USER MOD reduce.3.24.130724 H: found=0, std=0, add=930, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 930 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 6 THR OG1 : rot 33:sc= 0.534 USER MOD Set 1.2: A 21 SER OG : rot 180:sc=-0.00863 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -160:sc= -0.0965 (180deg=-0.546) USER MOD Single : A 8 SER OG : rot -62:sc= 1.27 USER MOD Single : A 9 LYS NZ :NH3+ 143:sc= 0.378 (180deg=-1.52) USER MOD Single : A 11 THR OG1 : rot 61:sc= 1.14 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -0.86 K(o=-0.86,f=-3.9!) USER MOD Single : A 33 HIS : no HD1:sc=-0.00297 X(o=-0.003,f=-0.37) USER MOD Single : A 34 ASN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 40 TYR OH : rot 100:sc= -0.361 USER MOD Single : A 43 ASN : amide:sc= -0.13 X(o=-0.13,f=0) USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc=-0.00259 X(o=-0.0026,f=-0.17) USER MOD Single : A 72 LYS NZ :NH3+ -161:sc= -0.111 (180deg=-0.568) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 160:sc= -0.0742 (180deg=-0.649) USER MOD Single : A 83 ASN : amide:sc= -0.222 X(o=-0.22,f=-0.0012) USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= -2.27 K(o=-2.3,f=-1.6) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 170:sc= -1.19 (180deg=-1.6) USER MOD Single : A 105 ASN : amide:sc= -3.48 K(o=-3.5,f=-2) USER MOD Single : A 106 ASN : amide:sc= -0.31 X(o=-0.31,f=0) USER MOD Single : A 109 SER OG : rot 170:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 HIS : no HD1:sc= -1.38! C(o=-1.4!,f=-2.9!) USER MOD Single : A 118 HIS : no HD1:sc= -1.98 K(o=-2,f=-3.5!) USER MOD Single : A 119 HIS : no HD1:sc= 0 X(o=0,f=-0.032) USER MOD Single : A 120 HIS : no HD1:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 121 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 122 HIS : no HD1:sc= -1.49! C(o=-1.5!,f=-4.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.074 12.887 3.109 1.00 1.00 N ATOM 2 CA MET A 1 11.274 12.030 2.899 1.00 1.00 C ATOM 3 C MET A 1 10.802 10.638 2.464 1.00 1.00 C ATOM 4 O MET A 1 10.925 9.667 3.210 1.00 1.00 O ATOM 5 CB MET A 1 12.073 11.946 4.222 1.00 1.00 C ATOM 6 CG MET A 1 12.563 13.344 4.667 1.00 1.00 C ATOM 7 SD MET A 1 13.799 13.982 3.504 1.00 1.00 S ATOM 8 CE MET A 1 14.009 15.613 4.264 1.00 1.00 C ATOM 0 H1 MET A 1 10.351 13.889 3.069 1.00 1.00 H new ATOM 0 H2 MET A 1 9.374 12.692 2.365 1.00 1.00 H new ATOM 0 H3 MET A 1 9.658 12.680 4.039 1.00 1.00 H new ATOM 0 HA MET A 1 11.921 12.449 2.128 1.00 1.00 H new ATOM 0 HB2 MET A 1 11.447 11.512 5.001 1.00 1.00 H new ATOM 0 HB3 MET A 1 12.928 11.282 4.093 1.00 1.00 H new ATOM 0 HG2 MET A 1 11.719 14.031 4.723 1.00 1.00 H new ATOM 0 HG3 MET A 1 12.992 13.284 5.667 1.00 1.00 H new ATOM 0 HE1 MET A 1 14.742 16.187 3.697 1.00 1.00 H new ATOM 0 HE2 MET A 1 13.055 16.141 4.262 1.00 1.00 H new ATOM 0 HE3 MET A 1 14.356 15.494 5.290 1.00 1.00 H new ATOM 20 N ASP A 2 10.257 10.557 1.254 1.00 1.00 N ATOM 21 CA ASP A 2 9.753 9.281 0.723 1.00 1.00 C ATOM 22 C ASP A 2 8.769 8.638 1.719 1.00 1.00 C ATOM 23 O ASP A 2 9.153 7.784 2.519 1.00 1.00 O ATOM 24 CB ASP A 2 10.945 8.337 0.426 1.00 1.00 C ATOM 25 CG ASP A 2 10.495 7.078 -0.327 1.00 1.00 C ATOM 26 OD1 ASP A 2 9.359 6.672 -0.147 1.00 1.00 O ATOM 27 OD2 ASP A 2 11.302 6.537 -1.066 1.00 1.00 O ATOM 0 H ASP A 2 10.150 11.350 0.621 1.00 1.00 H new ATOM 0 HA ASP A 2 9.214 9.463 -0.207 1.00 1.00 H new ATOM 0 HB2 ASP A 2 11.692 8.868 -0.165 1.00 1.00 H new ATOM 0 HB3 ASP A 2 11.424 8.050 1.362 1.00 1.00 H new ATOM 32 N LEU A 3 7.508 9.055 1.654 1.00 1.00 N ATOM 33 CA LEU A 3 6.479 8.540 2.579 1.00 1.00 C ATOM 34 C LEU A 3 6.257 7.010 2.369 1.00 1.00 C ATOM 35 O LEU A 3 6.537 6.520 1.275 1.00 1.00 O ATOM 36 CB LEU A 3 5.141 9.346 2.384 1.00 1.00 C ATOM 37 CG LEU A 3 5.103 10.647 3.253 1.00 1.00 C ATOM 38 CD1 LEU A 3 6.266 11.594 2.875 1.00 1.00 C ATOM 39 CD2 LEU A 3 3.750 11.372 3.046 1.00 1.00 C ATOM 0 H LEU A 3 7.167 9.741 0.981 1.00 1.00 H new ATOM 0 HA LEU A 3 6.821 8.679 3.605 1.00 1.00 H new ATOM 0 HB2 LEU A 3 5.028 9.610 1.333 1.00 1.00 H new ATOM 0 HB3 LEU A 3 4.295 8.711 2.646 1.00 1.00 H new ATOM 0 HG LEU A 3 5.212 10.367 4.301 1.00 1.00 H new ATOM 0 HD11 LEU A 3 6.219 12.492 3.492 1.00 1.00 H new ATOM 0 HD12 LEU A 3 7.217 11.088 3.042 1.00 1.00 H new ATOM 0 HD13 LEU A 3 6.183 11.871 1.824 1.00 1.00 H new ATOM 0 HD21 LEU A 3 3.726 12.278 3.652 1.00 1.00 H new ATOM 0 HD22 LEU A 3 3.636 11.636 1.995 1.00 1.00 H new ATOM 0 HD23 LEU A 3 2.935 10.713 3.345 1.00 1.00 H new ATOM 51 N PRO A 4 5.764 6.296 3.344 1.00 1.00 N ATOM 52 CA PRO A 4 5.524 4.806 3.195 1.00 1.00 C ATOM 53 C PRO A 4 4.670 4.473 1.967 1.00 1.00 C ATOM 54 O PRO A 4 4.772 3.390 1.390 1.00 1.00 O ATOM 55 CB PRO A 4 4.779 4.418 4.510 1.00 1.00 C ATOM 56 CG PRO A 4 5.264 5.432 5.498 1.00 1.00 C ATOM 57 CD PRO A 4 5.345 6.745 4.705 1.00 1.00 C ATOM 0 HA PRO A 4 6.454 4.258 3.047 1.00 1.00 H new ATOM 0 HB2 PRO A 4 3.697 4.463 4.387 1.00 1.00 H new ATOM 0 HB3 PRO A 4 5.022 3.403 4.824 1.00 1.00 H new ATOM 0 HG2 PRO A 4 4.580 5.521 6.342 1.00 1.00 H new ATOM 0 HG3 PRO A 4 6.237 5.155 5.904 1.00 1.00 H new ATOM 0 HD2 PRO A 4 4.385 7.261 4.681 1.00 1.00 H new ATOM 0 HD3 PRO A 4 6.067 7.435 5.141 1.00 1.00 H new ATOM 65 N ILE A 5 3.812 5.416 1.589 1.00 1.00 N ATOM 66 CA ILE A 5 2.903 5.246 0.427 1.00 1.00 C ATOM 67 C ILE A 5 3.200 6.327 -0.629 1.00 1.00 C ATOM 68 O ILE A 5 3.240 7.520 -0.332 1.00 1.00 O ATOM 69 CB ILE A 5 1.417 5.351 0.899 1.00 1.00 C ATOM 70 CG1 ILE A 5 1.126 4.239 1.965 1.00 1.00 C ATOM 71 CG2 ILE A 5 0.446 5.173 -0.315 1.00 1.00 C ATOM 72 CD1 ILE A 5 -0.231 4.478 2.652 1.00 1.00 C ATOM 0 H ILE A 5 3.716 6.314 2.063 1.00 1.00 H new ATOM 0 HA ILE A 5 3.065 4.264 -0.016 1.00 1.00 H new ATOM 0 HB ILE A 5 1.257 6.335 1.339 1.00 1.00 H new ATOM 0 HG12 ILE A 5 1.128 3.260 1.485 1.00 1.00 H new ATOM 0 HG13 ILE A 5 1.920 4.229 2.712 1.00 1.00 H new ATOM 0 HG21 ILE A 5 -0.585 5.249 0.030 1.00 1.00 H new ATOM 0 HG22 ILE A 5 0.640 5.951 -1.053 1.00 1.00 H new ATOM 0 HG23 ILE A 5 0.606 4.195 -0.769 1.00 1.00 H new ATOM 0 HD11 ILE A 5 -0.410 3.693 3.387 1.00 1.00 H new ATOM 0 HD12 ILE A 5 -0.221 5.447 3.151 1.00 1.00 H new ATOM 0 HD13 ILE A 5 -1.025 4.463 1.905 1.00 1.00 H new ATOM 84 N THR A 6 3.369 5.883 -1.870 1.00 1.00 N ATOM 85 CA THR A 6 3.633 6.812 -3.000 1.00 1.00 C ATOM 86 C THR A 6 2.712 6.479 -4.176 1.00 1.00 C ATOM 87 O THR A 6 2.745 5.374 -4.717 1.00 1.00 O ATOM 88 CB THR A 6 5.108 6.691 -3.446 1.00 1.00 C ATOM 89 OG1 THR A 6 5.357 5.372 -3.911 1.00 1.00 O ATOM 90 CG2 THR A 6 6.046 6.998 -2.266 1.00 1.00 C ATOM 0 H THR A 6 3.331 4.898 -2.133 1.00 1.00 H new ATOM 0 HA THR A 6 3.439 7.833 -2.671 1.00 1.00 H new ATOM 0 HB THR A 6 5.294 7.407 -4.247 1.00 1.00 H new ATOM 0 HG1 THR A 6 4.550 5.019 -4.340 1.00 1.00 H new ATOM 0 HG21 THR A 6 7.082 6.910 -2.592 1.00 1.00 H new ATOM 0 HG22 THR A 6 5.863 8.012 -1.910 1.00 1.00 H new ATOM 0 HG23 THR A 6 5.858 6.290 -1.458 1.00 1.00 H new ATOM 98 N LEU A 7 1.899 7.453 -4.569 1.00 1.00 N ATOM 99 CA LEU A 7 0.950 7.282 -5.688 1.00 1.00 C ATOM 100 C LEU A 7 1.489 7.973 -6.953 1.00 1.00 C ATOM 101 O LEU A 7 2.140 9.014 -6.877 1.00 1.00 O ATOM 102 CB LEU A 7 -0.420 7.891 -5.294 1.00 1.00 C ATOM 103 CG LEU A 7 -0.934 7.307 -3.937 1.00 1.00 C ATOM 104 CD1 LEU A 7 -2.300 7.944 -3.592 1.00 1.00 C ATOM 105 CD2 LEU A 7 -1.075 5.753 -3.990 1.00 1.00 C ATOM 0 H LEU A 7 1.870 8.375 -4.135 1.00 1.00 H new ATOM 0 HA LEU A 7 0.829 6.219 -5.898 1.00 1.00 H new ATOM 0 HB2 LEU A 7 -0.329 8.974 -5.215 1.00 1.00 H new ATOM 0 HB3 LEU A 7 -1.149 7.689 -6.079 1.00 1.00 H new ATOM 0 HG LEU A 7 -0.201 7.546 -3.166 1.00 1.00 H new ATOM 0 HD11 LEU A 7 -2.662 7.539 -2.647 1.00 1.00 H new ATOM 0 HD12 LEU A 7 -2.186 9.024 -3.504 1.00 1.00 H new ATOM 0 HD13 LEU A 7 -3.017 7.718 -4.381 1.00 1.00 H new ATOM 0 HD21 LEU A 7 -1.434 5.387 -3.028 1.00 1.00 H new ATOM 0 HD22 LEU A 7 -1.784 5.478 -4.771 1.00 1.00 H new ATOM 0 HD23 LEU A 7 -0.105 5.307 -4.208 1.00 1.00 H new ATOM 117 N SER A 8 1.207 7.379 -8.109 1.00 1.00 N ATOM 118 CA SER A 8 1.664 7.940 -9.401 1.00 1.00 C ATOM 119 C SER A 8 0.765 9.101 -9.832 1.00 1.00 C ATOM 120 O SER A 8 0.566 9.336 -11.023 1.00 1.00 O ATOM 121 CB SER A 8 1.643 6.851 -10.486 1.00 1.00 C ATOM 122 OG SER A 8 1.989 7.425 -11.740 1.00 1.00 O ATOM 0 H SER A 8 0.669 6.516 -8.190 1.00 1.00 H new ATOM 0 HA SER A 8 2.682 8.308 -9.272 1.00 1.00 H new ATOM 0 HB2 SER A 8 2.344 6.056 -10.232 1.00 1.00 H new ATOM 0 HB3 SER A 8 0.653 6.397 -10.542 1.00 1.00 H new ATOM 0 HG SER A 8 1.327 8.106 -11.982 1.00 1.00 H new ATOM 128 N LYS A 9 0.225 9.819 -8.852 1.00 1.00 N ATOM 129 CA LYS A 9 -0.662 10.960 -9.129 1.00 1.00 C ATOM 130 C LYS A 9 0.158 12.154 -9.663 1.00 1.00 C ATOM 131 O LYS A 9 0.022 13.287 -9.202 1.00 1.00 O ATOM 132 CB LYS A 9 -1.445 11.332 -7.839 1.00 1.00 C ATOM 133 CG LYS A 9 -2.659 12.241 -8.162 1.00 1.00 C ATOM 134 CD LYS A 9 -3.457 12.557 -6.877 1.00 1.00 C ATOM 135 CE LYS A 9 -4.682 13.425 -7.226 1.00 1.00 C ATOM 136 NZ LYS A 9 -5.469 13.711 -5.994 1.00 1.00 N ATOM 0 H LYS A 9 0.381 9.638 -7.860 1.00 1.00 H new ATOM 0 HA LYS A 9 -1.384 10.688 -9.899 1.00 1.00 H new ATOM 0 HB2 LYS A 9 -1.789 10.424 -7.345 1.00 1.00 H new ATOM 0 HB3 LYS A 9 -0.781 11.842 -7.142 1.00 1.00 H new ATOM 0 HG2 LYS A 9 -2.315 13.168 -8.620 1.00 1.00 H new ATOM 0 HG3 LYS A 9 -3.307 11.748 -8.887 1.00 1.00 H new ATOM 0 HD2 LYS A 9 -3.779 11.631 -6.401 1.00 1.00 H new ATOM 0 HD3 LYS A 9 -2.821 13.079 -6.162 1.00 1.00 H new ATOM 0 HE2 LYS A 9 -4.358 14.359 -7.686 1.00 1.00 H new ATOM 0 HE3 LYS A 9 -5.307 12.910 -7.956 1.00 1.00 H new ATOM 0 HZ1 LYS A 9 -5.845 14.680 -6.039 1.00 1.00 H new ATOM 0 HZ2 LYS A 9 -6.258 13.037 -5.921 1.00 1.00 H new ATOM 0 HZ3 LYS A 9 -4.855 13.617 -5.160 1.00 1.00 H new ATOM 150 N GLU A 10 0.997 11.872 -10.655 1.00 1.00 N ATOM 151 CA GLU A 10 1.846 12.911 -11.265 1.00 1.00 C ATOM 152 C GLU A 10 0.979 14.010 -11.891 1.00 1.00 C ATOM 153 O GLU A 10 1.277 15.200 -11.797 1.00 1.00 O ATOM 154 CB GLU A 10 2.743 12.265 -12.349 1.00 1.00 C ATOM 155 CG GLU A 10 3.636 11.176 -11.716 1.00 1.00 C ATOM 156 CD GLU A 10 4.533 10.525 -12.773 1.00 1.00 C ATOM 157 OE1 GLU A 10 4.041 10.260 -13.858 1.00 1.00 O ATOM 158 OE2 GLU A 10 5.696 10.294 -12.479 1.00 1.00 O ATOM 0 H GLU A 10 1.113 10.942 -11.057 1.00 1.00 H new ATOM 0 HA GLU A 10 2.470 13.361 -10.493 1.00 1.00 H new ATOM 0 HB2 GLU A 10 2.124 11.829 -13.133 1.00 1.00 H new ATOM 0 HB3 GLU A 10 3.364 13.027 -12.821 1.00 1.00 H new ATOM 0 HG2 GLU A 10 4.252 11.615 -10.931 1.00 1.00 H new ATOM 0 HG3 GLU A 10 3.012 10.417 -11.245 1.00 1.00 H new ATOM 165 N THR A 11 -0.104 13.583 -12.534 1.00 1.00 N ATOM 166 CA THR A 11 -1.049 14.510 -13.206 1.00 1.00 C ATOM 167 C THR A 11 -2.459 14.430 -12.550 1.00 1.00 C ATOM 168 O THR A 11 -3.276 13.624 -12.995 1.00 1.00 O ATOM 169 CB THR A 11 -1.138 14.110 -14.698 1.00 1.00 C ATOM 170 OG1 THR A 11 -1.751 12.833 -14.803 1.00 1.00 O ATOM 171 CG2 THR A 11 0.273 14.047 -15.319 1.00 1.00 C ATOM 0 H THR A 11 -0.362 12.599 -12.612 1.00 1.00 H new ATOM 0 HA THR A 11 -0.691 15.535 -13.107 1.00 1.00 H new ATOM 0 HB THR A 11 -1.729 14.855 -15.231 1.00 1.00 H new ATOM 0 HG1 THR A 11 -2.657 12.874 -14.432 1.00 1.00 H new ATOM 0 HG21 THR A 11 0.196 13.764 -16.369 1.00 1.00 H new ATOM 0 HG22 THR A 11 0.749 15.024 -15.240 1.00 1.00 H new ATOM 0 HG23 THR A 11 0.872 13.308 -14.787 1.00 1.00 H new ATOM 179 N PRO A 12 -2.738 15.223 -11.552 1.00 1.00 N ATOM 180 CA PRO A 12 -4.103 15.187 -10.878 1.00 1.00 C ATOM 181 C PRO A 12 -5.281 15.175 -11.883 1.00 1.00 C ATOM 182 O PRO A 12 -5.526 16.171 -12.562 1.00 1.00 O ATOM 183 CB PRO A 12 -4.093 16.481 -10.021 1.00 1.00 C ATOM 184 CG PRO A 12 -2.653 16.618 -9.620 1.00 1.00 C ATOM 185 CD PRO A 12 -1.864 16.245 -10.901 1.00 1.00 C ATOM 0 HA PRO A 12 -4.255 14.276 -10.299 1.00 1.00 H new ATOM 0 HB2 PRO A 12 -4.436 17.344 -10.592 1.00 1.00 H new ATOM 0 HB3 PRO A 12 -4.746 16.393 -9.153 1.00 1.00 H new ATOM 0 HG2 PRO A 12 -2.425 17.633 -9.293 1.00 1.00 H new ATOM 0 HG3 PRO A 12 -2.405 15.954 -8.792 1.00 1.00 H new ATOM 0 HD2 PRO A 12 -1.708 17.111 -11.545 1.00 1.00 H new ATOM 0 HD3 PRO A 12 -0.879 15.842 -10.665 1.00 1.00 H new ATOM 193 N PHE A 13 -5.991 14.054 -11.959 1.00 1.00 N ATOM 194 CA PHE A 13 -7.142 13.912 -12.876 1.00 1.00 C ATOM 195 C PHE A 13 -8.025 12.714 -12.453 1.00 1.00 C ATOM 196 O PHE A 13 -7.646 11.553 -12.612 1.00 1.00 O ATOM 197 CB PHE A 13 -6.640 13.726 -14.347 1.00 1.00 C ATOM 198 CG PHE A 13 -6.300 15.091 -14.978 1.00 1.00 C ATOM 199 CD1 PHE A 13 -7.345 15.978 -15.305 1.00 1.00 C ATOM 200 CD2 PHE A 13 -4.967 15.478 -15.224 1.00 1.00 C ATOM 201 CE1 PHE A 13 -7.060 17.230 -15.867 1.00 1.00 C ATOM 202 CE2 PHE A 13 -4.688 16.731 -15.789 1.00 1.00 C ATOM 203 CZ PHE A 13 -5.734 17.605 -16.109 1.00 1.00 C ATOM 0 H PHE A 13 -5.798 13.223 -11.400 1.00 1.00 H new ATOM 0 HA PHE A 13 -7.744 14.819 -12.824 1.00 1.00 H new ATOM 0 HB2 PHE A 13 -5.759 13.084 -14.359 1.00 1.00 H new ATOM 0 HB3 PHE A 13 -7.407 13.226 -14.939 1.00 1.00 H new ATOM 0 HD1 PHE A 13 -8.370 15.692 -15.122 1.00 1.00 H new ATOM 0 HD2 PHE A 13 -4.158 14.807 -14.976 1.00 1.00 H new