USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 912 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 81 CYS SG : rot -23:sc= -4.42! USER MOD Set 1.2: A 91 CYS SG : rot -95:sc= -0.254 USER MOD Set 2.1: A 68 HIS : no HD1:sc= 0.284 K(o=-1.6,f=-6.9!) USER MOD Set 2.2: A 71 GLN : amide:sc= -1.93 X(o=-1.6,f=-2.1!) USER MOD Set 3.1: A 20 LYS NZ :NH3+ -171:sc= 2.41 (180deg=1.22) USER MOD Set 3.2: A 84 SER OG : rot -23:sc= 1.73 USER MOD Single : A 9 LYS NZ :NH3+ 154:sc= 1.29 (180deg=1.14) USER MOD Single : A 13 THR OG1 : rot -123:sc= 1.23 USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.0601 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN : amide:sc= -2.05! K(o=-2.1!,f=-0.084) USER MOD Single : A 35 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0054) USER MOD Single : A 36 LYS NZ :NH3+ 175:sc= 0.588 (180deg=0.464) USER MOD Single : A 38 ASN : amide:sc= -1.3 X(o=-1.3,f=-1.3) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HE2:sc= 1.2 K(o=1.2,f=-5!) USER MOD Single : A 44 TYR OH : rot 25:sc= 0.22 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= -0.426 (180deg=-0.426) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0.0117 USER MOD Single : A 62 ASN : amide:sc= -2.64! K(o=-2.6!,f=-0.24) USER MOD Single : A 66 LYS NZ :NH3+ -137:sc= 0.128 (180deg=-0.624) USER MOD Single : A 76 LYS NZ :NH3+ -179:sc= 0.526 (180deg=0.525) USER MOD Single : A 83 SER OG : rot 33:sc= 0.918 USER MOD Single : A 85 MET CE :methyl 138:sc= -8.63! (180deg=-9.7!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ -179:sc= 1.26 (180deg=1.26) USER MOD Single : A 97 SER OG : rot 180:sc= 0.0261 USER MOD Single : A 98 MET CE :methyl 164:sc= -0.114 (180deg=-0.627) USER MOD Single : A 99 TYR OH : rot 130:sc= -0.0134 USER MOD Single : A 101 TYR OH : rot -146:sc= 0.212 USER MOD Single : A 109 SER OG : rot -51:sc= 1.11 USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 SER OG : rot -170:sc= -0.0282 USER MOD Single : A 124 SER OG : rot -8:sc= 1.02 USER MOD ----------------------------------------------------------------- ATOM 95 N PHE A 7 15.348 -1.150 3.042 1.00 0.87 N ATOM 96 CA PHE A 7 16.330 -1.638 3.996 1.00 0.77 C ATOM 97 C PHE A 7 17.635 -0.863 3.862 1.00 0.72 C ATOM 98 O PHE A 7 17.992 -0.394 2.774 1.00 0.87 O ATOM 99 CB PHE A 7 16.582 -3.137 3.795 1.00 0.77 C ATOM 100 CG PHE A 7 15.353 -3.981 3.971 1.00 1.61 C ATOM 101 CD1 PHE A 7 14.705 -4.037 5.194 1.00 1.82 C ATOM 102 CD2 PHE A 7 14.850 -4.722 2.915 1.00 2.72 C ATOM 103 CE1 PHE A 7 13.578 -4.816 5.359 1.00 2.63 C ATOM 104 CE2 PHE A 7 13.724 -5.501 3.074 1.00 3.60 C ATOM 105 CZ PHE A 7 13.076 -5.536 4.293 1.00 3.44 C ATOM 0 HA PHE A 7 15.934 -1.485 5.000 1.00 0.77 H new ATOM 0 HB2 PHE A 7 16.984 -3.299 2.795 1.00 0.77 H new ATOM 0 HB3 PHE A 7 17.344 -3.467 4.501 1.00 0.77 H new ATOM 0 HD1 PHE A 7 15.086 -3.465 6.027 1.00 1.82 H new ATOM 0 HD2 PHE A 7 15.345 -4.689 1.956 1.00 2.72 H new ATOM 0 HE1 PHE A 7 13.089 -4.863 6.321 1.00 2.63 H new ATOM 0 HE2 PHE A 7 13.349 -6.084 2.246 1.00 3.60 H new ATOM 0 HZ PHE A 7 12.179 -6.125 4.412 1.00 3.44 H new ATOM 115 N GLU A 8 18.336 -0.726 4.970 1.00 0.72 N ATOM 116 CA GLU A 8 19.571 0.032 5.001 1.00 0.76 C ATOM 117 C GLU A 8 20.765 -0.874 4.717 1.00 0.62 C ATOM 118 O GLU A 8 20.741 -2.070 5.011 1.00 0.61 O ATOM 119 CB GLU A 8 19.725 0.718 6.359 1.00 1.01 C ATOM 120 CG GLU A 8 20.894 1.687 6.439 1.00 1.20 C ATOM 121 CD GLU A 8 20.928 2.434 7.752 1.00 1.97 C ATOM 122 OE1 GLU A 8 21.539 1.920 8.715 1.00 2.71 O ATOM 123 OE2 GLU A 8 20.356 3.538 7.828 1.00 2.22 O ATOM 0 H GLU A 8 18.069 -1.133 5.866 1.00 0.72 H new ATOM 0 HA GLU A 8 19.535 0.795 4.224 1.00 0.76 H new ATOM 0 HB2 GLU A 8 18.805 1.256 6.588 1.00 1.01 H new ATOM 0 HB3 GLU A 8 19.847 -0.045 7.127 1.00 1.01 H new ATOM 0 HG2 GLU A 8 21.827 1.139 6.311 1.00 1.20 H new ATOM 0 HG3 GLU A 8 20.828 2.401 5.618 1.00 1.20 H new ATOM 130 N LYS A 9 21.799 -0.292 4.127 1.00 0.60 N ATOM 131 CA LYS A 9 23.019 -1.014 3.811 1.00 0.53 C ATOM 132 C LYS A 9 24.078 -0.680 4.848 1.00 0.50 C ATOM 133 O LYS A 9 24.180 0.464 5.287 1.00 0.56 O ATOM 134 CB LYS A 9 23.527 -0.658 2.404 1.00 0.63 C ATOM 135 CG LYS A 9 22.759 -1.316 1.252 1.00 0.72 C ATOM 136 CD LYS A 9 21.282 -0.939 1.228 1.00 0.95 C ATOM 137 CE LYS A 9 21.078 0.555 1.037 1.00 1.49 C ATOM 138 NZ LYS A 9 19.635 0.915 0.982 1.00 1.88 N ATOM 0 H LYS A 9 21.814 0.691 3.855 1.00 0.60 H new ATOM 0 HA LYS A 9 22.808 -2.083 3.828 1.00 0.53 H new ATOM 0 HB2 LYS A 9 23.481 0.424 2.280 1.00 0.63 H new ATOM 0 HB3 LYS A 9 24.577 -0.943 2.330 1.00 0.63 H new ATOM 0 HG2 LYS A 9 23.217 -1.028 0.306 1.00 0.72 H new ATOM 0 HG3 LYS A 9 22.850 -2.399 1.334 1.00 0.72 H new ATOM 0 HD2 LYS A 9 20.783 -1.479 0.423 1.00 0.95 H new ATOM 0 HD3 LYS A 9 20.813 -1.253 2.161 1.00 0.95 H new ATOM 0 HE2 LYS A 9 21.556 1.094 1.855 1.00 1.49 H new ATOM 0 HE3 LYS A 9 21.567 0.874 0.116 1.00 1.49 H new ATOM 0 HZ1 LYS A 9 19.511 1.901 1.289 1.00 1.88 H new ATOM 0 HZ2 LYS A 9 19.288 0.810 0.007 1.00 1.88 H new ATOM 0 HZ3 LYS A 9 19.096 0.286 1.611 1.00 1.88 H new ATOM 152 N VAL A 10 24.867 -1.667 5.233 1.00 0.46 N ATOM 153 CA VAL A 10 25.828 -1.475 6.306 1.00 0.46 C ATOM 154 C VAL A 10 27.239 -1.292 5.757 1.00 0.48 C ATOM 155 O VAL A 10 27.847 -2.231 5.237 1.00 0.54 O ATOM 156 CB VAL A 10 25.806 -2.657 7.297 1.00 0.51 C ATOM 157 CG1 VAL A 10 26.632 -2.330 8.527 1.00 0.54 C ATOM 158 CG2 VAL A 10 24.381 -2.998 7.694 1.00 0.59 C ATOM 0 H VAL A 10 24.863 -2.601 4.824 1.00 0.46 H new ATOM 0 HA VAL A 10 25.537 -0.569 6.837 1.00 0.46 H new ATOM 0 HB VAL A 10 26.242 -3.526 6.804 1.00 0.51 H new ATOM 0 HG11 VAL A 10 26.607 -3.173 9.217 1.00 0.54 H new ATOM 0 HG12 VAL A 10 27.663 -2.133 8.231 1.00 0.54 H new ATOM 0 HG13 VAL A 10 26.221 -1.448 9.017 1.00 0.54 H new ATOM 0 HG21 VAL A 10 24.388 -3.834 8.393 1.00 0.59 H new ATOM 0 HG22 VAL A 10 23.918 -2.132 8.168 1.00 0.59 H new ATOM 0 HG23 VAL A 10 23.812 -3.273 6.806 1.00 0.59 H new ATOM 168 N GLU A 11 27.748 -0.071 5.871 1.00 0.53 N ATOM 169 CA GLU A 11 29.083 0.255 5.392 1.00 0.63 C ATOM 170 C GLU A 11 30.135 -0.057 6.453 1.00 0.55 C ATOM 171 O GLU A 11 30.215 0.639 7.467 1.00 0.59 O ATOM 172 CB GLU A 11 29.183 1.736 5.030 1.00 0.88 C ATOM 173 CG GLU A 11 28.184 2.205 3.989 1.00 1.37 C ATOM 174 CD GLU A 11 28.295 3.694 3.750 1.00 1.72 C ATOM 175 OE1 GLU A 11 29.195 4.109 2.992 1.00 2.02 O ATOM 176 OE2 GLU A 11 27.511 4.457 4.353 1.00 2.16 O ATOM 0 H GLU A 11 27.252 0.713 6.294 1.00 0.53 H new ATOM 0 HA GLU A 11 29.266 -0.353 4.506 1.00 0.63 H new ATOM 0 HB2 GLU A 11 29.047 2.327 5.936 1.00 0.88 H new ATOM 0 HB3 GLU A 11 30.190 1.939 4.665 1.00 0.88 H new ATOM 0 HG2 GLU A 11 28.353 1.671 3.054 1.00 1.37 H new ATOM 0 HG3 GLU A 11 27.173 1.962 4.317 1.00 1.37 H new ATOM 183 N LEU A 12 30.925 -1.102 6.211 1.00 0.52 N ATOM 184 CA LEU A 12 32.042 -1.469 7.082 1.00 0.51 C ATOM 185 C LEU A 12 31.586 -1.613 8.536 1.00 0.52 C ATOM 186 O LEU A 12 31.867 -0.762 9.378 1.00 0.61 O ATOM 187 CB LEU A 12 33.166 -0.431 6.974 1.00 0.57 C ATOM 188 CG LEU A 12 34.498 -0.838 7.605 1.00 0.88 C ATOM 189 CD1 LEU A 12 35.113 -2.005 6.844 1.00 1.35 C ATOM 190 CD2 LEU A 12 35.457 0.344 7.636 1.00 1.45 C ATOM 0 H LEU A 12 30.809 -1.718 5.406 1.00 0.52 H new ATOM 0 HA LEU A 12 32.423 -2.436 6.752 1.00 0.51 H new ATOM 0 HB2 LEU A 12 33.335 -0.212 5.920 1.00 0.57 H new ATOM 0 HB3 LEU A 12 32.829 0.494 7.442 1.00 0.57 H new ATOM 0 HG LEU A 12 34.311 -1.156 8.631 1.00 0.88 H new ATOM 0 HD11 LEU A 12 36.060 -2.282 7.306 1.00 1.35 H new ATOM 0 HD12 LEU A 12 34.433 -2.856 6.872 1.00 1.35 H new ATOM 0 HD13 LEU A 12 35.286 -1.713 5.808 1.00 1.35 H new ATOM 0 HD21 LEU A 12 36.400 0.036 8.088 1.00 1.45 H new ATOM 0 HD22 LEU A 12 35.639 0.692 6.619 1.00 1.45 H new ATOM 0 HD23 LEU A 12 35.020 1.152 8.223 1.00 1.45 H new ATOM 202 N THR A 13 30.858 -2.683 8.812 1.00 0.50 N ATOM 203 CA THR A 13 30.312 -2.920 10.141 1.00 0.56 C ATOM 204 C THR A 13 31.364 -3.509 11.077 1.00 0.53 C ATOM 205 O THR A 13 32.335 -4.128 10.630 1.00 0.50 O ATOM 206 CB THR A 13 29.092 -3.863 10.065 1.00 0.68 C ATOM 207 OG1 THR A 13 28.573 -4.135 11.373 1.00 0.78 O ATOM 208 CG2 THR A 13 29.453 -5.167 9.371 1.00 0.69 C ATOM 0 H THR A 13 30.630 -3.406 8.130 1.00 0.50 H new ATOM 0 HA THR A 13 29.996 -1.958 10.543 1.00 0.56 H new ATOM 0 HB THR A 13 28.323 -3.358 9.481 1.00 0.68 H new ATOM 0 HG1 THR A 13 28.573 -5.102 11.530 1.00 0.78 H new ATOM 0 HG21 THR A 13 28.576 -5.813 9.331 1.00 0.69 H new ATOM 0 HG22 THR A 13 29.796 -4.957 8.358 1.00 0.69 H new ATOM 0 HG23 THR A 13 30.247 -5.667 9.926 1.00 0.69 H new ATOM 216 N ALA A 14 31.153 -3.320 12.375 1.00 0.61 N ATOM 217 CA ALA A 14 32.060 -3.824 13.399 1.00 0.66 C ATOM 218 C ALA A 14 32.019 -5.347 13.499 1.00 0.69 C ATOM 219 O ALA A 14 32.702 -5.935 14.335 1.00 0.79 O ATOM 220 CB ALA A 14 31.736 -3.199 14.745 1.00 0.81 C ATOM 0 H ALA A 14 30.349 -2.814 12.746 1.00 0.61 H new ATOM 0 HA ALA A 14 33.072 -3.542 13.107 1.00 0.66 H new ATOM 0 HB1 ALA A 14 32.421 -3.585 15.500 1.00 0.81 H new ATOM 0 HB2 ALA A 14 31.842 -2.116 14.678 1.00 0.81 H new ATOM 0 HB3 ALA A 14 30.712 -3.447 15.024 1.00 0.81 H new ATOM 226 N ASP A 15 31.217 -5.984 12.645 1.00 0.71 N ATOM 227 CA ASP A 15 31.162 -7.447 12.583 1.00 0.85 C ATOM 228 C ASP A 15 32.449 -8.015 11.981 1.00 0.74 C ATOM 229 O ASP A 15 32.571 -9.223 11.793 1.00 0.86 O ATOM 230 CB ASP A 15 29.979 -7.929 11.730 1.00 1.08 C ATOM 231 CG ASP A 15 28.619 -7.540 12.273 1.00 1.69 C ATOM 232 OD1 ASP A 15 28.161 -8.155 13.255 1.00 1.87 O ATOM 233 OD2 ASP A 15 27.989 -6.632 11.682 1.00 2.40 O ATOM 0 H ASP A 15 30.597 -5.512 11.987 1.00 0.71 H new ATOM 0 HA ASP A 15 31.040 -7.801 13.607 1.00 0.85 H new ATOM 0 HB2 ASP A 15 30.084 -7.525 10.723 1.00 1.08 H new ATOM 0 HB3 ASP A 15 30.026 -9.015 11.645 1.00 1.08 H new ATOM 238 N GLY A 16 33.407 -7.141 11.686 1.00 0.64 N ATOM 239 CA GLY A 16 34.655 -7.572 11.076 1.00 0.68 C ATOM 240 C GLY A 16 34.934 -6.887 9.749 1.00 0.57 C ATOM 241 O GLY A 16 35.889 -7.233 9.051 1.00 0.63 O ATOM 0 H GLY A 16 33.342 -6.138 11.859 1.00 0.64 H new ATOM 0 HA2 GLY A 16 35.477 -7.371 11.763 1.00 0.68 H new ATOM 0 HA3 GLY A 16 34.625 -8.651 10.923 1.00 0.68 H new ATOM 245 N GLY A 17 34.105 -5.913 9.400 1.00 0.54 N ATOM 246 CA GLY A 17 34.352 -5.120 8.208 1.00 0.52 C ATOM 247 C GLY A 17 33.949 -5.807 6.918 1.00 0.46 C ATOM 248 O GLY A 17 34.806 -6.200 6.128 1.00 0.61 O ATOM 0 H GLY A 17 33.266 -5.656 9.919 1.00 0.54 H new ATOM 0 HA2 GLY A 17 33.810 -4.178 8.291 1.00 0.52 H new ATOM 0 HA3 GLY A 17 35.413 -4.874 8.161 1.00 0.52 H new ATOM 252 N VAL A 18 32.646 -5.949 6.709 1.00 0.36 N ATOM 253 CA VAL A 18 32.106 -6.475 5.457 1.00 0.34 C ATOM 254 C VAL A 18 30.813 -5.739 5.101 1.00 0.32 C ATOM 255 O VAL A 18 30.054 -5.345 5.992 1.00 0.36 O ATOM 256 CB VAL A 18 31.841 -8.004 5.536 1.00 0.40 C ATOM 257 CG1 VAL A 18 30.962 -8.486 4.389 1.00 0.47 C ATOM 258 CG2 VAL A 18 33.145 -8.776 5.526 1.00 0.49 C ATOM 0 H VAL A 18 31.935 -5.705 7.398 1.00 0.36 H new ATOM 0 HA VAL A 18 32.851 -6.310 4.679 1.00 0.34 H new ATOM 0 HB VAL A 18 31.316 -8.187 6.473 1.00 0.40 H new ATOM 0 HG11 VAL A 18 30.801 -9.560 4.481 1.00 0.47 H new ATOM 0 HG12 VAL A 18 30.002 -7.970 4.425 1.00 0.47 H new ATOM 0 HG13 VAL A 18 31.453 -8.273 3.440 1.00 0.47 H new ATOM 0 HG21 VAL A 18 32.936 -9.844 5.582 1.00 0.49 H new ATOM 0 HG22 VAL A 18 33.688 -8.560 4.606 1.00 0.49 H new ATOM 0 HG23 VAL A 18 33.750 -8.479 6.383 1.00 0.49 H new ATOM 268 N ILE A 19 30.586 -5.537 3.807 1.00 0.31 N ATOM 269 CA ILE A 19 29.373 -4.887 3.322 1.00 0.31 C ATOM 270 C ILE A 19 28.250 -5.909 3.166 1.00 0.30 C ATOM 271 O ILE A 19 28.288 -6.762 2.275 1.00 0.30 O ATOM 272 CB ILE A 19 29.608 -4.196 1.956 1.00 0.34 C ATOM 273 CG1 ILE A 19 30.773 -3.200 2.040 1.00 0.41 C ATOM 274 CG2 ILE A 19 28.335 -3.498 1.479 1.00 0.36 C ATOM 275 CD1 ILE A 19 30.495 -2.005 2.926 1.00 0.47 C ATOM 0 H ILE A 19 31.233 -5.817 3.069 1.00 0.31 H new ATOM 0 HA ILE A 19 29.094 -4.132 4.057 1.00 0.31 H new ATOM 0 HB ILE A 19 29.871 -4.964 1.229 1.00 0.34 H new ATOM 0 HG12 ILE A 19 31.656 -3.719 2.413 1.00 0.41 H new ATOM 0 HG13 ILE A 19 31.011 -2.848 1.036 1.00 0.41 H new ATOM 0 HG21 ILE A 19 28.521 -3.019 0.518 1.00 0.36 H new ATOM 0 HG22 ILE A 19 27.537 -4.232 1.370 1.00 0.36 H new ATOM 0 HG23 ILE A 19 28.038 -2.745 2.209 1.00 0.36 H new ATOM 0 HD11 ILE A 19 31.365 -1.348 2.934 1.00 0.47 H new ATOM 0 HD12 ILE A 19 29.632 -1.460 2.542 1.00 0.47 H new ATOM 0 HD13 ILE A 19 30.288 -2.345 3.941 1.00 0.47 H new ATOM 287 N LYS A 20 27.253 -5.823 4.030 1.00 0.33 N ATOM 288 CA LYS A 20 26.115 -6.723 3.956 1.00 0.37 C ATOM 289 C LYS A 20 24.801 -5.950 4.021 1.00 0.33 C ATOM 290 O LYS A 20 24.697 -4.926 4.699 1.00 0.37 O ATOM 291 CB LYS A 20 26.184 -7.802 5.050 1.00 0.53 C ATOM 292 CG LYS A 20 26.463 -7.280 6.457 1.00 0.59 C ATOM 293 CD LYS A 20 26.605 -8.437 7.446 1.00 0.76 C ATOM 294 CE LYS A 20 27.222 -8.007 8.772 1.00 0.83 C ATOM 295 NZ LYS A 20 26.261 -7.293 9.657 1.00 1.34 N ATOM 0 H LYS A 20 27.208 -5.142 4.788 1.00 0.33 H new ATOM 0 HA LYS A 20 26.154 -7.231 2.993 1.00 0.37 H new ATOM 0 HB2 LYS A 20 25.240 -8.346 5.062 1.00 