HIS A -4 44.479 2.873 9.651 1.00 0.00 C ATOM 22 C HIS A -4 43.799 3.282 8.348 1.00 0.00 C ATOM 23 O HIS A -4 43.051 2.504 7.755 1.00 0.00 O ATOM 24 CB HIS A -4 45.712 2.022 9.337 1.00 0.00 C ATOM 25 CG HIS A -4 46.529 1.681 10.553 1.00 0.00 C ATOM 26 ND1 HIS A -4 46.321 0.521 11.281 1.00 0.00 N ATOM 27 CD2 HIS A -4 47.558 2.338 11.181 1.00 0.00 C ATOM 28 CE1 HIS A -4 47.205 0.513 12.294 1.00 0.00 C ATOM 29 NE2 HIS A -4 47.984 1.598 12.281 1.00 0.00 N ATOM 0 H HIS A -4 43.226 1.243 10.079 1.00 0.00 H new ATOM 0 HA HIS A -4 44.782 3.771 10.189 1.00 0.00 H new ATOM 0 HB2 HIS A -4 45.393 1.099 8.852 1.00 0.00 H new ATOM 0 HB3 HIS A -4 46.341 2.556 8.624 1.00 0.00 H new ATOM 0 HD2 HIS A -4 47.974 3.285 10.869 1.00 0.00 H new ATOM 0 HE1 HIS A -4 47.277 -0.275 13.029 1.00 0.00 H new ATOM 0 HE2 HIS A -4 48.730 1.834 12.936 1.00 0.00 H new ATOM 37 N HIS A -3 44.066 4.509 7.908 1.00 0.00 N ATOM 38 CA HIS A -3 43.479 5.023 6.672 1.00 0.00 C ATOM 39 C HIS A -3 44.574 5.405 5.682 1.00 0.00 C ATOM 40 O HIS A -3 45.617 5.934 6.069 1.00 0.00 O ATOM 41 CB HIS A -3 42.618 6.249 6.978 1.00 0.00 C ATOM 42 CG HIS A -3 41.425 5.943 7.842 1.00 0.00 C ATOM 43 ND1 HIS A -3 41.470 6.036 9.223 1.00 0.00 N ATOM 44 CD2 HIS A -3 40.147 5.542 7.534 1.00 0.00 C ATOM 45 CE1 HIS A -3 40.255 5.701 9.693 1.00 0.00 C ATOM 46 NE2 HIS A -3 39.410 5.391 8.706 1.00 0.00 N ATOM 0 H HIS A -3 44.683 5.165 8.387 1.00 0.00 H new ATOM 0 HA HIS A -3 42.859 4.243 6.230 1.00 0.00 H new ATOM 0 HB2 HIS A -3 43.233 7.000 7.474 1.00 0.00 H new ATOM 0 HB3 HIS A -3 42.275 6.686 6.040 1.00 0.00 H new ATOM 0 HD2 HIS A -3 39.772 5.370 6.536 1.00 0.00 H new ATOM 0 HE1 HIS A -3 39.994 5.685 10.741 1.00 0.00 H new ATOM 0 HE2 HIS A -3 38.435 5.105 8.792 1.00 0.00 H new ATOM 54 N HIS A -2 44.331 5.134 4.403 1.00 0.00 N ATOM 55 CA HIS A -2 45.299 5.451 3.356 1.00 0.00 C ATOM 56 C HIS A -2 44.740 6.516 2.418 1.00 0.00 C ATOM 57 O HIS A -2 43.571 6.469 2.037 1.00 0.00 O ATOM 58 CB HIS A -2 45.630 4.190 2.555 1.00 0.00 C ATOM 59 CG HIS A -2 46.240 3.095 3.387 1.00 0.00 C ATOM 60 ND1 HIS A -2 47.519 3.188 3.909 1.00 0.00 N ATOM 61 CD2 HIS A -2 45.755 1.877 3.797 1.00 0.00 C ATOM 62 CE1 HIS A -2 47.761 2.058 4.597 1.00 0.00 C ATOM 63 NE2 HIS A -2 46.719 1.224 4.561 1.00 0.00 N ATOM 0 H HIS A -2 43.474 4.696 4.066 1.00 0.00 H new ATOM 0 HA HIS A -2 46.205 5.833 3.826 1.00 0.00 H new ATOM 0 HB2 HIS A -2 44.719 3.816 2.088 1.00 0.00 H new ATOM 0 HB3 HIS A -2 46.317 4.450 1.750 1.00 0.00 H new ATOM 0 HD2 HIS A -2 44.776 1.486 3.563 1.00 0.00 H new ATOM 0 HE1 HIS A -2 48.685 1.851 5.115 1.00 0.00 H new ATOM 0 HE2 HIS A -2 46.645 0.306 4.999 1.00 0.00 H new ATOM 71 N HIS A -1 45.584 7.476 2.049 1.00 0.00 N ATOM 72 CA HIS A -1 45.169 8.557 1.159 1.00 0.00 C ATOM 73 C HIS A -1 46.138 8.685 -0.013 1.00 0.00 C ATOM 74 O HIS A -1 47.354 8.618 0.164 1.00 0.00 O ATOM 75 CB HIS A -1 45.124 9.877 1.929 1.00 0.00 C ATOM 76 CG HIS A -1 44.662 11.041 1.095 1.00 0.00 C ATOM 77 ND1 HIS A -1 45.550 11.883 0.446 1.00 0.00 N ATOM 78 CD2 HIS A -1 43.408 11.516 0.796 1.00 0.00 C ATOM 79 CE1 HIS A -1 44.827 12.811 -0.206 1.00 0.00 C ATOM 80 NE2 HIS A -1 43.516 12.635 -0.026 1.00 0.00 N ATOM 0 H HIS A -1 46.557 7.528 2.351 1.00 0.00 H new ATOM 0 HA HIS A -1 44.176 8.326 0.774 1.00 0.00 H new ATOM 0 HB2 HIS A -1 44.459 9.767 2.785 1.00 0.00 H new ATOM 0 HB3 HIS A -1 46.117 10.093 2.323 1.00 0.00 H new ATOM 0 HD2 HIS A -1 42.480 11.087 1.145 1.00 0.00 H new ATOM 0 HE1 HIS A -1 45.255 13.603 -0.803 1.00 0.00 H new ATOM 0 HE2 HIS A -1 42.757 13.199 -0.408 1.00 0.00 H new ATOM 88 N HIS A 0 45.588 8.872 -1.211 1.00 0.00 N ATOM 89 CA HIS A 0 46.404 9.017 -2.414 1.00 0.00 C ATOM 90 C HIS A 0 46.153 10.372 -3.067 1.00 0.00 C ATOM 91 O HIS A 0 45.021 10.856 -3.102 1.00 0.00 O ATOM 92 CB HIS A 0 46.070 7.903 -3.407 1.00 0.00 C ATOM 93 CG HIS A 0 46.423 6.529 -2.905 1.00 0.00 C ATOM 94 ND1 HIS A 0 45.518 5.737 -2.219 1.00 0.00 N ATOM 95 CD2 HIS A 0 47.581 5.794 -2.982 1.00 0.00 C ATOM 96 CE1 HIS A 0 46.136 4.584 -1.912 1.00 0.00 C ATOM 97 NE2 HIS A 0 47.397 4.565 -2.354 1.00 0.00 N ATOM 0 H HIS A 0 44.583 8.927 -1.374 1.00 0.00 H new ATOM 0 HA HIS A 0 47.454 8.949 -2.131 1.00 0.00 H new ATOM 0 HB2 HIS A 0 45.004 7.936 -3.634 1.00 0.00 H new ATOM 0 HB3 HIS A 0 46.601 8.088 -4.341 1.00 0.00 H new ATOM 0 HD2 HIS A 0 48.495 6.120 -3.457 1.00 0.00 H new ATOM 0 HE1 HIS A 0 45.670 3.772 -1.374 1.00 0.00 H new ATOM 0 HE2 HIS A 0 48.078 3.812 -2.253 1.00 0.00 H new ATOM 105 N SER A 1 47.217 10.982 -3.583 1.00 0.00 N ATOM 106 CA SER A 1 47.114 12.289 -4.228 1.00 0.00 C ATOM 107 C SER A 1 47.549 12.202 -5.687 1.00 0.00 C ATOM 108 O SER A 1 48.402 11.389 -6.042 1.00 0.00 O ATOM 109 CB SER A 1 47.995 13.301 -3.493 1.00 0.00 C ATOM 110 OG SER A 1 47.589 13.373 -2.133 1.00 0.00 O ATOM 0 H SER A 1 48.160 10.593 -3.567 1.00 0.00 H new ATOM 0 HA SER A 1 46.074 12.613 -4.189 1.00 0.00 H new ATOM 0 HB2 SER A 1 49.042 13.004 -3.557 1.00 0.00 H new ATOM 0 HB3 SER A 1 47.912 14.281 -3.962 1.00 0.00 H new ATOM 0 HG SER A 1 48.152 14.019 -1.657 1.00 0.00 H new ATOM 116 N SER A 2 46.956 13.045 -6.527 1.00 0.00 N ATOM 117 CA SER A 2 47.292 13.056 -7.945 1.00 0.00 C ATOM 118 C SER A 2 48.690 13.625 -8.160 1.00 0.00 C ATOM 119 O SER A 2 49.149 14.474 -7.394 1.00 0.00 O ATOM 120 CB SER A 2 46.273 13.894 -8.717 1.00 0.00 C ATOM 121 OG SER A 2 46.544 13.795 -10.109 1.00 0.00 O ATOM 0 H SER A 2 46.246 13.724 -6.252 1.00 0.00 H new ATOM 0 HA SER A 2 47.270 12.030 -8.312 1.00 0.00 H new ATOM 0 HB2 SER A 2 45.262 13.545 -8.506 1.00 0.00 H new ATOM 0 HB3 SER A 2 46.324 14.935 -8.398 1.00 0.00 H new ATOM 0 HG SER A 2 45.892 14.330 -10.608 1.00 0.00 H new ATOM 127 N GLY A 3 49.362 13.154 -9.205 1.00 0.00 N ATOM 128 CA GLY A 3 50.715 13.611 -9.499 1.00 0.00 C ATOM 129 C GLY A 3 50.729 15.094 -9.857 1.00 0.00 C ATOM 130 O GLY A 3 49.828 15.588 -10.536 1.00 0.00 O ATOM 0 H GLY A 3 48.995 12.461 -9.858 1.00 0.00 H new ATOM 0 HA2 GLY A 3 51.357 13.436 -8.635 1.00 0.00 H new ATOM 0 HA3 GLY A 3 51.127 13.031 -10.325 1.00 0.00 H new ATOM 134 N LEU A 4 51.758 15.797 -9.394 1.00 0.00 N ATOM 135 CA LEU A 4 51.895 17.220 -9.680 1.00 0.00 C ATOM 136 C LEU A 4 52.918 17.442 -10.789 1.00 0.00 C ATOM 137 O LEU A 4 53.994 16.843 -10.780 1.00 0.00 O ATOM 138 CB LEU A 4 52.336 17.966 -8.418 1.00 0.00 C ATOM 139 CG LEU A 4 52.323 19.472 -8.681 1.00 0.00 C ATOM 140 CD1 LEU A 4 50.877 19.963 -8.769 1.00 0.00 C ATOM 141 CD2 LEU A 4 53.035 20.194 -7.535 1.00 0.00 C ATOM 0 H LEU A 4 52.506 15.406 -8.821 1.00 0.00 H new ATOM 0 HA LEU A 4 50.929 17.603 -10.008 1.00 0.00 H new ATOM 0 HB2 LEU A 4 51.669 17.726 -7.590 1.00 0.00 H new ATOM 0 HB3 LEU A 4 53.336 17.646 -8.125 1.00 0.00 H new ATOM 0 HG LEU A 4 52.836 19.681 -9.620 1.00 0.00 H new ATOM 0 HD11 LEU A 4 50.868 21.037 -8.956 1.00 0.00 H new ATOM 0 HD12 LEU A 4 50.367 19.448 -9.583 1.00 0.00 H new ATOM 0 HD13 LEU A 4 50.364 19.754 -7.830 1.00 0.00 H new ATOM 0 HD21 LEU A 4 53.027 21.268 -7.721 1.00 0.00 H new ATOM 0 HD22 LEU A 4 52.521 19.984 -6.597 1.00 0.00 H new ATOM 0 HD23 LEU A 4 54.066 19.845 -7.470 1.00 0.00 H new ATOM 153 N VAL A 5 52.579 18.303 -11.743 1.00 0.00 N ATOM 154 CA VAL A 5 53.471 18.569 -12.866 1.00 0.00 C ATOM 155 C VAL A 5 54.818 19.094 -12.349 1.00 0.00 C ATOM 156 O VAL A 5 54.837 19.853 -11.379 1.00 0.00 O ATOM 157 CB VAL A 5 52.815 19.595 -13.801 1.00 0.00 C ATOM 158 CG1 VAL A 5 52.561 20.903 -13.045 1.00 0.00 C ATOM 159 CG2 VAL A 5 53.722 19.870 -15.003 1.00 0.00 C ATOM 0 H VAL A 5 51.702 18.824 -11.762 1.00 0.00 H new ATOM 0 HA VAL A 5 53.651 17.648 -13.420 1.00 0.00 H new ATOM 0 HB VAL A 5 51.867 19.189 -14.153 1.00 0.00 H new ATOM 0 HG11 VAL A 5 52.095 21.626 -13.715 1.00 0.00 H new ATOM 0 HG12 VAL A 5 51.899 20.712 -12.200 1.00 0.00 H new ATOM 0 HG13 VAL A 5 53.508 21.303 -12.681 1.00 0.00 H new ATOM 0 HG21 VAL A 5 53.246 20.599 -15.659 1.00 0.00 H new ATOM 0 HG22 VAL A 5 54.677 20.264 -14.656 1.00 0.00 H new ATOM 0 HG23 VAL A 5 53.890 18.943 -15.552 1.00 0.00 H new ATOM 169 N PRO A 6 55.931 18.726 -12.949 1.00 0.00 N ATOM 170 CA PRO A 6 57.267 19.197 -12.482 1.00 0.00 C ATOM 171 C PRO A 6 57.707 20.484 -13.174 1.00 0.00 C ATOM 172 O PRO A 6 57.995 20.486 -14.371 1.00 0.00 O ATOM 173 CB PRO A 6 58.184 18.036 -12.861 1.00 0.00 C ATOM 174 CG PRO A 6 57.588 17.460 -14.103 1.00 0.00 C ATOM 175 CD PRO A 6 56.100 17.828 -14.109 1.00 0.00 C ATOM 0 HA PRO A 6 57.274 19.441 -11.420 1.00 0.00 H new ATOM 0 HB2 PRO A 6 59.204 18.380 -13.036 1.00 0.00 H new ATOM 0 HB3 PRO A 6 58.230 17.293 -12.064 1.00 0.00 H new ATOM 0 HG2 PRO A 6 58.085 17.857 -14.988 1.00 0.00 H new ATOM 0 HG3 PRO A 6 57.716 16.378 -14.124 1.00 0.00 H new ATOM 0 HD2 PRO A 6 55.819 18.324 -15.038 1.00 0.00 H new ATOM 0 HD3 PRO A 6 55.472 16.941 -14.018 1.00 0.00 H new ATOM 183 N ARG A 7 57.756 21.576 -12.416 1.00 0.00 N ATOM 184 CA ARG A 7 58.201 22.857 -12.957 1.00 0.00 C ATOM 185 C ARG A 7 59.228 23.496 -12.028 1.00 0.00 C ATOM 186 O ARG A 7 59.026 23.560 -10.815 1.00 0.00 O ATOM 187 CB ARG A 7 57.006 23.797 -13.123 1.00 0.00 C ATOM 188 CG ARG A 7 57.456 25.073 -13.839 1.00 0.00 C ATOM 189 CD ARG A 7 56.275 26.038 -13.955 1.00 0.00 C ATOM 190 NE ARG A 7 56.655 27.211 -14.748 1.00 0.00 N ATOM 191 CZ ARG A 7 57.301 28.272 -14.239 1.00 0.00 C ATOM 192 NH1 ARG A 7 57.643 28.342 -12.976 1.00 0.00 N ATOM 193 NH2 ARG A 7 57.597 29.267 -15.030 1.00 0.00 N ATOM 0 H ARG A 7 57.495 21.600 -11.430 1.00 0.00 H new ATOM 0 HA ARG A 7 58.662 22.683 -13.929 1.00 0.00 H new ATOM 0 HB2 ARG A 7 56.219 23.305 -13.695 1.00 0.00 H new ATOM 0 HB3 ARG A 7 56.585 24.043 -12.148 1.00 0.00 H new ATOM 0 HG2 ARG A 7 58.271 25.543 -13.288 1.00 0.00 H new ATOM 0 HG3 ARG A 7 57.839 24.830 -14.830 1.00 0.00 H new ATOM 0 HD2 ARG A 7 55.428 25.534 -14.421 1.00 0.00 H new ATOM 0 HD3 ARG A 7 55.952 26.350 -12.962 1.00 0.00 H new ATOM 0 HE ARG A 7 56.416 27.222 -15.739 1.00 0.00 H new ATOM 0 HH11 ARG A 7 57.419 27.574 -12.344 1.00 0.00 H new ATOM 0 HH12 ARG A 7 58.133 29.165 -12.625 1.00 0.00 H new ATOM 0 HH21 ARG A 7 57.338 29.229 -16.016 1.00 0.00 H new ATOM 0 HH22 ARG A 7 58.088 30.082 -14.662 1.00 0.00 H new ATOM 207 N GLY A 8 60.329 23.968 -12.603 1.00 0.00 N ATOM 208 CA GLY A 8 61.380 24.599 -11.813 1.00 0.00 C ATOM 209 C GLY A 8 62.708 24.590 -12.564 1.00 0.00 C ATOM 210 O GLY A 8 62.768 24.212 -13.733 1.00 0.00 O ATOM 0 H GLY A 8 60.516 23.926 -13.605 1.00 0.00 H new ATOM 0 HA2 GLY A 8 61.097 25.625 -11.579 1.00 0.00 H new ATOM 0 HA3 GLY A 8 61.491 24.075 -10.864 1.00 0.00 H new ATOM 214 N SER A 9 63.770 25.011 -11.882 1.00 0.00 N ATOM 215 CA SER A 9 65.102 25.041 -12.480 1.00 0.00 C ATOM 216 C SER A 9 66.060 24.152 -11.693 1.00 0.00 C ATOM 217 O SER A 9 65.930 24.010 -10.476 1.00 0.00 O ATOM 218 CB SER A 9 65.632 26.475 -12.495 1.00 0.00 C ATOM 219 OG SER A 9 64.733 27.298 -13.224 1.00 0.00 O ATOM 0 H SER A 9 63.734 25.336 -10.916 1.00 0.00 H new ATOM 0 HA SER A 9 65.032 24.668 -13.502 1.00 0.00 H new ATOM 0 HB2 SER A 9 65.739 26.846 -11.476 1.00 0.00 H new ATOM 0 HB3 SER A 9 66.622 26.505 -12.951 1.00 0.00 H new ATOM 0 HG SER A 9 65.068 28.219 -13.235 1.00 0.00 H new ATOM 225 N GLY A 10 67.020 23.558 -12.393 1.00 0.00 N ATOM 226 CA GLY A 10 67.990 22.680 -11.748 1.00 0.00 C ATOM 227 C GLY A 10 69.149 23.481 -11.164 1.00 0.00 C ATOM 228 O GLY A 10 69.166 24.709 -11.237 1.00 0.00 O ATOM 0 H GLY A 10 67.147 23.667 -13.399 1.00 0.00 H new ATOM 0 HA2 GLY A 10 67.501 22.111 -10.957 1.00 0.00 H new ATOM 0 HA3 GLY A 10 68.370 21.958 -12.471 1.00 0.00 H new ATOM 232 N MET A 11 70.116 22.775 -10.584 1.00 0.00 N ATOM 233 CA MET A 11 71.282 23.422 -9.987 1.00 0.00 C ATOM 234 C MET A 11 72.569 22.810 -10.531 1.00 0.00 C ATOM 235 O MET A 11 72.582 21.663 -10.978 1.00 0.00 O ATOM 236 CB MET A 11 71.245 23.261 -8.466 1.00 0.00 C ATOM 237 CG MET A 11 70.032 24.002 -7.902 1.00 0.00 C ATOM 238 SD MET A 11 70.052 23.905 -6.095 1.00 0.00 S ATOM 239 CE MET A 11 68.468 24.730 -5.806 1.00 0.00 C ATOM 0 H MET A 11 70.116 21.757 -10.514 1.00 0.00 H new ATOM 0 HA MET A 11 71.258 24.481 -10.242 1.00 0.00 H new ATOM 0 HB2 MET A 11 71.193 22.204 -8.203 1.00 0.00 H new ATOM 0 HB3 MET A 11 72.161 23.654 -8.026 1.00 0.00 H new ATOM 0 HG2 MET A 11 70.048 25.044 -8.221 1.00 0.00 H new ATOM 0 HG3 MET A 11 69.112 23.564 -8.290 1.00 0.00 H new ATOM 0 HE1 MET A 11 68.275 24.781 -4.735 1.00 0.00 H new ATOM 0 HE2 MET A 11 68.503 25.739 -6.217 1.00 0.00 H new ATOM 0 HE3 MET A 11 67.671 24.168 -6.292 1.00 0.00 H new ATOM 249 N LYS A 12 73.649 23.583 -10.491 1.00 0.00 N ATOM 250 CA LYS A 12 74.938 23.104 -10.979 1.00 0.00 C ATOM 251 C LYS A 12 75.613 22.225 -9.931 1.00 0.00 C ATOM 252 O LYS A 12 75.670 22.580 -8.754 1.00 0.00 O ATOM 253 CB LYS A 12 75.843 24.291 -11.315 1.00 0.00 C ATOM 254 CG LYS A 12 77.130 23.785 -11.968 1.00 0.00 C ATOM 255 CD LYS A 12 77.988 24.977 -12.396 1.00 0.00 C ATOM 256 CE LYS A 12 78.504 25.707 -11.156 1.00 0.00 C ATOM 257 NZ LYS A 12 79.536 26.703 -11.559 1.00 0.00 N ATOM 0 H LYS A 12 73.659 24.536 -10.129 1.00 0.00 H new ATOM 0 HA LYS A 12 74.769 22.512 -11.878 1.00 0.00 H new ATOM 0 HB2 LYS A 12 75.327 24.976 -11.988 1.00 0.00 H new ATOM 0 HB3 LYS A 12 76.078 24.850 -10.409 1.00 0.00 H new ATOM 0 HG2 LYS A 12 77.683 23.158 -11.269 1.00 0.00 H new ATOM 0 HG3 LYS A 12 76.892 23.165 -12.833 1.00 0.00 H new ATOM 0 HD2 LYS A 12 78.825 24.636 -13.005 1.00 0.00 H new ATOM 0 HD3 LYS A 12 77.402 25.657 -13.014 1.00 0.00 H new ATOM 0 HE2 LYS A 12 77.680 26.207 -10.646 1.00 0.00 H new ATOM 0 HE3 LYS A 12 78.929 24.993 -10.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 79.887 27.200 -10.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 80.326 26.214 -12.