USER MOD reduce.3.24.130724 H: found=0, std=0, add=1117, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1118 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 27 ASN : amide:sc= -1.87 K(o=-2.1,f=-1) USER MOD Set 1.2: A 29 LYS NZ :NH3+ 160:sc= -0.182 (180deg=-1.16) USER MOD Set 2.1: A 21 GLN : amide:sc= 0.837 K(o=2,f=-4.1!) USER MOD Set 2.2: A 25 TYR OH : rot 83:sc= 1.12 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.115 USER MOD Single : A 13 SER OG : rot 87:sc= -1.25! USER MOD Single : A 19 THR OG1 : rot 84:sc= -5.35! USER MOD Single : A 26 LYS NZ :NH3+ -111:sc= -1.86! (180deg=-4.35!) USER MOD Single : A 28 LYS NZ :NH3+ 173:sc= -14.5! (180deg=-14.8!) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN : amide:sc= -9.29! C(o=-9.3!,f=-13!) USER MOD Single : A 34 THR OG1 : rot -105:sc= 1.25 USER MOD Single : A 38 CYS SG : rot 54:sc= -1.48 USER MOD Single : A 45 SER OG : rot 135:sc= -5.32! USER MOD Single : A 49 SER OG : rot 108:sc= -8.59! USER MOD Single : A 50 SER OG : rot 55:sc= 0.668 USER MOD Single : A 53 LYS NZ :NH3+ -145:sc= 0.0217 (180deg=-0.306) USER MOD Single : A 54 GLN : amide:sc= -4.59! C(o=-4.6!,f=-9.7!) USER MOD Single : A 55 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.084) USER MOD Single : A 56 MET CE :methyl -139:sc= -1.9 (180deg=-8.14!) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot -169:sc= -5.17! USER MOD Single : A 67 LYS NZ :NH3+ -166:sc= -5.02! (180deg=-5.91!) USER MOD Single : A 71 THR OG1 : rot -170:sc= -0.954 USER MOD Single : A 79 ASN : amide:sc= -7.49! C(o=-7.5!,f=-4.3!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot -70:sc= -2.34! USER MOD Single : A 93 LYS NZ :NH3+ 162:sc= -15.3! (180deg=-16.9!) USER MOD Single : A 96 THR OG1 : rot -93:sc= -1.37! USER MOD Single : A 97 MET CE :methyl 147:sc= -0.0406 (180deg=-0.994) USER MOD Single : A 98 LYS NZ :NH3+ 140:sc= -1.04 (180deg=-3.04!) USER MOD Single : A 99 TYR OH : rot -140:sc= -1.19 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0.112 USER MOD Single : A 126 ASN : amide:sc= -1.9 K(o=-1.9,f=-3.5!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 101:sc= 0.631 USER MOD Single : A 141 SER OG : rot 97:sc= 0.6 USER MOD ----------------------------------------------------------------- ATOM 105 N VAL A 7 113.055 4.209 -13.913 1.00 0.00 N ATOM 106 CA VAL A 7 113.342 5.146 -12.793 1.00 0.00 C ATOM 107 C VAL A 7 114.828 5.513 -12.770 1.00 0.00 C ATOM 108 O VAL A 7 115.192 6.666 -12.885 1.00 0.00 O ATOM 109 CB VAL A 7 112.973 4.475 -11.465 1.00 0.00 C ATOM 110 CG1 VAL A 7 113.481 3.029 -11.456 1.00 0.00 C ATOM 111 CG2 VAL A 7 113.612 5.250 -10.311 1.00 0.00 C ATOM 0 HA VAL A 7 112.754 6.053 -12.934 1.00 0.00 H new ATOM 0 HB VAL A 7 111.889 4.474 -11.349 1.00 0.00 H new ATOM 0 HG11 VAL A 7 113.216 2.556 -10.510 1.00 0.00 H new ATOM 0 HG12 VAL A 7 113.024 2.478 -12.278 1.00 0.00 H new ATOM 0 HG13 VAL A 7 114.565 3.023 -11.574 1.00 0.00 H new ATOM 0 HG21 VAL A 7 113.351 4.775 -9.365 1.00 0.00 H new ATOM 0 HG22 VAL A 7 114.696 5.252 -10.430 1.00 0.00 H new ATOM 0 HG23 VAL A 7 113.245 6.276 -10.315 1.00 0.00 H new ATOM 121 N LYS A 8 115.688 4.548 -12.592 1.00 0.00 N ATOM 122 CA LYS A 8 117.145 4.858 -12.529 1.00 0.00 C ATOM 123 C LYS A 8 117.355 5.935 -11.468 1.00 0.00 C ATOM 124 O LYS A 8 118.444 6.436 -11.274 1.00 0.00 O ATOM 125 CB LYS A 8 117.633 5.366 -13.882 1.00 0.00 C ATOM 126 CG LYS A 8 116.936 4.589 -14.999 1.00 0.00 C ATOM 127 CD LYS A 8 117.372 5.141 -16.357 1.00 0.00 C ATOM 128 CE LYS A 8 116.530 4.500 -17.462 1.00 0.00 C ATOM 129 NZ LYS A 8 116.708 5.265 -18.729 1.00 0.00 N ATOM 0 H LYS A 8 115.447 3.562 -12.488 1.00 0.00 H new ATOM 0 HA LYS A 8 117.707 3.959 -12.276 1.00 0.00 H new ATOM 0 HB2 LYS A 8 117.423 6.431 -13.980 1.00 0.00 H new ATOM 0 HB3 LYS A 8 118.713 5.245 -13.960 1.00 0.00 H new ATOM 0 HG2 LYS A 8 117.184 3.530 -14.929 1.00 0.00 H new ATOM 0 HG3 LYS A 8 115.854 4.670 -14.892 1.00 0.00 H new ATOM 0 HD2 LYS A 8 117.253 6.224 -16.376 1.00 0.00 H new ATOM 0 HD3 LYS A 8 118.429 4.933 -16.524 1.00 0.00 H new ATOM 0 HE2 LYS A 8 116.829 3.462 -17.606 1.00 0.00 H new ATOM 0 HE3 LYS A 8 115.479 4.492 -17.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 116.136 4.830 -19.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 116.402 6.249 -18.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 117.711 5.251 -19.005 1.00 0.00 H new ATOM 143 N GLY A 9 116.305 6.289 -10.778 1.00 0.00 N ATOM 144 CA GLY A 9 116.412 7.329 -9.721 1.00 0.00 C ATOM 145 C GLY A 9 115.493 8.499 -10.058 1.00 0.00 C ATOM 146 O GLY A 9 115.934 9.541 -10.501 1.00 0.00 O ATOM 0 H GLY A 9 115.371 5.898 -10.904 1.00 0.00 H new ATOM 0 HA2 GLY A 9 116.140 6.907 -8.753 1.00 0.00 H new ATOM 0 HA3 GLY A 9 117.443 7.675 -9.640 1.00 0.00 H new ATOM 150 N ALA A 10 114.214 8.338 -9.849 1.00 0.00 N ATOM 151 CA ALA A 10 113.271 9.452 -10.159 1.00 0.00 C ATOM 152 C ALA A 10 111.849 8.904 -10.282 1.00 0.00 C ATOM 153 O ALA A 10 111.053 9.383 -11.065 1.00 0.00 O ATOM 154 CB ALA A 10 113.679 10.112 -11.478 1.00 0.00 C ATOM 0 H ALA A 10 113.783 7.490 -9.480 1.00 0.00 H new ATOM 0 HA ALA A 10 113.305 10.188 -9.356 1.00 0.00 H new ATOM 0 HB1 ALA A 10 112.991 10.926 -11.706 1.00 0.00 H new ATOM 0 HB2 ALA A 10 114.691 10.507 -11.390 1.00 0.00 H new ATOM 0 HB3 ALA A 10 113.646 9.374 -12.280 1.00 0.00 H new ATOM 160 N LEU A 11 111.524 7.903 -9.515 1.00 0.00 N ATOM 161 CA LEU A 11 110.156 7.324 -9.588 1.00 0.00 C ATOM 162 C LEU A 11 109.120 8.401 -9.258 1.00 0.00 C ATOM 163 O LEU A 11 109.445 9.559 -9.087 1.00 0.00 O ATOM 164 CB LEU A 11 110.037 6.166 -8.594 1.00 0.00 C ATOM 165 CG LEU A 11 109.847 6.698 -7.168 1.00 0.00 C ATOM 166 CD1 LEU A 11 110.073 5.558 -6.177 1.00 0.00 C ATOM 167 CD2 LEU A 11 110.857 7.810 -6.873 1.00 0.00 C ATOM 0 H LEU A 11 112.148 7.460 -8.840 1.00 0.00 H new ATOM 0 HA LEU A 11 109.974 6.953 -10.596 1.00 0.00 H new ATOM 0 HB2 LEU A 11 109.194 5.531 -8.866 1.00 0.00 H new ATOM 0 HB3 LEU A 11 110.932 5.546 -8.641 1.00 0.00 H new ATOM 0 HG LEU A 11 108.837 7.096 -7.072 1.00 0.00 H new ATOM 0 HD11 LEU A 11 109.940 5.928 -5.160 1.00 0.00 H new ATOM 0 HD12 LEU A 11 109.355 4.761 -6.370 1.00 0.00 H new ATOM 0 HD13 LEU A 11 111.085 5.171 -6.292 1.00 0.00 H new ATOM 0 HD21 LEU A 11 110.708 8.176 -5.857 1.00 0.00 H new ATOM 0 HD22 LEU A 11 111.869 7.418 -6.973 1.00 0.00 H new ATOM 0 HD23 LEU A 11 110.713 8.628 -7.578 1.00 0.00 H new ATOM 179 N THR A 12 107.875 8.027 -9.174 1.00 0.00 N ATOM 180 CA THR A 12 106.814 9.027 -8.861 1.00 0.00 C ATOM 181 C THR A 12 107.296 9.973 -7.757 1.00 0.00 C ATOM 182 O THR A 12 108.276 9.716 -7.087 1.00 0.00 O ATOM 183 CB THR A 12 105.552 8.299 -8.392 1.00 0.00 C ATOM 184 OG1 THR A 12 105.497 7.014 -8.995 1.00 0.00 O ATOM 185 CG2 THR A 12 104.316 9.106 -8.792 1.00 0.00 C ATOM 0 H THR A 12 107.544 7.071 -9.308 1.00 0.00 H new ATOM 0 HA THR A 12 106.593 9.607 -9.757 1.00 0.00 H new ATOM 0 HB THR A 12 105.576 8.191 -7.308 1.00 0.00 H new ATOM 0 HG1 THR A 12 104.690 6.546 -8.694 1.00 0.00 H new ATOM 0 HG21 THR A 12 103.418 8.586 -8.457 1.00 0.00 H new ATOM 0 HG22 THR A 12 104.359 10.091 -8.328 1.00 0.00 H new ATOM 0 HG23 THR A 12 104.289 9.216 -9.876 1.00 0.00 H new ATOM 193 N SER A 13 106.603 11.064 -7.565 1.00 0.00 N ATOM 194 CA SER A 13 106.993 12.045 -6.507 1.00 0.00 C ATOM 195 C SER A 13 107.032 11.352 -5.139 1.00 0.00 C ATOM 196 O SER A 13 107.118 11.993 -4.110 1.00 0.00 O ATOM 197 CB SER A 13 105.969 13.179 -6.473 1.00 0.00 C ATOM 198 OG SER A 13 106.481 14.250 -5.690 1.00 0.00 O ATOM 0 H SER A 13 105.774 11.321 -8.101 1.00 0.00 H new ATOM 0 HA SER A 13 107.982 12.445 -6.732 1.00 0.00 H new ATOM 0 HB2 SER A 13 105.756 13.523 -7.485 1.00 0.00 H new ATOM 0 HB3 SER A 13 105.028 12.823 -6.053 1.00 0.00 H new ATOM 0 HG SER A 13 107.023 14.839 -6.256 1.00 0.00 H new ATOM 204 N GLY A 14 106.945 10.052 -5.120 1.00 0.00 N ATOM 205 CA GLY A 14 106.949 9.307 -3.826 1.00 0.00 C ATOM 206 C GLY A 14 108.053 9.820 -2.897 1.00 0.00 C ATOM 207 O GLY A 14 107.924 9.773 -1.690 1.00 0.00 O ATOM 0 H GLY A 14 106.871 9.466 -5.952 1.00 0.00 H new ATOM 0 HA2 GLY A 14 105.980 9.414 -3.338 1.00 0.00 H new ATOM 0 HA3 GLY A 14 107.094 8.244 -4.016 1.00 0.00 H new ATOM 211 N ARG A 15 109.143 10.288 -3.433 1.00 0.00 N ATOM 212 CA ARG A 15 110.246 10.772 -2.553 1.00 0.00 C ATOM 213 C ARG A 15 109.766 11.920 -1.660 1.00 0.00 C ATOM 214 O ARG A 15 109.794 11.824 -0.449 1.00 0.00 O ATOM 215 CB ARG A 15 111.425 11.251 -3.404 1.00 0.00 C ATOM 216 CG ARG A 15 110.917 12.016 -4.630 1.00 0.00 C ATOM 217 CD ARG A 15 110.464 11.027 -5.703 1.00 0.00 C ATOM 218 NE ARG A 15 111.235 11.264 -6.956 1.00 0.00 N ATOM 219 CZ ARG A 15 111.198 12.433 -7.534 1.00 0.00 C ATOM 220 NH1 ARG A 15 110.488 13.396 -7.014 1.00 0.00 N ATOM 221 NH2 ARG A 15 111.873 12.640 -8.632 1.00 0.00 N ATOM 0 H ARG A 15 109.320 10.357 -4.435 1.00 0.00 H new ATOM 0 HA ARG A 15 110.564 9.943 -1.921 1.00 0.00 H new ATOM 0 HB2 ARG A 15 112.075 11.893 -2.809 1.00 0.00 H new ATOM 0 HB3 ARG A 15 112.024 10.398 -3.721 1.00 0.00 H new ATOM 0 HG2 ARG A 15 110.089 12.666 -4.348 1.00 0.00 H new ATOM 0 HG3 ARG A 15 111.706 12.658 -5.023 1.00 0.00 H new ATOM 0 HD2 ARG A 15 110.617 10.004 -5.358 1.00 0.00 H new ATOM 0 HD3 ARG A 15 109.397 11.144 -5.893 1.00 0.00 H new ATOM 0 HE ARG A 15 111.792 10.512 -7.362 1.00 0.00 H new ATOM 0 HH11 ARG A 15 109.962 13.235 -6.155 1.00 0.00 H new ATOM 0 HH12 ARG A 15 110.459 14.310 -7.466 1.00 0.00 H new ATOM 0 HH21 ARG A 15 112.429 11.888 -9.038 1.00 0.00 H new ATOM 0 HH22 ARG A 15 111.844 13.554 -9.084 1.00 0.00 H new ATOM 235 N GLU A 16 109.351 13.011 -2.237 1.00 0.00 N ATOM 236 CA GLU A 16 108.903 14.164 -1.407 1.00 0.00 C ATOM 237 C GLU A 16 107.448 13.984 -0.970 1.00 0.00 C ATOM 238 O GLU A 16 107.033 14.493 0.051 1.00 0.00 O ATOM 239 CB GLU A 16 109.031 15.454 -2.220 1.00 0.00 C ATOM 240 CG GLU A 16 108.753 15.161 -3.696 1.00 0.00 C ATOM 241 CD GLU A 16 108.128 16.392 -4.353 1.00 0.00 C ATOM 242 OE1 GLU A 16 108.219 17.461 -3.771 1.00 0.00 O ATOM 243 OE2 GLU A 16 107.568 16.246 -5.427 1.00 0.00 O ATOM 0 H GLU A 16 109.302 13.155 -3.246 1.00 0.00 H new ATOM 0 HA GLU A 16 109.531 14.218 -0.518 1.00 0.00 H new ATOM 0 HB2 GLU A 16 108.329 16.201 -1.849 1.00 0.00 H new ATOM 0 HB3 GLU A 16 110.031 15.871 -2.104 1.00 0.00 H new ATOM 0 HG2 GLU A 16 109.679 14.895 -4.205 1.00 0.00 H new ATOM 0 HG3 GLU A 16 108.082 14.307 -3.788 1.00 0.00 H new ATOM 250 N GLU A 17 106.662 13.286 -1.740 1.00 0.00 N ATOM 251 CA GLU A 17 105.229 13.107 -1.369 1.00 0.00 C ATOM 252 C GLU A 17 105.073 12.011 -0.312 1.00 0.00 C ATOM 253 O GLU A 17 104.435 12.206 0.702 1.00 0.00 O ATOM 254 CB GLU A 17 104.428 12.719 -2.612 1.00 0.00 C ATOM 255 CG GLU A 17 104.296 13.930 -3.536 1.00 0.00 C ATOM 256 CD GLU A 17 103.513 15.035 -2.824 1.00 0.00 C ATOM 257 OE1 GLU A 17 102.623 14.704 -2.057 1.00 0.00 O ATOM 258 OE2 GLU A 17 103.818 16.193 -3.056 1.00 0.00 O ATOM 0 H GLU A 17 106.947 12.832 -2.608 1.00 0.00 H new ATOM 0 HA GLU A 17 104.858 14.046 -0.959 1.00 0.00 H new ATOM 0 HB2 GLU A 17 104.924 11.902 -3.136 1.00 0.00 H new ATOM 0 HB3 GLU A 17 103.440 12.360 -2.323 1.00 0.00 H new ATOM 0 HG2 GLU A 17 105.284 14.294 -3.818 1.00 0.00 H new ATOM 0 HG3 GLU A 17 103.787 13.644 -4.456 1.00 0.00 H new ATOM 265 N LEU A 18 105.619 10.851 -0.548 1.00 0.00 N ATOM 266 CA LEU A 18 105.458 9.747 0.440 1.00 0.00 C ATOM 267 C LEU A 18 106.389 9.942 1.642 1.00 0.00 C ATOM 268 O LEU A 18 106.086 9.505 2.735 1.00 0.00 O ATOM 269 CB LEU A 18 105.756 8.407 -0.238 1.00 0.00 C ATOM 270 CG LEU A 18 104.491 7.543 -0.237 1.00 0.00 C ATOM 271 CD1 LEU A 18 104.100 7.208 1.206 1.00 0.00 C ATOM 272 CD2 LEU A 18 103.346 8.306 -0.914 1.00 0.00 C ATOM 0 H LEU A 18 106.167 10.620 -1.377 1.00 0.00 H new ATOM 0 HA LEU A 18 104.430 9.755 0.803 1.00 0.00 H new ATOM 0 HB2 LEU A 18 106.096 8.572 -1.260 1.00 0.00 H new ATOM 0 HB3 LEU A 18 106.561 7.893 0.287 1.00 0.00 H new ATOM 0 HG LEU A 18 104.684 6.620 -0.784 1.00 0.00 H new ATOM 0 HD11 LEU A 18 103.200 6.593 1.206 1.00 0.00 H new ATOM 0 HD12 LEU A 18 104.912 6.662 1.686 1.00 0.00 H new ATOM 0 HD13 LEU A 18 103.909 8.130 1.755 1.00 0.00 H new ATOM 0 HD21 LEU A 18 102.447 7.690 -0.912 1.00 0.00 H new ATOM 0 HD22 LEU A 18 103.153 9.231 -0.370 1.00 0.00 H new ATOM 0 HD23 LEU A 18 103.623 8.541 -1.942 1.00 0.00 H new ATOM 284 N THR A 19 107.512 10.586 1.473 1.00 0.00 N ATOM 285 CA THR A 19 108.414 10.773 2.645 1.00 0.00 C ATOM 286 C THR A 19 107.848 11.877 3.533 1.00 0.00 C ATOM 287 O THR A 19 107.611 11.676 4.706 1.00 0.00 O ATOM 288 CB THR A 19 109.813 11.158 2.167 1.00 0.00 C ATOM 289 OG1 THR A 19 110.212 10.264 1.139 1.00 0.00 O ATOM 290 CG2 THR A 19 110.799 11.072 3.337 1.00 0.00 C ATOM 0 H THR A 19 107.839 10.984 0.593 1.00 0.00 H new ATOM 0 HA THR A 19 108.480 9.843 3.210 1.00 0.00 H new ATOM 0 HB THR A 19 109.804 12.178 1.784 1.00 0.00 H new ATOM 0 HG1 THR A 19 109.853 10.571 0.281 1.00 0.00 H new ATOM 0 HG21 THR A 19 111.796 11.347 2.993 1.00 0.00 H new ATOM 0 HG22 THR A 19 110.486 11.755 4.127 1.00 0.00 H new ATOM 0 HG23 THR A 19 110.817 10.053 3.724 1.00 0.00 H new ATOM 298 N ARG A 20 107.608 13.035 2.980 1.00 0.00 N ATOM 299 CA ARG A 20 107.036 14.143 3.790 1.00 0.00 C ATOM 300 C ARG A 20 105.775 13.648 4.499 1.00 0.00 C ATOM 301 O ARG A 20 105.485 14.027 5.616 1.00 0.00 O ATOM 302 CB ARG A 20 106.675 15.305 2.871 1.00 0.00 C ATOM 303 CG ARG A 20 107.956 15.966 2.376 1.00 0.00 C ATOM 304 CD ARG A 20 107.642 16.901 1.204 1.00 0.00 C ATOM 305 NE ARG A 20 107.988 18.301 1.581 1.00 0.00 N ATOM 306 CZ ARG A 20 108.226 19.186 0.652 1.00 0.00 C ATOM 307 NH1 ARG A 20 108.162 18.845 -0.606 1.00 0.00 N ATOM 308 NH2 ARG A 20 108.529 20.412 0.982 1.00 0.00 N ATOM 0 H ARG A 20 107.784 13.260 2.001 1.00 0.00 H new ATOM 0 HA ARG A 20 107.767 14.474 4.528 1.00 0.00 H new ATOM 0 HB2 ARG A 20 106.086 14.947 2.027 1.00 0.00 H new ATOM 0 HB3 ARG A 20 106.060 16.030 3.405 1.00 0.00 H new ATOM 0 HG2 ARG A 20 108.422 16.528 3.186 1.00 0.00 H new ATOM 0 HG3 ARG A 20 108.671 15.205 2.064 1.00 0.00 H new ATOM 0 HD2 ARG A 20 108.208 16.600 0.322 1.00 0.00 H new ATOM 0 HD3 ARG A 20 106.586 16.833 0.943 1.00 0.00 H new ATOM 0 HE ARG A 20 108.039 18.567 2.564 1.00 0.00 H new ATOM 0 HH11 ARG A 20 107.926 17.887 -0.863 1.00 0.00 H new ATOM 0 HH12 ARG A 20 108.348 19.537 -1.332 1.00 0.00 H new ATOM 0 HH21 ARG A 20 108.580 20.678 1.965 1.00 0.00 H new ATOM 0 HH22 ARG A 20 108.715 21.104 0.256 1.00 0.00 H new ATOM 322 N GLN A 21 105.026 12.796 3.856 1.00 0.00 N ATOM 323 CA GLN A 21 103.788 12.264 4.485 1.00 0.00 C ATOM 324 C GLN A 21 104.166 11.173 5.488 1.00 0.00 C ATOM 325 O GLN A 21 103.399 10.830 6.364 1.00 0.00 O ATOM 326 CB GLN A 21 102.873 11.681 3.409 1.00 0.00 C ATOM 327 CG GLN A 21 102.541 12.764 2.380 1.00 0.00 C ATOM 328 CD GLN A 21 101.327 13.564 2.855 1.00 0.00 C ATOM 329 OE1 GLN A 21 100.528 13.076 3.629 1.00 0.00 O ATOM 330 NE2 GLN A 21 101.153 14.782 2.420 1.00 0.00 N ATOM 0 H GLN A 21 105.220 12.445 2.918 1.00 0.00 H new ATOM 0 HA GLN A 21 103.263 13.069 5.000 1.00 0.00 H new ATOM 0 HB2 GLN A 21 103.360 10.837 2.920 1.00 0.00 H new ATOM 0 HB3 GLN A 21 101.957 11.302 3.862 1.00 0.00 H new ATOM 0 HG2 GLN A 21 103.396 13.426 2.245 1.00 0.00 H new ATOM 0 HG3 GLN A 21 102.334 12.309 1.411 1.00 0.00 H new ATOM 0 HE21 GLN A 21 101.824 15.192 1.770 1.00 0.00 H new ATOM 0 HE22 GLN A 21 100.346 15.324 2.730 1.00 0.00 H new ATOM 339 N VAL A 22 105.343 10.622 5.361 1.00 0.00 N ATOM 340 CA VAL A 22 105.770 9.550 6.304 1.00 0.00 C ATOM 341 C VAL A 22 105.468 9.990 7.738 1.00 0.00 C ATOM 342 O VAL A 22 105.171 9.183 8.594 1.00 0.00 O ATOM 343 CB VAL A 22 107.272 9.295 6.141 1.00 0.00 C ATOM 344 CG1 VAL A 22 108.068 10.384 6.862 1.00 0.00 C ATOM 345 CG2 VAL A 22 107.627 7.933 6.737 1.00 0.00 C ATOM 0 H VAL A 22 106.027 10.868 4.645 1.00 0.00 H new ATOM 0 HA VAL A 22 105.227 8.630 6.087 1.00 0.00 H new ATOM 0 HB VAL A 22 107.522 9.309 5.080 1.00 0.00 H new ATOM 0 HG11 VAL A 22 109.135 10.195 6.741 1.00 0.00 H new ATOM 0 HG12 VAL A 22 107.821 11.357 6.437 1.00 0.00 H new ATOM 0 HG13 VAL A 22 107.816 10.377 7.922 1.00 0.00 H new ATOM 0 HG21 VAL A 22 108.696 7.752 6.621 1.00 0.00 H new ATOM 