USER MOD reduce.3.24.130724 H: found=0, std=0, add=929, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 925 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 53 SER OG : rot -140:sc= -0.125 USER MOD Set 1.2: A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 75 THR OG1 : rot -132:sc= -1.26 USER MOD Set 2.2: A 76 HIS : no HD1:sc= -1.78 K(o=-3,f=-1.1) USER MOD Set 3.1: A 40 HIS : no HD1:sc= -5.7! C(o=-8.3!,f=-9.9!) USER MOD Set 3.2: A 60 MET CE :methyl -148:sc= -2.63 (180deg=-5.05!) USER MOD Single : A 1 GLY N :NH3+ -120:sc= 0.139 (180deg=0) USER MOD Single : A 2 SER OG : rot 23:sc= 0.07 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 37:sc= 0.361 USER MOD Single : A 6 SER OG : rot 180:sc= 0.00727 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 LYS NZ :NH3+ -164:sc= 0.0364 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= 0.188 K(o=0.19,f=-2.2!) USER MOD Single : A 13 SER OG : rot 46:sc= 0.459 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.326 K(o=-0.33,f=-1.6!) USER MOD Single : A 21 ASN : amide:sc= -0.775 K(o=-0.77,f=-2.4!) USER MOD Single : A 22 TYR OH : rot -90:sc= 0.971 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= -0.0363 USER MOD Single : A 26 GLN : amide:sc= -0.0369 K(o=-0.037,f=-0.73) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot -74:sc= 1.06 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= 0.874 K(o=0.87,f=-13!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= -0.282 USER MOD Single : A 64 ASN : amide:sc= -1.85 K(o=-1.9,f=-0.8) USER MOD Single : A 70 MET CE :methyl 138:sc= -1.24 (180deg=-2.89!) USER MOD Single : A 73 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.012) USER MOD Single : A 79 ASN : amide:sc= -1.58 K(o=-1.6,f=-12!) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0.0385 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 72:sc= 0.316 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 CYS SG : rot 180:sc= -0.0319 USER MOD Single : A 96 ASN : amide:sc= -6.4! C(o=-6.4!,f=-2.6!) USER MOD Single : A 98 SER OG : rot -140:sc= -0.591 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 ASN : amide:sc= -1.08 K(o=-1.1,f=-7.8!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.137 -26.407 7.314 1.00 0.00 N ATOM 2 CA GLY A 1 -4.173 -27.173 6.543 1.00 0.00 C ATOM 3 C GLY A 1 -2.798 -27.160 7.216 1.00 0.00 C ATOM 4 O GLY A 1 -2.626 -26.552 8.271 1.00 0.00 O ATOM 0 H1 GLY A 1 -5.921 -27.026 7.603 1.00 0.00 H new ATOM 0 H2 GLY A 1 -4.674 -26.017 8.159 1.00 0.00 H new ATOM 0 H3 GLY A 1 -5.508 -25.629 6.732 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.521 -28.201 6.438 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.094 -26.758 5.538 1.00 0.00 H new ATOM 8 N SER A 2 -1.856 -27.839 6.577 1.00 0.00 N ATOM 9 CA SER A 2 -0.503 -27.913 7.101 1.00 0.00 C ATOM 10 C SER A 2 0.503 -27.949 5.948 1.00 0.00 C ATOM 11 O SER A 2 0.776 -29.011 5.391 1.00 0.00 O ATOM 12 CB SER A 2 -0.326 -29.139 7.999 1.00 0.00 C ATOM 13 OG SER A 2 -0.803 -28.906 9.321 1.00 0.00 O ATOM 0 H SER A 2 -2.003 -28.342 5.702 1.00 0.00 H new ATOM 0 HA SER A 2 -0.321 -27.025 7.706 1.00 0.00 H new ATOM 0 HB2 SER A 2 -0.858 -29.986 7.566 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.729 -29.411 8.037 1.00 0.00 H new ATOM 0 HG SER A 2 -1.455 -28.174 9.309 1.00 0.00 H new ATOM 19 N SER A 3 1.027 -26.776 5.625 1.00 0.00 N ATOM 20 CA SER A 3 1.997 -26.660 4.549 1.00 0.00 C ATOM 21 C SER A 3 3.304 -26.074 5.084 1.00 0.00 C ATOM 22 O SER A 3 3.321 -24.962 5.611 1.00 0.00 O ATOM 23 CB SER A 3 1.454 -25.796 3.410 1.00 0.00 C ATOM 24 OG SER A 3 2.043 -26.134 2.157 1.00 0.00 O ATOM 0 H SER A 3 0.798 -25.897 6.090 1.00 0.00 H new ATOM 0 HA SER A 3 2.190 -27.657 4.152 1.00 0.00 H new ATOM 0 HB2 SER A 3 0.373 -25.917 3.347 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.645 -24.745 3.629 1.00 0.00 H new ATOM 0 HG SER A 3 1.669 -25.562 1.455 1.00 0.00 H new ATOM 30 N GLY A 4 4.369 -26.847 4.931 1.00 0.00 N ATOM 31 CA GLY A 4 5.679 -26.418 5.392 1.00 0.00 C ATOM 32 C GLY A 4 6.780 -26.909 4.450 1.00 0.00 C ATOM 33 O GLY A 4 7.393 -27.947 4.694 1.00 0.00 O ATOM 0 H GLY A 4 4.352 -27.768 4.494 1.00 0.00 H new ATOM 0 HA2 GLY A 4 5.708 -25.330 5.455 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.858 -26.800 6.397 1.00 0.00 H new ATOM 37 N SER A 5 6.997 -26.140 3.393 1.00 0.00 N ATOM 38 CA SER A 5 8.013 -26.484 2.413 1.00 0.00 C ATOM 39 C SER A 5 8.414 -25.241 1.617 1.00 0.00 C ATOM 40 O SER A 5 9.582 -24.857 1.605 1.00 0.00 O ATOM 41 CB SER A 5 7.519 -27.583 1.470 1.00 0.00 C ATOM 42 OG SER A 5 7.874 -28.883 1.932 1.00 0.00 O ATOM 0 H SER A 5 6.486 -25.280 3.194 1.00 0.00 H new ATOM 0 HA SER A 5 8.886 -26.864 2.944 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.435 -27.517 1.372 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.939 -27.424 0.477 1.00 0.00 H new ATOM 0 HG SER A 5 7.813 -28.911 2.910 1.00 0.00 H new ATOM 48 N SER A 6 7.422 -24.646 0.971 1.00 0.00 N ATOM 49 CA SER A 6 7.656 -23.454 0.174 1.00 0.00 C ATOM 50 C SER A 6 7.518 -22.205 1.047 1.00 0.00 C ATOM 51 O SER A 6 8.458 -21.420 1.168 1.00 0.00 O ATOM 52 CB SER A 6 6.690 -23.384 -1.010 1.00 0.00 C ATOM 53 OG SER A 6 5.345 -23.642 -0.617 1.00 0.00 O ATOM 0 H SER A 6 6.454 -24.967 0.983 1.00 0.00 H new ATOM 0 HA SER A 6 8.670 -23.502 -0.222 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.751 -22.397 -1.470 1.00 0.00 H new ATOM 0 HB3 SER A 6 6.992 -24.108 -1.767 1.00 0.00 H new ATOM 0 HG SER A 6 4.759 -23.586 -1.400 1.00 0.00 H new ATOM 59 N GLY A 7 6.339 -22.059 1.633 1.00 0.00 N ATOM 60 CA GLY A 7 6.066 -20.919 2.491 1.00 0.00 C ATOM 61 C GLY A 7 5.002 -20.010 1.873 1.00 0.00 C ATOM 62 O GLY A 7 3.944 -20.479 1.457 1.00 0.00 O ATOM 0 H GLY A 7 5.562 -22.711 1.530 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.730 -21.267 3.468 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.983 -20.353 2.653 1.00 0.00 H new ATOM 66 N GLN A 8 5.320 -18.724 1.831 1.00 0.00 N ATOM 67 CA GLN A 8 4.405 -17.745 1.270 1.00 0.00 C ATOM 68 C GLN A 8 5.176 -16.516 0.783 1.00 0.00 C ATOM 69 O GLN A 8 5.125 -16.175 -0.397 1.00 0.00 O ATOM 70 CB GLN A 8 3.332 -17.351 2.288 1.00 0.00 C ATOM 71 CG GLN A 8 1.930 -17.608 1.733 1.00 0.00 C ATOM 72 CD GLN A 8 0.869 -16.891 2.570 1.00 0.00 C ATOM 73 OE1 GLN A 8 0.548 -15.734 2.353 1.00 0.00 O ATOM 74 NE2 GLN A 8 0.344 -17.640 3.535 1.00 0.00 N ATOM 0 H GLN A 8 6.199 -18.338 2.176 1.00 0.00 H new ATOM 0 HA GLN A 8 3.901 -18.196 0.415 1.00 0.00 H new ATOM 0 HB2 GLN A 8 3.473 -17.918 3.208 1.00 0.00 H new ATOM 0 HB3 GLN A 8 3.438 -16.297 2.544 1.00 0.00 H new ATOM 0 HG2 GLN A 8 1.876 -17.266 0.700 1.00 0.00 H new ATOM 0 HG3 GLN A 8 1.729 -18.679 1.725 1.00 0.00 H new ATOM 0 HE21 GLN A 8 0.658 -18.602 3.662 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -0.373 -17.253 4.148 1.00 0.00 H new ATOM 83 N LYS A 9 5.872 -15.885 1.717 1.00 0.00 N ATOM 84 CA LYS A 9 6.652 -14.702 1.398 1.00 0.00 C ATOM 85 C LYS A 9 5.742 -13.655 0.752 1.00 0.00 C ATOM 86 O LYS A 9 5.853 -13.384 -0.443 1.00 0.00 O ATOM 87 CB LYS A 9 7.865 -15.074 0.543 1.00 0.00 C ATOM 88 CG LYS A 9 9.074 -15.404 1.420 1.00 0.00 C ATOM 89 CD LYS A 9 10.048 -16.329 0.687 1.00 0.00 C ATOM 90 CE LYS A 9 9.953 -17.759 1.221 1.00 0.00 C ATOM 91 NZ LYS A 9 10.077 -18.735 0.115 1.00 0.00 N ATOM 0 H LYS A 9 5.912 -16.171 2.695 1.00 0.00 H new ATOM 0 HA LYS A 9 7.056 -14.256 2.307 1.00 0.00 H new ATOM 0 HB2 LYS A 9 7.622 -15.931 -0.085 1.00 0.00 H new ATOM 0 HB3 LYS A 9 8.110 -14.248 -0.125 1.00 0.00 H new ATOM 0 HG2 LYS A 9 9.584 -14.483 1.703 1.00 0.00 H new ATOM 0 HG3 LYS A 9 8.740 -15.879 2.342 1.00 0.00 H new ATOM 0 HD2 LYS A 9 9.829 -16.321 -0.381 1.00 0.00 H new ATOM 0 HD3 LYS A 9 11.066 -15.959 0.807 1.00 0.00 H new ATOM 0 HE2 LYS A 9 10.739 -17.932 1.956 1.00 0.00 H new ATOM 0 HE3 LYS A 9 9.001 -17.900 1.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 9.746 -19.667 0.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 9.500 -18.421 -0.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 11.073 -18.803 -0.178 1.00 0.00 H new ATOM 105 N ASN A 10 4.864 -13.095 1.570 1.00 0.00 N ATOM 106 CA ASN A 10 3.935 -12.084 1.093 1.00 0.00 C ATOM 107 C ASN A 10 4.564 -10.700 1.263 1.00 0.00 C ATOM 108 O ASN A 10 5.146 -10.402 2.305 1.00 0.00 O ATOM 109 CB ASN A 10 2.631 -12.112 1.894 1.00 0.00 C ATOM 110 CG ASN A 10 2.901 -11.926 3.388 1.00 0.00 C ATOM 111 OD1 ASN A 10 3.444 -12.788 4.059 1.00 0.00 O ATOM 112 ND2 ASN A 10 2.492 -10.756 3.870 1.00 0.00 N ATOM 0 H ASN A 10 4.776 -13.322 2.561 1.00 0.00 H new ATOM 0 HA ASN A 10 3.719 -12.292 0.045 1.00 0.00 H new ATOM 0 HB2 ASN A 10 1.966 -11.324 1.540 1.00 0.00 H new ATOM 0 HB3 ASN A 10 2.119 -13.060 1.729 1.00 0.00 H new ATOM 0 HD21 ASN A 10 2.626 -10.536 4.857 1.00 0.00 H new ATOM 0 HD22 ASN A 10 2.044 -10.079 3.253 1.00 0.00 H new ATOM 119 N PRO A 11 4.422 -9.869 0.196 1.00 0.00 N ATOM 120 CA PRO A 11 4.969 -8.523 0.217 1.00 0.00 C ATOM 121 C PRO A 11 4.120 -7.600 1.092 1.00 0.00 C ATOM 122 O PRO A 11 3.097 -8.018 1.631 1.00 0.00 O ATOM 123 CB PRO A 11 5.007 -8.091 -1.240 1.00 0.00 C ATOM 124 CG PRO A 11 4.055 -9.020 -1.975 1.00 0.00 C ATOM 125 CD PRO A 11 3.739 -10.188 -1.055 1.00 0.00 C ATOM 0 HA PRO A 11 5.965 -8.481 0.657 1.00 0.00 H new ATOM 0 HB2 PRO A 11 4.698 -7.051 -1.347 1.00 0.00 H new ATOM 0 HB3 PRO A 11 6.017 -8.167 -1.644 1.00 0.00 H new ATOM 0 HG2 PRO A 11 3.142 -8.492 -2.249 1.00 0.00 H new ATOM 0 HG3 PRO A 11 4.507 -9.375 -2.901 1.00 0.00 H new ATOM 0 HD2 PRO A 11 2.665 -10.294 -0.904 1.00 0.00 H new ATOM 0 HD3 PRO A 11 4.096 -11.129 -1.473 1.00 0.00 H new ATOM 133 N ASP A 12 4.576 -6.361 1.206 1.00 0.00 N ATOM 134 CA ASP A 12 3.871 -5.375 2.007 1.00 0.00 C ATOM 135 C ASP A 12 2.550 -5.018 1.322 1.00 0.00 C ATOM 136 O ASP A 12 1.485 -5.118 1.929 1.00 0.00 O ATOM 137 CB ASP A 12 4.692 -4.091 2.148 1.00 0.00 C ATOM 138 CG ASP A 12 5.692 -4.087 3.306 1.00 0.00 C ATOM 139 OD1 ASP A 12 6.792 -4.648 3.108 1.00 0.00 O ATOM 140 OD2 ASP A 12 5.334 -3.524 4.363 1.00 0.00 O ATOM 0 H ASP A 12 5.425 -6.018 0.757 1.00 0.00 H new ATOM 0 HA ASP A 12 3.699 -5.803 2.994 1.00 0.00 H new ATOM 0 HB2 ASP A 12 5.235 -3.921 1.218 1.00 0.00 H new ATOM 0 HB3 ASP A 12 4.008 -3.252 2.276 1.00 0.00 H new ATOM 145 N SER A 13 2.663 -4.609 0.067 1.00 0.00 N ATOM 146 CA SER A 13 1.491 -4.236 -0.707 1.00 0.00 C ATOM 147 C SER A 13 0.855 -5.483 -1.325 1.00 0.00 C ATOM 148 O SER A 13 1.119 -5.811 -2.481 1.00 0.00 O ATOM 149 CB SER A 13 1.849 -3.226 -1.799 1.00 0.00 C ATOM 150 OG SER A 13 2.891 -3.704 -2.646 1.00 0.00 O ATOM 0 H SER A 13 3.548 -4.528 -0.433 1.00 0.00 H new ATOM 0 HA SER A 13 0.774 -3.764 -0.036 1.00 0.00 H new ATOM 0 HB2 SER A 13 0.964 -3.011 -2.398 1.00 0.00 H new ATOM 0 HB3 SER A 13 2.158 -2.288 -1.338 1.00 0.00 H new ATOM 0 HG SER A 13 2.708 -4.633 -2.897 1.00 0.00 H new ATOM 156 N TYR A 14 0.027 -6.143 -0.528 1.00 0.00 N ATOM 157 CA TYR A 14 -0.649 -7.347 -0.983 1.00 0.00 C ATOM 158 C TYR A 14 -2.096 -7.383 -0.487 1.00 0.00 C ATOM 159 O TYR A 14 -3.025 -7.519 -1.282 1.00 0.00 O ATOM 160 CB TYR A 14 0.118 -8.519 -0.367 1.00 0.00 C ATOM 161 CG TYR A 14 -0.437 -9.893 -0.748 1.00 0.00 C ATOM 162 CD1 TYR A 14 -1.530 -10.405 -0.079 1.00 0.00 C ATOM 163 CD2 TYR A 14 0.156 -10.621 -1.759 1.00 0.00 C ATOM 164 CE1 TYR A 14 -2.052 -11.698 -0.437 1.00 0.00 C ATOM 165 CE2 TYR A 14 -0.366 -11.915 -2.117 1.00 0.00 C ATOM 166 CZ TYR A 14 -1.445 -12.389 -1.438 1.00 0.00 C ATOM 167 OH TYR A 14 -1.938 -13.611 -1.776 1.00 0.00 O ATOM 0 H TYR A 14 -0.191 -5.867 0.429 1.00 0.00 H new ATOM 0 HA TYR A 14 -0.671 -7.388 -2.072 1.00 0.00 H new ATOM 0 HB2 TYR A 14 1.161 -8.461 -0.677 1.00 0.00 H new ATOM 0 HB3 TYR A 14 0.102 -8.420 0.718 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -1.994 -9.836 0.713 1.00 0.00 H new ATOM 0 HD2 TYR A 14 1.012 -10.221 -2.282 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.907 -12.110 0.078 1.00 0.00 H new ATOM 0 HE2 TYR A 14 0.089 -12.495 -2.906 1.00 0.00 H new ATOM 0 HH TYR A 14 -1.406 -13.988 -2.508 1.00 0.00 H new ATOM 177 N ASN A 15 -2.242 -7.259 0.824 1.00 0.00 N ATOM 178 CA ASN A 15 -3.560 -7.276 1.435 1.00 0.00 C ATOM 179 C ASN A 15 -4.172 -5.876 1.356 1.00 0.00 C ATOM 180 O ASN A 15 -3.451 -4.883 1.267 1.00 0.00 O ATOM 181 CB ASN A 15 -3.479 -7.673 2.910 1.00 0.00 C ATOM 182 CG ASN A 15 -4.319 -8.921 3.189 1.00 0.00 C ATOM 183 OD1 ASN A 15 -4.583 -9.731 2.315 1.00 0.00 O ATOM 184 ND2 ASN A 15 -4.723 -9.030 4.451 1.00 0.00 N ATOM 0 H ASN A 15 -1.469 -7.146 1.480 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.170 -8.003 0.899 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -2.441 -7.861 3.183 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -3.828 -6.849 3.532 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -5.290 -9.828 4.738 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -4.466 -8.316 5.132 1.00 0.00 H new ATOM 191 N GLY A 16 -5.496 -5.840 1.391 1.00 0.00 N ATOM 192 CA GLY A 16 -6.213 -4.578 1.324 1.00 0.00 C ATOM 193 C GLY A 16 -6.321 -4.085 -0.120 1.00 0.00 C ATOM 194 O GLY A 16 -6.634 -4.859 -1.023 1.00 0.00 O ATOM 0 H GLY A 16 -6.091 -6.665 1.465 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -7.211 -4.700 1.746 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -5.699 -3.831 1.930 1.00 0.00 H new ATOM 198 N ALA A 17 -6.056 -2.798 -0.293 1.00 0.00 N ATOM 199 CA ALA A 17 -6.120 -2.192 -1.612 1.00 0.00 C ATOM 200 C ALA A 17 -4.982 -1.178 -1.757 1.00 0.00 C ATOM 201 O ALA A 17 -4.740 -0.378 -0.856 1.00 0.00 O ATOM 202 CB ALA A 17 -7.496 -1.556 -1.816 1.00 0.00 C ATOM 0 H ALA A 17 -5.797 -2.159 0.458 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.992 -2.947 -2.388 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -7.544 -1.101 -2.806 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -8.267 -2.322 -1.731 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -7.659 -0.791 -1.057 1.00 0.00 H new ATOM 208 N VAL A 18 -4.315 -1.246 -2.900 1.00 0.00 N ATOM 209 CA VAL A 18 -3.209 -0.345 -3.176 