USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 646 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: B 221 TYR OH : rot 30:sc= -0.356 USER MOD Set 1.2: B 245 THR OG1 : rot 102:sc= 1.15 USER MOD Set 2.1: A 6 TYR OH : rot 150:sc= -1.68 USER MOD Set 2.2: B 212 ASN : amide:sc= -11.2! C(o=-13!,f=-14!) USER MOD Set 3.1: A 21 TYR OH : rot 65:sc= 0.0304 USER MOD Set 3.2: A 45 THR OG1 : rot 88:sc= 0.38 USER MOD Set 4.1: A 13 ASN : amide:sc= 0 X(o=0,f=0.064) USER MOD Set 4.2: B 207 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 12 ASN : amide:sc= -6.15! C(o=-6.2!,f=-13!) USER MOD Set 5.2: B 206 TYR OH : rot 180:sc=-0.00254 USER MOD Set 6.1: A 11 THR OG1 : rot 131:sc= -2.26 USER MOD Set 6.2: A 18 SER OG : rot 45:sc= 0.76 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= -2.54 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot -21:sc= -2.66! USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.367 X(o=-0.37,f=-0.37) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.251 USER MOD Single : A 40 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0393) USER MOD Single : A 44 ASN : amide:sc= -0.17 X(o=-0.17,f=0) USER MOD Single : B 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 205 THR OG1 : rot 180:sc= -3.56! USER MOD Single : B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : B 211 THR OG1 : rot 160:sc= -3.03 USER MOD Single : B 213 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 214 SER OG : rot 180:sc= 0 USER MOD Single : B 215 ASN :FLIP amide:sc= -0.273 F(o=-1.1,f=-0.27) USER MOD Single : B 218 SER OG : rot 180:sc= 0 USER MOD Single : B 223 THR OG1 : rot 180:sc= 0 USER MOD Single : B 225 THR OG1 : rot 180:sc= -0.234 USER MOD Single : B 227 MET CE :methyl 153:sc= -0.905! (180deg=-3.84!) USER MOD Single : B 228 THR OG1 : rot -170:sc= -0.707 USER MOD Single : B 240 LYS NZ :NH3+ -126:sc= -0.11 (180deg=-1.95!) USER MOD Single : B 244 ASN :FLIP amide:sc= -0.734 F(o=-1.4!,f=-0.73) USER MOD ----------------------------------------------------------------- ATOM 25 N LYS A 3 -1.581 -20.100 -6.742 1.00 0.00 N ATOM 26 CA LYS A 3 -0.583 -19.834 -5.719 1.00 0.00 C ATOM 27 C LYS A 3 -1.092 -18.729 -4.793 1.00 0.00 C ATOM 28 O LYS A 3 -2.078 -18.060 -5.101 1.00 0.00 O ATOM 29 CB LYS A 3 0.771 -19.525 -6.361 1.00 0.00 C ATOM 30 CG LYS A 3 1.468 -20.809 -6.815 1.00 0.00 C ATOM 31 CD LYS A 3 0.453 -21.831 -7.331 1.00 0.00 C ATOM 32 CE LYS A 3 1.158 -23.024 -7.980 1.00 0.00 C ATOM 33 NZ LYS A 3 0.823 -23.105 -9.419 1.00 0.00 N ATOM 0 HA LYS A 3 -0.423 -20.718 -5.102 1.00 0.00 H new ATOM 0 HB2 LYS A 3 0.630 -18.862 -7.215 1.00 0.00 H new ATOM 0 HB3 LYS A 3 1.403 -18.996 -5.648 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.188 -20.578 -7.600 1.00 0.00 H new ATOM 0 HG3 LYS A 3 2.029 -21.236 -5.984 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -0.171 -22.177 -6.507 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -0.209 -21.357 -8.055 1.00 0.00 H new ATOM 0 HE2 LYS A 3 2.237 -22.927 -7.857 1.00 0.00 H new ATOM 0 HE3 LYS A 3 0.861 -23.946 -7.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 1.310 -23.920 -9.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.205 -23.219 -9.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 1.128 -22.233 -9.896 1.00 0.00 H new ATOM 47 N ALA A 4 -0.396 -18.569 -3.676 1.00 0.00 N ATOM 48 CA ALA A 4 -0.765 -17.556 -2.703 1.00 0.00 C ATOM 49 C ALA A 4 0.235 -16.400 -2.773 1.00 0.00 C ATOM 50 O ALA A 4 1.281 -16.439 -2.127 1.00 0.00 O ATOM 51 CB ALA A 4 -0.831 -18.186 -1.310 1.00 0.00 C ATOM 0 H ALA A 4 0.421 -19.125 -3.424 1.00 0.00 H new ATOM 0 HA ALA A 4 -1.753 -17.152 -2.925 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -1.108 -17.426 -0.580 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -1.576 -18.982 -1.306 1.00 0.00 H new ATOM 0 HB3 ALA A 4 0.144 -18.600 -1.051 1.00 0.00 H new ATOM 57 N THR A 5 -0.122 -15.398 -3.562 1.00 0.00 N ATOM 58 CA THR A 5 0.730 -14.232 -3.725 1.00 0.00 C ATOM 59 C THR A 5 -0.110 -12.954 -3.738 1.00 0.00 C ATOM 60 O THR A 5 -1.294 -12.989 -4.069 1.00 0.00 O ATOM 61 CB THR A 5 1.560 -14.427 -4.996 1.00 0.00 C ATOM 62 OG1 THR A 5 0.587 -14.626 -6.018 1.00 0.00 O ATOM 63 CG2 THR A 5 2.356 -15.734 -4.980 1.00 0.00 C ATOM 0 H THR A 5 -0.991 -15.369 -4.096 1.00 0.00 H new ATOM 0 HA THR A 5 1.416 -14.123 -2.885 1.00 0.00 H new ATOM 0 HB THR A 5 2.244 -13.587 -5.116 1.00 0.00 H new ATOM 0 HG1 THR A 5 1.038 -14.759 -6.878 1.00 0.00 H new ATOM 0 HG21 THR A 5 2.927 -15.823 -5.904 1.00 0.00 H new ATOM 0 HG22 THR A 5 3.038 -15.734 -4.130 1.00 0.00 H new ATOM 0 HG23 THR A 5 1.670 -16.577 -4.894 1.00 0.00 H new ATOM 71 N TYR A 6 0.536 -11.856 -3.374 1.00 0.00 N ATOM 72 CA TYR A 6 -0.138 -10.569 -3.340 1.00 0.00 C ATOM 73 C TYR A 6 0.710 -9.488 -4.015 1.00 0.00 C ATOM 74 O TYR A 6 1.920 -9.422 -3.805 1.00 0.00 O ATOM 75 CB TYR A 6 -0.303 -10.219 -1.860 1.00 0.00 C ATOM 76 CG TYR A 6 -1.600 -10.742 -1.238 1.00 0.00 C ATOM 77 CD1 TYR A 6 -1.838 -12.100 -1.179 1.00 0.00 C ATOM 78 CD2 TYR A 6 -2.532 -9.856 -0.737 1.00 0.00 C ATOM 79 CE1 TYR A 6 -3.059 -12.592 -0.594 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.752 -10.348 -0.152 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.955 -11.692 -0.109 1.00 0.00 C ATOM 82 OH TYR A 6 -5.107 -12.157 0.444 1.00 0.00 O ATOM 0 H TYR A 6 1.518 -11.831 -3.100 1.00 0.00 H new ATOM 0 HA TYR A 6 -1.091 -10.621 -3.867 1.00 0.00 H new ATOM 0 HB2 TYR A 6 0.543 -10.624 -1.305 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -0.269 -9.135 -1.747 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -1.109 -12.794 -1.571 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -2.346 -8.793 -0.784 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -3.258 -13.652 -0.542 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -4.489 -9.665 0.244 1.00 0.00 H new ATOM 0 HH TYR A 6 -5.411 -11.536 1.138 1.00 0.00 H new ATOM 92 N THR A 7 0.041 -8.669 -4.812 1.00 0.00 N ATOM 93 CA THR A 7 0.718 -7.595 -5.520 1.00 0.00 C ATOM 94 C THR A 7 0.244 -6.235 -5.003 1.00 0.00 C ATOM 95 O THR A 7 -0.923 -5.880 -5.157 1.00 0.00 O ATOM 96 CB THR A 7 0.479 -7.792 -7.018 1.00 0.00 C ATOM 97 OG1 THR A 7 1.288 -8.916 -7.353 1.00 0.00 O ATOM 98 CG2 THR A 7 1.059 -6.653 -7.859 1.00 0.00 C ATOM 0 H THR A 7 -0.963 -8.727 -4.984 1.00 0.00 H new ATOM 0 HA THR A 7 1.793 -7.619 -5.342 1.00 0.00 H new ATOM 0 HB THR A 7 -0.591 -7.874 -7.207 1.00 0.00 H new ATOM 0 HG1 THR A 7 1.192 -9.115 -8.308 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.862 -6.843 -8.914 1.00 0.00 H new ATOM 0 HG22 THR A 7 0.594 -5.712 -7.566 1.00 0.00 H new ATOM 0 HG23 THR A 7 2.135 -6.592 -7.696 1.00 0.00 H new ATOM 106 N VAL A 8 1.175 -5.510 -4.401 1.00 0.00 N ATOM 107 CA VAL A 8 0.869 -4.197 -3.860 1.00 0.00 C ATOM 108 C VAL A 8 1.357 -3.123 -4.834 1.00 0.00 C ATOM 109 O VAL A 8 2.532 -3.096 -5.196 1.00 0.00 O ATOM 110 CB VAL A 8 1.470 -4.053 -2.461 1.00 0.00 C ATOM 111 CG1 VAL A 8 1.363 -2.610 -1.964 1.00 0.00 C ATOM 112 CG2 VAL A 8 0.810 -5.022 -1.478 1.00 0.00 C ATOM 0 H VAL A 8 2.143 -5.807 -4.276 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.208 -4.071 -3.750 1.00 0.00 H new ATOM 0 HB VAL A 8 2.528 -4.308 -2.523 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.798 -2.535 -0.967 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.901 -1.950 -2.645 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.314 -2.315 -1.926 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.256 -4.899 -0.491 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.258 -4.812 -1.422 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.962 -6.046 -1.819 1.00 0.00 H new ATOM 122 N THR A 9 0.430 -2.263 -5.230 1.00 0.00 N ATOM 123 CA THR A 9 0.751 -1.189 -6.155 1.00 0.00 C ATOM 124 C THR A 9 0.600 0.170 -5.467 1.00 0.00 C ATOM 125 O THR A 9 -0.398 0.422 -4.795 1.00 0.00 O ATOM 126 CB THR A 9 -0.138 -1.347 -7.390 1.00 0.00 C ATOM 127 OG1 THR A 9 -0.221 -2.757 -7.581 1.00 0.00 O ATOM 128 CG2 THR A 9 0.536 -0.838 -8.666 1.00 0.00 C ATOM 0 H THR A 9 -0.544 -2.288 -4.927 1.00 0.00 H new ATOM 0 HA THR A 9 1.791 -1.242 -6.477 1.00 0.00 H new ATOM 0 HB THR A 9 -1.073 -0.810 -7.234 1.00 0.00 H new ATOM 0 HG1 THR A 9 0.533 -3.193 -7.132 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.138 -0.974 -9.512 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.772 0.220 -8.556 1.00 0.00 H new ATOM 0 HG23 THR A 9 1.455 -1.398 -8.840 1.00 0.00 H new ATOM 136 N VAL A 10 1.607 1.009 -5.660 1.00 0.00 N ATOM 137 CA VAL A 10 1.600 2.335 -5.067 1.00 0.00 C ATOM 138 C VAL A 10 1.913 3.374 -6.147 1.00 0.00 C ATOM 139 O VAL A 10 2.955 3.304 -6.797 1.00 0.00 O ATOM 140 CB VAL A 10 2.573 2.387 -3.888 1.00 0.00 C ATOM 141 CG1 VAL A 10 3.026 3.822 -3.613 1.00 0.00 C ATOM 142 CG2 VAL A 10 1.953 1.759 -2.639 1.00 0.00 C ATOM 0 H VAL A 10 2.433 0.796 -6.219 1.00 0.00 H new ATOM 0 HA VAL A 10 0.613 2.569 -4.667 1.00 0.00 H new ATOM 0 HB VAL A 10 3.454 1.804 -4.155 1.00 0.00 H new ATOM 0 HG11 VAL A 10 3.717 3.830 -2.770 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.526 4.221 -4.496 1.00 0.00 H new ATOM 0 HG13 VAL A 10 2.159 4.438 -3.377 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.665 1.809 -1.815 1.00 0.00 H new ATOM 0 HG22 VAL A 10 1.048 2.303 -2.369 1.00 0.00 H new ATOM 0 HG23 VAL A 10 1.704 0.717 -2.841 1.00 0.00 H new ATOM 152 N THR A 11 0.993 4.313 -6.305 1.00 0.00 N ATOM 153 CA THR