USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1016 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 73 ASN : amide:sc= -0.928 K(o=-0.93,f=-2!) USER MOD Set 1.2: A 121 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 28 TYR OH : rot 37:sc= 1.02 USER MOD Set 2.2: A 85 GLN : amide:sc= 0.905 K(o=1.9,f=-0.52) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 70:sc= 0.121 USER MOD Single : A 15 THR OG1 : rot 89:sc= 0.913 USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0.0187 USER MOD Single : A 19 TYR OH : rot 10:sc= 1.16 USER MOD Single : A 20 MET CE :methyl 158:sc= -0.394 (180deg=-1.11) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0.055 USER MOD Single : A 38 LYS NZ :NH3+ 169:sc= 0.282 (180deg=0.189) USER MOD Single : A 41 SER OG : rot -50:sc= -0.393 USER MOD Single : A 43 LYS NZ :NH3+ -167:sc= 1.26 (180deg=1.11) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN :FLIP amide:sc= -0.861 F(o=-3!,f=-0.86) USER MOD Single : A 56 ASN :FLIP amide:sc= -1.05 F(o=-2.7!,f=-1) USER MOD Single : A 59 THR OG1 : rot -67:sc= -0.842 USER MOD Single : A 63 LYS NZ :NH3+ 149:sc= 1.13 (180deg=0.5) USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 71 ASN : amide:sc= -0.932 X(o=-0.93,f=-0.44) USER MOD Single : A 75 LYS NZ :NH3+ -179:sc= 1.16 (180deg=1.12) USER MOD Single : A 76 THR OG1 : rot -1:sc= 1.06 USER MOD Single : A 78 LYS NZ :NH3+ -161:sc= 1.15 (180deg=0.883) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 91 GLN :FLIP amide:sc= -2.6 F(o=-3.1!,f=-2.6) USER MOD Single : A 92 LYS NZ :NH3+ -162:sc= 1.13 (180deg=0.891) USER MOD Single : A 97 GLN : amide:sc= -0.336 K(o=-0.34,f=-8.3!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.0386 USER MOD Single : A 107 LYS NZ :NH3+ -146:sc= 1.25 (180deg=0.541) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 LYS NZ :NH3+ -169:sc= 0.937 (180deg=0.377) USER MOD Single : A 124 SER OG : rot 180:sc= -0.375 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 GLN :FLIP amide:sc= 0 F(o=-0.75,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.548 -23.193 -1.668 1.00 0.00 N ATOM 2 CA GLY A 1 -11.611 -21.759 -1.956 1.00 0.00 C ATOM 3 C GLY A 1 -12.918 -21.381 -2.632 1.00 0.00 C ATOM 4 O GLY A 1 -13.104 -21.658 -3.827 1.00 0.00 O ATOM 0 H1 GLY A 1 -10.643 -23.415 -1.207 1.00 0.00 H new ATOM 0 H2 GLY A 1 -12.332 -23.455 -1.036 1.00 0.00 H new ATOM 0 H3 GLY A 1 -11.625 -23.729 -2.556 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -11.504 -21.196 -1.029 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -10.775 -21.479 -2.597 1.00 0.00 H new ATOM 10 N PRO A 2 -13.864 -20.774 -1.899 1.00 0.00 N ATOM 11 CA PRO A 2 -15.146 -20.377 -2.447 1.00 0.00 C ATOM 12 C PRO A 2 -15.098 -18.986 -3.093 1.00 0.00 C ATOM 13 O PRO A 2 -14.232 -18.157 -2.765 1.00 0.00 O ATOM 14 CB PRO A 2 -16.046 -20.359 -1.208 1.00 0.00 C ATOM 15 CG PRO A 2 -15.142 -19.954 -0.091 1.00 0.00 C ATOM 16 CD PRO A 2 -13.755 -20.424 -0.464 1.00 0.00 C ATOM 0 HA PRO A 2 -15.485 -21.044 -3.240 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -16.869 -19.655 -1.327 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -16.488 -21.338 -1.025 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -15.160 -18.873 0.049 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -15.463 -20.403 0.849 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -13.012 -19.643 -0.300 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -13.452 -21.284 0.134 1.00 0.00 H new ATOM 24 N LEU A 3 -16.027 -18.735 -3.995 1.00 0.00 N ATOM 25 CA LEU A 3 -16.123 -17.450 -4.659 1.00 0.00 C ATOM 26 C LEU A 3 -16.663 -16.431 -3.683 1.00 0.00 C ATOM 27 O LEU A 3 -17.810 -16.537 -3.223 1.00 0.00 O ATOM 28 CB LEU A 3 -17.016 -17.499 -5.926 1.00 0.00 C ATOM 29 CG LEU A 3 -16.495 -18.285 -7.154 1.00 0.00 C ATOM 30 CD1 LEU A 3 -16.423 -19.779 -6.894 1.00 0.00 C ATOM 31 CD2 LEU A 3 -17.359 -17.999 -8.372 1.00 0.00 C ATOM 0 H LEU A 3 -16.732 -19.412 -4.287 1.00 0.00 H new ATOM 0 HA LEU A 3 -15.123 -17.169 -4.990 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -17.978 -17.926 -5.640 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -17.204 -16.473 -6.242 1.00 0.00 H new ATOM 0 HG LEU A 3 -15.478 -17.943 -7.348 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -16.052 -20.286 -7.785 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -15.748 -19.971 -6.060 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -17.417 -20.154 -6.650 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -16.980 -18.559 -9.227 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -18.387 -18.300 -8.168 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -17.331 -16.933 -8.596 1.00 0.00 H new ATOM 43 N GLY A 4 -15.850 -15.483 -3.346 1.00 0.00 N ATOM 44 CA GLY A 4 -16.226 -14.485 -2.395 1.00 0.00 C ATOM 45 C GLY A 4 -15.238 -14.439 -1.271 1.00 0.00 C ATOM 46 O GLY A 4 -15.600 -14.522 -0.094 1.00 0.00 O ATOM 0 H GLY A 4 -14.907 -15.378 -3.721 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.279 -13.511 -2.882 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.221 -14.701 -2.005 1.00 0.00 H new ATOM 50 N SER A 5 -13.992 -14.342 -1.622 1.00 0.00 N ATOM 51 CA SER A 5 -12.941 -14.280 -0.656 1.00 0.00 C ATOM 52 C SER A 5 -12.478 -12.837 -0.525 1.00 0.00 C ATOM 53 O SER A 5 -12.389 -12.123 -1.535 1.00 0.00 O ATOM 54 CB SER A 5 -11.801 -15.196 -1.090 1.00 0.00 C ATOM 55 OG SER A 5 -12.286 -16.532 -1.255 1.00 0.00 O ATOM 0 H SER A 5 -13.675 -14.304 -2.591 1.00 0.00 H new ATOM 0 HA SER A 5 -13.293 -14.620 0.318 1.00 0.00 H new ATOM 0 HB2 SER A 5 -11.371 -14.838 -2.025 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.005 -15.178 -0.346 1.00 0.00 H new ATOM 0 HG SER A 5 -12.874 -16.572 -2.038 1.00 0.00 H new ATOM 61 N PRO A 6 -12.227 -12.364 0.702 1.00 0.00 N ATOM 62 CA PRO A 6 -11.809 -11.000 0.926 1.00 0.00 C ATOM 63 C PRO A 6 -10.367 -10.759 0.483 1.00 0.00 C ATOM 64 O PRO A 6 -9.420 -10.974 1.246 1.00 0.00 O ATOM 65 CB PRO A 6 -11.974 -10.794 2.438 1.00 0.00 C ATOM 66 CG PRO A 6 -11.864 -12.162 3.025 1.00 0.00 C ATOM 67 CD PRO A 6 -12.345 -13.125 1.967 1.00 0.00 C ATOM 0 HA PRO A 6 -12.400 -10.295 0.342 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -11.204 -10.131 2.833 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -12.937 -10.340 2.672 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -10.834 -12.380 3.308 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -12.468 -12.246 3.929 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -11.737 -14.029 1.946 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -13.373 -13.436 2.150 1.00 0.00 H new ATOM 75 N LEU A 7 -10.208 -10.444 -0.780 1.00 0.00 N ATOM 76 CA LEU A 7 -8.917 -10.072 -1.333 1.00 0.00 C ATOM 77 C LEU A 7 -8.867 -8.564 -1.420 1.00 0.00 C ATOM 78 O LEU A 7 -7.805 -7.944 -1.406 1.00 0.00 O ATOM 79 CB LEU A 7 -8.723 -10.699 -2.724 1.00 0.00 C ATOM 80 CG LEU A 7 -8.772 -12.236 -2.785 1.00 0.00 C ATOM 81 CD1 LEU A 7 -8.630 -12.725 -4.217 1.00 0.00 C ATOM 82 CD2 LEU A 7 -7.686 -12.849 -1.911 1.00 0.00 C ATOM 0 H LEU A 7 -10.969 -10.437 -1.459 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.115 -10.440 -0.693 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -9.491 -10.304 -3.389 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -7.761 -10.370 -3.118 1.00 0.00 H new ATOM 0 HG LEU A 7 -9.743 -12.554 -2.404 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -8.668 -13.814 -4.235 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -9.444 -12.324 -4.821 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -7.676 -12.388 -4.624 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -7.741 -13.936 -1.971 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -6.708 -12.516 -2.258 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -7.830 -12.535 -0.877 1.00 0.00 H new ATOM 94 N ILE A 8 -10.043 -7.996 -1.527 1.00 0.00 N ATOM 95 CA ILE A 8 -10.250 -6.585 -1.545 1.00 0.00 C ATOM 96 C ILE A 8 -11.294 -6.253 -0.492 1.00 0.00 C ATOM 97 O ILE A 8 -12.309 -6.958 -0.365 1.00 0.00 O ATOM 98 CB ILE A 8 -10.712 -6.094 -2.955 1.00 0.00 C ATOM 99 CG1 ILE A 8 -9.599 -6.350 -3.977 1.00 0.00 C ATOM 100 CG2 ILE A 8 -11.091 -4.605 -2.935 1.00 0.00 C ATOM 101 CD1 ILE A 8 -9.982 -6.060 -5.412 1.00 0.00 C ATOM 0 H ILE A 8 -10.908 -8.531 -1.606 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.313 -6.074 -1.325 1.00 0.00 H new ATOM 0 HB ILE A 8 -11.602 -6.654 -3.240 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -8.735 -5.739 -3.715 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -9.287 -7.392 -3.901 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -11.407 -4.297 -3.931 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -11.907 -4.447 -2.230 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -10.228 -4.014 -2.629 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -9.134 -6.269 -6.064 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -10.824 -6.690 -5.698 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -10.264 -5.012 -5.509 1.00 0.00 H new ATOM 113 N GLY A 9 -11.021 -5.252 0.291 1.00 0.00 N ATOM 114 CA GLY A 9 -11.931 -4.839 1.304 1.00 0.00 C ATOM 115 C GLY A 9 -11.215 -4.136 2.405 1.00 0.00 C ATOM 116 O GLY A 9 -10.596 -3.111 2.179 1.00 0.00 O ATOM 0 H GLY A 9 -10.162 -4.704 0.242 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -12.685 -4.179 0.875 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.457 -5.707 1.702 1.00 0.00 H new ATOM 120 N GLU A 10 -11.254 -4.704 3.575 1.00 0.00 N ATOM 121 CA GLU A 10 -10.626 -4.119 4.735 1.00 0.00 C ATOM 122 C GLU A 10 -9.602 -5.076 5.282 1.00 0.00 C ATOM 123 O GLU A 10 -9.800 -6.305 5.250 1.00 0.00 O ATOM 124 CB GLU A 10 -11.664 -3.794 5.801 1.00 0.00 C ATOM 125 CG GLU A 10 -12.727 -2.819 5.338 1.00 0.00 C ATOM 126 CD GLU A 10 -13.740 -2.540 6.395 1.00 0.00 C ATOM 127 OE1 GLU A 10 -14.739 -3.278 6.482 1.00 0.00 O ATOM 128 OE2 GLU A 10 -13.554 -1.592 7.166 1.00 0.00 O ATOM 0 H GLU A 10 -11.724 -5.591 3.758 1.00 0.00 H new ATOM 0 HA GLU A 10 -10.137 -3.190 4.444 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.146 -4.718 6.121 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -11.159 -3.380 6.673 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.253 -1.885 5.037 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -13.227 -3.222 4.457 1.00 0.00 H new ATOM 135 N ILE A 11 -8.530 -4.548 5.784 1.00 0.00 N ATOM 136 CA ILE A 11 -7.465 -5.361 6.279 1.00 0.00 C ATOM 137 C ILE A 11 -7.585 -5.527 7.780 1.00 0.00 C ATOM 138 O ILE A 11 -7.540 -4.550 8.536 1.00 0.00 O ATOM 139 CB ILE A 11 -6.089 -4.760 5.983 1.00 0.00 C ATOM 140 CG1 ILE A 11 -5.921 -4.486 4.540 1.00 0.00 C ATOM 141 CG2 ILE A 11 -5.002 -5.711 6.400 1.00 0.00 C ATOM 142 CD1 ILE A 11 -4.619 -3.786 4.218 1.00 0.00 C ATOM 0 H ILE A 11 -8.369 -3.544 5.862 1.00 0.00 H new ATOM 0 HA ILE A 11 -7.549 -6.322 5.771 1.00 0.00 H new ATOM 0 HB ILE A 11 -6.020 -3.828 6.544 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -5.967 -5.426 3.990 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -6.752 -3.872 4.193 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -4.029 -5.269 6.183 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -5.081 -5.908 7.469 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -5.106 -6.646 5.850 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -4.555 -3.613 3.144 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -4.580 -2.831 4.742 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -3.783 -4.409 4.536 1.00 0.00 H new ATOM 154 N GLY A 12 -7.699 -6.740 8.196 1.00 0.00 N ATOM 155 CA GLY A 12 -7.744 -7.049 9.576 1.00 0.00 C ATOM 156 C GLY A 12 -6.566 -7.920 9.915 1.00 0.00 C ATOM 157 O GLY A 12 -5.910 -8.443 8.995 1.00 0.00 O ATOM 0 H GLY A 12 -7.764 -7.550 7.580 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -7.720 -6.135 10.169 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -8.675 -7.562 9.818 1.00 0.00 H new ATOM 161 N PRO A 13 -6.267 -8.131 11.203 1.00 0.00 N ATOM 162 CA PRO A 13 -5.133 -8.975 11.634 1.00 0.00 C ATOM 163 C PRO A 13 -5.263 -10.406 11.113 1.00 0.00 C ATOM 164 O PRO A 13 -4.273 -11.110 10.893 1.00 0.00 O ATOM 165 CB PRO A 13 -5.220 -8.952 13.165 1.00 0.00 C ATOM 166 CG PRO A 13 -6.591 -8.458 13.477 1.00 0.00 C ATOM 167 CD PRO A 13 -6.977 -7.549 12.353 1.00 0.00 C ATOM 0 HA PRO A 13 -4.181 -8.608 11.251 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -5.056 -9.945 13.583 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -4.460 -8.297 13.592 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -7.293 -9.288 13.564 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -6.605 -7.927 14.429 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -8.056 -7.535 12.197 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -6.668 -6.521 12.540 1.00 0.00 H new ATOM 175 N GLU A 14 -6.491 -10.791 10.870 1.00 0.00 N ATOM 176 CA GLU A 14 -6.824 -12.102 10.390 1.00 0.00 C ATOM 177 C GLU A 14 -6.775 -12.178 8.856 1.00 0.00 C ATOM 178 O GLU A 14 -6.803 -13.268 8.294 1.00 0.00 O ATOM 179 CB GLU A 14 -8.221 -12.493 10.890 1.00 0.00 C ATOM 180 CG GLU A 14 -9.335 -11.546 10.447 1.00 0.00 C ATOM 181 CD GLU A 14 -10.697 -11.978 10.923 1.00 0.00 C ATOM 182 OE1 GLU A 14 -11.349 -12.785 10.242 1.00 0.00 O ATOM 183 OE2 GLU A 14 -11.151 -11.502 11.987 1.00 0.00 O ATOM 0 H GLU A 14 -7.301 -10.186 11.004 1.00 0.00 H new ATOM 0 HA GLU A 14 -6.083 -12.801 10.778 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -8.452 -13.498 10.537 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -8.206 -12.533 11.979 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -9.125 -10.545 10.824 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -9.339 -11.483 9.359 1.00 0.00 H new ATOM 190 N THR A 15 -6.691 -11.037 8.174 1.00 0.00 N ATOM 191 CA THR A 15 -6.748 -11.077 6.729 1.00 0.00 C ATOM 192 C THR A 15 -5.381 -10.858 6.112 1.00 0.00 C ATOM 193 O THR A 15 -5.044 -11.495 5.117 1.00 0.00 O ATOM 194 CB THR A 15 -7.770 -10.063 6.124 1.00 0.00 C ATOM 195 OG1 THR A 15 -7.335 -8.716 6.323 1.00 0.00 O ATOM 196 CG2 THR A 15 -9.125 -10.212 6.774 1.00 0.00 C ATOM 0 H THR A 15 -6.587 -10.110 8.587 1.00 0.00 H new ATOM 0 HA THR A 15 -7.098 -12.079 6.480 1.00 0.00 H new ATOM 0 HB THR A 15 -7.839 -10.280 5.058 1.00 0.00 H new ATOM 0 HG1 THR A 15 -6.776 -8.438 5.568 1.00 0.00 H new ATOM 0 HG21 THR A 15 -9.819 -9.495 6.336 1.00 0.00 H new ATOM 0 HG22 THR A 15 -9.497 -11.224 6.612 1.00 0.00 H new ATOM 0 HG23 THR A 15 -9.038 -10.025 7.844 1.00 0.00 H new ATOM 204 N TYR A 16 -4.558 -9.978 6.712 1.00 0.00 N ATOM 205 CA TYR A 16 -3.264 -9.684 6.119 1.00 0.00 C ATOM 206 C TYR A 16 -2.340 -10.877 6.031 1.00 0.00 C ATOM 207 O TYR A 16 -1.517 -10.961 5.124 1.00 0.00 O ATOM 208 CB TYR A 16 -2.576 -8.422 6.655 1.00 0.00 C ATOM 209 CG TYR A 16 -2.235 -8.336 8.139 1.00 0.00 C ATOM 210 CD1 TYR A 16 -1.227 -9.111 8.698 1.00 0.00 C ATOM 211 CD2 TYR A 16 -2.892 -7.438 8.965 1.00 0.00 C ATOM 212 CE1 TYR A 16 -0.898 -8.999 10.037 1.00 0.00 C ATOM 213 CE2 TYR A 16 -2.563 -7.314 10.298 1.00 0.00 C ATOM 214 CZ TYR A 16 -1.569 -8.097 10.829 1.00 0.00 C ATOM 215 OH TYR A 16 -1.241 -7.972 12.161 1.00 0.00 O ATOM 0 H TYR A 16 -4.766 -9.479 7.577 1.00 0.00 H new ATOM 0 HA TYR A 16 -3.514 -9.435 5.088 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -1.649 -8.291 6.097 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -3.215 -7.572 6.415 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -0.691 -9.813 8.077 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -3.679 -6.822 8.556 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -0.118 -9.617 10.458 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -3.085 -6.604 10.922 1.00 0.00 H new ATOM 0 HH TYR A 16 -1.810 -7.290 12.575 1.00 0.00 H new ATOM 225 N SER A 17 -2.533 -11.818 6.924 1.00 0.00 N ATOM 226 CA SER A 17 -1.794 -13.061 6.932 1.00 0.00 C ATOM 227 C SER A 17 -2.015 -13.822 5.605 1.00 0.00 C ATOM 228 O SER A 17 -1.103 -14.453 5.069 1.00 0.00 O ATOM 229 CB SER A 17 -2.303 -13.902 8.093 1.00 0.00 C ATOM 230 OG SER A 17 -2.388 -13.111 9.275 1.00 0.00 O ATOM 0 H SER A 17 -3.217 -11.742 7.677 1.00 0.00 H new ATOM 0 HA SER A 17 -0.728 -12.861 7.041 1.00 0.00 H new ATOM 0 HB2 SER A 17 -3.283 -14.313 7.851 1.00 0.00 H new ATOM 0 HB3 SER A 17 -1.635 -14.747 8.260 1.00 0.00 H new ATOM 0 HG SER A 17 -2.718 -13.663 10.015 1.00 0.00 H new ATOM 236 N ASP A 18 -3.202 -13.672 5.030 1.00 0.00 N ATOM 237 CA ASP A 18 -3.549 -14.412 3.820 1.00 0.00 C ATOM 238 C ASP A 18 -2.883 -13.738 2.644 1.00 0.00 C ATOM 239 O ASP A 18 -2.355 -14.396 1.746 1.00 0.00 O ATOM 240 CB ASP A 18 -5.073 -14.454 3.603 1.00 0.00 C ATOM 241 CG ASP A 18 -5.528 -15.527 2.602 1.00 0.00 C ATOM 242 OD1 ASP A 18 -5.196 -15.459 1.392 1.00 0.00 O ATOM 243 OD2 ASP A 18 -6.217 -16.488 3.028 1.00 0.00 O ATOM 0 H ASP A 18 -3.934 -13.052 5.376 1.00 0.00 H new ATOM 0 HA ASP A 18 -3.203 -15.441 3.921 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -5.562 -14.633 4.561 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -5.408 -13.478 3.252 1.00 0.00 H new ATOM 248 N TYR A 19 -2.788 -12.406 2.713 1.00 0.00 N ATOM 249 CA TYR A 19 -2.224 -11.641 1.626 1.00 0.00 C ATOM 250 C TYR A 19 -0.727 -11.859 1.618 1.00 0.00 C ATOM 251 O TYR A 19 -0.078 -11.888 0.573 1.00 0.00 O ATOM 252 CB TYR A 19 -2.543 -10.149 1.800 1.00 0.00 C ATOM 253 CG TYR A 19 -4.021 -9.835 2.011 1.00 0.00 C ATOM 254 CD1 TYR A 19 -5.009 -10.495 1.296 1.00 0.00 C ATOM 255 CD2 TYR A 19 -4.418 -8.897 2.948 1.00 0.00 C ATOM 256 CE1 TYR A 19 -6.340 -10.223 1.507 1.00 0.00 C ATOM 257 CE2 TYR A 19 -5.748 -8.622 3.171 1.00 0.00 C ATOM 258 CZ TYR A 19 -6.707 -9.292 2.449 1.00 0.00 C ATOM 259 OH TYR A 19 -8.038 -9.023 2.665 1.00 0.00 O ATOM 0 H TYR A 19 -3.096 -11.849 3.510 1.00 0.00 H new ATOM 0 HA TYR A 19 -2.654 -11.968 0.679 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -1.979 -9.767 2.651 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -2.193 -9.611 0.919 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -4.728 -11.235 0.561 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -3.667 -8.369 3.517 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -7.095 -10.740 0.934 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -6.036 -7.886 3.907 1.00 0.00 H new ATOM 0 HH TYR A 19 -8.586 -9.680 2.187 1.00 0.00 H new ATOM 269 N MET A 20 -0.215 -12.104 2.798 1.00 0.00 N ATOM 270 CA MET A 20 1.186 -12.317 3.018 1.00 0.00 C ATOM 271 C MET A 20 1.564 -13.735 2.626 1.00 0.00 C ATOM 272 O MET A 20 2.700 -14.024 2.301 1.00 0.00 O ATOM 273 CB MET A 20 1.487 -12.041 4.483 1.00 0.00 C ATOM 274 CG MET A 20 2.866 -11.484 4.739 1.00 0.00 C ATOM 275 SD MET A 20 3.232 -10.074 3.657 1.00 0.00 S ATOM 276 CE MET A 20 1.692 -9.118 3.719 1.00 0.00 C ATOM 0 H MET A 20 -0.776 -12.161 3.648 1.00 0.00 H new ATOM 0 HA MET A 20 1.779 -11.642 2.401 1.00 0.00 H new ATOM 0 HB2 MET A 20 0.747 -11.339 4.868 1.00 0.00 H new ATOM 0 HB3 MET A 20 1.371 -12.967 5.046 1.00 0.00 H new ATOM 0 HG2 MET A 20 2.945 -11.173 5.781 1.00 0.00 H new ATOM 0 HG3 MET A 20 3.609 -12.266 4.582 1.00 0.00 H new ATOM 0 HE1 MET A 20 1.895 -8.083 3.444 1.00 0.00 H new ATOM 0 HE2 MET A 20 0.971 -9.544 3.021 1.00 0.00 H new ATOM 0 HE3 MET A 20 1.283 -9.152 4.729 1.00 0.00 H new ATOM 286 N SER A 21 0.601 -14.612 2.647 1.00 0.00 N ATOM 287 CA SER A 21 0.821 -15.964 2.220 1.00 0.00 C ATOM 288 C SER A 21 0.480 -16.089 0.709 1.00 0.00 C ATOM 289 O SER A 21 0.783 -17.087 0.069 1.00 0.00 O ATOM 290 CB SER A 21 -0.026 -16.927 3.085 1.00 0.00 C ATOM 291 OG SER A 21 0.321 -18.288 2.866 1.00 0.00 O ATOM 0 H SER A 21 -0.350 -14.413 2.957 1.00 0.00 H new ATOM 0 HA SER A 21 1.868 -16.236 2.351 1.00 0.00 H new ATOM 0 HB2 SER A 21 0.112 -16.683 4.138 1.00 0.00 H new ATOM 0 HB3 SER A 21 -1.083 -16.782 2.860 1.00 0.00 H new ATOM 0 HG SER A 21 -0.236 -18.863 3.432 1.00 0.00 H new ATOM 297 N ALA A 22 -0.131 -15.041 0.141 1.00 0.00 N ATOM 298 CA ALA A 22 -0.519 -15.050 -1.268 1.00 0.00 C ATOM 299 C ALA A 22 0.667 -14.743 -2.174 1.00 0.00 C ATOM 300 O ALA A 22 0.642 -15.034 -3.379 1.00 0.00 O ATOM 301 CB ALA A 22 -1.654 -14.070 -1.516 1.00 0.00 C ATOM 0 H ALA A 22 -0.365 -14.181 0.637 1.00 0.00 H new ATOM 0 HA ALA A 22 -0.869 -16.053 -1.511 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -1.929 -14.091 -2.571 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -2.516 -14.351 -0.911 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -1.332 -13.064 -1.245 1.00 0.00 H new ATOM 307 N GLY A 23 1.685 -14.113 -1.603 1.00 0.00 N ATOM 308 CA GLY A 23 2.910 -13.826 -2.337 1.00 0.00 C ATOM 309 C GLY A 23 2.778 -12.636 -3.264 1.00 0.00 C ATOM 310 O GLY A 23 3.675 -12.352 -4.064 1.00 0.00 O ATOM 0 H GLY A 23 1.687 -13.791 -0.635 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.717 -13.640 -1.628 1.00 0.00 H new ATOM 0 HA3 GLY A 23 3.193 -14.703 -2.919 1.00 0.00 H new ATOM 314 N ILE A 24 1.685 -11.936 -3.149 1.00 0.00 N ATOM 315 CA ILE A 24 1.417 -10.798 -3.989 1.00 0.00 C ATOM 316 C ILE A 24 1.320 -9.529 -3.173 1.00 0.00 C ATOM 317 O ILE A 24 0.921 -9.579 -2.010 1.00 0.00 O ATOM 318 CB ILE A 24 0.147 -10.974 -4.855 1.00 0.00 C ATOM 319 CG1 ILE A 24 -1.026 -11.517 -4.030 1.00 0.00 C ATOM 320 CG2 ILE A 24 0.439 -11.862 -6.052 1.00 0.00 C ATOM 321 CD1 ILE A 24 -2.356 -11.501 -4.751 1.00 0.00 C ATOM 0 H ILE A 24 0.952 -12.137 -2.469 1.00 0.00 H new ATOM 0 HA ILE A 24 2.263 -10.719 -4.671 1.00 0.00 H new ATOM 0 HB ILE A 24 -0.148 -9.992 -5.224 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -0.801 -12.541 -3.730 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -1.115 -10.930 -3.116 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -0.465 -11.975 -6.650 1.00 0.00 H new ATOM 0 HG22 ILE A 24 1.222 -11.408 -6.660 1.00 0.00 H new ATOM 0 HG23 ILE A 24 0.770 -12.841 -5.706 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -3.130 -11.901 -4.096 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -2.608 -10.477 -5.027 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -2.290 -12.113 -5.651 1.00 0.00 H new ATOM 333 N PRO A 25 1.707 -8.383 -3.770 1.00 0.00 N ATOM 334 CA PRO A 25 1.711 -7.073 -3.111 1.00 0.00 C ATOM 335 C PRO A 25 0.384 -6.713 -2.446 1.00 0.00 C ATOM 336 O PRO A 25 -0.700 -6.912 -2.996 1.00 0.00 O ATOM 337 CB PRO A 25 2.032 -6.083 -4.239 1.00 0.00 C ATOM 338 CG PRO A 25 1.883 -6.860 -5.503 1.00 0.00 C ATOM 339 CD PRO A 25 2.180 -8.274 -5.157 1.00 0.00 C ATOM 0 HA PRO A 25 2.433 -7.059 -2.295 1.00 0.00 H new ATOM 0 HB2 PRO A 25 1.352 -5.231 -4.219 1.00 0.00 H new ATOM 0 HB3 PRO A 25 3.042 -5.687 -4.138 1.00 0.00 H new ATOM 0 HG2 PRO A 25 0.874 -6.761 -5.904 1.00 0.00 H new ATOM 0 HG3 PRO A 25 2.568 -6.494 -6.268 1.00 0.00 H new ATOM 0 HD2 PRO A 25 1.659 -8.968 -5.816 1.00 0.00 H new ATOM 0 HD3 PRO A 25 3.244 -8.494 -5.239 1.00 0.00 H new ATOM 347 N LEU A 26 0.481 -6.196 -1.269 1.00 0.00 N ATOM 348 CA LEU A 26 -0.649 -5.825 -0.494 1.00 0.00 C ATOM 349 C LEU A 26 -0.736 -4.310 -0.510 1.00 0.00 C ATOM 350 O LEU A 26 0.221 -3.627 -0.179 1.00 0.00 O ATOM 351 CB LEU A 26 -0.435 -6.310 0.937 1.00 0.00 C ATOM 352 CG LEU A 26 -1.671 -6.544 1.836 1.00 0.00 C ATOM 353 CD1 LEU A 26 -1.242 -7.033 3.201 1.00 0.00 C ATOM 354 CD2 LEU A 26 -2.523 -5.308 1.986 1.00 0.00 C ATOM 0 H LEU A 26 1.373 -6.016 -0.809 1.00 0.00 H new ATOM 0 HA LEU A 26 -1.565 -6.262 -0.891 1.00 0.00 H new ATOM 0 HB2 LEU A 26 0.120 -7.247 0.889 1.00 0.00 H new ATOM 0 HB3 LEU A 26 0.206 -5.585 1.439 1.00 0.00 H new ATOM 0 HG LEU A 26 -2.279 -7.303 1.343 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -2.122 -7.193 3.823 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.696 -7.970 3.097 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.598 -6.288 3.669 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.376 -5.530 2.627 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.931 -4.510 2.434 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -2.878 -4.990 1.006 1.00 0.00 H new ATOM 366 N ALA A 27 -1.848 -3.815 -0.895 1.00 0.00 N ATOM 367 CA ALA A 27 -2.091 -2.409 -0.920 1.00 0.00 C ATOM 368 C ALA A 27 -2.861 -2.001 0.319 1.00 0.00 C ATOM 369 O ALA A 27 -4.037 -2.343 0.483 1.00 0.00 O ATOM 370 CB ALA A 27 -2.848 -2.030 -2.168 1.00 0.00 C ATOM 0 H ALA A 27 -2.637 -4.379 -1.210 1.00 0.00 H new ATOM 0 HA ALA A 27 -1.137 -1.882 -0.929 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -3.026 -0.955 -2.173 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -2.263 -2.305 -3.046 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -3.803 -2.556 -2.188 1.00 0.00 H new ATOM 376 N TYR A 28 -2.184 -1.309 1.184 1.00 0.00 N ATOM 377 CA TYR A 28 -2.727 -0.822 2.420 1.00 0.00 C ATOM 378 C TYR A 28 -3.311 0.505 2.188 1.00 0.00 C ATOM 379 O TYR A 28 -2.610 1.443 1.817 1.00 0.00 O ATOM 380 CB TYR A 28 -1.647 -0.649 3.467 1.00 0.00 C ATOM 381 CG TYR A 28 -1.070 -1.909 4.041 1.00 0.00 C ATOM 382 CD1 TYR A 28 -0.160 -2.664 3.329 1.00 0.00 C ATOM 383 CD2 TYR A 28 -1.425 -2.335 5.312 1.00 0.00 C ATOM 384 CE1 TYR A 28 0.382 -3.806 3.859 1.00 0.00 C ATOM 385 CE2 TYR A 28 -0.876 -3.481 5.858 1.00 0.00 C ATOM 386 CZ TYR A 28 0.028 -4.213 5.119 1.00 0.00 C ATOM 387 OH TYR A 28 0.596 -5.354 5.642 1.00 0.00 O ATOM 0 H TYR A 28 -1.205 -1.058 1.046 1.00 0.00 H new ATOM 0 HA TYR A 28 -3.465 -1.544 2.769 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -0.835 -0.070 3.028 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -2.056 -0.056 4.285 1.00 0.00 H new ATOM 0 HD1 TYR A 28 0.130 -2.350 2.337 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -2.141 -1.763 5.884 1.00 0.00 H new ATOM 0 HE1 TYR A 28 1.089 -4.386 3.283 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -1.153 -3.799 6.852 1.00 0.00 H new ATOM 0 HH TYR A 28 1.533 -5.412 5.361 1.00 0.00 H new ATOM 397 N ILE A 29 -4.545 0.609 2.389 1.00 0.00 N ATOM 398 CA ILE A 29 -5.191 1.840 2.207 1.00 0.00 C ATOM 399 C ILE A 29 -5.535 2.412 3.551 1.00 0.00 C ATOM 400 O ILE A 29 -6.619 2.175 4.088 1.00 0.00 O ATOM 401 CB ILE A 29 -6.456 1.684 1.381 1.00 0.00 C ATOM 402 CG1 ILE A 29 -6.142 0.883 0.112 1.00 0.00 C ATOM 403 CG2 ILE A 29 -6.998 3.069 1.044 1.00 0.00 C ATOM 404 CD1 ILE A 29 -7.277 -0.001 -0.351 1.00 0.00 C ATOM 0 H ILE A 29 -5.150 -0.156 2.687 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.520 2.509 1.669 1.00 0.00 H new ATOM 0 HB ILE A 29 -7.215 1.140 1.943 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -5.884 1.576 -0.689 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -5.263 0.264 0.293 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -7.907 2.970 0.451 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -7.223 3.606 1.966 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -6.252 3.623 0.475 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -6.978 -0.535 -1.253 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -7.521 -0.720 0.431 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -8.152 0.613 -0.566 1.00 0.00 H new ATOM 416 N PHE A 30 -4.589 3.077 4.132 1.00 0.00 N ATOM 417 CA PHE A 30 -4.805 3.746 5.374 1.00 0.00 C ATOM 418 C PHE A 30 -5.583 4.967 5.093 1.00 0.00 C ATOM 419 O PHE A 30 -5.295 5.644 4.150 1.00 0.00 O ATOM 420 CB PHE A 30 -3.492 4.156 6.005 1.00 0.00 C ATOM 421 CG PHE A 30 -2.704 3.058 6.640 1.00 0.00 C ATOM 422 CD1 PHE A 30 -2.044 2.104 5.888 1.00 0.00 C ATOM 423 CD2 PHE A 30 -2.661 2.964 8.005 1.00 0.00 C ATOM 424 CE1 PHE A 30 -1.357 1.080 6.503 1.00 0.00 C ATOM 425 CE2 PHE A 30 -2.000 1.956 8.624 1.00 0.00 C ATOM 426 CZ PHE A 30 -1.341 1.001 7.872 1.00 0.00 C ATOM 0 H PHE A 30 -3.644 3.172 3.759 1.00 0.00 H new ATOM 0 HA PHE A 30 -5.327 3.077 6.058 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -2.874 4.625 5.240 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -3.695 4.915 6.760 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -2.067 2.162 4.810 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -3.165 3.710 8.602 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -0.834 0.344 5.910 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -1.988 1.899 9.702 1.00 0.00 H new ATOM 0 HZ PHE A 30 -0.815 0.195 8.362 1.00 0.00 H new ATOM 436 N ALA A 31 -6.568 5.224 5.864 1.00 0.00 N ATOM 437 CA ALA A 31 -7.348 6.450 5.702 1.00 0.00 C ATOM 438 C ALA A 31 -7.909 6.925 7.012 1.00 0.00 C ATOM 439 O ALA A 31 -8.598 6.182 7.691 1.00 0.00 O ATOM 440 CB ALA A 31 -8.461 6.325 4.624 1.00 0.00 C ATOM 0 H ALA A 31 -6.877 4.618 6.624 1.00 0.00 H new ATOM 0 HA ALA A 31 -6.651 7.206 5.339 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -9.004 7.267 4.551 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.009 6.091 3.660 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -9.151 5.529 4.904 1.00 0.00 H new ATOM 446 N GLU A 32 -7.533 8.140 7.412 1.00 0.00 N ATOM 447 CA GLU A 32 -8.127 8.762 8.603 1.00 0.00 C ATOM 448 C GLU A 32 -9.525 9.170 8.301 1.00 0.00 C ATOM 449 O GLU A 32 -10.395 9.194 9.174 1.00 0.00 O ATOM 450 CB GLU A 32 -7.413 10.047 9.026 1.00 0.00 C ATOM 451 CG GLU A 32 -6.153 9.908 9.827 1.00 0.00 C ATOM 452 CD GLU A 32 -5.714 11.254 10.356 1.00 0.00 C ATOM 453 OE1 GLU A 32 -6.457 11.875 11.157 1.00 0.00 O ATOM 454 OE2 GLU A 32 -4.634 11.723 9.997 1.00 0.00 O ATOM 0 H GLU A 32 -6.831 8.709 6.939 1.00 0.00 H new ATOM 0 HA GLU A 32 -8.053 8.018 9.396 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -7.178 10.613 8.125 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -8.115 10.647 9.605 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -6.316 9.220 10.656 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -5.366 9.479 9.207 1.00 0.00 H new ATOM 461 N THR A 33 -9.740 9.459 7.066 1.00 0.00 N ATOM 462 CA THR A 33 -10.949 10.053 6.652 1.00 0.00 C ATOM 463 C THR A 33 -11.984 9.019 6.305 1.00 0.00 C ATOM 464 O THR A 33 -11.915 8.393 5.277 1.00 0.00 O ATOM 465 CB THR A 33 -10.667 11.027 5.512 1.00 0.00 C ATOM 466 OG1 THR A 33 -9.652 10.467 4.641 1.00 0.00 O ATOM 467 CG2 THR A 33 -10.184 12.360 6.072 1.00 0.00 C ATOM 0 H THR A 33 -9.073 9.286 6.314 1.00 0.00 H new ATOM 0 HA THR A 33 -11.377 10.621 7.478 1.00 0.00 H new ATOM 0 HB THR A 33 -11.584 11.192 4.946 1.00 0.00 H new ATOM 0 HG1 THR A 33 -9.471 11.090 3.907 1.00 0.00 H new ATOM 0 HG21 THR A 33 -9.985 13.049 5.251 1.00 0.00 H new ATOM 0 HG22 THR A 33 -10.951 12.781 6.721 1.00 0.00 H new ATOM 0 HG23 THR A 33 -9.270 12.204 6.644 1.00 0.00 H new ATOM 475 N ALA A 34 -12.928 8.841 7.203 1.00 0.00 N ATOM 476 CA ALA A 34 -13.962 7.839 7.087 1.00 0.00 C ATOM 477 C ALA A 34 -15.058 8.304 6.154 1.00 0.00 C ATOM 478 O ALA A 34 -15.746 7.483 5.518 1.00 0.00 O ATOM 479 CB ALA A 34 -14.534 7.519 8.463 1.00 0.00 C ATOM 