0 HG22 VAL A 22 107.370 7.921 7.796 1.00 0.00 H new ATOM 0 HG23 VAL A 22 107.069 7.153 6.220 1.00 0.00 H new ATOM 355 N GLY A 23 105.530 11.265 8.008 1.00 0.00 N ATOM 356 CA GLY A 23 105.230 11.745 9.386 1.00 0.00 C ATOM 357 C GLY A 23 103.764 11.447 9.702 1.00 0.00 C ATOM 358 O GLY A 23 103.351 11.435 10.844 1.00 0.00 O ATOM 0 H GLY A 23 105.775 11.993 7.336 1.00 0.00 H new ATOM 0 HA2 GLY A 23 105.880 11.251 10.108 1.00 0.00 H new ATOM 0 HA3 GLY A 23 105.423 12.815 9.464 1.00 0.00 H new ATOM 362 N ARG A 24 102.977 11.202 8.689 1.00 0.00 N ATOM 363 CA ARG A 24 101.536 10.898 8.911 1.00 0.00 C ATOM 364 C ARG A 24 101.314 9.389 8.794 1.00 0.00 C ATOM 365 O ARG A 24 100.568 8.801 9.551 1.00 0.00 O ATOM 366 CB ARG A 24 100.695 11.623 7.857 1.00 0.00 C ATOM 367 CG ARG A 24 99.260 11.779 8.365 1.00 0.00 C ATOM 368 CD ARG A 24 98.506 12.766 7.472 1.00 0.00 C ATOM 369 NE ARG A 24 99.187 14.091 7.511 1.00 0.00 N ATOM 370 CZ ARG A 24 98.603 15.139 6.998 1.00 0.00 C ATOM 371 NH1 ARG A 24 97.424 15.028 6.450 1.00 0.00 N ATOM 372 NH2 ARG A 24 99.199 16.300 7.032 1.00 0.00 N ATOM 0 H ARG A 24 103.273 11.200 7.713 1.00 0.00 H new ATOM 0 HA ARG A 24 101.239 11.234 9.905 1.00 0.00 H new ATOM 0 HB2 ARG A 24 101.125 12.602 7.644 1.00 0.00 H new ATOM 0 HB3 ARG A 24 100.702 11.062 6.922 1.00 0.00 H new ATOM 0 HG2 ARG A 24 98.756 10.813 8.364 1.00 0.00 H new ATOM 0 HG3 ARG A 24 99.264 12.135 9.395 1.00 0.00 H new ATOM 0 HD2 ARG A 24 98.471 12.393 6.448 1.00 0.00 H new ATOM 0 HD3 ARG A 24 97.475 12.865 7.811 1.00 0.00 H new ATOM 0 HE ARG A 24 100.109 14.179 7.938 1.00 0.00 H new ATOM 0 HH11 ARG A 24 96.958 14.121 6.422 1.00 0.00 H new ATOM 0 HH12 ARG A 24 96.969 15.848 6.049 1.00 0.00 H new ATOM 0 HH21 ARG A 24 100.121 16.388 7.459 1.00 0.00 H new ATOM 0 HH22 ARG A 24 98.743 17.119 6.631 1.00 0.00 H new ATOM 386 N TYR A 25 101.958 8.756 7.850 1.00 0.00 N ATOM 387 CA TYR A 25 101.785 7.285 7.687 1.00 0.00 C ATOM 388 C TYR A 25 102.899 6.554 8.438 1.00 0.00 C ATOM 389 O TYR A 25 102.734 5.430 8.868 1.00 0.00 O ATOM 390 CB TYR A 25 101.849 6.920 6.202 1.00 0.00 C ATOM 391 CG TYR A 25 101.159 7.984 5.381 1.00 0.00 C ATOM 392 CD1 TYR A 25 100.125 8.747 5.942 1.00 0.00 C ATOM 393 CD2 TYR A 25 101.552 8.208 4.056 1.00 0.00 C ATOM 394 CE1 TYR A 25 99.487 9.730 5.179 1.00 0.00 C ATOM 395 CE2 TYR A 25 100.914 9.192 3.294 1.00 0.00 C ATOM 396 CZ TYR A 25 99.881 9.953 3.854 1.00 0.00 C ATOM 397 OH TYR A 25 99.252 10.924 3.101 1.00 0.00 O ATOM 0 H TYR A 25 102.596 9.194 7.186 1.00 0.00 H new ATOM 0 HA TYR A 25 100.817 6.989 8.091 1.00 0.00 H new ATOM 0 HB2 TYR A 25 102.888 6.822 5.887 1.00 0.00 H new ATOM 0 HB3 TYR A 25 101.373 5.954 6.035 1.00 0.00 H new ATOM 0 HD1 TYR A 25 99.821 8.575 6.964 1.00 0.00 H new ATOM 0 HD2 TYR A 25 102.348 7.621 3.622 1.00 0.00 H new ATOM 0 HE1 TYR A 25 98.690 10.317 5.612 1.00 0.00 H new ATOM 0 HE2 TYR A 25 101.219 9.365 2.272 1.00 0.00 H new ATOM 0 HH TYR A 25 99.646 11.799 3.300 1.00 0.00 H new ATOM 407 N LYS A 26 104.032 7.181 8.600 1.00 0.00 N ATOM 408 CA LYS A 26 105.151 6.515 9.324 1.00 0.00 C ATOM 409 C LYS A 26 105.577 5.257 8.564 1.00 0.00 C ATOM 410 O LYS A 26 106.572 4.636 8.883 1.00 0.00 O ATOM 411 CB LYS A 26 104.691 6.130 10.732 1.00 0.00 C ATOM 412 CG LYS A 26 103.910 7.291 11.350 1.00 0.00 C ATOM 413 CD LYS A 26 103.511 6.932 12.783 1.00 0.00 C ATOM 414 CE LYS A 26 102.539 5.751 12.762 1.00 0.00 C ATOM 415 NZ LYS A 26 103.308 4.475 12.733 1.00 0.00 N ATOM 0 H LYS A 26 104.231 8.123 8.263 1.00 0.00 H new ATOM 0 HA LYS A 26 105.996 7.200 9.392 1.00 0.00 H new ATOM 0 HB2 LYS A 26 104.065 5.238 10.690 1.00 0.00 H new ATOM 0 HB3 LYS A 26 105.553 5.886 11.353 1.00 0.00 H new ATOM 0 HG2 LYS A 26 104.518 8.195 11.346 1.00 0.00 H new ATOM 0 HG3 LYS A 26 103.021 7.502 10.756 1.00 0.00 H new ATOM 0 HD2 LYS A 26 104.397 6.677 13.365 1.00 0.00 H new ATOM 0 HD3 LYS A 26 103.046 7.790 13.268 1.00 0.00 H new ATOM 0 HE2 LYS A 26 101.895 5.780 13.641 1.00 0.00 H new ATOM 0 HE3 LYS A 26 101.889 5.816 11.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 103.183 4.015 11.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 104.317 4.674 12.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 102.961 3.844 13.483 1.00 0.00 H new ATOM 429 N ASN A 27 104.835 4.873 7.559 1.00 0.00 N ATOM 430 CA ASN A 27 105.206 3.657 6.785 1.00 0.00 C ATOM 431 C ASN A 27 106.349 3.997 5.826 1.00 0.00 C ATOM 432 O ASN A 27 106.456 5.106 5.341 1.00 0.00 O ATOM 433 CB ASN A 27 103.994 3.168 5.991 1.00 0.00 C ATOM 434 CG ASN A 27 103.163 2.223 6.860 1.00 0.00 C ATOM 435 OD1 ASN A 27 101.956 2.346 6.928 1.00 0.00 O ATOM 436 ND2 ASN A 27 103.761 1.279 7.533 1.00 0.00 N ATOM 0 H ASN A 27 103.990 5.349 7.243 1.00 0.00 H new ATOM 0 HA ASN A 27 105.528 2.871 7.469 1.00 0.00 H new ATOM 0 HB2 ASN A 27 103.387 4.016 5.674 1.00 0.00 H new ATOM 0 HB3 ASN A 27 104.321 2.655 5.087 1.00 0.00 H new ATOM 0 HD21 ASN A 27 103.215 0.644 8.116 1.00 0.00 H new ATOM 0 HD22 ASN A 27 104.774 1.175 7.476 1.00 0.00 H new ATOM 443 N LYS A 28 107.213 3.055 5.561 1.00 0.00 N ATOM 444 CA LYS A 28 108.360 3.323 4.645 1.00 0.00 C ATOM 445 C LYS A 28 108.444 2.202 3.600 1.00 0.00 C ATOM 446 O LYS A 28 108.622 2.436 2.414 1.00 0.00 O ATOM 447 CB LYS A 28 109.654 3.347 5.461 1.00 0.00 C ATOM 448 CG LYS A 28 109.467 4.201 6.723 1.00 0.00 C ATOM 449 CD LYS A 28 110.313 5.469 6.620 1.00 0.00 C ATOM 450 CE LYS A 28 110.283 6.210 7.958 1.00 0.00 C ATOM 451 NZ LYS A 28 110.906 7.554 7.799 1.00 0.00 N ATOM 0 H LYS A 28 107.174 2.109 5.940 1.00 0.00 H new ATOM 0 HA LYS A 28 108.219 4.281 4.145 1.00 0.00 H new ATOM 0 HB2 LYS A 28 109.937 2.332 5.738 1.00 0.00 H new ATOM 0 HB3 LYS A 28 110.467 3.750 4.857 1.00 0.00 H new ATOM 0 HG2 LYS A 28 108.416 4.463 6.843 1.00 0.00 H new ATOM 0 HG3 LYS A 28 109.756 3.630 7.605 1.00 0.00 H new ATOM 0 HD2 LYS A 28 111.339 5.214 6.356 1.00 0.00 H new ATOM 0 HD3 LYS A 28 109.930 6.112 5.827 1.00 0.00 H new ATOM 0 HE2 LYS A 28 109.255 6.313 8.305 1.00 0.00 H new ATOM 0 HE3 LYS A 28 110.819 5.637 8.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 110.779 8.101 8.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 111.921 7.445 7.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 110.453 8.056 7.009 1.00 0.00 H new ATOM 465 N LYS A 29 108.319 0.983 4.045 1.00 0.00 N ATOM 466 CA LYS A 29 108.387 -0.180 3.117 1.00 0.00 C ATOM 467 C LYS A 29 107.126 -0.219 2.253 1.00 0.00 C ATOM 468 O LYS A 29 106.980 -1.040 1.372 1.00 0.00 O ATOM 469 CB LYS A 29 108.471 -1.464 3.945 1.00 0.00 C ATOM 470 CG LYS A 29 107.692 -1.295 5.253 1.00 0.00 C ATOM 471 CD LYS A 29 106.263 -0.839 4.951 1.00 0.00 C ATOM 472 CE LYS A 29 105.363 -1.159 6.146 1.00 0.00 C ATOM 473 NZ LYS A 29 106.142 -1.013 7.408 1.00 0.00 N ATOM 0 H LYS A 29 108.171 0.740 5.025 1.00 0.00 H new ATOM 0 HA LYS A 29 109.262 -0.090 2.474 1.00 0.00 H new ATOM 0 HB2 LYS A 29 108.066 -2.301 3.376 1.00 0.00 H new ATOM 0 HB3 LYS A 29 109.513 -1.700 4.160 1.00 0.00 H new ATOM 0 HG2 LYS A 29 107.675 -2.237 5.801 1.00 0.00 H new ATOM 0 HG3 LYS A 29 108.189 -0.565 5.891 1.00 0.00 H new ATOM 0 HD2 LYS A 29 106.247 0.231 4.746 1.00 0.00 H new ATOM 0 HD3 LYS A 29 105.891 -1.340 4.057 1.00 0.00 H new ATOM 0 HE2 LYS A 29 104.503 -0.489 6.157 1.00 0.00 H new ATOM 0 HE3 LYS A 29 104.975 -2.174 6.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 105.488 -0.893 8.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 106.721 -1.864 7.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 106.761 -0.180 7.339 1.00 0.00 H new ATOM 487 N PHE A 30 106.207 0.651 2.524 1.00 0.00 N ATOM 488 CA PHE A 30 104.928 0.667 1.756 1.00 0.00 C ATOM 489 C PHE A 30 105.149 1.063 0.286 1.00 0.00 C ATOM 490 O PHE A 30 105.129 0.236 -0.606 1.00 0.00 O ATOM 491 CB PHE A 30 104.063 1.749 2.399 1.00 0.00 C ATOM 492 CG PHE A 30 104.884 3.032 2.557 1.00 0.00 C ATOM 493 CD1 PHE A 30 106.226 3.102 2.113 1.00 0.00 C ATOM 494 CD2 PHE A 30 104.301 4.159 3.146 1.00 0.00 C ATOM 495 CE1 PHE A 30 106.955 4.284 2.261 1.00 0.00 C ATOM 496 CE2 PHE A 30 105.041 5.341 3.292 1.00 0.00 C ATOM 497 CZ PHE A 30 106.367 5.400 2.848 1.00 0.00 C ATOM 0 H PHE A 30 106.281 1.362 3.251 1.00 0.00 H new ATOM 0 HA PHE A 30 104.477 -0.325 1.777 1.00 0.00 H new ATOM 0 HB2 PHE A 30 103.184 1.940 1.783 1.00 0.00 H new ATOM 0 HB3 PHE A 30 103.704 1.412 3.371 1.00 0.00 H new ATOM 0 HD1 PHE A 30 106.688 2.238 1.658 1.00 0.00 H new ATOM 0 HD2 PHE A 30 103.278 4.119 3.489 1.00 0.00 H new ATOM 0 HE1 PHE A 30 107.978 4.332 1.919 1.00 0.00 H new ATOM 0 HE2 PHE A 30 104.587 6.208 3.748 1.00 0.00 H new ATOM 0 HZ PHE A 30 106.934 6.312 2.961 1.00 0.00 H new ATOM 507 N MET A 31 105.389 2.322 0.045 1.00 0.00 N ATOM 508 CA MET A 31 105.644 2.809 -1.332 1.00 0.00 C ATOM 509 C MET A 31 107.096 2.540 -1.704 1.00 0.00 C ATOM 510 O MET A 31 107.401 2.051 -2.773 1.00 0.00 O ATOM 511 CB MET A 31 105.377 4.312 -1.393 1.00 0.00 C ATOM 512 CG MET A 31 105.944 4.881 -2.694 1.00 0.00 C ATOM 513 SD MET A 31 105.443 3.832 -4.081 1.00 0.00 S ATOM 514 CE MET A 31 104.665 5.128 -5.076 1.00 0.00 C ATOM 0 H MET A 31 105.419 3.046 0.763 1.00 0.00 H new ATOM 0 HA MET A 31 104.987 2.290 -2.030 1.00 0.00 H new ATOM 0 HB2 MET A 31 104.305 4.504 -1.337 1.00 0.00 H new ATOM 0 HB3 MET A 31 105.835 4.808 -0.537 1.00 0.00 H new ATOM 0 HG2 MET A 31 105.584 5.899 -2.845 1.00 0.00 H new ATOM 0 HG3 MET A 31 107.031 4.932 -2.637 1.00 0.00 H new ATOM 0 HE1 MET A 31 104.278 4.695 -5.998 1.00 0.00 H new ATOM 0 HE2 MET A 31 103.846 5.576 -4.514 1.00 0.00 H new ATOM 0 HE3 MET A 31 105.402 5.894 -5.316 1.00 0.00 H new ATOM 524 N GLN A 32 107.998 2.891 -0.826 1.00 0.00 N ATOM 525 CA GLN A 32 109.435 2.698 -1.120 1.00 0.00 C ATOM 526 C GLN A 32 109.787 1.210 -1.037 1.00 0.00 C ATOM 527 O GLN A 32 110.679 0.738 -1.713 1.00 0.00 O ATOM 528 CB GLN A 32 110.260 3.517 -0.126 1.00 0.00 C ATOM 529 CG GLN A 32 109.889 4.996 -0.265 1.00 0.00 C ATOM 530 CD GLN A 32 110.759 5.829 0.677 1.00 0.00 C ATOM 531 OE1 GLN A 32 110.310 6.817 1.224 1.00 0.00 O ATOM 532 NE2 GLN A 32 111.995 5.470 0.890 1.00 0.00 N ATOM 0 H GLN A 32 107.794 3.304 0.084 1.00 0.00 H new ATOM 0 HA GLN A 32 109.661 3.040 -2.130 1.00 0.00 H new ATOM 0 HB2 GLN A 32 110.070 3.176 0.892 1.00 0.00 H new ATOM 0 HB3 GLN A 32 111.324 3.377 -0.315 1.00 0.00 H new ATOM 0 HG2 GLN A 32 110.033 5.323 -1.295 1.00 0.00 H new ATOM 0 HG3 GLN A 32 108.835 5.142 -0.028 1.00 0.00 H new ATOM 0 HE21 GLN A 32 112.372 4.641 0.431 1.00 0.00 H new ATOM 0 HE22 GLN A 32 112.585 6.019 1.516 1.00 0.00 H new ATOM 541 N GLY A 33 109.097 0.457 -0.219 1.00 0.00 N ATOM 542 CA GLY A 33 109.410 -0.995 -0.126 1.00 0.00 C ATOM 543 C GLY A 33 108.970 -1.668 -1.423 1.00 0.00 C ATOM 544 O GLY A 33 109.733 -2.364 -2.061 1.00 0.00 O ATOM 0 H GLY A 33 108.339 0.783 0.381 1.00 0.00 H new ATOM 0 HA2 GLY A 33 110.478 -1.143 0.034 1.00 0.00 H new ATOM 0 HA3 GLY A 33 108.895 -1.440 0.725 1.00 0.00 H new ATOM 548 N THR A 34 107.749 -1.445 -1.834 1.00 0.00 N ATOM 549 CA THR A 34 107.278 -2.054 -3.108 1.00 0.00 C ATOM 550 C THR A 34 108.187 -1.561 -4.234 1.00 0.00 C ATOM 551 O THR A 34 108.301 -2.170 -5.279 1.00 0.00 O ATOM 552 CB THR A 34 105.836 -1.620 -3.384 1.00 0.00 C ATOM 553 OG1 THR A 34 105.664 -0.269 -2.979 1.00 0.00 O ATOM 554 CG2 THR A 34 104.874 -2.516 -2.603 1.00 0.00 C ATOM 0 H THR A 34 107.063 -0.871 -1.344 1.00 0.00 H new ATOM 0 HA THR A 34 107.311 -3.142 -3.043 1.00 0.00 H new ATOM 0 HB THR A 34 105.627 -1.709 -4.450 1.00 0.00 H new ATOM 0 HG1 THR A 34 105.160 -0.241 -2.139 1.00 0.00 H new ATOM 0 HG21 THR A 34 103.848 -2.207 -2.800 1.00 0.00 H new ATOM 0 HG22 THR A 34 105.007 -3.552 -2.915 1.00 0.00 H new ATOM 0 HG23 THR A 34 105.081 -2.429 -1.536 1.00 0.00 H new ATOM 562 N VAL A 35 108.843 -0.457 -4.012 1.00 0.00 N ATOM 563 CA VAL A 35 109.759 0.099 -5.043 1.00 0.00 C ATOM 564 C VAL A 35 111.030 -0.756 -5.096 1.00 0.00 C ATOM 565 O VAL A 35 111.408 -1.261 -6.135 1.00 0.00 O ATOM 566 CB VAL A 35 110.108 1.541 -4.660 1.00 0.00 C ATOM 567 CG1 VAL A 35 111.467 1.929 -5.232 1.00 0.00 C ATOM 568 CG2 VAL A 35 109.043 2.490 -5.213 1.00 0.00 C ATOM 0 H VAL A 35 108.782 0.088 -3.152 1.00 0.00 H new ATOM 0 HA VAL A 35 109.283 0.089 -6.024 1.00 0.00 H new ATOM 0 HB VAL A 35 110.144 1.614 -3.573 1.00 0.00 H new ATOM 0 HG11 VAL A 35 111.700 2.956 -4.951 1.00 0.00 H new ATOM 0 HG12 VAL A 35 112.232 1.262 -4.836 1.00 0.00 H new ATOM 0 HG13 VAL A 35 111.441 1.847 -6.319 1.00 0.00 H new ATOM 0 HG21 VAL A 35 109.292 3.515 -4.940 1.00 0.00 H new ATOM 0 HG22 VAL A 35 109.006 2.402 -6.299 1.00 0.00 H new ATOM 0 HG23 VAL A 35 108.071 2.229 -4.795 1.00 0.00 H new ATOM 578 N ALA A 36 111.689 -0.925 -3.980 1.00 0.00 N ATOM 579 CA ALA A 36 112.930 -1.749 -3.960 1.00 0.00 C ATOM 580 C ALA A 36 112.681 -3.070 -4.693 1.00 0.00 C ATOM 581 O ALA A 36 113.435 -3.458 -5.562 1.00 0.00 O ATOM 582 CB ALA A 36 113.327 -2.037 -2.511 1.00 0.00 C ATOM 0 H ALA A 36 111.420 -0.527 -3.081 1.00 0.00 H new ATOM 0 HA ALA A 36 113.734 -1.205 -4.457 1.00 0.00 H new ATOM 0 HB1 ALA A 36 114.235 -2.640 -2.495 1.00 0.00 H new ATOM 0 HB2 ALA A 36 113.507 -1.097 -1.989 1.00 0.00 H new ATOM 0 HB3 ALA A 36 112.523 -2.580 -2.014 1.00 0.00 H new ATOM 588 N VAL A 37 111.630 -3.766 -4.350 1.00 0.00 N ATOM 589 CA VAL A 37 111.347 -5.060 -5.035 1.00 0.00 C ATOM 590 C VAL A 37 111.297 -4.823 -6.543 1.00 0.00 C ATOM 591 O VAL A 37 111.771 -5.632 -7.320 1.00 0.00 O ATOM 592 CB VAL A 37 110.013 -5.639 -4.548 1.00 0.00 C ATOM 593 CG1 VAL A 37 109.739 -5.161 -3.122 1.00 0.00 C ATOM 594 CG2 VAL A 37 108.875 -5.181 -5.464 1.00 0.00 C ATOM 0 H VAL A 37 110.959 -3.497 -3.630 1.00 0.00 H new ATOM 0 HA VAL A 37 112.136 -5.775 -4.802 1.00 0.00 H new ATOM 0 HB VAL A 37 110.071 -6.727 -4.567 1.00 0.00 H new ATOM 0 HG11 VAL A 37 108.791 -5.573 -2.776 1.00 0.00 H new ATOM 0 HG12 VAL A 37 110.541 -5.497 -2.465 1.00 0.00 H new ATOM 0 HG13 VAL A 37 109.689 -4.072 -3.106 1.00 0.00 H new ATOM 0 HG21 VAL A 37 107.932 -5.598 -5.109 1.00 0.00 H new ATOM 0 HG22 VAL A 37 108.817 -4.093 -5.455 1.00 0.00 H new ATOM 0 HG23 VAL A 37 109.065 -5.526 -6.480 1.00 0.00 H new ATOM 604 N CYS A 38 110.754 -3.713 -6.974 1.00 0.00 N ATOM 605 CA CYS A 38 110.721 -3.450 -8.433 1.00 0.00 C ATOM 606 C CYS A 38 112.143 -3.611 -8.956 1.00 0.00 C ATOM 607 O CYS A 38 112.373 -4.037 -10.069 1.00 0.00 O ATOM 608 CB CYS A 38 110.232 -2.024 -8.699 1.00 0.00 C ATOM 609 SG CYS A 38 108.689 -1.735 -7.798 1.00 0.00 S ATOM 0 H CYS A 38 110.339 -2.991 -6.385 1.00 0.00 H new ATOM 0 HA CYS A 38 110.042 -4.142 -8.931 1.00 0.00 H new ATOM 0 HB2 CYS A 38 110.989 -1.305 -8.385 1.00 0.00 H new ATOM 0 HB3 CYS A 38 110.075 -1.876 -9.767 1.00 0.00 H new ATOM 0 HG CYS A 38 108.859 -2.024 -6.542 1.00 0.00 H new ATOM 615 N ALA A 39 113.103 -3.267 -8.145 1.00 0.00 N ATOM 616 CA ALA A 39 114.519 -3.399 -8.563 1.00 0.00 C ATOM 617 C ALA A 39 114.987 -4.856 -8.420 1.00 0.00 C ATOM 618 O ALA A 39 115.577 -5.423 -9.318 1.00 0.00 O ATOM 619 CB ALA A 39 115.388 -2.498 -7.686 1.00 0.00 C ATOM 0 H ALA A 39 112.963 -2.898 -7.205 1.00 0.00 H new ATOM 0 HA ALA A 39 114.610 -3.102 -9.608 1.00 0.00 H new ATOM 0 HB1 ALA A 39 116.431 -2.591 -7.989 1.00 0.00 H new ATOM 0 HB2 ALA A 39 115.068 -1.462 -7.799 1.00 0.00 H new ATOM 0 HB3 ALA A 39 115.285 -2.797 -6.643 1.00 0.00 H new ATOM 625 N ARG A 40 114.760 -5.450 -7.278 1.00 0.00 N ATOM 626 CA ARG A 40 115.232 -6.849 -7.043 1.00 0.00 C ATOM 627 C ARG A 40 115.038 -7.712 -8.295 1.00 0.00 C ATOM 628 O ARG A 40 115.903 -8.482 -8.655 1.00 0.00 O ATOM 629 CB ARG A 40 114.460 -7.456 -5.866 1.00 0.00 C ATOM 630 CG ARG A 40 114.662 -8.974 -5.832 1.00 0.00 C ATOM 631 CD ARG A 40 113.417 -9.673 -6.382 1.00 0.00 C ATOM 632 NE ARG A 40 113.804 -10.988 -6.967 1.00 0.00 N ATOM 633 CZ ARG A 40 112.935 -11.960 -7.018 1.00 0.00 C ATOM 634 NH1 ARG A 40 111.726 -11.781 -6.559 1.00 0.00 N ATOM 635 NH2 ARG A 40 113.274 -13.112 -7.530 1.00 0.00 N ATOM 0 H ARG A 40 114.266 -5.025 -6.493 1.00 0.00 H new ATOM 0 HA ARG A 40 116.297 -6.823 -6.811 1.00 0.00 H new ATOM 0 HB2 ARG A 40 114.802 -7.015 -4.930 1.00 0.00 H new ATOM 0 HB3 ARG A 40 113.399 -7.224 -5.959 1.00 0.00 H new ATOM 0 HG2 ARG A 40 115.536 -9.248 -6.424 1.00 0.00 H new ATOM 