A 11 1.158 5.365 -7.294 1.00 0.00 C ATOM 154 C THR A 11 0.973 6.739 -6.648 1.00 0.00 C ATOM 155 O THR A 11 0.126 6.908 -5.772 1.00 0.00 O ATOM 156 CB THR A 11 0.178 5.094 -8.439 1.00 0.00 C ATOM 157 OG1 THR A 11 0.597 3.839 -8.965 1.00 0.00 O ATOM 158 CG2 THR A 11 0.360 6.067 -9.606 1.00 0.00 C ATOM 0 H THR A 11 0.130 4.368 -5.764 1.00 0.00 H new ATOM 0 HA THR A 11 2.168 5.368 -7.704 1.00 0.00 H new ATOM 0 HB THR A 11 -0.844 5.161 -8.066 1.00 0.00 H new ATOM 0 HG1 THR A 11 -0.178 3.246 -9.053 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.359 5.832 -10.391 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.197 7.087 -9.258 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.372 5.976 -10.001 1.00 0.00 H new ATOM 166 N ASN A 12 1.780 7.685 -7.105 1.00 0.00 N ATOM 167 CA ASN A 12 1.716 9.039 -6.582 1.00 0.00 C ATOM 168 C ASN A 12 0.938 9.923 -7.560 1.00 0.00 C ATOM 169 O ASN A 12 1.477 10.350 -8.580 1.00 0.00 O ATOM 170 CB ASN A 12 3.116 9.634 -6.420 1.00 0.00 C ATOM 171 CG ASN A 12 4.111 8.572 -5.947 1.00 0.00 C ATOM 172 OD1 ASN A 12 3.751 7.461 -5.592 1.00 0.00 O ATOM 173 ND2 ASN A 12 5.379 8.974 -5.959 1.00 0.00 N ATOM 0 H ASN A 12 2.481 7.541 -7.831 1.00 0.00 H new ATOM 0 HA ASN A 12 1.225 9.001 -5.610 1.00 0.00 H new ATOM 0 HB2 ASN A 12 3.449 10.053 -7.370 1.00 0.00 H new ATOM 0 HB3 ASN A 12 3.086 10.454 -5.703 1.00 0.00 H new ATOM 0 HD21 ASN A 12 6.118 8.338 -5.659 1.00 0.00 H new ATOM 0 HD22 ASN A 12 5.612 9.918 -6.268 1.00 0.00 H new ATOM 180 N ASN A 13 -0.317 10.170 -7.214 1.00 0.00 N ATOM 181 CA ASN A 13 -1.175 10.994 -8.049 1.00 0.00 C ATOM 182 C ASN A 13 -0.563 12.391 -8.177 1.00 0.00 C ATOM 183 O ASN A 13 -0.978 13.179 -9.026 1.00 0.00 O ATOM 184 CB ASN A 13 -2.566 11.143 -7.431 1.00 0.00 C ATOM 185 CG ASN A 13 -3.619 10.417 -8.271 1.00 0.00 C ATOM 186 OD1 ASN A 13 -4.091 10.910 -9.283 1.00 0.00 O ATOM 187 ND2 ASN A 13 -3.960 9.223 -7.797 1.00 0.00 N ATOM 0 H ASN A 13 -0.760 9.814 -6.367 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.263 10.512 -9.023 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -2.563 10.741 -6.418 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -2.822 12.200 -7.354 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.656 8.660 -8.286 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -3.526 8.870 -6.944 1.00 0.00 H new ATOM 194 N SER A 14 0.414 12.655 -7.322 1.00 0.00 N ATOM 195 CA SER A 14 1.087 13.944 -7.330 1.00 0.00 C ATOM 196 C SER A 14 2.156 13.970 -8.425 1.00 0.00 C ATOM 197 O SER A 14 2.377 15.001 -9.057 1.00 0.00 O ATOM 198 CB SER A 14 1.716 14.245 -5.968 1.00 0.00 C ATOM 199 OG SER A 14 3.128 14.059 -5.979 1.00 0.00 O ATOM 0 H SER A 14 0.756 11.999 -6.619 1.00 0.00 H new ATOM 0 HA SER A 14 0.345 14.716 -7.537 1.00 0.00 H new ATOM 0 HB2 SER A 14 1.488 15.272 -5.682 1.00 0.00 H new ATOM 0 HB3 SER A 14 1.271 13.598 -5.212 1.00 0.00 H new ATOM 0 HG SER A 14 3.492 14.263 -5.092 1.00 0.00 H new ATOM 205 N ASN A 15 2.789 12.821 -8.616 1.00 0.00 N ATOM 206 CA ASN A 15 3.829 12.700 -9.623 1.00 0.00 C ATOM 207 C ASN A 15 3.328 11.808 -10.762 1.00 0.00 C ATOM 208 O ASN A 15 4.039 11.586 -11.740 1.00 0.00 O ATOM 209 CB ASN A 15 5.089 12.058 -9.040 1.00 0.00 C ATOM 210 CG ASN A 15 6.332 12.886 -9.376 1.00 0.00 C ATOM 211 OD1 ASN A 15 6.342 14.102 -9.285 1.00 0.00 O ATOM 212 ND2 ASN A 15 7.375 12.159 -9.769 1.00 0.00 N ATOM 0 H ASN A 15 2.602 11.967 -8.091 1.00 0.00 H new ATOM 0 HA ASN A 15 4.068 13.701 -9.983 1.00 0.00 H new ATOM 0 HB2 ASN A 15 4.989 11.968 -7.958 1.00 0.00 H new ATOM 0 HB3 ASN A 15 5.203 11.048 -9.434 1.00 0.00 H new ATOM 0 HD21 ASN A 15 8.252 12.617 -10.017 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.298 11.143 -9.823 1.00 0.00 H new ATOM 219 N GLY A 16 2.108 11.320 -10.596 1.00 0.00 N ATOM 220 CA GLY A 16 1.504 10.457 -11.596 1.00 0.00 C ATOM 221 C GLY A 16 2.359 9.211 -11.835 1.00 0.00 C ATOM 222 O GLY A 16 2.175 8.508 -12.828 1.00 0.00 O ATOM 0 H GLY A 16 1.521 11.506 -9.783 1.00 0.00 H new ATOM 0 HA2 GLY A 16 0.507 10.161 -11.271 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.385 11.005 -12.531 1.00 0.00 H new ATOM 226 N VAL A 17 3.277 8.977 -10.909 1.00 0.00 N ATOM 227 CA VAL A 17 4.161 7.829 -11.005 1.00 0.00 C ATOM 228 C VAL A 17 3.523 6.636 -10.290 1.00 0.00 C ATOM 229 O VAL A 17 2.962 6.787 -9.206 1.00 0.00 O ATOM 230 CB VAL A 17 5.545 8.185 -10.456 1.00 0.00 C ATOM 231 CG1 VAL A 17 6.422 6.938 -10.329 1.00 0.00 C ATOM 232 CG2 VAL A 17 6.223 9.246 -11.325 1.00 0.00 C ATOM 0 H VAL A 17 3.427 9.564 -10.088 1.00 0.00 H new ATOM 0 HA VAL A 17 4.303 7.544 -12.048 1.00 0.00 H new ATOM 0 HB VAL A 17 5.412 8.604 -9.458 1.00 0.00 H new ATOM 0 HG11 VAL A 17 7.399 7.219 -9.937 1.00 0.00 H new ATOM 0 HG12 VAL A 17 5.949 6.228 -9.650 1.00 0.00 H new ATOM 0 HG13 VAL A 17 6.543 6.477 -11.309 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.204 9.481 -10.913 1.00 0.00 H new ATOM 0 HG22 VAL A 17 6.337 8.866 -12.340 1.00 0.00 H new ATOM 0 HG23 VAL A 17 5.611 10.148 -11.342 1.00 0.00 H new ATOM 242 N SER A 18 3.631 5.478 -10.925 1.00 0.00 N ATOM 243 CA SER A 18 3.071 4.262 -10.363 1.00 0.00 C ATOM 244 C SER A 18 4.182 3.238 -10.119 1.00 0.00 C ATOM 245 O SER A 18 5.230 3.289 -10.762 1.00 0.00 O ATOM 246 CB SER A 18 2.000 3.671 -11.282 1.00 0.00 C ATOM 247 OG SER A 18 1.436 2.477 -10.748 1.00 0.00 O ATOM 0 H SER A 18 4.098 5.357 -11.824 1.00 0.00 H new ATOM 0 HA SER A 18 2.599 4.512 -9.413 1.00 0.00 H new ATOM 0 HB2 SER A 18 1.211 4.406 -11.438 1.00 0.00 H new ATOM 0 HB3 SER A 18 2.437 3.460 -12.258 1.00 0.00 H new ATOM 0 HG SER A 18 1.233 2.607 -9.798 1.00 0.00 H new ATOM 253 N VAL A 19 3.917 2.334 -9.187 1.00 0.00 N ATOM 254 CA VAL A 19 4.881 1.302 -8.850 1.00 0.00 C ATOM 255 C VAL A 19 4.148 0.103 -8.244 1.00 0.00 C ATOM 256 O VAL A 19 3.301 0.268 -7.367 1.00 0.00 O ATOM 257 CB VAL A 19 5.957 1.873 -7.925 1.00 0.00 C ATOM 258 CG1 VAL A 19 6.568 0.776 -7.050 1.00 0.00 C ATOM 259 CG2 VAL A 19 7.039 2.600 -8.727 1.00 0.00 C ATOM 0 H VAL A 19 3.048 2.296 -8.655 1.00 0.00 H new ATOM 0 HA VAL A 19 5.393 0.951 -9.746 1.00 0.00 H new ATOM 0 HB VAL A 19 5.481 2.600 -7.267 1.00 0.00 H new ATOM 0 HG11 VAL A 19 7.330 1.209 -6.402 1.00 0.00 H new ATOM 0 HG12 VAL A 19 5.788 0.321 -6.439 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.022 0.015 -7.685 1.00 0.00 H new ATOM 0 HG21 VAL A 19 7.792 2.997 -8.046 1.00 0.00 H new ATOM 0 HG22 VAL A 19 7.508 1.902 -9.420 1.00 0.00 H new ATOM 0 HG23 VAL A 19 6.588 3.420 -9.287 1.00 0.00 H new ATOM 269 N ASP A 20 4.499 -1.076 -8.735 1.00 0.00 N ATOM 270 CA ASP A 20 3.884 -2.301 -8.253 1.00 0.00 C ATOM 271 C ASP A 20 4.977 -3.262 -7.779 1.00 0.00 C ATOM 272 O ASP A 20 6.061 -3.309 -8.358 1.00 0.00 O ATOM 273 CB ASP A 20 3.095 -2.995 -9.365 1.00 0.00 C ATOM 274 CG ASP A 20 1.782 -3.642 -8.918 1.00 0.00 C ATOM 275 OD1 ASP A 20 1.749 -4.119 -7.763 1.00 0.00 O ATOM 276 OD2 ASP A 20 0.841 -3.643 -9.741 1.00 0.00 O ATOM 0 H ASP A 20 5.202 -1.209 -9.462 1.00 0.00 H new ATOM 0 HA ASP A 20 3.208 -2.042 -7.438 1.00 0.00 H new ATOM 0 HB2 ASP A 20 2.876 -2.265 -10.145 1.00 0.00 H new ATOM 0 HB3 ASP A 20 3.726 -3.762 -9.814 1.00 0.00 H new ATOM 281 N TYR A 21 4.653 -4.004 -6.730 1.00 0.00 N ATOM 282 CA TYR A 21 5.593 -4.960 -6.170 1.00 0.00 C ATOM 283 C TYR A 21 4.883 -6.253 -5.764 1.00 0.00 C ATOM 284 O TYR A 21 3.890 -6.219 -5.039 1.00 0.00 O ATOM 285 CB TYR A 21 6.175 -4.298 -4.921 1.00 0.00 C ATOM 286 CG TYR A 21 7.621 -3.822 -5.083 1.00 0.00 C ATOM 287 CD1 TYR A 21 7.932 -2.880 -6.042 1.00 0.00 C ATOM 288 CD2 TYR A 21 8.611 -4.336 -4.273 1.00 0.00 C ATOM 289 CE1 TYR A 21 9.293 -2.432 -6.196 1.00 0.00 C ATOM 290 CE2 TYR A 21 9.972 -3.888 -4.426 1.00 0.00 C ATOM 291 CZ TYR A 21 10.246 -2.959 -5.380 1.00 0.00 C ATOM 292 OH TYR A 21 11.529 -2.536 -5.525 1.00 0.00 O ATOM 0 H TYR A 21 3.752 -3.962 -6.253 1.00 0.00 H new ATOM 0 HA TYR A 21 6.359 -5.218 -6.901 1.00 0.00 H new ATOM 0 HB2 TYR A 21 5.551 -3.446 -4.650 1.00 0.00 H new ATOM 0 HB3 TYR A 21 6.127 -5.004 -4.092 1.00 0.00 H new ATOM 0 HD1 TYR A 21 7.156 -2.479 -6.677 1.00 0.00 H new ATOM 0 HD2 TYR A 21 8.367 -5.074 -3.524 1.00 0.00 H new ATOM 0 HE1 TYR A 21 9.551 -1.695 -6.942 1.00 0.00 H new ATOM 0 HE2 TYR A 21 10.757 -4.281 -3.797 1.00 0.00 H new ATOM 0 HH TYR A 21 11.589 -1.586 -5.291 1.00 0.00 H new ATOM 302 N GLU A 22 5.420 -7.362 -6.250 1.00 0.00 N ATOM 303 CA GLU A 22 4.850 -8.665 -5.947 1.00 0.00 C ATOM 304 C GLU A 22 5.561 -9.288 -4.744 1.00 0.00 C ATOM 305 O GLU A 22 6.741 -9.622 -4.820 1.00 0.00 O ATOM 306 CB GLU A 22 4.920 -9.591 -7.164 1.00 0.00 C ATOM 307 CG GLU A 22 4.334 -10.966 -6.840 1.00 0.00 C ATOM 308 CD GLU A 22 4.907 -12.039 -7.769 1.00 0.00 C ATOM 309 OE1 GLU A 22 4.585 -11.976 -8.974 1.00 0.00 O ATOM 310 OE2 GLU A 22 5.654 -12.897 -7.251 1.00 0.00 O ATOM 0 H GLU A 22 6.244 -7.386 -6.851 1.00 0.00 H new ATOM 0 HA GLU A 22 3.798 -8.530 -5.694 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.374 -9.146 -7.996 1.00 0.00 H new ATOM 0 HB3 GLU A 22 5.956 -9.699 -7.484 1.00 0.00 H new ATOM 0 HG2 GLU A 22 4.552 -11.223 -5.803 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.249 -10.935 -6.939 1.00 0.00 H new ATOM 317 N THR A 23 4.810 -9.424 -3.660 1.00 0.00 N ATOM 318 CA THR A 23 5.353 -10.001 -2.441 1.00 0.00 C ATOM 319 C THR A 23 4.356 -10.987 -1.828 1.00 0.00 C ATOM 320 O THR A 23 3.197 -10.643 -1.602 1.00 0.00 O ATOM 321 CB THR A 23 5.730 -8.853 -1.503 1.00 