USER MOD reduce.3.24.130724 H: found=0, std=0, add=752, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 754 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 Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -0.64 K(o=-0.64,f=-2.2) USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 GLN : amide:sc= -0.478 K(o=-0.48,f=-1.2) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 67 MET CE :methyl 173:sc= -7.12! (180deg=-7.34!) USER MOD Single : A 70 THR OG1 : rot -62:sc= -0.514 USER MOD Single : A 72 SER OG : rot 180:sc= 0.0276 USER MOD Single : A 74 ASN : amide:sc= -3.33! C(o=-3.3!,f=-3.2!) USER MOD Single : A 76 THR OG1 : rot 64:sc= 1.47 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -58:sc= -0.104 USER MOD Single : A 84 THR OG1 : rot 76:sc= 0.979 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 ASN :FLIP amide:sc= -0.278 F(o=-1.7,f=-0.28) USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 TYR OH : rot 30:sc= -2.23! USER MOD Single : A 99 GLN : amide:sc= -0.192 X(o=-0.19,f=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0.0454 USER MOD Single : A 111 MET CE :methyl -170:sc= -2.3! (180deg=-2.58!) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= -0.149 K(o=-0.15,f=-2.2!) USER MOD Single : A 131 CYS SG : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 69 N LYS A 4 3.538 3.678 -6.860 1.00 15.45 N ATOM 70 CA LYS A 4 4.797 4.413 -6.865 1.00 50.13 C ATOM 71 C LYS A 4 5.567 4.183 -5.569 1.00 12.53 C ATOM 72 O LYS A 4 6.069 5.128 -4.958 1.00 74.52 O ATOM 73 CB LYS A 4 4.538 5.909 -7.059 1.00 34.21 C ATOM 74 CG LYS A 4 3.662 6.519 -5.978 1.00 53.15 C ATOM 75 CD LYS A 4 4.332 7.717 -5.327 1.00 44.04 C ATOM 76 CE LYS A 4 3.309 8.711 -4.801 1.00 54.21 C ATOM 77 NZ LYS A 4 3.018 9.785 -5.791 1.00 64.03 N ATOM 0 HA LYS A 4 5.400 4.045 -7.695 1.00 50.13 H new ATOM 0 HB2 LYS A 4 5.493 6.435 -7.081 1.00 34.21 H new ATOM 0 HB3 LYS A 4 4.066 6.065 -8.029 1.00 34.21 H new ATOM 0 HG2 LYS A 4 2.709 6.824 -6.410 1.00 53.15 H new ATOM 0 HG3 LYS A 4 3.442 5.768 -5.220 1.00 53.15 H new ATOM 0 HD2 LYS A 4 4.967 7.379 -4.508 1.00 44.04 H new ATOM 0 HD3 LYS A 4 4.981 8.210 -6.051 1.00 44.04 H new ATOM 0 HE2 LYS A 4 2.386 8.186 -4.553 1.00 54.21 H new ATOM 0 HE3 LYS A 4 3.679 9.158 -3.878 1.00 54.21 H new ATOM 0 HZ1 LYS A 4 2.316 10.442 -5.394 1.00 64.03 H new ATOM 0 HZ2 LYS A 4 3.893 10.303 -6.008 1.00 64.03 H new ATOM 0 HZ3 LYS A 4 2.641 9.361 -6.663 1.00 64.03 H new ATOM 91 N ASP A 5 5.657 2.924 -5.155 1.00 1.42 N ATOM 92 CA ASP A 5 6.368 2.571 -3.932 1.00 24.22 C ATOM 93 C ASP A 5 7.830 2.248 -4.227 1.00 51.21 C ATOM 94 O ASP A 5 8.329 1.186 -3.854 1.00 74.24 O ATOM 95 CB ASP A 5 5.697 1.376 -3.253 1.00 54.11 C ATOM 96 CG ASP A 5 4.441 1.769 -2.500 1.00 74.13 C ATOM 97 OD1 ASP A 5 3.988 2.922 -2.661 1.00 43.01 O ATOM 98 OD2 ASP A 5 3.910 0.923 -1.751 1.00 75.01 O ATOM 0 H ASP A 5 5.247 2.131 -5.648 1.00 1.42 H new ATOM 0 HA ASP A 5 6.332 3.429 -3.260 1.00 24.22 H new ATOM 0 HB2 ASP A 5 5.447 0.627 -4.005 1.00 54.11 H new ATOM 0 HB3 ASP A 5 6.401 0.912 -2.562 1.00 54.11 H new ATOM 103 N ILE A 6 8.510 3.171 -4.899 1.00 70.22 N ATOM 104 CA ILE A 6 9.914 2.984 -5.244 1.00 52.12 C ATOM 105 C ILE A 6 10.768 2.807 -3.994 1.00 23.12 C ATOM 106 O ILE A 6 10.282 2.949 -2.872 1.00 32.01 O ATOM 107 CB ILE A 6 10.456 4.173 -6.059 1.00 3.32 C ATOM 108 CG1 ILE A 6 10.438 5.449 -5.214 1.00 71.10 C ATOM 109 CG2 ILE A 6 9.641 4.361 -7.329 1.00 53.13 C ATOM 110 CD1 ILE A 6 10.972 6.663 -5.941 1.00 53.14 C ATOM 0 H ILE A 6 8.112 4.055 -5.215 1.00 70.22 H new ATOM 0 HA ILE A 6 9.973 2.081 -5.852 1.00 52.12 H new ATOM 0 HB ILE A 6 11.487 3.961 -6.341 1.00 3.32 H new ATOM 0 HG12 ILE A 6 9.415 5.648 -4.893 1.00 71.10 H new ATOM 0 HG13 ILE A 6 11.029 5.286 -4.313 1.00 71.10 H new ATOM 0 HG21 ILE A 6 10.037 5.205 -7.894 1.00 53.13 H new ATOM 0 HG22 ILE A 6 9.701 3.458 -7.937 1.00 53.13 H new ATOM 0 HG23 ILE A 6 8.601 4.555 -7.068 1.00 53.13 H new ATOM 0 HD11 ILE A 6 10.929 7.530 -5.282 1.00 53.14 H new ATOM 0 HD12 ILE A 6 12.005 6.484 -6.238 1.00 53.14 H new ATOM 0 HD13 ILE A 6 10.367 6.851 -6.828 1.00 53.14 H new ATOM 122 N ARG A 7 12.045 2.497 -4.195 1.00 40.42 N ATOM 123 CA ARG A 7 12.968 2.301 -3.084 1.00 2.40 C ATOM 124 C ARG A 7 13.658 3.611 -2.713 1.00 33.04 C ATOM 125 O ARG A 7 14.876 3.656 -2.541 1.00 20.31 O ATOM 126 CB ARG A 7 14.015 1.245 -3.443 1.00 1.30 C ATOM 127 CG ARG A 7 13.441 -0.154 -3.596 1.00 42.21 C ATOM 128 CD ARG A 7 13.689 -0.996 -2.355 1.00 34.34 C ATOM 129 NE ARG A 7 13.019 -2.292 -2.430 1.00 11.00 N ATOM 130 CZ ARG A 7 13.318 -3.321 -1.644 1.00 52.44 C ATOM 131 NH1 ARG A 7 14.270 -3.205 -0.729 1.00 32.02 N ATOM 132 NH2 ARG A 7 12.664 -4.468 -1.774 1.00 15.35 N ATOM 0 H ARG A 7 12.464 2.376 -5.117 1.00 40.42 H new ATOM 0 HA ARG A 7 12.394 1.956 -2.224 1.00 2.40 H new ATOM 0 HB2 ARG A 7 14.504 1.532 -4.374 1.00 1.30 H new ATOM 0 HB3 ARG A 7 14.784 1.231 -2.671 1.00 1.30 H new ATOM 0 HG2 ARG A 7 12.370 -0.090 -3.786 1.00 42.21 H new ATOM 0 HG3 ARG A 7 13.890 -0.640 -4.462 1.00 42.21 H new ATOM 0 HD2 ARG A 7 14.761 -1.149 -2.229 1.00 34.34 H new ATOM 0 HD3 ARG A 7 13.338 -0.457 -1.475 1.00 34.34 H new ATOM 0 HE ARG A 7 12.281 -2.414 -3.124 1.00 11.00 H new ATOM 0 HH11 ARG A 7 14.775 -2.325 -0.627 1.00 32.02 H new ATOM 0 HH12 ARG A 7 14.498 -3.996 -0.127 1.00 32.02 H new ATOM 0 HH21 ARG A 7 11.931 -4.560 -2.478 1.00 15.35 H new ATOM 0 HH22 ARG A 7 12.894 -5.257 -1.170 1.00 15.35 H new ATOM 146 N ASP A 8 12.871 4.674 -2.591 1.00 14.10 N ATOM 147 CA ASP A 8 13.405 5.985 -2.240 1.00 32.24 C ATOM 148 C ASP A 8 14.357 6.491 -3.319 1.00 23.54 C ATOM 149 O ASP A 8 15.414 7.046 -3.017 1.00 52.43 O ATOM 150 CB ASP A 8 14.128 5.920 -0.893 1.00 54.32 C ATOM 151 CG ASP A 8 14.175 7.266 -0.197 1.00 2.04 C ATOM 152 OD1 ASP A 8 13.099 7.862 0.016 1.00 52.13 O ATOM 153 OD2 ASP A 8 15.289 7.724 0.135 1.00 30.45 O ATOM 0 H ASP A 8 11.861 4.654 -2.730 1.00 14.10 H new ATOM 0 HA ASP A 8 12.570 6.682 -2.163 1.00 32.24 H new ATOM 0 HB2 ASP A 8 13.626 5.198 -0.249 1.00 54.32 H new ATOM 0 HB3 ASP A 8 15.144 5.558 -1.046 1.00 54.32 H new ATOM 158 N TYR A 9 13.977 6.293 -4.576 1.00 11.12 N ATOM 159 CA TYR A 9 14.799 6.726 -5.700 1.00 34.11 C ATOM 160 C TYR A 9 16.208 6.151 -5.597 1.00 41.14 C ATOM 161 O TYR A 9 17.181 6.788 -5.999 1.00 11.55 O ATOM 162 CB TYR A 9 14.861 8.253 -5.755 1.00 3.23 C ATOM 163 CG TYR A 9 13.520 8.922 -5.556 1.00 72.21 C ATOM 164 CD1 TYR A 9 13.025 9.166 -4.281 1.00 51.01 C ATOM 165 CD2 TYR A 9 12.748 9.310 -6.644 1.00 54.31 C ATOM 166 CE1 TYR A 9 11.799 9.776 -4.095 1.00 64.13 C ATOM 167 CE2 TYR A 9 11.522 9.922 -6.468 1.00 14.23 C ATOM 168 CZ TYR A 9 11.052 10.152 -5.192 1.00 13.35 C ATOM 169 OH TYR A 9 9.831 10.761 -5.011 1.00 1.44 O ATOM 0 H TYR A 9 13.105 5.836 -4.843 1.00 11.12 H new ATOM 0 HA TYR A 9 14.341 6.355 -6.617 1.00 34.11 H new ATOM 0 HB2 TYR A 9 15.551 8.608 -4.990 1.00 3.23 H new ATOM 0 HB3 TYR A 9 15.270 8.557 -6.719 1.00 3.23 H new ATOM 0 HD1 TYR A 9 13.608 8.874 -3.420 1.00 51.01 H new ATOM 0 HD2 TYR A 9 13.113 9.130 -7.645 1.00 54.31 H new ATOM 0 HE1 TYR A 9 11.428 9.957 -3.097 1.00 64.13 H new ATOM 0 HE2 TYR A 9 10.935 10.219 -7.325 1.00 14.23 H new ATOM 0 HH TYR A 9 9.434 10.963 -5.884 1.00 1.44 H new ATOM 179 N ASN A 10 16.309 4.941 -5.057 1.00 72.12 N ATOM 180 CA ASN A 10 17.599 4.278 -4.901 1.00 54.43 C ATOM 181 C ASN A 10 17.819 3.250 -6.006 1.00 71.33 C ATOM 182 O ASN A 10 18.692 3.416 -6.859 1.00 14.34 O ATOM 183 CB ASN A 10 17.685 3.600 -3.533 1.00 33.33 C ATOM 184 CG ASN A 10 17.610 4.593 -2.389 1.00 70.11 C ATOM 185 OD1 ASN A 10 17.771 5.797 -2.587 1.00 14.42 O ATOM 186 ND2 ASN A 10 17.365 4.091 -1.184 1.00 64.55 N ATOM 0 H ASN A 10 15.513 4.399 -4.720 1.00 72.12 H new ATOM 0 HA ASN A 10 18.380 5.035 -4.973 1.00 54.43 H new ATOM 0 HB2 ASN A 10 16.874 2.878 -3.437 1.00 33.33 H new ATOM 0 HB3 ASN A 10 18.619 3.042 -3.465 1.00 33.33 H new ATOM 0 HD21 ASN A 10 17.304 4.711 -0.376 1.00 64.55 H new ATOM 0 HD22 ASN A 10 17.238 3.086 -1.066 1.00 64.55 H new ATOM 193 N ASP A 11 17.022 2.187 -5.985 1.00 53.32 N ATOM 194 CA ASP A 11 17.128 1.132 -6.986 1.00 32.11 C ATOM 195 C ASP A 11 15.913 0.211 -6.936 1.00 15.15 C ATOM 196 O ASP A 11 16.013 -0.943 -6.520 1.00 13.21 O ATOM 197 CB ASP A 11 18.407 0.321 -6.770 1.00 14.33 C ATOM 198 CG ASP A 11 19.575 0.858 -7.572 1.00 42.34 C ATOM 199 OD1 ASP A 11 19.371 1.213 -8.752 1.00 11.31 O ATOM 200 OD2 ASP A 11 20.694 0.923 -7.021 1.00 63.24 O ATOM 0 H ASP A 11 16.296 2.033 -5.286 1.00 53.32 H new ATOM 0 HA ASP A 11 17.166 1.601 -7.969 1.00 32.11 H new ATOM 0 HB2 ASP A 11 18.664 0.328 -5.711 1.00 14.33 H new ATOM 0 HB3 ASP A 11 18.226 -0.718 -7.047 1.00 14.33 H new ATOM 205 N ALA A 12 14.765 0.730 -7.361 1.00 3.14 N ATOM 206 CA ALA A 12 13.531 -0.045 -7.365 1.00 21.42 C ATOM 207 C ALA A 12 13.573 -1.138 -8.428 1.00 54.52 C ATOM 208 O ALA A 12 12.994 -2.210 -8.253 1.00 53.11 O ATOM 209 CB ALA A 12 12.335 0.868 -7.589 1.00 71.45 C ATOM 0 H ALA A 12 14.665 1.684 -7.707 1.00 3.14 H new ATOM 0 HA ALA A 12 13.429 -0.525 -6.392 1.00 21.42 H new ATOM 0 HB1 ALA A 12 11.420 0.276 -7.590 1.00 71.45 H new ATOM 0 HB2 ALA A 12 12.288 1.608 -6.790 1.00 71.45 H new ATOM 0 HB3 ALA A 12 12.439 1.376 -8.548 1.00 71.45 H new ATOM 215 N ASP A 13 14.260 -0.858 -9.530 1.00 54.22 N ATOM 216 CA ASP A 13 14.377 -1.817 -10.622 1.00 73.13 C ATOM 217 C ASP A 13 14.861 -3.169 -10.108 1.00 60.23 C ATOM 218 O ASP A 13 14.384 -4.217 -10.543 1.00 54.34 O ATOM 219 CB ASP A 13 15.336 -1.291 -11.691 1.00 54.43 C ATOM 220 CG ASP A 13 16.768 -1.219 -11.200 1.00 31.34 C ATOM 221 OD1 ASP A 13 17.489 -2.230 -11.327 1.00 25.32 O ATOM 222 OD2 ASP A 13 17.167 -0.153 -10.687 1.00 1.42 O ATOM 0 H ASP A 13 14.744 0.025 -9.691 1.00 54.22 H new ATOM 0 HA ASP A 13 13.389 -1.949 -11.064 1.00 73.13 H new ATOM 0 HB2 ASP A 13 15.288 -1.937 -12.568 1.00 54.43 H new ATOM 0 HB3 ASP A 13 15.013 -0.299 -12.008 1.00 54.43 H new ATOM 227 N MET A 14 15.812 -3.138 -9.181 1.00 5.21 N ATOM 228 CA MET A 14 16.361 -4.361 -8.608 1.00 22.32 C ATOM 229 C MET A 14 15.256 -5.224 -8.008 1.00 34.12 C ATOM 230 O MET A 14 15.375 -6.447 -7.945 1.00 23.22 O ATOM 231 CB MET A 14 17.401 -4.027 -7.537 1.00 10.53 C ATOM 232 CG MET A 14 18.826 -3.991 -8.063 1.00 44.04 C ATOM 233 SD MET A 14 19.938 -3.053 -6.997 1.00 72.51 S ATOM 234 CE MET A 14 21.530 -3.656 -7.554 1.00 51.24 C ATOM 0 H MET A 14 16.219 -2.279 -8.810 1.00 5.21 H new ATOM 0 HA MET A 14 16.842 -4.923 -9.409 1.00 22.32 H new ATOM 0 HB2 MET A 14 17.160 -3.059 -7.098 1.00 10.53 H new ATOM 0 HB3 MET A 14 17.336 -4.765 -6.737 1.00 10.53 H new ATOM 0 HG2 MET A 14 19.198 -5.011 -8.162 1.00 44.04 H new ATOM 0 HG3 MET A 14 18.830 -3.552 -9.061 1.00 44.04 H new ATOM 0 HE1 MET A 14 22.323 -3.168 -6.987 1.00 51.24 H new ATOM 0 HE2 MET A 14 21.585 -4.734 -7.400 1.00 51.24 H new ATOM 0 HE3 MET A 14 21.653 -3.434 -8.614 1.00 51.24 H new ATOM 244 N ALA A 15 14.180 -4.579 -7.568 1.00 43.31 N ATOM 245 CA ALA A 15 13.053 -5.288 -6.975 1.00 3.41 C ATOM 246 C ALA A 15 12.454 -6.287 -7.959 1.00 1.14 C ATOM 247 O ALA A 15 11.756 -7.220 -7.562 1.00 23.40 O ATOM 248 CB ALA A 15 11.993 -4.300 -6.512 1.00 0.53 C ATOM 0 H ALA A 15 14.065 -3.566 -7.611 1.00 43.31 H new ATOM 0 HA ALA A 15 13.419 -5.843 -6.111 1.00 3.41 H new ATOM 0 HB1 ALA A 15 11.157 -4.843 -6.071 1.00 0.53 H new ATOM 0 HB2 ALA A 15 12.422 -3.628 -5.768 1.00 0.53 H new ATOM 0 HB3 ALA A 15 11.640 -3.720 -7.364 1.00 0.53 H new ATOM 254 N ARG A 16 12.730 -6.084 -9.243 1.00 22.33 N ATOM 255 CA ARG A 16 12.216 -6.967 -10.283 1.00 44.12 C ATOM 256 C ARG A 16 12.820 -8.363 -10.159 1.00 13.05 C ATOM 257 O ARG A 16 12.254 -9.341 -10.649 1.00 22.42 O ATOM 258 CB ARG A 16 12.520 -6.390 -11.667 1.00 64.10 C ATOM 259 CG ARG A 16 11.799 -7.106 -12.797 1.00 65.32 C ATOM 260 CD ARG A 16 12.479 -6.860 -14.135 1.00 74.44 C ATOM 261 NE ARG A 16 12.498 -8.060 -14.968 1.00 71.11 N ATOM 262 CZ ARG A 16 11.409 -8.601 -15.502 1.00 72.44 C ATOM 263 NH1 ARG A 16 10.220 -8.052 -15.292 1.00 64.44 N ATOM 264 NH2 ARG A 16 11.507 -9.694 -16.249 1.00 45.21 N ATOM 0 H ARG A 16 13.306 -5.316 -9.588 1.00 22.33 H new ATOM 0 HA ARG A 16 11.136 -7.045 -10.158 1.00 44.12 H new ATOM 0 HB2 ARG A 16 12.243 -5.336 -11.681 1.00 64.10 H new ATOM 0 HB3 ARG A 16 13.594 -6.439 -11.844 1.00 64.10 H new ATOM 0 HG2 ARG A 16 11.772 -8.176 -12.593 1.00 65.32 H new ATOM 0 HG3 ARG A 16 10.765 -6.764 -12.845 1.00 65.32 H new ATOM 0 HD2 ARG A 16 11.961 -6.060 -14.663 1.00 74.44 H new ATOM 0 HD3 ARG A 16 13.501 -6.520 -13.965 1.00 74.44 H new ATOM 0 HE ARG A 16 13.397 -8.507 -15.149 1.00 71.11 H new ATOM 0 HH11 ARG A 16 10.140 -7.212 -14.719 1.00 64.44 H new ATOM 0 HH12 ARG A 16 9.385 -8.470 -15.704 1.00 64.44 H new ATOM 0 HH21 ARG A 16 12.419 -10.119 -16.413 1.00 45.21 H new ATOM 0 HH22 ARG A 16 10.670 -10.109 -16.659 1.00 45.21 H new ATOM 278 N LEU A 17 13.970 -8.448 -9.500 1.00 45.24 N ATOM 279 CA LEU A 17 14.651 -9.724 -9.311 1.00 64.14 C ATOM 280 C LEU A 17 13.703 -10.766 -8.728 1.00 31.23 C ATOM 281 O LEU A 17 13.855 -11.964 -8.969 1.00 72.45 O ATOM 282 CB LEU A 17 15.862 -9.548 -8.392 1.00 55.44 C ATOM 283 CG LEU A 17 17.199 -9.290 -9.086 1.00 44.44 C ATOM 284 CD1 LEU A 17 17.739 -7.918 -8.712 1.00 40.12 C ATOM 285 CD2 LEU A 17 18.204 -10.376 -8.729 1.00 53.41 C ATOM 0 H LEU A 17 14.451 -7.648 -9.087 1.00 45.24 H new ATOM 0 HA LEU A 17 14.991 -10.074 -10.286 1.00 64.14 H new ATOM 0 HB2 LEU A 17 15.661 -8.718 -7.714 1.00 55.44 H new ATOM 0 HB3 LEU A 17 15.961 -10.444 -7.779 1.00 55.44 H new ATOM 0 HG LEU A 17 17.037 -9.313 -10.164 1.00 44.44 H new ATOM 0 HD11 LEU A 17 18.691 -7.752 -9.216 1.00 40.12 H new ATOM 0 HD12 LEU A 17 17.028 -7.151 -9.019 1.00 40.12 H new ATOM 0 HD13 LEU A 17 17.885 -7.866 -7.633 1.00 40.12 H new ATOM 0 HD21 LEU A 17 19.150 -10.176 -9.232 1.00 53.41 H new ATOM 0 HD22 LEU A 17 18.362 -10.386 -7.650 1.00 53.41 H new ATOM 0 HD23 LEU A 17 17.821 -11.345 -9.048 1.00 53.41 H new ATOM 297 N LEU A 18 12.723 -10.302 -7.960 1.00 30.41 N ATOM 298 CA LEU A 18 11.747 -11.194 -7.343 1.00 60.10 C ATOM 299 C LEU A 18 11.132 -12.129 -8.380 1.00 12.34 C ATOM 300 O LEU A 18 10.858 -13.294 -8.093 1.00 41.33 O ATOM 301 CB LEU A 18 10.648 -10.382 -6.656 1.00 31.14 C ATOM 302 CG LEU A 18 10.135 -10.937 -5.326 1.00 44.11 C ATOM 303 CD1 LEU A 18 11.225 -10.877 -4.267 1.00 42.10 C ATOM 304 CD2 LEU A 18 8.902 -10.172 -4.869 1.00 0.21 C ATOM 0 H LEU A 18 12.583 -9.314 -7.750 1.00 30.41 H new ATOM 0 HA LEU A 18 12.264 -11.798 -6.597 1.00 60.10 H new ATOM 0 HB2 LEU A 18 11.023 -9.373 -6.485 1.00 31.14 H new ATOM 0 HB3 LEU A 18 9.804 -10.297 -7.341 1.00 31.14 H new ATOM 0 HG LEU A 18 9.857 -11.981 -5.473 1.00 44.11 H new ATOM 0 HD11 LEU A 18 10.842 -11.276 -3.328 1.00 42.10 H new ATOM 0 HD12 LEU A 18 12.080 -11.470 -4.591 1.00 42.10 H new ATOM 0 HD13 LEU A 18 11.535 -9.842 -4.122 1.00 42.10 H new ATOM 0 HD21 LEU A 18 8.551 -10.580 -3.921 1.00 0.21 H new ATOM 0 HD22 LEU A 18 9.154 -9.120 -4.739 1.00 0.21 H new ATOM 0 HD23 LEU A 18 8.116 -10.267 -5.618 1.00 0.21 H new ATOM 316 N GLU A 19 10.919 -11.610 -9.585 1.00 3.41 N ATOM 317 CA GLU A 19 10.338 -12.399 -10.664 1.00 73.12 C ATOM 318 C GLU A 19 11.100 -13.708 -10.853 1.00 12.33 C ATOM 319 O GLU A 19 10.530 -14.714 -11.275 1.00 1.52 O ATOM 320 CB GLU A 19 10.342 -11.601 -11.970 1.00 3.25 C ATOM 321 CG GLU A 19 9.255 -12.021 -12.944 1.00 31.20 C ATOM 322 CD GLU A 19 7.867 -11.638 -12.469 1.00 75.53 C ATOM 323 OE1 GLU A 19 7.353 -12.302 -11.544 1.00 54.04 O ATOM 324 OE2 GLU A 19 7.294 -10.677 -13.022 1.00 50.54 O ATOM 0 H GLU A 19 11.140 -10.647 -9.838 1.00 3.41 H new ATOM 0 HA GLU A 19 9.309 -12.634 -10.393 1.00 73.12 H new ATOM 0 HB2 GLU A 19 10.222 -10.542 -11.739 1.00 3.25 H new ATOM 0 HB3 GLU A 19 11.313 -11.714 -12.452 1.00 3.25 H new ATOM 0 HG2 GLU A 19 9.443 -11.560 -13.914 1.00 31.20 H new ATOM 0 HG3 GLU A 19 9.300 -13.100 -13.090 1.00 31.20 H new ATOM 331 N GLN A 20 12.391 -13.685 -10.537 1.00 53.52 N ATOM 332 CA GLN A 20 13.231 -14.868 -10.673 1.00 61.31 C ATOM 333 C GLN A 20 12.668 -16.032 -9.863 1.00 50.43 C ATOM 334 O GLN A 20 12.894 -17.196 -10.192 1.00 63.10 O ATOM 335 CB GLN A 20 14.659 -14.560 -10.220 1.00 64.42 C ATOM 336 CG GLN A 20 15.668 -15.624 -10.624 1.00 1.42 C ATOM 337 CD GLN A 20 16.458 -16.156 -9.445 1.00 30.24 C ATOM 338 OE1 GLN A 20 16.694 -15.444 -8.468 1.00 70.21 O ATOM 339 NE2 GLN A 20 16.871 -17.415 -9.529 1.00 24.32 N ATOM 0 H GLN A 20 12.877 -12.860 -10.185 1.00 53.52 H new ATOM 0 HA GLN A 20 13.244 -15.154 -11.725 1.00 61.31 H new ATOM 0 HB2 GLN A 20 14.966 -13.602 -10.640 1.00 64.42 H new ATOM 0 HB3 GLN A 20 14.672 -14.452 -9.135 1.00 64.42 H new ATOM 0 HG2 GLN A 20 15.146 -16.449 -11.109 1.00 1.42 H new ATOM 0 HG3 GLN A 20 16.356 -15.206 -11.359 1.00 1.42 H new ATOM 0 HE21 GLN A 20 16.653 -17.969 -10.357 1.00 24.32 H new ATOM 0 HE22 GLN A 20 17.406 -17.828 -8.765 1.00 24.32 H new ATOM 348 N TRP A 21 11.935 -15.708 -8.804 1.00 74.24 N ATOM 349 CA TRP A 21 11.339 -16.727 -7.947 1.00 64.22 C ATOM 350 C TRP A 21 10.210 -17.454 -8.669 1.00 51.20 C ATOM 351 O TRP A 21 10.065 -18.670 -8.547 1.00 44.33 O ATOM 352 CB TRP A 21 10.813 -16.095 -6.658 1.00 4.52 C ATOM 353 CG TRP A 21 11.901 -15.661 -5.722 1.00 42.44 C ATOM 354 CD1 TRP A 21 12.793 -14.645 -5.918 1.00 23.33 C ATOM 355 CD2 TRP A 21 12.212 -16.231 -4.446 1.00 41.24 C ATOM 356 NE1 TRP A 21 13.640 -14.550 -4.840 1.00 3.11 N ATOM 357 CE2 TRP A 21 13.304 -15.511 -3.923 1.00 50.33 C ATOM 358 CE3 TRP A 21 11.673 -17.278 -3.694 1.00 3.20 C ATOM 359 CZ2 TRP A 21 13.865 -15.807 -2.684 1.00 44.31 C ATOM 360 CZ3 TRP A 21 12.232 -17.570 -2.464 1.00 71.54 C ATOM 361 CH2 TRP A 21 13.318 -16.837 -1.969 1.00 0.12 C ATOM 0 H TRP A 21 11.739 -14.749 -8.518 1.00 74.24 H new ATOM 0 HA TRP A 21 12.112 -17.454 -7.698 1.00 64.22 H new ATOM 0 HB2 TRP A 21 10.195 -15.233 -6.910 1.00 4.52 H new ATOM 0 HB3 TRP A 21 10.168 -16.811 -6.148 1.00 4.52 H new ATOM 0 HD1 TRP A 21 12.827 -14.010 -6.791 1.00 23.33 H new ATOM 0 HE1 TRP A 21 14.397 -13.873 -4.739 1.00 3.11 H new ATOM 0 HE3 TRP A 21 10.835 -17.849 -4.067 1.00 3.20 H new ATOM 0 HZ2 TRP A 21 14.703 -15.243 -2.301 1.00 44.31 H new ATOM 0 HZ3 TRP A 21 11.824 -18.378 -1.874 1.00 71.54 H new ATOM 0 HH2 TRP A 21 13.732 -17.090 -1.004 1.00 0.12 H new ATOM 372 N GLU A 22 9.412 -16.701 -9.420 1.00 44.14 N ATOM 373 CA GLU A 22 8.295 -17.276 -10.161 1.00 4.41 C ATOM 374 C GLU A 22 8.762 -18.437 -11.034 1.00 53.35 C ATOM 375 O GLU A 22 8.483 -19.600 -10.742 1.00 42.21 O ATOM 376 CB GLU A 22 7.626 -16.207 -11.028 1.00 62.32 C ATOM 377 CG GLU A 22 6.629 -15.346 -10.271 1.00 45.53 C ATOM 378 CD GLU A 22 7.186 -14.825 -8.960 1.00 73.12 C ATOM 379 OE1 GLU A 22 8.143 -14.025 -8.997 1.00 43.22 O ATOM 380 OE2 GLU A 22 6.662 -15.219 -7.897 1.00 3.34 O ATOM 0 H GLU A 22 9.518 -15.693 -9.531 1.00 44.14 H new ATOM 0 HA GLU A 22 7.570 -17.655 -9.441 1.00 4.41 H new ATOM 0 HB2 GLU A 22 8.396 -15.565 -11.457 1.00 62.32 H new ATOM 0 HB3 GLU A 22 7.116 -16.693 -11.860 1.00 62.32 H new ATOM 0 HG2 GLU A 22 6.334 -14.504 -10.896 1.00 45.53 H new ATOM 0 HG3 GLU A 22 5.729 -15.928 -10.073 1.00 45.53 H new ATOM 387 N LYS A 23 9.473 -18.113 -12.109 1.00 53.50 N ATOM 388 CA LYS A 23 9.979 -19.126 -13.026 1.00 63.34 C ATOM 389 C LYS A 23 8.841 -19.981 -13.575 1.00 42.34 C ATOM 390 O LYS A 23 9.051 -21.123 -13.984 1.00 2.10 O ATOM 391 CB LYS A 23 11.004 -20.016 -12.320 1.00 23.41 C ATOM 392 CG LYS A 23 12.039 -20.614 -13.257 1.00 62.31 C ATOM 393 CD LYS A 23 12.569 -21.938 -12.732 1.00 10.15 C ATOM 394 CE LYS A 23 11.768 -23.113 -13.272 1.00 44.20 C ATOM 395 NZ LYS A 23 12.622 -24.314 -13.487 1.00 2.23 N ATOM 0 H LYS A 23 9.712 -17.155 -12.366 1.00 53.50 H new ATOM 0 HA LYS A 23 10.462 -18.616 -13.860 1.00 63.34 H new ATOM 0 HB2 LYS A 23 11.514 -19.431 -11.555 1.00 23.41 H new ATOM 0 HB3 LYS A 23 10.480 -20.823 -11.808 1.00 23.41 H new ATOM 0 HG2 LYS A 23 11.596 -20.763 -14.242 1.00 62.31 H new ATOM 0 HG3 LYS A 23 12.865 -19.914 -13.382 1.00 62.31 H new ATOM 0 HD2 LYS A 23 13.616 -22.050 -13.014 1.00 10.15 H new ATOM 0 HD3 LYS A 23 12.531 -21.940 -11.643 1.00 10.15 H new ATOM 0 HE2 LYS A 23 10.967 -23.357 -12.575 1.00 44.20 H new ATOM 0 HE3 LYS A 23 11.297 -22.829 -14.213 1.00 44.20 H new ATOM 0 HZ1 LYS A 23 12.039 -25.093 -13.855 1.00 2.23 H new ATOM 0 HZ2 LYS A 23 13.372 -24.089 -14.172 1.00 2.23 H new ATOM 0 HZ3 LYS A 23 13.052 -24.600 -12.584 1.00 2.23 H new ATOM 409 N ASP A 24 7.637 -19.420 -13.583 1.00 41.31 N ATOM 410 CA ASP A 24 6.466 -20.130 -14.085 1.00 1.53 C ATOM 411 C ASP A 24 6.502 -20.230 -15.606 1.00 52.35 C ATOM 412 O ASP A 24 5.916 -21.140 -16.192 1.00 62.35 O ATOM 413 CB ASP A 24 5.185 -19.423 -13.638 1.00 20.54 C ATOM 414 CG ASP A 24 4.703 -19.903 -12.283 1.00 14.33 C ATOM 415 OD1 ASP A 24 5.551 -20.110 -11.390 1.00 41.34 O ATOM 416 OD2 ASP A 24 3.476 -20.072 -12.115 1.00 4.53 O ATOM 0 H ASP A 24 7.446 -18.476 -13.248 1.00 41.31 H new ATOM 0 HA ASP A 24 6.478 -21.139 -13.672 1.00 1.53 H new ATOM 0 HB2 ASP A 24 5.361 -18.348 -13.598 1.00 20.54 H new ATOM 0 HB3 ASP A 24 4.403 -19.590 -14.379 1.00 20.54 H new ATOM 421 N ASP A 25 7.192 -19.288 -16.240 1.00 54.41 N ATOM 422 CA ASP A 25 7.304 -19.269 -17.694 1.00 31.50 C ATOM 423 C ASP A 25 5.937 -19.070 -18.342 1.00 44.11 C ATOM 424 O ASP A 25 5.581 -19.769 -19.290 1.00 60.35 O ATOM 425 CB ASP A 25 7.934 -20.570 -18.194 1.00 44.04 C ATOM 426 CG ASP A 25 8.550 -20.422 -19.572 1.00 74.52 C ATOM 427 OD1 ASP A 25 8.546 -19.293 -20.106 1.00 23.20 O ATOM 428 OD2 ASP A 25 9.035 -21.436 -20.116 1.00 50.03 O ATOM 0 H ASP A 25 7.682 -18.527 -15.770 1.00 54.41 H new ATOM 0 HA ASP A 25 7.944 -18.432 -17.974 1.00 31.50 H new ATOM 0 HB2 ASP A 25 8.700 -20.894 -17.489 1.00 44.04 H new ATOM 0 HB3 ASP A 25 7.175 -21.351 -18.221 1.00 44.04 H new ATOM 433 N ASP A 26 5.177 -18.112 -17.823 1.00 74.43 N ATOM 434 CA ASP A 26 3.849 -17.821 -18.351 1.00 51.42 C ATOM 435 C ASP A 26 3.939 -17.249 -19.763 1.00 31.22 C ATOM 436 O ASP A 26 3.021 -17.410 -20.568 1.00 20.43 O ATOM 437 CB ASP A 26 3.117 -16.838 -17.436 1.00 3.14 C ATOM 438 CG ASP A 26 1.657 -16.675 -17.810 1.00 22.01 C ATOM 439 OD1 ASP A 26 1.382 -16.212 -18.936 1.00 61.34 O ATOM 440 OD2 ASP A 26 0.790 -17.010 -16.976 1.00 13.52 O ATOM 0 H ASP A 26 5.457 -17.524 -17.038 1.00 74.43 H new ATOM 0 HA ASP A 26 3.288 -18.755 -18.391 1.00 51.42 H new ATOM 0 HB2 ASP A 26 3.188 -17.184 -16.405 1.00 3.14 H new ATOM 0 HB3 ASP A 26 3.611 -15.867 -17.481 1.00 3.14 H new ATOM 445 N ILE A 27 5.049 -16.581 -20.055 1.00 44.23 N ATOM 446 CA ILE A 27 5.259 -15.986 -21.369 1.00 55.24 C ATOM 447 C ILE A 27 6.470 -16.598 -22.063 1.00 45.05 C ATOM 448 O ILE A 27 7.073 -17.545 -21.560 1.00 22.13 O ATOM 449 CB ILE A 27 5.452 -14.461 -21.273 1.00 24.04 C ATOM 450 CG1 ILE A 27 6.739 -14.136 -20.512 1.00 4.13 C ATOM 451 CG2 ILE A 27 4.253 -13.817 -20.595 1.00 15.45 C ATOM 452 CD1 ILE A 27 7.899 -13.775 -21.413 1.00 4.01 C ATOM 0 H ILE A 27 5.817 -16.438 -19.399 1.00 44.23 H new ATOM 0 HA ILE A 27 4.364 -16.194 -21.955 1.00 55.24 H new ATOM 0 HB ILE A 27 5.535 -14.056 -22.281 1.00 24.04 H new ATOM 0 HG12 ILE A 27 6.548 -13.308 -19.829 1.00 4.13 H new ATOM 0 HG13 ILE A 27 7.017 -14.995 -19.902 1.00 4.13 H new ATOM 0 HG21 ILE A 27 4.405 -12.739 -20.535 1.00 15.45 H new ATOM 0 HG22 ILE A 27 3.353 -14.025 -21.173 1.00 15.45 H new ATOM 0 HG23 ILE A 27 4.141 -14.224 -19.590 1.00 15.45 H new ATOM 0 HD11 ILE A 27 8.777 -13.557 -20.806 1.00 4.01 H new ATOM 0 HD12 ILE A 27 8.116 -14.610 -22.079 1.00 4.01 H new ATOM 0 HD13 ILE A 27 7.640 -12.897 -22.005 1.00 4.01 H new ATOM 1035 N THR A 64 19.253 3.570 -22.813 1.00 52.40 N ATOM 1036 CA THR A 64 17.837 3.898 -22.702 1.00 40.15 C ATOM 1037 C THR A 64 17.147 3.014 -21.670 1.00 61.10 C ATOM 1038 O THR A 64 17.563 1.879 -21.432 1.00 1.21 O ATOM 1039 CB THR A 64 17.118 3.745 -24.056 1.00 34.22 C ATOM 1040 OG1 THR A 64 15.791 4.278 -23.969 1.00 23.33 O ATOM 1041 CG2 THR A 64 17.056 2.283 -24.473 1.00 52.34 C ATOM 0 HA THR A 64 17.777 4.938 -22.382 1.00 40.15 H new ATOM 0 HB THR A 64 17.683 4.297 -24.807 1.00 34.22 H new ATOM 0 HG1 THR A 64 15.341 4.179 -24.834 1.00 23.33 H new ATOM 0 HG21 THR A 64 16.544 2.199 -25.432 1.00 52.34 H new ATOM 0 HG22 THR A 64 18.068 1.888 -24.566 1.00 52.34 H new ATOM 0 HG23 THR A 64 16.512 1.713 -23.720 1.00 52.34 H new ATOM 1049 N LEU A 65 16.090 3.539 -21.060 1.00 5.12 N ATOM 1050 CA LEU A 65 15.341 2.796 -20.052 1.00 42.42 C ATOM 1051 C LEU A 65 13.921 2.511 -20.530 1.00 50.40 C ATOM 1052 O LEU A 65 13.153 3.432 -20.808 1.00 71.21 O ATOM 1053 CB LEU A 65 15.302 3.578 -18.738 1.00 42.41 C ATOM 1054 CG LEU A 65 14.354 3.041 -17.665 1.00 51.45 C ATOM 1055 CD1 LEU A 65 14.610 1.563 -17.418 1.00 23.10 C ATOM 1056 CD2 LEU A 65 14.504 3.834 -16.375 1.00 65.02 C ATOM 0 H LEU A 65 15.732 4.476 -21.246 1.00 5.12 H new ATOM 0 HA LEU A 65 15.847 1.845 -19.886 1.00 42.42 H new ATOM 0 HB2 LEU A 65 16.310 3.604 -18.324 1.00 42.41 H new ATOM 0 HB3 LEU A 65 15.022 4.608 -18.959 1.00 42.41 H new ATOM 0 HG LEU A 65 13.330 3.156 -18.021 1.00 51.45 H new ATOM 0 HD11 LEU A 65 13.926 1.198 -16.651 1.00 23.10 H new ATOM 0 HD12 LEU A 65 14.450 1.007 -18.342 1.00 23.10 H new ATOM 0 HD13 LEU A 65 15.638 1.423 -17.084 1.00 23.10 H new ATOM 0 HD21 LEU A 65 13.822 3.438 -15.623 1.00 65.02 H new ATOM 0 HD22 LEU A 65 15.529 3.751 -16.014 1.00 65.02 H new ATOM 0 HD23 LEU A 65 14.269 4.882 -16.562 1.00 65.02 H new ATOM 1068 N MET A 66 13.579 1.230 -20.621 1.00 14.52 N ATOM 1069 CA MET A 66 12.249 0.825 -21.062 1.00 21.44 C ATOM 1070 C MET A 66 11.992 -0.643 -20.735 1.00 24.04 C ATOM 1071 O MET A 66 12.647 -1.533 -21.276 1.00 44.25 O ATOM 1072 CB MET A 66 12.093 1.059 -22.565 1.00 63.14 C ATOM 1073 CG MET A 66 10.741 1.634 -22.954 1.00 72.30 C ATOM 1074 SD MET A 66 10.778 2.481 -24.545 1.00 55.21 S ATOM 1075 CE MET A 66 11.042 4.173 -24.021 1.00 45.44 C ATOM 0 H MET A 66 14.203 0.456 -20.396 1.00 14.52 H new ATOM 0 HA MET A 66 11.517 1.432 -20.530 1.00 21.44 H new ATOM 0 HB2 MET A 66 12.877 1.737 -22.902 1.00 63.14 H new ATOM 0 HB3 MET A 66 12.241 0.115 -23.089 1.00 63.14 H new ATOM 0 HG2 MET A 66 10.006 0.830 -22.992 1.00 72.30 H new ATOM 0 HG3 MET A 66 10.412 2.331 -22.183 1.00 72.30 H new ATOM 0 HE1 MET A 66 11.088 4.822 -24.896 1.00 45.44 H new ATOM 0 HE2 MET A 66 10.219 4.488 -23.379 1.00 45.44 H new ATOM 0 HE3 MET A 66 11.980 4.241 -23.469 1.00 45.44 H new ATOM 1085 N MET A 67 11.036 -0.888 -19.845 1.00 53.11 N ATOM 1086 CA MET A 67 10.693 -2.248 -19.447 1.00 72.43 C ATOM 1087 C MET A 67 9.236 -2.334 -19.004 1.00 73.22 C ATOM 1088 O MET A 67 8.806 -1.611 -18.106 1.00 1.45 O ATOM 1089 CB MET A 67 11.610 -2.719 -18.317 1.00 43.40 C ATOM 1090 CG MET A 67 11.402 -4.174 -17.931 1.00 30.01 C ATOM 1091 SD MET A 67 12.842 -4.889 -17.116 1.00 23.34 S ATOM 1092 CE MET A 67 14.006 -4.950 -18.476 1.00 0.02 C ATOM 0 H MET A 67 10.485 -0.163 -19.386 1.00 53.11 H new ATOM 0 HA MET A 67 10.831 -2.898 -20.311 1.00 72.43 H new ATOM 0 HB2 MET A 67 12.648 -2.577 -18.619 1.00 43.40 H new ATOM 0 HB3 MET A 67 11.444 -2.092 -17.441 1.00 43.40 H new ATOM 0 HG2 MET A 67 10.539 -4.250 -17.269 1.00 30.01 H new ATOM 0 HG3 MET A 67 11.170 -4.753 -18.825 1.00 30.01 H new ATOM 0 HE1 MET A 67 14.985 -5.253 -18.104 1.00 0.02 H new ATOM 0 HE2 MET A 67 13.661 -5.670 -19.218 1.00 0.02 H new ATOM 0 HE3 MET A 67 14.081 -3.964 -18.935 1.00 0.02 H new ATOM 1102 N PHE A 68 8.480 -3.223 -19.641 1.00 13.14 N ATOM 1103 CA PHE A 68 7.070 -3.402 -19.312 1.00 62.05 C ATOM 1104 C PHE A 68 6.748 -4.876 -19.085 1.00 73.14 C ATOM 1105 O PHE A 68 6.906 -5.703 -19.983 1.00 61.43 O ATOM 1106 CB PHE A 68 6.189 -2.842 -20.431 1.00 62.01 C ATOM 1107 CG PHE A 68 6.652 -1.510 -20.949 1.00 32.13 C ATOM 1108 CD1 PHE A 68 6.978 -0.487 -20.073 1.00 20.11 C ATOM 1109 CD2 PHE A 68 6.761 -1.281 -22.311 1.00 21.22 C ATOM 1110 CE1 PHE A 68 7.403 0.740 -20.547 1.00 22.34 C ATOM 1111 CE2 PHE A 68 7.186 -0.057 -22.790 1.00 42.54 C ATOM 1112 CZ PHE A 68 7.509 0.955 -21.907 1.00 33.21 C ATOM 0 H PHE A 68 8.820 -3.830 -20.387 1.00 13.14 H new ATOM 0 HA PHE A 68 6.865 -2.857 -18.390 1.00 62.05 H new ATOM 0 HB2 PHE A 68 6.165 -3.555 -21.255 1.00 62.01 H new ATOM 0 HB3 PHE A 68 5.167 -2.745 -20.064 1.00 62.01 H new ATOM 0 HD1 PHE A 68 6.899 -0.650 -19.008 1.00 20.11 H new ATOM 0 HD2 PHE A 68 6.511 -2.069 -23.006 1.00 21.22 H new ATOM 0 HE1 PHE A 68 7.652 1.530 -19.854 1.00 22.34 H new ATOM 0 HE2 PHE A 68 7.266 0.109 -23.854 1.00 42.54 H new ATOM 0 HZ PHE A 68 7.844 1.912 -22.279 1.00 33.21 H new ATOM 1122 N VAL A 69 6.295 -5.197 -17.878 1.00 32.43 N ATOM 1123 CA VAL A 69 5.949 -6.571 -17.531 1.00 42.23 C ATOM 1124 C VAL A 69 4.818 -6.612 -16.510 1.00 70.01 C ATOM 1125 O VAL A 69 4.668 -5.701 -15.695 1.00 23.23 O ATOM 1126 CB VAL A 69 7.164 -7.330 -16.966 1.00 4.22 C ATOM 1127 CG1 VAL A 69 6.820 -8.793 -16.734 1.00 74.01 C ATOM 1128 CG2 VAL A 69 8.357 -7.196 -17.900 1.00 64.12 C ATOM 0 H VAL A 69 6.159 -4.525 -17.123 1.00 32.43 H new ATOM 0 HA VAL A 69 5.622 -7.057 -18.450 1.00 42.23 H new ATOM 0 HB VAL A 69 7.432 -6.888 -16.006 1.00 4.22 H new ATOM 0 HG11 VAL A 69 7.691 -9.313 -16.335 1.00 74.01 H new ATOM 0 HG12 VAL A 69 5.997 -8.865 -16.023 1.00 74.01 H new ATOM 0 HG13 VAL A 69 6.525 -9.252 -17.678 1.00 74.01 H new ATOM 0 HG21 VAL A 69 9.207 -7.738 -17.485 1.00 64.12 H new ATOM 0 HG22 VAL A 69 8.103 -7.610 -18.876 1.00 64.12 H new ATOM 0 HG23 VAL A 69 8.617 -6.143 -18.009 1.00 64.12 H new ATOM 1138 N THR A 70 4.022 -7.676 -16.559 1.00 41.21 N ATOM 1139 CA THR A 70 2.903 -7.836 -15.639 1.00 63.40 C ATOM 1140 C THR A 70 2.361 -9.261 -15.676 1.00 52.53 C ATOM 1141 O THR A 70 1.327 -9.526 -16.290 1.00 22.00 O ATOM 1142 CB THR A 70 1.762 -6.856 -15.966 1.00 54.53 C ATOM 1143 OG1 THR A 70 0.591 -7.198 -15.215 1.00 45.40 O ATOM 1144 CG2 THR A 70 1.440 -6.876 -17.453 1.00 31.20 C ATOM 0 H THR A 70 4.132 -8.440 -17.226 1.00 41.21 H new ATOM 0 HA THR A 70 3.282 -7.620 -14.640 1.00 63.40 H new ATOM 0 HB THR A 70 2.087 -5.852 -15.694 1.00 54.53 H new ATOM 0 HG1 THR A 70 0.287 -8.093 -15.473 1.00 45.40 H new ATOM 0 HG21 THR A 70 0.631 -6.176 -17.659 1.00 31.20 H new ATOM 0 HG22 THR A 70 2.324 -6.586 -18.021 1.00 31.20 H new ATOM 0 HG23 THR A 70 1.134 -7.880 -17.746 1.00 31.20 H new ATOM 1152 N VAL A 71 3.064 -10.174 -15.015 1.00 63.31 N ATOM 1153 CA VAL A 71 2.652 -11.572 -14.971 1.00 71.12 C ATOM 1154 C VAL A 71 3.583 -12.392 -14.086 1.00 64.40 C ATOM 1155 O VAL A 71 4.630 -11.910 -13.654 1.00 63.00 O ATOM 1156 CB VAL A 71 2.622 -12.193 -16.380 1.00 71.04 C ATOM 1157 CG1 VAL A 71 4.001 -12.705 -16.768 1.00 32.22 C ATOM 1158 CG2 VAL A 71 1.591 -13.309 -16.448 1.00 71.45 C ATOM 0 H VAL A 71 3.922 -9.971 -14.502 1.00 63.31 H new ATOM 0 HA VAL A 71 1.646 -11.592 -14.552 1.00 71.12 H new ATOM 0 HB VAL A 71 2.335 -11.420 -17.093 1.00 71.04 H new ATOM 0 HG11 VAL A 71 3.960 -13.140 -17.766 1.00 32.22 H new ATOM 0 HG12 VAL A 71 4.711 -11.878 -16.762 1.00 32.22 H new ATOM 0 HG13 VAL A 71 4.321 -13.464 -16.054 1.00 32.22 H new ATOM 0 HG21 VAL A 71 1.583 -13.737 -17.451 1.00 71.45 H new ATOM 0 HG22 VAL A 71 1.845 -14.084 -15.725 1.00 71.45 H new ATOM 0 HG23 VAL A 71 0.604 -12.907 -16.217 1.00 71.45 H new ATOM 1168 N SER A 72 3.196 -13.636 -13.820 1.00 54.41 N ATOM 1169 CA SER A 72 3.994 -14.523 -12.983 1.00 65.12 C ATOM 1170 C SER A 72 4.878 -15.426 -13.838 1.00 62.31 C ATOM 1171 O SER A 72 4.385 -16.203 -14.655 1.00 23.34 O ATOM 1172 CB SER A 72 3.086 -15.374 -12.093 1.00 4.30 C ATOM 1173 OG SER A 72 1.910 -15.758 -12.784 1.00 23.23 O ATOM 0 H SER A 72 2.334 -14.052 -14.173 1.00 54.41 H new ATOM 0 HA SER A 72 4.635 -13.907 -12.352 1.00 65.12 H new ATOM 0 HB2 SER A 72 3.624 -16.263 -11.763 1.00 4.30 H new ATOM 0 HB3 SER A 72 2.819 -14.812 -11.198 1.00 4.30 H new ATOM 0 HG SER A 72 1.347 -16.302 -12.195 1.00 23.23 H new ATOM 1179 N GLY A 73 6.189 -15.317 -13.643 1.00 61.34 N ATOM 1180 CA GLY A 73 7.122 -16.129 -14.403 1.00 51.01 C ATOM 1181 C GLY A 73 7.948 -15.308 -15.373 1.00 24.01 C ATOM 1182 O GLY A 73 7.466 -14.921 -16.436 1.00 42.43 O ATOM 0 H GLY A 73 6.621 -14.681 -12.973 1.00 61.34 H new ATOM 0 HA2 GLY A 73 7.787 -16.652 -13.716 1.00 51.01 H new ATOM 0 HA3 GLY A 73 6.571 -16.891 -14.954 1.00 51.01 H new ATOM 1186 N ASN A 74 9.197 -15.041 -15.005 1.00 2.43 N ATOM 1187 CA ASN A 74 10.092 -14.258 -15.849 1.00 42.04 C ATOM 1188 C ASN A 74 11.464 -14.110 -15.198 1.00 51.02 C ATOM 1189 O ASN A 74 11.800 -13.071 -14.630 1.00 40.30 O ATOM 1190 CB ASN A 74 9.493 -12.877 -16.121 1.00 54.23 C ATOM 1191 CG ASN A 74 8.892 -12.770 -17.510 1.00 34.54 C ATOM 1192 OD1 ASN A 74 7.691 -12.544 -17.663 1.00 22.42 O ATOM 1193 ND2 ASN A 74 9.726 -12.934 -18.529 1.00 43.24 N ATOM 0 H ASN A 74 9.612 -15.355 -14.128 1.00 2.43 H new ATOM 0 HA ASN A 74 10.213 -14.787 -16.794 1.00 42.04 H new ATOM 0 HB2 ASN A 74 8.724 -12.665 -15.378 1.00 54.23 H new ATOM 0 HB3 ASN A 74 10.267 -12.119 -16.004 1.00 54.23 H new ATOM 0 HD21 ASN A 74 9.379 -12.874 -19.486 1.00 43.24 H new ATOM 0 HD22 ASN A 74 10.714 -13.120 -18.355 1.00 43.24 H new ATOM 1200 N PRO A 75 12.277 -15.174 -15.282 1.00 54.31 N ATOM 1201 CA PRO A 75 13.625 -15.187 -14.708 1.00 3.21 C ATOM 1202 C PRO A 75 14.585 -14.271 -15.461 1.00 33.43 C ATOM 1203 O PRO A 75 15.103 -14.632 -16.518 1.00 25.12 O ATOM 1204 CB PRO A 75 14.058 -16.648 -14.851 1.00 34.21 C ATOM 1205 CG PRO A 75 13.259 -17.169 -15.995 1.00 73.33 C ATOM 1206 CD PRO A 75 11.942 -16.446 -15.944 1.00 54.55 C ATOM 0 HA PRO A 75 13.633 -14.824 -13.680 1.00 3.21 H new ATOM 0 HB2 PRO A 75 15.127 -16.727 -15.047 1.00 34.21 H new ATOM 0 HB3 PRO A 75 13.858 -17.211 -13.939 1.00 34.21 H new ATOM 0 HG2 PRO A 75 13.768 -16.986 -16.941 1.00 73.33 H new ATOM 0 HG3 PRO A 75 13.116 -18.246 -15.912 1.00 73.33 H new ATOM 0 HD2 PRO A 75 11.533 -16.284 -16.941 1.00 54.55 H new ATOM 0 HD3 PRO A 75 11.197 -17.008 -15.381 1.00 54.55 H new ATOM 1214 N THR A 76 14.818 -13.084 -14.910 1.00 32.14 N