0 HG3 ARG A 40 114.854 -9.302 -4.810 1.00 0.00 H new ATOM 0 HD2 ARG A 40 112.686 -9.818 -5.586 1.00 0.00 H new ATOM 0 HD3 ARG A 40 112.943 -9.051 -7.141 1.00 0.00 H new ATOM 0 HE ARG A 40 114.748 -11.128 -7.327 1.00 0.00 H new ATOM 0 HH11 ARG A 40 111.460 -10.881 -6.160 1.00 0.00 H new ATOM 0 HH12 ARG A 40 111.047 -12.541 -6.599 1.00 0.00 H new ATOM 0 HH21 ARG A 40 114.218 -13.252 -7.890 1.00 0.00 H new ATOM 0 HH22 ARG A 40 112.595 -13.872 -7.570 1.00 0.00 H new ATOM 649 N ILE A 41 113.924 -7.610 -8.962 1.00 0.00 N ATOM 650 CA ILE A 41 113.728 -8.452 -10.182 1.00 0.00 C ATOM 651 C ILE A 41 114.199 -7.712 -11.439 1.00 0.00 C ATOM 652 O ILE A 41 114.474 -8.321 -12.453 1.00 0.00 O ATOM 653 CB ILE A 41 112.252 -8.814 -10.336 1.00 0.00 C ATOM 654 CG1 ILE A 41 111.391 -7.729 -9.689 1.00 0.00 C ATOM 655 CG2 ILE A 41 111.986 -10.155 -9.657 1.00 0.00 C ATOM 656 CD1 ILE A 41 111.761 -6.373 -10.287 1.00 0.00 C ATOM 0 H ILE A 41 113.149 -6.991 -8.724 1.00 0.00 H new ATOM 0 HA ILE A 41 114.320 -9.359 -10.064 1.00 0.00 H new ATOM 0 HB ILE A 41 112.002 -8.888 -11.394 1.00 0.00 H new ATOM 0 HG12 ILE A 41 110.334 -7.938 -9.857 1.00 0.00 H new ATOM 0 HG13 ILE A 41 111.547 -7.719 -8.610 1.00 0.00 H new ATOM 0 HG21 ILE A 41 110.933 -10.415 -9.766 1.00 0.00 H new ATOM 0 HG22 ILE A 41 112.600 -10.926 -10.122 1.00 0.00 H new ATOM 0 HG23 ILE A 41 112.234 -10.082 -8.598 1.00 0.00 H new ATOM 0 HD11 ILE A 41 111.150 -5.595 -9.830 1.00 0.00 H new ATOM 0 HD12 ILE A 41 112.814 -6.167 -10.097 1.00 0.00 H new ATOM 0 HD13 ILE A 41 111.583 -6.389 -11.362 1.00 0.00 H new ATOM 668 N ALA A 42 114.279 -6.411 -11.397 1.00 0.00 N ATOM 669 CA ALA A 42 114.714 -5.664 -12.609 1.00 0.00 C ATOM 670 C ALA A 42 116.239 -5.539 -12.628 1.00 0.00 C ATOM 671 O ALA A 42 116.809 -4.962 -13.533 1.00 0.00 O ATOM 672 CB ALA A 42 114.069 -4.276 -12.610 1.00 0.00 C ATOM 0 H ALA A 42 114.064 -5.837 -10.582 1.00 0.00 H new ATOM 0 HA ALA A 42 114.399 -6.206 -13.501 1.00 0.00 H new ATOM 0 HB1 ALA A 42 114.387 -3.728 -13.497 1.00 0.00 H new ATOM 0 HB2 ALA A 42 112.984 -4.379 -12.616 1.00 0.00 H new ATOM 0 HB3 ALA A 42 114.376 -3.731 -11.717 1.00 0.00 H new ATOM 678 N VAL A 43 116.902 -6.061 -11.628 1.00 0.00 N ATOM 679 CA VAL A 43 118.395 -5.960 -11.581 1.00 0.00 C ATOM 680 C VAL A 43 118.975 -5.947 -13.000 1.00 0.00 C ATOM 681 O VAL A 43 119.996 -5.344 -13.254 1.00 0.00 O ATOM 682 CB VAL A 43 118.967 -7.133 -10.777 1.00 0.00 C ATOM 683 CG1 VAL A 43 117.890 -7.708 -9.862 1.00 0.00 C ATOM 684 CG2 VAL A 43 119.472 -8.231 -11.714 1.00 0.00 C ATOM 0 H VAL A 43 116.476 -6.553 -10.842 1.00 0.00 H new ATOM 0 HA VAL A 43 118.673 -5.027 -11.091 1.00 0.00 H new ATOM 0 HB VAL A 43 119.801 -6.766 -10.179 1.00 0.00 H new ATOM 0 HG11 VAL A 43 118.303 -8.541 -9.293 1.00 0.00 H new ATOM 0 HG12 VAL A 43 117.546 -6.935 -9.175 1.00 0.00 H new ATOM 0 HG13 VAL A 43 117.051 -8.059 -10.463 1.00 0.00 H new ATOM 0 HG21 VAL A 43 119.874 -9.055 -11.125 1.00 0.00 H new ATOM 0 HG22 VAL A 43 118.647 -8.593 -12.328 1.00 0.00 H new ATOM 0 HG23 VAL A 43 120.255 -7.829 -12.357 1.00 0.00 H new ATOM 694 N ALA A 44 118.334 -6.597 -13.927 1.00 0.00 N ATOM 695 CA ALA A 44 118.855 -6.614 -15.323 1.00 0.00 C ATOM 696 C ALA A 44 120.272 -7.191 -15.329 1.00 0.00 C ATOM 697 O ALA A 44 120.780 -7.607 -16.351 1.00 0.00 O ATOM 698 CB ALA A 44 118.883 -5.187 -15.875 1.00 0.00 C ATOM 0 H ALA A 44 117.470 -7.119 -13.780 1.00 0.00 H new ATOM 0 HA ALA A 44 118.207 -7.231 -15.946 1.00 0.00 H new ATOM 0 HB1 ALA A 44 119.264 -5.199 -16.896 1.00 0.00 H new ATOM 0 HB2 ALA A 44 117.874 -4.775 -15.869 1.00 0.00 H new ATOM 0 HB3 ALA A 44 119.531 -4.569 -15.253 1.00 0.00 H new ATOM 704 N SER A 45 120.912 -7.220 -14.193 1.00 0.00 N ATOM 705 CA SER A 45 122.292 -7.769 -14.127 1.00 0.00 C ATOM 706 C SER A 45 122.255 -9.271 -14.373 1.00 0.00 C ATOM 707 O SER A 45 121.480 -9.769 -15.165 1.00 0.00 O ATOM 708 CB SER A 45 122.882 -7.509 -12.743 1.00 0.00 C ATOM 709 OG SER A 45 122.611 -8.621 -11.900 1.00 0.00 O ATOM 0 H SER A 45 120.536 -6.886 -13.306 1.00 0.00 H new ATOM 0 HA SER A 45 122.906 -7.284 -14.886 1.00 0.00 H new ATOM 0 HB2 SER A 45 123.958 -7.348 -12.818 1.00 0.00 H new ATOM 0 HB3 SER A 45 122.453 -6.602 -12.317 1.00 0.00 H new ATOM 0 HG SER A 45 123.421 -8.859 -11.402 1.00 0.00 H new ATOM 715 N ASP A 46 123.091 -9.990 -13.691 1.00 0.00 N ATOM 716 CA ASP A 46 123.121 -11.469 -13.866 1.00 0.00 C ATOM 717 C ASP A 46 123.213 -12.139 -12.494 1.00 0.00 C ATOM 718 O ASP A 46 124.182 -12.803 -12.183 1.00 0.00 O ATOM 719 CB ASP A 46 124.338 -11.859 -14.707 1.00 0.00 C ATOM 720 CG ASP A 46 125.562 -11.077 -14.229 1.00 0.00 C ATOM 721 OD1 ASP A 46 125.827 -11.100 -13.038 1.00 0.00 O ATOM 722 OD2 ASP A 46 126.214 -10.468 -15.061 1.00 0.00 O ATOM 0 H ASP A 46 123.760 -9.620 -13.016 1.00 0.00 H new ATOM 0 HA ASP A 46 122.212 -11.795 -14.372 1.00 0.00 H new ATOM 0 HB2 ASP A 46 124.523 -12.930 -14.624 1.00 0.00 H new ATOM 0 HB3 ASP A 46 124.148 -11.649 -15.760 1.00 0.00 H new ATOM 727 N GLY A 47 122.215 -11.971 -11.668 1.00 0.00 N ATOM 728 CA GLY A 47 122.261 -12.602 -10.320 1.00 0.00 C ATOM 729 C GLY A 47 120.881 -12.549 -9.664 1.00 0.00 C ATOM 730 O GLY A 47 120.334 -13.559 -9.267 1.00 0.00 O ATOM 0 H GLY A 47 121.375 -11.427 -11.868 1.00 0.00 H new ATOM 0 HA2 GLY A 47 122.591 -13.637 -10.406 1.00 0.00 H new ATOM 0 HA3 GLY A 47 122.989 -12.086 -9.694 1.00 0.00 H new ATOM 734 N VAL A 48 120.317 -11.381 -9.537 1.00 0.00 N ATOM 735 CA VAL A 48 118.977 -11.265 -8.897 1.00 0.00 C ATOM 736 C VAL A 48 119.082 -11.662 -7.424 1.00 0.00 C ATOM 737 O VAL A 48 119.893 -12.486 -7.049 1.00 0.00 O ATOM 738 CB VAL A 48 117.981 -12.185 -9.607 1.00 0.00 C ATOM 739 CG1 VAL A 48 116.554 -11.738 -9.286 1.00 0.00 C ATOM 740 CG2 VAL A 48 118.207 -12.114 -11.119 1.00 0.00 C ATOM 0 H VAL A 48 120.726 -10.500 -9.849 1.00 0.00 H new ATOM 0 HA VAL A 48 118.629 -10.235 -8.973 1.00 0.00 H new ATOM 0 HB VAL A 48 118.128 -13.209 -9.265 1.00 0.00 H new ATOM 0 HG11 VAL A 48 115.845 -12.393 -9.792 1.00 0.00 H new ATOM 0 HG12 VAL A 48 116.390 -11.788 -8.210 1.00 0.00 H new ATOM 0 HG13 VAL A 48 116.408 -10.713 -9.628 1.00 0.00 H new ATOM 0 HG21 VAL A 48 117.497 -12.769 -11.624 1.00 0.00 H new ATOM 0 HG22 VAL A 48 118.061 -11.089 -11.461 1.00 0.00 H new ATOM 0 HG23 VAL A 48 119.223 -12.433 -11.350 1.00 0.00 H new ATOM 750 N SER A 49 118.271 -11.077 -6.584 1.00 0.00 N ATOM 751 CA SER A 49 118.329 -11.416 -5.135 1.00 0.00 C ATOM 752 C SER A 49 116.935 -11.801 -4.636 1.00 0.00 C ATOM 753 O SER A 49 116.228 -12.564 -5.264 1.00 0.00 O ATOM 754 CB SER A 49 118.832 -10.203 -4.351 1.00 0.00 C ATOM 755 OG SER A 49 119.708 -9.444 -5.173 1.00 0.00 O ATOM 0 H SER A 49 117.572 -10.380 -6.839 1.00 0.00 H new ATOM 0 HA SER A 49 119.008 -12.256 -4.988 1.00 0.00 H new ATOM 0 HB2 SER A 49 117.991 -9.588 -4.031 1.00 0.00 H new ATOM 0 HB3 SER A 49 119.351 -10.528 -3.449 1.00 0.00 H new ATOM 0 HG SER A 49 119.265 -8.612 -5.442 1.00 0.00 H new ATOM 761 N SER A 50 116.542 -11.282 -3.506 1.00 0.00 N ATOM 762 CA SER A 50 115.204 -11.612 -2.946 1.00 0.00 C ATOM 763 C SER A 50 115.251 -11.398 -1.436 1.00 0.00 C ATOM 764 O SER A 50 114.593 -10.530 -0.899 1.00 0.00 O ATOM 765 CB SER A 50 114.863 -13.072 -3.247 1.00 0.00 C ATOM 766 OG SER A 50 114.162 -13.146 -4.481 1.00 0.00 O ATOM 0 H SER A 50 117.097 -10.638 -2.942 1.00 0.00 H new ATOM 0 HA SER A 50 114.442 -10.974 -3.394 1.00 0.00 H new ATOM 0 HB2 SER A 50 115.775 -13.667 -3.297 1.00 0.00 H new ATOM 0 HB3 SER A 50 114.254 -13.488 -2.444 1.00 0.00 H new ATOM 0 HG SER A 50 114.687 -12.708 -5.183 1.00 0.00 H new ATOM 772 N GLU A 51 116.038 -12.178 -0.749 1.00 0.00 N ATOM 773 CA GLU A 51 116.147 -12.017 0.725 1.00 0.00 C ATOM 774 C GLU A 51 116.918 -10.732 1.038 1.00 0.00 C ATOM 775 O GLU A 51 116.654 -10.064 2.017 1.00 0.00 O ATOM 776 CB GLU A 51 116.891 -13.216 1.317 1.00 0.00 C ATOM 777 CG GLU A 51 117.087 -13.006 2.819 1.00 0.00 C ATOM 778 CD GLU A 51 117.409 -14.345 3.485 1.00 0.00 C ATOM 779 OE1 GLU A 51 116.492 -15.127 3.674 1.00 0.00 O ATOM 780 OE2 GLU A 51 118.568 -14.566 3.795 1.00 0.00 O ATOM 0 H GLU A 51 116.611 -12.922 -1.147 1.00 0.00 H new ATOM 0 HA GLU A 51 115.149 -11.960 1.160 1.00 0.00 H new ATOM 0 HB2 GLU A 51 116.327 -14.131 1.138 1.00 0.00 H new ATOM 0 HB3 GLU A 51 117.857 -13.336 0.827 1.00 0.00 H new ATOM 0 HG2 GLU A 51 117.896 -12.297 2.995 1.00 0.00 H new ATOM 0 HG3 GLU A 51 116.186 -12.577 3.257 1.00 0.00 H new ATOM 787 N GLU A 52 117.875 -10.382 0.219 1.00 0.00 N ATOM 788 CA GLU A 52 118.658 -9.141 0.484 1.00 0.00 C ATOM 789 C GLU A 52 117.785 -7.915 0.217 1.00 0.00 C ATOM 790 O GLU A 52 117.657 -7.046 1.055 1.00 0.00 O ATOM 791 CB GLU A 52 119.881 -9.107 -0.432 1.00 0.00 C ATOM 792 CG GLU A 52 121.111 -9.601 0.334 1.00 0.00 C ATOM 793 CD GLU A 52 121.421 -8.638 1.482 1.00 0.00 C ATOM 794 OE1 GLU A 52 121.271 -7.444 1.283 1.00 0.00 O ATOM 795 OE2 GLU A 52 121.802 -9.111 2.540 1.00 0.00 O ATOM 0 H GLU A 52 118.147 -10.899 -0.617 1.00 0.00 H new ATOM 0 HA GLU A 52 118.982 -9.132 1.525 1.00 0.00 H new ATOM 0 HB2 GLU A 52 119.710 -9.733 -1.307 1.00 0.00 H new ATOM 0 HB3 GLU A 52 120.049 -8.093 -0.794 1.00 0.00 H new ATOM 0 HG2 GLU A 52 120.931 -10.603 0.725 1.00 0.00 H new ATOM 0 HG3 GLU A 52 121.967 -9.670 -0.338 1.00 0.00 H new ATOM 802 N LYS A 53 117.166 -7.834 -0.932 1.00 0.00 N ATOM 803 CA LYS A 53 116.296 -6.654 -1.198 1.00 0.00 C ATOM 804 C LYS A 53 115.270 -6.580 -0.071 1.00 0.00 C ATOM 805 O LYS A 53 114.932 -5.518 0.414 1.00 0.00 O ATOM 806 CB LYS A 53 115.588 -6.805 -2.556 1.00 0.00 C ATOM 807 CG LYS A 53 114.108 -6.414 -2.432 1.00 0.00 C ATOM 808 CD LYS A 53 113.297 -7.610 -1.917 1.00 0.00 C ATOM 809 CE LYS A 53 112.387 -8.136 -3.029 1.00 0.00 C ATOM 810 NZ LYS A 53 111.979 -9.535 -2.717 1.00 0.00 N ATOM 0 H LYS A 53 117.224 -8.521 -1.684 1.00 0.00 H new ATOM 0 HA LYS A 53 116.891 -5.741 -1.236 1.00 0.00 H new ATOM 0 HB2 LYS A 53 116.076 -6.176 -3.300 1.00 0.00 H new ATOM 0 HB3 LYS A 53 115.671 -7.834 -2.905 1.00 0.00 H new ATOM 0 HG2 LYS A 53 114.001 -5.570 -1.751 1.00 0.00 H new ATOM 0 HG3 LYS A 53 113.725 -6.093 -3.400 1.00 0.00 H new ATOM 0 HD2 LYS A 53 113.969 -8.399 -1.581 1.00 0.00 H new ATOM 0 HD3 LYS A 53 112.699 -7.312 -1.056 1.00 0.00 H new ATOM 0 HE2 LYS A 53 111.506 -7.501 -3.123 1.00 0.00 H new ATOM 0 HE3 LYS A 53 112.908 -8.103 -3.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 111.905 -10.080 -3.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 112.690 -9.974 -2.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 111.057 -9.529 -2.236 1.00 0.00 H new ATOM 824 N GLN A 54 114.782 -7.711 0.353 1.00 0.00 N ATOM 825 CA GLN A 54 113.788 -7.730 1.456 1.00 0.00 C ATOM 826 C GLN A 54 114.353 -6.936 2.638 1.00 0.00 C ATOM 827 O GLN A 54 113.647 -6.193 3.294 1.00 0.00 O ATOM 828 CB GLN A 54 113.511 -9.190 1.848 1.00 0.00 C ATOM 829 CG GLN A 54 114.085 -9.500 3.234 1.00 0.00 C ATOM 830 CD GLN A 54 113.252 -8.794 4.306 1.00 0.00 C ATOM 831 OE1 GLN A 54 113.747 -7.935 5.008 1.00 0.00 O ATOM 832 NE2 GLN A 54 111.999 -9.124 4.463 1.00 0.00 N ATOM 0 H GLN A 54 115.031 -8.627 -0.020 1.00 0.00 H new ATOM 0 HA GLN A 54 112.849 -7.272 1.145 1.00 0.00 H new ATOM 0 HB2 GLN A 54 112.437 -9.374 1.845 1.00 0.00 H new ATOM 0 HB3 GLN A 54 113.951 -9.859 1.109 1.00 0.00 H new ATOM 0 HG2 GLN A 54 114.082 -10.576 3.407 1.00 0.00 H new ATOM 0 HG3 GLN A 54 115.123 -9.171 3.291 1.00 0.00 H new ATOM 0 HE21 GLN A 54 111.584 -9.845 3.873 1.00 0.00 H new ATOM 0 HE22 GLN A 54 111.435 -8.661 5.175 1.00 0.00 H new ATOM 841 N LYS A 55 115.627 -7.068 2.901 1.00 0.00 N ATOM 842 CA LYS A 55 116.231 -6.298 4.022 1.00 0.00 C ATOM 843 C LYS A 55 116.115 -4.814 3.685 1.00 0.00 C ATOM 844 O LYS A 55 115.776 -3.998 4.519 1.00 0.00 O ATOM 845 CB LYS A 55 117.705 -6.683 4.182 1.00 0.00 C ATOM 846 CG LYS A 55 117.815 -7.951 5.036 1.00 0.00 C ATOM 847 CD LYS A 55 118.830 -8.908 4.407 1.00 0.00 C ATOM 848 CE LYS A 55 119.393 -9.835 5.486 1.00 0.00 C ATOM 849 NZ LYS A 55 118.297 -10.684 6.033 1.00 0.00 N ATOM 0 H LYS A 55 116.270 -7.673 2.390 1.00 0.00 H new ATOM 0 HA LYS A 55 115.715 -6.517 4.957 1.00 0.00 H new ATOM 0 HB2 LYS A 55 118.156 -6.851 3.204 1.00 0.00 H new ATOM 0 HB3 LYS A 55 118.256 -5.868 4.651 1.00 0.00 H new ATOM 0 HG2 LYS A 55 118.123 -7.693 6.049 1.00 0.00 H new ATOM 0 HG3 LYS A 55 116.842 -8.436 5.112 1.00 0.00 H new ATOM 0 HD2 LYS A 55 118.354 -9.494 3.621 1.00 0.00 H new ATOM 0 HD3 LYS A 55 119.637 -8.344 3.940 1.00 0.00 H new ATOM 0 HE2 LYS A 55 120.179 -10.463 5.067 1.00 0.00 H new ATOM 0 HE3 LYS A 55 119.846 -9.248 6.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 118.705 -11.456 6.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 117.677 -10.105 6.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 117.743 -11.084 5.249 1.00 0.00 H new ATOM 863 N MET A 56 116.375 -4.465 2.454 1.00 0.00 N ATOM 864 CA MET A 56 116.260 -3.041 2.043 1.00 0.00 C ATOM 865 C MET A 56 114.874 -2.527 2.444 1.00 0.00 C ATOM 866 O MET A 56 114.697 -1.368 2.757 1.00 0.00 O ATOM 867 CB MET A 56 116.426 -2.942 0.521 1.00 0.00 C ATOM 868 CG MET A 56 117.421 -1.832 0.177 1.00 0.00 C ATOM 869 SD MET A 56 116.672 -0.222 0.529 1.00 0.00 S ATOM 870 CE MET A 56 118.117 0.798 0.147 1.00 0.00 C ATOM 0 H MET A 56 116.662 -5.108 1.716 1.00 0.00 H new ATOM 0 HA MET A 56 117.031 -2.443 2.529 1.00 0.00 H new ATOM 0 HB2 MET A 56 116.777 -3.894 0.122 1.00 0.00 H new ATOM 0 HB3 MET A 56 115.463 -2.737 0.054 1.00 0.00 H new ATOM 0 HG2 MET A 56 118.335 -1.955 0.758 1.00 0.00 H new ATOM 0 HG3 MET A 56 117.701 -1.893 -0.875 1.00 0.00 H new ATOM 0 HE1 MET A 56 118.205 1.595 0.885 1.00 0.00 H new ATOM 0 HE2 MET A 56 119.015 0.180 0.171 1.00 0.00 H new ATOM 0 HE3 MET A 56 118.003 1.234 -0.846 1.00 0.00 H new ATOM 880 N ILE A 57 113.889 -3.386 2.451 1.00 0.00 N ATOM 881 CA ILE A 57 112.523 -2.942 2.848 1.00 0.00 C ATOM 882 C ILE A 57 112.523 -2.645 4.349 1.00 0.00 C ATOM 883 O ILE A 57 111.924 -1.690 4.803 1.00 0.00 O ATOM 884 CB ILE A 57 111.504 -4.044 2.533 1.00 0.00 C ATOM 885 CG1 ILE A 57 111.843 -4.689 1.184 1.00 0.00 C ATOM 886 CG2 ILE A 57 110.092 -3.448 2.474 1.00 0.00 C ATOM 887 CD1 ILE A 57 111.632 -3.674 0.058 1.00 0.00 C ATOM 0 H ILE A 57 113.972 -4.371 2.200 1.00 0.00 H new ATOM 0 HA ILE A 57 112.248 -2.045 2.293 1.00 0.00 H new ATOM 0 HB ILE A 57 111.543 -4.800 3.318 1.00 0.00 H new ATOM 0 HG12 ILE A 57 112.877 -5.035 1.185 1.00 0.00 H new ATOM 0 HG13 ILE A 57 111.214 -5.564 1.020 1.00 0.00 H new ATOM 0 HG21 ILE A 57 109.373 -4.236 2.250 1.00 0.00 H new ATOM 0 HG22 ILE A 57 109.847 -2.996 3.435 1.00 0.00 H new ATOM 0 HG23 ILE A 57 110.051 -2.687 1.695 1.00 0.00 H new ATOM 0 HD11 ILE A 57 111.874 -4.137 -0.899 1.00 0.00 H new ATOM 0 HD12 ILE A 57 110.592 -3.349 0.051 1.00 0.00 H new ATOM 0 HD13 ILE A 57 112.280 -2.812 0.219 1.00 0.00 H new ATOM 899 N GLY A 58 113.210 -3.443 5.123 1.00 0.00 N ATOM 900 CA GLY A 58 113.267 -3.187 6.591 1.00 0.00 C ATOM 901 C GLY A 58 113.994 -1.861 6.822 1.00 0.00 C ATOM 902 O GLY A 58 113.558 -1.011 7.585 1.00 0.00 O ATOM 0 H GLY A 58 113.732 -4.258 4.803 1.00 0.00 H new ATOM 0 HA2 GLY A 58 112.261 -3.146 7.008 1.00 0.00 H new ATOM 0 HA3 GLY A 58 113.789 -3.999 7.098 1.00 0.00 H new ATOM 906 N PHE A 59 115.092 -1.666 6.145 1.00 0.00 N ATOM 907 CA PHE A 59 115.837 -0.392 6.299 1.00 0.00 C ATOM 908 C PHE A 59 114.866 0.747 6.014 1.00 0.00 C ATOM 909 O PHE A 59 114.887 1.776 6.657 1.00 0.00 O ATOM 910 CB PHE A 59 116.998 -0.362 5.300 1.00 0.00 C ATOM 911 CG PHE A 59 117.069 0.986 4.624 1.00 0.00 C ATOM 912 CD1 PHE A 59 117.727 2.050 5.248 1.00 0.00 C ATOM 913 CD2 PHE A 59 116.477 1.168 3.370 1.00 0.00 C ATOM 914 CE1 PHE A 59 117.791 3.296 4.617 1.00 0.00 C ATOM 915 CE2 PHE A 59 116.541 2.414 2.740 1.00 0.00 C ATOM 916 CZ PHE A 59 117.196 3.478 3.362 1.00 0.00 C ATOM 0 H PHE A 59 115.502 -2.335 5.493 1.00 0.00 H new ATOM 0 HA PHE A 59 116.244 -0.294 7.305 1.00 0.00 H new ATOM 0 HB2 PHE A 59 117.936 -0.569 5.815 1.00 0.00 H new ATOM 0 HB3 PHE A 59 116.865 -1.145 4.553 1.00 0.00 H new ATOM 0 HD1 PHE A 59 118.185 1.910 6.216 1.00 0.00 H new ATOM 0 HD2 PHE A 59 115.970 0.345 2.888 1.00 0.00 H new ATOM 0 HE1 PHE A 59 118.300 4.119 5.098 