0.00 C ATOM 322 OG1 THR A 23 6.480 -9.483 -0.468 1.00 0.00 O ATOM 323 CG2 THR A 23 4.516 -8.266 -0.779 1.00 0.00 C ATOM 0 H THR A 23 3.831 -9.145 -3.601 1.00 0.00 H new ATOM 0 HA THR A 23 6.253 -10.582 -2.644 1.00 0.00 H new ATOM 0 HB THR A 23 6.228 -8.068 -2.072 1.00 0.00 H new ATOM 0 HG1 THR A 23 6.766 -8.810 0.184 1.00 0.00 H new ATOM 0 HG21 THR A 23 4.839 -7.455 -0.126 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.806 -7.882 -1.512 1.00 0.00 H new ATOM 0 HG23 THR A 23 4.037 -9.043 -0.183 1.00 0.00 H new ATOM 331 N GLU A 24 4.844 -12.192 -1.577 1.00 0.00 N ATOM 332 CA GLU A 24 4.010 -13.230 -0.993 1.00 0.00 C ATOM 333 C GLU A 24 4.062 -13.156 0.534 1.00 0.00 C ATOM 334 O GLU A 24 4.966 -13.711 1.156 1.00 0.00 O ATOM 335 CB GLU A 24 4.432 -14.614 -1.491 1.00 0.00 C ATOM 336 CG GLU A 24 3.818 -15.717 -0.624 1.00 0.00 C ATOM 337 CD GLU A 24 4.228 -17.102 -1.129 1.00 0.00 C ATOM 338 OE1 GLU A 24 3.830 -17.432 -2.266 1.00 0.00 O ATOM 339 OE2 GLU A 24 4.932 -17.799 -0.366 1.00 0.00 O ATOM 0 H GLU A 24 5.806 -12.474 -1.767 1.00 0.00 H new ATOM 0 HA GLU A 24 2.980 -13.064 -1.309 1.00 0.00 H new ATOM 0 HB2 GLU A 24 4.119 -14.743 -2.527 1.00 0.00 H new ATOM 0 HB3 GLU A 24 5.519 -14.695 -1.474 1.00 0.00 H new ATOM 0 HG2 GLU A 24 4.139 -15.593 0.410 1.00 0.00 H new ATOM 0 HG3 GLU A 24 2.732 -15.629 -0.633 1.00 0.00 H new ATOM 346 N THR A 25 3.080 -12.466 1.095 1.00 0.00 N ATOM 347 CA THR A 25 3.002 -12.313 2.538 1.00 0.00 C ATOM 348 C THR A 25 1.570 -12.551 3.022 1.00 0.00 C ATOM 349 O THR A 25 0.659 -11.805 2.669 1.00 0.00 O ATOM 350 CB THR A 25 3.542 -10.927 2.895 1.00 0.00 C ATOM 351 OG1 THR A 25 2.918 -10.058 1.953 1.00 0.00 O ATOM 352 CG2 THR A 25 5.036 -10.787 2.600 1.00 0.00 C ATOM 0 H THR A 25 2.331 -12.007 0.576 1.00 0.00 H new ATOM 0 HA THR A 25 3.612 -13.057 3.049 1.00 0.00 H new ATOM 0 HB THR A 25 3.361 -10.728 3.951 1.00 0.00 H new ATOM 0 HG1 THR A 25 3.211 -9.137 2.114 1.00 0.00 H new ATOM 0 HG21 THR A 25 5.368 -9.785 2.871 1.00 0.00 H new ATOM 0 HG22 THR A 25 5.592 -11.523 3.180 1.00 0.00 H new ATOM 0 HG23 THR A 25 5.214 -10.953 1.538 1.00 0.00 H new ATOM 360 N PRO A 26 1.413 -13.622 3.846 1.00 0.00 N ATOM 361 CA PRO A 26 0.109 -13.968 4.383 1.00 0.00 C ATOM 362 C PRO A 26 -0.298 -13.004 5.501 1.00 0.00 C ATOM 363 O PRO A 26 -0.916 -11.973 5.242 1.00 0.00 O ATOM 364 CB PRO A 26 0.247 -15.405 4.860 1.00 0.00 C ATOM 365 CG PRO A 26 1.741 -15.655 4.998 1.00 0.00 C ATOM 366 CD PRO A 26 2.470 -14.527 4.287 1.00 0.00 C ATOM 0 HA PRO A 26 -0.686 -13.883 3.642 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.263 -15.552 5.812 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -0.201 -16.098 4.148 1.00 0.00 H new ATOM 0 HG2 PRO A 26 2.026 -15.691 6.049 1.00 0.00 H new ATOM 0 HG3 PRO A 26 2.009 -16.617 4.562 1.00 0.00 H new ATOM 0 HD2 PRO A 26 3.169 -14.024 4.955 1.00 0.00 H new ATOM 0 HD3 PRO A 26 3.049 -14.900 3.443 1.00 0.00 H new ATOM 374 N MET A 27 0.066 -13.375 6.719 1.00 0.00 N ATOM 375 CA MET A 27 -0.252 -12.557 7.877 1.00 0.00 C ATOM 376 C MET A 27 0.649 -11.322 7.941 1.00 0.00 C ATOM 377 O MET A 27 0.261 -10.293 8.491 1.00 0.00 O ATOM 378 CB MET A 27 -0.076 -13.384 9.152 1.00 0.00 C ATOM 379 CG MET A 27 -1.036 -14.575 9.170 1.00 0.00 C ATOM 380 SD MET A 27 -2.158 -14.433 10.550 1.00 0.00 S ATOM 381 CE MET A 27 -3.718 -14.624 9.702 1.00 0.00 C ATOM 0 H MET A 27 0.578 -14.231 6.930 1.00 0.00 H new ATOM 0 HA MET A 27 -1.286 -12.225 7.789 1.00 0.00 H new ATOM 0 HB2 MET A 27 0.952 -13.740 9.220 1.00 0.00 H new ATOM 0 HB3 MET A 27 -0.254 -12.756 10.025 1.00 0.00 H new ATOM 0 HG2 MET A 27 -1.598 -14.614 8.237 1.00 0.00 H new ATOM 0 HG3 MET A 27 -0.473 -15.505 9.243 1.00 0.00 H new ATOM 0 HE1 MET A 27 -4.534 -14.561 10.422 1.00 0.00 H new ATOM 0 HE2 MET A 27 -3.827 -13.834 8.959 1.00 0.00 H new ATOM 0 HE3 MET A 27 -3.746 -15.594 9.206 1.00 0.00 H new ATOM 391 N THR A 28 1.836 -11.465 7.368 1.00 0.00 N ATOM 392 CA THR A 28 2.796 -10.374 7.354 1.00 0.00 C ATOM 393 C THR A 28 2.152 -9.105 6.791 1.00 0.00 C ATOM 394 O THR A 28 2.657 -8.004 6.999 1.00 0.00 O ATOM 395 CB THR A 28 4.022 -10.835 6.564 1.00 0.00 C ATOM 396 OG1 THR A 28 3.791 -12.223 6.342 1.00 0.00 O ATOM 397 CG2 THR A 28 5.304 -10.800 7.400 1.00 0.00 C ATOM 0 H THR A 28 2.154 -12.319 6.910 1.00 0.00 H new ATOM 0 HA THR A 28 3.119 -10.117 8.363 1.00 0.00 H new ATOM 0 HB THR A 28 4.145 -10.204 5.684 1.00 0.00 H new ATOM 0 HG1 THR A 28 4.538 -12.602 5.834 1.00 0.00 H new ATOM 0 HG21 THR A 28 6.144 -11.137 6.792 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.488 -9.781 7.741 1.00 0.00 H new ATOM 0 HG23 THR A 28 5.194 -11.457 8.263 1.00 0.00 H new ATOM 405 N LEU A 29 1.047 -9.303 6.088 1.00 0.00 N ATOM 406 CA LEU A 29 0.328 -8.189 5.493 1.00 0.00 C ATOM 407 C LEU A 29 -0.226 -7.294 6.603 1.00 0.00 C ATOM 408 O LEU A 29 -0.173 -6.069 6.502 1.00 0.00 O ATOM 409 CB LEU A 29 -0.739 -8.696 4.521 1.00 0.00 C ATOM 410 CG LEU A 29 -0.235 -9.157 3.152 1.00 0.00 C ATOM 411 CD1 LEU A 29 -1.255 -10.075 2.474 1.00 0.00 C ATOM 412 CD2 LEU A 29 0.135 -7.962 2.272 1.00 0.00 C ATOM 0 H LEU A 29 0.632 -10.219 5.917 1.00 0.00 H new ATOM 0 HA LEU A 29 1.003 -7.576 4.896 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.265 -9.527 4.991 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.470 -7.902 4.368 1.00 0.00 H new ATOM 0 HG LEU A 29 0.674 -9.739 3.301 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -0.873 -10.389 1.503 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.426 -10.953 3.098 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.194 -9.538 2.338 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.490 -8.318 1.305 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.742 -7.332 2.127 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.921 -7.383 2.756 1.00 0.00 H new ATOM 424 N LEU A 30 -0.744 -7.940 7.637 1.00 0.00 N ATOM 425 CA LEU A 30 -1.308 -7.219 8.765 1.00 0.00 C ATOM 426 C LEU A 30 -0.174 -6.622 9.600 1.00 0.00 C ATOM 427 O LEU A 30 -0.362 -5.609 10.274 1.00 0.00 O ATOM 428 CB LEU A 30 -2.249 -8.123 9.563 1.00 0.00 C ATOM 429 CG LEU A 30 -3.165 -9.032 8.741 1.00 0.00 C ATOM 430 CD1 LEU A 30 -4.220 -9.695 9.628 1.00 0.00 C ATOM 431 CD2 LEU A 30 -3.795 -8.265 7.576 1.00 0.00 C ATOM 0 H LEU A 30 -0.785 -8.956 7.717 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.922 -6.388 8.418 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.647 -8.748 10.223 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -2.871 -7.494 10.200 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.559 -9.830 8.312 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.857 -10.335 9.018 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.727 -10.296 10.393 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -4.828 -8.927 10.106 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.441 -8.934 7.007 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -4.384 -7.434 7.964 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.009 -7.881 6.926 1.00 0.00 H new ATOM 443 N VAL A 31 0.977 -7.272 9.529 1.00 0.00 N ATOM 444 CA VAL A 31 2.141 -6.817 10.270 1.00 0.00 C ATOM 445 C VAL A 31 2.469 -5.380 9.864 1.00 0.00 C ATOM 446 O VAL A 31 2.471 -5.049 8.679 1.00 0.00 O ATOM 447 CB VAL A 31 3.310 -7.781 10.052 1.00 0.00 C ATOM 448 CG1 VAL A 31 4.581 -7.263 10.728 1.00 0.00 C ATOM 449 CG2 VAL A 31 2.960 -9.187 10.543 1.00 0.00 C ATOM 0 H VAL A 31 1.129 -8.111 8.969 1.00 0.00 H new ATOM 0 HA VAL A 31 1.935 -6.814 11.340 1.00 0.00 H new ATOM 0 HB VAL A 31 3.501 -7.839 8.981 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.396 -7.966 10.558 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.846 -6.292 10.309 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.408 -7.161 11.799 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.807 -9.852 10.376 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.729 -9.154 11.608 1.00 0.00 H new ATOM 0 HG23 VAL A 31 2.094 -9.559 9.995 1.00 0.00 H new ATOM 459 N PRO A 32 2.746 -4.539 10.897 1.00 0.00 N ATOM 460 CA PRO A 32 3.074 -3.144 10.661 1.00 0.00 C ATOM 461 C PRO A 32 4.497 -3.000 10.117 1.00 0.00 C ATOM 462 O PRO A 32 4.736 -2.230 9.189 1.00 0.00 O ATOM 463 CB PRO A 32 2.879 -2.460 12.003 1.00 0.00 C ATOM 464 CG PRO A 32 2.900 -3.569 13.043 1.00 0.00 C ATOM 465 CD PRO A 32 2.753 -4.894 12.313 1.00 0.00 C ATOM 0 HA PRO A 32 2.441 -2.686 9.901 1.00 0.00 H new ATOM 0 HB2 PRO A 32 3.670 -1.734 12.190 1.00 0.00 H new ATOM 0 HB3 PRO A 32 1.935 -1.916 12.031 1.00 0.00 H new ATOM 0 HG2 PRO A 32 3.832 -3.545 13.608 1.00 0.00 H new ATOM 0 HG3 PRO A 32 2.090 -3.436 13.760 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.576 -5.569 12.548 1.00 0.00 H new ATOM 0 HD3 PRO A 32 1.832 -5.403 12.598 1.00 0.00 H new ATOM 473 N GLU A 33 5.405 -3.753 10.720 1.00 0.00 N ATOM 474 CA GLU A 33 6.799 -3.719 10.309 1.00 0.00 C ATOM 475 C GLU A 33 6.925 -4.102 8.833 1.00 0.00 C ATOM 476 O GLU A 33 7.771 -3.564 8.120 1.00 0.00 O ATOM 477 CB GLU A 33 7.653 -4.635 11.189 1.00 0.00 C ATOM 478 CG GLU A 33 7.225 -4.541 12.655 1.00 0.00 C ATOM 479 CD GLU A 33 8.362 -4.971 13.585 1.00 0.00 C ATOM 480 OE1 GLU A 33 8.554 -6.199 13.716 1.00 0.00 O ATOM 481 OE2 GLU A 33 9.011 -4.061 14.145 1.00 0.00 O ATOM 0 H GLU A 33 5.203 -4.391 11.490 1.00 0.00 H new ATOM 0 HA GLU A 33 7.171 -2.702 10.434 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.561 -5.665 10.845 