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 79.116 27.391 -12.216 1.00 0.00 H new ATOM 271 N GLU A 13 76.124 21.079 -10.367 1.00 0.00 N ATOM 272 CA GLU A 13 76.799 20.161 -9.454 1.00 0.00 C ATOM 273 C GLU A 13 78.109 20.765 -8.961 1.00 0.00 C ATOM 274 O GLU A 13 78.811 21.443 -9.711 1.00 0.00 O ATOM 275 CB GLU A 13 77.076 18.823 -10.146 1.00 0.00 C ATOM 276 CG GLU A 13 75.755 18.118 -10.474 1.00 0.00 C ATOM 277 CD GLU A 13 75.076 18.734 -11.699 1.00 0.00 C ATOM 278 OE1 GLU A 13 75.750 19.393 -12.476 1.00 0.00 O ATOM 279 OE2 GLU A 13 73.881 18.535 -11.843 1.00 0.00 O ATOM 0 H GLU A 13 76.085 20.765 -11.337 1.00 0.00 H new ATOM 0 HA GLU A 13 76.144 19.989 -8.600 1.00 0.00 H new ATOM 0 HB2 GLU A 13 77.646 18.988 -11.060 1.00 0.00 H new ATOM 0 HB3 GLU A 13 77.685 18.190 -9.501 1.00 0.00 H new ATOM 0 HG2 GLU A 13 75.942 17.060 -10.655 1.00 0.00 H new ATOM 0 HG3 GLU A 13 75.086 18.181 -9.616 1.00 0.00 H new ATOM 286 N THR A 14 78.433 20.516 -7.695 1.00 0.00 N ATOM 287 CA THR A 14 79.661 21.042 -7.107 1.00 0.00 C ATOM 288 C THR A 14 80.368 19.972 -6.278 1.00 0.00 C ATOM 289 O THR A 14 79.745 19.014 -5.820 1.00 0.00 O ATOM 290 CB THR A 14 79.337 22.264 -6.239 1.00 0.00 C ATOM 291 OG1 THR A 14 80.545 22.816 -5.734 1.00 0.00 O ATOM 292 CG2 THR A 14 78.422 21.868 -5.077 1.00 0.00 C ATOM 0 H THR A 14 77.865 19.956 -7.059 1.00 0.00 H new ATOM 0 HA THR A 14 80.333 21.343 -7.911 1.00 0.00 H new ATOM 0 HB THR A 14 78.821 23.006 -6.849 1.00 0.00 H new ATOM 0 HG1 THR A 14 80.341 23.598 -5.180 1.00 0.00 H new ATOM 0 HG21 THR A 14 78.202 22.747 -4.471 1.00 0.00 H new ATOM 0 HG22 THR A 14 77.492 21.456 -5.470 1.00 0.00 H new ATOM 0 HG23 THR A 14 78.919 21.118 -4.461 1.00 0.00 H new ATOM 300 N ALA A 15 81.672 20.144 -6.090 1.00 0.00 N ATOM 301 CA ALA A 15 82.456 19.191 -5.314 1.00 0.00 C ATOM 302 C ALA A 15 82.019 19.199 -3.852 1.00 0.00 C ATOM 303 O ALA A 15 81.626 20.237 -3.318 1.00 0.00 O ATOM 304 CB ALA A 15 83.943 19.540 -5.405 1.00 0.00 C ATOM 0 H ALA A 15 82.206 20.930 -6.462 1.00 0.00 H new ATOM 0 HA ALA A 15 82.290 18.195 -5.725 1.00 0.00 H new ATOM 0 HB1 ALA A 15 84.521 18.823 -4.822 1.00 0.00 H new ATOM 0 HB2 ALA A 15 84.262 19.503 -6.447 1.00 0.00 H new ATOM 0 HB3 ALA A 15 84.106 20.543 -5.011 1.00 0.00 H new ATOM 310 N ALA A 16 82.090 18.037 -3.211 1.00 0.00 N ATOM 311 CA ALA A 16 81.708 17.925 -1.809 1.00 0.00 C ATOM 312 C ALA A 16 82.603 18.801 -0.938 1.00 0.00 C ATOM 313 O ALA A 16 83.784 18.983 -1.233 1.00 0.00 O ATOM 314 CB ALA A 16 81.816 16.470 -1.353 1.00 0.00 C ATOM 0 H ALA A 16 82.406 17.166 -3.637 1.00 0.00 H new ATOM 0 HA ALA A 16 80.677 18.262 -1.705 1.00 0.00 H new ATOM 0 HB1 ALA A 16 81.529 16.395 -0.304 1.00 0.00 H new ATOM 0 HB2 ALA A 16 81.153 15.850 -1.956 1.00 0.00 H new ATOM 0 HB3 ALA A 16 82.843 16.126 -1.473 1.00 0.00 H new ATOM 320 N ALA A 17 82.034 19.340 0.135 1.00 0.00 N ATOM 321 CA ALA A 17 82.789 20.202 1.036 1.00 0.00 C ATOM 322 C ALA A 17 83.959 19.442 1.651 1.00 0.00 C ATOM 323 O ALA A 17 83.857 18.249 1.939 1.00 0.00 O ATOM 324 CB ALA A 17 81.876 20.722 2.148 1.00 0.00 C ATOM 0 H ALA A 17 81.060 19.197 0.400 1.00 0.00 H new ATOM 0 HA ALA A 17 83.178 21.043 0.462 1.00 0.00 H new ATOM 0 HB1 ALA A 17 82.448 21.365 2.817 1.00 0.00 H new ATOM 0 HB2 ALA A 17 81.056 21.291 1.709 1.00 0.00 H new ATOM 0 HB3 ALA A 17 81.473 19.880 2.711 1.00 0.00 H new ATOM 330 N LYS A 18 85.073 20.142 1.848 1.00 0.00 N ATOM 331 CA LYS A 18 86.260 19.525 2.429 1.00 0.00 C ATOM 332 C LYS A 18 86.343 19.826 3.921 1.00 0.00 C ATOM 333 O LYS A 18 85.834 20.845 4.388 1.00 0.00 O ATOM 334 CB LYS A 18 87.523 20.044 1.734 1.00 0.00 C ATOM 335 CG LYS A 18 87.435 19.804 0.224 1.00 0.00 C ATOM 336 CD LYS A 18 87.391 18.302 -0.065 1.00 0.00 C ATOM 337 CE LYS A 18 87.499 18.068 -1.572 1.00 0.00 C ATOM 338 NZ LYS A 18 88.920 18.215 -1.998 1.00 0.00 N ATOM 0 H LYS A 18 85.178 21.130 1.616 1.00 0.00 H new ATOM 0 HA LYS A 18 86.187 18.447 2.286 1.00 0.00 H new ATOM 0 HB2 LYS A 18 87.645 21.109 1.933 1.00 0.00 H new ATOM 0 HB3 LYS A 18 88.402 19.541 2.138 1.00 0.00 H new ATOM 0 HG2 LYS A 18 86.544 20.286 -0.178 1.00 0.00 H new ATOM 0 HG3 LYS A 18 88.294 20.254 -0.275 1.00 0.00 H new ATOM 0 HD2 LYS A 18 88.208 17.798 0.451 1.00 0.00 H new ATOM 0 HD3 LYS A 18 86.462 17.875 0.314 1.00 0.00 H new ATOM 0 HE2 LYS A 18 87.134 17.072 -1.823 1.00 0.00 H new ATOM 0 HE3 LYS A 18 86.872 18.781 -2.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 88.963 18.760 -2.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 89.454 18.714 -1.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 89.336 17.274 -2.151 1.00 0.00 H new ATOM 352 N PHE A 19 86.987 18.931 4.666 1.00 0.00 N ATOM 353 CA PHE A 19 87.132 19.103 6.109 1.00 0.00 C ATOM 354 C PHE A 19 88.575 18.846 6.533 1.00 0.00 C ATOM 355 O PHE A 19 89.359 18.265 5.782 1.00 0.00 O ATOM 356 CB PHE A 19 86.198 18.139 6.844 1.00 0.00 C ATOM 357 CG PHE A 19 86.524 16.683 6.607 1.00 0.00 C ATOM 358 CD1 PHE A 19 86.025 16.030 5.475 1.00 0.00 C ATOM 359 CD2 PHE A 19 87.325 15.989 7.521 1.00 0.00 C ATOM 360 CE1 PHE A 19 86.326 14.681 5.256 1.00 0.00 C ATOM 361 CE2 PHE A 19 87.628 14.639 7.302 1.00 0.00 C ATOM 362 CZ PHE A 19 87.128 13.985 6.169 1.00 0.00 C ATOM 0 H PHE A 19 87.415 18.082 4.296 1.00 0.00 H new ATOM 0 HA PHE A 19 86.868 20.129 6.366 1.00 0.00 H new ATOM 0 HB2 PHE A 19 86.246 18.344 7.913 1.00 0.00 H new ATOM 0 HB3 PHE A 19 85.172 18.329 6.529 1.00 0.00 H new ATOM 0 HD1 PHE A 19 85.408 16.567 4.770 1.00 0.00 H new ATOM 0 HD2 PHE A 19 87.709 16.494 8.395 1.00 0.00 H new ATOM 0 HE1 PHE A 19 85.940 14.177 4.383 1.00 0.00 H new ATOM 0 HE2 PHE A 19 88.247 14.103 8.006 1.00 0.00 H new ATOM 0 HZ PHE A 19 87.361 12.944 5.999 1.00 0.00 H new ATOM 372 N GLU A 20 88.917 19.281 7.742 1.00 0.00 N ATOM 373 CA GLU A 20 90.275 19.113 8.249 1.00 0.00 C ATOM 374 C GLU A 20 90.681 17.643 8.232 1.00 0.00 C ATOM 375 O GLU A 20 89.865 16.760 8.496 1.00 0.00 O ATOM 376 CB GLU A 20 90.368 19.652 9.677 1.00 0.00 C ATOM 377 CG GLU A 20 90.065 21.156 9.678 1.00 0.00 C ATOM 378 CD GLU A 20 90.227 21.767 11.074 1.00 0.00 C ATOM 379 OE1 GLU A 20 90.372 21.029 12.039 1.00 0.00 O ATOM 380 OE2 GLU A 20 90.203 22.984 11.160 1.00 0.00 O ATOM 0 H GLU A 20 88.278 19.749 8.385 1.00 0.00 H new ATOM 0 HA GLU A 20 90.953 19.670 7.603 1.00 0.00 H new ATOM 0 HB2 GLU A 20 89.662 19.128 10.321 1.00 0.00 H new ATOM 0 HB3 GLU A 20 91.364 19.471 10.081 1.00 0.00 H new ATOM 0 HG2 GLU A 20 90.732 21.662 8.980 1.00 0.00 H new ATOM 0 HG3 GLU A 20 89.048 21.322 9.324 1.00 0.00 H new ATOM 387 N ARG A 21 91.949 17.389 7.923 1.00 0.00 N ATOM 388 CA ARG A 21 92.455 16.022 7.873 1.00 0.00 C ATOM 389 C ARG A 21 92.389 15.366 9.250 1.00 0.00 C ATOM 390 O ARG A 21 92.574 16.026 10.273 1.00 0.00 O ATOM 391 CB ARG A 21 93.891 16.019 7.335 1.00 0.00 C ATOM 392 CG ARG A 21 94.828 16.760 8.294 1.00 0.00 C ATOM 393 CD ARG A 21 96.204 16.918 7.645 1.00 0.00 C ATOM 394 NE ARG A 21 97.148 17.513 8.596 1.00 0.00 N ATOM 395 CZ ARG A 21 98.477 17.522 8.412 1.00 0.00 C ATOM 396 NH1 ARG A 21 99.041 16.989 7.354 1.00 0.00 N ATOM 397 NH2 ARG A 21 99.235 18.078 9.317 1.00 0.00 N ATOM 0 H ARG A 21 92.640 18.106 7.705 1.00 0.00 H new ATOM 0 HA ARG A 21 91.826 15.440 7.199 1.00 0.00 H new ATOM 0 HB2 ARG A 21 94.234 14.993 7.204 1.00 0.00 H new ATOM 0 HB3 ARG A 21 93.918 16.492 6.353 1.00 0.00 H new ATOM 0 HG2 ARG A 21 94.415 17.739 8.538 1.00 0.00 H new ATOM 0 HG3 ARG A 21 94.917 16.209 9.230 1.00 0.00 H new ATOM 0 HD2 ARG A 21 96.572 15.946 7.316 1.00 0.00 H new ATOM 0 HD3 ARG A 21 96.126 17.547 6.758 1.00 0.00 H new ATOM 0 HE ARG A 21 96.775 17.943 9.442 1.00 0.00 H new ATOM 0 HH11 ARG A 21 98.465 16.548 6.637 1.00 0.00 H new ATOM 0 HH12 ARG A 21 100.055 17.015 7.249 1.00 0.00 H new ATOM 0 HH21 ARG A 21 98.815 18.496 10.147 1.00 0.00 H new ATOM 0 HH22 ARG A 21 100.247 18.094 9.194 1.00 0.00 H new ATOM 411 N GLN A 22 92.127 14.063 9.268 1.00 0.00 N ATOM 412 CA GLN A 22 92.034 13.328 10.524 1.00 0.00 C ATOM 413 C GLN A 22 93.334 12.581 10.804 1.00 0.00 C ATOM 414 O GLN A 22 93.807 11.806 9.972 1.00 0.00 O ATOM 415 CB GLN A 22 90.872 12.332 10.459 1.00 0.00 C ATOM 416 CG GLN A 22 90.668 11.685 11.831 1.00 0.00 C ATOM 417 CD GLN A 22 90.009 12.678 12.782 1.00 0.00 C ATOM 418 OE1 GLN A 22 88.872 13.093 12.557 1.00 0.00 O ATOM 419 NE2 GLN A 22 90.658 13.086 13.838 1.00 0.00 N ATOM 0 H GLN A 22 91.976 13.497 8.433 1.00 0.00 H new ATOM 0 HA GLN A 22 91.858 14.040 11.330 1.00 0.00 H new ATOM 0 HB2 GLN A 22 89.960 12.842 10.148 1.00 0.00 H new ATOM 0 HB3 GLN A 22 91.079 11.566 9.712 1.00 0.00 H new ATOM 0 HG2 GLN A 22 90.047 10.795 11.734 1.00 0.00 H new ATOM 0 HG3 GLN A 22 91.627 11.362 12.236 1.00 0.00 H new ATOM 0 HE21 GLN A 22 91.600 12.741 14.023 1.00 0.00 H new ATOM 0 HE22 GLN A 22 90.223 13.750 14.479 1.00 0.00 H new ATOM 428 N HIS A 23 93.906 12.820 11.981 1.00 0.00 N ATOM 429 CA HIS A 23 95.151 12.163 12.372 1.00 0.00 C ATOM 430 C HIS A 23 94.996 11.507 13.741 1.00 0.00 C ATOM 431 O HIS A 23 94.394 12.078 14.649 1.00 0.00 O ATOM 432 CB HIS A 23 96.287 13.185 12.422 1.00 0.00 C ATOM 433 CG HIS A 23 97.630 12.575 12.718 1.00 0.00 C ATOM 434 ND1 HIS A 23 98.149 12.516 14.001 1.00 0.00 N ATOM 435 CD2 HIS A 23 98.572 11.990 11.906 1.00 0.00 C ATOM 436 CE1 HIS A 23 99.350 11.918 13.927 1.00 0.00 C ATOM 437 NE2 HIS A 23 99.658 11.577 12.673 1.00 0.00 N ATOM 0 H HIS A 23 93.529 13.461 12.679 1.00 0.00 H new ATOM 0 HA HIS A 23 95.386 11.396 11.634 1.00 0.00 H new ATOM 0 HB2 HIS A 23 96.337 13.708 11.467 1.00 0.00 H new ATOM 0 HB3 HIS A 23 96.060 13.932 13.183 1.00 0.00 H new ATOM 0 HD2 HIS A 23 98.483 11.869 10.836 1.00 0.00 H new ATOM 0 HE1 HIS A 23 99.989 11.735 14.778 1.00 0.00 H new ATOM 0 HE2 HIS A 23 100.506 11.114 12.347 1.00 0.00 H new ATOM 445 N MET A 24 95.544 10.303 13.881 1.00 0.00 N ATOM 446 CA MET A 24 95.456 9.564 15.138 1.00 0.00 C ATOM 447 C MET A 24 96.843 9.143 15.611 1.00 0.00 C ATOM 448 O MET A 24 97.800 9.138 14.836 1.00 0.00 O ATOM 449 CB MET A 24 94.581 8.323 14.952 1.00 0.00 C ATOM 450 CG MET A 24 93.159 8.749 14.582 1.00 0.00 C ATOM 451 SD MET A 24 92.075 7.300 14.586 1.00 0.00 S ATOM 452 CE MET A 24 92.006 7.072 16.380 1.00 0.00 C ATOM 0 H MET A 24 96.053 9.819 13.141 1.00 0.00 H new ATOM 0 HA MET A 24 95.010 10.215 15.890 1.00 0.00 H new ATOM 0 HB2 MET A 24 94.996 7.687 14.170 1.00 0.00 H new ATOM 0 HB3 MET A 24 94.568 7.734 15.869 1.00 0.00 H new ATOM 0 HG2 MET A 24 92.794 9.491 15.292 1.00 0.00 H new ATOM 0 HG3 MET A 24 93.153 9.218 13.598 1.00 0.00 H new ATOM 0 HE1 MET A 24 90.966 7.046 16.704 1.00 0.00 H new ATOM 0 HE2 MET A 24 92.493 6.134 16.647 1.00 0.00 H new ATOM 0 HE3 MET A 24 92.518 7.899 16.872 1.00 0.00 H new ATOM 462 N ASP A 25 96.944 8.789 16.889 1.00 0.00 N ATOM 463 CA ASP A 25 98.218 8.369 17.459 1.00 0.00 C ATOM 464 C ASP A 25 98.604 6.983 16.949 1.00 0.00 C ATOM 465 O ASP A 25 97.921 6.412 16.100 1.00 0.00 O ATOM 466 CB ASP A 25 98.131 8.357 18.990 1.00 0.00 C ATOM 467 CG ASP A 25 97.102 7.336 19.472 1.00 0.00 C ATOM 468 OD1 ASP A 25 96.158 7.074 18.744 1.00 0.00 O ATOM 469 OD2 ASP A 25 97.270 6.834 20.571 1.00 0.00 O ATOM 0 H ASP A 25 96.163 8.785 17.545 1.00 0.00 H new ATOM 0 HA ASP A 25 98.985 9.079 17.150 1.00 0.00 H new ATOM 0 HB2 ASP A 25 99.108 8.121 19.411 1.00 0.00 H new ATOM 0 HB3 ASP A 25 97.860 9.349 19.350 1.00 0.00 H new ATOM 474 N SER A 26 99.704 6.451 17.473 1.00 0.00 N ATOM 475 CA SER A 26 100.177 5.136 17.056 1.00 0.00 C ATOM 476 C SER A 26 99.091 4.079 17.277 1.00 0.00 C ATOM 477 O SER A 26 98.244 4.249 18.155 1.00 0.00 O ATOM 478 CB SER A 26 101.430 4.757 17.846 1.00 0.00 C ATOM 479 OG SER A 26 101.139 4.813 19.237 1.00 0.00 O ATOM 0 H SER A 26 100.280 6.906 18.181 1.00 0.00 H new ATOM 0 HA SER A 26 100.417 5.177 15.994 1.00 0.00 H new ATOM 0 HB2 SER A 26 101.759 3.755 17.571 1.00 0.00 H new ATOM 0 HB3 SER A 26 102.246 5.438 17.605 1.00 0.00 H new ATOM 0 HG SER A 26 101.939 4.569 19.749 1.00 0.00 H new ATOM 485 N PRO A 27 99.089 3.003 16.517 1.00 0.00 N ATOM 486 CA PRO A 27 98.043 1.948 16.663 1.00 0.00 C ATOM 487 C PRO A 27 98.340 0.995 17.817 1.00 0.00 C ATOM 488 O PRO A 27 99.383 1.092 18.465 1.00 0.00 O ATOM 489 CB PRO A 27 98.084 1.214 15.324 1.00 0.00 C ATOM 490 CG PRO A 27 99.493 1.344 14.851 1.00 0.00 C ATOM 491 CD PRO A 27 100.048 2.637 15.451 1.00 0.00 C ATOM 0 HA PRO A 27 97.065 2.370 16.894 1.00 0.00 H new ATOM 0 HB2 PRO A 27 97.802 0.167 15.440 1.00 0.00 H new ATOM 0 HB3 PRO A 27 97.387 1.655 14.611 1.00 0.00 H new ATOM 0 HG2 PRO A 27 100.087 0.486 15.167 1.00 0.00 H new ATOM 0 HG3 PRO A 27 99.533 1.376 13.762 1.00 0.00 H new ATOM 0 HD2 PRO A 27 101.049 2.488 15.855 1.00 0.00 H new ATOM 0 HD3 PRO A 27 100.121 3.422 14.699 1.00 0.00 H new ATOM 499 N ASP A 28 97.415 0.075 18.066 1.00 0.00 N ATOM 500 CA ASP A 28 97.581 -0.894 19.144 1.00 0.00 C ATOM 501 C ASP A 28 98.441 -2.066 18.682 1.00 0.00 C ATOM 502 O ASP A 28 98.129 -2.726 17.691 1.00 0.00 O ATOM 503 CB ASP A 28 96.214 -1.408 19.600 1.00 0.00 C ATOM 504 CG ASP A 28 96.378 -2.320 20.811 1.00 0.00 C ATOM 505 OD1 ASP A 28 96.451 -1.802 21.913 1.00 0.00 O ATOM 506 OD2 ASP A 28 96.429 -3.524 20.619 1.00 0.00 O ATOM 0 H ASP A 28 96.547 -0.021 17.539 1.00 0.00 H new ATOM 0 HA ASP A 28 98.079 -0.400 19.979 1.00 0.00 H new ATOM 0 HB2 ASP A 28 95.566 -0.568 19.852 1.00 0.00 H new ATOM 0 HB3 ASP A 28 95.731 -1.951 18.788 1.00 0.00 H new ATOM 511 N LEU A 29 99.524 -2.321 19.409 1.00 0.00 N ATOM 512 CA LEU A 29 100.422 -3.418 19.067 1.00 0.00 C ATOM 513 C LEU A 29 99.818 -4.752 19.492 1.00 0.00 C ATOM 514 O LEU A 29 99.026 -4.815 20.433 1.00 0.00 O ATOM 515 CB LEU A 29 101.777 -3.228 19.752 1.00 0.00 C ATOM 516 CG LEU A 29 102.461 -1.971 19.205 1.00 0.00 C ATOM 517 CD1 LEU A 29 101.966 -0.742 19.970 1.00 0.00 C ATOM 518 CD2 LEU A 29 103.977 -2.097 19.378 1.00 0.00 C ATOM 0 H LEU A 29 99.800 -1.787 20.233 1.00 0.00 H new ATOM 0 HA LEU A 29 100.564 -3.420 17.986 1.00 0.00 H new ATOM 0 HB2 LEU A 29 101.641 -3.140 20.830 1.00 0.00 H new ATOM 0 HB3 LEU A 29 102.407 -4.100 19.581 1.00 0.00 H new ATOM 0 HG LEU A 29 102.221 -1.863 18.147 1.00 0.00 H new ATOM 0 HD11 LEU A 29 102.454 0.151 19.579 1.00 0.00 H new ATOM 0 HD12 LEU A 29 100.887 -0.648 19.849 1.00 0.00 H new ATOM 0 HD13 LEU A 29 102.204 -0.852 21.028 1.00 0.00 H new ATOM 0 HD21 LEU A 29 104.463 -1.203 18.989 1.00 0.00 H new ATOM 0 HD22 LEU A 29 104.215 -2.208 20.436 1.00 0.00 H new ATOM 0 HD23 LEU A 29 104.334 -2.971 18.833 1.00 0.00 H new ATOM 530 N GLY A 30 100.200 -5.819 18.794 1.00 0.00 N ATOM 531 CA GLY A 30 99.669 -7.146 19.085 1.00 0.00 C ATOM 532 C GLY A 30 99.863 -7.514 20.553 1.00 0.00 C ATOM 533 O GLY A 30 100.807 -7.059 21.199 1.00 0.00 O ATOM 0 H GLY A 30 100.872 -5.790 18.027 1.00 0.00 H new ATOM 0 HA2 GLY A 30 98.608 -7.177 18.838 1.00 0.00 H new ATOM 0 HA3 GLY A 30 100.165 -7.884 18.455 1.00 0.00 H new ATOM 537 N THR A 31 98.960 -8.343 21.070 1.00 0.00 N ATOM 538 CA THR A 31 99.014 -8.763 22.469 1.00 0.00 C ATOM 539 C THR A 31 99.126 -10.281 22.566 1.00 0.00 C ATOM 540 O THR A 31 98.978 -10.988 21.569 1.00 0.00 O ATOM 541 CB THR A 31 97.757 -8.296 23.209 1.00 0.00 C ATOM 542 OG1 THR A 31 96.617 -8.932 22.647 1.00 0.00 O ATOM 543 CG2 THR A 31 97.612 -6.777 23.087 1.00 0.00 C ATOM 0 H THR A 31 98.182 -8.738 20.542 1.00 0.00 H new ATOM 0 HA THR A 31 99.893 -8.311 22.929 1.00 0.00 H new ATOM 0 HB THR A 31 97.841 -8.560 24.263 1.00 0.00 H new ATOM 0 HG1 THR A 31 95.811 -8.636 23.120 1.00 0.00 H new ATOM 0 HG21 THR A 31 96.716 -6.453 23.616 1.00 0.00 H new ATOM 0 HG22 THR A 31 98.485 -6.292 23.523 1.00 0.00 H new ATOM 0 HG23 THR A 31 97.532 -6.502 22.035 1.00 0.00 H new ATOM 551 N ASP A 32 99.387 -10.774 23.772 1.00 0.00 N ATOM 552 CA ASP A 32 99.526 -12.210 23.984 1.00 0.00 C ATOM 553 C ASP A 32 98.177 -12.905 23.830 1.00 0.00 C ATOM 554 O ASP A 32 97.193 -12.518 24.459 1.00 0.00 O ATOM 555 CB ASP A 32 100.084 -12.480 25.383 1.00 0.00 C ATOM 556 CG ASP A 32 100.357 -13.971 25.557 1.00 0.00 C ATOM 557 OD1 ASP A 32 101.418 -14.410 25.145 1.00 0.00 O ATOM 558 OD2 ASP A 32 99.502 -14.649 26.099 1.00 0.00 O ATOM 0 H ASP