1.00 0.00 H new ATOM 0 HE2 PHE A 59 116.084 2.554 1.772 1.00 0.00 H new ATOM 0 HZ PHE A 59 117.244 4.441 2.876 1.00 0.00 H new ATOM 926 N LEU A 60 113.992 0.550 5.067 1.00 0.00 N ATOM 927 CA LEU A 60 112.990 1.598 4.750 1.00 0.00 C ATOM 928 C LEU A 60 112.228 1.921 6.029 1.00 0.00 C ATOM 929 O LEU A 60 111.994 3.066 6.356 1.00 0.00 O ATOM 930 CB LEU A 60 112.021 1.061 3.692 1.00 0.00 C ATOM 931 CG LEU A 60 112.042 1.933 2.427 1.00 0.00 C ATOM 932 CD1 LEU A 60 113.475 2.369 2.089 1.00 0.00 C ATOM 933 CD2 LEU A 60 111.493 1.107 1.266 1.00 0.00 C ATOM 0 H LEU A 60 113.930 -0.295 4.499 1.00 0.00 H new ATOM 0 HA LEU A 60 113.476 2.495 4.365 1.00 0.00 H new ATOM 0 HB2 LEU A 60 112.290 0.036 3.435 1.00 0.00 H new ATOM 0 HB3 LEU A 60 111.011 1.033 4.101 1.00 0.00 H new ATOM 0 HG LEU A 60 111.437 2.824 2.597 1.00 0.00 H new ATOM 0 HD11 LEU A 60 113.465 2.985 1.190 1.00 0.00 H new ATOM 0 HD12 LEU A 60 113.886 2.944 2.919 1.00 0.00 H new ATOM 0 HD13 LEU A 60 114.093 1.487 1.918 1.00 0.00 H new ATOM 0 HD21 LEU A 60 111.499 1.708 0.357 1.00 0.00 H new ATOM 0 HD22 LEU A 60 112.115 0.224 1.121 1.00 0.00 H new ATOM 0 HD23 LEU A 60 110.472 0.798 1.490 1.00 0.00 H new ATOM 945 N ARG A 61 111.849 0.917 6.767 1.00 0.00 N ATOM 946 CA ARG A 61 111.119 1.176 8.031 1.00 0.00 C ATOM 947 C ARG A 61 111.897 2.227 8.817 1.00 0.00 C ATOM 948 O ARG A 61 111.329 3.093 9.453 1.00 0.00 O ATOM 949 CB ARG A 61 111.026 -0.117 8.842 1.00 0.00 C ATOM 950 CG ARG A 61 110.464 -1.231 7.956 1.00 0.00 C ATOM 951 CD ARG A 61 110.522 -2.562 8.707 1.00 0.00 C ATOM 952 NE ARG A 61 110.147 -3.670 7.785 1.00 0.00 N ATOM 953 CZ ARG A 61 110.222 -4.909 8.188 1.00 0.00 C ATOM 954 NH1 ARG A 61 110.629 -5.178 9.399 1.00 0.00 N ATOM 955 NH2 ARG A 61 109.891 -5.879 7.381 1.00 0.00 N ATOM 0 H ARG A 61 112.013 -0.066 6.549 1.00 0.00 H new ATOM 0 HA ARG A 61 110.110 1.531 7.824 1.00 0.00 H new ATOM 0 HB2 ARG A 61 112.011 -0.396 9.216 1.00 0.00 H new ATOM 0 HB3 ARG A 61 110.385 0.031 9.711 1.00 0.00 H new ATOM 0 HG2 ARG A 61 109.435 -1.004 7.677 1.00 0.00 H new ATOM 0 HG3 ARG A 61 111.037 -1.298 7.031 1.00 0.00 H new ATOM 0 HD2 ARG A 61 111.525 -2.726 9.101 1.00 0.00 H new ATOM 0 HD3 ARG A 61 109.844 -2.540 9.560 1.00 0.00 H new ATOM 0 HE ARG A 61 109.831 -3.460 6.838 1.00 0.00 H new ATOM 0 HH11 ARG A 61 110.888 -4.420 10.030 1.00 0.00 H new ATOM 0 HH12 ARG A 61 110.688 -6.146 9.714 1.00 0.00 H new ATOM 0 HH21 ARG A 61 109.573 -5.669 6.435 1.00 0.00 H new ATOM 0 HH22 ARG A 61 109.950 -6.847 7.696 1.00 0.00 H new ATOM 969 N SER A 62 113.202 2.160 8.768 1.00 0.00 N ATOM 970 CA SER A 62 114.029 3.161 9.505 1.00 0.00 C ATOM 971 C SER A 62 114.800 4.052 8.514 1.00 0.00 C ATOM 972 O SER A 62 115.644 4.832 8.906 1.00 0.00 O ATOM 973 CB SER A 62 115.014 2.431 10.418 1.00 0.00 C ATOM 974 OG SER A 62 114.297 1.797 11.468 1.00 0.00 O ATOM 0 H SER A 62 113.730 1.457 8.251 1.00 0.00 H new ATOM 0 HA SER A 62 113.373 3.793 10.104 1.00 0.00 H new ATOM 0 HB2 SER A 62 115.577 1.692 9.848 1.00 0.00 H new ATOM 0 HB3 SER A 62 115.737 3.135 10.829 1.00 0.00 H new ATOM 0 HG SER A 62 114.925 1.326 12.055 1.00 0.00 H new ATOM 980 N SER A 63 114.532 3.929 7.236 1.00 0.00 N ATOM 981 CA SER A 63 115.262 4.754 6.220 1.00 0.00 C ATOM 982 C SER A 63 115.440 6.193 6.708 1.00 0.00 C ATOM 983 O SER A 63 115.015 6.557 7.783 1.00 0.00 O ATOM 984 CB SER A 63 114.482 4.774 4.904 1.00 0.00 C ATOM 985 OG SER A 63 113.110 4.517 5.164 1.00 0.00 O ATOM 0 H SER A 63 113.836 3.290 6.851 1.00 0.00 H new ATOM 0 HA SER A 63 116.243 4.305 6.068 1.00 0.00 H new ATOM 0 HB2 SER A 63 114.596 5.742 4.416 1.00 0.00 H new ATOM 0 HB3 SER A 63 114.881 4.024 4.221 1.00 0.00 H new ATOM 0 HG SER A 63 112.641 4.356 4.318 1.00 0.00 H new ATOM 991 N GLU A 64 116.067 7.017 5.908 1.00 0.00 N ATOM 992 CA GLU A 64 116.273 8.435 6.307 1.00 0.00 C ATOM 993 C GLU A 64 114.924 9.148 6.314 1.00 0.00 C ATOM 994 O GLU A 64 114.771 10.204 6.895 1.00 0.00 O ATOM 995 CB GLU A 64 117.211 9.119 5.308 1.00 0.00 C ATOM 996 CG GLU A 64 117.459 10.570 5.740 1.00 0.00 C ATOM 997 CD GLU A 64 118.952 10.782 6.000 1.00 0.00 C ATOM 998 OE1 GLU A 64 119.728 10.583 5.079 1.00 0.00 O ATOM 999 OE2 GLU A 64 119.294 11.139 7.115 1.00 0.00 O ATOM 0 H GLU A 64 116.445 6.765 4.995 1.00 0.00 H new ATOM 0 HA GLU A 64 116.718 8.478 7.301 1.00 0.00 H new ATOM 0 HB2 GLU A 64 118.156 8.579 5.254 1.00 0.00 H new ATOM 0 HB3 GLU A 64 116.774 9.096 4.310 1.00 0.00 H new ATOM 0 HG2 GLU A 64 117.114 11.254 4.965 1.00 0.00 H new ATOM 0 HG3 GLU A 64 116.888 10.794 6.641 1.00 0.00 H new ATOM 1006 N GLU A 65 113.936 8.572 5.682 1.00 0.00 N ATOM 1007 CA GLU A 65 112.592 9.211 5.667 1.00 0.00 C ATOM 1008 C GLU A 65 112.265 9.684 7.083 1.00 0.00 C ATOM 1009 O GLU A 65 111.320 10.414 7.308 1.00 0.00 O ATOM 1010 CB GLU A 65 111.547 8.189 5.212 1.00 0.00 C ATOM 1011 CG GLU A 65 111.590 8.038 3.686 1.00 0.00 C ATOM 1012 CD GLU A 65 112.124 6.651 3.322 1.00 0.00 C ATOM 1013 OE1 GLU A 65 111.412 5.686 3.546 1.00 0.00 O ATOM 1014 OE2 GLU A 65 113.236 6.577 2.825 1.00 0.00 O ATOM 0 H GLU A 65 114.003 7.688 5.177 1.00 0.00 H new ATOM 0 HA GLU A 65 112.585 10.057 4.980 1.00 0.00 H new ATOM 0 HB2 GLU A 65 111.737 7.226 5.686 1.00 0.00 H new ATOM 0 HB3 GLU A 65 110.553 8.508 5.526 1.00 0.00 H new ATOM 0 HG2 GLU A 65 110.593 8.176 3.269 1.00 0.00 H new ATOM 0 HG3 GLU A 65 112.226 8.809 3.252 1.00 0.00 H new ATOM 1021 N LEU A 66 113.055 9.275 8.037 1.00 0.00 N ATOM 1022 CA LEU A 66 112.818 9.696 9.445 1.00 0.00 C ATOM 1023 C LEU A 66 112.605 11.209 9.467 1.00 0.00 C ATOM 1024 O LEU A 66 111.832 11.733 10.244 1.00 0.00 O ATOM 1025 CB LEU A 66 114.052 9.352 10.289 1.00 0.00 C ATOM 1026 CG LEU A 66 113.978 7.908 10.811 1.00 0.00 C ATOM 1027 CD1 LEU A 66 113.217 7.013 9.826 1.00 0.00 C ATOM 1028 CD2 LEU A 66 115.400 7.366 10.983 1.00 0.00 C ATOM 0 H LEU A 66 113.860 8.663 7.900 1.00 0.00 H new ATOM 0 HA LEU A 66 111.945 9.184 9.849 1.00 0.00 H new ATOM 0 HB2 LEU A 66 114.954 9.480 9.690 1.00 0.00 H new ATOM 0 HB3 LEU A 66 114.126 10.043 11.129 1.00 0.00 H new ATOM 0 HG LEU A 66 113.451 7.906 11.765 1.00 0.00 H new ATOM 0 HD11 LEU A 66 113.177 5.996 10.215 1.00 0.00 H new ATOM 0 HD12 LEU A 66 112.203 7.393 9.698 1.00 0.00 H new ATOM 0 HD13 LEU A 66 113.729 7.013 8.864 1.00 0.00 H new ATOM 0 HD21 LEU A 66 115.357 6.342 11.353 1.00 0.00 H new ATOM 0 HD22 LEU A 66 115.915 7.383 10.022 1.00 0.00 H new ATOM 0 HD23 LEU A 66 115.942 7.987 11.696 1.00 0.00 H new ATOM 1040 N LYS A 67 113.292 11.911 8.609 1.00 0.00 N ATOM 1041 CA LYS A 67 113.149 13.392 8.554 1.00 0.00 C ATOM 1042 C LYS A 67 111.758 13.760 8.031 1.00 0.00 C ATOM 1043 O LYS A 67 111.063 14.552 8.631 1.00 0.00 O ATOM 1044 CB LYS A 67 114.212 13.971 7.618 1.00 0.00 C ATOM 1045 CG LYS A 67 114.419 13.025 6.428 1.00 0.00 C ATOM 1046 CD LYS A 67 114.096 13.749 5.123 1.00 0.00 C ATOM 1047 CE LYS A 67 113.832 12.709 4.033 1.00 0.00 C ATOM 1048 NZ LYS A 67 115.011 11.806 3.911 1.00 0.00 N ATOM 0 H LYS A 67 113.952 11.518 7.938 1.00 0.00 H new ATOM 0 HA LYS A 67 113.278 13.803 9.555 1.00 0.00 H new ATOM 0 HB2 LYS A 67 113.903 14.955 7.264 1.00 0.00 H new ATOM 0 HB3 LYS A 67 115.150 14.106 8.156 1.00 0.00 H new ATOM 0 HG2 LYS A 67 115.449 12.669 6.411 1.00 0.00 H new ATOM 0 HG3 LYS A 67 113.781 12.148 6.535 1.00 0.00 H new ATOM 0 HD2 LYS A 67 113.223 14.389 5.253 1.00 0.00 H new ATOM 0 HD3 LYS A 67 114.925 14.395 4.835 1.00 0.00 H new ATOM 0 HE2 LYS A 67 112.941 12.130 4.276 1.00 0.00 H new ATOM 0 HE3 LYS A 67 113.640 13.205 3.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 114.940 11.259 3.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 115.883 12.373 3.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 115.035 11.155 4.721 1.00 0.00 H new ATOM 1062 N VAL A 68 111.354 13.197 6.915 1.00 0.00 N ATOM 1063 CA VAL A 68 110.010 13.516 6.346 1.00 0.00 C ATOM 1064 C VAL A 68 110.140 14.708 5.396 1.00 0.00 C ATOM 1065 O VAL A 68 109.369 15.641 5.464 1.00 0.00 O ATOM 1066 CB VAL A 68 109.035 13.867 7.485 1.00 0.00 C ATOM 1067 CG1 VAL A 68 107.597 13.874 6.965 1.00 0.00 C ATOM 1068 CG2 VAL A 68 109.161 12.830 8.611 1.00 0.00 C ATOM 0 H VAL A 68 111.902 12.528 6.374 1.00 0.00 H new ATOM 0 HA VAL A 68 109.627 12.652 5.802 1.00 0.00 H new ATOM 0 HB VAL A 68 109.283 14.857 7.867 1.00 0.00 H new ATOM 0 HG11 VAL A 68 106.917 14.123 7.779 1.00 0.00 H new ATOM 0 HG12 VAL A 68 107.501 14.615 6.172 1.00 0.00 H new ATOM 0 HG13 VAL A 68 107.347 12.888 6.573 1.00 0.00 H new ATOM 0 HG21 VAL A 68 108.470 13.081 9.416 1.00 0.00 H new ATOM 0 HG22 VAL A 68 108.922 11.840 8.222 1.00 0.00 H new ATOM 0 HG23 VAL A 68 110.181 12.832 8.995 1.00 0.00 H new ATOM 1078 N PHE A 69 111.110 14.688 4.507 1.00 0.00 N ATOM 1079 CA PHE A 69 111.275 15.845 3.568 1.00 0.00 C ATOM 1080 C PHE A 69 112.344 15.573 2.497 1.00 0.00 C ATOM 1081 O PHE A 69 112.057 15.568 1.317 1.00 0.00 O ATOM 1082 CB PHE A 69 111.697 17.085 4.361 1.00 0.00 C ATOM 1083 CG PHE A 69 110.536 17.603 5.172 1.00 0.00 C ATOM 1084 CD1 PHE A 69 109.480 18.271 4.542 1.00 0.00 C ATOM 1085 CD2 PHE A 69 110.516 17.413 6.559 1.00 0.00 C ATOM 1086 CE1 PHE A 69 108.403 18.749 5.299 1.00 0.00 C ATOM 1087 CE2 PHE A 69 109.440 17.891 7.316 1.00 0.00 C ATOM 1088 CZ PHE A 69 108.384 18.559 6.686 1.00 0.00 C ATOM 0 H PHE A 69 111.785 13.932 4.393 1.00 0.00 H new ATOM 0 HA PHE A 69 110.318 15.999 3.070 1.00 0.00 H new ATOM 0 HB2 PHE A 69 112.529 16.839 5.020 1.00 0.00 H new ATOM 0 HB3 PHE A 69 112.049 17.860 3.679 1.00 0.00 H new ATOM 0 HD1 PHE A 69 109.496 18.418 3.472 1.00 0.00 H new ATOM 0 HD2 PHE A 69 111.331 16.897 7.045 1.00 0.00 H new ATOM 0 HE1 PHE A 69 107.587 19.264 4.813 1.00 0.00 H new ATOM 0 HE2 PHE A 69 109.425 17.744 8.386 1.00 0.00 H new ATOM 0 HZ PHE A 69 107.554 18.928 7.270 1.00 0.00 H new ATOM 1098 N ASP A 70 113.579 15.397 2.890 1.00 0.00 N ATOM 1099 CA ASP A 70 114.663 15.185 1.879 1.00 0.00 C ATOM 1100 C ASP A 70 114.252 14.134 0.843 1.00 0.00 C ATOM 1101 O ASP A 70 114.508 12.951 0.993 1.00 0.00 O ATOM 1102 CB ASP A 70 115.949 14.733 2.576 1.00 0.00 C ATOM 1103 CG ASP A 70 117.107 14.768 1.577 1.00 0.00 C ATOM 1104 OD1 ASP A 70 116.856 14.553 0.402 1.00 0.00 O ATOM 1105 OD2 ASP A 70 118.224 15.008 2.003 1.00 0.00 O ATOM 0 H ASP A 70 113.885 15.391 3.863 1.00 0.00 H new ATOM 0 HA ASP A 70 114.835 16.132 1.367 1.00 0.00 H new ATOM 0 HB2 ASP A 70 116.165 15.384 3.423 1.00 0.00 H new ATOM 0 HB3 ASP A 70 115.826 13.725 2.972 1.00 0.00 H new ATOM 1110 N THR A 71 113.640 14.567 -0.226 1.00 0.00 N ATOM 1111 CA THR A 71 113.237 13.611 -1.290 1.00 0.00 C ATOM 1112 C THR A 71 114.500 13.013 -1.907 1.00 0.00 C ATOM 1113 O THR A 71 114.517 11.880 -2.345 1.00 0.00 O ATOM 1114 CB THR A 71 112.438 14.347 -2.369 1.00 0.00 C ATOM 1115 OG1 THR A 71 112.935 13.988 -3.651 1.00 0.00 O ATOM 1116 CG2 THR A 71 112.576 15.857 -2.171 1.00 0.00 C ATOM 0 H THR A 71 113.403 15.543 -0.406 1.00 0.00 H new ATOM 0 HA THR A 71 112.616 12.821 -0.867 1.00 0.00 H new ATOM 0 HB THR A 71 111.387 14.069 -2.295 1.00 0.00 H new ATOM 0 HG1 THR A 71 112.537 14.571 -4.331 1.00 0.00 H new ATOM 0 HG21 THR A 71 112.006 16.378 -2.940 1.00 0.00 H new ATOM 0 HG22 THR A 71 112.194 16.131 -1.188 1.00 0.00 H new ATOM 0 HG23 THR A 71 113.626 16.139 -2.244 1.00 0.00 H new ATOM 1124 N ALA A 72 115.566 13.769 -1.933 1.00 0.00 N ATOM 1125 CA ALA A 72 116.836 13.248 -2.508 1.00 0.00 C ATOM 1126 C ALA A 72 117.249 12.000 -1.730 1.00 0.00 C ATOM 1127 O ALA A 72 117.701 11.024 -2.294 1.00 0.00 O ATOM 1128 CB ALA A 72 117.928 14.312 -2.388 1.00 0.00 C ATOM 0 H ALA A 72 115.610 14.725 -1.580 1.00 0.00 H new ATOM 0 HA ALA A 72 116.694 13.001 -3.560 1.00 0.00 H new ATOM 0 HB1 ALA A 72 118.857 13.929 -2.810 1.00 0.00 H new ATOM 0 HB2 ALA A 72 117.625 15.207 -2.931 1.00 0.00 H new ATOM 0 HB3 ALA A 72 118.081 14.559 -1.338 1.00 0.00 H new ATOM 1134 N GLU A 73 117.083 12.021 -0.436 1.00 0.00 N ATOM 1135 CA GLU A 73 117.451 10.833 0.380 1.00 0.00 C ATOM 1136 C GLU A 73 116.551 9.665 -0.021 1.00 0.00 C ATOM 1137 O GLU A 73 116.959 8.519 -0.025 1.00 0.00 O ATOM 1138 CB GLU A 73 117.250 11.151 1.863 1.00 0.00 C ATOM 1139 CG GLU A 73 118.471 11.904 2.394 1.00 0.00 C ATOM 1140 CD GLU A 73 119.631 10.926 2.583 1.00 0.00 C ATOM 1141 OE1 GLU A 73 119.370 9.792 2.950 1.00 0.00 O ATOM 1142 OE2 GLU A 73 120.761 11.327 2.359 1.00 0.00 O ATOM 0 H GLU A 73 116.708 12.810 0.090 1.00 0.00 H new ATOM 0 HA GLU A 73 118.495 10.572 0.209 1.00 0.00 H new ATOM 0 HB2 GLU A 73 116.351 11.753 1.998 1.00 0.00 H new ATOM 0 HB3 GLU A 73 117.104 10.230 2.427 1.00 0.00 H new ATOM 0 HG2 GLU A 73 118.756 12.693 1.698 1.00 0.00 H new ATOM 0 HG3 GLU A 73 118.230 12.387 3.341 1.00 0.00 H new ATOM 1149 N VAL A 74 115.324 9.949 -0.366 1.00 0.00 N ATOM 1150 CA VAL A 74 114.395 8.857 -0.775 1.00 0.00 C ATOM 1151 C VAL A 74 114.795 8.348 -2.165 1.00 0.00 C ATOM 1152 O VAL A 74 115.230 7.219 -2.327 1.00 0.00 O ATOM 1153 CB VAL A 74 112.964 9.396 -0.814 1.00 0.00 C ATOM 1154 CG1 VAL A 74 111.972 8.230 -0.835 1.00 0.00 C ATOM 1155 CG2 VAL A 74 112.708 10.256 0.428 1.00 0.00 C ATOM 0 H VAL A 74 114.926 10.888 -0.382 1.00 0.00 H new ATOM 0 HA VAL A 74 114.451 8.037 -0.059 1.00 0.00 H new ATOM 0 HB VAL A 74 112.832 10.000 -1.712 1.00 0.00 H new ATOM 0 HG11 VAL A 74 110.954 8.619 -0.863 1.00 0.00 H new ATOM 0 HG12 VAL A 74 112.150 7.616 -1.718 1.00 0.00 H new ATOM 0 HG13 VAL A 74 112.104 7.623 0.061 1.00 0.00 H new ATOM 0 HG21 VAL A 74 111.688 10.640 0.401 1.00 0.00 H new ATOM 0 HG22 VAL A 74 112.844 9.650 1.324 1.00 0.00 H new ATOM 0 HG23 VAL A 74 113.410 11.090 0.444 1.00 0.00 H new ATOM 1165 N ILE A 75 114.674 9.173 -3.171 1.00 0.00 N ATOM 1166 CA ILE A 75 115.074 8.726 -4.533 1.00 0.00 C ATOM 1167 C ILE A 75 116.492 8.181 -4.446 1.00 0.00 C ATOM 1168 O ILE A 75 116.917 7.388 -5.254 1.00 0.00 O ATOM 1169 CB ILE A 75 115.051 9.902 -5.513 1.00 0.00 C ATOM 1170 CG1 ILE A 75 115.843 11.075 -4.921 1.00 0.00 C ATOM 1171 CG2 ILE A 75 113.606 10.333 -5.774 1.00 0.00 C ATOM 1172 CD1 ILE A 75 117.076 11.351 -5.785 1.00 0.00 C ATOM 0 H ILE A 75 114.319 10.127 -3.108 1.00 0.00 H new ATOM 0 HA ILE A 75 114.380 7.965 -4.889 1.00 0.00 H new ATOM 0 HB ILE A 75 115.506 9.596 -6.455 1.00 0.00 H new ATOM 0 HG12 ILE A 75 115.214 11.964 -4.873 1.00 0.00 H new ATOM 0 HG13 ILE A 75 116.146 10.843 -3.900 1.00 0.00 H new ATOM 0 HG21 ILE A 75 113.596 11.170 -6.472 1.00 0.00 H new ATOM 0 HG22 ILE A 75 113.049 9.499 -6.200 1.00 0.00 H new ATOM 0 HG23 ILE A 75 113.142 10.638 -4.836 1.00 0.00 H new ATOM 0 HD11 ILE A 75 117.637 12.185 -5.363 1.00 0.00 H new ATOM 0 HD12 ILE A 75 117.709 10.464 -5.810 1.00 0.00 H new ATOM 0 HD13 ILE A 75 116.762 11.602 -6.798 1.00 0.00 H new ATOM 1184 N GLU A 76 117.230 8.611 -3.463 1.00 0.00 N ATOM 1185 CA GLU A 76 118.626 8.126 -3.314 1.00 0.00 C ATOM 1186 C GLU A 76 118.611 6.620 -3.062 1.00 0.00 C ATOM 1187 O GLU A 76 119.407 5.888 -3.616 1.00 0.00 O ATOM 1188 CB GLU A 76 119.298 8.837 -2.139 1.00 0.00 C ATOM 1189 CG GLU A 76 120.020 10.089 -2.642 1.00 0.00 C ATOM 1190 CD GLU A 76 121.469 9.741 -2.987 1.00 0.00 C ATOM 1191 OE1 GLU A 76 122.259 9.602 -2.067 1.00 0.00 O ATOM 1192 OE2 GLU A 76 121.764 9.621 -4.164 1.00 0.00 O ATOM 0 H GLU A 76 116.925 9.279 -2.755 1.00 0.00 H new ATOM 0 HA GLU A 76 119.184 8.339 -4.226 1.00 0.00 H new ATOM 0 HB2 GLU A 76 118.553 9.110 -1.392 1.00 0.00 H new ATOM 0 HB3 GLU A 76 120.007 8.167 -1.652 1.00 0.00 H new ATOM 0 HG2 GLU A 76 119.512 10.486 -3.521 1.00 0.00 H new ATOM 0 HG3 GLU A 76 119.994 10.867 -1.879 1.00 0.00 H new ATOM 1199 N PHE A 77 117.718 6.137 -2.234 1.00 0.00 N ATOM 1200 CA PHE A 77 117.695 4.673 -1.986 1.00 0.00 C ATOM 1201 C PHE A 77 117.225 3.960 -3.252 1.00 0.00 C ATOM 1202 O PHE A 77 117.947 3.164 -3.816 1.00 0.00 O ATOM 1203 CB PHE A 77 116.753 4.349 -0.820 1.00 0.00 C ATOM 1204 CG PHE A 77 115.435 3.821 -1.343 1.00 0.00 C ATOM 1205 CD1 PHE A 77 115.339 2.500 -1.803 1.00 0.00 C ATOM 1206 CD2 PHE A 77 114.310 4.651 -1.371 1.00 0.00 C ATOM 1207 CE1 PHE A 77 114.120 2.013 -2.287 1.00 0.00 C ATOM 1208 CE2 PHE A 77 113.091 4.165 -1.856 1.00 0.00 C ATOM 1209 CZ PHE A 77 112.995 2.846 -2.314 1.00 0.00 C ATOM 0 H PHE A 77 117.020 6.684 -1.731 1.00 0.00 H new ATOM 0 HA PHE A 77 