0 H ALA A 34 -12.999 9.402 8.052 1.00 0.00 H new ATOM 0 HA ALA A 34 -13.523 6.934 6.668 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -15.313 6.763 8.366 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -13.740 7.142 9.108 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -14.958 8.423 8.900 1.00 0.00 H new ATOM 485 N GLU A 35 -15.192 9.615 6.030 1.00 0.00 N ATOM 486 CA GLU A 35 -16.229 10.193 5.205 1.00 0.00 C ATOM 487 C GLU A 35 -15.926 9.911 3.756 1.00 0.00 C ATOM 488 O GLU A 35 -16.649 9.160 3.089 1.00 0.00 O ATOM 489 CB GLU A 35 -16.365 11.698 5.442 1.00 0.00 C ATOM 490 CG GLU A 35 -16.844 12.093 6.834 1.00 0.00 C ATOM 491 CD GLU A 35 -18.169 11.471 7.209 1.00 0.00 C ATOM 492 OE1 GLU A 35 -19.157 11.649 6.469 1.00 0.00 O ATOM 493 OE2 GLU A 35 -18.245 10.810 8.267 1.00 0.00 O ATOM 0 H GLU A 35 -14.591 10.297 6.494 1.00 0.00 H new ATOM 0 HA GLU A 35 -17.181 9.737 5.476 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -15.398 12.167 5.261 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -17.060 12.105 4.707 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -16.092 11.799 7.566 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -16.932 13.178 6.886 1.00 0.00 H new ATOM 500 N GLU A 36 -14.815 10.424 3.292 1.00 0.00 N ATOM 501 CA GLU A 36 -14.420 10.207 1.935 1.00 0.00 C ATOM 502 C GLU A 36 -13.704 8.879 1.737 1.00 0.00 C ATOM 503 O GLU A 36 -13.286 8.582 0.642 1.00 0.00 O ATOM 504 CB GLU A 36 -13.604 11.366 1.329 1.00 0.00 C ATOM 505 CG GLU A 36 -12.392 11.809 2.132 1.00 0.00 C ATOM 506 CD GLU A 36 -12.754 12.750 3.247 1.00 0.00 C ATOM 507 OE1 GLU A 36 -13.164 12.294 4.329 1.00 0.00 O ATOM 508 OE2 GLU A 36 -12.659 13.980 3.041 1.00 0.00 O ATOM 0 H GLU A 36 -14.171 10.995 3.840 1.00 0.00 H new ATOM 0 HA GLU A 36 -15.359 10.167 1.383 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -13.270 11.070 0.335 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -14.265 12.223 1.201 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -11.895 10.932 2.547 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -11.678 12.295 1.468 1.00 0.00 H new ATOM 515 N ARG A 37 -13.602 8.052 2.794 1.00 0.00 N ATOM 516 CA ARG A 37 -12.977 6.711 2.682 1.00 0.00 C ATOM 517 C ARG A 37 -13.777 5.915 1.677 1.00 0.00 C ATOM 518 O ARG A 37 -13.234 5.132 0.908 1.00 0.00 O ATOM 519 CB ARG A 37 -12.972 5.989 4.055 1.00 0.00 C ATOM 520 CG ARG A 37 -11.965 4.829 4.220 1.00 0.00 C ATOM 521 CD ARG A 37 -12.344 3.570 3.464 1.00 0.00 C ATOM 522 NE ARG A 37 -13.591 2.989 3.957 1.00 0.00 N ATOM 523 CZ ARG A 37 -14.198 1.918 3.439 1.00 0.00 C ATOM 524 NH1 ARG A 37 -13.742 1.353 2.320 1.00 0.00 N ATOM 525 NH2 ARG A 37 -15.283 1.443 4.024 1.00 0.00 N ATOM 0 H ARG A 37 -13.939 8.281 3.729 1.00 0.00 H new ATOM 0 HA ARG A 37 -11.941 6.808 2.359 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -12.770 6.729 4.829 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -13.973 5.600 4.240 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -10.984 5.162 3.881 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -11.872 4.590 5.279 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -12.446 3.801 2.404 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -11.542 2.837 3.555 1.00 0.00 H new ATOM 0 HE ARG A 37 -14.033 3.437 4.760 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -12.922 1.739 1.851 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -14.213 0.535 1.933 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -15.649 1.894 4.863 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -15.755 0.626 3.637 1.00 0.00 H new ATOM 539 N LYS A 38 -15.058 6.197 1.658 1.00 0.00 N ATOM 540 CA LYS A 38 -15.994 5.559 0.771 1.00 0.00 C ATOM 541 C LYS A 38 -15.609 5.831 -0.690 1.00 0.00 C ATOM 542 O LYS A 38 -15.464 4.902 -1.479 1.00 0.00 O ATOM 543 CB LYS A 38 -17.403 6.070 1.073 1.00 0.00 C ATOM 544 CG LYS A 38 -17.793 5.918 2.541 1.00 0.00 C ATOM 545 CD LYS A 38 -19.185 6.459 2.810 1.00 0.00 C ATOM 546 CE LYS A 38 -19.540 6.388 4.292 1.00 0.00 C ATOM 547 NZ LYS A 38 -18.661 7.245 5.126 1.00 0.00 N ATOM 0 H LYS A 38 -15.485 6.891 2.272 1.00 0.00 H new ATOM 0 HA LYS A 38 -15.971 4.480 0.926 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -17.470 7.121 0.792 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -18.120 5.529 0.455 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -17.751 4.866 2.822 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -17.071 6.444 3.166 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -19.246 7.493 2.470 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -19.914 5.890 2.233 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -20.577 6.694 4.429 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -19.464 5.355 4.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -19.051 7.311 6.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -17.708 6.830 5.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -18.606 8.196 4.709 1.00 0.00 H new ATOM 561 N GLU A 39 -15.359 7.099 -1.029 1.00 0.00 N ATOM 562 CA GLU A 39 -14.994 7.430 -2.393 1.00 0.00 C ATOM 563 C GLU A 39 -13.506 7.179 -2.649 1.00 0.00 C ATOM 564 O GLU A 39 -13.084 6.985 -3.795 1.00 0.00 O ATOM 565 CB GLU A 39 -15.390 8.844 -2.791 1.00 0.00 C ATOM 566 CG GLU A 39 -14.667 9.939 -2.057 1.00 0.00 C ATOM 567 CD GLU A 39 -15.055 11.281 -2.572 1.00 0.00 C ATOM 568 OE1 GLU A 39 -14.681 11.625 -3.721 1.00 0.00 O ATOM 569 OE2 GLU A 39 -15.769 12.014 -1.862 1.00 0.00 O ATOM 0 H GLU A 39 -15.403 7.891 -0.388 1.00 0.00 H new ATOM 0 HA GLU A 39 -15.569 6.759 -3.032 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -15.214 8.967 -3.860 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -16.461 8.964 -2.628 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -14.892 9.876 -0.992 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -13.591 9.803 -2.164 1.00 0.00 H new ATOM 576 N LEU A 40 -12.720 7.167 -1.574 1.00 0.00 N ATOM 577 CA LEU A 40 -11.319 6.857 -1.639 1.00 0.00 C ATOM 578 C LEU A 40 -11.240 5.407 -2.176 1.00 0.00 C ATOM 579 O LEU A 40 -10.666 5.129 -3.248 1.00 0.00 O ATOM 580 CB LEU A 40 -10.748 7.005 -0.175 1.00 0.00 C ATOM 581 CG LEU A 40 -9.280 7.429 0.028 1.00 0.00 C ATOM 582 CD1 LEU A 40 -8.335 6.351 -0.453 1.00 0.00 C ATOM 583 CD2 LEU A 40 -9.032 8.728 -0.719 1.00 0.00 C ATOM 0 H LEU A 40 -13.053 7.376 -0.633 1.00 0.00 H new ATOM 0 HA LEU A 40 -10.735 7.508 -2.289 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -11.372 7.730 0.347 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -10.884 6.047 0.327 1.00 0.00 H new ATOM 0 HG LEU A 40 -9.095 7.579 1.092 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -7.306 6.674 -0.299 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.515 5.433 0.107 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -8.503 6.167 -1.514 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.995 9.035 -0.581 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -9.228 8.580 -1.781 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -9.695 9.502 -0.332 1.00 0.00 H new ATOM 595 N SER A 41 -11.972 4.523 -1.513 1.00 0.00 N ATOM 596 CA SER A 41 -12.029 3.136 -1.898 1.00 0.00 C ATOM 597 C SER A 41 -12.822 2.943 -3.196 1.00 0.00 C ATOM 598 O SER A 41 -12.655 1.960 -3.878 1.00 0.00 O ATOM 599 CB SER A 41 -12.622 2.319 -0.777 1.00 0.00 C ATOM 600 OG SER A 41 -11.895 2.536 0.423 1.00 0.00 O ATOM 0 H SER A 41 -12.538 4.754 -0.697 1.00 0.00 H new ATOM 0 HA SER A 41 -11.013 2.791 -2.089 1.00 0.00 H new ATOM 0 HB2 SER A 41 -13.667 2.591 -0.632 1.00 0.00 H new ATOM 0 HB3 SER A 41 -12.601 1.261 -1.038 1.00 0.00 H new ATOM 0 HG SER A 41 -10.937 2.423 0.250 1.00 0.00 H new ATOM 606 N ASP A 42 -13.653 3.905 -3.522 1.00 0.00 N ATOM 607 CA ASP A 42 -14.450 3.906 -4.756 1.00 0.00 C ATOM 608 C ASP A 42 -13.578 3.917 -5.959 1.00 0.00 C ATOM 609 O ASP A 42 -13.848 3.225 -6.924 1.00 0.00 O ATOM 610 CB ASP A 42 -15.302 5.123 -4.776 1.00 0.00 C ATOM 611 CG ASP A 42 -16.170 5.291 -6.006 1.00 0.00 C ATOM 612 OD1 ASP A 42 -17.267 4.718 -6.053 1.00 0.00 O ATOM 613 OD2 ASP A 42 -15.796 6.056 -6.920 1.00 0.00 O ATOM 0 H ASP A 42 -13.807 4.727 -2.938 1.00 0.00 H new ATOM 0 HA ASP A 42 -15.059 3.002 -4.775 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -15.946 5.109 -3.897 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -14.658 5.998 -4.685 1.00 0.00 H new ATOM 618 N LYS A 43 -12.527 4.707 -5.897 1.00 0.00 N ATOM 619 CA LYS A 43 -11.577 4.797 -7.000 1.00 0.00 C ATOM 620 C LYS A 43 -10.688 3.591 -6.965 1.00 0.00 C ATOM 621 O LYS A 43 -10.191 3.079 -8.015 1.00 0.00 O ATOM 622 CB LYS A 43 -10.713 6.040 -6.869 1.00 0.00 C ATOM 623 CG LYS A 43 -11.471 7.309 -6.558 1.00 0.00 C ATOM 624 CD LYS A 43 -12.691 7.462 -7.453 1.00 0.00 C ATOM 625 CE LYS A 43 -13.598 8.566 -6.978 1.00 0.00 C ATOM 626 NZ LYS A 43 -14.892 8.512 -7.667 1.00 0.00 N ATOM 0 H LYS A 43 -12.304 5.299 -5.097 1.00 0.00 H new ATOM 0 HA LYS A 43 -12.130 4.849 -7.938 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -9.976 5.872 -6.084 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -10.161 6.182 -7.798 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -11.783 7.301 -5.514 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -10.813 8.168 -6.688 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -12.369 7.670 -8.474 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -13.244 6.523 -7.478 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -13.750 8.480 -5.902 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -13.126 9.532 -7.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -15.414 9.395 -7.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -14.737 8.396 -8.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -15.444 7.707 -7.307 1.00 0.00 H new ATOM 640 N LEU A 44 -10.506 3.103 -5.764 1.00 0.00 N ATOM 641 CA LEU A 44 -9.698 1.974 -5.544 1.00 0.00 C ATOM 642 C LEU A 44 -10.345 0.702 -6.066 1.00 0.00 C ATOM 643 O LEU A 44 -9.667 -0.236 -6.387 1.00 0.00 O ATOM 644 CB LEU A 44 -9.418 1.877 -4.096 1.00 0.00 C ATOM 645 CG LEU A 44 -8.613 3.029 -3.497 1.00 0.00 C ATOM 646 CD1 LEU A 44 -8.311 2.767 -2.058 1.00 0.00 C ATOM 647 CD2 LEU A 44 -7.328 3.288 -4.272 1.00 0.00 C ATOM 0 H LEU A 44 -10.925 3.494 -4.920 1.00 0.00 H new ATOM 0 HA LEU A 44 -8.765 2.088 -6.096 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -10.367 1.807 -3.565 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -8.880 0.947 -3.910 1.00 0.00 H new ATOM 0 HG LEU A 44 -9.227 3.927 -3.571 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -7.737 3.599 -1.649 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -9.244 2.663 -1.504 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.731 1.848 -1.969 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -6.786 4.115 -3.812 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -6.706 2.393 -4.255 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -7.570 3.542 -5.304 1.00 0.00 H new ATOM 659 N LYS A 45 -11.648 0.712 -6.181 1.00 0.00 N ATOM 660 CA LYS A 45 -12.390 -0.427 -6.674 1.00 0.00 C ATOM 661 C LYS A 45 -12.033 -0.770 -8.148 1.00 0.00 C ATOM 662 O LYS A 45 -11.676 -1.900 -8.426 1.00 0.00 O ATOM 663 CB LYS A 45 -13.906 -0.233 -6.465 1.00 0.00 C ATOM 664 CG LYS A 45 -14.374 -0.361 -5.019 1.00 0.00 C ATOM 665 CD LYS A 45 -15.818 0.122 -4.834 1.00 0.00 C ATOM 666 CE LYS A 45 -16.799 -0.607 -5.737 1.00 0.00 C ATOM 667 NZ LYS A 45 -18.195 -0.143 -5.542 1.00 0.00 N ATOM 0 H LYS A 45 -12.230 1.513 -5.935 1.00 0.00 H new ATOM 0 HA LYS A 45 -12.090 -1.293 -6.084 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -14.187 0.752 -6.837 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -14.439 -0.966 -7.071 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -14.297 -1.402 -4.705 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -13.714 0.217 -4.372 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -16.114 -0.019 -3.794 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -15.868 1.192 -5.038 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -16.511 -0.458 -6.778 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -16.744 -1.678 -5.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -18.828 -0.668 -6.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -18.481 -0.308 -4.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -18.256 0.873 -5.755 1.00 0.00 H new ATOM 681 N PRO A 46 -12.106 0.192 -9.109 1.00 0.00 N ATOM 682 CA PRO A 46 -11.758 -0.049 -10.515 1.00 0.00 C ATOM 683 C PRO A 46 -10.293 -0.308 -10.689 1.00 0.00 C ATOM 684 O PRO A 46 -9.899 -1.280 -11.392 1.00 0.00 O ATOM 685 CB PRO A 46 -12.099 1.279 -11.149 1.00 0.00 C ATOM 686 CG PRO A 46 -13.135 1.766 -10.305 1.00 0.00 C ATOM 687 CD PRO A 46 -12.574 1.563 -8.972 1.00 0.00 C ATOM 0 HA PRO A 46 -12.271 -0.915 -10.934 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.241 1.952 -11.168 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -12.436 1.162 -12.179 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -13.356 2.816 -10.497 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -14.065 1.214 -10.443 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -11.766 2.260 -8.748 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -13.319 1.674 -8.184 1.00 0.00 H new ATOM 695 N ILE A 47 -9.443 0.519 -10.030 1.00 0.00 N ATOM 696 CA ILE A 47 -8.025 0.294 -10.184 1.00 0.00 C ATOM 697 C ILE A 47 -7.668 -1.085 -9.670 1.00 0.00 C ATOM 698 O ILE A 47 -6.867 -1.762 -10.258 1.00 0.00 O ATOM 699 CB ILE A 47 -7.102 1.409 -9.568 1.00 0.00 C ATOM 700 CG1 ILE A 47 -5.613 1.078 -9.774 1.00 0.00 C ATOM 701 CG2 ILE A 47 -7.378 1.623 -8.101 1.00 0.00 C ATOM 702 CD1 ILE A 47 -5.198 0.909 -11.225 1.00 0.00 C ATOM 0 H ILE A 47 -9.713 1.296 -9.427 1.00 0.00 H new ATOM 0 HA ILE A 47 -7.821 0.353 -11.253 1.00 0.00 H new ATOM 0 HB ILE A 47 -7.336 2.333 -10.097 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -5.013 1.871 -9.328 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -5.380 0.160 -9.234 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -6.719 2.401 -7.716 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -8.416 1.928 -7.967 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -7.199 0.695 -7.558 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.134 0.678 -11.275 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -5.767 0.095 -11.674 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -5.394 1.833 -11.770 1.00 0.00 H new ATOM 714 N ALA A 48 -8.406 -1.559 -8.685 1.00 0.00 N ATOM 715 CA ALA A 48 -8.079 -2.856 -8.106 1.00 0.00 C ATOM 716 C ALA A 48 -8.772 -3.951 -8.839 1.00 0.00 C ATOM 717 O ALA A 48 -8.390 -5.065 -8.743 1.00 0.00 O ATOM 718 CB ALA A 48 -8.405 -2.929 -6.645 1.00 0.00 C ATOM 0 H ALA A 48 -9.212 -1.087 -8.276 1.00 0.00 H new ATOM 0 HA ALA A 48 -7.001 -2.982 -8.207 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -8.142 -3.915 -6.262 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -7.839 -2.169 -6.107 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.472 -2.756 -6.501 1.00 0.00 H new ATOM 724 N GLU A 49 -9.795 -3.624 -9.573 1.00 0.00 N ATOM 725 CA GLU A 49 -10.473 -4.568 -10.399 1.00 0.00 C ATOM 726 C GLU A 49 -9.508 -4.962 -11.530 1.00 0.00 C ATOM 727 O GLU A 49 -9.566 -6.061 -12.070 1.00 0.00 O ATOM 728 CB GLU A 49 -11.698 -3.876 -10.957 1.00 0.00 C ATOM 729 CG GLU A 49 -12.924 -4.733 -11.078 1.00 0.00 C ATOM 730 CD GLU A 49 -12.781 -5.885 -12.036 1.00 0.00 C ATOM 731 OE1 GLU A 49 -12.837 -5.661 -13.282 1.00 0.00 O ATOM 732 OE2 GLU A 49 -12.648 -7.024 -11.581 1.00 0.00 O ATOM 0 H GLU A 49 -10.183 -2.682 -9.612 1.00 0.00 H new ATOM 0 HA GLU A 49 -10.777 -5.462 -9.855 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -11.933 -3.023 -10.321 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -11.453 -3.481 -11.943 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -13.179 -5.124 -10.093 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -13.759 -4.110 -11.399 1.00 0.00 H new ATOM 739 N ALA A 50 -8.575 -4.063 -11.818 1.00 0.00 N ATOM 740 CA ALA A 50 -7.577 -4.275 -12.854 1.00 0.00 C ATOM 741 C ALA A 50 -6.457 -5.177 -12.343 1.00 0.00 C ATOM 742 O ALA A 50 -5.726 -5.806 -13.111 1.00 0.00 O ATOM 743 CB ALA A 50 -6.990 -2.938 -13.235 1.00 0.00 C ATOM 0 H ALA A 50 -8.491 -3.167 -11.339 1.00 0.00 H new ATOM 0 HA ALA A 50 -8.049 -4.751 -13.713 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.239 -3.079 -14.012 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -7.780 -2.287 -13.608 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -6.526 -2.482 -12.360 1.00 0.00 H new ATOM 749 N GLN A 51 -6.360 -5.264 -11.048 1.00 0.00 N ATOM 750 CA GLN A 51 -5.267 -5.920 -10.385 1.00 0.00 C ATOM 751 C GLN A 51 -5.756 -6.716 -9.193 1.00 0.00 C ATOM 752 O GLN A 51 -5.045 -6.947 -8.228 1.00 0.00 O ATOM 753 CB GLN A 51 -4.261 -4.854 -10.027 1.00 0.00 C ATOM 754 CG GLN A 51 -4.822 -3.619 -9.421 1.00 0.00 C ATOM 755 CD GLN A 51 -3.787 -2.550 -9.242 1.00 0.00 C ATOM 756 OE1 GLN A 51 -2.838 -2.495 -10.135 1.00 0.00 O flip ATOM 757 NE2 GLN A 51 -3.853 -1.751 -8.335 1.00 0.00 N flip ATOM 0 H GLN A 51 -7.052 -4.873 -10.409 1.00 0.00 H new ATOM 0 HA GLN A 51 -4.787 -6.654 -11.033 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -3.537 -5.281 -9.333 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -3.714 -4.579 -10.929 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -5.626 -3.241 -10.052 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -5.263 -3.860 -8.454 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -4.606 -1.818 -7.650 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -3.155 -1.011 -8.255 1.00 0.00 H new ATOM 766 N ARG A 52 -6.930 -7.258 -9.384 1.00 0.00 N ATOM 767 CA ARG A 52 -7.715 -7.957 -8.380 1.00 0.00 C ATOM 768 C ARG A 52 -7.095 -9.289 -7.984 1.00 0.00 C ATOM 769 O ARG A 52 -7.437 -9.864 -6.948 1.00 0.00 O ATOM 770 CB ARG A 52 -9.116 -8.176 -8.951 1.00 0.00 C ATOM 771 CG ARG A 52 -9.140 -9.107 -10.151 1.00 0.00 C ATOM 772 CD ARG A 52 -10.515 -9.231 -10.744 1.00 0.00 C ATOM 773 NE ARG A 52 -10.513 -10.164 -11.865 1.00 0.00 N ATOM 774 CZ ARG A 52 -11.284 -10.089 -12.949 1.00 0.00 C ATOM 775 NH1 ARG A 52 -12.154 -9.097 -13.102 1.00 0.00 N ATOM 776 NH2 ARG A 52 -11.165 -11.010 -13.889 1.00 0.00 N ATOM 0 H ARG A 52 -7.396 -7.226 -10.291 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.750 -7.351 -7.474 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.758 -8.584 -8.171 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -9.537 -7.213 -9.239 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -8.451 -8.737 -10.910 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -8.785 -10.093 -9.851 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -11.215 -9.573 -9.982 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -10.861 -8.253 -11.079 1.00 0.00 H new ATOM 0 HE ARG A 52 -9.861 -10.947 -11.814 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -12.239 -8.378 -12.384 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -12.737 -9.054 -13.938 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -10.489 -11.766 -13.779 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -11.749 -10.965 -14.724 1.00 0.00 H new ATOM 790 N GLY A 53 -6.232 -9.783 -8.825 1.00 0.00 N ATOM 791 CA GLY A 53 -5.574 -11.021 -8.557 1.00 0.00 C ATOM 792 C GLY A 53 -4.085 -10.847 -8.475 1.00 0.00 C ATOM 793 O GLY A 53 -3.340 -11.820 -8.538 1.00 0.00 O ATOM 0 H GLY A 53 -5.969 -9.341 -9.706 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -5.945 -11.436 -7.620 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -5.815 -11.739 -9.341 1.00 0.00 H new ATOM 797 N VAL A 54 -3.638 -9.614 -8.357 1.00 0.00 N ATOM 798 CA VAL A 54 -2.217 -9.356 -8.239 1.00 0.00 C ATOM 799 C VAL A 54 -1.917 -8.449 -7.047 1.00 0.00 C ATOM 800 O VAL A 54 -0.887 -8.585 -6.413 1.00 0.00 O ATOM 801 CB VAL A 54 -1.562 -8.826 -9.568 1.00 0.00 C ATOM 802 CG1 VAL A 54 -2.106 -7.484 -9.989 1.00 0.00 C ATOM 803 CG2 VAL A 54 -0.037 -8.792 -9.474 1.00 0.00 C ATOM 0 H VAL A 54 -4.229 -8.783 -8.340 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.745 -10.321 -8.052 1.00 0.00 H new ATOM 0 HB VAL A 54 -1.836 -9.539 -10.345 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.619 -7.167 -10.911 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.180 -7.563 -10.155 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.912 -6.751 -9.206 1.00 0.00 H new ATOM 0 HG21 VAL A 54 0.377 -8.420 -10.411 1.00 0.00 H new ATOM 0 HG22 VAL A 54 0.263 -8.134 -8.659 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.338 -9.798 -9.285 1.00 0.00 H new ATOM 813 N ILE A 55 -2.816 -7.543 -6.727 1.00 0.00 N ATOM 814 CA ILE A 55 -2.625 -6.708 -5.557 1.00 0.00 C ATOM 815 C ILE A 55 -3.810 -6.870 -4.605 1.00 0.00 C ATOM 816 O ILE A 55 -4.966 -6.874 -5.036 1.00 0.00 O ATOM 817 CB ILE A 55 -2.404 -5.198 -5.910 1.00 0.00 C ATOM 818 CG1 ILE A 55 -1.178 -5.026 -6.802 1.00 0.00 C ATOM 819 CG2 ILE A 55 -2.178 -4.410 -4.636 1.00 0.00 C ATOM 820 CD1 ILE A 55 -0.949 -3.595 -7.311 1.00 0.00 C ATOM 0 H ILE A 55 -3.674 -7.366 -7.250 1.00 0.00 H new ATOM 0 HA ILE A 55 -1.711 -7.045 -5.068 1.00 0.00 H new ATOM 0 HB ILE A 55 -3.288 -4.837 -6.435 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -0.295 -5.346 -6.248 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -1.274 -5.691 -7.660 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -2.024 -3.359 -4.881 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -3.049 -4.508 -3.988 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -1.298 -4.795 -4.121 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -0.056 -3.570 -7.936 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -1.811 -3.275 -7.896 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -0.817 -2.924 -6.462 1.00 0.00 H new ATOM 832 N ASN A 56 -3.519 -7.029 -3.324 1.00 0.00 N ATOM 833 CA ASN A 56 -4.543 -7.204 -2.316 1.00 0.00 C ATOM 834 C ASN A 56 -4.953 -5.829 -1.829 1.00 0.00 C ATOM 835 O ASN A 56 -4.170 -5.162 -1.170 1.00 0.00 O ATOM 836 CB ASN A 56 -3.983 -7.970 -1.114 1.00 0.00 C ATOM 837 CG ASN A 56 -3.194 -9.230 -1.454 1.00 0.00 C ATOM 838 OD1 ASN A 56 -1.890 -9.089 -1.597 1.00 0.00 O flip ATOM 839 ND2 ASN A 56 -3.741 -10.322 -1.565 1.00 0.00 N flip ATOM 0 H ASN A 56 -2.567 -7.040 -2.958 1.00 0.00 H new ATOM 0 HA ASN A 56 -5.380 -7.755 -2.744 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -3.338 -7.300 -0.545 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -4.812 -8.245 -0.461 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -4.751 -10.400 -1.449 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -3.186 -11.152 -1.773 1.00 0.00 H new ATOM 846 N PHE A 57 -6.134 -5.393 -2.152 1.00 0.00 N ATOM 847 CA PHE A 57 -6.586 -4.066 -1.753 1.00 0.00 C ATOM 848 C PHE A 57 -7.357 -4.073 -0.459 1.00 0.00 C ATOM 849 O PHE A 57 -8.485 -4.520 -0.399 1.00 0.00 O ATOM 850 CB PHE A 57 -7.374 -3.381 -2.858 1.00 0.00 C ATOM 851 CG PHE A 57 -6.534 -2.561 -3.774 1.00 0.00 C ATOM 852 CD1 PHE A 57 -5.638 -3.151 -4.636 1.00 0.00 C ATOM 853 CD2 PHE A 57 -6.654 -1.191 -3.777 1.00 0.00 C ATOM 854 CE1 PHE A 57 -4.874 -2.385 -5.486 1.00 0.00 C ATOM 855 CE2 PHE A 57 -5.892 -0.418 -4.623 1.00 0.00 C ATOM 856 CZ PHE A 57 -5.000 -1.015 -5.477 1.00 0.00 C ATOM 0 H PHE A 57 -6.814 -5.928 -2.692 1.00 0.00 H new ATOM 0 HA PHE A 57 -5.682 -3.483 -1.575 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.898 -4.138 -3.441 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -8.134 -2.743 -2.408 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -5.534 -4.226 -4.645 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -7.355 -0.716 -3.107 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -4.176 -2.859 -6.160 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -5.996 0.657 -4.615 1.00 0.00 H new ATOM 0 HZ PHE A 57 -4.398 -0.411 -6.140 1.00 0.00 H new ATOM 866 N GLY A 58 -6.745 -3.562 0.555 1.00 0.00 N ATOM 867 CA GLY A 58 -7.348 -3.527 1.855 1.00 0.00 C ATOM 868 C GLY A 58 -7.270 -2.173 2.525 1.00 0.00 C ATOM 869 O GLY A 58 -6.213 -1.551 2.567 1.00 0.00 O ATOM 0 H GLY A 58 -5.811 -3.155 0.512 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -8.394 -3.820 1.769 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -6.862 -4.266 2.492 1.00 0.00 H new ATOM 873 N THR A 59 -8.372 -1.729 3.046 1.00 0.00 N ATOM 874 CA THR A 59 -8.451 -0.472 3.744 1.00 0.00 C ATOM 875 C THR A 59 -8.210 -0.656 5.232 1.00 0.00 C ATOM 876 O THR A 59 -8.470 -1.736 5.793 1.00 0.00 O ATOM 877 CB THR A 59 -9.810 0.231 3.498 1.00 0.00 C ATOM 878 OG1 THR A 59 -10.891 -0.642 3.835 1.00 0.00 O ATOM 879 CG2 THR A 59 -9.954 0.644 2.051 1.00 0.00 C ATOM 0 H THR A 59 -9.258 -2.233 3.001 1.00 0.00 H new ATOM 0 HA THR A 59 -7.665 0.169 3.345 1.00 0.00 H new ATOM 0 HB THR A 59 -9.839 1.119 4.130 1.00 0.00 H new ATOM 0 HG1 THR A 59 -10.909 -1.397 3.210 1.00 0.00 H new ATOM 0 HG21 THR A 59 -10.917 1.135 1.907 1.00 0.00 H new ATOM 0 HG22 THR A 59 -9.152 1.334 1.788 1.00 0.00 H new ATOM 0 HG23 THR A 59 -9.897 -0.238 1.413 1.00 0.00 H new ATOM 887 N ILE A 60 -7.668 0.361 5.853 1.00 0.00 N ATOM 888 CA ILE A 60 -7.406 0.346 7.250 1.00 0.00 C ATOM 889 C ILE A 60 -7.467 1.791 7.778 1.00 0.00 C ATOM 890 O ILE A 60 -7.165 2.739 7.047 1.00 0.00 O ATOM 891 CB ILE A 60 -6.019 -0.311 7.518 1.00 0.00 C ATOM 892 CG1 ILE A 60 -5.708 -0.387 9.015 1.00 0.00 C ATOM 893 CG2 ILE A 60 -4.914 0.404 6.760 1.00 0.00 C ATOM 894 CD1 ILE A 60 -4.331 -0.922 9.316 1.00 0.00 C ATOM 0 H ILE A 60 -7.397 1.227 5.388 1.00 0.00 H new ATOM 0 HA ILE A 60 -8.155 -0.247 7.776 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.068 -1.334 7.146 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -5.806 0.608 9.449 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -6.450 -1.021 9.501 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -3.959 -0.078 6.968 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -5.118 0.358 5.690 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -4.871 1.446 7.077 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -4.179 -0.948 10.395 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -4.236 -1.930 8.911 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -3.582 -0.275 8.860 1.00 0.00 H new ATOM 906 N ASP A 61 -7.904 1.951 9.002 1.00 0.00 N ATOM 907 CA ASP A 61 -8.033 3.273 9.616 1.00 0.00 C ATOM 908 C ASP A 61 -6.671 3.887 9.854 1.00 0.00 C ATOM 909 O ASP A 61 -5.806 3.246 10.439 1.00 0.00 O ATOM 910 CB ASP A 61 -8.742 3.160 10.958 1.00 0.00 C ATOM 911 CG ASP A 61 -8.844 4.459 11.681 1.00 0.00 C ATOM 912 OD1 ASP A 61 -8.932 5.515 11.040 1.00 0.00 O ATOM 913 OD2 ASP A 61 -8.837 4.441 12.903 1.00 0.00 O ATOM 0 H ASP A 61 -8.182 1.180 9.609 1.00 0.00 H new ATOM 0 HA ASP A 61 -8.607 3.901 8.935 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -9.744 2.760 10.800 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.209 2.444 11.584 1.00 0.00 H new ATOM 918 N ALA A 62 -6.481 5.122 9.437 1.00 0.00 N ATOM 919 CA ALA A 62 -5.202 5.766 9.668 1.00 0.00 C ATOM 920 C ALA A 62 -5.225 6.559 10.951 1.00 0.00 C ATOM 921 O ALA A 62 -4.214 7.123 11.364 1.00 0.00 O ATOM 922 CB ALA A 62 -4.808 6.655 8.518 1.00 0.00 C ATOM 0 H ALA A 62 -7.175 5.689 8.949 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.455 4.976 9.753 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -3.845 7.119 8.730 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.732 6.060 7.608 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -5.562 7.431 8.383 1.00 0.00 H new ATOM 928 N LYS A 63 -6.364 6.604 11.584 1.00 0.00 N ATOM 929 CA LYS A 63 -6.487 7.347 12.788 1.00 0.00 C ATOM 930 C LYS A 63 -6.065 6.484 13.972 1.00 0.00 C ATOM 931 O LYS A 63 -5.244 6.894 14.799 1.00 0.00 O ATOM 932 CB LYS A 63 -7.922 7.835 12.959 1.00 0.00 C ATOM 933 CG LYS A 63 -8.083 8.911 14.000 1.00 0.00 C ATOM 934 CD LYS A 63 -7.262 10.133 13.600 1.00 0.00 C ATOM 935 CE LYS A 63 -7.605 11.383 14.383 1.00 0.00 C ATOM 936 NZ LYS A 63 -6.819 12.543 13.888 1.00 0.00 N ATOM 0 H LYS A 63 -7.215 6.132 11.279 1.00 0.00 H new ATOM 0 HA LYS A 63 -5.833 8.218 12.742 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -8.283 8.212 12.002 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -8.554 6.988 13.226 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -9.134 9.182 14.098 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -7.756 8.543 14.973 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -6.204 9.909 13.737 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -7.412 10.328 12.538 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -8.671 11.594 14.293 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -7.400 11.223 15.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -7.372 13.415 14.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -5.932 12.617 14.