ATOM 0 HE1 PHE A 13 -7.865 17.906 -16.114 1.00 1.00 H new ATOM 0 HE2 PHE A 13 -3.665 17.022 -15.977 1.00 1.00 H new ATOM 0 HZ PHE A 13 -5.517 18.570 -16.543 1.00 1.00 H new ATOM 213 N GLU A 14 -9.210 13.023 -11.938 1.00 1.00 N ATOM 214 CA GLU A 14 -10.151 11.970 -11.511 1.00 1.00 C ATOM 215 C GLU A 14 -10.433 11.003 -12.682 1.00 1.00 C ATOM 216 O GLU A 14 -10.527 11.418 -13.838 1.00 1.00 O ATOM 217 CB GLU A 14 -11.465 12.617 -10.995 1.00 1.00 C ATOM 218 CG GLU A 14 -12.465 11.560 -10.445 1.00 1.00 C ATOM 219 CD GLU A 14 -11.904 10.838 -9.217 1.00 1.00 C ATOM 220 OE1 GLU A 14 -11.144 11.450 -8.487 1.00 1.00 O ATOM 221 OE2 GLU A 14 -12.240 9.679 -9.033 1.00 1.00 O ATOM 0 H GLU A 14 -9.547 13.976 -11.804 1.00 1.00 H new ATOM 0 HA GLU A 14 -9.706 11.396 -10.698 1.00 1.00 H new ATOM 0 HB2 GLU A 14 -11.230 13.335 -10.210 1.00 1.00 H new ATOM 0 HB3 GLU A 14 -11.936 13.173 -11.805 1.00 1.00 H new ATOM 0 HG2 GLU A 14 -13.404 12.048 -10.183 1.00 1.00 H new ATOM 0 HG3 GLU A 14 -12.691 10.832 -11.224 1.00 1.00 H new ATOM 228 N GLY A 15 -10.564 9.721 -12.360 1.00 1.00 N ATOM 229 CA GLY A 15 -10.819 8.694 -13.392 1.00 1.00 C ATOM 230 C GLY A 15 -9.517 8.230 -14.044 1.00 1.00 C ATOM 231 O GLY A 15 -9.530 7.622 -15.115 1.00 1.00 O ATOM 0 H GLY A 15 -10.501 9.360 -11.408 1.00 1.00 H new ATOM 0 HA2 GLY A 15 -11.328 7.841 -12.942 1.00 1.00 H new ATOM 0 HA3 GLY A 15 -11.486 9.098 -14.153 1.00 1.00 H new ATOM 235 N GLU A 16 -8.400 8.495 -13.376 1.00 1.00 N ATOM 236 CA GLU A 16 -7.053 8.091 -13.869 1.00 1.00 C ATOM 237 C GLU A 16 -6.513 6.935 -13.038 1.00 1.00 C ATOM 238 O GLU A 16 -6.715 6.904 -11.824 1.00 1.00 O ATOM 239 CB GLU A 16 -6.079 9.300 -13.829 1.00 1.00 C ATOM 240 CG GLU A 16 -4.726 8.948 -14.510 1.00 1.00 C ATOM 241 CD GLU A 16 -3.801 10.170 -14.535 1.00 1.00 C ATOM 242 OE1 GLU A 16 -4.242 11.210 -14.992 1.00 1.00 O ATOM 243 OE2 GLU A 16 -2.663 10.043 -14.106 1.00 1.00 O ATOM 0 H GLU A 16 -8.383 8.990 -12.484 1.00 1.00 H new ATOM 0 HA GLU A 16 -7.142 7.758 -14.903 1.00 1.00 H new ATOM 0 HB2 GLU A 16 -6.532 10.154 -14.333 1.00 1.00 H new ATOM 0 HB3 GLU A 16 -5.904 9.596 -12.795 1.00 1.00 H new ATOM 0 HG2 GLU A 16 -4.244 8.131 -13.973 1.00 1.00 H new ATOM 0 HG3 GLU A 16 -4.904 8.599 -15.527 1.00 1.00 H new ATOM 250 N GLU A 17 -5.804 6.011 -13.678 1.00 1.00 N ATOM 251 CA GLU A 17 -5.222 4.879 -12.962 1.00 1.00 C ATOM 252 C GLU A 17 -3.995 5.352 -12.172 1.00 1.00 C ATOM 253 O GLU A 17 -3.110 6.019 -12.709 1.00 1.00 O ATOM 254 CB GLU A 17 -4.836 3.761 -13.964 1.00 1.00 C ATOM 255 CG GLU A 17 -4.383 2.485 -13.212 1.00 1.00 C ATOM 256 CD GLU A 17 -4.015 1.378 -14.203 1.00 1.00 C ATOM 257 OE1 GLU A 17 -3.281 1.666 -15.133 1.00 1.00 O ATOM 258 OE2 GLU A 17 -4.465 0.258 -14.012 1.00 1.00 O ATOM 0 H GLU A 17 -5.619 6.022 -14.681 1.00 1.00 H new ATOM 0 HA GLU A 17 -5.953 4.472 -12.263 1.00 1.00 H new ATOM 0 HB2 GLU A 17 -5.688 3.529 -14.604 1.00 1.00 H new ATOM 0 HB3 GLU A 17 -4.034 4.110 -14.615 1.00 1.00 H new ATOM 0 HG2 GLU A 17 -3.525 2.714 -12.580 1.00 1.00 H new ATOM 0 HG3 GLU A 17 -5.181 2.141 -12.554 1.00 1.00 H new ATOM 265 N ILE A 18 -3.947 4.981 -10.897 1.00 1.00 N ATOM 266 CA ILE A 18 -2.821 5.354 -10.004 1.00 1.00 C ATOM 267 C ILE A 18 -2.108 4.096 -9.509 1.00 1.00 C ATOM 268 O ILE A 18 -2.732 3.065 -9.262 1.00 1.00 O ATOM 269 CB ILE A 18 -3.342 6.205 -8.800 1.00 1.00 C ATOM 270 CG1 ILE A 18 -4.491 5.455 -8.052 1.00 1.00 C ATOM 271 CG2 ILE A 18 -3.853 7.581 -9.312 1.00 1.00 C ATOM 272 CD1 ILE A 18 -4.874 6.196 -6.758 1.00 1.00 C ATOM 0 H ILE A 18 -4.669 4.421 -10.444 1.00 1.00 H new ATOM 0 HA ILE A 18 -2.108 5.958 -10.565 1.00 1.00 H new ATOM 0 HB ILE A 18 -2.520 6.361 -8.102 1.00 1.00 H new ATOM 0 HG12 ILE A 18 -5.362 5.374 -8.702 1.00 1.00 H new ATOM 0 HG13 ILE A 18 -4.175 4.439 -7.815 1.00 1.00 H new ATOM 0 HG21 ILE A 18 -4.215 8.171 -8.470 1.00 1.00 H new ATOM 0 HG22 ILE A 18 -3.038 8.112 -9.803 1.00 1.00 H new ATOM 0 HG23 ILE A 18 -4.665 7.426 -10.022 1.00 1.00 H new ATOM 0 HD11 ILE A 18 -5.676 5.657 -6.253 1.00 1.00 H new ATOM 0 HD12 ILE A 18 -4.006 6.254 -6.101 1.00 1.00 H new ATOM 0 HD13 ILE A 18 -5.212 7.203 -7.002 1.00 1.00 H new ATOM 284 N THR A 19 -0.790 4.198 -9.357 1.00 1.00 N ATOM 285 CA THR A 19 0.016 3.062 -8.887 1.00 1.00 C ATOM 286 C THR A 19 0.087 3.092 -7.365 1.00 1.00 C ATOM 287 O THR A 19 0.703 3.984 -6.781 1.00 1.00 O ATOM 288 CB THR A 19 1.447 3.138 -9.483 1.00 1.00 C ATOM 289 OG1 THR A 19 1.352 3.289 -10.893 1.00 1.00 O ATOM 290 CG2 THR A 19 2.245 1.851 -9.172 1.00 1.00 C ATOM 0 H THR A 19 -0.256 5.046 -9.549 1.00 1.00 H new ATOM 0 HA THR A 19 -0.449 2.132 -9.213 1.00 1.00 H new ATOM 0 HB THR A 19 1.965 3.987 -9.037 1.00 1.00 H new ATOM 0 HG1 THR A 19 2.252 3.340 -11.278 1.00 1.00 H new ATOM 0 HG21 THR A 19 3.244 1.930 -9.601 1.00 1.00 H new ATOM 0 HG22 THR A 19 2.322 1.723 -8.092 1.00 1.00 H new ATOM 0 HG23 THR A 19 1.732 0.992 -9.603 1.00 1.00 H new ATOM 298 N VAL A 20 -0.528 2.100 -6.728 1.00 1.00 N ATOM 299 CA VAL A 20 -0.527 2.025 -5.254 1.00 1.00 C ATOM 300 C VAL A 20 0.591 1.098 -4.798 1.00 1.00 C ATOM 301 O VAL A 20 0.558 -0.099 -5.080 1.00 1.00 O ATOM 302 CB VAL A 20 -1.898 1.502 -4.741 1.00 1.00 C ATOM 303 CG1 VAL A 20 -1.965 1.598 -3.190 1.00 1.00 C ATOM 304 CG2 VAL A 20 -3.041 2.347 -5.354 1.00 1.00 C ATOM 0 H VAL A 20 -1.029 1.343 -7.193 1.00 1.00 H new ATOM 0 HA VAL A 20 -0.362 3.021 -4.843 1.00 1.00 H new ATOM 0 HB VAL A 20 -2.009 0.460 -5.040 1.00 1.00 H new ATOM 0 HG11 VAL A 20 -2.930 1.229 -2.844 1.00 1.00 H new ATOM 0 HG12 VAL A 20 -1.168 0.996 -2.753 1.00 1.00 H new ATOM 0 HG13 VAL A 20 -1.843 2.637 -2.884 1.00 1.00 H new ATOM 0 HG21 VAL A 20 -4.001 1.978 -4.992 1.00 1.00 H new ATOM 0 HG22 VAL A 20 -2.920 3.390 -5.061 1.00 1.00 H new ATOM 0 HG23 VAL A 20 -3.008 2.269 -6.441 1.00 1.00 H new ATOM 314 N SER A 21 1.573 1.648 -4.089 1.00 1.00 N ATOM 315 CA SER A 21 2.715 0.862 -3.585 1.00 1.00 C ATOM 316 C SER A 21 2.919 1.123 -2.095 1.00 1.00 C ATOM 317 O SER A 21 2.900 2.265 -1.636 1.00 1.00 O ATOM 318 CB SER A 21 3.992 1.262 -4.332 1.00 1.00 C ATOM 319 OG SER A 21 4.363 2.583 -3.959 1.00 1.00 O ATOM 0 H SER A 21 1.608 2.638 -3.845 1.00 1.00 H new ATOM 0 HA SER A 21 2.504 -0.195 -3.746 1.00 1.00 H new ATOM 0 HB2 SER A 21 4.797 0.566 -4.097 1.00 1.00 H new ATOM 0 HB3 SER A 21 3.829 1.208 -5.408 1.00 1.00 H new ATOM 0 HG SER A 21 5.180 2.840 -4.435 1.00 1.00 H new ATOM 325 N ALA A 22 3.127 0.045 -1.347 1.00 1.00 N ATOM 326 CA ALA A 22 3.347 0.122 0.110 1.00 1.00 C ATOM 327 C ALA A 22 4.740 -0.418 0.455 1.00 1.00 C ATOM 328 O ALA A 22 5.090 -1.538 0.085 1.00 1.00 O ATOM 329 CB ALA A 22 2.270 -0.718 0.823 1.00 1.00 C ATOM 0 H ALA A 22 3.150 -0.904 -1.721 1.00 1.00 H new ATOM 0 HA ALA A 22 3.281 1.160 0.437 1.00 1.00 H new ATOM 0 HB1 ALA A 22 2.424 -0.668 1.901 1.00 1.00 H new ATOM 0 HB2 ALA A 22 1.282 -0.327 0.579 1.00 1.00 H new ATOM 0 HB3 ALA A 22 2.341 -1.755 0.494 1.00 1.00 H new ATOM 335 N ARG A 23 5.513 0.380 1.184 1.00 1.00 N ATOM 336 CA ARG A 23 6.869 -0.030 1.579 1.00 1.00 C ATOM 337 C ARG A 23 6.797 -0.889 2.844 1.00 1.00 C ATOM 338 O ARG A 23 6.382 -0.417 3.902 1.00 1.00 O ATOM 339 CB ARG A 23 7.744 1.216 1.836 1.00 1.00 C ATOM 340 CG ARG A 23 7.867 2.056 0.544 1.00 1.00 C ATOM 341 CD ARG A 23 8.755 3.288 0.790 1.00 1.00 C ATOM 342 NE ARG A 23 10.110 2.851 1.137 1.00 1.00 N ATOM 343 CZ ARG A 23 11.073 3.709 1.492 1.00 1.00 C ATOM 344 NH1 ARG A 23 10.832 4.992 1.566 1.00 1.00 N ATOM 345 NH2 ARG A 23 12.262 3.257 1.773 1.00 1.00 N ATOM 0 H ARG A 23 5.235 1.304 1.513 1.00 1.00 H new ATOM 0 HA ARG A 23 7.316 -0.613 0.774 1.00 1.00 H new ATOM 0 HB2 ARG A 23 7.306 1.820 2.631 1.00 1.00 H new ATOM 0 HB3 ARG A 23 8.734 0.911 2.176 1.00 1.00 H new ATOM 0 HG2 ARG A 23 8.291 1.447 -0.255 1.00 1.00 H new ATOM 0 HG3 ARG A 23 6.878 2.373 0.212 1.00 1.00 H new ATOM 0 HD2 ARG A 23 8.781 3.915 -0.101 1.00 1.00 H new ATOM 0 HD3 ARG A 23 8.339 3.894 1.595 1.00 1.00 H new ATOM 0 HE ARG A 23 10.327 1.855 1.107 1.00 1.00 H new ATOM 0 HH11 ARG A 23 9.901 5.349 1.352 1.00 1.00 H new ATOM 0 HH12 ARG A 23 11.575 5.636 1.838 1.00 1.00 H new ATOM 0 HH21 ARG A 23 12.453 2.256 1.721 1.00 1.00 H new ATOM 0 HH22 ARG A 23 13.002 3.904 2.045 1.00 1.00 H new ATOM 359 N VAL A 24 7.204 -2.149 2.723 1.00 1.00 N ATOM 360 CA VAL A 24 7.179 -3.092 3.873 1.00 1.00 C ATOM 361 C VAL A 24 8.570 -3.174 4.520 1.00 1.00 C ATOM 362 O VAL A 24 9.560 -3.437 3.838 1.00 1.00 O ATOM 363 CB VAL A 24 6.720 -4.502 3.395 1.00 1.00 C ATOM 364 CG1 VAL A 24 6.542 -5.456 4.610 1.00 1.00 C ATOM 365 CG2 VAL A 24 5.372 -4.376 2.641 1.00 1.00 C ATOM 0 H VAL A 24 7.555 -2.553 1.855 1.00 1.00 H new ATOM 0 HA VAL A 24 6.471 -2.726 4.616 1.00 1.00 H new ATOM 0 HB VAL A 24 7.481 -4.913 2.731 1.00 1.00 H new ATOM 0 HG11 VAL A 24 6.221 -6.437 4.259 1.00 1.00 H new ATOM 0 HG12 VAL A 24 7.490 -5.552 5.139 1.00 1.00 H new ATOM 0 HG13 VAL A 24 5.790 -5.049 5.285 1.00 1.00 H new ATOM 0 HG21 VAL A 24 5.049 -5.362 2.306 1.00 1.00 H new ATOM 0 HG22 VAL A 24 4.620 -3.955 3.308 1.00 1.00 H new ATOM 0 HG23 VAL A 24 5.498 -3.722 1.778 1.00 1.00 H new ATOM 375 N THR A 25 8.632 -2.950 5.829 1.00 1.00 N ATOM 376 CA THR A 25 9.912 -2.995 6.574 1.00 1.00 C ATOM 377 C THR A 25 10.103 -4.374 7.221 1.00 1.00 C ATOM 378 O THR A 25 9.232 -4.853 7.948 1.00 1.00 O ATOM 379 CB THR A 25 9.915 -1.890 7.660 1.00 1.00 C ATOM 380 OG1 THR A 25 9.743 -0.629 7.027 1.00 1.00 O ATOM 381 CG2 THR A 25 11.249 -1.865 8.446 1.00 1.00 C ATOM 0 H THR A 25 7.819 -2.735 6.406 1.00 1.00 H new ATOM 0 HA THR A 25 10.736 -2.822 5.882 1.00 1.00 H new ATOM 0 HB THR A 25 9.106 -2.098 8.360 1.00 1.00 H new ATOM 0 HG1 THR A 25 9.741 0.079 7.704 1.00 1.00 H new ATOM 0 HG21 THR A 25 11.213 -1.077 9.199 1.00 1.00 H new ATOM 0 HG22 THR A 25 11.401 -2.827 8.935 1.00 1.00 H new ATOM 0 HG23 THR A 25 12.073 -1.673 7.759 1.00 1.00 H new ATOM 389 N ASN A 26 11.248 -4.995 6.957 1.00 1.00 N ATOM 390 CA ASN A 26 11.555 -6.319 7.519 1.00 1.00 C ATOM 391 C ASN A 26 12.105 -6.163 8.943 1.00 1.00 C ATOM 392 O ASN A 26 13.237 -5.722 9.144 1.00 1.00 O ATOM 393 CB ASN A 26 12.585 -7.049 6.625 1.00 1.00 C ATOM 394 CG ASN A 26 12.840 -8.469 7.142 1.00 1.00 C ATOM 395 OD1 ASN A 26 11.926 -9.107 7.661 1.00 1.00 O ATOM 396 ND2 ASN A 26 14.028 -9.000 7.033 1.00 1.00 N ATOM 0 H ASN A 26 11.980 -4.610 6.361 1.00 1.00 H new ATOM 0 HA ASN A 26 10.642 -6.913 7.555 1.00 1.00 H new ATOM 0 HB2 ASN A 26 12.219 -7.090 5.599 1.00 1.00 H new ATOM 0 HB3 ASN A 26 13.520 -6.489 6.608 1.00 1.00 H new ATOM 0 HD21 ASN A 26 14.198 -9.945 7.378 1.00 1.00 H new ATOM 0 HD22 ASN A 26 14.786 -8.470 6.602 1.00 1.00 H new ATOM 403 N ARG A 27 11.291 -6.541 9.925 1.00 1.00 N ATOM 404 CA ARG A 27 11.673 -6.449 11.346 1.00 1.00 C ATOM 405 C ARG A 27 12.162 -7.804 11.850 1.00 1.00 C ATOM 406 O ARG A 27 12.405 -8.718 11.061 1.00 1.00 O ATOM 407 CB ARG A 27 10.447 -5.983 12.163 1.00 1.00 C ATOM 408 CG ARG A 27 10.002 -4.578 11.688 1.00 1.00 C ATOM 409 CD ARG A 27 8.780 -4.104 12.497 1.00 1.00 C ATOM 410 NE ARG A 27 9.147 -3.983 13.911 1.00 1.00 N ATOM 411 CZ ARG A 27 8.259 -3.658 14.859 1.00 1.00 C ATOM 412 NH1 ARG A 27 7.013 -3.404 14.556 1.00 1.00 N ATOM 413 NH2 ARG A 27 8.650 -3.586 16.102 1.00 1.00 N ATOM 0 H ARG A 27 10.356 -6.917 9.769 1.00 1.00 H new ATOM 0 HA ARG A 27 12.484 -5.730 11.462 1.00 1.00 H new ATOM 0 HB2 ARG A 27 9.628 -6.693 12.044 1.00 1.00 H new ATOM 0 HB3 ARG A 27 10.695 -5.956 13.224 1.00 1.00 H new ATOM 0 HG2 ARG A 27 10.822 -3.870 11.806 1.00 1.00 H new ATOM 0 HG3 ARG A 27 9.756 -4.606 10.627 1.00 1.00 H new ATOM 0 HD2 ARG A 27 8.430 -3.144 12.118 1.00 1.00 H new ATOM 0 HD3 ARG A 27 7.958 -4.811 12.383 1.00 1.00 H new ATOM 0 HE ARG A 27 10.115 -4.153 14.183 1.00 1.00 H new ATOM 0 HH11 ARG A 27 6.704 -3.452 13.585 1.00 1.00 H new ATOM 0 HH12 ARG A 27 6.349 -3.158 15.291 1.00 1.00 H new ATOM 0 HH21 ARG A 27 9.623 -3.776 16.342 1.00 1.00 H new ATOM 0 HH22 ARG A 27 7.983 -3.339 16.833 1.00 1.00 H new ATOM 427 N GLY A 28 12.307 -7.926 13.166 1.00 1.00 N ATOM 428 CA GLY A 28 12.775 -9.170 13.795 1.00 1.00 C ATOM 429 C GLY A 28 14.299 -9.161 13.949 1.00 1.00 C ATOM 430 O GLY A 28 14.855 -8.265 14.585 1.00 1.00 O ATOM 0 H GLY A 28 12.107 -7.176 13.827 1.00 1.00 H new ATOM 0 HA2 GLY A 28 12.307 -9.287 14.772 1.00 1.00 H new ATOM 0 HA3 GLY A 28 12.471 -10.025 13.191 1.00 1.00 H new ATOM 434 N ALA A 29 14.961 -10.161 13.378 1.00 1.00 N ATOM 435 CA ALA A 29 16.428 -10.260 13.460 1.00 1.00 C ATOM 436 C ALA A 29 16.959 -11.307 12.474 1.00 1.00 C ATOM 437 O ALA A 29 18.125 -11.696 12.542 1.00 1.00 O ATOM 438 CB ALA A 29 16.839 -10.635 14.895 1.00 1.00 C ATOM 0 H ALA A 29 14.516 -10.915 12.854 1.00 1.00 H new ATOM 0 HA ALA A 29 16.858 -9.294 13.197 1.00 1.00 H new ATOM 0 HB1 ALA A 29 17.925 -10.708 14.955 1.00 1.00 H new ATOM 0 HB2 ALA A 29 16.488 -9.869 15.586 1.00 1.00 H new ATOM 0 HB3 ALA A 29 16.395 -11.594 15.162 1.00 1.00 H new ATOM 444 N ALA A 30 16.099 -11.754 11.565 1.00 1.00 N ATOM 445 CA ALA A 30 16.479 -12.768 10.558 1.00 1.00 C ATOM 446 C ALA A 30 15.777 -12.494 9.226 1.00 1.00 C ATOM 447 O ALA A 30 14.724 -11.858 9.178 1.00 1.00 O ATOM 448 CB ALA A 30 16.095 -14.168 11.072 1.00 1.00 C ATOM 0 H ALA A 30 