118.697 4.333 -1.725 1.00 0.00 H new ATOM 0 HB2 PHE A 77 117.215 3.610 -0.165 1.00 0.00 H new ATOM 0 HB3 PHE A 77 116.583 5.244 -0.221 1.00 0.00 H new ATOM 0 HD1 PHE A 77 116.207 1.858 -1.784 1.00 0.00 H new ATOM 0 HD2 PHE A 77 114.382 5.669 -1.018 1.00 0.00 H new ATOM 0 HE1 PHE A 77 114.047 0.995 -2.640 1.00 0.00 H new ATOM 0 HE2 PHE A 77 112.224 4.808 -1.877 1.00 0.00 H new ATOM 0 HZ PHE A 77 112.054 2.471 -2.688 1.00 0.00 H new ATOM 1219 N PHE A 78 116.032 4.233 -3.721 1.00 0.00 N ATOM 1220 CA PHE A 78 115.576 3.538 -4.954 1.00 0.00 C ATOM 1221 C PHE A 78 116.541 3.835 -6.102 1.00 0.00 C ATOM 1222 O PHE A 78 116.930 2.953 -6.832 1.00 0.00 O ATOM 1223 CB PHE A 78 114.173 4.004 -5.337 1.00 0.00 C ATOM 1224 CG PHE A 78 113.625 3.125 -6.447 1.00 0.00 C ATOM 1225 CD1 PHE A 78 113.938 1.754 -6.500 1.00 0.00 C ATOM 1226 CD2 PHE A 78 112.798 3.684 -7.428 1.00 0.00 C ATOM 1227 CE1 PHE A 78 113.425 0.956 -7.530 1.00 0.00 C ATOM 1228 CE2 PHE A 78 112.285 2.883 -8.456 1.00 0.00 C ATOM 1229 CZ PHE A 78 112.598 1.520 -8.508 1.00 0.00 C ATOM 0 H PHE A 78 115.371 4.892 -3.311 1.00 0.00 H new ATOM 0 HA PHE A 78 115.555 2.465 -4.763 1.00 0.00 H new ATOM 0 HB2 PHE A 78 113.516 3.961 -4.469 1.00 0.00 H new ATOM 0 HB3 PHE A 78 114.202 5.043 -5.664 1.00 0.00 H new ATOM 0 HD1 PHE A 78 114.575 1.317 -5.745 1.00 0.00 H new ATOM 0 HD2 PHE A 78 112.555 4.736 -7.392 1.00 0.00 H new ATOM 0 HE1 PHE A 78 113.668 -0.096 -7.570 1.00 0.00 H new ATOM 0 HE2 PHE A 78 111.646 3.318 -9.210 1.00 0.00 H new ATOM 0 HZ PHE A 78 112.202 0.904 -9.302 1.00 0.00 H new ATOM 1239 N ASN A 79 116.935 5.065 -6.271 1.00 0.00 N ATOM 1240 CA ASN A 79 117.875 5.393 -7.383 1.00 0.00 C ATOM 1241 C ASN A 79 119.068 4.448 -7.325 1.00 0.00 C ATOM 1242 O ASN A 79 119.407 3.799 -8.294 1.00 0.00 O ATOM 1243 CB ASN A 79 118.375 6.832 -7.239 1.00 0.00 C ATOM 1244 CG ASN A 79 119.430 7.114 -8.310 1.00 0.00 C ATOM 1245 OD1 ASN A 79 120.079 8.141 -8.285 1.00 0.00 O ATOM 1246 ND2 ASN A 79 119.631 6.239 -9.257 1.00 0.00 N ATOM 0 H ASN A 79 116.650 5.855 -5.692 1.00 0.00 H new ATOM 0 HA ASN A 79 117.354 5.284 -8.334 1.00 0.00 H new ATOM 0 HB2 ASN A 79 117.543 7.529 -7.340 1.00 0.00 H new ATOM 0 HB3 ASN A 79 118.799 6.983 -6.246 1.00 0.00 H new ATOM 0 HD21 ASN A 79 120.333 6.417 -9.976 1.00 0.00 H new ATOM 0 HD22 ASN A 79 119.087 5.377 -9.279 1.00 0.00 H new ATOM 1253 N LYS A 80 119.710 4.361 -6.198 1.00 0.00 N ATOM 1254 CA LYS A 80 120.877 3.452 -6.091 1.00 0.00 C ATOM 1255 C LYS A 80 120.413 2.014 -6.321 1.00 0.00 C ATOM 1256 O LYS A 80 121.118 1.211 -6.894 1.00 0.00 O ATOM 1257 CB LYS A 80 121.503 3.582 -4.702 1.00 0.00 C ATOM 1258 CG LYS A 80 122.469 4.771 -4.689 1.00 0.00 C ATOM 1259 CD LYS A 80 123.826 4.345 -5.259 1.00 0.00 C ATOM 1260 CE LYS A 80 124.422 3.239 -4.387 1.00 0.00 C ATOM 1261 NZ LYS A 80 125.893 3.444 -4.261 1.00 0.00 N ATOM 0 H LYS A 80 119.478 4.878 -5.350 1.00 0.00 H new ATOM 0 HA LYS A 80 121.622 3.718 -6.841 1.00 0.00 H new ATOM 0 HB2 LYS A 80 120.725 3.723 -3.952 1.00 0.00 H new ATOM 0 HB3 LYS A 80 122.033 2.666 -4.443 1.00 0.00 H new ATOM 0 HG2 LYS A 80 122.058 5.591 -5.278 1.00 0.00 H new ATOM 0 HG3 LYS A 80 122.592 5.140 -3.671 1.00 0.00 H new ATOM 0 HD2 LYS A 80 123.707 3.991 -6.283 1.00 0.00 H new ATOM 0 HD3 LYS A 80 124.502 5.199 -5.294 1.00 0.00 H new ATOM 0 HE2 LYS A 80 123.957 3.248 -3.401 1.00 0.00 H new ATOM 0 HE3 LYS A 80 124.216 2.263 -4.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 126.299 2.692 -3.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 126.330 3.415 -5.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 126.078 4.369 -3.822 1.00 0.00 H new ATOM 1275 N LEU A 81 119.230 1.678 -5.879 1.00 0.00 N ATOM 1276 CA LEU A 81 118.739 0.285 -6.081 1.00 0.00 C ATOM 1277 C LEU A 81 118.478 0.028 -7.571 1.00 0.00 C ATOM 1278 O LEU A 81 118.997 -0.902 -8.146 1.00 0.00 O ATOM 1279 CB LEU A 81 117.428 0.079 -5.307 1.00 0.00 C ATOM 1280 CG LEU A 81 117.632 0.270 -3.797 1.00 0.00 C ATOM 1281 CD1 LEU A 81 116.698 -0.681 -3.046 1.00 0.00 C ATOM 1282 CD2 LEU A 81 119.087 -0.020 -3.399 1.00 0.00 C ATOM 0 H LEU A 81 118.588 2.302 -5.391 1.00 0.00 H new ATOM 0 HA LEU A 81 119.498 -0.407 -5.718 1.00 0.00 H new ATOM 0 HB2 LEU A 81 116.677 0.783 -5.666 1.00 0.00 H new ATOM 0 HB3 LEU A 81 117.044 -0.923 -5.500 1.00 0.00 H new ATOM 0 HG LEU A 81 117.406 1.305 -3.539 1.00 0.00 H new ATOM 0 HD11 LEU A 81 116.835 -0.553 -1.972 1.00 0.00 H new ATOM 0 HD12 LEU A 81 115.664 -0.458 -3.309 1.00 0.00 H new ATOM 0 HD13 LEU A 81 116.929 -1.710 -3.321 1.00 0.00 H new ATOM 0 HD21 LEU A 81 119.206 0.122 -2.325 1.00 0.00 H new ATOM 0 HD22 LEU A 81 119.337 -1.049 -3.659 1.00 0.00 H new ATOM 0 HD23 LEU A 81 119.752 0.660 -3.931 1.00 0.00 H new ATOM 1294 N VAL A 82 117.667 0.826 -8.203 1.00 0.00 N ATOM 1295 CA VAL A 82 117.372 0.587 -9.641 1.00 0.00 C ATOM 1296 C VAL A 82 118.635 0.765 -10.500 1.00 0.00 C ATOM 1297 O VAL A 82 118.889 -0.013 -11.391 1.00 0.00 O ATOM 1298 CB VAL A 82 116.267 1.548 -10.095 1.00 0.00 C ATOM 1299 CG1 VAL A 82 116.628 2.988 -9.712 1.00 0.00 C ATOM 1300 CG2 VAL A 82 116.081 1.438 -11.613 1.00 0.00 C ATOM 0 H VAL A 82 117.197 1.631 -7.788 1.00 0.00 H new ATOM 0 HA VAL A 82 117.032 -0.441 -9.769 1.00 0.00 H new ATOM 0 HB VAL A 82 115.334 1.279 -9.599 1.00 0.00 H new ATOM 0 HG11 VAL A 82 115.836 3.661 -10.040 1.00 0.00 H new ATOM 0 HG12 VAL A 82 116.741 3.059 -8.630 1.00 0.00 H new ATOM 0 HG13 VAL A 82 117.565 3.269 -10.194 1.00 0.00 H new ATOM 0 HG21 VAL A 82 115.295 2.122 -11.934 1.00 0.00 H new ATOM 0 HG22 VAL A 82 117.014 1.697 -12.114 1.00 0.00 H new ATOM 0 HG23 VAL A 82 115.801 0.417 -11.872 1.00 0.00 H new ATOM 1310 N THR A 83 119.421 1.778 -10.270 1.00 0.00 N ATOM 1311 CA THR A 83 120.641 1.963 -11.113 1.00 0.00 C ATOM 1312 C THR A 83 121.784 1.040 -10.653 1.00 0.00 C ATOM 1313 O THR A 83 122.467 0.444 -11.462 1.00 0.00 O ATOM 1314 CB THR A 83 121.093 3.423 -11.038 1.00 0.00 C ATOM 1315 OG1 THR A 83 121.787 3.764 -12.229 1.00 0.00 O ATOM 1316 CG2 THR A 83 122.015 3.611 -9.838 1.00 0.00 C ATOM 0 H THR A 83 119.277 2.480 -9.544 1.00 0.00 H new ATOM 0 HA THR A 83 120.391 1.703 -12.142 1.00 0.00 H new ATOM 0 HB THR A 83 120.221 4.068 -10.928 1.00 0.00 H new ATOM 0 HG1 THR A 83 122.076 4.699 -12.183 1.00 0.00 H new ATOM 0 HG21 THR A 83 122.336 4.651 -9.786 1.00 0.00 H new ATOM 0 HG22 THR A 83 121.481 3.350 -8.924 1.00 0.00 H new ATOM 0 HG23 THR A 83 122.888 2.967 -9.945 1.00 0.00 H new ATOM 1324 N SER A 84 122.021 0.938 -9.372 1.00 0.00 N ATOM 1325 CA SER A 84 123.147 0.078 -8.884 1.00 0.00 C ATOM 1326 C SER A 84 122.779 -1.409 -8.935 1.00 0.00 C ATOM 1327 O SER A 84 123.605 -2.249 -9.234 1.00 0.00 O ATOM 1328 CB SER A 84 123.481 0.448 -7.438 1.00 0.00 C ATOM 1329 OG SER A 84 123.261 1.839 -7.244 1.00 0.00 O ATOM 0 H SER A 84 121.487 1.410 -8.642 1.00 0.00 H new ATOM 0 HA SER A 84 124.005 0.249 -9.535 1.00 0.00 H new ATOM 0 HB2 SER A 84 122.862 -0.129 -6.751 1.00 0.00 H new ATOM 0 HB3 SER A 84 124.519 0.198 -7.218 1.00 0.00 H new ATOM 0 HG SER A 84 123.942 2.349 -7.730 1.00 0.00 H new ATOM 1335 N PHE A 85 121.567 -1.748 -8.607 1.00 0.00 N ATOM 1336 CA PHE A 85 121.170 -3.186 -8.595 1.00 0.00 C ATOM 1337 C PHE A 85 121.527 -3.887 -9.911 1.00 0.00 C ATOM 1338 O PHE A 85 121.174 -5.026 -10.117 1.00 0.00 O ATOM 1339 CB PHE A 85 119.669 -3.316 -8.326 1.00 0.00 C ATOM 1340 CG PHE A 85 118.872 -3.105 -9.595 1.00 0.00 C ATOM 1341 CD1 PHE A 85 119.415 -2.416 -10.691 1.00 0.00 C ATOM 1342 CD2 PHE A 85 117.586 -3.639 -9.681 1.00 0.00 C ATOM 1343 CE1 PHE A 85 118.666 -2.269 -11.865 1.00 0.00 C ATOM 1344 CE2 PHE A 85 116.838 -3.485 -10.852 1.00 0.00 C ATOM 1345 CZ PHE A 85 117.378 -2.803 -11.945 1.00 0.00 C ATOM 0 H PHE A 85 120.830 -1.093 -8.346 1.00 0.00 H new ATOM 0 HA PHE A 85 121.728 -3.674 -7.796 1.00 0.00 H new ATOM 0 HB2 PHE A 85 119.453 -4.303 -7.916 1.00 0.00 H new ATOM 0 HB3 PHE A 85 119.365 -2.586 -7.576 1.00 0.00 H new ATOM 0 HD1 PHE A 85 120.410 -2.000 -10.629 1.00 0.00 H new ATOM 0 HD2 PHE A 85 117.167 -4.173 -8.841 1.00 0.00 H new ATOM 0 HE1 PHE A 85 119.085 -1.742 -12.710 1.00 0.00 H new ATOM 0 HE2 PHE A 85 115.840 -3.894 -10.912 1.00 0.00 H new ATOM 0 HZ PHE A 85 116.800 -2.689 -12.850 1.00 0.00 H new ATOM 1355 N ASP A 86 122.211 -3.241 -10.813 1.00 0.00 N ATOM 1356 CA ASP A 86 122.548 -3.945 -12.081 1.00 0.00 C ATOM 1357 C ASP A 86 123.876 -4.685 -11.909 1.00 0.00 C ATOM 1358 O ASP A 86 124.442 -5.201 -12.852 1.00 0.00 O ATOM 1359 CB ASP A 86 122.641 -2.961 -13.239 1.00 0.00 C ATOM 1360 CG ASP A 86 123.411 -1.714 -12.801 1.00 0.00 C ATOM 1361 OD1 ASP A 86 124.038 -1.766 -11.756 1.00 0.00 O ATOM 1362 OD2 ASP A 86 123.361 -0.728 -13.518 1.00 0.00 O ATOM 0 H ASP A 86 122.544 -2.280 -10.732 1.00 0.00 H new ATOM 0 HA ASP A 86 121.758 -4.660 -12.310 1.00 0.00 H new ATOM 0 HB2 ASP A 86 123.142 -3.429 -14.086 1.00 0.00 H new ATOM 0 HB3 ASP A 86 121.641 -2.683 -13.573 1.00 0.00 H new ATOM 1367 N PHE A 87 124.358 -4.760 -10.700 1.00 0.00 N ATOM 1368 CA PHE A 87 125.628 -5.491 -10.433 1.00 0.00 C ATOM 1369 C PHE A 87 125.418 -6.339 -9.177 1.00 0.00 C ATOM 1370 O PHE A 87 125.210 -7.534 -9.248 1.00 0.00 O ATOM 1371 CB PHE A 87 126.784 -4.494 -10.222 1.00 0.00 C ATOM 1372 CG PHE A 87 127.589 -4.870 -8.992 1.00 0.00 C ATOM 1373 CD1 PHE A 87 127.939 -6.208 -8.758 1.00 0.00 C ATOM 1374 CD2 PHE A 87 127.968 -3.883 -8.071 1.00 0.00 C ATOM 1375 CE1 PHE A 87 128.656 -6.550 -7.613 1.00 0.00 C ATOM 1376 CE2 PHE A 87 128.694 -4.232 -6.928 1.00 0.00 C ATOM 1377 CZ PHE A 87 129.036 -5.568 -6.700 1.00 0.00 C ATOM 0 H PHE A 87 123.922 -4.342 -9.878 1.00 0.00 H new ATOM 0 HA PHE A 87 125.889 -6.126 -11.280 1.00 0.00 H new ATOM 0 HB2 PHE A 87 127.431 -4.486 -11.099 1.00 0.00 H new ATOM 0 HB3 PHE A 87 126.387 -3.485 -10.110 1.00 0.00 H new ATOM 0 HD1 PHE A 87 127.653 -6.973 -9.465 1.00 0.00 H new ATOM 0 HD2 PHE A 87 127.699 -2.852 -8.245 1.00 0.00 H new ATOM 0 HE1 PHE A 87 128.919 -7.582 -7.432 1.00 0.00 H new ATOM 0 HE2 PHE A 87 128.990 -3.470 -6.222 1.00 0.00 H new ATOM 0 HZ PHE A 87 129.595 -5.839 -5.816 1.00 0.00 H new ATOM 1387 N ASP A 88 125.464 -5.725 -8.028 1.00 0.00 N ATOM 1388 CA ASP A 88 125.257 -6.486 -6.768 1.00 0.00 C ATOM 1389 C ASP A 88 123.776 -6.446 -6.407 1.00 0.00 C ATOM 1390 O ASP A 88 123.328 -5.590 -5.670 1.00 0.00 O ATOM 1391 CB ASP A 88 126.065 -5.847 -5.644 1.00 0.00 C ATOM 1392 CG ASP A 88 126.140 -4.336 -5.868 1.00 0.00 C ATOM 1393 OD1 ASP A 88 125.384 -3.840 -6.687 1.00 0.00 O ATOM 1394 OD2 ASP A 88 126.948 -3.700 -5.215 1.00 0.00 O ATOM 0 H ASP A 88 125.636 -4.727 -7.908 1.00 0.00 H new ATOM 0 HA ASP A 88 125.582 -7.517 -6.904 1.00 0.00 H new ATOM 0 HB2 ASP A 88 125.601 -6.060 -4.681 1.00 0.00 H new ATOM 0 HB3 ASP A 88 127.068 -6.272 -5.616 1.00 0.00 H new ATOM 1399 N LEU A 89 123.011 -7.357 -6.926 1.00 0.00 N ATOM 1400 CA LEU A 89 121.560 -7.368 -6.625 1.00 0.00 C ATOM 1401 C LEU A 89 121.358 -7.544 -5.119 1.00 0.00 C ATOM 1402 O LEU A 89 120.673 -6.773 -4.480 1.00 0.00 O ATOM 1403 CB LEU A 89 120.894 -8.524 -7.379 1.00 0.00 C ATOM 1404 CG LEU A 89 121.348 -8.550 -8.854 1.00 0.00 C ATOM 1405 CD1 LEU A 89 121.986 -7.221 -9.265 1.00 0.00 C ATOM 1406 CD2 LEU A 89 122.371 -9.662 -9.077 1.00 0.00 C ATOM 0 H LEU A 89 123.330 -8.099 -7.549 1.00 0.00 H new ATOM 0 HA LEU A 89 121.110 -6.427 -6.941 1.00 0.00 H new ATOM 0 HB2 LEU A 89 121.146 -9.470 -6.900 1.00 0.00 H new ATOM 0 HB3 LEU A 89 119.810 -8.420 -7.329 1.00 0.00 H new ATOM 0 HG LEU A 89 120.460 -8.726 -9.460 1.00 0.00 H new ATOM 0 HD11 LEU A 89 122.295 -7.273 -10.309 1.00 0.00 H new ATOM 0 HD12 LEU A 89 121.262 -6.416 -9.140 1.00 0.00 H new ATOM 0 HD13 LEU A 89 122.857 -7.026 -8.639 1.00 0.00 H new ATOM 0 HD21 LEU A 89 122.681 -9.667 -10.122 1.00 0.00 H new ATOM 0 HD22 LEU A 89 123.240 -9.490 -8.442 1.00 0.00 H new ATOM 0 HD23 LEU A 89 121.923 -10.624 -8.827 1.00 0.00 H new ATOM 1418 N GLU A 90 121.942 -8.558 -4.551 1.00 0.00 N ATOM 1419 CA GLU A 90 121.775 -8.791 -3.087 1.00 0.00 C ATOM 1420 C GLU A 90 122.689 -7.861 -2.276 1.00 0.00 C ATOM 1421 O GLU A 90 122.267 -7.239 -1.319 1.00 0.00 O ATOM 1422 CB GLU A 90 122.132 -10.247 -2.769 1.00 0.00 C ATOM 1423 CG GLU A 90 122.292 -11.028 -4.070 1.00 0.00 C ATOM 1424 CD GLU A 90 123.663 -10.732 -4.681 1.00 0.00 C ATOM 1425 OE1 GLU A 90 124.654 -11.001 -4.022 1.00 0.00 O ATOM 1426 OE2 GLU A 90 123.699 -10.241 -5.797 1.00 0.00 O ATOM 0 H GLU A 90 122.529 -9.238 -5.035 1.00 0.00 H new ATOM 0 HA GLU A 90 120.740 -8.584 -2.816 1.00 0.00 H new ATOM 0 HB2 GLU A 90 123.056 -10.288 -2.192 1.00 0.00 H new ATOM 0 HB3 GLU A 90 121.352 -10.698 -2.155 1.00 0.00 H new ATOM 0 HG2 GLU A 90 122.191 -12.096 -3.879 1.00 0.00 H new ATOM 0 HG3 GLU A 90 121.503 -10.753 -4.770 1.00 0.00 H new ATOM 1433 N ILE A 91 123.942 -7.790 -2.629 1.00 0.00 N ATOM 1434 CA ILE A 91 124.894 -6.937 -1.855 1.00 0.00 C ATOM 1435 C ILE A 91 124.671 -5.447 -2.143 1.00 0.00 C ATOM 1436 O ILE A 91 124.924 -4.603 -1.306 1.00 0.00 O ATOM 1437 CB ILE A 91 126.326 -7.313 -2.248 1.00 0.00 C ATOM 1438 CG1 ILE A 91 126.341 -8.739 -2.802 1.00 0.00 C ATOM 1439 CG2 ILE A 91 127.240 -7.231 -1.025 1.00 0.00 C ATOM 1440 CD1 ILE A 91 127.767 -9.286 -2.777 1.00 0.00 C ATOM 0 H ILE A 91 124.351 -8.286 -3.421 1.00 0.00 H new ATOM 0 HA ILE A 91 124.726 -7.108 -0.792 1.00 0.00 H new ATOM 0 HB ILE A 91 126.685 -6.620 -3.009 1.00 0.00 H new ATOM 0 HG12 ILE A 91 125.686 -9.377 -2.209 1.00 0.00 H new ATOM 0 HG13 ILE A 91 125.956 -8.747 -3.822 1.00 0.00 H new ATOM 0 HG21 ILE A 91 128.257 -7.500 -1.312 1.00 0.00 H new ATOM 0 HG22 ILE A 91 127.231 -6.215 -0.631 1.00 0.00 H new ATOM 0 HG23 ILE A 91 126.885 -7.920 -0.259 1.00 0.00 H new ATOM 0 HD11 ILE A 91 127.774 -10.302 -3.172 1.00 0.00 H new ATOM 0 HD12 ILE A 91 128.410 -8.654 -3.389 1.00 0.00 H new ATOM 0 HD13 ILE A 91 128.136 -9.293 -1.751 1.00 0.00 H new ATOM 1452 N GLY A 92 124.232 -5.113 -3.322 1.00 0.00 N ATOM 1453 CA GLY A 92 124.034 -3.671 -3.662 1.00 0.00 C ATOM 1454 C GLY A 92 123.043 -3.014 -2.697 1.00 0.00 C ATOM 1455 O GLY A 92 123.325 -1.992 -2.104 1.00 0.00 O ATOM 0 H GLY A 92 124.001 -5.771 -4.066 1.00 0.00 H new ATOM 0 HA2 GLY A 92 124.990 -3.149 -3.620 1.00 0.00 H new ATOM 0 HA3 GLY A 92 123.666 -3.581 -4.684 1.00 0.00 H new ATOM 1459 N LYS A 93 121.879 -3.578 -2.549 1.00 0.00 N ATOM 1460 CA LYS A 93 120.863 -2.971 -1.639 1.00 0.00 C ATOM 1461 C LYS A 93 121.208 -3.255 -0.171 1.00 0.00 C ATOM 1462 O LYS A 93 120.691 -2.616 0.726 1.00 0.00 O ATOM 1463 CB LYS A 93 119.469 -3.541 -1.946 1.00 0.00 C ATOM 1464 CG LYS A 93 119.574 -4.825 -2.783 1.00 0.00 C ATOM 1465 CD LYS A 93 119.308 -4.508 -4.260 1.00 0.00 C ATOM 1466 CE LYS A 93 120.589 -3.989 -4.916 1.00 0.00 C ATOM 1467 NZ LYS A 93 120.873 -2.609 -4.431 1.00 0.00 N ATOM 0 H LYS A 93 121.584 -4.434 -3.018 1.00 0.00 H new ATOM 0 HA LYS A 93 120.865 -1.894 -1.804 1.00 0.00 H new ATOM 0 HB2 LYS A 93 118.944 -3.752 -1.014 1.00 0.00 H new ATOM 0 HB3 LYS A 93 118.879 -2.799 -2.483 1.00 0.00 H new ATOM 0 HG2 LYS A 93 120.565 -5.264 -2.669 1.00 0.00 H new ATOM 0 HG3 LYS A 93 118.856 -5.563 -2.425 1.00 0.00 H new ATOM 0 HD2 LYS A 93 118.960 -5.402 -4.777 1.00 0.00 H new ATOM 0 HD3 LYS A 93 118.517 -3.763 -4.345 1.00 0.00 H new ATOM 0 HE2 LYS A 93 121.424 -4.648 -4.679 1.00 0.00 H new ATOM 0 HE3 LYS A 93 120.481 -3.989 -6.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 121.868 -2.372 -4.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 120.255 -1.933 -4.