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -6.602 12.410 12.880 1.00 0.00 H new ATOM 950 N ALA A 64 -6.594 5.294 14.044 1.00 0.00 N ATOM 951 CA ALA A 64 -6.298 4.406 15.148 1.00 0.00 C ATOM 952 C ALA A 64 -5.254 3.382 14.784 1.00 0.00 C ATOM 953 O ALA A 64 -4.406 3.037 15.607 1.00 0.00 O ATOM 954 CB ALA A 64 -7.548 3.719 15.635 1.00 0.00 C ATOM 0 H ALA A 64 -7.236 4.910 13.351 1.00 0.00 H new ATOM 0 HA ALA A 64 -5.895 5.022 15.952 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.300 3.057 16.465 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.267 4.467 15.970 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.982 3.136 14.823 1.00 0.00 H new ATOM 960 N PHE A 65 -5.292 2.881 13.563 1.00 0.00 N ATOM 961 CA PHE A 65 -4.332 1.894 13.165 1.00 0.00 C ATOM 962 C PHE A 65 -3.291 2.525 12.266 1.00 0.00 C ATOM 963 O PHE A 65 -2.495 1.837 11.645 1.00 0.00 O ATOM 964 CB PHE A 65 -5.002 0.746 12.421 1.00 0.00 C ATOM 965 CG PHE A 65 -5.999 -0.074 13.206 1.00 0.00 C ATOM 966 CD1 PHE A 65 -7.304 0.357 13.375 1.00 0.00 C ATOM 967 CD2 PHE A 65 -5.631 -1.292 13.748 1.00 0.00 C ATOM 968 CE1 PHE A 65 -8.215 -0.405 14.074 1.00 0.00 C ATOM 969 CE2 PHE A 65 -6.541 -2.061 14.446 1.00 0.00 C ATOM 970 CZ PHE A 65 -7.835 -1.617 14.609 1.00 0.00 C ATOM 0 H PHE A 65 -5.970 3.142 12.847 1.00 0.00 H new ATOM 0 HA PHE A 65 -3.860 1.500 14.065 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -5.509 1.155 11.547 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -4.224 0.077 12.054 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -7.612 1.303 12.954 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -4.618 -1.646 13.624 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -9.228 -0.052 14.203 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -6.239 -3.010 14.864 1.00 0.00 H new ATOM 0 HZ PHE A 65 -8.549 -2.217 15.154 1.00 0.00 H new ATOM 980 N GLY A 66 -3.267 3.838 12.255 1.00 0.00 N ATOM 981 CA GLY A 66 -2.452 4.559 11.328 1.00 0.00 C ATOM 982 C GLY A 66 -0.986 4.500 11.592 1.00 0.00 C ATOM 983 O GLY A 66 -0.201 4.728 10.677 1.00 0.00 O ATOM 0 H GLY A 66 -3.811 4.425 12.887 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -2.640 4.173 10.326 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -2.764 5.603 11.331 1.00 0.00 H new ATOM 987 N ALA A 67 -0.593 4.166 12.813 1.00 0.00 N ATOM 988 CA ALA A 67 0.824 4.061 13.155 1.00 0.00 C ATOM 989 C ALA A 67 1.477 2.947 12.340 1.00 0.00 C ATOM 990 O ALA A 67 2.671 3.005 12.001 1.00 0.00 O ATOM 991 CB ALA A 67 1.014 3.819 14.645 1.00 0.00 C ATOM 0 H ALA A 67 -1.230 3.963 13.583 1.00 0.00 H new ATOM 0 HA ALA A 67 1.307 5.007 12.910 1.00 0.00 H new ATOM 0 HB1 ALA A 67 2.078 3.745 14.869 1.00 0.00 H new ATOM 0 HB2 ALA A 67 0.582 4.647 15.206 1.00 0.00 H new ATOM 0 HB3 ALA A 67 0.518 2.891 14.929 1.00 0.00 H new ATOM 997 N HIS A 68 0.650 1.980 11.951 1.00 0.00 N ATOM 998 CA HIS A 68 1.071 0.828 11.183 1.00 0.00 C ATOM 999 C HIS A 68 1.563 1.275 9.783 1.00 0.00 C ATOM 1000 O HIS A 68 2.418 0.628 9.187 1.00 0.00 O ATOM 1001 CB HIS A 68 -0.109 -0.178 11.081 1.00 0.00 C ATOM 1002 CG HIS A 68 0.241 -1.566 10.588 1.00 0.00 C ATOM 1003 ND1 HIS A 68 0.116 -2.700 11.363 1.00 0.00 N ATOM 1004 CD2 HIS A 68 0.676 -1.999 9.374 1.00 0.00 C ATOM 1005 CE1 HIS A 68 0.469 -3.755 10.625 1.00 0.00 C ATOM 1006 NE2 HIS A 68 0.817 -3.387 9.405 1.00 0.00 N ATOM 0 H HIS A 68 -0.347 1.982 12.168 1.00 0.00 H new ATOM 0 HA HIS A 68 1.904 0.331 11.681 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -0.568 -0.269 12.065 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -0.862 0.243 10.415 1.00 0.00 H new ATOM 0 HD2 HIS A 68 0.880 -1.368 8.521 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.470 -4.775 10.979 1.00 0.00 H new ATOM 0 HE2 HIS A 68 1.125 -3.992 8.644 1.00 0.00 H new ATOM 1014 N ALA A 69 1.077 2.436 9.305 1.00 0.00 N ATOM 1015 CA ALA A 69 1.452 2.960 7.974 1.00 0.00 C ATOM 1016 C ALA A 69 2.919 3.250 7.938 1.00 0.00 C ATOM 1017 O ALA A 69 3.595 3.084 6.929 1.00 0.00 O ATOM 1018 CB ALA A 69 0.668 4.220 7.635 1.00 0.00 C ATOM 0 H ALA A 69 0.425 3.029 9.818 1.00 0.00 H new ATOM 0 HA ALA A 69 1.211 2.200 7.230 1.00 0.00 H new ATOM 0 HB1 ALA A 69 0.967 4.580 6.651 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -0.398 3.995 7.631 1.00 0.00 H new ATOM 0 HB3 ALA A 69 0.874 4.988 8.380 1.00 0.00 H new ATOM 1024 N GLY A 70 3.419 3.679 9.035 1.00 0.00 N ATOM 1025 CA GLY A 70 4.835 3.912 9.094 1.00 0.00 C ATOM 1026 C GLY A 70 5.591 2.874 9.840 1.00 0.00 C ATOM 1027 O GLY A 70 6.715 3.098 10.259 1.00 0.00 O ATOM 0 H GLY A 70 2.898 3.875 9.889 1.00 0.00 H new ATOM 0 HA2 GLY A 70 5.225 3.970 8.078 1.00 0.00 H new ATOM 0 HA3 GLY A 70 5.014 4.881 9.560 1.00 0.00 H new ATOM 1031 N ASN A 71 4.972 1.722 10.013 1.00 0.00 N ATOM 1032 CA ASN A 71 5.705 0.543 10.465 1.00 0.00 C ATOM 1033 C ASN A 71 6.467 0.054 9.273 1.00 0.00 C ATOM 1034 O ASN A 71 7.454 -0.650 9.377 1.00 0.00 O ATOM 1035 CB ASN A 71 4.777 -0.578 10.959 1.00 0.00 C ATOM 1036 CG ASN A 71 4.337 -0.455 12.404 1.00 0.00 C ATOM 1037 OD1 ASN A 71 4.125 -1.461 13.080 1.00 0.00 O ATOM 1038 ND2 ASN A 71 4.167 0.744 12.886 1.00 0.00 N ATOM 0 H ASN A 71 3.976 1.572 9.851 1.00 0.00 H new ATOM 0 HA ASN A 71 6.345 0.810 11.306 1.00 0.00 H new ATOM 0 HB2 ASN A 71 3.890 -0.601 10.326 1.00 0.00 H new ATOM 0 HB3 ASN A 71 5.285 -1.533 10.830 1.00 0.00 H new ATOM 0 HD21 ASN A 71 3.850 0.867 13.848 1.00 0.00 H new ATOM 0 HD22 ASN A 71 4.351 1.559 12.301 1.00 0.00 H new ATOM 1045 N LEU A 72 5.960 0.451 8.127 1.00 0.00 N ATOM 1046 CA LEU A 72 6.548 0.148 6.881 1.00 0.00 C ATOM 1047 C LEU A 72 7.264 1.394 6.305 1.00 0.00 C ATOM 1048 O LEU A 72 8.293 1.258 5.639 1.00 0.00 O ATOM 1049 CB LEU A 72 5.453 -0.425 5.928 1.00 0.00 C ATOM 1050 CG LEU A 72 4.312 0.505 5.469 1.00 0.00 C ATOM 1051 CD1 LEU A 72 4.714 1.341 4.278 1.00 0.00 C ATOM 1052 CD2 LEU A 72 3.059 -0.262 5.148 1.00 0.00 C ATOM 0 H LEU A 72 5.107 1.006 8.055 1.00 0.00 H new ATOM 0 HA LEU A 72 7.316 -0.616 6.997 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.954 -0.799 5.035 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.000 -1.284 6.423 1.00 0.00 H new ATOM 0 HG LEU A 72 4.106 1.171 6.307 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.882 1.982 3.986 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.573 1.958 4.540 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.977 0.687 3.447 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.280 0.431 4.829 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.263 -0.973 4.347 1.00 0.00 H new ATOM 0 HD23 LEU A 72 2.725 -0.800 6.035 1.00 0.00 H new ATOM 1064 N ASN A 73 6.721 2.623 6.573 1.00 0.00 N ATOM 1065 CA ASN A 73 7.328 3.843 5.972 1.00 0.00 C ATOM 1066 C ASN A 73 6.736 5.182 6.431 1.00 0.00 C ATOM 1067 O ASN A 73 7.460 6.047 6.908 1.00 0.00 O ATOM 1068 CB ASN A 73 7.092 3.779 4.502 1.00 0.00 C ATOM 1069 CG ASN A 73 7.932 4.722 3.675 1.00 0.00 C ATOM 1070 OD1 ASN A 73 7.582 5.872 3.481 1.00 0.00 O ATOM 1071 ND2 ASN A 73 8.996 4.218 3.124 1.00 0.00 N ATOM 0 H ASN A 73 5.909 2.787 7.168 1.00 0.00 H new ATOM 0 HA ASN A 73 8.373 3.831 6.283 1.00 0.00 H new ATOM 0 HB2 ASN A 73 7.279 2.760 4.164 1.00 0.00 H new ATOM 0 HB3 ASN A 73 6.040 3.991 4.309 1.00 0.00 H new ATOM 0 HD21 ASN A 73 9.570 4.791 2.505 1.00 0.00 H new ATOM 0 HD22 ASN A 73 9.257 3.250 3.311 1.00 0.00 H new ATOM 1078 N LEU A 74 5.420 5.349 6.254 1.00 0.00 N ATOM 1079 CA LEU A 74 4.781 6.677 6.363 1.00 0.00 C ATOM 1080 C LEU A 74 4.931 7.390 7.712 1.00 0.00 C ATOM 1081 O LEU A 74 5.216 6.795 8.737 1.00 0.00 O ATOM 1082 CB LEU A 74 3.309 6.707 5.875 1.00 0.00 C ATOM 1083 CG LEU A 74 3.033 6.304 4.403 1.00 0.00 C ATOM 1084 CD1 LEU A 74 4.049 6.912 3.444 1.00 0.00 C ATOM 1085 CD2 LEU A 74 2.920 4.801 4.248 1.00 0.00 C ATOM 0 H LEU A 74 4.775 4.589 6.036 1.00 0.00 H new ATOM 0 HA LEU A 74 5.376 7.266 5.665 1.00 0.00 H new ATOM 0 HB2 LEU A 74 2.728 6.047 6.519 1.00 0.00 H new ATOM 0 HB3 LEU A 74 2.926 7.716 6.025 1.00 0.00 H new ATOM 0 HG LEU A 74 2.065 6.723 4.130 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.817 6.603 2.425 1.00 0.00 H new ATOM 0 HD12 LEU A 74 4.008 7.999 3.512 1.00 0.00 H new ATOM 0 HD13 LEU A 74 5.049 6.569 3.708 1.00 0.00 H new ATOM 0 HD21 LEU A 74 2.727 4.556 3.204 1.00 0.00 H new ATOM 0 HD22 LEU A 74 3.852 4.332 4.564 1.00 0.00 H new ATOM 0 HD23 LEU A 74 2.100 4.432 4.865 1.00 0.00 H new ATOM 1097 N LYS A 75 4.677 8.668 7.672 1.00 0.00 N ATOM 1098 CA LYS A 75 4.851 9.577 8.793 1.00 0.00 C ATOM 1099 C LYS A 75 3.626 9.540 9.741 1.00 0.00 C ATOM 1100 O LYS A 75 3.638 10.072 10.841 1.00 0.00 O ATOM 1101 CB LYS A 75 5.121 10.949 8.191 1.00 0.00 C ATOM 1102 CG LYS A 75 5.283 12.076 9.140 1.00 0.00 C ATOM 1103 CD LYS A 75 5.636 13.351 8.358 1.00 0.00 C ATOM 1104 CE LYS A 75 5.875 14.557 9.253 1.00 0.00 C ATOM 1105 NZ LYS A 75 4.702 14.882 10.066 1.00 0.00 N ATOM 0 H LYS A 75 4.330 9.131 6.832 1.00 0.00 H new ATOM 0 HA LYS A 75 5.689 9.289 9.427 1.00 0.00 H new ATOM 0 HB2 LYS A 75 6.025 10.882 7.586 1.00 0.00 H new ATOM 0 HB3 LYS A 75 4.301 11.190 7.514 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.363 12.225 9.706 1.00 0.00 H new ATOM 0 HG3 LYS A 75 6.068 11.849 9.862 1.00 0.00 H new ATOM 0 HD2 LYS A 75 6.529 13.167 7.761 1.00 0.00 H new ATOM 0 HD3 LYS A 75 4.828 13.578 7.662 1.00 0.00 H new ATOM 0 HE2 LYS A 75 6.725 14.360 9.906 1.00 0.00 H new ATOM 0 HE3 LYS A 75 6.139 15.417 8.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 4.904 15.720 10.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 3.892 15.079 9.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 4.475 14.078 10.685 1.00 0.00 H new ATOM 1119 N THR A 76 2.595 8.871 9.262 1.00 0.00 N ATOM 1120 CA THR A 76 1.333 8.514 9.992 1.00 0.00 C ATOM 1121 C THR A 76 0.503 9.728 10.486 1.00 0.00 C ATOM 1122 O THR A 76 -0.400 9.581 11.309 1.00 0.00 O ATOM 1123 CB THR A 76 1.637 7.549 11.197 1.00 0.00 C ATOM 1124 OG1 THR A 76 2.401 8.202 12.223 1.00 0.00 O ATOM 1125 CG2 THR A 76 2.430 6.351 10.718 1.00 0.00 C ATOM 0 H THR A 76 2.587 8.530 8.301 1.00 0.00 H new ATOM 0 HA THR A 76 0.714 8.009 9.250 1.00 0.00 H new ATOM 0 HB THR A 76 0.675 7.240 11.607 1.00 0.00 H new ATOM 0 HG1 THR A 76 2.590 9.125 11.953 1.00 0.00 H new ATOM 0 HG21 THR A 76 2.635 5.690 11.560 1.00 0.00 H new ATOM 0 HG22 THR A 76 1.855 5.812 9.965 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.371 6.688 10.284 1.00 0.00 H new ATOM 1133 N ASP A 77 0.754 10.872 9.928 1.00 0.00 N ATOM 1134 CA ASP A 77 0.199 12.134 10.422 1.00 0.00 C ATOM 1135 C ASP A 77 -0.793 12.812 9.483 1.00 0.00 C ATOM 1136 O ASP A 77 -1.534 13.705 9.902 1.00 0.00 O ATOM 1137 CB ASP A 77 1.353 13.096 10.564 1.00 0.00 C ATOM 1138 CG ASP A 77 2.002 13.415 9.215 1.00 0.00 C ATOM 1139 OD1 ASP A 77 2.241 12.470 8.410 1.00 0.00 O ATOM 1140 OD2 ASP A 77 2.316 14.601 8.959 1.00 0.00 O ATOM 0 H ASP A 77 1.353 10.977 9.109 1.00 0.00 H new ATOM 0 HA ASP A 77 -0.331 11.897 11.345 1.00 0.00 H new ATOM 0 HB2 ASP A 77 1.001 14.019 11.024 1.00 0.00 H new ATOM 0 HB3 ASP A 77 2.100 12.670 11.234 1.00 0.00 H new ATOM 1145 N LYS A 78 -0.798 12.440 8.247 1.00 0.00 N ATOM 1146 CA LYS A 78 -1.522 13.223 7.269 1.00 0.00 C ATOM 1147 C LYS A 78 -2.665 12.422 6.606 1.00 0.00 C ATOM 1148 O LYS A 78 -3.132 11.431 7.171 1.00 0.00 O ATOM 1149 CB LYS A 78 -0.488 13.754 6.266 1.00 0.00 C ATOM 1150 CG LYS A 78 -0.796 15.134 5.701 1.00 0.00 C ATOM 1151 CD LYS A 78 0.409 15.734 4.972 1.00 0.00 C ATOM 1152 CE LYS A 78 1.595 15.959 5.914 1.00 0.00 C ATOM 1153 NZ LYS A 78 2.697 16.715 5.274 1.00 0.00 N ATOM 0 H LYS A 78 -0.322 11.615 7.882 1.00 0.00 H new ATOM 0 HA LYS A 78 -2.031 14.060 7.746 1.00 0.00 H new ATOM 0 HB2 LYS A 78 0.487 13.786 6.753 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -0.409 13.048 5.439 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -1.639 15.065 5.013 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -1.099 15.798 6.510 1.00 0.00 H new ATOM 0 HD2 LYS A 78 0.710 15.070 4.162 1.00 0.00 H new ATOM 0 HD3 LYS A 78 0.122 16.682 4.517 1.00 0.00 H new ATOM 0 HE2 LYS A 78 1.255 16.499 6.798 1.00 0.00 H new ATOM 0 HE3 LYS A 78 1.971 14.994 6.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 3.576 16.568 5.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 2.827 16.380 4.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 2.463 17.728 5.264 1.00 0.00 H new ATOM 1167 N PHE A 79 -3.130 12.897 5.435 1.00 0.00 N ATOM 1168 CA PHE A 79 -4.244 12.302 4.659 1.00 0.00 C ATOM 1169 C PHE A 79 -3.991 10.819 4.360 1.00 0.00 C ATOM 1170 O PHE A 79 -2.846 10.372 4.508 1.00 0.00 O ATOM 1171 CB PHE A 79 -4.446 13.111 3.364 1.00 0.00 C ATOM 1172 CG PHE A 79 -4.950 14.503 3.615 1.00 0.00 C ATOM 1173 CD1 PHE A 79 -6.285 14.719 3.910 1.00 0.00 C ATOM 1174 CD2 PHE A 79 -4.096 15.589 3.562 1.00 0.00 C ATOM 1175 CE1 PHE A 79 -6.759 15.989 4.149 1.00 0.00 C ATOM 1176 CE2 PHE A 79 -4.566 16.863 3.799 1.00 0.00 C ATOM 1177 CZ PHE A 79 -5.898 17.063 4.094 1.00 0.00 C ATOM 0 H PHE A 79 -2.735 13.725 4.988 1.00 0.00 H new ATOM 0 HA PHE A 79 -5.156 12.349 5.254 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.501 13.165 2.824 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -5.151 12.586 2.720 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -6.964 13.880 3.953 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -3.051 15.438 3.333 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -7.803 16.143 4.379 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -3.891 17.705 3.754 1.00 0.00 H new ATOM 0 HZ PHE A 79 -6.266 18.061 4.282 1.00 0.00 H new ATOM 1187 N PRO A 80 -5.061 10.015 3.938 1.00 0.00 N ATOM 1188 CA PRO A 80 -4.937 8.578 3.739 1.00 0.00 C ATOM 1189 C PRO A 80 -3.627 8.129 3.094 1.00 0.00 C ATOM 1190 O PRO A 80 -3.208 8.621 2.062 1.00 0.00 O ATOM 1191 CB PRO A 80 -6.157 8.192 2.897 1.00 0.00 C ATOM 1192 CG PRO A 80 -6.872 9.437 2.590 1.00 0.00 C ATOM 1193 CD PRO A 80 -6.458 10.435 3.616 1.00 0.00 C ATOM 0 HA PRO A 80 -4.909 8.069 4.703 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -5.850 7.687 1.981 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -6.800 7.501 3.442 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -6.625 9.788 1.588 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -7.950 9.280 2.616 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -6.496 11.453 3.229 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -7.103 10.404 4.494 1.00 0.00 H new ATOM 1201 N ALA A 81 -3.020 7.184 3.712 1.00 0.00 N ATOM 1202 CA ALA A 81 -1.721 6.763 3.346 1.00 0.00 C ATOM 1203 C ALA A 81 -1.783 5.403 2.680 1.00 0.00 C ATOM 1204 O ALA A 81 -1.998 4.375 3.325 1.00 0.00 O ATOM 1205 CB ALA A 81 -0.823 6.754 4.572 1.00 0.00 C ATOM 0 H ALA A 81 -3.419 6.673 4.499 1.00 0.00 H new ATOM 0 HA ALA A 81 -1.296 7.461 2.624 1.00 0.00 H new ATOM 0 HB1 ALA A 81 0.178 6.429 4.288 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -0.773 7.758 4.993 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -1.229 6.068 5.316 1.00 0.00 H new ATOM 1211 N PHE A 82 -1.639 5.411 1.402 1.00 0.00 N ATOM 1212 CA PHE A 82 -1.690 4.212 0.616 1.00 0.00 C ATOM 1213 C PHE A 82 -0.302 3.582 0.544 1.00 0.00 C ATOM 1214 O PHE A 82 0.611 4.164 -0.020 1.00 0.00 O ATOM 1215 CB PHE A 82 -2.212 4.569 -0.773 1.00 0.00 C ATOM 1216 CG PHE A 82 -2.349 3.417 -1.706 1.00 0.00 C ATOM 1217 CD1 PHE A 82 -3.280 2.431 -1.468 1.00 0.00 C ATOM 1218 CD2 PHE A 82 -1.557 3.330 -2.832 1.00 0.00 C ATOM 1219 CE1 PHE A 82 -3.423 1.378 -2.334 1.00 0.00 C ATOM 1220 CE2 PHE A 82 -1.694 2.282 -3.703 1.00 0.00 C ATOM 1221 CZ PHE A 82 -2.632 1.303 -3.459 1.00 0.00 C ATOM 0 H PHE A 82 -1.480 6.259 0.858 1.00 0.00 H new ATOM 0 HA PHE A 82 -2.360 3.482 1.071 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -3.184 5.050 -0.667 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -1.541 5.302 -1.220 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -3.905 2.488 -0.589 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -0.821 4.096 -3.029 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -4.154 0.609 -2.135 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -1.067 2.223 -4.580 1.00 0.00 H new ATOM 0 HZ PHE A 82 -2.747 0.479 -4.148 1.00 0.00 H new ATOM 1231 N ALA A 83 -0.137 2.428 1.135 1.00 0.00 N ATOM 1232 CA ALA A 83 1.145 1.776 1.156 1.00 0.00 C ATOM 1233 C ALA A 83 1.117 0.424 0.468 1.00 0.00 C ATOM 1234 O ALA A 83 0.360 -0.439 0.851 1.00 0.00 O ATOM 1235 CB ALA A 83 1.591 1.620 2.574 1.00 0.00 C ATOM 0 H ALA A 83 -0.881 1.917 1.611 1.00 0.00 H new ATOM 0 HA ALA A 83 1.848 2.399 0.603 1.00 0.00 H new ATOM 0 HB1 ALA A 83 2.562 1.126 2.598 1.00 0.00 H new ATOM 0 HB2 ALA A 83 1.672 2.602 3.040 1.00 0.00 H new ATOM 0 HB3 ALA A 83 0.865 1.018 3.120 1.00 0.00 H new ATOM 1241 N ILE A 84 1.932 0.241 -0.543 1.00 0.00 N ATOM 1242 CA ILE A 84 1.997 -1.038 -1.218 1.00 0.00 C ATOM 1243 C ILE A 84 3.132 -1.861 -0.651 1.00 0.00 C ATOM 1244 O ILE A 84 4.302 -1.538 -0.829 1.00 0.00 O ATOM 1245 CB ILE A 84 2.188 -0.907 -2.741 1.00 0.00 C ATOM 1246 CG1 ILE A 84 1.163 0.055 -3.337 1.00 0.00 C ATOM 1247 CG2 ILE A 84 2.070 -2.282 -3.399 1.00 0.00 C ATOM 1248 CD1 ILE A 84 1.396 0.354 -4.802 1.00 0.00 C ATOM 0 H ILE A 84 2.557 0.955 -0.917 1.00 0.00 H new ATOM 0 HA ILE A 84 1.038 -1.528 -1.048 1.00 0.00 H new ATOM 0 HB ILE A 84 3.182 -0.503 -2.932 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.166 -0.368 -3.215 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.184 0.989 -2.776 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.206 -2.183 -4.476 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.836 -2.945 -2.996 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.084 -2.700 -3.195 1.00 0.00 H new ATOM 0 HD11 ILE A 84 0.631 1.044 -5.159 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.380 0.806 -4.929 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.345 -0.572 -5.375 1.00 0.00 H new ATOM 1260 N GLN A 85 2.796 -2.898 0.033 1.00 0.00 N ATOM 1261 CA GLN A 85 3.773 -3.758 0.595 1.00 0.00 C ATOM 1262 C GLN A 85 3.934 -4.979 -0.286 1.00 0.00 C ATOM 1263 O GLN A 85 2.974 -5.653 -0.599 1.00 0.00 O ATOM 1264 CB GLN A 85 3.379 -4.201 1.985 1.00 0.00 C ATOM 1265 CG GLN A 85 4.418 -5.097 2.598 1.00 0.00 C ATOM 1266 CD GLN A 85 3.999 -5.740 3.883 1.00 0.00 C ATOM 1267 OE1 GLN A 85 3.215 -5.203 4.664 1.00 0.00 O ATOM 1268 NE2 GLN A 85 4.522 -6.889 4.104 1.00 0.00 N ATOM 0 H GLN A 85 1.832 -3.173 0.218 1.00 0.00 H new ATOM 0 HA GLN A 85 4.712 -3.209 0.660 1.00 0.00 H new ATOM 0 HB2 GLN A 85 3.234 -3.326 2.618 1.00 0.00 H new ATOM 0 HB3 GLN A 85 2.425 -4.726 1.943 1.00 0.00 H new ATOM 0 HG2 GLN A 85 4.675 -5.878 1.882 1.00 0.00 H new ATOM 0 HG3 GLN A 85 5.323 -4.516 2.775 1.00 0.00 H new ATOM 0 HE21 GLN A 85 5.168 -7.294 3.426 1.00 0.00 H new ATOM 0 HE22 GLN A 85 4.293 -7.398 4.958 1.00 0.00 H new ATOM 1277 N GLU A 86 5.124 -5.251 -0.675 1.00 0.00 N ATOM 1278 CA GLU A 86 5.405 -6.402 -1.481 1.00 0.00 C ATOM 1279 C GLU A 86 5.681 -7.599 -0.638 1.00 0.00 C ATOM 1280 O GLU A 86 6.360 -7.510 0.378 1.00 0.00 O ATOM 1281 CB GLU A 86 6.587 -6.159 -2.368 1.00 0.00 C ATOM 1282 CG GLU A 86 6.241 -5.876 -3.801 1.00 0.00 C ATOM 1283 CD GLU A 86 5.872 -7.146 -4.519 1.00 0.00 C ATOM 1284 OE1 GLU A 86 5.934 -8.239 -3.889 1.00 0.00 O ATOM 1285 OE2 GLU A 86 5.578 -7.090 -5.703 1.00 0.00 O ATOM 0 H GLU A 86 5.942 -4.685 -0.448 1.00 0.00 H new ATOM 0 HA GLU A 86 4.520 -6.586 -2.090 1.00 0.00 H new ATOM 0 HB2 GLU A 86 7.156 -5.318 -1.972 1.00 0.00 H new ATOM 0 HB3 GLU A 86 7.239 -7.031 -2.330 1.00 0.00 H new ATOM 0 HG2 GLU A 86 5.411 -5.171 -3.848 1.00 0.00 H new ATOM 0 HG3 GLU A 86 7.088 -5.404 -4.299 1.00 0.00 H new ATOM 1292 N VAL A 87 5.188 -8.712 -1.069 1.00 0.00 N ATOM 1293 CA VAL A 87 5.434 -9.949 -0.385 1.00 0.00 C ATOM 1294 C VAL A 87 6.554 -10.704 -1.122 1.00 0.00 C ATOM 1295 O VAL A 87 7.042 -11.739 -0.679 1.00 0.00 O ATOM 1296 CB VAL A 87 4.137 -10.811 -0.267 1.00 0.00 C ATOM 1297 CG1 VAL A 87 4.355 -12.027 0.610 1.00 0.00 C ATOM 1298 CG2 VAL A 87 2.996 -9.973 0.278 1.00 0.00 C ATOM 0 H VAL A 87 4.605 -8.796 -1.902 1.00 0.00 H new ATOM 0 HA VAL A 87 5.752 -9.740 0.636 1.00 0.00 H new ATOM 0 HB VAL A 87 3.879 -11.161 -1.267 1.00 0.00 H new ATOM 0 HG11 VAL A 87 3.432 -12.603 0.669 1.00 0.00 H new ATOM 0 HG12 VAL A 87 5.143 -12.647 0.183 1.00 0.00 H new ATOM 0 HG13 VAL A 87 4.648 -11.707 1.610 1.00 0.00 H new ATOM 0 HG21 VAL A 87 2.098 -10.587 0.355 1.00 0.00 H new ATOM 0 HG22 VAL A 87 3.262 -9.594 1.265 1.00 0.00 H new ATOM 0 HG23 VAL A 87 2.807 -9.136 -0.394 1.00 0.00 H new ATOM 1308 N ALA A 88 6.984 -10.155 -2.242 1.00 0.00 N ATOM 1309 CA ALA A 88 8.058 -10.781 -2.990 1.00 0.00 C ATOM 1310 C ALA A 88 9.277 -9.911 -2.943 1.00 0.00 C ATOM 1311 O ALA A 88 10.394 -10.394 -2.820 1.00 0.00 O ATOM 1312 CB ALA A 88 7.655 -11.058 -4.425 1.00 0.00 C ATOM 0 H ALA A 88 6.616 -9.295 -2.648 1.00 0.00 H new ATOM 0 HA ALA A 88 8.281 -11.742 -2.527 1.00 0.00 H new ATOM 0 HB1 ALA A 88 8.486 -11.527 -4.952 1.00 0.00 H new ATOM 0 HB2 ALA A 88 6.794 -11.726 -4.439 1.00 0.00 H new ATOM 0 HB3 ALA A 88 7.395 -10.121 -4.917 1.00 0.00 H new ATOM 1318 N LYS A 89 9.056 -8.620 -3.021 1.00 0.00 N ATOM 1319 CA LYS A 89 10.136 -7.664 -2.965 1.00 0.00 C ATOM 1320 C LYS A 89 10.368 -7.244 -1.522 1.00 0.00 C ATOM 1321 O LYS A 89 11.393 -6.642 -1.205 1.00 0.00 O ATOM 1322 CB LYS A 89 9.794 -6.422 -3.790 1.00 0.00 C ATOM 1323 CG LYS A 89 9.409 -6.684 -5.240 1.00 0.00 C ATOM 1324 CD LYS A 89 10.540 -7.277 -6.044 1.00 0.00 C ATOM 1325 CE LYS A 89 10.095 -7.542 -7.468 1.00 0.00 C ATOM 1326 NZ LYS A 89 11.192 -8.066 -8.294 1.00 0.00 N ATOM 0 H LYS A 89 8.130 -8.205 -3.124 1.00 0.00 H new ATOM 0 HA LYS A 89 11.033 -8.130 -3.371 1.00 0.00 H new ATOM 0 HB2 LYS A 89 8.971 -5.899 -3.303 1.00 0.00 H new ATOM 0 HB3 LYS A 89 10.652 -5.750 -3.776 1.00 0.00 H new ATOM 0 HG2 LYS A 89 8.555 -7.360 -5.268 1.00 0.00 H new ATOM 0 HG3 LYS A 89 9.091 -5.749 -5.702 1.00 0.00 H new ATOM 0 HD2 LYS A 89 11.391 -6.596 -6.043 1.00 0.00 H new ATOM 0 HD3 LYS A 89 10.875 -8.206 -5.582 1.00 0.00 H new ATOM 0 HE2 LYS A 89 9.270 -8.255 -7.464 1.00 0.00 H new ATOM 0 HE3 LYS A 89 9.717 -6.619 -7.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 10.848 -8.235 -9.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 11.969 -7.375 -8.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 11.536 -8.960 -7.888 1.00 0.00 H new ATOM 1340 N ASN A 90 9.369 -7.532 -0.657 1.00 0.00 N ATOM 1341 CA ASN A 90 9.392 -7.206 0.760 1.00 0.00 C ATOM 1342 C ASN A 90 9.539 -5.714 0.937 1.00 0.00 C ATOM 1343 O ASN A 90 10.046 -5.216 1.947 1.00 0.00 O ATOM 1344 CB ASN A 90 10.502 -7.955 1.494 1.00 0.00 C ATOM 1345 CG ASN A 90 10.285 -9.461 1.623 1.00 0.00 C ATOM 1346 OD1 ASN A 90 9.633 -10.097 0.791 1.00 0.00 O ATOM 1347 ND2 ASN A 90 10.848 -10.045 2.655 1.00 0.00 N ATOM 0 H ASN A 90 8.514 -8.007 -0.945 1.00 0.00 H new ATOM 0 HA ASN A 90 8.447 -7.526 1.200 1.00 0.00 H new ATOM 0 HB2 ASN A 90 11.443 -7.782 0.973 1.00 0.00 H new ATOM 0 HB3 ASN A 90 10.608 -7.531 2.493 1.00 0.00 H new ATOM 0 HD21 ASN A 90 10.752 -11.052 2.786 1.00 0.00 H new ATOM 0 HD22 ASN A 90 11.381 -9.492 3.326 1.00 0.00 H new ATOM 1354 N GLN A 91 9.014 -5.004 -0.015 1.00 0.00 N ATOM 1355 CA GLN A 91 9.211 -3.608 -0.089 1.00 0.00 C ATOM 1356 C GLN A 91 7.974 -2.865 0.217 1.00 0.00 C ATOM 1357 O GLN A 91 6.894 -3.419 0.279 1.00 0.00 O ATOM 1358 CB GLN A 91 9.767 -3.214 -1.454 1.00 0.00 C ATOM 1359 CG GLN A 91 10.400 -1.810 -1.547 1.00 0.00 C ATOM 1360 CD GLN A 91 11.313 -1.460 -0.354 1.00 0.00 C ATOM 1361 OE1 GLN A 91 11.932 -2.444 0.252 1.00 0.00 O flip ATOM 1362 NE2 GLN A 91 11.433 -0.288 0.021 1.00 0.00 N flip ATOM 0 H GLN A 91 8.435 -5.389 -0.761 1.00 0.00 H new ATOM 0 HA GLN A 91 9.945 -3.337 0.670 1.00 0.00 H new ATOM 0 HB2 GLN A 91 10.518 -3.949 -1.744 1.00 0.00 H new ATOM 0 HB3 GLN A 91 8.960 -3.276 -2.185 1.00 0.00 H new ATOM 0 HG2 GLN A 91 10.979 -1.743 -2.468 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.605 -1.067 -1.615 1.00 0.00 H new ATOM 0 HE21 GLN A 91 10.939 0.458 -0.470 1.00 0.00 H new ATOM 0 HE22 GLN A 91 12.026 -0.067 0.821 1.00 0.00 H new ATOM 1371 N LYS A 92 8.168 -1.624 0.400 1.00 0.00 N ATOM 1372 CA LYS A 92 7.204 -0.721 0.773 1.00 0.00 C ATOM 1373 C LYS A 92 7.180 0.345 -0.291 1.00 0.00 C ATOM 1374 O LYS A 92 8.095 1.167 -0.357 1.00 0.00 O ATOM 1375 CB LYS A 92 7.593 -0.082 2.121 1.00 0.00 C ATOM 1376 CG LYS A 92 7.720 -1.028 3.354 1.00 0.00 C ATOM 1377 CD LYS A 92 8.852 -2.059 3.295 1.00 0.00 C ATOM 1378 CE LYS A 92 8.912 -2.898 4.564 1.00 0.00 C ATOM 1379 NZ LYS A 92 9.964 -3.941 4.491 1.00 0.00 N ATOM 0 H LYS A 92 9.085 -1.194 0.279 1.00 0.00 H new ATOM 0 HA LYS A 92 6.232 -1.202 0.880 1.00 0.00 H new ATOM 0 HB2 LYS A 92 8.547 0.429 1.989 1.00 0.00 H new ATOM 0 HB3 LYS A 92 6.852 0.682 2.358 1.00 0.00 H new ATOM 0 HG2 LYS A 92 7.859 -0.415 4.245 1.00 0.00 H new ATOM 0 HG3 LYS A 92 6.777 -1.560 3.478 1.00 0.00 H new ATOM 0 HD2 LYS A 92 8.707 -2.711 2.434 1.00 0.00 H new ATOM 0 HD3 LYS A 92 9.804 -1.548 3.151 1.00 0.00 H new ATOM 0 HE2 LYS A 92 9.103 -2.249 5.419 1.00 0.00 H new ATOM 0 HE3 LYS A 92 7.944 -3.370 4.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 9.782 -4.668 5.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 9.954 -4.379 3.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 10.894 -3.508 4.662 1.00 0.00 H new ATOM 1393 N PHE A 93 6.255 0.232 -1.191 1.00 0.00 N ATOM 1394 CA PHE A 93 5.997 1.281 -2.205 1.00 0.00 C ATOM 1395 C PHE A 93 4.764 2.117 -1.749 1.00 0.00 C ATOM 1396 O PHE A 93 3.645 1.813 -2.122 1.00 0.00 O ATOM 1397 CB PHE A 93 5.727 0.653 -3.632 1.00 0.00 C ATOM 1398 CG PHE A 93 6.787 -0.316 -4.081 1.00 0.00 C ATOM 1399 CD1 PHE A 93 6.762 -1.630 -3.650 1.00 0.00 C ATOM 1400 CD2 PHE A 93 7.795 0.078 -4.932 1.00 0.00 C ATOM 1401 CE1 PHE A 93 7.721 -2.523 -4.058 1.00 0.00 C ATOM 1402 CE2 PHE A 93 8.761 -0.817 -5.349 1.00 0.00 C ATOM 1403 CZ PHE A 93 8.723 -2.119 -4.911 1.00 0.00 C ATOM 0 H PHE A 93 5.641 -0.579 -1.268 1.00 0.00 H new ATOM 0 HA PHE A 93 6.878 1.917 -2.289 1.00 0.00 H new ATOM 0 HB2 PHE A 93 4.764 0.142 -3.617 1.00 0.00 H new ATOM 0 HB3 PHE A 93 5.650 1.457 -4.364 1.00 0.00 H new ATOM 0 HD1 PHE A 93 5.978 -1.958 -2.984 1.00 0.00 H new ATOM 0 HD2 PHE A 93 7.831 1.100 -5.278 1.00 0.00 H new ATOM 0 HE1 PHE A 93 7.689 -3.545 -3.709 1.00 0.00 H new ATOM 0 HE2 PHE A 93 9.545 -0.494 -6.018 1.00 0.00 H new ATOM 0 HZ PHE A 93 9.476 -2.822 -5.235 1.00 0.00 H new ATOM 1413 N PRO A 94 4.932 3.118 -0.856 1.00 0.00 N ATOM 1414 CA PRO A 94 3.832 3.904 -0.352 1.00 0.00 C ATOM 1415 C PRO A 94 3.690 5.279 -1.039 1.00 0.00 C ATOM 1416 O PRO A 94 4.672 5.893 -1.500 1.00 0.00 O ATOM 1417 CB PRO A 94 4.221 4.007 1.107 1.00 0.00 C ATOM 1418 CG PRO A 94 5.702 4.240 1.054 1.00 0.00 C ATOM 1419 CD PRO A 94 6.189 3.557 -0.222 1.00 0.00 C ATOM 0 HA PRO A 94 2.850 3.466 -0.532 1.00 0.00 H new ATOM 0 HB2 PRO A 94 3.702 4.827 1.605 1.00 0.00 H new ATOM 0 HB3 PRO A 94 3.976 3.096 1.654 1.00 0.00 H new ATOM 0 HG2 PRO A 94 5.929 5.306 1.037 1.00 0.00 H new ATOM 0 HG3 PRO A 94 6.194 3.823 1.932 1.00 0.00 H new ATOM 0 HD2 PRO A 94 6.746 4.242 -0.860 1.00 0.00 H new ATOM 0 HD3 PRO A 94 6.848 2.716 -0.005 1.00 0.00 H new ATOM 1427 N PHE A 95 2.471 5.727 -1.118 1.00 0.00 N ATOM 1428 CA PHE A 95 2.098 6.948 -1.793 1.00 0.00 C ATOM 1429 C PHE A 95 2.330 8.140 -0.857 1.00 0.00 C ATOM 1430 O PHE A 95 2.498 7.963 0.353 1.00 0.00 O ATOM 1431 CB PHE A 95 0.612 6.830 -2.219 1.00 0.00 C ATOM 1432 CG PHE A 95 0.071 7.945 -3.083 1.00 0.00 C ATOM 1433 CD1 PHE A 95 0.451 8.058 -4.409 1.00 0.00 C ATOM 1434 CD2 PHE A 95 -0.822 8.871 -2.569 1.00 0.00 C ATOM 1435 CE1 PHE A 95 -0.044 9.072 -5.204 1.00 0.00 C ATOM 1436 CE2 PHE A 95 -1.323 9.886 -3.360 1.00 0.00 C ATOM 1437 CZ PHE A 95 -0.933 9.985 -4.678 1.00 0.00 C ATOM 0 H PHE A 95 1.678 5.240 -0.702 1.00 0.00 H new ATOM 0 HA PHE A 95 2.706 7.108 -2.683 1.00 0.00 H new ATOM 0 HB2 PHE A 95 0.484 5.889 -2.755 1.00 0.00 H new ATOM 0 HB3 PHE A 95 0.002 6.769 -1.318 1.00 0.00 H new ATOM 0 HD1 PHE A 95 1.144 7.343 -4.827 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -1.130 8.798 -1.536 1.00 0.00 H new ATOM 0 HE1 PHE A 95 0.265 9.150 -6.236 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -2.019 10.601 -2.947 1.00 0.00 H new ATOM 0 HZ PHE A 95 -1.324 10.778 -5.299 1.00 0.00 H new ATOM 1447 N ASP A 96 2.385 9.325 -1.425 1.00 0.00 N ATOM 1448 CA ASP A 96 2.592 10.552 -0.665 1.00 0.00 C ATOM 1449 C ASP A 96 1.354 10.857 0.121 1.00 0.00 C ATOM 1450 O ASP A 96 0.240 10.798 -0.399 1.00 0.00 O ATOM 1451 CB ASP A 96 2.867 11.724 -1.581 1.00 0.00 C ATOM 1452 CG ASP A 96 4.095 11.562 -2.436 1.00 0.00 C ATOM 1453 OD1 ASP A 96 3.997 10.927 -3.496 1.00 0.00 O ATOM 1454 OD2 ASP A 96 5.169 12.067 -2.079 1.00 0.00 O ATOM 0 H ASP A 96 2.288 9.472 -2.430 1.00 0.00 H new ATOM 0 HA ASP A 96 3.449 10.403 -0.009 1.00 0.00 H new ATOM 0 HB2 ASP A 96 2.004 11.875 -2.229 1.00 0.00 H new ATOM 0 HB3 ASP A 96 2.974 12.625 -0.978 1.00 0.00 H new ATOM 1459 N GLN A 97 1.551 11.280 1.316 1.00 0.00 N ATOM 1460 CA GLN A 97 0.474 11.491 2.266 1.00 0.00 C ATOM 1461 C GLN A 97 -0.142 12.881 2.059 1.00 0.00 C ATOM 1462 O GLN A 97 -1.056 13.283 2.771 1.00 0.00 O ATOM 1463 CB GLN A 97 1.055 11.394 3.680 1.00 0.00 C ATOM 1464 CG GLN A 97 1.997 10.202 3.883 1.00 0.00 C ATOM 1465 CD GLN A 97 2.716 10.237 5.213 1.00 0.00 C ATOM 1466 OE1 GLN A 97 3.863 9.823 5.324 1.00 0.00 O ATOM 1467 NE2 GLN A 97 2.024 10.595 6.238 1.00 0.00 N ATOM 0 H GLN A 97 2.476 11.499 1.687 1.00 0.00 H new ATOM 0 HA GLN A 97 -0.302 10.739 2.122 1.00 0.00 H new ATOM 0 HB2 GLN A 97 1.595 12.314 3.904 1.00 0.00 H new ATOM 0 HB3 GLN A 97 0.235 11.323 4.395 1.00 0.00 H new ATOM 0 HG2 GLN A 97 1.425 9.277 3.810 1.00 0.00 H new ATOM 0 HG3 GLN A 97 2.733 10.186 3.079 1.00 0.00 H new ATOM 0 HE21 GLN A 97 1.071 10.936 6.116 1.00 0.00 H new ATOM 0 HE22 GLN A 97 2.429 10.537 7.172 1.00 0.00 H new ATOM 1476 N GLU A 98 0.364 13.604 1.072 1.00 0.00 N ATOM 1477 CA GLU A 98 -0.073 14.976 0.827 1.00 0.00 C ATOM 1478 C GLU A 98 -0.254 15.247 -0.649 1.00 0.00 C ATOM 1479 O GLU A 98 -0.412 16.395 -1.078 1.00 0.00 O ATOM 1480 CB GLU A 98 0.943 15.945 1.409 1.00 0.00 C ATOM 1481 CG GLU A 98 2.369 15.665 0.980 1.00 0.00 C ATOM 1482 CD GLU A 98 3.320 16.653 1.553 1.00 0.00 C ATOM 1483 OE1 GLU A 98 3.702 16.507 2.726 1.00 0.00 O ATOM 1484 OE2 GLU A 98 3.687 17.611 0.851 1.00 0.00 O ATOM 0 H GLU A 98 1.078 13.267 0.426 1.00 0.00 H new ATOM 0 HA GLU A 98 -1.039 15.116 1.312 1.00 0.00 H new ATOM 0 HB2 GLU A 98 0.676 16.959 1.111 1.00 0.00 H new ATOM 0 HB3 GLU A 98 0.886 15.907 2.497 1.00 0.00 H new ATOM 0 HG2 GLU A 98 2.653 14.661 1.295 1.00 0.00 H new ATOM 0 HG3 GLU A 98 2.433 15.687 -0.108 1.00 0.00 H new ATOM 1491 N LYS A 99 -0.267 14.205 -1.419 1.00 0.00 N ATOM 1492 CA LYS A 99 -0.368 14.331 -2.844 1.00 0.00 C ATOM 1493 C LYS A 99 -1.837 14.304 -3.257 1.00 0.00 C ATOM 1494 O LYS A 99 -2.166 14.584 -4.389 1.00 0.00 O ATOM 1495 CB LYS A 99 0.389 13.169 -3.446 1.00 0.00 C ATOM 1496 CG LYS A 99 0.627 13.192 -4.932 1.00 0.00 C ATOM 1497 CD LYS A 99 1.632 14.264 -5.352 1.00 0.00 C ATOM 1498 CE LYS A 99 3.013 14.001 -4.748 1.00 0.00 C ATOM 1499 NZ LYS A 99 4.038 14.930 -5.249 1.00 0.00 N ATOM 0 H LYS A 99 -0.208 13.244 -1.082 1.00 0.00 H new ATOM 0 HA LYS A 99 0.054 15.273 -3.194 1.00 0.00 H new ATOM 0 HB2 LYS A 99 1.358 13.106 -2.951 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -0.152 12.254 -3.206 1.00 0.00 H new ATOM 0 HG2 LYS A 99 0.989 12.215 -5.253 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -0.319 13.366 -5.445 1.00 0.00 H new ATOM 0 HD2 LYS A 99 1.707 14.289 -6.439 1.00 0.00 H new ATOM 0 HD3 LYS A 99 1.275 15.244 -5.035 1.00 0.00 H new ATOM 0 HE2 LYS A 99 2.952 14.084 -3.663 1.00 0.00 H new ATOM 0 HE3 LYS A 99 3.315 12.978 -4.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 4.953 14.708 -4.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 4.119 14.834 -6.