0.53 H new ATOM 0 HB3 LYS A 20 26.962 -8.518 4.784 1.00 0.53 H new ATOM 0 HG2 LYS A 20 27.375 -6.684 6.454 1.00 0.59 H new ATOM 0 HG3 LYS A 20 25.653 -6.622 6.773 1.00 0.59 H new ATOM 0 HD2 LYS A 20 25.623 -8.873 7.631 1.00 0.76 H new ATOM 0 HD3 LYS A 20 27.221 -9.217 7.000 1.00 0.76 H new ATOM 0 HE2 LYS A 20 27.601 -8.887 9.292 1.00 0.83 H new ATOM 0 HE3 LYS A 20 28.077 -7.359 8.576 1.00 0.83 H new ATOM 0 HZ1 LYS A 20 26.770 -6.893 10.471 1.00 1.34 H new ATOM 0 HZ2 LYS A 20 25.803 -6.526 9.125 1.00 1.34 H new ATOM 0 HZ3 LYS A 20 25.538 -7.960 9.994 1.00 1.34 H new ATOM 309 N THR A 21 23.821 -6.426 3.274 1.00 0.34 N ATOM 310 CA THR A 21 22.517 -5.795 3.216 1.00 0.36 C ATOM 311 C THR A 21 21.474 -6.677 3.892 1.00 0.36 C ATOM 312 O THR A 21 21.286 -7.833 3.507 1.00 0.40 O ATOM 313 CB THR A 21 22.107 -5.539 1.753 1.00 0.44 C ATOM 314 OG1 THR A 21 23.169 -4.853 1.069 1.00 0.49 O ATOM 315 CG2 THR A 21 20.830 -4.713 1.675 1.00 0.50 C ATOM 0 H THR A 21 23.907 -7.259 2.692 1.00 0.34 H new ATOM 0 HA THR A 21 22.574 -4.841 3.740 1.00 0.36 H new ATOM 0 HB THR A 21 21.919 -6.501 1.277 1.00 0.44 H new ATOM 0 HG1 THR A 21 22.908 -4.692 0.138 1.00 0.49 H new ATOM 0 HG21 THR A 21 20.566 -4.549 0.630 1.00 0.50 H new ATOM 0 HG22 THR A 21 20.021 -5.246 2.174 1.00 0.50 H new ATOM 0 HG23 THR A 21 20.988 -3.752 2.165 1.00 0.50 H new ATOM 323 N ILE A 22 20.814 -6.134 4.905 1.00 0.40 N ATOM 324 CA ILE A 22 19.798 -6.874 5.633 1.00 0.43 C ATOM 325 C ILE A 22 18.522 -6.977 4.798 1.00 0.44 C ATOM 326 O ILE A 22 18.094 -6.001 4.178 1.00 0.55 O ATOM 327 CB ILE A 22 19.501 -6.216 7.007 1.00 0.56 C ATOM 328 CG1 ILE A 22 18.590 -7.109 7.855 1.00 0.63 C ATOM 329 CG2 ILE A 22 18.883 -4.834 6.838 1.00 0.67 C ATOM 330 CD1 ILE A 22 19.256 -8.394 8.294 1.00 0.66 C ATOM 0 H ILE A 22 20.965 -5.183 5.240 1.00 0.40 H new ATOM 0 HA ILE A 22 20.177 -7.879 5.821 1.00 0.43 H new ATOM 0 HB ILE A 22 20.452 -6.099 7.527 1.00 0.56 H new ATOM 0 HG12 ILE A 22 18.268 -6.555 8.737 1.00 0.63 H new ATOM 0 HG13 ILE A 22 17.693 -7.349 7.284 1.00 0.63 H new ATOM 0 HG21 ILE A 22 18.687 -4.401 7.819 1.00 0.67 H new ATOM 0 HG22 ILE A 22 19.572 -4.192 6.289 1.00 0.67 H new ATOM 0 HG23 ILE A 22 17.947 -4.919 6.286 1.00 0.67 H new ATOM 0 HD11 ILE A 22 18.557 -8.981 8.891 1.00 0.66 H new ATOM 0 HD12 ILE A 22 19.554 -8.968 7.416 1.00 0.66 H new ATOM 0 HD13 ILE A 22 20.137 -8.161 8.892 1.00 0.66 H new ATOM 342 N LEU A 23 17.940 -8.166 4.750 1.00 0.41 N ATOM 343 CA LEU A 23 16.706 -8.378 4.005 1.00 0.47 C ATOM 344 C LEU A 23 15.588 -8.774 4.953 1.00 0.50 C ATOM 345 O LEU A 23 14.707 -7.974 5.257 1.00 0.67 O ATOM 346 CB LEU A 23 16.882 -9.451 2.921 1.00 0.54 C ATOM 347 CG LEU A 23 17.159 -8.929 1.505 1.00 0.53 C ATOM 348 CD1 LEU A 23 15.991 -8.088 1.011 1.00 0.83 C ATOM 349 CD2 LEU A 23 18.451 -8.127 1.461 1.00 0.64 C ATOM 0 H LEU A 23 18.301 -8.998 5.217 1.00 0.41 H new ATOM 0 HA LEU A 23 16.447 -7.442 3.511 1.00 0.47 H new ATOM 0 HB2 LEU A 23 17.703 -10.105 3.214 1.00 0.54 H new ATOM 0 HB3 LEU A 23 15.981 -10.063 2.893 1.00 0.54 H new ATOM 0 HG LEU A 23 17.274 -9.788 0.844 1.00 0.53 H new ATOM 0 HD11 LEU A 23 16.203 -7.725 0.005 1.00 0.83 H new ATOM 0 HD12 LEU A 23 15.086 -8.696 0.994 1.00 0.83 H new ATOM 0 HD13 LEU A 23 15.845 -7.239 1.679 1.00 0.83 H new ATOM 0 HD21 LEU A 23 18.623 -7.769 0.446 1.00 0.64 H new ATOM 0 HD22 LEU A 23 18.374 -7.276 2.138 1.00 0.64 H new ATOM 0 HD23 LEU A 23 19.283 -8.761 1.768 1.00 0.64 H new ATOM 361 N LYS A 24 15.628 -10.006 5.438 1.00 0.49 N ATOM 362 CA LYS A 24 14.670 -10.436 6.438 1.00 0.60 C ATOM 363 C LYS A 24 15.216 -10.104 7.814 1.00 0.60 C ATOM 364 O LYS A 24 16.421 -10.011 7.994 1.00 0.76 O ATOM 365 CB LYS A 24 14.372 -11.935 6.335 1.00 0.78 C ATOM 366 CG LYS A 24 13.777 -12.361 5.001 1.00 1.05 C ATOM 367 CD LYS A 24 12.762 -13.481 5.183 1.00 1.11 C ATOM 368 CE LYS A 24 13.347 -14.670 5.929 1.00 1.12 C ATOM 369 NZ LYS A 24 12.292 -15.647 6.303 1.00 1.56 N ATOM 0 H LYS A 24 16.305 -10.716 5.158 1.00 0.49 H new ATOM 0 HA LYS A 24 13.731 -9.909 6.267 1.00 0.60 H new ATOM 0 HB2 LYS A 24 15.295 -12.490 6.503 1.00 0.78 H new ATOM 0 HB3 LYS A 24 13.683 -12.213 7.133 1.00 0.78 H new ATOM 0 HG2 LYS A 24 13.297 -11.506 4.524 1.00 1.05 H new ATOM 0 HG3 LYS A 24 14.573 -12.693 4.334 1.00 1.05 H new ATOM 0 HD2 LYS A 24 11.898 -13.101 5.728 1.00 1.11 H new ATOM 0 HD3 LYS A 24 12.404 -13.807 4.206 1.00 1.11 H new ATOM 0 HE2 LYS A 24 14.095 -15.160 5.306 1.00 1.12 H new ATOM 0 HE3 LYS A 24 13.858 -14.323 6.827 1.00 1.12 H new ATOM 0 HZ1 LYS A 24 12.723 -16.446 6.810 1.00 1.56 H new ATOM 0 HZ2 LYS A 24 11.592 -15.184 6.917 1.00 1.56 H new ATOM 0 HZ3 LYS A 24 11.821 -15.996 5.444 1.00 1.56 H new ATOM 383 N LYS A 25 14.341 -9.905 8.775 1.00 0.61 N ATOM 384 CA LYS A 25 14.779 -9.582 10.116 1.00 0.64 C ATOM 385 C LYS A 25 14.174 -10.538 11.132 1.00 0.72 C ATOM 386 O LYS A 25 12.953 -10.661 11.245 1.00 0.90 O ATOM 387 CB LYS A 25 14.470 -8.116 10.449 1.00 0.76 C ATOM 388 CG LYS A 25 13.126 -7.618 9.941 1.00 1.52 C ATOM 389 CD LYS A 25 13.061 -6.099 10.000 1.00 1.72 C ATOM 390 CE LYS A 25 11.731 -5.563 9.487 1.00 2.60 C ATOM 391 NZ LYS A 25 11.696 -4.072 9.474 1.00 2.95 N ATOM 0 H LYS A 25 13.330 -9.960 8.655 1.00 0.61 H new ATOM 0 HA LYS A 25 15.861 -9.706 10.166 1.00 0.64 H new ATOM 0 HB2 LYS A 25 14.504 -7.989 11.531 1.00 0.76 H new ATOM 0 HB3 LYS A 25 15.257 -7.489 10.029 1.00 0.76 H new ATOM 0 HG2 LYS A 25 12.971 -7.955 8.916 1.00 1.52 H new ATOM 0 HG3 LYS A 25 12.323 -8.045 10.542 1.00 1.52 H new ATOM 0 HD2 LYS A 25 13.212 -5.770 11.028 1.00 1.72 H new ATOM 0 HD3 LYS A 25 13.874 -5.678 9.408 1.00 1.72 H new ATOM 0 HE2 LYS A 25 11.554 -5.938 8.479 1.00 2.60 H new ATOM 0 HE3 LYS A 25 10.923 -5.939 10.114 1.00 2.60 H new ATOM 0 HZ1 LYS A 25 10.774 -3.749 9.118 1.00 2.95 H new ATOM 0 HZ2 LYS A 25 11.839 -3.713 10.439 1.00 2.95 H new ATOM 0 HZ3 LYS A 25 12.451 -3.712 8.855 1.00 2.95 H new ATOM 405 N GLY A 26 15.051 -11.238 11.838 1.00 0.69 N ATOM 406 CA GLY A 26 14.619 -12.211 12.815 1.00 0.85 C ATOM 407 C GLY A 26 14.120 -11.560 14.085 1.00 0.88 C ATOM 408 O GLY A 26 14.691 -10.572 14.550 1.00 1.32 O ATOM 0 H GLY A 26 16.063 -11.146 11.748 1.00 0.69 H new ATOM 0 HA2 GLY A 26 13.827 -12.826 12.388 1.00 0.85 H new ATOM 0 HA3 GLY A 26 15.447 -12.879 13.052 1.00 0.85 H new ATOM 412 N ASP A 27 13.069 -12.127 14.651 1.00 0.84 N ATOM 413 CA ASP A 27 12.442 -11.564 15.844 1.00 1.01 C ATOM 414 C ASP A 27 13.181 -11.997 17.100 1.00 0.93 C ATOM 415 O ASP A 27 13.781 -11.178 17.789 1.00 1.24 O ATOM 416 CB ASP A 27 10.970 -11.972 15.935 1.00 1.33 C ATOM 417 CG ASP A 27 10.318 -11.479 17.214 1.00 2.08 C ATOM 418 OD1 ASP A 27 10.176 -10.248 17.374 1.00 2.38 O ATOM 419 OD2 ASP A 27 9.947 -12.322 18.061 1.00 2.77 O ATOM 0 H ASP A 27 12.628 -12.979 14.306 1.00 0.84 H new ATOM 0 HA ASP A 27 12.496 -10.478 15.764 1.00 1.01 H new ATOM 0 HB2 ASP A 27 10.430 -11.573 15.076 1.00 1.33 H new ATOM 0 HB3 ASP A 27 10.892 -13.058 15.884 1.00 1.33 H new ATOM 424 N GLU A 28 13.145 -13.285 17.393 1.00 0.91 N ATOM 425 CA GLU A 28 13.837 -13.811 18.557 1.00 0.91 C ATOM 426 C GLU A 28 15.165 -14.434 18.151 1.00 0.96 C ATOM 427 O GLU A 28 15.271 -15.066 17.098 1.00 1.22 O ATOM 428 CB GLU A 28 12.946 -14.803 19.325 1.00 1.11 C ATOM 429 CG GLU A 28 12.256 -15.860 18.467 1.00 1.59 C ATOM 430 CD GLU A 28 13.129 -17.068 18.181 1.00 2.09 C ATOM 431 OE1 GLU A 28 13.994 -17.396 19.024 1.00 2.64 O ATOM 432 OE2 GLU A 28 12.977 -17.669 17.096 1.00 2.56 O ATOM 0 H GLU A 28 12.646 -13.984 16.843 1.00 0.91 H new ATOM 0 HA GLU A 28 14.055 -12.986 19.235 1.00 0.91 H new ATOM 0 HB2 GLU A 28 13.555 -15.308 20.074 1.00 1.11 H new ATOM 0 HB3 GLU A 28 12.183 -14.240 19.862 1.00 1.11 H new ATOM 0 HG2 GLU A 28 11.347 -16.189 18.970 1.00 1.59 H new ATOM 0 HG3 GLU A 28 11.952 -15.409 17.522 1.00 1.59 H new ATOM 439 N GLY A 29 16.188 -14.194 18.955 1.00 0.88 N ATOM 440 CA GLY A 29 17.498 -14.739 18.681 1.00 1.04 C ATOM 441 C GLY A 29 18.337 -14.823 19.933 1.00 0.79 C ATOM 442 O GLY A 29 19.545 -14.610 19.895 1.00 0.90 O ATOM 0 H GLY A 29 16.132 -13.626 19.800 1.00 0.88 H new ATOM 0 HA2 GLY A 29 17.395 -15.732 18.244 1.00 1.04 H new ATOM 0 HA3 GLY A 29 18.005 -14.117 17.944 1.00 1.04 H new ATOM 446 N GLU A 30 17.688 -15.147 21.043 1.00 0.73 N ATOM 447 CA GLU A 30 18.371 -15.254 22.325 1.00 0.80 C ATOM 448 C GLU A 30 19.257 -16.496 22.319 1.00 0.78 C ATOM 449 O GLU A 30 20.331 -16.522 22.916 1.00 0.96 O ATOM 450 CB GLU A 30 17.348 -15.335 23.462 1.00 1.08 C ATOM 451 CG GLU A 30 17.934 -15.096 24.844 1.00 1.35 C ATOM 452 CD GLU A 30 18.365 -13.656 25.049 1.00 1.68 C ATOM 453 OE1 GLU A 30 17.530 -12.844 25.503 1.00 1.89 O ATOM 454 OE2 GLU A 30 19.531 -13.328 24.761 1.00 2.29 O ATOM 0 H GLU A 30 16.687 -15.341 21.081 1.00 0.73 H new ATOM 0 HA GLU A 30 18.990 -14.371 22.483 1.00 0.80 H new ATOM 0 HB2 GLU A 30 16.561 -14.602 23.281 1.00 1.08 H new ATOM 0 HB3 GLU A 30 16.878 -16.318 23.444 1.00 1.08 H new ATOM 0 HG2 GLU A 30 17.195 -15.362 25.600 1.00 1.35 H new ATOM 0 HG3 GLU A 30 18.791 -15.753 24.991 1.00 1.35 H new ATOM 461 N GLU A 31 18.788 -17.521 21.621 1.00 0.76 N ATOM 462 CA GLU A 31 19.545 -18.751 21.455 1.00 0.86 C ATOM 463 C GLU A 31 19.979 -18.914 20.005 1.00 0.78 C ATOM 464 O GLU A 31 20.557 -19.932 19.627 1.00 1.11 O ATOM 465 CB GLU A 31 18.706 -19.958 21.867 1.00 1.09 C ATOM 466 CG GLU A 31 18.414 -20.028 23.354 1.00 1.56 C ATOM 467 CD GLU A 31 17.540 -21.212 23.702 1.00 2.17 C ATOM 468 OE1 GLU A 31 17.737 -22.295 23.114 1.00 2.64 O ATOM 469 OE2 GLU A 31 16.654 -21.067 24.571 1.00 2.54 O ATOM 0 H GLU A 31 17.879 -17.523 21.158 1.00 0.76 H new ATOM 0 HA GLU A 31 20.427 -18.693 22.093 1.00 0.86 H new ATOM 0 HB2 GLU A 31 17.762 -19.934 21.323 1.00 1.09 H new ATOM 0 HB3 GLU A 31 19.225 -20.868 21.566 1.00 1.09 H new ATOM 0 HG2 GLU A 31 19.352 -20.095 23.905 1.00 1.56 H new ATOM 0 HG3 GLU A 31 17.922 -19.108 23.671 1.00 1.56 H new ATOM 476 N ASN A 32 19.692 -17.914 19.187 1.00 0.51 N ATOM 477 CA ASN A 32 19.988 -18.011 17.767 1.00 0.55 C ATOM 478 C ASN A 32 21.045 -17.005 17.356 1.00 0.49 C ATOM 479 O ASN A 32 20.732 -15.952 16.802 1.00 0.57 O ATOM 480 CB ASN A 32 18.729 -17.822 16.915 1.00 0.71 C ATOM 481 CG ASN A 32 17.701 -18.924 17.109 1.00 0.95 C ATOM 482 OD1 ASN A 32 16.513 -18.711 16.896 1.00 1.45 O ATOM 483 ND2 ASN A 32 18.142 -20.107 17.516 1.00 1.19 N ATOM 0 H ASN A 32 19.260 -17.037 19.477 1.00 0.51 H new ATOM 0 HA ASN A 32 20.374 -19.015 17.591 1.00 0.55 H new ATOM 0 HB2 ASN A 32 18.274 -16.863 17.160 1.00 0.71 H new ATOM 0 HB3 ASN A 32 19.013 -17.781 15.863 1.00 0.71 H new ATOM 0 HD21 ASN A 32 17.485 -20.874 17.661 1.00 1.19 H new ATOM 0 HD22 ASN A 32 19.138 -20.250 17.684 1.00 1.19 H new ATOM 490 N ILE A 33 22.292 -17.335 17.647 1.00 0.47 N ATOM 491 CA ILE A 33 23.424 -16.513 17.253 1.00 0.51 C ATOM 492 C ILE A 33 24.456 -17.377 16.527 1.00 0.44 C ATOM 493 O ILE A 33 25.032 -18.296 17.114 1.00 0.47 O ATOM 494 CB ILE A 33 24.077 -15.824 18.474 1.00 0.66 C ATOM 495 CG1 ILE A 33 23.089 -14.855 19.144 1.00 0.74 C ATOM 496 CG2 ILE A 33 25.350 -15.091 18.065 1.00 0.76 C ATOM 497 CD1 ILE A 33 22.712 -13.664 18.281 1.00 0.81 C ATOM 0 H ILE A 33 22.548 -18.178 18.162 1.00 0.47 H new ATOM 0 HA ILE A 33 23.061 -15.732 16.585 1.00 0.51 H new ATOM 0 HB ILE A 33 24.344 -16.596 19.196 1.00 0.66 H new ATOM 0 HG12 ILE A 33 22.183 -15.401 19.408 1.00 0.74 H new ATOM 0 HG13 ILE A 33 23.526 -14.493 20.075 1.00 0.74 H new ATOM 0 HG21 ILE A 33 25.792 -14.614 18.940 1.00 0.76 H new ATOM 0 HG22 ILE A 33 26.059 -15.802 17.642 1.00 0.76 H new ATOM 0 HG23 ILE A 33 25.110 -14.332 17.320 1.00 0.76 H new ATOM 0 HD11 ILE A 33 22.013 -13.028 18.824 1.00 0.81 H new ATOM 0 HD12 ILE A 33 23.608 -13.093 18.038 1.00 0.81 H new ATOM 0 HD13 ILE A 33 22.245 -14.015 17.361 1.00 0.81 H new ATOM 509 N PRO A 34 24.681 -17.105 15.234 1.00 0.46 N ATOM 510 CA PRO A 34 25.604 -17.873 14.407 1.00 0.44 C ATOM 511 C PRO A 34 27.056 -17.473 14.655 1.00 0.52 C ATOM 512 O PRO A 34 27.492 -16.393 14.249 1.00 0.75 O ATOM 513 CB PRO A 34 25.204 -17.520 12.968 1.00 0.51 C ATOM 514 CG PRO A 34 24.086 -16.527 13.067 1.00 0.54 C ATOM 515 CD PRO A 34 24.067 -16.014 14.479 1.00 0.62 C ATOM 0 HA PRO A 34 25.544 -18.939 14.625 1.00 0.44 H new ATOM 0 HB2 PRO A 34 26.049 -17.099 12.423 1.00 0.51 H new ATOM 0 HB3 PRO A 34 24.885 -18.410 12.425 1.00 0.51 H new ATOM 0 HG2 PRO A 34 24.236 -15.709 12.363 1.00 0.54 H new ATOM 0 HG3 PRO A 34 23.134 -16.994 12.815 1.00 0.54 H new ATOM 0 HD2 PRO A 34 24.631 -15.087 14.579 1.00 0.62 H new ATOM 0 HD3 PRO A 34 23.052 -15.808 14.820 1.00 0.62 H new ATOM 523 N LYS A 35 27.794 -18.325 15.343 1.00 0.49 N ATOM 524 CA LYS A 35 29.206 -18.074 15.593 1.00 0.60 C ATOM 525 C LYS A 35 30.062 -19.166 14.976 1.00 0.56 C ATOM 526 O LYS A 35 29.585 -20.272 14.723 1.00 0.58 O ATOM 527 CB LYS A 35 29.488 -17.949 17.092 1.00 0.83 C ATOM 528 CG LYS A 35 28.950 -16.662 17.701 1.00 1.17 C ATOM 529 CD LYS A 35 29.526 -15.438 16.998 1.00 1.46 C ATOM 530 CE LYS A 35 28.923 -14.142 17.520 1.00 1.98 C ATOM 531 NZ LYS A 35 29.312 -13.865 18.927 1.00 2.66 N ATOM 0 H LYS A 35 27.442 -19.196 