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 120.694 -2.557 -3.408 1.00 0.00 H new ATOM 1481 N GLY A 94 122.054 -4.214 0.086 1.00 0.00 N ATOM 1482 CA GLY A 94 122.398 -4.547 1.501 1.00 0.00 C ATOM 1483 C GLY A 94 123.184 -3.409 2.176 1.00 0.00 C ATOM 1484 O GLY A 94 122.835 -2.968 3.252 1.00 0.00 O ATOM 0 H GLY A 94 122.522 -4.782 -0.620 1.00 0.00 H new ATOM 0 HA2 GLY A 94 121.484 -4.741 2.062 1.00 0.00 H new ATOM 0 HA3 GLY A 94 122.989 -5.463 1.527 1.00 0.00 H new ATOM 1488 N GLU A 95 124.250 -2.942 1.577 1.00 0.00 N ATOM 1489 CA GLU A 95 125.048 -1.850 2.225 1.00 0.00 C ATOM 1490 C GLU A 95 124.438 -0.484 1.900 1.00 0.00 C ATOM 1491 O GLU A 95 124.375 0.402 2.738 1.00 0.00 O ATOM 1492 CB GLU A 95 126.492 -1.892 1.707 1.00 0.00 C ATOM 1493 CG GLU A 95 127.121 -0.493 1.796 1.00 0.00 C ATOM 1494 CD GLU A 95 126.721 0.324 0.566 1.00 0.00 C ATOM 1495 OE1 GLU A 95 126.577 -0.267 -0.492 1.00 0.00 O ATOM 1496 OE2 GLU A 95 126.566 1.526 0.702 1.00 0.00 O ATOM 0 H GLU A 95 124.602 -3.264 0.676 1.00 0.00 H new ATOM 0 HA GLU A 95 125.037 -2.000 3.305 1.00 0.00 H new ATOM 0 HB2 GLU A 95 127.077 -2.601 2.293 1.00 0.00 H new ATOM 0 HB3 GLU A 95 126.507 -2.242 0.675 1.00 0.00 H new ATOM 0 HG2 GLU A 95 126.788 0.010 2.704 1.00 0.00 H new ATOM 0 HG3 GLU A 95 128.206 -0.573 1.855 1.00 0.00 H new ATOM 1503 N THR A 96 124.007 -0.295 0.689 1.00 0.00 N ATOM 1504 CA THR A 96 123.426 1.018 0.313 1.00 0.00 C ATOM 1505 C THR A 96 122.372 1.436 1.341 1.00 0.00 C ATOM 1506 O THR A 96 122.371 2.554 1.820 1.00 0.00 O ATOM 1507 CB THR A 96 122.804 0.919 -1.076 1.00 0.00 C ATOM 1508 OG1 THR A 96 122.105 -0.309 -1.192 1.00 0.00 O ATOM 1509 CG2 THR A 96 123.917 0.982 -2.123 1.00 0.00 C ATOM 0 H THR A 96 124.032 -0.991 -0.056 1.00 0.00 H new ATOM 0 HA THR A 96 124.212 1.773 0.297 1.00 0.00 H new ATOM 0 HB THR A 96 122.108 1.743 -1.232 1.00 0.00 H new ATOM 0 HG1 THR A 96 122.698 -0.988 -1.578 1.00 0.00 H new ATOM 0 HG21 THR A 96 123.483 0.912 -3.120 1.00 0.00 H new ATOM 0 HG22 THR A 96 124.454 1.925 -2.027 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.608 0.153 -1.969 1.00 0.00 H new ATOM 1517 N MET A 97 121.483 0.549 1.697 1.00 0.00 N ATOM 1518 CA MET A 97 120.444 0.910 2.705 1.00 0.00 C ATOM 1519 C MET A 97 121.128 1.464 3.953 1.00 0.00 C ATOM 1520 O MET A 97 120.536 2.179 4.744 1.00 0.00 O ATOM 1521 CB MET A 97 119.653 -0.341 3.090 1.00 0.00 C ATOM 1522 CG MET A 97 120.615 -1.509 3.313 1.00 0.00 C ATOM 1523 SD MET A 97 119.683 -3.061 3.344 1.00 0.00 S ATOM 1524 CE MET A 97 119.618 -3.252 5.142 1.00 0.00 C ATOM 0 H MET A 97 121.430 -0.404 1.337 1.00 0.00 H new ATOM 0 HA MET A 97 119.772 1.657 2.283 1.00 0.00 H new ATOM 0 HB2 MET A 97 119.076 -0.154 3.996 1.00 0.00 H new ATOM 0 HB3 MET A 97 118.940 -0.589 2.304 1.00 0.00 H new ATOM 0 HG2 MET A 97 121.361 -1.536 2.519 1.00 0.00 H new ATOM 0 HG3 MET A 97 121.153 -1.377 4.252 1.00 0.00 H new ATOM 0 HE1 MET A 97 118.682 -3.735 5.423 1.00 0.00 H new ATOM 0 HE2 MET A 97 120.457 -3.865 5.473 1.00 0.00 H new ATOM 0 HE3 MET A 97 119.676 -2.271 5.614 1.00 0.00 H new ATOM 1534 N LYS A 98 122.371 1.127 4.138 1.00 0.00 N ATOM 1535 CA LYS A 98 123.107 1.604 5.337 1.00 0.00 C ATOM 1536 C LYS A 98 123.482 3.078 5.190 1.00 0.00 C ATOM 1537 O LYS A 98 123.361 3.843 6.122 1.00 0.00 O ATOM 1538 CB LYS A 98 124.385 0.778 5.501 1.00 0.00 C ATOM 1539 CG LYS A 98 124.590 0.434 6.978 1.00 0.00 C ATOM 1540 CD LYS A 98 125.844 -0.429 7.131 1.00 0.00 C ATOM 1541 CE LYS A 98 125.461 -1.907 7.039 1.00 0.00 C ATOM 1542 NZ LYS A 98 126.695 -2.743 7.068 1.00 0.00 N ATOM 0 H LYS A 98 122.912 0.537 3.505 1.00 0.00 H new ATOM 0 HA LYS A 98 122.465 1.490 6.211 1.00 0.00 H new ATOM 0 HB2 LYS A 98 124.317 -0.136 4.911 1.00 0.00 H new ATOM 0 HB3 LYS A 98 125.242 1.337 5.125 1.00 0.00 H new ATOM 0 HG2 LYS A 98 124.690 1.347 7.565 1.00 0.00 H new ATOM 0 HG3 LYS A 98 123.720 -0.098 7.363 1.00 0.00 H new ATOM 0 HD2 LYS A 98 126.566 -0.181 6.353 1.00 0.00 H new ATOM 0 HD3 LYS A 98 126.324 -0.226 8.088 1.00 0.00 H new ATOM 0 HE2 LYS A 98 124.807 -2.176 7.868 1.00 0.00 H new ATOM 0 HE3 LYS A 98 124.904 -2.093 6.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 126.528 -3.588 7.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 126.941 -3.032 6.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 127.478 -2.192 7.474 1.00 0.00 H new ATOM 1556 N TYR A 99 123.961 3.490 4.048 1.00 0.00 N ATOM 1557 CA TYR A 99 124.357 4.922 3.916 1.00 0.00 C ATOM 1558 C TYR A 99 123.130 5.833 4.002 1.00 0.00 C ATOM 1559 O TYR A 99 123.221 6.937 4.505 1.00 0.00 O ATOM 1560 CB TYR A 99 125.130 5.155 2.610 1.00 0.00 C ATOM 1561 CG TYR A 99 124.188 5.335 1.448 1.00 0.00 C ATOM 1562 CD1 TYR A 99 123.433 6.505 1.321 1.00 0.00 C ATOM 1563 CD2 TYR A 99 124.088 4.329 0.487 1.00 0.00 C ATOM 1564 CE1 TYR A 99 122.575 6.665 0.227 1.00 0.00 C ATOM 1565 CE2 TYR A 99 123.229 4.484 -0.606 1.00 0.00 C ATOM 1566 CZ TYR A 99 122.471 5.654 -0.736 1.00 0.00 C ATOM 1567 OH TYR A 99 121.623 5.812 -1.813 1.00 0.00 O ATOM 0 H TYR A 99 124.094 2.913 3.218 1.00 0.00 H new ATOM 0 HA TYR A 99 125.019 5.172 4.745 1.00 0.00 H new ATOM 0 HB2 TYR A 99 125.762 6.037 2.710 1.00 0.00 H new ATOM 0 HB3 TYR A 99 125.791 4.310 2.419 1.00 0.00 H new ATOM 0 HD1 TYR A 99 123.512 7.283 2.065 1.00 0.00 H new ATOM 0 HD2 TYR A 99 124.675 3.428 0.587 1.00 0.00 H new ATOM 0 HE1 TYR A 99 121.993 7.569 0.126 1.00 0.00 H new ATOM 0 HE2 TYR A 99 123.151 3.703 -1.348 1.00 0.00 H new ATOM 0 HH TYR A 99 121.173 4.962 -2.002 1.00 0.00 H new ATOM 1577 N ILE A 100 121.977 5.400 3.552 1.00 0.00 N ATOM 1578 CA ILE A 100 120.785 6.293 3.665 1.00 0.00 C ATOM 1579 C ILE A 100 120.449 6.471 5.146 1.00 0.00 C ATOM 1580 O ILE A 100 120.358 7.575 5.644 1.00 0.00 O ATOM 1581 CB ILE A 100 119.577 5.686 2.951 1.00 0.00 C ATOM 1582 CG1 ILE A 100 119.849 5.600 1.449 1.00 0.00 C ATOM 1583 CG2 ILE A 100 118.357 6.580 3.189 1.00 0.00 C ATOM 1584 CD1 ILE A 100 120.758 4.406 1.165 1.00 0.00 C ATOM 0 H ILE A 100 121.812 4.490 3.122 1.00 0.00 H new ATOM 0 HA ILE A 100 121.016 7.251 3.200 1.00 0.00 H new ATOM 0 HB ILE A 100 119.392 4.685 3.341 1.00 0.00 H new ATOM 0 HG12 ILE A 100 118.911 5.495 0.904 1.00 0.00 H new ATOM 0 HG13 ILE A 100 120.319 6.520 1.100 1.00 0.00 H new ATOM 0 HG21 ILE A 100 117.490 6.155 2.683 1.00 0.00 H new ATOM 0 HG22 ILE A 100 118.157 6.646 4.259 1.00 0.00 H new ATOM 0 HG23 ILE A 100 118.554 7.577 2.795 1.00 0.00 H new ATOM 0 HD11 ILE A 100 120.953 4.344 0.094 1.00 0.00 H new ATOM 0 HD12 ILE A 100 121.700 4.531 1.699 1.00 0.00 H new ATOM 0 HD13 ILE A 100 120.271 3.490 1.499 1.00 0.00 H new ATOM 1596 N LEU A 101 120.276 5.389 5.858 1.00 0.00 N ATOM 1597 CA LEU A 101 119.959 5.501 7.311 1.00 0.00 C ATOM 1598 C LEU A 101 121.190 6.026 8.042 1.00 0.00 C ATOM 1599 O LEU A 101 121.143 7.033 8.720 1.00 0.00 O ATOM 1600 CB LEU A 101 119.594 4.119 7.858 1.00 0.00 C ATOM 1601 CG LEU A 101 118.183 4.156 8.438 1.00 0.00 C ATOM 1602 CD1 LEU A 101 117.721 2.731 8.751 1.00 0.00 C ATOM 1603 CD2 LEU A 101 118.182 4.995 9.719 1.00 0.00 C ATOM 0 H LEU A 101 120.340 4.437 5.498 1.00 0.00 H new ATOM 0 HA LEU A 101 119.120 6.181 7.459 1.00 0.00 H new ATOM 0 HB2 LEU A 101 119.652 3.375 7.064 1.00 0.00 H new ATOM 0 HB3 LEU A 101 120.307 3.821 8.627 1.00 0.00 H new ATOM 0 HG LEU A 101 117.501 4.602 7.714 1.00 0.00 H new ATOM 0 HD11 LEU A 101 116.713 2.758 9.165 1.00 0.00 H new ATOM 0 HD12 LEU A 101 117.721 2.139 7.836 1.00 0.00 H new ATOM 0 HD13 LEU A 101 118.399 2.280 9.475 1.00 0.00 H new ATOM 0 HD21 LEU A 101 117.175 5.023 10.135 1.00 0.00 H new ATOM 0 HD22 LEU A 101 118.863 4.551 10.445 1.00 0.00 H new ATOM 0 HD23 LEU A 101 118.508 6.010 9.490 1.00 0.00 H new ATOM 1615 N ALA A 102 122.296 5.354 7.899 1.00 0.00 N ATOM 1616 CA ALA A 102 123.533 5.818 8.574 1.00 0.00 C ATOM 1617 C ALA A 102 123.749 7.290 8.240 1.00 0.00 C ATOM 1618 O ALA A 102 123.320 8.169 8.960 1.00 0.00 O ATOM 1619 CB ALA A 102 124.729 5.005 8.077 1.00 0.00 C ATOM 0 H ALA A 102 122.395 4.504 7.344 1.00 0.00 H new ATOM 0 HA ALA A 102 123.436 5.687 9.652 1.00 0.00 H new ATOM 0 HB1 ALA A 102 125.635 5.349 8.575 1.00 0.00 H new ATOM 0 HB2 ALA A 102 124.570 3.950 8.301 1.00 0.00 H new ATOM 0 HB3 ALA A 102 124.835 5.135 7.000 1.00 0.00 H new ATOM 1625 N LEU A 103 124.407 7.564 7.146 1.00 0.00 N ATOM 1626 CA LEU A 103 124.654 8.978 6.756 1.00 0.00 C ATOM 1627 C LEU A 103 125.397 9.692 7.888 1.00 0.00 C ATOM 1628 O LEU A 103 126.087 10.665 7.663 1.00 0.00 O ATOM 1629 CB LEU A 103 123.310 9.670 6.482 1.00 0.00 C ATOM 1630 CG LEU A 103 123.521 11.122 6.024 1.00 0.00 C ATOM 1631 CD1 LEU A 103 123.834 12.018 7.228 1.00 0.00 C ATOM 1632 CD2 LEU A 103 124.674 11.194 5.015 1.00 0.00 C ATOM 0 H LEU A 103 124.784 6.866 6.505 1.00 0.00 H new ATOM 0 HA LEU A 103 125.263 9.015 5.853 1.00 0.00 H new ATOM 0 HB2 LEU A 103 122.763 9.119 5.717 1.00 0.00 H new ATOM 0 HB3 LEU A 103 122.699 9.655 7.384 1.00 0.00 H new ATOM 0 HG LEU A 103 122.605 11.472 5.548 1.00 0.00 H new ATOM 0 HD11 LEU A 103 123.981 13.044 6.890 1.00 0.00 H new ATOM 0 HD12 LEU A 103 123.003 11.984 7.933 1.00 0.00 H new ATOM 0 HD13 LEU A 103 124.741 11.664 7.719 1.00 0.00 H new ATOM 0 HD21 LEU A 103 124.815 12.227 4.697 1.00 0.00 H new ATOM 0 HD22 LEU A 103 125.589 10.830 5.482 1.00 0.00 H new ATOM 0 HD23 LEU A 103 124.438 10.576 4.148 1.00 0.00 H new ATOM 1644 N LYS A 104 125.272 9.212 9.102 1.00 0.00 N ATOM 1645 CA LYS A 104 125.986 9.864 10.241 1.00 0.00 C ATOM 1646 C LYS A 104 127.236 10.552 9.697 1.00 0.00 C ATOM 1647 O LYS A 104 127.553 11.671 10.048 1.00 0.00 O ATOM 1648 CB LYS A 104 126.394 8.796 11.263 1.00 0.00 C ATOM 1649 CG LYS A 104 126.301 9.352 12.688 1.00 0.00 C ATOM 1650 CD LYS A 104 125.311 8.515 13.504 1.00 0.00 C ATOM 1651 CE LYS A 104 123.932 8.559 12.842 1.00 0.00 C ATOM 1652 NZ LYS A 104 122.879 8.645 13.893 1.00 0.00 N ATOM 0 H LYS A 104 124.708 8.400 9.351 1.00 0.00 H new ATOM 0 HA LYS A 104 125.337 10.594 10.725 1.00 0.00 H new ATOM 0 HB2 LYS A 104 125.748 7.924 11.164 1.00 0.00 H new ATOM 0 HB3 LYS A 104 127.412 8.463 11.062 1.00 0.00 H new ATOM 0 HG2 LYS A 104 127.283 9.335 13.161 1.00 0.00 H new ATOM 0 HG3 LYS A 104 125.978 10.393 12.662 1.00 0.00 H new ATOM 0 HD2 LYS A 104 125.660 7.485 13.572 1.00 0.00 H new ATOM 0 HD3 LYS A 104 125.249 8.898 14.523 1.00 0.00 H new ATOM 0 HE2 LYS A 104 123.865 9.417 12.174 1.00 0.00 H new ATOM 0 HE3 LYS A 104 123.781 7.668 12.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 121.942 8.675 13.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 122.939 7.813 14.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 123.020 9.508 14.456 1.00 0.00 H new ATOM 1666 N ASP A 105 127.933 9.888 8.815 1.00 0.00 N ATOM 1667 CA ASP A 105 129.149 10.491 8.210 1.00 0.00 C ATOM 1668 C ASP A 105 128.995 10.446 6.689 1.00 0.00 C ATOM 1669 O ASP A 105 128.623 11.422 6.068 1.00 0.00 O ATOM 1670 CB ASP A 105 130.387 9.697 8.633 1.00 0.00 C ATOM 1671 CG ASP A 105 131.628 10.584 8.512 1.00 0.00 C ATOM 1672 OD1 ASP A 105 131.599 11.503 7.710 1.00 0.00 O ATOM 1673 OD2 ASP A 105 132.586 10.328 9.223 1.00 0.00 O ATOM 0 H ASP A 105 127.709 8.948 8.487 1.00 0.00 H new ATOM 0 HA ASP A 105 129.268 11.521 8.546 1.00 0.00 H new ATOM 0 HB2 ASP A 105 130.275 9.348 9.660 1.00 0.00 H new ATOM 0 HB3 ASP A 105 130.497 8.812 8.006 1.00 0.00 H new ATOM 1678 N GLN A 106 129.255 9.313 6.091 1.00 0.00 N ATOM 1679 CA GLN A 106 129.105 9.185 4.612 1.00 0.00 C ATOM 1680 C GLN A 106 130.059 8.107 4.083 1.00 0.00 C ATOM 1681 O GLN A 106 129.639 7.169 3.433 1.00 0.00 O ATOM 1682 CB GLN A 106 129.401 10.529 3.932 1.00 0.00 C ATOM 1683 CG GLN A 106 129.963 10.288 2.528 1.00 0.00 C ATOM 1684 CD GLN A 106 129.976 11.605 1.750 1.00 0.00 C ATOM 1685 OE1 GLN A 106 130.726 12.506 2.070 1.00 0.00 O ATOM 1686 NE2 GLN A 106 129.172 11.756 0.734 1.00 0.00 N ATOM 0 H GLN A 106 129.567 8.466 6.567 1.00 0.00 H new ATOM 0 HA GLN A 106 128.079 8.895 4.384 1.00 0.00 H new ATOM 0 HB2 GLN A 106 128.490 11.125 3.872 1.00 0.00 H new ATOM 0 HB3 GLN A 106 130.115 11.098 4.527 1.00 0.00 H new ATOM 0 HG2 GLN A 106 130.973 9.882 2.594 1.00 0.00 H new ATOM 0 HG3 GLN A 106 129.356 9.550 2.004 1.00 0.00 H new ATOM 0 HE21 GLN A 106 128.542 11.000 0.465 1.00 0.00 H new ATOM 0 HE22 GLN A 106 129.173 12.630 0.208 1.00 0.00 H new ATOM 1695 N PRO A 107 131.335 8.239 4.347 1.00 0.00 N ATOM 1696 CA PRO A 107 132.355 7.257 3.873 1.00 0.00 C ATOM 1697 C PRO A 107 132.267 5.902 4.584 1.00 0.00 C ATOM 1698 O PRO A 107 132.734 4.905 4.075 1.00 0.00 O ATOM 1699 CB PRO A 107 133.689 7.932 4.195 1.00 0.00 C ATOM 1700 CG PRO A 107 133.394 8.867 5.318 1.00 0.00 C ATOM 1701 CD PRO A 107 131.952 9.331 5.121 1.00 0.00 C ATOM 0 HA PRO A 107 132.215 7.028 2.817 1.00 0.00 H new ATOM 0 HB2 PRO A 107 134.442 7.198 4.481 1.00 0.00 H new ATOM 0 HB3 PRO A 107 134.078 8.467 3.329 1.00 0.00 H new ATOM 0 HG2 PRO A 107 133.514 8.369 6.280 1.00 0.00 H new ATOM 0 HG3 PRO A 107 134.080 9.714 5.309 1.00 0.00 H new ATOM 0 HD2 PRO A 107 131.446 9.481 6.075 1.00 0.00 H new ATOM 0 HD3 PRO A 107 131.906 10.278 4.583 1.00 0.00 H new ATOM 1709 N GLU A 108 131.686 5.845 5.754 1.00 0.00 N ATOM 1710 CA GLU A 108 131.609 4.532 6.464 1.00 0.00 C ATOM 1711 C GLU A 108 130.643 3.607 5.725 1.00 0.00 C ATOM 1712 O GLU A 108 130.994 2.511 5.323 1.00 0.00 O ATOM 1713 CB GLU A 108 131.116 4.748 7.899 1.00 0.00 C ATOM 1714 CG GLU A 108 131.036 6.246 8.196 1.00 0.00 C ATOM 1715 CD GLU A 108 132.409 6.885 7.978 1.00 0.00 C ATOM 1716 OE1 GLU A 108 133.268 6.222 7.420 1.00 0.00 O ATOM 1717 OE2 GLU A 108 132.579 8.026 8.374 1.00 0.00 O ATOM 0 H GLU A 108 131.267 6.636 6.243 1.00 0.00 H new ATOM 0 HA GLU A 108 132.599 4.078 6.489 1.00 0.00 H new ATOM 0 HB2 GLU A 108 130.136 4.289 8.030 1.00 0.00 H new ATOM 0 HB3 GLU A 108 131.792 4.263 8.603 1.00 0.00 H new ATOM 0 HG2 GLU A 108 130.297 6.717 7.548 1.00 0.00 H new ATOM 0 HG3 GLU A 108 130.707 6.407 9.223 1.00 0.00 H new ATOM 1724 N ALA A 109 129.434 4.045 5.522 1.00 0.00 N ATOM 1725 CA ALA A 109 128.455 3.197 4.795 1.00 0.00 C ATOM 1726 C ALA A 109 129.001 2.924 3.396 1.00 0.00 C ATOM 1727 O ALA A 109 128.870 1.841 2.858 1.00 0.00 O ATOM 1728 CB ALA A 109 127.123 3.942 4.701 1.00 0.00 C ATOM 0 H ALA A 109 129.083 4.952 5.828 1.00 0.00 H new ATOM 0 HA ALA A 109 128.299 2.254 5.319 1.00 0.00 H new ATOM 0 HB1 ALA A 109 126.398 3.326 4.168 1.00 0.00 H new ATOM 0 HB2 ALA A 109 126.752 4.153 5.704 1.00 0.00 H new ATOM 0 HB3 ALA A 109 127.267 4.879 4.163 1.00 0.00 H new ATOM 1734 N ALA A 110 129.626 3.906 2.813 1.00 0.00 N ATOM 1735 CA ALA A 110 130.207 3.736 1.456 1.00 0.00 C ATOM 1736 C ALA A 110 131.449 2.847 1.538 1.00 0.00 C ATOM 1737 O ALA A 110 131.799 2.172 0.591 1.00 0.00 O ATOM 1738 CB ALA A 110 130.593 5.103 0.889 1.00 0.00 C ATOM 0 H ALA A 110 129.760 4.830 3.224 1.00 0.00 H new ATOM 0 HA ALA A 110 129.470 3.268 0.803 1.00 0.00 H new ATOM 0 HB1 ALA A 110 131.019 4.977 -0.106 1.00 0.00 H new ATOM 0 HB2 ALA A 110 129.707 5.735 0.827 1.00 0.00 H new ATOM 0 HB3 ALA A 110 131.329 5.573 1.542 1.00 0.00 H new ATOM 1744 N GLN A 111 132.120 2.830 2.661 1.00 0.00 N ATOM 1745 CA GLN A 111 133.326 1.970 2.774 1.00 0.00 C ATOM 1746 C GLN A 111 132.904 0.545 2.469 1.00 0.00 C ATOM 1747 O GLN A 111 133.537 -0.163 1.708 1.00 0.00 O ATOM 1748 CB GLN A 111 133.906 2.057 4.186 1.00 0.00 C ATOM 1749 CG GLN A 111 134.709 3.354 4.322 1.00 0.00 C ATOM 1750 CD GLN A 111 136.187 3.026 4.544 1.00 0.00 C ATOM 1751 OE1 GLN A 111 136.893 2.687 3.615 1.00 0.00 O ATOM 1752 NE2 GLN A 111 136.689 3.113 5.746 1.00 0.00 N ATOM 0 H GLN A 111 131.885 3.370 3.494 1.00 0.00 H new ATOM 0 HA GLN A 111 134.095 2.298 2.075 1.00 0.00 H new ATOM 0 HB2 GLN A 111 133.104 2.033 4.924 1.00 0.00 H new ATOM 0 HB3 GLN A 111 134.546 1.197 4.383 1.00 0.00 H new ATOM 0 HG2 GLN A 111 134.592 3.961 3.424 1.00 0.00 H new ATOM 0 HG3 GLN A 111 134.328 3.943 5.156 1.00 0.00 H new ATOM 0 HE21 GLN A 111 136.097 3.398 6.526 1.00 0.00 H new ATOM 0 HE22 GLN A 111 137.673 2.897 5.905 1.00 0.00 H new ATOM 1761 N LEU A 112 131.809 0.132 3.032 1.00 0.00 N ATOM 1762 CA LEU A 112 131.314 -1.230 2.747 1.00 0.00 C ATOM 1763 C LEU A 112 130.962 -1.292 1.265 1.00 0.00 C ATOM 1764 O LEU A 112 131.295 -2.229 0.573 1.00 0.00 O ATOM 1765 CB LEU A 112 130.087 -1.504 3.610 1.00 0.00 C ATOM 1766 CG LEU A 112 130.559 -1.973 4.987 1.00 0.00 C ATOM 1767 CD1 LEU A 112 129.605 -1.457 6.065 1.00 0.00 C ATOM 1768 CD2 LEU A 112 130.605 -3.505 5.022 1.00 0.00 C ATOM 0 H LEU A 112 131.238 0.680 3.676 1.00 0.00 H new ATOM 0 HA LEU A 112 132.067 -1.984 2.976 1.00 0.00 H new ATOM 0 HB2 LEU A 112 129.481 -0.603 3.704 1.00 0.00 H new ATOM 0 HB3 LEU A 112 129.459 -2.264 3.145 1.00 0.00 H new ATOM 0 HG LEU A 112 131.558 -1.580 5.178 1.00 0.00 H new ATOM 0 HD11 LEU A 112 129.946 -1.794 7.044 1.00 0.00 H new ATOM 0 HD12 LEU A 112 129.586 -0.367 6.043 1.00 0.00 H new ATOM 0 HD13 LEU A 112 128.602 -1.841 5.878 1.00 0.00 H new ATOM 0 HD21 LEU A 112 130.942 -3.837 6.004 