15.132 -11.437 11.496 1.00 1.00 H new ATOM 0 HA ALA A 30 17.556 -12.719 10.397 1.00 1.00 H new ATOM 0 HB1 ALA A 30 16.374 -14.917 10.331 1.00 1.00 H new ATOM 0 HB2 ALA A 30 16.619 -14.369 12.006 1.00 1.00 H new ATOM 0 HB3 ALA A 30 15.019 -14.210 11.243 1.00 1.00 H new ATOM 454 N GLU A 31 16.375 -12.988 8.148 1.00 1.00 N ATOM 455 CA GLU A 31 15.814 -12.806 6.803 1.00 1.00 C ATOM 456 C GLU A 31 14.383 -13.390 6.733 1.00 1.00 C ATOM 457 O GLU A 31 14.184 -14.586 6.949 1.00 1.00 O ATOM 458 CB GLU A 31 16.751 -13.477 5.751 1.00 1.00 C ATOM 459 CG GLU A 31 17.079 -14.939 6.140 1.00 1.00 C ATOM 460 CD GLU A 31 18.009 -15.576 5.103 1.00 1.00 C ATOM 461 OE1 GLU A 31 18.916 -14.896 4.652 1.00 1.00 O ATOM 462 OE2 GLU A 31 17.799 -16.734 4.776 1.00 1.00 O ATOM 0 H GLU A 31 17.247 -13.517 8.173 1.00 1.00 H new ATOM 0 HA GLU A 31 15.748 -11.741 6.579 1.00 1.00 H new ATOM 0 HB2 GLU A 31 16.274 -13.458 4.771 1.00 1.00 H new ATOM 0 HB3 GLU A 31 17.675 -12.905 5.667 1.00 1.00 H new ATOM 0 HG2 GLU A 31 17.550 -14.963 7.123 1.00 1.00 H new ATOM 0 HG3 GLU A 31 16.158 -15.517 6.214 1.00 1.00 H new ATOM 469 N ALA A 32 13.408 -12.537 6.433 1.00 1.00 N ATOM 470 CA ALA A 32 11.999 -12.957 6.335 1.00 1.00 C ATOM 471 C ALA A 32 11.670 -13.364 4.903 1.00 1.00 C ATOM 472 O ALA A 32 12.239 -12.833 3.948 1.00 1.00 O ATOM 473 CB ALA A 32 11.082 -11.790 6.759 1.00 1.00 C ATOM 0 H ALA A 32 13.561 -11.545 6.252 1.00 1.00 H new ATOM 0 HA ALA A 32 11.838 -13.810 6.994 1.00 1.00 H new ATOM 0 HB1 ALA A 32 10.040 -12.101 6.686 1.00 1.00 H new ATOM 0 HB2 ALA A 32 11.305 -11.507 7.788 1.00 1.00 H new ATOM 0 HB3 ALA A 32 11.252 -10.936 6.103 1.00 1.00 H new ATOM 479 N HIS A 33 10.735 -14.299 4.760 1.00 1.00 N ATOM 480 CA HIS A 33 10.303 -14.791 3.440 1.00 1.00 C ATOM 481 C HIS A 33 8.782 -14.924 3.410 1.00 1.00 C ATOM 482 O HIS A 33 8.100 -14.938 4.435 1.00 1.00 O ATOM 483 CB HIS A 33 10.975 -16.157 3.140 1.00 1.00 C ATOM 484 CG HIS A 33 12.451 -15.972 2.866 1.00 1.00 C ATOM 485 ND1 HIS A 33 13.398 -15.896 3.876 1.00 1.00 N ATOM 486 CD2 HIS A 33 13.147 -15.843 1.690 1.00 1.00 C ATOM 487 CE1 HIS A 33 14.600 -15.731 3.289 1.00 1.00 C ATOM 488 NE2 HIS A 33 14.502 -15.690 1.960 1.00 1.00 N ATOM 0 H HIS A 33 10.254 -14.739 5.545 1.00 1.00 H new ATOM 0 HA HIS A 33 10.606 -14.079 2.672 1.00 1.00 H new ATOM 0 HB2 HIS A 33 10.838 -16.830 3.986 1.00 1.00 H new ATOM 0 HB3 HIS A 33 10.495 -16.624 2.280 1.00 1.00 H new ATOM 0 HD2 HIS A 33 12.708 -15.858 0.703 1.00 1.00 H new ATOM 0 HE1 HIS A 33 15.531 -15.643 3.830 1.00 1.00 H new ATOM 0 HE2 HIS A 33 15.259 -15.572 1.286 1.00 1.00 H new ATOM 497 N ASN A 34 8.258 -15.008 2.192 1.00 1.00 N ATOM 498 CA ASN A 34 6.809 -15.126 1.995 1.00 1.00 C ATOM 499 C ASN A 34 6.073 -13.986 2.725 1.00 1.00 C ATOM 500 O ASN A 34 5.344 -14.209 3.692 1.00 1.00 O ATOM 501 CB ASN A 34 6.311 -16.498 2.489 1.00 1.00 C ATOM 502 CG ASN A 34 7.104 -17.615 1.816 1.00 1.00 C ATOM 503 OD1 ASN A 34 7.453 -17.510 0.640 1.00 1.00 O ATOM 504 ND2 ASN A 34 7.410 -18.684 2.498 1.00 1.00 N ATOM 0 H ASN A 34 8.805 -14.997 1.331 1.00 1.00 H new ATOM 0 HA ASN A 34 6.595 -15.046 0.929 1.00 1.00 H new ATOM 0 HB2 ASN A 34 6.420 -16.565 3.571 1.00 1.00 H new ATOM 0 HB3 ASN A 34 5.250 -16.610 2.268 1.00 1.00 H new ATOM 0 HD21 ASN A 34 7.940 -19.436 2.057 1.00 1.00 H new ATOM 0 HD22 ASN A 34 7.119 -18.768 3.472 1.00 1.00 H new ATOM 511 N VAL A 35 6.272 -12.768 2.234 1.00 1.00 N ATOM 512 CA VAL A 35 5.639 -11.562 2.826 1.00 1.00 C ATOM 513 C VAL A 35 4.743 -10.886 1.768 1.00 1.00 C ATOM 514 O VAL A 35 5.181 -9.919 1.144 1.00 1.00 O ATOM 515 CB VAL A 35 6.757 -10.576 3.302 1.00 1.00 C ATOM 516 CG1 VAL A 35 6.138 -9.379 4.073 1.00 1.00 C ATOM 517 CG2 VAL A 35 7.748 -11.323 4.228 1.00 1.00 C ATOM 0 H VAL A 35 6.865 -12.574 1.427 1.00 1.00 H new ATOM 0 HA VAL A 35 5.025 -11.843 3.682 1.00 1.00 H new ATOM 0 HB VAL A 35 7.282 -10.197 2.425 1.00 1.00 H new ATOM 0 HG11 VAL A 35 6.931 -8.705 4.396 1.00 1.00 H new ATOM 0 HG12 VAL A 35 5.449 -8.843 3.420 1.00 1.00 H new ATOM 0 HG13 VAL A 35 5.598 -9.748 4.945 1.00 1.00 H new ATOM 0 HG21 VAL A 35 8.526 -10.635 4.559 1.00 1.00 H new ATOM 0 HG22 VAL A 35 7.214 -11.711 5.095 1.00 1.00 H new ATOM 0 HG23 VAL A 35 8.203 -12.150 3.683 1.00 1.00 H new ATOM 527 N PRO A 36 3.535 -11.343 1.580 1.00 1.00 N ATOM 528 CA PRO A 36 2.624 -10.709 0.573 1.00 1.00 C ATOM 529 C PRO A 36 1.978 -9.441 1.134 1.00 1.00 C ATOM 530 O PRO A 36 2.150 -9.089 2.301 1.00 1.00 O ATOM 531 CB PRO A 36 1.605 -11.833 0.266 1.00 1.00 C ATOM 532 CG PRO A 36 1.448 -12.543 1.584 1.00 1.00 C ATOM 533 CD PRO A 36 2.856 -12.504 2.246 1.00 1.00 C ATOM 0 HA PRO A 36 3.131 -10.365 -0.329 1.00 1.00 H new ATOM 0 HB2 PRO A 36 0.656 -11.428 -0.086 1.00 1.00 H new ATOM 0 HB3 PRO A 36 1.972 -12.505 -0.510 1.00 1.00 H new ATOM 0 HG2 PRO A 36 0.706 -12.048 2.210 1.00 1.00 H new ATOM 0 HG3 PRO A 36 1.110 -13.569 1.439 1.00 1.00 H new ATOM 0 HD2 PRO A 36 2.787 -12.362 3.324 1.00 1.00 H new ATOM 0 HD3 PRO A 36 3.401 -13.434 2.082 1.00 1.00 H new ATOM 541 N VAL A 37 1.229 -8.758 0.274 1.00 1.00 N ATOM 542 CA VAL A 37 0.543 -7.500 0.666 1.00 1.00 C ATOM 543 C VAL A 37 -0.894 -7.521 0.162 1.00 1.00 C ATOM 544 O VAL A 37 -1.170 -7.928 -0.967 1.00 1.00 O ATOM 545 CB VAL A 37 1.292 -6.264 0.083 1.00 1.00 C ATOM 546 CG1 VAL A 37 0.642 -4.937 0.576 1.00 1.00 C ATOM 547 CG2 VAL A 37 2.770 -6.303 0.527 1.00 1.00 C ATOM 0 H VAL A 37 1.073 -9.039 -0.694 1.00 1.00 H new ATOM 0 HA VAL A 37 0.544 -7.424 1.753 1.00 1.00 H new ATOM 0 HB VAL A 37 1.226 -6.301 -1.004 1.00 1.00 H new ATOM 0 HG11 VAL A 37 1.182 -4.089 0.156 1.00 1.00 H new ATOM 0 HG12 VAL A 37 -0.399 -4.900 0.254 1.00 1.00 H new ATOM 0 HG13 VAL A 37 0.687 -4.892 1.664 1.00 1.00 H new ATOM 0 HG21 VAL A 37 3.295 -5.439 0.120 1.00 1.00 H new ATOM 0 HG22 VAL A 37 2.824 -6.280 1.615 1.00 1.00 H new ATOM 0 HG23 VAL A 37 3.236 -7.217 0.160 1.00 1.00 H new ATOM 557 N ALA A 38 -1.809 -7.053 1.005 1.00 1.00 N ATOM 558 CA ALA A 38 -3.236 -6.994 0.660 1.00 1.00 C ATOM 559 C ALA A 38 -3.754 -5.586 0.897 1.00 1.00 C ATOM 560 O ALA A 38 -3.828 -5.133 2.039 1.00 1.00 O ATOM 561 CB ALA A 38 -4.009 -7.977 1.560 1.00 1.00 C ATOM 0 H ALA A 38 -1.591 -6.706 1.939 1.00 1.00 H new ATOM 0 HA ALA A 38 -3.374 -7.261 -0.388 1.00 1.00 H new ATOM 0 HB1 ALA A 38 -5.070 -7.941 1.312 1.00 1.00 H new ATOM 0 HB2 ALA A 38 -3.634 -8.988 1.401 1.00 1.00 H new ATOM 0 HB3 ALA A 38 -3.871 -7.699 2.605 1.00 1.00 H new ATOM 567 N VAL A 39 -4.144 -4.906 -0.178 1.00 1.00 N ATOM 568 CA VAL A 39 -4.680 -3.539 -0.104 1.00 1.00 C ATOM 569 C VAL A 39 -6.185 -3.573 -0.371 1.00 1.00 C ATOM 570 O VAL A 39 -6.669 -4.305 -1.234 1.00 1.00 O ATOM 571 CB VAL A 39 -3.971 -2.637 -1.154 1.00 1.00 C ATOM 572 CG1 VAL A 39 -4.423 -1.162 -0.988 1.00 1.00 C ATOM 573 CG2 VAL A 39 -2.439 -2.730 -0.965 1.00 1.00 C ATOM 0 H VAL A 39 -4.100 -5.281 -1.125 1.00 1.00 H new ATOM 0 HA VAL A 39 -4.499 -3.128 0.889 1.00 1.00 H new ATOM 0 HB VAL A 39 -4.240 -2.980 -2.153 1.00 1.00 H new ATOM 0 HG11 VAL A 39 -3.919 -0.541 -1.729 1.00 1.00 H new ATOM 0 HG12 VAL A 39 -5.502 -1.094 -1.130 1.00 1.00 H new ATOM 0 HG13 VAL A 39 -4.166 -0.813 0.012 1.00 1.00 H new ATOM 0 HG21 VAL A 39 -1.943 -2.098 -1.701 1.00 1.00 H new ATOM 0 HG22 VAL A 39 -2.175 -2.395 0.038 1.00 1.00 H new ATOM 0 HG23 VAL A 39 -2.118 -3.763 -1.099 1.00 1.00 H new ATOM 583 N TYR A 40 -6.916 -2.757 0.381 1.00 1.00 N ATOM 584 CA TYR A 40 -8.381 -2.681 0.232 1.00 1.00 C ATOM 585 C TYR A 40 -8.862 -1.245 0.485 1.00 1.00 C ATOM 586 O TYR A 40 -8.512 -0.621 1.487 1.00 1.00 O ATOM 587 CB TYR A 40 -9.047 -3.672 1.213 1.00 1.00 C ATOM 588 CG TYR A 40 -8.527 -3.406 2.628 1.00 1.00 C ATOM 589 CD1 TYR A 40 -9.184 -2.485 3.466 1.00 1.00 C ATOM 590 CD2 TYR A 40 -7.371 -4.068 3.100 1.00 1.00 C ATOM 591 CE1 TYR A 40 -8.696 -2.230 4.752 1.00 1.00 C ATOM 592 CE2 TYR A 40 -6.891 -3.811 4.388 1.00 1.00 C ATOM 593 CZ TYR A 40 -7.554 -2.892 5.213 1.00 1.00 C ATOM 594 OH TYR A 40 -7.078 -2.629 6.479 1.00 1.00 O ATOM 0 H TYR A 40 -6.531 -2.140 1.096 1.00 1.00 H new ATOM 0 HA TYR A 40 -8.662 -2.955 -0.785 1.00 1.00 H new ATOM 0 HB2 TYR A 40 -10.131 -3.558 1.184 1.00 1.00 H new ATOM 0 HB3 TYR A 40 -8.826 -4.698 0.918 1.00 1.00 H new ATOM 0 HD1 TYR A 40 -10.068 -1.973 3.115 1.00 1.00 H new ATOM 0 HD2 TYR A 40 -6.857 -4.774 2.464 1.00 1.00 H new ATOM 0 HE1 TYR A 40 -9.202 -1.521 5.390 1.00 1.00 H new ATOM 0 HE2 TYR A 40 -6.009 -4.321 4.747 1.00 1.00 H new ATOM 0 HH TYR A 40 -7.368 -3.337 7.091 1.00 1.00 H new ATOM 604 N LEU A 41 -9.672 -0.736 -0.437 1.00 1.00 N ATOM 605 CA LEU A 41 -10.198 0.637 -0.321 1.00 1.00 C ATOM 606 C LEU A 41 -11.447 0.646 0.565 1.00 1.00 C ATOM 607 O LEU A 41 -12.401 -0.089 0.309 1.00 1.00 O ATOM 608 CB LEU A 41 -10.552 1.197 -1.732 1.00 1.00 C ATOM 609 CG LEU A 41 -10.780 2.767 -1.688 1.00 1.00 C ATOM 610 CD1 LEU A 41 -9.448 3.515 -1.967 1.00 1.00 C ATOM 611 CD2 LEU A 41 -11.846 3.192 -2.731 1.00 1.00 C ATOM 0 H LEU A 41 -9.981 -1.240 -1.268 1.00 1.00 H new ATOM 0 HA LEU A 41 -9.433 1.268 0.131 1.00 1.00 H new ATOM 0 HB2 LEU A 41 -9.749 0.963 -2.431 1.00 1.00 H new ATOM 0 HB3 LEU A 41 -11.451 0.707 -2.105 1.00 1.00 H new ATOM 0 HG LEU A 41 -11.135 3.031 -0.692 1.00 1.00 H new ATOM 0 HD11 LEU A 41 -9.621 4.591 -1.933 1.00 1.00 H new ATOM 0 HD12 LEU A 41 -8.712 3.242 -1.211 1.00 1.00 H new ATOM 0 HD13 LEU A 41 -9.075 3.238 -2.953 1.00 1.00 H new ATOM 0 HD21 LEU A 41 -11.989 4.272 -2.686 1.00 1.00 H new ATOM 0 HD22 LEU A 41 -11.510 2.912 -3.729 1.00 1.00 H new ATOM 0 HD23 LEU A 41 -12.789 2.692 -2.512 1.00 1.00 H new ATOM 623 N GLY A 42 -11.433 1.481 1.600 1.00 1.00 N ATOM 624 CA GLY A 42 -12.564 1.612 2.536 1.00 1.00 C ATOM 625 C GLY A 42 -12.122 1.325 3.963 1.00 1.00 C ATOM 626 O GLY A 42 -10.938 1.399 4.297 1.00 1.00 O ATOM 0 H GLY A 42 -10.643 2.088 1.820 1.00 1.00 H new ATOM 0 HA2 GLY A 42 -12.978 2.619 2.474 1.00 1.00 H new ATOM 0 HA3 GLY A 42 -13.359 0.923 2.251 1.00 1.00 H new ATOM 630 N ASN A 43 -13.093 1.001 4.810 1.00 1.00 N ATOM 631 CA ASN A 43 -12.825 0.711 6.239 1.00 1.00 C ATOM 632 C ASN A 43 -12.994 -0.808 6.555 1.00 1.00 C ATOM 633 O ASN A 43 -13.898 -1.431 5.999 1.00 1.00 O ATOM 634 CB ASN A 43 -13.810 1.541 7.084 1.00 1.00 C ATOM 635 CG ASN A 43 -13.586 3.041 6.844 1.00 1.00 C ATOM 636 OD1 ASN A 43 -12.912 3.700 7.635 1.00 1.00 O ATOM 637 ND2 ASN A 43 -14.101 3.617 5.788 1.00 1.00 N ATOM 0 H ASN A 43 -14.075 0.929 4.545 1.00 1.00 H new ATOM 0 HA ASN A 43 -11.794 0.976 6.475 1.00 1.00 H new ATOM 0 HB2 ASN A 43 -14.835 1.274 6.827 1.00 1.00 H new ATOM 0 HB3 ASN A 43 -13.676 1.311 8.141 1.00 1.00 H new ATOM 0 HD21 ASN A 43 -13.944 4.611 5.621 1.00 1.00 H new ATOM 0 HD22 ASN A 43 -14.660 3.072 5.131 1.00 1.00 H new ATOM 644 N PRO A 44 -12.189 -1.371 7.413 1.00 1.00 N ATOM 645 CA PRO A 44 -12.328 -2.843 7.747 1.00 1.00 C ATOM 646 C PRO A 44 -13.592 -3.123 8.584 1.00 1.00 C ATOM 647 O PRO A 44 -14.074 -4.255 8.631 1.00 1.00 O ATOM 648 CB PRO A 44 -11.016 -3.158 8.519 1.00 1.00 C ATOM 649 CG PRO A 44 -10.705 -1.867 9.220 1.00 1.00 C ATOM 650 CD PRO A 44 -11.062 -0.769 8.192 1.00 1.00 C ATOM 0 HA PRO A 44 -12.452 -3.474 6.867 1.00 1.00 H new ATOM 0 HB2 PRO A 44 -11.153 -3.976 9.226 1.00 1.00 H new ATOM 0 HB3 PRO A 44 -10.213 -3.452 7.843 1.00 1.00 H new ATOM 0 HG2 PRO A 44 -11.291 -1.761 10.133 1.00 1.00 H new ATOM 0 HG3 PRO A 44 -9.655 -1.815 9.507 1.00 1.00 H new ATOM 0 HD2 PRO A 44 -11.363 0.157 8.682 1.00 1.00 H new ATOM 0 HD3 PRO A 44 -10.214 -0.529 7.550 1.00 1.00 H new ATOM 658 N ALA A 45 -14.104 -2.089 9.243 1.00 1.00 N ATOM 659 CA ALA A 45 -15.310 -2.230 10.079 1.00 1.00 C ATOM 660 C ALA A 45 -16.528 -2.628 9.225 1.00 1.00 C ATOM 661 O ALA A 45 -17.287 -3.526 9.588 1.00 1.00 O ATOM 662 CB ALA A 45 -15.589 -0.895 10.797 1.00 1.00 C ATOM 0 H ALA A 45 -13.713 -1.147 9.221 1.00 1.00 H new ATOM 0 HA ALA A 45 -15.138 -3.017 10.813 1.00 1.00 H new ATOM 0 HB1 ALA A 45 -16.480 -0.994 11.417 1.00 1.00 H new ATOM 0 HB2 ALA A 45 -14.737 -0.635 11.426 1.00 1.00 H new ATOM 0 HB3 ALA A 45 -15.747 -0.110 10.057 1.00 1.00 H new ATOM 668 N GLN A 46 -16.696 -1.948 8.096 1.00 1.00 N ATOM 669 CA GLN A 46 -17.832 -2.237 7.194 1.00 1.00 C ATOM 670 C GLN A 46 -17.609 -3.572 6.476 1.00 1.00 C ATOM 671 O GLN A 46 -18.306 -4.554 6.731 1.00 1.00 O ATOM 672 CB GLN A 46 -17.993 -1.087 6.165 1.00 1.00 C ATOM 673 CG GLN A 46 -19.254 -1.296 5.286 1.00 1.00 C ATOM 674 CD GLN A 46 -19.431 -0.123 4.315 1.00 1.00 C ATOM 675 OE1 GLN A 46 -18.556 0.131 3.485 1.00 1.00 O ATOM 676 NE2 GLN A 46 -20.514 0.608 4.365 1.00 1.00 N ATOM 0 H GLN A 46 -16.077 -1.202 7.777 1.00 1.00 H new ATOM 0 HA GLN A 46 -18.746 -2.311 7.783 1.00 1.00 H new ATOM 0 HB2 GLN A 46 -18.065 -0.134 6.689 1.00 1.00 H new ATOM 0 HB3 GLN A 46 -17.108 -1.036 5.531 1.00 1.00 H new ATOM 0 HG2 GLN A 46 -19.165 -2.228 4.728 1.00 1.00 H new ATOM 0 HG3 GLN A 46 -20.136 -1.387 5.920 1.00 1.00 H new ATOM 0 HE21 GLN A 46 -21.239 0.399 5.051 1.00 1.00 H new ATOM 0 HE22 GLN A 46 -20.634 1.387 3.718 1.00 1.00 H new ATOM 685 N GLY A 47 -16.636 -3.589 5.570 1.00 1.00 N ATOM 686 CA GLY A 47 -16.320 -4.809 4.810 1.00 1.00 C ATOM 687 C GLY A 47 -15.425 -4.494 3.617 1.00 1.00 C ATOM 688 O GLY A 47 -15.891 -4.437 2.479 1.00 1.00 O ATOM 0 H GLY A 47 -16.054 -2.784 5.341 1.00 1.00 H new ATOM 0 HA2 GLY A 47 -15.824 -5.529 5.461 1.00 1.00 H new ATOM 0 HA3 GLY A 47 -17.243 -5.275 4.464 1.00 1.00 H new ATOM 692 N GLY A 48 -14.140 -4.290 3.885 1.00 1.00 N ATOM 693 CA GLY A 48 -13.175 -3.983 2.824 1.00 1.00 C ATOM 694 C GLY A 48 -13.071 -5.137 1.825 1.00 1.00 C ATOM 695 O GLY A 48 -13.528 -6.247 2.100 1.00 1.00 O ATOM 0 H GLY A 48 -13.739 -4.330 4.822 1.00 1.00 H new ATOM 0 HA2 GLY A 48 -13.478 -3.074 2.304 1.00 1.00 H new ATOM 0 HA3 GLY A 48 -12.196 -3.788 3.263 1.00 1.00 H new ATOM 699 N VAL A 49 -12.460 -4.871 0.674 1.00 1.00 N ATOM 700 CA VAL A 49 -12.289 -5.892 -0.391 1.00 1.00 C ATOM 701 C VAL A 49 -10.864 -5.845 -0.957 1.00 1.00 C ATOM 702 O VAL A 49 -10.283 -4.774 -1.127 1.00 1.00 O ATOM 703 CB VAL A 49 -13.340 -5.646 -1.514 1.00 1.00 C ATOM 704 CG1 VAL A 49 -13.145 -4.253 -2.164 1.00 1.00 C ATOM 705 CG2 VAL A 49 -13.255 -6.746 -2.606 1.00 1.00 C ATOM 0 H VAL A 49 -12.069 -3.958 0.441 1.00 1.00 H new ATOM 0 HA VAL A 49 -12.447 -6.884 0.031 1.00 1.00 H new ATOM 0 HB VAL A 49 -14.326 -5.683 -1.051 1.00 1.00 H new ATOM 0 HG11 VAL A 49 -13.892 -4.108 -2.944 1.00 1.00 H new ATOM 0 HG12 VAL A 49 -13.258 -3.479 -1.405 1.00 1.00 H new ATOM 0 HG13 VAL A 49 -12.148 -4.191 -2.600 1.00 1.00 H new ATOM 0 HG21 VAL A 49 -13.999 -6.551 -3.378 1.00 1.00 H new ATOM 0 HG22 VAL A 49 -12.260 -6.740 -3.051 1.00 1.00 H new ATOM 0 HG23 VAL A 49 -13.446 -7.720 -2.156 1.00 1.00 H new ATOM 715 N GLU A 50 -10.318 -7.020 -1.254 1.00 1.00 N ATOM 716 CA GLU A 50 -8.958 -7.107 -1.807 1.00 1.00 C ATOM 717 C GLU A 50 -8.964 -6.650 -3.281 1.00 1.00 C ATOM 718 O GLU A 50 -9.816 -7.062 -4.067 1.00 1.00 O ATOM 719 CB GLU A 50 -8.437 -8.561 -1.680 1.00 1.00 C ATOM 720 CG GLU A 50 -6.957 -8.660 -2.125 1.00 1.00 C ATOM 721 CD GLU A 50 -6.436 -10.092 -1.981 1.00 1.00 C ATOM 722 OE1 GLU A 50 -7.000 -10.846 -1.202 1.00 1.00 O ATOM 723 OE2 GLU A 50 -5.484 -10.416 -2.669 1.00 1.00 O ATOM 0 H GLU A 50 -10.784 -7.918 -1.126 1.00 1.00 H new ATOM 0 HA GLU A 50 -8.291 -6.451 -1.247 1.00 1.00 H new ATOM 0 HB2 GLU A 50 -8.533 -8.897 -0.648 1.00 1.00 H new ATOM 0 HB3 GLU A 50 -9.049 -9.225 -2.290 1.00 1.00 H new ATOM 0 HG2 GLU A 50 -6.863 -8.337 -3.162 1.00 1.00 H new ATOM 0 HG3 GLU A 50 -6.347 -7.985 -1.525 1.00 1.00 H new ATOM 730 N ILE A 51 -7.995 -5.813 -3.636 1.00 1.00 N ATOM 731 CA ILE A 51 -7.880 -5.290 -5.027 1.00 1.00 C ATOM 732 C ILE A 51 -6.845 -6.103 -5.787 1.00 1.00 C ATOM 733 O ILE A 51 -7.035 -6.439 -6.957 1.00 1.00 O ATOM 734 CB ILE A 51 -7.472 -3.781 -5.002 1.00 1.00 C ATOM 735 CG1 ILE A 51 -8.512 -2.987 -4.155 1.00 1.00 C ATOM 736 CG2 ILE A 51 -7.436 -3.205 -6.451 1.00 1.00 C ATOM 737 CD1 ILE A 51 -8.051 -1.539 -3.932 1.00 1.00 C ATOM 0 H ILE A 51 -7.275 -5.474 -2.998 1.00 1.00 H new ATOM 0 HA ILE A 51 -8.844 -5.379 -5.528 1.00 1.00 H new ATOM 0 HB ILE A 51 -6.479 -3.686 -4.562 1.00 1.00 H new ATOM 0 HG12 ILE A 51 -9.477 -2.991 -4.661 1.00 1.00 H new ATOM 0 HG13 ILE A 51 -8.654 -3.479 -3.193 1.00 1.00 H new ATOM 0 HG21 ILE A 51 -7.150 -2.154 -6.418 1.00 1.00 H new ATOM 0 HG22 ILE A 51 -6.710 -3.760 -7.045 1.00 1.00 H new ATOM 0 HG23 ILE A 51 -8.423 -3.299 -6.904 1.00 1.00 H new ATOM 0 HD11 ILE A 51 -8.795 -1.008 -3.338 1.00 1.00 H new ATOM 0 HD12 ILE A 51 -7.097 -1.538 -3.404 1.00 1.00 H new ATOM 0 HD13 ILE A 51 -7.933 -1.042 -4.895 1.00 1.00 H new ATOM 749 N GLY A 52 -5.737 -6.402 -5.117 1.00 1.00 N ATOM 750 CA GLY A 52 -4.660 -7.173 -5.734 1.00 1.00 C ATOM 751 C GLY A 52 -3.517 -7.380 -4.752 1.00 1.00 C ATOM 752 O GLY A 52 -3.471 -6.762 -3.689 1.00 1.00 O ATOM 0 H GLY A 52 -5.560 -6.125 -4.152 1.00 1.00 H new ATOM 0 HA2 GLY A 52 -5.041 -8.139 -6.065 1.00 1.00 H new ATOM 0 HA3 GLY A 52 -4.295 -6.653 -6.620 1.00 1.00 H new ATOM 756 N ARG A 53 -2.589 -8.258 -5.119 1.00 1.00 N ATOM 757 CA ARG A 53 -1.428 -8.557 -4.268 1.00 1.00 C ATOM 758 C ARG A 53 -0.253 -9.044 -5.121 1.00 1.00 C ATOM 759 O ARG A 53 -0.409 -9.395 -6.290 1.00 1.00 O ATOM 760 CB ARG A 53 -1.809 -9.620 -3.208 1.00 1.00 C ATOM 761 CG ARG A 53 -2.340 -10.908 -3.884 1.00 1.00 C ATOM 762 CD ARG A 53 -2.667 -11.977 -2.823 1.00 1.00 C ATOM 763 NE ARG A 53 -3.201 -13.175 -3.480 1.00 1.00 N ATOM 764 CZ ARG A 53 -3.541 -14.276 -2.799 1.00 1.00 C ATOM 765 NH1 ARG A 53 -3.408 -14.327 -1.498 1.00 1.00 N ATOM 766 NH2 ARG A 53 -4.012 -15.311 -3.440 1.00 1.00 N ATOM 0 H ARG A 53 -2.612 -8.777 -5.997 1.00 1.00 H new ATOM 0 HA ARG A 53 -1.123 -7.645 -3.754 1.00 1.00 H new ATOM 0 HB2 ARG A 53 -0.939 -9.858 -2.596 1.00 1.00 H new ATOM 0 HB3 ARG A 53 -2.568 -9.216 -2.539 1.00 1.00 H new ATOM 0 HG2 ARG A 53 -3.233 -10.679 -4.466 1.00 1.00 H new ATOM 0 HG3 ARG A 53 -1.596 -11.294 -4.581 1.00 1.00 H new ATOM 0 HD2 ARG A 53 -1.770 -12.229 -2.258 1.00 1.00 H new ATOM 0 HD3 ARG A 53 -3.393 -11.586 -2.110 1.00 1.00 H new ATOM 0 HE ARG A 53 -3.318 -13.169 -4.493 1.00 1.00 H new ATOM 0 HH11 ARG A 53 -3.041 -13.521 -0.991 1.00 1.00 H new ATOM 0 HH12 ARG A 53 -3.671 -15.172 -0.991 1.00 1.00 H new ATOM 0 HH21 ARG A 53 -4.119 -15.278 -4.454 1.00 1.00 H new ATOM 0 HH22 ARG A 53 -4.273 -16.153 -2.927 1.00 1.00 H new ATOM 780 N ASP A 54 0.926 -9.071 -4.508 1.00 1.00 N ATOM 781 CA ASP A 54 2.146 -9.524 -5.199 1.00 1.00 C ATOM 782 C ASP A 54 3.166 -10.049 -4.177 1.00 1.00 C ATOM 783 O ASP A 54 3.685 -9.285 -3.362 1.00 1.00 O ATOM 784 CB ASP A 54 2.761 -8.348 -5.993 1.00 1.00 C ATOM 785 CG ASP A 54 1.796 -7.877 -7.089 1.00 1.00 C ATOM 786 OD1 ASP A 54 1.479 -8.678 -7.952 1.00 1.00 O ATOM 787 OD2 ASP A 54 1.391 -6.725 -7.048 1.00 1.00 O ATOM 0 H ASP A 54 1.071 -8.788 -3.539 1.00 1.00 H new ATOM 0 HA ASP A 54 1.887 -10.329 -5.887 1.00 1.00 H new ATOM 0 HB2 ASP A 54 2.984 -7.522 -5.317 1.00 1.00 H new ATOM 0 HB3 ASP A 54 3.705 -8.658 -6.440 1.00 1.00 H new ATOM 792 N THR A 55 3.459 -11.342 -4.246 1.00 1.00 N ATOM 793 CA THR A 55 4.427 -11.959 -3.323 1.00 1.00 C ATOM 794 C THR A 55 5.851 -11.579 -3.749 1.00 1.00 C ATOM 795 O THR A 55 6.208 -11.675 -4.923 1.00 1.00 O ATOM 796 CB THR A 55 4.252 -13.499 -3.324 1.00 1.00 C ATOM 797 OG1 THR A 55 2.883 -13.806 -3.107 1.00 1.00 O ATOM 798 CG2 THR A 55 5.090 -14.151 -2.201 1.00 1.00 C ATOM 0 H THR A 55 3.049 -11.986 -4.922 1.00 1.00 H new ATOM 0 HA THR A 55 4.250 -11.593 -2.311 1.00 1.00 H new ATOM 0 HB THR A 55 4.590 -13.887 -4.285 1.00 1.00 H new ATOM 0 HG1 THR A 55 2.762 -14.778 -3.108 1.00 1.00 H new ATOM 0 HG21 THR A 55 4.950 -15.232 -2.223 1.00 1.00 H new ATOM 0 HG22 THR A 55 6.144 -13.919 -2.352 1.00 1.00 H new ATOM 0 HG23 THR A 55 4.768 -13.763 -1.235 1.00 1.00 H new ATOM 806 N ILE A 56 6.655 -11.154 -2.779 1.00 1.00 N ATOM 807 CA ILE A 56 8.047 -10.751 -3.043 1.00 1.00 C ATOM 808 C ILE A 56 8.953 -11.984 -2.989 1.00 1.00 C ATOM 809 O ILE A 56 8.703 -12.923 -2.233 1.00 1.00 O ATOM 810 CB ILE A 56 8.484 -9.683 -1.993 1.00 1.00 C ATOM 811 CG1 ILE A 56 7.548 -8.422 -2.108 1.00 1.00 C ATOM 812 CG2 ILE A 56 9.968 -9.256 -2.235 1.00 1.00 C ATOM 813 CD1 ILE A 56 7.730 -7.463 -0.910 1.00 1.00 C ATOM 0 H ILE A 56 6.374 -11.077 -1.801 1.00 1.00 H new ATOM 0 HA ILE A 56 8.129 -10.310 -4.036 1.00 1.00 H new ATOM 0 HB ILE A 56 8.401 -10.114 -0.995 1.00 1.00 H new ATOM 0 HG12 ILE A 56 7.765 -7.891 -3.035 1.00 1.00 H new ATOM 0 HG13 ILE A 56 6.508 -8.744 -2.161 1.00 1.00 H new ATOM 0 HG21 ILE A 56 10.258 -8.511 -1.494 1.00 1.00 H new ATOM 0 HG22 ILE A 56 10.617 -10.127 -2.145 1.00 1.00 H new ATOM 0 HG23 ILE A 56 10.066 -8.832 -3.234 1.00 1.00 H new ATOM 0 HD11 ILE A 56 7.067 -6.606 -1.026 1.00 1.00 H new ATOM 0 HD12 ILE A 56 7.488 -7.986 0.015 1.00 1.00 H new ATOM 0 HD13 ILE A 56 8.764 -7.120 -0.872 1.00 1.00 H new ATOM 825 N SER A 57 10.017 -11.960 -3.785 1.00 1.00 N ATOM 826 CA SER A 57 10.962 -13.085 -3.820 1.00 1.00 C ATOM 827 C SER A 57 11.616 -13.273 -2.459 1.00 1.00 C ATOM 828 O SER A 57 11.652 -14.376 -1.912 1.00 1.00 O ATOM 829 CB SER A 57 12.048 -12.819 -4.873 1.00 1.00 C ATOM 830 OG SER A 57 12.975 -13.897 -4.873 1.00 1.00 O ATOM 0 H SER A 57 10.250 -11.188 -4.409 1.00 1.00 H new ATOM 0 HA SER A 57 10.413 -13.991 -4.078 1.00 1.00 H new ATOM 0 HB2 SER A 57 11.596 -12.712 -5.859 1.00 1.00 H new ATOM 0 HB3 SER A 57 12.561 -11.883 -4.655 1.00 1.00 H new ATOM 0 HG SER A 57 13.669 -13.732 -5.545 1.00 1.00 H new ATOM 836 N ARG A 58 12.129 -12.177 -1.911 1.00 1.00 N ATOM 837 CA ARG A 58 12.788 -12.203 -0.597 1.00 1.00 C ATOM 838 C ARG A 58 13.198 -10.782 -0.178 1.00 1.00 C ATOM 839 O ARG A 58 13.570 -9.955 -1.011 1.00 1.00 O ATOM 840 CB ARG A 58 14.034 -13.137 -0.630 1.00 1.00 C ATOM 841 CG ARG A 58 14.998 -12.710 -1.760 1.00 1.00 C ATOM 842 CD ARG A 58 16.205 -13.664 -1.824 1.00 1.00 C ATOM 843 NE ARG A 58 17.109 -13.244 -2.897 1.00 1.00 N ATOM 844 CZ ARG A 58 18.214 -13.933 -3.211 1.00 1.00 C ATOM 845 NH1 ARG A 58 18.520 -15.030 -2.567 1.00 1.00 N ATOM 846 NH2 ARG A 58 18.988 -13.510 -4.173 1.00 1.00 N ATOM 0 H ARG A 58 12.105 -11.257 -2.351 1.00 1.00 H new ATOM 0 HA ARG A 58 12.082 -12.594 0.136 1.00 1.00 H new ATOM 0 HB2 ARG A 58 14.550 -13.100 0.330 1.00 1.00 H new ATOM 0 HB3 ARG A 58 13.719 -14.169 -0.783 1.00 1.00 H new ATOM 0 HG2 ARG A 58 14.473 -12.713 -2.715 1.00 1.00 H new ATOM 0 HG3 ARG A 58 15.341 -11.690 -1.588 1.00 1.00 H new ATOM 0 HD2 ARG A 58 16.732 -13.664 -0.870 1.00 1.00 H new ATOM 0 HD3 ARG A 58 15.865 -14.685 -2.000 1.00 1.00 H new ATOM 0 HE ARG A 58 16.890 -12.398 -3.423 1.00 1.00 H new ATOM 0 HH11 ARG A 58 17.915 -15.368 -1.818 1.00 1.00 H new ATOM 0 HH12 ARG A 58 19.364 -15.548 -2.814 1.00 1.00 H new ATOM 0 HH21 ARG A 58 18.750 -12.658 -4.682 1.00 1.00 H new ATOM 0 HH22 ARG A 58 19.831 -14.031 -4.416 1.00 1.00 H new ATOM 860 N ILE A 59 13.152 -10.524 1.125 1.00 1.00 N ATOM 861 CA ILE A 59 13.526 -9.178 1.669 1.00 1.00 C ATOM 862 C ILE A 59 14.753 -9.295 2.633 1.00 1.00 C ATOM 863 O ILE A 59 14.659 -10.056 3.596 1.00 1.00 O ATOM 864 CB ILE A 59 12.310 -8.541 2.435 1.00 1.00 C ATOM 865 CG1 ILE A 59 11.022 -8.634 1.559 1.00 1.00 C ATOM 866 CG2 ILE A 59 12.622 -7.049 2.759 1.00 1.00 C ATOM 867 CD1 ILE A 59 9.789 -8.088 2.313 1.00 1.00 C ATOM 0 H ILE A 59 12.867 -11.202 1.832 1.00 1.00 H new ATOM 0 HA ILE A 59 13.796 -8.536 0.831 1.00 1.00 H new ATOM 0 HB ILE A 59 12.146 -9.086 3.365 1.00 1.00 H new ATOM 0 HG12 ILE A 59 11.166 -8.071 0.637 1.00 1.00 H new ATOM 0 HG13 ILE A 59 10.847 -9.672 1.275 1.00 1.00 H new ATOM 0 HG21 ILE A 59 11.778 -6.608 3.290 1.00 1.00 H new ATOM 0 HG22 ILE A 59 13.514 -6.991 3.383 1.00 1.00 H new ATOM 0 HG23 ILE A 59 12.792 -6.503 1.831 1.00 1.00 H new ATOM 0 HD11 ILE A 59 8.908 -8.167 1.676 1.00 1.00 H new ATOM 0 HD12 ILE A 59 9.632 -8.668 3.222 1.00 1.00 H new ATOM 0 HD13 ILE A 59 9.955 -7.043 2.574 1.00 1.00 H new ATOM 879 N PRO A 60 15.825 -8.585 2.409 1.00 1.00 N ATOM 880 CA PRO A 60 17.022 -8.692 3.338 1.00 1.00 C ATOM 881 C PRO A 60 16.764 -8.002 4.695 1.00 1.00 C ATOM 882 O PRO A 60 15.838 -7.202 4.839 1.00 1.00 O ATOM 883 CB PRO A 60 18.162 -8.034 2.522 1.00 1.00 C ATOM 884 CG PRO A 60 17.461 -6.965 1.735 1.00 1.00 C ATOM 885 CD PRO A 60 16.111 -7.600 1.314 1.00 1.00 C ATOM 0 HA PRO A 60 17.260 -9.717 3.621 1.00 1.00 H new ATOM 0 HB2 PRO A 60 18.930 -7.615 3.172 1.00 1.00 H new ATOM 0 HB3 PRO A 60 18.655 -8.754 1.869 1.00 1.00 H new ATOM 0 HG2 PRO A 60 17.306 -6.069 2.336 1.00 1.00 H new ATOM 0 HG3 PRO A 60 18.046 -6.667 0.865 1.00 1.00 H new ATOM 0 HD2 PRO A 60 15.324 -6.851 1.234 1.00 1.00 H new ATOM 0 HD3 PRO A 60 16.184 -8.090 0.343 1.00 1.00 H new ATOM 893 N VAL A 61 17.592 -8.334 5.680 1.00 1.00 N ATOM 894 CA VAL A 61 17.468 -7.766 7.042 1.00 1.00 C ATOM 895 C VAL A 61 17.892 -6.295 7.056 1.00 1.00 C ATOM 896 O VAL A 61 18.833 -5.914 6.359 1.00 1.00 O ATOM 897 CB VAL A 61 18.319 -8.593 8.047 1.00 1.00 C ATOM 898 CG1 VAL A 61 18.099 -8.089 9.501 1.00 1.00 C ATOM 899 CG2 VAL A 61 17.910 -10.082 7.956 1.00 1.00 C ATOM 0 H VAL A 61 18.362 -8.994 5.572 1.00 1.00 H new ATOM 0 HA VAL A 61 16.423 -7.818 7.346 1.00 1.00 H new ATOM 0 HB VAL A 61 19.372 -8.475 7.793 1.00 1.00 H new ATOM 0 HG11 VAL A 61 18.704 -8.682 10.187 1.00 1.00 H new ATOM 0 HG12 VAL A 61 18.392 -7.041 9.571 1.00 1.00 H new ATOM 0 HG13 VAL A 61 17.046 -8.190 9.766 1.00 1.00 H new ATOM 0 HG21 VAL A 61 18.504 -10.666 8.659 1.00 1.00 H new ATOM 0 HG22 VAL A 61 16.853 -10.185 8.201 1.00 1.00 H new ATOM 0 HG23 VAL A 61 18.084 -10.446 6.943 1.00 1.00 H new ATOM 909 N GLY A 62 17.197 -5.480 7.843 1.00 1.00 N ATOM 910 CA GLY A 62 17.514 -4.053 7.946 1.00 1.00 C ATOM 911 C GLY A 62 17.151 -3.332 6.659 1.00 1.00 C ATOM 912 O GLY A 62 17.433 -2.145 6.495 1.00 1.00 O ATOM 0 H GLY A 62 16.411 -5.779 8.420 1.00 1.00 H new ATOM 0 HA2 GLY A 62 16.970 -3.613 8.782 1.00 1.00 H new ATOM 0 HA3 GLY A 62 18.576 -3.925 8.154 1.00 1.00 H new ATOM 916 N GLY A 63 16.510 -4.056 5.746 1.00 1.00 N ATOM 917 CA GLY A 63 16.085 -3.514 4.444 1.00 1.00 C ATOM 918 C GLY A 63 14.577 -3.339 4.408 1.00 1.00 C ATOM 919 O GLY A 63 13.905 -3.398 5.437 1.00 1.00 O ATOM 0 H GLY A 63 16.267 -5.037 5.881 1.00 1.00 H new ATOM 0 HA2 GLY A 63 16.573 -2.556 4.266 1.00 1.00 H new ATOM 0 HA3 GLY A 63 16.398 -4.185 3.644 1.00 1.00 H new ATOM 923 N THR A 64 14.047 -3.120 3.209 1.00 1.00 