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.704 -4.360 11.095 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.928 -3.518 12.886 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.353 -5.172 12.824 1.00 0.00 H new ATOM 488 N VAL A 34 6.073 -5.028 8.419 1.00 0.00 N ATOM 489 CA VAL A 34 6.080 -5.489 7.042 1.00 0.00 C ATOM 490 C VAL A 34 5.295 -4.502 6.175 1.00 0.00 C ATOM 491 O VAL A 34 5.742 -4.130 5.091 1.00 0.00 O ATOM 492 CB VAL A 34 5.536 -6.917 6.965 1.00 0.00 C ATOM 493 CG1 VAL A 34 5.066 -7.249 5.547 1.00 0.00 C ATOM 494 CG2 VAL A 34 6.578 -7.927 7.447 1.00 0.00 C ATOM 0 H VAL A 34 5.373 -5.472 9.014 1.00 0.00 H new ATOM 0 HA VAL A 34 7.099 -5.523 6.655 1.00 0.00 H new ATOM 0 HB VAL A 34 4.673 -6.983 7.628 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.684 -8.270 5.520 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.276 -6.558 5.255 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.903 -7.156 4.855 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.166 -8.934 7.382 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.468 -7.858 6.822 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.844 -7.710 8.482 1.00 0.00 H new ATOM 504 N ALA A 35 4.137 -4.107 6.685 1.00 0.00 N ATOM 505 CA ALA A 35 3.286 -3.171 5.971 1.00 0.00 C ATOM 506 C ALA A 35 4.014 -1.834 5.827 1.00 0.00 C ATOM 507 O ALA A 35 4.040 -1.251 4.743 1.00 0.00 O ATOM 508 CB ALA A 35 1.951 -3.032 6.706 1.00 0.00 C ATOM 0 H ALA A 35 3.769 -4.418 7.584 1.00 0.00 H new ATOM 0 HA ALA A 35 3.069 -3.538 4.968 1.00 0.00 H new ATOM 0 HB1 ALA A 35 1.312 -2.330 6.170 1.00 0.00 H new ATOM 0 HB2 ALA A 35 1.460 -4.004 6.756 1.00 0.00 H new ATOM 0 HB3 ALA A 35 2.129 -2.663 7.716 1.00 0.00 H new ATOM 514 N ALA A 36 4.587 -1.386 6.934 1.00 0.00 N ATOM 515 CA ALA A 36 5.314 -0.128 6.944 1.00 0.00 C ATOM 516 C ALA A 36 6.452 -0.192 5.923 1.00 0.00 C ATOM 517 O ALA A 36 6.616 0.719 5.113 1.00 0.00 O ATOM 518 CB ALA A 36 5.817 0.161 8.360 1.00 0.00 C ATOM 0 H ALA A 36 4.563 -1.872 7.831 1.00 0.00 H new ATOM 0 HA ALA A 36 4.659 0.695 6.656 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.362 1.105 8.367 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.969 0.227 9.041 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.479 -0.643 8.682 1.00 0.00 H new ATOM 524 N GLU A 37 7.208 -1.277 5.996 1.00 0.00 N ATOM 525 CA GLU A 37 8.326 -1.473 5.088 1.00 0.00 C ATOM 526 C GLU A 37 7.824 -1.613 3.650 1.00 0.00 C ATOM 527 O GLU A 37 8.482 -1.166 2.712 1.00 0.00 O ATOM 528 CB GLU A 37 9.159 -2.689 5.498 1.00 0.00 C ATOM 529 CG GLU A 37 10.375 -2.853 4.585 1.00 0.00 C ATOM 530 CD GLU A 37 11.648 -3.083 5.403 1.00 0.00 C ATOM 531 OE1 GLU A 37 11.799 -2.381 6.427 1.00 0.00 O ATOM 532 OE2 GLU A 37 12.441 -3.953 4.986 1.00 0.00 O ATOM 0 H GLU A 37 7.069 -2.030 6.670 1.00 0.00 H new ATOM 0 HA GLU A 37 8.971 -0.596 5.143 1.00 0.00 H new ATOM 0 HB2 GLU A 37 9.488 -2.577 6.531 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.543 -3.587 5.455 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.216 -3.693 3.909 1.00 0.00 H new ATOM 0 HG3 GLU A 37 10.492 -1.964 3.966 1.00 0.00 H new ATOM 539 N VAL A 38 6.661 -2.236 3.521 1.00 0.00 N ATOM 540 CA VAL A 38 6.063 -2.441 2.213 1.00 0.00 C ATOM 541 C VAL A 38 5.617 -1.091 1.644 1.00 0.00 C ATOM 542 O VAL A 38 5.898 -0.778 0.489 1.00 0.00 O ATOM 543 CB VAL A 38 4.921 -3.455 2.312 1.00 0.00 C ATOM 544 CG1 VAL A 38 3.745 -3.044 1.425 1.00 0.00 C ATOM 545 CG2 VAL A 38 5.407 -4.863 1.963 1.00 0.00 C ATOM 0 H VAL A 38 6.117 -2.605 4.301 1.00 0.00 H new ATOM 0 HA VAL A 38 6.793 -2.861 1.521 1.00 0.00 H new ATOM 0 HB VAL A 38 4.572 -3.468 3.345 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.947 -3.781 1.514 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.375 -2.069 1.741 1.00 0.00 H new ATOM 0 HG13 VAL A 38 4.074 -2.989 0.387 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.576 -5.564 2.041 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.795 -4.872 0.944 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.196 -5.157 2.655 1.00 0.00 H new ATOM 555 N ILE A 39 4.928 -0.330 2.482 1.00 0.00 N ATOM 556 CA ILE A 39 4.441 0.977 2.078 1.00 0.00 C ATOM 557 C ILE A 39 5.631 1.899 1.807 1.00 0.00 C ATOM 558 O ILE A 39 5.663 2.595 0.793 1.00 0.00 O ATOM 559 CB ILE A 39 3.460 1.527 3.115 1.00 0.00 C ATOM 560 CG1 ILE A 39 2.199 0.664 3.190 1.00 0.00 C ATOM 561 CG2 ILE A 39 3.134 2.996 2.837 1.00 0.00 C ATOM 562 CD1 ILE A 39 1.536 0.545 1.816 1.00 0.00 C ATOM 0 H ILE A 39 4.696 -0.594 3.439 1.00 0.00 H new ATOM 0 HA ILE A 39 3.877 0.903 1.148 1.00 0.00 H new ATOM 0 HB ILE A 39 3.938 1.483 4.094 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.454 -0.328 3.562 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.497 1.100 3.901 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.435 3.362 3.589 1.00 0.00 H new ATOM 0 HG22 ILE A 39 4.050 3.586 2.876 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.685 3.088 1.848 1.00 0.00 H new ATOM 0 HD11 ILE A 39 0.642 -0.073 1.896 1.00 0.00 H new ATOM 0 HD12 ILE A 39 1.261 1.537 1.458 1.00 0.00 H new ATOM 0 HD13 ILE A 39 2.233 0.086 1.114 1.00 0.00 H new ATOM 574 N LYS A 40 6.581 1.874 2.731 1.00 0.00 N ATOM 575 CA LYS A 40 7.770 2.699 2.604 1.00 0.00 C ATOM 576 C LYS A 40 8.604 2.205 1.421 1.00 0.00 C ATOM 577 O LYS A 40 9.086 3.005 0.620 1.00 0.00 O ATOM 578 CB LYS A 40 8.539 2.736 3.926 1.00 0.00 C ATOM 579 CG LYS A 40 10.048 2.799 3.681 1.00 0.00 C ATOM 580 CD LYS A 40 10.678 1.408 3.781 1.00 0.00 C ATOM 581 CE LYS A 40 12.118 1.420 3.265 1.00 0.00 C ATOM 582 NZ LYS A 40 12.972 2.264 4.132 1.00 0.00 N ATOM 0 H LYS A 40 6.551 1.295 3.570 1.00 0.00 H new ATOM 0 HA LYS A 40 7.496 3.732 2.392 1.00 0.00 H new ATOM 0 HB2 LYS A 40 8.225 3.602 4.509 1.00 0.00 H new ATOM 0 HB3 LYS A 40 8.299 1.851 4.515 1.00 0.00 H new ATOM 0 HG2 LYS A 40 10.243 3.220 2.695 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.511 3.465 4.409 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.662 1.071 4.818 1.00 0.00 H new ATOM 0 HD3 LYS A 40 10.088 0.695 3.205 1.00 0.00 H new ATOM 0 HE2 LYS A 40 12.509 0.403 3.238 1.00 0.00 H new ATOM 0 HE3 LYS A 40 12.141 1.798 2.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.963 2.181 3.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.669 3.256 4.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.884 1.948 5.119 1.00 0.00 H new ATOM 596 N ASP A 41 8.750 0.890 1.348 1.00 0.00 N ATOM 597 CA ASP A 41 9.518 0.280 0.277 1.00 0.00 C ATOM 598 C ASP A 41 8.919 0.689 -1.071 1.00 0.00 C ATOM 599 O ASP A 41 9.647 1.051 -1.994 1.00 0.00 O ATOM 600 CB ASP A 41 9.476 -1.247 0.368 1.00 0.00 C ATOM 601 CG ASP A 41 10.024 -1.983 -0.855 1.00 0.00 C ATOM 602 OD1 ASP A 41 11.116 -1.586 -1.316 1.00 0.00 O ATOM 603 OD2 ASP A 41 9.338 -2.928 -1.304 1.00 0.00 O ATOM 0 H ASP A 41 8.349 0.230 2.014 1.00 0.00 H new ATOM 0 HA ASP A 41 10.550 0.618 0.368 1.00 0.00 H new ATOM 0 HB2 ASP A 41 10.043 -1.559 1.245 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.444 -1.558 0.528 1.00 0.00 H new ATOM 608 N LEU A 42 7.597 0.617 -1.141 1.00 0.00 N ATOM 609 CA LEU A 42 6.893 0.976 -2.361 1.00 0.00 C ATOM 610 C LEU A 42 7.118 2.460 -2.657 1.00 0.00 C ATOM 611 O LEU A 42 7.532 2.820 -3.758 1.00 0.00 O ATOM 612 CB LEU A 42 5.417 0.586 -2.260 1.00 0.00 C ATOM 613 CG LEU A 42 5.064 -0.831 -2.715 1.00 0.00 C ATOM 614 CD1 LEU A 42 4.469 -1.644 -1.564 1.00 0.00 C ATOM 615 CD2 LEU A 42 4.139 -0.802 -3.934 1.00 0.00 C ATOM 0 H LEU A 42 6.996 0.316 -0.374 1.00 0.00 H new ATOM 0 HA LEU A 42 7.290 0.418 -3.209 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.101 0.702 -1.223 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.834 1.292 -2.852 1.00 0.00 H new ATOM 0 HG LEU A 42 5.984 -1.330 -3.021 1.00 0.00 H new ATOM 0 HD11 LEU A 42 4.227 -2.647 -1.914 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.193 -1.708 -0.752 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.563 -1.157 -1.205 1.00 0.00 H new ATOM 0 HD21 LEU A 42 3.904 -1.822 -4.237 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.218 -0.278 -3.679 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.636 -0.285 -4.755 1.00 0.00 H new ATOM 627 N VAL A 43 6.837 3.281 -1.657 1.00 0.00 N ATOM 628 CA VAL A 43 7.004 4.716 -1.797 1.00 0.00 C ATOM 629 C VAL A 43 8.456 5.022 -2.170 1.00 0.00 C ATOM 630 O VAL A 43 8.714 5.774 -3.109 1.00 0.00 O ATOM 631 CB VAL A 43 6.555 5.423 -0.517 1.00 0.00 C ATOM 632 CG1 VAL A 43 7.428 6.647 -0.229 1.00 0.00 C ATOM 633 CG2 VAL A 43 5.076 5.811 -0.595 1.00 0.00 C ATOM 0 H VAL A 43 6.494 2.979 -0.745 1.00 0.00 H new ATOM 0 HA VAL A 43 6.374 5.097 -2.601 1.00 0.00 H new ATOM 0 HB VAL A 43 6.676 4.724 0.311 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.086 7.130 0.686 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.465 6.334 -0.109 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.355 7.350 -1.059 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.782 6.312 0.327 1.00 0.00 H new ATOM 0 HG22 VAL A 43 4.920 6.483 -1.439 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.471 4.914 -0.729 1.00 0.00 H new ATOM 643 N ASN A 44 9.366 4.425 -1.415 1.00 0.00 N ATOM 644 CA ASN A 44 10.785 4.624 -1.655 1.00 0.00 C ATOM 645 C ASN A 44 11.112 4.246 -3.100 1.00 0.00 C ATOM 646 O ASN A 44 11.978 4.856 -3.725 1.00 0.00 O ATOM 647 CB ASN A 44 11.629 3.742 -0.731 1.00 0.00 C ATOM 648 CG ASN A 44 