1.00 0.00 C ATOM 210 C VAL A 18 -3.049 -0.189 -4.689 1.00 0.00 C ATOM 211 O VAL A 18 -3.354 -1.108 -5.447 1.00 0.00 O ATOM 212 CB VAL A 18 -1.939 -0.850 -2.489 1.00 0.00 C ATOM 213 CG1 VAL A 18 -1.764 -2.355 -2.697 1.00 0.00 C ATOM 214 CG2 VAL A 18 -0.709 -0.082 -2.978 1.00 0.00 C ATOM 0 H VAL A 18 -4.519 -1.911 -3.646 1.00 0.00 H new ATOM 0 HA VAL A 18 -3.412 0.645 -2.767 1.00 0.00 H new ATOM 0 HB VAL A 18 -2.043 -0.670 -1.419 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.854 -2.688 -2.198 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -2.621 -2.882 -2.278 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -1.693 -2.569 -3.763 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.180 -0.460 -2.474 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -0.601 -0.216 -4.054 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.829 0.978 -2.754 1.00 0.00 H new ATOM 224 N ARG A 19 -2.571 0.982 -5.084 1.00 0.00 N ATOM 225 CA ARG A 19 -2.366 1.270 -6.493 1.00 0.00 C ATOM 226 C ARG A 19 -0.929 1.734 -6.737 1.00 0.00 C ATOM 227 O ARG A 19 -0.118 0.992 -7.290 1.00 0.00 O ATOM 228 CB ARG A 19 -3.333 2.351 -6.981 1.00 0.00 C ATOM 229 CG ARG A 19 -3.937 1.977 -8.336 1.00 0.00 C ATOM 230 CD ARG A 19 -5.406 1.575 -8.189 1.00 0.00 C ATOM 231 NE ARG A 19 -6.230 2.299 -9.183 1.00 0.00 N ATOM 232 CZ ARG A 19 -6.609 3.578 -9.055 1.00 0.00 C ATOM 233 NH1 ARG A 19 -6.240 4.281 -7.976 1.00 0.00 N ATOM 234 NH2 ARG A 19 -7.357 4.154 -10.006 1.00 0.00 N ATOM 0 H ARG A 19 -2.320 1.742 -4.452 1.00 0.00 H new ATOM 0 HA ARG A 19 -2.554 0.352 -7.049 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -4.129 2.488 -6.250 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -2.808 3.303 -7.063 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -3.854 2.821 -9.021 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -3.373 1.154 -8.775 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -5.513 0.499 -8.330 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -5.755 1.801 -7.181 1.00 0.00 H new ATOM 0 HE ARG A 19 -6.528 1.793 -10.017 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -5.671 3.843 -7.252 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -6.528 5.255 -7.878 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -7.638 3.619 -10.828 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -7.645 5.128 -9.908 1.00 0.00 H new ATOM 248 N GLU A 20 -0.656 2.959 -6.313 1.00 0.00 N ATOM 249 CA GLU A 20 0.669 3.531 -6.479 1.00 0.00 C ATOM 250 C GLU A 20 0.716 4.943 -5.890 1.00 0.00 C ATOM 251 O GLU A 20 1.719 5.340 -5.299 1.00 0.00 O ATOM 252 CB GLU A 20 1.084 3.537 -7.952 1.00 0.00 C ATOM 253 CG GLU A 20 0.202 4.486 -8.766 1.00 0.00 C ATOM 254 CD GLU A 20 0.036 3.984 -10.201 1.00 0.00 C ATOM 255 OE1 GLU A 20 -0.803 3.077 -10.393 1.00 0.00 O ATOM 256 OE2 GLU A 20 0.752 4.518 -11.075 1.00 0.00 O ATOM 0 H GLU A 20 -1.330 3.572 -5.854 1.00 0.00 H new ATOM 0 HA GLU A 20 1.382 2.909 -5.938 1.00 0.00 H new ATOM 0 HB2 GLU A 20 2.127 3.840 -8.038 1.00 0.00 H new ATOM 0 HB3 GLU A 20 1.011 2.528 -8.358 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -0.776 4.575 -8.293 1.00 0.00 H new ATOM 0 HG3 GLU A 20 0.644 5.482 -8.774 1.00 0.00 H new ATOM 263 N ASN A 21 -0.382 5.662 -6.072 1.00 0.00 N ATOM 264 CA ASN A 21 -0.479 7.020 -5.567 1.00 0.00 C ATOM 265 C ASN A 21 -0.278 7.011 -4.050 1.00 0.00 C ATOM 266 O ASN A 21 0.590 7.711 -3.531 1.00 0.00 O ATOM 267 CB ASN A 21 -1.856 7.619 -5.857 1.00 0.00 C ATOM 268 CG ASN A 21 -1.730 8.944 -6.612 1.00 0.00 C ATOM 269 OD1 ASN A 21 -0.713 9.253 -7.210 1.00 0.00 O ATOM 270 ND2 ASN A 21 -2.818 9.708 -6.550 1.00 0.00 N ATOM 0 H ASN A 21 -1.212 5.329 -6.562 1.00 0.00 H new ATOM 0 HA ASN A 21 0.286 7.619 -6.062 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -2.446 6.916 -6.445 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -2.391 7.779 -4.921 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -2.833 10.613 -7.021 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -3.636 9.389 -6.032 1.00 0.00 H new ATOM 277 N TYR A 22 -1.095 6.210 -3.382 1.00 0.00 N ATOM 278 CA TYR A 22 -1.018 6.101 -1.935 1.00 0.00 C ATOM 279 C TYR A 22 -1.435 4.705 -1.468 1.00 0.00 C ATOM 280 O TYR A 22 -2.487 4.204 -1.861 1.00 0.00 O ATOM 281 CB TYR A 22 -2.006 7.128 -1.381 1.00 0.00 C ATOM 282 CG TYR A 22 -3.469 6.830 -1.719 1.00 0.00 C ATOM 283 CD1 TYR A 22 -4.171 5.899 -0.981 1.00 0.00 C ATOM 284 CD2 TYR A 22 -4.085 7.492 -2.761 1.00 0.00 C ATOM 285 CE1 TYR A 22 -5.547 5.619 -1.299 1.00 0.00 C ATOM 286 CE2 TYR A 22 -5.461 7.211 -3.080 1.00 0.00 C ATOM 287 CZ TYR A 22 -6.124 6.288 -2.333 1.00 0.00 C ATOM 288 OH TYR A 22 -7.424 6.023 -2.633 1.00 0.00 O ATOM 0 H TYR A 22 -1.813 5.630 -3.816 1.00 0.00 H new ATOM 0 HA TYR A 22 0.001 6.275 -1.591 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -1.896 7.175 -0.298 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -1.747 8.113 -1.770 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -3.689 5.381 -0.165 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -3.535 8.221 -3.338 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -6.109 4.894 -0.729 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -5.955 7.721 -3.894 1.00 0.00 H new ATOM 0 HH TYR A 22 -7.467 5.296 -3.289 1.00 0.00 H new ATOM 298 N THR A 23 -0.590 4.117 -0.635 1.00 0.00 N ATOM 299 CA THR A 23 -0.858 2.789 -0.110 1.00 0.00 C ATOM 300 C THR A 23 -1.709 2.879 1.159 1.00 0.00 C ATOM 301 O THR A 23 -1.622 3.856 1.901 1.00 0.00 O ATOM 302 CB THR A 23 0.484 2.086 0.107 1.00 0.00 C ATOM 303 OG1 THR A 23 1.289 2.531 -0.981 1.00 0.00 O ATOM 304 CG2 THR A 23 0.391 0.572 -0.092 1.00 0.00 C ATOM 0 H THR A 23 0.281 4.536 -0.310 1.00 0.00 H new ATOM 0 HA THR A 23 -1.442 2.196 -0.814 1.00 0.00 H new ATOM 0 HB THR A 23 0.846 2.298 1.113 1.00 0.00 H new ATOM 0 HG1 THR A 23 2.178 2.124 -0.918 1.00 0.00 H new ATOM 0 HG21 THR A 23 1.370 0.122 0.074 1.00 0.00 H new ATOM 0 HG22 THR A 23 -0.324 0.155 0.617 1.00 0.00 H new ATOM 0 HG23 THR A 23 0.061 0.358 -1.109 1.00 0.00 H new ATOM 312 N TRP A 24 -2.512 1.846 1.369 1.00 0.00 N ATOM 313 CA TRP A 24 -3.378 1.796 2.534 1.00 0.00 C ATOM 314 C TRP A 24 -3.683 0.327 2.834 1.00 0.00 C ATOM 315 O TRP A 24 -3.391 -0.550 2.022 1.00 0.00 O ATOM 316 CB TRP A 24 -4.638 2.636 2.318 1.00 0.00 C ATOM 317 CG TRP A 24 -5.709 1.945 1.472 1.00 0.00 C ATOM 318 CD1 TRP A 24 -5.785 1.871 0.136 1.00 0.00 C ATOM 319 CD2 TRP A 24 -6.862 1.228 1.962 1.00 0.00 C ATOM 320 NE1 TRP A 24 -6.897 1.162 -0.269 1.00 0.00 N ATOM 321 CE2 TRP A 24 -7.573 0.758 0.877 1.00 0.00 C ATOM 322 CE3 TRP A 24 -7.289 0.984 3.279 1.00 0.00 C ATOM 323 CZ2 TRP A 24 -8.754 0.016 0.997 1.00 0.00 C ATOM 324 CZ3 TRP A 24 -8.471 0.241 3.382 1.00 0.00 C ATOM 325 CH2 TRP A 24 -9.199 -0.239 2.300 1.00 0.00 C ATOM 0 H TRP A 24 -2.581 1.037 0.752 1.00 0.00 H new ATOM 0 HA TRP A 24 -2.883 2.233 3.401 1.00 0.00 H new ATOM 0 HB2 TRP A 24 -5.064 2.890 3.289 1.00 0.00 H new ATOM 0 HB3 TRP A 24 -4.359 3.574 1.838 1.00 0.00 H new ATOM 0 HD1 TRP A 24 -5.066 2.311 -0.539 1.00 0.00 H new ATOM 0 HE1 TRP A 24 -7.173 0.970 -1.232 1.00 0.00 H new ATOM 0 HE3 TRP A 24 -6.748 1.341 4.143 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 -9.293 -0.340 0.131 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 -8.843 0.026 4.373 1.00 0.00 H new ATOM 0 HH2 TRP A 24 -10.104 -0.806 2.463 1.00 0.00 H new ATOM 336 N SER A 25 -4.266 0.103 4.002 1.00 0.00 N ATOM 337 CA SER A 25 -4.614 -1.244 4.419 1.00 0.00 C ATOM 338 C SER A 25 -5.792 -1.203 5.395 1.00 0.00 C ATOM 339 O SER A 25 -6.144 -0.140 5.903 1.00 0.00 O ATOM 340 CB SER A 25 -3.417 -1.948 5.062 1.00 0.00 C ATOM 341 OG SER A 25 -2.307 -2.034 4.173 1.00 0.00 O ATOM 0 H SER A 25 -4.506 0.832 4.673 1.00 0.00 H new ATOM 0 HA SER A 25 -4.903 -1.811 3.534 1.00 0.00 H new ATOM 0 HB2 SER A 25 -3.120 -1.409 5.962 1.00 0.00 H new ATOM 0 HB3 SER A 25 -3.711 -2.951 5.373 1.00 0.00 H new ATOM 0 HG SER A 25 -1.563 -2.488 4.621 1.00 0.00 H new ATOM 347 N GLN A 26 -6.369 -2.373 5.626 1.00 0.00 N ATOM 348 CA GLN A 26 -7.500 -2.484 6.532 1.00 0.00 C ATOM 349 C GLN A 26 -7.158 -3.415 7.697 1.00 0.00 C ATOM 350 O GLN A 26 -6.813 -4.577 7.487 1.00 0.00 O ATOM 351 CB GLN A 26 -8.749 -2.967 5.792 1.00 0.00 C ATOM 352 CG GLN A 26 -8.455 -4.238 4.993 1.00 0.00 C ATOM 353 CD GLN A 26 -9.640 -5.205 5.047 1.00 0.00 C ATOM 354 OE1 GLN A 26 -10.681 -4.987 4.450 1.00 0.00 O ATOM 355 NE2 GLN A 26 -9.423 -6.284 5.794 1.00 0.00 N ATOM 0 H GLN A 26 -6.075 -3.253 5.202 1.00 0.00 H new ATOM 0 HA GLN A 26 -7.716 -1.495 6.935 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -9.548 -3.160 6.508 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -9.104 -2.185 5.121 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -8.239 -3.979 3.956 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -7.565 -4.725 5.392 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -8.528 -6.405 6.267 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -10.152 -6.990 5.893 1.00 0.00 H new ATOM 364 N ASP A 27 -7.266 -2.869 8.900 1.00 0.00 N ATOM 365 CA ASP A 27 -6.972 -3.636 10.098 1.00 0.00 C ATOM 366 C ASP A 27 -8.278 -3.947 10.832 1.00 0.00 C ATOM 367 O ASP A 27 -9.351 -3.528 10.401 1.00 0.00 O ATOM 368 CB ASP A 27 -6.071 -2.847 11.050 1.00 0.00 C ATOM 369 CG ASP A 27 -4.610 -2.734 10.612 1.00 0.00 C ATOM 370 OD1 ASP A 27 -4.389 -2.661 9.384 1.00 0.00 O ATOM 371 OD2 ASP A 27 -3.746 -2.722 11.516 1.00 0.00 O ATOM 0 H ASP A 27 -7.553 -1.905 9.070 1.00 0.00 H new ATOM 0 HA ASP A 27 -6.463 -4.551 9.796 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -6.479 -1.843 11.164 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -6.105 -3.318 12.032 1.00 0.00 H new ATOM 376 N TYR A 28 -8.144 -4.680 11.928 1.00 0.00 N ATOM 377 CA TYR A 28 -9.300 -5.052 12.725 1.00 0.00 C ATOM 378 C TYR A 28 -10.293 -3.891 12.827 1.00 0.00 C ATOM 379 O TYR A 28 -11.464 -4.039 12.481 1.00 0.00 O ATOM 380 CB TYR A 28 -8.764 -5.372 14.122 1.00 0.00 C ATOM 381 CG TYR A 28 -7.739 -6.507 14.150 1.00 0.00 C ATOM 382 CD1 TYR A 28 -7.937 -7.635 13.378 1.00 0.00 C ATOM 383 CD2 TYR A 28 -6.616 -6.404 14.946 1.00 0.00 C ATOM 384 CE1 TYR A 28 -6.972 -8.703 13.404 1.00 0.00 C ATOM 385 CE2 TYR A 28 -5.651 -7.473 14.972 1.00 0.00 C ATOM 386 CZ TYR A 28 -5.877 -8.570 14.200 1.00 0.00 C ATOM 387 OH TYR A 28 -4.966 -9.579 14.224 1.00 0.00 O ATOM 0 H TYR A 28 -7.252 -5.026 12.282 1.00 0.00 H new ATOM 0 HA TYR A 28 -9.821 -5.896 12.273 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -8.308 -4.474 14.540 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -9.600 -5.635 14.769 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -8.815 -7.716 12.755 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -6.461 -5.522 15.549 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -7.114 -9.590 12.805 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -4.768 -7.405 15.590 1.00 0.00 H new ATOM 0 HH TYR A 28 -4.236 -9.346 14.835 1.00 0.00 H new ATOM 397 N THR A 29 -9.788 -2.763 13.303 1.00 0.00 N ATOM 398 CA THR A 29 -10.615 -1.578 13.455 1.00 0.00 C ATOM 399 C THR A 29 -9.760 -0.314 13.347 1.00 0.00 C ATOM 400 O THR A 29 -9.526 0.368 14.344 1.00 0.00 O ATOM 401 CB THR A 29 -11.366 -1.693 14.782 1.00 0.00 C ATOM 402 OG1 THR A 29 -11.775 -0.357 15.066 1.00 0.00 O ATOM 403 CG2 THR A 29 -10.444 -2.056 15.948 1.00 0.00 C ATOM 0 H THR A 29 -8.816 -2.644 13.589 1.00 0.00 H new ATOM 0 HA THR A 29 -11.351 -1.503 12.655 1.00 0.00 H new ATOM 0 HB THR A 29 -12.149 -2.445 14.691 1.00 0.00 H new ATOM 0 HG1 THR A 29 -10.999 0.168 15.354 1.00 0.00 H new ATOM 0 HG21 THR A 29 -11.028 -2.125 16.866 1.00 0.00 H new ATOM 0 HG22 THR A 29 -9.966 -3.015 15.749 1.00 0.00 H new ATOM 0 HG23 THR A 29 -9.680 -1.287 16.061 1.00 0.00 H new ATOM 411 N ASP A 30 -9.318 -0.038 12.129 1.00 0.00 N ATOM 412 CA ASP A 30 -8.495 1.132 11.878 1.00 0.00 C ATOM 413 C ASP A 30 -7.922 1.054 10.461 1.00 0.00 C ATOM 414 O ASP A 30 -7.851 -0.025 9.876 1.00 0.00 O ATOM 415 CB ASP A 30 -7.322 1.201 12.859 1.00 0.00 C ATOM 416 CG ASP A 30 -6.604 -0.128 13.101 1.00 0.00 C ATOM 417 OD1 ASP A 30 -7.250 -1.024 13.686 1.00 0.00 O ATOM 418 OD2 ASP A 30 -5.424 -0.217 12.698 1.00 0.00 O ATOM 0 H ASP A 30 -9.515 -0.605 11.305 1.00 0.00 H new ATOM 0 HA ASP A 30 -9.121 2.016 12.000 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -6.598 1.925 12.486 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -7.688 1.578 13.814 1.00 0.00 H new ATOM 423 N LEU A 31 -7.530 2.212 9.951 1.00 0.00 N ATOM 424 CA LEU A 31 -6.966 2.288 8.614 1.00 0.00 C ATOM 425 C LEU A 31 -5.584 2.939 8.685 1.00 0.00 C ATOM 426 O LEU A 31 -5.365 3.856 9.475 1.00 0.00 O ATOM 427 CB LEU A 31 -7.933 2.999 7.665 1.00 0.00 C ATOM 428 CG LEU A 31 -9.372 2.480 7.661 1.00 0.00 C ATOM 429 CD1 LEU A 31 -10.277 3.365 8.521 1.00 0.00 C ATOM 430 CD2 LEU A 31 -9.901 2.338 6.232 1.00 0.00 C ATOM 0 H LEU A 31 -7.592 3.105 10.439 1.00 0.00 H new ATOM 0 HA LEU A 31 -6.827 1.289 8.201 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -7.950 4.058 7.922 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -7.538 2.924 6.652 1.00 0.00 H new ATOM 0 HG LEU A 31 -9.376 1.485 8.106 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -11.294 2.974 8.501 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -9.911 3.371 9.548 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -10.272 4.382 8.128 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -10.926 1.967 6.259 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -9.879 3.309 5.738 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -9.275 1.636 5.681 1.00 0.00 H new ATOM 442 N GLU A 32 -4.686 2.440 7.848 1.00 0.00 N ATOM 443 CA GLU A 32 -3.331 2.962 7.805 1.00 0.00 C ATOM 444 C GLU A 32 -2.906 3.219 6.358 1.00 0.00 C ATOM 445 O GLU A 32 -2.686 2.280 5.595 1.00 0.00 O ATOM 446 CB GLU A 32 -2.355 2.011 8.501 1.00 0.00 C ATOM 447 CG GLU A 32 -1.566 2.738 9.593 1.00 0.00 C ATOM 448 CD GLU A 32 -0.723 1.754 10.407 1.00 0.00 C ATOM 449 OE1 GLU A 32 -1.337 0.864 