N ATOM 924 CA THR A 64 12.595 -2.940 3.022 1.00 1.00 C ATOM 925 C THR A 64 12.162 -3.521 1.678 1.00 1.00 C ATOM 926 O THR A 64 12.932 -3.555 0.719 1.00 1.00 O ATOM 927 CB THR A 64 12.225 -1.440 3.048 1.00 1.00 C ATOM 928 OG1 THR A 64 12.771 -0.811 1.899 1.00 1.00 O ATOM 929 CG2 THR A 64 12.788 -0.750 4.308 1.00 1.00 C ATOM 0 H THR A 64 14.592 -3.061 2.349 1.00 1.00 H new ATOM 0 HA THR A 64 12.086 -3.457 3.835 1.00 1.00 H new ATOM 0 HB THR A 64 11.139 -1.352 3.059 1.00 1.00 H new ATOM 0 HG1 THR A 64 12.540 0.141 1.906 1.00 1.00 H new ATOM 0 HG21 THR A 64 12.512 0.304 4.299 1.00 1.00 H new ATOM 0 HG22 THR A 64 12.376 -1.226 5.198 1.00 1.00 H new ATOM 0 HG23 THR A 64 13.874 -0.841 4.318 1.00 1.00 H new ATOM 937 N GLY A 65 10.903 -3.945 1.612 1.00 1.00 N ATOM 938 CA GLY A 65 10.323 -4.515 0.391 1.00 1.00 C ATOM 939 C GLY A 65 9.504 -3.467 -0.329 1.00 1.00 C ATOM 940 O GLY A 65 9.051 -2.493 0.272 1.00 1.00 O ATOM 0 H GLY A 65 10.255 -3.905 2.398 1.00 1.00 H new ATOM 0 HA2 GLY A 65 11.116 -4.881 -0.262 1.00 1.00 H new ATOM 0 HA3 GLY A 65 9.696 -5.370 0.641 1.00 1.00 H new ATOM 944 N LEU A 66 9.306 -3.670 -1.628 1.00 1.00 N ATOM 945 CA LEU A 66 8.519 -2.716 -2.440 1.00 1.00 C ATOM 946 C LEU A 66 7.669 -3.476 -3.477 1.00 1.00 C ATOM 947 O LEU A 66 8.189 -4.101 -4.401 1.00 1.00 O ATOM 948 CB LEU A 66 9.484 -1.685 -3.127 1.00 1.00 C ATOM 949 CG LEU A 66 8.823 -0.278 -3.267 1.00 1.00 C ATOM 950 CD1 LEU A 66 9.796 0.695 -3.958 1.00 1.00 C ATOM 951 CD2 LEU A 66 7.498 -0.368 -4.064 1.00 1.00 C ATOM 0 H LEU A 66 9.669 -4.471 -2.145 1.00 1.00 H new ATOM 0 HA LEU A 66 7.836 -2.163 -1.795 1.00 1.00 H new ATOM 0 HB2 LEU A 66 10.400 -1.600 -2.543 1.00 1.00 H new ATOM 0 HB3 LEU A 66 9.767 -2.053 -4.113 1.00 1.00 H new ATOM 0 HG LEU A 66 8.595 0.096 -2.269 1.00 1.00 H new ATOM 0 HD11 LEU A 66 9.326 1.674 -4.051 1.00 1.00 H new ATOM 0 HD12 LEU A 66 10.705 0.784 -3.363 1.00 1.00 H new ATOM 0 HD13 LEU A 66 10.046 0.317 -4.949 1.00 1.00 H new ATOM 0 HD21 LEU A 66 7.056 0.625 -4.148 1.00 1.00 H new ATOM 0 HD22 LEU A 66 7.699 -0.762 -5.060 1.00 1.00 H new ATOM 0 HD23 LEU A 66 6.805 -1.031 -3.545 1.00 1.00 H new ATOM 963 N ALA A 67 6.352 -3.404 -3.302 1.00 1.00 N ATOM 964 CA ALA A 67 5.386 -4.065 -4.196 1.00 1.00 C ATOM 965 C ALA A 67 4.793 -3.047 -5.169 1.00 1.00 C ATOM 966 O ALA A 67 4.815 -1.841 -4.923 1.00 1.00 O ATOM 967 CB ALA A 67 4.259 -4.695 -3.351 1.00 1.00 C ATOM 0 H ALA A 67 5.917 -2.887 -2.538 1.00 1.00 H new ATOM 0 HA ALA A 67 5.895 -4.843 -4.766 1.00 1.00 H new ATOM 0 HB1 ALA A 67 3.542 -5.185 -4.009 1.00 1.00 H new ATOM 0 HB2 ALA A 67 4.684 -5.429 -2.667 1.00 1.00 H new ATOM 0 HB3 ALA A 67 3.754 -3.916 -2.780 1.00 1.00 H new ATOM 973 N ARG A 68 4.253 -3.550 -6.274 1.00 1.00 N ATOM 974 CA ARG A 68 3.638 -2.676 -7.308 1.00 1.00 C ATOM 975 C ARG A 68 2.206 -3.143 -7.601 1.00 1.00 C ATOM 976 O ARG A 68 1.978 -4.286 -7.997 1.00 1.00 O ATOM 977 CB ARG A 68 4.494 -2.706 -8.606 1.00 1.00 C ATOM 978 CG ARG A 68 3.952 -1.685 -9.646 1.00 1.00 C ATOM 979 CD ARG A 68 4.814 -1.696 -10.924 1.00 1.00 C ATOM 980 NE ARG A 68 4.338 -0.652 -11.851 1.00 1.00 N ATOM 981 CZ ARG A 68 4.613 0.652 -11.677 1.00 1.00 C ATOM 982 NH1 ARG A 68 5.364 1.045 -10.680 1.00 1.00 N ATOM 983 NH2 ARG A 68 4.135 1.534 -12.511 1.00 1.00 N ATOM 0 H ARG A 68 4.221 -4.546 -6.490 1.00 1.00 H new ATOM 0 HA ARG A 68 3.603 -1.652 -6.937 1.00 1.00 H new ATOM 0 HB2 ARG A 68 5.532 -2.474 -8.368 1.00 1.00 H new ATOM 0 HB3 ARG A 68 4.481 -3.709 -9.033 1.00 1.00 H new ATOM 0 HG2 ARG A 68 2.919 -1.928 -9.896 1.00 1.00 H new ATOM 0 HG3 ARG A 68 3.949 -0.685 -9.213 1.00 1.00 H new ATOM 0 HD2 ARG A 68 5.860 -1.522 -10.671 1.00 1.00 H new ATOM 0 HD3 ARG A 68 4.760 -2.674 -11.403 1.00 1.00 H new ATOM 0 HE ARG A 68 3.778 -0.931 -12.656 1.00 1.00 H new ATOM 0 HH11 ARG A 68 5.745 0.360 -10.028 1.00 1.00 H new ATOM 0 HH12 ARG A 68 5.568 2.037 -10.555 1.00 1.00 H new ATOM 0 HH21 ARG A 68 3.554 1.233 -13.293 1.00 1.00 H new ATOM 0 HH22 ARG A 68 4.343 2.524 -12.381 1.00 1.00 H new ATOM 997 N VAL A 69 1.253 -2.236 -7.413 1.00 1.00 N ATOM 998 CA VAL A 69 -0.173 -2.532 -7.661 1.00 1.00 C ATOM 999 C VAL A 69 -0.831 -1.337 -8.353 1.00 1.00 C ATOM 1000 O VAL A 69 -0.499 -0.178 -8.105 1.00 1.00 O ATOM 1001 CB VAL A 69 -0.908 -2.856 -6.322 1.00 1.00 C ATOM 1002 CG1 VAL A 69 -2.353 -3.352 -6.599 1.00 1.00 C ATOM 1003 CG2 VAL A 69 -0.125 -3.950 -5.551 1.00 1.00 C ATOM 0 H VAL A 69 1.432 -1.285 -7.089 1.00 1.00 H new ATOM 0 HA VAL A 69 -0.246 -3.406 -8.308 1.00 1.00 H new ATOM 0 HB VAL A 69 -0.958 -1.947 -5.723 1.00 1.00 H new ATOM 0 HG11 VAL A 69 -2.849 -3.573 -5.654 1.00 1.00 H new ATOM 0 HG12 VAL A 69 -2.908 -2.578 -7.128 1.00 1.00 H new ATOM 0 HG13 VAL A 69 -2.317 -4.254 -7.209 1.00 1.00 H new ATOM 0 HG21 VAL A 69 -0.639 -4.175 -4.617 1.00 1.00 H new ATOM 0 HG22 VAL A 69 -0.066 -4.852 -6.159 1.00 1.00 H new ATOM 0 HG23 VAL A 69 0.882 -3.592 -5.334 1.00 1.00 H new ATOM 1013 N GLN A 70 -1.791 -1.643 -9.221 1.00 1.00 N ATOM 1014 CA GLN A 70 -2.528 -0.609 -9.980 1.00 1.00 C ATOM 1015 C GLN A 70 -4.019 -0.686 -9.657 1.00 1.00 C ATOM 1016 O GLN A 70 -4.582 -1.769 -9.496 1.00 1.00 O ATOM 1017 CB GLN A 70 -2.283 -0.808 -11.499 1.00 1.00 C ATOM 1018 CG GLN A 70 -2.682 -2.232 -11.942 1.00 1.00 C ATOM 1019 CD GLN A 70 -2.393 -2.427 -13.433 1.00 1.00 C ATOM 1020 OE1 GLN A 70 -3.282 -2.254 -14.266 1.00 1.00 O ATOM 1021 NE2 GLN A 70 -1.194 -2.774 -13.820 1.00 1.00 N ATOM 0 H GLN A 70 -2.085 -2.598 -9.424 1.00 1.00 H new ATOM 0 HA GLN A 70 -2.168 0.379 -9.693 1.00 1.00 H new ATOM 0 HB2 GLN A 70 -2.858 -0.073 -12.063 1.00 1.00 H new ATOM 0 HB3 GLN A 70 -1.232 -0.633 -11.727 1.00 1.00 H new ATOM 0 HG2 GLN A 70 -2.131 -2.969 -11.359 1.00 1.00 H new ATOM 0 HG3 GLN A 70 -3.741 -2.398 -11.746 1.00 1.00 H new ATOM 0 HE21 GLN A 70 -0.457 -2.917 -13.130 1.00 1.00 H new ATOM 0 HE22 GLN A 70 -0.995 -2.901 -14.812 1.00 1.00 H new ATOM 1030 N TRP A 71 -4.652 0.480 -9.574 1.00 1.00 N ATOM 1031 CA TRP A 71 -6.085 0.576 -9.268 1.00 1.00 C ATOM 1032 C TRP A 71 -6.704 1.745 -10.048 1.00 1.00 C ATOM 1033 O TRP A 71 -6.085 2.787 -10.262 1.00 1.00 O ATOM 1034 CB TRP A 71 -6.298 0.766 -7.740 1.00 1.00 C ATOM 1035 CG TRP A 71 -7.763 0.953 -7.447 1.00 1.00 C ATOM 1036 CD1 TRP A 71 -8.733 0.056 -7.734 1.00 1.00 C ATOM 1037 CD2 TRP A 71 -8.432 2.101 -6.849 1.00 1.00 C ATOM 1038 NE1 TRP A 71 -9.957 0.590 -7.373 1.00 1.00 N ATOM 1039 CE2 TRP A 71 -9.821 1.846 -6.819 1.00 1.00 C ATOM 1040 CE3 TRP A 71 -7.971 3.328 -6.340 1.00 1.00 C ATOM 1041 CZ2 TRP A 71 -10.724 2.778 -6.308 1.00 1.00 C ATOM 1042 CZ3 TRP A 71 -8.876 4.269 -5.820 1.00 1.00 C ATOM 1043 CH2 TRP A 71 -10.250 3.996 -5.807 1.00 1.00 C ATOM 0 H TRP A 71 -4.195 1.381 -9.715 1.00 1.00 H new ATOM 0 HA TRP A 71 -6.577 -0.349 -9.569 1.00 1.00 H new ATOM 0 HB2 TRP A 71 -5.918 -0.101 -7.200 1.00 1.00 H new ATOM 0 HB3 TRP A 71 -5.735 1.631 -7.390 1.00 1.00 H new ATOM 0 HD1 TRP A 71 -8.578 -0.918 -8.173 1.00 1.00 H new ATOM 0 HE1 TRP A 71 -10.850 0.114 -7.501 1.00 1.00 H new ATOM 0 HE3 TRP A 71 -6.914 3.549 -6.349 1.00 1.00 H new ATOM 0 HZ2 TRP A 71 -11.782 2.561 -6.299 1.00 1.00 H new ATOM 0 HZ3 TRP A 71 -8.511 5.207 -5.429 1.00 1.00 H new ATOM 0 HH2 TRP A 71 -10.942 4.724 -5.411 1.00 1.00 H new ATOM 1054 N LYS A 72 -7.953 1.547 -10.457 1.00 1.00 N ATOM 1055 CA LYS A 72 -8.683 2.582 -11.213 1.00 1.00 C ATOM 1056 C LYS A 72 -9.454 3.480 -10.244 1.00 1.00 C ATOM 1057 O LYS A 72 -10.310 3.007 -9.496 1.00 1.00 O ATOM 1058 CB LYS A 72 -9.654 1.914 -12.218 1.00 1.00 C ATOM 1059 CG LYS A 72 -10.324 2.983 -13.124 1.00 1.00 C ATOM 1060 CD LYS A 72 -11.231 2.304 -14.172 1.00 1.00 C ATOM 1061 CE LYS A 72 -11.868 3.371 -15.084 1.00 1.00 C ATOM 1062 NZ LYS A 72 -12.645 4.334 -14.254 1.00 1.00 N ATOM 0 H LYS A 72 -8.484 0.693 -10.285 1.00 1.00 H new ATOM 0 HA LYS A 72 -7.972 3.193 -11.769 1.00 1.00 H new ATOM 0 HB2 LYS A 72 -9.112 1.196 -12.833 1.00 1.00 H new ATOM 0 HB3 LYS A 72 -10.419 1.357 -11.677 1.00 1.00 H new ATOM 0 HG2 LYS A 72 -10.912 3.670 -12.515 1.00 1.00 H new ATOM 0 HG3 LYS A 72 -9.559 3.576 -13.625 1.00 1.00 H new ATOM 0 HD2 LYS A 72 -10.649 1.603 -14.770 1.00 1.00 H new ATOM 0 HD3 LYS A 72 -12.010 1.728 -13.673 1.00 1.00 H new ATOM 0 HE2 LYS A 72 -11.093 3.897 -15.642 1.00 1.00 H new ATOM 0 HE3 LYS A 72 -12.521 2.896 -15.816 1.00 1.00 H new ATOM 0 HZ1 LYS A 72 -13.321 4.845 -14.857 1.00 1.00 H new ATOM 0 HZ2 LYS A 72 -13.162 3.817 -13.515 1.00 1.00 H new ATOM 0 HZ3 LYS A 72 -11.995 5.014 -13.811 1.00 1.00 H new ATOM 1076 N ALA A 73 -9.158 4.776 -10.277 1.00 1.00 N ATOM 1077 CA ALA A 73 -9.836 5.728 -9.396 1.00 1.00 C ATOM 1078 C ALA A 73 -11.257 5.970 -9.901 1.00 1.00 C ATOM 1079 O ALA A 73 -11.453 6.227 -11.090 1.00 1.00 O ATOM 1080 CB ALA A 73 -9.052 7.054 -9.366 1.00 1.00 C ATOM 0 H ALA A 73 -8.461 5.190 -10.896 1.00 1.00 H new ATOM 0 HA ALA A 73 -9.882 5.320 -8.386 1.00 1.00 H new ATOM 0 HB1 ALA A 73 -9.559 7.761 -8.709 1.00 1.00 H new ATOM 0 HB2 ALA A 73 -8.044 6.872 -8.994 1.00 1.00 H new ATOM 0 HB3 ALA A 73 -8.998 7.468 -10.373 1.00 1.00 H new ATOM 1086 N THR A 74 -12.235 5.915 -9.003 1.00 1.00 N ATOM 1087 CA THR A 74 -13.631 6.153 -9.382 1.00 1.00 C ATOM 1088 C THR A 74 -14.511 6.254 -8.127 1.00 1.00 C ATOM 1089 O THR A 74 -14.608 5.309 -7.344 1.00 1.00 O ATOM 1090 CB THR A 74 -14.142 5.017 -10.317 1.00 1.00 C ATOM 1091 OG1 THR A 74 -15.553 5.110 -10.435 1.00 1.00 O ATOM 1092 CG2 THR A 74 -13.776 3.616 -9.775 1.00 1.00 C ATOM 0 H THR A 74 -12.093 5.710 -8.014 1.00 1.00 H new ATOM 0 HA THR A 74 -13.690 7.096 -9.925 1.00 1.00 H new ATOM 0 HB THR A 74 -13.662 5.141 -11.287 1.00 1.00 H new ATOM 0 HG1 THR A 74 -15.880 4.398 -11.024 1.00 1.00 H new ATOM 0 HG21 THR A 74 -14.151 2.853 -10.457 1.00 1.00 H new ATOM 0 HG22 THR A 74 -12.693 3.529 -9.693 1.00 1.00 H new ATOM 0 HG23 THR A 74 -14.226 3.477 -8.792 1.00 1.00 H new ATOM 1100 N ARG A 75 -15.155 7.404 -7.956 1.00 1.00 N ATOM 1101 CA ARG A 75 -16.038 7.626 -6.799 1.00 1.00 C ATOM 1102 C ARG A 75 -16.862 8.912 -7.002 1.00 1.00 C ATOM 1103 O ARG A 75 -17.468 9.404 -6.050 1.00 1.00 O ATOM 1104 CB ARG A 75 -15.185 7.718 -5.478 1.00 1.00 C ATOM 1105 CG ARG A 75 -16.042 7.390 -4.225 1.00 1.00 C ATOM 1106 CD ARG A 75 -15.197 7.487 -2.945 1.00 1.00 C ATOM 1107 NE ARG A 75 -16.036 7.150 -1.785 1.00 1.00 N ATOM 1108 CZ ARG A 75 -16.401 5.888 -1.511 1.00 1.00 C ATOM 1109 NH1 ARG A 75 -15.999 4.899 -2.269 1.00 1.00 N ATOM 1110 NH2 ARG A 75 -17.169 5.643 -0.486 1.00 1.00 N ATOM 0 H ARG A 75 -15.088 8.196 -8.595 1.00 1.00 H new ATOM 0 HA ARG A 75 -16.725 6.785 -6.710 1.00 1.00 H new ATOM 0 HB2 ARG A 75 -14.345 7.026 -5.537 1.00 1.00 H new ATOM 0 HB3 ARG A 75 -14.767 8.720 -5.382 1.00 1.00 H new ATOM 0 HG2 ARG A 75 -16.884 8.080 -4.164 1.00 1.00 H new ATOM 0 HG3 ARG A 75 -16.458 6.387 -4.316 1.00 1.00 H new ATOM 0 HD2 ARG A 75 -14.347 6.807 -3.004 1.00 1.00 H new ATOM 0 HD3 ARG A 75 -14.793 8.494 -2.837 1.00 1.00 H new ATOM 0 HE ARG A 75 -16.351 7.900 -1.169 1.00 1.00 H new ATOM 0 HH11 ARG A 75 -15.403 5.084 -3.076 1.00 1.00 H new ATOM 0 HH12 ARG A 75 -16.282 3.943 -2.053 1.00 1.00 H new ATOM 0 HH21 ARG A 75 -17.491 6.410 0.105 1.00 1.00 H new ATOM 0 HH22 ARG A 75 -17.448 4.685 -0.275 1.00 1.00 H new ATOM 1124 N LYS A 76 -16.863 9.452 -8.217 1.00 1.00 N ATOM 1125 CA LYS A 76 -17.607 10.675 -8.523 1.00 1.00 C ATOM 1126 C LYS A 76 -19.112 10.451 -8.325 1.00 1.00 C ATOM 1127 O LYS A 76 -19.606 9.327 -8.419 1.00 1.00 O ATOM 1128 CB LYS A 76 -17.306 11.118 -9.981 1.00 1.00 C ATOM 1129 CG LYS A 76 -17.646 9.985 -10.981 1.00 1.00 C ATOM 1130 CD LYS A 76 -17.317 10.429 -12.427 1.00 1.00 C ATOM 1131 CE LYS A 76 -17.630 9.287 -13.412 1.00 1.00 C ATOM 1132 NZ LYS A 76 -19.070 8.919 -13.295 1.00 1.00 N ATOM 0 H LYS A 76 -16.355 9.062 -9.011 1.00 1.00 H new ATOM 0 HA LYS A 76 -17.291 11.465 -7.842 1.00 1.00 H new ATOM 0 HB2 LYS A 76 -17.886 12.009 -10.222 1.00 1.00 H new ATOM 0 HB3 LYS A 76 -16.254 11.388 -10.074 1.00 1.00 H new ATOM 0 HG2 LYS A 76 -17.080 9.088 -10.731 1.00 1.00 H new ATOM 0 HG3 LYS A 76 -18.702 9.727 -10.904 1.00 1.00 H new ATOM 0 HD2 LYS A 76 -17.899 11.314 -12.686 1.00 1.00 H new ATOM 0 HD3 LYS A 76 -16.265 10.706 -12.501 1.00 1.00 H new ATOM 0 HE2 LYS A 76 -17.404 9.598 -14.432 1.00 1.00 H new ATOM 0 HE3 LYS A 76 -17.003 8.422 -13.196 1.00 1.00 H new ATOM 0 HZ1 LYS A 76 -19.370 8.414 -14.153 1.00 1.00 H new ATOM 0 HZ2 LYS A 76 -19.205 8.305 -12.467 1.00 1.00 H new ATOM 0 HZ3 LYS A 76 -19.641 9.781 -13.183 1.00 1.00 H new ATOM 1146 N LEU A 77 -19.831 11.537 -8.055 1.00 1.00 N ATOM 1147 CA LEU A 77 -21.292 11.469 -7.839 1.00 1.00 C ATOM 1148 C LEU A 77 -21.964 12.739 -8.361 1.00 1.00 C ATOM 1149 O LEU A 77 -23.129 12.994 -8.053 1.00 1.00 O ATOM 1150 CB LEU A 77 -21.598 11.288 -6.317 1.00 1.00 C ATOM 1151 CG LEU A 77 -20.842 12.375 -5.431 1.00 1.00 C ATOM 1152 CD1 LEU A 77 -21.734 12.852 -4.255 1.00 1.00 C ATOM 1153 CD2 LEU A 77 -19.522 11.790 -4.856 1.00 1.00 C ATOM 0 H LEU A 77 -19.438 12.475 -7.979 1.00 1.00 H new ATOM 0 HA LEU A 77 -21.689 10.613 -8.386 1.00 1.00 H new ATOM 0 HB2 LEU A 77 -22.672 11.366 -6.150 1.00 1.00 H new ATOM 0 HB3 LEU A 77 -21.298 10.289 -6.002 1.00 1.00 H new ATOM 0 HG LEU A 77 -20.616 