ATOM 1215 CA THR A 76 15.714 -12.117 -15.529 1.00 44.43 C ATOM 1216 C THR A 76 16.470 -11.314 -14.476 1.00 54.23 C ATOM 1217 O THR A 76 16.674 -10.110 -14.630 1.00 20.23 O ATOM 1218 CB THR A 76 14.946 -11.146 -16.446 1.00 4.53 C ATOM 1219 OG1 THR A 76 14.195 -10.217 -15.656 1.00 33.54 O ATOM 1220 CG2 THR A 76 14.010 -11.904 -17.374 1.00 51.11 C ATOM 0 H THR A 76 14.398 -12.770 -14.035 1.00 32.14 H new ATOM 0 HA THR A 76 16.426 -12.685 -16.128 1.00 44.43 H new ATOM 0 HB THR A 76 15.671 -10.603 -17.052 1.00 4.53 H new ATOM 0 HG1 THR A 76 14.809 -9.668 -15.125 1.00 33.54 H new ATOM 0 HG21 THR A 76 13.479 -11.197 -18.012 1.00 51.11 H new ATOM 0 HG22 THR A 76 14.588 -12.589 -17.994 1.00 51.11 H new ATOM 0 HG23 THR A 76 13.291 -12.470 -16.782 1.00 51.11 H new ATOM 1228 N GLU A 77 16.882 -11.988 -13.408 1.00 22.43 N ATOM 1229 CA GLU A 77 17.615 -11.336 -12.329 1.00 42.22 C ATOM 1230 C GLU A 77 18.788 -10.530 -12.879 1.00 5.41 C ATOM 1231 O GLU A 77 19.098 -9.446 -12.384 1.00 41.52 O ATOM 1232 CB GLU A 77 18.121 -12.374 -11.325 1.00 42.15 C ATOM 1233 CG GLU A 77 18.730 -13.604 -11.977 1.00 21.20 C ATOM 1234 CD GLU A 77 19.607 -14.395 -11.025 1.00 41.44 C ATOM 1235 OE1 GLU A 77 20.798 -14.046 -10.887 1.00 11.45 O ATOM 1236 OE2 GLU A 77 19.102 -15.363 -10.419 1.00 55.52 O ATOM 0 H GLU A 77 16.721 -12.985 -13.266 1.00 22.43 H new ATOM 0 HA GLU A 77 16.933 -10.654 -11.821 1.00 42.22 H new ATOM 0 HB2 GLU A 77 18.866 -11.909 -10.679 1.00 42.15 H new ATOM 0 HB3 GLU A 77 17.293 -12.683 -10.687 1.00 42.15 H new ATOM 0 HG2 GLU A 77 17.932 -14.247 -12.349 1.00 21.20 H new ATOM 0 HG3 GLU A 77 19.321 -13.298 -12.840 1.00 21.20 H new ATOM 1243 N LYS A 78 19.439 -11.067 -13.905 1.00 73.24 N ATOM 1244 CA LYS A 78 20.578 -10.400 -14.525 1.00 14.35 C ATOM 1245 C LYS A 78 20.131 -9.156 -15.286 1.00 2.53 C ATOM 1246 O LYS A 78 20.840 -8.150 -15.318 1.00 72.14 O ATOM 1247 CB LYS A 78 21.303 -11.358 -15.472 1.00 52.44 C ATOM 1248 CG LYS A 78 22.620 -11.877 -14.922 1.00 50.42 C ATOM 1249 CD LYS A 78 22.421 -13.132 -14.089 1.00 55.42 C ATOM 1250 CE LYS A 78 23.736 -13.633 -13.512 1.00 53.44 C ATOM 1251 NZ LYS A 78 23.771 -15.119 -13.422 1.00 4.43 N ATOM 0 H LYS A 78 19.197 -11.964 -14.326 1.00 73.24 H new ATOM 0 HA LYS A 78 21.263 -10.094 -13.734 1.00 14.35 H new ATOM 0 HB2 LYS A 78 20.651 -12.204 -15.689 1.00 52.44 H new ATOM 0 HB3 LYS A 78 21.489 -10.849 -16.418 1.00 52.44 H new ATOM 0 HG2 LYS A 78 23.301 -12.091 -15.746 1.00 50.42 H new ATOM 0 HG3 LYS A 78 23.090 -11.105 -14.312 1.00 50.42 H new ATOM 0 HD2 LYS A 78 21.722 -12.925 -13.278 1.00 55.42 H new ATOM 0 HD3 LYS A 78 21.972 -13.911 -14.705 1.00 55.42 H new ATOM 0 HE2 LYS A 78 24.561 -13.287 -14.135 1.00 53.44 H new ATOM 0 HE3 LYS A 78 23.884 -13.205 -12.520 1.00 53.44 H new ATOM 0 HZ1 LYS A 78 24.683 -15.421 -13.024 1.00 4.43 H new ATOM 0 HZ2 LYS A 78 22.999 -15.448 -12.807 1.00 4.43 H new ATOM 0 HZ3 LYS A 78 23.655 -15.527 -14.372 1.00 4.43 H new ATOM 1265 N GLU A 79 18.952 -9.231 -15.895 1.00 31.13 N ATOM 1266 CA GLU A 79 18.412 -8.110 -16.655 1.00 2.34 C ATOM 1267 C GLU A 79 18.006 -6.969 -15.726 1.00 54.12 C ATOM 1268 O GLU A 79 18.214 -5.795 -16.037 1.00 32.43 O ATOM 1269 CB GLU A 79 17.208 -8.560 -17.485 1.00 4.21 C ATOM 1270 CG GLU A 79 16.851 -7.601 -18.609 1.00 25.43 C ATOM 1271 CD GLU A 79 17.157 -8.171 -19.980 1.00 70.14 C ATOM 1272 OE1 GLU A 79 16.620 -9.250 -20.307 1.00 34.20 O ATOM 1273 OE2 GLU A 79 17.933 -7.539 -20.727 1.00 11.23 O ATOM 0 H GLU A 79 18.353 -10.056 -15.877 1.00 31.13 H new ATOM 0 HA GLU A 79 19.192 -7.750 -17.326 1.00 2.34 H new ATOM 0 HB2 GLU A 79 17.416 -9.542 -17.909 1.00 4.21 H new ATOM 0 HB3 GLU A 79 16.346 -8.673 -16.828 1.00 4.21 H new ATOM 0 HG2 GLU A 79 15.791 -7.356 -18.550 1.00 25.43 H new ATOM 0 HG3 GLU A 79 17.401 -6.670 -18.476 1.00 25.43 H new ATOM 1280 N THR A 80 17.423 -7.322 -14.584 1.00 42.24 N ATOM 1281 CA THR A 80 16.985 -6.329 -13.611 1.00 63.31 C ATOM 1282 C THR A 80 18.126 -5.392 -13.231 1.00 13.14 C ATOM 1283 O THR A 80 17.961 -4.173 -13.219 1.00 54.30 O ATOM 1284 CB THR A 80 16.437 -6.997 -12.336 1.00 4.14 C ATOM 1285 OG1 THR A 80 17.513 -7.563 -11.578 1.00 51.22 O ATOM 1286 CG2 THR A 80 15.429 -8.082 -12.683 1.00 43.10 C ATOM 0 H THR A 80 17.243 -8.288 -14.311 1.00 42.24 H new ATOM 0 HA THR A 80 16.188 -5.754 -14.082 1.00 63.31 H new ATOM 0 HB THR A 80 15.935 -6.234 -11.740 1.00 4.14 H new ATOM 0 HG1 THR A 80 17.996 -8.212 -12.131 1.00 51.22 H new ATOM 0 HG21 THR A 80 15.056 -8.539 -11.766 1.00 43.10 H new ATOM 0 HG22 THR A 80 14.597 -7.643 -13.234 1.00 43.10 H new ATOM 0 HG23 THR A 80 15.910 -8.843 -13.298 1.00 43.10 H new ATOM 1294 N GLU A 81 19.282 -5.970 -12.921 1.00 2.44 N ATOM 1295 CA GLU A 81 20.450 -5.184 -12.540 1.00 12.25 C ATOM 1296 C GLU A 81 20.820 -4.191 -13.638 1.00 14.02 C ATOM 1297 O GLU A 81 21.094 -3.023 -13.365 1.00 44.04 O ATOM 1298 CB GLU A 81 21.638 -6.103 -12.247 1.00 35.01 C ATOM 1299 CG GLU A 81 22.710 -5.457 -11.386 1.00 51.30 C ATOM 1300 CD GLU A 81 23.729 -6.457 -10.875 1.00 50.51 C ATOM 1301 OE1 GLU A 81 23.326 -7.415 -10.183 1.00 51.34 O ATOM 1302 OE2 GLU A 81 24.930 -6.280 -11.168 1.00 23.32 O ATOM 0 H GLU A 81 19.435 -6.978 -12.926 1.00 2.44 H new ATOM 0 HA GLU A 81 20.201 -4.625 -11.638 1.00 12.25 H new ATOM 0 HB2 GLU A 81 21.276 -7.002 -11.748 1.00 35.01 H new ATOM 0 HB3 GLU A 81 22.083 -6.419 -13.190 1.00 35.01 H new ATOM 0 HG2 GLU A 81 23.221 -4.687 -11.965 1.00 51.30 H new ATOM 0 HG3 GLU A 81 22.239 -4.959 -10.539 1.00 51.30 H new ATOM 1309 N GLU A 82 20.824 -4.666 -14.880 1.00 3.24 N ATOM 1310 CA GLU A 82 21.162 -3.820 -16.019 1.00 33.33 C ATOM 1311 C GLU A 82 20.289 -2.569 -16.045 1.00 35.00 C ATOM 1312 O GLU A 82 20.669 -1.546 -16.615 1.00 72.14 O ATOM 1313 CB GLU A 82 20.997 -4.598 -17.326 1.00 72.10 C ATOM 1314 CG GLU A 82 21.741 -3.982 -18.499 1.00 21.03 C ATOM 1315 CD GLU A 82 23.233 -4.247 -18.447 1.00 62.41 C ATOM 1316 OE1 GLU A 82 23.728 -4.649 -17.373 1.00 41.14 O ATOM 1317 OE2 GLU A 82 23.906 -4.053 -19.482 1.00 33.55 O ATOM 0 H GLU A 82 20.597 -5.630 -15.123 1.00 3.24 H new ATOM 0 HA GLU A 82 22.203 -3.513 -15.916 1.00 33.33 H new ATOM 0 HB2 GLU A 82 21.350 -5.619 -17.178 1.00 72.10 H new ATOM 0 HB3 GLU A 82 19.937 -4.660 -17.571 1.00 72.10 H new ATOM 0 HG2 GLU A 82 21.337 -4.380 -19.430 1.00 21.03 H new ATOM 0 HG3 GLU A 82 21.567 -2.906 -18.510 1.00 21.03 H new ATOM 1324 N ILE A 83 19.117 -2.659 -15.424 1.00 61.15 N ATOM 1325 CA ILE A 83 18.190 -1.535 -15.376 1.00 64.11 C ATOM 1326 C ILE A 83 18.792 -0.359 -14.614 1.00 70.04 C ATOM 1327 O ILE A 83 18.595 0.800 -14.982 1.00 33.24 O ATOM 1328 CB ILE A 83 16.857 -1.933 -14.715 1.00 4.50 C ATOM 1329 CG1 ILE A 83 16.292 -3.192 -15.374 1.00 55.03 C ATOM 1330 CG2 ILE A 83 15.860 -0.787 -14.804 1.00 73.44 C ATOM 1331 CD1 ILE A 83 15.945 -3.006 -16.835 1.00 10.21 C ATOM 0 H ILE A 83 18.787 -3.498 -14.947 1.00 61.15 H new ATOM 0 HA ILE A 83 18.000 -1.238 -16.407 1.00 64.11 H new ATOM 0 HB ILE A 83 17.039 -2.149 -13.662 1.00 4.50 H new ATOM 0 HG12 ILE A 83 17.020 -3.998 -15.282 1.00 55.03 H new ATOM 0 HG13 ILE A 83 15.399 -3.505 -14.834 1.00 55.03 H new ATOM 0 HG21 ILE A 83 14.923 -1.083 -14.333 1.00 73.44 H new ATOM 0 HG22 ILE A 83 16.263 0.087 -14.292 1.00 73.44 H new ATOM 0 HG23 ILE A 83 15.679 -0.543 -15.851 1.00 73.44 H new ATOM 0 HD11 ILE A 83 15.550 -3.939 -17.237 1.00 10.21 H new ATOM 0 HD12 ILE A 83 15.194 -2.222 -16.934 1.00 10.21 H new ATOM 0 HD13 ILE A 83 16.840 -2.723 -17.388 1.00 10.21 H new ATOM 1343 N THR A 84 19.529 -0.664 -13.551 1.00 62.40 N ATOM 1344 CA THR A 84 20.161 0.367 -12.737 1.00 71.53 C ATOM 1345 C THR A 84 20.948 1.344 -13.602 1.00 53.53 C ATOM 1346 O THR A 84 21.021 2.535 -13.300 1.00 11.41 O ATOM 1347 CB THR A 84 21.106 -0.247 -11.687 1.00 72.30 C ATOM 1348 OG1 THR A 84 21.379 0.708 -10.656 1.00 11.11 O ATOM 1349 CG2 THR A 84 22.410 -0.695 -12.329 1.00 23.32 C ATOM 0 H THR A 84 19.703 -1.617 -13.233 1.00 62.40 H new ATOM 0 HA THR A 84 19.360 0.901 -12.226 1.00 71.53 H new ATOM 0 HB THR A 84 20.615 -1.118 -11.254 1.00 72.30 H new ATOM 0 HG1 THR A 84 20.605 0.774 -10.058 1.00 11.11 H new ATOM 0 HG21 THR A 84 23.061 -1.125 -11.568 1.00 23.32 H new ATOM 0 HG22 THR A 84 22.201 -1.444 -13.093 1.00 23.32 H new ATOM 0 HG23 THR A 84 22.904 0.162 -12.786 1.00 23.32 H new ATOM 1357 N SER A 85 21.535 0.834 -14.680 1.00 55.13 N ATOM 1358 CA SER A 85 22.319 1.663 -15.588 1.00 61.21 C ATOM 1359 C SER A 85 21.415 2.589 -16.396 1.00 43.12 C ATOM 1360 O SER A 85 21.658 3.794 -16.482 1.00 23.43 O ATOM 1361 CB SER A 85 23.142 0.784 -16.532 1.00 4.12 C ATOM 1362 OG SER A 85 24.508 0.770 -16.154 1.00 41.11 O ATOM 0 H SER A 85 21.482 -0.149 -14.946 1.00 55.13 H new ATOM 0 HA SER A 85 22.995 2.275 -14.990 1.00 61.21 H new ATOM 0 HB2 SER A 85 22.748 -0.232 -16.523 1.00 4.12 H new ATOM 0 HB3 SER A 85 23.048 1.154 -17.553 1.00 4.12 H new ATOM 0 HG SER A 85 25.012 0.200 -16.771 1.00 41.11 H new ATOM 1368 N LEU A 86 20.372 2.018 -16.988 1.00 12.42 N ATOM 1369 CA LEU A 86 19.430 2.792 -17.790 1.00 31.50 C ATOM 1370 C LEU A 86 18.873 3.967 -16.993 1.00 40.14 C ATOM 1371 O LEU A 86 18.497 4.992 -17.562 1.00 42.20 O ATOM 1372 CB LEU A 86 18.285 1.898 -18.270 1.00 32.11 C ATOM 1373 CG LEU A 86 18.687 0.530 -18.823 1.00 3.23 C ATOM 1374 CD1 LEU A 86 17.468 -0.216 -19.341 1.00 53.34 C ATOM 1375 CD2 LEU A 86 19.728 0.685 -19.922 1.00 71.42 C ATOM 0 H LEU A 86 20.157 1.023 -16.928 1.00 12.42 H new ATOM 0 HA LEU A 86 19.964 3.185 -18.655 1.00 31.50 H new ATOM 0 HB2 LEU A 86 17.598 1.743 -17.438 1.00 32.11 H new ATOM 0 HB3 LEU A 86 17.733 2.432 -19.044 1.00 32.11 H new ATOM 0 HG LEU A 86 19.126 -0.053 -18.014 1.00 3.23 H new ATOM 0 HD11 LEU A 86 17.774 -1.187 -19.730 1.00 53.34 H new ATOM 0 HD12 LEU A 86 16.756 -0.359 -18.528 1.00 53.34 H new ATOM 0 HD13 LEU A 86 16.998 0.362 -20.137 1.00 53.34 H new ATOM 0 HD21 LEU A 86 20.003 -0.298 -20.304 1.00 71.42 H new ATOM 0 HD22 LEU A 86 19.315 1.287 -20.732 1.00 71.42 H new ATOM 0 HD23 LEU A 86 20.613 1.178 -19.518 1.00 71.42 H new ATOM 1387 N TRP A 87 18.825 3.812 -15.675 1.00 63.04 N ATOM 1388 CA TRP A 87 18.316 4.862 -14.800 1.00 44.03 C ATOM 1389 C TRP A 87 19.059 6.173 -15.034 1.00 22.10 C ATOM 1390 O TRP A 87 18.448 7.239 -15.097 1.00 2.23 O ATOM 1391 CB TRP A 87 18.447 4.442 -13.336 1.00 21.55 C ATOM 1392 CG TRP A 87 18.033 5.512 -12.371 1.00 62.41 C ATOM 1393 CD1 TRP A 87 17.182 6.551 -12.616 1.00 40.11 C ATOM 1394 CD2 TRP A 87 18.454 5.648 -11.009 1.00 62.55 C ATOM 1395 NE1 TRP A 87 17.049 7.325 -11.489 1.00 15.14 N ATOM 1396 CE2 TRP A 87 17.818 6.792 -10.489 1.00 21.50 C ATOM 1397 CE3 TRP A 87 19.305 4.913 -10.179 1.00 12.33 C ATOM 1398 CZ2 TRP A 87 18.008 7.216 -9.177 1.00 3.52 C ATOM 1399 CZ3 TRP A 87 19.493 5.337 -8.877 1.00 33.53 C ATOM 1400 CH2 TRP A 87 18.846 6.479 -8.386 1.00 24.23 C ATOM 0 H TRP A 87 19.132 2.970 -15.189 1.00 63.04 H new ATOM 0 HA TRP A 87 17.263 5.016 -15.033 1.00 44.03 H new ATOM 0 HB2 TRP A 87 17.839 3.554 -13.165 1.00 21.55 H new ATOM 0 HB3 TRP A 87 19.482 4.164 -13.137 1.00 21.55 H new ATOM 0 HD1 TRP A 87 16.686 6.737 -13.557 1.00 40.11 H new ATOM 0 HE1 TRP A 87 16.471 8.162 -11.410 1.00 15.14 H new ATOM 0 HE3 TRP A 87 19.806 4.030 -10.548 1.00 12.33 H new ATOM 0 HZ2 TRP A 87 17.511 8.096 -8.797 1.00 3.52 H new ATOM 0 HZ3 TRP A 87 20.150 