USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1052 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 41 LYS NZ :NH3+ -163:sc= 2.34 (180deg=0.849) USER MOD Set 1.2: A 184 ASN : amide:sc= 0.924 K(o=3.3,f=-13!) USER MOD Set 2.1: A 130 ASN :FLIP amide:sc= -1.24! C(o=-2!,f=0.17!) USER MOD Set 2.2: A 133 ASN : amide:sc= 1.41 K(o=0.17,f=-1.6) USER MOD Set 3.1: A 88 ASN :FLIP amide:sc= 0.466 F(o=-0.058,f=1) USER MOD Set 3.2: A 142 TYR OH : rot 14:sc= 0.572 USER MOD Set 4.1: A 40 HIS : no HE2:sc= 1.54 K(o=1.1,f=-11!) USER MOD Set 4.2: A 179 HIS : no HE2:sc= -0.466 K(o=1.1,f=-7.3!) USER MOD Single : A 32 THR OG1 : rot -21:sc= 0.202 USER MOD Single : A 33 THR OG1 : rot 167:sc= 1.22 USER MOD Single : A 34 THR OG1 : rot 11:sc= 0.173 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 120:sc= -0.129 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 170:sc= -0.171 (180deg=-0.351) USER MOD Single : A 51 LYS NZ :NH3+ 170:sc= 0.565 (180deg=0.517) USER MOD Single : A 54 ASN : amide:sc= 0.498 X(o=0.5,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=-0.059) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.106 X(o=-0.11,f=-0.0026) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= -0.03 K(o=-0.03,f=-2) USER MOD Single : A 74 LYS NZ :NH3+ 158:sc= -0.113 (180deg=-0.56) USER MOD Single : A 80 MET CE :methyl -160:sc= -0.0156 (180deg=-0.761) USER MOD Single : A 84 THR OG1 : rot -22:sc= 0.892 USER MOD Single : A 85 ASN : amide:sc= -0.481 X(o=-0.48,f=-0.12) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 ASN : amide:sc= -0.149 X(o=-0.15,f=-0.005) USER MOD Single : A 96 GLN : amide:sc= 0.631 K(o=0.63,f=0) USER MOD Single : A 97 THR OG1 : rot 128:sc= 1.31 USER MOD Single : A 101 ASN : amide:sc= -0.483 X(o=-0.48,f=-0.23) USER MOD Single : A 105 GLN :FLIP amide:sc= 0 F(o=-1.9!,f=0) USER MOD Single : A 106 THR OG1 : rot -170:sc= -0.536 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0.672 USER MOD Single : A 113 MET CE :methyl 166:sc= 0 (180deg=-0.133) USER MOD Single : A 116 THR OG1 : rot 123:sc= 1.23 USER MOD Single : A 118 MET CE :methyl 157:sc= -0.973 (180deg=-1.51) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 THR OG1 : rot 172:sc= -0.459 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ -145:sc= 1.01 (180deg=-0.243) USER MOD Single : A 139 TYR OH : rot 7:sc= 1.15 USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 HIS : no HE2:sc= -0.0531 K(o=-0.053,f=-0.81) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 173 ASN : amide:sc= 0.427 K(o=0.43,f=-3.2!) USER MOD Single : A 181 TYR OH : rot 180:sc= 0 USER MOD Single : A 183 LYS NZ :NH3+ 135:sc= -0.368 (180deg=-1.99!) USER MOD Single : A 185 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 167 N THR A 32 -1.334 -20.242 -1.536 1.00 1.13 N ATOM 168 CA THR A 32 -0.614 -19.138 -2.191 1.00 0.95 C ATOM 169 C THR A 32 0.816 -19.508 -2.615 1.00 0.90 C ATOM 170 O THR A 32 1.371 -20.507 -2.153 1.00 0.92 O ATOM 171 CB THR A 32 -0.532 -17.937 -1.231 1.00 0.89 C ATOM 172 OG1 THR A 32 -0.114 -18.325 0.061 1.00 1.04 O ATOM 173 CG2 THR A 32 -1.885 -17.259 -1.076 1.00 0.97 C ATOM 0 HA THR A 32 -1.177 -18.898 -3.093 1.00 0.95 H new ATOM 0 HB THR A 32 0.194 -17.254 -1.672 1.00 0.89 H new ATOM 0 HG1 THR A 32 -0.275 -19.284 0.183 1.00 1.04 H new ATOM 0 HG21 THR A 32 -1.793 -16.415 -0.392 1.00 0.97 H new ATOM 0 HG22 THR A 32 -2.227 -16.903 -2.048 1.00 0.97 H new ATOM 0 HG23 THR A 32 -2.606 -17.973 -0.677 1.00 0.97 H new ATOM 181 N THR A 33 1.433 -18.696 -3.483 1.00 0.97 N ATOM 182 CA THR A 33 2.816 -18.868 -3.982 1.00 1.04 C ATOM 183 C THR A 33 3.858 -18.009 -3.249 1.00 1.07 C ATOM 184 O THR A 33 5.062 -18.172 -3.464 1.00 1.38 O ATOM 185 CB THR A 33 2.901 -18.590 -5.493 1.00 1.34 C ATOM 186 OG1 THR A 33 2.385 -17.314 -5.795 1.00 1.94 O ATOM 187 CG2 THR A 33 2.112 -19.613 -6.307 1.00 1.64 C ATOM 0 H THR A 33 0.974 -17.873 -3.874 1.00 0.97 H new ATOM 0 HA THR A 33 3.061 -19.910 -3.778 1.00 1.04 H new ATOM 0 HB THR A 33 3.957 -18.652 -5.757 1.00 1.34 H new ATOM 0 HG1 THR A 33 2.632 -17.070 -6.711 1.00 1.94 H new ATOM 0 HG21 THR A 33 2.199 -19.379 -7.368 1.00 1.64 H new ATOM 0 HG22 THR A 33 2.510 -20.611 -6.121 1.00 1.64 H new ATOM 0 HG23 THR A 33 1.063 -19.581 -6.013 1.00 1.64 H new ATOM 195 N THR A 34 3.419 -17.089 -2.384 1.00 0.99 N ATOM 196 CA THR A 34 4.250 -16.190 -1.565 1.00 1.09 C ATOM 197 C THR A 34 3.554 -15.904 -0.225 1.00 0.86 C ATOM 198 O THR A 34 2.326 -15.830 -0.198 1.00 0.83 O ATOM 199 CB THR A 34 4.528 -14.896 -2.352 1.00 1.55 C ATOM 200 OG1 THR A 34 5.469 -15.140 -3.373 1.00 2.73 O ATOM 201 CG2 THR A 34 5.122 -13.769 -1.517 1.00 0.88 C ATOM 0 H THR A 34 2.422 -16.941 -2.225 1.00 0.99 H new ATOM 0 HA THR A 34 5.205 -16.665 -1.342 1.00 1.09 H new ATOM 0 HB THR A 34 3.550 -14.591 -2.725 1.00 1.55 H new ATOM 0 HG1 THR A 34 5.606 -16.106 -3.467 1.00 2.73 H new ATOM 0 HG21 THR A 34 5.286 -12.896 -2.149 1.00 0.88 H new ATOM 0 HG22 THR A 34 4.434 -13.510 -0.712 1.00 0.88 H new ATOM 0 HG23 THR A 34 6.072 -14.093 -1.092 1.00 0.88 H new ATOM 209 N THR A 35 4.299 -15.735 0.879 1.00 0.83 N ATOM 210 CA THR A 35 3.748 -15.620 2.257 1.00 0.70 C ATOM 211 C THR A 35 3.820 -14.237 2.921 1.00 0.53 C ATOM 212 O THR A 35 3.118 -14.021 3.903 1.00 0.66 O ATOM 213 CB THR A 35 4.396 -16.656 3.192 1.00 0.87 C ATOM 214 OG1 THR A 35 5.796 -16.681 3.020 1.00 1.05 O ATOM 215 CG2 THR A 35 3.863 -18.062 2.928 1.00 1.04 C ATOM 0 H THR A 35 5.317 -15.672 0.849 1.00 0.83 H new ATOM 0 HA THR A 35 2.685 -15.810 2.112 1.00 0.70 H new ATOM 0 HB THR A 35 4.146 -16.357 4.210 1.00 0.87 H new ATOM 0 HG1 THR A 35 6.188 -17.345 3.625 1.00 1.05 H new ATOM 0 HG21 THR A 35 4.343 -18.767 3.607 1.00 1.04 H new ATOM 0 HG22 THR A 35 2.785 -18.079 3.090 1.00 1.04 H new ATOM 0 HG23 THR A 35 4.079 -18.346 1.898 1.00 1.04 H new ATOM 223 N SER A 36 4.602 -13.288 2.402 1.00 0.41 N ATOM 224 CA SER A 36 4.615 -11.880 2.826 1.00 0.38 C ATOM 225 C SER A 36 4.714 -10.931 1.627 1.00 0.40 C ATOM 226 O SER A 36 5.323 -11.262 0.603 1.00 0.68 O ATOM 227 CB SER A 36 5.771 -11.587 3.792 1.00 0.52 C ATOM 228 OG SER A 36 5.661 -12.325 4.991 1.00 1.82 O ATOM 0 H SER A 36 5.265 -13.481 1.652 1.00 0.41 H new ATOM 0 HA SER A 36 3.670 -11.708 3.342 1.00 0.38 H new ATOM 0 HB2 SER A 36 6.718 -11.824 3.306 1.00 0.52 H new ATOM 0 HB3 SER A 36 5.789 -10.522 4.023 1.00 0.52 H new ATOM 0 HG SER A 36 6.449 -12.899 5.096 1.00 1.82 H new ATOM 234 N VAL A 37 4.129 -9.741 1.777 1.00 0.35 N ATOM 235 CA VAL A 37 4.133 -8.623 0.819 1.00 0.33 C ATOM 236 C VAL A 37 4.871 -7.416 1.410 1.00 0.35 C ATOM 237 O VAL A 37 4.733 -7.118 2.598 1.00 0.37 O ATOM 238 CB VAL A 37 2.698 -8.275 0.367 1.00 0.32 C ATOM 239 CG1 VAL A 37 1.852 -7.751 1.512 1.00 0.33 C ATOM 240 CG2 VAL A 37 2.635 -7.265 -0.786 1.00 0.32 C ATOM 0 H VAL A 37 3.606 -9.514 2.622 1.00 0.35 H new ATOM 0 HA VAL A 37 4.675 -8.928 -0.076 1.00 0.33 H new ATOM 0 HB VAL A 37 2.296 -9.222 0.007 1.00 0.32 H new ATOM 0 HG11 VAL A 37 0.851 -7.519 1.148 1.00 0.33 H new ATOM 0 HG12 VAL A 37 1.788 -8.508 2.293 1.00 0.33 H new ATOM 0 HG13 VAL A 37 2.308 -6.848 1.918 1.00 0.33 H new ATOM 0 HG21 VAL A 37 1.594 -7.073 -1.045 1.00 0.32 H new ATOM 0 HG22 VAL A 37 3.111 -6.333 -0.480 1.00 0.32 H new ATOM 0 HG23 VAL A 37 3.156 -7.670 -1.654 1.00 0.32 H new ATOM 250 N THR A 38 5.618 -6.685 0.582 1.00 0.38 N ATOM 251 CA THR A 38 6.253 -5.414 0.966 1.00 0.42 C ATOM 252 C THR A 38 5.579 -4.264 0.229 1.00 0.44 C ATOM 253 O THR A 38 5.542 -4.231 -1.000 1.00 0.46 O ATOM 254 CB THR A 38 7.772 -5.407 0.734 1.00 0.52 C ATOM 255 OG1 THR A 38 8.371 -6.508 1.374 1.00 0.74 O ATOM 256 CG2 THR A 38 8.455 -4.185 1.347 1.00 0.60 C ATOM 0 H THR A 38 5.804 -6.957 -0.383 1.00 0.38 H new ATOM 0 HA THR A 38 6.116 -5.289 2.040 1.00 0.42 H new ATOM 0 HB THR A 38 7.897 -5.421 -0.349 1.00 0.52 H new ATOM 0 HG1 THR A 38 9.338 -6.492 1.216 1.00 0.74 H new ATOM 0 HG21 THR A 38 9.527 -4.232 1.153 1.00 0.60 H new ATOM 0 HG22 THR A 38 8.045 -3.278 0.903 1.00 0.60 H new ATOM 0 HG23 THR A 38 8.281 -4.173 2.423 1.00 0.60 H new ATOM 264 N VAL A 39 5.035 -3.305 0.972 1.00 0.47 N ATOM 265 CA VAL A 39 4.456 -2.075 0.417 1.00 0.47 C ATOM 266 C VAL A 39 5.492 -0.955 0.480 1.00 0.50 C ATOM 267 O VAL A 39 6.108 -0.694 1.515 1.00 0.57 O ATOM 268 CB VAL A 39 3.091 -1.738 1.049 1.00 0.49 C ATOM 269 CG1 VAL A 39 3.090 -1.868 2.565 1.00 0.59 C ATOM 270 CG2 VAL A 39 2.561 -0.358 0.651 1.00 0.50 C ATOM 0 H VAL A 39 4.981 -3.356 1.989 1.00 0.47 H new ATOM 0 HA VAL A 39 4.218 -2.220 -0.637 1.00 0.47 H new ATOM 0 HB VAL A 39 2.415 -2.488 0.639 1.00 0.49 H new ATOM 0 HG11 VAL A 39 2.102 -1.618 2.951 1.00 0.59 H new ATOM 0 HG12 VAL A 39 3.339 -2.892 2.843 1.00 0.59 H new ATOM 0 HG13 VAL A 39 3.828 -1.187 2.989 1.00 0.59 H new ATOM 0 HG21 VAL A 39 1.598 -0.186 1.131 1.00 0.50 H new ATOM 0 HG22 VAL A 39 3.267 0.409 0.970 1.00 0.50 H new ATOM 0 HG23 VAL A 39 2.440 -0.313 -0.431 1.00 0.50 H new ATOM 280 N HIS A 40 5.707 -0.329 -0.669 1.00 0.46 N ATOM 281 CA HIS A 40 6.628 0.792 -0.881 1.00 0.52 C ATOM 282 C HIS A 40 5.815 2.098 -0.984 1.00 0.80 C ATOM 283 O HIS A 40 4.612 2.081 -0.726 1.00 1.90 O ATOM 284 CB HIS A 40 7.471 0.478 -2.132 1.00 0.55 C ATOM 285 CG HIS A 40 8.183 -0.858 -2.069 1.00 0.53 C ATOM 286 ND1 HIS A 40 9.498 -1.070 -1.734 1.00 0.64 N ATOM 287 CD2 HIS A 40 7.635 -2.096 -2.277 1.00 0.57 C ATOM 288 CE1 HIS A 40 9.738 -2.388 -1.737 1.00 0.69 C ATOM 289 NE2 HIS A 40 8.621 -3.064 -2.050 1.00 0.62 N ATOM 0 H HIS A 40 5.222 -0.599 -1.525 1.00 0.46 H new ATOM 0 HA HIS A 40 7.318 0.930 -0.048 1.00 0.52 H new ATOM 0 HB2 HIS A 40 6.823 0.493 -3.009 1.00 0.55 H new ATOM 0 HB3 HIS A 40 8.210 1.267 -2.268 1.00 0.55 H new ATOM 0 HD1 HIS A 40 10.180 -0.343 -1.518 1.00 0.64 H new ATOM 0 HD2 HIS A 40 6.614 -2.293 -2.567 1.00 0.57 H new ATOM 0 HE1 HIS A 40 10.693 -2.842 -1.519 1.00 0.69 H new ATOM 297 N LYS A 41 6.420 3.246 -1.329 1.00 0.43 N ATOM 298 CA LYS A 41 5.651 4.460 -1.680 1.00 0.43 C ATOM 299 C LYS A 41 6.421 5.394 -2.613 1.00 0.43 C ATOM 300 O LYS A 41 7.598 5.660 -2.370 1.00 0.51 O ATOM 301 CB LYS A 41 5.185 5.194 -0.406 1.00 0.52 C ATOM 302 CG LYS A 41 3.944 6.071 -0.687 1.00 0.85 C ATOM 303 CD LYS A 41 4.276 7.559 -0.856 1.00 0.86 C ATOM 304 CE LYS A 41 3.319 8.231 -1.849 1.00 0.73 C ATOM 305 NZ LYS A 41 1.991 8.503 -1.266 1.00 0.94 N ATOM 0 H LYS A 41 7.432 3.363 -1.374 1.00 0.43 H new ATOM 0 HA LYS A 41 4.770 4.135 -2.233 1.00 0.43 H new ATOM 0 HB2 LYS A 41 4.951 4.466 0.371 1.00 0.52 H new ATOM 0 HB3 LYS A 41 5.995 5.817 -0.025 1.00 0.52 H new ATOM 0 HG2 LYS A 41 3.451 5.711 -1.590 1.00 0.85 H new ATOM 0 HG3 LYS A 41 3.234 5.955 0.132 1.00 0.85 H new ATOM 0 HD2 LYS A 41 4.213 8.060 0.110 1.00 0.86 H new ATOM 0 HD3 LYS A 41 5.303 7.668 -1.206 1.00 0.86 H new ATOM 0 HE2 LYS A 41 3.758 9.167 -2.194 1.00 0.73 H new ATOM 0 HE3 LYS A 41 3.203 7.592 -2.724 1.00 0.73 H new ATOM 0 HZ1 LYS A 41 1.307 8.682 -2.029 1.00 0.94 H new ATOM 0 HZ2 LYS A 41 1.681 7.681 -0.709 1.00 0.94 H new ATOM 0 HZ3 LYS A 41 2.047 9.338 -0.648 1.00 0.94 H new ATOM 319 N LEU A 42 5.755 5.887 -3.662 1.00 0.46 N ATOM 320 CA LEU A 42 6.358 6.676 -4.743 1.00 0.47 C ATOM 321 C LEU A 42 5.731 8.070 -4.889 1.00 0.48 C ATOM 322 O LEU A 42 4.539 8.249 -4.646 1.00 0.52 O ATOM 323 CB LEU A 42 6.201 5.930 -6.083 1.00 0.51 C ATOM 324 CG LEU A 42 6.756 4.508 -6.181 1.00 0.56 C ATOM 325 CD1 LEU A 42 6.761 4.066 -7.641 1.00 0.66 C ATOM 326 CD2 LEU A 42 8.184 4.382 -5.681 1.00 0.56 C ATOM 0 H LEU A 42 4.753 5.745 -3.787 1.00 0.46 H new ATOM 0 HA LEU A 42 7.409 6.806 -4.483 1.00 0.47 H new ATOM 0 HB2 LEU A 42 5.138 5.891 -6.321 1.00 0.51 H new ATOM 0 HB3 LEU A 42 6.679 6.530 -6.857 1.00 0.51 H new ATOM 0 HG LEU A 42 6.111 3.890 -5.556 1.00 0.56 H new ATOM 0 HD11 LEU A 42 7.156 3.053 -7.713 1.00 0.66 H new ATOM 0 HD12 LEU A 42 5.743 4.087 -8.031 1.00 0.66 H new ATOM 0 HD13 LEU A 42 7.387 4.742 -8.224 1.00 0.66 H new ATOM 0 HD21 LEU A 42 8.514 3.348 -5.779 1.00 0.56 H new ATOM 0 HD22 LEU A 42 8.834 5.028 -6.271 1.00 0.56 H new ATOM 0 HD23 LEU A 42 8.230 4.679 -4.633 1.00 0.56 H new ATOM 338 N LEU A 43 6.530 9.032 -5.359 1.00 0.49 N ATOM 339 CA LEU A 43 6.112 10.365 -5.817 1.00 0.50 C ATOM 340 C LEU A 43 6.926 10.767 -7.063 1.00 0.49 C ATOM 341 O LEU A 43 7.915 10.111 -7.408 1.00 0.52 O ATOM 342 CB LEU A 43 6.274 11.413 -4.693 1.00 0.65 C ATOM 343 CG LEU A 43 5.287 11.311 -3.515 1.00 0.70 C ATOM 344 CD1 LEU A 43 5.560 12.460 -2.546 1.00 1.69 C ATOM 345 CD2 LEU A 43 3.818 11.424 -3.931 1.00 0.93 C ATOM 0 H LEU A 43 7.538 8.898 -5.435 1.00 0.49 H new ATOM 0 HA LEU A 43 5.056 10.328 -6.083 1.00 0.50 H new ATOM 0 HB2 LEU A 43 7.287 11.336 -4.298 1.00 0.65 H new ATOM 0 HB3 LEU A 43 6.178 12.405 -5.134 1.00 0.65 H new ATOM 0 HG LEU A 43 5.441 10.327 -3.072 1.00 0.70 H new ATOM 0 HD11 LEU A 43 4.868 12.400 -1.706 1.00 1.69 H new ATOM 0 HD12 LEU A 43 6.584 12.390 -2.178 1.00 1.69 H new ATOM 0 HD13 LEU A 43 5.424 13.411 -3.061 1.00 1.69 H new ATOM 0 HD21 LEU A 43 3.183 11.343 -3.049 1.00 0.93 H new ATOM 0 HD22 LEU A 43 3.649 12.387 -4.413 1.00 0.93 H new ATOM 0 HD23 LEU A 43 3.575 10.622 -4.628 1.00 0.93 H new ATOM 357 N ALA A 44 6.527 11.852 -7.729 1.00 0.55 N ATOM 358 CA ALA A 44 7.270 12.450 -8.839 1.00 0.59 C ATOM 359 C ALA A 44 8.113 13.666 -8.385 1.00 0.66 C ATOM 360 O ALA A 44 8.017 14.098 -7.232 1.00 0.80 O ATOM 361 CB ALA A 44 6.269 12.784 -9.949 1.00 0.67 C ATOM 0 H ALA A 44 5.664 12.348 -7.508 1.00 0.55 H new ATOM 0 HA ALA A 44 8.003 11.743 -9.228 1.00 0.59 H new ATOM 0 HB1 ALA A 44 6.796 13.232 -10.791 1.00 0.67 H new ATOM 0 HB2 ALA A 44 5.771 11.871 -10.277 1.00 0.67 H new ATOM 0 HB3 ALA A 44 5.527 13.486 -9.570 1.00 0.67 H new ATOM 367 N THR A 45 8.949 14.210 -9.280 1.00 0.70 N ATOM 368 CA THR A 45 9.787 15.408 -9.030 1.00 0.77 C ATOM 369 C THR A 45 9.246 16.704 -9.656 1.00 0.87 C ATOM 370 O THR A 45 9.510 17.796 -9.139 1.00 1.02 O ATOM 371 CB THR A 45 11.245 15.175 -9.460 1.00 0.81 C ATOM 372 OG1 THR A 45 11.340 14.879 -10.835 1.00 0.89 O ATOM 373 CG2 THR A 45 11.906 14.023 -8.697 1.00 0.82 C ATOM 0 H THR A 45 9.070 13.828 -10.218 1.00 0.70 H new ATOM 0 HA THR A 45 9.748 15.555 -7.951 1.00 0.77 H new ATOM 0 HB THR A 45 11.762 16.107 -9.233 1.00 0.81 H new ATOM 0 HG1 THR A 45 12.280 14.738 -11.075 1.00 0.89 H new ATOM 0 HG21 THR A 45 12.934 13.902 -9.040 1.00 0.82 H new ATOM 0 HG22 THR A 45 11.903 14.244 -7.630 1.00 0.82 H new ATOM 0 HG23 THR A 45 11.352 13.102 -8.878 1.00 0.82 H new ATOM 381 N ASP A 46 8.461 16.599 -10.734 1.00 0.87 N ATOM 382 CA ASP A 46 7.675 17.678 -11.359 1.00 0.95 C ATOM 383 C ASP A 46 6.248 17.182 -11.690 1.00 0.95 C ATOM 384 O ASP A 46 5.749 17.354 -12.801 1.00 1.26 O ATOM 385 CB ASP A 46 8.429 18.269 -12.571 1.00 1.04 C ATOM 386 CG ASP A 46 7.648 19.375 -13.292 1.00 1.27 C ATOM 387 OD1 ASP A 46 7.161 20.315 -12.620 1.00 1.57 O ATOM 388 OD2 ASP A 46 7.463 19.278 -14.532 1.00 2.55 O ATOM 0 H ASP A 46 8.348 15.711 -11.224 1.00 0.87 H new ATOM 0 HA ASP A 46 7.554 18.500 -10.654 1.00 0.95 H new ATOM 0 HB2 ASP A 46 9.385 18.669 -12.235 1.00 1.04 H new ATOM 0 HB3 ASP A 46 8.649 17.469 -13.278 1.00 1.04 H new ATOM 393 N GLY A 47 5.602 16.480 -10.751 1.00 0.87 N ATOM 394 CA GLY A 47 4.210 16.024 -10.886 1.00 0.87 C ATOM 395 C GLY A 47 3.957 14.938 -11.940 1.00 0.78 C ATOM 396 O GLY A 47 2.801 14.688 -12.282 1.00 0.86 O ATOM 0 H GLY A 47 6.033 16.209 -9.867 1.00 0.87 H new ATOM 0 HA2 GLY A 47 3.876 15.648 -9.919 1.00 0.87 H new ATOM 0 HA3 GLY A 47 3.588 16.886 -11.125 1.00 0.87 H new ATOM 400 N ASP A 48 5.012 14.285 -12.430 1.00 0.70 N ATOM 401 CA ASP A 48 5.049 13.341 -13.560 1.00 0.70 C ATOM 402 C ASP A 48 4.377 11.965 -13.316 1.00 0.68 C ATOM 403 O ASP A 48 4.757 10.959 -13.917 1.00 0.71 O ATOM 404 CB ASP A 48 6.516 13.163 -13.990 1.00 0.75 C ATOM 405 CG ASP A 48 7.236 14.493 -14.214 1.00 0.95 C ATOM 406 OD1 ASP A 48 7.124 15.091 -15.315 1.00 2.20 O ATOM 407 OD2 ASP A 48 7.928 14.954 -13.278 1.00 1.70 O ATOM 0 H ASP A 48 5.937 14.409 -12.019 1.00 0.70 H new ATOM 0 HA ASP A 48 4.443 13.784 -14.350 1.00 0.70 H new ATOM 0 HB2 ASP A 48 7.046 12.593 -13.227 1.00 0.75 H new ATOM 0 HB3 ASP A 48 6.552 12.577 -14.908 1.00 0.75 H new ATOM 412 N MET A 49 3.383 11.868 -12.429 1.00 0.66 N ATOM 413 CA MET A 49 2.817 10.581 -11.994 1.00 0.66 C ATOM 414 C MET A 49 2.099 9.797 -13.113 1.00 0.68 C ATOM 415 O MET A 49 1.913 8.590 -12.975 1.00 0.62 O ATOM 416 CB MET A 49 1.864 10.785 -10.804 1.00 0.66 C ATOM 417 CG MET A 49 2.478 11.427 -9.547 1.00 0.67 C ATOM 418 SD MET A 49 2.999 10.280 -8.229 