13.223 -6.077 1.00 1.00 H new ATOM 0 HD11 LEU A 77 -21.194 13.593 -3.666 1.00 1.00 H new ATOM 0 HD12 LEU A 77 -22.648 13.297 -4.649 1.00 1.00 H new ATOM 0 HD13 LEU A 77 -21.988 12.001 -3.623 1.00 1.00 H new ATOM 0 HD21 LEU A 77 -19.020 12.547 -4.254 1.00 1.00 H new ATOM 0 HD22 LEU A 77 -19.748 10.924 -4.234 1.00 1.00 H new ATOM 0 HD23 LEU A 77 -18.870 11.488 -5.676 1.00 1.00 H new ATOM 1165 N ALA A 78 -21.229 13.533 -9.135 1.00 1.00 N ATOM 1166 CA ALA A 78 -21.766 14.782 -9.690 1.00 1.00 C ATOM 1167 C ALA A 78 -22.357 15.661 -8.576 1.00 1.00 C ATOM 1168 O ALA A 78 -23.463 16.189 -8.691 1.00 1.00 O ATOM 1169 CB ALA A 78 -22.835 14.469 -10.757 1.00 1.00 C ATOM 0 H ALA A 78 -20.262 13.339 -9.394 1.00 1.00 H new ATOM 0 HA ALA A 78 -20.952 15.333 -10.160 1.00 1.00 H new ATOM 0 HB1 ALA A 78 -23.228 15.401 -11.163 1.00 1.00 H new ATOM 0 HB2 ALA A 78 -22.387 13.884 -11.560 1.00 1.00 H new ATOM 0 HB3 ALA A 78 -23.647 13.901 -10.303 1.00 1.00 H new ATOM 1175 N GLY A 79 -21.597 15.801 -7.493 1.00 1.00 N ATOM 1176 CA GLY A 79 -22.032 16.604 -6.347 1.00 1.00 C ATOM 1177 C GLY A 79 -20.991 16.570 -5.224 1.00 1.00 C ATOM 1178 O GLY A 79 -20.333 15.554 -5.000 1.00 1.00 O ATOM 0 H GLY A 79 -20.679 15.371 -7.382 1.00 1.00 H new ATOM 0 HA2 GLY A 79 -22.198 17.634 -6.663 1.00 1.00 H new ATOM 0 HA3 GLY A 79 -22.985 16.227 -5.975 1.00 1.00 H new ATOM 1182 N ARG A 80 -20.856 17.690 -4.520 1.00 1.00 N ATOM 1183 CA ARG A 80 -19.889 17.791 -3.413 1.00 1.00 C ATOM 1184 C ARG A 80 -18.467 17.430 -3.892 1.00 1.00 C ATOM 1185 O ARG A 80 -17.910 16.407 -3.491 1.00 1.00 O ATOM 1186 CB ARG A 80 -20.320 16.864 -2.241 1.00 1.00 C ATOM 1187 CG ARG A 80 -19.510 17.182 -0.957 1.00 1.00 C ATOM 1188 CD ARG A 80 -19.902 16.216 0.181 1.00 1.00 C ATOM 1189 NE ARG A 80 -21.324 16.369 0.504 1.00 1.00 N ATOM 1190 CZ ARG A 80 -21.925 15.638 1.457 1.00 1.00 C ATOM 1191 NH1 ARG A 80 -21.246 14.783 2.180 1.00 1.00 N ATOM 1192 NH2 ARG A 80 -23.201 15.792 1.673 1.00 1.00 N ATOM 0 H ARG A 80 -21.396 18.539 -4.688 1.00 1.00 H new ATOM 0 HA ARG A 80 -19.875 18.822 -3.059 1.00 1.00 H new ATOM 0 HB2 ARG A 80 -21.385 16.990 -2.045 1.00 1.00 H new ATOM 0 HB3 ARG A 80 -20.169 15.822 -2.522 1.00 1.00 H new ATOM 0 HG2 ARG A 80 -18.443 17.098 -1.163 1.00 1.00 H new ATOM 0 HG3 ARG A 80 -19.695 18.211 -0.649 1.00 1.00 H new ATOM 0 HD2 ARG A 80 -19.697 15.188 -0.118 1.00 1.00 H new ATOM 0 HD3 ARG A 80 -19.297 16.418 1.065 1.00 1.00 H new ATOM 0 HE ARG A 80 -21.876 17.054 -0.013 1.00 1.00 H new ATOM 0 HH11 ARG A 80 -20.245 14.664 2.023 1.00 1.00 H new ATOM 0 HH12 ARG A 80 -21.718 14.236 2.900 1.00 1.00 H new ATOM 0 HH21 ARG A 80 -23.734 16.463 1.120 1.00 1.00 H new ATOM 0 HH22 ARG A 80 -23.666 15.241 2.395 1.00 1.00 H new ATOM 1206 N ALA A 81 -17.900 18.273 -4.750 1.00 1.00 N ATOM 1207 CA ALA A 81 -16.546 18.043 -5.285 1.00 1.00 C ATOM 1208 C ALA A 81 -15.497 18.646 -4.352 1.00 1.00 C ATOM 1209 O ALA A 81 -14.316 18.309 -4.439 1.00 1.00 O ATOM 1210 CB ALA A 81 -16.431 18.673 -6.687 1.00 1.00 C ATOM 0 H ALA A 81 -18.349 19.122 -5.094 1.00 1.00 H new ATOM 0 HA ALA A 81 -16.370 16.970 -5.357 1.00 1.00 H new ATOM 0 HB1 ALA A 81 -15.429 18.502 -7.082 1.00 1.00 H new ATOM 0 HB2 ALA A 81 -17.165 18.218 -7.352 1.00 1.00 H new ATOM 0 HB3 ALA A 81 -16.617 19.745 -6.621 1.00 1.00 H new ATOM 1216 N ALA A 82 -15.932 19.543 -3.471 1.00 1.00 N ATOM 1217 CA ALA A 82 -15.035 20.204 -2.511 1.00 1.00 C ATOM 1218 C ALA A 82 -14.710 19.264 -1.335 1.00 1.00 C ATOM 1219 O ALA A 82 -14.591 19.701 -0.190 1.00 1.00 O ATOM 1220 CB ALA A 82 -15.713 21.489 -2.001 1.00 1.00 C ATOM 0 H ALA A 82 -16.907 19.834 -3.398 1.00 1.00 H new ATOM 0 HA ALA A 82 -14.097 20.456 -3.005 1.00 1.00 H new ATOM 0 HB1 ALA A 82 -15.057 21.988 -1.288 1.00 1.00 H new ATOM 0 HB2 ALA A 82 -15.909 22.155 -2.841 1.00 1.00 H new ATOM 0 HB3 ALA A 82 -16.654 21.235 -1.512 1.00 1.00 H new ATOM 1226 N ASN A 83 -14.560 17.979 -1.640 1.00 1.00 N ATOM 1227 CA ASN A 83 -14.233 16.984 -0.588 1.00 1.00 C ATOM 1228 C ASN A 83 -13.802 15.619 -1.209 1.00 1.00 C ATOM 1229 O ASN A 83 -14.528 15.118 -2.069 1.00 1.00 O ATOM 1230 CB ASN A 83 -15.460 16.761 0.324 1.00 1.00 C ATOM 1231 CG ASN A 83 -15.128 15.785 1.461 1.00 1.00 C ATOM 1232 OD1 ASN A 83 -14.747 16.206 2.553 1.00 1.00 O ATOM 1233 ND2 ASN A 83 -15.242 14.500 1.258 1.00 1.00 N ATOM 0 H ASN A 83 -14.654 17.594 -2.580 1.00 1.00 H new ATOM 0 HA ASN A 83 -13.400 17.378 -0.005 1.00 1.00 H new ATOM 0 HB2 ASN A 83 -15.786 17.714 0.741 1.00 1.00 H new ATOM 0 HB3 ASN A 83 -16.290 16.370 -0.265 1.00 1.00 H new ATOM 0 HD21 ASN A 83 -15.015 13.844 2.005 1.00 1.00 H new ATOM 0 HD22 ASN A 83 -15.558 14.153 0.352 1.00 1.00 H new ATOM 1240 N PRO A 84 -12.705 15.038 -0.803 1.00 1.00 N ATOM 1241 CA PRO A 84 -12.285 13.712 -1.396 1.00 1.00 C ATOM 1242 C PRO A 84 -13.197 12.553 -0.933 1.00 1.00 C ATOM 1243 O PRO A 84 -14.128 12.156 -1.634 1.00 1.00 O ATOM 1244 CB PRO A 84 -10.814 13.546 -0.910 1.00 1.00 C ATOM 1245 CG PRO A 84 -10.757 14.293 0.402 1.00 1.00 C ATOM 1246 CD PRO A 84 -11.726 15.492 0.237 1.00 1.00 C ATOM 0 HA PRO A 84 -12.368 13.690 -2.483 1.00 1.00 H new ATOM 0 HB2 PRO A 84 -10.557 12.495 -0.779 1.00 1.00 H new ATOM 0 HB3 PRO A 84 -10.109 13.959 -1.632 1.00 1.00 H new ATOM 0 HG2 PRO A 84 -11.061 13.654 1.231 1.00 1.00 H new ATOM 0 HG3 PRO A 84 -9.744 14.633 0.616 1.00 1.00 H new ATOM 0 HD2 PRO A 84 -12.226 15.732 1.176 1.00 1.00 H new ATOM 0 HD3 PRO A 84 -11.197 16.390 -0.081 1.00 1.00 H new ATOM 1254 N GLY A 85 -12.897 12.015 0.245 1.00 1.00 N ATOM 1255 CA GLY A 85 -13.676 10.899 0.806 1.00 1.00 C ATOM 1256 C GLY A 85 -13.191 9.572 0.244 1.00 1.00 C ATOM 1257 O GLY A 85 -13.834 8.537 0.422 1.00 1.00 O ATOM 0 H GLY A 85 -12.124 12.327 0.833 1.00 1.00 H new ATOM 0 HA2 GLY A 85 -13.585 10.895 1.892 1.00 1.00 H new ATOM 0 HA3 GLY A 85 -14.733 11.034 0.575 1.00 1.00 H new ATOM 1261 N VAL A 86 -12.042 9.605 -0.424 1.00 1.00 N ATOM 1262 CA VAL A 86 -11.428 8.399 -1.023 1.00 1.00 C ATOM 1263 C VAL A 86 -10.048 8.151 -0.374 1.00 1.00 C ATOM 1264 O VAL A 86 -9.038 8.224 -1.074 1.00 1.00 O ATOM 1265 CB VAL A 86 -11.337 8.591 -2.584 1.00 1.00 C ATOM 1266 CG1 VAL A 86 -10.628 9.919 -2.963 1.00 1.00 C ATOM 1267 CG2 VAL A 86 -10.621 7.377 -3.283 1.00 1.00 C ATOM 0 H VAL A 86 -11.503 10.459 -0.571 1.00 1.00 H new ATOM 0 HA VAL A 86 -12.038 7.516 -0.834 1.00 1.00 H new ATOM 0 HB VAL A 86 -12.364 8.637 -2.948 1.00 1.00 H new ATOM 0 HG11 VAL A 86 -10.586 10.012 -4.048 1.00 1.00 H new ATOM 0 HG12 VAL A 86 -11.184 10.760 -2.548 1.00 1.00 H new ATOM 0 HG13 VAL A 86 -9.615 9.919 -2.560 1.00 1.00 H new ATOM 0 HG21 VAL A 86 -10.579 7.549 -4.358 1.00 1.00 H new ATOM 0 HG22 VAL A 86 -9.609 7.277 -2.892 1.00 1.00 H new ATOM 0 HG23 VAL A 86 -11.179 6.462 -3.084 1.00 1.00 H new ATOM 1277 N PRO A 87 -9.992 7.852 0.895 1.00 1.00 N ATOM 1278 CA PRO A 87 -8.689 7.576 1.591 1.00 1.00 C ATOM 1279 C PRO A 87 -8.067 6.265 1.109 1.00 1.00 C ATOM 1280 O PRO A 87 -8.652 5.519 0.324 1.00 1.00 O ATOM 1281 CB PRO A 87 -9.090 7.514 3.097 1.00 1.00 C ATOM 1282 CG PRO A 87 -10.494 6.989 3.049 1.00 1.00 C ATOM 1283 CD PRO A 87 -11.128 7.751 1.872 1.00 1.00 C ATOM 0 HA PRO A 87 -7.929 8.332 1.393 1.00 1.00 H new ATOM 0 HB2 PRO A 87 -8.432 6.855 3.663 1.00 1.00 H new ATOM 0 HB3 PRO A 87 -9.042 8.496 3.569 1.00 1.00 H new ATOM 0 HG2 PRO A 87 -10.513 5.912 2.885 1.00 1.00 H new ATOM 0 HG3 PRO A 87 -11.025 7.179 3.982 1.00 1.00 H new ATOM 0 HD2 PRO A 87 -11.977 7.213 1.451 1.00 1.00 H new ATOM 0 HD3 PRO A 87 -11.491 8.733 2.174 1.00 1.00 H new ATOM 1291 N VAL A 88 -6.866 5.995 1.607 1.00 1.00 N ATOM 1292 CA VAL A 88 -6.128 4.761 1.239 1.00 1.00 C ATOM 1293 C VAL A 88 -5.608 4.068 2.504 1.00 1.00 C ATOM 1294 O VAL A 88 -5.065 4.706 3.406 1.00 1.00 O ATOM 1295 CB VAL A 88 -4.952 5.112 0.284 1.00 1.00 C ATOM 1296 CG1 VAL A 88 -4.227 3.826 -0.200 1.00 1.00 C ATOM 1297 CG2 VAL A 88 -5.503 5.883 -0.942 1.00 1.00 C ATOM 0 H VAL A 88 -6.373 6.600 2.263 1.00 1.00 H new ATOM 0 HA VAL A 88 -6.802 4.079 0.722 1.00 1.00 H new ATOM 0 HB VAL A 88 -4.236 5.729 0.826 1.00 1.00 H new ATOM 0 HG11 VAL A 88 -3.409 4.099 -0.867 1.00 1.00 H new ATOM 0 HG12 VAL A 88 -3.830 3.286 0.660 1.00 1.00 H new ATOM 0 HG13 VAL A 88 -4.933 3.189 -0.734 1.00 1.00 H new ATOM 0 HG21 VAL A 88 -4.682 6.131 -1.615 1.00 1.00 H new ATOM 0 HG22 VAL A 88 -6.227 5.261 -1.468 1.00 1.00 H new ATOM 0 HG23 VAL A 88 -5.988 6.800 -0.607 1.00 1.00 H new ATOM 1307 N TYR A 89 -5.774 2.750 2.548 1.00 1.00 N ATOM 1308 CA TYR A 89 -5.323 1.934 3.694 1.00 1.00 C ATOM 1309 C TYR A 89 -4.613 0.679 3.186 1.00 1.00 C ATOM 1310 O TYR A 89 -4.961 0.109 2.151 1.00 1.00 O ATOM 1311 CB TYR A 89 -6.532 1.544 4.584 1.00 1.00 C ATOM 1312 CG TYR A 89 -7.107 2.802 5.263 1.00 1.00 C ATOM 1313 CD1 TYR A 89 -6.445 3.352 6.380 1.00 1.00 C ATOM 1314 CD2 TYR A 89 -8.274 3.427 4.777 1.00 1.00 C ATOM 1315 CE1 TYR A 89 -6.946 4.506 6.999 1.00 1.00 C ATOM 1316 CE2 TYR A 89 -8.765 4.582 5.401 1.00 1.00 C ATOM 1317 CZ TYR A 89 -8.102 5.119 6.509 1.00 1.00 C ATOM 1318 OH TYR A 89 -8.585 6.260 7.115 1.00 1.00 O ATOM 0 H TYR A 89 -6.219 2.212 1.804 1.00 1.00 H new ATOM 0 HA TYR A 89 -4.626 2.518 4.294 1.00 1.00 H new ATOM 0 HB2 TYR A 89 -7.300 1.063 3.979 1.00 1.00 H new ATOM 0 HB3 TYR A 89 -6.222 0.822 5.339 1.00 1.00 H new ATOM 0 HD1 TYR A 89 -5.549 2.883 6.760 1.00 1.00 H new ATOM 0 HD2 TYR A 89 -8.790 3.015 3.923 1.00 1.00 H new ATOM 0 HE1 TYR A 89 -6.437 4.922 7.856 1.00 1.00 H new ATOM 0 HE2 TYR A 89 -9.658 5.059 5.025 1.00 1.00 H new ATOM 0 HH TYR A 89 -9.395 6.559 6.651 1.00 1.00 H new ATOM 1328 N ALA A 90 -3.618 0.245 3.952 1.00 1.00 N ATOM 1329 CA ALA A 90 -2.833 -0.948 3.596 1.00 1.00 C ATOM 1330 C ALA A 90 -2.401 -1.681 4.859 1.00 1.00 C ATOM 1331 O ALA A 90 -2.077 -1.063 5.873 1.00 1.00 O ATOM 1332 CB ALA A 90 -1.599 -0.516 2.784 1.00 1.00 C ATOM 0 H ALA A 90 -3.331 0.694 4.822 1.00 1.00 H new ATOM 0 HA ALA A 90 -3.443 -1.622 2.995 1.00 1.00 H new ATOM 0 HB1 ALA A 90 -1.013 -1.395 2.517 1.00 1.00 H new ATOM 0 HB2 ALA A 90 -1.921 -0.005 1.876 1.00 1.00 H new ATOM 0 HB3 ALA A 90 -0.988 0.159 3.383 1.00 1.00 H new ATOM 1338 N VAL A 91 -2.396 -3.007 4.787 1.00 1.00 N ATOM 1339 CA VAL A 91 -2.010 -3.855 5.930 1.00 1.00 C ATOM 1340 C VAL A 91 -1.078 -4.970 5.454 1.00 1.00 C ATOM 1341 O VAL A 91 -1.273 -5.567 4.395 1.00 1.00 O ATOM 1342 CB VAL A 91 -3.280 -4.463 6.592 1.00 1.00 C ATOM 1343 CG1 VAL A 91 -2.902 -5.275 7.863 1.00 1.00 C ATOM 1344 CG2 VAL A 91 -4.250 -3.324 6.983 1.00 1.00 C ATOM 0 H VAL A 91 -2.655 -3.528 3.949 1.00 1.00 H new ATOM 0 HA VAL A 91 -1.487 -3.247 6.668 1.00 1.00 H new ATOM 0 HB VAL A 91 -3.759 -5.133 5.878 1.00 1.00 H new ATOM 0 HG11 VAL A 91 -3.804 -5.691 8.310 1.00 1.00 H new ATOM 0 HG12 VAL A 91 -2.226 -6.085 7.590 1.00 1.00 H new ATOM 0 HG13 VAL A 91 -2.411 -4.619 8.581 1.00 1.00 H new ATOM 0 HG21 VAL A 91 -5.141 -3.748 7.447 1.00 1.00 H new ATOM 0 HG22 VAL A 91 -3.758 -2.653 7.687 1.00 1.00 H new ATOM 0 HG23 VAL A 91 -4.536 -2.767 6.091 1.00 1.00 H new ATOM 1354 N VAL A 92 -0.067 -5.254 6.270 1.00 1.00 N ATOM 1355 CA VAL A 92 0.912 -6.305 5.964 1.00 1.00 C ATOM 1356 C VAL A 92 0.475 -7.610 6.629 1.00 1.00 C ATOM 1357 O VAL A 92 0.008 -7.614 7.768 1.00 1.00 O ATOM 1358 CB VAL A 92 2.320 -5.881 6.470 1.00 1.00 C ATOM 1359 CG1 VAL A 92 3.394 -6.897 5.995 1.00 1.00 C ATOM 1360 CG2 VAL A 92 2.665 -4.475 5.918 1.00 1.00 C ATOM 0 H VAL A 92 0.100 -4.772 7.153 1.00 1.00 H new ATOM 0 HA VAL A 92 0.964 -6.455 4.886 1.00 1.00 H new ATOM 0 HB VAL A 92 2.310 -5.860 7.560 1.00 1.00 H new ATOM 0 HG11 VAL A 92 4.374 -6.586 6.357 1.00 1.00 H new ATOM 0 HG12 VAL A 92 3.158 -7.886 6.388 1.00 1.00 H new ATOM 0 HG13 VAL A 92 3.404 -6.933 4.906 1.00 1.00 H new ATOM 0 HG21 VAL A 92 3.652 -4.177 6.272 1.00 1.00 H new ATOM 0 HG22 VAL A 92 2.663 -4.501 4.828 1.00 1.00 H new ATOM 0 HG23 VAL A 92 1.923 -3.756 6.265 1.00 1.00 H new ATOM 1370 N ASP A 93 0.659 -8.719 5.919 1.00 1.00 N ATOM 1371 CA ASP A 93 0.290 -10.056 6.431 1.00 1.00 C ATOM 1372 C ASP A 93 0.655 -10.219 7.940 1.00 1.00 C ATOM 1373 O ASP A 93 1.645 -9.625 8.365 1.00 1.00 O ATOM 1374 CB ASP A 93 1.027 -11.116 5.590 1.00 1.00 C ATOM 1375 CG ASP A 93 2.526 -10.833 5.614 1.00 1.00 C ATOM 1376 OD1 ASP A 93 2.982 -10.102 4.751 1.00 1.00 O ATOM 1377 OD2 ASP A 93 3.193 -11.343 6.498 1.00 1.00 O ATOM 0 H ASP A 93 1.062 -8.729 4.982 1.00 1.00 H new ATOM 0 HA ASP A 93 -0.789 -10.182 6.347 1.00 1.00 H new ATOM 0 HB2 ASP A 93 0.828 -12.112 5.985 1.00 1.00 H new ATOM 0 HB3 ASP A 93 0.660 -11.101 4.564 1.00 1.00 H new ATOM 1382 N PRO A 94 -0.099 -10.953 8.712 1.00 1.00 N ATOM 1383 CA PRO A 94 0.214 -11.104 10.180 1.00 1.00 C ATOM 1384 C PRO A 94 1.470 -11.955 10.422 1.00 1.00 C ATOM 1385 O PRO A 94 1.454 -13.169 10.217 1.00 1.00 O ATOM 1386 CB PRO A 94 -1.068 -11.777 10.739 1.00 1.00 C ATOM 1387 CG PRO A 94 -1.552 -12.617 9.593 1.00 1.00 C ATOM 1388 CD PRO A 94 -1.319 -11.732 8.349 1.00 1.00 C ATOM 0 HA PRO A 94 0.445 -10.156 10.666 1.00 1.00 H new ATOM 0 HB2 PRO A 94 -0.852 -12.384 11.618 1.00 1.00 H new ATOM 0 HB3 PRO A 94 -1.812 -11.038 11.037 1.00 1.00 H new ATOM 0 HG2 PRO A 94 -0.999 -13.554 9.524 1.00 1.00 H new ATOM 0 HG3 PRO A 94 -2.605 -12.876 9.706 1.00 1.00 H new ATOM 0 HD2 PRO A 94 -1.163 -12.331 7.452 1.00 1.00 H new ATOM 0 HD3 PRO A 94 -2.170 -11.080 8.153 1.00 1.00 H new ATOM 1396 N ASP A 95 2.544 -11.312 10.869 1.00 1.00 N ATOM 1397 CA ASP A 95 3.816 -11.995 11.153 1.00 1.00 C ATOM 1398 C ASP A 95 3.795 -12.572 12.573 1.00 1.00 C ATOM 1399 O ASP A 95 4.814 -13.052 13.068 1.00 1.00 O ATOM 1400 CB ASP A 95 4.981 -10.989 11.007 1.00 1.00 C ATOM 1401 CG ASP A 95 4.774 -9.783 11.929 1.00 1.00 C ATOM 1402 OD1 ASP A 95 3.690 -9.225 11.906 1.00 1.00 O ATOM 1403 OD2 ASP A 95 5.703 -9.436 12.642 1.00 1.00 O ATOM 0 H ASP A 95 2.565 -10.308 11.046 1.00 1.00 H new ATOM 0 HA ASP A 95 3.954 -12.813 10.446 1.00 1.00 H new ATOM 0 HB2 ASP A 95 5.924 -11.480 11.248 1.00 1.00 H new ATOM 0 HB3 ASP A 95 5.051 -10.654 9.972 1.00 1.00 H new ATOM 1408 N ASN A 96 2.630 -12.529 13.211 1.00 1.00 N ATOM 1409 CA ASN A 96 2.473 -13.043 14.587 1.00 1.00 C ATOM 1410 C ASN A 96 1.042 -13.567 14.810 1.00 1.00 C ATOM 1411 O ASN A 96 0.391 -13.229 15.798 1.00 1.00 O ATOM 1412 CB ASN A 96 2.791 -11.911 15.589 1.00 1.00 C ATOM 1413 CG ASN A 96 4.210 -11.383 15.366 1.00 1.00 C ATOM 1414 OD1 ASN A 96 5.184 -12.065 15.686 1.00 1.00 O ATOM 1415 ND2 ASN A 96 4.385 -10.203 14.831 1.00 1.00 N ATOM 0 H ASN A 96 1.776 -12.146 12.807 1.00 1.00 H new ATOM 0 HA ASN A 96 3.164 -13.872 14.742 1.00 1.00 H new ATOM 0 HB2 ASN A 96 2.072 -11.100 15.471 1.00 1.00 H new ATOM 0 HB3 ASN A 96 2.690 -12.281 16.609 1.00 1.00 H new ATOM 0 HD21 ASN A 96 5.329 -9.847 14.679 1.00 1.00 H new ATOM 0 HD22 ASN A 96 3.578 -9.638 14.566 1.00 1.00 H new ATOM 1422 N ARG A 97 0.577 -14.401 13.887 1.00 1.00 N ATOM 1423 CA ARG A 97 -0.779 -14.987 13.974 1.00 1.00 C ATOM 1424 C ARG A 97 -1.850 -13.888 14.161 1.00 1.00 C ATOM 1425 O ARG A 97 -2.408 -13.386 13.186 1.00 1.00 O ATOM 1426 CB ARG A 97 -0.845 -15.994 15.146 1.00 1.00 C ATOM 1427 CG ARG A 97 0.149 -17.158 14.925 1.00 1.00 C ATOM 1428 CD ARG A 97 0.099 -18.119 16.131 1.00 1.00 C ATOM 1429 NE ARG A 97 1.045 -19.225 15.948 1.00 1.00 N ATOM 1430 CZ ARG A 97 1.195 -20.189 16.868 1.00 1.00 C ATOM 1431 NH1 ARG A 97 0.496 -20.168 17.976 1.00 1.00 N ATOM 1432 NH2 ARG A 97 2.042 -21.156 16.659 1.00 1.00 N ATOM 0 H ARG A 97 1.108 -14.693 13.067 1.00 1.00 H new ATOM 0 HA ARG A 97 -0.985 -15.507 13.039 1.00 1.00 H new ATOM 0 HB2 ARG A 97 -0.614 -15.485 16.082 1.00 1.00 H new ATOM 0 HB3 ARG A 97 -1.858 -16.387 15.238 1.00 1.00 H new ATOM 0 HG2 ARG A 97 -0.101 -17.694 14.010 1.00 1.00 H new ATOM 0 HG3 ARG A 97 1.159 -16.768 14.800 1.00 1.00 H new ATOM 0 HD2 ARG A 97 0.338 -17.576 17.046 1.00 1.00 H new ATOM 0 HD3 ARG A 97 -0.911 -18.512 16.248 1.00 1.00 H new ATOM 0 HE ARG A 97 1.605 -19.262 15.096 1.00 1.00 H new ATOM 0 HH11 ARG A 97 -0.170 -19.414 18.145 1.00 1.00 H new ATOM 0 HH12 ARG A 97 0.617 -20.906 18.670 1.00 1.00 H new ATOM 0 HH21 ARG A 97 2.588 -21.178 15.798 1.00 1.00 H new ATOM 0 HH22 ARG A 97 2.159 -21.891 17.356 1.00 1.00 H new ATOM 1446 N VAL A 98 -2.109 -13.519 15.412 1.00 1.00 N ATOM 1447 CA VAL A 98 -3.104 -12.467 15.733 1.00 1.00 C ATOM 1448 C VAL A 98 -2.499 -11.461 16.724 1.00 1.00 C ATOM 1449 O VAL A 98 -2.027 -11.818 17.804 1.00 1.00 O ATOM 1450 CB VAL A 98 -4.387 -13.114 16.324 1.00 1.00 C ATOM 1451 CG1 VAL A 98 -5.495 -12.046 16.531 1.00 1.00 C ATOM 1452 CG2 VAL A 98 -4.902 -14.207 15.354 1.00 1.00 C ATOM 0 H VAL A 98 -1.651 -13.925 16.228 1.00 1.00 H new ATOM 0 HA VAL A 98 -3.374 -11.936 14.820 1.00 1.00 H new ATOM 0 HB VAL A 98 -4.143 -13.555 17.290 1.00 1.00 H new ATOM 0 HG11 VAL A 98 -6.385 -12.520 16.946 1.00 1.00 H new ATOM 0 HG12 VAL A 98 -5.138 -11.280 17.219 1.00 1.00 H new ATOM 0 HG13 VAL A 98 -5.741 -11.587 15.574 1.00 1.00 H new ATOM 0 HG21 VAL A 98 -5.802 -14.663 15.765 1.00 1.00 H new ATOM 0 HG22 VAL A 98 -5.132 -13.757 14.388 1.00 1.00 H new ATOM 0 HG23 VAL A 98 -4.135 -14.970 15.225 1.00 1.00 H new ATOM 1462 N ALA A 99 -2.538 -10.190 16.338 1.00 1.00 N ATOM 1463 CA ALA A 99 -1.998 -9.117 17.182 1.00 1.00 C ATOM 1464 C ALA A 99 -2.377 -7.749 16.601 1.00 1.00 C ATOM 1465 O ALA A 99 -1.744 -7.261 15.664 1.00 1.00 O ATOM 1466 CB ALA A 99 -0.464 -9.246 17.267 1.00 1.00 C ATOM 0 H ALA A 99 -2.934 -9.874 15.453 1.00 1.00 H new ATOM 0 HA ALA A 99 -2.421 -9.203 18.183 1.00 1.00 H new ATOM 0 HB1 ALA A 99 -0.066 -8.448 17.894 1.00 1.00 H new ATOM 0 HB2 ALA A 99 -0.204 -10.212 17.700 1.00 1.00 H new ATOM 0 HB3 ALA A 99 -0.036 -9.169 16.267 1.00 1.00 H new ATOM 1472 N GLU A 100 -3.406 -7.135 17.176 1.00 1.00 N ATOM 1473 CA GLU A 100 -3.859 -5.819 16.693 1.00 1.00 C ATOM 1474 C GLU A 100 -2.824 -4.750 17.050 1.00 1.00 C ATOM 1475 O GLU A 100 -2.265 -4.090 16.175 1.00 1.00 O ATOM 1476 CB GLU A 100 -5.242 -5.485 17.310 1.00 1.00 C ATOM 1477 CG GLU A 100 -5.854 -4.194 16.686 1.00 1.00 C ATOM 1478 CD GLU A 100 -6.205 -4.400 15.207 1.00 1.00 C ATOM 1479 OE1 GLU A 100 -6.444 -5.533 14.819 1.00 1.00 O ATOM 1480 OE2 GLU A 100 -6.220 -3.417 14.482 1.00 1.00 O ATOM 0 H GLU A 100 -3.938 -7.511 17.961 1.00 1.00 H new ATOM 0 HA GLU A 100 -3.963 -5.842 15.608 1.00 1.00 H new ATOM 0 HB2 GLU A 100 -5.922 -6.322 17.154 1.00 1.00 H new ATOM 0 HB3 GLU A 100 -5.138 -5.355 18.387 1.00 1.00 H new ATOM 0 HG2 GLU A 100 -6.750 -3.911 17.238 1.00 1.00 H new ATOM 0 HG3 GLU A 100 -5.146 -3.371 16.782 1.00 1.00 H new ATOM 1487 N SER A 101 -2.583 -4.584 18.347 1.00 1.00 N ATOM 1488 CA SER A 101 -1.605 -3.574 18.822 1.00 1.00 C ATOM 1489 C SER A 101 -0.303 -3.608 17.986 1.00 1.00 C ATOM 1490 O SER A 101 0.164 -2.564 17.531 1.00 1.00 O ATOM 1491 CB SER A 101 -1.269 -3.843 20.296 1.00 1.00 C ATOM 1492 OG SER A 101 -0.332 -2.877 20.754 1.00 1.00 O ATOM 0 H SER A 101 -3.036 -5.119 19.088 1.00 1.00 H new ATOM 0 HA SER A 101 -2.056 -2.588 18.710 1.00 1.00 H new ATOM 0 HB2 SER A 101 -2.175 -3.801 20.900 1.00 1.00 H new ATOM 0 HB3 SER A 101 -0.857 -4.846 20.409 1.00 1.00 H new ATOM 0 HG SER A 101 -0.119 -3.048 21.695 1.00 1.00 H new ATOM 1498 N ASP A 102 0.239 -4.802 17.764 1.00 1.00 N ATOM 1499 CA ASP A 102 1.466 -4.942 16.950 1.00 1.00 C ATOM 1500 C ASP A 102 1.217 -4.446 15.514 1.00 1.00 C ATOM 1501 O ASP A 102 1.701 -3.380 15.132 1.00 1.00 O ATOM 1502 CB ASP A 102 1.918 -6.419 16.926 1.00 1.00 C ATOM 1503 CG ASP A 102 3.271 -6.576 16.215 1.00 1.00 C ATOM 1504 OD1 ASP A 102 4.206 -5.896 16.609 1.00 1.00 O ATOM 1505 OD2 ASP A 102 3.352 -7.376 15.296 1.00 1.00 O ATOM 0 H ASP A 102 -0.136 -5.679 18.125 1.00 1.00 H new ATOM 0 HA ASP A 102 2.253 -4.335 17.398 1.00 1.00 H new ATOM 0 HB2 ASP A 102 1.995 -6.795 17.946 1.00 1.00 H new ATOM 0 HB3 ASP A 102 1.166 -7.024 16.419 1.00 1.00 H new ATOM 1510 N LYS A 103 0.461 -5.216 14.739 1.00 1.00 N ATOM 1511 CA LYS A 103 0.148 -4.824 13.328 1.00 1.00 C ATOM 1512 C LYS A 103 -0.199 -3.314 13.228 1.00 1.00 C ATOM 1513 O LYS A 103 0.300 -2.606 12.353 1.00 1.00 O ATOM 1514 CB LYS A 103 -1.057 -5.654 12.811 1.00 1.00 C ATOM 1515 CG LYS A 103 -0.693 -7.160 12.736 1.00 1.00 C ATOM 1516 CD LYS A 103 -1.941 -8.028 12.397 1.00 1.00 C ATOM 1517 CE LYS A 103 -2.477 -7.749 10.961 1.00 1.00 C ATOM 1518 NZ LYS A 103 -1.354 -7.718 9.980 1.00 1.00 N ATOM 0 H LYS A 103 0.051 -6.101 15.036 1.00 1.00 H new ATOM 0 HA LYS A 103 1.031 -5.020 12.720 1.00 1.00 H new ATOM 0 HB2 LYS A 103 -1.912 -5.514 13.472 1.00 1.00 H new ATOM 0 HB3 LYS A 103 -1.355 -5.297 11.825 1.00 1.00 H new ATOM 0 HG2 LYS A 103 0.076 -7.313 11.979 1.00 1.00 H new ATOM 0 HG3 LYS A 103 -0.271 -7.482 13.688 1.00 1.00 H new ATOM 0 HD2 LYS A 103 -1.684 -9.083 12.489 1.00 1.00 H new ATOM 0 HD3 LYS A 103 -2.729 -7.828 13.123 1.00 1.00 H new ATOM 0 HE2 LYS A 103 -3.193 -8.520 10.678 1.00 1.00 H new ATOM 0 HE3 LYS A 103 -3.009 -6.798 10.944 1.00 1.00 H new ATOM 0 HZ1 LYS A 103 -1.738 -7.701 9.014 1.00 1.00 H new ATOM 0 HZ2 LYS A 103 -0.778 -6.867 10.139 1.00 1.00 H new ATOM 0 HZ3 LYS A 103 -0.762 -8.564 10.103 1.00 1.00 H new ATOM 1532 N ALA A 104 -1.037 -2.846 14.148 1.00 1.00 N ATOM 1533 CA ALA A 104 -1.421 -1.410 14.190 1.00 1.00 C ATOM 1534 C ALA A 104 -0.173 -0.479 14.192 1.00 1.00 C ATOM 1535 O ALA A 104 -0.281 0.742 14.079 1.00 1.00 O ATOM 1536 CB ALA A 104 -2.272 -1.140 15.443 1.00 1.00 C ATOM 0 H ALA A 104 -1.467 -3.420 14.873 1.00 1.00 H new ATOM 0 HA ALA A 104 -1.999 -1.191 13.292 1.00 1.00 H new ATOM 0 HB1 ALA A 104 -2.553 -0.087 15.472 1.00 1.00 H new ATOM 0 HB2 ALA A 104 -3.172 -1.755 15.411 1.00 1.00 H new ATOM 0 HB3 ALA A 104 -1.695 -1.387 16.335 1.00 1.00 H new ATOM 1542 N ASN A 105 0.999 -1.096 14.297 1.00 1.00 N ATOM 1543 CA ASN A 105 2.271 -0.335 14.283 1.00 1.00 C ATOM 1544 C ASN A 105 2.707 -0.075 12.841 1.00 1.00 C ATOM 1545 O ASN A 105 3.230 0.998 12.540 1.00 1.00 O ATOM 1546 CB ASN A 105 3.393 -1.079 15.046 1.00 1.00 C ATOM 1547 CG ASN A 105 2.972 -1.365 16.494 1.00 1.00 C ATOM 1548 OD1 ASN A 105 3.601 -2.183 17.166 1.00 1.00 O ATOM 1549 ND2 ASN A 105 1.944 -0.747 17.016 1.00 1.00 N ATOM 0 H ASN A 105 1.109 -2.106 14.392 1.00 1.00 H new ATOM 0 HA ASN A 105 2.096 0.614 14.790 1.00 1.00 H new ATOM 0 HB2 ASN A 105 3.625 -2.015 14.538 1.00 1.00 H new ATOM 0 HB3 ASN A 105 4.303 -0.479 15.039 1.00 1.00 H new ATOM 0 HD21 ASN A 105 1.665 -0.943 17.977 1.00 1.00 H new ATOM 0 HD22 ASN A 105 1.421 -0.069 16.462 1.00 1.00 H new ATOM 1556 N ASN A 106 2.502 -1.052 11.964 1.00 1.00 N ATOM 1557 CA ASN A 106 2.876 -0.956 10.541 1.00 1.00 C ATOM 1558 C ASN A 106 1.673 -0.501 9.706 1.00 1.00 C ATOM 1559 O ASN A 106 1.386 -1.057 8.646 1.00 1.00 O ATOM 1560 CB ASN A 106 3.362 -2.340 10.055 1.00 1.00 C ATOM 1561 CG ASN A 106 4.579 -2.795 10.860 1.00 1.00 C ATOM 1562 OD1 ASN A 106 4.671 -3.963 11.240 1.00 1.00 O ATOM 1563 ND2 ASN A 106 5.525 -1.941 11.139 1.00 1.00 N ATOM 0 H ASN A 106 2.070 -1.942 12.213 1.00 1.00 H new ATOM 0 HA ASN A 106 3.674 -0.223 10.424 1.00 1.00 H new ATOM 0 HB2 ASN A 106 2.559 -3.070 10.156 1.00 1.00 H new ATOM 0 HB3 ASN A 106 3.617 -2.291 8.996 1.00 1.00 H new ATOM 0 HD21 ASN A 106 6.341 -2.240 11.672 1.00 1.00 H new ATOM 0 HD22 ASN A 106 5.448 -0.974 10.824 1.00 1.00 H new ATOM 1570 N VAL A 107 0.991 0.533 10.188 1.00 1.00 N ATOM 1571 CA VAL A 107 -0.194 1.091 9.493 1.00 1.00 C ATOM 1572 C VAL A 107 0.180 2.413 8.836 1.00 1.00 C ATOM 1573 O VAL A 107 0.894 3.229 9.418 1.00 1.00 O ATOM 1574 CB VAL A 107 -1.357 1.295 10.510 1.00 1.00 C ATOM 1575 CG1 VAL A 107 -0.970 2.326 11.606 1.00 1.00 C ATOM 1576 CG2 VAL A 107 -2.649 1.768 9.783 1.00 1.00 C ATOM 0 H VAL A 107 1.228 1.011 11.057 1.00 1.00 H new ATOM 0 HA VAL A 107 -0.527 0.396 8.723 1.00 1.00 H new ATOM 0 HB VAL A 107 -1.547 0.333 10.986 1.00 1.00 H new ATOM 0 HG11 VAL A 107 -1.801 2.447 12.301 1.00 1.00 H new ATOM 0 HG12 VAL A 107 -0.093 1.970 12.147 1.00 1.00 H new ATOM 0 HG13 VAL A 107 -0.744 3.285 11.140 1.00 1.00 H new ATOM 0 HG21 VAL A 107 -3.448 1.904 10.512 1.00 1.00 H new ATOM 0 HG22 VAL A 107 -2.456 2.713 9.276 1.00 1.00 H new ATOM 0 HG23 VAL A 107 -2.950 1.018 9.051 1.00 1.00 H new ATOM 1586 N PHE A 108 -0.316 2.621 7.620 1.00 1.00 N ATOM 1587 CA PHE A 108 -0.030 3.852 6.872 1.00 1.00 C ATOM 1588 C PHE A 108 -1.245 4.254 6.035 1.00 1.00 C ATOM 1589 O PHE A 108 -1.946 3.405 5.483 1.00 1.00 O ATOM 1590 CB PHE A 108 1.199 3.613 5.967 1.00 1.00 C ATOM 1591 CG PHE A 108 2.376 3.108 6.821 1.00 1.00 C ATOM 1592 CD1 PHE A 108 2.967 3.962 7.770 1.00 1.00 C ATOM 1593 CD2 PHE A 108 2.881 1.793 6.672 1.00 1.00 C ATOM 1594 CE1 PHE A 108 4.041 3.517 8.554 1.00 1.00 C ATOM 1595 CE2 PHE A 108 3.956 1.356 7.461 1.00 1.00 C ATOM 1596 CZ PHE A 108 4.534 2.217 8.400 1.00 1.00 C ATOM 0 H PHE A 108 -0.916 1.959 7.129 1.00 1.00 H new ATOM 0 HA PHE A 108 0.186 4.664 7.566 1.00 1.00 H new ATOM 0 HB2 PHE A 108 0.958 2.884 5.194 1.00 1.00 H new ATOM 0 HB3 PHE A 108 1.475 4.537 5.459 1.00 1.00 H new ATOM 0 HD1 PHE A 108 2.591 4.967 7.895 1.00 1.00 H new ATOM 0 HD2 PHE A 108 2.437 1.125 5.949 1.00 1.00 H new ATOM 0 HE1 PHE A 108 4.489 4.180 9.279 1.00 1.00 H new ATOM 0 HE2 PHE A 108 4.338 0.353 7.343 1.00 1.00 H new ATOM 0 HZ PHE A 108 5.361 1.878 9.006 1.00 1.00 H new ATOM 1606 N SER A 109 -1.474 5.559 5.938 1.00 1.00 N ATOM 1607 CA SER A 109 -2.604 6.082 5.171 1.00 1.00 C ATOM 1608 C SER A 109 -2.485 7.597 5.040 1.00 1.00 C ATOM 1609 O SER A 109 -2.053 8.287 5.964 1.00 1.00 O ATOM 1610 CB SER A 109 -3.919 5.728 5.892 1.00 1.00 C ATOM 1611 OG SER A 109 -3.858 6.214 7.226 1.00 1.00 O ATOM 0 H SER A 109 -0.895 6.274 6.379 1.00 1.00 H new ATOM 0 HA SER A 109 -2.601 5.637 4.176 1.00 1.00 H new ATOM 0 HB2 SER A 109 -4.767 6.170 5.368 1.00 1.00 H new ATOM 0 HB3 SER A 109 -4.071 4.649 5.891 1.00 1.00 H new ATOM 0 HG SER A 109 -4.742 6.139 7.642 1.00 1.00 H new ATOM 1617 N ARG A 110 -2.884 8.110 3.880 1.00 1.00 N ATOM 1618 CA ARG A 110 -2.831 9.556 3.614 1.00 1.00 C ATOM 1619 C ARG A 110 -4.031 9.981 2.770 1.00 1.00 C ATOM 1620 O ARG A 110 -4.515 9.233 1.920 1.00 1.00 O ATOM 1621 CB ARG A 110 -1.504 9.891 2.888 1.00 1.00 C ATOM 1622 CG ARG A 110 -1.471 9.256 1.473 1.00 1.00 C ATOM 1623 CD ARG A 110 -0.103 9.491 0.816 1.00 1.00 C ATOM 1624 NE ARG A 110 0.136 10.928 0.670 1.00 1.00 N ATOM 1625 CZ ARG A 110 1.268 11.417 0.147 1.00 1.00 C ATOM 1626 NH1 ARG A 110 2.220 10.619 -0.266 1.00 1.00 N ATOM 1627 NH2 ARG A 110 1.419 