12.247 4.566 0.400 1.00 0.00 C ATOM 649 OD1 ASN A 44 13.450 4.750 0.482 1.00 0.00 O ATOM 650 ND2 ASN A 44 11.359 5.048 1.265 1.00 0.00 N ATOM 0 H ASN A 44 9.148 3.803 -0.636 1.00 0.00 H new ATOM 0 HA ASN A 44 11.016 5.672 -1.463 1.00 0.00 H new ATOM 0 HB2 ASN A 44 11.008 2.950 -0.312 1.00 0.00 H new ATOM 0 HB3 ASN A 44 12.418 3.258 -1.306 1.00 0.00 H new ATOM 0 HD21 ASN A 44 11.671 5.610 2.057 1.00 0.00 H new ATOM 0 HD22 ASN A 44 10.366 4.856 1.137 1.00 0.00 H new ATOM 657 N THR A 45 10.402 3.240 -3.589 1.00 0.00 N ATOM 658 CA THR A 45 10.606 2.771 -4.949 1.00 0.00 C ATOM 659 C THR A 45 10.072 3.796 -5.952 1.00 0.00 C ATOM 660 O THR A 45 10.746 4.128 -6.925 1.00 0.00 O ATOM 661 CB THR A 45 9.950 1.396 -5.080 1.00 0.00 C ATOM 662 OG1 THR A 45 10.923 0.496 -4.558 1.00 0.00 O ATOM 663 CG2 THR A 45 9.784 0.961 -6.538 1.00 0.00 C ATOM 0 H THR A 45 9.684 2.736 -3.067 1.00 0.00 H new ATOM 0 HA THR A 45 11.667 2.663 -5.174 1.00 0.00 H new ATOM 0 HB THR A 45 8.975 1.412 -4.594 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.803 0.410 -3.589 1.00 0.00 H new ATOM 0 HG21 THR A 45 9.314 -0.022 -6.573 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.158 1.682 -7.064 1.00 0.00 H new ATOM 0 HG23 THR A 45 10.762 0.912 -7.017 1.00 0.00 H new ATOM 925 N LYS B 203 -2.283 18.069 -7.219 1.00 0.00 N ATOM 926 CA LYS B 203 -2.611 17.657 -5.864 1.00 0.00 C ATOM 927 C LYS B 203 -1.679 16.521 -5.440 1.00 0.00 C ATOM 928 O LYS B 203 -1.178 15.778 -6.283 1.00 0.00 O ATOM 929 CB LYS B 203 -4.097 17.308 -5.756 1.00 0.00 C ATOM 930 CG LYS B 203 -4.657 17.708 -4.389 1.00 0.00 C ATOM 931 CD LYS B 203 -6.176 17.873 -4.446 1.00 0.00 C ATOM 932 CE LYS B 203 -6.562 19.346 -4.601 1.00 0.00 C ATOM 933 NZ LYS B 203 -8.032 19.506 -4.544 1.00 0.00 N ATOM 0 HA LYS B 203 -2.448 18.478 -5.166 1.00 0.00 H new ATOM 0 HB2 LYS B 203 -4.652 17.818 -6.544 1.00 0.00 H new ATOM 0 HB3 LYS B 203 -4.235 16.238 -5.910 1.00 0.00 H new ATOM 0 HG2 LYS B 203 -4.397 16.950 -3.650 1.00 0.00 H new ATOM 0 HG3 LYS B 203 -4.198 18.641 -4.063 1.00 0.00 H new ATOM 0 HD2 LYS B 203 -6.577 17.298 -5.281 1.00 0.00 H new ATOM 0 HD3 LYS B 203 -6.624 17.470 -3.538 1.00 0.00 H new ATOM 0 HE2 LYS B 203 -6.095 19.935 -3.812 1.00 0.00 H new ATOM 0 HE3 LYS B 203 -6.185 19.729 -5.549 1.00 0.00 H new ATOM 0 HZ1 LYS B 203 -8.276 20.511 -4.651 1.00 0.00 H new ATOM 0 HZ2 LYS B 203 -8.471 18.960 -5.312 1.00 0.00 H new ATOM 0 HZ3 LYS B 203 -8.384 19.160 -3.629 1.00 0.00 H new ATOM 947 N ALA B 204 -1.476 16.421 -4.135 1.00 0.00 N ATOM 948 CA ALA B 204 -0.613 15.387 -3.590 1.00 0.00 C ATOM 949 C ALA B 204 -1.474 14.263 -3.012 1.00 0.00 C ATOM 950 O ALA B 204 -2.093 14.427 -1.961 1.00 0.00 O ATOM 951 CB ALA B 204 0.322 16.000 -2.545 1.00 0.00 C ATOM 0 H ALA B 204 -1.894 17.039 -3.439 1.00 0.00 H new ATOM 0 HA ALA B 204 0.011 14.956 -4.373 1.00 0.00 H new ATOM 0 HB1 ALA B 204 0.969 15.224 -2.136 1.00 0.00 H new ATOM 0 HB2 ALA B 204 0.932 16.773 -3.012 1.00 0.00 H new ATOM 0 HB3 ALA B 204 -0.269 16.440 -1.742 1.00 0.00 H new ATOM 957 N THR B 205 -1.485 13.145 -3.722 1.00 0.00 N ATOM 958 CA THR B 205 -2.261 11.993 -3.293 1.00 0.00 C ATOM 959 C THR B 205 -1.544 10.695 -3.674 1.00 0.00 C ATOM 960 O THR B 205 -0.632 10.706 -4.499 1.00 0.00 O ATOM 961 CB THR B 205 -3.661 12.113 -3.896 1.00 0.00 C ATOM 962 OG1 THR B 205 -3.423 12.392 -5.274 1.00 0.00 O ATOM 963 CG2 THR B 205 -4.412 13.347 -3.392 1.00 0.00 C ATOM 0 H THR B 205 -0.969 13.012 -4.592 1.00 0.00 H new ATOM 0 HA THR B 205 -2.361 11.966 -2.208 1.00 0.00 H new ATOM 0 HB THR B 205 -4.235 11.217 -3.661 1.00 0.00 H new ATOM 0 HG1 THR B 205 -4.279 12.484 -5.742 1.00 0.00 H new ATOM 0 HG21 THR B 205 -5.400 13.384 -3.851 1.00 0.00 H new ATOM 0 HG22 THR B 205 -4.517 13.292 -2.309 1.00 0.00 H new ATOM 0 HG23 THR B 205 -3.855 14.245 -3.657 1.00 0.00 H new ATOM 971 N TYR B 206 -1.984 9.609 -3.055 1.00 0.00 N ATOM 972 CA TYR B 206 -1.397 8.308 -3.319 1.00 0.00 C ATOM 973 C TYR B 206 -2.479 7.231 -3.431 1.00 0.00 C ATOM 974 O TYR B 206 -3.477 7.272 -2.714 1.00 0.00 O ATOM 975 CB TYR B 206 -0.505 7.995 -2.115 1.00 0.00 C ATOM 976 CG TYR B 206 0.982 8.257 -2.358 1.00 0.00 C ATOM 977 CD1 TYR B 206 1.782 7.262 -2.880 1.00 0.00 C ATOM 978 CD2 TYR B 206 1.523 9.490 -2.056 1.00 0.00 C ATOM 979 CE1 TYR B 206 3.183 7.509 -3.108 1.00 0.00 C ATOM 980 CE2 TYR B 206 2.924 9.737 -2.285 1.00 0.00 C ATOM 981 CZ TYR B 206 3.684 8.735 -2.799 1.00 0.00 C ATOM 982 OH TYR B 206 5.006 8.967 -3.015 1.00 0.00 O ATOM 0 H TYR B 206 -2.741 9.604 -2.371 1.00 0.00 H new ATOM 0 HA TYR B 206 -0.843 8.320 -4.258 1.00 0.00 H new ATOM 0 HB2 TYR B 206 -0.835 8.594 -1.266 1.00 0.00 H new ATOM 0 HB3 TYR B 206 -0.639 6.949 -1.839 1.00 0.00 H new ATOM 0 HD1 TYR B 206 1.358 6.298 -3.118 1.00 0.00 H new ATOM 0 HD2 TYR B 206 0.897 10.270 -1.648 1.00 0.00 H new ATOM 0 HE1 TYR B 206 3.821 6.738 -3.515 1.00 0.00 H new ATOM 0 HE2 TYR B 206 3.360 10.697 -2.053 1.00 0.00 H new ATOM 0 HH TYR B 206 5.225 9.885 -2.750 1.00 0.00 H new ATOM 992 N THR B 207 -2.242 6.291 -4.335 1.00 0.00 N ATOM 993 CA THR B 207 -3.182 5.206 -4.550 1.00 0.00 C ATOM 994 C THR B 207 -2.499 3.855 -4.326 1.00 0.00 C ATOM 995 O THR B 207 -1.678 3.429 -5.136 1.00 0.00 O ATOM 996 CB THR B 207 -3.773 5.362 -5.953 1.00 0.00 C ATOM 997 OG1 THR B 207 -4.193 6.723 -6.002 1.00 0.00 O ATOM 998 CG2 THR B 207 -5.067 4.566 -6.135 1.00 0.00 C ATOM 0 H THR B 207 -1.412 6.259 -4.927 1.00 0.00 H new ATOM 0 HA THR B 207 -4.000 5.245 -3.831 1.00 0.00 H new ATOM 0 HB THR B 207 -3.041 5.039 -6.694 1.00 0.00 H new ATOM 0 HG1 THR B 207 -4.587 6.912 -6.879 1.00 0.00 H new ATOM 0 HG21 THR B 207 -5.444 4.711 -7.147 1.00 0.00 H new ATOM 0 HG22 THR B 207 -4.869 3.507 -5.970 1.00 0.00 H new ATOM 0 HG23 THR B 207 -5.811 4.912 -5.417 1.00 0.00 H new ATOM 1006 N VAL B 208 -2.863 3.219 -3.222 1.00 0.00 N ATOM 1007 CA VAL B 208 -2.296 1.926 -2.881 1.00 0.00 C ATOM 1008 C VAL B 208 -3.273 0.821 -3.289 1.00 0.00 C ATOM 1009 O VAL B 208 -4.421 0.810 -2.848 1.00 0.00 O ATOM 1010 CB VAL B 208 -1.938 1.888 -1.393 1.00 0.00 C ATOM 1011 CG1 VAL B 208 -1.468 0.492 -0.978 1.00 0.00 C ATOM 1012 CG2 VAL B 208 -0.883 2.944 -1.056 1.00 0.00 C ATOM 0 H VAL B 208 -3.544 3.576 -2.552 1.00 0.00 H new ATOM 0 HA VAL B 208 -1.369 1.759 -3.430 1.00 0.00 H new ATOM 0 HB VAL B 208 -2.839 2.121 -0.825 1.00 0.00 H new ATOM 0 HG11 VAL B 208 -1.220 0.492 0.083 1.00 0.00 H new ATOM 0 HG12 VAL B 208 -2.263 -0.230 -1.165 1.00 0.00 H new ATOM 0 HG13 VAL B 208 -0.586 0.218 -1.557 1.00 0.00 H new ATOM 0 HG21 VAL B 208 -0.647 2.896 0.007 1.00 0.00 H new ATOM 0 HG22 VAL B 208 0.019 2.755 -1.637 1.00 0.00 H new ATOM 0 HG23 VAL B 208 -1.269 3.934 -1.297 1.00 0.00 H new ATOM 1022 N THR B 209 -2.780 -0.080 -4.127 1.00 0.00 N ATOM 1023 CA THR B 209 -3.595 -1.186 -4.599 1.00 0.00 C ATOM 1024 C THR B 209 -3.149 -2.495 -3.944 1.00 0.00 C ATOM 1025 O THR B 209 -1.965 -2.684 -3.671 1.00 0.00 O ATOM 1026 CB THR B 209 -3.516 -1.213 -6.126 1.00 0.00 C ATOM 1027 OG1 THR B 209 -3.458 0.163 -6.495 1.00 0.00 O ATOM 1028 CG2 THR B 209 -4.808 -1.718 -6.771 1.00 0.00 C ATOM 0 H THR B 209 -1.827 -0.066 -4.491 1.00 0.00 H new ATOM 0 HA THR B 209 -4.639 -1.057 -4.315 1.00 0.00 H new ATOM 0 HB THR B 209 -2.685 -1.847 -6.435 1.00 0.00 H new ATOM 0 HG1 THR B 209 -3.403 0.238 -7.471 1.00 0.00 H new ATOM 0 HG21 THR B 209 -4.698 -1.717 -7.855 1.00 0.00 H new ATOM 0 HG22 THR B 209 -5.014 -2.732 -6.428 1.00 0.00 H new ATOM 0 HG23 THR B 209 -5.634 -1.065 -6.490 1.00 0.00 H new ATOM 1036 N VAL B 210 -4.121 -3.365 -3.712 1.00 0.00 N ATOM 1037 CA VAL B 210 -3.843 -4.650 -3.095 1.00 0.00 C ATOM 1038 C VAL B 210 -4.683 -5.731 -3.777 1.00 0.00 C ATOM 1039 O VAL B 210 -5.910 -5.726 -3.675 1.00 0.00 O ATOM 1040 CB VAL B 210 -4.083 -4.569 -1.586 1.00 0.00 C ATOM 1041 CG1 VAL B 210 -4.367 -5.955 -1.001 1.00 0.00 C ATOM 1042 CG2 VAL B 210 -2.902 -3.905 -0.877 1.00 0.00 C ATOM 0 H VAL B 210 -5.102 -3.205 -3.940 1.00 0.00 H new ATOM 0 HA VAL B 210 -2.795 -4.920 -3.230 1.00 0.00 H new ATOM 0 HB VAL B 210 -4.964 -3.949 -1.420 1.00 0.00 H new ATOM 0 HG11 VAL B 210 -4.534 -5.869 0.073 1.00 0.00 H new ATOM 0 HG12 VAL B 210 -5.255 -6.375 -1.474 1.00 0.00 H new ATOM 0 HG13 VAL B 210 -3.515 -6.609 -1.185 1.00 0.00 H new ATOM 0 HG21 VAL B 210 -3.099 -3.860 0.194 1.00 0.00 H new ATOM 0 HG22 VAL B 210 -1.997 -4.486 -1.056 1.00 0.00 H new ATOM 0 HG23 VAL B 210 -2.767 -2.895 -1.263 1.00 0.00 H new ATOM 1052 N THR B 211 -3.991 -6.633 -4.458 1.00 0.00 N ATOM 1053 CA THR B 211 -4.659 -7.717 -5.157 1.00 0.00 C ATOM 1054 C THR B 211 -4.074 -9.065 -4.733 1.00 0.00 C ATOM 1055 O THR B 211 -2.856 -9.222 -4.659 1.00 0.00 O ATOM 1056 CB THR B 211 -4.547 -7.452 -6.660 1.00 0.00 C ATOM 1057 OG1 THR B 211 -5.296 -6.257 -6.859 1.00 0.00 O ATOM 1058 CG2 THR B 211 -5.284 -8.499 -7.496 1.00 0.00 C ATOM 0 H THR B 211 -2.974 -6.635 -4.540 1.00 0.00 H new ATOM 0 HA THR B 211 -5.717 -7.761 -4.898 1.00 0.00 H new ATOM 0 HB THR B 211 -3.496 -7.434 -6.948 1.00 0.00 H new ATOM 0 HG1 THR B 211 -5.026 -5.838 -7.703 1.00 0.00 H new ATOM 0 HG21 THR B 211 -5.173 -8.264 -8.554 1.00 0.00 H new ATOM 0 HG22 THR B 211 -4.864 -9.485 -7.297 1.00 0.00 H new ATOM 0 HG23 THR B 211 -6.342 -8.496 -7.233 1.00 0.00 H new ATOM 1066 N ASN B 212 -4.969 -10.005 -4.464 1.00 0.00 N ATOM 1067 CA ASN B 212 -4.556 -11.335 -4.049 1.00 0.00 C ATOM 1068 C ASN B 212 -4.556 -12.266 -5.262 1.00 0.00 C ATOM 1069 O ASN B 212 -5.606 -12.534 -5.844 1.00 