1.00 0.65 S ATOM 419 CE MET A 49 4.216 9.243 -9.083 1.00 0.58 C ATOM 0 H MET A 49 2.945 12.678 -11.990 1.00 0.66 H new ATOM 0 HA MET A 49 3.670 9.973 -11.693 1.00 0.66 H new ATOM 0 HB2 MET A 49 1.031 11.406 -11.134 1.00 0.66 H new ATOM 0 HB3 MET A 49 1.449 9.816 -10.527 1.00 0.66 H new ATOM 0 HG2 MET A 49 3.344 12.015 -9.851 1.00 0.67 H new ATOM 0 HG3 MET A 49 1.751 12.123 -9.128 1.00 0.67 H new ATOM 0 HE1 MET A 49 4.739 8.622 -8.356 1.00 0.58 H new ATOM 0 HE2 MET A 49 3.707 8.605 -9.806 1.00 0.58 H new ATOM 0 HE3 MET A 49 4.935 9.878 -9.602 1.00 0.58 H new ATOM 429 N ASP A 50 1.702 10.442 -14.214 1.00 0.78 N ATOM 430 CA ASP A 50 0.954 9.843 -15.328 1.00 0.79 C ATOM 431 C ASP A 50 1.872 9.159 -16.356 1.00 0.81 C ATOM 432 O ASP A 50 1.600 8.033 -16.791 1.00 0.90 O ATOM 433 CB ASP A 50 0.109 10.913 -16.034 1.00 0.80 C ATOM 434 CG ASP A 50 -0.773 11.733 -15.089 1.00 1.07 C ATOM 435 OD1 ASP A 50 -0.289 12.736 -14.509 1.00 2.28 O ATOM 436 OD2 ASP A 50 -1.975 11.408 -14.950 1.00 1.61 O ATOM 0 H ASP A 50 1.899 11.432 -14.361 1.00 0.78 H new ATOM 0 HA ASP A 50 0.309 9.076 -14.898 1.00 0.79 H new ATOM 0 HB2 ASP A 50 0.773 11.589 -16.573 1.00 0.80 H new ATOM 0 HB3 ASP A 50 -0.524 10.429 -16.777 1.00 0.80 H new ATOM 441 N LYS A 51 2.997 9.794 -16.728 1.00 0.79 N ATOM 442 CA LYS A 51 4.003 9.157 -17.582 1.00 0.85 C ATOM 443 C LYS A 51 4.732 8.041 -16.830 1.00 0.88 C ATOM 444 O LYS A 51 4.892 6.966 -17.407 1.00 0.95 O ATOM 445 CB LYS A 51 4.892 10.232 -18.212 1.00 0.85 C ATOM 446 CG LYS A 51 5.679 11.041 -17.180 1.00 0.79 C ATOM 447 CD LYS A 51 6.034 12.433 -17.697 1.00 0.91 C ATOM 448 CE LYS A 51 4.896 13.436 -17.486 1.00 2.90 C ATOM 449 NZ LYS A 51 5.360 14.823 -17.717 1.00 3.41 N ATOM 0 H LYS A 51 3.228 10.747 -16.449 1.00 0.79 H new ATOM 0 HA LYS A 51 3.534 8.641 -18.420 1.00 0.85 H new ATOM 0 HB2 LYS A 51 5.590 9.759 -18.903 1.00 0.85 H new ATOM 0 HB3 LYS A 51 4.272 10.909 -18.799 1.00 0.85 H new ATOM 0 HG2 LYS A 51 5.092 11.132 -16.266 1.00 0.79 H new ATOM 0 HG3 LYS A 51 6.593 10.507 -16.920 1.00 0.79 H new ATOM 0 HD2 LYS A 51 6.930 12.790 -17.189 1.00 0.91 H new ATOM 0 HD3 LYS A 51 6.272 12.374 -18.759 1.00 0.91 H new ATOM 0 HE2 LYS A 51 4.074 13.206 -18.164 1.00 2.90 H new ATOM 0 HE3 LYS A 51 4.508 13.343 -16.472 1.00 2.90 H new ATOM 0 HZ1 LYS A 51 4.542 15.464 -17.735 1.00 3.41 H new ATOM 0 HZ2 LYS A 51 6.004 15.106 -16.951 1.00 3.41 H new ATOM 0 HZ3 LYS A 51 5.860 14.875 -18.627 1.00 3.41 H new ATOM 463 N ILE A 52 5.043 8.228 -15.536 1.00 0.83 N ATOM 464 CA ILE A 52 5.494 7.164 -14.625 1.00 0.84 C ATOM 465 C ILE A 52 4.520 5.978 -14.676 1.00 0.92 C ATOM 466 O ILE A 52 4.954 4.857 -14.919 1.00 0.99 O ATOM 467 CB ILE A 52 5.632 7.715 -13.183 1.00 0.74 C ATOM 468 CG1 ILE A 52 6.804 8.719 -13.124 1.00 0.69 C ATOM 469 CG2 ILE A 52 5.847 6.580 -12.158 1.00 0.72 C ATOM 470 CD1 ILE A 52 6.947 9.474 -11.805 1.00 0.62 C ATOM 0 H ILE A 52 4.987 9.142 -15.086 1.00 0.83 H new ATOM 0 HA ILE A 52 6.474 6.812 -14.945 1.00 0.84 H new ATOM 0 HB ILE A 52 4.703 8.221 -12.921 1.00 0.74 H new ATOM 0 HG12 ILE A 52 7.732 8.182 -13.319 1.00 0.69 H new ATOM 0 HG13 ILE A 52 6.681 9.445 -13.928 1.00 0.69 H new ATOM 0 HG21 ILE A 52 5.939 7.005 -11.159 1.00 0.72 H new ATOM 0 HG22 ILE A 52 4.996 5.899 -12.186 1.00 0.72 H new ATOM 0 HG23 ILE A 52 6.757 6.034 -12.406 1.00 0.72 H new ATOM 0 HD11 ILE A 52 7.798 10.153 -11.865 1.00 0.62 H new ATOM 0 HD12 ILE A 52 6.039 10.046 -11.613 1.00 0.62 H new ATOM 0 HD13 ILE A 52 7.107 8.763 -10.994 1.00 0.62 H new ATOM 482 N ALA A 53 3.209 6.202 -14.532 1.00 0.93 N ATOM 483 CA ALA A 53 2.218 5.122 -14.558 1.00 0.99 C ATOM 484 C ALA A 53 2.218 4.315 -15.877 1.00 1.04 C ATOM 485 O ALA A 53 1.903 3.122 -15.876 1.00 1.04 O ATOM 486 CB ALA A 53 0.840 5.724 -14.257 1.00 1.02 C ATOM 0 H ALA A 53 2.808 7.130 -14.395 1.00 0.93 H new ATOM 0 HA ALA A 53 2.485 4.394 -13.792 1.00 0.99 H new ATOM 0 HB1 ALA A 53 0.087 4.936 -14.272 1.00 1.02 H new ATOM 0 HB2 ALA A 53 0.855 6.193 -13.273 1.00 1.02 H new ATOM 0 HB3 ALA A 53 0.597 6.472 -15.012 1.00 1.02 H new ATOM 492 N ASN A 54 2.620 4.921 -16.998 1.00 1.09 N ATOM 493 CA ASN A 54 2.780 4.215 -18.275 1.00 1.13 C ATOM 494 C ASN A 54 4.102 3.426 -18.364 1.00 1.12 C ATOM 495 O ASN A 54 4.135 2.344 -18.955 1.00 1.16 O ATOM 496 CB ASN A 54 2.589 5.198 -19.435 1.00 1.12 C ATOM 497 CG ASN A 54 1.115 5.437 -19.710 1.00 1.15 C ATOM 498 OD1 ASN A 54 0.555 4.872 -20.641 1.00 1.23 O ATOM 499 ND2 ASN A 54 0.446 6.227 -18.896 1.00 1.11 N ATOM 0 H ASN A 54 2.844 5.915 -17.047 1.00 1.09 H new ATOM 0 HA ASN A 54 2.003 3.454 -18.344 1.00 1.13 H new ATOM 0 HB2 ASN A 54 3.076 6.144 -19.199 1.00 1.12 H new ATOM 0 HB3 ASN A 54 3.071 4.806 -20.331 1.00 1.12 H new ATOM 0 HD21 ASN A 54 -0.553 6.376 -19.036 1.00 1.11 H new ATOM 0 HD22 ASN A 54 0.927 6.690 -18.125 1.00 1.11 H new ATOM 506 N GLU A 55 5.171 3.913 -17.726 1.00 1.07 N ATOM 507 CA GLU A 55 6.424 3.158 -17.529 1.00 1.07 C ATOM 508 C GLU A 55 6.251 1.960 -16.565 1.00 1.07 C ATOM 509 O GLU A 55 7.099 1.065 -16.528 1.00 1.18 O ATOM 510 CB GLU A 55 7.549 4.075 -17.033 1.00 1.09 C ATOM 511 CG GLU A 55 7.887 5.251 -17.960 1.00 1.03 C ATOM 512 CD GLU A 55 8.148 4.882 -19.425 1.00 1.10 C ATOM 513 OE1 GLU A 55 8.841 3.869 -19.686 1.00 1.86 O ATOM 514 OE2 GLU A 55 7.686 5.628 -20.327 1.00 2.10 O ATOM 0 H GLU A 55 5.196 4.851 -17.326 1.00 1.07 H new ATOM 0 HA GLU A 55 6.697 2.756 -18.505 1.00 1.07 H new ATOM 0 HB2 GLU A 55 7.270 4.471 -16.056 1.00 1.09 H new ATOM 0 HB3 GLU A 55 8.448 