12.708 0.048 1.00 1.00 N ATOM 0 H ARG A 110 -3.248 7.553 3.107 1.00 1.00 H new ATOM 0 HA ARG A 110 -2.870 10.103 4.556 1.00 1.00 H new ATOM 0 HB2 ARG A 110 -1.391 10.972 2.808 1.00 1.00 H new ATOM 0 HB3 ARG A 110 -0.661 9.525 3.475 1.00 1.00 H new ATOM 0 HG2 ARG A 110 -1.670 8.187 1.542 1.00 1.00 H new ATOM 0 HG3 ARG A 110 -2.258 9.688 0.855 1.00 1.00 H new ATOM 0 HD2 ARG A 110 0.684 9.042 1.422 1.00 1.00 H new ATOM 0 HD3 ARG A 110 -0.070 9.006 -0.160 1.00 1.00 H new ATOM 0 HE ARG A 110 -0.585 11.580 0.978 1.00 1.00 H new ATOM 0 HH11 ARG A 110 2.106 9.608 -0.192 1.00 1.00 H new ATOM 0 HH12 ARG A 110 3.076 11.008 -0.662 1.00 1.00 H new ATOM 0 HH21 ARG A 110 0.680 13.334 0.367 1.00 1.00 H new ATOM 0 HH22 ARG A 110 2.277 13.092 -0.349 1.00 1.00 H new ATOM 1641 N ILE A 111 -4.492 11.206 3.004 1.00 1.00 N ATOM 1642 CA ILE A 111 -5.632 11.760 2.261 1.00 1.00 C ATOM 1643 C ILE A 111 -5.102 12.532 1.047 1.00 1.00 C ATOM 1644 O ILE A 111 -4.062 13.190 1.106 1.00 1.00 O ATOM 1645 CB ILE A 111 -6.476 12.692 3.197 1.00 1.00 C ATOM 1646 CG1 ILE A 111 -7.223 11.846 4.282 1.00 1.00 C ATOM 1647 CG2 ILE A 111 -7.539 13.514 2.385 1.00 1.00 C ATOM 1648 CD1 ILE A 111 -6.260 11.066 5.199 1.00 1.00 C ATOM 0 H ILE A 111 -4.098 11.838 3.701 1.00 1.00 H new ATOM 0 HA ILE A 111 -6.282 10.956 1.914 1.00 1.00 H new ATOM 0 HB ILE A 111 -5.780 13.383 3.673 1.00 1.00 H new ATOM 0 HG12 ILE A 111 -7.841 12.507 4.890 1.00 1.00 H new ATOM 0 HG13 ILE A 111 -7.896 11.145 3.789 1.00 1.00 H new ATOM 0 HG21 ILE A 111 -8.106 14.149 3.066 1.00 1.00 H new ATOM 0 HG22 ILE A 111 -7.032 14.135 1.647 1.00 1.00 H new ATOM 0 HG23 ILE A 111 -8.218 12.829 1.878 1.00 1.00 H new ATOM 0 HD11 ILE A 111 -6.834 10.498 5.931 1.00 1.00 H new ATOM 0 HD12 ILE A 111 -5.660 10.382 4.599 1.00 1.00 H new ATOM 0 HD13 ILE A 111 -5.604 11.766 5.717 1.00 1.00 H new ATOM 1660 N VAL A 112 -5.852 12.463 -0.047 1.00 1.00 N ATOM 1661 CA VAL A 112 -5.472 13.163 -1.297 1.00 1.00 C ATOM 1662 C VAL A 112 -6.705 13.819 -1.923 1.00 1.00 C ATOM 1663 O VAL A 112 -7.796 13.248 -1.934 1.00 1.00 O ATOM 1664 CB VAL A 112 -4.802 12.164 -2.294 1.00 1.00 C ATOM 1665 CG1 VAL A 112 -3.426 11.705 -1.744 1.00 1.00 C ATOM 1666 CG2 VAL A 112 -5.708 10.927 -2.505 1.00 1.00 C ATOM 0 H VAL A 112 -6.724 11.937 -0.107 1.00 1.00 H new ATOM 0 HA VAL A 112 -4.748 13.944 -1.064 1.00 1.00 H new ATOM 0 HB VAL A 112 -4.660 12.672 -3.248 1.00 1.00 H new ATOM 0 HG11 VAL A 112 -2.967 11.009 -2.446 1.00 1.00 H new ATOM 0 HG12 VAL A 112 -2.778 12.572 -1.616 1.00 1.00 H new ATOM 0 HG13 VAL A 112 -3.565 11.211 -0.782 1.00 1.00 H new ATOM 0 HG21 VAL A 112 -5.229 10.240 -3.202 1.00 1.00 H new ATOM 0 HG22 VAL A 112 -5.866 10.425 -1.551 1.00 1.00 H new ATOM 0 HG23 VAL A 112 -6.668 11.244 -2.911 1.00 1.00 H new ATOM 1676 N LYS A 113 -6.514 15.026 -2.447 1.00 1.00 N ATOM 1677 CA LYS A 113 -7.603 15.798 -3.080 1.00 1.00 C ATOM 1678 C LYS A 113 -7.387 15.858 -4.588 1.00 1.00 C ATOM 1679 O LYS A 113 -6.256 15.951 -5.065 1.00 1.00 O ATOM 1680 CB LYS A 113 -7.638 17.230 -2.486 1.00 1.00 C ATOM 1681 CG LYS A 113 -7.920 17.160 -0.964 1.00 1.00 C ATOM 1682 CD LYS A 113 -8.044 18.581 -0.368 1.00 1.00 C ATOM 1683 CE LYS A 113 -8.327 18.502 1.146 1.00 1.00 C ATOM 1684 NZ LYS A 113 -8.472 19.880 1.700 1.00 1.00 N ATOM 0 H LYS A 113 -5.612 15.502 -2.450 1.00 1.00 H new ATOM 0 HA LYS A 113 -8.556 15.308 -2.882 1.00 1.00 H new ATOM 0 HB2 LYS A 113 -6.687 17.732 -2.666 1.00 1.00 H new ATOM 0 HB3 LYS A 113 -8.409 17.820 -2.981 1.00 1.00 H new ATOM 0 HG2 LYS A 113 -8.839 16.603 -0.784 1.00 1.00 H new ATOM 0 HG3 LYS A 113 -7.117 16.619 -0.464 1.00 1.00 H new ATOM 0 HD2 LYS A 113 -7.124 19.139 -0.545 1.00 1.00 H new ATOM 0 HD3 LYS A 113 -8.847 19.124 -0.867 1.00 1.00 H new ATOM 0 HE2 LYS A 113 -9.236 17.929 1.327 1.00 1.00 H new ATOM 0 HE3 LYS A 113 -7.515 17.979 1.651 1.00 1.00 H new ATOM 0 HZ1 LYS A 113 -8.663 19.825 2.721 1.00 1.00 H new ATOM 0 HZ2 LYS A 113 -7.593 20.413 1.540 1.00 1.00 H new ATOM 0 HZ3 LYS A 113 -9.261 20.364 1.226 1.00 1.00 H new ATOM 1698 N VAL A 114 -8.486 15.813 -5.334 1.00 1.00 N ATOM 1699 CA VAL A 114 -8.454 15.850 -6.808 1.00 1.00 C ATOM 1700 C VAL A 114 -9.001 17.188 -7.305 1.00 1.00 C ATOM 1701 O VAL A 114 -10.025 17.676 -6.826 1.00 1.00 O ATOM 1702 CB VAL A 114 -9.286 14.659 -7.375 1.00 1.00 C ATOM 1703 CG1 VAL A 114 -8.633 13.323 -6.943 1.00 1.00 C ATOM 1704 CG2 VAL A 114 -10.747 14.706 -6.853 1.00 1.00 C ATOM 0 H VAL A 114 -9.426 15.750 -4.944 1.00 1.00 H new ATOM 0 HA VAL A 114 -7.426 15.753 -7.158 1.00 1.00 H new ATOM 0 HB VAL A 114 -9.301 14.735 -8.462 1.00 1.00 H new ATOM 0 HG11 VAL A 114 -9.214 12.490 -7.339 1.00 1.00 H new ATOM 0 HG12 VAL A 114 -7.616 13.273 -7.331 1.00 1.00 H new ATOM 0 HG13 VAL A 114 -8.610 13.265 -5.855 1.00 1.00 H new ATOM 0 HG21 VAL A 114 -11.307 13.865 -7.262 1.00 1.00 H new ATOM 0 HG22 VAL A 114 -10.747 14.646 -5.765 1.00 1.00 H new ATOM 0 HG23 VAL A 114 -11.215 15.640 -7.165 1.00 1.00 H new ATOM 1714 N LEU A 115 -8.308 17.769 -8.279 1.00 1.00 N ATOM 1715 CA LEU A 115 -8.722 19.060 -8.842 1.00 1.00 C ATOM 1716 C LEU A 115 -9.813 18.821 -9.895 1.00 1.00 C ATOM 1717 O LEU A 115 -9.695 17.957 -10.763 1.00 1.00 O ATOM 1718 CB LEU A 115 -7.486 19.795 -9.456 1.00 1.00 C ATOM 1719 CG LEU A 115 -6.603 20.503 -8.359 1.00 1.00 C ATOM 1720 CD1 LEU A 115 -7.341 21.713 -7.684 1.00 1.00 C ATOM 1721 CD2 LEU A 115 -6.147 19.479 -7.284 1.00 1.00 C ATOM 0 H LEU A 115 -7.464 17.375 -8.695 1.00 1.00 H new ATOM 0 HA LEU A 115 -9.130 19.698 -8.058 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -6.875 19.077 -10.003 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -7.829 20.537 -10.177 1.00 1.00 H new ATOM 0 HG LEU A 115 -5.726 20.905 -8.866 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -6.689 22.165 -6.936 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -7.593 22.454 -8.442 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -8.254 21.360 -7.204 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -5.538 19.985 -6.535 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -7.022 19.040 -6.805 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -5.560 18.692 -7.757 1.00 1.00 H new ATOM 1733 N GLU A 116 -10.877 19.613 -9.802 1.00 1.00 N ATOM 1734 CA GLU A 116 -12.017 19.505 -10.735 1.00 1.00 C ATOM 1735 C GLU A 116 -12.361 20.887 -11.289 1.00 1.00 C ATOM 1736 O GLU A 116 -13.015 21.696 -10.631 1.00 1.00 O ATOM 1737 CB GLU A 116 -13.231 18.909 -9.986 1.00 1.00 C ATOM 1738 CG GLU A 116 -12.894 17.502 -9.429 1.00 1.00 C ATOM 1739 CD GLU A 116 -12.596 16.507 -10.558 1.00 1.00 C ATOM 1740 OE1 GLU A 116 -13.408 16.408 -11.463 1.00 1.00 O ATOM 1741 OE2 GLU A 116 -11.561 15.859 -10.500 1.00 1.00 O ATOM 0 H GLU A 116 -10.983 20.339 -9.094 1.00 1.00 H new ATOM 0 HA GLU A 116 -11.754 18.852 -11.567 1.00 1.00 H new ATOM 0 HB2 GLU A 116 -13.520 19.569 -9.169 1.00 1.00 H new ATOM 0 HB3 GLU A 116 -14.085 18.844 -10.661 1.00 1.00 H new ATOM 0 HG2 GLU A 116 -12.032 17.569 -8.765 1.00 1.00 H new ATOM 0 HG3 GLU A 116 -13.729 17.136 -8.831 1.00 1.00 H new ATOM 1748 N HIS A 117 -11.926 21.139 -12.520 1.00 1.00 N ATOM 1749 CA HIS A 117 -12.176 22.420 -13.177 1.00 1.00 C ATOM 1750 C HIS A 117 -11.889 22.311 -14.673 1.00 1.00 C ATOM 1751 O HIS A 117 -11.358 21.310 -15.154 1.00 1.00 O ATOM 1752 CB HIS A 117 -11.293 23.511 -12.529 1.00 1.00 C ATOM 1753 CG HIS A 117 -9.831 23.157 -12.671 1.00 1.00 C ATOM 1754 ND1 HIS A 117 -9.356 21.871 -12.462 1.00 1.00 N ATOM 1755 CD2 HIS A 117 -8.732 23.911 -13.009 1.00 1.00 C ATOM 1756 CE1 HIS A 117 -8.027 21.889 -12.675 1.00 1.00 C ATOM 1757 NE2 HIS A 117 -7.596 23.108 -13.011 1.00 1.00 N ATOM 0 H HIS A 117 -11.398 20.473 -13.084 1.00 1.00 H new ATOM 0 HA HIS A 117 -13.224 22.693 -13.052 1.00 1.00 H new ATOM 0 HB2 HIS A 117 -11.488 24.474 -13.001 1.00 1.00 H new ATOM 0 HB3 HIS A 117 -11.548 23.615 -11.474 1.00 1.00 H new ATOM 0 HD2 HIS A 117 -8.748 24.966 -13.238 1.00 1.00 H new ATOM 0 HE1 HIS A 117 -7.387 21.024 -12.585 1.00 1.00 H new ATOM 0 HE2 HIS A 117 -6.639 23.390 -13.224 1.00 1.00 H new ATOM 1766 N HIS A 118 -12.245 23.363 -15.403 1.00 1.00 N ATOM 1767 CA HIS A 118 -12.027 23.397 -16.859 1.00 1.00 C ATOM 1768 C HIS A 118 -11.793 24.832 -17.323 1.00 1.00 C ATOM 1769 O HIS A 118 -12.278 25.785 -16.714 1.00 1.00 O ATOM 1770 CB HIS A 118 -13.254 22.796 -17.576 1.00 1.00 C ATOM 1771 CG HIS A 118 -13.461 21.374 -17.116 1.00 1.00 C ATOM 1772 ND1 HIS A 118 -14.194 21.064 -15.980 1.00 1.00 N ATOM 1773 CD2 HIS A 118 -13.023 20.173 -17.617 1.00 1.00 C ATOM 1774 CE1 HIS A 118 -14.174 19.726 -15.838 1.00 1.00 C ATOM 1775 NE2 HIS A 118 -13.474 19.135 -16.808 1.00 1.00 N ATOM 0 H HIS A 118 -12.683 24.201 -15.021 1.00 1.00 H new ATOM 0 HA HIS A 118 -11.144 22.807 -17.105 1.00 1.00 H new ATOM 0 HB2 HIS A 118 -14.141 23.391 -17.361 1.00 1.00 H new ATOM 0 HB3 HIS A 118 -13.106 22.822 -18.656 1.00 1.00 H new ATOM 0 HD2 HIS A 118 -12.420 20.052 -18.505 1.00 1.00 H new ATOM 0 HE1 HIS A 118 -14.665 19.195 -15.036 1.00 1.00 H new ATOM 0 HE2 HIS A 118 -13.306 18.136 -16.930 1.00 1.00 H new ATOM 1784 N HIS A 119 -11.050 24.973 -18.417 1.00 1.00 N ATOM 1785 CA HIS A 119 -10.748 26.294 -18.967 1.00 1.00 C ATOM 1786 C HIS A 119 -12.024 26.915 -19.544 1.00 1.00 C ATOM 1787 O HIS A 119 -12.665 26.336 -20.421 1.00 1.00 O ATOM 1788 CB HIS A 119 -9.672 26.164 -20.066 1.00 1.00 C ATOM 1789 CG HIS A 119 -8.411 25.577 -19.476 1.00 1.00 C ATOM 1790 ND1 HIS A 119 -7.693 26.223 -18.481 1.00 1.00 N ATOM 1791 CD2 HIS A 119 -7.735 24.408 -19.728 1.00 1.00 C ATOM 1792 CE1 HIS A 119 -6.637 25.447 -18.173 1.00 1.00 C ATOM 1793 NE2 HIS A 119 -6.616 24.329 -18.903 1.00 1.00 N ATOM 0 H HIS A 119 -10.647 24.195 -18.939 1.00 1.00 H new ATOM 0 HA HIS A 119 -10.368 26.940 -18.176 1.00 1.00 H new ATOM 0 HB2 HIS A 119 -10.037 25.529 -20.873 1.00 1.00 H new ATOM 0 HB3 HIS A 119 -9.461 27.141 -20.500 1.00 1.00 H new ATOM 0 HD2 HIS A 119 -8.027 23.664 -20.455 1.00 1.00 H new ATOM 0 HE1 HIS A 119 -5.897 25.698 -17.427 1.00 1.00 H new ATOM 0 HE2 HIS A 119 -5.927 23.578 -18.864 1.00 1.00 H new ATOM 1802 N HIS A 120 -12.376 28.098 -19.051 1.00 1.00 N ATOM 1803 CA HIS A 120 -13.575 28.804 -19.507 1.00 1.00 C ATOM 1804 C HIS A 120 -13.293 29.505 -20.839 1.00 1.00 C ATOM 1805 O HIS A 120 -12.373 29.130 -21.566 1.00 1.00 O ATOM 1806 CB HIS A 120 -13.995 29.831 -18.428 1.00 1.00 C ATOM 1807 CG HIS A 120 -14.203 29.130 -17.108 1.00 1.00 C ATOM 1808 ND1 HIS A 120 -13.178 28.966 -16.189 1.00 1.00 N ATOM 1809 CD2 HIS A 120 -15.312 28.552 -16.537 1.00 1.00 C ATOM 1810 CE1 HIS A 120 -13.685 28.316 -15.125 1.00 1.00 C ATOM 1811 NE2 HIS A 120 -14.981 28.040 -15.285 1.00 1.00 N ATOM 0 H HIS A 120 -11.847 28.592 -18.332 1.00 1.00 H new ATOM 0 HA HIS A 120 -14.388 28.094 -19.661 1.00 1.00 H new ATOM 0 HB2 HIS A 120 -13.228 30.599 -18.326 1.00 1.00 H new ATOM 0 HB3 HIS A 120 -14.913 30.336 -18.731 1.00 1.00 H new ATOM 0 HD2 HIS A 120 -16.291 28.503 -16.990 1.00 1.00 H new ATOM 0 HE1 HIS A 120 -13.113 28.050 -14.248 1.00 1.00 H new ATOM 0 HE2 HIS A 120 -15.597 27.558 -14.631 1.00 1.00 H new ATOM 1820 N HIS A 121 -14.088 30.526 -21.145 1.00 1.00 N ATOM 1821 CA HIS A 121 -13.923 31.282 -22.401 1.00 1.00 C ATOM 1822 C HIS A 121 -13.979 30.340 -23.626 1.00 1.00 C ATOM 1823 O HIS A 121 -15.026 30.190 -24.256 1.00 1.00 O ATOM 1824 CB HIS A 121 -12.589 32.064 -22.385 1.00 1.00 C ATOM 1825 CG HIS A 121 -12.530 32.964 -21.178 1.00 1.00 C ATOM 1826 ND1 HIS A 121 -13.277 34.126 -21.083 1.00 1.00 N ATOM 1827 CD2 HIS A 121 -11.805 32.887 -20.014 1.00 1.00 C ATOM 1828 CE1 HIS A 121 -12.986 34.699 -19.900 1.00 1.00 C ATOM 1829 NE2 HIS A 121 -12.094 33.985 -19.209 1.00 1.00 N ATOM 0 H HIS A 121 -14.850 30.854 -20.551 1.00 1.00 H new ATOM 0 HA HIS A 121 -14.746 31.992 -22.481 1.00 1.00 H new ATOM 0 HB2 HIS A 121 -11.751 31.368 -22.370 1.00 1.00 H new ATOM 0 HB3 HIS A 121 -12.495 32.657 -23.295 1.00 1.00 H new ATOM 0 HD2 HIS A 121 -11.116 32.095 -19.762 1.00 1.00 H new ATOM 0 HE1 HIS A 121 -13.421 35.624 -19.552 1.00 1.00 H new ATOM 0 HE2 HIS A 121 -11.708 34.198 -18.289 1.00 1.00 H new ATOM 1838 N HIS A 122 -12.849 29.713 -23.942 1.00 1.00 N ATOM 1839 CA HIS A 122 -12.767 28.785 -25.079 1.00 1.00 C ATOM 1840 C HIS A 122 -11.469 27.968 -25.004 1.00 1.00 C ATOM 1841 O HIS A 122 -10.552 28.409 -24.332 1.00 1.00 O ATOM 1842 CB HIS A 122 -12.833 29.577 -26.401 1.00 1.00 C ATOM 1843 CG HIS A 122 -11.702 30.575 -26.460 1.00 1.00 C ATOM 1844 ND1 HIS A 122 -11.306 31.306 -25.351 1.00 1.00 N ATOM 1845 CD2 HIS A 122 -10.869 30.960 -27.480 1.00 1.00 C ATOM 1846 CE1 HIS A 122 -10.275 32.085 -25.726 1.00 1.00 C ATOM 1847 NE2 HIS A 122 -9.968 31.913 -27.015 1.00 1.00 N ATOM 1848 OXT HIS A 122 -11.419 26.916 -25.621 1.00 1.00 O ATOM 0 H HIS A 122 -11.974 29.827 -23.430 1.00 1.00 H new ATOM 0 HA HIS A 122 -13.609 28.094 -25.040 1.00 1.00 H new ATOM 0 HB2 HIS A 122 -12.771 28.894 -27.248 1.00 1.00 H new ATOM 0 HB3 HIS A 122 -13.790 30.094 -26.478 1.00 1.00 H new ATOM 0 HD2 HIS A 122 -10.907 30.581 -28.491 1.00 1.00 H new ATOM 0 HE1 HIS A 122 -9.759 32.766 -25.066 1.00 1.00 H new ATOM 0 HE2 HIS A 122 -9.232 32.380 -27.544 1.00 1.00 H new TER 1857 HIS A 122