11.033 1.00 0.00 O ATOM 450 OE2 GLU A 32 0.516 1.916 10.385 1.00 0.00 O ATOM 0 H GLU A 32 -4.871 1.679 7.194 1.00 0.00 H new ATOM 0 HA GLU A 32 -3.311 3.910 8.343 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -2.904 1.177 8.938 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -1.666 1.591 7.768 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -0.919 3.489 9.140 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -2.254 3.266 10.253 1.00 0.00 H new ATOM 457 N VAL A 33 -2.805 4.497 6.023 1.00 0.00 N ATOM 458 CA VAL A 33 -2.411 4.890 4.681 1.00 0.00 C ATOM 459 C VAL A 33 -1.156 5.762 4.757 1.00 0.00 C ATOM 460 O VAL A 33 -1.129 6.757 5.479 1.00 0.00 O ATOM 461 CB VAL A 33 -3.578 5.583 3.974 1.00 0.00 C ATOM 462 CG1 VAL A 33 -4.409 6.403 4.964 1.00 0.00 C ATOM 463 CG2 VAL A 33 -3.080 6.457 2.821 1.00 0.00 C ATOM 0 H VAL A 33 -2.989 5.274 6.658 1.00 0.00 H new ATOM 0 HA VAL A 33 -2.162 4.012 4.084 1.00 0.00 H new ATOM 0 HB VAL A 33 -4.222 4.810 3.554 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -5.232 6.885 4.436 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -4.809 5.745 5.736 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -3.779 7.163 5.426 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.929 6.938 2.336 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.404 7.219 3.208 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -2.551 5.837 2.097 1.00 0.00 H new ATOM 473 N ARG A 34 -0.146 5.356 4.001 1.00 0.00 N ATOM 474 CA ARG A 34 1.109 6.088 3.974 1.00 0.00 C ATOM 475 C ARG A 34 1.385 6.616 2.565 1.00 0.00 C ATOM 476 O ARG A 34 1.312 5.868 1.591 1.00 0.00 O ATOM 477 CB ARG A 34 2.274 5.199 4.415 1.00 0.00 C ATOM 478 CG ARG A 34 2.497 5.297 5.925 1.00 0.00 C ATOM 479 CD ARG A 34 2.913 3.944 6.507 1.00 0.00 C ATOM 480 NE ARG A 34 4.347 3.697 6.239 1.00 0.00 N ATOM 481 CZ ARG A 34 5.108 2.851 6.947 1.00 0.00 C ATOM 482 NH1 ARG A 34 4.577 2.166 7.969 1.00 0.00 N ATOM 483 NH2 ARG A 34 6.401 2.690 6.633 1.00 0.00 N ATOM 0 H ARG A 34 -0.171 4.530 3.403 1.00 0.00 H new ATOM 0 HA ARG A 34 1.021 6.924 4.668 1.00 0.00 H new ATOM 0 HB2 ARG A 34 2.071 4.164 4.140 1.00 0.00 H new ATOM 0 HB3 ARG A 34 3.182 5.496 3.890 1.00 0.00 H new ATOM 0 HG2 ARG A 34 3.267 6.039 6.135 1.00 0.00 H new ATOM 0 HG3 ARG A 34 1.583 5.640 6.410 1.00 0.00 H new ATOM 0 HD2 ARG A 34 2.727 3.928 7.581 1.00 0.00 H new ATOM 0 HD3 ARG A 34 2.310 3.149 6.068 1.00 0.00 H new ATOM 0 HE ARG A 34 4.783 4.202 5.468 1.00 0.00 H new ATOM 0 HH11 ARG A 34 3.593 2.288 8.208 1.00 0.00 H new ATOM 0 HH12 ARG A 34 5.157 1.522 8.507 1.00 0.00 H new ATOM 0 HH21 ARG A 34 6.806 3.211 5.855 1.00 0.00 H new ATOM 0 HH22 ARG A 34 6.980 2.046 7.172 1.00 0.00 H new ATOM 497 N VAL A 35 1.697 7.902 2.500 1.00 0.00 N ATOM 498 CA VAL A 35 1.984 8.540 1.226 1.00 0.00 C ATOM 499 C VAL A 35 3.489 8.789 1.113 1.00 0.00 C ATOM 500 O VAL A 35 4.106 9.314 2.038 1.00 0.00 O ATOM 501 CB VAL A 35 1.154 9.818 1.082 1.00 0.00 C ATOM 502 CG1 VAL A 35 1.353 10.447 -0.298 1.00 0.00 C ATOM 503 CG2 VAL A 35 -0.327 9.543 1.351 1.00 0.00 C ATOM 0 H VAL A 35 1.757 8.520 3.309 1.00 0.00 H new ATOM 0 HA VAL A 35 1.699 7.889 0.400 1.00 0.00 H new ATOM 0 HB VAL A 35 1.503 10.531 1.829 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.752 11.353 -0.375 1.00 0.00 H new ATOM 0 HG12 VAL A 35 2.405 10.696 -0.436 1.00 0.00 H new ATOM 0 HG13 VAL A 35 1.043 9.740 -1.068 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -0.894 10.467 1.242 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -0.695 8.805 0.638 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -0.448 9.160 2.364 1.00 0.00 H new ATOM 513 N PRO A 36 4.051 8.389 -0.059 1.00 0.00 N ATOM 514 CA PRO A 36 5.473 8.563 -0.305 1.00 0.00 C ATOM 515 C PRO A 36 5.802 10.026 -0.606 1.00 0.00 C ATOM 516 O PRO A 36 5.067 10.694 -1.332 1.00 0.00 O ATOM 517 CB PRO A 36 5.788 7.632 -1.464 1.00 0.00 C ATOM 518 CG PRO A 36 4.454 7.322 -2.125 1.00 0.00 C ATOM 519 CD PRO A 36 3.351 7.763 -1.176 1.00 0.00 C ATOM 0 HA PRO A 36 6.084 8.317 0.563 1.00 0.00 H new ATOM 0 HB2 PRO A 36 6.473 8.104 -2.169 1.00 0.00 H new ATOM 0 HB3 PRO A 36 6.271 6.720 -1.112 1.00 0.00 H new ATOM 0 HG2 PRO A 36 4.369 7.844 -3.078 1.00 0.00 H new ATOM 0 HG3 PRO A 36 4.372 6.256 -2.337 1.00 0.00 H new ATOM 0 HD2 PRO A 36 2.670 8.464 -1.659 1.00 0.00 H new ATOM 0 HD3 PRO A 36 2.753 6.915 -0.843 1.00 0.00 H new ATOM 527 N VAL A 37 6.907 10.481 -0.034 1.00 0.00 N ATOM 528 CA VAL A 37 7.342 11.853 -0.232 1.00 0.00 C ATOM 529 C VAL A 37 8.759 11.855 -0.808 1.00 0.00 C ATOM 530 O VAL A 37 9.489 10.874 -0.675 1.00 0.00 O ATOM 531 CB VAL A 37 7.229 12.633 1.079 1.00 0.00 C ATOM 532 CG1 VAL A 37 5.784 12.652 1.582 1.00 0.00 C ATOM 533 CG2 VAL A 37 8.171 12.061 2.141 1.00 0.00 C ATOM 0 H VAL A 37 7.514 9.924 0.567 1.00 0.00 H new ATOM 0 HA VAL A 37 6.697 12.358 -0.951 1.00 0.00 H new ATOM 0 HB VAL A 37 7.530 13.662 0.883 1.00 0.00 H new ATOM 0 HG11 VAL A 37 5.731 13.213 2.515 1.00 0.00 H new ATOM 0 HG12 VAL A 37 5.146 13.126 0.837 1.00 0.00 H new ATOM 0 HG13 VAL A 37 5.445 11.630 1.753 1.00 0.00 H new ATOM 0 HG21 VAL A 37 8.071 12.634 3.063 1.00 0.00 H new ATOM 0 HG22 VAL A 37 7.914 11.019 2.332 1.00 0.00 H new ATOM 0 HG23 VAL A 37 9.200 12.122 1.786 1.00 0.00 H new ATOM 543 N PRO A 38 9.116 12.998 -1.453 1.00 0.00 N ATOM 544 CA PRO A 38 10.433 13.141 -2.050 1.00 0.00 C ATOM 545 C PRO A 38 11.499 13.374 -0.978 1.00 0.00 C ATOM 546 O PRO A 38 11.181 13.474 0.207 1.00 0.00 O ATOM 547 CB PRO A 38 10.301 14.305 -3.019 1.00 0.00 C ATOM 548 CG PRO A 38 9.056 15.064 -2.592 1.00 0.00 C ATOM 549 CD PRO A 38 8.277 14.180 -1.631 1.00 0.00 C ATOM 0 HA PRO A 38 10.759 12.241 -2.571 1.00 0.00 H new ATOM 0 HB2 PRO A 38 11.182 14.946 -2.981 1.00 0.00 H new ATOM 0 HB3 PRO A 38 10.209 13.950 -4.045 1.00 0.00 H new ATOM 0 HG2 PRO A 38 9.328 16.004 -2.111 1.00 0.00 H new ATOM 0 HG3 PRO A 38 8.446 15.315 -3.460 1.00 0.00 H new ATOM 0 HD2 PRO A 38 8.100 14.686 -0.682 1.00 0.00 H new ATOM 0 HD3 PRO A 38 7.301 13.916 -2.038 1.00 0.00 H new ATOM 557 N LYS A 39 12.741 13.452 -1.431 1.00 0.00 N ATOM 558 CA LYS A 39 13.856 13.670 -0.525 1.00 0.00 C ATOM 559 C LYS A 39 14.005 15.170 -0.258 1.00 0.00 C ATOM 560 O LYS A 39 14.987 15.603 0.341 1.00 0.00 O ATOM 561 CB LYS A 39 15.126 13.014 -1.069 1.00 0.00 C ATOM 562 CG LYS A 39 14.836 11.602 -1.584 1.00 0.00 C ATOM 563 CD LYS A 39 15.003 10.567 -0.469 1.00 0.00 C ATOM 564 CE LYS A 39 15.657 9.290 -1.000 1.00 0.00 C ATOM 565 NZ LYS A 39 17.097 9.264 -0.657 1.00 0.00 N ATOM 0 H LYS A 39 13.000 13.368 -2.414 1.00 0.00 H new ATOM 0 HA LYS A 39 13.665 13.192 0.435 1.00 0.00 H new ATOM 0 HB2 LYS A 39 15.537 13.622 -1.875 1.00 0.00 H new ATOM 0 HB3 LYS A 39 15.882 12.971 -0.285 1.00 0.00 H new ATOM 0 HG2 LYS A 39 13.821 11.556 -1.979 1.00 0.00 H new ATOM 0 HG3 LYS A 39 15.509 11.366 -2.408 1.00 0.00 H new ATOM 0 HD2 LYS A 39 15.612 10.986 0.332 1.00 0.00 H new ATOM 0 HD3 LYS A 39 14.030 10.330 -0.039 1.00 0.00 H new ATOM 0 HE2 LYS A 39 15.160 8.417 -0.577 1.00 0.00 H new ATOM 0 HE3 LYS A 39 15.534 9.234 -2.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 17.526 8.391 -1.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 17.570 10.087 -1.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 17.208 9.296 0.377 1.00 0.00 H new ATOM 579 N HIS A 40 13.014 15.921 -0.717 1.00 0.00 N ATOM 580 CA HIS A 40 13.022 17.362 -0.536 1.00 0.00 C ATOM 581 C HIS A 40 11.946 17.758 0.477 1.00 0.00 C ATOM 582 O HIS A 40 11.825 18.929 0.834 1.00 0.00 O ATOM 583 CB HIS A 40 12.866 18.080 -1.878 1.00 0.00 C ATOM 584 CG HIS A 40 11.444 18.137 -2.381 1.00 0.00 C ATOM 585 ND1 HIS A 40 11.017 17.446 -3.502 1.00 0.00 N ATOM 586 CD2 HIS A 40 10.356 18.809 -1.905 1.00 0.00 C ATOM 587 CE1 HIS A 40 9.729 17.699 -3.684 1.00 0.00 C ATOM 588 NE2 HIS A 40 9.321 18.544 -2.693 1.00 0.00 N ATOM 0 H HIS A 40 12.200 15.558 -1.214 1.00 0.00 H new ATOM 0 HA HIS A 40 13.985 17.676 -0.133 1.00 0.00 H new ATOM 0 HB2 HIS A 40 13.248 19.096 -1.781 1.00 0.00 H new ATOM 0 HB3 HIS A 40 13.484 17.577 -2.622 1.00 0.00 H new ATOM 0 HD2 HIS A 40 10.340 19.448 -1.035 1.00 0.00 H new ATOM 0 HE1 HIS A 40 9.111 17.306 -4.477 1.00 0.00 H new ATOM 0 HE2 HIS A 40 8.377 18.911 -2.577 1.00 0.00 H new ATOM 596 N VAL A 41 11.192 16.760 0.912 1.00 0.00 N ATOM 597 CA VAL A 41 10.130 16.989 1.877 1.00 0.00 C ATOM 598 C VAL A 41 10.602 16.549 3.263 1.00 0.00 C ATOM 599 O VAL A 41 10.773 15.357 3.516 1.00 0.00 O ATOM 600 CB VAL A 41 8.852 16.278 1.427 1.00 0.00 C ATOM 601 CG1 VAL A 41 7.875 16.116 2.593 1.00 0.00 C ATOM 602 CG2 VAL A 41 8.195 17.017 0.260 1.00 0.00 C ATOM 0 H VAL A 41 11.295 15.790 0.614 1.00 0.00 H new ATOM 0 HA VAL A 41 9.892 18.051 1.937 1.00 0.00 H new ATOM 0 HB VAL A 41 9.128 15.282 1.080 1.00 0.00 H new ATOM 0 HG11 VAL A 41 6.975 15.608 2.246 1.00 0.00 H new ATOM 0 HG12 VAL A 41 8.344 15.527 3.381 1.00 0.00 H new ATOM 0 HG13 VAL A 41 7.609 17.098 2.984 1.00 0.00 H new ATOM 0 HG21 VAL A 41 7.289 16.491 -0.040 1.00 0.00 H new ATOM 0 HG22 VAL A 41 7.940 18.031 0.569 1.00 0.00 H new ATOM 0 HG23 VAL A 41 8.887 17.057 -0.581 1.00 0.00 H new ATOM 612 N VAL A 42 10.801 17.534 4.126 1.00 0.00 N ATOM 613 CA VAL A 42 11.251 17.264 5.481 1.00 0.00 C ATOM 614 C VAL A 42 10.414 18.083 6.465 1.00 0.00 C ATOM 615 O VAL A 42 10.030 17.587 7.523 1.00 0.00 O ATOM 616 CB VAL A 42 12.752 17.539 5.599 1.00 0.00 C ATOM 617 CG1 VAL A 42 13.562 16.503 4.817 1.00 0.00 C ATOM 618 CG2 VAL A 42 13.087 18.958 5.139 1.00 0.00 C ATOM 0 H VAL A 42 10.659 18.521 3.913 1.00 0.00 H new ATOM 0 HA VAL A 42 11.106 16.212 5.729 1.00 0.00 H new ATOM 0 HB VAL A 42 13.027 17.455 6.650 1.00 0.00 H new ATOM 0 HG11 VAL A 42 14.625 16.721 4.917 1.00 0.00 H new ATOM 0 HG12 VAL A 42 13.357 15.508 5.211 1.00 0.00 H new ATOM 0 HG13 VAL A 42 13.282 16.541 3.764 1.00 0.00 H new ATOM 0 HG21 VAL A 42 14.160 19.127 5.233 1.00 0.00 H new ATOM 0 HG22 VAL A 42 12.790 19.083 4.098 1.00 0.00 H new ATOM 0 HG23 VAL A 42 12.551 19.677 5.758 1.00 0.00 H new ATOM 628 N LYS A 43 10.156 19.325 6.082 1.00 0.00 N ATOM 629 CA LYS A 43 9.372 20.219 6.917 1.00 0.00 C ATOM 630 C LYS A 43 7.887 19.882 6.763 1.00 0.00 C ATOM 631 O LYS A 43 7.450 19.461 5.693 1.00 0.00 O ATOM 632 CB LYS A 43 9.707 21.678 6.603 1.00 0.00 C ATOM 633 CG LYS A 43 11.108 22.039 7.102 1.00 0.00 C ATOM 634 CD LYS A 43 11.074 22.462 8.572 1.00 0.00 C ATOM 635 CE LYS A 43 12.442 22.268 9.229 1.00 0.00 C ATOM 636 NZ LYS A 43 12.726 23.374 10.171 1.00 0.00 N ATOM 0 H LYS A 43 10.476 19.733 5.204 1.00 0.00 H new ATOM 0 HA LYS A 43 9.625 20.078 7.968 1.00 0.00 H new ATOM 0 HB2 LYS A 43 9.646 21.846 5.528 1.00 0.00 H new ATOM 0 HB3 LYS A 43 8.971 22.332 7.070 1.00 0.00 H new ATOM 0 HG2 LYS A 43 11.773 21.184 6.981 1.00 0.00 H new ATOM 0 HG3 LYS A 43 11.516 22.848 6.496 1.00 0.00 H new ATOM 0 HD2 LYS A 43 10.776 23.508 8.647 1.00 0.00 H new ATOM 0 HD3 LYS A 43 10.324 21.878 9.105 1.00 0.00 H new ATOM 0 HE2 LYS A 43 12.466 21.316 9.759 1.00 0.00 H new ATOM 0 HE3 LYS A 43 13.217 22.226 8.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 13.658 23.227 10.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 12.724 24.278 9.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 11.996 23.396 10.911 1.00 0.00 H new ATOM 650 N GLY A 44 7.153 20.079 7.848 1.00 0.00 N ATOM 651 CA GLY A 44 5.727 19.801 7.847 1.00 0.00 C ATOM 652 C GLY A 44 4.958 20.885 7.090 1.00 0.00 C ATOM 653 O GLY A 44 3.733 20.828 6.991 1.00 0.00 O ATOM 0 H GLY A 44 7.519 20.428 8.734 1.00 0.00 H new ATOM 0 HA2 GLY A 44 5.542 18.830 7.387 1.00 0.00 H new ATOM 0 HA3 GLY A 44 5.364 19.741 8.873 1.00 0.00 H new ATOM 657 N LYS A 45 5.708 21.848 6.575 1.00 0.00 N ATOM 658 CA LYS A 45 5.112 22.944 5.829 1.00 0.00 C ATOM 659 C LYS A 45 5.090 22.589 4.341 1.00 0.00 C ATOM 660 O LYS A 45 4.451 23.276 3.545 1.00 0.00 O ATOM 661 CB LYS A 45 5.834 24.257 6.138 1.00 0.00 C ATOM 662 CG LYS A 45 7.135 24.368 5.341 1.00 0.00 C ATOM 663 CD LYS A 45 6.924 25.176 4.058 1.00 0.00 C ATOM 664 CE LYS A 45 7.855 26.390 4.016 1.00 0.00 C ATOM 665 NZ LYS A 45 7.361 27.387 3.041 1.00 0.00 N ATOM 0 H LYS A 45 6.724 21.892 6.659 1.00 0.00 H new ATOM 0 HA LYS A 45 4.077 23.096 6.136 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.184 25.099 5.899 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.051 24.315 7.205 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.901 24.844 5.953 1.00 0.00 H new ATOM 0 HG3 LYS A 45 7.499 23.371 5.092 1.00 0.00 H new ATOM 0 HD2 LYS A 45 7.107 24.542 3.190 1.00 0.00 H new ATOM 0 HD3 LYS A 45 5.887 25.506 3.998 1.00 0.00 H new ATOM 0 HE2 LYS A 45 7.919 26.841 5.006 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.862 26.074 3.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 8.004 28.204 3.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 7.323 26.958 2.