3.476 -16.889 1.00 1.09 H new ATOM 0 HG2 GLU A 55 7.066 5.967 -17.924 1.00 1.03 H new ATOM 0 HG3 GLU A 55 8.769 5.758 -17.568 1.00 1.03 H new ATOM 521 N LEU A 56 5.160 1.921 -15.786 1.00 1.02 N ATOM 522 CA LEU A 56 4.811 0.821 -14.876 1.00 0.99 C ATOM 523 C LEU A 56 3.801 -0.185 -15.459 1.00 1.09 C ATOM 524 O LEU A 56 3.958 -1.388 -15.246 1.00 1.11 O ATOM 525 CB LEU A 56 4.349 1.397 -13.530 1.00 0.97 C ATOM 526 CG LEU A 56 5.395 2.251 -12.779 1.00 0.90 C ATOM 527 CD1 LEU A 56 4.818 2.639 -11.427 1.00 1.00 C ATOM 528 CD2 LEU A 56 6.728 1.562 -12.502 1.00 0.66 C ATOM 0 H LEU A 56 4.476 2.677 -15.772 1.00 1.02 H new ATOM 0 HA LEU A 56 5.714 0.230 -14.724 1.00 0.99 H new ATOM 0 HB2 LEU A 56 3.462 2.007 -13.701 1.00 0.97 H new ATOM 0 HB3 LEU A 56 4.049 0.571 -12.885 1.00 0.97 H new ATOM 0 HG LEU A 56 5.601 3.095 -13.438 1.00 0.90 H new ATOM 0 HD11 LEU A 56 5.543 3.243 -10.882 1.00 1.00 H new ATOM 0 HD12 LEU A 56 3.904 3.214 -11.573 1.00 1.00 H new ATOM 0 HD13 LEU A 56 4.593 1.739 -10.855 1.00 1.00 H new ATOM 0 HD21 LEU A 56 7.389 2.248 -11.972 1.00 0.66 H new ATOM 0 HD22 LEU A 56 6.559 0.675 -11.891 1.00 0.66 H new ATOM 0 HD23 LEU A 56 7.190 1.270 -13.445 1.00 0.66 H new ATOM 540 N GLU A 57 2.796 0.244 -16.232 1.00 1.18 N ATOM 541 CA GLU A 57 1.810 -0.691 -16.823 1.00 1.33 C ATOM 542 C GLU A 57 2.374 -1.591 -17.938 1.00 1.40 C ATOM 543 O GLU A 57 1.751 -2.593 -18.306 1.00 1.51 O ATOM 544 CB GLU A 57 0.553 0.047 -17.302 1.00 1.44 C ATOM 545 CG GLU A 57 0.701 0.743 -18.660 1.00 1.50 C ATOM 546 CD GLU A 57 -0.600 1.451 -19.031 1.00 1.65 C ATOM 547 OE1 GLU A 57 -0.972 2.430 -18.349 1.00 2.51 O ATOM 548 OE2 GLU A 57 -1.307 0.996 -19.964 1.00 2.44 O ATOM 0 H GLU A 57 2.638 1.224 -16.466 1.00 1.18 H new ATOM 0 HA GLU A 57 1.539 -1.364 -16.010 1.00 1.33 H new ATOM 0 HB2 GLU A 57 -0.270 -0.665 -17.361 1.00 1.44 H new ATOM 0 HB3 GLU A 57 0.278 0.791 -16.555 1.00 1.44 H new ATOM 0 HG2 GLU A 57 1.518 1.464 -18.621 1.00 1.50 H new ATOM 0 HG3 GLU A 57 0.957 0.012 -19.426 1.00 1.50 H new ATOM 555 N THR A 58 3.544 -1.240 -18.483 1.00 1.38 N ATOM 556 CA THR A 58 4.309 -2.091 -19.413 1.00 1.47 C ATOM 557 C THR A 58 4.962 -3.306 -18.728 1.00 1.30 C ATOM 558 O THR A 58 5.119 -4.363 -19.353 1.00 1.28 O ATOM 559 CB THR A 58 5.344 -1.242 -20.169 1.00 1.62 C ATOM 560 OG1 THR A 58 5.922 -1.994 -21.206 1.00 1.90 O ATOM 561 CG2 THR A 58 6.471 -0.716 -19.286 1.00 1.44 C ATOM 0 H THR A 58 3.996 -0.346 -18.291 1.00 1.38 H new ATOM 0 HA THR A 58 3.600 -2.508 -20.128 1.00 1.47 H new ATOM 0 HB THR A 58 4.793 -0.384 -20.554 1.00 1.62 H new ATOM 0 HG1 THR A 58 6.579 -1.444 -21.682 1.00 1.90 H new ATOM 0 HG21 THR A 58 7.161 -0.127 -19.890 1.00 1.44 H new ATOM 0 HG22 THR A 58 6.053 -0.090 -18.497 1.00 1.44 H new ATOM 0 HG23 THR A 58 7.005 -1.555 -18.839 1.00 1.44 H new ATOM 569 N GLY A 59 5.325 -3.181 -17.445 1.00 1.22 N ATOM 570 CA GLY A 59 5.959 -4.227 -16.633 1.00 1.13 C ATOM 571 C GLY A 59 4.950 -5.074 -15.852 1.00 1.06 C ATOM 572 O GLY A 59 3.786 -4.700 -15.699 1.00 1.10 O ATOM 0 H GLY A 59 5.180 -2.316 -16.925 1.00 1.22 H new ATOM 0 HA2 GLY A 59 6.545 -4.877 -17.282 1.00 1.13 H new ATOM 0 HA3 GLY A 59 6.655 -3.764 -15.933 1.00 1.13 H new ATOM 576 N ASN A 60 5.376 -6.230 -15.340 1.00 1.00 N ATOM 577 CA ASN A 60 4.534 -7.141 -14.549 1.00 0.97 C ATOM 578 C ASN A 60 4.555 -6.770 -13.052 1.00 0.90 C ATOM 579 O ASN A 60 4.894 -7.598 -12.198 1.00 1.13 O ATOM 580 CB ASN A 60 4.937 -8.604 -14.805 1.00 1.02 C ATOM 581 CG ASN A 60 5.008 -9.013 -16.269 1.00 1.28 C ATOM 582 OD1 ASN A 60 4.336 -8.486 -17.153 1.00 1.59 O ATOM 583 ND2 ASN A 60 5.823 -9.993 -16.560 1.00 1.63 N ATOM 0 H ASN A 60 6.330 -6.569 -15.463 1.00 1.00 H new ATOM 0 HA ASN A 60 3.500 -7.030 -14.874 1.00 0.97 H new ATOM 0 HB2 ASN A 60 5.911 -8.781 -14.348 1.00 1.02 H new ATOM 0 HB3 ASN A 60 4.224 -9.254 -14.298 1.00 1.02 H new ATOM 0 HD21 ASN A 60 5.902 -10.322 -17.522 1.00 1.63 H new ATOM 0 HD22 ASN A 60 6.380 -10.429 -15.825 1.00 1.63 H new ATOM 590 N TYR A 61 4.257 -5.513 -12.710 1.00 0.74 N ATOM 591 CA TYR A 61 4.448 -4.997 -11.346 1.00 0.68 C ATOM 592 C TYR A 61 3.236 -5.186 -10.421 1.00 0.70 C ATOM 593 O TYR A 61 3.236 -4.702 -9.287 1.00 0.72 O ATOM 594 CB TYR A 61 4.983 -3.561 -11.364 1.00 0.65 C ATOM 595 CG TYR A 61 6.168 -3.292 -12.280 1.00 0.65 C ATOM 596 CD1 TYR A 61 7.154 -4.270 -12.531 1.00 1.75 C ATOM 597 CD2 TYR A 61 6.282 -2.027 -12.879 1.00 1.89 C ATOM 598 CE1 TYR A 61 8.205 -3.997 -13.426 1.00 1.79 C ATOM 599 CE2 TYR A 61 7.365 -1.730 -13.724 1.00 1.89 C ATOM 600 CZ TYR A 61 8.309 -2.727 -14.035 1.00 0.74 C ATOM 601 OH TYR A 61 9.317 -2.461 -14.904 1.00 0.84 O ATOM 0 H TYR A 61 3.879 -4.827 -13.363 1.00 0.74 H new ATOM 0 HA TYR A 61 5.217 -5.622 -10.891 1.00 0.68 H new ATOM 0 HB2 TYR A 61 4.169 -2.897 -11.654 1.00 0.65 H new ATOM 0 HB3 TYR A 61 5.268 -3.290 -10.348 1.00 0.65 H new ATOM 0 HD1 TYR A 61 7.102 -5.228 -12.036 1.00 1.75 H new ATOM 0 HD2 TYR A 61 5.530 -1.275 -12.689 1.00 1.89 H new ATOM 0 HE1 TYR A 61 8.935 -4.762 -13.648 1.00 1.79 H new ATOM 0 HE2 TYR A 61 7.473 -0.737 -14.135 1.00 1.89 H new ATOM 0 HH TYR A 61 9.235 -1.540 -15.228 1.00 0.84 H new ATOM 611 N ALA A 62 2.210 -5.923 -10.858 1.00 0.75 N ATOM 612 CA ALA A 62 1.128 -6.378 -9.984 1.00 0.80 C ATOM 613 C ALA A 62 1.611 -7.455 -8.993 1.00 0.74 C ATOM 614 O ALA A 62 1.021 -7.622 -7.923 1.00 0.83 O ATOM 615 CB ALA A 62 0.001 -6.935 -10.856 1.00 0.92 C ATOM 0 H ALA A 62 2.108 -6.220 -11.828 1.00 0.75 H new ATOM 0 HA ALA A 62 0.773 -5.533 -9.395 1.00 0.80 H new ATOM 0 HB1 ALA A 62 -0.815 -7.279 -10.220 1.00 0.92 H new ATOM 0 HB2 ALA A 62 -0.363 -6.153 -11.523 1.00 0.92 H new ATOM 0 HB3 ALA A 62 0.377 -7.770 -11.447 1.00 0.92 H new ATOM 621 N GLY A 63 2.668 -8.198 -9.346 1.00 0.67 N ATOM 622 CA GLY A 63 3.232 -9.268 -8.519 1.00 0.64 C ATOM 623 C GLY A 63 4.622 -8.913 -8.000 1.00 0.54 C ATOM 624 O GLY A 63 4.774 -8.449 -6.868 1.00 0.55 O ATOM 0 H GLY A 63 3.162 -8.069 -10.229 1.00 0.67 H new ATOM 0 HA2 GLY A 63 2.569 -9.463 -7.676 1.00 0.64 H new ATOM 0 HA3 GLY A 63 3.286 -10.187 -9.102 1.00 0.64 H new ATOM 628 N ASN A 64 5.629 -9.134 -8.849 1.00 0.67 N ATOM 629 CA ASN A 64 7.039 -8.863 -8.561 1.00 0.66 C ATOM 630 C ASN A 64 7.353 -7.347 -8.482 1.00 0.55 C ATOM 631 O ASN A 64 6.577 -6.526 -8.978 1.00 0.60 O ATOM 632 CB ASN A 64 7.911 -9.686 -9.536 1.00 0.90 C ATOM 633 CG ASN A 64 8.608 -8.831 -10.564 1.00 1.17 C ATOM 634 OD1 ASN A 64 9.828 -8.728 -10.596 1.00 1.74 O ATOM 635 ND2 ASN A 64 7.863 -8.124 -11.374 1.00 1.51 N ATOM 0 H ASN A 64 5.481 -9.517 -9.783 1.00 0.67 H new ATOM 0 HA ASN A 64 7.293 -9.200 -7.556 1.00 0.66 H new ATOM 0 HB2 ASN A 64 8.656 -10.242 -8.968 1.00 0.90 H new ATOM 0 HB3 ASN A 64 7.285 -10.419 -10.045 1.00 0.90 H new ATOM 0 HD21 ASN A 64 8.298 -7.482 -12.037 1.00 1.51 H new ATOM 0 HD22 ASN A 64 6.848 -8.214 -11.342 1.00 1.51 H new ATOM 642 N LYS A 65 8.484 -6.971 -7.866 1.00 0.52 N ATOM 643 CA LYS A 65 8.900 -5.567 -7.646 1.00 0.51 C ATOM 644 C LYS A 65 9.086 -4.751 -8.937 1.00 0.54 C ATOM 645 O LYS A 65 9.362 -5.312 -10.003 1.00 0.60 O ATOM 646 CB LYS A 65 10.168 -5.536 -6.768 1.00 0.55 C ATOM 647 CG LYS A 65 11.446 -5.965 -7.514 1.00 1.05 C ATOM 648 CD LYS A 65 12.653 -6.182 -6.590 1.00 1.43 C ATOM 649 CE LYS A 65 12.958 -4.952 -5.727 1.00 1.52 C ATOM 650 NZ LYS A 65 14.263 -5.075 -5.040 1.00 2.51 N ATOM 0 H LYS A 65 9.154 -7.646 -7.497 1.00 0.52 H new ATOM 0 HA LYS A 65 8.079 -5.073 -7.127 1.00 0.51 H new ATOM 0 HB2 LYS A 65 10.306 -4.527 -6.379 1.00 0.55 H new ATOM 0 HB3 LYS A 65 10.021 -6.191 -5.909 1.00 0.55 H new ATOM 0 HG2 LYS A 65 11.246 -6.887 -8.060 1.00 1.05 H new ATOM 0 HG3 LYS A 65 11.697 -5.205 -8.254 1.00 1.05 H new ATOM 0 HD2 LYS A 65 12.462 -7.038 -5.943 1.00 1.43 H new ATOM 0 HD3 LYS A 65 13.528 -6.426 -7.192 1.00 1.43 H new ATOM 0 HE2 LYS A 65 12.959 -4.060 -6.353 1.00 1.52 H new ATOM 0 HE3 LYS A 65 12.168 -4.822 -4.987 1.00 1.52 H new ATOM 0 HZ1 LYS A 65 14.435 -4.225 -4.466 1.00 2.51 H new ATOM 0 HZ2 LYS A 65 14.253 -5.913 -4.424 1.00 2.51 H new ATOM 0 HZ3 LYS A 65 15.019 -5.174 -5.747 1.00 2.51 H new ATOM 664 N VAL A 66 9.015 -3.415 -8.837 1.00 0.52 N ATOM 665 CA VAL A 66 9.260 -2.510 -9.980 1.00 0.54 C ATOM 666 C VAL A 66 10.669 -2.721 -10.542 1.00 0.63 C ATOM 667 O VAL A 66 11.661 -2.653 -9.809 1.00 0.72 O ATOM 668 CB VAL A 66 9.016 -1.024 -9.637 1.00 0.51 C ATOM 669 CG1 VAL A 66 9.522 -0.057 -10.725 1.00 0.55 C ATOM 670 CG2 VAL A 66 7.514 -0.775 -9.492 1.00 0.48 C ATOM 0 H VAL A 66 8.788 -2.930 -7.969 1.00 0.52 H new ATOM 0 HA VAL A 66 8.531 -2.769 -10.748 1.00 0.54 H new ATOM 0 HB VAL A 66 9.565 -0.834 -8.715 1.00 0.51 H new ATOM 0 HG11 VAL A 66 9.320 0.970 -10.422 1.00 0.55 H new ATOM 0 HG12 VAL A 66 10.595 -0.191 -10.860 1.00 0.55 H new ATOM 0 HG13 VAL A 66 9.009 -0.266 -11.664 1.00 0.55 H new ATOM 0 HG21 VAL A 66 7.341 0.274 -9.250 1.00 0.48 H new ATOM 0 HG22 VAL A 66 7.013 -1.019 -10.429 1.00 0.48 H new ATOM 0 HG23 VAL A 66 7.117 -1.402 -8.694 1.00 0.48 H new ATOM 680 N GLY A 67 10.739 -2.963 -11.853 1.00 0.74 N ATOM 681 CA GLY A 67 11.966 -3.281 -12.585 1.00 0.90 C ATOM 682 C GLY A 67 12.988 -2.150 -12.569 1.00 0.75 C ATOM 683 O GLY A 67 14.150 -2.394 -12.246 1.00 0.89 O ATOM 0 H GLY A 67 9.915 -2.942 -12.454 1.00 0.74 H new ATOM 0 HA2 GLY A 67 12.417 -4.175 -12.154 1.00 0.90 H new ATOM 0 HA3 GLY A 67 11.713 -3.518 -13.618 1.00 0.90 H new ATOM 687 N VAL A 68 12.570 -0.919 -12.878 1.00 0.70 N ATOM 688 CA VAL A 68 13.392 0.297 -12.777 1.00 0.85 C ATOM 689 C VAL A 68 12.518 1.552 -12.696 1.00 0.69 C ATOM 690 O VAL A 68 11.613 1.746 -13.510 1.00 0.74 O ATOM 691 CB VAL A 68 14.402 0.360 -13.943 1.00 1.26 C ATOM 692 CG1 VAL A 68 13.767 0.354 -15.337 1.00 2.02 C ATOM 693 CG2 VAL A 68 15.356 1.550 -13.807 1.00 2.59 C ATOM 0 H VAL A 68 11.625 -0.733 -13.215 1.00 0.70 H new ATOM 0 HA VAL A 68 13.964 0.256 -11.850 1.00 0.85 H new ATOM 0 HB VAL A 68 14.967 -0.568 -13.859 1.00 1.26 H new ATOM 0 HG11 VAL A 68 14.550 0.401 -16.094 1.00 2.02 H new ATOM 0 HG12 VAL A 68 13.188 -0.560 -15.469 1.00 2.02 H new ATOM 0 HG13 VAL A 68 13.110 1.217 -15.441 1.00 2.02 H new ATOM 0 HG21 VAL A 68 16.050 1.558 -14.647 1.00 2.59 H new ATOM 0 HG22 VAL A 68 14.783 2.477 -13.801 1.00 2.59 H new ATOM 0 HG23 VAL A 68 15.915 1.463 -12.875 1.00 2.59 H new ATOM 703 N LEU A 69 12.774 2.409 -11.706 1.00 0.70 N ATOM 704 CA LEU A 69 12.116 3.707 -11.555 1.00 0.61 C ATOM 705 C LEU A 69 12.732 4.767 -12.493 1.00 0.67 C ATOM 706 O LEU A 69 13.952 4.769 -12.683 1.00 0.84 O ATOM 707 CB LEU A 69 12.207 4.150 -10.083 1.00 0.68 C ATOM 708 CG LEU A 69 11.390 3.270 -9.120 1.00 0.71 C ATOM 709 CD1 LEU A 69 11.700 3.649 -7.675 1.00 0.88 C ATOM 710 CD2 LEU A 69 9.887 3.453 -9.335 1.00 0.65 C ATOM 0 H LEU A 69 13.457 2.216 -10.973 1.00 0.70 H new ATOM 0 HA LEU A 69 11.068 3.606 -11.838 1.00 0.61 H new ATOM 0 HB2 LEU A 69 13.252 4.139 -9.773 1.00 0.68 H new ATOM 0 HB3 LEU A 69 11.861 5.181 -10.001 1.00 0.68 H new ATOM 0 HG LEU A 69 11.664 2.234 -9.319 1.00 0.71 H new ATOM 0 HD11 LEU