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 3.768 15.906 -5.012 1.00 0.00 H new ATOM 1513 N GLU A 100 -2.698 13.989 -2.285 1.00 0.00 N ATOM 1514 CA GLU A 100 -4.145 13.859 -2.470 1.00 0.00 C ATOM 1515 C GLU A 100 -4.484 12.626 -3.304 1.00 0.00 C ATOM 1516 O GLU A 100 -4.078 12.488 -4.465 1.00 0.00 O ATOM 1517 CB GLU A 100 -4.798 15.145 -3.014 1.00 0.00 C ATOM 1518 CG GLU A 100 -6.311 15.060 -3.181 1.00 0.00 C ATOM 1519 CD GLU A 100 -6.930 16.386 -3.553 1.00 0.00 C ATOM 1520 OE1 GLU A 100 -7.051 16.697 -4.752 1.00 0.00 O ATOM 1521 OE2 GLU A 100 -7.291 17.167 -2.645 1.00 0.00 O ATOM 0 H GLU A 100 -2.401 13.813 -1.325 1.00 0.00 H new ATOM 0 HA GLU A 100 -4.582 13.712 -1.483 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -4.565 15.970 -2.340 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -4.351 15.385 -3.979 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -6.547 14.325 -3.950 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -6.756 14.704 -2.252 1.00 0.00 H new ATOM 1528 N ILE A 101 -5.202 11.736 -2.692 1.00 0.00 N ATOM 1529 CA ILE A 101 -5.538 10.481 -3.283 1.00 0.00 C ATOM 1530 C ILE A 101 -6.777 10.619 -4.151 1.00 0.00 C ATOM 1531 O ILE A 101 -7.818 11.105 -3.701 1.00 0.00 O ATOM 1532 CB ILE A 101 -5.772 9.359 -2.212 1.00 0.00 C ATOM 1533 CG1 ILE A 101 -4.510 9.047 -1.374 1.00 0.00 C ATOM 1534 CG2 ILE A 101 -6.298 8.087 -2.848 1.00 0.00 C ATOM 1535 CD1 ILE A 101 -4.149 10.093 -0.337 1.00 0.00 C ATOM 0 H ILE A 101 -5.577 11.865 -1.752 1.00 0.00 H new ATOM 0 HA ILE A 101 -4.687 10.184 -3.896 1.00 0.00 H new ATOM 0 HB ILE A 101 -6.524 9.755 -1.530 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -4.656 8.092 -0.868 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -3.665 8.923 -2.051 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -6.449 7.331 -2.078 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -7.246 8.294 -3.344 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -5.578 7.721 -3.580 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -3.251 9.782 0.197 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -3.965 11.047 -0.831 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -4.971 10.203 0.370 1.00 0.00 H new ATOM 1547 N THR A 102 -6.637 10.207 -5.373 1.00 0.00 N ATOM 1548 CA THR A 102 -7.691 10.166 -6.338 1.00 0.00 C ATOM 1549 C THR A 102 -7.515 8.871 -7.098 1.00 0.00 C ATOM 1550 O THR A 102 -6.513 8.163 -6.851 1.00 0.00 O ATOM 1551 CB THR A 102 -7.610 11.365 -7.320 1.00 0.00 C ATOM 1552 OG1 THR A 102 -6.273 11.522 -7.817 1.00 0.00 O ATOM 1553 CG2 THR A 102 -8.092 12.659 -6.684 1.00 0.00 C ATOM 0 H THR A 102 -5.745 9.876 -5.741 1.00 0.00 H new ATOM 0 HA THR A 102 -8.661 10.225 -5.845 1.00 0.00 H new ATOM 0 HB THR A 102 -8.276 11.143 -8.154 1.00 0.00 H new ATOM 0 HG1 THR A 102 -6.241 12.281 -8.436 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.017 13.470 -7.408 1.00 0.00 H new ATOM 0 HG22 THR A 102 -9.130 12.546 -6.371 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.475 12.890 -5.816 1.00 0.00 H new ATOM 1561 N PHE A 103 -8.435 8.547 -8.001 1.00 0.00 N ATOM 1562 CA PHE A 103 -8.320 7.324 -8.810 1.00 0.00 C ATOM 1563 C PHE A 103 -7.016 7.305 -9.523 1.00 0.00 C ATOM 1564 O PHE A 103 -6.181 6.439 -9.323 1.00 0.00 O ATOM 1565 CB PHE A 103 -9.429 7.252 -9.891 1.00 0.00 C ATOM 1566 CG PHE A 103 -9.252 6.127 -10.923 1.00 0.00 C ATOM 1567 CD1 PHE A 103 -9.753 4.840 -10.710 1.00 0.00 C ATOM 1568 CD2 PHE A 103 -8.563 6.372 -12.130 1.00 0.00 C ATOM 1569 CE1 PHE A 103 -9.574 3.870 -11.667 1.00 0.00 C ATOM 1570 CE2 PHE A 103 -8.401 5.378 -13.061 1.00 0.00 C ATOM 1571 CZ PHE A 103 -8.916 4.131 -12.823 1.00 0.00 C ATOM 0 H PHE A 103 -9.266 9.106 -8.195 1.00 0.00 H new ATOM 0 HA PHE A 103 -8.412 6.481 -8.125 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -10.391 7.123 -9.396 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -9.466 8.206 -10.417 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -10.279 4.608 -9.796 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -8.158 7.355 -12.323 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -9.966 2.879 -11.494 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -7.869 5.578 -13.979 1.00 0.00 H new ATOM 0 HZ PHE A 103 -8.797 3.351 -13.561 1.00 0.00 H new ATOM 1581 N GLU A 104 -6.874 8.296 -10.334 1.00 0.00 N ATOM 1582 CA GLU A 104 -5.862 8.477 -11.240 1.00 0.00 C ATOM 1583 C GLU A 104 -4.519 8.560 -10.573 1.00 0.00 C ATOM 1584 O GLU A 104 -3.559 7.989 -11.065 1.00 0.00 O ATOM 1585 CB GLU A 104 -6.249 9.732 -11.854 1.00 0.00 C ATOM 1586 CG GLU A 104 -5.524 10.141 -13.002 1.00 0.00 C ATOM 1587 CD GLU A 104 -5.706 9.234 -14.178 1.00 0.00 C ATOM 1588 OE1 GLU A 104 -6.848 8.876 -14.498 1.00 0.00 O ATOM 1589 OE2 GLU A 104 -4.708 8.868 -14.812 1.00 0.00 O ATOM 0 H GLU A 104 -7.548 9.061 -10.358 1.00 0.00 H new ATOM 0 HA GLU A 104 -5.746 7.657 -11.949 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -7.302 9.665 -12.126 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -6.163 10.517 -11.102 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -5.835 11.148 -13.279 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -4.464 10.192 -12.753 1.00 0.00 H new ATOM 1596 N ALA A 105 -4.472 9.227 -9.445 1.00 0.00 N ATOM 1597 CA ALA A 105 -3.249 9.379 -8.705 1.00 0.00 C ATOM 1598 C ALA A 105 -2.730 8.015 -8.239 1.00 0.00 C ATOM 1599 O ALA A 105 -1.551 7.697 -8.393 1.00 0.00 O ATOM 1600 CB ALA A 105 -3.451 10.311 -7.525 1.00 0.00 C ATOM 0 H ALA A 105 -5.281 9.678 -9.017 1.00 0.00 H new ATOM 0 HA ALA A 105 -2.501 9.822 -9.363 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -2.514 10.413 -6.977 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -3.770 11.289 -7.885 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -4.215 9.901 -6.864 1.00 0.00 H new ATOM 1606 N ILE A 106 -3.632 7.207 -7.714 1.00 0.00 N ATOM 1607 CA ILE A 106 -3.291 5.881 -7.227 1.00 0.00 C ATOM 1608 C ILE A 106 -3.013 4.964 -8.375 1.00 0.00 C ATOM 1609 O ILE A 106 -2.068 4.203 -8.343 1.00 0.00 O ATOM 1610 CB ILE A 106 -4.417 5.302 -6.344 1.00 0.00 C ATOM 1611 CG1 ILE A 106 -4.620 6.195 -5.139 1.00 0.00 C ATOM 1612 CG2 ILE A 106 -4.143 3.862 -5.916 1.00 0.00 C ATOM 1613 CD1 ILE A 106 -3.351 6.470 -4.352 1.00 0.00 C ATOM 0 H ILE A 106 -4.618 7.449 -7.613 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.393 5.968 -6.615 1.00 0.00 H new ATOM 0 HB ILE A 106 -5.330 5.276 -6.939 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -5.043 7.144 -5.470 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -5.353 5.733 -4.477 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -4.966 3.504 -5.297 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -4.052 3.231 -6.800 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -3.215 3.822 -5.345 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -3.581 7.117 -3.505 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -2.937 5.529 -3.988 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -2.622 6.962 -4.997 1.00 0.00 H new ATOM 1625 N LYS A 107 -3.831 5.078 -9.390 1.00 0.00 N ATOM 1626 CA LYS A 107 -3.713 4.311 -10.617 1.00 0.00 C ATOM 1627 C LYS A 107 -2.331 4.516 -11.191 1.00 0.00 C ATOM 1628 O LYS A 107 -1.624 3.571 -11.470 1.00 0.00 O ATOM 1629 CB LYS A 107 -4.739 4.820 -11.641 1.00 0.00 C ATOM 1630 CG LYS A 107 -4.784 4.040 -12.951 1.00 0.00 C ATOM 1631 CD LYS A 107 -4.939 4.954 -14.162 1.00 0.00 C ATOM 1632 CE LYS A 107 -3.681 5.787 -14.388 1.00 0.00 C ATOM 1633 NZ LYS A 107 -3.737 6.559 -15.638 1.00 0.00 N ATOM 0 H LYS A 107 -4.621 5.723 -9.392 1.00 0.00 H new ATOM 0 HA LYS A 107 -3.889 3.257 -10.404 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -5.729 4.793 -11.185 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -4.520 5.864 -11.865 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -3.870 3.455 -13.055 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -5.614 3.334 -12.923 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -5.146 4.355 -15.049 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -5.794 5.614 -14.016 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -3.545 6.469 -13.549 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -2.812 5.129 -14.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -2.783 6.626 -16.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -4.370 6.083 -16.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -4.097 7.514 -15.440 1.00 0.00 H new ATOM 1647 N ALA A 108 -1.972 5.769 -11.333 1.00 0.00 N ATOM 1648 CA ALA A 108 -0.662 6.154 -11.886 1.00 0.00 C ATOM 1649 C ALA A 108 0.488 5.600 -11.042 1.00 0.00 C ATOM 1650 O ALA A 108 1.509 5.146 -11.578 1.00 0.00 O ATOM 1651 CB ALA A 108 -0.551 7.670 -12.005 1.00 0.00 C ATOM 0 H ALA A 108 -2.564 6.559 -11.075 1.00 0.00 H new ATOM 0 HA ALA A 108 -0.586 5.719 -12.882 1.00 0.00 H new ATOM 0 HB1 ALA A 108 0.424 7.932 -12.415 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -1.335 8.041 -12.665 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -0.663 8.122 -11.019 1.00 0.00 H new ATOM 1657 N PHE A 109 0.299 5.625 -9.740 1.00 0.00 N ATOM 1658 CA PHE A 109 1.267 5.141 -8.795 1.00 0.00 C ATOM 1659 C PHE A 109 1.404 3.609 -8.887 1.00 0.00 C ATOM 1660 O PHE A 109 2.465 3.106 -9.186 1.00 0.00 O ATOM 1661 CB PHE A 109 0.862 5.582 -7.375 1.00 0.00 C ATOM 1662 CG PHE A 109 1.877 5.286 -6.313 1.00 0.00 C ATOM 1663 CD1 PHE A 109 2.936 6.155 -6.094 1.00 0.00 C ATOM 1664 CD2 PHE A 109 1.777 4.146 -5.534 1.00 0.00 C ATOM 1665 CE1 PHE A 109 3.875 5.889 -5.121 1.00 0.00 C ATOM 1666 CE2 PHE A 109 2.716 3.875 -4.563 1.00 0.00 C ATOM 1667 CZ PHE A 109 3.764 4.747 -4.357 1.00 0.00 C ATOM 0 H PHE A 109 -0.549 5.990 -9.307 1.00 0.00 H new ATOM 0 HA PHE A 109 2.242 5.568 -9.030 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.668 6.655 -7.384 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -0.074 5.091 -7.110 1.00 0.00 H new ATOM 0 HD1 PHE A 109 3.026 7.050 -6.692 1.00 0.00 H new ATOM 0 HD2 PHE A 109 0.955 3.463 -5.689 1.00 0.00 H new ATOM 0 HE1 PHE A 109 4.695 6.573 -4.958 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.631 2.980 -3.964 1.00 0.00 H new ATOM 0 HZ PHE A 109 4.500 4.535 -3.595 1.00 0.00 H new ATOM 1677 N VAL A 110 0.314 2.879 -8.691 1.00 0.00 N ATOM 1678 CA VAL A 110 0.360 1.410 -8.700 1.00 0.00 C ATOM 1679 C VAL A 110 0.856 0.892 -10.053 1.00 0.00 C ATOM 1680 O VAL A 110 1.517 -0.122 -10.117 1.00 0.00 O ATOM 1681 CB VAL A 110 -1.008 0.768 -8.381 1.00 0.00 C ATOM 1682 CG1 VAL A 110 -1.498 1.125 -7.004 1.00 0.00 C ATOM 1683 CG2 VAL A 110 -1.992 1.175 -9.388 1.00 0.00 C ATOM 0 H VAL A 110 -0.613 3.271 -8.524 1.00 0.00 H new ATOM 0 HA VAL A 110 1.056 1.122 -7.912 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.879 -0.314 -8.406 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.463 0.650 -6.827 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.780 0.777 -6.261 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.606 2.207 -6.925 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.956 0.720 -9.160 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -2.092 2.260 -9.381 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.661 0.848 -10.374 1.00 0.00 H new ATOM 1693 N ASP A 111 0.522 1.632 -11.107 1.00 0.00 N ATOM 1694 CA ASP A 111 0.950 1.370 -12.492 1.00 0.00 C ATOM 1695 C ASP A 111 2.437 1.371 -12.552 1.00 0.00 C ATOM 1696 O ASP A 111 3.062 0.416 -12.983 1.00 0.00 O ATOM 1697 CB ASP A 111 0.465 2.510 -13.374 1.00 0.00 C ATOM 1698 CG ASP A 111 0.782 2.357 -14.845 1.00 0.00 C ATOM 1699 OD1 ASP A 111 1.845 2.836 -15.291 1.00 0.00 O ATOM 1700 OD2 ASP A 111 -0.066 1.826 -15.605 1.00 0.00 O ATOM 0 H ASP A 111 -0.072 2.457 -11.026 1.00 0.00 H new ATOM 0 HA ASP A 111 0.548 0.412 -12.822 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -0.615 2.606 -13.258 1.00 0.00 H new ATOM 0 HB3 ASP A 111 0.908 3.440 -13.017 1.00 0.00 H new ATOM 1705 N ASP A 112 2.982 2.454 -12.061 1.00 0.00 N ATOM 1706 CA ASP A 112 4.422 2.700 -12.041 1.00 0.00 C ATOM 1707 C ASP A 112 5.069 1.611 -11.226 1.00 0.00 C ATOM 1708 O ASP A 112 6.034 1.014 -11.627 1.00 0.00 O ATOM 1709 CB ASP A 112 4.688 4.111 -11.452 1.00 0.00 C ATOM 1710 CG ASP A 112 6.006 4.779 -11.738 1.00 0.00 C ATOM 1711 OD1 ASP A 112 6.161 5.312 -12.843 1.00 0.00 O ATOM 1712 OD2 ASP A 112 6.872 4.866 -10.889 1.00 0.00 O ATOM 0 H ASP A 112 2.436 3.212 -11.653 1.00 0.00 H new ATOM 0 HA ASP A 112 4.848 2.680 -13.044 1.00 0.00 H new ATOM 0 HB2 ASP A 112 3.898 4.772 -11.809 1.00 0.00 H new ATOM 0 HB3 ASP A 112 4.581 4.042 -10.369 1.00 0.00 H new ATOM 1717 N PHE A 113 4.475 1.298 -10.122 1.00 0.00 N ATOM 1718 CA PHE A 113 4.951 0.238 -9.253 1.00 0.00 C ATOM 1719 C PHE A 113 4.989 -1.118 -9.963 1.00 0.00 C ATOM 1720 O PHE A 113 6.058 -1.696 -10.155 1.00 0.00 O ATOM 1721 CB PHE A 113 4.075 0.173 -7.988 1.00 0.00 C ATOM 1722 CG PHE A 113 3.954 -1.173 -7.358 1.00 0.00 C ATOM 1723 CD1 PHE A 113 5.036 -1.782 -6.771 1.00 0.00 C ATOM 1724 CD2 PHE A 113 2.756 -1.860 -7.429 1.00 0.00 C ATOM 1725 CE1 PHE A 113 4.925 -3.043 -6.260 1.00 0.00 C ATOM 1726 CE2 PHE A 113 2.649 -3.120 -6.935 1.00 0.00 C ATOM 1727 CZ PHE A 113 3.728 -3.713 -6.350 1.00 0.00 C ATOM 0 H PHE A 113 3.636 1.767 -9.782 1.00 0.00 H new ATOM 0 HA PHE A 113 5.977 0.470 -8.969 1.00 0.00 H new ATOM 0 HB2 PHE A 113 4.481 0.865 -7.250 1.00 0.00 H new ATOM 0 HB3 PHE A 113 3.076 0.527 -8.241 1.00 0.00 H new ATOM 0 HD1 PHE A 113 5.980 -1.260 -6.713 1.00 0.00 H new ATOM 0 HD2 PHE A 113 1.896 -1.389 -7.882 1.00 0.00 H new ATOM 0 HE1 PHE A 113 5.775 -3.513 -5.787 1.00 0.00 H new ATOM 0 HE2 PHE A 113 1.711 -3.651 -7.005 1.00 0.00 H new ATOM 0 HZ PHE A 113 3.642 -4.715 -5.955 1.00 0.00 H new ATOM 1737 N VAL A 114 3.827 -1.588 -10.345 1.00 0.00 N ATOM 1738 CA VAL A 114 3.657 -2.906 -10.947 1.00 0.00 C ATOM 1739 C VAL A 114 4.385 -3.023 -12.297 1.00 0.00 C ATOM 1740 O VAL A 114 4.678 -4.114 -12.758 1.00 0.00 O ATOM 1741 CB VAL A 114 2.141 -3.282 -11.080 1.00 0.00 C ATOM 1742 CG1 VAL A 114 1.424 -2.457 -12.136 1.00 0.00 C ATOM 1743 CG2 VAL A 114 1.940 -4.772 -11.295 1.00 0.00 C ATOM 0 H VAL A 114 2.956 -1.066 -10.249 1.00 0.00 H new ATOM 0 HA VAL A 114 4.120 -3.627 -10.273 1.00 0.00 H new ATOM 0 HB VAL A 114 1.680 -3.030 -10.125 1.00 0.00 H new ATOM 0 HG11 VAL A 114 0.378 -2.759 -12.185 1.00 0.00 H new ATOM 0 HG12 VAL A 114 1.485 -1.400 -11.875 1.00 0.00 H new ATOM 0 HG13 VAL A 114 1.895 -2.619 -13.106 1.00 0.00 H new ATOM 0 HG21 VAL A 114 0.875 -4.987 -11.382 1.00 0.00 H new ATOM 0 HG22 VAL A 114 2.448 -5.079 -12.209 1.00 0.00 H new ATOM 0 HG23 VAL A 114 2.353 -5.321 -10.449 1.00 0.00 H new ATOM 1753 N ALA A 115 4.672 -1.899 -12.926 1.00 0.00 N ATOM 1754 CA ALA A 115 5.422 -1.920 -14.173 1.00 0.00 C ATOM 1755 C ALA A 115 6.894 -2.140 -13.885 1.00 0.00 C ATOM 1756 O ALA A 115 7.601 -2.816 -14.641 1.00 0.00 O ATOM 1757 CB ALA A 115 5.231 -0.632 -14.947 1.00 0.00 C ATOM 0 H ALA A 115 4.403 -0.970 -12.602 1.00 0.00 H new ATOM 0 HA ALA A 115 5.046 -2.741 -14.784 1.00 0.00 H new ATOM 0 HB1 ALA A 115 5.803 -0.676 -15.874 1.00 0.00 H new ATOM 0 HB2 ALA A 115 4.174 -0.500 -15.179 1.00 0.00 H new ATOM 0 HB3 ALA A 115 5.578 0.208 -14.346 1.00 0.00 H new ATOM 1763 N GLY A 116 7.342 -1.583 -12.786 1.00 0.00 N ATOM 1764 CA GLY A 116 8.732 -1.692 -12.407 1.00 0.00 C ATOM 1765 C GLY A 116 9.362 -0.355 -12.548 1.00 0.00 C ATOM 1766 O GLY A 116 10.543 -0.216 -12.846 1.00 0.00 O ATOM 0 H GLY A 116 6.764 -1.049 -12.137 1.00 0.00 H new ATOM 0 HA2 GLY A 116 8.818 -2.046 -11.380 1.00 0.00 H new ATOM 0 HA3 GLY A 116 9.241 -2.420 -13.039 1.00 0.00 H new ATOM 1770 N LYS A 117 8.540 0.629 -12.343 1.00 0.00 N ATOM 1771 CA LYS A 117 8.885 1.989 -12.487 1.00 0.00 C ATOM 1772 C LYS A 117 9.112 2.594 -11.120 1.00 0.00 C ATOM 1773 O LYS A 117 10.100 3.308 -10.908 1.00 0.00 O ATOM 1774 CB LYS A 117 7.805 2.717 -13.313 1.00 0.00 C ATOM 1775 CG LYS A 117 8.303 3.234 -14.665 1.00 0.00 C ATOM 1776 CD LYS A 117 7.237 4.007 -15.449 1.00 0.00 C ATOM 1777 CE LYS A 117 6.015 3.159 -15.768 1.00 0.00 C ATOM 1778 NZ LYS A 117 5.020 3.907 -16.566 1.00 0.00 N ATOM 0 H LYS A 117 7.571 0.487 -12.059 1.00 0.00 H new ATOM 0 HA LYS A 117 9.818 2.097 -13.040 1.00 0.00 H new ATOM 0 HB2 LYS A 117 6.970 2.037 -13.480 1.00 0.00 H new ATOM 0 HB3 LYS A 117 7.422 3.556 -12.733 1.00 0.00 H new ATOM 0 HG2 LYS A 117 9.165 3.881 -14.503 1.00 0.00 H new ATOM 0 HG3 LYS A 117 8.645 2.391 -15.265 1.00 0.00 H new ATOM 0 HD2 LYS A 117 6.929 4.879 -14.873 1.00 0.00 H new ATOM 0 HD3 LYS A 117 7.671 4.376 -16.378 1.00 0.00 H new ATOM 0 HE2 LYS A 117 6.324 2.268 -16.315 1.00 0.00 H new ATOM 0 HE3 LYS A 117 5.556 2.820 -14.