A 32 99.506 -10.206 24.611 1.00 0.00 H new ATOM 0 HA ASP A 32 100.214 -12.605 23.237 1.00 0.00 H new ATOM 0 HB2 ASP A 32 101.003 -11.914 25.532 1.00 0.00 H new ATOM 0 HB3 ASP A 32 99.375 -12.141 26.138 1.00 0.00 H new ATOM 563 N ASP A 33 98.141 -13.934 22.989 1.00 0.00 N ATOM 564 CA ASP A 33 96.902 -14.658 22.733 1.00 0.00 C ATOM 565 C ASP A 33 96.356 -15.265 24.021 1.00 0.00 C ATOM 566 O ASP A 33 97.116 -15.692 24.890 1.00 0.00 O ATOM 567 CB ASP A 33 97.148 -15.767 21.709 1.00 0.00 C ATOM 568 CG ASP A 33 98.204 -16.735 22.230 1.00 0.00 C ATOM 569 OD1 ASP A 33 97.837 -17.652 22.945 1.00 0.00 O ATOM 570 OD2 ASP A 33 99.365 -16.544 21.906 1.00 0.00 O ATOM 0 H ASP A 33 98.951 -14.283 22.476 1.00 0.00 H new ATOM 0 HA ASP A 33 96.169 -13.954 22.339 1.00 0.00 H new ATOM 0 HB2 ASP A 33 96.219 -16.302 21.510 1.00 0.00 H new ATOM 0 HB3 ASP A 33 97.475 -15.334 20.764 1.00 0.00 H new ATOM 575 N ASP A 34 95.032 -15.301 24.134 1.00 0.00 N ATOM 576 CA ASP A 34 94.384 -15.849 25.320 1.00 0.00 C ATOM 577 C ASP A 34 93.187 -16.707 24.924 1.00 0.00 C ATOM 578 O ASP A 34 92.832 -16.791 23.748 1.00 0.00 O ATOM 579 CB ASP A 34 93.919 -14.712 26.233 1.00 0.00 C ATOM 580 CG ASP A 34 95.112 -13.891 26.717 1.00 0.00 C ATOM 581 OD1 ASP A 34 96.180 -14.461 26.872 1.00 0.00 O ATOM 582 OD2 ASP A 34 94.939 -12.702 26.924 1.00 0.00 O ATOM 0 H ASP A 34 94.388 -14.958 23.421 1.00 0.00 H new ATOM 0 HA ASP A 34 95.104 -16.470 25.852 1.00 0.00 H new ATOM 0 HB2 ASP A 34 93.222 -14.069 25.696 1.00 0.00 H new ATOM 0 HB3 ASP A 34 93.381 -15.121 27.088 1.00 0.00 H new ATOM 587 N ASP A 35 92.567 -17.344 25.913 1.00 0.00 N ATOM 588 CA ASP A 35 91.407 -18.188 25.655 1.00 0.00 C ATOM 589 C ASP A 35 90.287 -17.374 25.018 1.00 0.00 C ATOM 590 O ASP A 35 90.166 -16.172 25.259 1.00 0.00 O ATOM 591 CB ASP A 35 90.910 -18.808 26.964 1.00 0.00 C ATOM 592 CG ASP A 35 91.974 -19.730 27.558 1.00 0.00 C ATOM 593 OD1 ASP A 35 92.729 -20.312 26.795 1.00 0.00 O ATOM 594 OD2 ASP A 35 92.017 -19.840 28.772 1.00 0.00 O ATOM 0 H ASP A 35 92.846 -17.292 26.893 1.00 0.00 H new ATOM 0 HA ASP A 35 91.702 -18.981 24.968 1.00 0.00 H new ATOM 0 HB2 ASP A 35 90.665 -18.020 27.676 1.00 0.00 H new ATOM 0 HB3 ASP A 35 89.994 -19.370 26.782 1.00 0.00 H new ATOM 599 N LYS A 36 89.470 -18.034 24.204 1.00 0.00 N ATOM 600 CA LYS A 36 88.379 -17.350 23.516 1.00 0.00 C ATOM 601 C LYS A 36 87.270 -16.989 24.498 1.00 0.00 C ATOM 602 O LYS A 36 86.954 -17.758 25.406 1.00 0.00 O ATOM 603 CB LYS A 36 87.815 -18.247 22.413 1.00 0.00 C ATOM 604 CG LYS A 36 88.891 -18.491 21.352 1.00 0.00 C ATOM 605 CD LYS A 36 88.295 -19.298 20.197 1.00 0.00 C ATOM 606 CE LYS A 36 89.397 -19.645 19.194 1.00 0.00 C ATOM 607 NZ LYS A 36 88.829 -20.488 18.104 1.00 0.00 N ATOM 0 H LYS A 36 89.540 -19.032 24.005 1.00 0.00 H new ATOM 0 HA LYS A 36 88.770 -16.433 23.074 1.00 0.00 H new ATOM 0 HB2 LYS A 36 87.484 -19.196 22.835 1.00 0.00 H new ATOM 0 HB3 LYS A 36 86.942 -17.778 21.959 1.00 0.00 H new ATOM 0 HG2 LYS A 36 89.276 -17.540 20.984 1.00 0.00 H new ATOM 0 HG3 LYS A 36 89.733 -19.029 21.789 1.00 0.00 H new ATOM 0 HD2 LYS A 36 87.834 -20.210 20.577 1.00 0.00 H new ATOM 0 HD3 LYS A 36 87.509 -18.724 19.706 1.00 0.00 H new ATOM 0 HE2 LYS A 36 89.825 -18.733 18.778 1.00 0.00 H new ATOM 0 HE3 LYS A 36 90.206 -20.176 19.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 89.578 -20.724 17.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 88.441 -21.364 18.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 88.072 -19.965 17.620 1.00 0.00 H new ATOM 621 N THR A 37 86.682 -15.810 24.308 1.00 0.00 N ATOM 622 CA THR A 37 85.619 -15.331 25.188 1.00 0.00 C ATOM 623 C THR A 37 84.373 -14.982 24.381 1.00 0.00 C ATOM 624 O THR A 37 84.415 -14.911 23.154 1.00 0.00 O ATOM 625 CB THR A 37 86.090 -14.093 25.957 1.00 0.00 C ATOM 626 OG1 THR A 37 86.358 -13.043 25.040 1.00 0.00 O ATOM 627 CG2 THR A 37 87.359 -14.422 26.747 1.00 0.00 C ATOM 0 H THR A 37 86.924 -15.169 23.552 1.00 0.00 H new ATOM 0 HA THR A 37 85.375 -16.125 25.893 1.00 0.00 H new ATOM 0 HB THR A 37 85.310 -13.781 26.651 1.00 0.00 H new ATOM 0 HG1 THR A 37 86.658 -12.249 25.530 1.00 0.00 H new ATOM 0 HG21 THR A 37 87.688 -13.537 27.291 1.00 0.00 H new ATOM 0 HG22 THR A 37 87.150 -15.226 27.453 1.00 0.00 H new ATOM 0 HG23 THR A 37 88.144 -14.738 26.060 1.00 0.00 H new ATOM 635 N GLY A 38 83.265 -14.765 25.083 1.00 0.00 N ATOM 636 CA GLY A 38 82.011 -14.417 24.426 1.00 0.00 C ATOM 637 C GLY A 38 82.025 -12.964 23.963 1.00 0.00 C ATOM 638 O GLY A 38 83.078 -12.327 23.923 1.00 0.00 O ATOM 0 H GLY A 38 83.210 -14.824 26.100 1.00 0.00 H new ATOM 0 HA2 GLY A 38 81.849 -15.074 23.571 1.00 0.00 H new ATOM 0 HA3 GLY A 38 81.180 -14.576 25.113 1.00 0.00 H new ATOM 642 N GLY A 39 80.852 -12.445 23.614 1.00 0.00 N ATOM 643 CA GLY A 39 80.744 -11.071 23.131 1.00 0.00 C ATOM 644 C GLY A 39 81.372 -10.085 24.112 1.00 0.00 C ATOM 645 O GLY A 39 81.354 -10.301 25.323 1.00 0.00 O ATOM 0 H GLY A 39 79.967 -12.951 23.656 1.00 0.00 H new ATOM 0 HA2 GLY A 39 81.235 -10.985 22.162 1.00 0.00 H new ATOM 0 HA3 GLY A 39 79.695 -10.818 22.980 1.00 0.00 H new ATOM 649 N GLY A 40 81.926 -9.002 23.577 1.00 0.00 N ATOM 650 CA GLY A 40 82.585 -8.001 24.408 1.00 0.00 C ATOM 651 C GLY A 40 82.725 -6.679 23.662 1.00 0.00 C ATOM 652 O GLY A 40 81.994 -6.412 22.708 1.00 0.00 O ATOM 0 H GLY A 40 81.932 -8.796 22.578 1.00 0.00 H new ATOM 0 HA2 GLY A 40 82.012 -7.848 25.323 1.00 0.00 H new ATOM 0 HA3 GLY A 40 83.570 -8.361 24.705 1.00 0.00 H new ATOM 656 N ARG A 41 83.669 -5.853 24.104 1.00 0.00 N ATOM 657 CA ARG A 41 83.889 -4.554 23.477 1.00 0.00 C ATOM 658 C ARG A 41 84.201 -4.725 21.993 1.00 0.00 C ATOM 659 O ARG A 41 84.825 -5.706 21.589 1.00 0.00 O ATOM 660 CB ARG A 41 85.052 -3.827 24.159 1.00 0.00 C ATOM 661 CG ARG A 41 84.788 -3.680 25.662 1.00 0.00 C ATOM 662 CD ARG A 41 83.672 -2.660 25.908 1.00 0.00 C ATOM 663 NE ARG A 41 84.075 -1.341 25.415 1.00 0.00 N ATOM 664 CZ ARG A 41 83.202 -0.393 25.035 1.00 0.00 C ATOM 665 NH1 ARG A 41 81.905 -0.580 25.077 1.00 0.00 N ATOM 666 NH2 ARG A 41 83.661 0.752 24.611 1.00 0.00 N ATOM 0 H ARG A 41 84.289 -6.058 24.887 1.00 0.00 H new ATOM 0 HA ARG A 41 82.979 -3.963 23.586 1.00 0.00 H new ATOM 0 HB2 ARG A 41 85.978 -4.380 23.999 1.00 0.00 H new ATOM 0 HB3 ARG A 41 85.187 -2.843 23.710 1.00 0.00 H new ATOM 0 HG2 ARG A 41 84.508 -4.645 26.085 1.00 0.00 H new ATOM 0 HG3 ARG A 41 85.699 -3.362 26.169 1.00 0.00 H new ATOM 0 HD2 ARG A 41 82.759 -2.981 25.406 1.00 0.00 H new ATOM 0 HD3 ARG A 41 83.448 -2.605 26.973 1.00 0.00 H new ATOM 0 HE ARG A 41 85.071 -1.131 25.357 1.00 0.00 H new ATOM 0 HH11 ARG A 41 81.528 -1.469 25.406 1.00 0.00 H new ATOM 0 HH12 ARG A 41 81.273 0.163 24.780 1.00 0.00 H new ATOM 0 HH21 ARG A 41 84.667 0.915 24.572 1.00 0.00 H new ATOM 0 HH22 ARG A 41 83.014 1.484 24.318 1.00 0.00 H new ATOM 680 N ALA A 42 83.760 -3.764 21.188 1.00 0.00 N ATOM 681 CA ALA A 42 83.985 -3.821 19.748 1.00 0.00 C ATOM 682 C ALA A 42 85.477 -3.817 19.434 1.00 0.00 C ATOM 683 O ALA A 42 86.271 -3.211 20.153 1.00 0.00 O ATOM 684 CB ALA A 42 83.317 -2.625 19.068 1.00 0.00 C ATOM 0 H ALA A 42 83.248 -2.941 21.506 1.00 0.00 H new ATOM 0 HA ALA A 42 83.550 -4.746 19.370 1.00 0.00 H new ATOM 0 HB1 ALA A 42 83.490 -2.675 17.993 1.00 0.00 H new ATOM 0 HB2 ALA A 42 82.245 -2.646 19.265 1.00 0.00 H new ATOM 0 HB3 ALA A 42 83.740 -1.700 19.461 1.00 0.00 H new ATOM 690 N ASP A 43 85.850 -4.501 18.357 1.00 0.00 N ATOM 691 CA ASP A 43 87.250 -4.570 17.955 1.00 0.00 C ATOM 692 C ASP A 43 87.774 -3.177 17.597 1.00 0.00 C ATOM 693 O ASP A 43 86.990 -2.313 17.201 1.00 0.00 O ATOM 694 CB ASP A 43 87.402 -5.501 16.750 1.00 0.00 C ATOM 695 CG ASP A 43 86.910 -6.899 17.105 1.00 0.00 C ATOM 696 OD1 ASP A 43 85.722 -7.139 16.970 1.00 0.00 O ATOM 697 OD2 ASP A 43 87.729 -7.709 17.509 1.00 0.00 O ATOM 0 H ASP A 43 85.208 -5.012 17.751 1.00 0.00 H new ATOM 0 HA ASP A 43 87.831 -4.961 18.790 1.00 0.00 H new ATOM 0 HB2 ASP A 43 86.835 -5.111 15.905 1.00 0.00 H new ATOM 0 HB3 ASP A 43 88.447 -5.542 16.441 1.00 0.00 H new ATOM 702 N PRO A 44 89.064 -2.931 17.722 1.00 0.00 N ATOM 703 CA PRO A 44 89.633 -1.587 17.405 1.00 0.00 C ATOM 704 C PRO A 44 89.702 -1.330 15.902 1.00 0.00 C ATOM 705 O PRO A 44 89.414 -2.216 15.097 1.00 0.00 O ATOM 706 CB PRO A 44 91.035 -1.622 18.014 1.00 0.00 C ATOM 707 CG PRO A 44 91.423 -3.060 18.020 1.00 0.00 C ATOM 708 CD PRO A 44 90.129 -3.861 18.161 1.00 0.00 C ATOM 0 HA PRO A 44 89.014 -0.783 17.804 1.00 0.00 H new ATOM 0 HB2 PRO A 44 91.735 -1.028 17.426 1.00 0.00 H new ATOM 0 HB3 PRO A 44 91.036 -1.210 19.023 1.00 0.00 H new ATOM 0 HG2 PRO A 44 91.944 -3.325 17.100 1.00 0.00 H new ATOM 0 HG3 PRO A 44 92.103 -3.274 18.844 1.00 0.00 H new ATOM 0 HD2 PRO A 44 90.150 -4.759 17.544 1.00 0.00 H new ATOM 0 HD3 PRO A 44 89.973 -4.185 19.190 1.00 0.00 H new ATOM 716 N ALA A 45 90.085 -0.112 15.534 1.00 0.00 N ATOM 717 CA ALA A 45 90.188 0.261 14.126 1.00 0.00 C ATOM 718 C ALA A 45 91.648 0.285 13.685 1.00 0.00 C ATOM 719 O ALA A 45 92.543 0.557 14.485 1.00 0.00 O ATOM 720 CB ALA A 45 89.564 1.640 13.906 1.00 0.00 C ATOM 0 H ALA A 45 90.329 0.632 16.188 1.00 0.00 H new ATOM 0 HA ALA A 45 89.653 -0.479 13.532 1.00 0.00 H new ATOM 0 HB1 ALA A 45 89.644 1.912 12.854 1.00 0.00 H new ATOM 0 HB2 ALA A 45 88.513 1.614 14.195 1.00 0.00 H new ATOM 0 HB3 ALA A 45 90.089 2.378 14.513 1.00 0.00 H new ATOM 726 N HIS A 46 91.881 0.000 12.407 1.00 0.00 N ATOM 727 CA HIS A 46 93.235 -0.015 11.864 1.00 0.00 C ATOM 728 C HIS A 46 93.453 1.174 10.933 1.00 0.00 C ATOM 729 O HIS A 46 92.577 1.524 10.143 1.00 0.00 O ATOM 730 CB HIS A 46 93.472 -1.314 11.092 1.00 0.00 C ATOM 731 CG HIS A 46 93.347 -2.548 11.944 1.00 0.00 C ATOM 732 ND1 HIS A 46 94.275 -2.869 12.920 1.00 0.00 N ATOM 733 CD2 HIS A 46 92.408 -3.550 11.975 1.00 0.00 C ATOM 734 CE1 HIS A 46 93.881 -4.019 13.493 1.00 0.00 C ATOM 735 NE2 HIS A 46 92.748 -4.479 12.955 1.00 0.00 N ATOM 0 H HIS A 46 91.152 -0.223 11.730 1.00 0.00 H new ATOM 0 HA HIS A 46 93.939 0.052 12.694 1.00 0.00 H new ATOM 0 HB2 HIS A 46 92.758 -1.375 10.271 1.00 0.00 H new ATOM 0 HB3 HIS A 46 94.467 -1.288 10.648 1.00 0.00 H new ATOM 0 HD2 HIS A 46 91.539 -3.608 11.337 1.00 0.00 H new ATOM 0 HE1 HIS A 46 94.416 -4.512 14.292 1.00 0.00 H new ATOM 0 HE2 HIS A 46 92.241 -5.328 13.208 1.00 0.00 H new ATOM 743 N ARG A 47 94.626 1.790 11.035 1.00 0.00 N ATOM 744 CA ARG A 47 94.950 2.939 10.198 1.00 0.00 C ATOM 745 C ARG A 47 94.984 2.547 8.722 1.00 0.00 C ATOM 746 O ARG A 47 95.343 1.421 8.379 1.00 0.00 O ATOM 747 CB ARG A 47 96.295 3.538 10.633 1.00 0.00 C ATOM 748 CG ARG A 47 97.431 2.538 10.398 1.00 0.00 C ATOM 749 CD ARG A 47 98.723 3.074 11.017 1.00 0.00 C ATOM 750 NE ARG A 47 99.846 2.190 10.690 1.00 0.00 N ATOM 751 CZ ARG A 47 100.972 2.123 11.417 1.00 0.00 C ATOM 752 NH1 ARG A 47 101.156 2.854 12.491 1.00 0.00 N ATOM 753 NH2 ARG A 47 101.916 1.303 11.042 1.00 0.00 N ATOM 0 H ARG A 47 95.363 1.515 11.684 1.00 0.00 H new ATOM 0 HA ARG A 47 94.172 3.692 10.323 1.00 0.00 H new ATOM 0 HB2 ARG A 47 96.489 4.454 10.075 1.00 0.00 H new ATOM 0 HB3 ARG A 47 96.254 3.809 11.688 1.00 0.00 H new ATOM 0 HG2 ARG A 47 97.177 1.574 10.839 1.00 0.00 H new ATOM 0 HG3 ARG A 47 97.569 2.373 9.329 1.00 0.00 H new ATOM 0 HD2 ARG A 47 98.922 4.080 10.647 1.00 0.00 H new ATOM 0 HD3 ARG A 47 98.613 3.149 12.099 1.00 0.00 H new ATOM 0 HE ARG A 47 99.767 1.594 9.866 1.00 0.00 H new ATOM 0 HH11 ARG A 47 100.429 3.500 12.799 1.00 0.00 H new ATOM 0 HH12 ARG A 47 102.026 2.776 13.018 1.00 0.00 H new ATOM 0 HH21 ARG A 47 101.790 0.727 10.209 1.00 0.00 H new ATOM 0 HH22 ARG A 47 102.779 1.238 11.582 1.00 0.00 H new ATOM 767 N SER A 48 94.610 3.484 7.855 1.00 0.00 N ATOM 768 CA SER A 48 94.611 3.237 6.415 1.00 0.00 C ATOM 769 C SER A 48 95.607 4.167 5.715 1.00 0.00 C ATOM 770 O SER A 48 95.925 5.231 6.249 1.00 0.00 O ATOM 771 CB SER A 48 93.211 3.472 5.849 1.00 0.00 C ATOM 772 OG SER A 48 92.269 2.726 6.608 1.00 0.00 O ATOM 0 H SER A 48 94.303 4.419 8.123 1.00 0.00 H new ATOM 0 HA SER A 48 94.907 2.203 6.239 1.00 0.00 H new ATOM 0 HB2 SER A 48 92.965 4.533 5.884 1.00 0.00 H new ATOM 0 HB3 SER A 48 93.173 3.170 4.802 1.00 0.00 H new ATOM 0 HG SER A 48 91.369 2.875 6.250 1.00 0.00 H new ATOM 778 N PRO A 49 96.103 3.804 4.549 1.00 0.00 N ATOM 779 CA PRO A 49 97.072 4.674 3.814 1.00 0.00 C ATOM 780 C PRO A 49 96.538 6.091 3.632 1.00 0.00 C ATOM 781 O PRO A 49 95.375 6.284 3.276 1.00 0.00 O ATOM 782 CB PRO A 49 97.255 3.986 2.459 1.00 0.00 C ATOM 783 CG PRO A 49 96.884 2.560 2.685 1.00 0.00 C ATOM 784 CD PRO A 49 95.834 2.561 3.795 1.00 0.00 C ATOM 0 HA PRO A 49 98.009 4.783 4.361 1.00 0.00 H new ATOM 0 HB2 PRO A 49 96.620 4.441 1.699 1.00 0.00 H new ATOM 0 HB3 PRO A 49 98.284 4.074 2.110 1.00 0.00 H new ATOM 0 HG2 PRO A 49 96.486 2.113 1.774 1.00 0.00 H new ATOM 0 HG3 PRO A 49 97.755 1.973 2.975 1.00 0.00 H new ATOM 0 HD2 PRO A 49 94.823 2.554 3.387 1.00 0.00 H new ATOM 0 HD3 PRO A 49 95.927 1.681 4.432 1.00 0.00 H new ATOM 792 N VAL A 50 97.392 7.080 3.878 1.00 0.00 N ATOM 793 CA VAL A 50 96.985 8.474 3.734 1.00 0.00 C ATOM 794 C VAL A 50 97.204 8.917 2.283 1.00 0.00 C ATOM 795 O VAL A 50 98.221 8.541 1.696 1.00 0.00 O ATOM 796 CB VAL A 50 97.817 9.350 4.680 1.00 0.00 C ATOM 797 CG1 VAL A 50 97.379 10.813 4.570 1.00 0.00 C ATOM 798 CG2 VAL A 50 97.620 8.880 6.123 1.00 0.00 C ATOM 0 H VAL A 50 98.359 6.945 4.174 1.00 0.00 H new ATOM 0 HA VAL A 50 95.930 8.578 3.987 1.00 0.00 H new ATOM 0 HB VAL A 50 98.867 9.265 4.401 1.00 0.00 H new ATOM 0 HG11 VAL A 50 97.977 11.424 5.246 1.00 0.00 H new ATOM 0 HG12 VAL A 50 97.521 11.159 3.546 1.00 0.00 H new ATOM 0 HG13 VAL A 50 96.326 10.899 4.839 1.00 0.00 H new ATOM 0 HG21 VAL A 50 98.212 9.504 6.793 1.00 0.00 H new ATOM 0 HG22 VAL A 50 96.566 8.959 6.391 1.00 0.00 H new ATOM 0 HG23 VAL A 50 97.941 7.842 6.215 1.00 0.00 H new ATOM 808 N PRO A 51 96.329 9.710 1.698 1.00 0.00 N ATOM 809 CA PRO A 51 96.515 10.157 0.283 1.00 0.00 C ATOM 810 C PRO A 51 97.896 10.769 0.063 1.00 0.00 C ATOM 811 O PRO A 51 98.481 11.347 0.980 1.00 0.00 O ATOM 812 CB PRO A 51 95.420 11.203 0.062 1.00 0.00 C ATOM 813 CG PRO A 51 94.364 10.889 1.066 1.00 0.00 C ATOM 814 CD PRO A 51 95.076 10.256 2.260 1.00 0.00 C ATOM 0 HA PRO A 51 96.446 9.323 -0.415 1.00 0.00 H new ATOM 0 HB2 PRO A 51 95.807 12.212 0.202 1.00 0.00 H new ATOM 0 HB3 PRO A 51 95.025 11.150 -0.953 1.00 0.00 H new ATOM 0 HG2 PRO A 51 93.832 11.792 1.365 1.00 0.00 H new ATOM 0 HG3 PRO A 51 93.623 10.206 0.649 1.00 0.00 H new ATOM 0 HD2 PRO A 51 95.278 10.993 3.038 1.00 0.00 H new ATOM 0 HD3 PRO A 51 94.470 9.472 2.713 1.00 0.00 H new ATOM 822 N LEU A 52 98.412 10.635 -1.154 1.00 0.00 N ATOM 823 CA LEU A 52 99.741 11.148 -1.468 1.00 0.00 C ATOM 824 C LEU A 52 99.772 12.671 -1.336 1.00 0.00 C ATOM 825 O LEU A 52 98.730 13.315 -1.470 1.00 0.00 O ATOM 826 CB LEU A 52 100.129 10.765 -2.897 1.00 0.00 C ATOM 827 CG LEU A 52 100.660 9.331 -2.935 1.00 0.00 C ATOM 828 CD1 LEU A 52 100.769 8.875 -4.391 1.00 0.00 C ATOM 829 CD2 LEU A 52 102.045 9.277 -2.285 1.00 0.00 C ATOM 0 H LEU A 52 97.936 10.180 -1.933 1.00 0.00 H new ATOM 0 HA LEU A 52 100.449 10.710 -0.765 1.00 0.00 H new ATOM 0 HB2 LEU A 52 99.264 10.857 -3.553 1.00 0.00 H new ATOM 0 HB3 LEU A 52 100.888 11.452 -3.272 1.00 0.00 H new ATOM 0 HG LEU A 52 99.979 8.677 -2.391 1.00 0.00 H new ATOM 0 HD11 LEU A 52 101.147 7.853 -4.425 1.00 0.00 H new ATOM 0 HD12 LEU A 52 99.785 8.914 -4.859 1.00 0.00 H new ATOM 0 HD13 LEU A 52 101.452 9.533 -4.928 1.00 0.00 H new ATOM 0 HD21 LEU A 52 102.421 8.254 -2.314 1.00 0.00 H new ATOM 0 HD22 LEU A 52 102.728 9.930 -2.829 1.00 0.00 H new ATOM 0 HD23 LEU A 52 101.974 9.609 -1.249 1.00 0.00 H new ATOM 841 N PRO A 53 100.921 13.264 -1.078 1.00 0.00 N ATOM 842 CA PRO A 53 101.028 14.752 -1.023 1.00 0.00 C ATOM 843 C PRO A 53 100.946 15.362 -2.418 1.00 0.00 C ATOM 844 O PRO A 53 101.436 14.780 -3.389 1.00 0.00 O ATOM 845 CB PRO A 53 102.395 15.011 -0.389 1.00 0.00 C ATOM 846 CG PRO A 53 103.210 13.804 -0.701 1.00 0.00 C ATOM 847 CD PRO A 53 102.233 12.633 -0.814 1.00 0.00 C ATOM 0 HA PRO A 53 100.215 15.204 -0.455 1.00 0.00 H new ATOM 0 HB2 PRO A 53 102.854 15.911 -0.798 1.00 0.00 H new ATOM 0 HB3 PRO A 53 102.307 15.159 0.687 1.00 0.00 H new ATOM 0 HG2 PRO A 53 103.762 13.939 -1.631 1.00 0.00 H new ATOM 0 HG3 PRO A 53 103.946 13.620 0.082 1.00 0.00 H new ATOM 0 HD2 PRO A 53 102.517 11.957 -1.620 1.00 0.00 H new ATOM 0 HD3 PRO A 53 102.212 12.044 0.103 1.00 0.00 H new ATOM 855 N SER A 54 100.362 16.557 -2.506 1.00 0.00 N ATOM 856 CA SER A 54 100.145 17.197 -3.800 1.00 0.00 C ATOM 857 C SER A 54 101.469 17.323 -4.557 1.00 0.00 C ATOM 858 O SER A 54 102.490 17.642 -3.943 1.00 0.00 O ATOM 859 CB SER A 54 99.533 18.584 -3.601 1.00 0.00 C ATOM 860 OG SER A 54 98.265 18.450 -2.975 1.00 0.00 O ATOM 0 H SER A 54 100.034 17.096 -1.704 1.00 0.00 H new ATOM 0 HA SER A 54 99.460 16.582 -4.383 1.00 0.00 H new ATOM 0 HB2 SER A 54 100.191 19.200 -2.988 1.00 0.00 H new ATOM 0 HB3 SER A 54 99.426 19.089 -4.561 1.00 0.00 H new ATOM 0 HG SER A 54 97.870 19.337 -2.844 1.00 0.00 H new ATOM 866 N PRO A 55 101.490 17.095 -5.852 1.00 0.00 N ATOM 867 CA PRO A 55 102.776 16.998 -6.596 1.00 0.00 C ATOM 868 C PRO A 55 103.377 18.357 -6.932 1.00 0.00 C ATOM 869 O PRO A 55 102.763 19.167 -7.627 1.00 0.00 O ATOM 870 CB PRO A 55 102.391 16.247 -7.871 1.00 0.00 C ATOM 871 CG PRO A 55 100.970 16.619 -8.129 1.00 0.00 C ATOM 872 CD PRO A 55 100.343 16.960 -6.774 1.00 0.00 C ATOM 0 HA PRO A 55 103.545 16.501 -6.004 1.00 0.00 H new ATOM 0 HB2 PRO A 55 103.031 16.534 -8.705 1.00 0.00 H new ATOM 0 HB3 PRO A 55 102.499 15.170 -7.742 1.00 0.00 H new ATOM 0 HG2 PRO A 55 100.911 17.471 -8.806 1.00 0.00 H new ATOM 0 HG3 PRO A 55 100.436 15.796 -8.605 1.00 0.00 H new ATOM 0 HD2 PRO A 55 99.766 17.883 -6.826 1.00 0.00 H new ATOM 0 HD3 PRO A 55 99.661 16.176 -6.445 1.00 0.00 H new ATOM 880 N THR A 56 104.583 18.597 -6.431 1.00 0.00 N ATOM 881 CA THR A 56 105.364 19.740 -6.878 1.00 0.00 C ATOM 882 C THR A 56 106.180 19.304 -8.088 1.00 0.00 C ATOM 883 O THR A 56 106.419 18.110 -8.271 1.00 0.00 O ATOM 884 CB THR A 56 106.291 20.235 -5.764 1.00 0.00 C ATOM 885 OG1 THR A 56 107.237 19.224 -5.456 1.00 0.00 O ATOM 886 CG2 THR A 56 105.471 20.569 -4.517 1.00 0.00 C ATOM 0 H THR A 56 105.036 18.021 -5.722 1.00 0.00 H new ATOM 0 HA THR A 56 104.700 20.563 -7.142 1.00 0.00 H new ATOM 0 HB THR A 56 106.812 21.132 -6.099 1.00 0.00 H new ATOM 0 HG1 THR A 56 107.145 18.966 -4.515 1.00 0.00 H new ATOM 0 HG21 THR A 56 106.136 20.921 -3.728 1.00 0.00 H new ATOM 0 HG22 THR A 56 104.747 21.348 -4.756 1.00 0.00 H new ATOM 0 HG23 THR A 56 104.945 19.677 -4.178 1.00 0.00 H new ATOM 894 N SER A 57 106.639 20.257 -8.896 1.00 0.00 N ATOM 895 CA SER A 57 107.255 19.904 -10.172 1.00 0.00 C ATOM 896 C SER A 57 108.403 18.912 -9.990 1.00 0.00 C ATOM 897 O SER A 57 109.337 19.147 -9.224 1.00 0.00 O ATOM 898 CB SER A 57 107.779 21.166 -10.859 1.00 0.00 C ATOM 899 OG SER A 57 108.986 21.575 -10.229 1.00 0.00 O ATOM 0 H SER A 57 106.598 21.257 -8.697 1.00 0.00 H new ATOM 0 HA SER A 57 106.492 19.430 -10.789 1.00 0.00 H new ATOM 0 HB2 SER A 57 107.955 20.972 -11.917 1.00 0.00 H new ATOM 0 HB3 SER A 57 107.036 21.962 -10.800 1.00 0.00 H new ATOM 0 HG SER A 57 109.245 20.911 -9.556 1.00 0.00 H new ATOM 905 N ASN A 58 108.309 17.799 -10.712 1.00 0.00 N ATOM 906 CA ASN A 58 109.402 16.837 -10.814 1.00 0.00 C ATOM 907 C ASN A 58 109.762 16.176 -9.481 1.00 0.00 C ATOM 908 O ASN A 58 110.834 15.578 -9.384 1.00 0.00 O ATOM 909 CB ASN A 58 110.645 17.528 -11.382 1.00 0.00 C ATOM 910 CG ASN A 58 110.375 18.023 -12.800 1.00 0.00 C ATOM 911 OD1 ASN A 58 109.472 17.529 -13.476 1.00 0.00 O ATOM 912 ND2 ASN A 58 111.114 18.978 -13.296 1.00 0.00 N ATOM 0 H ASN A 58 107.476 17.539 -11.241 1.00 0.00 H new ATOM 0 HA ASN A 58 109.054 16.046 -11.478 1.00 0.00 H new ATOM 0 HB2 ASN A 58 110.927 18.366 -10.745 1.00 0.00 H new ATOM 0 HB3 ASN A 58 111.485 16.834 -11.386 1.00 0.00 H new ATOM 0 HD21 ASN A 58 110.943 19.315 -14.243 1.00 0.00 H new ATOM 0 HD22 ASN A 58 111.862 19.387 -12.736 1.00 0.00 H new ATOM 919 N LYS A 59 108.898 16.267 -8.465 1.00 0.00 N ATOM 920 CA LYS A 59 109.212 15.649 -7.175 1.00 0.00 C ATOM 921 C LYS A 59 107.974 15.411 -6.304 1.00 0.00 C ATOM 922 O LYS A 59 106.933 16.041 -6.489 1.00 0.00 O ATOM 923 CB LYS A 59 110.248 16.508 -6.435 1.00 0.00 C ATOM 924 CG LYS A 59 109.639 17.837 -5.976 1.00 0.00 C ATOM 925 CD LYS A 59 110.732 18.719 -5.368 1.00 0.00 C ATOM 926 CE LYS A 59 110.089 19.895 -4.631 1.00 0.00 C ATOM 927 NZ LYS A 59 109.592 19.437 -3.303 1.00 0.00 N ATOM 0 H LYS A 59 108.000 16.749 -8.507 1.00 0.00 H new ATOM 0 HA LYS A 59 109.628 14.662 -7.377 1.00 0.00 H new ATOM 0 HB2 LYS A 59 110.628 15.961 -5.572 1.00 0.00 H new ATOM 0 HB3 LYS A 59 111.098 16.701 -7.089 1.00 0.00 H new ATOM 0 HG2 LYS A 59 109.174 18.346 -6.820 1.00 0.00 H new ATOM 0 HG3 LYS A 59 108.854 17.655 -5.242 1.00 0.00 H new ATOM 0 HD2 LYS A 59 111.344 18.136 -4.680 1.00 0.00 H new ATOM 0 HD3 LYS A 59 111.395 19.086 -6.151 1.00 0.00 H new ATOM 0 HE2 LYS A 59 110.815 20.698 -4.502 1.00 0.00 H new ATOM 0 HE3 LYS A 59 109.266 20.300 -5.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 108.665 19.868 -3.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 109.498 18.401 -3.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 110.265 19.722 -2.563 1.00 0.00 H new ATOM 941 N GLN A 60 108.112 14.487 -5.353 1.00 0.00 N ATOM 942 CA GLN A 60 107.081 14.249 -4.341 1.00 0.00 C ATOM 943 C GLN A 60 107.713 13.806 -3.026 1.00 0.00 C ATOM 944 O GLN A 60 108.796 13.222 -3.014 1.00 0.00 O ATOM 945 CB GLN A 60 106.090 13.164 -4.773 1.00 0.00 C ATOM 946 CG GLN A 60 105.249 13.648 -5.951 1.00 0.00 C ATOM 947 CD GLN A 60 104.139 12.639 -6.241 1.00 0.00 C ATOM 948 OE1 GLN A 60 104.361 11.667 -6.963 1.00 0.00 O ATOM 949 NE2 GLN A 60 102.958 12.790 -5.699 1.00 0.00 N ATOM 0 H GLN A 60 108.932 13.888 -5.262 1.00 0.00 H new ATOM 0 HA GLN A 60 106.549 15.192 -4.216 1.00 0.00 H new ATOM 0 HB2 GLN A 60 106.630 12.259 -5.052 1.00 0.00 H new ATOM 0 HB3 GLN A 60 105.440 12.903 -3.938 1.00 0.00 H new ATOM 0 HG2 GLN A 60 104.817 14.623 -5.726 1.00 0.00 H new ATOM 0 HG3 GLN A 60 105.878 13.774 -6.832 1.00 0.00 H new ATOM 0 HE21 GLN A 60 102.771 13.594 -5.100 1.00 0.00 H new ATOM 0 HE22 GLN A 60 102.224 12.103 -5.875 1.00 0.00 H new ATOM 958 N ASP A 61 107.028 14.078 -1.921 1.00 0.00 N ATOM 959 CA ASP A 61 107.452 13.554 -0.629 1.00 0.00 C ATOM 960 C ASP A 61 106.783 12.204 -0.384 1.00 0.00 C ATOM 961 O ASP A 61 105.559 12.094 -0.448 1.00 0.00 O ATOM 962 CB ASP A 61 107.071 14.529 0.487 1.00 0.00 C ATOM 963 CG ASP A 61 107.800 15.858 0.308 1.00 0.00 C ATOM 964 OD1 ASP A 61 108.908 15.847 -0.203 1.00 0.00 O ATOM 965 OD2 ASP A 61 107.236 16.873 0.686 1.00 0.00 O ATOM 0 H ASP A 61 106.185 14.652 -1.893 1.00 0.00 H new ATOM 0 HA ASP A 61 108.535 13.430 -0.633 1.00 0.00 H new ATOM 0 HB2 ASP A 61 105.994 14.695 0.481 1.00 0.00 H new ATOM 0 HB3 ASP A 61 107.322 14.098 1.456 1.00 0.00 H new ATOM 970 N ILE A 62 107.583 11.175 -0.109 1.00 0.00 N ATOM 971 CA ILE A 62 107.048 9.824 0.071 1.00 0.00 C ATOM 972 C ILE A 62 107.503 9.243 1.412 1.00 0.00 C ATOM 973 O ILE A 62 108.610 9.530 1.867 1.00 0.00 O ATOM 974 CB ILE A 62 107.491 8.948 -1.111 1.00 0.00 C ATOM 975 CG1 ILE A 62 106.732 7.618 -1.072 1.00 0.00 C ATOM 976 CG2 ILE A 62 109.001 8.684 -1.078 1.00 0.00 C ATOM 977 CD1 ILE A 62 105.261 7.849 -1.438 1.00 0.00 C ATOM 0 H ILE A 62 108.595 11.248 -0.006 1.00 0.00 H new ATOM 0 HA ILE A 62 105.959 9.855 0.089 1.00 0.00 H new ATOM 0 HB ILE A 62 107.264 9.480 -2.035 1.00 0.00 H new ATOM 0 HG12 ILE A 62 107.183 6.911 -1.768 1.00 0.00 H new ATOM 0 HG13 ILE A 62 106.804 7.177 -0.078 1.00 0.00 H new ATOM 0 HG21 ILE A 62 109.280 8.061 -1.928 1.00 0.00 H new ATOM 0 HG22 ILE A 62 109.537 9.632 -1.130 1.00 0.00 H new ATOM 0 HG23 ILE A 62 109.261 8.171 -0.152 1.00 0.00 H new ATOM 0 HD11 ILE A 62 104.725 6.900 -1.409 1.00 0.00 H new ATOM 0 HD12 ILE A 62 104.813 8.541 -0.725 1.00 0.00 H new ATOM 0 HD13 ILE A 62 105.198 8.271 -2.441 1.00 0.00 H new ATOM 989 N SER A 63 106.661 8.417 2.034 1.00 0.00 N ATOM 990 CA SER A 63 106.961 7.930 3.379 1.00 0.00 C ATOM 991 C SER A 63 106.374 6.547 3.643 1.00 0.00 C ATOM 992 O SER A 63 105.458 6.088 2.956 1.00 0.00 O ATOM 993 CB SER A 63 106.421 8.914 4.417 1.00 0.00 C ATOM 994 OG SER A 63 105.003 8.834 4.444 1.00 0.00 O ATOM 0 H SER A 63 105.784 8.077 1.638 1.00 0.00 H new ATOM 0 HA SER A 63 108.045 7.849 3.457 1.00 0.00 H new ATOM 0 HB2 SER A 63 106.829 8.683 5.401 1.00 0.00 H new ATOM 0 HB3 SER A 63 106.735 9.929 4.172 1.00 0.00 H new ATOM 0 HG SER A 63 104.657 8.840 3.527 1.00 0.00 H new ATOM 1000 N GLU A 64 106.905 5.896 4.674 1.00 0.00 N ATOM 1001 CA GLU A 64 106.444 4.570 5.063 1.00 0.00 C ATOM 1002 C GLU A 64 104.939 4.558 5.328 1.00 0.00 C ATOM 1003 O GLU A 64 104.262 3.581 5.017 1.00 0.00 O ATOM 1004 CB GLU A 64 107.195 4.113 6.318 1.00 0.00 C ATOM 1005 CG GLU A 64 106.934 5.086 7.474 1.00 0.00 C ATOM 1006 CD GLU A 64 107.759 4.733 8.717 1.00 0.00 C ATOM 1007 OE1 GLU A 64 108.418 3.703 8.725 1.00 0.00 O ATOM 1008 OE2 GLU A 64 107.715 5.509 9.657 1.00 0.00 O ATOM 0 H GLU A 64 107.656 6.267 5.255 1.00 0.00 H new ATOM 0 HA GLU A 64 106.646 3.885 4.240 1.00 0.00 H new ATOM 0 HB2 GLU A 64 106.874 3.110 6.598 1.00 0.00 H new ATOM 0 HB3 GLU A 64 108.264 4.060 6.112 1.00 0.00 H new ATOM 0 HG2 GLU A 64 107.174 6.100 7.156 1.00 0.00 H new ATOM 0 HG3 GLU A 64 105.874 5.073 7.727 1.00 0.00 H new ATOM 1015 N ALA A 65 104.413 5.651 5.874 1.00 0.00 N ATOM 1016 CA ALA A 65 103.000 5.703 6.235 1.00 0.00 C ATOM 1017 C ALA A 65 102.112 5.467 5.017 1.00 0.00 C ATOM 1018 O ALA A 65 101.136 4.720 5.089 1.00 0.00 O ATOM 1019 CB ALA A 65 102.667 7.065 6.848 1.00 0.00 C ATOM 0 H ALA A 65 104.937 6.503 6.074 1.00 0.00 H new ATOM 0 HA ALA A 65 102.810 4.914 6.963 1.00 0.00 H new ATOM 0 HB1 ALA A 65 101.611 7.096 7.115 1.00 0.00 H new ATOM 0 HB2 ALA A 65 103.271 7.219 7.742 1.00 0.00 H new ATOM 0 HB3 ALA A 65 102.882 7.852 6.125 1.00 0.00 H new ATOM 1025 N ASN A 66 102.452 6.104 3.901 1.00 0.00 N ATOM 1026 CA ASN A 66 101.623 6.010 2.703 1.00 0.00 C ATOM 1027 C ASN A 66 101.676 4.608 2.102 1.00 0.00 C ATOM 1028 O ASN A 66 100.645 4.030 1.760 1.00 0.00 O ATOM 1029 CB ASN A 66 102.096 7.014 1.647 1.00 0.00 C ATOM 1030 CG ASN A 66 102.195 8.420 2.234 1.00 0.00 C ATOM 1031 OD1 ASN A 66 103.276 8.850 2.634 1.00 0.00 O ATOM 1032 ND2 ASN A 66 101.129 9.168 2.300 1.00 0.00 N ATOM 0 H ASN A 66 103.285 6.684 3.800 1.00 0.00 H new ATOM 0 HA ASN A 66 100.598 6.234 2.998 1.00 0.00 H new ATOM 0 HB2 ASN A 66 103.068 6.709 1.259 1.00 0.00 H new ATOM 0 HB3 ASN A 66 101.403 7.015 0.805 1.00 0.00 H new ATOM 0 HD21 ASN A 66 101.191 10.111 2.684 1.00 0.00 H new ATOM 0 HD22 ASN A 66 100.233 8.810 1.968 1.00 0.00 H new ATOM 1039 N LEU A 67 102.884 4.067 1.979 1.00 0.00 N ATOM 1040 CA LEU A 67 103.069 2.767 1.335 1.00 0.00 C ATOM 1041 C LEU A 67 102.598 1.601 2.205 1.00 0.00 C ATOM 1042 O LEU A 67 102.242 0.547 1.679 1.00 0.00 O ATOM 1043 CB LEU A 67 104.540 2.569 0.957 1.00 0.00 C ATOM 1044 CG LEU A 67 104.840 3.334 -0.336 1.00 0.00 C ATOM 1045 CD1 LEU A 67 104.916 4.833 -0.037 1.00 0.00 C ATOM 1046 CD2 LEU A 67 106.172 2.858 -0.929 1.00 0.00 C ATOM 0 H LEU A 67 103.744 4.502 2.313 1.00 0.00 H new ATOM 0 HA LEU A 67 102.450 2.770 0.438 1.00 0.00 H new ATOM 0 HB2 LEU A 67 105.185 2.924 1.761 1.00 0.00 H new ATOM 0 HB3 LEU A 67 104.753 1.508 0.823 1.00 0.00 H new ATOM 0 HG LEU A 67 104.043 3.147 -1.056 1.00 0.00 H new ATOM 0 HD11 LEU A 67 105.129 5.377 -0.957 1.00 0.00 H new ATOM 0 HD12 LEU A 67 103.964 5.171 0.372 1.00 0.00 H new ATOM 0 HD13 LEU A 67 105.709 5.020 0.687 1.00 0.00 H new ATOM 0 HD21 LEU A 67 106.378 3.407 -1.848 1.00 0.00 H new ATOM 0 HD22 LEU A 67 106.974 3.036 -0.212 1.00 0.00 H new ATOM 0 HD23 LEU A 67 106.112 1.792 -1.149 1.00 0.00 H new ATOM 1058 N ALA A 68 102.610 1.776 3.528 1.00 0.00 N ATOM 1059 CA ALA A 68 102.252 0.701 4.455 1.00 0.00 C ATOM 1060 C ALA A 68 103.360 -0.365 4.437 1.00 0.00 C ATOM 1061 O ALA A 68 104.523 -0.011 4.243 1.00 0.00 O ATOM 1062 CB ALA A 68 100.862 0.136 4.108 1.00 0.00 C ATOM 0 H ALA A 68 102.864 2.653 3.982 1.00 0.00 H new ATOM 0 HA ALA A 68 102.179 1.082 5.473 1.00 0.00 H new ATOM 0 HB1 ALA A 68 100.609 -0.662 4.806 1.00 0.00 H new ATOM 0 HB2 ALA A 68 100.118 0.930 4.180 1.00 0.00 H new ATOM 0 HB3 ALA A 68 100.873 -0.260 3.092 1.00 0.00 H new ATOM 1068 N TYR A 69 103.038 -1.652 4.603 1.00 0.00 N ATOM 1069 CA TYR A 69 104.071 -2.691 4.660 1.00 0.00 C ATOM 1070 C TYR A 69 104.973 -2.690 3.418 1.00 0.00 C ATOM 1071 O TYR A 69 106.083 -3.223 3.456 1.00 0.00 O ATOM 1072 CB TYR A 69 103.412 -4.063 4.803 1.00 0.00 C ATOM 1073 CG TYR A 69 102.600 -4.210 6.068 1.00 0.00 C ATOM 1074 CD1 TYR A 69 103.238 -4.504 7.279 1.00 0.00 C ATOM 1075 CD2 TYR A 69 101.209 -4.055 6.030 1.00 0.00 C ATOM 1076 CE1 TYR A 69 102.485 -4.641 8.452 1.00 0.00 C ATOM 1077 CE2 TYR A 69 100.456 -4.192 7.202 1.00 0.00 C ATOM 1078 CZ TYR A 69 101.094 -4.485 8.413 1.00 0.00 C ATOM 1079 OH TYR A 69 100.351 -4.619 9.569 1.00 0.00 O ATOM 0 H TYR A 69 102.083 -1.996 4.699 1.00 0.00 H new ATOM 0 HA TYR A 69 104.699 -2.475 5.525 1.00 0.00 H new ATOM 0 HB2 TYR A 69 102.766 -4.239 3.943 1.00 0.00 H new ATOM 0 HB3 TYR A 69 104.184 -4.832 4.784 1.00 0.00 H new ATOM 0 HD1 TYR A 69 104.311 -4.625 7.309 1.00 0.00 H new ATOM 0 HD2 TYR A 69 100.717 -3.830 5.096 1.00 0.00 H new ATOM 0 HE1 TYR A 69 102.977 -4.867 9.386 1.00 0.00 H new ATOM 0 HE2 TYR A 69 99.383 -4.072 7.172 1.00 0.00 H new ATOM 0 HH TYR A 69 99.402 -4.479 9.366 1.00 0.00 H new ATOM 1089 N LEU A 70 104.503 -2.099 2.322 1.00 0.00 N ATOM 1090 CA LEU A 70 105.270 -2.057 