A 69 11.117 3.021 -7.001 1.00 0.88 H new ATOM 0 HD12 LEU A 69 12.762 3.502 -7.480 1.00 0.88 H new ATOM 0 HD13 LEU A 69 11.442 4.695 -7.510 1.00 0.88 H new ATOM 0 HD21 LEU A 69 9.340 2.817 -8.639 1.00 0.65 H new ATOM 0 HD22 LEU A 69 9.619 4.495 -9.162 1.00 0.65 H new ATOM 0 HD23 LEU A 69 9.629 3.177 -10.358 1.00 0.65 H new ATOM 722 N PRO A 70 11.936 5.703 -13.044 1.00 0.58 N ATOM 723 CA PRO A 70 12.451 6.773 -13.902 1.00 0.64 C ATOM 724 C PRO A 70 13.208 7.862 -13.119 1.00 0.65 C ATOM 725 O PRO A 70 13.102 7.959 -11.894 1.00 0.65 O ATOM 726 CB PRO A 70 11.213 7.339 -14.595 1.00 0.61 C ATOM 727 CG PRO A 70 10.083 7.110 -13.611 1.00 0.50 C ATOM 728 CD PRO A 70 10.493 5.843 -12.855 1.00 0.47 C ATOM 0 HA PRO A 70 13.189 6.391 -14.607 1.00 0.64 H new ATOM 0 HB2 PRO A 70 11.334 8.399 -14.819 1.00 0.61 H new ATOM 0 HB3 PRO A 70 11.023 6.833 -15.541 1.00 0.61 H new ATOM 0 HG2 PRO A 70 9.966 7.957 -12.935 1.00 0.50 H new ATOM 0 HG3 PRO A 70 9.130 6.977 -14.123 1.00 0.50 H new ATOM 0 HD2 PRO A 70 10.245 5.924 -11.797 1.00 0.47 H new ATOM 0 HD3 PRO A 70 9.964 4.972 -13.240 1.00 0.47 H new ATOM 736 N ALA A 71 13.941 8.734 -13.818 1.00 0.71 N ATOM 737 CA ALA A 71 14.630 9.883 -13.213 1.00 0.77 C ATOM 738 C ALA A 71 13.666 10.961 -12.668 1.00 0.69 C ATOM 739 O ALA A 71 14.020 11.701 -11.742 1.00 0.81 O ATOM 740 CB ALA A 71 15.586 10.475 -14.251 1.00 0.90 C ATOM 0 H ALA A 71 14.075 8.664 -14.827 1.00 0.71 H new ATOM 0 HA ALA A 71 15.182 9.526 -12.343 1.00 0.77 H new ATOM 0 HB1 ALA A 71 16.107 11.330 -13.820 1.00 0.90 H new ATOM 0 HB2 ALA A 71 16.313 9.719 -14.549 1.00 0.90 H new ATOM 0 HB3 ALA A 71 15.020 10.798 -15.125 1.00 0.90 H new ATOM 746 N ASN A 72 12.435 11.026 -13.189 1.00 0.58 N ATOM 747 CA ASN A 72 11.369 11.898 -12.685 1.00 0.56 C ATOM 748 C ASN A 72 10.576 11.313 -11.492 1.00 0.53 C ATOM 749 O ASN A 72 9.714 11.998 -10.944 1.00 0.61 O ATOM 750 CB ASN A 72 10.487 12.385 -13.852 1.00 0.58 C ATOM 751 CG ASN A 72 9.731 11.317 -14.619 1.00 0.57 C ATOM 752 OD1 ASN A 72 9.572 10.193 -14.177 1.00 1.64 O ATOM 753 ND2 ASN A 72 9.242 11.648 -15.793 1.00 1.64 N ATOM 0 H ASN A 72 12.147 10.462 -13.989 1.00 0.58 H new ATOM 0 HA ASN A 72 11.846 12.774 -12.245 1.00 0.56 H new ATOM 0 HB2 ASN A 72 9.764 13.099 -13.458 1.00 0.58 H new ATOM 0 HB3 ASN A 72 11.120 12.927 -14.555 1.00 0.58 H new ATOM 0 HD21 ASN A 72 8.725 10.961 -16.342 1.00 1.64 H new ATOM 0 HD22 ASN A 72 9.380 12.591 -16.155 1.00 1.64 H new ATOM 760 N ALA A 73 10.894 10.090 -11.050 1.00 0.51 N ATOM 761 CA ALA A 73 10.348 9.456 -9.845 1.00 0.49 C ATOM 762 C ALA A 73 11.312 9.458 -8.637 1.00 0.49 C ATOM 763 O ALA A 73 12.539 9.521 -8.793 1.00 0.54 O ATOM 764 CB ALA A 73 9.982 8.010 -10.198 1.00 0.47 C ATOM 0 H ALA A 73 11.562 9.494 -11.539 1.00 0.51 H new ATOM 0 HA ALA A 73 9.481 10.040 -9.536 1.00 0.49 H new ATOM 0 HB1 ALA A 73 9.573 7.513 -9.318 1.00 0.47 H new ATOM 0 HB2 ALA A 73 9.239 8.007 -10.995 1.00 0.47 H new ATOM 0 HB3 ALA A 73 10.874 7.480 -10.532 1.00 0.47 H new ATOM 770 N LYS A 74 10.755 9.323 -7.424 1.00 0.50 N ATOM 771 CA LYS A 74 11.502 9.011 -6.190 1.00 0.66 C ATOM 772 C LYS A 74 10.667 8.218 -5.176 1.00 0.53 C ATOM 773 O LYS A 74 9.436 8.237 -5.220 1.00 0.48 O ATOM 774 CB LYS A 74 12.164 10.257 -5.563 1.00 1.15 C ATOM 775 CG LYS A 74 11.298 11.118 -4.630 1.00 1.05 C ATOM 776 CD LYS A 74 10.310 12.025 -5.374 1.00 1.30 C ATOM 777 CE LYS A 74 9.777 13.171 -4.503 1.00 1.32 C ATOM 778 NZ LYS A 74 10.865 14.059 -4.025 1.00 1.97 N ATOM 0 H LYS A 74 9.753 9.429 -7.267 1.00 0.50 H new ATOM 0 HA LYS A 74 12.317 8.353 -6.493 1.00 0.66 H new ATOM 0 HB2 LYS A 74 13.040 9.929 -5.003 1.00 1.15 H new ATOM 0 HB3 LYS A 74 12.523 10.892 -6.373 1.00 1.15 H new ATOM 0 HG2 LYS A 74 10.743 10.464 -3.957 1.00 1.05 H new ATOM 0 HG3 LYS A 74 11.949 11.735 -4.010 1.00 1.05 H new ATOM 0 HD2 LYS A 74 10.800 12.442 -6.254 1.00 1.30 H new ATOM 0 HD3 LYS A 74 9.472 11.426 -5.730 1.00 1.30 H new ATOM 0 HE2 LYS A 74 9.057 13.756 -5.075 1.00 1.32 H new ATOM 0 HE3 LYS A 74 9.244 12.758 -3.647 1.00 1.32 H new ATOM 0 HZ1 LYS A 74 10.470 14.988 -3.775 1.00 1.97 H new ATOM 0 HZ2 LYS A 74 11.315 13.637 -3.188 1.00 1.97 H new ATOM 0 HZ3 LYS A 74 11.574 14.176 -4.777 1.00 1.97 H new ATOM 792 N GLU A 75 11.350 7.543 -4.257 1.00 0.74 N ATOM 793 CA GLU A 75 10.769 6.754 -3.157 1.00 0.66 C ATOM 794 C GLU A 75 10.912 7.487 -1.806 1.00 0.65 C ATOM 795 O GLU A 75 11.895 8.206 -1.614 1.00 0.74 O ATOM 796 CB GLU A 75 11.470 5.383 -3.078 1.00 0.83 C ATOM 797 CG GLU A 75 11.492 4.565 -4.382 1.00 0.91 C ATOM 798 CD GLU A 75 12.341 3.295 -4.236 1.00 1.51 C ATOM 799 OE1 GLU A 75 13.594 3.384 -4.290 1.00 1.74 O ATOM 800 OE2 GLU A 75 11.783 2.209 -3.952 1.00 2.90 O ATOM 0 H GLU A 75 12.370 7.525 -4.251 1.00 0.74 H new ATOM 0 HA GLU A 75 9.707 6.617 -3.360 1.00 0.66 H new ATOM 0 HB2 GLU A 75 12.498 5.540 -2.753 1.00 0.83 H new ATOM 0 HB3 GLU A 75 10.979 4.789 -2.307 1.00 0.83 H new ATOM 0 HG2 GLU A 75 10.474 4.293 -4.659 1.00 0.91 H new ATOM 0 HG3 GLU A 75 11.889 5.178 -5.191 1.00 0.91 H new ATOM 807 N ILE A 76 10.000 7.300 -0.840 1.00 0.60 N ATOM 808 CA ILE A 76 10.088 7.924 0.506 1.00 0.61 C ATOM 809 C ILE A 76 9.718 6.981 1.667 1.00 0.56 C ATOM 810 O ILE A 76 8.732 6.241 1.603 1.00 0.60 O ATOM 811 CB ILE A 76 9.269 9.240 0.610 1.00 0.62 C ATOM 812 CG1 ILE A 76 7.839 9.113 0.031 1.00 0.60 C ATOM 813 CG2 ILE A 76 10.026 10.441 0.012 1.00 0.75 C ATOM 814 CD1 ILE A 76 7.062 10.432 0.068 1.00 0.78 C ATOM 0 H ILE A 76 9.176 6.712 -0.962 1.00 0.60 