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 6.409 27.701 3.318 1.00 0.00 H new ATOM 679 N GLN A 46 5.795 21.518 4.010 1.00 0.00 N ATOM 680 CA GLN A 46 5.865 21.064 2.631 1.00 0.00 C ATOM 681 C GLN A 46 4.814 19.982 2.375 1.00 0.00 C ATOM 682 O GLN A 46 4.974 19.157 1.477 1.00 0.00 O ATOM 683 CB GLN A 46 7.268 20.559 2.290 1.00 0.00 C ATOM 684 CG GLN A 46 8.336 21.360 3.037 1.00 0.00 C ATOM 685 CD GLN A 46 9.725 20.755 2.822 1.00 0.00 C ATOM 686 OE1 GLN A 46 10.491 20.550 3.750 1.00 0.00 O ATOM 687 NE2 GLN A 46 10.005 20.481 1.552 1.00 0.00 N ATOM 0 H GLN A 46 6.323 20.951 4.673 1.00 0.00 H new ATOM 0 HA GLN A 46 5.652 21.911 1.979 1.00 0.00 H new ATOM 0 HB2 GLN A 46 7.352 19.504 2.550 1.00 0.00 H new ATOM 0 HB3 GLN A 46 7.435 20.637 1.216 1.00 0.00 H new ATOM 0 HG2 GLN A 46 8.328 22.394 2.692 1.00 0.00 H new ATOM 0 HG3 GLN A 46 8.104 21.378 4.102 1.00 0.00 H new ATOM 0 HE21 GLN A 46 9.318 20.678 0.824 1.00 0.00 H new ATOM 0 HE22 GLN A 46 10.907 20.074 1.305 1.00 0.00 H new ATOM 696 N VAL A 47 3.763 20.020 3.181 1.00 0.00 N ATOM 697 CA VAL A 47 2.687 19.052 3.053 1.00 0.00 C ATOM 698 C VAL A 47 1.402 19.646 3.634 1.00 0.00 C ATOM 699 O VAL A 47 1.434 20.320 4.662 1.00 0.00 O ATOM 700 CB VAL A 47 3.088 17.732 3.714 1.00 0.00 C ATOM 701 CG1 VAL A 47 3.553 16.715 2.670 1.00 0.00 C ATOM 702 CG2 VAL A 47 4.164 17.957 4.778 1.00 0.00 C ATOM 0 H VAL A 47 3.634 20.706 3.925 1.00 0.00 H new ATOM 0 HA VAL A 47 2.497 18.829 2.003 1.00 0.00 H new ATOM 0 HB VAL A 47 2.207 17.324 4.209 1.00 0.00 H new ATOM 0 HG11 VAL A 47 3.832 15.786 3.166 1.00 0.00 H new ATOM 0 HG12 VAL A 47 2.744 16.521 1.965 1.00 0.00 H new ATOM 0 HG13 VAL A 47 4.414 17.113 2.133 1.00 0.00 H new ATOM 0 HG21 VAL A 47 4.431 17.003 5.233 1.00 0.00 H new ATOM 0 HG22 VAL A 47 5.047 18.398 4.315 1.00 0.00 H new ATOM 0 HG23 VAL A 47 3.782 18.630 5.545 1.00 0.00 H new ATOM 712 N SER A 48 0.300 19.373 2.950 1.00 0.00 N ATOM 713 CA SER A 48 -0.994 19.871 3.385 1.00 0.00 C ATOM 714 C SER A 48 -1.933 18.700 3.681 1.00 0.00 C ATOM 715 O SER A 48 -2.073 17.791 2.865 1.00 0.00 O ATOM 716 CB SER A 48 -1.611 20.794 2.333 1.00 0.00 C ATOM 717 OG SER A 48 -0.618 21.494 1.588 1.00 0.00 O ATOM 0 H SER A 48 0.277 18.813 2.098 1.00 0.00 H new ATOM 0 HA SER A 48 -0.848 20.451 4.297 1.00 0.00 H new ATOM 0 HB2 SER A 48 -2.228 20.207 1.653 1.00 0.00 H new ATOM 0 HB3 SER A 48 -2.270 21.511 2.822 1.00 0.00 H new ATOM 0 HG SER A 48 -1.052 22.071 0.926 1.00 0.00 H new ATOM 723 N VAL A 49 -2.552 18.761 4.851 1.00 0.00 N ATOM 724 CA VAL A 49 -3.474 17.717 5.265 1.00 0.00 C ATOM 725 C VAL A 49 -4.785 18.355 5.731 1.00 0.00 C ATOM 726 O VAL A 49 -4.772 19.374 6.420 1.00 0.00 O ATOM 727 CB VAL A 49 -2.824 16.838 6.335 1.00 0.00 C ATOM 728 CG1 VAL A 49 -3.860 15.936 7.009 1.00 0.00 C ATOM 729 CG2 VAL A 49 -1.679 16.011 5.744 1.00 0.00 C ATOM 0 H VAL A 49 -2.433 19.517 5.525 1.00 0.00 H new ATOM 0 HA VAL A 49 -3.711 17.063 4.426 1.00 0.00 H new ATOM 0 HB VAL A 49 -2.405 17.494 7.098 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -3.371 15.322 7.765 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -4.626 16.551 7.481 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -4.322 15.291 6.262 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -1.234 15.395 6.525 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -2.065 15.369 4.952 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.922 16.679 5.333 1.00 0.00 H new ATOM 739 N ALA A 50 -5.884 17.729 5.336 1.00 0.00 N ATOM 740 CA ALA A 50 -7.199 18.223 5.705 1.00 0.00 C ATOM 741 C ALA A 50 -8.037 17.067 6.256 1.00 0.00 C ATOM 742 O ALA A 50 -8.442 16.178 5.509 1.00 0.00 O ATOM 743 CB ALA A 50 -7.853 18.890 4.492 1.00 0.00 C ATOM 0 H ALA A 50 -5.890 16.884 4.764 1.00 0.00 H new ATOM 0 HA ALA A 50 -7.120 18.976 6.489 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -8.840 19.261 4.769 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -7.234 19.722 4.156 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -7.952 18.163 3.686 1.00 0.00 H new ATOM 749 N LEU A 51 -8.272 17.118 7.559 1.00 0.00 N ATOM 750 CA LEU A 51 -9.054 16.087 8.219 1.00 0.00 C ATOM 751 C LEU A 51 -10.423 16.655 8.599 1.00 0.00 C ATOM 752 O LEU A 51 -10.508 17.660 9.302 1.00 0.00 O ATOM 753 CB LEU A 51 -8.280 15.504 9.404 1.00 0.00 C ATOM 754 CG LEU A 51 -6.988 14.761 9.060 1.00 0.00 C ATOM 755 CD1 LEU A 51 -6.199 14.419 10.326 1.00 0.00 C ATOM 756 CD2 LEU A 51 -7.277 13.520 8.213 1.00 0.00 C ATOM 0 H LEU A 51 -7.934 17.857 8.175 1.00 0.00 H new ATOM 0 HA LEU A 51 -9.232 15.252 7.541 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -8.037 16.316 10.089 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -8.937 14.820 9.941 1.00 0.00 H new ATOM 0 HG LEU A 51 -6.364 15.422 8.459 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -5.285 13.891 10.054 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -5.944 15.337 10.855 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -6.805 13.785 10.972 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -6.341 13.011 7.983 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -7.930 12.846 8.767 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -7.766 13.818 7.285 1.00 0.00 H new ATOM 768 N SER A 52 -11.460 15.987 8.115 1.00 0.00 N ATOM 769 CA SER A 52 -12.821 16.413 8.395 1.00 0.00 C ATOM 770 C SER A 52 -13.608 15.265 9.031 1.00 0.00 C ATOM 771 O SER A 52 -13.985 15.339 10.199 1.00 0.00 O ATOM 772 CB SER A 52 -13.519 16.895 7.122 1.00 0.00 C ATOM 773 OG SER A 52 -13.249 18.267 6.851 1.00 0.00 O ATOM 0 H SER A 52 -11.385 15.154 7.531 1.00 0.00 H new ATOM 0 HA SER A 52 -12.782 17.248 9.094 1.00 0.00 H new ATOM 0 HB2 SER A 52 -13.192 16.288 6.278 1.00 0.00 H new ATOM 0 HB3 SER A 52 -14.595 16.750 7.222 1.00 0.00 H new ATOM 0 HG SER A 52 -13.711 18.535 6.030 1.00 0.00 H new ATOM 779 N SER A 53 -13.833 14.231 8.233 1.00 0.00 N ATOM 780 CA SER A 53 -14.568 13.070 8.704 1.00 0.00 C ATOM 781 C SER A 53 -14.751 12.068 7.562 1.00 0.00 C ATOM 782 O SER A 53 -14.420 10.892 7.704 1.00 0.00 O ATOM 783 CB SER A 53 -15.928 13.474 9.277 1.00 0.00 C ATOM 784 OG SER A 53 -16.743 14.129 8.308 1.00 0.00 O ATOM 0 H SER A 53 -13.519 14.174 7.264 1.00 0.00 H new ATOM 0 HA SER A 53 -13.992 12.602 9.502 1.00 0.00 H new ATOM 0 HB2 SER A 53 -16.444 12.587 9.645 1.00 0.00 H new ATOM 0 HB3 SER A 53 -15.780 14.134 10.132 1.00 0.00 H new ATOM 0 HG SER A 53 -17.221 14.872 8.731 1.00 0.00 H new ATOM 790 N SER A 54 -15.276 12.571 6.454 1.00 0.00 N ATOM 791 CA SER A 54 -15.506 11.735 5.288 1.00 0.00 C ATOM 792 C SER A 54 -14.719 12.276 4.093 1.00 0.00 C ATOM 793 O SER A 54 -15.115 12.081 2.945 1.00 0.00 O ATOM 794 CB SER A 54 -16.996 11.657 4.952 1.00 0.00 C ATOM 795 OG SER A 54 -17.465 12.849 4.326 1.00 0.00 O ATOM 0 H SER A 54 -15.549 13.547 6.339 1.00 0.00 H new ATOM 0 HA SER A 54 -15.160 10.727 5.516 1.00 0.00 H new ATOM 0 HB2 SER A 54 -17.175 10.807 4.294 1.00 0.00 H new ATOM 0 HB3 SER A 54 -17.565 11.479 5.865 1.00 0.00 H new ATOM 0 HG SER A 54 -18.420 12.759 4.126 1.00 0.00 H new ATOM 801 N SER A 55 -13.619 12.945 4.403 1.00 0.00 N ATOM 802 CA SER A 55 -12.773 13.516 3.369 1.00 0.00 C ATOM 803 C SER A 55 -11.309 13.479 3.810 1.00 0.00 C ATOM 804 O SER A 55 -11.017 13.477 5.005 1.00 0.00 O ATOM 805 CB SER A 55 -13.193 14.951 3.043 1.00 0.00 C ATOM 806 OG SER A 55 -13.912 15.553 4.116 1.00 0.00 O ATOM 0 H SER A 55 -13.294 13.105 5.356 1.00 0.00 H new ATOM 0 HA SER A 55 -12.888 12.918 2.465 1.00 0.00 H new ATOM 0 HB2 SER A 55 -12.307 15.546 2.821 1.00 0.00 H new ATOM 0 HB3 SER A 55 -13.812 14.953 2.146 1.00 0.00 H new ATOM 0 HG SER A 55 -14.161 16.468 3.870 1.00 0.00 H new ATOM 812 N ILE A 56 -10.426 13.450 2.822 1.00 0.00 N ATOM 813 CA ILE A 56 -8.999 13.413 3.093 1.00 0.00 C ATOM 814 C ILE A 56 -8.254 14.162 1.987 1.00 0.00 C ATOM 815 O ILE A 56 -8.675 14.147 0.831 1.00 0.00 O ATOM 816 CB ILE A 56 -8.528 11.971 3.285 1.00 0.00 C ATOM 817 CG1 ILE A 56 -7.036 11.921 3.623 1.00 0.00 C ATOM 818 CG2 ILE A 56 -8.867 11.116 2.062 1.00 0.00 C ATOM 819 CD1 ILE A 56 -6.183 12.073 2.362 1.00 0.00 C ATOM 0 H ILE A 56 -10.672 13.451 1.832 1.00 0.00 H new ATOM 0 HA ILE A 56 -8.776 13.924 4.030 1.00 0.00 H new ATOM 0 HB ILE A 56 -9.065 11.547 4.134 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -6.793 12.715 4.329 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -6.802 10.976 4.113 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -8.521 10.095 2.225 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -9.946 11.113 1.908 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -8.376 11.530 1.181 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -5.127 12.034 2.630 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -6.411 11.264 1.668 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -6.402 13.030 1.888 1.00 0.00 H new ATOM 831 N ARG A 57 -7.161 14.799 2.379 1.00 0.00 N ATOM 832 CA ARG A 57 -6.353 15.552 1.435 1.00 0.00 C ATOM 833 C ARG A 57 -4.868 15.406 1.772 1.00 0.00 C ATOM 834 O ARG A 57 -4.468 15.589 2.920 1.00 0.00 O ATOM 835 CB ARG A 57 -6.729 17.035 1.449 1.00 0.00 C ATOM 836 CG ARG A 57 -6.634 17.638 0.045 1.00 0.00 C ATOM 837 CD ARG A 57 -5.840 18.945 0.063 1.00 0.00 C ATOM 838 NE ARG A 57 -5.822 19.545 -1.290 1.00 0.00 N ATOM 839 CZ ARG A 57 -5.116 20.635 -1.619 1.00 0.00 C ATOM 840 NH1 ARG A 57 -4.366 21.252 -0.695 1.00 0.00 N ATOM 841 NH2 ARG A 57 -5.160 21.109 -2.872 1.00 0.00 N ATOM 0 H ARG A 57 -6.816 14.809 3.339 1.00 0.00 H new ATOM 0 HA ARG A 57 -6.544 15.150 0.440 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.743 17.153 1.832 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -6.068 17.575 2.126 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.156 16.927 -0.629 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.635 17.822 -0.344 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -6.286 19.642 0.773 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.821 18.756 0.400 1.00 0.00 H new ATOM 0 HE ARG A 57 -6.382 19.101 -2.017 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.333 20.892 0.259 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -3.828 22.082 -0.946 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -5.731 20.640 -3.575 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.622 21.939 -3.122 1.00 0.00 H new ATOM 855 N VAL A 58 -4.092 15.078 0.750 1.00 0.00 N ATOM 856 CA VAL A 58 -2.659 14.906 0.923 1.00 0.00 C ATOM 857 C VAL A 58 -1.925 15.580 -0.237 1.00 0.00 C ATOM 858 O VAL A 58 -2.032 15.143 -1.382 1.00 0.00 O ATOM 859 CB VAL A 58 -2.324 13.419 1.060 1.00 0.00 C ATOM 860 CG1 VAL A 58 -0.821 13.212 1.260 1.00 0.00 C ATOM 861 CG2 VAL A 58 -3.122 12.779 2.197 1.00 0.00 C ATOM 0 H VAL A 58 -4.428 14.927 -0.201 1.00 0.00 H new ATOM 0 HA VAL A 58 -2.324 15.387 1.842 1.00 0.00 H new ATOM 0 HB VAL A 58 -2.610 12.924 0.132 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.610 12.147 1.355 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -0.281 13.614 0.403 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -0.500 13.727 2.165 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -2.865 11.722 2.272 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -2.883 13.279 3.136 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -4.188 12.879 1.994 1.00 0.00 H new ATOM 871 N ALA A 59 -1.195 16.633 0.099 1.00 0.00 N ATOM 872 CA ALA A 59 -0.442 17.372 -0.901 1.00 0.00 C ATOM 873 C ALA A 59 0.962 17.662 -0.365 1.00 0.00 C ATOM 874 O ALA A 59 1.202 17.569 0.837 1.00 0.00 O ATOM 875 CB ALA A 59 -1.200 18.649 -1.270 1.00 0.00 C ATOM 0 H ALA A 59 -1.109 16.992 1.050 1.00 0.00 H new ATOM 0 HA ALA A 59 -0.332 16.783 -1.812 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -0.636 19.203 -2.020 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -2.179 18.388 -1.672 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -1.326 19.267 -0.381 1.00 0.00 H new ATOM 881 N MET A 60 1.851 18.006 -1.285 1.00 0.00 N ATOM 882 CA MET A 60 3.225 18.310 -0.920 1.00 0.00 C ATOM 883 C MET A 60 3.771 19.468 -1.758 1.00 0.00 C ATOM 884 O MET A 60 3.583 19.503 -2.973 1.00 0.00 O ATOM 885 CB MET A 60 4.096 17.070 -1.134 1.00 0.00 C ATOM 886 CG MET A 60 3.846 16.455 -2.512 1.00 0.00 C ATOM 887 SD MET A 60 5.387 15.899 -3.221 1.00 0.00 S ATOM 888 CE MET A 60 6.301 17.433 -3.219 1.00 0.00 C ATOM 0 H MET A 60 1.647 18.081 -2.282 1.00 0.00 H new ATOM 0 HA MET A 60 3.246 18.604 0.129 1.00 0.00 H new ATOM 0 HB2 MET A 60 5.148 17.339 -1.037 1.00 0.00 H new ATOM 0 HB3 MET A 60 3.883 16.334 -0.359 1.00 0.00 H new ATOM 0 HG2 MET A 60 3.153 15.618 -2.426 1.00 0.00 H new ATOM 0 HG3 MET A 60 3.378 17.189 -3.168 1.00 0.00 H new ATOM 0 HE1 MET A 60 6.984 17.451 -4.068 1.00 0.00 H new ATOM 0 HE2 MET A 60 5.607 18.270 -3.294 1.00 0.00 H new ATOM 0 HE3 MET A 60 6.871 17.516 -2.294 1.00 0.00 H new ATOM 898 N LEU A 61 4.437 20.387 -1.074 1.00 0.00 N ATOM 899 CA LEU A 61 5.012 21.544 -1.740 1.00 0.00 C ATOM 900 C LEU A 61 6.192 21.095 -2.604 1.00 0.00 C ATOM 901 O LEU A 61 7.067 20.368 -2.137 1.00 0.00 O ATOM 902 CB LEU A 61 5.373 22.625 -0.719 1.00 0.00 C ATOM 903 CG LEU A 61 4.202 23.239 0.050 1.00 0.00 C ATOM 904 CD1 LEU A 61 4.597 24.579 0.673 1.00 0.00 C ATOM 905 CD2 LEU A 61 2.965 23.364 -0.842 1.00 0.00 C ATOM 0 H LEU A 61 4.591 20.354 -0.066 1.00 0.00 H new ATOM 0 HA LEU A 61 4.282 22.001 -2.409 1.00 0.00 H new ATOM 0 HB2 LEU A 61 6.071 22.198 0.001 1.00 0.00 H new ATOM 0 HB3 LEU A 61 5.901 23.425 -1.238 1.00 0.00 H new ATOM 0 HG LEU A 61 3.942 22.568 0.869 1.00 0.00 H new ATOM 0 HD11 LEU A 61 3.746 24.994 1.214 1.00 0.00 H new ATOM 0 HD12 LEU A 61 5.427 24.429 1.363 1.00 0.00 H new ATOM 0 HD13 LEU A 61 4.899 25.271 -0.113 1.00 0.00 H new ATOM 0 HD21 LEU A 61 2.147 23.803 -0.271 1.00 0.00 H new ATOM 0 HD22 LEU A 61 3.195 24.002 -1.696 1.00 0.00 H new ATOM 0 HD23 LEU A 61 2.670 22.376 -1.196 1.00 0.00 H new ATOM 917 N GLU A 62 6.178 21.547 -3.849 1.00 0.00 N ATOM 918 CA GLU A 62 7.237 21.201 -4.783 1.00 0.00 C ATOM 919 C GLU A 62 8.277 22.321 -4.844 1.00 0.00 C ATOM 920 O GLU A 62 9.417 22.139 -4.419 1.00 0.00 O ATOM 921 CB GLU A 62 6.668 20.905 -6.172 1.00 0.00 C ATOM 922 CG GLU A 62 6.091 19.489 -6.238 1.00 0.00 C ATOM 923 CD GLU A 62 7.108 18.510 -6.828 1.00 0.00 C ATOM 924 OE1 GLU A 62 7.807 18.923 -7.779 1.00 0.00 O ATOM 925 OE2 GLU A 62 7.163 17.372 -6.316 1.00 0.00 O ATOM 0 H GLU A 62 5.450 22.150 -4.233 1.00 0.00 H new ATOM 0 HA GLU A 62 7.727 20.295 -4.427 1.00 0.00 H new ATOM 0 HB2 GLU A 62 5.890 21.630 -6.412 1.00 0.00 H new ATOM 0 HB3 GLU A 62 7.451 21.018 -6.921 1.00 0.00 H new ATOM 0 HG2 GLU A 62 5.804 19.162 -5.238 1.00 0.00 H new ATOM 0 HG3 GLU A 62 5.186 19.489 -6.846 1.00 0.00 H new ATOM 932 N GLU A 63 7.848 23.456 -5.377 1.00 0.00 N ATOM 933 CA GLU A 63 8.728 24.605 -5.499 1.00 0.00 C ATOM 934 C GLU A 63 7.919 25.862 -5.827 1.00 0.00 C ATOM 935 O GLU A 63 7.812 26.768 -5.002 1.00 0.00 O ATOM 936 CB GLU A 63 9.808 24.359 -6.555 1.00 0.00 C ATOM 937 CG GLU A 63 10.898 25.431 -6.485 1.00 0.00 C ATOM 938 CD GLU A 63 12.271 24.839 -6.807 1.00 0.00 C ATOM 939 OE1 GLU A 63 12.386 24.230 -7.893 1.00 0.00 O ATOM 940 OE2 GLU A 63 13.175 25.008 -5.961 1.00 0.00 O ATOM 0 H GLU A 63 6.902 