15.739 1.00 0.49 H new ATOM 0 HA LYS A 35 29.466 -17.126 15.123 1.00 0.60 H new ATOM 0 HB2 LYS A 35 29.046 -18.800 17.610 1.00 0.83 H new ATOM 0 HB3 LYS A 35 30.564 -17.999 17.258 1.00 0.83 H new ATOM 0 HG2 LYS A 35 27.863 -16.649 17.628 1.00 1.17 H new ATOM 0 HG3 LYS A 35 29.199 -16.626 18.762 1.00 1.17 H new ATOM 0 HD2 LYS A 35 30.607 -15.416 17.136 1.00 1.46 H new ATOM 0 HD3 LYS A 35 29.343 -15.517 15.926 1.00 1.46 H new ATOM 0 HE2 LYS A 35 29.243 -13.314 16.887 1.00 1.98 H new ATOM 0 HE3 LYS A 35 27.837 -14.195 17.450 1.00 1.98 H new ATOM 0 HZ1 LYS A 35 28.905 -12.956 19.227 1.00 2.66 H new ATOM 0 HZ2 LYS A 35 28.955 -14.624 19.542 1.00 2.66 H new ATOM 0 HZ3 LYS A 35 30.349 -13.821 18.998 1.00 2.66 H new ATOM 545 N LYS A 36 31.326 -18.851 14.736 1.00 0.67 N ATOM 546 CA LYS A 36 32.226 -19.769 14.055 1.00 0.82 C ATOM 547 C LYS A 36 32.769 -20.826 15.010 1.00 0.84 C ATOM 548 O LYS A 36 32.889 -20.591 16.215 1.00 0.91 O ATOM 549 CB LYS A 36 33.360 -18.989 13.370 1.00 1.09 C ATOM 550 CG LYS A 36 34.255 -18.172 14.300 1.00 1.26 C ATOM 551 CD LYS A 36 35.444 -18.986 14.799 1.00 1.36 C ATOM 552 CE LYS A 36 36.595 -18.092 15.231 1.00 2.14 C ATOM 553 NZ LYS A 36 37.232 -17.414 14.067 1.00 2.51 N ATOM 0 H LYS A 36 31.752 -17.964 15.004 1.00 0.67 H new ATOM 0 HA LYS A 36 31.663 -20.297 13.285 1.00 0.82 H new ATOM 0 HB2 LYS A 36 33.984 -19.696 12.823 1.00 1.09 H new ATOM 0 HB3 LYS A 36 32.921 -18.316 12.634 1.00 1.09 H new ATOM 0 HG2 LYS A 36 34.615 -17.288 13.774 1.00 1.26 H new ATOM 0 HG3 LYS A 36 33.671 -17.821 15.151 1.00 1.26 H new ATOM 0 HD2 LYS A 36 35.132 -19.609 15.637 1.00 1.36 H new ATOM 0 HD3 LYS A 36 35.782 -19.658 14.010 1.00 1.36 H new ATOM 0 HE2 LYS A 36 36.230 -17.343 15.934 1.00 2.14 H new ATOM 0 HE3 LYS A 36 37.340 -18.687 15.758 1.00 2.14 H new ATOM 0 HZ1 LYS A 36 37.956 -16.749 14.406 1.00 2.51 H new ATOM 0 HZ2 LYS A 36 37.676 -18.125 13.451 1.00 2.51 H new ATOM 0 HZ3 LYS A 36 36.509 -16.894 13.530 1.00 2.51 H new ATOM 567 N GLY A 37 33.068 -21.995 14.466 1.00 0.92 N ATOM 568 CA GLY A 37 33.569 -23.088 15.272 1.00 1.04 C ATOM 569 C GLY A 37 32.492 -24.115 15.547 1.00 0.96 C ATOM 570 O GLY A 37 32.777 -25.292 15.762 1.00 1.12 O ATOM 0 H GLY A 37 32.972 -22.207 13.473 1.00 0.92 H new ATOM 0 HA2 GLY A 37 34.405 -23.565 14.761 1.00 1.04 H new ATOM 0 HA3 GLY A 37 33.952 -22.700 16.216 1.00 1.04 H new ATOM 574 N ASN A 38 31.247 -23.664 15.522 1.00 0.79 N ATOM 575 CA ASN A 38 30.111 -24.542 15.747 1.00 0.75 C ATOM 576 C ASN A 38 29.579 -25.060 14.423 1.00 0.72 C ATOM 577 O ASN A 38 29.800 -24.453 13.372 1.00 0.79 O ATOM 578 CB ASN A 38 29.001 -23.810 16.509 1.00 0.75 C ATOM 579 CG ASN A 38 29.402 -23.455 17.927 1.00 0.87 C ATOM 580 OD1 ASN A 38 30.158 -24.178 18.574 1.00 1.38 O ATOM 581 ND2 ASN A 38 28.895 -22.338 18.424 1.00 0.98 N ATOM 0 H ASN A 38 30.998 -22.690 15.347 1.00 0.79 H new ATOM 0 HA ASN A 38 30.445 -25.386 16.351 1.00 0.75 H new ATOM 0 HB2 ASN A 38 28.737 -22.899 15.972 1.00 0.75 H new ATOM 0 HB3 ASN A 38 28.109 -24.436 16.534 1.00 0.75 H new ATOM 0 HD21 ASN A 38 29.128 -22.051 19.375 1.00 0.98 H new ATOM 0 HD22 ASN A 38 28.271 -21.764 17.856 1.00 0.98 H new ATOM 588 N GLU A 39 28.880 -26.181 14.475 1.00 0.71 N ATOM 589 CA GLU A 39 28.368 -26.821 13.272 1.00 0.73 C ATOM 590 C GLU A 39 27.212 -26.014 12.677 1.00 0.63 C ATOM 591 O GLU A 39 26.066 -26.138 13.115 1.00 0.69 O ATOM 592 CB GLU A 39 27.888 -28.232 13.604 1.00 0.86 C ATOM 593 CG GLU A 39 27.966 -29.201 12.442 1.00 1.37 C ATOM 594 CD GLU A 39 29.394 -29.520 12.074 1.00 1.73 C ATOM 595 OE1 GLU A 39 30.233 -29.635 12.994 1.00 2.17 O ATOM 596 OE2 GLU A 39 29.681 -29.662 10.868 1.00 2.20 O ATOM 0 H GLU A 39 28.652 -26.670 15.341 1.00 0.71 H new ATOM 0 HA GLU A 39 29.172 -26.869 12.538 1.00 0.73 H new ATOM 0 HB2 GLU A 39 28.484 -28.622 14.429 1.00 0.86 H new ATOM 0 HB3 GLU A 39 26.856 -28.181 13.952 1.00 0.86 H new ATOM 0 HG2 GLU A 39 27.443 -30.122 12.701 1.00 1.37 H new ATOM 0 HG3 GLU A 39 27.454 -28.775 11.579 1.00 1.37 H new ATOM 603 N VAL A 40 27.521 -25.168 11.709 1.00 0.60 N ATOM 604 CA VAL A 40 26.501 -24.384 11.030 1.00 0.54 C ATOM 605 C VAL A 40 26.400 -24.799 9.567 1.00 0.54 C ATOM 606 O VAL A 40 27.368 -25.290 8.984 1.00 0.67 O ATOM 607 CB VAL A 40 26.785 -22.866 11.113 1.00 0.57 C ATOM 608 CG1 VAL A 40 27.029 -22.440 12.548 1.00 0.61 C ATOM 609 CG2 VAL A 40 27.974 -22.480 10.254 1.00 0.67 C ATOM 0 H VAL A 40 28.471 -25.006 11.375 1.00 0.60 H new ATOM 0 HA VAL A 40 25.556 -24.581 11.537 1.00 0.54 H new ATOM 0 HB VAL A 40 25.903 -22.349 10.735 1.00 0.57 H new ATOM 0 HG11 VAL A 40 27.226 -21.369 12.581 1.00 0.61 H new ATOM 0 HG12 VAL A 40 26.148 -22.665 13.149 1.00 0.61 H new ATOM 0 HG13 VAL A 40 27.888 -22.980 12.947 1.00 0.61 H new ATOM 0 HG21 VAL A 40 28.148 -21.407 10.334 1.00 0.67 H new ATOM 0 HG22 VAL A 40 28.859 -23.017 10.595 1.00 0.67 H new ATOM 0 HG23 VAL A 40 27.771 -22.738 9.215 1.00 0.67 H new ATOM 619 N THR A 41 25.229 -24.614 8.982 1.00 0.46 N ATOM 620 CA THR A 41 25.012 -24.957 7.590 1.00 0.48 C ATOM 621 C THR A 41 24.408 -23.775 6.839 1.00 0.42 C ATOM 622 O THR A 41 23.237 -23.434 7.036 1.00 0.44 O ATOM 623 CB THR A 41 24.087 -26.181 7.470 1.00 0.56 C ATOM 624 OG1 THR A 41 24.521 -27.193 8.390 1.00 0.65 O ATOM 625 CG2 THR A 41 24.103 -26.731 6.052 1.00 0.63 C ATOM 0 H THR A 41 24.412 -24.226 9.453 1.00 0.46 H new ATOM 0 HA THR A 41 25.977 -25.203 7.146 1.00 0.48 H new ATOM 0 HB THR A 41 23.067 -25.878 7.708 1.00 0.56 H new ATOM 0 HG1 THR A 41 23.933 -27.974 8.318 1.00 0.65 H new ATOM 0 HG21 THR A 41 23.442 -27.596 5.990 1.00 0.63 H new ATOM 0 HG22 THR A 41 23.760 -25.962 5.360 1.00 0.63 H new ATOM 0 HG23 THR A 41 25.118 -27.030 5.789 1.00 0.63 H new ATOM 633 N VAL A 42 25.215 -23.134 5.999 1.00 0.40 N ATOM 634 CA VAL A 42 24.771 -21.960 5.255 1.00 0.42 C ATOM 635 C VAL A 42 24.947 -22.150 3.753 1.00 0.43 C ATOM 636 O VAL A 42 25.908 -22.774 3.300 1.00 0.49 O ATOM 637 CB VAL A 42 25.531 -20.693 5.701 1.00 0.46 C ATOM 638 CG1 VAL A 42 24.978 -20.179 7.018 1.00 0.80 C ATOM 639 CG2 VAL A 42 27.017 -20.984 5.837 1.00 0.87 C ATOM 0 H VAL A 42 26.180 -23.408 5.816 1.00 0.40 H new ATOM 0 HA VAL A 42 23.710 -21.834 5.472 1.00 0.42 H new ATOM 0 HB VAL A 42 25.393 -19.925 4.940 1.00 0.46 H new ATOM 0 HG11 VAL A 42 25.525 -19.285 7.318 1.00 0.80 H new ATOM 0 HG12 VAL A 42 23.922 -19.935 6.899 1.00 0.80 H new ATOM 0 HG13 VAL A 42 25.089 -20.947 7.784 1.00 0.80 H new ATOM 0 HG21 VAL A 42 27.538 -20.080 6.152 1.00 0.87 H new ATOM 0 HG22 VAL A 42 27.168 -21.767 6.580 1.00 0.87 H new ATOM 0 HG23 VAL A 42 27.413 -21.314 4.876 1.00 0.87 H new ATOM 649 N HIS A 43 23.998 -21.619 2.994 1.00 0.44 N ATOM 650 CA HIS A 43 24.040 -21.677 1.536 1.00 0.49 C ATOM 651 C HIS A 43 24.231 -20.277 0.957 1.00 0.47 C ATOM 652 O HIS A 43 23.720 -19.307 1.509 1.00 0.53 O ATOM 653 CB HIS A 43 22.743 -22.306 0.994 1.00 0.64 C ATOM 654 CG HIS A 43 22.541 -22.137 -0.488 1.00 1.16 C ATOM 655 ND1 HIS A 43 23.356 -22.721 -1.436 1.00 2.00 N ATOM 656 CD2 HIS A 43 21.614 -21.429 -1.182 1.00 2.04 C ATOM 657 CE1 HIS A 43 22.940 -22.380 -2.643 1.00 2.74 C ATOM 658 NE2 HIS A 43 21.887 -21.597 -2.518 1.00 2.75 N ATOM 0 H HIS A 43 23.180 -21.138 3.368 1.00 0.44 H new ATOM 0 HA HIS A 43 24.884 -22.297 1.233 1.00 0.49 H new ATOM 0 HB2 HIS A 43 22.744 -23.370 1.229 1.00 0.64 H new ATOM 0 HB3 HIS A 43 21.894 -21.865 1.517 1.00 0.64 H new ATOM 0 HD1 HIS A 43 24.155 -23.322 -1.236 1.00 2.00 H new ATOM 0 HD2 HIS A 43 20.811 -20.842 -0.762 1.00 2.04 H new ATOM 0 HE1 HIS A 43 23.388 -22.691 -3.575 1.00 2.74 H new ATOM 667 N TYR A 44 24.962 -20.183 -0.156 1.00 0.44 N ATOM 668 CA TYR A 44 25.163 -18.907 -0.837 1.00 0.42 C ATOM 669 C TYR A 44 24.926 -19.050 -2.341 1.00 0.41 C ATOM 670 O TYR A 44 25.259 -20.078 -2.935 1.00 0.47 O ATOM 671 CB TYR A 44 26.576 -18.365 -0.568 1.00 0.46 C ATOM 672 CG TYR A 44 27.693 -19.193 -1.172 1.00 0.50 C ATOM 673 CD1 TYR A 44 28.075 -20.398 -0.602 1.00 0.52 C ATOM 674 CD2 TYR A 44 28.369 -18.764 -2.309 1.00 0.60 C ATOM 675 CE1 TYR A 44 29.092 -21.155 -1.144 1.00 0.60 C ATOM 676 CE2 TYR A 44 29.389 -19.517 -2.860 1.00 0.68 C ATOM 677 CZ TYR A 44 29.747 -20.713 -2.271 1.00 0.66 C ATOM 678 OH TYR A 44 30.753 -21.478 -2.813 1.00 0.76 O ATOM 0 H TYR A 44 25.423 -20.976 -0.603 1.00 0.44 H new ATOM 0 HA TYR A 44 24.438 -18.196 -0.441 1.00 0.42 H new ATOM 0 HB2 TYR A 44 26.642 -17.349 -0.958 1.00 0.46 H new ATOM 0 HB3 TYR A 44 26.729 -18.303 0.509 1.00 0.46 H new ATOM 0 HD1 TYR A 44 27.566 -20.750 0.283 1.00 0.52 H new ATOM 0 HD2 TYR A 44 28.093 -17.827 -2.769 1.00 0.60 H new ATOM 0 HE1 TYR A 44 29.374 -22.092 -0.686 1.00 0.60 H new ATOM 0 HE2 TYR A 44 29.902 -19.172 -3.745 1.00 0.68 H new ATOM 0 HH TYR A 44 30.620 -22.417 -2.564 1.00 0.76 H new ATOM 688 N VAL A 45 24.310 -18.037 -2.936 1.00 0.35 N ATOM 689 CA VAL A 45 24.089 -17.992 -4.380 1.00 0.36 C ATOM 690 C VAL A 45 23.630 -16.591 -4.776 1.00 0.30 C ATOM 691 O VAL A 45 23.083 -15.867 -3.944 1.00 0.30 O ATOM 692 CB VAL A 45 23.045 -19.046 -4.832 1.00 0.44 C ATOM 693 CG1 VAL A 45 21.657 -18.711 -4.309 1.00 0.47 C ATOM 694 CG2 VAL A 45 23.035 -19.196 -6.353 1.00 0.49 C ATOM 0 H VAL A 45 23.950 -17.225 -2.435 1.00 0.35 H new ATOM 0 HA VAL A 45 25.029 -18.229 -4.879 1.00 0.36 H new ATOM 0 HB VAL A 45 23.339 -20.004 -4.402 1.00 0.44 H new ATOM 0 HG11 VAL A 45 20.949 -19.469 -4.644 1.00 0.47 H new ATOM 0 HG12 VAL A 45 21.675 -18.687 -3.219 1.00 0.47 H new ATOM 0 HG13 VAL A 45 21.351 -17.736 -4.688 1.00 0.47 H new ATOM 0 HG21 VAL A 45 22.294 -19.942 -6.640 1.00 0.49 H new ATOM 0 HG22 VAL A 45 22.784 -18.239 -6.811 1.00 0.49 H new ATOM 0 HG23 VAL A 45 24.020 -19.514 -6.694 1.00 0.49 H new ATOM 704 N GLY A 46 23.865 -16.191 -6.018 1.00 0.31 N ATOM 705 CA GLY A 46 23.437 -14.875 -6.444 1.00 0.30 C ATOM 706 C GLY A 46 23.825 -14.554 -7.873 1.00 0.30 C ATOM 707 O GLY A 46 23.417 -15.246 -8.804 1.00 0.36 O ATOM 0 H GLY A 46 24.339 -16.747 -6.730 1.00 0.31 H new ATOM 0 HA2 GLY A 46 22.354 -14.802 -6.343 1.00 0.30 H new ATOM 0 HA3 GLY A 46 23.870 -14.127 -5.780 1.00 0.30 H new ATOM 711 N LYS A 47 24.605 -13.494 -8.046 1.00 0.27 N ATOM 712 CA LYS A 47 25.020 -13.051 -9.372 1.00 0.29 C ATOM 713 C LYS A 47 26.291 -12.216 -9.297 1.00 0.25 C ATOM 714 O LYS A 47 26.778 -11.914 -8.207 1.00 0.26 O ATOM 715 CB LYS A 47 23.907 -12.257 -10.074 1.00 0.36 C ATOM 716 CG LYS A 47 23.370 -11.060 -9.300 1.00 0.42 C ATOM 717 CD LYS A 47 22.477 -10.195 -10.184 1.00 0.66 C ATOM 718 CE LYS A 47 21.700 -9.148 -9.391 1.00 0.83 C ATOM 719 NZ LYS A 47 22.579 -8.185 -8.673 1.00 1.43 N ATOM 0 H LYS A 47 24.964 -12.923 -7.281 1.00 0.27 H new ATOM 0 HA LYS A 47 25.224 -13.945 -9.961 1.00 0.29 H new ATOM 0 HB2 LYS A 47 24.284 -11.907 -11.035 1.00 0.36 H new ATOM 0 HB3 LYS A 47 23.079 -12.934 -10.284 1.00 0.36 H new ATOM 0 HG2 LYS A 47 22.806 -11.406 -8.434 1.00 0.42 H new ATOM 0 HG3 LYS A 47 24.201 -10.464 -8.922 1.00 0.42 H new ATOM 0 HD2 LYS A 47 23.090 -9.695 -10.934 1.00 0.66 H new ATOM 0 HD3 LYS A 47 21.775 -10.834 -10.720 1.00 0.66 H new ATOM 0 HE2 LYS A 47 21.047 -8.598 -10.069 1.00 0.83 H new ATOM 0 HE3 LYS A 47 21.057 -9.652 -8.669 1.00 0.83 H new ATOM 0 HZ1 LYS A 47 21.993 -7.500 -8.154 1.00 1.43 H new ATOM 0 HZ2 LYS A 47 23.184 -8.701 -8.003 1.00 1.43 H new ATOM 0 HZ3 LYS A 47 23.175 -7.680 -9.360 1.00 1.43 H new ATOM 733 N LEU A 48 26.837 -11.875 -10.457 1.00 0.27 N ATOM 734 CA LEU A 48 28.004 -11.009 -10.536 1.00 0.26 C ATOM 735 C LEU A 48 27.558 -9.555 -10.652 1.00 0.25 C ATOM 736 O LEU A 48 27.075 -9.128 -11.702 1.00 0.27 O ATOM 737 CB LEU A 48 28.880 -11.394 -11.735 1.00 0.29 C ATOM 738 CG LEU A 48 30.108 -10.509 -11.973 1.00 0.32 C ATOM 739 CD1 LEU A 48 31.020 -10.519 -10.759 1.00 0.36 C ATOM 740 CD2 LEU A 48 30.867 -10.964 -13.212 1.00 0.38 C ATOM 0 H LEU A 48 26.486 -12.188 -11.362 1.00 0.27 H new ATOM 0 HA LEU A 48 28.595 -11.130 -9.628 1.00 0.26 H new ATOM 0 HB2 LEU A 48 29.217 -12.422 -11.600 1.00 0.29 H new ATOM 0 HB3 LEU A 48 28.263 -11.376 -12.633 1.00 0.29 H new ATOM 0 HG LEU A 48 29.764 -9.488 -12.136 1.00 0.32 H new ATOM 0 HD11 LEU A 48 31.886 -9.884 -10.949 1.00 0.36 H new ATOM 0 HD12 LEU A 48 30.477 -10.142 -9.893 1.00 0.36 H new ATOM 0 HD13 LEU A 48 31.353 -11.538 -10.563 1.00 0.36 H new ATOM 0 HD21 LEU A 48 31.735 -10.322 -13.363 1.00 0.38 H new ATOM 0 HD22 LEU A 48 31.196 -11.995 -13.079 1.00 0.38 H new ATOM 0 HD23 LEU A 48 30.214 -10.901 -14.082 1.00 0.38 H new ATOM 752 N GLU A 49 27.718 -8.797 -9.573 1.00 0.29 N ATOM 753 CA GLU A 49 27.241 -7.415 -9.526 1.00 0.36 C ATOM 754 C GLU A 49 28.053 -6.533 -10.456 1.00 0.34 C ATOM 755 O GLU A 49 27.576 -5.506 -10.932 1.00 0.41 O ATOM 756 CB GLU A 49 27.340 -6.858 -8.106 1.00 0.50 C ATOM 757 CG GLU A 49 26.579 -5.558 -7.909 1.00 0.63 C ATOM 758 CD GLU A 49 25.074 -5.748 -7.956 1.00 1.20 C ATOM 759 OE1 GLU A 49 24.567 -6.395 -8.901 1.00 1.75 O ATOM 760 OE2 GLU A 49 24.387 -5.253 -7.040 1.00 1.96 O ATOM 0 H GLU A 49 28.174 -9.114 -8.718 1.00 0.29 H new ATOM 0 HA GLU A 49 26.199 -7.416 -9.846 1.00 0.36 H new ATOM 0 HB2 GLU A 49 26.960 -7.602 -7.406 1.00 0.50 H new ATOM 0 HB3 GLU A 49 28.390 -6.696 -7.860 1.00 