0.00 O ATOM 1070 CB ASN B 212 -5.521 -11.911 -3.010 1.00 0.00 C ATOM 1071 CG ASN B 212 -5.923 -10.848 -1.985 1.00 0.00 C ATOM 1072 OD1 ASN B 212 -5.402 -9.746 -1.960 1.00 0.00 O ATOM 1073 ND2 ASN B 212 -6.877 -11.241 -1.146 1.00 0.00 N ATOM 0 H ASN B 212 -5.978 -9.872 -4.525 1.00 0.00 H new ATOM 0 HA ASN B 212 -3.560 -11.259 -3.613 1.00 0.00 H new ATOM 0 HB2 ASN B 212 -6.411 -12.295 -3.509 1.00 0.00 H new ATOM 0 HB3 ASN B 212 -5.052 -12.753 -2.501 1.00 0.00 H new ATOM 0 HD21 ASN B 212 -7.216 -10.604 -0.425 1.00 0.00 H new ATOM 0 HD22 ASN B 212 -7.270 -12.179 -1.224 1.00 0.00 H new ATOM 1080 N ASN B 213 -3.365 -12.733 -5.608 1.00 0.00 N ATOM 1081 CA ASN B 213 -3.214 -13.630 -6.743 1.00 0.00 C ATOM 1082 C ASN B 213 -3.767 -15.008 -6.375 1.00 0.00 C ATOM 1083 O ASN B 213 -3.971 -15.852 -7.246 1.00 0.00 O ATOM 1084 CB ASN B 213 -1.741 -13.796 -7.120 1.00 0.00 C ATOM 1085 CG ASN B 213 -1.460 -13.207 -8.504 1.00 0.00 C ATOM 1086 OD1 ASN B 213 -1.671 -13.835 -9.529 1.00 0.00 O ATOM 1087 ND2 ASN B 213 -0.973 -11.971 -8.478 1.00 0.00 N ATOM 0 H ASN B 213 -2.496 -12.508 -5.123 1.00 0.00 H new ATOM 0 HA ASN B 213 -3.756 -13.202 -7.586 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -1.114 -13.303 -6.377 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -1.476 -14.853 -7.110 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -0.752 -11.491 -9.351 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -0.820 -11.502 -7.585 1.00 0.00 H new ATOM 1094 N SER B 214 -3.993 -15.195 -5.082 1.00 0.00 N ATOM 1095 CA SER B 214 -4.517 -16.457 -4.589 1.00 0.00 C ATOM 1096 C SER B 214 -6.040 -16.484 -4.736 1.00 0.00 C ATOM 1097 O SER B 214 -6.621 -17.529 -5.028 1.00 0.00 O ATOM 1098 CB SER B 214 -4.121 -16.684 -3.129 1.00 0.00 C ATOM 1099 OG SER B 214 -5.231 -16.540 -2.245 1.00 0.00 O ATOM 0 H SER B 214 -3.823 -14.493 -4.362 1.00 0.00 H new ATOM 0 HA SER B 214 -4.086 -17.262 -5.184 1.00 0.00 H new ATOM 0 HB2 SER B 214 -3.698 -17.682 -3.019 1.00 0.00 H new ATOM 0 HB3 SER B 214 -3.342 -15.975 -2.850 1.00 0.00 H new ATOM 0 HG SER B 214 -4.937 -16.694 -1.323 1.00 0.00 H new ATOM 1105 N ASN B 215 -6.643 -15.323 -4.529 1.00 0.00 N ATOM 1106 CA ASN B 215 -8.087 -15.200 -4.634 1.00 0.00 C ATOM 1107 C ASN B 215 -8.435 -14.372 -5.873 1.00 0.00 C ATOM 1108 O ASN B 215 -9.609 -14.162 -6.175 1.00 0.00 O ATOM 1109 CB ASN B 215 -8.670 -14.490 -3.412 1.00 0.00 C ATOM 1110 CG ASN B 215 -9.871 -15.256 -2.853 1.00 0.00 C ATOM 1111 OD1 ASN B 215 -10.919 -14.488 -2.568 1.00 0.00 O flip ATOM 1112 ND2 ASN B 215 -9.847 -16.465 -2.692 1.00 0.00 N flip ATOM 0 H ASN B 215 -6.158 -14.459 -4.289 1.00 0.00 H new ATOM 0 HA ASN B 215 -8.507 -16.204 -4.702 1.00 0.00 H new ATOM 0 HB2 ASN B 215 -7.904 -14.396 -2.642 1.00 0.00 H new ATOM 0 HB3 ASN B 215 -8.974 -13.479 -3.685 1.00 0.00 H new ATOM 0 HD21 ASN B 215 -9.009 -16.995 -2.932 1.00 0.00 H new ATOM 0 HD22 ASN B 215 -10.665 -16.946 -2.318 1.00 0.00 H new ATOM 1119 N GLY B 216 -7.393 -13.923 -6.557 1.00 0.00 N ATOM 1120 CA GLY B 216 -7.573 -13.122 -7.756 1.00 0.00 C ATOM 1121 C GLY B 216 -8.417 -11.880 -7.464 1.00 0.00 C ATOM 1122 O GLY B 216 -8.936 -11.248 -8.383 1.00 0.00 O ATOM 0 H GLY B 216 -6.421 -14.099 -6.304 1.00 0.00 H new ATOM 0 HA2 GLY B 216 -6.601 -12.822 -8.146 1.00 0.00 H new ATOM 0 HA3 GLY B 216 -8.056 -13.721 -8.529 1.00 0.00 H new ATOM 1126 N VAL B 217 -8.528 -11.568 -6.182 1.00 0.00 N ATOM 1127 CA VAL B 217 -9.301 -10.413 -5.757 1.00 0.00 C ATOM 1128 C VAL B 217 -8.400 -9.175 -5.754 1.00 0.00 C ATOM 1129 O VAL B 217 -7.342 -9.175 -5.127 1.00 0.00 O ATOM 1130 CB VAL B 217 -9.945 -10.686 -4.396 1.00 0.00 C ATOM 1131 CG1 VAL B 217 -10.501 -9.397 -3.784 1.00 0.00 C ATOM 1132 CG2 VAL B 217 -11.036 -11.752 -4.511 1.00 0.00 C ATOM 0 H VAL B 217 -8.096 -12.095 -5.423 1.00 0.00 H new ATOM 0 HA VAL B 217 -10.116 -10.221 -6.455 1.00 0.00 H new ATOM 0 HB VAL B 217 -9.172 -11.067 -3.729 1.00 0.00 H new ATOM 0 HG11 VAL B 217 -10.953 -9.619 -2.817 1.00 0.00 H new ATOM 0 HG12 VAL B 217 -9.692 -8.679 -3.650 1.00 0.00 H new ATOM 0 HG13 VAL B 217 -11.254 -8.974 -4.449 1.00 0.00 H new ATOM 0 HG21 VAL B 217 -11.478 -11.928 -3.530 1.00 0.00 H new ATOM 0 HG22 VAL B 217 -11.808 -11.410 -5.201 1.00 0.00 H new ATOM 0 HG23 VAL B 217 -10.601 -12.679 -4.884 1.00 0.00 H new ATOM 1142 N SER B 218 -8.853 -8.151 -6.462 1.00 0.00 N ATOM 1143 CA SER B 218 -8.101 -6.911 -6.549 1.00 0.00 C ATOM 1144 C SER B 218 -8.846 -5.795 -5.813 1.00 0.00 C ATOM 1145 O SER B 218 -10.075 -5.787 -5.772 1.00 0.00 O ATOM 1146 CB SER B 218 -7.858 -6.516 -8.008 1.00 0.00 C ATOM 1147 OG SER B 218 -8.815 -7.101 -8.885 1.00 0.00 O ATOM 0 H SER B 218 -9.731 -8.155 -6.981 1.00 0.00 H new ATOM 0 HA SER B 218 -7.131 -7.064 -6.076 1.00 0.00 H new ATOM 0 HB2 SER B 218 -7.897 -5.431 -8.101 1.00 0.00 H new ATOM 0 HB3 SER B 218 -6.856 -6.826 -8.306 1.00 0.00 H new ATOM 0 HG SER B 218 -8.627 -6.824 -9.806 1.00 0.00 H new ATOM 1153 N VAL B 219 -8.070 -4.880 -5.251 1.00 0.00 N ATOM 1154 CA VAL B 219 -8.641 -3.762 -4.519 1.00 0.00 C ATOM 1155 C VAL B 219 -7.672 -2.579 -4.567 1.00 0.00 C ATOM 1156 O VAL B 219 -6.471 -2.747 -4.362 1.00 0.00 O ATOM 1157 CB VAL B 219 -8.988 -4.194 -3.093 1.00 0.00 C ATOM 1158 CG1 VAL B 219 -9.440 -2.997 -2.253 1.00 0.00 C ATOM 1159 CG2 VAL B 219 -10.050 -5.295 -3.095 1.00 0.00 C ATOM 0 H VAL B 219 -7.051 -4.890 -5.288 1.00 0.00 H new ATOM 0 HA VAL B 219 -9.573 -3.437 -4.982 1.00 0.00 H new ATOM 0 HB VAL B 219 -8.085 -4.602 -2.638 1.00 0.00 H new ATOM 0 HG11 VAL B 219 -9.681 -3.331 -1.244 1.00 0.00 H new ATOM 0 HG12 VAL B 219 -8.639 -2.260 -2.210 1.00 0.00 H new ATOM 0 HG13 VAL B 219 -10.323 -2.547 -2.707 1.00 0.00 H new ATOM 0 HG21 VAL B 219 -10.278 -5.583 -2.069 1.00 0.00 H new ATOM 0 HG22 VAL B 219 -10.955 -4.927 -3.578 1.00 0.00 H new ATOM 0 HG23 VAL B 219 -9.675 -6.161 -3.640 1.00 0.00 H new ATOM 1169 N ASP B 220 -8.231 -1.409 -4.839 1.00 0.00 N ATOM 1170 CA ASP B 220 -7.432 -0.198 -4.917 1.00 0.00 C ATOM 1171 C ASP B 220 -8.001 0.847 -3.955 1.00 0.00 C ATOM 1172 O ASP B 220 -9.211 0.912 -3.750 1.00 0.00 O ATOM 1173 CB ASP B 220 -7.462 0.392 -6.328 1.00 0.00 C ATOM 1174 CG ASP B 220 -7.909 -0.576 -7.425 1.00 0.00 C ATOM 1175 OD1 ASP B 220 -8.982 -1.190 -7.237 1.00 0.00 O ATOM 1176 OD2 ASP B 220 -7.169 -0.680 -8.427 1.00 0.00 O ATOM 0 H ASP B 220 -9.228 -1.274 -5.008 1.00 0.00 H new ATOM 0 HA ASP B 220 -6.405 -0.454 -4.655 1.00 0.00 H new ATOM 0 HB2 ASP B 220 -8.129 1.254 -6.331 1.00 0.00 H new ATOM 0 HB3 ASP B 220 -6.466 0.760 -6.573 1.00 0.00 H new ATOM 1181 N TYR B 221 -7.100 1.638 -3.390 1.00 0.00 N ATOM 1182 CA TYR B 221 -7.497 2.675 -2.454 1.00 0.00 C ATOM 1183 C TYR B 221 -6.675 3.948 -2.665 1.00 0.00 C ATOM 1184 O TYR B 221 -5.446 3.899 -2.692 1.00 0.00 O ATOM 1185 CB TYR B 221 -7.207 2.119 -1.059 1.00 0.00 C ATOM 1186 CG TYR B 221 -8.446 1.600 -0.326 1.00 0.00 C ATOM 1187 CD1 TYR B 221 -9.366 2.490 0.190 1.00 0.00 C ATOM 1188 CD2 TYR B 221 -8.643 0.242 -0.180 1.00 0.00 C ATOM 1189 CE1 TYR B 221 -10.530 2.002 0.881 1.00 0.00 C ATOM 1190 CE2 TYR B 221 -9.807 -0.246 0.511 1.00 0.00 C ATOM 1191 CZ TYR B 221 -10.695 0.657 1.007 1.00 0.00 C ATOM 1192 OH TYR B 221 -11.795 0.196 1.659 1.00 0.00 O ATOM 0 H TYR B 221 -6.096 1.581 -3.563 1.00 0.00 H new ATOM 0 HA TYR B 221 -8.547 2.933 -2.590 1.00 0.00 H new ATOM 0 HB2 TYR B 221 -6.483 1.309 -1.145 1.00 0.00 H new ATOM 0 HB3 TYR B 221 -6.742 2.900 -0.457 1.00 0.00 H new ATOM 0 HD1 TYR B 221 -9.212 3.553 0.075 1.00 0.00 H new ATOM 0 HD2 TYR B 221 -7.924 -0.455 -0.584 1.00 0.00 H new ATOM 0 HE1 TYR B 221 -11.257 2.688 1.291 1.00 0.00 H new ATOM 0 HE2 TYR B 221 -9.972 -1.306 0.633 1.00 0.00 H new ATOM 0 HH TYR B 221 -12.534 0.829 1.542 1.00 0.00 H new ATOM 1202 N GLU B 222 -7.385 5.057 -2.809 1.00 0.00 N ATOM 1203 CA GLU B 222 -6.736 6.340 -3.017 1.00 0.00 C ATOM 1204 C GLU B 222 -6.768 7.166 -1.729 1.00 0.00 C ATOM 1205 O GLU B 222 -7.840 7.544 -1.257 1.00 0.00 O ATOM 1206 CB GLU B 222 -7.384 7.102 -4.174 1.00 0.00 C ATOM 1207 CG GLU B 222 -6.805 8.513 -4.294 1.00 0.00 C ATOM 1208 CD GLU B 222 -7.622 9.360 -5.272 1.00 0.00 C ATOM 1209 OE1 GLU B 222 -7.477 9.119 -6.489 1.00 0.00 O ATOM 1210 OE2 GLU B 222 -8.374 10.228 -4.779 1.00 0.00 O ATOM 0 H GLU B 222 -8.404 5.094 -2.786 1.00 0.00 H new ATOM 0 HA GLU B 222 -5.695 6.159 -3.284 1.00 0.00 H new ATOM 0 HB2 GLU B 222 -7.225 6.559 -5.106 1.00 0.00 H new ATOM 0 HB3 GLU B 222 -8.461 7.159 -4.018 1.00 0.00 H new ATOM 0 HG2 GLU B 222 -6.795 8.990 -3.314 1.00 0.00 H new ATOM 0 HG3 GLU B 222 -5.770 8.458 -4.632 1.00 0.00 H new ATOM 1217 N THR B 223 -5.583 7.421 -1.196 1.00 0.00 N ATOM 1218 CA THR B 223 -5.462 8.194 0.028 1.00 0.00 C ATOM 1219 C THR B 223 -4.292 9.173 -0.074 1.00 0.00 C ATOM 1220 O THR B 223 -3.272 8.868 -0.691 1.00 0.00 O ATOM 1221 CB THR B 223 -5.335 7.215 1.195 1.00 0.00 C ATOM 1222 OG1 THR B 223 -5.551 8.022 2.350 1.00 0.00 O ATOM 1223 CG2 THR B 223 -3.908 6.691 1.369 1.00 0.00 C ATOM 0 H THR B 223 -4.697 7.106 -1.590 1.00 0.00 H new ATOM 0 HA THR B 223 -6.346 8.809 0.196 1.00 0.00 H new ATOM 0 HB THR B 223 -6.013 6.376 1.039 1.00 0.00 H new ATOM 0 HG1 THR B 223 -5.488 7.466 3.154 1.00 0.00 H new ATOM 0 HG21 THR B 223 -3.874 6.000 2.211 1.00 0.00 H new ATOM 0 HG22 THR B 223 -3.598 6.173 0.462 1.00 0.00 H new ATOM 0 HG23 THR B 223 -3.234 7.527 1.558 1.00 0.00 H new ATOM 1231 N GLU B 224 -4.476 10.333 0.541 1.00 0.00 N ATOM 1232 CA GLU B 224 -3.447 11.359 0.528 1.00 0.00 