23.604 -5.729 1.00 0.00 H new ATOM 0 HA GLU A 63 9.228 24.757 -4.542 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.251 23.375 -6.405 1.00 0.00 H new ATOM 0 HB3 GLU A 63 9.358 24.358 -7.548 1.00 0.00 H new ATOM 0 HG2 GLU A 63 10.670 26.233 -7.187 1.00 0.00 H new ATOM 0 HG3 GLU A 63 10.914 25.874 -5.489 1.00 0.00 H new ATOM 947 N ASN A 64 7.369 25.875 -7.032 1.00 0.00 N ATOM 948 CA ASN A 64 6.572 27.006 -7.479 1.00 0.00 C ATOM 949 C ASN A 64 5.109 26.776 -7.095 1.00 0.00 C ATOM 950 O ASN A 64 4.268 27.652 -7.288 1.00 0.00 O ATOM 951 CB ASN A 64 6.643 27.163 -8.999 1.00 0.00 C ATOM 952 CG ASN A 64 5.759 28.319 -9.472 1.00 0.00 C ATOM 953 OD1 ASN A 64 6.169 29.467 -9.526 1.00 0.00 O ATOM 954 ND2 ASN A 64 4.526 27.953 -9.811 1.00 0.00 N ATOM 0 H ASN A 64 7.459 25.121 -7.713 1.00 0.00 H new ATOM 0 HA ASN A 64 6.966 27.905 -7.005 1.00 0.00 H new ATOM 0 HB2 ASN A 64 7.675 27.342 -9.302 1.00 0.00 H new ATOM 0 HB3 ASN A 64 6.325 26.237 -9.479 1.00 0.00 H new ATOM 0 HD21 ASN A 64 3.859 28.651 -10.140 1.00 0.00 H new ATOM 0 HD22 ASN A 64 4.247 26.974 -9.742 1.00 0.00 H new ATOM 961 N GLY A 65 4.850 25.592 -6.560 1.00 0.00 N ATOM 962 CA GLY A 65 3.503 25.235 -6.147 1.00 0.00 C ATOM 963 C GLY A 65 3.513 23.988 -5.262 1.00 0.00 C ATOM 964 O GLY A 65 4.331 23.874 -4.351 1.00 0.00 O ATOM 0 H GLY A 65 5.550 24.867 -6.403 1.00 0.00 H new ATOM 0 HA2 GLY A 65 3.053 26.066 -5.605 1.00 0.00 H new ATOM 0 HA3 GLY A 65 2.885 25.056 -7.027 1.00 0.00 H new ATOM 968 N GLU A 66 2.592 23.082 -5.561 1.00 0.00 N ATOM 969 CA GLU A 66 2.485 21.847 -4.804 1.00 0.00 C ATOM 970 C GLU A 66 1.789 20.771 -5.640 1.00 0.00 C ATOM 971 O GLU A 66 1.369 21.030 -6.766 1.00 0.00 O ATOM 972 CB GLU A 66 1.747 22.076 -3.483 1.00 0.00 C ATOM 973 CG GLU A 66 0.232 22.053 -3.689 1.00 0.00 C ATOM 974 CD GLU A 66 -0.208 23.159 -4.651 1.00 0.00 C ATOM 975 OE1 GLU A 66 -0.317 24.311 -4.179 1.00 0.00 O ATOM 976 OE2 GLU A 66 -0.424 22.827 -5.837 1.00 0.00 O ATOM 0 H GLU A 66 1.914 23.179 -6.317 1.00 0.00 H new ATOM 0 HA GLU A 66 3.491 21.501 -4.566 1.00 0.00 H new ATOM 0 HB2 GLU A 66 2.031 21.306 -2.766 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.045 23.034 -3.057 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -0.070 21.082 -4.082 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -0.271 22.179 -2.730 1.00 0.00 H new ATOM 983 N ARG A 67 1.690 19.585 -5.056 1.00 0.00 N ATOM 984 CA ARG A 67 1.053 18.469 -5.733 1.00 0.00 C ATOM 985 C ARG A 67 0.218 17.654 -4.743 1.00 0.00 C ATOM 986 O ARG A 67 0.652 17.400 -3.621 1.00 0.00 O ATOM 987 CB ARG A 67 2.092 17.555 -6.386 1.00 0.00 C ATOM 988 CG ARG A 67 1.416 16.443 -7.191 1.00 0.00 C ATOM 989 CD ARG A 67 2.278 16.030 -8.386 1.00 0.00 C ATOM 990 NE ARG A 67 1.422 15.472 -9.457 1.00 0.00 N ATOM 991 CZ ARG A 67 1.856 15.184 -10.692 1.00 0.00 C ATOM 992 NH1 ARG A 67 3.138 15.400 -11.019 1.00 0.00 N ATOM 993 NH2 ARG A 67 1.009 14.681 -11.600 1.00 0.00 N ATOM 0 H ARG A 67 2.040 19.373 -4.122 1.00 0.00 H new ATOM 0 HA ARG A 67 0.406 18.878 -6.509 1.00 0.00 H new ATOM 0 HB2 ARG A 67 2.737 18.141 -7.040 1.00 0.00 H new ATOM 0 HB3 ARG A 67 2.730 17.117 -5.618 1.00 0.00 H new ATOM 0 HG2 ARG A 67 1.240 15.580 -6.549 1.00 0.00 H new ATOM 0 HG3 ARG A 67 0.442 16.783 -7.541 1.00 0.00 H new ATOM 0 HD2 ARG A 67 2.830 16.891 -8.762 1.00 0.00 H new ATOM 0 HD3 ARG A 67 3.015 15.290 -8.075 1.00 0.00 H new ATOM 0 HE ARG A 67 0.441 15.296 -9.242 1.00 0.00 H new ATOM 0 HH11 ARG A 67 3.783 15.783 -10.328 1.00 0.00 H new ATOM 0 HH12 ARG A 67 3.469 15.181 -11.959 1.00 0.00 H new ATOM 0 HH21 ARG A 67 0.033 14.517 -11.352 1.00 0.00 H new ATOM 0 HH22 ARG A 67 1.340 14.462 -12.540 1.00 0.00 H new ATOM 1007 N VAL A 68 -0.966 17.267 -5.195 1.00 0.00 N ATOM 1008 CA VAL A 68 -1.865 16.486 -4.364 1.00 0.00 C ATOM 1009 C VAL A 68 -1.589 14.996 -4.579 1.00 0.00 C ATOM 1010 O VAL A 68 -2.056 14.409 -5.554 1.00 0.00 O ATOM 1011 CB VAL A 68 -3.317 16.873 -4.656 1.00 0.00 C ATOM 1012 CG1 VAL A 68 -4.289 15.980 -3.882 1.00 0.00 C ATOM 1013 CG2 VAL A 68 -3.563 18.350 -4.344 1.00 0.00 C ATOM 0 H VAL A 68 -1.323 17.480 -6.126 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.691 16.699 -3.309 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.497 16.720 -5.720 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.313 16.276 -4.107 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -4.139 14.941 -4.174 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -4.108 16.086 -2.812 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.602 18.599 -4.560 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.356 18.539 -3.291 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -2.907 18.966 -4.959 1.00 0.00 H new ATOM 1023 N LEU A 69 -0.831 14.428 -3.653 1.00 0.00 N ATOM 1024 CA LEU A 69 -0.487 13.018 -3.730 1.00 0.00 C ATOM 1025 C LEU A 69 -1.764 12.180 -3.640 1.00 0.00 C ATOM 1026 O LEU A 69 -2.040 11.368 -4.520 1.00 0.00 O ATOM 1027 CB LEU A 69 0.558 12.664 -2.669 1.00 0.00 C ATOM 1028 CG LEU A 69 1.779 13.583 -2.597 1.00 0.00 C ATOM 1029 CD1 LEU A 69 2.651 13.242 -1.387 1.00 0.00 C ATOM 1030 CD2 LEU A 69 2.573 13.544 -3.904 1.00 0.00 C ATOM 0 H LEU A 69 -0.445 14.918 -2.846 1.00 0.00 H new ATOM 0 HA LEU A 69 -0.024 12.790 -4.690 1.00 0.00 H new ATOM 0 HB2 LEU A 69 0.071 12.663 -1.694 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.904 11.647 -2.853 1.00 0.00 H new ATOM 0 HG LEU A 69 1.428 14.606 -2.464 1.00 0.00 H new ATOM 0 HD11 LEU A 69 3.512 13.910 -1.359 1.00 0.00 H new ATOM 0 HD12 LEU A 69 2.069 13.362 -0.473 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.994 12.210 -1.465 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.435 14.206 -3.826 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.913 12.526 -4.093 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.937 13.872 -4.726 1.00 0.00 H new ATOM 1042 N MET A 70 -2.508 12.407 -2.567 1.00 0.00 N ATOM 1043 CA MET A 70 -3.749 11.683 -2.350 1.00 0.00 C ATOM 1044 C MET A 70 -4.868 12.631 -1.915 1.00 0.00 C ATOM 1045 O MET A 70 -4.626 13.585 -1.177 1.00 0.00 O ATOM 1046 CB MET A 70 -3.536 10.616 -1.275 1.00 0.00 C ATOM 1047 CG MET A 70 -4.869 10.004 -0.839 1.00 0.00 C ATOM 1048 SD MET A 70 -4.594 8.789 0.440 1.00 0.00 S ATOM 1049 CE MET A 70 -6.271 8.239 0.710 1.00 0.00 C ATOM 0 H MET A 70 -2.275 13.082 -1.839 1.00 0.00 H new ATOM 0 HA MET A 70 -4.042 11.212 -3.288 1.00 0.00 H new ATOM 0 HB2 MET A 70 -2.881 9.834 -1.658 1.00 0.00 H new ATOM 0 HB3 MET A 70 -3.035 11.057 -0.413 1.00 0.00 H new ATOM 0 HG2 MET A 70 -5.535 10.785 -0.473 1.00 0.00 H new ATOM 0 HG3 MET A 70 -5.362 9.540 -1.693 1.00 0.00 H new ATOM 0 HE1 MET A 70 -6.285 7.155 0.821 1.00 0.00 H new ATOM 0 HE2 MET A 70 -6.664 8.701 1.615 1.00 0.00 H new ATOM 0 HE3 MET A 70 -6.889 8.525 -0.141 1.00 0.00 H new ATOM 1059 N GLU A 71 -6.068 12.336 -2.391 1.00 0.00 N ATOM 1060 CA GLU A 71 -7.226 13.150 -2.061 1.00 0.00 C ATOM 1061 C GLU A 71 -8.507 12.479 -2.560 1.00 0.00 C ATOM 1062 O GLU A 71 -8.472 11.689 -3.502 1.00 0.00 O ATOM 1063 CB GLU A 71 -7.086 14.561 -2.637 1.00 0.00 C ATOM 1064 CG GLU A 71 -8.230 15.461 -2.166 1.00 0.00 C ATOM 1065 CD GLU A 71 -9.474 15.266 -3.035 1.00 0.00 C ATOM 1066 OE1 GLU A 71 -9.303 15.234 -4.272 1.00 0.00 O ATOM 1067 OE2 GLU A 71 -10.569 15.154 -2.441 1.00 0.00 O ATOM 0 H GLU A 71 -6.264 11.544 -3.003 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.285 13.240 -0.976 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -6.132 14.990 -2.331 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -7.080 14.514 -3.726 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -8.469 15.237 -1.126 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -7.916 16.504 -2.203 1.00 0.00 H new ATOM 1074 N GLY A 72 -9.608 12.817 -1.904 1.00 0.00 N ATOM 1075 CA GLY A 72 -10.898 12.257 -2.269 1.00 0.00 C ATOM 1076 C GLY A 72 -11.774 12.047 -1.033 1.00 0.00 C ATOM 1077 O GLY A 72 -11.263 11.835 0.066 1.00 0.00 O ATOM 0 H GLY A 72 -9.633 13.472 -1.122 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -11.403 12.924 -2.968 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -10.754 11.306 -2.783 1.00 0.00 H new ATOM 1081 N LYS A 73 -13.079 12.114 -1.253 1.00 0.00 N ATOM 1082 CA LYS A 73 -14.031 11.935 -0.170 1.00 0.00 C ATOM 1083 C LYS A 73 -13.995 10.478 0.298 1.00 0.00 C ATOM 1084 O LYS A 73 -14.043 9.559 -0.518 1.00 0.00 O ATOM 1085 CB LYS A 73 -15.422 12.410 -0.595 1.00 0.00 C ATOM 1086 CG LYS A 73 -15.487 13.938 -0.646 1.00 0.00 C ATOM 1087 CD LYS A 73 -16.431 14.410 -1.753 1.00 0.00 C ATOM 1088 CE LYS A 73 -17.867 14.524 -1.238 1.00 0.00 C ATOM 1089 NZ LYS A 73 -18.041 15.773 -0.463 1.00 0.00 N ATOM 0 H LYS A 73 -13.499 12.290 -2.166 1.00 0.00 H new ATOM 0 HA LYS A 73 -13.756 12.553 0.685 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -15.667 11.999 -1.574 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -16.168 12.034 0.105 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -15.827 14.323 0.315 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -14.489 14.342 -0.817 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -16.099 15.377 -2.131 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -16.395 13.711 -2.589 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -18.563 14.509 -2.077 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -18.105 13.664 -0.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -18.813 15.651 0.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -17.160 15.993 0.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -18.272 16.554 -1.110 1.00 0.00 H new ATOM 1103 N LEU A 74 -13.911 10.314 1.610 1.00 0.00 N ATOM 1104 CA LEU A 74 -13.868 8.985 2.197 1.00 0.00 C ATOM 1105 C LEU A 74 -15.218 8.296 1.986 1.00 0.00 C ATOM 1106 O LEU A 74 -16.222 8.956 1.725 1.00 0.00 O ATOM 1107 CB LEU A 74 -13.438 9.061 3.663 1.00 0.00 C ATOM 1108 CG LEU A 74 -12.065 9.681 3.929 1.00 0.00 C ATOM 1109 CD1 LEU A 74 -11.983 10.244 5.349 1.00 0.00 C ATOM 1110 CD2 LEU A 74 -10.946 8.676 3.645 1.00 0.00 C ATOM 0 H LEU A 74 -13.872 11.079 2.283 1.00 0.00 H new ATOM 0 HA LEU A 74 -13.116 8.372 1.700 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -14.186 9.635 4.211 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -13.445 8.052 4.076 1.00 0.00 H new ATOM 0 HG LEU A 74 -11.929 10.517 3.243 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -10.997 10.679 5.512 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -12.745 11.013 5.480 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -12.149 9.442 6.068 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -9.980 9.142 3.842 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -11.067 7.805 4.289 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -10.993 8.365 2.601 1.00 0.00 H new ATOM 1122 N THR A 75 -15.198 6.977 2.108 1.00 0.00 N ATOM 1123 CA THR A 75 -16.407 6.191 1.934 1.00 0.00 C ATOM 1124 C THR A 75 -17.303 6.310 3.169 1.00 0.00 C ATOM 1125 O THR A 75 -18.519 6.154 3.075 1.00 0.00 O ATOM 1126 CB THR A 75 -15.995 4.752 1.619 1.00 0.00 C ATOM 1127 OG1 THR A 75 -15.636 4.208 2.886 1.00 0.00 O ATOM 1128 CG2 THR A 75 -14.703 4.678 0.802 1.00 0.00 C ATOM 0 H THR A 75 -14.363 6.433 2.325 1.00 0.00 H new ATOM 0 HA THR A 75 -17.004 6.563 1.101 1.00 0.00 H new ATOM 0 HB THR A 75 -16.798 4.256 1.074 1.00 0.00 H new ATOM 0 HG1 THR A 75 -14.776 3.745 2.811 1.00 0.00 H new ATOM 0 HG21 THR A 75 -14.456 3.635 0.606 1.00 0.00 H new ATOM 0 HG22 THR A 75 -14.840 5.202 -0.144 1.00 0.00 H new ATOM 0 HG23 THR A 75 -13.892 5.144 1.361 1.00 0.00 H new ATOM 1136 N HIS A 76 -16.666 6.584 4.298 1.00 0.00 N ATOM 1137 CA HIS A 76 -17.389 6.726 5.550 1.00 0.00 C ATOM 1138 C HIS A 76 -16.768 7.853 6.377 1.00 0.00 C ATOM 1139 O HIS A 76 -15.871 8.551 5.907 1.00 0.00 O ATOM 1140 CB HIS A 76 -17.438 5.395 6.303 1.00 0.00 C ATOM 1141 CG HIS A 76 -17.798 4.212 5.436 1.00 0.00 C ATOM 1142 ND1 HIS A 76 -19.062 4.028 4.905 1.00 0.00 N ATOM 1143 CD2 HIS A 76 -17.045 3.155 5.013 1.00 0.00 C ATOM 1144 CE1 HIS A 76 -19.061 2.908 4.197 1.00 0.00 C ATOM 1145 NE2 HIS A 76 -17.810 2.368 4.266 1.00 0.00 N ATOM 0 H HIS A 76 -15.657 6.711 4.372 1.00 0.00 H new ATOM 0 HA HIS A 76 -18.424 7.000 5.347 1.00 0.00 H new ATOM 0 HB2 HIS A 76 -16.467 5.213 6.763 1.00 0.00 H new ATOM 0 HB3 HIS A 76 -18.164 5.474 7.112 1.00 0.00 H new ATOM 0 HD2 HIS A 76 -16.004 2.987 5.246 1.00 0.00 H new ATOM 0 HE1 HIS A 76 -19.902 2.495 3.660 1.00 0.00 H new ATOM 0 HE2 HIS A 76 -17.512 1.502 3.817 1.00 0.00 H new ATOM 1153 N LYS A 77 -17.269 7.995 7.595 1.00 0.00 N ATOM 1154 CA LYS A 77 -16.774 9.025 8.493 1.00 0.00 C ATOM 1155 C LYS A 77 -15.700 8.428 9.404 1.00 0.00 C ATOM 1156 O LYS A 77 -15.586 7.209 9.520 1.00 0.00 O ATOM 1157 CB LYS A 77 -17.933 9.675 9.252 1.00 0.00 C ATOM 1158 CG LYS A 77 -18.726 10.614 8.342 1.00 0.00 C ATOM 1159 CD LYS A 77 -19.714 11.457 9.151 1.00 0.00 C ATOM 1160 CE LYS A 77 -20.335 12.556 8.286 1.00 0.00 C ATOM 1161 NZ LYS A 77 -20.149 13.881 8.919 1.00 0.00 N ATOM 0 H LYS A 77 -18.013 7.414 7.981 1.00 0.00 H new ATOM 0 HA LYS A 77 -16.302 9.829 7.928 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -18.593 8.902 9.647 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -17.547 10.231 10.106 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -18.041 11.268 7.803 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -19.266 10.032 7.595 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -20.500 10.817 9.552 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -19.203 11.905 10.003 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -19.877 12.551 7.297 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -21.398 12.359 8.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -20.576 14.615 8.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -20.607 13.887 9.