4.778 -8.227 1.00 33.53 H new ATOM 0 HH2 TRP A 87 19.012 6.783 -7.363 1.00 24.23 H new ATOM 1411 N GLN A 88 20.379 6.085 -15.162 1.00 42.42 N ATOM 1412 CA GLN A 88 21.204 7.266 -15.389 1.00 2.24 C ATOM 1413 C GLN A 88 20.626 8.128 -16.506 1.00 61.02 C ATOM 1414 O GLN A 88 20.581 9.353 -16.399 1.00 75.30 O ATOM 1415 CB GLN A 88 22.636 6.855 -15.734 1.00 44.04 C ATOM 1416 CG GLN A 88 23.314 6.036 -14.647 1.00 53.42 C ATOM 1417 CD GLN A 88 24.766 5.737 -14.961 1.00 42.14 C ATOM 1418 OE1 GLN A 88 25.427 6.491 -15.677 1.00 33.02 O ATOM 1419 NE2 GLN A 88 25.272 4.632 -14.427 1.00 23.12 N ATOM 0 H GLN A 88 20.900 5.209 -15.112 1.00 42.42 H new ATOM 0 HA GLN A 88 21.214 7.853 -14.471 1.00 2.24 H new ATOM 0 HB2 GLN A 88 22.627 6.278 -16.659 1.00 44.04 H new ATOM 0 HB3 GLN A 88 23.227 7.751 -15.923 1.00 44.04 H new ATOM 0 HG2 GLN A 88 23.254 6.575 -13.701 1.00 53.42 H new ATOM 0 HG3 GLN A 88 22.774 5.098 -14.514 1.00 53.42 H new ATOM 0 HE21 GLN A 88 24.689 4.036 -13.840 1.00 23.12 H new ATOM 0 HE22 GLN A 88 26.244 4.379 -14.604 1.00 23.12 H new ATOM 1428 N GLY A 89 20.185 7.479 -17.580 1.00 22.02 N ATOM 1429 CA GLY A 89 19.616 8.202 -18.702 1.00 43.11 C ATOM 1430 C GLY A 89 18.260 8.798 -18.381 1.00 21.35 C ATOM 1431 O GLY A 89 18.016 9.977 -18.636 1.00 2.04 O ATOM 0 H GLY A 89 20.212 6.466 -17.693 1.00 22.02 H new ATOM 0 HA2 GLY A 89 20.298 8.998 -19.000 1.00 43.11 H new ATOM 0 HA3 GLY A 89 19.521 7.528 -19.554 1.00 43.11 H new ATOM 1435 N SER A 90 17.374 7.980 -17.820 1.00 42.33 N ATOM 1436 CA SER A 90 16.033 8.432 -17.469 1.00 20.14 C ATOM 1437 C SER A 90 16.090 9.716 -16.647 1.00 42.20 C ATOM 1438 O SER A 90 15.308 10.642 -16.865 1.00 53.12 O ATOM 1439 CB SER A 90 15.295 7.344 -16.685 1.00 51.55 C ATOM 1440 OG SER A 90 14.395 7.912 -15.750 1.00 32.04 O ATOM 0 H SER A 90 17.561 7.002 -17.599 1.00 42.33 H new ATOM 0 HA SER A 90 15.492 8.636 -18.393 1.00 20.14 H new ATOM 0 HB2 SER A 90 14.749 6.701 -17.375 1.00 51.55 H new ATOM 0 HB3 SER A 90 16.016 6.714 -16.164 1.00 51.55 H new ATOM 0 HG SER A 90 13.935 7.197 -15.263 1.00 32.04 H new ATOM 1446 N LEU A 91 17.022 9.765 -15.701 1.00 72.33 N ATOM 1447 CA LEU A 91 17.183 10.935 -14.845 1.00 52.14 C ATOM 1448 C LEU A 91 17.262 12.211 -15.677 1.00 42.22 C ATOM 1449 O LEU A 91 16.637 13.219 -15.348 1.00 12.42 O ATOM 1450 CB LEU A 91 18.440 10.794 -13.986 1.00 65.22 C ATOM 1451 CG LEU A 91 18.814 12.010 -13.138 1.00 43.34 C ATOM 1452 CD1 LEU A 91 19.221 11.580 -11.737 1.00 54.15 C ATOM 1453 CD2 LEU A 91 19.934 12.799 -13.802 1.00 31.01 C ATOM 0 H LEU A 91 17.678 9.008 -15.508 1.00 72.33 H new ATOM 0 HA LEU A 91 16.311 11.001 -14.194 1.00 52.14 H new ATOM 0 HB2 LEU A 91 18.308 9.940 -13.322 1.00 65.22 H new ATOM 0 HB3 LEU A 91 19.279 10.561 -14.641 1.00 65.22 H new ATOM 0 HG LEU A 91 17.939 12.655 -13.058 1.00 43.34 H new ATOM 0 HD11 LEU A 91 19.484 12.459 -11.148 1.00 54.15 H new ATOM 0 HD12 LEU A 91 18.390 11.059 -11.261 1.00 54.15 H new ATOM 0 HD13 LEU A 91 20.081 10.913 -11.797 1.00 54.15 H new ATOM 0 HD21 LEU A 91 20.187 13.661 -13.185 1.00 31.01 H new ATOM 0 HD22 LEU A 91 20.811 12.162 -13.913 1.00 31.01 H new ATOM 0 HD23 LEU A 91 19.606 13.140 -14.784 1.00 31.01 H new ATOM 1465 N PHE A 92 18.033 12.160 -16.758 1.00 64.22 N ATOM 1466 CA PHE A 92 18.194 13.311 -17.639 1.00 14.25 C ATOM 1467 C PHE A 92 16.836 13.873 -18.051 1.00 43.31 C ATOM 1468 O PHE A 92 16.556 15.055 -17.853 1.00 72.42 O ATOM 1469 CB PHE A 92 18.996 12.922 -18.882 1.00 22.33 C ATOM 1470 CG PHE A 92 19.143 14.039 -19.875 1.00 31.12 C ATOM 1471 CD1 PHE A 92 18.159 14.275 -20.822 1.00 3.43 C ATOM 1472 CD2 PHE A 92 20.264 14.853 -19.861 1.00 71.02 C ATOM 1473 CE1 PHE A 92 18.292 15.302 -21.737 1.00 43.21 C ATOM 1474 CE2 PHE A 92 20.402 15.882 -20.774 1.00 23.31 C ATOM 1475 CZ PHE A 92 19.414 16.107 -21.712 1.00 45.25 C ATOM 0 H PHE A 92 18.557 11.333 -17.045 1.00 64.22 H new ATOM 0 HA PHE A 92 18.737 14.082 -17.093 1.00 14.25 H new ATOM 0 HB2 PHE A 92 19.987 12.587 -18.575 1.00 22.33 H new ATOM 0 HB3 PHE A 92 18.510 12.076 -19.368 1.00 22.33 H new ATOM 0 HD1 PHE A 92 17.279 13.650 -20.845 1.00 3.43 H new ATOM 0 HD2 PHE A 92 21.039 14.682 -19.128 1.00 71.02 H new ATOM 0 HE1 PHE A 92 17.519 15.475 -22.471 1.00 43.21 H new ATOM 0 HE2 PHE A 92 21.281 16.509 -20.754 1.00 23.31 H new ATOM 0 HZ PHE A 92 19.518 16.911 -22.425 1.00 45.25 H new ATOM 1485 N ASN A 93 15.998 13.017 -18.627 1.00 2.24 N ATOM 1486 CA ASN A 93 14.670 13.428 -19.069 1.00 24.23 C ATOM 1487 C ASN A 93 13.762 13.708 -17.875 1.00 61.23 C ATOM 1488 O ASN A 93 13.241 14.812 -17.725 1.00 13.30 O ATOM 1489 CB ASN A 93 14.048 12.347 -19.955 1.00 23.32 C ATOM 1490 CG ASN A 93 12.793 12.827 -20.658 1.00 22.13 C ATOM 1491 OD1 ASN A 93 11.710 12.968 -19.903 1.00 23.41 O flip ATOM 1492 ND2 ASN A 93 12.798 13.069 -21.865 1.00 73.40 N flip ATOM 0 H ASN A 93 16.215 12.035 -18.799 1.00 2.24 H new ATOM 0 HA ASN A 93 14.774 14.346 -19.647 1.00 24.23 H new ATOM 0 HB2 ASN A 93 14.778 12.026 -20.699 1.00 23.32 H new ATOM 0 HB3 ASN A 93 13.809 11.475 -19.346 1.00 23.32 H new ATOM 0 HD21 ASN A 93 13.654 12.946 -22.406 1.00 73.40 H new ATOM 0 HD22 ASN A 93 11.946 13.392 -22.324 1.00 73.40 H new ATOM 1499 N ALA A 94 13.578 12.700 -17.029 1.00 63.42 N ATOM 1500 CA ALA A 94 12.736 12.838 -15.848 1.00 34.31 C ATOM 1501 C ALA A 94 13.426 12.270 -14.612 1.00 54.21 C ATOM 1502 O ALA A 94 14.085 11.234 -14.679 1.00 33.32 O ATOM 1503 CB ALA A 94 11.397 12.149 -16.071 1.00 24.03 C ATOM 0 H ALA A 94 14.001 11.779 -17.140 1.00 63.42 H new ATOM 0 HA ALA A 94 12.562 13.901 -15.678 1.00 34.31 H new ATOM 0 HB1 ALA A 94 10.778 12.260 -15.181 1.00 24.03 H new ATOM 0 HB2 ALA A 94 10.892 12.603 -16.923 1.00 24.03 H new ATOM 0 HB3 ALA A 94 11.561 11.090 -16.269 1.00 24.03 H new ATOM 1509 N ASN A 95 13.270 12.957 -13.485 1.00 54.20 N ATOM 1510 CA ASN A 95 13.879 12.522 -12.234 1.00 22.42 C ATOM 1511 C ASN A 95 13.298 11.185 -11.782 1.00 43.10 C ATOM 1512 O ASN A 95 12.320 11.142 -11.035 1.00 41.15 O ATOM 1513 CB ASN A 95 13.668 13.576 -11.145 1.00 45.14 C ATOM 1514 CG ASN A 95 14.901 14.431 -10.922 1.00 70.03 C ATOM 1515 OD1 ASN A 95 15.928 13.947 -10.446 1.00 71.01 O ATOM 1516 ND2 ASN A 95 14.804 15.710 -11.266 1.00 72.12 N ATOM 0 H ASN A 95 12.727 13.817 -13.413 1.00 54.20 H new ATOM 0 HA ASN A 95 14.948 12.395 -12.405 1.00 22.42 H new ATOM 0 HB2 ASN A 95 12.830 14.216 -11.420 1.00 45.14 H new ATOM 0 HB3 ASN A 95 13.398 13.082 -10.212 1.00 45.14 H new ATOM 0 HD21 ASN A 95 15.601 16.334 -11.139 1.00 72.12 H new ATOM 0 HD22 ASN A 95 13.933 16.068 -11.657 1.00 72.12 H new ATOM 1523 N TYR A 96 13.907 10.097 -12.239 1.00 65.11 N ATOM 1524 CA TYR A 96 13.450 8.759 -11.884 1.00 22.22 C ATOM 1525 C TYR A 96 11.948 8.618 -12.111 1.00 41.12 C ATOM 1526 O TYR A 96 11.147 8.852 -11.206 1.00 23.32 O ATOM 1527 CB TYR A 96 13.787 8.453 -10.423 1.00 60.15 C ATOM 1528 CG TYR A 96 13.739 6.980 -10.087 1.00 35.34 C ATOM 1529 CD1 TYR A 96 14.277 6.032 -10.948 1.00 44.03 C ATOM 1530 CD2 TYR A 96 13.153 6.535 -8.908 1.00 2.13 C ATOM 1531 CE1 TYR A 96 14.235 4.685 -10.645 1.00 71.22 C ATOM 1532 CE2 TYR A 96 13.108 5.190 -8.596 1.00 15.23 C ATOM 1533 CZ TYR A 96 13.649 4.269 -9.468 1.00 4.04 C ATOM 1534 OH TYR A 96 13.605 2.928 -9.161 1.00 54.22 O ATOM 0 H TYR A 96 14.719 10.115 -12.856 1.00 65.11 H new ATOM 0 HA TYR A 96 13.965 8.045 -12.526 1.00 22.22 H new ATOM 0 HB2 TYR A 96 14.783 8.836 -10.201 1.00 60.15 H new ATOM 0 HB3 TYR A 96 13.089 8.987 -9.778 1.00 60.15 H new ATOM 0 HD1 TYR A 96 14.736 6.354 -11.871 1.00 44.03 H new ATOM 0 HD2 TYR A 96 12.725 7.253 -8.224 1.00 2.13 H new ATOM 0 HE1 TYR A 96 14.659 3.962 -11.326 1.00 71.22 H new ATOM 0 HE2 TYR A 96 12.651 4.862 -7.674 1.00 15.23 H new ATOM 0 HH TYR A 96 14.378 2.476 -9.558 1.00 54.22 H new ATOM 1544 N ASP A 97 11.574 8.234 -13.327 1.00 1.13 N ATOM 1545 CA ASP A 97 10.169 8.060 -13.675 1.00 34.13 C ATOM 1546 C ASP A 97 9.849 6.589 -13.923 1.00 14.13 C ATOM 1547 O ASP A 97 9.741 6.151 -15.068 1.00 70.12 O ATOM 1548 CB ASP A 97 9.822 8.886 -14.914 1.00 51.12 C ATOM 1549 CG ASP A 97 9.132 10.190 -14.566 1.00 53.31 C ATOM 1550 OD1 ASP A 97 9.779 11.056 -13.939 1.00 73.52 O ATOM 1551 OD2 ASP A 97 7.945 10.346 -14.921 1.00 51.23 O ATOM 0 H ASP A 97 12.224 8.037 -14.088 1.00 1.13 H new ATOM 0 HA ASP A 97 9.567 8.408 -12.836 1.00 34.13 H new ATOM 0 HB2 ASP A 97 10.734 9.099 -15.472 1.00 51.12 H new ATOM 0 HB3 ASP A 97 9.177 8.300 -15.569 1.00 51.12 H new ATOM 1556 N VAL A 98 9.698 5.831 -12.841 1.00 64.23 N ATOM 1557 CA VAL A 98 9.391 4.409 -12.941 1.00 53.12 C ATOM 1558 C VAL A 98 8.390 3.987 -11.872 1.00 12.04 C ATOM 1559 O VAL A 98 8.409 4.501 -10.753 1.00 74.25 O ATOM 1560 CB VAL A 98 10.661 3.549 -12.807 1.00 45.15 C ATOM 1561 CG1 VAL A 98 11.718 3.999 -13.805 1.00 22.21 C ATOM 1562 CG2 VAL A 98 11.198 3.610 -11.386 1.00 5.25 C ATOM 0 H VAL A 98 9.783 6.178 -11.886 1.00 64.23 H new ATOM 0 HA VAL A 98 8.955 4.248 -13.927 1.00 53.12 H new ATOM 0 HB VAL A 98 10.403 2.514 -13.029 1.00 45.15 H new ATOM 0 HG11 VAL A 98 12.608 3.380 -13.696 1.00 22.21 H new ATOM 0 HG12 VAL A 98 11.328 3.898 -14.818 1.00 22.21 H new ATOM 0 HG13 VAL A 98 11.975 5.041 -13.617 1.00 22.21 H new ATOM 0 HG21 VAL A 98 12.096 2.996 -11.310 1.00 5.25 H new ATOM 0 HG22 VAL A 98 11.441 4.642 -11.133 1.00 5.25 H new ATOM 0 HG23 VAL A 98 10.443 3.235 -10.695 1.00 5.25 H new ATOM 1572 N GLN A 99 7.517 3.048 -12.223 1.00 23.10 N ATOM 1573 CA GLN A 99 6.508 2.557 -11.292 1.00 61.22 C ATOM 1574 C GLN A 99 6.509 1.033 -11.242 1.00 63.53 C ATOM 1575 O GLN A 99 6.483 0.368 -12.278 1.00 70.13 O ATOM 1576 CB GLN A 99 5.122 3.065 -11.695 1.00 25.41 C ATOM 1577 CG GLN A 99 3.997 2.501 -10.843 1.00 33.10 C ATOM 1578 CD GLN A 99 2.956 1.765 -11.664 1.00 21.13 C ATOM 1579 OE1 GLN A 99 1.794 2.168 -11.720 1.00 11.22 O ATOM 1580 NE2 GLN A 99 3.368 0.679 -12.307 1.00 25.45 N ATOM 0 H GLN A 99 7.488 2.612 -13.145 1.00 23.10 H new ATOM 0 HA GLN A 99 6.751 2.935 -10.299 1.00 61.22 H new ATOM 0 HB2 GLN A 99 5.109 4.153 -11.626 1.00 25.41 H new ATOM 0 HB3 GLN A 99 4.940 2.809 -12.739 1.00 25.41 H new ATOM 0 HG2 GLN A 99 4.415 1.822 -10.100 1.00 33.10 H new ATOM 0 HG3 GLN A 99 3.517 3.314 -10.298 1.00 33.10 H new ATOM 0 HE21 GLN A 99 4.341 0.381 -12.233 1.00 25.45 H new ATOM 0 HE22 GLN A 99 2.712 0.143 -12.875 1.00 25.45 H new ATOM 1589 N ARG A 100 6.541 0.485 -10.032 1.00 14.13 N ATOM 1590 CA ARG A 100 6.547 -0.961 -9.847 1.00 71.11 C ATOM 1591 C ARG A 100 5.478 -1.386 -8.845 1.00 0.05 C ATOM 1592 O ARG A 100 5.199 -0.674 -7.880 1.00 15.31 O ATOM 1593 CB ARG A 100 7.923 -1.430 -9.371 1.00 1.21 C ATOM 1594 CG ARG A 100 8.071 -2.942 -9.329 1.00 52.03 C ATOM 1595 CD ARG A 100 8.472 -3.425 -7.944 1.00 45.43 C ATOM 1596 NE ARG A 100 7.447 -3.135 -6.945 1.00 64.22 N ATOM 1597 CZ ARG A 100 7.674 -3.143 -5.636 1.00 72.43 C ATOM 1598 NH1 ARG A 100 8.883 -3.424 -5.171 1.00 61.41 N ATOM 1599 NH2 ARG A 100 6.689 -2.870 -4.790 1.00 4.53 N ATOM 0 H ARG A 100 6.563 1.021 -9.164 1.00 14.13 H new ATOM 0 HA ARG A 100 6.325 -1.426 -10.808 1.00 71.11 H new ATOM 0 HB2 ARG A 100 8.686 -1.017 -10.031 1.00 1.21 H new ATOM 0 HB3 ARG A 100 8.110 -1.027 -8.376 1.00 1.21 H new ATOM 0 HG2 ARG A 100 7.130 -3.409 -9.620 1.00 52.03 H new ATOM 0 HG3 ARG A 100 8.820 -3.256 -10.056 1.00 52.03 H new ATOM 0 HD2 ARG A 