1.00 0.00 H new ATOM 0 HD22 LEU A 112 129.610 -3.903 4.826 1.00 0.00 H new ATOM 0 HD23 LEU A 112 131.297 -3.866 4.261 1.00 0.00 H new ATOM 1780 N ALA A 113 130.324 -0.272 0.762 1.00 0.00 N ATOM 1781 CA ALA A 113 129.991 -0.253 -0.685 1.00 0.00 C ATOM 1782 C ALA A 113 131.262 -0.591 -1.468 1.00 0.00 C ATOM 1783 O ALA A 113 131.215 -1.118 -2.562 1.00 0.00 O ATOM 1784 CB ALA A 113 129.497 1.140 -1.082 1.00 0.00 C ATOM 0 H ALA A 113 130.021 0.546 1.291 1.00 0.00 H new ATOM 0 HA ALA A 113 129.207 -0.978 -0.903 1.00 0.00 H new ATOM 0 HB1 ALA A 113 129.254 1.151 -2.144 1.00 0.00 H new ATOM 0 HB2 ALA A 113 128.608 1.389 -0.503 1.00 0.00 H new ATOM 0 HB3 ALA A 113 130.278 1.874 -0.881 1.00 0.00 H new ATOM 1790 N LEU A 114 132.401 -0.293 -0.898 1.00 0.00 N ATOM 1791 CA LEU A 114 133.692 -0.594 -1.583 1.00 0.00 C ATOM 1792 C LEU A 114 133.901 -2.106 -1.593 1.00 0.00 C ATOM 1793 O LEU A 114 134.067 -2.724 -2.636 1.00 0.00 O ATOM 1794 CB LEU A 114 134.842 0.078 -0.829 1.00 0.00 C ATOM 1795 CG LEU A 114 135.973 0.402 -1.806 1.00 0.00 C ATOM 1796 CD1 LEU A 114 137.130 1.056 -1.049 1.00 0.00 C ATOM 1797 CD2 LEU A 114 136.462 -0.890 -2.464 1.00 0.00 C ATOM 0 H LEU A 114 132.492 0.148 0.017 1.00 0.00 H new ATOM 0 HA LEU A 114 133.667 -0.216 -2.605 1.00 0.00 H new ATOM 0 HB2 LEU A 114 134.491 0.991 -0.347 1.00 0.00 H new ATOM 0 HB3 LEU A 114 135.206 -0.579 -0.040 1.00 0.00 H new ATOM 0 HG LEU A 114 135.607 1.086 -2.572 1.00 0.00 H new ATOM 0 HD11 LEU A 114 137.936 1.287 -1.745 1.00 0.00 H new ATOM 0 HD12 LEU A 114 136.783 1.976 -0.578 1.00 0.00 H new ATOM 0 HD13 LEU A 114 137.497 0.372 -0.283 1.00 0.00 H new ATOM 0 HD21 LEU A 114 137.268 -0.661 -3.161 1.00 0.00 H new ATOM 0 HD22 LEU A 114 136.828 -1.573 -1.697 1.00 0.00 H new ATOM 0 HD23 LEU A 114 135.638 -1.358 -3.003 1.00 0.00 H new ATOM 1809 N ARG A 115 133.865 -2.728 -0.447 1.00 0.00 N ATOM 1810 CA ARG A 115 134.029 -4.196 -0.445 1.00 0.00 C ATOM 1811 C ARG A 115 132.996 -4.731 -1.427 1.00 0.00 C ATOM 1812 O ARG A 115 133.284 -5.540 -2.277 1.00 0.00 O ATOM 1813 CB ARG A 115 133.801 -4.762 0.961 1.00 0.00 C ATOM 1814 CG ARG A 115 135.118 -4.719 1.738 1.00 0.00 C ATOM 1815 CD ARG A 115 135.501 -3.266 2.029 1.00 0.00 C ATOM 1816 NE ARG A 115 136.700 -2.898 1.225 1.00 0.00 N ATOM 1817 CZ ARG A 115 137.825 -3.535 1.403 1.00 0.00 C ATOM 1818 NH1 ARG A 115 137.899 -4.493 2.286 1.00 0.00 N ATOM 1819 NH2 ARG A 115 138.876 -3.214 0.699 1.00 0.00 N ATOM 0 H ARG A 115 133.732 -2.290 0.465 1.00 0.00 H new ATOM 0 HA ARG A 115 135.038 -4.490 -0.736 1.00 0.00 H new ATOM 0 HB2 ARG A 115 133.039 -4.182 1.481 1.00 0.00 H new ATOM 0 HB3 ARG A 115 133.434 -5.787 0.899 1.00 0.00 H new ATOM 0 HG2 ARG A 115 135.018 -5.272 2.672 1.00 0.00 H new ATOM 0 HG3 ARG A 115 135.906 -5.204 1.163 1.00 0.00 H new ATOM 0 HD2 ARG A 115 134.670 -2.604 1.786 1.00 0.00 H new ATOM 0 HD3 ARG A 115 135.709 -3.139 3.091 1.00 0.00 H new ATOM 0 HE ARG A 115 136.642 -2.148 0.536 1.00 0.00 H new ATOM 0 HH11 ARG A 115 137.078 -4.744 2.837 1.00 0.00 H new ATOM 0 HH12 ARG A 115 138.778 -4.991 2.426 1.00 0.00 H new ATOM 0 HH21 ARG A 115 138.818 -2.465 0.009 1.00 0.00 H new ATOM 0 HH22 ARG A 115 139.755 -3.712 0.839 1.00 0.00 H new ATOM 1833 N VAL A 116 131.801 -4.225 -1.376 1.00 0.00 N ATOM 1834 CA VAL A 116 130.797 -4.673 -2.364 1.00 0.00 C ATOM 1835 C VAL A 116 131.481 -4.590 -3.726 1.00 0.00 C ATOM 1836 O VAL A 116 131.243 -5.383 -4.610 1.00 0.00 O ATOM 1837 CB VAL A 116 129.581 -3.740 -2.310 1.00 0.00 C ATOM 1838 CG1 VAL A 116 129.092 -3.424 -3.723 1.00 0.00 C ATOM 1839 CG2 VAL A 116 128.448 -4.406 -1.523 1.00 0.00 C ATOM 0 H VAL A 116 131.481 -3.530 -0.702 1.00 0.00 H new ATOM 0 HA VAL A 116 130.446 -5.686 -2.166 1.00 0.00 H new ATOM 0 HB VAL A 116 129.876 -2.814 -1.816 1.00 0.00 H new ATOM 0 HG11 VAL A 116 128.229 -2.761 -3.669 1.00 0.00 H new ATOM 0 HG12 VAL A 116 129.890 -2.937 -4.284 1.00 0.00 H new ATOM 0 HG13 VAL A 116 128.809 -4.349 -4.225 1.00 0.00 H new ATOM 0 HG21 VAL A 116 127.587 -3.738 -1.488 1.00 0.00 H new ATOM 0 HG22 VAL A 116 128.164 -5.338 -2.012 1.00 0.00 H new ATOM 0 HG23 VAL A 116 128.785 -4.616 -0.508 1.00 0.00 H new ATOM 1849 N GLY A 117 132.367 -3.644 -3.884 1.00 0.00 N ATOM 1850 CA GLY A 117 133.099 -3.529 -5.168 1.00 0.00 C ATOM 1851 C GLY A 117 133.673 -4.902 -5.501 1.00 0.00 C ATOM 1852 O GLY A 117 133.511 -5.419 -6.602 1.00 0.00 O ATOM 0 H GLY A 117 132.612 -2.949 -3.178 1.00 0.00 H new ATOM 0 HA2 GLY A 117 132.430 -3.192 -5.960 1.00 0.00 H new ATOM 0 HA3 GLY A 117 133.897 -2.790 -5.088 1.00 0.00 H new ATOM 1856 N ILE A 118 134.333 -5.522 -4.554 1.00 0.00 N ATOM 1857 CA ILE A 118 134.885 -6.867 -4.855 1.00 0.00 C ATOM 1858 C ILE A 118 133.749 -7.723 -5.399 1.00 0.00 C ATOM 1859 O ILE A 118 133.953 -8.581 -6.235 1.00 0.00 O ATOM 1860 CB ILE A 118 135.544 -7.522 -3.622 1.00 0.00 C ATOM 1861 CG1 ILE A 118 134.661 -7.468 -2.365 1.00 0.00 C ATOM 1862 CG2 ILE A 118 136.837 -6.772 -3.318 1.00 0.00 C ATOM 1863 CD1 ILE A 118 133.246 -7.988 -2.644 1.00 0.00 C ATOM 0 H ILE A 118 134.507 -5.164 -3.615 1.00 0.00 H new ATOM 0 HA ILE A 118 135.679 -6.775 -5.596 1.00 0.00 H new ATOM 0 HB ILE A 118 135.714 -8.571 -3.863 1.00 0.00 H new ATOM 0 HG12 ILE A 118 135.118 -8.062 -1.574 1.00 0.00 H new ATOM 0 HG13 ILE A 118 134.607 -6.442 -2.002 1.00 0.00 H new ATOM 0 HG21 ILE A 118 137.321 -7.218 -2.449 1.00 0.00 H new ATOM 0 HG22 ILE A 118 137.505 -6.835 -4.177 1.00 0.00 H new ATOM 0 HG23 ILE A 118 136.611 -5.726 -3.110 1.00 0.00 H new ATOM 0 HD11 ILE A 118 132.652 -7.934 -1.732 1.00 0.00 H new ATOM 0 HD12 ILE A 118 132.780 -7.377 -3.417 1.00 0.00 H new ATOM 0 HD13 ILE A 118 133.299 -9.023 -2.982 1.00 0.00 H new ATOM 1875 N ALA A 119 132.542 -7.482 -4.956 1.00 0.00 N ATOM 1876 CA ALA A 119 131.408 -8.269 -5.483 1.00 0.00 C ATOM 1877 C ALA A 119 131.182 -7.871 -6.938 1.00 0.00 C ATOM 1878 O ALA A 119 130.751 -8.667 -7.742 1.00 0.00 O ATOM 1879 CB ALA A 119 130.149 -8.011 -4.654 1.00 0.00 C ATOM 0 H ALA A 119 132.302 -6.778 -4.258 1.00 0.00 H new ATOM 0 HA ALA A 119 131.634 -9.334 -5.422 1.00 0.00 H new ATOM 0 HB1 ALA A 119 129.323 -8.598 -5.055 1.00 0.00 H new ATOM 0 HB2 ALA A 119 130.330 -8.299 -3.618 1.00 0.00 H new ATOM 0 HB3 ALA A 119 129.896 -6.952 -4.697 1.00 0.00 H new ATOM 1885 N VAL A 120 131.503 -6.661 -7.313 1.00 0.00 N ATOM 1886 CA VAL A 120 131.316 -6.298 -8.741 1.00 0.00 C ATOM 1887 C VAL A 120 131.993 -7.394 -9.531 1.00 0.00 C ATOM 1888 O VAL A 120 131.478 -7.887 -10.515 1.00 0.00 O ATOM 1889 CB VAL A 120 131.963 -4.950 -9.041 1.00 0.00 C ATOM 1890 CG1 VAL A 120 131.784 -4.621 -10.522 1.00 0.00 C ATOM 1891 CG2 VAL A 120 131.294 -3.871 -8.193 1.00 0.00 C ATOM 0 H VAL A 120 131.876 -5.929 -6.709 1.00 0.00 H new ATOM 0 HA VAL A 120 130.260 -6.207 -8.997 1.00 0.00 H new ATOM 0 HB VAL A 120 133.026 -4.991 -8.805 1.00 0.00 H new ATOM 0 HG11 VAL A 120 132.246 -3.658 -10.739 1.00 0.00 H new ATOM 0 HG12 VAL A 120 132.257 -5.395 -11.126 1.00 0.00 H new ATOM 0 HG13 VAL A 120 130.721 -4.575 -10.759 1.00 0.00 H new ATOM 0 HG21 VAL A 120 131.753 -2.905 -8.404 1.00 0.00 H new ATOM 0 HG22 VAL A 120 130.231 -3.827 -8.432 1.00 0.00 H new ATOM 0 HG23 VAL A 120 131.419 -4.109 -7.137 1.00 0.00 H new ATOM 1901 N ALA A 121 133.118 -7.832 -9.055 1.00 0.00 N ATOM 1902 CA ALA A 121 133.800 -8.964 -9.724 1.00 0.00 C ATOM 1903 C ALA A 121 133.203 -10.250 -9.142 1.00 0.00 C ATOM 1904 O ALA A 121 133.317 -11.323 -9.702 1.00 0.00 O ATOM 1905 CB ALA A 121 135.303 -8.911 -9.437 1.00 0.00 C ATOM 0 H ALA A 121 133.593 -7.457 -8.234 1.00 0.00 H new ATOM 0 HA ALA A 121 133.660 -8.921 -10.804 1.00 0.00 H new ATOM 0 HB1 ALA A 121 135.798 -9.747 -9.932 1.00 0.00 H new ATOM 0 HB2 ALA A 121 135.712 -7.973 -9.812 1.00 0.00 H new ATOM 0 HB3 ALA A 121 135.471 -8.976 -8.362 1.00 0.00 H new ATOM 1911 N LYS A 122 132.568 -10.127 -8.001 1.00 0.00 N ATOM 1912 CA LYS A 122 131.947 -11.307 -7.324 1.00 0.00 C ATOM 1913 C LYS A 122 130.522 -10.957 -6.866 1.00 0.00 C ATOM 1914 O LYS A 122 130.177 -11.136 -5.715 1.00 0.00 O ATOM 1915 CB LYS A 122 132.795 -11.702 -6.112 1.00 0.00 C ATOM 1916 CG LYS A 122 133.889 -12.682 -6.549 1.00 0.00 C ATOM 1917 CD LYS A 122 135.198 -12.356 -5.824 1.00 0.00 C ATOM 1918 CE LYS A 122 136.356 -13.084 -6.508 1.00 0.00 C ATOM 1919 NZ LYS A 122 136.349 -14.519 -6.104 1.00 0.00 N ATOM 0 H LYS A 122 132.453 -9.244 -7.503 1.00 0.00 H new ATOM 0 HA LYS A 122 131.901 -12.141 -8.024 1.00 0.00 H new ATOM 0 HB2 LYS A 122 133.244 -10.815 -5.665 1.00 0.00 H new ATOM 0 HB3 LYS A 122 132.166 -12.160 -5.349 1.00 0.00 H new ATOM 0 HG2 LYS A 122 133.584 -13.704 -6.326 1.00 0.00 H new ATOM 0 HG3 LYS A 122 134.035 -12.621 -7.627 1.00 0.00 H new ATOM 0 HD2 LYS A 122 135.374 -11.280 -5.835 1.00 0.00 H new ATOM 0 HD3 LYS A 122 135.132 -12.658 -4.779 1.00 0.00 H new ATOM 0 HE2 LYS A 122 136.264 -13.000 -7.591 1.00 0.00 H new ATOM 0 HE3 LYS A 122 137.304 -12.622 -6.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 137.136 -15.014 -6.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 136.457 -14.590 -5.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 135.449 -14.955 -6.389 1.00 0.00 H new ATOM 1933 N SER A 123 129.705 -10.427 -7.740 1.00 0.00 N ATOM 1934 CA SER A 123 128.317 -10.033 -7.337 1.00 0.00 C ATOM 1935 C SER A 123 127.732 -11.070 -6.386 1.00 0.00 C ATOM 1936 O SER A 123 126.736 -10.834 -5.730 1.00 0.00 O ATOM 1937 CB SER A 123 127.433 -9.926 -8.580 1.00 0.00 C ATOM 1938 OG SER A 123 128.248 -9.675 -9.717 1.00 0.00 O ATOM 0 H SER A 123 129.938 -10.249 -8.717 1.00 0.00 H new ATOM 0 HA SER A 123 128.356 -9.068 -6.831 1.00 0.00 H new ATOM 0 HB2 SER A 123 126.869 -10.848 -8.719 1.00 0.00 H new ATOM 0 HB3 SER A 123 126.706 -9.123 -8.455 1.00 0.00 H new ATOM 0 HG SER A 123 127.684 -9.607 -10.515 1.00 0.00 H new ATOM 1944 N ASP A 124 128.344 -12.205 -6.295 1.00 0.00 N ATOM 1945 CA ASP A 124 127.829 -13.251 -5.372 1.00 0.00 C ATOM 1946 C ASP A 124 128.973 -14.190 -4.987 1.00 0.00 C ATOM 1947 O ASP A 124 128.892 -15.390 -5.161 1.00 0.00 O ATOM 1948 CB ASP A 124 126.711 -14.035 -6.063 1.00 0.00 C ATOM 1949 CG ASP A 124 127.316 -15.021 -7.064 1.00 0.00 C ATOM 1950 OD1 ASP A 124 128.407 -14.756 -7.540 1.00 0.00 O ATOM 1951 OD2 ASP A 124 126.678 -16.024 -7.337 1.00 0.00 O ATOM 0 H ASP A 124 129.181 -12.460 -6.819 1.00 0.00 H new ATOM 0 HA ASP A 124 127.429 -12.786 -4.471 1.00 0.00 H new ATOM 0 HB2 ASP A 124 126.118 -14.572 -5.322 1.00 0.00 H new ATOM 0 HB3 ASP A 124 126.036 -13.350 -6.576 1.00 0.00 H new ATOM 1956 N GLY A 125 130.043 -13.650 -4.465 1.00 0.00 N ATOM 1957 CA GLY A 125 131.193 -14.511 -4.072 1.00 0.00 C ATOM 1958 C GLY A 125 131.984 -13.851 -2.937 1.00 0.00 C ATOM 1959 O GLY A 125 132.514 -14.522 -2.074 1.00 0.00 O ATOM 0 H GLY A 125 130.169 -12.652 -4.295 1.00 0.00 H new ATOM 0 HA2 GLY A 125 130.832 -15.489 -3.753 1.00 0.00 H new ATOM 0 HA3 GLY A 125 131.844 -14.676 -4.931 1.00 0.00 H new ATOM 1963 N ASN A 126 132.078 -12.546 -2.930 1.00 0.00 N ATOM 1964 CA ASN A 126 132.848 -11.866 -1.847 1.00 0.00 C ATOM 1965 C ASN A 126 131.921 -10.964 -1.023 1.00 0.00 C ATOM 1966 O ASN A 126 130.720 -10.962 -1.202 1.00 0.00 O ATOM 1967 CB ASN A 126 133.978 -11.041 -2.464 1.00 0.00 C ATOM 1968 CG ASN A 126 135.272 -11.858 -2.450 1.00 0.00 C ATOM 1969 OD1 ASN A 126 135.239 -13.071 -2.509 1.00 0.00 O ATOM 1970 ND2 ASN A 126 136.419 -11.240 -2.374 1.00 0.00 N ATOM 0 H ASN A 126 131.658 -11.926 -3.622 1.00 0.00 H new ATOM 0 HA ASN A 126 133.275 -12.619 -1.184 1.00 0.00 H new ATOM 0 HB2 ASN A 126 133.723 -10.762 -3.486 1.00 0.00 H new ATOM 0 HB3 ASN A 126 134.114 -10.115 -1.905 1.00 0.00 H new ATOM 0 HD21 ASN A 126 137.287 -11.775 -2.364 1.00 0.00 H new ATOM 0 HD22 ASN A 126 136.447 -10.222 -2.324 1.00 0.00 H new ATOM 1977 N PHE A 127 132.479 -10.212 -0.107 1.00 0.00 N ATOM 1978 CA PHE A 127 131.650 -9.317 0.758 1.00 0.00 C ATOM 1979 C PHE A 127 131.206 -10.086 2.000 1.00 0.00 C ATOM 1980 O PHE A 127 131.529 -11.244 2.175 1.00 0.00 O ATOM 1981 CB PHE A 127 130.415 -8.827 0.000 1.00 0.00 C ATOM 1982 CG PHE A 127 130.010 -7.484 0.555 1.00 0.00 C ATOM 1983 CD1 PHE A 127 130.832 -6.374 0.349 1.00 0.00 C ATOM 1984 CD2 PHE A 127 128.823 -7.349 1.285 1.00 0.00 C ATOM 1985 CE1 PHE A 127 130.471 -5.127 0.871 1.00 0.00 C ATOM 1986 CE2 PHE A 127 128.460 -6.098 1.805 1.00 0.00 C ATOM 1987 CZ PHE A 127 129.285 -4.989 1.596 1.00 0.00 C ATOM 0 H PHE A 127 133.481 -10.180 0.080 1.00 0.00 H new ATOM 0 HA PHE A 127 132.250 -8.454 1.046 1.00 0.00 H new ATOM 0 HB2 PHE A 127 130.632 -8.746 -1.065 1.00 0.00 H new ATOM 0 HB3 PHE A 127 129.599 -9.541 0.105 1.00 0.00 H new ATOM 0 HD1 PHE A 127 131.748 -6.478 -0.214 1.00 0.00 H new ATOM 0 HD2 PHE A 127 128.188 -8.207 1.448 1.00 0.00 H new ATOM 0 HE1 PHE A 127 131.110 -4.271 0.713 1.00 0.00 H new ATOM 0 HE2 PHE A 127 127.544 -5.992 2.367 1.00 0.00 H new ATOM 0 HZ PHE A 127 129.005 -4.025 1.995 1.00 0.00 H new ATOM 1997 N ASP A 128 130.466 -9.451 2.867 1.00 0.00 N ATOM 1998 CA ASP A 128 130.000 -10.142 4.095 1.00 0.00 C ATOM 1999 C ASP A 128 131.210 -10.584 4.919 1.00 0.00 C ATOM 2000 O ASP A 128 131.075 -11.081 6.015 1.00 0.00 O ATOM 2001 CB ASP A 128 129.157 -11.359 3.704 1.00 0.00 C ATOM 2002 CG ASP A 128 128.775 -11.269 2.224 1.00 0.00 C ATOM 2003 OD1 ASP A 128 127.783 -10.625 1.927 1.00 0.00 O ATOM 2004 OD2 ASP A 128 129.480 -11.848 1.414 1.00 0.00 O ATOM 0 H ASP A 128 130.165 -8.481 2.775 1.00 0.00 H new ATOM 0 HA ASP A 128 129.391 -9.463 4.692 1.00 0.00 H new ATOM 0 HB2 ASP A 128 129.717 -12.276 3.890 1.00 0.00 H new ATOM 0 HB3 ASP A 128 128.258 -11.404 4.319 1.00 0.00 H new ATOM 2009 N ASP A 129 132.395 -10.393 4.411 1.00 0.00 N ATOM 2010 CA ASP A 129 133.601 -10.796 5.188 1.00 0.00 C ATOM 2011 C ASP A 129 134.103 -9.587 5.972 1.00 0.00 C ATOM 2012 O ASP A 129 134.468 -9.686 7.127 1.00 0.00 O ATOM 2013 CB ASP A 129 134.692 -11.280 4.231 1.00 0.00 C ATOM 2014 CG ASP A 129 135.297 -10.082 3.496 1.00 0.00 C ATOM 2015 OD1 ASP A 129 136.044 -9.347 4.119 1.00 0.00 O ATOM 2016 OD2 ASP A 129 135.001 -9.921 2.324 1.00 0.00 O ATOM 0 H ASP A 129 132.581 -9.978 3.498 1.00 0.00 H new ATOM 0 HA ASP A 129 133.349 -11.605 5.874 1.00 0.00 H new ATOM 0 HB2 ASP A 129 135.467 -11.809 4.785 1.00 0.00 H new ATOM 0 HB3 ASP A 129 134.274 -11.986 3.514 1.00 0.00 H new ATOM 2021 N ASP A 130 134.110 -8.442 5.352 1.00 0.00 N ATOM 2022 CA ASP A 130 134.570 -7.215 6.053 1.00 0.00 C ATOM 2023 C ASP A 130 133.392 -6.611 6.815 1.00 0.00 C ATOM 2024 O ASP A 130 133.564 -5.810 7.707 1.00 0.00 O ATOM 2025 CB ASP A 130 135.088 -6.207 5.029 1.00 0.00 C ATOM 2026 CG ASP A 130 136.171 -5.337 5.671 1.00 0.00 C ATOM 2027 OD1 ASP A 130 136.171 -5.225 6.885 1.00 0.00 O ATOM 2028 OD2 ASP A 130 136.982 -4.798 4.936 1.00 0.00 O ATOM 0 H ASP A 130 133.815 -8.303 4.385 1.00 0.00 H new ATOM 0 HA ASP A 130 135.372 -7.463 6.748 1.00 0.00 H new ATOM 0 HB2 ASP A 130 135.493 -6.729 4.162 1.00 0.00 H new ATOM 0 HB3 ASP A 130 134.269 -5.582 4.672 1.00 0.00 H new ATOM 2033 N GLU A 131 132.193 -6.987 6.461 1.00 0.00 N ATOM 2034 CA GLU A 131 131.003 -6.425 7.156 1.00 0.00 C ATOM 2035 C GLU A 131 131.192 -6.543 8.668 1.00 0.00 C ATOM 2036 O GLU A 131 130.754 -5.702 9.422 1.00 0.00 O ATOM 2037 CB GLU A 131 129.754 -7.205 6.736 1.00 0.00 C ATOM 2038 CG GLU A 131 129.138 -6.556 5.494 1.00 0.00 C ATOM 2039 CD GLU A 131 128.020 -5.600 5.916 1.00 0.00 C ATOM 2040 OE1 GLU A 131 127.993 -5.228 7.077 1.00 0.00 O ATOM 2041 OE2 GLU A 131 127.210 -5.257 5.070 1.00 0.00 O ATOM 0 H GLU A 131 131.988 -7.658 5.721 1.00 0.00 H new ATOM 0 HA GLU A 131 130.886 -5.375 6.886 1.00 0.00 H new ATOM 0 HB2 GLU A 131 130.014 -8.242 6.526 1.00 0.00 H new ATOM 0 HB3 GLU A 131 129.029 -7.217 7.550 1.00 0.00 H new ATOM 0 HG2 GLU A 131 129.903 -6.014 4.937 1.00 0.00 H new ATOM 0 HG3 GLU A 131 128.742 -7.323 4.829 1.00 0.00 H new ATOM 2048 N LYS A 132 131.849 -7.572 9.121 1.00 0.00 N ATOM 2049 CA LYS A 132 132.066 -7.724 10.586 1.00 0.00 C ATOM 2050 C LYS A 132 133.071 -6.671 11.052 1.00 0.00 C ATOM 2051 O LYS A 132 132.795 -5.885 11.937 1.00 0.00 O ATOM 2052 CB LYS A 132 132.604 -9.125 10.875 1.00 0.00 C ATOM 2053 CG LYS A 132 132.072 -10.091 9.815 1.00 0.00 C ATOM 2054 CD LYS A 132 131.747 -11.439 10.457 1.00 0.00 C ATOM 2055 CE LYS A 132 132.984 -11.964 11.183 1.00 0.00 C ATOM 2056 NZ LYS A 132 132.904 -13.448 11.294 1.00 0.00 N ATOM 0 H LYS A 132 132.245 -8.313 8.542 1.00 0.00 H new ATOM 0 HA LYS A 132 131.125 -7.587 11.120 1.00 0.00 H new ATOM 0 HB2 LYS A 132 133.694 -9.119 10.866 1.00 0.00 H new ATOM 0 HB3 LYS A 132 132.295 -9.449 11.869 1.00 0.00 H new ATOM 0 HG2 LYS A 132 131.179 -9.676 9.348 1.00 0.00 H new ATOM 0 HG3 LYS A 132 132.813 -10.223 9.026 1.00 0.00 H new ATOM 0 HD2 LYS A 132 130.919 -11.331 11.157 1.00 0.00 H new ATOM 0 HD3 LYS A 132 131.429 -12.151 9.695 1.00 0.00 H new ATOM 0 HE2 LYS A 132 133.885 -11.677 10.641 1.00 0.00 H new ATOM 0 HE3 LYS A 132 133.053 -11.518 12.