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -19.133 14.073 9.031 1.00 0.00 H new ATOM 1175 N ILE A 78 -14.938 9.316 10.026 1.00 0.00 N ATOM 1176 CA ILE A 78 -13.876 8.892 10.923 1.00 0.00 C ATOM 1177 C ILE A 78 -13.868 9.794 12.159 1.00 0.00 C ATOM 1178 O ILE A 78 -14.738 10.650 12.312 1.00 0.00 O ATOM 1179 CB ILE A 78 -12.536 8.850 10.185 1.00 0.00 C ATOM 1180 CG1 ILE A 78 -12.218 10.203 9.547 1.00 0.00 C ATOM 1181 CG2 ILE A 78 -12.510 7.713 9.161 1.00 0.00 C ATOM 1182 CD1 ILE A 78 -11.166 10.960 10.360 1.00 0.00 C ATOM 0 H ILE A 78 -15.035 10.327 9.927 1.00 0.00 H new ATOM 0 HA ILE A 78 -14.055 7.875 11.271 1.00 0.00 H new ATOM 0 HB ILE A 78 -11.751 8.646 10.913 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -11.857 10.053 8.529 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -13.128 10.799 9.478 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -11.547 7.705 8.650 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -12.658 6.761 9.671 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -13.306 7.862 8.432 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -10.959 11.918 9.884 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -11.539 11.130 11.370 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -10.249 10.372 10.406 1.00 0.00 H new ATOM 1194 N ASN A 79 -12.876 9.571 13.009 1.00 0.00 N ATOM 1195 CA ASN A 79 -12.744 10.353 14.226 1.00 0.00 C ATOM 1196 C ASN A 79 -11.523 11.268 14.110 1.00 0.00 C ATOM 1197 O ASN A 79 -10.433 10.913 14.555 1.00 0.00 O ATOM 1198 CB ASN A 79 -12.543 9.447 15.443 1.00 0.00 C ATOM 1199 CG ASN A 79 -12.809 10.209 16.743 1.00 0.00 C ATOM 1200 OD1 ASN A 79 -11.977 10.278 17.633 1.00 0.00 O ATOM 1201 ND2 ASN A 79 -14.011 10.774 16.803 1.00 0.00 N ATOM 0 H ASN A 79 -12.156 8.860 12.879 1.00 0.00 H new ATOM 0 HA ASN A 79 -13.658 10.933 14.355 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -13.212 8.589 15.377 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -11.525 9.058 15.447 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -14.284 11.304 17.630 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -14.660 10.677 16.022 1.00 0.00 H new ATOM 1208 N THR A 80 -11.748 12.427 13.510 1.00 0.00 N ATOM 1209 CA THR A 80 -10.679 13.395 13.329 1.00 0.00 C ATOM 1210 C THR A 80 -9.965 13.655 14.657 1.00 0.00 C ATOM 1211 O THR A 80 -8.825 14.117 14.673 1.00 0.00 O ATOM 1212 CB THR A 80 -11.284 14.656 12.708 1.00 0.00 C ATOM 1213 OG1 THR A 80 -12.485 14.865 13.445 1.00 0.00 O ATOM 1214 CG2 THR A 80 -11.762 14.430 11.272 1.00 0.00 C ATOM 0 H THR A 80 -12.654 12.718 13.143 1.00 0.00 H new ATOM 0 HA THR A 80 -9.913 13.017 12.652 1.00 0.00 H new ATOM 0 HB THR A 80 -10.545 15.458 12.723 1.00 0.00 H new ATOM 0 HG1 THR A 80 -12.940 15.665 13.108 1.00 0.00 H new ATOM 0 HG21 THR A 80 -12.182 15.355 10.879 1.00 0.00 H new ATOM 0 HG22 THR A 80 -10.920 14.122 10.652 1.00 0.00 H new ATOM 0 HG23 THR A 80 -12.525 13.651 11.261 1.00 0.00 H new ATOM 1222 N GLU A 81 -10.665 13.346 15.739 1.00 0.00 N ATOM 1223 CA GLU A 81 -10.112 13.540 17.069 1.00 0.00 C ATOM 1224 C GLU A 81 -9.049 12.479 17.361 1.00 0.00 C ATOM 1225 O GLU A 81 -7.936 12.807 17.771 1.00 0.00 O ATOM 1226 CB GLU A 81 -11.214 13.519 18.129 1.00 0.00 C ATOM 1227 CG GLU A 81 -12.250 14.614 17.865 1.00 0.00 C ATOM 1228 CD GLU A 81 -13.225 14.740 19.038 1.00 0.00 C ATOM 1229 OE1 GLU A 81 -12.797 14.424 20.169 1.00 0.00 O ATOM 1230 OE2 GLU A 81 -14.377 15.149 18.776 1.00 0.00 O ATOM 0 H GLU A 81 -11.610 12.963 15.722 1.00 0.00 H new ATOM 0 HA GLU A 81 -9.638 14.521 17.105 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -11.702 12.544 18.132 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -10.776 13.659 19.117 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -11.745 15.566 17.703 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -12.801 14.386 16.952 1.00 0.00 H new ATOM 1237 N SER A 82 -9.429 11.230 17.140 1.00 0.00 N ATOM 1238 CA SER A 82 -8.522 10.119 17.375 1.00 0.00 C ATOM 1239 C SER A 82 -7.534 9.995 16.214 1.00 0.00 C ATOM 1240 O SER A 82 -6.444 9.448 16.377 1.00 0.00 O ATOM 1241 CB SER A 82 -9.292 8.809 17.558 1.00 0.00 C ATOM 1242 OG SER A 82 -9.344 8.407 18.924 1.00 0.00 O ATOM 0 H SER A 82 -10.353 10.962 16.801 1.00 0.00 H new ATOM 0 HA SER A 82 -7.970 10.317 18.294 1.00 0.00 H new ATOM 0 HB2 SER A 82 -10.306 8.928 17.176 1.00 0.00 H new ATOM 0 HB3 SER A 82 -8.819 8.025 16.967 1.00 0.00 H new ATOM 0 HG SER A 82 -9.845 7.568 18.999 1.00 0.00 H new ATOM 1248 N SER A 83 -7.949 10.514 15.067 1.00 0.00 N ATOM 1249 CA SER A 83 -7.114 10.468 13.879 1.00 0.00 C ATOM 1250 C SER A 83 -6.007 11.520 13.978 1.00 0.00 C ATOM 1251 O SER A 83 -6.229 12.614 14.495 1.00 0.00 O ATOM 1252 CB SER A 83 -7.944 10.689 12.613 1.00 0.00 C ATOM 1253 OG SER A 83 -8.896 9.648 12.411 1.00 0.00 O ATOM 0 H SER A 83 -8.853 10.968 14.936 1.00 0.00 H new ATOM 0 HA SER A 83 -6.662 9.478 13.816 1.00 0.00 H new ATOM 0 HB2 SER A 83 -8.462 11.646 12.681 1.00 0.00 H new ATOM 0 HB3 SER A 83 -7.281 10.746 11.750 1.00 0.00 H new ATOM 0 HG SER A 83 -9.619 9.734 13.067 1.00 0.00 H new ATOM 1259 N LEU A 84 -4.838 11.152 13.473 1.00 0.00 N ATOM 1260 CA LEU A 84 -3.696 12.050 13.498 1.00 0.00 C ATOM 1261 C LEU A 84 -3.046 12.078 12.113 1.00 0.00 C ATOM 1262 O LEU A 84 -3.498 11.394 11.197 1.00 0.00 O ATOM 1263 CB LEU A 84 -2.734 11.662 14.622 1.00 0.00 C ATOM 1264 CG LEU A 84 -2.357 10.180 14.701 1.00 0.00 C ATOM 1265 CD1 LEU A 84 -1.745 9.699 13.385 1.00 0.00 C ATOM 1266 CD2 LEU A 84 -1.437 9.912 15.894 1.00 0.00 C ATOM 0 H LEU A 84 -4.657 10.244 13.044 1.00 0.00 H new ATOM 0 HA LEU A 84 -4.015 13.068 13.722 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.819 12.244 14.507 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.180 11.954 15.572 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.268 9.603 14.861 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.486 8.643 13.468 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.465 9.833 12.578 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.846 10.277 13.169 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.184 8.852 15.928 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.525 10.500 15.789 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.946 10.193 16.816 1.00 0.00 H new ATOM 1278 N TRP A 85 -1.994 12.878 12.005 1.00 0.00 N ATOM 1279 CA TRP A 85 -1.277 13.004 10.748 1.00 0.00 C ATOM 1280 C TRP A 85 0.117 13.556 11.053 1.00 0.00 C ATOM 1281 O TRP A 85 0.250 14.637 11.623 1.00 0.00 O ATOM 1282 CB TRP A 85 -2.058 13.869 9.756 1.00 0.00 C ATOM 1283 CG TRP A 85 -1.593 15.325 9.700 1.00 0.00 C ATOM 1284 CD1 TRP A 85 -2.111 16.382 10.342 1.00 0.00 C ATOM 1285 CD2 TRP A 85 -0.489 15.847 8.930 1.00 0.00 C ATOM 1286 NE1 TRP A 85 -1.424 17.541 10.043 1.00 0.00 N ATOM 1287 CE2 TRP A 85 -0.407 17.205 9.158 1.00 0.00 C ATOM 1288 CE3 TRP A 85 0.410 15.192 8.070 1.00 0.00 C ATOM 1289 CZ2 TRP A 85 0.560 18.025 8.563 1.00 0.00 C ATOM 1290 CZ3 TRP A 85 1.370 16.025 7.483 1.00 0.00 C ATOM 1291 CH2 TRP A 85 1.466 17.394 7.702 1.00 0.00 C ATOM 0 H TRP A 85 -1.622 13.445 12.767 1.00 0.00 H new ATOM 0 HA TRP A 85 -1.170 12.032 10.266 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -1.971 13.432 8.761 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -3.115 13.846 10.023 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -2.959 16.333 11.009 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -1.626 18.473 10.405 1.00 0.00 H new ATOM 0 HE3 TRP A 85 0.364 14.130 7.877 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 0.604 19.086 8.758 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 2.086 15.572 6.813 1.00 0.00 H new ATOM 0 HH2 TRP A 85 2.237 17.969 7.210 1.00 0.00 H new ATOM 1302 N SER A 86 1.122 12.787 10.659 1.00 0.00 N ATOM 1303 CA SER A 86 2.501 13.184 10.883 1.00 0.00 C ATOM 1304 C SER A 86 3.263 13.201 9.556 1.00 0.00 C ATOM 1305 O SER A 86 2.849 12.562 8.591 1.00 0.00 O ATOM 1306 CB SER A 86 3.190 12.249 11.879 1.00 0.00 C ATOM 1307 OG SER A 86 2.936 12.626 13.229 1.00 0.00 O ATOM 0 H SER A 86 1.008 11.891 10.186 1.00 0.00 H new ATOM 0 HA SER A 86 2.502 14.187 11.309 1.00 0.00 H new ATOM 0 HB2 SER A 86 2.844 11.228 11.717 1.00 0.00 H new ATOM 0 HB3 SER A 86 4.265 12.254 11.697 1.00 0.00 H new ATOM 0 HG SER A 86 3.392 12.004 13.834 1.00 0.00 H new ATOM 1313 N LEU A 87 4.363 13.939 9.552 1.00 0.00 N ATOM 1314 CA LEU A 87 5.187 14.047 8.359 1.00 0.00 C ATOM 1315 C LEU A 87 6.591 13.524 8.666 1.00 0.00 C ATOM 1316 O LEU A 87 7.117 13.747 9.755 1.00 0.00 O ATOM 1317 CB LEU A 87 5.168 15.480 7.823 1.00 0.00 C ATOM 1318 CG LEU A 87 6.205 15.807 6.747 1.00 0.00 C ATOM 1319 CD1 LEU A 87 7.585 16.036 7.367 1.00 0.00 C ATOM 1320 CD2 LEU A 87 6.234 14.725 5.666 1.00 0.00 C ATOM 0 H LEU A 87 4.703 14.468 10.355 1.00 0.00 H new ATOM 0 HA LEU A 87 4.783 13.427 7.559 1.00 0.00 H new ATOM 0 HB2 LEU A 87 4.177 15.682 7.417 1.00 0.00 H new ATOM 0 HB3 LEU A 87 5.315 16.162 8.660 1.00 0.00 H new ATOM 0 HG LEU A 87 5.912 16.738 6.262 1.00 0.00 H new ATOM 0 HD11 LEU A 87 8.304 16.267 6.580 1.00 0.00 H new ATOM 0 HD12 LEU A 87 7.535 16.869 8.068 1.00 0.00 H new ATOM 0 HD13 LEU A 87 7.901 15.136 7.894 1.00 0.00 H new ATOM 0 HD21 LEU A 87 6.980 14.982 4.914 1.00 0.00 H new ATOM 0 HD22 LEU A 87 6.490 13.766 6.117 1.00 0.00 H new ATOM 0 HD23 LEU A 87 5.253 14.654 5.196 1.00 0.00 H new ATOM 1332 N GLU A 88 7.159 12.837 7.685 1.00 0.00 N ATOM 1333 CA GLU A 88 8.493 12.280 7.836 1.00 0.00 C ATOM 1334 C GLU A 88 9.409 12.787 6.721 1.00 0.00 C ATOM 1335 O GLU A 88 9.017 12.817 5.556 1.00 0.00 O ATOM 1336 CB GLU A 88 8.449 10.751 7.857 1.00 0.00 C ATOM 1337 CG GLU A 88 8.246 10.228 9.281 1.00 0.00 C ATOM 1338 CD GLU A 88 9.394 9.305 9.695 1.00 0.00 C ATOM 1339 OE1 GLU A 88 10.494 9.844 9.944 1.00 0.00 O ATOM 1340 OE2 GLU A 88 9.146 8.081 9.752 1.00 0.00 O ATOM 0 H GLU A 88 6.720 12.654 6.783 1.00 0.00 H new ATOM 0 HA GLU A 88 8.899 12.612 8.792 1.00 0.00 H new ATOM 0 HB2 GLU A 88 7.640 10.398 7.217 1.00 0.00 H new ATOM 0 HB3 GLU A 88 9.377 10.351 7.448 1.00 0.00 H new ATOM 0 HG2 GLU A 88 8.181 11.067 9.974 1.00 0.00 H new ATOM 0 HG3 GLU A 88 7.301 9.689 9.343 1.00 0.00 H new ATOM 1347 N PRO A 89 10.645 13.184 7.128 1.00 0.00 N ATOM 1348 CA PRO A 89 11.620 13.688 6.177 1.00 0.00 C ATOM 1349 C PRO A 89 12.220 12.549 5.351 1.00 0.00 C ATOM 1350 O PRO A 89 12.767 11.597 5.905 1.00 0.00 O ATOM 1351 CB PRO A 89 12.653 14.418 7.021 1.00 0.00 C ATOM 1352 CG PRO A 89 12.471 13.902 8.439 1.00 0.00 C ATOM 1353 CD PRO A 89 11.144 13.163 8.500 1.00 0.00 C ATOM 0 HA PRO A 89 11.180 14.360 5.441 1.00 0.00 H new ATOM 0 HB2 PRO A 89 13.662 14.221 6.660 1.00 0.00 H new ATOM 0 HB3 PRO A 89 12.503 15.497 6.975 1.00 0.00 H new ATOM 0 HG2 PRO A 89 13.291 13.237 8.711 1.00 0.00 H new ATOM 0 HG3 PRO A 89 12.481 14.728 9.150 1.00 0.00 H new ATOM 0 HD2 PRO A 89 11.275 12.142 8.858 1.00 0.00 H new ATOM 0 HD3 PRO A 89 10.449 13.653 9.182 1.00 0.00 H new ATOM 1361 N GLY A 90 12.098 12.683 4.038 1.00 0.00 N ATOM 1362 CA GLY A 90 12.621 11.677 3.130 1.00 0.00 C ATOM 1363 C GLY A 90 12.092 10.287 3.489 1.00 0.00 C ATOM 1364 O GLY A 90 12.869 9.378 3.778 1.00 0.00 O ATOM 0 H GLY A 90 11.644 13.474 3.581 1.00 0.00 H new ATOM 0 HA2 GLY A 90 12.339 11.924 2.106 1.00 0.00 H new ATOM 0 HA3 GLY A 90 13.710 11.677 3.170 1.00 0.00 H new ATOM 1368 N LYS A 91 10.773 10.165 3.457 1.00 0.00 N ATOM 1369 CA LYS A 91 10.130 8.901 3.775 1.00 0.00 C ATOM 1370 C LYS A 91 8.719 8.888 3.184 1.00 0.00 C ATOM 1371 O LYS A 91 8.543 8.624 1.995 1.00 0.00 O ATOM 1372 CB LYS A 91 10.167 8.645 5.283 1.00 0.00 C ATOM 1373 CG LYS A 91 11.383 7.798 5.666 1.00 0.00 C ATOM 1374 CD LYS A 91 10.993 6.693 6.649 1.00 0.00 C ATOM 1375 CE LYS A 91 12.072 5.610 6.713 1.00 0.00 C ATOM 1376 NZ LYS A 91 11.466 4.291 7.001 1.00 0.00 N ATOM 0 H LYS A 91 10.132 10.921 3.216 1.00 0.00 H new ATOM 0 HA LYS A 91 10.674 8.073 3.321 1.00 0.00 H new ATOM 0 HB2 LYS A 91 10.199 9.595 5.816 1.00 0.00 H new ATOM 0 HB3 LYS A 91 9.254 8.137 5.592 1.00 0.00 H new ATOM 0 HG2 LYS A 91 11.819 7.356 4.770 1.00 0.00 H new ATOM 0 HG3 LYS A 91 12.148 8.434 6.112 1.00 0.00 H new ATOM 0 HD2 LYS A 91 10.842 7.120 7.640 1.00 0.00 H new ATOM 0 HD3 LYS A 91 10.045 6.249 6.345 1.00 0.00 H new ATOM 0 HE2 LYS A 91 12.612 5.570 5.767 1.00 0.00 H new ATOM 0 HE3 LYS A 91 12.800 5.859 7.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 12.212 3.567 7.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 10.971 4.329 7.