100 8.656 -4.499 -7.974 1.00 45.43 H new ATOM 0 HD3 ARG A 100 9.408 -2.950 -7.651 1.00 45.43 H new ATOM 0 HE ARG A 100 6.506 -2.914 -7.270 1.00 64.22 H new ATOM 0 HH11 ARG A 100 9.642 -3.635 -5.819 1.00 61.41 H new ATOM 0 HH12 ARG A 100 9.054 -3.429 -4.165 1.00 61.41 H new ATOM 0 HH21 ARG A 100 5.757 -2.654 -5.145 1.00 4.53 H new ATOM 0 HH22 ARG A 100 6.863 -2.876 -3.785 1.00 4.53 H new ATOM 1613 N PHE A 101 4.883 -2.551 -9.080 1.00 2.24 N ATOM 1614 CA PHE A 101 3.844 -3.070 -8.198 1.00 72.14 C ATOM 1615 C PHE A 101 3.933 -4.589 -8.088 1.00 62.43 C ATOM 1616 O PHE A 101 4.274 -5.273 -9.054 1.00 22.21 O ATOM 1617 CB PHE A 101 2.461 -2.665 -8.712 1.00 74.22 C ATOM 1618 CG PHE A 101 1.409 -2.634 -7.641 1.00 14.24 C ATOM 1619 CD1 PHE A 101 1.596 -1.885 -6.490 1.00 34.44 C ATOM 1620 CD2 PHE A 101 0.233 -3.352 -7.785 1.00 33.15 C ATOM 1621 CE1 PHE A 101 0.629 -1.856 -5.502 1.00 5.52 C ATOM 1622 CE2 PHE A 101 -0.737 -3.326 -6.800 1.00 53.31 C ATOM 1623 CZ PHE A 101 -0.539 -2.575 -5.658 1.00 21.53 C ATOM 0 H PHE A 101 5.102 -3.153 -9.873 1.00 2.24 H new ATOM 0 HA PHE A 101 3.996 -2.642 -7.207 1.00 72.14 H new ATOM 0 HB2 PHE A 101 2.528 -1.680 -9.173 1.00 74.22 H new ATOM 0 HB3 PHE A 101 2.154 -3.362 -9.492 1.00 74.22 H new ATOM 0 HD1 PHE A 101 2.506 -1.318 -6.363 1.00 34.44 H new ATOM 0 HD2 PHE A 101 0.072 -3.939 -8.677 1.00 33.15 H new ATOM 0 HE1 PHE A 101 0.788 -1.271 -4.608 1.00 5.52 H new ATOM 0 HE2 PHE A 101 -1.648 -3.892 -6.924 1.00 53.31 H new ATOM 0 HZ PHE A 101 -1.296 -2.550 -4.889 1.00 21.53 H new ATOM 1633 N ILE A 102 3.625 -5.110 -6.905 1.00 42.12 N ATOM 1634 CA ILE A 102 3.670 -6.547 -6.669 1.00 21.54 C ATOM 1635 C ILE A 102 2.386 -7.036 -6.006 1.00 5.10 C ATOM 1636 O ILE A 102 1.969 -6.511 -4.974 1.00 10.42 O ATOM 1637 CB ILE A 102 4.870 -6.935 -5.785 1.00 24.30 C ATOM 1638 CG1 ILE A 102 6.166 -6.371 -6.371 1.00 3.13 C ATOM 1639 CG2 ILE A 102 4.960 -8.448 -5.647 1.00 53.21 C ATOM 1640 CD1 ILE A 102 7.366 -6.551 -5.468 1.00 3.25 C ATOM 0 H ILE A 102 3.342 -4.558 -6.095 1.00 42.12 H new ATOM 0 HA ILE A 102 3.777 -7.023 -7.643 1.00 21.54 H new ATOM 0 HB ILE A 102 4.725 -6.507 -4.793 1.00 24.30 H new ATOM 0 HG12 ILE A 102 6.365 -6.856 -7.327 1.00 3.13 H new ATOM 0 HG13 ILE A 102 6.031 -5.309 -6.575 1.00 3.13 H new ATOM 0 HG21 ILE A 102 5.813 -8.706 -5.019 1.00 53.21 H new ATOM 0 HG22 ILE A 102 4.046 -8.827 -5.190 1.00 53.21 H new ATOM 0 HG23 ILE A 102 5.086 -8.896 -6.633 1.00 53.21 H new ATOM 0 HD11 ILE A 102 8.249 -6.128 -5.947 1.00 3.25 H new ATOM 0 HD12 ILE A 102 7.188 -6.042 -4.521 1.00 3.25 H new ATOM 0 HD13 ILE A 102 7.527 -7.613 -5.284 1.00 3.25 H new ATOM 1652 N VAL A 103 1.765 -8.046 -6.606 1.00 32.34 N ATOM 1653 CA VAL A 103 0.530 -8.609 -6.072 1.00 52.34 C ATOM 1654 C VAL A 103 0.407 -10.089 -6.415 1.00 24.33 C ATOM 1655 O VAL A 103 0.419 -10.470 -7.585 1.00 14.34 O ATOM 1656 CB VAL A 103 -0.705 -7.864 -6.613 1.00 73.24 C ATOM 1657 CG1 VAL A 103 -0.842 -6.503 -5.948 1.00 72.13 C ATOM 1658 CG2 VAL A 103 -0.621 -7.722 -8.126 1.00 11.14 C ATOM 0 H VAL A 103 2.096 -8.491 -7.462 1.00 32.34 H new ATOM 0 HA VAL A 103 0.571 -8.493 -4.989 1.00 52.34 H new ATOM 0 HB VAL A 103 -1.594 -8.449 -6.375 1.00 73.24 H new ATOM 0 HG11 VAL A 103 -1.720 -5.992 -6.343 1.00 72.13 H new ATOM 0 HG12 VAL A 103 -0.952 -6.633 -4.871 1.00 72.13 H new ATOM 0 HG13 VAL A 103 0.047 -5.907 -6.152 1.00 72.13 H new ATOM 0 HG21 VAL A 103 -1.501 -7.193 -8.491 1.00 11.14 H new ATOM 0 HG22 VAL A 103 0.275 -7.160 -8.390 1.00 11.14 H new ATOM 0 HG23 VAL A 103 -0.576 -8.711 -8.582 1.00 11.14 H new ATOM 1668 N GLY A 104 0.290 -10.922 -5.384 1.00 50.34 N ATOM 1669 CA GLY A 104 0.167 -12.352 -5.597 1.00 13.03 C ATOM 1670 C GLY A 104 1.470 -12.987 -6.039 1.00 51.15 C ATOM 1671 O GLY A 104 2.543 -12.611 -5.568 1.00 20.33 O ATOM 0 H GLY A 104 0.278 -10.632 -4.406 1.00 50.34 H new ATOM 0 HA2 GLY A 104 -0.170 -12.826 -4.675 1.00 13.03 H new ATOM 0 HA3 GLY A 104 -0.599 -12.539 -6.350 1.00 13.03 H new ATOM 1675 N SER A 105 1.377 -13.953 -6.947 1.00 62.24 N ATOM 1676 CA SER A 105 2.558 -14.646 -7.450 1.00 11.11 C ATOM 1677 C SER A 105 3.077 -13.982 -8.722 1.00 1.14 C ATOM 1678 O SER A 105 4.039 -14.450 -9.331 1.00 73.14 O ATOM 1679 CB SER A 105 2.235 -16.116 -7.724 1.00 12.11 C ATOM 1680 OG SER A 105 0.841 -16.356 -7.640 1.00 12.02 O ATOM 0 H SER A 105 0.496 -14.274 -7.350 1.00 62.24 H new ATOM 0 HA SER A 105 3.335 -14.588 -6.688 1.00 11.11 H new ATOM 0 HB2 SER A 105 2.596 -16.392 -8.715 1.00 12.11 H new ATOM 0 HB3 SER A 105 2.760 -16.747 -7.006 1.00 12.11 H new ATOM 0 HG SER A 105 0.660 -17.302 -7.821 1.00 12.02 H new ATOM 1686 N ASP A 106 2.434 -12.889 -9.115 1.00 54.45 N ATOM 1687 CA ASP A 106 2.830 -12.158 -10.314 1.00 33.11 C ATOM 1688 C ASP A 106 3.115 -10.695 -9.989 1.00 74.13 C ATOM 1689 O ASP A 106 2.359 -10.052 -9.260 1.00 22.41 O ATOM 1690 CB ASP A 106 1.737 -12.253 -11.380 1.00 32.53 C ATOM 1691 CG ASP A 106 0.410 -11.701 -10.899 1.00 15.41 C ATOM 1692 OD1 ASP A 106 0.285 -10.462 -10.798 1.00 75.44 O ATOM 1693 OD2 ASP A 106 -0.504 -12.506 -10.622 1.00 70.34 O ATOM 0 H ASP A 106 1.636 -12.489 -8.621 1.00 54.45 H new ATOM 0 HA ASP A 106 3.743 -12.610 -10.700 1.00 33.11 H new ATOM 0 HB2 ASP A 106 2.053 -11.708 -12.270 1.00 32.53 H new ATOM 0 HB3 ASP A 106 1.609 -13.295 -11.673 1.00 32.53 H new ATOM 1698 N ARG A 107 4.210 -10.176 -10.535 1.00 15.42 N ATOM 1699 CA ARG A 107 4.595 -8.789 -10.301 1.00 65.22 C ATOM 1700 C ARG A 107 4.774 -8.045 -11.621 1.00 53.22 C ATOM 1701 O ARG A 107 5.136 -8.639 -12.636 1.00 42.22 O ATOM 1702 CB ARG A 107 5.891 -8.728 -9.490 1.00 11.11 C ATOM 1703 CG ARG A 107 6.999 -9.608 -10.044 1.00 71.51 C ATOM 1704 CD ARG A 107 7.508 -10.588 -8.998 1.00 51.11 C ATOM 1705 NE ARG A 107 6.425 -11.368 -8.406 1.00 33.30 N ATOM 1706 CZ ARG A 107 6.587 -12.181 -7.367 1.00 53.45 C ATOM 1707 NH1 ARG A 107 7.781 -12.318 -6.809 1.00 3.20 N ATOM 1708 NH2 ARG A 107 5.552 -12.857 -6.885 1.00 62.22 N ATOM 0 H ARG A 107 4.846 -10.694 -11.142 1.00 15.42 H new ATOM 0 HA ARG A 107 3.797 -8.306 -9.736 1.00 65.22 H new ATOM 0 HB2 ARG A 107 6.241 -7.696 -9.457 1.00 11.11 H new ATOM 0 HB3 ARG A 107 5.681 -9.026 -8.463 1.00 11.11 H new ATOM 0 HG2 ARG A 107 6.630 -10.158 -10.910 1.00 71.51 H new ATOM 0 HG3 ARG A 107 7.822 -8.983 -10.390 1.00 71.51 H new ATOM 0 HD2 ARG A 107 8.232 -11.262 -9.455 1.00 51.11 H new ATOM 0 HD3 ARG A 107 8.032 -10.041 -8.214 1.00 51.11 H new ATOM 0 HE ARG A 107 5.493 -11.284 -8.812 1.00 33.30 H new ATOM 0 HH11 ARG A 107 8.578 -11.799 -7.177 1.00 3.20 H new ATOM 0 HH12 ARG A 107 7.903 -12.942 -6.012 1.00 3.20 H new ATOM 0 HH21 ARG A 107 4.631 -12.753 -7.312 1.00 62.22 H new ATOM 0 HH22 ARG A 107 5.677 -13.481 -6.088 1.00 62.22 H new ATOM 1722 N ALA A 108 4.516 -6.741 -11.599 1.00 31.21 N ATOM 1723 CA ALA A 108 4.649 -5.916 -12.793 1.00 2.42 C ATOM 1724 C ALA A 108 5.675 -4.808 -12.582 1.00 45.42 C ATOM 1725 O ALA A 108 5.804 -4.269 -11.483 1.00 13.55 O ATOM 1726 CB ALA A 108 3.302 -5.323 -13.178 1.00 73.40 C ATOM 0 H ALA A 108 4.214 -6.234 -10.767 1.00 31.21 H new ATOM 0 HA ALA A 108 5.000 -6.551 -13.606 1.00 2.42 H new ATOM 0 HB1 ALA A 108 3.417 -4.709 -14.071 1.00 73.40 H new ATOM 0 HB2 ALA A 108 2.594 -6.127 -13.379 1.00 73.40 H new ATOM 0 HB3 ALA A 108 2.929 -4.707 -12.360 1.00 73.40 H new ATOM 1732 N ILE A 109 6.404 -4.473 -13.642 1.00 21.32 N ATOM 1733 CA ILE A 109 7.419 -3.429 -13.572 1.00 34.11 C ATOM 1734 C ILE A 109 7.303 -2.470 -14.752 1.00 34.11 C ATOM 1735 O ILE A 109 7.075 -2.890 -15.887 1.00 10.32 O ATOM 1736 CB ILE A 109 8.839 -4.025 -13.547 1.00 13.44 C ATOM 1737 CG1 ILE A 109 9.883 -2.907 -13.506 1.00 63.32 C ATOM 1738 CG2 ILE A 109 9.059 -4.920 -14.757 1.00 2.22 C ATOM 1739 CD1 ILE A 109 11.284 -3.400 -13.219 1.00 63.11 C ATOM 0 H ILE A 109 6.310 -4.910 -14.559 1.00 21.32 H new ATOM 0 HA ILE A 109 7.247 -2.883 -12.644 1.00 34.11 H new ATOM 0 HB ILE A 109 8.948 -4.631 -12.648 1.00 13.44 H new ATOM 0 HG12 ILE A 109 9.880 -2.382 -14.461 1.00 63.32 H new ATOM 0 HG13 ILE A 109 9.598 -2.182 -12.743 1.00 63.32 H new ATOM 0 HG21 ILE A 109 10.067 -5.334 -14.725 1.00 2.22 H new ATOM 0 HG22 ILE A 109 8.333 -5.733 -14.745 1.00 2.22 H new ATOM 0 HG23 ILE A 109 8.935 -4.336 -15.669 1.00 2.22 H new ATOM 0 HD11 ILE A 109 11.972 -2.554 -13.205 1.00 63.11 H new ATOM 0 HD12 ILE A 109 11.303 -3.899 -12.250 1.00 63.11 H new ATOM 0 HD13 ILE A 109 11.589 -4.102 -13.995 1.00 63.11 H new ATOM 1751 N PHE A 110 7.463 -1.180 -14.477 1.00 15.14 N ATOM 1752 CA PHE A 110 7.377 -0.160 -15.515 1.00 73.15 C ATOM 1753 C PHE A 110 8.456 0.902 -15.326 1.00 32.14 C ATOM 1754 O PHE A 110 8.504 1.575 -14.297 1.00 5.23 O ATOM 1755 CB PHE A 110 5.994 0.494 -15.504 1.00 53.34 C ATOM 1756 CG PHE A 110 5.909 1.731 -16.353 1.00 32.22 C ATOM 1757 CD1 PHE A 110 5.678 1.637 -17.716 1.00 10.32 C ATOM 1758 CD2 PHE A 110 6.060 2.987 -15.787 1.00 63.34 C ATOM 1759 CE1 PHE A 110 5.599 2.773 -18.499 1.00 51.24 C ATOM 1760 CE2 PHE A 110 5.982 4.126 -16.566 1.00 32.02 C ATOM 1761 CZ PHE A 110 5.752 4.019 -17.924 1.00 1.14 C ATOM 0 H PHE A 110 7.653 -0.816 -13.543 1.00 15.14 H new ATOM 0 HA PHE A 110 7.534 -0.644 -16.479 1.00 73.15 H new ATOM 0 HB2 PHE A 110 5.256 -0.228 -15.854 1.00 53.34 H new ATOM 0 HB3 PHE A 110 5.729 0.748 -14.478 1.00 53.34 H new ATOM 0 HD1 PHE A 110 5.558 0.665 -18.172 1.00 10.32 H new ATOM 0 HD2 PHE A 110 6.241 3.077 -14.726 1.00 63.34 H new ATOM 0 HE1 PHE A 110 5.418 2.686 -19.560 1.00 51.24 H new ATOM 0 HE2 PHE A 110 6.101 5.099 -16.113 1.00 32.02 H new ATOM 0 HZ PHE A 110 5.692 4.908 -18.534 1.00 1.14 H new ATOM 1771 N MET A 111 9.319 1.045 -16.326 1.00 24.34 N ATOM 1772 CA MET A 111 10.398 2.025 -16.269 1.00 73.14 C ATOM 1773 C MET A 111 10.469 2.829 -17.564 1.00 2.35 C ATOM 1774 O MET A 111 10.495 2.264 -18.657 1.00 73.44 O ATOM 1775 CB MET A 111 11.736 1.329 -16.013 1.00 73.34 C ATOM 1776 CG MET A 111 11.667 0.257 -14.938 1.00 70.51 C ATOM 1777 SD MET A 111 12.927 0.467 -13.666 1.00 23.01 S ATOM 1778 CE MET A 111 11.988 0.079 -12.191 1.00 72.11 C ATOM 0 H MET A 111 9.293 0.496 -17.185 1.00 24.34 H new ATOM 0 HA MET A 111 10.191 2.710 -15.447 1.00 73.14 H new ATOM 0 HB2 MET A 111 12.086 0.878 -16.942 1.00 73.34 H new ATOM 0 HB3 MET A 111 12.475 2.076 -15.723 1.00 73.34 H new ATOM 0 HG2 MET A 111 10.681 0.276 -14.474 1.00 70.51 H new ATOM 0 HG3 MET A 111 11.783 -0.723 -15.400 1.00 70.51 H new ATOM 0 HE1 MET A 111 12.575 0.334 -11.309 1.00 72.11 H new ATOM 0 HE2 MET A 111 11.061 0.652 -12.189 1.00 72.11 H new ATOM 0 HE3 MET A 111 11.756 -0.986 -12.177 1.00 72.11 H new ATOM 1788 N LEU A 112 10.501 4.151 -17.432 1.00 71.23 N ATOM 1789 CA LEU A 112 10.569 5.033 -18.592 1.00 2.41 C ATOM 1790 C LEU A 112 11.290 6.332 -18.246 1.00 3.21 C ATOM 1791 O LEU A 112 11.246 6.793 -17.105 1.00 41.43 O ATOM 1792 CB LEU A 112 9.162 5.340 -19.108 1.00 21.31 C ATOM 1793 CG LEU A 112 8.948 5.174 -20.613 1.00 4.40 C ATOM 1794 CD1 LEU A 112 7.750 4.279 -20.887 1.00 14.43 C ATOM 1795 CD2 LEU A 112 8.766 6.531 -21.278 1.00 65.10 C ATOM 0 H LEU A 112 10.481 4.635 -16.534 1.00 71.23 H new ATOM 0 HA LEU A 112 11.132 4.522 -19.373 1.00 2.41 H new ATOM 0 HB2 LEU A 112 8.456 4.693 -18.587 1.00 21.31 H new ATOM 0 HB3 LEU A 112 8.913 6.366 -18.837 1.00 21.31 H new ATOM 0 HG LEU A 112 9.833 4.700 -21.036 1.00 4.40 H new ATOM 0 HD11 LEU A 