0.50 H new ATOM 0 HG2 GLU A 49 26.856 -5.121 -6.950 1.00 0.63 H new ATOM 0 HG3 GLU A 49 26.876 -4.847 -8.680 1.00 0.63 H new ATOM 767 N SER A 50 29.282 -6.959 -10.704 1.00 0.33 N ATOM 768 CA SER A 50 30.233 -6.178 -11.485 1.00 0.40 C ATOM 769 C SER A 50 29.661 -5.808 -12.858 1.00 0.45 C ATOM 770 O SER A 50 29.919 -4.725 -13.381 1.00 0.55 O ATOM 771 CB SER A 50 31.544 -6.958 -11.650 1.00 0.46 C ATOM 772 OG SER A 50 32.572 -6.157 -12.216 1.00 0.67 O ATOM 0 H SER A 50 29.648 -7.851 -10.372 1.00 0.33 H new ATOM 0 HA SER A 50 30.431 -5.252 -10.946 1.00 0.40 H new ATOM 0 HB2 SER A 50 31.869 -7.331 -10.679 1.00 0.46 H new ATOM 0 HB3 SER A 50 31.371 -7.828 -12.284 1.00 0.46 H new ATOM 0 HG SER A 50 33.390 -6.689 -12.303 1.00 0.67 H new ATOM 778 N THR A 51 28.875 -6.709 -13.430 1.00 0.44 N ATOM 779 CA THR A 51 28.280 -6.480 -14.739 1.00 0.53 C ATOM 780 C THR A 51 26.753 -6.642 -14.688 1.00 0.54 C ATOM 781 O THR A 51 26.034 -6.128 -15.545 1.00 0.73 O ATOM 782 CB THR A 51 28.898 -7.428 -15.798 1.00 0.59 C ATOM 783 OG1 THR A 51 28.188 -7.343 -17.038 1.00 0.72 O ATOM 784 CG2 THR A 51 28.917 -8.869 -15.303 1.00 0.53 C ATOM 0 H THR A 51 28.634 -7.606 -13.008 1.00 0.44 H new ATOM 0 HA THR A 51 28.499 -5.453 -15.031 1.00 0.53 H new ATOM 0 HB THR A 51 29.927 -7.108 -15.963 1.00 0.59 H new ATOM 0 HG1 THR A 51 28.597 -7.949 -17.691 1.00 0.72 H new ATOM 0 HG21 THR A 51 29.356 -9.510 -16.067 1.00 0.53 H new ATOM 0 HG22 THR A 51 29.511 -8.933 -14.391 1.00 0.53 H new ATOM 0 HG23 THR A 51 27.898 -9.196 -15.096 1.00 0.53 H new ATOM 792 N GLY A 52 26.266 -7.345 -13.671 1.00 0.48 N ATOM 793 CA GLY A 52 24.834 -7.504 -13.492 1.00 0.51 C ATOM 794 C GLY A 52 24.314 -8.813 -14.054 1.00 0.54 C ATOM 795 O GLY A 52 23.104 -9.006 -14.169 1.00 0.78 O ATOM 0 H GLY A 52 26.839 -7.809 -12.966 1.00 0.48 H new ATOM 0 HA2 GLY A 52 24.597 -7.450 -12.429 1.00 0.51 H new ATOM 0 HA3 GLY A 52 24.318 -6.675 -13.976 1.00 0.51 H new ATOM 799 N LYS A 53 25.219 -9.718 -14.402 1.00 0.44 N ATOM 800 CA LYS A 53 24.817 -11.005 -14.956 1.00 0.49 C ATOM 801 C LYS A 53 24.509 -11.980 -13.832 1.00 0.41 C ATOM 802 O LYS A 53 25.301 -12.127 -12.899 1.00 0.38 O ATOM 803 CB LYS A 53 25.909 -11.594 -15.852 1.00 0.60 C ATOM 804 CG LYS A 53 26.452 -10.625 -16.891 1.00 0.84 C ATOM 805 CD LYS A 53 25.366 -10.052 -17.789 1.00 1.47 C ATOM 806 CE LYS A 53 24.689 -11.123 -18.630 1.00 2.09 C ATOM 807 NZ LYS A 53 23.798 -10.533 -19.664 1.00 2.89 N ATOM 0 H LYS A 53 26.227 -9.588 -14.312 1.00 0.44 H new ATOM 0 HA LYS A 53 23.925 -10.842 -15.562 1.00 0.49 H new ATOM 0 HB2 LYS A 53 26.732 -11.936 -15.225 1.00 0.60 H new ATOM 0 HB3 LYS A 53 25.511 -12.471 -16.362 1.00 0.60 H new ATOM 0 HG2 LYS A 53 26.967 -9.808 -16.385 1.00 0.84 H new ATOM 0 HG3 LYS A 53 27.193 -11.136 -17.506 1.00 0.84 H new ATOM 0 HD2 LYS A 53 24.619 -9.548 -17.176 1.00 1.47 H new ATOM 0 HD3 LYS A 53 25.801 -9.298 -18.446 1.00 1.47 H new ATOM 0 HE2 LYS A 53 25.447 -11.739 -19.113 1.00 2.09 H new ATOM 0 HE3 LYS A 53 24.109 -11.780 -17.983 1.00 2.09 H new ATOM 0 HZ1 LYS A 53 23.355 -11.295 -20.216 1.00 2.89 H new ATOM 0 HZ2 LYS A 53 23.059 -9.965 -19.202 1.00 2.89 H new ATOM 0 HZ3 LYS A 53 24.356 -9.926 -20.297 1.00 2.89 H new ATOM 821 N VAL A 54 23.365 -12.639 -13.924 1.00 0.44 N ATOM 822 CA VAL A 54 22.946 -13.600 -12.912 1.00 0.44 C ATOM 823 C VAL A 54 23.675 -14.932 -13.117 1.00 0.46 C ATOM 824 O VAL A 54 24.259 -15.164 -14.180 1.00 0.51 O ATOM 825 CB VAL A 54 21.408 -13.806 -12.955 1.00 0.52 C ATOM 826 CG1 VAL A 54 20.988 -14.549 -14.214 1.00 0.59 C ATOM 827 CG2 VAL A 54 20.906 -14.531 -11.715 1.00 0.57 C ATOM 0 H VAL A 54 22.705 -12.526 -14.694 1.00 0.44 H new ATOM 0 HA VAL A 54 23.207 -13.207 -11.929 1.00 0.44 H new ATOM 0 HB VAL A 54 20.951 -12.817 -12.973 1.00 0.52 H new ATOM 0 HG11 VAL A 54 19.906 -14.678 -14.216 1.00 0.59 H new ATOM 0 HG12 VAL A 54 21.287 -13.976 -15.092 1.00 0.59 H new ATOM 0 HG13 VAL A 54 21.470 -15.526 -14.238 1.00 0.59 H new ATOM 0 HG21 VAL A 54 19.825 -14.657 -11.780 1.00 0.57 H new ATOM 0 HG22 VAL A 54 21.382 -15.509 -11.648 1.00 0.57 H new ATOM 0 HG23 VAL A 54 21.150 -13.947 -10.828 1.00 0.57 H new ATOM 837 N PHE A 55 23.657 -15.796 -12.107 1.00 0.48 N ATOM 838 CA PHE A 55 24.310 -17.095 -12.207 1.00 0.54 C ATOM 839 C PHE A 55 23.514 -18.032 -13.103 1.00 0.61 C ATOM 840 O PHE A 55 22.527 -18.633 -12.684 1.00 0.78 O ATOM 841 CB PHE A 55 24.494 -17.732 -10.823 1.00 0.59 C ATOM 842 CG PHE A 55 25.684 -17.218 -10.061 1.00 0.47 C ATOM 843 CD1 PHE A 55 26.396 -16.115 -10.504 1.00 0.52 C ATOM 844 CD2 PHE A 55 26.095 -17.854 -8.901 1.00 0.58 C ATOM 845 CE1 PHE A 55 27.496 -15.657 -9.805 1.00 0.46 C ATOM 846 CE2 PHE A 55 27.193 -17.400 -8.198 1.00 0.70 C ATOM 847 CZ PHE A 55 27.895 -16.301 -8.651 1.00 0.56 C ATOM 0 H PHE A 55 23.199 -15.620 -11.213 1.00 0.48 H new ATOM 0 HA PHE A 55 25.294 -16.934 -12.648 1.00 0.54 H new ATOM 0 HB2 PHE A 55 23.595 -17.556 -10.232 1.00 0.59 H new ATOM 0 HB3 PHE A 55 24.591 -18.811 -10.942 1.00 0.59 H new ATOM 0 HD1 PHE A 55 26.087 -15.608 -11.406 1.00 0.52 H new ATOM 0 HD2 PHE A 55 25.550 -18.715 -8.542 1.00 0.58 H new ATOM 0 HE1 PHE A 55 28.043 -14.796 -10.161 1.00 0.46 H new ATOM 0 HE2 PHE A 55 27.503 -17.904 -7.294 1.00 0.70 H new ATOM 0 HZ PHE A 55 28.755 -15.946 -8.103 1.00 0.56 H new ATOM 857 N ASP A 56 23.946 -18.130 -14.350 1.00 0.61 N ATOM 858 CA ASP A 56 23.346 -19.054 -15.298 1.00 0.71 C ATOM 859 C ASP A 56 24.439 -19.835 -16.016 1.00 0.70 C ATOM 860 O ASP A 56 24.915 -19.439 -17.083 1.00 0.87 O ATOM 861 CB ASP A 56 22.465 -18.310 -16.304 1.00 0.91 C ATOM 862 CG ASP A 56 21.773 -19.250 -17.269 1.00 1.59 C ATOM 863 OD1 ASP A 56 21.038 -20.146 -16.809 1.00 2.18 O ATOM 864 OD2 ASP A 56 21.942 -19.086 -18.494 1.00 2.14 O ATOM 0 H ASP A 56 24.714 -17.577 -14.730 1.00 0.61 H new ATOM 0 HA ASP A 56 22.711 -19.752 -14.752 1.00 0.71 H new ATOM 0 HB2 ASP A 56 21.716 -17.728 -15.767 1.00 0.91 H new ATOM 0 HB3 ASP A 56 23.076 -17.603 -16.865 1.00 0.91 H new ATOM 869 N SER A 57 24.864 -20.920 -15.391 1.00 0.61 N ATOM 870 CA SER A 57 25.906 -21.768 -15.939 1.00 0.67 C ATOM 871 C SER A 57 25.506 -23.232 -15.785 1.00 0.68 C ATOM 872 O SER A 57 24.546 -23.549 -15.084 1.00 0.75 O ATOM 873 CB SER A 57 27.232 -21.498 -15.226 1.00 0.75 C ATOM 874 OG SER A 57 27.565 -20.117 -15.247 1.00 1.24 O ATOM 0 H SER A 57 24.497 -21.236 -14.493 1.00 0.61 H new ATOM 0 HA SER A 57 26.033 -21.545 -16.998 1.00 0.67 H new ATOM 0 HB2 SER A 57 27.167 -21.842 -14.194 1.00 0.75 H new ATOM 0 HB3 SER A 57 28.026 -22.072 -15.704 1.00 0.75 H new ATOM 0 HG SER A 57 28.416 -19.979 -14.782 1.00 1.24 H new ATOM 880 N SER A 58 26.249 -24.115 -16.432 1.00 0.75 N ATOM 881 CA SER A 58 25.900 -25.529 -16.505 1.00 0.82 C ATOM 882 C SER A 58 25.769 -26.181 -15.124 1.00 0.70 C ATOM 883 O SER A 58 24.809 -26.908 -14.864 1.00 0.70 O ATOM 884 CB SER A 58 26.961 -26.253 -17.328 1.00 1.03 C ATOM 885 OG SER A 58 27.233 -25.539 -18.523 1.00 1.49 O ATOM 0 H SER A 58 27.111 -23.875 -16.922 1.00 0.75 H new ATOM 0 HA SER A 58 24.922 -25.609 -16.979 1.00 0.82 H new ATOM 0 HB2 SER A 58 27.875 -26.357 -16.743 1.00 1.03 H new ATOM 0 HB3 SER A 58 26.619 -27.260 -17.568 1.00 1.03 H new ATOM 0 HG SER A 58 27.917 -26.014 -19.040 1.00 1.49 H new ATOM 891 N PHE A 59 26.711 -25.899 -14.236 1.00 0.69 N ATOM 892 CA PHE A 59 26.786 -26.601 -12.958 1.00 0.70 C ATOM 893 C PHE A 59 25.990 -25.879 -11.878 1.00 0.64 C ATOM 894 O PHE A 59 25.190 -26.488 -11.164 1.00 0.67 O ATOM 895 CB PHE A 59 28.243 -26.717 -12.511 1.00 0.85 C ATOM 896 CG PHE A 59 29.197 -27.060 -13.623 1.00 1.08 C ATOM 897 CD1 PHE A 59 29.260 -28.346 -14.135 1.00 1.28 C ATOM 898 CD2 PHE A 59 30.038 -26.090 -14.150 1.00 1.39 C ATOM 899 CE1 PHE A 59 30.143 -28.659 -15.150 1.00 1.58 C ATOM 900 CE2 PHE A 59 30.922 -26.400 -15.166 1.00 1.77 C ATOM 901 CZ PHE A 59 30.974 -27.687 -15.665 1.00 1.80 C ATOM 0 H PHE A 59 27.433 -25.192 -14.374 1.00 0.69 H new ATOM 0 HA PHE A 59 26.358 -27.593 -13.100 1.00 0.70 H new ATOM 0 HB2 PHE A 59 28.550 -25.774 -12.060 1.00 0.85 H new ATOM 0 HB3 PHE A 59 28.315 -27.480 -11.736 1.00 0.85 H new ATOM 0 HD1 PHE A 59 28.612 -29.112 -13.736 1.00 1.28 H new ATOM 0 HD2 PHE A 59 30.001 -25.083 -13.762 1.00 1.39 H new ATOM 0 HE1 PHE A 59 30.182 -29.665 -15.540 1.00 1.58 H new ATOM 0 HE2 PHE A 59 31.571 -25.637 -15.569 1.00 1.77 H new ATOM 0 HZ PHE A 59 31.665 -27.932 -16.458 1.00 1.80 H new ATOM 911 N ASP A 60 26.217 -24.576 -11.792 1.00 0.66 N ATOM 912 CA ASP A 60 25.727 -23.737 -10.697 1.00 0.72 C ATOM 913 C ASP A 60 24.219 -23.848 -10.499 1.00 0.71 C ATOM 914 O ASP A 60 23.742 -23.977 -9.370 1.00 0.86 O ATOM 915 CB ASP A 60 26.104 -22.281 -10.973 1.00 0.83 C ATOM 916 CG ASP A 60 27.539 -22.145 -11.443 1.00 1.54 C ATOM 917 OD1 ASP A 60 27.838 -22.529 -12.590 1.00 1.89 O ATOM 918 OD2 ASP A 60 28.370 -21.651 -10.652 1.00 2.19 O ATOM 0 H ASP A 60 26.754 -24.060 -12.489 1.00 0.66 H new ATOM 0 HA ASP A 60 26.196 -24.089 -9.778 1.00 0.72 H new ATOM 0 HB2 ASP A 60 25.435 -21.870 -11.729 1.00 0.83 H new ATOM 0 HB3 ASP A 60 25.962 -21.692 -10.067 1.00 0.83 H new ATOM 923 N ARG A 61 23.465 -23.811 -11.591 1.00 0.68 N ATOM 924 CA ARG A 61 22.010 -23.828 -11.496 1.00 0.80 C ATOM 925 C ARG A 61 21.471 -25.249 -11.364 1.00 0.75 C ATOM 926 O ARG A 61 20.261 -25.457 -11.275 1.00 0.92 O ATOM 927 CB ARG A 61 21.371 -23.103 -12.694 1.00 0.97 C ATOM 928 CG ARG A 61 21.795 -23.603 -14.073 1.00 1.23 C ATOM 929 CD ARG A 61 21.124 -24.916 -14.458 1.00 1.65 C ATOM 930 NE ARG A 61 21.434 -25.313 -15.832 1.00 1.75 N ATOM 931 CZ ARG A 61 20.551 -25.892 -16.651 1.00 2.15 C ATOM 932 NH1 ARG A 61 19.310 -26.120 -16.233 1.00 2.58 N ATOM 933 NH2 ARG A 61 20.903 -26.229 -17.887 1.00 2.78 N ATOM 0 H ARG A 61 23.831 -23.770 -12.542 1.00 0.68 H new ATOM 0 HA ARG A 61 21.735 -23.290 -10.589 1.00 0.80 H new ATOM 0 HB2 ARG A 61 20.288 -23.191 -12.613 1.00 0.97 H new ATOM 0 HB3 ARG A 61 21.610 -22.042 -12.623 1.00 0.97 H new ATOM 0 HG2 ARG A 61 21.555 -22.845 -14.819 1.00 1.23 H new ATOM 0 HG3 ARG A 61 22.877 -23.735 -14.090 1.00 1.23 H new ATOM 0 HD2 ARG A 61 21.446 -25.701 -13.773 1.00 1.65 H new ATOM 0 HD3 ARG A 61 20.044 -24.817 -14.345 1.00 1.65 H new ATOM 0 HE ARG A 61 22.375 -25.138 -16.184 1.00 1.75 H new ATOM 0 HH11 ARG A 61 19.033 -25.853 -15.288 1.00 2.58 H new ATOM 0 HH12 ARG A 61 18.635 -26.562 -16.857 1.00 2.58 H new ATOM 0 HH21 ARG A 61 21.851 -26.046 -18.215 1.00 2.78 H new ATOM 0 HH22 ARG A 61 20.225 -26.671 -18.508 1.00 2.78 H new ATOM 947 N ASN A 62 22.370 -26.221 -11.341 1.00 0.64 N ATOM 948 CA ASN A 62 21.965 -27.614 -11.242 1.00 0.68 C ATOM 949 C ASN A 62 22.201 -28.148 -9.833 1.00 0.73 C ATOM 950 O ASN A 62 21.358 -28.855 -9.286 1.00 0.89 O ATOM 951 CB ASN A 62 22.714 -28.471 -12.269 1.00 0.71 C ATOM 952 CG ASN A 62 22.229 -29.910 -12.298 1.00 0.83 C ATOM 953 OD1 ASN A 62 21.253 -30.234 -12.973 1.00 0.93 O ATOM 954 ND2 ASN A 62 22.917 -30.786 -11.580 1.00 1.10 N ATOM 0 H ASN A 62 23.378 -26.072 -11.389 1.00 0.64 H new ATOM 0 HA ASN A 62 20.898 -27.671 -11.457 1.00 0.68 H new ATOM 0 HB2 ASN A 62 22.594 -28.032 -13.259 1.00 0.71 H new ATOM 0 HB3 ASN A 62 23.780 -28.456 -12.041 1.00 0.71 H new ATOM 0 HD21 ASN A 62 22.643 -31.768 -11.574 1.00 1.10 H new ATOM 0 HD22 ASN A 62 23.721 -30.478 -11.033 1.00 1.10 H new ATOM 961 N VAL A 63 23.342 -27.804 -9.243 1.00 0.68 N ATOM 962 CA VAL A 63 23.678 -28.280 -7.902 1.00 0.83 C ATOM 963 C VAL A 63 23.974 -27.116 -6.950 1.00 0.62 C ATOM 964 O VAL A 63 24.801 -26.253 -7.246 1.00 0.64 O ATOM 965 CB VAL A 63 24.880 -29.258 -7.914 1.00 1.16 C ATOM 966 CG1 VAL A 63 24.468 -30.608 -8.488 1.00 1.76 C ATOM 967 CG2 VAL A 63 26.051 -28.680 -8.697 1.00 2.03 C ATOM 0 H VAL A 63 24.047 -27.201 -9.668 1.00 0.68 H new ATOM 0 HA VAL A 63 22.801 -28.818 -7.542 1.00 0.83 H new ATOM 0 HB VAL A 63 25.203 -29.404 -6.883 1.00 1.16 H new ATOM 0 HG11 VAL A 63 25.326 -31.281 -8.488 1.00 1.76 H new ATOM 0 HG12 VAL A 63 23.672 -31.035 -7.878 1.00 1.76 H new ATOM 0 HG13 VAL A 63 24.111 -30.475 -9.509 1.00 1.76 H new ATOM 0 HG21 VAL A 63 26.880 -29.388 -8.688 1.00 2.03 H new ATOM 0 HG22 VAL A 63 25.744 -28.494 -9.726 1.00 2.03 H new ATOM 0 HG23 VAL A 63 26.369 -27.744 -8.238 1.00 2.03 H new ATOM 977 N PRO A 64 23.277 -27.065 -5.801 1.00 0.91 N ATOM 978 CA PRO A 64 23.498 -26.049 -4.774 1.00 1.03 C ATOM 979 C PRO A 64 24.622 -26.430 -3.807 1.00 0.81 C ATOM 980 O PRO A 64 24.738 -27.586 -3.397 1.00 0.86 O ATOM 981 CB PRO A 64 22.152 -25.991 -4.025 1.00 1.53 C ATOM 982 CG PRO A 64 21.291 -27.076 -4.608 1.00 1.76 C ATOM 983 CD PRO A 64 22.195 -27.971 -5.414 1.00 1.40 C ATOM 0 HA PRO A 64 23.803 -25.097 -5.210 1.00 1.03 H new ATOM 0 HB2 PRO A 64 22.297 -26.143 -2.955 1.00 1.53 H new ATOM 0 HB3 PRO A 64 21.682 -25.015 -4.147 1.00 1.53 H new ATOM 0 HG2 PRO A 64 20.794 -27.640 -3.819 1.00 1.76 H new ATOM 0 HG3 PRO A 64 20.509 -26.651 -5.237 1.00 1.76 H new ATOM 0 HD2 PRO A 64 22.561 -28.813 -4.826 1.00 1.40 H new ATOM 0 HD3 PRO A 64 21.684 -28.387 -6.282 1.00 1.40 H new ATOM 991 N PHE A 65 25.445 -25.454 -3.436 1.00 0.68 N ATOM 992 CA PHE A 65 26.569 -25.697 -2.533 1.00 0.53 C ATOM 993 C PHE A 65 26.348 -25.013 -1.175 1.00 0.47 C ATOM 994 O PHE A 65 25.688 -23.972 -1.089 1.00 0.54 O ATOM 995 CB PHE A 65 27.868 -25.198 -3.180 1.00 0.62 C ATOM 996 CG PHE A 65 29.114 -25.551 -2.413 1.00 0.72 C ATOM 997 CD1 PHE A 65 29.628 -26.836 -2.451 1.00 1.06 C ATOM 998 CD2 PHE A 65 29.768 -24.595 -1.655 1.00 0.71 C ATOM 999 CE1 PHE A 65 30.771 -27.161 -1.746 1.00 1.31 C ATOM 1000 CE2 PHE A 65 30.912 -24.912 -0.947 1.00 0.95 C ATOM 1001 CZ PHE A 65 31.414 -26.198 -0.994 1.00 1.24 C ATOM 0 H PHE A 65 25.356 -24.486 -3.746 1.00 0.68 H new ATOM 0 HA PHE A 65 26.645 -26.770 -2.355 1.00 0.53 H new ATOM 0 HB2 PHE A 65 27.943 -25.614 -4.185 1.00 0.62 H new ATOM 0 HB3 PHE A 65 27.815 -24.115 -3.286 1.00 0.62 H new ATOM 0 HD1 PHE A 65 29.130 -27.593 -3.038 1.00 1.06 H new ATOM 0 HD2 PHE A 65 29.379 -23.588 -1.616 1.00 0.71 H new ATOM 0 HE1 PHE A 65 31.161 -28.167 -1.783 1.00 1.31 H new ATOM 0 HE2 PHE A 65 31.412 -24.157 -0.359 1.00 0.95 H new ATOM 0 HZ PHE A 65 32.308 -26.450 -0.443 1.00 1.24 H new ATOM 1011 N LYS A 66 26.887 -25.621 -0.121 1.00 0.41 N ATOM 1012 CA LYS A 66 26.820 -25.070 1.233 1.00 0.39 C ATOM 1013 C LYS A 66 28.175 -25.207 1.926 1.00 0.38 C ATOM 1014 O LYS A 66 28.981 -26.055 1.542 1.00 0.48 O ATOM 1015 CB LYS A 66 25.718 -25.772 2.046 1.00 0.45 C ATOM 1016 CG LYS A 66 25.645 -27.283 1.844 1.00 0.60 C ATOM 1017 CD LYS A 66 25.944 -28.053 3.125 1.00 0.67 C ATOM 1018 CE LYS A 66 27.435 -28.141 3.408 1.00 0.93 C ATOM 1019 NZ LYS A 66 28.170 -28.844 2.321 1.00 1.36 N ATOM 0 H LYS A 66 27.383 -26.510 -0.180 1.00 0.41 H new ATOM 0 HA LYS A 66 26.571 -24.011 1.168 1.00 0.39 H new ATOM 0 HB2 LYS A 66 25.879 -25.567 3.104 1.00 0.45 H new ATOM 0 HB3 LYS A 66 24.755 -25.336 1.780 1.00 0.45 H new ATOM 0 HG2 LYS A 66 24.652 -27.552 1.485 1.00 0.60 H new ATOM 0 HG3 LYS A 66 26.354 -27.579 1.071 1.00 0.60 H new ATOM 0 HD2 LYS A 66 25.445 -27.567 3.964 1.00 0.67 H new ATOM 0 HD3 LYS A 66 25.531 -29.059 3.047 1.00 0.67 H new ATOM 0 HE2 LYS A 66 27.841 -27.137 3.529 1.00 0.93 H new ATOM 0 HE3 LYS A 66 27.595 -28.665 4.351 1.00 0.93 H new ATOM 0 HZ1 LYS A 66 28.863 -29.499 2.737 1.00 1.36 H new ATOM 0 HZ2 LYS A 66 27.497 -29.379 1.736 1.00 1.36 H new ATOM 0 HZ3 LYS A 66 28.665 -28.147 1.729 1.00 1.36 H new ATOM 1033 N PHE A 67 28.430 -24.384 2.941 1.00 0.39 N ATOM 1034 CA PHE A 67 29.733 -24.383 3.602 1.00 0.42 C ATOM 1035 C PHE A 67 29.606 -24.222 5.117 1.00 0.42 C ATOM 1036 O PHE A 67 28.504 -24.065 5.650 1.00 0.46 O ATOM 1037 CB PHE A 67 30.610 -23.262 3.030 1.00 0.46 C ATOM 1038 CG PHE A 67 30.082 -21.865 3.278 1.00 0.45 C ATOM 1039 CD1 PHE A 67 29.133 -21.305 2.436 1.00 0.55 C ATOM 1040 CD2 PHE A 67 30.536 -21.115 4.353 1.00 0.43 C ATOM 1041 CE1 PHE A 67 28.653 -20.027 2.657 1.00 0.57 C ATOM 1042 CE2 PHE A 67 30.058 -19.836 4.577 1.00 0.46 C ATOM 1043 CZ PHE A 67 29.113 -19.293 3.729 1.00 0.51 C ATOM 0 H PHE A 67 27.759 -23.716 3.321 1.00 0.39 H new ATOM 0 HA PHE A 67 30.199 -25.349 3.410 1.00 0.42 H new ATOM 0 HB2 PHE A 67 31.608 -23.342 3.462 1.00 0.46 H new ATOM 0 HB3 PHE A 67 30.715 -23.412 1.955 1.00 0.46 H new ATOM 0 HD1 PHE A 67 28.764 -21.875 1.596 1.00 0.55 H new ATOM 0 HD2 PHE A 67 31.272 -21.535 5.023 1.00 0.43 H new ATOM 0 HE1 PHE A 67 27.917 -19.604 1.989 1.00 0.57 H new ATOM 0 HE2 PHE A 67 30.424 -19.262 5.415 1.00 0.46 H new ATOM 0 HZ PHE A 67 28.736 -18.297 3.905 1.00 0.51 H new ATOM 1053 N HIS A 68 30.748 -24.275 5.798 1.00 0.42 N ATOM 1054 CA HIS A 68 30.813 -24.070 7.243 1.00 0.44 C ATOM 1055 C HIS A 68 31.447 -22.722 7.567 1.00 0.42 C ATOM 1056 O HIS A 68 32.312 -22.243 6.831 1.00 0.44 O ATOM 1057 CB HIS A 68 31.651 -25.162 7.912 1.00 0.53 C ATOM 1058 CG HIS A 68 30.985 -26.500 8.025 1.00 0.89 C ATOM 1059 ND1 HIS A 68 31.187 -27.522 7.125 1.00 1.68 N ATOM 1060 CD2 HIS A 68 30.157 -26.998 8.973 1.00 1.56 C ATOM 1061 CE1 HIS A 68 30.515 -28.590 7.517 1.00 1.98 C ATOM 1062 NE2 HIS A 68 29.882 -28.300 8.638 1.00 1.87 N ATOM 0 H HIS A 68 31.653 -24.461 5.365 1.00 0.42 H new ATOM 0 HA HIS A 68 29.791 -24.104 7.621 1.00 0.44 H new ATOM 0 HB2 HIS A 68 32.577 -25.282 7.350 1.00 0.53 H new ATOM 0 HB3 HIS A 68 31.926 -24.825 8.912 1.00 0.53 H new ATOM 0 HD2 HIS A 68 29.781 -26.468 9.835 1.00 1.56 H new ATOM 0 HE1 HIS A 68 30.488 -29.541 7.006 1.00 1.98 H new ATOM 0 HE2 HIS A 68 29.287 -28.938 9.167 1.00 1.87 H new ATOM 1071 N LEU A 69 31.020 -22.119 8.670 1.00 0.44 N ATOM 1072 CA LEU A 69 31.662 -20.909 9.175 1.00 0.47 C ATOM 1073 C LEU A 69 32.947 -21.293 9.907 1.00 0.49 C ATOM 1074 O LEU A 69 32.914 -22.096 10.842 1.00 0.58 O ATOM 1075 CB LEU A 69 30.704 -20.144 10.100 1.00 0.59 C ATOM 1076 CG LEU A 69 31.272 -18.890 10.771 1.00 0.71 C ATOM 1077 CD1 LEU A 69 31.919 -17.975 9.748 1.00 0.74 C ATOM 1078 CD2 LEU A 69 30.171 -18.154 11.523 1.00 0.95 C ATOM 0 H LEU A 69 30.234 -22.446 9.232 1.00 0.44 H new ATOM 0 HA LEU A 69 31.914 -20.251 8.343 1.00 0.47 H new ATOM 0 HB2 LEU A 69 29.826 -19.856 9.522 1.00 0.59 H new ATOM 0 HB3 LEU A 69 30.363 -20.825 10.879 1.00 0.59 H new ATOM 0 HG LEU A 69 32.039 -19.197 11.482 1.00 0.71 H new ATOM 0 HD11 LEU A 69 32.315 -17.092 10.249 1.00 0.74 H new ATOM 0 HD12 LEU A 69 32.731 -18.504 9.249 1.00 0.74 H new ATOM 0 HD13 LEU A 69 31.176 -17.672 9.010 1.00 0.74 H new ATOM 0 HD21 LEU A 69 30.586 -17.264 11.996 1.00 0.95 H new ATOM 0 HD22 LEU A 69 29.386 -17.862 10.825 1.00 0.95 H new ATOM 0 HD23 LEU A 69 29.752 -18.809 12.287 1.00 0.95 H new ATOM 1090 N GLU A 70 34.064 -20.701 9.477 1.00 0.59 N ATOM 1091 CA GLU A 70 35.397 -21.135 9.893 1.00 0.69 C ATOM 1092 C GLU A 70 35.662 -22.550 9.414 1.00 0.69 C ATOM 1093 O GLU A 70 35.521 -23.530 10.142 1.00 0.96 O ATOM 1094 CB GLU A 70 35.601 -20.995 11.399 1.00 0.95 C ATOM 1095 CG GLU A 70 36.280 -19.692 11.763 1.00 1.12 C ATOM 1096 CD GLU A 70 37.760 -19.698 11.459 1.00 1.47 C ATOM 1097 OE1 GLU A 70 38.128 -20.123 10.340 1.00 1.79 O ATOM 1098 OE2 GLU A 70 38.559 -19.285 12.324 1.00 2.08 O ATOM 0 H GLU A 70 34.069 -19.910 8.833 1.00 0.59 H new ATOM 0 HA GLU A 70 36.128 -20.476 9.425 1.00 0.69 H new ATOM 0 HB2 GLU A 70 34.636 -21.053 11.902 1.00 0.95 H new ATOM 0 HB3 GLU A 70 36.201 -21.830 11.762 1.00 0.95 H new ATOM 0 HG2 GLU A 70 35.805 -18.876 11.219 1.00 1.12 H new ATOM 0 HG3 GLU A 70 36.133 -19.495 12.825 1.00 1.12 H new ATOM 1105 N GLN A 71 36.010 -22.622 8.147 1.00 0.68 N ATOM 1106 CA GLN A 71 36.202 -23.883 7.458 1.00 0.86 C ATOM 1107 C GLN A 71 37.538 -23.870 6.715 1.00 0.83 C ATOM 1108 O GLN A 71 37.955 -24.863 6.124 1.00 0.96 O ATOM 1109 CB GLN A 71 35.019 -24.071 6.502 1.00 1.05 C ATOM 1110 CG GLN A 71 35.083 -25.284 5.593 1.00 0.96 C ATOM 1111 CD GLN A 71 33.836 -25.394 4.735 1.00 1.14 C ATOM 1112 OE1 GLN A 71 32.885 -26.092 5.084 1.00 1.98 O ATOM 1113 NE2 GLN A 71 33.807 -24.658 3.634 1.00 0.97 N ATOM 0 H GLN A 71 36.169 -21.802 7.561 1.00 0.68 H new ATOM 0 HA GLN A 71 36.236 -24.717 8.159 1.00 0.86 H new ATOM 0 HB2 GLN A 71 34.106 -24.133 7.094 1.00 1.05 H new ATOM 0 HB3 GLN A 71 34.935 -23.180 5.880 1.00 1.05 H new ATOM 0 HG2 GLN A 71 35.963 -25.216 4.953 1.00 0.96 H new ATOM 0 HG3 GLN A 71 35.195 -26.186 6.194 1.00 0.96 H new ATOM 0 HE21 GLN A 71 34.616 -24.092 3.378 1.00 0.97 H new ATOM 0 HE22 GLN A 71 32.976 -24.657 3.043 1.00 0.97 H new ATOM 1122 N GLY A 72 38.213 -22.725 6.768 1.00 0.72 N ATOM 1123 CA GLY A 72 39.452 -22.550 6.031 1.00 0.72 C ATOM 1124 C GLY A 72 39.201 -22.114 4.601 1.00 0.67 C ATOM 1125 O GLY A 72 40.120 -21.720 3.889 1.00 0.70 O ATOM 0 H GLY A 72 37.922 -21.912 7.311 1.00 0.72 H new ATOM 0 HA2 GLY A 72 40.072 -21.808 6.534 1.00 0.72 H new ATOM 0 HA3 GLY A 72 40.011 -23.486 6.033 1.00 0.72 H new ATOM 1129 N GLU A 73 37.944 -22.183 4.185 1.00 0.63 N ATOM 1130 CA GLU A 73 37.568 -21.841 2.818 1.00 0.62 C ATOM 1131 C GLU A 73 36.967 -20.442 2.755 1.00 0.57 C ATOM 1132 O GLU A 73 36.902 -19.828 1.694 1.00 0.66 O ATOM 1133 CB GLU A 73 36.561 -22.857 2.282 1.00 0.67 C ATOM 1134 CG GLU A 73 36.996 -24.303 2.472 1.00 0.73 C ATOM 1135 CD GLU A 73 38.294 -24.639 1.762 1.00 0.81 C ATOM 1136 OE1 GLU A 73 38.266 -24.847 0.533 1.00 0.97 O ATOM 1137 OE2 GLU A 73 39.343 -24.719 2.436 1.00 0.92 O ATOM 0 H GLU A 73 37.165 -22.473 4.775 1.00 0.63 H new ATOM 0 HA GLU A 73 38.467 -21.862 2.202 1.00 0.62 H new ATOM 0 HB2 GLU A 73 35.604 -22.706 2.781 1.00 0.67 H new ATOM 0 HB3 GLU A 73 36.400 -22.671 1.220 1.00 0.67 H new ATOM 0 HG2 GLU A 73 37.111 -24.503 3.537 1.00 0.73 H new ATOM 0 HG3 GLU A 73 36.209 -24.963 2.106 1.00 0.73 H new ATOM 1144 N VAL A 74 36.530 -19.942 3.901 1.00 0.50 N ATOM 1145 CA VAL A 74 35.882 -18.641 3.963 1.00 0.45 C ATOM 1146 C VAL A 74 36.765 -17.646 4.706 1.00 0.41 C ATOM 1147 O VAL A 74 37.252 -17.926 5.799 1.00 0.46 O ATOM 1148 CB VAL A 74 34.484 -18.733 4.623 1.00 0.50 C ATOM 1149 CG1 VAL A 74 33.559 -19.579 3.768 1.00 0.58 C ATOM 1150 CG2 VAL A 74 34.571 -19.298 6.037 1.00 0.55 C ATOM 0 H VAL A 74 36.612 -20.417 4.800 1.00 0.50 H new ATOM 0 HA VAL A 74 35.739 -18.288 2.942 1.00 0.45 H new ATOM 0 HB VAL A 74 34.077 -17.724 4.696 1.00 0.50 H new ATOM 0 HG11 VAL A 74 32.579 -19.637 4.241 1.00 0.58 H new ATOM 0 HG12 VAL A 74 33.460 -19.126 2.782 1.00 0.58 H new ATOM 0 HG13 VAL A 74 33.973 -20.582 3.667 1.00 0.58 H new ATOM 0 HG21 VAL A 74 33.572 -19.349 6.471 1.00 0.55 H new ATOM 0 HG22 VAL A 74 35.003 -20.298 6.003 1.00 0.55 H new ATOM 0 HG23 VAL A 74 35.200 -18.651 6.649 1.00 0.55 H new ATOM 1160 N ILE A 75 37.008 -16.502 4.084 1.00 0.38 N ATOM 1161 CA ILE A 75 37.892 -15.499 4.661 1.00 0.40 C ATOM 1162 C ILE A 75 37.124 -14.414 5.415 1.00 0.39 C ATOM 1163 O ILE A 75 37.094 -14.412 6.644 1.00 0.47 O ATOM 1164 CB ILE A 75 38.824 -14.849 3.604 1.00 0.45 C ATOM 1165 CG1 ILE A 75 38.093 -14.603 2.264 1.00 0.46 C ATOM 1166 CG2 ILE A 75 40.068 -15.706 3.393 1.00 0.53 C ATOM 1167 CD1 ILE A 75 38.069 -15.793 1.323 1.00 0.62 C ATOM 0 H ILE A 75 36.607 -16.245 3.182 1.00 0.38 H new ATOM 0 HA ILE A 75 38.515 -16.037 5.375 1.00 0.40 H new ATOM 0 HB ILE A 75 39.129 -13.876 3.988 1.00 0.45 H new ATOM 0 HG12 ILE A 75 37.066 -14.305 2.476 1.00 0.46 H new ATOM 0 HG13 ILE A 75 38.569 -13.765 1.755 1.00 0.46 H new ATOM 0 HG21 ILE A 75 40.711 -15.236 2.649 1.00 0.53 H new ATOM 0 HG22 ILE A 75 40.610 -15.799 4.334 1.00 0.53 H new ATOM 0 HG23 ILE A 75 39.773 -16.696 3.045 1.00 0.53 H new ATOM 0 HD11 ILE A 75 37.535 -15.525 0.411 1.00 0.62 H new ATOM 0 HD12 ILE A 75 39.090 -16.081 1.074 1.00 0.62 H new ATOM 0 HD13 ILE A 75 37.564 -16.629 1.807 1.00 0.62 H new ATOM 1179 N LYS A 76 36.510 -13.490 4.691 1.00 0.33 N ATOM 1180 CA LYS A 76 35.820 -12.380 5.337 1.00 0.35 C ATOM 1181 C LYS A 76 34.383 -12.228 4.855 1.00 0.29 C ATOM 1182 O LYS A 76 33.469 -12.142 5.670 1.00 0.31 O ATOM 1183 CB LYS A 76 36.562 -11.059 5.119 1.00 0.48 C ATOM 1184 CG LYS A 76 37.955 -11.018 5.730 1.00 0.62 C ATOM 1185 CD LYS A 76 38.445 -9.587 5.911 1.00 0.98 C ATOM 1186 CE LYS A 76 37.582 -8.829 6.911 1.00 1.18 C ATOM 1187 NZ LYS A 76 38.027 -7.423 7.095 1.00 2.04 N ATOM 0 H LYS A 76 36.474 -13.484 3.672 1.00 0.33 H new ATOM 0 HA LYS A 76 35.803 -12.618 6.401 1.00 0.35 H new ATOM 0 HB2 LYS A 76 36.642 -10.872 4.048 1.00 0.48 H new ATOM 0 HB3 LYS A 76 35.968 -10.248 5.541 1.00 0.48 H new ATOM 0 HG2 LYS A 76 37.945 -11.525 6.695 1.00 0.62 H new ATOM 0 HG3 LYS A 76 38.650 -11.563 5.091 1.00 0.62 H new ATOM 0 HD2 LYS A 76 39.480 -9.595 6.253 1.00 0.98 H new ATOM 0 HD3 LYS A 76 38.431 -9.071 4.951 1.00 0.98 H new ATOM 0 HE2 LYS A 76 36.546 -8.838 6.572 1.00 1.18 H new ATOM 0 HE3 LYS A 76 37.607 -9.344 7.872 1.00 1.18 H new ATOM 0 HZ1 LYS A 76 37.419 -6.955 7.797 1.00 2.04 H new ATOM 0 HZ2 LYS A 76 39.012 -7.411 7.428 1.00 2.04 H new ATOM 0 HZ3 LYS A 76 37.962 -6.917 6.189 1.00 2.04 H new ATOM 1201 N GLY A 77 34.187 -12.209 3.535 1.00 0.29 N ATOM 1202 CA GLY A 77 32.880 -11.890 2.976 1.00 0.30 C ATOM 1203 C GLY A 77 31.759 -12.729 3.554 1.00 0.27 C ATOM 1204 O GLY A 77 30.764 -12.195 4.041 1.00 0.32 O ATOM 0 H GLY A 77 34.910 -12.409 2.844 1.00 0.29 H new ATOM 0 HA2 GLY A 77 32.664 -10.836 3.153 1.00 0.30 H new ATOM 0 HA3 GLY A 77 32.910 -12.032 1.896 1.00 0.30 H new ATOM 1208 N TRP A 78 31.924 -14.039 3.514 1.00 0.24 N ATOM 1209 CA TRP A 78 30.932 -14.942 4.076 1.00 0.26 C ATOM 1210 C TRP A 78 31.025 -14.960 5.597 1.00 0.29 C ATOM 1211 O TRP A 78 30.013 -14.871 6.287 1.00 0.30 O ATOM 1212 CB TRP A 78 31.123 -16.354 3.522 1.00 0.28 C ATOM 1213 CG TRP A 78 31.118 -16.417 2.024 1.00 0.29 C ATOM 1214 CD1 TRP A 78 30.025 -16.479 1.209 1.00 0.32 C ATOM 1215 CD2 TRP A 78 32.265 -16.424 1.159 1.00 0.34 C ATOM 1216 NE1 TRP A 78 30.419 -16.517 -0.107 1.00 0.36 N ATOM 1217 CE2 TRP A 78 31.789 -16.482 -0.163 1.00 0.37 C ATOM 1218 CE3 TRP A 78 33.646 -16.373 1.380 1.00 0.40 C ATOM 1219 CZ2 TRP A 78 32.645 -16.508 -1.261 1.00 0.43 C ATOM 1220 CZ3 TRP A 78 34.494 -16.399 0.289 1.00 0.48 C ATOM 1221 CH2 TRP A 78 33.991 -16.458 -1.016 1.00 0.49 C ATOM 0 H TRP A 78 32.733 -14.502 3.100 1.00 0.24 H new ATOM 0 HA TRP A 78 29.943 -14.583 3.792 1.00 0.26 H new ATOM 0 HB2 TRP A 78 32.067 -16.755 3.891 1.00 0.28 H new ATOM 0 HB3 TRP A 78 30.331 -16.996 3.907 1.00 0.28 H new ATOM 0 HD1 TRP A 78 29.000 -16.496 1.549 1.00 