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 10.789 4.049 6.250 1.00 0.00 H new ATOM 1390 N CYS A 92 7.751 9.178 4.040 1.00 0.00 N ATOM 1391 CA CYS A 92 6.361 9.203 3.617 1.00 0.00 C ATOM 1392 C CYS A 92 5.546 9.930 4.688 1.00 0.00 C ATOM 1393 O CYS A 92 6.087 10.337 5.716 1.00 0.00 O ATOM 1394 CB CYS A 92 5.825 7.795 3.351 1.00 0.00 C ATOM 1395 SG CYS A 92 6.585 6.605 4.515 1.00 0.00 S ATOM 0 H CYS A 92 7.901 9.398 5.025 1.00 0.00 H new ATOM 0 HA CYS A 92 6.276 9.738 2.671 1.00 0.00 H new ATOM 0 HB2 CYS A 92 4.741 7.783 3.462 1.00 0.00 H new ATOM 0 HB3 CYS A 92 6.044 7.502 2.324 1.00 0.00 H new ATOM 0 HG CYS A 92 6.121 5.413 4.282 1.00 0.00 H new ATOM 1401 N VAL A 93 4.258 10.072 4.412 1.00 0.00 N ATOM 1402 CA VAL A 93 3.363 10.744 5.339 1.00 0.00 C ATOM 1403 C VAL A 93 2.501 9.702 6.054 1.00 0.00 C ATOM 1404 O VAL A 93 1.912 8.832 5.413 1.00 0.00 O ATOM 1405 CB VAL A 93 2.537 11.797 4.599 1.00 0.00 C ATOM 1406 CG1 VAL A 93 1.386 12.303 5.471 1.00 0.00 C ATOM 1407 CG2 VAL A 93 3.419 12.956 4.129 1.00 0.00 C ATOM 0 H VAL A 93 3.813 9.733 3.559 1.00 0.00 H new ATOM 0 HA VAL A 93 3.932 11.275 6.102 1.00 0.00 H new ATOM 0 HB VAL A 93 2.106 11.325 3.716 1.00 0.00 H new ATOM 0 HG11 VAL A 93 0.814 13.051 4.921 1.00 0.00 H new ATOM 0 HG12 VAL A 93 0.735 11.469 5.734 1.00 0.00 H new ATOM 0 HG13 VAL A 93 1.788 12.750 6.380 1.00 0.00 H new ATOM 0 HG21 VAL A 93 2.807 13.690 3.606 1.00 0.00 H new ATOM 0 HG22 VAL A 93 3.892 13.426 4.991 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.188 12.578 3.455 1.00 0.00 H new ATOM 1417 N LEU A 94 2.453 9.823 7.372 1.00 0.00 N ATOM 1418 CA LEU A 94 1.672 8.902 8.181 1.00 0.00 C ATOM 1419 C LEU A 94 0.326 9.544 8.521 1.00 0.00 C ATOM 1420 O LEU A 94 0.263 10.730 8.843 1.00 0.00 O ATOM 1421 CB LEU A 94 2.470 8.459 9.409 1.00 0.00 C ATOM 1422 CG LEU A 94 1.977 7.190 10.107 1.00 0.00 C ATOM 1423 CD1 LEU A 94 0.648 7.438 10.822 1.00 0.00 C ATOM 1424 CD2 LEU A 94 1.889 6.022 9.122 1.00 0.00 C ATOM 0 H LEU A 94 2.942 10.545 7.901 1.00 0.00 H new ATOM 0 HA LEU A 94 1.459 7.991 7.622 1.00 0.00 H new ATOM 0 HB2 LEU A 94 3.506 8.305 9.108 1.00 0.00 H new ATOM 0 HB3 LEU A 94 2.466 9.273 10.134 1.00 0.00 H new ATOM 0 HG LEU A 94 2.706 6.915 10.869 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.320 6.520 11.310 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.778 8.220 11.570 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.103 7.751 10.096 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.536 5.132 9.643 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.194 6.273 8.321 1.00 0.00 H new ATOM 0 HD23 LEU A 94 2.875 5.828 8.699 1.00 0.00 H new ATOM 1436 N VAL A 95 -0.718 8.733 8.438 1.00 0.00 N ATOM 1437 CA VAL A 95 -2.060 9.207 8.733 1.00 0.00 C ATOM 1438 C VAL A 95 -2.879 8.064 9.334 1.00 0.00 C ATOM 1439 O VAL A 95 -2.943 6.975 8.766 1.00 0.00 O ATOM 1440 CB VAL A 95 -2.694 9.800 7.473 1.00 0.00 C ATOM 1441 CG1 VAL A 95 -4.128 10.258 7.745 1.00 0.00 C ATOM 1442 CG2 VAL A 95 -1.847 10.948 6.921 1.00 0.00 C ATOM 0 H VAL A 95 -0.662 7.750 8.171 1.00 0.00 H new ATOM 0 HA VAL A 95 -2.029 10.008 9.472 1.00 0.00 H new ATOM 0 HB VAL A 95 -2.730 9.017 6.716 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -4.556 10.675 6.833 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.726 9.407 8.070 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -4.125 11.019 8.526 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.320 11.351 6.026 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -1.764 11.733 7.673 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -0.852 10.579 6.671 1.00 0.00 H new ATOM 1452 N ASN A 96 -3.486 8.350 10.477 1.00 0.00 N ATOM 1453 CA ASN A 96 -4.299 7.360 11.161 1.00 0.00 C ATOM 1454 C ASN A 96 -5.770 7.776 11.091 1.00 0.00 C ATOM 1455 O ASN A 96 -6.111 8.916 11.403 1.00 0.00 O ATOM 1456 CB ASN A 96 -3.909 7.250 12.636 1.00 0.00 C ATOM 1457 CG ASN A 96 -2.747 6.272 12.825 1.00 0.00 C ATOM 1458 OD1 ASN A 96 -2.866 5.244 13.471 1.00 0.00 O ATOM 1459 ND2 ASN A 96 -1.621 6.649 12.227 1.00 0.00 N ATOM 0 H ASN A 96 -3.431 9.254 10.946 1.00 0.00 H new ATOM 0 HA ASN A 96 -4.139 6.399 10.673 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -3.628 8.232 13.016 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -4.768 6.917 13.219 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -0.788 6.065 12.294 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -1.590 7.523 11.701 1.00 0.00 H new ATOM 1466 N LEU A 97 -6.601 6.830 10.680 1.00 0.00 N ATOM 1467 CA LEU A 97 -8.027 7.085 10.566 1.00 0.00 C ATOM 1468 C LEU A 97 -8.783 6.179 11.540 1.00 0.00 C ATOM 1469 O LEU A 97 -8.766 4.957 11.398 1.00 0.00 O ATOM 1470 CB LEU A 97 -8.482 6.939 9.112 1.00 0.00 C ATOM 1471 CG LEU A 97 -7.876 7.931 8.117 1.00 0.00 C ATOM 1472 CD1 LEU A 97 -8.678 7.959 6.814 1.00 0.00 C ATOM 1473 CD2 LEU A 97 -7.747 9.323 8.740 1.00 0.00 C ATOM 0 H LEU A 97 -6.314 5.886 10.422 1.00 0.00 H new ATOM 0 HA LEU A 97 -8.253 8.114 10.846 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -8.245 5.929 8.778 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -9.567 7.039 9.080 1.00 0.00 H new ATOM 0 HG LEU A 97 -6.869 7.594 7.869 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -8.226 8.672 6.124 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -8.675 6.966 6.364 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -9.705 8.259 7.025 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -7.314 10.009 8.012 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -8.733 9.682 9.035 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -7.102 9.271 9.617 1.00 0.00 H new ATOM 1485 N SER A 98 -9.427 6.813 12.509 1.00 0.00 N ATOM 1486 CA SER A 98 -10.187 6.080 13.507 1.00 0.00 C ATOM 1487 C SER A 98 -11.594 5.787 12.982 1.00 0.00 C ATOM 1488 O SER A 98 -12.208 6.634 12.335 1.00 0.00 O ATOM 1489 CB SER A 98 -10.263 6.857 14.822 1.00 0.00 C ATOM 1490 OG SER A 98 -9.644 6.152 15.895 1.00 0.00 O ATOM 0 H SER A 98 -9.438 7.826 12.624 1.00 0.00 H new ATOM 0 HA SER A 98 -9.675 5.138 13.702 1.00 0.00 H new ATOM 0 HB2 SER A 98 -9.780 7.826 14.699 1.00 0.00 H new ATOM 0 HB3 SER A 98 -11.307 7.050 15.069 1.00 0.00 H new ATOM 0 HG SER A 98 -10.180 6.258 16.708 1.00 0.00 H new ATOM 1496 N LYS A 99 -12.064 4.585 13.280 1.00 0.00 N ATOM 1497 CA LYS A 99 -13.387 4.170 12.846 1.00 0.00 C ATOM 1498 C LYS A 99 -14.419 4.596 13.892 1.00 0.00 C ATOM 1499 O LYS A 99 -14.233 4.361 15.085 1.00 0.00 O ATOM 1500 CB LYS A 99 -13.405 2.671 12.539 1.00 0.00 C ATOM 1501 CG LYS A 99 -12.383 2.320 11.456 1.00 0.00 C ATOM 1502 CD LYS A 99 -12.823 1.086 10.666 1.00 0.00 C ATOM 1503 CE LYS A 99 -11.800 0.736 9.583 1.00 0.00 C ATOM 1504 NZ LYS A 99 -11.966 -0.669 9.149 1.00 0.00 N ATOM 0 H LYS A 99 -11.552 3.885 13.817 1.00 0.00 H new ATOM 0 HA LYS A 99 -13.655 4.666 11.913 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -13.186 2.108 13.446 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -14.402 2.375 12.213 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -12.261 3.165 10.779 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -11.411 2.136 11.914 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -12.945 0.241 11.343 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -13.795 1.270 10.208 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -11.922 1.403 8.730 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -10.791 0.888 9.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -11.264 -0.890 8.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -11.827 -1.302 9.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -12.923 -0.803 8.765 1.00 0.00 H new ATOM 1518 N VAL A 100 -15.485 5.215 13.407 1.00 0.00 N ATOM 1519 CA VAL A 100 -16.547 5.676 14.286 1.00 0.00 C ATOM 1520 C VAL A 100 -17.613 4.585 14.405 1.00 0.00 C ATOM 1521 O VAL A 100 -18.808 4.878 14.408 1.00 0.00 O ATOM 1522 CB VAL A 100 -17.107 7.006 13.777 1.00 0.00 C ATOM 1523 CG1 VAL A 100 -16.025 8.088 13.766 1.00 0.00 C ATOM 1524 CG2 VAL A 100 -17.733 6.843 12.390 1.00 0.00 C ATOM 0 H VAL A 100 -15.637 5.408 12.417 1.00 0.00 H new ATOM 0 HA VAL A 100 -16.160 5.864 15.288 1.00 0.00 H new ATOM 0 HB VAL A 100 -17.892 7.323 14.464 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -16.449 9.023 13.400 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -15.645 8.233 14.777 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -15.209 7.780 13.113 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -18.123 7.803 12.052 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -16.977 6.491 11.688 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -18.546 6.118 12.441 1.00 0.00 H new ATOM 1534 N GLY A 101 -17.143 3.351 14.502 1.00 0.00 N ATOM 1535 CA GLY A 101 -18.041 2.215 14.622 1.00 0.00 C ATOM 1536 C GLY A 101 -17.490 0.998 13.875 1.00 0.00 C ATOM 1537 O GLY A 101 -16.410 1.062 13.290 1.00 0.00 O ATOM 0 H GLY A 101 -16.151 3.112 14.500 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -18.181 1.967 15.674 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -19.021 2.478 14.223 1.00 0.00 H new ATOM 1541 N GLU A 102 -18.257 -0.081 13.920 1.00 0.00 N ATOM 1542 CA GLU A 102 -17.859 -1.310 13.256 1.00 0.00 C ATOM 1543 C GLU A 102 -18.308 -1.293 11.793 1.00 0.00 C ATOM 1544 O GLU A 102 -19.440 -1.660 11.484 1.00 0.00 O ATOM 1545 CB GLU A 102 -18.416 -2.534 13.986 1.00 0.00 C ATOM 1546 CG GLU A 102 -17.434 -3.034 15.047 1.00 0.00 C ATOM 1547 CD GLU A 102 -18.105 -4.038 15.986 1.00 0.00 C ATOM 1548 OE1 GLU A 102 -18.870 -3.575 16.859 1.00 0.00 O ATOM 1549 OE2 GLU A 102 -17.839 -5.247 15.809 1.00 0.00 O ATOM 0 H GLU A 102 -19.152 -0.130 14.406 1.00 0.00 H new ATOM 0 HA GLU A 102 -16.771 -1.377 13.281 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -19.366 -2.280 14.456 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -18.617 -3.329 13.268 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -16.576 -3.501 14.563 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -17.054 -2.190 15.623 1.00 0.00 H new ATOM 1556 N TYR A 103 -17.397 -0.862 10.933 1.00 0.00 N ATOM 1557 CA TYR A 103 -17.686 -0.791 9.511 1.00 0.00 C ATOM 1558 C TYR A 103 -16.597 -1.491 8.695 1.00 0.00 C ATOM 1559 O TYR A 103 -15.463 -1.625 9.153 1.00 0.00 O ATOM 1560 CB TYR A 103 -17.695 0.697 9.155 1.00 0.00 C ATOM 1561 CG TYR A 103 -18.879 1.469 9.740 1.00 0.00 C ATOM 1562 CD1 TYR A 103 -20.060 1.561 9.032 1.00 0.00 C ATOM 1563 CD2 TYR A 103 -18.767 2.073 10.976 1.00 0.00 C ATOM 1564 CE1 TYR A 103 -21.175 2.288 9.582 1.00 0.00 C ATOM 1565 CE2 TYR A 103 -19.882 2.800 11.526 1.00 0.00 C ATOM 1566 CZ TYR A 103 -21.031 2.871 10.802 1.00 0.00 C ATOM 1567 OH TYR A 103 -22.084 3.558 11.321 1.00 0.00 O ATOM 0 H TYR A 103 -16.459 -0.559 11.194 1.00 0.00 H new ATOM 0 HA TYR A 103 -18.634 -1.280 9.288 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -16.769 1.150 9.508 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -17.707 0.801 8.070 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -20.148 1.088 8.065 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -17.843 2.000 11.531 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -22.104 2.368 9.038 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -19.807 3.278 12.492 1.00 0.00 H new ATOM 0 HH TYR A 103 -21.838 3.920 12.198 1.00 0.00 H new ATOM 1577 N TRP A 104 -16.980 -1.919 7.501 1.00 0.00 N ATOM 1578 CA TRP A 104 -16.050 -2.602 6.617 1.00 0.00 C ATOM 1579 C TRP A 104 -15.619 -1.615 5.531 1.00 0.00 C ATOM 1580 O TRP A 104 -16.283 -1.489 4.503 1.00 0.00 O ATOM 1581 CB TRP A 104 -16.670 -3.881 6.052 1.00 0.00 C ATOM 1582 CG TRP A 104 -17.838 -3.636 5.093 1.00 0.00 C ATOM 1583 CD1 TRP A 104 -17.834 -3.699 3.755 1.00 0.00 C ATOM 1584 CD2 TRP A 104 -19.189 -3.282 5.457 1.00 0.00 C ATOM 1585 NE1 TRP A 104 -19.078 -3.414 3.231 1.00 0.00 N ATOM 1586 CE2 TRP A 104 -19.928 -3.152 4.299 1.00 0.00 C ATOM 1587 CE3 TRP A 104 -19.767 -3.078 6.722 1.00 0.00 C ATOM 1588 CZ2 TRP A 104 -21.287 -2.814 4.291 1.00 0.00 C ATOM 1589 CZ3 TRP A 104 -21.125 -2.741 6.697 1.00 0.00 C ATOM 1590 CH2 TRP A 104 -21.884 -2.607 5.541 1.00 0.00 C ATOM 0 H TRP A 104 -17.921 -1.806 7.125 1.00 0.00 H new ATOM 0 HA TRP A 104 -15.164 -2.926 7.164 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -15.898 -4.447 5.531 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -17.016 -4.501 6.879 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -16.966 -3.942 3.161 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -19.328 -3.398 2.242 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -19.207 -3.174 7.641 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -21.844 -2.718 3.371 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -21.618 -2.573 7.643 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -22.930 -2.344 5.606 1.00 0.00 H new ATOM 1601 N TRP A 105 -14.509 -0.942 5.794 1.00 0.00 N ATOM 1602 CA TRP A 105 -13.981 0.030 4.852 1.00 0.00 C ATOM 1603 C TRP A 105 -13.525 -0.724 3.601 1.00 0.00 C ATOM 1604 O TRP A 105 -12.356 -1.085 3.481 1.00 0.00 O ATOM 1605 CB TRP A 105 -12.866 0.862 5.488 1.00 0.00 C ATOM 1606 CG TRP A 105 -13.368 1.987 6.394 1.00 0.00 C ATOM 1607 CD1 TRP A 105 -14.064 1.881 7.534 1.00 0.00 C ATOM 1608 CD2 TRP A 105 -13.184 3.404 6.187 1.00 0.00 C ATOM 1609 NE1 TRP A 105 -14.341 3.119 8.076 1.00 0.00 N ATOM 1610 CE2 TRP A 105 -13.789 4.075 7.231 1.00 0.00 C ATOM 1611 CE3 TRP A 105 -12.529 4.095 5.153 1.00 0.00 C ATOM 1612 CZ2 TRP A 105 -13.798 5.471 7.341 1.00 0.00 C ATOM 1613 CZ3 TRP A 105 -12.547 5.489 5.279 1.00 0.00 C ATOM 1614 CH2 TRP A 105 -13.151 6.180 6.323 1.00 0.00 C ATOM 0 H TRP A 105 -13.960 -1.051 6.647 1.00 0.00 H new ATOM 0 HA TRP A 105 -14.751 0.747 4.566 1.00 0.00 H new ATOM 0 HB2 TRP A 105 -12.221 0.203 6.069 1.00 0.00 H new ATOM 0 HB3 TRP A 105 -12.252 1.293 4.697 1.00 0.00 H new ATOM 0 HD1 TRP A 105 -14.370 0.943 7.974 1.00 0.00 H new ATOM 0 HE1 TRP A 105 -14.856 3.300 8.938 1.00 0.00 H new ATOM 0 HE3 TRP A 105 -12.050 3.591 4.327 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 -14.279 5.973 8.167 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 -12.057 6.069 4.511 1.00 0.00 H new ATOM 0 HH2 TRP A 105 -13.121 7.259 6.348 1.00 0.00 H new ATOM 1625 N ASN A 106 -14.473 -0.940 2.701 1.00 0.00 N ATOM 1626 CA ASN A 106 -14.184 -1.645 1.463 1.00 0.00 C ATOM 1627 C ASN A 106 -13.152 -0.851 0.659 1.00 0.00 C ATOM 1628 O ASN A 106 -12.547 -1.379 -0.273 1.00 0.00 O ATOM 1629 CB ASN A 106 -15.442 -1.791 0.605 1.00 0.00 C ATOM 1630 CG ASN A 106 -16.202 -0.466 0.516 1.00 0.00 C ATOM 1631 OD1 ASN A 106 -15.759 0.566 0.991 1.00 0.00 O ATOM 1632 ND2 ASN A 106 -17.368 -0.553 -0.117 1.00 0.00 N ATOM 0 H ASN A 106 -15.442 -0.639 2.804 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.806 -2.635 1.719 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -15.167 -2.125 -0.396 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -16.089 -2.558 1.030 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -17.951 0.277 -0.229 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.680 -1.449 -0.491 1.00 0.00 H new ATOM 1639 N ALA A 107 -12.984 0.404 1.048 1.00 0.00 N ATOM 1640 CA ALA A 107 -12.037 1.276 0.375 1.00 0.00 C ATOM 1641 C ALA A 107 -11.898 2.578 1.165 1.00 0.00 C ATOM 1642 O ALA A 107 -12.733 2.886 2.014 1.00 0.00 O ATOM 1643 CB ALA A 107 -12.496 1.514 -1.065 1.00 0.00 C ATOM 0 H ALA A 107 -13.488 0.838 1.821 1.00 0.00 H new ATOM 0 HA ALA A 107 -11.052 0.811 0.331 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -11.785 2.168 -1.570 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -12.550 0.561 -1.592 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -13.480 1.982 -1.060 1.00 0.00 H new ATOM 1649 N ILE A 