112 7.614 4.173 -21.963 1.00 14.43 H new ATOM 0 HD12 LEU A 112 7.920 3.298 -20.444 1.00 14.43 H new ATOM 0 HD13 LEU A 112 6.856 4.724 -20.450 1.00 14.43 H new ATOM 0 HD21 LEU A 112 8.615 6.394 -22.349 1.00 65.10 H new ATOM 0 HD22 LEU A 112 7.898 7.032 -20.850 1.00 65.10 H new ATOM 0 HD23 LEU A 112 9.655 7.140 -21.112 1.00 65.10 H new ATOM 1807 N ARG A 113 11.952 6.918 -19.239 1.00 12.15 N ATOM 1808 CA ARG A 113 12.681 8.165 -19.039 1.00 65.54 C ATOM 1809 C ARG A 113 11.720 9.343 -18.913 1.00 63.11 C ATOM 1810 O ARG A 113 12.015 10.327 -18.235 1.00 40.41 O ATOM 1811 CB ARG A 113 13.650 8.404 -20.199 1.00 53.42 C ATOM 1812 CG ARG A 113 12.973 8.441 -21.560 1.00 2.02 C ATOM 1813 CD ARG A 113 13.452 7.305 -22.451 1.00 11.53 C ATOM 1814 NE ARG A 113 13.561 7.715 -23.848 1.00 73.13 N ATOM 1815 CZ ARG A 113 14.599 8.382 -24.340 1.00 61.41 C ATOM 1816 NH1 ARG A 113 15.613 8.712 -23.552 1.00 33.12 N ATOM 1817 NH2 ARG A 113 14.625 8.719 -25.623 1.00 62.22 N ATOM 0 H ARG A 113 11.998 6.550 -20.189 1.00 12.15 H new ATOM 0 HA ARG A 113 13.248 8.081 -18.112 1.00 65.54 H new ATOM 0 HB2 ARG A 113 14.172 9.347 -20.037 1.00 53.42 H new ATOM 0 HB3 ARG A 113 14.405 7.617 -20.199 1.00 53.42 H new ATOM 0 HG2 ARG A 113 11.893 8.374 -21.432 1.00 2.02 H new ATOM 0 HG3 ARG A 113 13.178 9.396 -22.044 1.00 2.02 H new ATOM 0 HD2 ARG A 113 14.422 6.953 -22.100 1.00 11.53 H new ATOM 0 HD3 ARG A 113 12.761 6.466 -22.372 1.00 11.53 H new ATOM 0 HE ARG A 113 12.798 7.476 -24.481 1.00 73.13 H new ATOM 0 HH11 ARG A 113 15.597 8.454 -22.565 1.00 33.12 H new ATOM 0 HH12 ARG A 113 16.409 9.224 -23.932 1.00 33.12 H new ATOM 0 HH21 ARG A 113 13.847 8.466 -26.233 1.00 62.22 H new ATOM 0 HH22 ARG A 113 15.423 9.231 -26.000 1.00 62.22 H new ATOM 1831 N ASP A 114 10.571 9.235 -19.571 1.00 1.24 N ATOM 1832 CA ASP A 114 9.566 10.291 -19.532 1.00 1.32 C ATOM 1833 C ASP A 114 8.572 10.054 -18.399 1.00 71.14 C ATOM 1834 O ASP A 114 8.569 10.773 -17.401 1.00 50.34 O ATOM 1835 CB ASP A 114 8.827 10.370 -20.868 1.00 55.23 C ATOM 1836 CG ASP A 114 9.657 11.031 -21.951 1.00 74.22 C ATOM 1837 OD1 ASP A 114 10.885 10.808 -21.977 1.00 23.52 O ATOM 1838 OD2 ASP A 114 9.078 11.771 -22.774 1.00 34.52 O ATOM 0 H ASP A 114 10.312 8.427 -20.138 1.00 1.24 H new ATOM 0 HA ASP A 114 10.076 11.237 -19.351 1.00 1.32 H new ATOM 0 HB2 ASP A 114 8.552 9.365 -21.188 1.00 55.23 H new ATOM 0 HB3 ASP A 114 7.900 10.927 -20.734 1.00 55.23 H new ATOM 1843 N GLY A 115 7.728 9.040 -18.562 1.00 74.35 N ATOM 1844 CA GLY A 115 6.739 8.727 -17.547 1.00 24.51 C ATOM 1845 C GLY A 115 5.445 9.491 -17.742 1.00 2.11 C ATOM 1846 O GLY A 115 4.360 8.914 -17.678 1.00 13.00 O ATOM 0 H GLY A 115 7.711 8.430 -19.379 1.00 74.35 H new ATOM 0 HA2 GLY A 115 6.532 7.657 -17.564 1.00 24.51 H new ATOM 0 HA3 GLY A 115 7.148 8.957 -16.563 1.00 24.51 H new ATOM 1850 N SER A 116 5.559 10.794 -17.979 1.00 22.01 N ATOM 1851 CA SER A 116 4.388 11.640 -18.178 1.00 44.13 C ATOM 1852 C SER A 116 3.617 11.215 -19.424 1.00 33.12 C ATOM 1853 O SER A 116 2.443 10.851 -19.346 1.00 70.14 O ATOM 1854 CB SER A 116 4.807 13.106 -18.300 1.00 4.41 C ATOM 1855 OG SER A 116 4.671 13.780 -17.061 1.00 10.23 O ATOM 0 H SER A 116 6.450 11.287 -18.038 1.00 22.01 H new ATOM 0 HA SER A 116 3.736 11.526 -17.312 1.00 44.13 H new ATOM 0 HB2 SER A 116 5.842 13.165 -18.638 1.00 4.41 H new ATOM 0 HB3 SER A 116 4.196 13.600 -19.055 1.00 4.41 H new ATOM 0 HG SER A 116 4.947 14.715 -17.165 1.00 10.23 H new ATOM 1861 N TYR A 117 4.284 11.264 -20.571 1.00 24.00 N ATOM 1862 CA TYR A 117 3.662 10.887 -21.834 1.00 70.34 C ATOM 1863 C TYR A 117 3.415 9.382 -21.892 1.00 41.32 C ATOM 1864 O TYR A 117 2.433 8.925 -22.476 1.00 13.23 O ATOM 1865 CB TYR A 117 4.543 11.316 -23.009 1.00 73.31 C ATOM 1866 CG TYR A 117 3.759 11.752 -24.226 1.00 15.20 C ATOM 1867 CD1 TYR A 117 3.202 13.023 -24.299 1.00 4.51 C ATOM 1868 CD2 TYR A 117 3.573 10.893 -25.302 1.00 52.32 C ATOM 1869 CE1 TYR A 117 2.485 13.427 -25.408 1.00 74.54 C ATOM 1870 CE2 TYR A 117 2.858 11.288 -26.416 1.00 52.32 C ATOM 1871 CZ TYR A 117 2.316 12.556 -26.464 1.00 75.45 C ATOM 1872 OH TYR A 117 1.601 12.952 -27.572 1.00 4.42 O ATOM 0 H TYR A 117 5.256 11.561 -20.652 1.00 24.00 H new ATOM 0 HA TYR A 117 2.702 11.398 -21.903 1.00 70.34 H new ATOM 0 HB2 TYR A 117 5.187 12.135 -22.689 1.00 73.31 H new ATOM 0 HB3 TYR A 117 5.195 10.487 -23.285 1.00 73.31 H new ATOM 0 HD1 TYR A 117 3.332 13.707 -23.474 1.00 4.51 H new ATOM 0 HD2 TYR A 117 3.995 9.899 -25.267 1.00 52.32 H new ATOM 0 HE1 TYR A 117 2.059 14.419 -25.448 1.00 74.54 H new ATOM 0 HE2 TYR A 117 2.724 10.608 -27.245 1.00 52.32 H new ATOM 0 HH TYR A 117 1.577 12.221 -28.224 1.00 4.42 H new ATOM 1882 N ALA A 118 4.315 8.618 -21.282 1.00 35.24 N ATOM 1883 CA ALA A 118 4.194 7.165 -21.260 1.00 43.33 C ATOM 1884 C ALA A 118 3.021 6.724 -20.392 1.00 3.24 C ATOM 1885 O ALA A 118 2.411 5.684 -20.638 1.00 61.11 O ATOM 1886 CB ALA A 118 5.487 6.536 -20.764 1.00 25.04 C ATOM 0 H ALA A 118 5.136 8.981 -20.797 1.00 35.24 H new ATOM 0 HA ALA A 118 4.005 6.825 -22.278 1.00 43.33 H new ATOM 0 HB1 ALA A 118 5.383 5.451 -20.753 1.00 25.04 H new ATOM 0 HB2 ALA A 118 6.305 6.815 -21.428 1.00 25.04 H new ATOM 0 HB3 ALA A 118 5.701 6.891 -19.756 1.00 25.04 H new ATOM 1892 N TRP A 119 2.712 7.521 -19.375 1.00 20.31 N ATOM 1893 CA TRP A 119 1.612 7.211 -18.469 1.00 13.01 C ATOM 1894 C TRP A 119 0.331 6.926 -19.245 1.00 70.24 C ATOM 1895 O TRP A 119 -0.516 6.153 -18.799 1.00 61.43 O ATOM 1896 CB TRP A 119 1.385 8.368 -17.495 1.00 2.24 C ATOM 1897 CG TRP A 119 0.193 8.173 -16.607 1.00 64.30 C ATOM 1898 CD1 TRP A 119 -1.110 8.439 -16.915 1.00 12.32 C ATOM 1899 CD2 TRP A 119 0.197 7.671 -15.266 1.00 74.53 C ATOM 1900 NE1 TRP A 119 -1.918 8.133 -15.846 1.00 4.21 N ATOM 1901 CE2 TRP A 119 -1.140 7.659 -14.823 1.00 33.14 C ATOM 1902 CE3 TRP A 119 1.198 7.228 -14.398 1.00 61.31 C ATOM 1903 CZ2 TRP A 119 -1.498 7.223 -13.550 1.00 10.15 C ATOM 1904 CZ3 TRP A 119 0.841 6.796 -13.135 1.00 25.21 C ATOM 1905 CH2 TRP A 119 -0.497 6.795 -12.720 1.00 51.14 C ATOM 0 H TRP A 119 3.207 8.386 -19.157 1.00 20.31 H new ATOM 0 HA TRP A 119 1.880 6.317 -17.905 1.00 13.01 H new ATOM 0 HB2 TRP A 119 2.274 8.492 -16.876 1.00 2.24 H new ATOM 0 HB3 TRP A 119 1.260 9.291 -18.061 1.00 2.24 H new ATOM 0 HD1 TRP A 119 -1.455 8.832 -17.860 1.00 12.32 H new ATOM 0 HE1 TRP A 119 -2.932 8.241 -15.819 1.00 4.21 H new ATOM 0 HE3 TRP A 119 2.232 7.223 -14.709 1.00 61.31 H new ATOM 0 HZ2 TRP A 119 -2.529 7.222 -13.229 1.00 10.15 H new ATOM 0 HZ3 TRP A 119 1.607 6.453 -12.456 1.00 25.21 H new ATOM 0 HH2 TRP A 119 -0.743 6.450 -11.727 1.00 51.14 H new ATOM 1916 N GLU A 120 0.197 7.555 -20.409 1.00 33.12 N ATOM 1917 CA GLU A 120 -0.982 7.368 -21.246 1.00 74.40 C ATOM 1918 C GLU A 120 -1.097 5.918 -21.709 1.00 25.13 C ATOM 1919 O GLU A 120 -2.102 5.253 -21.457 1.00 63.43 O ATOM 1920 CB GLU A 120 -0.927 8.299 -22.459 1.00 32.30 C ATOM 1921 CG GLU A 120 -1.483 9.686 -22.187 1.00 2.52 C ATOM 1922 CD GLU A 120 -2.654 10.032 -23.085 1.00 53.43 C ATOM 1923 OE1 GLU A 120 -3.654 9.284 -23.072 1.00 42.24 O ATOM 1924 OE2 GLU A 120 -2.571 11.052 -23.801 1.00 50.33 O ATOM 0 H GLU A 120 0.890 8.198 -20.793 1.00 33.12 H new ATOM 0 HA GLU A 120 -1.861 7.612 -20.649 1.00 74.40 H new ATOM 0 HB2 GLU A 120 0.108 8.390 -22.790 1.00 32.30 H new ATOM 0 HB3 GLU A 120 -1.485 7.847 -23.279 1.00 32.30 H new ATOM 0 HG2 GLU A 120 -1.798 9.749 -21.145 1.00 2.52 H new ATOM 0 HG3 GLU A 120 -0.693 10.424 -22.326 1.00 2.52 H new ATOM 1931 N ILE A 121 -0.060 5.436 -22.386 1.00 50.01 N ATOM 1932 CA ILE A 121 -0.043 4.066 -22.883 1.00 74.04 C ATOM 1933 C ILE A 121 0.071 3.067 -21.737 1.00 65.44 C ATOM 1934 O ILE A 121 -0.497 1.976 -21.791 1.00 23.42 O ATOM 1935 CB ILE A 121 1.120 3.838 -23.867 1.00 13.21 C ATOM 1936 CG1 ILE A 121 1.019 4.810 -25.044 1.00 53.22 C ATOM 1937 CG2 ILE A 121 1.122 2.399 -24.360 1.00 22.10 C ATOM 1938 CD1 ILE A 121 2.175 4.707 -26.014 1.00 71.31 C ATOM 0 H ILE A 121 0.779 5.974 -22.603 1.00 50.01 H new ATOM 0 HA ILE A 121 -0.986 3.908 -23.406 1.00 74.04 H new ATOM 0 HB ILE A 121 2.059 4.024 -23.346 1.00 13.21 H new ATOM 0 HG12 ILE A 121 0.088 4.624 -25.580 1.00 53.22 H new ATOM 0 HG13 ILE A 121 0.967 5.829 -24.660 1.00 53.22 H new ATOM 0 HG21 ILE A 121 1.949 2.253 -25.054 1.00 22.10 H new ATOM 0 HG22 ILE A 121 1.237 1.724 -23.512 1.00 22.10 H new ATOM 0 HG23 ILE A 121 0.181 2.187 -24.867 1.00 22.10 H new ATOM 0 HD11 ILE A 121 2.037 5.425 -26.822 1.00 71.31 H new ATOM 0 HD12 ILE A 121 3.108 4.923 -25.493 1.00 71.31 H new ATOM 0 HD13 ILE A 121 2.215 3.699 -26.427 1.00 71.31 H new ATOM 1950 N LYS A 122 0.809 3.447 -20.700 1.00 22.22 N ATOM 1951 CA LYS A 122 0.997 2.586 -19.538 1.00 1.42 C ATOM 1952 C LYS A 122 -0.344 2.098 -19.000 1.00 11.35 C ATOM 1953 O LYS A 122 -0.439 1.005 -18.441 1.00 3.42 O ATOM 1954 CB LYS A 122 1.757 3.335 -18.441 1.00 11.34 C ATOM 1955 CG LYS A 122 1.822 2.582 -17.123 1.00 55.40 C ATOM 1956 CD LYS A 122 0.976 3.255 -16.054 1.00 61.14 C ATOM 1957 CE LYS A 122 -0.395 2.607 -15.939 1.00 31.11 C ATOM 1958 NZ LYS A 122 -0.939 2.703 -14.556 1.00 54.41 N ATOM 0 H LYS A 122 1.287 4.346 -20.640 1.00 22.22 H new ATOM 0 HA LYS A 122 1.580 1.719 -19.849 1.00 1.42 H new ATOM 0 HB2 LYS A 122 2.771 3.536 -18.786 1.00 11.34 H new ATOM 0 HB3 LYS A 122 1.280 4.301 -18.275 1.00 11.34 H new ATOM 0 HG2 LYS A 122 1.477 1.558 -17.270 1.00 55.40 H new ATOM 0 HG3 LYS A 122 2.857 2.524 -16.786 1.00 55.40 H new ATOM 0 HD2 LYS A 122 1.488 3.198 -15.094 1.00 61.14 H new ATOM 0 HD3 LYS A 122 0.861 4.313 -16.292 1.00 61.14 H new ATOM 0 HE2 LYS A 122 -1.083 3.087 -16.634 1.00 31.11 H new ATOM 0 HE3 LYS A 122 -0.327 1.559 -16.231 1.00 31.11 H new ATOM 0 HZ1 LYS A 122 -1.874 2.250 -14.519 1.00 54.41 H new ATOM 0 HZ2 LYS A 122 -0.295 2.223 -13.896 1.00 54.41 H new ATOM 0 HZ3 LYS A 122 -1.028 3.704 -14.287 1.00 54.41 H new ATOM 1972 N ASP A 123 -1.378 2.914 -19.173 1.00 10.22 N ATOM 1973 CA ASP A 123 -2.715 2.564 -18.707 1.00 23.04 C ATOM 1974 C ASP A 123 -3.162 1.229 -19.293 1.00 75.04 C ATOM 1975 O ASP A 123 -3.485 0.294 -18.561 1.00 22.35 O ATOM 1976 CB ASP A 123 -3.713 3.661 -19.082 1.00 65.41 C ATOM 1977 CG ASP A 123 -4.499 4.162 -17.887 1.00 32.41 C ATOM 1978 OD1 ASP A 123 -5.114 3.328 -17.190 1.00 25.33 O ATOM 1979 OD2 ASP A 123 -4.501 5.388 -17.649 1.00 72.12 O ATOM 0 H ASP A 123 -1.316 3.823 -19.633 1.00 10.22 H new ATOM 0 HA ASP A 123 -2.682 2.471 -17.622 1.00 23.04 H new ATOM 0 HB2 ASP A 123 -3.178 4.495 -19.537 1.00 65.41 H new ATOM 0 HB3 ASP A 123 -4.404 3.278 -19.833 1.00 65.41 H new ATOM 1984 N PHE A 124 -3.181 1.148 -20.620 1.00 31.13 N ATOM 1985 CA PHE A 124 -3.591 -0.072 -21.305 1.00 55.14 C ATOM 1986 C PHE A 124 -2.553 -1.174 -21.122 1.00 65.55 C ATOM 1987 O PHE A 124 -2.884 -2.361 -21.113 1.00 53.31 O ATOM 1988 CB PHE A 124 -3.804 0.202 -22.796 1.00 3.23 C ATOM 1989 CG PHE A 124 -4.549 -0.891 -23.506 1.00 62.42 C ATOM 1990 CD1 PHE A 124 -5.864 -1.178 -23.178 1.00 30.23 C ATOM 1991 CD2 PHE A 124 -3.934 -1.632 -24.503 1.00 33.22 C ATOM 1992 CE1 PHE A 124 -6.552 -2.185 -23.829 1.00 45.55 C ATOM 1993 CE2 PHE A 124 -4.617 -2.640 -25.158 1.00 50.54 C ATOM 1994 CZ PHE A 124 -5.928 -2.915 -24.822 1.00 23.21 C ATOM 0 H PHE A 124 -2.917 1.913 -21.242 1.00 31.13 H new ATOM 0 HA PHE A 124 -4.531 -0.407 -20.866 1.00 55.14 H new ATOM 0 HB2 PHE A 124 -4.351 1.138 -22.911 1.00 3.23 H new ATOM 0 HB3 PHE A 124 -2.834 0.340 -23.274 1.00 3.23 H new ATOM 0 HD1 PHE A 124 -6.358 -0.608 -22.405 1.00 30.23 H new ATOM 0 HD2 PHE A 124 -2.910 -1.420 -24.771 1.00 33.22 H new ATOM 0 HE1 PHE A 124 -7.576 -2.401 -23.562 1.00 45.55 H new ATOM 0 HE2 PHE A 124 -4.126 -3.212 -25.932 1.00 50.54 H new ATOM 0 HZ PHE A 124 -6.465 -3.700 -25.335 1.00 23.21 H new ATOM 2004 N LEU A 125 -1.294 -0.775 -20.978 1.00 40.20 N ATOM 2005 CA LEU A 125 -0.205 -1.728 -20.796 1.00 4.22 C ATOM 2006 C LEU A 125 -0.459 -2.620 -19.585 1.00 4.01 C ATOM 2007 O LEU A 125 -0.462 -3.846 -19.694 1.00 24.33 O ATOM 2008 CB LEU A 125 1.124 -0.988 -20.629 1.00 31.20 C ATOM 2009 CG LEU A 125 1.734 -0.408 -21.905 1.00 70.04 C ATOM 2010 CD1 LEU A 125 3.006 0.362 -21.587 1.00 22.11 C ATOM 2011 CD2 LEU A 125 2.015 -1.514 -22.912 1.00 45.23 C ATOM 0 H LEU A 125 -1.002 0.202 -20.984 1.00 40.20 H new ATOM 0 HA LEU A 125 -0.154 -2.358 -21.684 1.00 4.22 H new ATOM 0 HB2 LEU A 125 0.977 -0.175 -19.918 1.00 31.20 H new ATOM 0 HB3 LEU A 125 1.845 -1.674 -20.184 1.00 31.20 H new ATOM 0 HG LEU A 125 1.016 0.284 -22.346 1.00 70.04 H new ATOM 0 HD11 LEU A 125 3.426 0.767 -22.508 1.00 22.11 H new ATOM 0 HD12 LEU A 125 2.776 1.179 -20.903 1.00 22.11 H new ATOM 0 HD13 LEU A 125 3.730 -0.307 -21.122 1.00 22.11 H new ATOM 0 HD21 LEU A 125 2.449 -1.083 -23.814 1.00 45.23 H new ATOM 0 HD22 LEU A 125 2.714 -2.231 -22.480 1.00 45.23 H new ATOM 0 HD23 LEU A 125 1.084 -2.022 -23.164 1.00 45.23 H new ATOM 2023 N VAL A 126 -0.673 -1.996 -18.431 1.00 55.11 N ATOM 2024 CA VAL A 126 -0.932 -2.733 -17.200 1.00 0.22 C ATOM 2025 C VAL A 126 -2.282 -3.438 -17.255 1.00 34.12 C ATOM 2026 O VAL A 126 -2.468 -4.494 -16.650 1.00 0.13 O ATOM 2027 CB VAL A 126 -0.900 -1.803 -15.972 1.00 72.21 C ATOM 2028 CG1 VAL A 126 -1.944 -0.705 -16.106 1.00 75.42 C ATOM 2029 CG2 VAL A 126 -1.114 -2.601 -14.695 1.00 14.03 C ATOM 0 H VAL A 126 -0.672 -0.982 -18.323 1.00 55.11 H new ATOM 0 HA VAL A 126 -0.141 -3.477 -17.104 1.00 0.22 H new ATOM 0 HB VAL A 126 0.082 -1.332 -15.919 1.00 72.21 H new ATOM 0 HG11 VAL A 126 -1.906 -0.058 -15.229 1.00 75.42 H new ATOM 0 HG12 VAL A 126 -1.740 -0.116 -17.000 1.00 75.42 H new ATOM 0 HG13 VAL A 126 -2.935 -1.153 -16.184 1.00 75.42 H new ATOM 0 HG21 VAL A 126 -1.088 -1.929 -13.837 1.00 14.03 H new ATOM 0 HG22 VAL A 126 -2.082 -3.100 -14.736 1.00 14.03 H new ATOM 0 HG23 VAL A 126 -0.325 -3.346 -14.595 1.00 14.03 H new ATOM 2039 N SER A 127 -3.223 -2.847 -17.985 1.00 31.51 N ATOM 2040 CA SER A 127 -4.559 -3.417 -18.117 1.00 22.53 C ATOM 2041 C SER A 127 -4.486 -4.878 -18.551 1.00 63.13 C ATOM 2042 O SER A 127 -5.341 -5.687 -18.192 1.00 11.51 O ATOM 2043 CB SER A 127 -5.382 -2.614 -19.125 1.00 61.05 C ATOM 2044 OG SER A 127 -6.170 -3.468 -19.936 1.00 61.23 O ATOM 0 H SER A 127 -3.085 -1.974 -18.494 1.00 31.51 H new ATOM 0 HA SER A 127 -5.045 -3.370 -17.143 1.00 22.53 H new ATOM 0 HB2 SER A 127 -6.027 -1.913 -18.596 1.00 61.05 H new ATOM 0 HB3 SER A 127 -4.716 -2.023 -19.754 1.00 61.05 H new ATOM 0 HG SER A 127 -6.688 -2.930 -20.571 1.00 61.23 H new ATOM 2050 N GLN A 128 -3.458 -5.207 -19.327 1.00 23.42 N ATOM 2051 CA GLN A 128 -3.273 -6.570 -19.811 1.00 62.14 C ATOM 2052 C GLN A 128 -3.223 -7.559 -18.651 1.00 10.51 C ATOM 2053 O GLN A 128 -3.909 -8.581 -18.664 1.00 2.13 O ATOM 2054 CB GLN A 128 -1.989 -6.670 -20.638 1.00 33.44 C ATOM 2055 CG GLN A 128 -1.987 -5.778 -21.868 1.00 42.02 C ATOM 2056 CD GLN A 128 -2.507 -6.486 -23.104 1.00 31.04 C ATOM 2057 OE1 GLN A 128 -2.804 -7.680 -23.070 1.00 34.53 O ATOM 2058 NE2 GLN A 128 -2.620 -5.751 -24.204 1.00 33.22 N ATOM 0 H GLN A 128 -2.741 -4.549 -19.634 1.00 23.42 H new ATOM 0 HA GLN A 128 -4.125 -6.823 -20.442 1.00 62.14 H new ATOM 0 HB2 GLN A 128 -1.139 -6.408 -20.008 1.00 33.44 H new ATOM 0 HB3 GLN A 128 -1.847 -7.705 -20.950 1.00 33.44 H new ATOM 0 HG2 GLN A 128 -2.599 -4.897 -21.674 1.00 42.02 H new ATOM 0 HG3 GLN A 128 -0.972 -5.426 -22.055 1.00 42.02 H new ATOM 0 HE21 GLN A 128 -2.362 -4.764 -24.187 1.00 33.22 H new ATOM 0 HE22 GLN A 128 -2.965 -6.173 -25.066 1.00 33.22 H new ATOM 2067 N ASP A 129 -2.408 -7.247 -17.650 1.00 5.03 N ATOM 2068 CA ASP A 129 -2.269 -8.108 -16.481 1.00 3.44 C ATOM 2069 C ASP A 129 -1.692 -9.465 -16.870 1.00 71.05 C ATOM 2070 O ASP A 129 -1.800 -10.435 -16.120 1.00 0.10 O ATOM 2071 CB ASP A 129 -3.622 -8.293 -15.793 1.00 55.25 C ATOM 2072 CG ASP A 129 -3.582 -7.918 -14.325 1.00 35.40 C ATOM 2073 OD1 ASP A 129 -3.358 -6.728 -14.023 1.00 14.14 O ATOM 2074 OD2 ASP A 129 -3.774 -8.816 -13.478 1.00 34.11 O ATOM 0 H ASP A 129 -1.834 -6.405 -17.624 1.00 5.03 H new ATOM 0 HA ASP A 129 -1.580 -7.627 -15.787 1.00 3.44 H new ATOM 0 HB2 ASP A 129 -4.370 -7.684 -16.300 1.00 55.25 H new ATOM 0 HB3 ASP A 129 -3.937 -9.332 -15.891 1.00 55.25 H new ATOM 2079 N ARG A 130 -1.081 -9.526 -18.049 1.00 70.21 N ATOM 2080 CA ARG A 130 -0.490 -10.765 -18.540 1.00 23.34 C ATOM 2081 C ARG A 130 0.257 -10.530 -19.850 1.00 33.14 C ATOM 2082 O ARG A 130 -0.117 -11.067 -20.893 1.00 64.22 O ATOM 2083 CB ARG A 130 -1.572 -11.827 -18.741 1.00 31.45 C ATOM 2084 CG ARG A 130 -1.024 -13.188 -19.140 1.00 10.31 C ATOM 2085 CD ARG A 130 -1.589 -14.295 -18.264 1.00 51.01 C ATOM 2086 NE ARG A 130 -1.342 -14.051 -16.846 1.00 3.04 N ATOM 2087 CZ ARG A 130 -1.471 -14.981 -15.906 1.00 62.44 C ATOM 2088 NH1 ARG A 130 -1.842 -16.211 -16.234 1.00 33.43 N ATOM 2089 NH2 ARG A 130 -1.228 -14.682 -14.637 1.00 24.43 N ATOM 0 H ARG A 130 -0.982 -8.732 -18.682 1.00 70.21 H new ATOM 0 HA ARG A 130 0.222 -11.118 -17.794 1.00 23.34 H new ATOM 0 HB2 ARG A 130 -2.143 -11.931 -17.818 1.00 31.45 H new ATOM 0 HB3 ARG A 130 -2.266 -11.485 -19.509 1.00 31.45 H new ATOM 0 HG2 ARG A 130 -1.268 -13.388 -20.183 1.00 10.31 H new ATOM 0 HG3 ARG A 130 0.063 -13.181 -19.063 1.00 10.31 H new ATOM 0 HD2 ARG A 130 -2.662 -14.381 -18.435 1.00 51.01 H new ATOM 0 HD3 ARG A 130 -1.143 -15.247 -18.551 1.00 51.01 H new ATOM 0 HE ARG A 130 -1.054 -13.115 -16.561 1.00 3.04 H new ATOM 0 HH11 ARG A 130 -2.029 -16.444 -17.209 1.00 33.43 H new ATOM 0 HH12 ARG A 130 -1.941 -16.924 -15.511 1.00 33.43 H new ATOM 0 HH21 ARG A 130 -0.942 -13.737 -14.382 1.00 24.43 H new ATOM 0 HH22 ARG A 130 -1.328 -15.397 -13.916 1.00 24.43 H new ATOM 2103 N CYS A 131 1.311 -9.725 -19.787 1.00 41.22 N ATOM 2104 CA CYS A 131 2.109 -9.417 -20.969 1.00 24.33 C ATOM 2105 C CYS A 131 3.560 -9.142 -20.588 1.00 3.21 C ATOM 2106 O CYS A 131 3.836 -8.514 -19.566 1.00 52.42 O ATOM 2107 CB CYS A 131 1.525 -8.211 -21.705 1.00 33.01 C ATOM 2108 SG CYS A 131 2.129 -8.016 -23.398 1.00 13.41 S ATOM 0 H CYS A 131 1.633 -9.274 -18.931 1.00 41.22 H new ATOM 0 HA CYS A 131 2.083 -10.283 -21.630 1.00 24.33 H new ATOM 0 HB2 CYS A 131 0.439 -8.303 -21.726 1.00 33.01 H new ATOM 0 HB3 CYS A 131 1.757 -7.307 -21.141 1.00 33.01 H new ATOM 0 HG CYS A 131 1.576 -6.971 -23.938 1.00 13.41 H new ATOM 2114 N ALA A 132 4.485 -9.618 -21.416 1.00 15.40 N ATOM 2115 CA ALA A 132 5.907 -9.422 -21.166 1.00 63.33 C ATOM 2116 C ALA A 132 6.564 -8.650 -22.306 1.00 33.31 C ATOM 2117 O ALA A 132 6.448 -9.029 -23.471 1.00 24.11 O ATOM 2118 CB ALA A 132 6.597 -10.764 -20.969 1.00 4.23 C ATOM 0 H ALA A 132 4.274 -10.142 -22.265 1.00 15.40 H new ATOM 0 HA ALA A 132 6.013 -8.833 -20.255 1.00 63.33 H new ATOM 0 HB1 ALA A 132 7.659 -10.603 -20.783 1.00 4.23 H new ATOM 0 HB2 ALA A 132 6.153 -11.280 -20.117 1.00 4.23 H new ATOM 0 HB3 ALA A 132 6.474 -11.372 -21.865 1.00 4.23 H new ATOM 2124 N GLU A 133 7.251 -7.566 -21.961 1.00 63.11 N ATOM 2125 CA GLU A 133 7.924 -6.741 -22.957 1.00 5.41 C ATOM 2126 C GLU A 133 9.171 -6.086 -22.369 1.00 23.54 C ATOM 2127 O GLU A 133 9.200 -5.725 -21.192 1.00 41.11 O ATOM 2128 CB GLU A 133 6.974 -5.666 -23.488 1.00 14.32 C ATOM 2129 CG GLU A 133 5.998 -6.179 -24.534 1.00 1.23 C ATOM 2130 CD GLU A 133 4.957 -5.145 -24.917 1.00 33.40 C ATOM 2131 OE1 GLU A 133 5.168 -3.951 -24.617 1.00 65.55 O ATOM 2132 OE2 GLU A 133 3.931 -5.530 -25.516 1.00 13.14 O ATOM 0 H GLU A 133 7.356 -7.239 -21.001 1.00 63.11 H new ATOM 0 HA GLU A 133 8.227 -7.387 -23.781 1.00 5.41 H new ATOM 0 HB2 GLU A 133 6.412 -5.246 -22.654 1.00 14.32 H new ATOM 0 HB3 GLU A 133 7.561 -4.854 -23.918 1.00 14.32 H new ATOM 0 HG2 GLU A 133 6.550 -6.480 -25.424 1.00 1.23 H new ATOM 0 HG3 GLU A 133 5.498 -7.069 -24.153 1.00 1.23 H new ATOM 2139 N VAL A 134 10.201 -5.938 -23.196 1.00 21.30 N ATOM 2140 CA VAL A 134 11.451 -5.328 -22.759 1.00 40.22 C ATOM 2141 C VAL A 134 12.148 -4.616 -23.913 1.00 55.44 C ATOM 2142 O VAL A 134 12.384 -5.204 -24.969 1.00 53.23 O ATOM 2143 CB VAL A 134 12.410 -6.376 -22.164 1.00 13.02 C ATOM 2144 CG1 VAL A 134 12.651 -7.504 -23.156 1.00 2.52 C ATOM 2145 CG2 VAL A 134 13.722 -5.725 -21.754 1.00 62.11 C ATOM 0 H VAL A 134 10.194 -6.232 -24.173 1.00 21.30 H new ATOM 0 HA VAL A 134 11.195 -4.601 -21.988 1.00 40.22 H new ATOM 0 HB VAL A 134 11.948 -6.801 -21.273 1.00 13.02 H new ATOM 0 HG11 VAL A 134 13.331 -8.235 -22.718 1.00 2.52 H new ATOM 0 HG12 VAL A 134 11.704 -7.987 -23.395 1.00 2.52 H new ATOM 0 HG13 VAL A 134 13.091 -7.099 -24.067 1.00 2.52 H new ATOM 0 HG21 VAL A 134 14.388 -6.480 -21.336 1.00 62.11 H new ATOM 0 HG22 VAL A 134 14.191 -5.271 -22.627 1.00 62.11 H new ATOM 0 HG23 VAL A 134 13.529 -4.957 -21.005 1.00 62.11 H new ATOM 2155 N THR A 135 12.475 -3.344 -23.706 1.00 24.15 N ATOM 2156 CA THR A 135 13.145 -2.550 -24.728 1.00 74.34 C ATOM 2157 C THR A 135 14.372 -1.845 -24.162 1.00 34.21 C ATOM 2158 O THR A 135 14.265 -1.037 -23.238 1.00 71.41 O ATOM 2159 CB THR A 135 12.196 -1.498 -25.333 1.00 73.53 C ATOM 2160 OG1 THR A 135 10.873 -1.674 -24.813 1.00 25.43 O ATOM 2161 CG2 THR A 135 12.167 -1.605 -26.851 1.00 0.54 C ATOM 0 H THR A 135 12.286 -2.842 -22.839 1.00 24.15 H new ATOM 0 HA THR A 135 13.457 -3.241 -25.511 1.00 74.34 H new ATOM 0 HB THR A 135 12.565 -0.509 -25.060 1.00 73.53 H new ATOM 0 HG1 THR A 135 10.277 -1.000 -25.201 1.00 25.43 H new ATOM 0 HG21 THR A 135 11.490 -0.852 -27.256 1.00 0.54 H new ATOM 0 HG22 THR A 135 13.170 -1.442 -27.246 1.00 0.54 H new ATOM 0 HG23 THR A 135 11.820 -2.597 -27.139 1.00 0.54 H new ATOM 2169 N LEU A 136 15.536 -2.155 -24.721 1.00 4.53 N ATOM 2170 CA LEU A 136 16.785 -1.549 -24.271 1.00 63.23 C ATOM 2171 C LEU A 136 17.788 -1.456 -25.417 1.00 24.34 C ATOM 2172 O LEU A 136 17.810 -2.307 -26.306 1.00 13.34 O ATOM 2173 CB LEU A 136 17.382 -2.360 -23.120 1.00 4.24 C ATOM 2174 CG LEU A 136 17.609 -3.847 -23.393 1.00 21.24 C ATOM 2175 CD1 LEU A 136 19.031 -4.091 -23.874 1.00 51.11 C ATOM 2176 CD2 LEU A 136 17.318 -4.669 -22.145 1.00 43.31 C ATOM 0 H LEU A 136 15.642 -2.822 -25.486 1.00 4.53 H new ATOM 0 HA LEU A 136 16.566 -0.540 -23.921 1.00 63.23 H new ATOM 0 HB2 LEU A 136 18.336 -1.912 -22.843 1.00 4.24 H new ATOM 0 HB3 LEU A 136 16.724 -2.266 -22.256 1.00 4.24 H new ATOM 0 HG LEU A 136 16.923 -4.161 -24.179 1.00 21.24 H new ATOM 0 HD11 LEU A 136 19.174 -5.155 -24.063 1.00 51.11 H new ATOM 0 HD12 LEU A 136 19.205 -3.532 -24.794 1.00 51.11 H new ATOM 0 HD13 LEU A 136 19.735 -3.761 -23.110 1.00 51.11 H new ATOM 0 HD21 LEU A 136 17.485 -5.725 -22.358 1.00 43.31 H new ATOM 0 HD22 LEU A 136 17.979 -4.352 -21.338 1.00 43.31 H new ATOM 0 HD23 LEU A 136 16.281 -4.519 -21.844 1.00 43.31 H new