0.32 H new ATOM 0 HE1 TRP A 78 29.794 -16.564 -0.912 1.00 0.36 H new ATOM 0 HE3 TRP A 78 34.041 -16.314 2.383 1.00 0.40 H new ATOM 0 HZ2 TRP A 78 32.261 -16.565 -2.269 1.00 0.43 H new ATOM 0 HZ3 TRP A 78 35.562 -16.373 0.446 1.00 0.48 H new ATOM 0 HH2 TRP A 78 34.680 -16.464 -1.848 1.00 0.49 H new ATOM 1232 N ASP A 79 32.257 -15.031 6.097 1.00 0.35 N ATOM 1233 CA ASP A 79 32.539 -15.212 7.527 1.00 0.42 C ATOM 1234 C ASP A 79 31.842 -14.157 8.387 1.00 0.43 C ATOM 1235 O ASP A 79 31.167 -14.478 9.366 1.00 0.47 O ATOM 1236 CB ASP A 79 34.051 -15.155 7.757 1.00 0.52 C ATOM 1237 CG ASP A 79 34.462 -15.608 9.145 1.00 0.76 C ATOM 1238 OD1 ASP A 79 34.490 -14.760 10.061 1.00 0.90 O ATOM 1239 OD2 ASP A 79 34.740 -16.812 9.332 1.00 1.14 O ATOM 0 H ASP A 79 33.096 -14.965 5.521 1.00 0.35 H new ATOM 0 HA ASP A 79 32.150 -16.185 7.826 1.00 0.42 H new ATOM 0 HB2 ASP A 79 34.549 -15.780 7.016 1.00 0.52 H new ATOM 0 HB3 ASP A 79 34.398 -14.134 7.597 1.00 0.52 H new ATOM 1244 N ILE A 80 31.993 -12.899 8.004 1.00 0.45 N ATOM 1245 CA ILE A 80 31.417 -11.795 8.762 1.00 0.52 C ATOM 1246 C ILE A 80 29.898 -11.725 8.581 1.00 0.47 C ATOM 1247 O ILE A 80 29.163 -11.417 9.523 1.00 0.56 O ATOM 1248 CB ILE A 80 32.070 -10.440 8.365 1.00 0.63 C ATOM 1249 CG1 ILE A 80 33.446 -10.277 9.027 1.00 0.75 C ATOM 1250 CG2 ILE A 80 31.175 -9.260 8.723 1.00 0.78 C ATOM 1251 CD1 ILE A 80 34.512 -11.217 8.512 1.00 0.70 C ATOM 0 H ILE A 80 32.510 -12.615 7.172 1.00 0.45 H new ATOM 0 HA ILE A 80 31.626 -11.983 9.815 1.00 0.52 H new ATOM 0 HB ILE A 80 32.201 -10.451 7.283 1.00 0.63 H new ATOM 0 HG12 ILE A 80 33.785 -9.251 8.881 1.00 0.75 H new ATOM 0 HG13 ILE A 80 33.337 -10.427 10.101 1.00 0.75 H new ATOM 0 HG21 ILE A 80 31.664 -8.331 8.431 1.00 0.78 H new ATOM 0 HG22 ILE A 80 30.225 -9.351 8.197 1.00 0.78 H new ATOM 0 HG23 ILE A 80 30.995 -9.253 9.798 1.00 0.78 H new ATOM 0 HD11 ILE A 80 35.448 -11.028 9.037 1.00 0.70 H new ATOM 0 HD12 ILE A 80 34.201 -12.248 8.683 1.00 0.70 H new ATOM 0 HD13 ILE A 80 34.656 -11.054 7.444 1.00 0.70 H new ATOM 1263 N CYS A 81 29.427 -12.031 7.381 1.00 0.38 N ATOM 1264 CA CYS A 81 28.010 -11.907 7.071 1.00 0.40 C ATOM 1265 C CYS A 81 27.192 -12.999 7.755 1.00 0.35 C ATOM 1266 O CYS A 81 26.128 -12.725 8.312 1.00 0.42 O ATOM 1267 CB CYS A 81 27.785 -11.954 5.561 1.00 0.44 C ATOM 1268 SG CYS A 81 26.078 -11.612 5.067 1.00 0.55 S ATOM 0 H CYS A 81 30.003 -12.366 6.608 1.00 0.38 H new ATOM 0 HA CYS A 81 27.673 -10.942 7.451 1.00 0.40 H new ATOM 0 HB2 CYS A 81 28.444 -11.230 5.082 1.00 0.44 H new ATOM 0 HB3 CYS A 81 28.070 -12.939 5.191 1.00 0.44 H new ATOM 0 HG CYS A 81 25.279 -11.872 6.059 1.00 0.55 H new ATOM 1274 N VAL A 82 27.696 -14.230 7.733 1.00 0.30 N ATOM 1275 CA VAL A 82 26.971 -15.356 8.307 1.00 0.34 C ATOM 1276 C VAL A 82 26.798 -15.188 9.814 1.00 0.39 C ATOM 1277 O VAL A 82 25.787 -15.599 10.384 1.00 0.48 O ATOM 1278 CB VAL A 82 27.660 -16.710 8.024 1.00 0.36 C ATOM 1279 CG1 VAL A 82 27.680 -17.013 6.539 1.00 0.84 C ATOM 1280 CG2 VAL A 82 29.068 -16.722 8.578 1.00 0.73 C ATOM 0 H VAL A 82 28.599 -14.471 7.326 1.00 0.30 H new ATOM 0 HA VAL A 82 25.994 -15.364 7.824 1.00 0.34 H new ATOM 0 HB VAL A 82 27.081 -17.487 8.524 1.00 0.36 H new ATOM 0 HG11 VAL A 82 28.171 -17.971 6.370 1.00 0.84 H new ATOM 0 HG12 VAL A 82 26.658 -17.057 6.163 1.00 0.84 H new ATOM 0 HG13 VAL A 82 28.226 -16.228 6.015 1.00 0.84 H new ATOM 0 HG21 VAL A 82 29.534 -17.685 8.367 1.00 0.73 H new ATOM 0 HG22 VAL A 82 29.650 -15.927 8.111 1.00 0.73 H new ATOM 0 HG23 VAL A 82 29.036 -16.563 9.656 1.00 0.73 H new ATOM 1290 N SER A 83 27.774 -14.557 10.450 1.00 0.39 N ATOM 1291 CA SER A 83 27.773 -14.409 11.898 1.00 0.49 C ATOM 1292 C SER A 83 26.834 -13.274 12.331 1.00 0.48 C ATOM 1293 O SER A 83 26.750 -12.935 13.510 1.00 0.60 O ATOM 1294 CB SER A 83 29.200 -14.144 12.392 1.00 0.63 C ATOM 1295 OG SER A 83 29.330 -14.435 13.774 1.00 1.43 O ATOM 0 H SER A 83 28.579 -14.138 9.984 1.00 0.39 H new ATOM 0 HA SER A 83 27.408 -15.334 12.344 1.00 0.49 H new ATOM 0 HB2 SER A 83 29.903 -14.752 11.823 1.00 0.63 H new ATOM 0 HB3 SER A 83 29.462 -13.101 12.212 1.00 0.63 H new ATOM 0 HG SER A 83 28.738 -15.180 14.008 1.00 1.43 H new ATOM 1301 N SER A 84 26.119 -12.703 11.371 1.00 0.50 N ATOM 1302 CA SER A 84 25.230 -11.583 11.637 1.00 0.53 C ATOM 1303 C SER A 84 23.770 -11.985 11.423 1.00 0.51 C ATOM 1304 O SER A 84 22.865 -11.152 11.515 1.00 0.64 O ATOM 1305 CB SER A 84 25.599 -10.418 10.713 1.00 0.69 C ATOM 1306 OG SER A 84 24.782 -9.281 10.944 1.00 1.23 O ATOM 0 H SER A 84 26.139 -13.000 10.395 1.00 0.50 H new ATOM 0 HA SER A 84 25.345 -11.277 12.677 1.00 0.53 H new ATOM 0 HB2 SER A 84 26.645 -10.151 10.865 1.00 0.69 H new ATOM 0 HB3 SER A 84 25.498 -10.732 9.674 1.00 0.69 H new ATOM 0 HG SER A 84 23.939 -9.562 11.357 1.00 1.23 H new ATOM 1312 N MET A 85 23.547 -13.267 11.160 1.00 0.46 N ATOM 1313 CA MET A 85 22.219 -13.756 10.803 1.00 0.49 C ATOM 1314 C MET A 85 21.445 -14.266 12.015 1.00 0.49 C ATOM 1315 O MET A 85 21.870 -14.114 13.161 1.00 0.74 O ATOM 1316 CB MET A 85 22.323 -14.878 9.776 1.00 0.54 C ATOM 1317 CG MET A 85 22.908 -14.448 8.447 1.00 0.63 C ATOM 1318 SD MET A 85 22.961 -15.807 7.269 1.00 1.05 S ATOM 1319 CE MET A 85 23.884 -17.017 8.206 1.00 2.27 C ATOM 0 H MET A 85 24.268 -13.988 11.187 1.00 0.46 H new ATOM 0 HA MET A 85 21.677 -12.909 10.382 1.00 0.49 H new ATOM 0 HB2 MET A 85 22.937 -15.678 10.189 1.00 0.54 H new ATOM 0 HB3 MET A 85 21.330 -15.294 9.606 1.00 0.54 H new ATOM 0 HG2 MET A 85 22.313 -13.633 8.035 1.00 0.63 H new ATOM 0 HG3 MET A 85 23.915 -14.061 8.601 1.00 0.63 H new ATOM 0 HE1 MET A 85 23.434 -18.001 8.072 1.00 2.27 H new ATOM 0 HE2 MET A 85 24.916 -17.039 7.855 1.00 2.27 H new ATOM 0 HE3 MET A 85 23.866 -16.750 9.263 1.00 2.27 H new ATOM 1329 N ARG A 86 20.292 -14.862 11.739 1.00 0.45 N ATOM 1330 CA ARG A 86 19.475 -15.508 12.755 1.00 0.46 C ATOM 1331 C ARG A 86 18.801 -16.722 12.122 1.00 0.49 C ATOM 1332 O ARG A 86 18.773 -16.836 10.900 1.00 0.57 O ATOM 1333 CB ARG A 86 18.421 -14.538 13.311 1.00 0.49 C ATOM 1334 CG ARG A 86 18.173 -14.704 14.800 1.00 0.96 C ATOM 1335 CD ARG A 86 17.699 -13.403 15.425 1.00 1.24 C ATOM 1336 NE ARG A 86 18.686 -12.329 15.257 1.00 2.20 N ATOM 1337 CZ ARG A 86 18.930 -11.381 16.168 1.00 3.10 C ATOM 1338 NH1 ARG A 86 18.275 -11.380 17.324 1.00 3.34 N ATOM 1339 NH2 ARG A 86 19.832 -10.435 15.924 1.00 4.19 N ATOM 0 H ARG A 86 19.897 -14.910 10.800 1.00 0.45 H new ATOM 0 HA ARG A 86 20.104 -15.819 13.589 1.00 0.46 H new ATOM 0 HB2 ARG A 86 18.741 -13.515 13.116 1.00 0.49 H new ATOM 0 HB3 ARG A 86 17.483 -14.686 12.775 1.00 0.49 H new ATOM 0 HG2 ARG A 86 17.427 -15.482 14.963 1.00 0.96 H new ATOM 0 HG3 ARG A 86 19.089 -15.033 15.290 1.00 0.96 H new ATOM 0 HD2 ARG A 86 16.755 -13.104 14.971 1.00 1.24 H new ATOM 0 HD3 ARG A 86 17.507 -13.558 16.487 1.00 1.24 H new ATOM 0 HE ARG A 86 19.220 -12.304 14.389 1.00 2.20 H new ATOM 0 HH11 ARG A 86 17.583 -12.104 17.519 1.00 3.34 H new ATOM 0 HH12 ARG A 86 18.464 -10.655 18.017 1.00 3.34 H new ATOM 0 HH21 ARG A 86 20.340 -10.431 15.040 1.00 4.19 H new ATOM 0 HH22 ARG A 86 20.016 -9.713 16.621 1.00 4.19 H new ATOM 1353 N LYS A 87 18.251 -17.613 12.937 1.00 0.51 N ATOM 1354 CA LYS A 87 17.659 -18.853 12.425 1.00 0.59 C ATOM 1355 C LYS A 87 16.461 -18.574 11.510 1.00 0.59 C ATOM 1356 O LYS A 87 16.116 -19.387 10.656 1.00 0.74 O ATOM 1357 CB LYS A 87 17.246 -19.759 13.591 1.00 0.68 C ATOM 1358 CG LYS A 87 16.650 -21.092 13.160 1.00 0.84 C ATOM 1359 CD LYS A 87 16.521 -22.051 14.330 1.00 1.03 C ATOM 1360 CE LYS A 87 15.921 -23.381 13.896 1.00 1.26 C ATOM 1361 NZ LYS A 87 14.448 -23.302 13.719 1.00 1.94 N ATOM 0 H LYS A 87 18.200 -17.506 13.950 1.00 0.51 H new ATOM 0 HA LYS A 87 18.414 -19.363 11.827 1.00 0.59 H new ATOM 0 HB2 LYS A 87 18.118 -19.948 14.217 1.00 0.68 H new ATOM 0 HB3 LYS A 87 16.519 -19.231 14.208 1.00 0.68 H new ATOM 0 HG2 LYS A 87 15.669 -20.926 12.715 1.00 0.84 H new ATOM 0 HG3 LYS A 87 17.278 -21.540 12.389 1.00 0.84 H new ATOM 0 HD2 LYS A 87 17.502 -22.220 14.773 1.00 1.03 H new ATOM 0 HD3 LYS A 87 15.896 -21.603 15.102 1.00 1.03 H new ATOM 0 HE2 LYS A 87 16.381 -23.697 12.960 1.00 1.26 H new ATOM 0 HE3 LYS A 87 16.155 -24.143 14.639 1.00 1.26 H new ATOM 0 HZ1 LYS A 87 14.084 -24.230 13.423 1.00 1.94 H new ATOM 0 HZ2 LYS A 87 14.005 -23.026 14.618 1.00 1.94 H new ATOM 0 HZ3 LYS A 87 14.223 -22.594 12.991 1.00 1.94 H new ATOM 1375 N ASN A 88 15.838 -17.419 11.682 1.00 0.55 N ATOM 1376 CA ASN A 88 14.690 -17.053 10.866 1.00 0.66 C ATOM 1377 C ASN A 88 15.005 -15.802 10.050 1.00 0.60 C ATOM 1378 O ASN A 88 14.107 -15.064 9.647 1.00 0.71 O ATOM 1379 CB ASN A 88 13.463 -16.816 11.754 1.00 0.79 C ATOM 1380 CG ASN A 88 13.065 -18.038 12.564 1.00 0.96 C ATOM 1381 OD1 ASN A 88 12.367 -18.922 12.073 1.00 1.23 O ATOM 1382 ND2 ASN A 88 13.493 -18.090 13.818 1.00 1.20 N ATOM 0 H ASN A 88 16.106 -16.721 12.376 1.00 0.55 H new ATOM 0 HA ASN A 88 14.469 -17.871 10.181 1.00 0.66 H new ATOM 0 HB2 ASN A 88 13.669 -15.989 12.434 1.00 0.79 H new ATOM 0 HB3 ASN A 88 12.623 -16.513 11.129 1.00 0.79 H new ATOM 0 HD21 ASN A 88 13.244 -18.883 14.409 1.00 1.20 H new ATOM 0 HD22 ASN A 88 14.071 -17.337 14.191 1.00 1.20 H new ATOM 1389 N GLU A 89 16.289 -15.583 9.803 1.00 0.50 N ATOM 1390 CA GLU A 89 16.751 -14.381 9.126 1.00 0.46 C ATOM 1391 C GLU A 89 17.547 -14.768 7.877 1.00 0.47 C ATOM 1392 O GLU A 89 18.115 -15.857 7.814 1.00 0.65 O ATOM 1393 CB GLU A 89 17.597 -13.563 10.116 1.00 0.50 C ATOM 1394 CG GLU A 89 17.918 -12.134 9.704 1.00 0.48 C ATOM 1395 CD GLU A 89 19.104 -12.042 8.770 1.00 1.01 C ATOM 1396 OE1 GLU A 89 20.201 -12.481 9.156 1.00 1.60 O ATOM 1397 OE2 GLU A 89 18.936 -11.517 7.654 1.00 1.38 O ATOM 0 H GLU A 89 17.034 -16.229 10.064 1.00 0.50 H new ATOM 0 HA GLU A 89 15.910 -13.770 8.798 1.00 0.46 H new ATOM 0 HB2 GLU A 89 17.074 -13.535 11.072 1.00 0.50 H new ATOM 0 HB3 GLU A 89 18.536 -14.091 10.282 1.00 0.50 H new ATOM 0 HG2 GLU A 89 17.045 -11.697 9.219 1.00 0.48 H new ATOM 0 HG3 GLU A 89 18.118 -11.540 10.596 1.00 0.48 H new ATOM 1404 N LYS A 90 17.560 -13.887 6.887 1.00 0.39 N ATOM 1405 CA LYS A 90 18.269 -14.131 5.640 1.00 0.40 C ATOM 1406 C LYS A 90 18.633 -12.809 4.976 1.00 0.39 C ATOM 1407 O LYS A 90 17.760 -11.972 4.711 1.00 0.47 O ATOM 1408 CB LYS A 90 17.419 -14.964 4.681 1.00 0.50 C ATOM 1409 CG LYS A 90 18.063 -15.125 3.315 1.00 0.56 C ATOM 1410 CD LYS A 90 17.183 -15.904 2.357 1.00 0.93 C ATOM 1411 CE LYS A 90 17.795 -15.923 0.969 1.00 0.85 C ATOM 1412 NZ LYS A 90 17.061 -16.817 0.036 1.00 1.17 N ATOM 0 H LYS A 90 17.082 -12.987 6.925 1.00 0.39 H new ATOM 0 HA LYS A 90 19.178 -14.685 5.873 1.00 0.40 H new ATOM 0 HB2 LYS A 90 17.248 -15.949 5.116 1.00 0.50 H new ATOM 0 HB3 LYS A 90 16.443 -14.493 4.565 1.00 0.50 H new ATOM 0 HG2 LYS A 90 18.272 -14.141 2.895 1.00 0.56 H new ATOM 0 HG3 LYS A 90 19.020 -15.635 3.424 1.00 0.56 H new ATOM 0 HD2 LYS A 90 17.056 -16.924 2.719 1.00 0.93 H new ATOM 0 HD3 LYS A 90 16.191 -15.454 2.317 1.00 0.93 H new ATOM 0 HE2 LYS A 90 17.804 -14.910 0.565 1.00 0.85 H new ATOM 0 HE3 LYS A 90 18.833 -16.248 1.037 1.00 0.85 H new ATOM 0 HZ1 LYS A 90 17.528 -16.808 -0.893 1.00 1.17 H new ATOM 0 HZ2 LYS A 90 17.059 -17.786 0.413 1.00 1.17 H new ATOM 0 HZ3 LYS A 90 16.081 -16.483 -0.066 1.00 1.17 H new ATOM 1426 N CYS A 91 19.914 -12.627 4.693 1.00 0.35 N ATOM 1427 CA CYS A 91 20.391 -11.387 4.108 1.00 0.38 C ATOM 1428 C CYS A 91 21.357 -11.651 2.953 1.00 0.32 C ATOM 1429 O CYS A 91 21.755 -12.792 2.704 1.00 0.37 O ATOM 1430 CB CYS A 91 21.053 -10.521 5.187 1.00 0.48 C ATOM 1431 SG CYS A 91 22.139 -11.434 6.306 1.00 1.20 S ATOM 0 H CYS A 91 20.640 -13.323 4.860 1.00 0.35 H new ATOM 0 HA CYS A 91 19.536 -10.849 3.700 1.00 0.38 H new ATOM 0 HB2 CYS A 91 21.629 -9.733 4.702 1.00 0.48 H new ATOM 0 HB3 CYS A 91 20.275 -10.032 5.773 1.00 0.48 H new ATOM 0 HG CYS A 91 21.479 -11.769 7.374 1.00 1.20 H new ATOM 1437 N LEU A 92 21.711 -10.591 2.231 1.00 0.31 N ATOM 1438 CA LEU A 92 22.615 -10.700 1.091 1.00 0.32 C ATOM 1439 C LEU A 92 23.902 -9.931 1.361 1.00 0.28 C ATOM 1440 O LEU A 92 23.879 -8.818 1.891 1.00 0.39 O ATOM 1441 CB LEU A 92 21.956 -10.177 -0.193 1.00 0.40 C ATOM 1442 CG LEU A 92 20.955 -11.121 -0.877 1.00 0.79 C ATOM 1443 CD1 LEU A 92 19.700 -11.310 -0.035 1.00 1.39 C ATOM 1444 CD2 LEU A 92 20.591 -10.593 -2.256 1.00 1.73 C ATOM 0 H LEU A 92 21.383 -9.643 2.417 1.00 0.31 H new ATOM 0 HA LEU A 92 22.849 -11.755 0.951 1.00 0.32 H new ATOM 0 HB2 LEU A 92 21.442 -9.245 0.041 1.00 0.40 H new ATOM 0 HB3 LEU A 92 22.743 -9.936 -0.908 1.00 0.40 H new ATOM 0 HG LEU A 92 21.434 -12.094 -0.983 1.00 0.79 H new ATOM 0 HD11 LEU A 92 19.015 -11.983 -0.550 1.00 1.39 H new ATOM 0 HD12 LEU A 92 19.971 -11.736 0.931 1.00 1.39 H new ATOM 0 HD13 LEU A 92 19.215 -10.346 0.117 1.00 1.39 H new ATOM 0 HD21 LEU A 92 19.881 -11.271 -2.730 1.00 1.73 H new ATOM 0 HD22 LEU A 92 20.140 -9.605 -2.160 1.00 1.73 H new ATOM 0 HD23 LEU A 92 21.490 -10.524 -2.868 1.00 1.73 H new ATOM 1456 N VAL A 93 25.018 -10.532 1.000 1.00 0.25 N ATOM 1457 CA VAL A 93 26.321 -9.922 1.222 1.00 0.25 C