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 4.202 3.295 -16.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 4.706 4.744 -16.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 5.451 4.209 -17.463 1.00 0.00 H new ATOM 1792 N ILE A 118 8.217 2.309 -10.180 1.00 0.00 N ATOM 1793 CA ILE A 118 8.470 2.706 -8.811 1.00 0.00 C ATOM 1794 C ILE A 118 9.486 1.743 -8.254 1.00 0.00 C ATOM 1795 O ILE A 118 9.467 0.546 -8.572 1.00 0.00 O ATOM 1796 CB ILE A 118 7.201 2.690 -7.907 1.00 0.00 C ATOM 1797 CG1 ILE A 118 6.122 3.508 -8.511 1.00 0.00 C ATOM 1798 CG2 ILE A 118 7.484 3.269 -6.561 1.00 0.00 C ATOM 1799 CD1 ILE A 118 4.891 3.640 -7.686 1.00 0.00 C ATOM 0 H ILE A 118 7.337 1.819 -10.338 1.00 0.00 H new ATOM 0 HA ILE A 118 8.822 3.738 -8.816 1.00 0.00 H new ATOM 0 HB ILE A 118 6.898 1.647 -7.813 1.00 0.00 H new ATOM 0 HG12 ILE A 118 6.513 4.505 -8.713 1.00 0.00 H new ATOM 0 HG13 ILE A 118 5.851 3.071 -9.472 1.00 0.00 H new ATOM 0 HG21 ILE A 118 6.578 3.243 -5.956 1.00 0.00 H new ATOM 0 HG22 ILE A 118 8.265 2.687 -6.071 1.00 0.00 H new ATOM 0 HG23 ILE A 118 7.817 4.301 -6.672 1.00 0.00 H new ATOM 0 HD11 ILE A 118 4.163 4.256 -8.214 1.00 0.00 H new ATOM 0 HD12 ILE A 118 4.467 2.652 -7.504 1.00 0.00 H new ATOM 0 HD13 ILE A 118 5.140 4.109 -6.734 1.00 0.00 H new ATOM 1811 N GLU A 119 10.354 2.245 -7.470 1.00 0.00 N ATOM 1812 CA GLU A 119 11.420 1.474 -6.918 1.00 0.00 C ATOM 1813 C GLU A 119 11.371 1.591 -5.399 1.00 0.00 C ATOM 1814 O GLU A 119 10.591 2.414 -4.896 1.00 0.00 O ATOM 1815 CB GLU A 119 12.749 1.972 -7.502 1.00 0.00 C ATOM 1816 CG GLU A 119 13.084 3.425 -7.205 1.00 0.00 C ATOM 1817 CD GLU A 119 14.429 3.803 -7.750 1.00 0.00 C ATOM 1818 OE1 GLU A 119 14.541 4.092 -8.962 1.00 0.00 O ATOM 1819 OE2 GLU A 119 15.417 3.770 -6.994 1.00 0.00 O ATOM 0 H GLU A 119 10.354 3.223 -7.180 1.00 0.00 H new ATOM 0 HA GLU A 119 11.323 0.419 -7.175 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.554 1.345 -7.118 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.726 1.835 -8.583 1.00 0.00 H new ATOM 0 HG2 GLU A 119 12.320 4.071 -7.638 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.068 3.590 -6.128 1.00 0.00 H new ATOM 1826 N PRO A 120 12.119 0.729 -4.644 1.00 0.00 N ATOM 1827 CA PRO A 120 12.198 0.790 -3.180 1.00 0.00 C ATOM 1828 C PRO A 120 12.244 2.216 -2.639 1.00 0.00 C ATOM 1829 O PRO A 120 13.152 2.987 -2.956 1.00 0.00 O ATOM 1830 CB PRO A 120 13.506 0.066 -2.888 1.00 0.00 C ATOM 1831 CG PRO A 120 13.565 -0.998 -3.924 1.00 0.00 C ATOM 1832 CD PRO A 120 12.918 -0.417 -5.162 1.00 0.00 C ATOM 0 HA PRO A 120 11.320 0.351 -2.706 1.00 0.00 H new ATOM 0 HB2 PRO A 120 14.360 0.740 -2.958 1.00 0.00 H new ATOM 0 HB3 PRO A 120 13.514 -0.355 -1.882 1.00 0.00 H new ATOM 0 HG2 PRO A 120 14.596 -1.290 -4.124 1.00 0.00 H new ATOM 0 HG3 PRO A 120 13.039 -1.893 -3.593 1.00 0.00 H new ATOM 0 HD2 PRO A 120 13.664 -0.089 -5.886 1.00 0.00 H new ATOM 0 HD3 PRO A 120 12.286 -1.150 -5.664 1.00 0.00 H new ATOM 1840 N SER A 121 11.235 2.551 -1.849 1.00 0.00 N ATOM 1841 CA SER A 121 11.094 3.867 -1.281 1.00 0.00 C ATOM 1842 C SER A 121 12.294 4.172 -0.384 1.00 0.00 C ATOM 1843 O SER A 121 12.931 5.214 -0.516 1.00 0.00 O ATOM 1844 CB SER A 121 9.772 3.941 -0.502 1.00 0.00 C ATOM 1845 OG SER A 121 9.492 5.244 -0.037 1.00 0.00 O ATOM 0 H SER A 121 10.489 1.906 -1.587 1.00 0.00 H new ATOM 0 HA SER A 121 11.069 4.619 -2.070 1.00 0.00 H new ATOM 0 HB2 SER A 121 8.957 3.604 -1.143 1.00 0.00 H new ATOM 0 HB3 SER A 121 9.815 3.257 0.346 1.00 0.00 H new ATOM 0 HG SER A 121 8.642 5.242 0.450 1.00 0.00 H new ATOM 1851 N ILE A 122 12.640 3.226 0.470 1.00 0.00 N ATOM 1852 CA ILE A 122 13.772 3.386 1.364 1.00 0.00 C ATOM 1853 C ILE A 122 14.545 2.098 1.469 1.00 0.00 C ATOM 1854 O ILE A 122 15.740 2.057 1.194 1.00 0.00 O ATOM 1855 CB ILE A 122 13.385 3.894 2.803 1.00 0.00 C ATOM 1856 CG1 ILE A 122 12.185 3.119 3.410 1.00 0.00 C ATOM 1857 CG2 ILE A 122 13.148 5.396 2.823 1.00 0.00 C ATOM 1858 CD1 ILE A 122 11.822 3.538 4.826 1.00 0.00 C ATOM 0 H ILE A 122 12.151 2.336 0.563 1.00 0.00 H new ATOM 0 HA ILE A 122 14.392 4.164 0.919 1.00 0.00 H new ATOM 0 HB ILE A 122 14.243 3.686 3.443 1.00 0.00 H new ATOM 0 HG12 ILE A 122 11.315 3.258 2.768 1.00 0.00 H new ATOM 0 HG13 ILE A 122 12.416 2.054 3.407 1.00 0.00 H new ATOM 0 HG21 ILE A 122 12.883 5.709 3.833 1.00 0.00 H new ATOM 0 HG22 ILE A 122 14.056 5.912 2.509 1.00 0.00 H new ATOM 0 HG23 ILE A 122 12.335 5.645 2.141 1.00 0.00 H new ATOM 0 HD11 ILE A 122 10.974 2.948 5.174 1.00 0.00 H new ATOM 0 HD12 ILE A 122 12.675 3.372 5.484 1.00 0.00 H new ATOM 0 HD13 ILE A 122 11.556 4.595 4.836 1.00 0.00 H new ATOM 1870 N LYS A 123 13.822 1.035 1.816 1.00 0.00 N ATOM 1871 CA LYS A 123 14.383 -0.271 2.054 1.00 0.00 C ATOM 1872 C LYS A 123 15.429 -0.181 3.164 1.00 0.00 C ATOM 1873 O LYS A 123 16.634 -0.175 2.915 1.00 0.00 O ATOM 1874 CB LYS A 123 14.938 -0.910 0.759 1.00 0.00 C ATOM 1875 CG LYS A 123 15.575 -2.274 0.945 1.00 0.00 C ATOM 1876 CD LYS A 123 16.169 -2.799 -0.350 1.00 0.00 C ATOM 1877 CE LYS A 123 16.899 -4.120 -0.133 1.00 0.00 C ATOM 1878 NZ LYS A 123 15.995 -5.209 0.303 1.00 0.00 N ATOM 0 H LYS A 123 12.810 1.070 1.939 1.00 0.00 H new ATOM 0 HA LYS A 123 13.590 -0.940 2.388 1.00 0.00 H new ATOM 0 HB2 LYS A 123 14.126 -0.999 0.038 1.00 0.00 H new ATOM 0 HB3 LYS A 123 15.677 -0.236 0.326 1.00 0.00 H new ATOM 0 HG2 LYS A 123 16.355 -2.211 1.704 1.00 0.00 H new ATOM 0 HG3 LYS A 123 14.828 -2.977 1.314 1.00 0.00 H new ATOM 0 HD2 LYS A 123 15.377 -2.936 -1.086 1.00 0.00 H new ATOM 0 HD3 LYS A 123 16.860 -2.063 -0.760 1.00 0.00 H new ATOM 0 HE2 LYS A 123 17.394 -4.413 -1.059 1.00 0.00 H new ATOM 0 HE3 LYS A 123 17.680 -3.980 0.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 16.560 -6.025 0.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.405 -4.876 1.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.385 -5.492 -0.490 1.00 0.00 H new ATOM 1892 N SER A 124 14.951 -0.003 4.373 1.00 0.00 N ATOM 1893 CA SER A 124 15.813 0.117 5.507 1.00 0.00 C ATOM 1894 C SER A 124 16.258 -1.263 5.961 1.00 0.00 C ATOM 1895 O SER A 124 15.584 -1.932 6.752 1.00 0.00 O ATOM 1896 CB SER A 124 15.107 0.873 6.622 1.00 0.00 C ATOM 1897 OG SER A 124 14.562 2.096 6.130 1.00 0.00 O ATOM 0 H SER A 124 13.956 0.061 4.590 1.00 0.00 H new ATOM 0 HA SER A 124 16.702 0.685 5.233 1.00 0.00 H new ATOM 0 HB2 SER A 124 14.312 0.256 7.041 1.00 0.00 H new ATOM 0 HB3 SER A 124 15.809 1.080 7.430 1.00 0.00 H new ATOM 0 HG SER A 124 14.110 2.569 6.859 1.00 0.00 H new ATOM 1903 N GLU A 125 17.329 -1.699 5.371 1.00 0.00 N ATOM 1904 CA GLU A 125 17.935 -2.968 5.626 1.00 0.00 C ATOM 1905 C GLU A 125 19.428 -2.741 5.569 1.00 0.00 C ATOM 1906 O GLU A 125 20.023 -2.723 4.486 1.00 0.00 O ATOM 1907 CB GLU A 125 17.499 -4.018 4.576 1.00 0.00 C ATOM 1908 CG GLU A 125 16.030 -4.436 4.661 1.00 0.00 C ATOM 1909 CD GLU A 125 15.589 -5.278 3.489 1.00 0.00 C ATOM 1910 OE1 GLU A 125 16.008 -6.454 3.369 1.00 0.00 O ATOM 1911 OE2 GLU A 125 14.813 -4.777 2.649 1.00 0.00 O ATOM 0 H GLU A 125 17.826 -1.154 4.667 1.00 0.00 H new ATOM 0 HA GLU A 125 17.629 -3.358 6.597 1.00 0.00 H new ATOM 0 HB2 GLU A 125 17.692 -3.618 3.581 1.00 0.00 H new ATOM 0 HB3 GLU A 125 18.122 -4.905 4.689 1.00 0.00 H new ATOM 0 HG2 GLU A 125 15.869 -4.994 5.583 1.00 0.00 H new ATOM 0 HG3 GLU A 125 15.406 -3.544 4.716 1.00 0.00 H new ATOM 1918 N PRO A 126 20.051 -2.498 6.714 1.00 0.00 N ATOM 1919 CA PRO A 126 21.456 -2.144 6.768 1.00 0.00 C ATOM 1920 C PRO A 126 22.358 -3.350 6.569 1.00 0.00 C ATOM 1921 O PRO A 126 21.888 -4.480 6.445 1.00 0.00 O ATOM 1922 CB PRO A 126 21.601 -1.571 8.172 1.00 0.00 C ATOM 1923 CG PRO A 126 20.617 -2.335 8.982 1.00 0.00 C ATOM 1924 CD PRO A 126 19.446 -2.580 8.068 1.00 0.00 C ATOM 0 HA PRO A 126 21.749 -1.451 5.979 1.00 0.00 H new ATOM 0 HB2 PRO A 126 22.615 -1.700 8.552 1.00 0.00 H new ATOM 0 HB3 PRO A 126 21.387 -0.502 8.190 1.00 0.00 H new ATOM 0 HG2 PRO A 126 21.043 -3.274 9.334 1.00 0.00 H new ATOM 0 HG3 PRO A 126 20.314 -1.772 9.865 1.00 0.00 H new ATOM 0 HD2 PRO A 126 18.991 -3.554 8.248 1.00 0.00 H new ATOM 0 HD3 PRO A 126 18.664 -1.833 8.206 1.00 0.00 H new ATOM 1932 N ILE A 127 23.634 -3.122 6.519 1.00 0.00 N ATOM 1933 CA ILE A 127 24.565 -4.205 6.354 1.00 0.00 C ATOM 1934 C ILE A 127 25.501 -4.301 7.572 1.00 0.00 C ATOM 1935 O ILE A 127 26.550 -3.644 7.642 1.00 0.00 O ATOM 1936 CB ILE A 127 25.339 -4.117 4.999 1.00 0.00 C ATOM 1937 CG1 ILE A 127 26.368 -5.252 4.875 1.00 0.00 C ATOM 1938 CG2 ILE A 127 25.976 -2.735 4.790 1.00 0.00 C ATOM 1939 CD1 ILE A 127 27.097 -5.273 3.553 1.00 0.00 C ATOM 0 H ILE A 127 24.059 -2.197 6.590 1.00 0.00 H new ATOM 0 HA ILE A 127 23.998 -5.135 6.305 1.00 0.00 H new ATOM 0 HB ILE A 127 24.612 -4.247 4.197 1.00 0.00 H new ATOM 0 HG12 ILE A 127 27.097 -5.158 5.680 1.00 0.00 H new ATOM 0 HG13 ILE A 127 25.861 -6.207 5.014 1.00 0.00 H new ATOM 0 HG21 ILE A 127 26.504 -2.718 3.836 1.00 0.00 H new ATOM 0 HG22 ILE A 127 25.197 -1.972 4.787 1.00 0.00 H new ATOM 0 HG23 ILE A 127 26.680 -2.533 5.598 1.00 0.00 H new ATOM 0 HD11 ILE A 127 27.806 -6.101 3.541 1.00 0.00 H new ATOM 0 HD12 ILE A 127 26.378 -5.399 2.743 1.00 0.00 H new ATOM 0 HD13 ILE A 127 27.634 -4.334 3.419 1.00 0.00 H new ATOM 1951 N PRO A 128 25.076 -5.025 8.603 1.00 0.00 N ATOM 1952 CA PRO A 128 25.845 -5.179 9.792 1.00 0.00 C ATOM 1953 C PRO A 128 26.677 -6.446 9.784 1.00 0.00 C ATOM 1954 O PRO A 128 26.451 -7.369 8.981 1.00 0.00 O ATOM 1955 CB PRO A 128 24.767 -5.260 10.865 1.00 0.00 C ATOM 1956 CG PRO A 128 23.628 -5.962 10.198 1.00 0.00 C ATOM 1957 CD PRO A 128 23.781 -5.723 8.713 1.00 0.00 C ATOM 0 HA PRO A 128 26.566 -4.373 9.932 1.00 0.00 H new ATOM 0 HB2 PRO A 128 25.116 -5.811 11.738 1.00 0.00 H new ATOM 0 HB3 PRO A 128 24.475 -4.268 11.210 1.00 0.00 H new ATOM 0 HG2 PRO A 128 23.646 -7.029 10.422 1.00 0.00 H new ATOM 0 HG3 PRO A 128 22.673 -5.577 10.556 1.00 0.00 H new ATOM 0 HD2 PRO A 128 23.782 -6.659 8.155 1.00 0.00 H new ATOM 0 HD3 PRO A 128 22.965 -5.118 8.319 1.00 0.00 H new ATOM 1965 N GLU A 129 27.612 -6.490 10.658 1.00 0.00 N ATOM 1966 CA GLU A 129 28.431 -7.652 10.837 1.00 0.00 C ATOM 1967 C GLU A 129 28.323 -8.119 12.277 1.00 0.00 C ATOM 1968 O GLU A 129 28.445 -7.310 13.209 1.00 0.00 O ATOM 1969 CB GLU A 129 29.897 -7.387 10.444 1.00 0.00 C ATOM 1970 CG GLU A 129 30.575 -6.265 11.216 1.00 0.00 C ATOM 1971 CD GLU A 129 32.039 -6.164 10.907 1.00 0.00 C ATOM 1972 OE1 GLU A 129 32.830 -6.934 11.485 1.00 0.00 O ATOM 1973 OE2 GLU A 129 32.436 -5.309 10.083 1.00 0.00 O ATOM 0 H GLU A 129 27.841 -5.716 11.282 1.00 0.00 H new ATOM 0 HA GLU A 129 28.071 -8.439 10.174 1.00 0.00 H new ATOM 0 HB2 GLU A 129 30.468 -8.304 10.588 1.00 0.00 H new ATOM 0 HB3 GLU A 129 29.936 -7.151 9.380 1.00 0.00 H new ATOM 0 HG2 GLU A 129 30.090 -5.318 10.978 1.00 0.00 H new ATOM 0 HG3 GLU A 129 30.442 -6.431 12.285 1.00 0.00 H new ATOM 1980 N LYS A 130 28.005 -9.397 12.450 1.00 0.00 N ATOM 1981 CA LYS A 130 27.917 -10.057 13.772 1.00 0.00 C ATOM 1982 C LYS A 130 26.832 -9.448 14.675 1.00 0.00 C ATOM 1983 O LYS A 130 26.850 -9.646 15.901 1.00 0.00 O ATOM 1984 CB LYS A 130 29.279 -10.031 14.498 1.00 0.00 C ATOM 1985 CG LYS A 130 30.406 -10.747 13.773 1.00 0.00 C ATOM 1986 CD LYS A 130 30.105 -12.222 13.568 1.00 0.00 C ATOM 1987 CE LYS A 130 31.272 -12.922 12.901 1.00 0.00 C ATOM 1988 NZ LYS A 130 30.998 -14.348 12.662 1.00 0.00 N ATOM 0 H LYS A 130 27.796 -10.023 11.672 1.00 0.00 H new ATOM 0 HA LYS A 130 27.633 -11.091 13.574 1.00 0.00 H new ATOM 0 HB2 LYS A 130 29.570 -8.992 14.655 1.00 0.00 H new ATOM 0 HB3 LYS A 130 29.157 -10.481 15.483 1.00 0.00 H new ATOM 0 HG2 LYS A 130 30.573 -10.273 12.806 1.00 0.00 H new ATOM 0 HG3 LYS A 130 31.329 -10.641 14.343 1.00 0.00 H new ATOM 0 HD2 LYS A 130 29.894 -12.692 14.529 1.00 0.00 H new ATOM 0 HD3 LYS A 130 29.210 -12.333 12.956 1.00 0.00 H new ATOM 0 HE2 LYS A 130 31.494 -12.432 11.953 1.00 0.00 H new ATOM 0 HE3 LYS A 130 32.159 -12.823 13.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 31.822 -14.788 12.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 30.811 -14.822 13.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 30.167 -14.443 12.044 1.00 0.00 H new ATOM 2002 N GLN A 131 25.878 -8.753 14.088 1.00 0.00 N ATOM 2003 CA GLN A 131 24.821 -8.114 14.855 1.00 0.00 C ATOM 2004 C GLN A 131 23.482 -8.551 14.340 1.00 0.00 C ATOM 2005 O GLN A 131 23.395 -9.091 13.236 1.00 0.00 O ATOM 2006 CB GLN A 131 24.904 -6.588 14.784 1.00 0.00 C ATOM 2007 CG GLN A 131 26.201 -6.007 15.298 1.00 0.00 C ATOM 2008 CD GLN A 131 26.235 -4.487 15.274 1.00 0.00 C ATOM 2009 OE1 GLN A 131 25.516 -3.872 14.367 1.00 0.00 O flip ATOM 2010 NE2 GLN A 131 26.911 -3.874 16.082 1.00 0.00 N flip ATOM 0 H GLN A 131 25.811 -8.615 13.080 1.00 0.00 H new ATOM 0 HA GLN A 131 24.947 -8.416 15.895 1.00 0.00 H new ATOM 0 HB2 GLN A 131 24.766 -6.277 13.748 1.00 0.00 H new ATOM 0 HB3 GLN A 131 24.079 -6.165 15.356 1.00 0.00 H new ATOM 0 HG2 GLN A 131 26.364 -6.350 16.320 1.00 0.00 H new ATOM 0 HG3 GLN A 131 27.025 -6.391 14.697 1.00 0.00 H new ATOM 0 HE21 GLN A 131 27.460 -4.381 16.776 1.00 0.00 H new ATOM 0 HE22 GLN A 131 26.927 -2.854 16.064 1.00 0.00 H new ATOM 2019 N GLU A 132 22.458 -8.298 15.138 1.00 0.00 N ATOM 2020 CA GLU A 132 21.063 -8.607 14.831 1.00 0.00 C ATOM 2021 C GLU A 132 20.794 -10.101 14.817 1.00 0.00 C ATOM 2022 O GLU A 132 21.313 -10.852 13.980 1.00 0.00 O ATOM 2023 CB GLU A 132 20.565 -7.935 13.556 1.00 0.00 C ATOM 2024 CG GLU A 132 20.650 -6.415 13.592 1.00 0.00 C ATOM 2025 CD GLU A 132 20.093 -5.772 12.354 1.00 0.00 C ATOM 2026 OE1 GLU A 132 18.861 -5.842 12.143 1.00 0.00 O ATOM 2027 OE2 GLU A 132 20.856 -5.155 11.591 1.00 0.00 O ATOM 0 H GLU A 132 22.575 -7.857 16.050 1.00 0.00 H new ATOM 0 HA GLU A 132 20.483 -8.180 15.649 1.00 0.00 H new ATOM 0 HB2 GLU A 132 21.147 -8.303 12.711 1.00 0.00 H new ATOM 0 HB3 GLU A 132 19.530 -8.228 13.382 1.00 0.00 H new ATOM 0 HG2 GLU A 132 20.108 -6.046 14.463 1.00 0.00 H new ATOM 0 HG3 GLU A 132 21.691 -6.117 13.714 1.00 0.00 H new ATOM 2034 N GLY A 133 19.975 -10.513 15.728 1.00 0.00 N ATOM 2035 CA GLY A 133 19.675 -11.895 15.908 1.00 0.00 C ATOM 2036 C GLY A 133 19.615 -12.219 17.370 1.00 0.00 C ATOM 2037 O GLY A 133 20.652 -12.555 17.955 1.00 0.00 O ATOM 2038 OXT GLY A 133 18.531 -12.104 17.971 1.00 0.00 O ATOM 0 H GLY A 133 19.490 -9.892 16.376 1.00 0.00 H new ATOM 0 HA2 GLY A 133 18.723 -12.134 15.435 1.00 0.00 H new ATOM 0 HA3 GLY A 133 20.435 -12.507 15.422 1.00 0.00 H new TER 2042 GLY A 133