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 133.746 -13.805 11.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 132.051 -13.711 11.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 132.858 -13.865 10.343 1.00 0.00 H new ATOM 2070 N SER A 133 134.227 -6.633 10.449 1.00 0.00 N ATOM 2071 CA SER A 133 135.234 -5.611 10.847 1.00 0.00 C ATOM 2072 C SER A 133 134.734 -4.242 10.388 1.00 0.00 C ATOM 2073 O SER A 133 134.957 -3.231 11.033 1.00 0.00 O ATOM 2074 CB SER A 133 136.574 -5.921 10.178 1.00 0.00 C ATOM 2075 OG SER A 133 136.340 -6.407 8.862 1.00 0.00 O ATOM 0 H SER A 133 134.517 -7.263 9.701 1.00 0.00 H new ATOM 0 HA SER A 133 135.371 -5.618 11.928 1.00 0.00 H new ATOM 0 HB2 SER A 133 137.192 -5.024 10.142 1.00 0.00 H new ATOM 0 HB3 SER A 133 137.121 -6.662 10.760 1.00 0.00 H new ATOM 0 HG SER A 133 136.494 -5.687 8.215 1.00 0.00 H new ATOM 2081 N ALA A 134 134.036 -4.206 9.285 1.00 0.00 N ATOM 2082 CA ALA A 134 133.499 -2.916 8.789 1.00 0.00 C ATOM 2083 C ALA A 134 132.476 -2.415 9.794 1.00 0.00 C ATOM 2084 O ALA A 134 132.505 -1.273 10.204 1.00 0.00 O ATOM 2085 CB ALA A 134 132.826 -3.115 7.432 1.00 0.00 C ATOM 0 H ALA A 134 133.817 -5.018 8.708 1.00 0.00 H new ATOM 0 HA ALA A 134 134.308 -2.195 8.673 1.00 0.00 H new ATOM 0 HB1 ALA A 134 132.435 -2.162 7.077 1.00 0.00 H new ATOM 0 HB2 ALA A 134 133.555 -3.498 6.717 1.00 0.00 H new ATOM 0 HB3 ALA A 134 132.008 -3.828 7.533 1.00 0.00 H new ATOM 2091 N VAL A 135 131.576 -3.264 10.218 1.00 0.00 N ATOM 2092 CA VAL A 135 130.582 -2.811 11.215 1.00 0.00 C ATOM 2093 C VAL A 135 131.342 -2.239 12.415 1.00 0.00 C ATOM 2094 O VAL A 135 130.909 -1.302 13.047 1.00 0.00 O ATOM 2095 CB VAL A 135 129.690 -3.971 11.654 1.00 0.00 C ATOM 2096 CG1 VAL A 135 128.767 -3.497 12.780 1.00 0.00 C ATOM 2097 CG2 VAL A 135 128.844 -4.445 10.465 1.00 0.00 C ATOM 0 H VAL A 135 131.492 -4.235 9.918 1.00 0.00 H new ATOM 0 HA VAL A 135 129.938 -2.048 10.778 1.00 0.00 H new ATOM 0 HB VAL A 135 130.309 -4.795 12.009 1.00 0.00 H new ATOM 0 HG11 VAL A 135 128.128 -4.321 13.098 1.00 0.00 H new ATOM 0 HG12 VAL A 135 129.367 -3.157 13.624 1.00 0.00 H new ATOM 0 HG13 VAL A 135 128.148 -2.675 12.421 1.00 0.00 H new ATOM 0 HG21 VAL A 135 128.208 -5.273 10.778 1.00 0.00 H new ATOM 0 HG22 VAL A 135 128.222 -3.623 10.110 1.00 0.00 H new ATOM 0 HG23 VAL A 135 129.501 -4.776 9.661 1.00 0.00 H new ATOM 2107 N ARG A 136 132.486 -2.786 12.728 1.00 0.00 N ATOM 2108 CA ARG A 136 133.268 -2.246 13.876 1.00 0.00 C ATOM 2109 C ARG A 136 133.462 -0.744 13.669 1.00 0.00 C ATOM 2110 O ARG A 136 133.169 0.058 14.533 1.00 0.00 O ATOM 2111 CB ARG A 136 134.643 -2.923 13.937 1.00 0.00 C ATOM 2112 CG ARG A 136 135.203 -2.824 15.361 1.00 0.00 C ATOM 2113 CD ARG A 136 134.596 -3.920 16.243 1.00 0.00 C ATOM 2114 NE ARG A 136 135.161 -3.817 17.618 1.00 0.00 N ATOM 2115 CZ ARG A 136 136.397 -4.168 17.843 1.00 0.00 C ATOM 2116 NH1 ARG A 136 137.139 -4.610 16.864 1.00 0.00 N ATOM 2117 NH2 ARG A 136 136.892 -4.077 19.047 1.00 0.00 N ATOM 0 H ARG A 136 132.910 -3.577 12.243 1.00 0.00 H new ATOM 0 HA ARG A 136 132.733 -2.438 14.806 1.00 0.00 H new ATOM 0 HB2 ARG A 136 134.558 -3.969 13.641 1.00 0.00 H new ATOM 0 HB3 ARG A 136 135.326 -2.447 13.233 1.00 0.00 H new ATOM 0 HG2 ARG A 136 136.288 -2.922 15.341 1.00 0.00 H new ATOM 0 HG3 ARG A 136 134.979 -1.843 15.781 1.00 0.00 H new ATOM 0 HD2 ARG A 136 133.511 -3.818 16.275 1.00 0.00 H new ATOM 0 HD3 ARG A 136 134.811 -4.902 15.822 1.00 0.00 H new ATOM 0 HE ARG A 136 134.581 -3.472 18.383 1.00 0.00 H new ATOM 0 HH11 ARG A 136 136.752 -4.681 15.923 1.00 0.00 H new ATOM 0 HH12 ARG A 136 138.105 -4.884 17.040 1.00 0.00 H new ATOM 0 HH21 ARG A 136 136.312 -3.731 19.812 1.00 0.00 H new ATOM 0 HH22 ARG A 136 137.858 -4.351 19.223 1.00 0.00 H new ATOM 2131 N GLU A 137 133.958 -0.362 12.524 1.00 0.00 N ATOM 2132 CA GLU A 137 134.179 1.085 12.244 1.00 0.00 C ATOM 2133 C GLU A 137 132.844 1.774 11.939 1.00 0.00 C ATOM 2134 O GLU A 137 132.680 2.954 12.171 1.00 0.00 O ATOM 2135 CB GLU A 137 135.112 1.232 11.041 1.00 0.00 C ATOM 2136 CG GLU A 137 136.566 1.121 11.504 1.00 0.00 C ATOM 2137 CD GLU A 137 137.035 2.473 12.044 1.00 0.00 C ATOM 2138 OE1 GLU A 137 136.259 3.412 11.989 1.00 0.00 O ATOM 2139 OE2 GLU A 137 138.163 2.546 12.503 1.00 0.00 O ATOM 0 H GLU A 137 134.221 -0.993 11.767 1.00 0.00 H new ATOM 0 HA GLU A 137 134.628 1.552 13.120 1.00 0.00 H new ATOM 0 HB2 GLU A 137 134.895 0.460 10.303 1.00 0.00 H new ATOM 0 HB3 GLU A 137 134.947 2.194 10.555 1.00 0.00 H new ATOM 0 HG2 GLU A 137 136.655 0.358 12.277 1.00 0.00 H new ATOM 0 HG3 GLU A 137 137.200 0.809 10.674 1.00 0.00 H new ATOM 2146 N ILE A 138 131.892 1.053 11.410 1.00 0.00 N ATOM 2147 CA ILE A 138 130.577 1.680 11.084 1.00 0.00 C ATOM 2148 C ILE A 138 129.806 1.957 12.381 1.00 0.00 C ATOM 2149 O ILE A 138 129.387 3.062 12.643 1.00 0.00 O ATOM 2150 CB ILE A 138 129.778 0.729 10.170 1.00 0.00 C ATOM 2151 CG1 ILE A 138 129.261 1.496 8.946 1.00 0.00 C ATOM 2152 CG2 ILE A 138 128.583 0.127 10.922 1.00 0.00 C ATOM 2153 CD1 ILE A 138 130.299 1.447 7.818 1.00 0.00 C ATOM 0 H ILE A 138 131.967 0.060 11.190 1.00 0.00 H new ATOM 0 HA ILE A 138 130.731 2.625 10.564 1.00 0.00 H new ATOM 0 HB ILE A 138 130.442 -0.076 9.854 1.00 0.00 H new ATOM 0 HG12 ILE A 138 128.321 1.062 8.605 1.00 0.00 H new ATOM 0 HG13 ILE A 138 129.054 2.532 9.216 1.00 0.00 H new ATOM 0 HG21 ILE A 138 128.034 -0.540 10.258 1.00 0.00 H new ATOM 0 HG22 ILE A 138 128.941 -0.434 11.785 1.00 0.00 H new ATOM 0 HG23 ILE A 138 127.924 0.927 11.258 1.00 0.00 H new ATOM 0 HD11 ILE A 138 129.923 1.994 6.954 1.00 0.00 H new ATOM 0 HD12 ILE A 138 131.229 1.902 8.159 1.00 0.00 H new ATOM 0 HD13 ILE A 138 130.484 0.410 7.539 1.00 0.00 H new ATOM 2165 N ALA A 139 129.616 0.959 13.192 1.00 0.00 N ATOM 2166 CA ALA A 139 128.875 1.155 14.467 1.00 0.00 C ATOM 2167 C ALA A 139 129.552 2.251 15.289 1.00 0.00 C ATOM 2168 O ALA A 139 128.902 3.076 15.901 1.00 0.00 O ATOM 2169 CB ALA A 139 128.890 -0.153 15.258 1.00 0.00 C ATOM 0 H ALA A 139 129.944 0.008 13.026 1.00 0.00 H new ATOM 0 HA ALA A 139 127.847 1.447 14.253 1.00 0.00 H new ATOM 0 HB1 ALA A 139 128.349 -0.018 16.194 1.00 0.00 H new ATOM 0 HB2 ALA A 139 128.412 -0.938 14.672 1.00 0.00 H new ATOM 0 HB3 ALA A 139 129.920 -0.437 15.472 1.00 0.00 H new ATOM 2175 N ARG A 140 130.856 2.262 15.315 1.00 0.00 N ATOM 2176 CA ARG A 140 131.577 3.298 16.103 1.00 0.00 C ATOM 2177 C ARG A 140 131.559 4.627 15.339 1.00 0.00 C ATOM 2178 O ARG A 140 131.235 5.662 15.886 1.00 0.00 O ATOM 2179 CB ARG A 140 133.022 2.828 16.340 1.00 0.00 C ATOM 2180 CG ARG A 140 134.019 3.953 16.037 1.00 0.00 C ATOM 2181 CD ARG A 140 133.708 5.173 16.910 1.00 0.00 C ATOM 2182 NE ARG A 140 134.898 5.502 17.745 1.00 0.00 N ATOM 2183 CZ ARG A 140 136.049 5.735 17.176 1.00 0.00 C ATOM 2184 NH1 ARG A 140 136.159 5.681 15.877 1.00 0.00 N ATOM 2185 NH2 ARG A 140 137.091 6.023 17.908 1.00 0.00 N ATOM 0 H ARG A 140 131.453 1.597 14.824 1.00 0.00 H new ATOM 0 HA ARG A 140 131.088 3.447 17.066 1.00 0.00 H new ATOM 0 HB2 ARG A 140 133.138 2.502 17.374 1.00 0.00 H new ATOM 0 HB3 ARG A 140 133.237 1.966 15.708 1.00 0.00 H new ATOM 0 HG2 ARG A 140 135.036 3.610 16.225 1.00 0.00 H new ATOM 0 HG3 ARG A 140 133.964 4.225 14.983 1.00 0.00 H new ATOM 0 HD2 ARG A 140 133.444 6.024 16.283 1.00 0.00 H new ATOM 0 HD3 ARG A 140 132.848 4.968 17.548 1.00 0.00 H new ATOM 0 HE ARG A 140 134.813 5.545 18.761 1.00 0.00 H new ATOM 0 HH11 ARG A 140 135.345 5.456 15.305 1.00 0.00 H new ATOM 0 HH12 ARG A 140 137.059 5.863 15.433 1.00 0.00 H new ATOM 0 HH21 ARG A 140 137.005 6.066 18.923 1.00 0.00 H new ATOM 0 HH22 ARG A 140 137.991 6.205 17.464 1.00 0.00 H new ATOM 2199 N SER A 141 131.902 4.607 14.080 1.00 0.00 N ATOM 2200 CA SER A 141 131.900 5.871 13.289 1.00 0.00 C ATOM 2201 C SER A 141 130.507 6.497 13.348 1.00 0.00 C ATOM 2202 O SER A 141 130.354 7.681 13.573 1.00 0.00 O ATOM 2203 CB SER A 141 132.261 5.566 11.835 1.00 0.00 C ATOM 2204 OG SER A 141 133.571 5.016 11.782 1.00 0.00 O ATOM 0 H SER A 141 132.183 3.772 13.566 1.00 0.00 H new ATOM 0 HA SER A 141 132.632 6.564 13.704 1.00 0.00 H new ATOM 0 HB2 SER A 141 131.543 4.866 11.409 1.00 0.00 H new ATOM 0 HB3 SER A 141 132.212 6.476 11.237 1.00 0.00 H new ATOM 0 HG SER A 141 133.514 4.038 11.752 1.00 0.00 H new ATOM 2210 N LEU A 142 129.489 5.706 13.154 1.00 0.00 N ATOM 2211 CA LEU A 142 128.103 6.243 13.205 1.00 0.00 C ATOM 2212 C LEU A 142 127.608 6.200 14.654 1.00 0.00 C ATOM 2213 O LEU A 142 127.371 7.223 15.265 1.00 0.00 O ATOM 2214 CB LEU A 142 127.191 5.397 12.313 1.00 0.00 C ATOM 2215 CG LEU A 142 127.931 5.016 11.027 1.00 0.00 C ATOM 2216 CD1 LEU A 142 127.115 3.977 10.266 1.00 0.00 C ATOM 2217 CD2 LEU A 142 128.112 6.254 10.149 1.00 0.00 C ATOM 0 H LEU A 142 129.559 4.707 12.962 1.00 0.00 H new ATOM 0 HA LEU A 142 128.089 7.272 12.846 1.00 0.00 H new ATOM 0 HB2 LEU A 142 126.880 4.498 12.844 1.00 0.00 H new ATOM 0 HB3 LEU A 142 126.286 5.954 12.071 1.00 0.00 H new ATOM 0 HG LEU A 142 128.909 4.606 11.281 1.00 0.00 H new ATOM 0 HD11 LEU A 142 127.638 3.703 9.350 1.00 0.00 H new ATOM 0 HD12 LEU A 142 126.983 3.091 10.887 1.00 0.00 H new ATOM 0 HD13 LEU A 142 126.139 4.393 10.016 1.00 0.00 H new ATOM 0 HD21 LEU A 142 128.639 5.978 9.235 1.00 0.00 H new ATOM 0 HD22 LEU A 142 127.135 6.666 9.895 1.00 0.00 H new ATOM 0 HD23 LEU A 142 128.691 7.002 10.690 1.00 0.00 H new ATOM 2229 N GLY A 143 127.464 5.028 15.221 1.00 0.00 N ATOM 2230 CA GLY A 143 127.004 4.951 16.638 1.00 0.00 C ATOM 2231 C GLY A 143 126.148 3.700 16.876 1.00 0.00 C ATOM 2232 O GLY A 143 125.156 3.752 17.576 1.00 0.00 O ATOM 0 H GLY A 143 127.643 4.132 14.769 1.00 0.00 H new ATOM 0 HA2 GLY A 143 127.867 4.936 17.303 1.00 0.00 H new ATOM 0 HA3 GLY A 143 126.427 5.842 16.885 1.00 0.00 H new ATOM 2236 N PHE A 144 126.516 2.573 16.320 1.00 0.00 N ATOM 2237 CA PHE A 144 125.702 1.339 16.553 1.00 0.00 C ATOM 2238 C PHE A 144 126.481 0.357 17.435 1.00 0.00 C ATOM 2239 O PHE A 144 127.074 0.734 18.426 1.00 0.00 O ATOM 2240 CB PHE A 144 125.365 0.659 15.223 1.00 0.00 C ATOM 2241 CG PHE A 144 125.023 1.692 14.179 1.00 0.00 C ATOM 2242 CD1 PHE A 144 124.396 2.890 14.546 1.00 0.00 C ATOM 2243 CD2 PHE A 144 125.330 1.447 12.836 1.00 0.00 C ATOM 2244 CE1 PHE A 144 124.079 3.840 13.570 1.00 0.00 C ATOM 2245 CE2 PHE A 144 125.013 2.396 11.860 1.00 0.00 C ATOM 2246 CZ PHE A 144 124.387 3.594 12.227 1.00 0.00 C ATOM 0 H PHE A 144 127.334 2.453 15.722 1.00 0.00 H new ATOM 0 HA PHE A 144 124.777 1.628 17.052 1.00 0.00 H new ATOM 0 HB2 PHE A 144 126.212 0.060 14.888 1.00 0.00 H new ATOM 0 HB3 PHE A 144 124.526 -0.023 15.358 1.00 0.00 H new ATOM 0 HD1 PHE A 144 124.158 3.080 15.582 1.00 0.00 H new ATOM 0 HD2 PHE A 144 125.813 0.523 12.553 1.00 0.00 H new ATOM 0 HE1 PHE A 144 123.596 4.764 13.853 1.00 0.00 H new ATOM 0 HE2 PHE A 144 125.251 2.206 10.824 1.00 0.00 H new ATOM 0 HZ PHE A 144 124.142 4.328 11.474 1.00 0.00 H new ATOM 2256 N ASP A 145 126.475 -0.903 17.084 1.00 0.00 N ATOM 2257 CA ASP A 145 127.204 -1.916 17.905 1.00 0.00 C ATOM 2258 C ASP A 145 128.537 -2.273 17.232 1.00 0.00 C ATOM 2259 O ASP A 145 128.562 -2.798 16.136 1.00 0.00 O ATOM 2260 CB ASP A 145 126.347 -3.178 18.025 1.00 0.00 C ATOM 2261 CG ASP A 145 125.438 -3.064 19.250 1.00 0.00 C ATOM 2262 OD1 ASP A 145 124.802 -2.033 19.398 1.00 0.00 O ATOM 2263 OD2 ASP A 145 125.394 -4.010 20.020 1.00 0.00 O ATOM 0 H ASP A 145 125.996 -1.275 16.264 1.00 0.00 H new ATOM 0 HA ASP A 145 127.400 -1.503 18.895 1.00 0.00 H new ATOM 0 HB2 ASP A 145 125.747 -3.310 17.125 1.00 0.00 H new ATOM 0 HB3 ASP A 145 126.986 -4.057 18.114 1.00 0.00 H new ATOM 2268 N PRO A 146 129.639 -1.993 17.885 1.00 0.00 N ATOM 2269 CA PRO A 146 130.998 -2.292 17.344 1.00 0.00 C ATOM 2270 C PRO A 146 131.130 -3.721 16.801 1.00 0.00 C ATOM 2271 O PRO A 146 131.358 -4.658 17.540 1.00 0.00 O ATOM 2272 CB PRO A 146 131.922 -2.102 18.547 1.00 0.00 C ATOM 2273 CG PRO A 146 131.207 -1.159 19.456 1.00 0.00 C ATOM 2274 CD PRO A 146 129.710 -1.355 19.210 1.00 0.00 C ATOM 0 HA PRO A 146 131.232 -1.646 16.498 1.00 0.00 H new ATOM 0 HB2 PRO A 146 132.119 -3.052 19.044 1.00 0.00 H new ATOM 0 HB3 PRO A 146 132.886 -1.696 18.241 1.00 0.00 H new ATOM 0 HG2 PRO A 146 131.457 -1.362 20.497 1.00 0.00 H new ATOM 0 HG3 PRO A 146 131.500 -0.129 19.253 1.00 0.00 H new ATOM 0 HD2 PRO A 146 129.260 -1.983 19.979 1.00 0.00 H new ATOM 0 HD3 PRO A 146 129.177 -0.404 19.223 1.00 0.00 H new ATOM 2282 N ALA A 147 131.002 -3.889 15.513 1.00 0.00 N ATOM 2283 CA ALA A 147 131.133 -5.243 14.908 1.00 0.00 C ATOM 2284 C ALA A 147 130.169 -6.216 15.562 1.00 0.00 C ATOM 2285 O ALA A 147 130.272 -6.527 16.731 1.00 0.00 O ATOM 2286 CB ALA A 147 132.553 -5.769 15.089 1.00 0.00 C ATOM 0 H ALA A 147 130.811 -3.139 14.849 1.00 0.00 H new ATOM 0 HA ALA A 147 130.902 -5.158 13.846 1.00 0.00 H new ATOM 0 HB1 ALA A 147 132.634 -6.760 14.642 1.00 0.00 H new ATOM 0 HB2 ALA A 147 133.256 -5.093 14.603 1.00 0.00 H new ATOM 0 HB3 ALA A 147 132.785 -5.831 16.152 1.00 0.00 H new ATOM 2292 N GLU A 148 129.246 -6.714 14.803 1.00 0.00 N ATOM 2293 CA GLU A 148 128.281 -7.691 15.362 1.00 0.00 C ATOM 2294 C GLU A 148 127.198 -8.004 14.323 1.00 0.00 C ATOM 2295 O GLU A 148 126.085 -8.349 14.668 1.00 0.00 O ATOM 2296 CB GLU A 148 127.632 -7.104 16.621 1.00 0.00 C ATOM 2297 CG GLU A 148 128.030 -7.937 17.842 1.00 0.00 C ATOM 2298 CD GLU A 148 127.688 -7.167 19.119 1.00 0.00 C ATOM 2299 OE1 GLU A 148 128.339 -6.167 19.377 1.00 0.00 O ATOM 2300 OE2 GLU A 148 126.782 -7.590 19.818 1.00 0.00 O ATOM 0 H GLU A 148 129.116 -6.488 13.817 1.00 0.00 H new ATOM 0 HA GLU A 148 128.807 -8.611 15.619 1.00 0.00 H new ATOM 0 HB2 GLU A 148 127.947 -6.069 16.756 1.00 0.00 H new ATOM 0 HB3 GLU A 148 126.547 -7.095 16.513 1.00 0.00 H new ATOM 0 HG2 GLU A 148 127.506 -8.893 17.830 1.00 0.00 H new ATOM 0 HG3 GLU A 148 129.097 -8.158 17.813 1.00 0.00 H new ATOM 2307 N PHE A 149 127.499 -7.876 13.052 1.00 0.00 N ATOM 2308 CA PHE A 149 126.466 -8.157 12.021 1.00 0.00 C ATOM 2309 C PHE A 149 127.010 -9.155 11.009 1.00 0.00 C ATOM 2310 O PHE A 149 126.475 -10.233 10.844 1.00 0.00 O ATOM 2311 CB PHE A 149 126.090 -6.856 11.311 1.00 0.00 C ATOM 2312 CG PHE A 149 125.770 -5.807 12.346 1.00 0.00 C ATOM 2313 CD1 PHE A 149 126.736 -5.438 13.289 1.00 0.00 C ATOM 2314 CD2 PHE A 149 124.506 -5.211 12.370 1.00 0.00 C ATOM 2315 CE1 PHE A 149 126.438 -4.473 14.255 1.00 0.00 C ATOM 2316 CE2 PHE A 149 124.207 -4.247 13.338 1.00 0.00 C ATOM 2317 CZ PHE A 149 125.174 -3.879 14.281 1.00 0.00 C ATOM 0 H PHE A 149 128.410 -7.591 12.692 1.00 0.00 H new ATOM 0 HA PHE A 149 125.581 -8.578 12.499 1.00 0.00 H new ATOM 0 HB2 PHE A 149 126.912 -6.522 10.678 1.00 0.00 H new ATOM 0 HB3 PHE A 149 125.231 -7.017 10.660 1.00 0.00 H new ATOM 0 HD1 PHE A 149 127.712 -5.899 13.270 1.00 0.00 H new ATOM 0 HD2 PHE A 149 123.761 -5.495 11.642 1.00 0.00 H new ATOM 0 HE1 PHE A 149 127.185 -4.187 14.981 1.00 0.00 H new ATOM 0 HE2 PHE A 149 123.230 -3.787 13.358 1.00 0.00 H new ATOM 0 HZ PHE A 149 124.943 -3.135 15.029 1.00 0.00 H new ATOM 2327 N GLY A 150 128.066 -8.811 10.328 1.00 0.00 N ATOM 2328 CA GLY A 150 128.629 -9.748 9.329 1.00 0.00 C ATOM 2329 C GLY A 150 127.483 -10.501 8.656 1.00 0.00 C ATOM 2330 O GLY A 150 127.210 -11.641 8.970 1.00 0.00 O ATOM 0 H GLY A 150 128.560 -7.923 10.422 1.00 0.00 H new ATOM 0 HA2 GLY A 150 129.209 -9.202 8.585 1.00 0.00 H new ATOM 0 HA3 GLY A 150 129.309 -10.450 9.812 1.00 0.00 H new