ATOM 1458 C VAL A 93 26.977 -9.528 -0.103 1.00 0.23 C ATOM 1459 O VAL A 93 26.734 -10.150 -1.142 1.00 0.26 O ATOM 1460 CB VAL A 93 27.246 -10.879 2.021 1.00 0.34 C ATOM 1461 CG1 VAL A 93 27.360 -12.229 1.322 1.00 0.74 C ATOM 1462 CG2 VAL A 93 28.623 -10.270 2.257 1.00 0.60 C ATOM 0 H VAL A 93 25.052 -11.446 0.549 1.00 0.25 H new ATOM 0 HA VAL A 93 26.170 -9.016 1.809 1.00 0.25 H new ATOM 0 HB VAL A 93 26.789 -11.035 2.998 1.00 0.34 H new ATOM 0 HG11 VAL A 93 28.013 -12.884 1.899 1.00 0.74 H new ATOM 0 HG12 VAL A 93 26.372 -12.682 1.241 1.00 0.74 H new ATOM 0 HG13 VAL A 93 27.777 -12.088 0.325 1.00 0.74 H new ATOM 0 HG21 VAL A 93 29.239 -10.971 2.819 1.00 0.60 H new ATOM 0 HG22 VAL A 93 29.096 -10.059 1.298 1.00 0.60 H new ATOM 0 HG23 VAL A 93 28.519 -9.344 2.822 1.00 0.60 H new ATOM 1472 N ARG A 94 27.787 -8.473 -0.063 1.00 0.25 N ATOM 1473 CA ARG A 94 28.515 -8.017 -1.236 1.00 0.30 C ATOM 1474 C ARG A 94 29.973 -8.427 -1.121 1.00 0.33 C ATOM 1475 O ARG A 94 30.696 -7.929 -0.259 1.00 0.38 O ATOM 1476 CB ARG A 94 28.417 -6.495 -1.379 1.00 0.40 C ATOM 1477 CG ARG A 94 27.622 -6.036 -2.594 1.00 0.92 C ATOM 1478 CD ARG A 94 26.154 -6.417 -2.493 1.00 0.65 C ATOM 1479 NE ARG A 94 25.372 -5.863 -3.599 1.00 0.89 N ATOM 1480 CZ ARG A 94 24.100 -5.470 -3.496 1.00 1.05 C ATOM 1481 NH1 ARG A 94 23.468 -5.529 -2.329 1.00 1.71 N ATOM 1482 NH2 ARG A 94 23.455 -5.029 -4.571 1.00 1.58 N ATOM 0 H ARG A 94 27.954 -7.917 0.776 1.00 0.25 H new ATOM 0 HA ARG A 94 28.072 -8.476 -2.120 1.00 0.30 H new ATOM 0 HB2 ARG A 94 27.956 -6.085 -0.480 1.00 0.40 H new ATOM 0 HB3 ARG A 94 29.423 -6.081 -1.439 1.00 0.40 H new ATOM 0 HG2 ARG A 94 27.709 -4.954 -2.696 1.00 0.92 H new ATOM 0 HG3 ARG A 94 28.050 -6.477 -3.494 1.00 0.92 H new ATOM 0 HD2 ARG A 94 26.060 -7.503 -2.489 1.00 0.65 H new ATOM 0 HD3 ARG A 94 25.750 -6.059 -1.546 1.00 0.65 H new ATOM 0 HE ARG A 94 25.828 -5.771 -4.507 1.00 0.89 H new ATOM 0 HH11 ARG A 94 23.954 -5.877 -1.503 1.00 1.71 H new ATOM 0 HH12 ARG A 94 22.496 -5.227 -2.259 1.00 1.71 H new ATOM 0 HH21 ARG A 94 23.932 -4.991 -5.472 1.00 1.58 H new ATOM 0 HH22 ARG A 94 22.483 -4.728 -4.495 1.00 1.58 H new ATOM 1496 N ILE A 95 30.402 -9.334 -1.983 1.00 0.35 N ATOM 1497 CA ILE A 95 31.759 -9.853 -1.910 1.00 0.38 C ATOM 1498 C ILE A 95 32.689 -9.039 -2.796 1.00 0.41 C ATOM 1499 O ILE A 95 32.628 -9.127 -4.022 1.00 0.45 O ATOM 1500 CB ILE A 95 31.852 -11.356 -2.299 1.00 0.43 C ATOM 1501 CG1 ILE A 95 31.163 -12.247 -1.260 1.00 0.47 C ATOM 1502 CG2 ILE A 95 33.306 -11.788 -2.447 1.00 0.52 C ATOM 1503 CD1 ILE A 95 29.659 -12.135 -1.254 1.00 0.51 C ATOM 0 H ILE A 95 29.836 -9.724 -2.736 1.00 0.35 H new ATOM 0 HA ILE A 95 32.068 -9.765 -0.868 1.00 0.38 H new ATOM 0 HB ILE A 95 31.341 -11.473 -3.255 1.00 0.43 H new ATOM 0 HG12 ILE A 95 31.439 -13.285 -1.447 1.00 0.47 H new ATOM 0 HG13 ILE A 95 31.540 -11.990 -0.270 1.00 0.47 H new ATOM 0 HG21 ILE A 95 33.346 -12.843 -2.719 1.00 0.52 H new ATOM 0 HG22 ILE A 95 33.785 -11.194 -3.225 1.00 0.52 H new ATOM 0 HG23 ILE A 95 33.828 -11.637 -1.502 1.00 0.52 H new ATOM 0 HD11 ILE A 95 29.248 -12.796 -0.491 1.00 0.51 H new ATOM 0 HD12 ILE A 95 29.372 -11.107 -1.036 1.00 0.51 H new ATOM 0 HD13 ILE A 95 29.269 -12.421 -2.231 1.00 0.51 H new ATOM 1515 N GLU A 96 33.522 -8.228 -2.154 1.00 0.43 N ATOM 1516 CA GLU A 96 34.554 -7.463 -2.840 1.00 0.49 C ATOM 1517 C GLU A 96 35.838 -8.292 -2.886 1.00 0.45 C ATOM 1518 O GLU A 96 35.936 -9.312 -2.201 1.00 0.45 O ATOM 1519 CB GLU A 96 34.804 -6.138 -2.103 1.00 0.55 C ATOM 1520 CG GLU A 96 35.559 -5.104 -2.930 1.00 0.77 C ATOM 1521 CD GLU A 96 35.901 -3.846 -2.154 1.00 0.88 C ATOM 1522 OE1 GLU A 96 34.976 -3.152 -1.687 1.00 1.19 O ATOM 1523 OE2 GLU A 96 37.106 -3.534 -2.023 1.00 1.37 O ATOM 0 H GLU A 96 33.500 -8.083 -1.145 1.00 0.43 H new ATOM 0 HA GLU A 96 34.230 -7.237 -3.856 1.00 0.49 H new ATOM 0 HB2 GLU A 96 33.846 -5.716 -1.799 1.00 0.55 H new ATOM 0 HB3 GLU A 96 35.367 -6.341 -1.192 1.00 0.55 H new ATOM 0 HG2 GLU A 96 36.479 -5.552 -3.306 1.00 0.77 H new ATOM 0 HG3 GLU A 96 34.958 -4.834 -3.798 1.00 0.77 H new ATOM 1530 N SER A 97 36.808 -7.852 -3.680 1.00 0.49 N ATOM 1531 CA SER A 97 38.086 -8.544 -3.823 1.00 0.54 C ATOM 1532 C SER A 97 38.737 -8.851 -2.468 1.00 0.52 C ATOM 1533 O SER A 97 39.299 -9.929 -2.274 1.00 0.59 O ATOM 1534 CB SER A 97 39.021 -7.682 -4.664 1.00 0.64 C ATOM 1535 OG SER A 97 38.361 -7.227 -5.832 1.00 1.00 O ATOM 0 H SER A 97 36.731 -7.005 -4.243 1.00 0.49 H new ATOM 0 HA SER A 97 37.901 -9.500 -4.312 1.00 0.54 H new ATOM 0 HB2 SER A 97 39.365 -6.830 -4.078 1.00 0.64 H new ATOM 0 HB3 SER A 97 39.905 -8.257 -4.939 1.00 0.64 H new ATOM 0 HG SER A 97 38.974 -6.674 -6.360 1.00 1.00 H new ATOM 1541 N MET A 98 38.640 -7.913 -1.525 1.00 0.48 N ATOM 1542 CA MET A 98 39.268 -8.084 -0.216 1.00 0.53 C ATOM 1543 C MET A 98 38.459 -9.026 0.674 1.00 0.49 C ATOM 1544 O MET A 98 38.903 -9.397 1.762 1.00 0.58 O ATOM 1545 CB MET A 98 39.456 -6.734 0.487 1.00 0.59 C ATOM 1546 CG MET A 98 38.157 -5.991 0.757 1.00 0.57 C ATOM 1547 SD MET A 98 38.396 -4.521 1.780 1.00 0.79 S ATOM 1548 CE MET A 98 39.616 -3.633 0.814 1.00 1.79 C ATOM 0 H MET A 98 38.136 -7.034 -1.642 1.00 0.48 H new ATOM 0 HA MET A 98 40.248 -8.530 -0.386 1.00 0.53 H new ATOM 0 HB2 MET A 98 39.972 -6.897 1.433 1.00 0.59 H new ATOM 0 HB3 MET A 98 40.102 -6.104 -0.125 1.00 0.59 H new ATOM 0 HG2 MET A 98 37.706 -5.699 -0.191 1.00 0.57 H new ATOM 0 HG3 MET A 98 37.455 -6.662 1.251 1.00 0.57 H new ATOM 0 HE1 MET A 98 39.661 -2.596 1.148 1.00 1.79 H new ATOM 0 HE2 MET A 98 40.593 -4.099 0.945 1.00 1.79 H new ATOM 0 HE3 MET A 98 39.338 -3.663 -0.239 1.00 1.79 H new ATOM 1558 N TYR A 99 37.271 -9.405 0.219 1.00 0.41 N ATOM 1559 CA TYR A 99 36.407 -10.291 0.991 1.00 0.43 C ATOM 1560 C TYR A 99 36.526 -11.729 0.496 1.00 0.49 C ATOM 1561 O TYR A 99 35.925 -12.643 1.071 1.00 0.48 O ATOM 1562 CB TYR A 99 34.946 -9.839 0.914 1.00 0.43 C ATOM 1563 CG TYR A 99 34.688 -8.467 1.498 1.00 0.46 C ATOM 1564 CD1 TYR A 99 35.479 -7.957 2.522 1.00 0.51 C ATOM 1565 CD2 TYR A 99 33.643 -7.684 1.026 1.00 0.53 C ATOM 1566 CE1 TYR A 99 35.234 -6.707 3.054 1.00 0.59 C ATOM 1567 CE2 TYR A 99 33.393 -6.433 1.554 1.00 0.62 C ATOM 1568 CZ TYR A 99 34.191 -5.948 2.567 1.00 0.63 C ATOM 1569 OH TYR A 99 33.943 -4.701 3.096 1.00 0.75 O ATOM 0 H TYR A 99 36.884 -9.114 -0.679 1.00 0.41 H new ATOM 0 HA TYR A 99 36.733 -10.245 2.030 1.00 0.43 H new ATOM 0 HB2 TYR A 99 34.631 -9.842 -0.130 1.00 0.43 H new ATOM 0 HB3 TYR A 99 34.325 -10.566 1.436 1.00 0.43 H new ATOM 0 HD1 TYR A 99 36.297 -8.548 2.907 1.00 0.51 H new ATOM 0 HD2 TYR A 99 33.015 -8.060 0.232 1.00 0.53 H new ATOM 0 HE1 TYR A 99 35.857 -6.325 3.849 1.00 0.59 H new ATOM 0 HE2 TYR A 99 32.576 -5.837 1.175 1.00 0.62 H new ATOM 0 HH TYR A 99 33.862 -4.048 2.370 1.00 0.75 H new ATOM 1579 N GLY A 100 37.309 -11.921 -0.559 1.00 0.60 N ATOM 1580 CA GLY A 100 37.479 -13.239 -1.140 1.00 0.71 C ATOM 1581 C GLY A 100 38.934 -13.542 -1.447 1.00 0.67 C ATOM 1582 O GLY A 100 39.812 -12.731 -1.155 1.00 0.67 O ATOM 0 H GLY A 100 37.833 -11.181 -1.025 1.00 0.60 H new ATOM 0 HA2 GLY A 100 37.089 -13.991 -0.454 1.00 0.71 H new ATOM 0 HA3 GLY A 100 36.893 -13.310 -2.056 1.00 0.71 H new ATOM 1586 N TYR A 101 39.191 -14.709 -2.031 1.00 0.76 N ATOM 1587 CA TYR A 101 40.559 -15.114 -2.358 1.00 0.86 C ATOM 1588 C TYR A 101 41.069 -14.383 -3.595 1.00 0.93 C ATOM 1589 O TYR A 101 42.153 -13.800 -3.576 1.00 1.52 O ATOM 1590 CB TYR A 101 40.649 -16.634 -2.553 1.00 1.01 C ATOM 1591 CG TYR A 101 40.659 -17.407 -1.257 1.00 0.86 C ATOM 1592 CD1 TYR A 101 41.741 -17.318 -0.394 1.00 1.09 C ATOM 1593 CD2 TYR A 101 39.592 -18.221 -0.894 1.00 0.75 C ATOM 1594 CE1 TYR A 101 41.764 -18.018 0.796 1.00 1.14 C ATOM 1595 CE2 TYR A 101 39.604 -18.924 0.298 1.00 0.74 C ATOM 1596 CZ TYR A 101 40.693 -18.820 1.139 1.00 0.92 C ATOM 1597 OH TYR A 101 40.712 -19.509 2.334 1.00 1.09 O ATOM 0 H TYR A 101 38.476 -15.389 -2.287 1.00 0.76 H new ATOM 0 HA TYR A 101 41.196 -14.839 -1.517 1.00 0.86 H new ATOM 0 HB2 TYR A 101 39.805 -16.965 -3.158 1.00 1.01 H new ATOM 0 HB3 TYR A 101 41.554 -16.868 -3.113 1.00 1.01 H new ATOM 0 HD1 TYR A 101 42.580 -16.691 -0.657 1.00 1.09 H new ATOM 0 HD2 TYR A 101 38.740 -18.306 -1.553 1.00 0.75 H new ATOM 0 HE1 TYR A 101 42.616 -17.939 1.456 1.00 1.14 H new ATOM 0 HE2 TYR A 101 38.766 -19.550 0.568 1.00 0.74 H new ATOM 0 HH TYR A 101 40.257 -20.370 2.223 1.00 1.09 H new ATOM 1681 N SER A 109 31.337 -19.529 -10.131 1.00 0.97 N ATOM 1682 CA SER A 109 30.939 -19.220 -11.493 1.00 0.88 C ATOM 1683 C SER A 109 31.982 -18.338 -12.176 1.00 0.77 C ATOM 1684 O SER A 109 32.726 -18.789 -13.047 1.00 0.85 O ATOM 1685 CB SER A 109 29.584 -18.510 -11.480 1.00 0.92 C ATOM 1686 OG SER A 109 28.687 -19.119 -10.568 1.00 1.52 O ATOM 0 HA SER A 109 30.859 -20.151 -12.054 1.00 0.88 H new ATOM 0 HB2 SER A 109 29.723 -17.463 -11.211 1.00 0.92 H new ATOM 0 HB3 SER A 109 29.154 -18.527 -12.481 1.00 0.92 H new ATOM 0 HG SER A 109 28.659 -20.085 -10.732 1.00 1.52 H new ATOM 1692 N ILE A 110 32.036 -17.078 -11.763 1.00 0.68 N ATOM 1693 CA ILE A 110 33.004 -16.134 -12.304 1.00 0.65 C ATOM 1694 C ILE A 110 33.716 -15.382 -11.180 1.00 0.63 C ATOM 1695 O ILE A 110 33.286 -14.308 -10.763 1.00 0.75 O ATOM 1696 CB ILE A 110 32.371 -15.108 -13.288 1.00 0.64 C ATOM 1697 CG1 ILE A 110 31.081 -14.478 -12.708 1.00 0.66 C ATOM 1698 CG2 ILE A 110 32.105 -15.754 -14.644 1.00 0.72 C ATOM 1699 CD1 ILE A 110 29.811 -15.270 -12.965 1.00 0.74 C ATOM 0 H ILE A 110 31.418 -16.686 -11.053 1.00 0.68 H new ATOM 0 HA ILE A 110 33.722 -16.731 -12.867 1.00 0.65 H new ATOM 0 HB ILE A 110 33.089 -14.300 -13.429 1.00 0.64 H new ATOM 0 HG12 ILE A 110 31.205 -14.357 -11.632 1.00 0.66 H new ATOM 0 HG13 ILE A 110 30.961 -13.480 -13.129 1.00 0.66 H new ATOM 0 HG21 ILE A 110 31.662 -15.019 -15.317 1.00 0.72 H new ATOM 0 HG22 ILE A 110 33.043 -16.113 -15.066 1.00 0.72 H new ATOM 0 HG23 ILE A 110 31.419 -16.592 -14.520 1.00 0.72 H new ATOM 0 HD11 ILE A 110 28.962 -14.750 -12.521 1.00 0.74 H new ATOM 0 HD12 ILE A 110 29.655 -15.369 -14.039 1.00 0.74 H new ATOM 0 HD13 ILE A 110 29.903 -16.260 -12.519 1.00 0.74 H new ATOM 1711 N PRO A 111 34.792 -15.966 -10.644 1.00 0.70 N ATOM 1712 CA PRO A 111 35.614 -15.308 -9.630 1.00 0.78 C ATOM 1713 C PRO A 111 36.561 -14.279 -10.244 1.00 0.79 C ATOM 1714 O PRO A 111 36.519 -14.027 -11.452 1.00 1.58 O ATOM 1715 CB PRO A 111 36.405 -16.467 -9.033 1.00 1.10 C ATOM 1716 CG PRO A 111 36.543 -17.440 -10.155 1.00 1.22 C ATOM 1717 CD PRO A 111 35.285 -17.317 -10.971 1.00 0.89 C ATOM 0 HA PRO A 111 35.019 -14.754 -8.903 1.00 0.78 H new ATOM 0 HB2 PRO A 111 37.379 -16.138 -8.670 1.00 1.10 H new ATOM 0 HB3 PRO A 111 35.882 -16.910 -8.185 1.00 1.10 H new ATOM 0 HG2 PRO A 111 37.423 -17.216 -10.759 1.00 1.22 H new ATOM 0 HG3 PRO A 111 36.665 -18.455 -9.778 1.00 1.22 H new ATOM 0 HD2 PRO A 111 35.486 -17.424 -12.037 1.00 0.89 H new ATOM 0 HD3 PRO A 111 34.558 -18.085 -10.706 1.00 0.89 H new ATOM 1725 N GLY A 112 37.413 -13.692 -9.416 1.00 0.95 N ATOM 1726 CA GLY A 112 38.381 -12.739 -9.914 1.00 1.02 C ATOM 1727 C GLY A 112 38.596 -11.592 -8.954 1.00 1.09 C ATOM 1728 O GLY A 112 38.774 -11.804 -7.754 1.00 2.05 O ATOM 0 H GLY A 112 37.451 -13.859 -8.410 1.00 0.95 H new ATOM 0 HA2 GLY A 112 39.330 -13.246 -10.091 1.00 1.02 H new ATOM 0 HA3 GLY A 112 38.044 -12.349 -10.874 1.00 1.02 H new ATOM 1732 N ASN A 113 38.568 -10.380 -9.482 1.00 0.74 N ATOM 1733 CA ASN A 113 38.775 -9.180 -8.680 1.00 0.84 C ATOM 1734 C ASN A 113 37.577 -8.250 -8.817 1.00 0.75 C ATOM 1735 O ASN A 113 37.720 -7.026 -8.849 1.00 1.00 O ATOM 1736 CB ASN A 113 40.050 -8.461 -9.127 1.00 1.00 C ATOM 1737 CG ASN A 113 41.303 -9.287 -8.895 1.00 1.49 C ATOM 1738 OD1 ASN A 113 41.717 -10.072 -9.752 1.00 2.03 O ATOM 1739 ND2 ASN A 113 41.923 -9.108 -7.741 1.00 1.79 N ATOM 0 H ASN A 113 38.402 -10.198 -10.472 1.00 0.74 H new ATOM 0 HA ASN A 113 38.882 -9.469 -7.634 1.00 0.84 H new ATOM 0 HB2 ASN A 113 39.972 -8.217 -10.187 1.00 1.00 H new ATOM 0 HB3 ASN A 113 40.137 -7.517 -8.589 1.00 1.00 H new ATOM 0 HD21 ASN A 113 42.775 -9.629 -7.534 1.00 1.79 H new ATOM 0 HD22 ASN A 113 41.549 -8.449 -7.058 1.00 1.79 H new ATOM 1746 N SER A 114 36.400 -8.841 -8.906 1.00 0.57 N ATOM 1747 CA SER A 114 35.170 -8.088 -9.060 1.00 0.58 C ATOM 1748 C SER A 114 34.270 -8.261 -7.836 1.00 0.50 C ATOM 1749 O SER A 114 34.623 -8.966 -6.888 1.00 0.59 O ATOM 1750 CB SER A 114 34.453 -8.549 -10.330 1.00 0.65 C ATOM 1751 OG SER A 114 34.333 -9.962 -10.363 1.00 1.14 O ATOM 0 H SER A 114 36.270 -9.852 -8.874 1.00 0.57 H new ATOM 0 HA SER A 114 35.408 -7.028 -9.147 1.00 0.58 H new ATOM 0 HB2 SER A 114 33.463 -8.095 -10.378 1.00 0.65 H new ATOM 0 HB3 SER A 114 35.003 -8.207 -11.207 1.00 0.65 H new ATOM 0 HG SER A 114 34.017 -10.243 -11.247 1.00 1.14 H new ATOM 1757 N VAL A 115 33.117 -7.604 -7.857 1.00 0.44 N ATOM 1758 CA VAL A 115 32.168 -7.698 -6.756 1.00 0.38 C ATOM 1759 C VAL A 115 30.976 -8.585 -7.132 1.00 0.31 C ATOM 1760 O VAL A 115 30.361 -8.414 -8.189 1.00 0.31 O ATOM 1761 CB VAL A 115 31.670 -6.296 -6.315 1.00 0.44 C ATOM 1762 