108 -10.836 3.309 0.858 1.00 0.00 N ATOM 1650 CA ILE A 108 -10.577 4.571 1.529 1.00 0.00 C ATOM 1651 C ILE A 108 -11.484 5.653 0.939 1.00 0.00 C ATOM 1652 O ILE A 108 -12.287 6.252 1.652 1.00 0.00 O ATOM 1653 CB ILE A 108 -9.088 4.916 1.467 1.00 0.00 C ATOM 1654 CG1 ILE A 108 -8.240 3.794 2.070 1.00 0.00 C ATOM 1655 CG2 ILE A 108 -8.808 6.265 2.131 1.00 0.00 C ATOM 1656 CD1 ILE A 108 -8.121 3.951 3.587 1.00 0.00 C ATOM 0 H ILE A 108 -10.145 3.051 0.153 1.00 0.00 H new ATOM 0 HA ILE A 108 -10.819 4.495 2.589 1.00 0.00 H new ATOM 0 HB ILE A 108 -8.803 5.009 0.419 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -8.688 2.828 1.835 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -7.247 3.803 1.621 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -7.742 6.485 2.072 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -9.369 7.046 1.618 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -9.114 6.226 3.177 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.513 3.141 3.990 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -7.651 4.907 3.818 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -9.114 3.917 4.035 1.00 0.00 H new ATOM 1668 N LEU A 109 -11.324 5.871 -0.358 1.00 0.00 N ATOM 1669 CA LEU A 109 -12.118 6.870 -1.053 1.00 0.00 C ATOM 1670 C LEU A 109 -13.246 6.177 -1.819 1.00 0.00 C ATOM 1671 O LEU A 109 -13.273 4.951 -1.916 1.00 0.00 O ATOM 1672 CB LEU A 109 -11.225 7.747 -1.933 1.00 0.00 C ATOM 1673 CG LEU A 109 -9.991 8.343 -1.253 1.00 0.00 C ATOM 1674 CD1 LEU A 109 -9.141 9.131 -2.252 1.00 0.00 C ATOM 1675 CD2 LEU A 109 -10.387 9.192 -0.043 1.00 0.00 C ATOM 0 H LEU A 109 -10.656 5.373 -0.946 1.00 0.00 H new ATOM 0 HA LEU A 109 -12.587 7.548 -0.339 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.895 7.154 -2.786 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -11.828 8.565 -2.328 1.00 0.00 H new ATOM 0 HG LEU A 109 -9.376 7.523 -0.883 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -8.270 9.544 -1.743 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -8.813 8.468 -3.053 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -9.734 9.943 -2.673 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -9.491 9.604 0.422 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -11.035 10.007 -0.367 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -10.918 8.571 0.679 1.00 0.00 H new ATOM 1687 N GLU A 110 -14.150 6.992 -2.343 1.00 0.00 N ATOM 1688 CA GLU A 110 -15.278 6.472 -3.098 1.00 0.00 C ATOM 1689 C GLU A 110 -14.849 6.130 -4.526 1.00 0.00 C ATOM 1690 O GLU A 110 -15.595 5.492 -5.267 1.00 0.00 O ATOM 1691 CB GLU A 110 -16.442 7.464 -3.098 1.00 0.00 C ATOM 1692 CG GLU A 110 -17.352 7.242 -1.888 1.00 0.00 C ATOM 1693 CD GLU A 110 -18.784 7.692 -2.189 1.00 0.00 C ATOM 1694 OE1 GLU A 110 -19.526 6.870 -2.769 1.00 0.00 O ATOM 1695 OE2 GLU A 110 -19.102 8.847 -1.834 1.00 0.00 O ATOM 0 H GLU A 110 -14.124 8.008 -2.260 1.00 0.00 H new ATOM 0 HA GLU A 110 -15.623 5.558 -2.615 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -16.056 8.483 -3.085 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -17.019 7.353 -4.016 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -17.348 6.187 -1.614 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -16.966 7.795 -1.032 1.00 0.00 H new ATOM 1702 N GLY A 111 -13.647 6.570 -4.870 1.00 0.00 N ATOM 1703 CA GLY A 111 -13.110 6.318 -6.196 1.00 0.00 C ATOM 1704 C GLY A 111 -12.477 4.927 -6.277 1.00 0.00 C ATOM 1705 O GLY A 111 -12.584 4.251 -7.299 1.00 0.00 O ATOM 0 H GLY A 111 -13.030 7.099 -4.253 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -13.905 6.403 -6.936 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -12.365 7.075 -6.440 1.00 0.00 H new ATOM 1709 N GLU A 112 -11.832 4.542 -5.186 1.00 0.00 N ATOM 1710 CA GLU A 112 -11.182 3.244 -5.121 1.00 0.00 C ATOM 1711 C GLU A 112 -12.228 2.128 -5.072 1.00 0.00 C ATOM 1712 O GLU A 112 -12.957 1.998 -4.090 1.00 0.00 O ATOM 1713 CB GLU A 112 -10.239 3.163 -3.919 1.00 0.00 C ATOM 1714 CG GLU A 112 -9.140 2.124 -4.153 1.00 0.00 C ATOM 1715 CD GLU A 112 -7.764 2.788 -4.230 1.00 0.00 C ATOM 1716 OE1 GLU A 112 -7.559 3.758 -3.468 1.00 0.00 O ATOM 1717 OE2 GLU A 112 -6.949 2.311 -5.049 1.00 0.00 O ATOM 0 H GLU A 112 -11.745 5.106 -4.340 1.00 0.00 H new ATOM 0 HA GLU A 112 -10.582 3.115 -6.022 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -9.789 4.139 -3.739 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -10.805 2.903 -3.025 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -9.149 1.392 -3.346 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -9.338 1.582 -5.078 1.00 0.00 H new ATOM 1724 N GLU A 113 -12.269 1.352 -6.146 1.00 0.00 N ATOM 1725 CA GLU A 113 -13.214 0.252 -6.238 1.00 0.00 C ATOM 1726 C GLU A 113 -13.233 -0.542 -4.931 1.00 0.00 C ATOM 1727 O GLU A 113 -12.302 -0.453 -4.133 1.00 0.00 O ATOM 1728 CB GLU A 113 -12.886 -0.654 -7.426 1.00 0.00 C ATOM 1729 CG GLU A 113 -11.882 -1.738 -7.028 1.00 0.00 C ATOM 1730 CD GLU A 113 -11.561 -2.651 -8.213 1.00 0.00 C ATOM 1731 OE1 GLU A 113 -10.662 -2.271 -8.995 1.00 0.00 O ATOM 1732 OE2 GLU A 113 -12.222 -3.707 -8.311 1.00 0.00 O ATOM 0 H GLU A 113 -11.663 1.463 -6.959 1.00 0.00 H new ATOM 0 HA GLU A 113 -14.209 0.666 -6.403 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -13.800 -1.118 -7.797 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -12.478 -0.057 -8.241 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -10.966 -1.274 -6.664 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -12.287 -2.330 -6.208 1.00 0.00 H new ATOM 1739 N PRO A 114 -14.333 -1.321 -4.748 1.00 0.00 N ATOM 1740 CA PRO A 114 -14.486 -2.131 -3.551 1.00 0.00 C ATOM 1741 C PRO A 114 -13.579 -3.363 -3.603 1.00 0.00 C ATOM 1742 O PRO A 114 -13.116 -3.752 -4.674 1.00 0.00 O ATOM 1743 CB PRO A 114 -15.964 -2.483 -3.501 1.00 0.00 C ATOM 1744 CG PRO A 114 -16.496 -2.253 -4.906 1.00 0.00 C ATOM 1745 CD PRO A 114 -15.456 -1.452 -5.672 1.00 0.00 C ATOM 0 HA PRO A 114 -14.185 -1.605 -2.645 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -16.108 -3.519 -3.194 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -16.490 -1.860 -2.778 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -16.687 -3.204 -5.402 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -17.443 -1.715 -4.872 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -15.158 -1.963 -6.587 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -15.844 -0.476 -5.964 1.00 0.00 H new ATOM 1753 N ILE A 115 -13.353 -3.941 -2.433 1.00 0.00 N ATOM 1754 CA ILE A 115 -12.510 -5.120 -2.331 1.00 0.00 C ATOM 1755 C ILE A 115 -13.389 -6.352 -2.106 1.00 0.00 C ATOM 1756 O ILE A 115 -14.558 -6.227 -1.742 1.00 0.00 O ATOM 1757 CB ILE A 115 -11.440 -4.923 -1.256 1.00 0.00 C ATOM 1758 CG1 ILE A 115 -12.072 -4.810 0.133 1.00 0.00 C ATOM 1759 CG2 ILE A 115 -10.551 -3.721 -1.581 1.00 0.00 C ATOM 1760 CD1 ILE A 115 -11.022 -4.448 1.185 1.00 0.00 C ATOM 0 H ILE A 115 -13.739 -3.615 -1.547 1.00 0.00 H new ATOM 0 HA ILE A 115 -11.967 -5.281 -3.262 1.00 0.00 H new ATOM 0 HB ILE A 115 -10.799 -5.804 -1.247 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -12.855 -4.052 0.120 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -12.547 -5.754 0.398 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -9.799 -3.603 -0.801 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -10.058 -3.882 -2.540 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -11.162 -2.820 -1.634 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -11.497 -4.374 2.163 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -10.253 -5.220 1.213 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -10.566 -3.491 0.930 1.00 0.00 H new ATOM 1772 N ASP A 116 -12.794 -7.514 -2.331 1.00 0.00 N ATOM 1773 CA ASP A 116 -13.508 -8.767 -2.156 1.00 0.00 C ATOM 1774 C ASP A 116 -13.174 -9.353 -0.783 1.00 0.00 C ATOM 1775 O ASP A 116 -12.391 -10.296 -0.679 1.00 0.00 O ATOM 1776 CB ASP A 116 -13.095 -9.789 -3.218 1.00 0.00 C ATOM 1777 CG ASP A 116 -12.797 -9.201 -4.599 1.00 0.00 C ATOM 1778 OD1 ASP A 116 -13.757 -8.700 -5.222 1.00 0.00 O ATOM 1779 OD2 ASP A 116 -11.615 -9.266 -5.000 1.00 0.00 O ATOM 0 H ASP A 116 -11.825 -7.614 -2.633 1.00 0.00 H new ATOM 0 HA ASP A 116 -14.575 -8.562 -2.247 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -12.210 -10.319 -2.866 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -13.890 -10.528 -3.318 1.00 0.00 H new ATOM 1784 N ILE A 117 -13.784 -8.768 0.238 1.00 0.00 N ATOM 1785 CA ILE A 117 -13.561 -9.220 1.601 1.00 0.00 C ATOM 1786 C ILE A 117 -14.860 -9.806 2.158 1.00 0.00 C ATOM 1787 O ILE A 117 -15.950 -9.411 1.748 1.00 0.00 O ATOM 1788 CB ILE A 117 -12.982 -8.089 2.453 1.00 0.00 C ATOM 1789 CG1 ILE A 117 -11.515 -7.833 2.101 1.00 0.00 C ATOM 1790 CG2 ILE A 117 -13.173 -8.372 3.944 1.00 0.00 C ATOM 1791 CD1 ILE A 117 -10.628 -8.984 2.580 1.00 0.00 C ATOM 0 H ILE A 117 -14.432 -7.985 0.149 1.00 0.00 H new ATOM 0 HA ILE A 117 -12.817 -10.016 1.621 1.00 0.00 H new ATOM 0 HB ILE A 117 -13.532 -7.175 2.226 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -11.411 -7.714 1.023 1.00 0.00 H new ATOM 0 HG13 ILE A 117 -11.185 -6.900 2.558 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -12.752 -7.552 4.527 1.00 0.00 H new ATOM 0 HG22 ILE A 117 -14.237 -8.465 4.163 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -12.666 -9.301 4.206 1.00 0.00 H new ATOM 0 HD11 ILE A 117 -9.590 -8.777 2.317 1.00 0.00 H new ATOM 0 HD12 ILE A 117 -10.715 -9.085 3.662 1.00 0.00 H new ATOM 0 HD13 ILE A 117 -10.945 -9.911 2.102 1.00 0.00 H new ATOM 1803 N ASP A 118 -14.701 -10.740 3.084 1.00 0.00 N ATOM 1804 CA ASP A 118 -15.847 -11.385 3.702 1.00 0.00 C ATOM 1805 C ASP A 118 -16.784 -11.905 2.610 1.00 0.00 C ATOM 1806 O ASP A 118 -17.689 -11.195 2.173 1.00 0.00 O ATOM 1807 CB ASP A 118 -16.633 -10.399 4.569 1.00 0.00 C ATOM 1808 CG ASP A 118 -16.106 -10.229 5.995 1.00 0.00 C ATOM 1809 OD1 ASP A 118 -16.563 -11.002 6.864 1.00 0.00 O ATOM 1810 OD2 ASP A 118 -15.258 -9.331 6.184 1.00 0.00 O ATOM 0 H ASP A 118 -13.795 -11.066 3.421 1.00 0.00 H new ATOM 0 HA ASP A 118 -15.480 -12.200 4.326 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -16.631 -9.426 4.079 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -17.671 -10.729 4.618 1.00 0.00 H new ATOM 1815 N SER A 119 -16.535 -13.140 2.200 1.00 0.00 N ATOM 1816 CA SER A 119 -17.345 -13.763 1.167 1.00 0.00 C ATOM 1817 C SER A 119 -16.920 -15.220 0.977 1.00 0.00 C ATOM 1818 O SER A 119 -16.248 -15.552 0.001 1.00 0.00 O ATOM 1819 CB SER A 119 -17.234 -13.001 -0.155 1.00 0.00 C ATOM 1820 OG SER A 119 -18.388 -13.179 -0.973 1.00 0.00 O ATOM 0 H SER A 119 -15.784 -13.726 2.564 1.00 0.00 H new ATOM 0 HA SER A 119 -18.387 -13.733 1.485 1.00 0.00 H new ATOM 0 HB2 SER A 119 -17.095 -11.939 0.049 1.00 0.00 H new ATOM 0 HB3 SER A 119 -16.351 -13.340 -0.696 1.00 0.00 H new ATOM 0 HG SER A 119 -18.279 -12.676 -1.807 1.00 0.00 H new ATOM 1826 N GLY A 120 -17.329 -16.051 1.924 1.00 0.00 N ATOM 1827 CA GLY A 120 -16.999 -17.465 1.873 1.00 0.00 C ATOM 1828 C GLY A 120 -16.894 -18.055 3.281 1.00 0.00 C ATOM 1829 O GLY A 120 -16.992 -17.331 4.270 1.00 0.00 O ATOM 0 H GLY A 120 -17.886 -15.772 2.732 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -17.762 -18.000 1.307 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -16.055 -17.603 1.346 1.00 0.00 H new ATOM 1833 N PRO A 121 -16.691 -19.399 3.327 1.00 0.00 N ATOM 1834 CA PRO A 121 -16.572 -20.095 4.597 1.00 0.00 C ATOM 1835 C PRO A 121 -15.209 -19.832 5.240 1.00 0.00 C ATOM 1836 O PRO A 121 -15.131 -19.277 6.335 1.00 0.00 O ATOM 1837 CB PRO A 121 -16.800 -21.560 4.266 1.00 0.00 C ATOM 1838 CG PRO A 121 -16.577 -21.689 2.768 1.00 0.00 C ATOM 1839 CD PRO A 121 -16.571 -20.289 2.176 1.00 0.00 C ATOM 0 HA PRO A 121 -17.296 -19.750 5.335 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -16.111 -22.197 4.820 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -17.809 -21.869 4.539 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -15.632 -22.194 2.565 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -17.364 -22.292 2.315 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -15.652 -20.098 1.622 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -17.398 -20.150 1.480 1.00 0.00 H new ATOM 1847 N SER A 122 -14.167 -20.243 4.532 1.00 0.00 N ATOM 1848 CA SER A 122 -12.811 -20.059 5.020 1.00 0.00 C ATOM 1849 C SER A 122 -12.658 -18.664 5.628 1.00 0.00 C ATOM 1850 O SER A 122 -12.362 -18.529 6.814 1.00 0.00 O ATOM 1851 CB SER A 122 -11.790 -20.264 3.899 1.00 0.00 C ATOM 1852 OG SER A 122 -10.452 -20.258 4.388 1.00 0.00 O ATOM 0 H SER A 122 -14.235 -20.703 3.624 1.00 0.00 H new ATOM 0 HA SER A 122 -12.620 -20.807 5.790 1.00 0.00 H new ATOM 0 HB2 SER A 122 -11.988 -21.211 3.397 1.00 0.00 H new ATOM 0 HB3 SER A 122 -11.907 -19.477 3.154 1.00 0.00 H new ATOM 0 HG SER A 122 -9.831 -20.393 3.642 1.00 0.00 H new ATOM 1858 N SER A 123 -12.868 -17.661 4.788 1.00 0.00 N ATOM 1859 CA SER A 123 -12.758 -16.281 5.229 1.00 0.00 C ATOM 1860 C SER A 123 -11.333 -15.997 5.709 1.00 0.00 C ATOM 1861 O SER A 123 -10.625 -16.908 6.134 1.00 0.00 O ATOM 1862 CB SER A 123 -13.763 -15.975 6.341 1.00 0.00 C ATOM 1863 OG SER A 123 -14.335 -14.677 6.202 1.00 0.00 O ATOM 0 H SER A 123 -13.114 -17.777 3.805 1.00 0.00 H new ATOM 0 HA SER A 123 -12.986 -15.633 4.383 1.00 0.00 H new ATOM 0 HB2 SER A 123 -14.555 -16.723 6.329 1.00 0.00 H new ATOM 0 HB3 SER A 123 -13.267 -16.051 7.309 1.00 0.00 H new ATOM 0 HG SER A 123 -14.972 -14.521 6.930 1.00 0.00 H new ATOM 1869 N GLY A 124 -10.956 -14.730 5.624 1.00 0.00 N ATOM 1870 CA GLY A 124 -9.628 -14.314 6.044 1.00 0.00 C ATOM 1871 C GLY A 124 -9.014 -13.339 5.037 1.00 0.00 C ATOM 1872 O GLY A 124 -7.793 -13.255 4.915 1.00 0.00 O ATOM 0 H GLY A 124 -11.547 -13.977 5.270 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -9.684 -13.842 7.025 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -8.985 -15.188 6.148 1.00 0.00 H new TER 1876 GLY A 124