1.077 1.00 0.00 C ATOM 1091 C LEU A 70 106.623 -1.353 1.254 1.00 0.00 C ATOM 1092 O LEU A 70 107.560 -1.615 0.501 1.00 0.00 O ATOM 1093 CB LEU A 70 104.461 -1.333 -0.013 1.00 0.00 C ATOM 1094 CG LEU A 70 103.463 -2.271 -0.720 1.00 0.00 C ATOM 1095 CD1 LEU A 70 104.216 -3.336 -1.521 1.00 0.00 C ATOM 1096 CD2 LEU A 70 102.533 -2.953 0.291 1.00 0.00 C ATOM 0 H LEU A 70 103.593 -1.641 2.270 1.00 0.00 H new ATOM 0 HA LEU A 70 105.464 -3.088 0.782 1.00 0.00 H new ATOM 0 HB2 LEU A 70 103.919 -0.499 0.433 1.00 0.00 H new ATOM 0 HB3 LEU A 70 105.144 -0.911 -0.750 1.00 0.00 H new ATOM 0 HG LEU A 70 102.857 -1.667 -1.395 1.00 0.00 H new ATOM 0 HD11 LEU A 70 103.500 -3.993 -2.016 1.00 0.00 H new ATOM 0 HD12 LEU A 70 104.843 -2.852 -2.270 1.00 0.00 H new ATOM 0 HD13 LEU A 70 104.842 -3.923 -0.848 1.00 0.00 H new ATOM 0 HD21 LEU A 70 101.840 -3.608 -0.237 1.00 0.00 H new ATOM 0 HD22 LEU A 70 103.126 -3.541 0.992 1.00 0.00 H new ATOM 0 HD23 LEU A 70 101.971 -2.195 0.837 1.00 0.00 H new ATOM 1108 N TRP A 71 106.727 -0.467 2.241 1.00 0.00 N ATOM 1109 CA TRP A 71 107.940 0.320 2.438 1.00 0.00 C ATOM 1110 C TRP A 71 109.162 -0.600 2.590 1.00 0.00 C ATOM 1111 O TRP A 71 109.260 -1.301 3.599 1.00 0.00 O ATOM 1112 CB TRP A 71 107.792 1.156 3.708 1.00 0.00 C ATOM 1113 CG TRP A 71 108.755 2.297 3.786 1.00 0.00 C ATOM 1114 CD1 TRP A 71 109.720 2.430 4.721 1.00 0.00 C ATOM 1115 CD2 TRP A 71 108.866 3.459 2.913 1.00 0.00 C ATOM 1116 NE1 TRP A 71 110.405 3.608 4.490 1.00 0.00 N ATOM 1117 CE2 TRP A 71 109.923 4.275 3.383 1.00 0.00 C ATOM 1118 CE3 TRP A 71 108.160 3.882 1.775 1.00 0.00 C ATOM 1119 CZ2 TRP A 71 110.266 5.471 2.743 1.00 0.00 C ATOM 1120 CZ3 TRP A 71 108.501 5.080 1.129 1.00 0.00 C ATOM 1121 CH2 TRP A 71 109.551 5.872 1.610 1.00 0.00 C ATOM 0 H TRP A 71 105.986 -0.276 2.916 1.00 0.00 H new ATOM 0 HA TRP A 71 108.085 0.964 1.571 1.00 0.00 H new ATOM 0 HB2 TRP A 71 106.775 1.545 3.761 1.00 0.00 H new ATOM 0 HB3 TRP A 71 107.933 0.512 4.576 1.00 0.00 H new ATOM 0 HD1 TRP A 71 109.923 1.731 5.518 1.00 0.00 H new ATOM 0 HE1 TRP A 71 111.175 3.944 5.069 1.00 0.00 H new ATOM 0 HE3 TRP A 71 107.348 3.280 1.394 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 111.075 6.079 3.120 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 107.950 5.393 0.255 1.00 0.00 H new ATOM 0 HH2 TRP A 71 109.808 6.792 1.106 1.00 0.00 H new ATOM 1132 N PRO A 72 110.090 -0.630 1.653 1.00 0.00 N ATOM 1133 CA PRO A 72 111.263 -1.552 1.734 1.00 0.00 C ATOM 1134 C PRO A 72 112.473 -0.961 2.460 1.00 0.00 C ATOM 1135 O PRO A 72 113.416 -1.686 2.776 1.00 0.00 O ATOM 1136 CB PRO A 72 111.594 -1.809 0.265 1.00 0.00 C ATOM 1137 CG PRO A 72 111.232 -0.545 -0.441 1.00 0.00 C ATOM 1138 CD PRO A 72 110.167 0.156 0.404 1.00 0.00 C ATOM 0 HA PRO A 72 111.025 -2.445 2.313 1.00 0.00 H new ATOM 0 HB2 PRO A 72 112.650 -2.045 0.134 1.00 0.00 H new ATOM 0 HB3 PRO A 72 111.027 -2.655 -0.125 1.00 0.00 H new ATOM 0 HG2 PRO A 72 112.108 0.092 -0.562 1.00 0.00 H new ATOM 0 HG3 PRO A 72 110.852 -0.758 -1.440 1.00 0.00 H new ATOM 0 HD2 PRO A 72 110.442 1.191 0.606 1.00 0.00 H new ATOM 0 HD3 PRO A 72 109.206 0.176 -0.110 1.00 0.00 H new ATOM 1146 N LEU A 73 112.472 0.349 2.694 1.00 0.00 N ATOM 1147 CA LEU A 73 113.635 1.009 3.284 1.00 0.00 C ATOM 1148 C LEU A 73 113.557 1.048 4.806 1.00 0.00 C ATOM 1149 O LEU A 73 112.478 1.173 5.386 1.00 0.00 O ATOM 1150 CB LEU A 73 113.744 2.443 2.767 1.00 0.00 C ATOM 1151 CG LEU A 73 113.826 2.449 1.240 1.00 0.00 C ATOM 1152 CD1 LEU A 73 113.827 3.900 0.758 1.00 0.00 C ATOM 1153 CD2 LEU A 73 115.117 1.760 0.789 1.00 0.00 C ATOM 0 H LEU A 73 111.689 0.969 2.487 1.00 0.00 H new ATOM 0 HA LEU A 73 114.512 0.430 2.994 1.00 0.00 H new ATOM 0 HB2 LEU A 73 112.880 3.022 3.094 1.00 0.00 H new ATOM 0 HB3 LEU A 73 114.628 2.923 3.188 1.00 0.00 H new ATOM 0 HG LEU A 73 112.974 1.915 0.821 1.00 0.00 H new ATOM 0 HD11 LEU A 73 113.885 3.922 -0.330 1.00 0.00 H new ATOM 0 HD12 LEU A 73 112.910 4.392 1.082 1.00 0.00 H new ATOM 0 HD13 LEU A 73 114.687 4.422 1.178 1.00 0.00 H new ATOM 0 HD21 LEU A 73 115.172 1.766 -0.300 1.00 0.00 H new ATOM 0 HD22 LEU A 73 115.976 2.292 1.199 1.00 0.00 H new ATOM 0 HD23 LEU A 73 115.124 0.730 1.147 1.00 0.00 H new ATOM 1165 N THR A 74 114.719 0.938 5.439 1.00 0.00 N ATOM 1166 CA THR A 74 114.825 1.079 6.885 1.00 0.00 C ATOM 1167 C THR A 74 114.578 2.527 7.302 1.00 0.00 C ATOM 1168 O THR A 74 113.965 2.777 8.340 1.00 0.00 O ATOM 1169 CB THR A 74 116.212 0.640 7.358 1.00 0.00 C ATOM 1170 OG1 THR A 74 117.196 1.487 6.782 1.00 0.00 O ATOM 1171 CG2 THR A 74 116.469 -0.808 6.935 1.00 0.00 C ATOM 0 H THR A 74 115.605 0.751 4.970 1.00 0.00 H new ATOM 0 HA THR A 74 114.069 0.444 7.347 1.00 0.00 H new ATOM 0 HB THR A 74 116.262 0.709 8.445 1.00 0.00 H new ATOM 0 HG1 THR A 74 117.302 1.267 5.833 1.00 0.00 H new ATOM 0 HG21 THR A 74 117.458 -1.116 7.274 1.00 0.00 H new ATOM 0 HG22 THR A 74 115.714 -1.456 7.380 1.00 0.00 H new ATOM 0 HG23 THR A 74 116.418 -0.884 5.849 1.00 0.00 H new ATOM 1179 N VAL A 75 115.056 3.480 6.497 1.00 0.00 N ATOM 1180 CA VAL A 75 114.771 4.886 6.767 1.00 0.00 C ATOM 1181 C VAL A 75 113.270 5.102 6.644 1.00 0.00 C ATOM 1182 O VAL A 75 112.664 4.702 5.655 1.00 0.00 O ATOM 1183 CB VAL A 75 115.528 5.813 5.807 1.00 0.00 C ATOM 1184 CG1 VAL A 75 117.025 5.742 6.111 1.00 0.00 C ATOM 1185 CG2 VAL A 75 115.291 5.401 4.350 1.00 0.00 C ATOM 0 H VAL A 75 115.629 3.307 5.671 1.00 0.00 H new ATOM 0 HA VAL A 75 115.108 5.131 7.774 1.00 0.00 H new ATOM 0 HB VAL A 75 115.162 6.830 5.947 1.00 0.00 H new ATOM 0 HG11 VAL A 75 117.566 6.400 5.431 1.00 0.00 H new ATOM 0 HG12 VAL A 75 117.203 6.058 7.139 1.00 0.00 H new ATOM 0 HG13 VAL A 75 117.375 4.718 5.980 1.00 0.00 H new ATOM 0 HG21 VAL A 75 115.838 6.073 3.688 1.00 0.00 H new ATOM 0 HG22 VAL A 75 115.640 4.380 4.199 1.00 0.00 H new ATOM 0 HG23 VAL A 75 114.226 5.457 4.125 1.00 0.00 H new ATOM 1195 N ASP A 76 112.669 5.712 7.657 1.00 0.00 N ATOM 1196 CA ASP A 76 111.214 5.757 7.741 1.00 0.00 C ATOM 1197 C ASP A 76 110.595 6.494 6.560 1.00 0.00 C ATOM 1198 O ASP A 76 109.495 6.149 6.129 1.00 0.00 O ATOM 1199 CB ASP A 76 110.779 6.417 9.052 1.00 0.00 C ATOM 1200 CG ASP A 76 111.221 5.574 10.247 1.00 0.00 C ATOM 1201 OD1 ASP A 76 111.286 4.362 10.110 1.00 0.00 O ATOM 1202 OD2 ASP A 76 111.478 6.154 11.289 1.00 0.00 O ATOM 0 H ASP A 76 113.157 6.177 8.422 1.00 0.00 H new ATOM 0 HA ASP A 76 110.856 4.728 7.714 1.00 0.00 H new ATOM 0 HB2 ASP A 76 111.210 7.415 9.124 1.00 0.00 H new ATOM 0 HB3 ASP A 76 109.696 6.536 9.064 1.00 0.00 H new ATOM 1207 N HIS A 77 111.280 7.516 6.056 1.00 0.00 N ATOM 1208 CA HIS A 77 110.755 8.266 4.922 1.00 0.00 C ATOM 1209 C HIS A 77 111.889 8.766 4.044 1.00 0.00 C ATOM 1210 O HIS A 77 113.060 8.548 4.346 1.00 0.00 O ATOM 1211 CB HIS A 77 109.901 9.438 5.410 1.00 0.00 C ATOM 1212 CG HIS A 77 110.609 10.348 6.375 1.00 0.00 C ATOM 1213 ND1 HIS A 77 111.106 9.898 7.588 1.00 0.00 N ATOM 1214 CD2 HIS A 77 110.893 11.690 6.328 1.00 0.00 C ATOM 1215 CE1 HIS A 77 111.658 10.951 8.215 1.00 0.00 C ATOM 1216 NE2 HIS A 77 111.556 12.069 7.493 1.00 0.00 N ATOM 0 H HIS A 77 112.182 7.839 6.407 1.00 0.00 H new ATOM 0 HA HIS A 77 110.127 7.602 4.328 1.00 0.00 H new ATOM 0 HB2 HIS A 77 109.575 10.021 4.548 1.00 0.00 H new ATOM 0 HB3 HIS A 77 109.003 9.046 5.888 1.00 0.00 H new ATOM 0 HD2 HIS A 77 110.641 12.351 5.512 1.00 0.00 H new ATOM 0 HE1 HIS A 77 112.128 10.899 9.186 1.00 0.00 H new ATOM 0 HE2 HIS A 77 111.891 13.000 7.741 1.00 0.00 H new ATOM 1224 N GLY A 78 111.523 9.372 2.922 1.00 0.00 N ATOM 1225 CA GLY A 78 112.494 9.979 2.027 1.00 0.00 C ATOM 1226 C GLY A 78 111.773 10.767 0.941 1.00 0.00 C ATOM 1227 O GLY A 78 110.574 10.592 0.716 1.00 0.00 O ATOM 0 H GLY A 78 110.555 9.455 2.611 1.00 0.00 H new ATOM 0 HA2 GLY A 78 113.157 10.638 2.588 1.00 0.00 H new ATOM 0 HA3 GLY A 78 113.118 9.208 1.576 1.00 0.00 H new ATOM 1231 N THR A 79 112.500 11.661 0.285 1.00 0.00 N ATOM 1232 CA THR A 79 111.926 12.457 -0.795 1.00 0.00 C ATOM 1233 C THR A 79 112.452 11.967 -2.139 1.00 0.00 C ATOM 1234 O THR A 79 113.627 11.639 -2.267 1.00 0.00 O ATOM 1235 CB THR A 79 112.286 13.930 -0.602 1.00 0.00 C ATOM 1236 OG1 THR A 79 112.152 14.269 0.771 1.00 0.00 O ATOM 1237 CG2 THR A 79 111.324 14.782 -1.430 1.00 0.00 C ATOM 0 H THR A 79 113.483 11.854 0.479 1.00 0.00 H new ATOM 0 HA THR A 79 110.841 12.349 -0.778 1.00 0.00 H new ATOM 0 HB THR A 79 113.313 14.109 -0.922 1.00 0.00 H new ATOM 0 HG1 THR A 79 112.384 15.213 0.899 1.00 0.00 H new ATOM 0 HG21 THR A 79 111.569 15.836 -1.302 1.00 0.00 H new ATOM 0 HG22 THR A 79 111.414 14.514 -2.483 1.00 0.00 H new ATOM 0 HG23 THR A 79 110.302 14.604 -1.097 1.00 0.00 H new ATOM 1245 N ILE A 80 111.580 11.914 -3.140 1.00 0.00 N ATOM 1246 CA ILE A 80 111.972 11.446 -4.468 1.00 0.00 C ATOM 1247 C ILE A 80 112.023 12.616 -5.441 1.00 0.00 C ATOM 1248 O ILE A 80 111.131 13.465 -5.445 1.00 0.00 O ATOM 1249 CB ILE A 80 110.984 10.387 -4.971 1.00 0.00 C ATOM 1250 CG1 ILE A 80 109.550 10.933 -4.937 1.00 0.00 C ATOM 1251 CG2 ILE A 80 111.086 9.151 -4.076 1.00 0.00 C ATOM 1252 CD1 ILE A 80 108.591 9.920 -5.566 1.00 0.00 C ATOM 0 H ILE A 80 110.601 12.188 -3.060 1.00 0.00 H new ATOM 0 HA ILE A 80 112.963 10.997 -4.402 1.00 0.00 H new ATOM 0 HB ILE A 80 111.230 10.125 -6.000 1.00 0.00 H new ATOM 0 HG12 ILE A 80 109.254 11.137 -3.908 1.00 0.00 H new ATOM 0 HG13 ILE A 80 109.499 11.879 -5.477 1.00 0.00 H new ATOM 0 HG21 ILE A 80 110.387 8.391 -4.425 1.00 0.00 H new ATOM 0 HG22 ILE A 80 112.101 8.756 -4.115 1.00 0.00 H new ATOM 0 HG23 ILE A 80 110.842 9.424 -3.049 1.00 0.00 H new ATOM 0 HD11 ILE A 80 107.575 10.315 -5.538 1.00 0.00 H new ATOM 0 HD12 ILE A 80 108.881 9.738 -6.601 1.00 0.00 H new ATOM 0 HD13 ILE A 80 108.632 8.985 -5.008 1.00 0.00 H new ATOM 1264 N GLU A 81 113.075 12.665 -6.254 1.00 0.00 N ATOM 1265 CA GLU A 81 113.251 13.785 -7.170 1.00 0.00 C ATOM 1266 C GLU A 81 113.907 13.360 -8.480 1.00 0.00 C ATOM 1267 O GLU A 81 114.803 12.515 -8.504 1.00 0.00 O ATOM 1268 CB GLU A 81 114.101 14.867 -6.501 1.00 0.00 C ATOM 1269 CG GLU A 81 114.136 16.121 -7.384 1.00 0.00 C ATOM 1270 CD GLU A 81 115.048 17.207 -6.802 1.00 0.00 C ATOM 1271 OE1 GLU A 81 115.655 16.987 -5.764 1.00 0.00 O ATOM 1272 OE2 GLU A 81 115.127 18.259 -7.414 1.00 0.00 O ATOM 0 H GLU A 81 113.806 11.955 -6.297 1.00 0.00 H new ATOM 0 HA GLU A 81 112.261 14.174 -7.407 1.00 0.00 H new ATOM 0 HB2 GLU A 81 113.689 15.112 -5.522 1.00 0.00 H new ATOM 0 HB3 GLU A 81 115.113 14.498 -6.338 1.00 0.00 H new ATOM 0 HG2 GLU A 81 114.483 15.852 -8.382 1.00 0.00 H new ATOM 0 HG3 GLU A 81 113.126 16.516 -7.493 1.00 0.00 H new ATOM 1279 N CYS A 82 113.424 13.950 -9.566 1.00 0.00 N ATOM 1280 CA CYS A 82 114.065 13.807 -10.866 1.00 0.00 C ATOM 1281 C CYS A 82 114.835 15.085 -11.185 1.00 0.00 C ATOM 1282 O CYS A 82 114.246 16.161 -11.287 1.00 0.00 O ATOM 1283 CB CYS A 82 113.011 13.555 -11.947 1.00 0.00 C ATOM 1284 SG CYS A 82 112.424 11.847 -11.836 1.00 0.00 S ATOM 0 H CYS A 82 112.588 14.534 -9.572 1.00 0.00 H new ATOM 0 HA CYS A 82 114.750 12.960 -10.841 1.00 0.00 H new ATOM 0 HB2 CYS A 82 112.177 14.246 -11.824 1.00 0.00 H new ATOM 0 HB3 CYS A 82 113.436 13.741 -12.934 1.00 0.00 H new ATOM 1289 N LEU A 83 116.149 14.965 -11.342 1.00 0.00 N ATOM 1290 CA LEU A 83 116.989 16.142 -11.544 1.00 0.00 C ATOM 1291 C LEU A 83 116.963 16.592 -13.007 1.00 0.00 C ATOM 1292 O LEU A 83 116.740 15.768 -13.893 1.00 0.00 O ATOM 1293 CB LEU A 83 118.430 15.829 -11.134 1.00 0.00 C ATOM 1294 CG LEU A 83 118.468 15.437 -9.656 1.00 0.00 C ATOM 1295 CD1 LEU A 83 119.816 14.792 -9.332 1.00 0.00 C ATOM 1296 CD2 LEU A 83 118.281 16.687 -8.793 1.00 0.00 C ATOM 0 H LEU A 83 116.651 14.077 -11.334 1.00 0.00 H new ATOM 0 HA LEU A 83 116.596 16.949 -10.925 1.00 0.00 H new ATOM 0 HB2 LEU A 83 118.825 15.018 -11.746 1.00 0.00 H new ATOM 0 HB3 LEU A 83 119.065 16.698 -11.307 1.00 0.00 H new ATOM 0 HG LEU A 83 117.667 14.727 -9.448 1.00 0.00 H new ATOM 0 HD11 LEU A 83 119.842 14.513 -8.279 1.00 0.00 H new ATOM 0 HD12 LEU A 83 119.951 13.902 -9.947 1.00 0.00 H new ATOM 0 HD13 LEU A 83 120.618 15.501 -9.540 1.00 0.00 H new ATOM 0 HD21 LEU A 83 118.308 16.409 -7.739 1.00 0.00 H new ATOM 0 HD22 LEU A 83 119.082 17.396 -9.002 1.00 0.00 H new ATOM 0 HD23 LEU A 83 117.320 17.147 -9.022 1.00 0.00 H new ATOM 1308 N PRO A 84 117.195 17.858 -13.292 1.00 0.00 N ATOM 1309 CA PRO A 84 117.248 18.339 -14.712 1.00 0.00 C ATOM 1310 C PRO A 84 118.207 17.528 -15.590 1.00 0.00 C ATOM 1311 O PRO A 84 118.122 17.576 -16.817 1.00 0.00 O ATOM 1312 CB PRO A 84 117.720 19.792 -14.603 1.00 0.00 C ATOM 1313 CG PRO A 84 117.358 20.223 -13.225 1.00 0.00 C ATOM 1314 CD PRO A 84 117.429 18.973 -12.350 1.00 0.00 C ATOM 0 HA PRO A 84 116.276 18.232 -15.193 1.00 0.00 H new ATOM 0 HB2 PRO A 84 118.794 19.870 -14.769 1.00 0.00 H new ATOM 0 HB3 PRO A 84 117.236 20.420 -15.351 1.00 0.00 H new ATOM 0 HG2 PRO A 84 118.045 20.989 -12.865 1.00 0.00 H new ATOM 0 HG3 PRO A 84 116.358 20.656 -13.204 1.00 0.00 H new ATOM 0 HD2 PRO A 84 118.399 18.884 -11.860 1.00 0.00 H new ATOM 0 HD3 PRO A 84 116.675 18.994 -11.563 1.00 0.00 H new ATOM 1322 N SER A 85 119.116 16.784 -14.962 1.00 0.00 N ATOM 1323 CA SER A 85 120.096 15.980 -15.695 1.00 0.00 C ATOM 1324 C SER A 85 119.523 14.653 -16.214 1.00 0.00 C ATOM 1325 O SER A 85 120.270 13.845 -16.765 1.00 0.00 O ATOM 1326 CB SER A 85 121.292 15.687 -14.789 1.00 0.00 C ATOM 1327 OG SER A 85 121.948 16.907 -14.473 1.00 0.00 O ATOM 0 H SER A 85 119.195 16.720 -13.947 1.00 0.00 H new ATOM 0 HA SER A 85 120.396 16.564 -16.565 1.00 0.00 H new ATOM 0 HB2 SER A 85 120.960 15.192 -13.877 1.00 0.00 H new ATOM 0 HB3 SER A 85 121.983 15.007 -15.287 1.00 0.00 H new ATOM 0 HG SER A 85 122.715 16.725 -13.891 1.00 0.00 H new ATOM 1333 N ASP A 86 118.226 14.408 -16.011 1.00 0.00 N ATOM 1334 CA ASP A 86 117.592 13.163 -16.429 1.00 0.00 C ATOM 1335 C ASP A 86 118.193 11.985 -15.665 1.00 0.00 C ATOM 1336 O ASP A 86 118.601 10.983 -16.254 1.00 0.00 O ATOM 1337 CB ASP A 86 117.727 12.962 -17.945 1.00 0.00 C ATOM 1338 CG ASP A 86 117.074 14.120 -18.696 1.00 0.00 C ATOM 1339 OD1 ASP A 86 116.107 14.666 -18.189 1.00 0.00 O ATOM 1340 OD2 ASP A 86 117.552 14.446 -19.770 1.00 0.00 O ATOM 0 H ASP A 86 117.593 15.065 -15.555 1.00 0.00 H new ATOM 0 HA ASP A 86 116.529 13.219 -16.196 1.00 0.00 H new ATOM 0 HB2 ASP A 86 118.780 12.892 -18.217 1.00 0.00 H new ATOM 0 HB3 ASP A 86 117.260 12.021 -18.237 1.00 0.00 H new ATOM 1345 N ASN A 87 118.280 12.148 -14.347 1.00 0.00 N ATOM 1346 CA ASN A 87 118.711 11.077 -13.454 1.00 0.00 C ATOM 1347 C ASN A 87 117.722 10.957 -12.297 1.00 0.00 C ATOM 1348 O ASN A 87 117.329 11.964 -11.707 1.00 0.00 O ATOM 1349 CB ASN A 87 120.108 11.381 -12.907 1.00 0.00 C ATOM 1350 CG ASN A 87 121.125 11.411 -14.044 1.00 0.00 C ATOM 1351 OD1 ASN A 87 120.904 10.814 -15.098 1.00 0.00 O ATOM 1352 ND2 ASN A 87 122.238 