CG1 VAL A 115 31.008 -5.549 -7.467 1.00 0.48 C ATOM 1763 CG2 VAL A 115 30.720 -6.409 -5.128 1.00 0.42 C ATOM 0 H VAL A 115 32.817 -7.001 -8.623 1.00 0.44 H new ATOM 0 HA VAL A 115 32.692 -8.154 -5.916 1.00 0.38 H new ATOM 0 HB VAL A 115 32.542 -5.719 -6.006 1.00 0.44 H new ATOM 0 HG11 VAL A 115 30.672 -4.572 -7.121 1.00 0.48 H new ATOM 0 HG12 VAL A 115 31.726 -5.420 -8.277 1.00 0.48 H new ATOM 0 HG13 VAL A 115 30.153 -6.120 -7.827 1.00 0.48 H new ATOM 0 HG21 VAL A 115 30.383 -5.414 -4.836 1.00 0.42 H new ATOM 0 HG22 VAL A 115 29.859 -7.016 -5.408 1.00 0.42 H new ATOM 0 HG23 VAL A 115 31.238 -6.877 -4.291 1.00 0.42 H new ATOM 1773 N LEU A 116 30.671 -9.547 -6.271 1.00 0.28 N ATOM 1774 CA LEU A 116 29.540 -10.440 -6.493 1.00 0.25 C ATOM 1775 C LEU A 116 28.536 -10.321 -5.349 1.00 0.28 C ATOM 1776 O LEU A 116 28.801 -9.656 -4.344 1.00 0.37 O ATOM 1777 CB LEU A 116 29.993 -11.909 -6.619 1.00 0.30 C ATOM 1778 CG LEU A 116 30.846 -12.267 -7.845 1.00 0.33 C ATOM 1779 CD1 LEU A 116 32.293 -11.832 -7.653 1.00 0.51 C ATOM 1780 CD2 LEU A 116 30.775 -13.761 -8.118 1.00 0.50 C ATOM 0 H LEU A 116 31.191 -9.729 -5.412 1.00 0.28 H new ATOM 0 HA LEU A 116 29.070 -10.141 -7.430 1.00 0.25 H new ATOM 0 HB2 LEU A 116 30.559 -12.168 -5.724 1.00 0.30 H new ATOM 0 HB3 LEU A 116 29.104 -12.539 -6.628 1.00 0.30 H new ATOM 0 HG LEU A 116 30.444 -11.731 -8.705 1.00 0.33 H new ATOM 0 HD11 LEU A 116 32.873 -12.098 -8.536 1.00 0.51 H new ATOM 0 HD12 LEU A 116 32.332 -10.753 -7.505 1.00 0.51 H new ATOM 0 HD13 LEU A 116 32.711 -12.333 -6.780 1.00 0.51 H new ATOM 0 HD21 LEU A 116 31.384 -14.001 -8.990 1.00 0.50 H new ATOM 0 HD22 LEU A 116 31.149 -14.307 -7.252 1.00 0.50 H new ATOM 0 HD23 LEU A 116 29.741 -14.047 -8.308 1.00 0.50 H new ATOM 1792 N LEU A 117 27.384 -10.974 -5.504 1.00 0.31 N ATOM 1793 CA LEU A 117 26.358 -10.991 -4.463 1.00 0.38 C ATOM 1794 C LEU A 117 25.952 -12.422 -4.169 1.00 0.31 C ATOM 1795 O LEU A 117 25.655 -13.182 -5.090 1.00 0.38 O ATOM 1796 CB LEU A 117 25.084 -10.234 -4.873 1.00 0.61 C ATOM 1797 CG LEU A 117 25.259 -9.008 -5.764 1.00 0.38 C ATOM 1798 CD1 LEU A 117 25.453 -9.424 -7.206 1.00 0.70 C ATOM 1799 CD2 LEU A 117 24.053 -8.100 -5.651 1.00 0.59 C ATOM 0 H LEU A 117 27.138 -11.499 -6.343 1.00 0.31 H new ATOM 0 HA LEU A 117 26.796 -10.503 -3.592 1.00 0.38 H new ATOM 0 HB2 LEU A 117 24.425 -10.934 -5.387 1.00 0.61 H new ATOM 0 HB3 LEU A 117 24.570 -9.921 -3.964 1.00 0.61 H new ATOM 0 HG LEU A 117 26.145 -8.467 -5.431 1.00 0.38 H new ATOM 0 HD11 LEU A 117 25.576 -8.537 -7.827 1.00 0.70 H new ATOM 0 HD12 LEU A 117 26.341 -10.050 -7.288 1.00 0.70 H new ATOM 0 HD13 LEU A 117 24.581 -9.985 -7.543 1.00 0.70 H new ATOM 0 HD21 LEU A 117 24.192 -7.229 -6.292 1.00 0.59 H new ATOM 0 HD22 LEU A 117 23.160 -8.641 -5.962 1.00 0.59 H new ATOM 0 HD23 LEU A 117 23.938 -7.775 -4.617 1.00 0.59 H new ATOM 1811 N PHE A 118 25.927 -12.783 -2.898 1.00 0.30 N ATOM 1812 CA PHE A 118 25.451 -14.098 -2.496 1.00 0.34 C ATOM 1813 C PHE A 118 24.432 -13.980 -1.373 1.00 0.34 C ATOM 1814 O PHE A 118 24.673 -13.297 -0.373 1.00 0.37 O ATOM 1815 CB PHE A 118 26.614 -14.988 -2.044 1.00 0.43 C ATOM 1816 CG PHE A 118 27.641 -15.233 -3.111 1.00 0.37 C ATOM 1817 CD1 PHE A 118 27.269 -15.735 -4.343 1.00 0.39 C ATOM 1818 CD2 PHE A 118 28.980 -14.960 -2.881 1.00 0.38 C ATOM 1819 CE1 PHE A 118 28.209 -15.957 -5.325 1.00 0.38 C ATOM 1820 CE2 PHE A 118 29.924 -15.183 -3.861 1.00 0.40 C ATOM 1821 CZ PHE A 118 29.537 -15.682 -5.086 1.00 0.38 C ATOM 0 H PHE A 118 26.229 -12.187 -2.127 1.00 0.30 H new ATOM 0 HA PHE A 118 24.975 -14.557 -3.363 1.00 0.34 H new ATOM 0 HB2 PHE A 118 27.100 -14.526 -1.185 1.00 0.43 H new ATOM 0 HB3 PHE A 118 26.217 -15.946 -1.709 1.00 0.43 H new ATOM 0 HD1 PHE A 118 26.230 -15.956 -4.538 1.00 0.39 H new ATOM 0 HD2 PHE A 118 29.288 -14.568 -1.923 1.00 0.38 H new ATOM 0 HE1 PHE A 118 27.904 -16.348 -6.285 1.00 0.38 H new ATOM 0 HE2 PHE A 118 30.965 -14.967 -3.669 1.00 0.40 H new ATOM 0 HZ PHE A 118 30.273 -15.857 -5.856 1.00 0.38 H new ATOM 1831 N GLU A 119 23.279 -14.613 -1.556 1.00 0.33 N ATOM 1832 CA GLU A 119 22.320 -14.765 -0.475 1.00 0.37 C ATOM 1833 C GLU A 119 22.878 -15.760 0.517 1.00 0.34 C ATOM 1834 O GLU A 119 23.246 -16.867 0.132 1.00 0.47 O ATOM 1835 CB GLU A 119 20.979 -15.312 -0.970 1.00 0.56 C ATOM 1836 CG GLU A 119 20.321 -14.522 -2.080 1.00 0.82 C ATOM 1837 CD GLU A 119 18.907 -15.005 -2.350 1.00 1.18 C ATOM 1838 OE1 GLU A 119 18.647 -16.226 -2.207 1.00 1.43 O ATOM 1839 OE2 GLU A 119 18.039 -14.169 -2.671 1.00 1.46 O ATOM 0 H GLU A 119 22.988 -15.027 -2.442 1.00 0.33 H new ATOM 0 HA GLU A 119 22.155 -13.783 -0.032 1.00 0.37 H new ATOM 0 HB2 GLU A 119 21.129 -16.335 -1.316 1.00 0.56 H new ATOM 0 HB3 GLU A 119 20.292 -15.359 -0.125 1.00 0.56 H new ATOM 0 HG2 GLU A 119 20.300 -13.466 -1.812 1.00 0.82 H new ATOM 0 HG3 GLU A 119 20.915 -14.608 -2.990 1.00 0.82 H new ATOM 1846 N ILE A 120 22.953 -15.387 1.778 1.00 0.29 N ATOM 1847 CA ILE A 120 23.381 -16.328 2.792 1.00 0.31 C ATOM 1848 C ILE A 120 22.190 -16.738 3.646 1.00 0.31 C ATOM 1849 O ILE A 120 21.493 -15.898 4.212 1.00 0.33 O ATOM 1850 CB ILE A 120 24.523 -15.778 3.670 1.00 0.34 C ATOM 1851 CG1 ILE A 120 25.762 -15.497 2.805 1.00 0.33 C ATOM 1852 CG2 ILE A 120 24.854 -16.768 4.775 1.00 0.48 C ATOM 1853 CD1 ILE A 120 26.985 -15.082 3.600 1.00 0.39 C ATOM 0 H ILE A 120 22.727 -14.454 2.122 1.00 0.29 H new ATOM 0 HA ILE A 120 23.782 -17.203 2.281 1.00 0.31 H new ATOM 0 HB ILE A 120 24.202 -14.843 4.129 1.00 0.34 H new ATOM 0 HG12 ILE A 120 26.001 -16.391 2.229 1.00 0.33 H new ATOM 0 HG13 ILE A 120 25.522 -14.711 2.089 1.00 0.33 H new ATOM 0 HG21 ILE A 120 25.662 -16.371 5.390 1.00 0.48 H new ATOM 0 HG22 ILE A 120 23.972 -16.930 5.395 1.00 0.48 H new ATOM 0 HG23 ILE A 120 25.166 -17.715 4.334 1.00 0.48 H new ATOM 0 HD11 ILE A 120 27.817 -14.902 2.920 1.00 0.39 H new ATOM 0 HD12 ILE A 120 26.766 -14.170 4.155 1.00 0.39 H new ATOM 0 HD13 ILE A 120 27.252 -15.876 4.297 1.00 0.39 H new ATOM 1865 N GLU A 121 21.941 -18.036 3.697 1.00 0.36 N ATOM 1866 CA GLU A 121 20.760 -18.567 4.357 1.00 0.40 C ATOM 1867 C GLU A 121 21.153 -19.563 5.447 1.00 0.35 C ATOM 1868 O GLU A 121 21.731 -20.616 5.159 1.00 0.40 O ATOM 1869 CB GLU A 121 19.865 -19.227 3.303 1.00 0.60 C ATOM 1870 CG GLU A 121 18.482 -19.621 3.796 1.00 1.06 C ATOM 1871 CD GLU A 121 17.590 -20.069 2.656 1.00 1.43 C ATOM 1872 OE1 GLU A 121 16.923 -19.210 2.041 1.00 1.88 O ATOM 1873 OE2 GLU A 121 17.532 -21.288 2.384 1.00 1.67 O ATOM 0 H GLU A 121 22.546 -18.746 3.286 1.00 0.36 H new ATOM 0 HA GLU A 121 20.212 -17.758 4.840 1.00 0.40 H new ATOM 0 HB2 GLU A 121 19.754 -18.543 2.462 1.00 0.60 H new ATOM 0 HB3 GLU A 121 20.368 -20.117 2.926 1.00 0.60 H new ATOM 0 HG2 GLU A 121 18.571 -20.425 4.527 1.00 1.06 H new ATOM 0 HG3 GLU A 121 18.023 -18.775 4.307 1.00 1.06 H new ATOM 1880 N LEU A 122 20.863 -19.209 6.693 1.00 0.33 N ATOM 1881 CA LEU A 122 21.152 -20.076 7.830 1.00 0.33 C ATOM 1882 C LEU A 122 19.988 -21.029 8.059 1.00 0.38 C ATOM 1883 O LEU A 122 19.040 -20.713 8.774 1.00 0.54 O ATOM 1884 CB LEU A 122 21.415 -19.232 9.084 1.00 0.38 C ATOM 1885 CG LEU A 122 21.915 -19.994 10.318 1.00 0.43 C ATOM 1886 CD1 LEU A 122 23.257 -20.654 10.034 1.00 0.80 C ATOM 1887 CD2 LEU A 122 22.027 -19.052 11.507 1.00 1.12 C ATOM 0 H LEU A 122 20.425 -18.322 6.943 1.00 0.33 H new ATOM 0 HA LEU A 122 22.046 -20.661 7.617 1.00 0.33 H new ATOM 0 HB2 LEU A 122 22.148 -18.465 8.834 1.00 0.38 H new ATOM 0 HB3 LEU A 122 20.492 -18.716 9.350 1.00 0.38 H new ATOM 0 HG LEU A 122 21.194 -20.776 10.558 1.00 0.43 H new ATOM 0 HD11 LEU A 122 23.594 -21.189 10.922 1.00 0.80 H new ATOM 0 HD12 LEU A 122 23.150 -21.355 9.206 1.00 0.80 H new ATOM 0 HD13 LEU A 122 23.989 -19.891 9.770 1.00 0.80 H new ATOM 0 HD21 LEU A 122 22.383 -19.604 12.377 1.00 1.12 H new ATOM 0 HD22 LEU A 122 22.730 -18.252 11.273 1.00 1.12 H new ATOM 0 HD23 LEU A 122 21.049 -18.623 11.725 1.00 1.12 H new ATOM 1899 N LEU A 123 20.054 -22.189 7.425 1.00 0.39 N ATOM 1900 CA LEU A 123 18.963 -23.152 7.492 1.00 0.47 C ATOM 1901 C LEU A 123 19.086 -24.061 8.710 1.00 0.47 C ATOM 1902 O LEU A 123 18.089 -24.596 9.198 1.00 0.59 O ATOM 1903 CB LEU A 123 18.886 -23.960 6.188 1.00 0.55 C ATOM 1904 CG LEU A 123 20.197 -24.588 5.698 1.00 0.58 C ATOM 1905 CD1 LEU A 123 20.477 -25.900 6.410 1.00 1.00 C ATOM 1906 CD2 LEU A 123 20.163 -24.795 4.191 1.00 0.77 C ATOM 0 H LEU A 123 20.849 -22.487 6.859 1.00 0.39 H new ATOM 0 HA LEU A 123 18.030 -22.600 7.607 1.00 0.47 H new ATOM 0 HB2 LEU A 123 18.154 -24.757 6.322 1.00 0.55 H new ATOM 0 HB3 LEU A 123 18.505 -23.307 5.403 1.00 0.55 H new ATOM 0 HG LEU A 123 21.007 -23.898 5.934 1.00 0.58 H new ATOM 0 HD11 LEU A 123 21.412 -26.321 6.042 1.00 1.00 H new ATOM 0 HD12 LEU A 123 20.556 -25.722 7.482 1.00 1.00 H new ATOM 0 HD13 LEU A 123 19.663 -26.599 6.217 1.00 1.00 H new ATOM 0 HD21 LEU A 123 21.102 -25.241 3.864 1.00 0.77 H new ATOM 0 HD22 LEU A 123 19.337 -25.458 3.933 1.00 0.77 H new ATOM 0 HD23 LEU A 123 20.026 -23.834 3.695 1.00 0.77 H new ATOM 1918 N SER A 124 20.306 -24.231 9.196 1.00 0.44 N ATOM 1919 CA SER A 124 20.561 -25.030 10.384 1.00 0.47 C ATOM 1920 C SER A 124 21.904 -24.654 10.995 1.00 0.43 C ATOM 1921 O SER A 124 22.832 -24.269 10.281 1.00 0.48 O ATOM 1922 CB SER A 124 20.534 -26.525 10.052 1.00 0.63 C ATOM 1923 OG SER A 124 19.236 -26.939 9.649 1.00 1.19 O ATOM 0 H SER A 124 21.143 -23.821 8.781 1.00 0.44 H new ATOM 0 HA SER A 124 19.772 -24.824 11.108 1.00 0.47 H new ATOM 0 HB2 SER A 124 21.249 -26.737 9.257 1.00 0.63 H new ATOM 0 HB3 SER A 124 20.847 -27.099 10.924 1.00 0.63 H new ATOM 0 HG SER A 124 18.602 -26.204 9.784 1.00 1.19 H new ATOM 1929 N PHE A 125 21.995 -24.761 12.314 1.00 0.39 N ATOM 1930 CA PHE A 125 23.207 -24.400 13.039 1.00 0.43 C ATOM 1931 C PHE A 125 23.131 -24.923 14.468 1.00 0.46 C ATOM 1932 O PHE A 125 22.178 -25.616 14.831 1.00 0.46 O ATOM 1933 CB PHE A 125 23.405 -22.876 13.046 1.00 0.46 C ATOM 1934 CG PHE A 125 22.478 -22.125 13.964 1.00 0.46 C ATOM 1935 CD1 PHE A 125 21.143 -22.479 14.079 1.00 0.44 C ATOM 1936 CD2 PHE A 125 22.947 -21.057 14.708 1.00 0.62 C ATOM 1937 CE1 PHE A 125 20.296 -21.784 14.916 1.00 0.54 C ATOM 1938 CE2 PHE A 125 22.104 -20.356 15.548 1.00 0.72 C ATOM 1939 CZ PHE A 125 20.777 -20.722 15.652 1.00 0.67 C ATOM 0 H PHE A 125 21.237 -25.098 12.908 1.00 0.39 H new ATOM 0 HA PHE A 125 24.060 -24.854 12.535 1.00 0.43 H new ATOM 0 HB2 PHE A 125 24.434 -22.658 13.333 1.00 0.46 H new ATOM 0 HB3 PHE A 125 23.271 -22.501 12.031 1.00 0.46 H new ATOM 0 HD1 PHE A 125 20.761 -23.310 13.505 1.00 0.44 H new ATOM 0 HD2 PHE A 125 23.985 -20.768 14.631 1.00 0.62 H new ATOM 0 HE1 PHE A 125 19.258 -22.071 14.995 1.00 0.54 H new ATOM 0 HE2 PHE A 125 22.482 -19.523 16.122 1.00 0.72 H new ATOM 0 HZ PHE A 125 20.116 -20.177 16.309 1.00 0.67 H new ATOM 1949 N ARG A 126 24.135 -24.601 15.270 1.00 0.60 N ATOM 1950 CA ARG A 126 24.132 -24.961 16.679 1.00 0.71 C ATOM 1951 C ARG A 126 25.049 -24.030 17.461 1.00 0.76 C ATOM 1952 O ARG A 126 25.796 -23.245 16.873 1.00 0.90 O ATOM 1953 CB ARG A 126 24.605 -26.404 16.863 1.00 0.83 C ATOM 1954 CG ARG A 126 26.052 -26.602 16.461 1.00 0.85 C ATOM 1955 CD ARG A 126 26.565 -27.976 16.845 1.00 1.12 C ATOM 1956 NE ARG A 126 25.918 -29.039 16.085 1.00 1.57 N ATOM 1957 CZ ARG A 126 26.332 -30.303 16.083 1.00 2.14 C ATOM 1958 NH1 ARG A 126 27.409 -30.660 16.777 1.00 2.47 N ATOM 1959 NH2 ARG A 126 25.674 -31.208 15.374 1.00 2.98 N ATOM 0 H ARG A 126 24.964 -24.090 14.967 1.00 0.60 H new ATOM 0 HA ARG A 126 23.113 -24.867 17.053 1.00 0.71 H new ATOM 0 HB2 ARG A 126 24.480 -26.693 17.907 1.00 0.83 H new ATOM 0 HB3 ARG A 126 23.974 -27.067 16.271 1.00 0.83 H new ATOM 0 HG2 ARG A 126 26.151 -26.466 15.384 1.00 0.85 H new ATOM 0 HG3 ARG A 126 26.668 -25.839 16.937 1.00 0.85 H new ATOM 0 HD2 ARG A 126 27.642 -28.019 16.681 1.00 1.12 H new ATOM 0 HD3 ARG A 126 26.398 -28.140 17.910 1.00 1.12 H new ATOM 0 HE ARG A 126 25.101 -28.800 15.523 1.00 1.57 H new ATOM 0 HH11 ARG A 126 27.923 -29.963 17.315 1.00 2.47 H new ATOM 0 HH12 ARG A 126 27.721 -31.631 16.771 1.00 2.47 H new ATOM 0 HH21 ARG A 126 24.854 -30.934 14.833 1.00 2.98 H new ATOM 0 HH22 ARG A 126 25.987 -32.179 15.369 1.00 2.98 H new ATOM 1973 N GLU A 127 24.986 -24.127 18.777 1.00 0.82 N ATOM 1974 CA GLU A 127 25.916 -23.433 19.648 1.00 0.88 C ATOM 1975 C GLU A 127 26.339 -24.398 20.744 1.00 1.01 C ATOM 1976 O GLU A 127 25.614 -25.352 21.036 1.00 1.11 O ATOM 1977 CB GLU A 127 25.291 -22.146 20.216 1.00 1.10 C ATOM 1978 CG GLU A 127 24.250 -22.352 21.309 1.00 1.68 C ATOM 1979 CD GLU A 127 24.869 -22.452 22.693 1.00 2.69 C ATOM 1980 OE1 GLU A 127 25.460 -21.460 23.162 1.00 3.18 O ATOM 1981 OE2 GLU A 127 24.752 -23.528 23.316 1.00 3.38 O ATOM 0 H GLU A 127 24.291 -24.687 19.270 1.00 0.82 H new ATOM 0 HA GLU A 127 26.796 -23.116 19.088 1.00 0.88 H new ATOM 0 HB2 GLU A 127 26.090 -21.519 20.612 1.00 1.10 H new ATOM 0 HB3 GLU A 127 24.829 -21.595 19.397 1.00 1.10 H new ATOM 0 HG2 GLU A 127 23.541 -21.524 21.291 1.00 1.68 H new ATOM 0 HG3 GLU A 127 23.685 -23.261 21.101 1.00 1.68 H new