C ATOM 1233 C GLU B 224 -2.579 11.256 1.783 1.00 0.00 C ATOM 1234 O GLU B 224 -2.914 11.823 2.822 1.00 0.00 O ATOM 1235 CB GLU B 224 -4.066 12.753 0.401 1.00 0.00 C ATOM 1236 CG GLU B 224 -3.031 13.840 0.696 1.00 0.00 C ATOM 1237 CD GLU B 224 -3.214 14.403 2.107 1.00 0.00 C ATOM 1238 OE1 GLU B 224 -4.253 15.064 2.323 1.00 0.00 O ATOM 1239 OE2 GLU B 224 -2.311 14.161 2.937 1.00 0.00 O ATOM 0 H GLU B 224 -5.323 10.585 1.051 1.00 0.00 H new ATOM 0 HA GLU B 224 -2.811 11.199 -0.343 1.00 0.00 H new ATOM 0 HB2 GLU B 224 -4.464 12.888 -0.605 1.00 0.00 H new ATOM 0 HB3 GLU B 224 -4.904 12.847 1.091 1.00 0.00 H new ATOM 0 HG2 GLU B 224 -2.027 13.429 0.592 1.00 0.00 H new ATOM 0 HG3 GLU B 224 -3.124 14.643 -0.035 1.00 0.00 H new ATOM 1246 N THR B 225 -1.480 10.529 1.646 1.00 0.00 N ATOM 1247 CA THR B 225 -0.561 10.345 2.757 1.00 0.00 C ATOM 1248 C THR B 225 0.883 10.545 2.293 1.00 0.00 C ATOM 1249 O THR B 225 1.451 9.681 1.627 1.00 0.00 O ATOM 1250 CB THR B 225 -0.820 8.963 3.360 1.00 0.00 C ATOM 1251 OG1 THR B 225 -0.921 8.104 2.229 1.00 0.00 O ATOM 1252 CG2 THR B 225 -2.192 8.864 4.029 1.00 0.00 C ATOM 0 H THR B 225 -1.205 10.060 0.783 1.00 0.00 H new ATOM 0 HA THR B 225 -0.725 11.091 3.535 1.00 0.00 H new ATOM 0 HB THR B 225 -0.044 8.734 4.090 1.00 0.00 H new ATOM 0 HG1 THR B 225 -1.087 7.186 2.529 1.00 0.00 H new ATOM 0 HG21 THR B 225 -2.325 7.863 4.440 1.00 0.00 H new ATOM 0 HG22 THR B 225 -2.259 9.598 4.832 1.00 0.00 H new ATOM 0 HG23 THR B 225 -2.971 9.060 3.292 1.00 0.00 H new ATOM 1260 N PRO B 226 1.451 11.722 2.671 1.00 0.00 N ATOM 1261 CA PRO B 226 2.819 12.046 2.301 1.00 0.00 C ATOM 1262 C PRO B 226 3.817 11.252 3.144 1.00 0.00 C ATOM 1263 O PRO B 226 4.349 10.239 2.693 1.00 0.00 O ATOM 1264 CB PRO B 226 2.934 13.548 2.502 1.00 0.00 C ATOM 1265 CG PRO B 226 1.781 13.937 3.413 1.00 0.00 C ATOM 1266 CD PRO B 226 0.810 12.770 3.460 1.00 0.00 C ATOM 0 HA PRO B 226 3.052 11.776 1.271 1.00 0.00 H new ATOM 0 HB2 PRO B 226 3.892 13.810 2.951 1.00 0.00 H new ATOM 0 HB3 PRO B 226 2.874 14.075 1.550 1.00 0.00 H new ATOM 0 HG2 PRO B 226 2.147 14.170 4.413 1.00 0.00 H new ATOM 0 HG3 PRO B 226 1.284 14.832 3.039 1.00 0.00 H new ATOM 0 HD2 PRO B 226 0.634 12.442 4.485 1.00 0.00 H new ATOM 0 HD3 PRO B 226 -0.159 13.044 3.042 1.00 0.00 H new ATOM 1274 N MET B 227 4.044 11.742 4.355 1.00 0.00 N ATOM 1275 CA MET B 227 4.970 11.091 5.265 1.00 0.00 C ATOM 1276 C MET B 227 4.345 9.837 5.880 1.00 0.00 C ATOM 1277 O MET B 227 5.051 8.887 6.215 1.00 0.00 O ATOM 1278 CB MET B 227 5.362 12.064 6.378 1.00 0.00 C ATOM 1279 CG MET B 227 5.573 13.475 5.824 1.00 0.00 C ATOM 1280 SD MET B 227 4.143 14.486 6.170 1.00 0.00 S ATOM 1281 CE MET B 227 3.876 14.069 7.884 1.00 0.00 C ATOM 0 H MET B 227 3.602 12.583 4.726 1.00 0.00 H new ATOM 0 HA MET B 227 5.855 10.794 4.701 1.00 0.00 H new ATOM 0 HB2 MET B 227 4.584 12.082 7.141 1.00 0.00 H new ATOM 0 HB3 MET B 227 6.276 11.719 6.862 1.00 0.00 H new ATOM 0 HG2 MET B 227 6.461 13.921 6.271 1.00 0.00 H new ATOM 0 HG3 MET B 227 5.746 13.430 4.749 1.00 0.00 H new ATOM 0 HE1 MET B 227 3.380 14.899 8.387 1.00 0.00 H new ATOM 0 HE2 MET B 227 3.250 13.179 7.949 1.00 0.00 H new ATOM 0 HE3 MET B 227 4.835 13.874 8.365 1.00 0.00 H new ATOM 1291 N THR B 228 3.026 9.875 6.009 1.00 0.00 N ATOM 1292 CA THR B 228 2.298 8.754 6.577 1.00 0.00 C ATOM 1293 C THR B 228 2.691 7.451 5.876 1.00 0.00 C ATOM 1294 O THR B 228 2.818 6.410 6.519 1.00 0.00 O ATOM 1295 CB THR B 228 0.803 9.066 6.486 1.00 0.00 C ATOM 1296 OG1 THR B 228 0.735 10.182 5.602 1.00 0.00 O ATOM 1297 CG2 THR B 228 0.234 9.599 7.803 1.00 0.00 C ATOM 0 H THR B 228 2.444 10.665 5.730 1.00 0.00 H new ATOM 0 HA THR B 228 2.551 8.610 7.627 1.00 0.00 H new ATOM 0 HB THR B 228 0.262 8.166 6.195 1.00 0.00 H new ATOM 0 HG1 THR B 228 -0.173 10.550 5.608 1.00 0.00 H new ATOM 0 HG21 THR B 228 -0.830 9.804 7.683 1.00 0.00 H new ATOM 0 HG22 THR B 228 0.374 8.855 8.587 1.00 0.00 H new ATOM 0 HG23 THR B 228 0.752 10.518 8.078 1.00 0.00 H new ATOM 1305 N LEU B 229 2.870 7.553 4.567 1.00 0.00 N ATOM 1306 CA LEU B 229 3.247 6.397 3.772 1.00 0.00 C ATOM 1307 C LEU B 229 4.471 5.727 4.399 1.00 0.00 C ATOM 1308 O LEU B 229 4.610 4.507 4.349 1.00 0.00 O ATOM 1309 CB LEU B 229 3.445 6.795 2.308 1.00 0.00 C ATOM 1310 CG LEU B 229 2.174 6.888 1.460 1.00 0.00 C ATOM 1311 CD1 LEU B 229 2.416 7.719 0.199 1.00 0.00 C ATOM 1312 CD2 LEU B 229 1.631 5.495 1.133 1.00 0.00 C ATOM 0 H LEU B 229 2.761 8.418 4.038 1.00 0.00 H new ATOM 0 HA LEU B 229 2.446 5.658 3.772 1.00 0.00 H new ATOM 0 HB2 LEU B 229 3.948 7.761 2.280 1.00 0.00 H new ATOM 0 HB3 LEU B 229 4.116 6.073 1.843 1.00 0.00 H new ATOM 0 HG LEU B 229 1.411 7.403 2.043 1.00 0.00 H new ATOM 0 HD11 LEU B 229 1.497 7.769 -0.386 1.00 0.00 H new ATOM 0 HD12 LEU B 229 2.723 8.726 0.480 1.00 0.00 H new ATOM 0 HD13 LEU B 229 3.201 7.254 -0.398 1.00 0.00 H new ATOM 0 HD21 LEU B 229 0.728 5.589 0.530 1.00 0.00 H new ATOM 0 HD22 LEU B 229 2.382 4.933 0.577 1.00 0.00 H new ATOM 0 HD23 LEU B 229 1.396 4.970 2.059 1.00 0.00 H new ATOM 1324 N LEU B 230 5.329 6.558 4.973 1.00 0.00 N ATOM 1325 CA LEU B 230 6.538 6.061 5.610 1.00 0.00 C ATOM 1326 C LEU B 230 6.207 5.594 7.028 1.00 0.00 C ATOM 1327 O LEU B 230 6.930 4.779 7.601 1.00 0.00 O ATOM 1328 CB LEU B 230 7.645 7.117 5.551 1.00 0.00 C ATOM 1329 CG LEU B 230 7.837 7.813 4.203 1.00 0.00 C ATOM 1330 CD1 LEU B 230 9.051 8.745 4.235 1.00 0.00 C ATOM 1331 CD2 LEU B 230 7.927 6.794 3.066 1.00 0.00 C ATOM 0 H LEU B 230 5.212 7.571 5.011 1.00 0.00 H new ATOM 0 HA LEU B 230 6.925 5.195 5.073 1.00 0.00 H new ATOM 0 HB2 LEU B 230 7.435 7.877 6.303 1.00 0.00 H new ATOM 0 HB3 LEU B 230 8.586 6.644 5.830 1.00 0.00 H new ATOM 0 HG LEU B 230 6.960 8.432 4.011 1.00 0.00 H new ATOM 0 HD11 LEU B 230 9.165 9.227 3.264 1.00 0.00 H new ATOM 0 HD12 LEU B 230 8.906 9.505 5.003 1.00 0.00 H new ATOM 0 HD13 LEU B 230 9.947 8.167 4.461 1.00 0.00 H new ATOM 0 HD21 LEU B 230 8.063 7.316 2.119 1.00 0.00 H new ATOM 0 HD22 LEU B 230 8.774 6.130 3.239 1.00 0.00 H new ATOM 0 HD23 LEU B 230 7.008 6.209 3.028 1.00 0.00 H new ATOM 1343 N VAL B 231 5.117 6.130 7.555 1.00 0.00 N ATOM 1344 CA VAL B 231 4.682 5.778 8.896 1.00 0.00 C ATOM 1345 C VAL B 231 4.185 4.331 8.903 1.00 0.00 C ATOM 1346 O VAL B 231 3.457 3.917 8.001 1.00 0.00 O ATOM 1347 CB VAL B 231 3.628 6.775 9.384 1.00 0.00 C ATOM 1348 CG1 VAL B 231 3.127 6.403 10.780 1.00 0.00 C ATOM 1349 CG2 VAL B 231 4.173 8.204 9.359 1.00 0.00 C ATOM 0 H VAL B 231 4.521 6.806 7.077 1.00 0.00 H new ATOM 0 HA VAL B 231 5.515 5.839 9.596 1.00 0.00 H new ATOM 0 HB VAL B 231 2.780 6.728 8.701 1.00 0.00 H new ATOM 0 HG11 VAL B 231 2.379 7.127 11.103 1.00 0.00 H new ATOM 0 HG12 VAL B 231 2.681 5.409 10.754 1.00 0.00 H new ATOM 0 HG13 VAL B 231 3.963 6.408 11.480 1.00 0.00 H new ATOM 0 HG21 VAL B 231 3.405 8.893 9.710 1.00 0.00 H new ATOM 0 HG22 VAL B 231 5.046 8.272 10.009 1.00 0.00 H new ATOM 0 HG23 VAL B 231 4.458 8.467 8.340 1.00 0.00 H new ATOM 1359 N PRO B 232 4.608 3.582 9.957 1.00 0.00 N ATOM 1360 CA PRO B 232 4.212 2.191 10.093 1.00 0.00 C ATOM 1361 C PRO B 232 2.757 2.076 10.550 1.00 0.00 C ATOM 1362 O PRO B 232 2.006 1.245 10.041 1.00 0.00 O ATOM 1363 CB PRO B 232 5.196 1.598 11.088 1.00 0.00 C ATOM 1364 CG PRO B 232 5.810 2.780 11.821 1.00 0.00 C ATOM 1365 CD PRO B 232 5.469 4.040 11.043 1.00 0.00 C ATOM 0 HA PRO B 232 4.246 1.650 9.147 1.00 0.00 H new ATOM 0 HB2 PRO B 232 4.692 0.926 11.783 1.00 0.00 H new ATOM 0 HB3 PRO B 232 5.962 1.013 10.579 1.00 0.00 H new ATOM 0 HG2 PRO B 232 5.421 2.842 12.837 1.00 0.00 H new ATOM 0 HG3 PRO B 232 6.891 2.661 11.900 1.00 0.00 H new ATOM 0 HD2 PRO B 232 4.959 4.769 11.673 1.00 0.00 H new ATOM 0 HD3 PRO B 232 6.367 4.524 10.659 1.00 0.00 H new ATOM 1373 N GLU B 233 2.402 2.922 11.506 1.00 0.00 N ATOM 1374 CA GLU B 233 1.050 2.927 12.038 1.00 0.00 C ATOM 1375 C GLU B 233 0.045 3.242 10.928 1.00 0.00 C ATOM 1376 O GLU B 233 -1.069 2.717 10.928 1.00 0.00 O ATOM 1377 CB GLU B 233 0.919 3.919 13.195 1.00 0.00 C ATOM 1378 CG GLU B 233 2.167 3.897 14.079 1.00 0.00 C ATOM 1379 CD GLU B 233 1.852 4.413 15.485 1.00 0.00 C ATOM 1380 OE1 GLU B 233 0.760 4.066 15.986 1.00 0.00 O ATOM 1381 OE2 GLU B 233 2.709 5.144 16.027 1.00 0.00 O ATOM 0 H GLU B 233 3.028 3.609 11.926 1.00 0.00 H new ATOM 0 HA GLU B 233 0.830 1.934 12.429 1.00 0.00 H new ATOM 0 HB2 GLU B 233 0.765 4.924 12.802 1.00 0.00 H new ATOM 0 HB3 GLU B 233 0.041 3.673 13.792 1.00 0.00 H new ATOM 0 HG2 GLU B 233 2.556 2.881 14.139 1.00 0.00 H new ATOM 0 HG3 GLU B 233 2.947 4.511 13.629 1.00 0.00 H new ATOM 1388 N VAL B 234 0.472 4.096 10.011 1.00 0.00 N ATOM 1389 CA VAL B 234 -0.377 4.487 8.899 1.00 0.00 C ATOM 1390 C VAL B 234 -0.306 3.418 7.807 1.00 0.00 C ATOM 1391 O VAL B 234 -1.332 2.998 7.275 1.00 0.00 O ATOM 1392 CB VAL B 234 0.020 5.878 8.401 1.00 0.00 C ATOM 1393 CG1 VAL B 234 -0.768 6.258 7.146 1.00 0.00 C ATOM 1394 CG2 VAL B 234 -0.162 6.927 9.500 1.00 0.00 C ATOM 0 H VAL B 234 1.396 4.529 10.015 1.00 0.00 H new ATOM 0 HA VAL B 234 -1.417 4.556 9.219 1.00 0.00 H new ATOM 0 HB VAL B 234 1.077 5.849 8.137 1.00 0.00 H new ATOM 0 HG11 VAL B 234 -0.466 7.251 6.814 1.00 0.00 H new ATOM 0 HG12 VAL B 234 -0.566 5.534 6.357 1.00 0.00 H new ATOM 0 HG13 VAL B 234 -1.834 6.260 7.372 1.00 0.00 H new ATOM 0 HG21 VAL B 234 0.127 7.907 9.119 1.00 0.00 H new ATOM 0 HG22 VAL B 234 -1.207 6.952 9.810 1.00 0.00 H new ATOM 0 HG23 VAL B 234 0.464 6.671 