12.077 -13.891 1.00 0.00 N ATOM 0 H ASN A 87 118.055 13.021 -13.871 1.00 0.00 H new ATOM 0 HA ASN A 87 118.744 10.138 -14.007 1.00 0.00 H new ATOM 0 HB2 ASN A 87 120.103 12.340 -12.389 1.00 0.00 H new ATOM 0 HB3 ASN A 87 120.392 10.625 -12.175 1.00 0.00 H new ATOM 0 HD21 ASN A 87 122.925 12.103 -14.645 1.00 0.00 H new ATOM 0 HD22 ASN A 87 122.421 12.571 -13.018 1.00 0.00 H new ATOM 1359 N ALA A 88 117.311 9.731 -11.986 1.00 0.00 N ATOM 1360 CA ALA A 88 116.349 9.513 -10.911 1.00 0.00 C ATOM 1361 C ALA A 88 117.064 9.143 -9.615 1.00 0.00 C ATOM 1362 O ALA A 88 117.757 8.123 -9.545 1.00 0.00 O ATOM 1363 CB ALA A 88 115.379 8.395 -11.297 1.00 0.00 C ATOM 0 H ALA A 88 117.625 8.882 -12.457 1.00 0.00 H new ATOM 0 HA ALA A 88 115.794 10.438 -10.754 1.00 0.00 H new ATOM 0 HB1 ALA A 88 114.664 8.238 -10.489 1.00 0.00 H new ATOM 0 HB2 ALA A 88 114.845 8.674 -12.205 1.00 0.00 H new ATOM 0 HB3 ALA A 88 115.936 7.474 -11.472 1.00 0.00 H new ATOM 1369 N VAL A 89 116.866 9.953 -8.574 1.00 0.00 N ATOM 1370 CA VAL A 89 117.539 9.723 -7.297 1.00 0.00 C ATOM 1371 C VAL A 89 116.565 9.797 -6.121 1.00 0.00 C ATOM 1372 O VAL A 89 115.518 10.445 -6.190 1.00 0.00 O ATOM 1373 CB VAL A 89 118.643 10.763 -7.094 1.00 0.00 C ATOM 1374 CG1 VAL A 89 119.691 10.621 -8.197 1.00 0.00 C ATOM 1375 CG2 VAL A 89 118.044 12.171 -7.143 1.00 0.00 C ATOM 0 H VAL A 89 116.251 10.767 -8.590 1.00 0.00 H new ATOM 0 HA VAL A 89 117.965 8.720 -7.329 1.00 0.00 H new ATOM 0 HB VAL A 89 119.111 10.602 -6.123 1.00 0.00 H new ATOM 0 HG11 VAL A 89 120.476 11.363 -8.050 1.00 0.00 H new ATOM 0 HG12 VAL A 89 120.124 9.622 -8.161 1.00 0.00 H new ATOM 0 HG13 VAL A 89 119.221 10.777 -9.168 1.00 0.00 H new ATOM 0 HG21 VAL A 89 118.834 12.908 -6.998 1.00 0.00 H new ATOM 0 HG22 VAL A 89 117.571 12.332 -8.112 1.00 0.00 H new ATOM 0 HG23 VAL A 89 117.299 12.277 -6.354 1.00 0.00 H new ATOM 1385 N PHE A 90 116.948 9.132 -5.037 1.00 0.00 N ATOM 1386 CA PHE A 90 116.180 9.116 -3.796 1.00 0.00 C ATOM 1387 C PHE A 90 116.966 9.819 -2.692 1.00 0.00 C ATOM 1388 O PHE A 90 118.139 9.527 -2.481 1.00 0.00 O ATOM 1389 CB PHE A 90 115.920 7.660 -3.404 1.00 0.00 C ATOM 1390 CG PHE A 90 115.234 7.469 -2.070 1.00 0.00 C ATOM 1391 CD1 PHE A 90 113.857 7.687 -1.946 1.00 0.00 C ATOM 1392 CD2 PHE A 90 115.979 7.051 -0.962 1.00 0.00 C ATOM 1393 CE1 PHE A 90 113.225 7.486 -0.713 1.00 0.00 C ATOM 1394 CE2 PHE A 90 115.348 6.851 0.272 1.00 0.00 C ATOM 1395 CZ PHE A 90 113.971 7.066 0.394 1.00 0.00 C ATOM 0 H PHE A 90 117.807 8.584 -4.994 1.00 0.00 H new ATOM 0 HA PHE A 90 115.233 9.638 -3.936 1.00 0.00 H new ATOM 0 HB2 PHE A 90 115.311 7.194 -4.179 1.00 0.00 H new ATOM 0 HB3 PHE A 90 116.872 7.129 -3.385 1.00 0.00 H new ATOM 0 HD1 PHE A 90 113.282 8.010 -2.801 1.00 0.00 H new ATOM 0 HD2 PHE A 90 117.041 6.882 -1.058 1.00 0.00 H new ATOM 0 HE1 PHE A 90 112.163 7.655 -0.616 1.00 0.00 H new ATOM 0 HE2 PHE A 90 115.923 6.531 1.128 1.00 0.00 H new ATOM 0 HZ PHE A 90 113.483 6.908 1.344 1.00 0.00 H new ATOM 1405 N VAL A 91 116.324 10.746 -1.992 1.00 0.00 N ATOM 1406 CA VAL A 91 116.985 11.484 -0.914 1.00 0.00 C ATOM 1407 C VAL A 91 116.416 11.042 0.428 1.00 0.00 C ATOM 1408 O VAL A 91 115.202 10.995 0.600 1.00 0.00 O ATOM 1409 CB VAL A 91 116.758 12.992 -1.096 1.00 0.00 C ATOM 1410 CG1 VAL A 91 117.484 13.798 -0.007 1.00 0.00 C ATOM 1411 CG2 VAL A 91 117.282 13.426 -2.468 1.00 0.00 C ATOM 0 H VAL A 91 115.350 11.007 -2.148 1.00 0.00 H new ATOM 0 HA VAL A 91 118.055 11.278 -0.943 1.00 0.00 H new ATOM 0 HB VAL A 91 115.688 13.186 -1.019 1.00 0.00 H new ATOM 0 HG11 VAL A 91 117.305 14.862 -0.162 1.00 0.00 H new ATOM 0 HG12 VAL A 91 117.108 13.506 0.973 1.00 0.00 H new ATOM 0 HG13 VAL A 91 118.554 13.599 -0.059 1.00 0.00 H new ATOM 0 HG21 VAL A 91 117.121 14.496 -2.597 1.00 0.00 H new ATOM 0 HG22 VAL A 91 118.348 13.209 -2.536 1.00 0.00 H new ATOM 0 HG23 VAL A 91 116.751 12.882 -3.249 1.00 0.00 H new ATOM 1421 N ALA A 92 117.293 10.743 1.381 1.00 0.00 N ATOM 1422 CA ALA A 92 116.838 10.330 2.710 1.00 0.00 C ATOM 1423 C ALA A 92 116.919 11.496 3.701 1.00 0.00 C ATOM 1424 O ALA A 92 117.710 12.413 3.496 1.00 0.00 O ATOM 1425 CB ALA A 92 117.697 9.169 3.216 1.00 0.00 C ATOM 0 H ALA A 92 118.306 10.777 1.265 1.00 0.00 H new ATOM 0 HA ALA A 92 115.799 10.011 2.632 1.00 0.00 H new ATOM 0 HB1 ALA A 92 117.353 8.866 4.205 1.00 0.00 H new ATOM 0 HB2 ALA A 92 117.612 8.327 2.529 1.00 0.00 H new ATOM 0 HB3 ALA A 92 118.738 9.486 3.275 1.00 0.00 H new ATOM 1431 N PRO A 93 116.135 11.493 4.761 1.00 0.00 N ATOM 1432 CA PRO A 93 116.175 12.598 5.769 1.00 0.00 C ATOM 1433 C PRO A 93 117.590 12.941 6.225 1.00 0.00 C ATOM 1434 O PRO A 93 117.863 14.074 6.622 1.00 0.00 O ATOM 1435 CB PRO A 93 115.352 12.071 6.949 1.00 0.00 C ATOM 1436 CG PRO A 93 114.441 11.039 6.382 1.00 0.00 C ATOM 1437 CD PRO A 93 115.105 10.493 5.119 1.00 0.00 C ATOM 0 HA PRO A 93 115.783 13.522 5.343 1.00 0.00 H new ATOM 0 HB2 PRO A 93 115.998 11.643 7.716 1.00 0.00 H new ATOM 0 HB3 PRO A 93 114.787 12.875 7.421 1.00 0.00 H new ATOM 0 HG2 PRO A 93 114.270 10.239 7.103 1.00 0.00 H new ATOM 0 HG3 PRO A 93 113.468 11.471 6.149 1.00 0.00 H new ATOM 0 HD2 PRO A 93 115.551 9.515 5.300 1.00 0.00 H new ATOM 0 HD3 PRO A 93 114.380 10.369 4.315 1.00 0.00 H new ATOM 1445 N ASP A 94 118.486 11.964 6.167 1.00 0.00 N ATOM 1446 CA ASP A 94 119.859 12.172 6.625 1.00 0.00 C ATOM 1447 C ASP A 94 120.614 13.218 5.790 1.00 0.00 C ATOM 1448 O ASP A 94 121.694 13.658 6.186 1.00 0.00 O ATOM 1449 CB ASP A 94 120.613 10.834 6.604 1.00 0.00 C ATOM 1450 CG ASP A 94 120.524 10.146 5.237 1.00 0.00 C ATOM 1451 OD1 ASP A 94 120.095 10.777 4.285 1.00 0.00 O ATOM 1452 OD2 ASP A 94 120.897 8.986 5.157 1.00 0.00 O ATOM 0 H ASP A 94 118.292 11.028 5.812 1.00 0.00 H new ATOM 0 HA ASP A 94 119.808 12.561 7.642 1.00 0.00 H new ATOM 0 HB2 ASP A 94 121.660 11.004 6.857 1.00 0.00 H new ATOM 0 HB3 ASP A 94 120.203 10.175 7.369 1.00 0.00 H new ATOM 1457 N GLY A 95 120.062 13.618 4.644 1.00 0.00 N ATOM 1458 CA GLY A 95 120.740 14.565 3.755 1.00 0.00 C ATOM 1459 C GLY A 95 121.653 13.875 2.732 1.00 0.00 C ATOM 1460 O GLY A 95 122.428 14.540 2.045 1.00 0.00 O ATOM 0 H GLY A 95 119.151 13.303 4.310 1.00 0.00 H new ATOM 0 HA2 GLY A 95 119.993 15.158 3.227 1.00 0.00 H new ATOM 0 HA3 GLY A 95 121.332 15.258 4.354 1.00 0.00 H new ATOM 1464 N THR A 96 121.565 12.550 2.627 1.00 0.00 N ATOM 1465 CA THR A 96 122.376 11.785 1.696 1.00 0.00 C ATOM 1466 C THR A 96 121.552 11.468 0.458 1.00 0.00 C ATOM 1467 O THR A 96 120.370 11.140 0.563 1.00 0.00 O ATOM 1468 CB THR A 96 122.815 10.477 2.357 1.00 0.00 C ATOM 1469 OG1 THR A 96 123.491 10.767 3.573 1.00 0.00 O ATOM 1470 CG2 THR A 96 123.750 9.704 1.423 1.00 0.00 C ATOM 0 H THR A 96 120.929 11.982 3.186 1.00 0.00 H new ATOM 0 HA THR A 96 123.255 12.365 1.416 1.00 0.00 H new ATOM 0 HB THR A 96 121.935 9.867 2.562 1.00 0.00 H new ATOM 0 HG1 THR A 96 123.772 9.930 3.999 1.00 0.00 H new ATOM 0 HG21 THR A 96 124.057 8.775 1.903 1.00 0.00 H new ATOM 0 HG22 THR A 96 123.229 9.477 0.493 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.631 10.309 1.208 1.00 0.00 H new ATOM 1478 N THR A 97 122.174 11.569 -0.711 1.00 0.00 N ATOM 1479 CA THR A 97 121.485 11.247 -1.953 1.00 0.00 C ATOM 1480 C THR A 97 121.917 9.872 -2.447 1.00 0.00 C ATOM 1481 O THR A 97 123.107 9.568 -2.532 1.00 0.00 O ATOM 1482 CB THR A 97 121.801 12.300 -3.017 1.00 0.00 C ATOM 1483 OG1 THR A 97 121.491 13.590 -2.509 1.00 0.00 O ATOM 1484 CG2 THR A 97 120.968 12.030 -4.271 1.00 0.00 C ATOM 0 H THR A 97 123.143 11.868 -0.824 1.00 0.00 H new ATOM 0 HA THR A 97 120.411 11.239 -1.767 1.00 0.00 H new ATOM 0 HB THR A 97 122.860 12.253 -3.272 1.00 0.00 H new ATOM 0 HG1 THR A 97 121.694 14.267 -3.188 1.00 0.00 H new ATOM 0 HG21 THR A 97 121.195 12.781 -5.027 1.00 0.00 H new ATOM 0 HG22 THR A 97 121.206 11.040 -4.660 1.00 0.00 H new ATOM 0 HG23 THR A 97 119.908 12.076 -4.021 1.00 0.00 H new ATOM 1492 N TYR A 98 120.929 9.050 -2.770 1.00 0.00 N ATOM 1493 CA TYR A 98 121.166 7.703 -3.268 1.00 0.00 C ATOM 1494 C TYR A 98 120.631 7.595 -4.692 1.00 0.00 C ATOM 1495 O TYR A 98 119.675 8.280 -5.047 1.00 0.00 O ATOM 1496 CB TYR A 98 120.442 6.691 -2.377 1.00 0.00 C ATOM 1497 CG TYR A 98 120.873 6.713 -0.926 1.00 0.00 C ATOM 1498 CD1 TYR A 98 121.959 5.936 -0.503 1.00 0.00 C ATOM 1499 CD2 TYR A 98 120.180 7.504 -0.001 1.00 0.00 C ATOM 1500 CE1 TYR A 98 122.350 5.951 0.842 1.00 0.00 C ATOM 1501 CE2 TYR A 98 120.572 7.520 1.344 1.00 0.00 C ATOM 1502 CZ TYR A 98 121.656 6.744 1.766 1.00 0.00 C ATOM 1503 OH TYR A 98 122.044 6.757 3.093 1.00 0.00 O ATOM 0 H TYR A 98 119.942 9.297 -2.694 1.00 0.00 H new ATOM 0 HA TYR A 98 122.236 7.493 -3.258 1.00 0.00 H new ATOM 0 HB2 TYR A 98 119.370 6.882 -2.428 1.00 0.00 H new ATOM 0 HB3 TYR A 98 120.606 5.690 -2.777 1.00 0.00 H new ATOM 0 HD1 TYR A 98 122.495 5.325 -1.214 1.00 0.00 H new ATOM 0 HD2 TYR A 98 119.342 8.103 -0.325 1.00 0.00 H new ATOM 0 HE1 TYR A 98 123.187 5.351 1.167 1.00 0.00 H new ATOM 0 HE2 TYR A 98 120.037 8.132 2.055 1.00 0.00 H new ATOM 0 HH TYR A 98 121.599 7.496 3.557 1.00 0.00 H new ATOM 1513 N ALA A 99 121.234 6.732 -5.500 1.00 0.00 N ATOM 1514 CA ALA A 99 120.795 6.561 -6.881 1.00 0.00 C ATOM 1515 C ALA A 99 119.681 5.522 -6.959 1.00 0.00 C ATOM 1516 O ALA A 99 119.842 4.391 -6.503 1.00 0.00 O ATOM 1517 CB ALA A 99 121.973 6.114 -7.751 1.00 0.00 C ATOM 0 H ALA A 99 122.022 6.144 -5.227 1.00 0.00 H new ATOM 0 HA ALA A 99 120.416 7.516 -7.246 1.00 0.00 H new ATOM 0 HB1 ALA A 99 121.638 5.988 -8.781 1.00 0.00 H new ATOM 0 HB2 ALA A 99 122.759 6.868 -7.715 1.00 0.00 H new ATOM 0 HB3 ALA A 99 122.362 5.167 -7.378 1.00 0.00 H new ATOM 1523 N LEU A 100 118.550 5.914 -7.541 1.00 0.00 N ATOM 1524 CA LEU A 100 117.430 4.996 -7.695 1.00 0.00 C ATOM 1525 C LEU A 100 117.671 4.086 -8.887 1.00 0.00 C ATOM 1526 O LEU A 100 117.499 2.870 -8.805 1.00 0.00 O ATOM 1527 CB LEU A 100 116.129 5.768 -7.921 1.00 0.00 C ATOM 1528 CG LEU A 100 115.571 6.254 -6.586 1.00 0.00 C ATOM 1529 CD1 LEU A 100 114.623 7.426 -6.839 1.00 0.00 C ATOM 1530 CD2 LEU A 100 114.798 5.113 -5.920 1.00 0.00 C ATOM 0 H LEU A 100 118.388 6.851 -7.909 1.00 0.00 H new ATOM 0 HA LEU A 100 117.345 4.405 -6.783 1.00 0.00 H new ATOM 0 HB2 LEU A 100 116.310 6.617 -8.579 1.00 0.00 H new ATOM 0 HB3 LEU A 100 115.399 5.129 -8.419 1.00 0.00 H new ATOM 0 HG LEU A 100 116.386 6.573 -5.937 1.00 0.00 H new ATOM 0 HD11 LEU A 100 114.220 7.779 -5.890 1.00 0.00 H new ATOM 0 HD12 LEU A 100 115.167 8.235 -7.326 1.00 0.00 H new ATOM 0 HD13 LEU A 100 113.805 7.100 -7.482 1.00 0.00 H new ATOM 0 HD21 LEU A 100 114.397 5.454 -4.966 1.00 0.00 H new ATOM 0 HD22 LEU A 100 113.978 4.802 -6.568 1.00 0.00 H new ATOM 0 HD23 LEU A 100 115.468 4.270 -5.752 1.00 0.00 H new ATOM 1542 N ASN A 101 118.073 4.696 -10.000 1.00 0.00 N ATOM 1543 CA ASN A 101 118.327 3.938 -11.227 1.00 0.00 C ATOM 1544 C ASN A 101 119.801 3.994 -11.620 1.00 0.00 C ATOM 1545 O ASN A 101 120.574 4.805 -11.107 1.00 0.00 O ATOM 1546 CB ASN A 101 117.445 4.468 -12.364 1.00 0.00 C ATOM 1547 CG ASN A 101 117.820 5.899 -12.744 1.00 0.00 C ATOM 1548 OD1 ASN A 101 118.780 6.461 -12.221 1.00 0.00 O ATOM 1549 ND2 ASN A 101 117.106 6.530 -13.635 1.00 0.00 N ATOM 0 H ASN A 101 118.229 5.701 -10.080 1.00 0.00 H new ATOM 0 HA ASN A 101 118.075 2.894 -11.040 1.00 0.00 H new ATOM 0 HB2 ASN A 101 117.545 3.821 -13.235 1.00 0.00 H new ATOM 0 HB3 ASN A 101 116.399 4.434 -12.060 1.00 0.00 H new ATOM 0 HD21 ASN A 101 117.345 7.487 -13.896 1.00 0.00 H new ATOM 0 HD22 ASN A 101 116.309 6.067 -14.071 1.00 0.00 H new ATOM 1556 N ASP A 102 120.185 3.119 -12.543 1.00 0.00 N ATOM 1557 CA ASP A 102 121.583 3.000 -12.947 1.00 0.00 C ATOM 1558 C ASP A 102 122.170 4.349 -13.357 1.00 0.00 C ATOM 1559 O ASP A 102 123.344 4.620 -13.116 1.00 0.00 O ATOM 1560 CB ASP A 102 121.703 2.019 -14.117 1.00 0.00 C ATOM 1561 CG ASP A 102 121.316 0.609 -13.677 1.00 0.00 C ATOM 1562 OD1 ASP A 102 121.521 0.286 -12.518 1.00 0.00 O ATOM 1563 OD2 ASP A 102 120.817 -0.130 -14.510 1.00 0.00 O ATOM 0 H ASP A 102 119.550 2.483 -13.025 1.00 0.00 H new ATOM 0 HA ASP A 102 122.145 2.632 -12.089 1.00 0.00 H new ATOM 0 HB2 ASP A 102 121.059 2.340 -14.936 1.00 0.00 H new ATOM 0 HB3 ASP A 102 122.725 2.020 -14.496 1.00 0.00 H new ATOM 1568 N ARG A 103 121.351 5.199 -13.966 1.00 0.00 N ATOM 1569 CA ARG A 103 121.826 6.483 -14.464 1.00 0.00 C ATOM 1570 C ARG A 103 122.368 7.339 -13.322 1.00 0.00 C ATOM 1571 O ARG A 103 123.486 7.853 -13.384 1.00 0.00 O ATOM 1572 CB ARG A 103 120.657 7.186 -15.155 1.00 0.00 C ATOM 1573 CG ARG A 103 120.255 6.373 -16.389 1.00 0.00 C ATOM 1574 CD ARG A 103 118.961 6.935 -16.977 1.00 0.00 C ATOM 1575 NE ARG A 103 119.179 8.293 -17.471 1.00 0.00 N ATOM 1576 CZ ARG A 103 119.714 8.577 -18.663 1.00 0.00 C ATOM 1577 NH1 ARG A 103 120.088 7.647 -19.506 1.00 0.00 N ATOM 1578 NH2 ARG A 103 119.861 9.833 -18.981 1.00 0.00 N ATOM 0 H ARG A 103 120.359 5.023 -14.126 1.00 0.00 H new ATOM 0 HA ARG A 103 122.641 6.329 -15.171 1.00 0.00 H new ATOM 0 HB2 ARG A 103 119.813 7.277 -14.471 1.00 0.00 H new ATOM 0 HB3 ARG A 103 120.942 8.197 -15.445 1.00 0.00 H new ATOM 0 HG2 ARG A 103 121.050 6.408 -17.134 1.00 0.00 H new ATOM 0 HG3 ARG A 103 120.118 5.326 -16.118 1.00 0.00 H new ATOM 0 HD2 ARG A 103 118.615 6.296 -17.789 1.00 0.00 H new ATOM 0 HD3 ARG A 103 118.179 6.938 -16.218 1.00 0.00 H new ATOM 0 HE ARG A 103 118.907 9.071 -16.870 1.00 0.00 H new ATOM 0 HH11 ARG A 103 119.975 6.663 -19.263 1.00 0.00 H new ATOM 0 HH12 ARG A 103 120.492 7.907 -20.406 1.00 0.00 H new ATOM 0 HH21 ARG A 103 119.571 10.562 -18.329 1.00 0.00 H new ATOM 0 HH22 ARG A 103 120.266 10.087 -19.882 1.00 0.00 H new ATOM 1592 N ALA A 104 121.590 7.448 -12.254 1.00 0.00 N ATOM 1593 CA ALA A 104 122.028 8.189 -11.073 1.00 0.00 C ATOM 1594 C ALA A 104 123.314 7.596 -10.500 1.00 0.00 C ATOM 1595 O ALA A 104 124.179 8.321 -10.002 1.00 0.00 O ATOM 1596 CB ALA A 104 120.934 8.155 -10.004 1.00 0.00 C ATOM 0 H ALA A 104 120.659 7.037 -12.178 1.00 0.00 H new ATOM 0 HA ALA A 104 122.222 9.219 -11.371 1.00 0.00 H new ATOM 0 HB1 ALA A 104 121.266 8.709 -9.126 1.00 0.00 H new ATOM 0 HB2 ALA A 104 120.026 8.611 -10.398 1.00 0.00 H new ATOM 0 HB3 ALA A 104 120.730 7.121 -9.725 1.00 0.00 H new ATOM 1602 N GLU A 105 123.429 6.271 -10.544 1.00 0.00 N ATOM 1603 CA GLU A 105 124.635 5.608 -10.060 1.00 0.00 C ATOM 1604 C GLU A 105 125.845 6.057 -10.878 1.00 0.00 C ATOM 1605 O GLU A 105 126.904 6.356 -10.330 1.00 0.00 O ATOM 1606 CB GLU A 105 124.472 4.090 -10.158 1.00 0.00 C ATOM 1607 CG GLU A 105 125.599 3.410 -9.373 1.00 0.00 C ATOM 1608 CD GLU A 105 125.554 1.883 -9.510 1.00 0.00 C ATOM 1609 OE1 GLU A 105 124.695 1.369 -10.211 1.00 0.00 O ATOM 1610 OE2 GLU A 105 126.395 1.242 -8.901 1.00 0.00 O ATOM 0 H GLU A 105 122.711 5.643 -10.905 1.00 0.00 H new ATOM 0 HA GLU A 105 124.793 5.881 -9.017 1.00 0.00 H new ATOM 0 HB2 GLU A 105 123.503 3.790 -9.760 1.00 0.00 H new ATOM 0 HB3 GLU A 105 124.499 3.776 -11.201 1.00 0.00 H new ATOM 0 HG2 GLU A 105 126.562 3.778 -9.728 1.00 0.00 H new ATOM 0 HG3 GLU A 105 125.523 3.682 -8.320 1.00 0.00 H new ATOM 1617 N LYS A 106 125.667 6.149 -12.191 1.00 0.00 N ATOM 1618 CA LYS A 106 126.722 6.649 -13.073 1.00 0.00 C ATOM 1619 C LYS A 106 127.153 8.064 -12.680 1.00 0.00 C ATOM 1620 O LYS A 106 128.321 8.429 -12.826 1.00 0.00 O ATOM 1621 CB LYS A 106 126.232 6.652 -14.523 1.00 0.00 C ATOM 1622 CG LYS A 106 127.422 6.854 -15.463 1.00 0.00 C ATOM 1623 CD LYS A 106 126.917 7.292 -16.840 1.00 0.00 C ATOM 1624 CE LYS A 106 126.221 6.117 -17.529 1.00 0.00 C ATOM 1625 NZ LYS A 106 126.245 6.321 -19.004 1.00 0.00 N ATOM 0 H LYS A 106 124.806 5.885 -12.670 1.00 0.00 H new ATOM 0 HA LYS A 106 127.582 5.987 -12.974 1.00 0.00 H new ATOM 0 HB2 LYS A 106 125.731 5.711 -14.751 1.00 0.00 H new ATOM 0 HB3 LYS A 106 125.500 7.447 -14.669 1.00 0.00 H new ATOM 0 HG2 LYS A 106 128.097 7.606 -15.055 1.00 0.00 H new ATOM 0 HG3 LYS A 106 127.991 5.929 -15.550 1.00 0.00 H new ATOM 0 HD2 LYS A 106 126.225 8.127 -16.736 1.00 0.00 H new ATOM 0 HD3 LYS A 106 127.750 7.642 -17.449 1.00 0.00 H new ATOM 0 HE2 LYS A 106 126.721 5.183 -17.272 1.00 0.00 H new ATOM 0 HE3 LYS A 106 125.192 6.034 -17.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 125.772 5.522 -19.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 125.749 7.204 -19.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 127.231 6.379 -19.330 1.00 0.00 H new ATOM 1639 N ALA A 107 126.206 8.856 -12.181 1.00 0.00 N ATOM 1640 CA ALA A 107 126.487 10.222 -11.733 1.00 0.00 C ATOM 1641 C ALA A 107 127.177 10.276 -10.362 1.00 0.00 C ATOM 1642 O ALA A 107 127.309 11.354 -9.781 1.00 0.00 O ATOM 1643 CB ALA A 107 125.181 11.016 -11.668 1.00 0.00 C ATOM 0 H ALA A 107 125.231 8.575 -12.076 1.00 0.00 H new ATOM 0 HA ALA A 107 127.174 10.658 -12.458 1.00 0.00 H new ATOM 0 HB1 ALA A 107 125.389 12.033 -11.335 1.00 0.00 H new ATOM 0 HB2 ALA A 107 124.723 11.045 -12.657 1.00 0.00 H new ATOM 0 HB3 ALA A 107 124.498 10.537 -10.966 1.00 0.00 H new ATOM 1649 N GLY A 108 127.615 9.131 -9.841 1.00 0.00 N ATOM 1650 CA GLY A 108 128.369 9.096 -8.592 1.00 0.00 C ATOM 1651 C GLY A 108 127.489 9.217 -7.349 1.00 0.00 C ATOM 1652 O GLY A 108 127.966 9.631 -6.292 1.00 0.00 O ATOM 0 H GLY A 108 127.460 8.216 -10.265 1.00 0.00 H new ATOM 0 HA2 GLY A 108 128.931 8.163 -8.541 1.00 0.00 H new ATOM 0 HA3 GLY A 108 129.097 9.907 -8.593 1.00 0.00 H new ATOM 1656 N HIS A 109 126.211 8.861 -7.469 1.00 0.00 N ATOM 1657 CA HIS A 109 125.352 8.763 -6.296 1.00 0.00 C ATOM 1658 C HIS A 109 125.276 7.297 -5.842 1.00 0.00 C ATOM 1659 O HIS A 109 124.696 6.486 -6.568 1.00 0.00 O ATOM 1660 CB HIS A 109 123.945 9.249 -6.654 1.00 0.00 C ATOM 1661 CG HIS A 109 123.868 10.734 -6.885 1.00 0.00 C ATOM 1662 ND1 HIS A 109 124.200 11.653 -5.904 1.00 0.00 N ATOM 1663 CD2 HIS A 109 123.496 11.474 -7.981 1.00 0.00 C ATOM 1664 CE1 HIS A 109 124.025 12.882 -6.423 1.00 0.00 C ATOM 1665 NE2 HIS A 109 123.596 12.830 -7.686 1.00 0.00 N ATOM 0 H HIS A 109 125.755 8.639 -8.354 1.00 0.00 H new ATOM 0 HA HIS A 109 125.761 9.377 -5.494 1.00 0.00 H new ATOM 0 HB2 HIS A 109 123.607 8.731 -7.551 1.00 0.00 H new ATOM 0 HB3 HIS A 109 123.259 8.977 -5.851 1.00 0.00 H new ATOM 0 HD2 HIS A 109 123.175 11.065 -8.928 1.00 0.00 H new ATOM 0 HE1 HIS A 109 124.209 13.799 -5.883 1.00 0.00 H new ATOM 0 HE2 HIS A 109 123.387 13.615 -8.302 1.00 0.00 H new ATOM 1673 N PRO A 110 125.822 6.920 -4.698 1.00 0.00 N ATOM 1674 CA PRO A 110 125.793 5.486 -4.261 1.00 0.00 C ATOM 1675 C PRO A 110 124.367 4.929 -4.245 1.00 0.00 C ATOM 1676 O PRO A 110 123.425 5.692 -4.041 1.00 0.00 O ATOM 1677 CB PRO A 110 126.386 5.497 -2.850 1.00 0.00 C ATOM 1678 CG PRO A 110 127.204 6.739 -2.778 1.00 0.00 C ATOM 1679 CD PRO A 110 126.532 7.749 -3.704 1.00 0.00 C ATOM 0 HA PRO A 110 126.352 4.847 -4.944 1.00 0.00 H new ATOM 0 HB2 PRO A 110 125.601 5.498 -2.093 1.00 0.00 H new ATOM 0 HB3 PRO A 110 126.998 4.612 -2.673 1.00 0.00 H new ATOM 0 HG2 PRO A 110 127.248 7.117 -1.757 1.00 0.00 H new ATOM 0 HG3 PRO A 110 128.230 6.547 -3.091 1.00 0.00 H new ATOM 0 HD2 PRO A 110 125.842 8.392 -3.157 1.00 0.00 H new ATOM 0 HD3 PRO A 110 127.265 8.400 -4.180 1.00 0.00 H new ATOM 1687 N PRO A 111 124.172 3.643 -4.458 1.00 0.00 N ATOM 1688 CA PRO A 111 122.793 3.062 -4.504 1.00 0.00 C ATOM 1689 C PRO A 111 122.117 3.053 -3.134 1.00 0.00 C ATOM 1690 O PRO A 111 122.784 3.116 -2.102 1.00 0.00 O ATOM 1691 CB PRO A 111 122.996 1.638 -5.028 1.00 0.00 C ATOM 1692 CG PRO A 111 124.408 1.287 -4.707 1.00 0.00 C ATOM 1693 CD PRO A 111 125.194 2.597 -4.674 1.00 0.00 C ATOM 0 HA PRO A 111 122.132 3.654 -5.137 1.00 0.00 H new ATOM 0 HB2 PRO A 111 122.303 0.944 -4.553 1.00 0.00 H new ATOM 0 HB3 PRO A 111 122.814 1.586 -6.101 1.00 0.00 H new ATOM 0 HG2 PRO A 111 124.470 0.775 -3.747 1.00 0.00 H new ATOM 0 HG3 PRO A 111 124.818 0.610 -5.456 1.00 0.00 H new ATOM 0 HD2 PRO A 111 125.934 2.595 -3.873 1.00 0.00 H new ATOM 0 HD3 PRO A 111 125.734 2.758 -5.607 1.00 0.00 H new ATOM 1701 N ILE A 112 120.787 2.975 -3.133 1.00 0.00 N ATOM 1702 CA ILE A 112 120.027 2.947 -1.881 1.00 0.00 C ATOM 1703 C ILE A 112 120.369 1.721 -1.017 1.00 0.00 C ATOM 1704 O ILE A 112 119.998 1.692 0.155 1.00 0.00 O ATOM 1705 CB ILE A 112 118.515 2.982 -2.172 1.00 0.00 C ATOM 1706 CG1 ILE A 112 118.188 4.236 -2.992 1.00 0.00 C ATOM 1707 CG2 ILE A 112 117.722 3.031 -0.856 1.00 0.00 C ATOM 1708 CD1 ILE A 112 116.739 4.192 -3.488 1.00 0.00 C ATOM 0 H ILE A 112 120.216 2.930 -3.977 1.00 0.00 H new ATOM 0 HA ILE A 112 120.310 3.834 -1.315 1.00 0.00 H new ATOM 0 HB ILE A 112 118.241 2.084 -2.726 1.00 0.00 H new ATOM 0 HG12 ILE A 112 118.343 5.126 -2.383 1.00 0.00 H new ATOM 0 HG13 ILE A 112 118.867 4.309 -3.842 1.00 0.00 H new ATOM 0 HG21 ILE A 112 116.655 3.055 -1.075 1.00 0.00 H new ATOM 0 HG22 ILE A 112 117.950 2.147 -0.261 1.00 0.00 H new ATOM 0 HG23 ILE A 112 117.998 3.925 -0.298 1.00 0.00 H new ATOM 0 HD11 ILE A 112 116.525 5.090 -4.068 1.00 0.00 H new ATOM 0 HD12 ILE A 112 116.596 3.312 -4.116 1.00 0.00 H new ATOM 0 HD13 ILE A 112 116.063 4.142 -2.634 1.00 0.00 H new ATOM 1720 N THR A 113 121.106 0.744 -1.552 1.00 0.00 N ATOM 1721 CA THR A 113 121.336 -0.518 -0.848 1.00 0.00 C ATOM 1722 C THR A 113 121.690 -0.390 0.646 1.00 0.00 C ATOM 1723 O THR A 113 121.172 -1.200 1.418 1.00 0.00 O ATOM 1724 CB THR A 113 122.351 -1.399 -1.599 1.00 0.00 C ATOM 1725 OG1 THR A 113 122.202 -2.742 -1.165 1.00 0.00 O ATOM 1726 CG2 THR A 113 123.801 -0.963 -1.365 1.00 0.00 C ATOM 0 H THR A 113 121.552 0.803 -2.467 1.00 0.00 H new ATOM 0 HA THR A 113 120.365 -1.013 -0.849 1.00 0.00 H new ATOM 0 HB THR A 113 122.146 -1.298 -2.665 1.00 0.00 H new ATOM 0 HG1 THR A 113 122.843 -3.312 -1.639 1.00 0.00 H new ATOM 0 HG21 THR A 113 124.472 -1.620 -1.919 1.00 0.00 H new ATOM 0 HG22 THR A 113 123.932 0.063 -1.708 1.00 0.00 H new ATOM 0 HG23 THR A 113 124.032 -1.022 -0.301 1.00 0.00 H new ATOM 1734 N PRO A 114 122.480 0.571 1.112 1.00 0.00 N ATOM 1735 CA PRO A 114 122.879 0.598 2.560 1.00 0.00 C ATOM 1736 C PRO A 114 121.673 0.675 3.497 1.00 0.00 C ATOM 1737 O PRO A 114 121.705 0.135 4.603 1.00 0.00 O ATOM 1738 CB PRO A 114 123.769 1.838 2.704 1.00 0.00 C ATOM 1739 CG PRO A 114 124.203 2.168 1.319 1.00 0.00 C ATOM 1740 CD PRO A 114 123.046 1.746 0.420 1.00 0.00 C ATOM 0 HA PRO A 114 123.396 -0.320 2.841 1.00 0.00 H new ATOM 0 HB2 PRO A 114 123.221 2.666 3.153 1.00 0.00 H new ATOM 0 HB3 PRO A 114 124.625 1.636 3.348 1.00 0.00 H new ATOM 0 HG2 PRO A 114 124.412 3.233 1.216 1.00 0.00 H new ATOM 0 HG3 PRO A 114 125.118 1.637 1.057 1.00 0.00 H new ATOM 0 HD2 PRO A 114 122.309 2.542 0.314 1.00 0.00 H new ATOM 0 HD3 PRO A 114 123.389 1.494 -0.583 1.00 0.00 H new ATOM 1748 N ILE A 115 120.611 1.344 3.054 1.00 0.00 N ATOM 1749 CA ILE A 115 119.394 1.475 3.866 1.00 0.00 C ATOM 1750 C ILE A 115 118.298 0.475 3.480 1.00 0.00 C ATOM 1751 O ILE A 115 117.184 0.575 3.987 1.00 0.00 O ATOM 1752 CB ILE A 115 118.819 2.898 3.789 1.00 0.00 C ATOM 1753 CG1 ILE A 115 118.699 3.362 2.329 1.00 0.00 C ATOM 1754 CG2 ILE A 115 119.714 3.864 4.567 1.00 0.00 C ATOM 1755 CD1 ILE A 115 117.884 4.660 2.242 1.00 0.00 C ATOM 0 H ILE A 115 120.564 1.803 2.144 1.00 0.00 H new ATOM 0 HA ILE A 115 119.705 1.255 4.887 1.00 0.00 H new ATOM 0 HB ILE A 115 117.823 2.890 4.231 1.00 0.00 H new ATOM 0 HG12 ILE A 115 119.692 3.521 1.909 1.00 0.00 H new ATOM 0 HG13 ILE A 115 118.221 2.585 1.733 1.00 0.00 H new ATOM 0 HG21 ILE A 115 119.300 4.871 4.508 1.00 0.00 H new ATOM 0 HG22 ILE A 115 119.765 3.553 5.610 1.00 0.00 H new ATOM 0 HG23 ILE A 115 120.716 3.858 4.138 1.00 0.00 H new ATOM 0 HD11 ILE A 115 117.809 4.974 1.201 1.00 0.00 H new ATOM 0 HD12 ILE A 115 116.885 4.490 2.642 1.00 0.00 H new ATOM 0 HD13 ILE A 115 118.379 5.440 2.821 1.00 0.00 H new ATOM 1767 N ARG A 116 118.590 -0.478 2.598 1.00 0.00 N ATOM 1768 CA ARG A 116 117.591 -1.455 2.175 1.00 0.00 C ATOM 1769 C ARG A 116 117.384 -2.510 3.258 1.00 0.00 C ATOM 1770 O ARG A 116 118.345 -2.991 3.859 1.00 0.00 O ATOM 1771 CB ARG A 116 118.051 -2.114 0.873 1.00 0.00 C ATOM 1772 CG ARG A 116 116.953 -3.029 0.329 1.00 0.00 C ATOM 1773 CD ARG A 116 117.367 -3.547 -1.050 1.00 0.00 C ATOM 1774 NE ARG A 116 118.514 -4.451 -0.933 1.00 0.00 N ATOM 1775 CZ ARG A 116 119.002 -5.165 -1.960 1.00 0.00 C ATOM 1776 NH1 ARG A 116 118.479 -5.110 -3.161 1.00 0.00 N ATOM 1777 NH2 ARG A 116 120.032 -5.939 -1.755 1.00 0.00 N ATOM 0 H ARG A 116 119.506 -0.594 2.164 1.00 0.00 H new ATOM 0 HA ARG A 116 116.640 -0.948 2.009 1.00 0.00 H new ATOM 0 HB2 ARG A 116 118.296 -1.349 0.136 1.00 0.00 H new ATOM 0 HB3 ARG A 116 118.960 -2.689 1.049 1.00 0.00 H new ATOM 0 HG2 ARG A 116 116.788 -3.864 1.010 1.00 0.00 H new ATOM 0 HG3 ARG A 116 116.011 -2.485 0.259 1.00 0.00 H new ATOM 0 HD2 ARG A 116 116.531 -4.069 -1.516 1.00 0.00 H new ATOM 0 HD3 ARG A 116 117.621 -2.709 -1.699 1.00 0.00 H new ATOM 0 HE ARG A 116 118.966 -4.543 -0.023 1.00 0.00 H new ATOM 0 HH11 ARG A 116 117.674 -4.510 -3.340 1.00 0.00 H new ATOM 0 HH12 ARG A 116 118.877 -5.667 -3.917 1.00 0.00 H new ATOM 0 HH21 ARG A 116 120.452 -5.994 -0.827 1.00 0.00 H new ATOM 0 HH22 ARG A 116 120.417 -6.489 -2.523 1.00 0.00 H new ATOM 1791 N ALA A 117 116.127 -2.866 3.504 1.00 0.00 N ATOM 1792 CA ALA A 117 115.796 -3.799 4.576 1.00 0.00 C ATOM 1793 C ALA A 117 115.900 -5.246 4.113 1.00 0.00 C ATOM 1794 O ALA A 117 115.729 -5.546 2.933 1.00 0.00 O ATOM 1795 CB ALA A 117 114.368 -3.536 5.057 1.00 0.00 C ATOM 0 H ALA A 117 115.323 -2.524 2.978 1.00 0.00 H new ATOM 0 HA ALA A 117 116.509 -3.644 5.385 1.00 0.00 H new ATOM 0 HB1 ALA A 117 114.120 -4.233 5.858 1.00 0.00 H new ATOM 0 HB2 ALA A 117 114.292 -2.514 5.428 1.00 0.00 H new ATOM 0 HB3 ALA A 117 113.674 -3.674 4.228 1.00 0.00 H new ATOM 1801 N LYS A 118 116.167 -6.142 5.058 1.00 0.00 N ATOM 1802 CA LYS A 118 116.191 -7.569 4.762 1.00 0.00 C ATOM 1803 C LYS A 118 114.777 -8.135 4.829 1.00 0.00 C ATOM 1804 O LYS A 118 113.949 -7.658 5.607 1.00 0.00 O ATOM 1805 CB LYS A 118 117.078 -8.298 5.773 1.00 0.00 C ATOM 1806 CG LYS A 118 118.527 -7.835 5.613 1.00 0.00 C ATOM 1807 CD LYS A 118 119.393 -8.427 6.730 1.00 0.00 C ATOM 1808 CE LYS A 118 119.658 -9.913 6.470 1.00 0.00 C ATOM 1809 NZ LYS A 118 119.810 -10.623 7.771 1.00 0.00 N ATOM 0 H LYS A 118 116.369 -5.907 6.030 1.00 0.00 H new ATOM 0 HA LYS A 118 116.593 -7.714 3.759 1.00 0.00 H new ATOM 0 HB2 LYS A 118 116.732 -8.097 6.787 1.00 0.00 H new ATOM 0 HB3 LYS A 118 117.011 -9.375 5.620 1.00 0.00 H new ATOM 0 HG2 LYS A 118 118.911 -8.145 4.641 1.00 0.00 H new ATOM 0 HG3 LYS A 118 118.575 -6.746 5.643 1.00 0.00 H new ATOM 0 HD2 LYS A 118 120.338 -7.888 6.790 1.00 0.00 H new ATOM 0 HD3 LYS A 118 118.893 -8.303 7.691 1.00 0.00 H new ATOM 0 HE2 LYS A 118 118.836 -10.346 5.900 1.00 0.00 H new ATOM 0 HE3 LYS A 118 120.560 -10.033 5.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 119.990 -11.632 7.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 120.608 -10.215 8.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 118.938 -10.518 8.328 1.00 0.00 H new ATOM 1823 N GLY A 119 114.500 -9.149 4.015 1.00 0.00 N ATOM 1824 CA GLY A 119 113.177 -9.765 4.010 1.00 0.00 C ATOM 1825 C GLY A 119 113.137 -11.017 4.879 1.00 0.00 C ATOM 1826 O GLY A 119 114.174 -11.502 5.333 1.00 0.00 O ATOM 0 H GLY A 119 115.164 -9.558 3.358 1.00 0.00 H new ATOM 0 HA2 GLY A 119 112.440 -9.048 4.370 1.00 0.00 H new ATOM 0 HA3 GLY A 119 112.899 -10.022 2.988 1.00 0.00 H new ATOM 1830 N SER A 120 111.935 -11.535 5.108 1.00 0.00 N ATOM 1831 CA SER A 120 111.768 -12.723 5.940 1.00 0.00 C ATOM 1832 C SER A 120 112.574 -13.897 5.389 1.00 0.00 C ATOM 1833 O SER A 120 113.144 -14.679 6.149 1.00 0.00 O ATOM 1834 CB SER A 120 110.291 -13.107 6.010 1.00 0.00 C ATOM 1835 OG SER A 120 109.538 -11.989 6.460 1.00 0.00 O ATOM 0 H SER A 120 111.066 -11.154 4.732 1.00 0.00 H new ATOM 0 HA SER A 120 112.135 -12.490 6.940 1.00 0.00 H new ATOM 0 HB2 SER A 120 109.939 -13.426 5.029 1.00 0.00 H new ATOM 0 HB3 SER A 120 110.154 -13.950 6.688 1.00 0.00 H new ATOM 0 HG SER A 120 108.589 -12.230 6.505 1.00 0.00 H new ATOM 1841 N GLY A 121 112.620 -14.015 4.066 1.00 0.00 N ATOM 1842 CA GLY A 121 113.366 -15.092 3.428 1.00 0.00 C ATOM 1843 C GLY A 121 114.074 -14.586 2.175 1.00 0.00 C ATOM 1844 O GLY A 121 113.937 -13.420 1.804 1.00 0.00 O ATOM 0 H GLY A 121 112.152 -13.381 3.418 1.00 0.00 H new ATOM 0 HA2 GLY A 121 114.097 -15.498 4.126 1.00 0.00 H new ATOM 0 HA3 GLY A 121 112.689 -15.905 3.166 1.00 0.00 H new ATOM 1848 N GLY A 122 114.829 -15.467 1.531 1.00 0.00 N ATOM 1849 CA GLY A 122 115.553 -15.091 0.322 1.00 0.00 C ATOM 1850 C GLY A 122 116.658 -14.089 0.639 1.00 0.00 C ATOM 1851 O GLY A 122 117.566 -14.379 1.417 1.00 0.00 O ATOM 0 H GLY A 122 114.956 -16.437 1.821 1.00 0.00 H new ATOM 0 HA2 GLY A 122 115.984 -15.979 -0.140 1.00 0.00 H new ATOM 0 HA3 GLY A 122 114.861 -14.659 -0.401 1.00 0.00 H new ATOM 1855 N GLY A 123 116.573 -12.909 0.030 1.00 0.00 N ATOM 1856 CA GLY A 123 117.588 -11.876 0.220 1.00 0.00 C ATOM 1857 C GLY A 123 116.980 -10.595 0.782 1.00 0.00 C ATOM 1858 O GLY A 123 116.403 -10.587 1.870 1.00 0.00 O ATOM 0 H GLY A 123 115.814 -12.645 -0.598 1.00 0.00 H new ATOM 0 HA2 GLY A 123 118.359 -12.242 0.897 1.00 0.00 H new ATOM 0 HA3 GLY A 123 118.075 -11.663 -0.732 1.00 0.00 H new ATOM 1862 N TYR A 124 117.117 -9.506 0.032 1.00 0.00 N ATOM 1863 CA TYR A 124 116.635 -8.205 0.483 1.00 0.00 C ATOM 1864 C TYR A 124 115.353 -7.813 -0.244 1.00 0.00 C ATOM 1865 O TYR A 124 115.027 -8.361 -1.297 1.00 0.00 O ATOM 1866 CB TYR A 124 117.716 -7.150 0.245 1.00 0.00 C ATOM 1867 CG TYR A 124 118.811 -7.179 1.286 1.00 0.00 C ATOM 1868 CD1 TYR A 124 119.433 -8.390 1.610 1.00 0.00 C ATOM 1869 CD2 TYR A 124 119.217 -5.994 1.911 1.00 0.00 C ATOM 1870 CE1 TYR