10.355 1.00 0.00 H new ATOM 1404 N ALA B 235 0.918 3.009 7.504 1.00 0.00 N ATOM 1405 CA ALA B 235 1.138 1.996 6.485 1.00 0.00 C ATOM 1406 C ALA B 235 0.526 0.672 6.948 1.00 0.00 C ATOM 1407 O ALA B 235 -0.157 -0.002 6.178 1.00 0.00 O ATOM 1408 CB ALA B 235 2.636 1.877 6.199 1.00 0.00 C ATOM 0 H ALA B 235 1.767 3.361 7.946 1.00 0.00 H new ATOM 0 HA ALA B 235 0.649 2.277 5.552 1.00 0.00 H new ATOM 0 HB1 ALA B 235 2.801 1.117 5.435 1.00 0.00 H new ATOM 0 HB2 ALA B 235 3.016 2.836 5.846 1.00 0.00 H new ATOM 0 HB3 ALA B 235 3.159 1.593 7.112 1.00 0.00 H new ATOM 1414 N ALA B 236 0.793 0.340 8.203 1.00 0.00 N ATOM 1415 CA ALA B 236 0.277 -0.892 8.776 1.00 0.00 C ATOM 1416 C ALA B 236 -1.244 -0.924 8.620 1.00 0.00 C ATOM 1417 O ALA B 236 -1.805 -1.924 8.174 1.00 0.00 O ATOM 1418 CB ALA B 236 0.716 -0.996 10.238 1.00 0.00 C ATOM 0 H ALA B 236 1.359 0.902 8.838 1.00 0.00 H new ATOM 0 HA ALA B 236 0.680 -1.759 8.251 1.00 0.00 H new ATOM 0 HB1 ALA B 236 0.330 -1.920 10.669 1.00 0.00 H new ATOM 0 HB2 ALA B 236 1.805 -0.998 10.292 1.00 0.00 H new ATOM 0 HB3 ALA B 236 0.327 -0.145 10.796 1.00 0.00 H new ATOM 1424 N GLU B 237 -1.870 0.182 8.995 1.00 0.00 N ATOM 1425 CA GLU B 237 -3.315 0.294 8.902 1.00 0.00 C ATOM 1426 C GLU B 237 -3.752 0.320 7.436 1.00 0.00 C ATOM 1427 O GLU B 237 -4.808 -0.209 7.089 1.00 0.00 O ATOM 1428 CB GLU B 237 -3.819 1.531 9.647 1.00 0.00 C ATOM 1429 CG GLU B 237 -4.190 1.189 11.091 1.00 0.00 C ATOM 1430 CD GLU B 237 -2.965 0.710 11.873 1.00 0.00 C ATOM 1431 OE1 GLU B 237 -2.433 -0.357 11.497 1.00 0.00 O ATOM 1432 OE2 GLU B 237 -2.588 1.422 12.830 1.00 0.00 O ATOM 0 H GLU B 237 -1.402 1.009 9.364 1.00 0.00 H new ATOM 0 HA GLU B 237 -3.759 -0.581 9.378 1.00 0.00 H new ATOM 0 HB2 GLU B 237 -3.050 2.303 9.639 1.00 0.00 H new ATOM 0 HB3 GLU B 237 -4.688 1.941 9.132 1.00 0.00 H new ATOM 0 HG2 GLU B 237 -4.617 2.066 11.578 1.00 0.00 H new ATOM 0 HG3 GLU B 237 -4.957 0.415 11.100 1.00 0.00 H new ATOM 1439 N VAL B 238 -2.919 0.941 6.614 1.00 0.00 N ATOM 1440 CA VAL B 238 -3.206 1.044 5.194 1.00 0.00 C ATOM 1441 C VAL B 238 -3.163 -0.352 4.567 1.00 0.00 C ATOM 1442 O VAL B 238 -4.111 -0.766 3.900 1.00 0.00 O ATOM 1443 CB VAL B 238 -2.237 2.026 4.533 1.00 0.00 C ATOM 1444 CG1 VAL B 238 -1.958 1.628 3.082 1.00 0.00 C ATOM 1445 CG2 VAL B 238 -2.766 3.459 4.617 1.00 0.00 C ATOM 0 H VAL B 238 -2.045 1.378 6.905 1.00 0.00 H new ATOM 0 HA VAL B 238 -4.208 1.442 5.035 1.00 0.00 H new ATOM 0 HB VAL B 238 -1.294 1.985 5.079 1.00 0.00 H new ATOM 0 HG11 VAL B 238 -1.266 2.342 2.635 1.00 0.00 H new ATOM 0 HG12 VAL B 238 -1.517 0.631 3.056 1.00 0.00 H new ATOM 0 HG13 VAL B 238 -2.892 1.626 2.519 1.00 0.00 H new ATOM 0 HG21 VAL B 238 -2.058 4.137 4.140 1.00 0.00 H new ATOM 0 HG22 VAL B 238 -3.728 3.522 4.108 1.00 0.00 H new ATOM 0 HG23 VAL B 238 -2.889 3.741 5.663 1.00 0.00 H new ATOM 1455 N ILE B 239 -2.056 -1.039 4.804 1.00 0.00 N ATOM 1456 CA ILE B 239 -1.876 -2.378 4.272 1.00 0.00 C ATOM 1457 C ILE B 239 -2.984 -3.287 4.810 1.00 0.00 C ATOM 1458 O ILE B 239 -3.652 -3.978 4.042 1.00 0.00 O ATOM 1459 CB ILE B 239 -0.464 -2.888 4.566 1.00 0.00 C ATOM 1460 CG1 ILE B 239 0.568 -2.182 3.686 1.00 0.00 C ATOM 1461 CG2 ILE B 239 -0.391 -4.410 4.428 1.00 0.00 C ATOM 1462 CD1 ILE B 239 0.698 -2.876 2.329 1.00 0.00 C ATOM 0 H ILE B 239 -1.273 -0.692 5.359 1.00 0.00 H new ATOM 0 HA ILE B 239 -1.966 -2.372 3.186 1.00 0.00 H new ATOM 0 HB ILE B 239 -0.222 -2.647 5.601 1.00 0.00 H new ATOM 0 HG12 ILE B 239 0.276 -1.142 3.540 1.00 0.00 H new ATOM 0 HG13 ILE B 239 1.535 -2.174 4.189 1.00 0.00 H new ATOM 0 HG21 ILE B 239 0.623 -4.747 4.642 1.00 0.00 H new ATOM 0 HG22 ILE B 239 -1.083 -4.873 5.132 1.00 0.00 H new ATOM 0 HG23 ILE B 239 -0.661 -4.697 3.412 1.00 0.00 H new ATOM 0 HD11 ILE B 239 1.438 -2.354 1.723 1.00 0.00 H new ATOM 0 HD12 ILE B 239 1.014 -3.909 2.477 1.00 0.00 H new ATOM 0 HD13 ILE B 239 -0.265 -2.861 1.819 1.00 0.00 H new ATOM 1474 N LYS B 240 -3.143 -3.259 6.124 1.00 0.00 N ATOM 1475 CA LYS B 240 -4.157 -4.072 6.773 1.00 0.00 C ATOM 1476 C LYS B 240 -5.540 -3.645 6.279 1.00 0.00 C ATOM 1477 O LYS B 240 -6.377 -4.488 5.959 1.00 0.00 O ATOM 1478 CB LYS B 240 -4.002 -4.009 8.294 1.00 0.00 C ATOM 1479 CG LYS B 240 -5.364 -4.082 8.987 1.00 0.00 C ATOM 1480 CD LYS B 240 -5.878 -2.683 9.333 1.00 0.00 C ATOM 1481 CE LYS B 240 -7.361 -2.720 9.708 1.00 0.00 C ATOM 1482 NZ LYS B 240 -8.080 -1.582 9.093 1.00 0.00 N ATOM 0 H LYS B 240 -2.586 -2.686 6.758 1.00 0.00 H new ATOM 0 HA LYS B 240 -4.032 -5.121 6.506 1.00 0.00 H new ATOM 0 HB2 LYS B 240 -3.373 -4.832 8.633 1.00 0.00 H new ATOM 0 HB3 LYS B 240 -3.497 -3.085 8.574 1.00 0.00 H new ATOM 0 HG2 LYS B 240 -6.080 -4.586 8.338 1.00 0.00 H new ATOM 0 HG3 LYS B 240 -5.282 -4.679 9.896 1.00 0.00 H new ATOM 0 HD2 LYS B 240 -5.300 -2.274 10.162 1.00 0.00 H new ATOM 0 HD3 LYS B 240 -5.731 -2.017 8.483 1.00 0.00 H new ATOM 0 HE2 LYS B 240 -7.803 -3.659 9.376 1.00 0.00 H new ATOM 0 HE3 LYS B 240 -7.469 -2.683 10.792 1.00 0.00 H new ATOM 0 HZ1 LYS B 240 -8.589 -1.054 9.830 1.00 0.00 H new ATOM 0 HZ2 LYS B 240 -7.397 -0.952 8.625 1.00 0.00 H new ATOM 0 HZ3 LYS B 240 -8.759 -1.939 8.391 1.00 0.00 H new ATOM 1496 N ASP B 241 -5.739 -2.336 6.230 1.00 0.00 N ATOM 1497 CA ASP B 241 -7.007 -1.787 5.780 1.00 0.00 C ATOM 1498 C ASP B 241 -7.307 -2.300 4.370 1.00 0.00 C ATOM 1499 O ASP B 241 -8.427 -2.721 4.084 1.00 0.00 O ATOM 1500 CB ASP B 241 -6.957 -0.259 5.726 1.00 0.00 C ATOM 1501 CG ASP B 241 -8.121 0.400 4.984 1.00 0.00 C ATOM 1502 OD1 ASP B 241 -9.118 -0.314 4.743 1.00 0.00 O ATOM 1503 OD2 ASP B 241 -7.987 1.603 4.673 1.00 0.00 O ATOM 0 H ASP B 241 -5.043 -1.639 6.495 1.00 0.00 H new ATOM 0 HA ASP B 241 -7.779 -2.098 6.484 1.00 0.00 H new ATOM 0 HB2 ASP B 241 -6.932 0.125 6.746 1.00 0.00 H new ATOM 0 HB3 ASP B 241 -6.024 0.042 5.249 1.00 0.00 H new ATOM 1508 N LEU B 242 -6.286 -2.248 3.526 1.00 0.00 N ATOM 1509 CA LEU B 242 -6.427 -2.701 2.152 1.00 0.00 C ATOM 1510 C LEU B 242 -6.741 -4.198 2.144 1.00 0.00 C ATOM 1511 O LEU B 242 -7.711 -4.631 1.524 1.00 0.00 O ATOM 1512 CB LEU B 242 -5.190 -2.327 1.335 1.00 0.00 C ATOM 1513 CG LEU B 242 -5.186 -0.923 0.728 1.00 0.00 C ATOM 1514 CD1 LEU B 242 -4.157 -0.029 1.422 1.00 0.00 C ATOM 1515 CD2 LEU B 242 -4.969 -0.979 -0.785 1.00 0.00 C ATOM 0 H LEU B 242 -5.358 -1.899 3.767 1.00 0.00 H new ATOM 0 HA LEU B 242 -7.263 -2.197 1.668 1.00 0.00 H new ATOM 0 HB2 LEU B 242 -4.313 -2.427 1.974 1.00 0.00 H new ATOM 0 HB3 LEU B 242 -5.080 -3.051 0.527 1.00 0.00 H new ATOM 0 HG LEU B 242 -6.166 -0.476 0.895 1.00 0.00 H new ATOM 0 HD11 LEU B 242 -4.175 0.963 0.972 1.00 0.00 H new ATOM 0 HD12 LEU B 242 -4.399 0.049 2.482 1.00 0.00 H new ATOM 0 HD13 LEU B 242 -3.163 -0.462 1.308 1.00 0.00 H new ATOM 0 HD21 LEU B 242 -4.971 0.033 -1.190 1.00 0.00 H new ATOM 0 HD22 LEU B 242 -4.011 -1.454 -0.998 1.00 0.00 H new ATOM 0 HD23 LEU B 242 -5.770 -1.556 -1.246 1.00 0.00 H new ATOM 1527 N VAL B 243 -5.900 -4.950 2.841 1.00 0.00 N ATOM 1528 CA VAL B 243 -6.075 -6.391 2.921 1.00 0.00 C ATOM 1529 C VAL B 243 -7.434 -6.700 3.552 1.00 0.00 C ATOM 1530 O VAL B 243 -8.162 -7.567 3.071 1.00 0.00 O ATOM 1531 CB VAL B 243 -4.906 -7.017 3.682 1.00 0.00 C ATOM 1532 CG1 VAL B 243 -5.372 -8.211 4.518 1.00 0.00 C ATOM 1533 CG2 VAL B 243 -3.783 -7.423 2.726 1.00 0.00 C ATOM 0 H VAL B 243 -5.096 -4.589 3.355 1.00 0.00 H new ATOM 0 HA VAL B 243 -6.071 -6.833 1.925 1.00 0.00 H new ATOM 0 HB VAL B 243 -4.510 -6.264 4.364 1.00 0.00 H new ATOM 0 HG11 VAL B 243 -4.521 -8.638 5.049 1.00 0.00 H new ATOM 0 HG12 VAL B 243 -6.121 -7.881 5.238 1.00 0.00 H new ATOM 0 HG13 VAL B 243 -5.807 -8.966 3.863 1.00 0.00 H new ATOM 0 HG21 VAL B 243 -2.964 -7.865 3.293 1.00 0.00 H new ATOM 0 HG22 VAL B 243 -4.162 -8.151 2.008 1.00 0.00 H new ATOM 0 HG23 VAL B 243 -3.422 -6.543 2.194 1.00 0.00 H new ATOM 1543 N ASN B 244 -7.734 -5.976 4.620 1.00 0.00 N ATOM 1544 CA ASN B 244 -8.993 -6.162 5.322 1.00 0.00 C ATOM 1545 C ASN B 244 -10.152 -5.968 4.341 1.00 0.00 C ATOM 1546 O ASN B 244 -11.163 -6.662 4.426 1.00 0.00 O ATOM 1547 CB ASN B 244 -9.151 -5.140 6.449 1.00 0.00 C ATOM 1548 CG ASN B 244 -8.835 -5.770 7.807 1.00 0.00 C ATOM 1549 OD1 ASN B 244 -7.597 -6.245 7.908 1.00 0.00 O flip ATOM 1550 ND2 ASN B 244 -9.660 -5.820 8.704 1.00 0.00 N flip ATOM 0 H ASN B 244 -7.127 -5.259 5.017 1.00 0.00 H new ATOM 0 HA ASN B 244 -8.999 -7.167 5.744 1.00 0.00 H new ATOM 0 HB2 ASN B 244 -8.487 -4.294 6.273 1.00 0.00 H new ATOM 0 HB3 ASN B 244 -10.169 -4.751 6.452 1.00 0.00 H new ATOM 0 HD21 ASN B 244 -10.594 -5.436 8.560 1.00 0.00 H new ATOM 0 HD22 ASN B 244 -9.416 -6.246 9.598 1.00 0.00 H new ATOM 1557 N THR B 245 -9.964 -5.021 3.433 1.00 0.00 N ATOM 1558 CA THR B 245 -10.982 -4.728 2.438 1.00 0.00 C ATOM 1559 C THR B 245 -11.067 -5.859 1.412 1.00 0.00 C ATOM 1560 O THR B 245 -12.158 -6.312 1.070 1.00 0.00 O ATOM 1561 CB THR B 245 -10.658 -3.367 1.818 1.00 0.00 C ATOM 1562 OG1 THR B 245 -10.607 -2.480 2.932 1.00 0.00 O ATOM 1563 CG2 THR B 245 -11.805 -2.825 0.962 1.00 0.00 C ATOM 0 H THR B 245 -9.123 -4.448 3.366 1.00 0.00 H new ATOM 0 HA THR B 245 -11.972 -4.668 2.890 1.00 0.00 H new ATOM 0 HB THR B 245 -9.759 -3.452 1.208 1.00 0.00 H new ATOM 0 HG1 THR B 245 -9.672 -2.296 3.161 1.00 0.00 H new ATOM 0 HG21 THR B 245 -11.523 -1.858 0.546 1.00 0.00 H new ATOM 0 HG22 THR B 245 -12.014 -3.522 0.150 1.00 0.00 H new ATOM 0 HG23 THR B 245 -12.696 -2.709 1.579 1.00 0.00 H new