A 124 120.459 -8.417 2.562 1.00 0.00 C ATOM 1871 CE2 TYR A 124 120.241 -6.021 2.865 1.00 0.00 C ATOM 1872 CZ TYR A 124 120.863 -7.233 3.190 1.00 0.00 C ATOM 1873 OH TYR A 124 121.875 -7.259 4.128 1.00 0.00 O ATOM 0 H TYR A 124 117.557 -9.498 -0.888 1.00 0.00 H new ATOM 0 HA TYR A 124 116.412 -8.267 1.548 1.00 0.00 H new ATOM 0 HB2 TYR A 124 118.155 -7.304 -0.740 1.00 0.00 H new ATOM 0 HB3 TYR A 124 117.256 -6.162 0.238 1.00 0.00 H new ATOM 0 HD1 TYR A 124 119.122 -9.304 1.126 1.00 0.00 H new ATOM 0 HD2 TYR A 124 118.740 -5.059 1.657 1.00 0.00 H new ATOM 0 HE1 TYR A 124 120.939 -9.352 2.812 1.00 0.00 H new ATOM 0 HE2 TYR A 124 120.551 -5.107 3.350 1.00 0.00 H new ATOM 0 HH TYR A 124 122.032 -6.352 4.465 1.00 0.00 H new ATOM 1883 N ILE A 125 114.637 -6.856 0.334 1.00 0.00 N ATOM 1884 CA ILE A 125 113.336 -6.450 -0.186 1.00 0.00 C ATOM 1885 C ILE A 125 113.507 -5.515 -1.384 1.00 0.00 C ATOM 1886 O ILE A 125 114.292 -4.568 -1.344 1.00 0.00 O ATOM 1887 CB ILE A 125 112.547 -5.776 0.946 1.00 0.00 C ATOM 1888 CG1 ILE A 125 112.325 -6.793 2.074 1.00 0.00 C ATOM 1889 CG2 ILE A 125 111.183 -5.287 0.446 1.00 0.00 C ATOM 1890 CD1 ILE A 125 111.904 -6.074 3.357 1.00 0.00 C ATOM 0 H ILE A 125 114.936 -6.345 1.165 1.00 0.00 H new ATOM 0 HA ILE A 125 112.783 -7.322 -0.536 1.00 0.00 H new ATOM 0 HB ILE A 125 113.117 -4.919 1.306 1.00 0.00 H new ATOM 0 HG12 ILE A 125 111.558 -7.510 1.782 1.00 0.00 H new ATOM 0 HG13 ILE A 125 113.240 -7.359 2.249 1.00 0.00 H new ATOM 0 HG21 ILE A 125 110.643 -4.813 1.266 1.00 0.00 H new ATOM 0 HG22 ILE A 125 111.328 -4.565 -0.358 1.00 0.00 H new ATOM 0 HG23 ILE A 125 110.607 -6.134 0.074 1.00 0.00 H new ATOM 0 HD11 ILE A 125 111.749 -6.806 4.150 1.00 0.00 H new ATOM 0 HD12 ILE A 125 112.685 -5.375 3.655 1.00 0.00 H new ATOM 0 HD13 ILE A 125 110.977 -5.528 3.181 1.00 0.00 H new ATOM 1902 N SER A 126 112.755 -5.795 -2.444 1.00 0.00 N ATOM 1903 CA SER A 126 112.866 -5.039 -3.688 1.00 0.00 C ATOM 1904 C SER A 126 112.486 -3.576 -3.498 1.00 0.00 C ATOM 1905 O SER A 126 111.537 -3.250 -2.786 1.00 0.00 O ATOM 1906 CB SER A 126 111.959 -5.660 -4.749 1.00 0.00 C ATOM 1907 OG SER A 126 112.340 -7.014 -4.956 1.00 0.00 O ATOM 0 H SER A 126 112.060 -6.542 -2.467 1.00 0.00 H new ATOM 0 HA SER A 126 113.907 -5.080 -4.008 1.00 0.00 H new ATOM 0 HB2 SER A 126 110.918 -5.607 -4.430 1.00 0.00 H new ATOM 0 HB3 SER A 126 112.036 -5.102 -5.682 1.00 0.00 H new ATOM 0 HG SER A 126 111.759 -7.417 -5.635 1.00 0.00 H new ATOM 1913 N LEU A 127 113.246 -2.704 -4.150 1.00 0.00 N ATOM 1914 CA LEU A 127 112.904 -1.282 -4.210 1.00 0.00 C ATOM 1915 C LEU A 127 112.067 -0.940 -5.455 1.00 0.00 C ATOM 1916 O LEU A 127 111.845 0.235 -5.745 1.00 0.00 O ATOM 1917 CB LEU A 127 114.184 -0.437 -4.236 1.00 0.00 C ATOM 1918 CG LEU A 127 115.086 -0.781 -3.046 1.00 0.00 C ATOM 1919 CD1 LEU A 127 116.379 0.033 -3.136 1.00 0.00 C ATOM 1920 CD2 LEU A 127 114.371 -0.440 -1.737 1.00 0.00 C ATOM 0 H LEU A 127 114.102 -2.953 -4.645 1.00 0.00 H new ATOM 0 HA LEU A 127 112.312 -1.058 -3.323 1.00 0.00 H new ATOM 0 HB2 LEU A 127 114.722 -0.611 -5.168 1.00 0.00 H new ATOM 0 HB3 LEU A 127 113.927 0.622 -4.209 1.00 0.00 H new ATOM 0 HG LEU A 127 115.316 -1.846 -3.068 1.00 0.00 H new ATOM 0 HD11 LEU A 127 117.022 -0.211 -2.290 1.00 0.00 H new ATOM 0 HD12 LEU A 127 116.896 -0.207 -4.065 1.00 0.00 H new ATOM 0 HD13 LEU A 127 116.141 1.097 -3.117 1.00 0.00 H new ATOM 0 HD21 LEU A 127 115.017 -0.687 -0.895 1.00 0.00 H new ATOM 0 HD22 LEU A 127 114.138 0.625 -1.716 1.00 0.00 H new ATOM 0 HD23 LEU A 127 113.447 -1.015 -1.666 1.00 0.00 H new ATOM 1932 N GLY A 128 111.602 -1.949 -6.197 1.00 0.00 N ATOM 1933 CA GLY A 128 110.914 -1.716 -7.464 1.00 0.00 C ATOM 1934 C GLY A 128 109.818 -0.657 -7.358 1.00 0.00 C ATOM 1935 O GLY A 128 109.737 0.236 -8.202 1.00 0.00 O ATOM 0 H GLY A 128 111.691 -2.932 -5.940 1.00 0.00 H new ATOM 0 HA2 GLY A 128 111.641 -1.406 -8.215 1.00 0.00 H new ATOM 0 HA3 GLY A 128 110.476 -2.652 -7.812 1.00 0.00 H new ATOM 1939 N ALA A 129 108.989 -0.738 -6.321 1.00 0.00 N ATOM 1940 CA ALA A 129 107.866 0.188 -6.189 1.00 0.00 C ATOM 1941 C ALA A 129 108.359 1.631 -6.131 1.00 0.00 C ATOM 1942 O ALA A 129 107.868 2.500 -6.853 1.00 0.00 O ATOM 1943 CB ALA A 129 107.070 -0.134 -4.922 1.00 0.00 C ATOM 0 H ALA A 129 109.070 -1.424 -5.570 1.00 0.00 H new ATOM 0 HA ALA A 129 107.223 0.074 -7.062 1.00 0.00 H new ATOM 0 HB1 ALA A 129 106.235 0.560 -4.831 1.00 0.00 H new ATOM 0 HB2 ALA A 129 106.689 -1.154 -4.981 1.00 0.00 H new ATOM 0 HB3 ALA A 129 107.718 -0.038 -4.051 1.00 0.00 H new ATOM 1949 N LEU A 130 109.357 1.875 -5.291 1.00 0.00 N ATOM 1950 CA LEU A 130 109.898 3.220 -5.137 1.00 0.00 C ATOM 1951 C LEU A 130 110.423 3.737 -6.474 1.00 0.00 C ATOM 1952 O LEU A 130 110.187 4.887 -6.847 1.00 0.00 O ATOM 1953 CB LEU A 130 111.025 3.193 -4.103 1.00 0.00 C ATOM 1954 CG LEU A 130 111.545 4.610 -3.856 1.00 0.00 C ATOM 1955 CD1 LEU A 130 110.482 5.423 -3.116 1.00 0.00 C ATOM 1956 CD2 LEU A 130 112.816 4.539 -3.006 1.00 0.00 C ATOM 0 H LEU A 130 109.805 1.166 -4.710 1.00 0.00 H new ATOM 0 HA LEU A 130 109.108 3.890 -4.797 1.00 0.00 H new ATOM 0 HB2 LEU A 130 110.663 2.762 -3.170 1.00 0.00 H new ATOM 0 HB3 LEU A 130 111.836 2.555 -4.454 1.00 0.00 H new ATOM 0 HG LEU A 130 111.767 5.089 -4.809 1.00 0.00 H new ATOM 0 HD11 LEU A 130 110.853 6.433 -2.940 1.00 0.00 H new ATOM 0 HD12 LEU A 130 109.575 5.470 -3.718 1.00 0.00 H new ATOM 0 HD13 LEU A 130 110.259 4.947 -2.161 1.00 0.00 H new ATOM 0 HD21 LEU A 130 113.191 5.547 -2.827 1.00 0.00 H new ATOM 0 HD22 LEU A 130 112.590 4.061 -2.053 1.00 0.00 H new ATOM 0 HD23 LEU A 130 113.574 3.958 -3.532 1.00 0.00 H new ATOM 1968 N LEU A 131 111.111 2.869 -7.208 1.00 0.00 N ATOM 1969 CA LEU A 131 111.678 3.256 -8.493 1.00 0.00 C ATOM 1970 C LEU A 131 110.578 3.703 -9.448 1.00 0.00 C ATOM 1971 O LEU A 131 110.713 4.717 -10.127 1.00 0.00 O ATOM 1972 CB LEU A 131 112.443 2.076 -9.097 1.00 0.00 C ATOM 1973 CG LEU A 131 113.138 2.504 -10.393 1.00 0.00 C ATOM 1974 CD1 LEU A 131 114.319 3.419 -10.060 1.00 0.00 C ATOM 1975 CD2 LEU A 131 113.650 1.263 -11.128 1.00 0.00 C ATOM 0 H LEU A 131 111.288 1.902 -6.938 1.00 0.00 H new ATOM 0 HA LEU A 131 112.363 4.089 -8.337 1.00 0.00 H new ATOM 0 HB2 LEU A 131 113.181 1.709 -8.384 1.00 0.00 H new ATOM 0 HB3 LEU A 131 111.757 1.253 -9.298 1.00 0.00 H new ATOM 0 HG LEU A 131 112.430 3.039 -11.026 1.00 0.00 H new ATOM 0 HD11 LEU A 131 114.814 3.724 -10.982 1.00 0.00 H new ATOM 0 HD12 LEU A 131 113.958 4.302 -9.533 1.00 0.00 H new ATOM 0 HD13 LEU A 131 115.027 2.883 -9.428 1.00 0.00 H new ATOM 0 HD21 LEU A 131 114.145 1.565 -12.051 1.00 0.00 H new ATOM 0 HD22 LEU A 131 114.359 0.731 -10.493 1.00 0.00 H new ATOM 0 HD23 LEU A 131 112.811 0.608 -11.364 1.00 0.00 H new ATOM 1987 N SER A 132 109.477 2.960 -9.472 1.00 0.00 N ATOM 1988 CA SER A 132 108.391 3.264 -10.395 1.00 0.00 C ATOM 1989 C SER A 132 107.860 4.671 -10.154 1.00 0.00 C ATOM 1990 O SER A 132 107.648 5.434 -11.098 1.00 0.00 O ATOM 1991 CB SER A 132 107.258 2.252 -10.221 1.00 0.00 C ATOM 1992 OG SER A 132 107.777 0.938 -10.378 1.00 0.00 O ATOM 0 H SER A 132 109.314 2.152 -8.871 1.00 0.00 H new ATOM 0 HA SER A 132 108.778 3.204 -11.412 1.00 0.00 H new ATOM 0 HB2 SER A 132 106.805 2.362 -9.236 1.00 0.00 H new ATOM 0 HB3 SER A 132 106.474 2.436 -10.955 1.00 0.00 H new ATOM 0 HG SER A 132 108.283 0.688 -9.577 1.00 0.00 H new ATOM 1998 N THR A 133 107.684 5.028 -8.886 1.00 0.00 N ATOM 1999 CA THR A 133 107.137 6.340 -8.552 1.00 0.00 C ATOM 2000 C THR A 133 108.041 7.447 -9.082 1.00 0.00 C ATOM 2001 O THR A 133 107.579 8.385 -9.735 1.00 0.00 O ATOM 2002 CB THR A 133 106.988 6.475 -7.036 1.00 0.00 C ATOM 2003 OG1 THR A 133 106.225 5.385 -6.538 1.00 0.00 O ATOM 2004 CG2 THR A 133 106.279 7.789 -6.703 1.00 0.00 C ATOM 0 H THR A 133 107.908 4.439 -8.084 1.00 0.00 H new ATOM 0 HA THR A 133 106.157 6.435 -9.019 1.00 0.00 H new ATOM 0 HB THR A 133 107.975 6.471 -6.574 1.00 0.00 H new ATOM 0 HG1 THR A 133 106.130 5.469 -5.566 1.00 0.00 H new ATOM 0 HG21 THR A 133 106.174 7.882 -5.622 1.00 0.00 H new ATOM 0 HG22 THR A 133 106.865 8.625 -7.084 1.00 0.00 H new ATOM 0 HG23 THR A 133 105.292 7.797 -7.165 1.00 0.00 H new ATOM 2012 N THR A 134 109.339 7.316 -8.830 1.00 0.00 N ATOM 2013 CA THR A 134 110.284 8.346 -9.249 1.00 0.00 C ATOM 2014 C THR A 134 110.313 8.479 -10.769 1.00 0.00 C ATOM 2015 O THR A 134 110.376 9.586 -11.299 1.00 0.00 O ATOM 2016 CB THR A 134 111.681 8.031 -8.715 1.00 0.00 C ATOM 2017 OG1 THR A 134 111.601 7.827 -7.312 1.00 0.00 O ATOM 2018 CG2 THR A 134 112.616 9.207 -9.008 1.00 0.00 C ATOM 0 H THR A 134 109.756 6.521 -8.346 1.00 0.00 H new ATOM 0 HA THR A 134 109.954 9.298 -8.834 1.00 0.00 H new ATOM 0 HB THR A 134 112.069 7.134 -9.198 1.00 0.00 H new ATOM 0 HG1 THR A 134 111.447 6.877 -7.128 1.00 0.00 H new ATOM 0 HG21 THR A 134 113.613 8.983 -8.627 1.00 0.00 H new ATOM 0 HG22 THR A 134 112.667 9.372 -10.084 1.00 0.00 H new ATOM 0 HG23 THR A 134 112.235 10.105 -8.521 1.00 0.00 H new ATOM 2026 N LEU A 135 110.248 7.352 -11.472 1.00 0.00 N ATOM 2027 CA LEU A 135 110.256 7.375 -12.933 1.00 0.00 C ATOM 2028 C LEU A 135 109.067 8.168 -13.467 1.00 0.00 C ATOM 2029 O LEU A 135 109.194 8.904 -14.446 1.00 0.00 O ATOM 2030 CB LEU A 135 110.214 5.948 -13.486 1.00 0.00 C ATOM 2031 CG LEU A 135 111.519 5.226 -13.143 1.00 0.00 C ATOM 2032 CD1 LEU A 135 111.379 3.737 -13.466 1.00 0.00 C ATOM 2033 CD2 LEU A 135 112.661 5.816 -13.973 1.00 0.00 C ATOM 0 H LEU A 135 110.190 6.421 -11.060 1.00 0.00 H new ATOM 0 HA LEU A 135 111.176 7.860 -13.260 1.00 0.00 H new ATOM 0 HB2 LEU A 135 109.366 5.408 -13.064 1.00 0.00 H new ATOM 0 HB3 LEU A 135 110.072 5.970 -14.566 1.00 0.00 H new ATOM 0 HG LEU A 135 111.734 5.352 -12.082 1.00 0.00 H new ATOM 0 HD11 LEU A 135 112.308 3.223 -13.222 1.00 0.00 H new ATOM 0 HD12 LEU A 135 110.564 3.312 -12.879 1.00 0.00 H new ATOM 0 HD13 LEU A 135 111.164 3.614 -14.527 1.00 0.00 H new ATOM 0 HD21 LEU A 135 113.591 5.302 -13.729 1.00 0.00 H new ATOM 0 HD22 LEU A 135 112.443 5.689 -15.033 1.00 0.00 H new ATOM 0 HD23 LEU A 135 112.763 6.878 -13.748 1.00 0.00 H new ATOM 2045 N ASN A 136 107.911 8.011 -12.828 1.00 0.00 N ATOM 2046 CA ASN A 136 106.724 8.755 -13.235 1.00 0.00 C ATOM 2047 C ASN A 136 106.987 10.255 -13.153 1.00 0.00 C ATOM 2048 O ASN A 136 106.612 11.012 -14.048 1.00 0.00 O ATOM 2049 CB ASN A 136 105.544 8.391 -12.330 1.00 0.00 C ATOM 2050 CG ASN A 136 104.247 8.933 -12.921 1.00 0.00 C ATOM 2051 OD1 ASN A 136 103.843 8.528 -14.011 1.00 0.00 O ATOM 2052 ND2 ASN A 136 103.567 9.832 -12.264 1.00 0.00 N ATOM 0 H ASN A 136 107.772 7.383 -12.036 1.00 0.00 H new ATOM 0 HA ASN A 136 106.484 8.492 -14.265 1.00 0.00 H new ATOM 0 HB2 ASN A 136 105.479 7.308 -12.221 1.00 0.00 H new ATOM 0 HB3 ASN A 136 105.699 8.803 -11.333 1.00 0.00 H new ATOM 0 HD21 ASN A 136 102.699 10.200 -12.653 1.00 0.00 H new ATOM 0 HD22 ASN A 136 103.903 10.166 -11.361 1.00 0.00 H new ATOM 2059 N LEU A 137 107.637 10.673 -12.072 1.00 0.00 N ATOM 2060 CA LEU A 137 107.980 12.082 -11.893 1.00 0.00 C ATOM 2061 C LEU A 137 108.919 12.564 -12.996 1.00 0.00 C ATOM 2062 O LEU A 137 108.797 13.689 -13.478 1.00 0.00 O ATOM 2063 CB LEU A 137 108.644 12.289 -10.529 1.00 0.00 C ATOM 2064 CG LEU A 137 107.709 11.811 -9.415 1.00 0.00 C ATOM 2065 CD1 LEU A 137 108.427 11.925 -8.068 1.00 0.00 C ATOM 2066 CD2 LEU A 137 106.447 12.678 -9.389 1.00 0.00 C ATOM 0 H LEU A 137 107.936 10.063 -11.311 1.00 0.00 H new ATOM 0 HA LEU A 137 107.059 12.663 -11.945 1.00 0.00 H new ATOM 0 HB2 LEU A 137 109.585 11.740 -10.486 1.00 0.00 H new ATOM 0 HB3 LEU A 137 108.883 13.343 -10.388 1.00 0.00 H new ATOM 0 HG LEU A 137 107.431 10.773 -9.599 1.00 0.00 H new ATOM 0 HD11 LEU A 137 107.764 11.585 -7.272 1.00 0.00 H new ATOM 0 HD12 LEU A 137 109.325 11.307 -8.081 1.00 0.00 H new ATOM 0 HD13 LEU A 137 108.704 12.964 -7.890 1.00 0.00 H new ATOM 0 HD21 LEU A 137 105.785 12.333 -8.594 1.00 0.00 H new ATOM 0 HD22 LEU A 137 106.723 13.717 -9.207 1.00 0.00 H new ATOM 0 HD23 LEU A 137 105.933 12.602 -10.347 1.00 0.00 H new ATOM 2078 N CYS A 138 109.855 11.707 -13.391 1.00 0.00 N ATOM 2079 CA CYS A 138 110.785 12.042 -14.469 1.00 0.00 C ATOM 2080 C CYS A 138 110.056 12.336 -15.786 1.00 0.00 C ATOM 2081 O CYS A 138 110.579 13.058 -16.635 1.00 0.00 O ATOM 2082 CB CYS A 138 111.765 10.885 -14.683 1.00 0.00 C ATOM 2083 SG CYS A 138 113.149 10.973 -13.511 1.00 0.00 S ATOM 0 H CYS A 138 109.991 10.781 -12.985 1.00 0.00 H new ATOM 0 HA CYS A 138 111.321 12.944 -14.172 1.00 0.00 H new ATOM 0 HB2 CYS A 138 111.243 9.936 -14.563 1.00 0.00 H new ATOM 0 HB3 CYS A 138 112.147 10.912 -15.704 1.00 0.00 H new ATOM 2088 N GLY A 139 108.855 11.783 -15.961 1.00 0.00 N ATOM 2089 CA GLY A 139 108.081 12.024 -17.178 1.00 0.00 C ATOM 2090 C GLY A 139 108.505 11.116 -18.336 1.00 0.00 C ATOM 2091 O GLY A 139 108.277 11.451 -19.499 1.00 0.00 O ATOM 0 H GLY A 139 108.401 11.171 -15.283 1.00 0.00 H new ATOM 0 HA2 GLY A 139 107.023 11.868 -16.968 1.00 0.00 H new ATOM 0 HA3 GLY A 139 108.197 13.066 -17.477 1.00 0.00 H new ATOM 2095 N LYS A 140 109.116 9.972 -18.029 1.00 0.00 N ATOM 2096 CA LYS A 140 109.545 9.043 -19.067 1.00 0.00 C ATOM 2097 C LYS A 140 108.535 7.909 -19.218 1.00 0.00 C ATOM 2098 O LYS A 140 107.955 7.447 -18.237 1.00 0.00 O ATOM 2099 CB LYS A 140 110.918 8.465 -18.717 1.00 0.00 C ATOM 2100 CG LYS A 140 111.955 9.590 -18.704 1.00 0.00 C ATOM 2101 CD LYS A 140 113.346 9.001 -18.460 1.00 0.00 C ATOM 2102 CE LYS A 140 114.363 10.137 -18.326 1.00 0.00 C ATOM 2103 NZ LYS A 140 114.219 10.777 -16.988 1.00 0.00 N ATOM 0 H LYS A 140 109.323 9.670 -17.077 1.00 0.00 H new ATOM 0 HA LYS A 140 109.611 9.585 -20.011 1.00 0.00 H new ATOM 0 HB2 LYS A 140 110.882 7.978 -17.743 1.00 0.00 H new ATOM 0 HB3 LYS A 140 111.200 7.704 -19.444 1.00 0.00 H new ATOM 0 HG2 LYS A 140 111.937 10.126 -19.653 1.00 0.00 H new ATOM 0 HG3 LYS A 140 111.713 10.313 -17.925 1.00 0.00 H new ATOM 0 HD2 LYS A 140 113.342 8.393 -17.555 1.00 0.00 H new ATOM 0 HD3 LYS A 140 113.624 8.344 -19.284 1.00 0.00 H new ATOM 0 HE2 LYS A 140 115.375 9.750 -18.449 1.00 0.00 H new ATOM 0 HE3 LYS A 140 114.206 10.875 -19.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 115.136 11.166 -16.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 113.519 11.544 -17.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 113.901 10.068 -16.296 1.00 0.00 H new ATOM 2117 N GLY A 141 108.331 7.466 -20.455 1.00 0.00 N ATOM 2118 CA GLY A 141 107.386 6.388 -20.723 1.00 0.00 C ATOM 2119 C GLY A 141 107.762 5.635 -21.994 1.00 0.00 C ATOM 2120 O GLY A 141 108.945 5.560 -22.286 1.00 0.00 O ATOM 2121 OXT GLY A 141 106.863 5.144 -22.656 1.00 0.00 O ATOM 0 H GLY A 141 108.803 7.833 -21.281 1.00 0.00 H new ATOM 0 HA2 GLY A 141 107.367 5.698 -19.879 1.00 0.00 H new ATOM 0 HA3 GLY A 141 106.381 6.797 -20.822 1.00 0.00 H new TER 2125 GLY A 141