H new ATOM 0 HA ILE A 76 11.146 8.161 0.615 1.00 0.61 H new ATOM 0 HB ILE A 76 9.147 9.432 1.676 1.00 0.62 H new ATOM 0 HG12 ILE A 76 7.899 8.761 -0.999 1.00 0.60 H new ATOM 0 HG13 ILE A 76 7.290 8.358 0.594 1.00 0.60 H new ATOM 0 HG21 ILE A 76 9.416 11.339 0.106 1.00 0.75 H new ATOM 0 HG22 ILE A 76 10.965 10.582 0.547 1.00 0.75 H new ATOM 0 HG23 ILE A 76 10.233 10.252 -1.041 1.00 0.75 H new ATOM 0 HD11 ILE A 76 6.067 10.280 -0.351 1.00 0.78 H new ATOM 0 HD12 ILE A 76 6.973 10.773 1.099 1.00 0.78 H new ATOM 0 HD13 ILE A 76 7.592 11.183 -0.518 1.00 0.78 H new ATOM 826 N ALA A 77 10.483 7.065 2.764 1.00 0.66 N ATOM 827 CA ALA A 77 10.209 6.377 4.028 1.00 0.64 C ATOM 828 C ALA A 77 9.546 7.290 5.084 1.00 0.59 C ATOM 829 O ALA A 77 9.849 8.482 5.169 1.00 0.85 O ATOM 830 CB ALA A 77 11.494 5.730 4.552 1.00 0.69 C ATOM 0 H ALA A 77 11.332 7.629 2.795 1.00 0.66 H new ATOM 0 HA ALA A 77 9.477 5.595 3.828 1.00 0.64 H new ATOM 0 HB1 ALA A 77 11.287 5.219 5.492 1.00 0.69 H new ATOM 0 HB2 ALA A 77 11.863 5.010 3.821 1.00 0.69 H new ATOM 0 HB3 ALA A 77 12.248 6.500 4.716 1.00 0.69 H new ATOM 836 N GLY A 78 8.678 6.717 5.925 1.00 0.45 N ATOM 837 CA GLY A 78 7.948 7.411 6.999 1.00 0.44 C ATOM 838 C GLY A 78 6.473 7.726 6.698 1.00 0.45 C ATOM 839 O GLY A 78 5.868 8.529 7.402 1.00 0.54 O ATOM 0 H GLY A 78 8.455 5.723 5.877 1.00 0.45 H new ATOM 0 HA2 GLY A 78 7.995 6.800 7.900 1.00 0.44 H new ATOM 0 HA3 GLY A 78 8.464 8.346 7.220 1.00 0.44 H new ATOM 843 N VAL A 79 5.883 7.121 5.664 1.00 0.45 N ATOM 844 CA VAL A 79 4.430 7.147 5.372 1.00 0.44 C ATOM 845 C VAL A 79 3.739 5.980 6.078 1.00 0.36 C ATOM 846 O VAL A 79 4.319 4.901 6.195 1.00 0.37 O ATOM 847 CB VAL A 79 4.160 7.152 3.848 1.00 0.55 C ATOM 848 CG1 VAL A 79 5.053 6.190 3.063 1.00 0.69 C ATOM 849 CG2 VAL A 79 2.714 6.835 3.466 1.00 0.76 C ATOM 0 H VAL A 79 6.412 6.580 4.980 1.00 0.45 H new ATOM 0 HA VAL A 79 4.008 8.074 5.761 1.00 0.44 H new ATOM 0 HB VAL A 79 4.390 8.182 3.576 1.00 0.55 H new ATOM 0 HG11 VAL A 79 4.807 6.248 2.003 1.00 0.69 H new ATOM 0 HG12 VAL A 79 6.098 6.463 3.208 1.00 0.69 H new ATOM 0 HG13 VAL A 79 4.891 5.172 3.418 1.00 0.69 H new ATOM 0 HG21 VAL A 79 2.611 6.859 2.381 1.00 0.76 H new ATOM 0 HG22 VAL A 79 2.449 5.844 3.834 1.00 0.76 H new ATOM 0 HG23 VAL A 79 2.049 7.576 3.910 1.00 0.76 H new ATOM 859 N MET A 80 2.509 6.210 6.547 1.00 0.37 N ATOM 860 CA MET A 80 1.645 5.219 7.197 1.00 0.34 C ATOM 861 C MET A 80 0.510 4.749 6.276 1.00 0.32 C ATOM 862 O MET A 80 -0.116 5.551 5.583 1.00 0.37 O ATOM 863 CB MET A 80 1.095 5.818 8.504 1.00 0.40 C ATOM 864 CG MET A 80 0.098 4.906 9.232 1.00 0.43 C ATOM 865 SD MET A 80 0.707 3.229 9.559 1.00 0.49 S ATOM 866 CE MET A 80 0.578 3.177 11.355 1.00 0.43 C ATOM 0 H MET A 80 2.070 7.128 6.482 1.00 0.37 H new ATOM 0 HA MET A 80 2.238 4.333 7.424 1.00 0.34 H new ATOM 0 HB2 MET A 80 1.928 6.036 9.172 1.00 0.40 H new ATOM 0 HB3 MET A 80 0.609 6.768 8.281 1.00 0.40 H new ATOM 0 HG2 MET A 80 -0.174 5.371 10.180 1.00 0.43 H new ATOM 0 HG3 MET A 80 -0.813 4.838 8.637 1.00 0.43 H new ATOM 0 HE1 MET A 80 1.222 2.388 11.743 1.00 0.43 H new ATOM 0 HE2 MET A 80 0.888 4.136 11.770 1.00 0.43 H new ATOM 0 HE3 MET A 80 -0.455 2.975 11.640 1.00 0.43 H new ATOM 876 N PHE A 81 0.208 3.451 6.319 1.00 0.31 N ATOM 877 CA PHE A 81 -0.939 2.836 5.647 1.00 0.35 C ATOM 878 C PHE A 81 -1.539 1.666 6.450 1.00 0.36 C ATOM 879 O PHE A 81 -0.863 1.014 7.251 1.00 0.36 O ATOM 880 CB PHE A 81 -0.579 2.423 4.205 1.00 0.37 C ATOM 881 CG PHE A 81 0.876 2.075 3.996 1.00 0.34 C ATOM 882 CD1 PHE A 81 1.379 0.942 4.652 1.00 1.98 C ATOM 883 CD2 PHE A 81 1.741 2.905 3.245 1.00 1.98 C ATOM 884 CE1 PHE A 81 2.741 0.644 4.574 1.00 1.97 C ATOM 885 CE2 PHE A 81 3.092 2.549 3.106 1.00 2.04 C ATOM 886 CZ PHE A 81 3.589 1.415 3.771 1.00 0.62 C ATOM 0 H PHE A 81 0.771 2.777 6.838 1.00 0.31 H new ATOM 0 HA PHE A 81 -1.721 3.593 5.591 1.00 0.35 H new ATOM 0 HB2 PHE A 81 -1.189 1.564 3.924 1.00 0.37 H new ATOM 0 HB3 PHE A 81 -0.845 3.237 3.531 1.00 0.37 H new ATOM 0 HD1 PHE A 81 0.716 0.303 5.215 1.00 1.98 H new ATOM 0 HD2 PHE A 81 1.365 3.805 2.782 1.00 1.98 H new ATOM 0 HE1 PHE A 81 3.142 -0.186 5.137 1.00 1.97 H new ATOM 0 HE2 PHE A 81 3.748 3.145 2.489 1.00 2.04 H new ATOM 0 HZ PHE A 81 4.627 1.138 3.662 1.00 0.62 H new ATOM 896 N VAL A 82 -2.822 1.392 6.198 1.00 0.38 N ATOM 897 CA VAL A 82 -3.636 0.320 6.800 1.00 0.35 C ATOM 898 C VAL A 82 -4.151 -0.625 5.695 1.00 0.33 C ATOM 899 O VAL A 82 -4.397 -0.176 4.572 1.00 0.33 O ATOM 900 CB VAL A 82 -4.803 0.894 7.643 1.00 0.36 C ATOM 901 CG1 VAL A 82 -4.364 2.042 8.566 1.00 0.41 C ATOM 902 CG2 VAL A 82 -5.969 1.438 6.810 1.00 0.38 C ATOM 0 H VAL A 82 -3.357 1.944 5.528 1.00 0.38 H new ATOM 0 HA VAL A 82 -3.007 -0.250 7.483 1.00 0.35 H new ATOM 0 HB VAL A 82 -5.132 0.029 8.219 1.00 0.36 H new ATOM 0 HG11 VAL A 82 -5.223 2.403 9.131 1.00 0.41 H new ATOM 0 HG12 VAL A 82 -3.601 1.682 9.256 1.00 0.41 H new ATOM 0 HG13 VAL A 82 -3.956 2.855 7.966 1.00 0.41 H new ATOM 0 HG21 VAL A 82 -6.744 1.821 7.475 1.00 0.38 H new ATOM 0 HG22 VAL A 82 -5.612 2.243 6.167 1.00 0.38 H new ATOM 0 HG23 VAL A 82 -6.381 0.638 6.195 1.00 0.38 H new ATOM 912 N TRP A 83 -4.353 -1.912 5.989 1.00 0.33 N ATOM 913 CA TRP A 83 -5.044 -2.859 5.103 1.00 0.31 C ATOM 914 C TRP A 83 -6.559 -2.902 5.370 1.00 0.32 C ATOM 915 O TRP A 83 -7.039 -2.771 6.498 1.00 0.33 O ATOM 916 CB TRP A 83 -4.434 -4.268 5.194 1.00 0.29 C ATOM 917 CG TRP A 83 -3.234 -4.546 4.330 1.00 0.30 C ATOM 918 CD1 TRP A 83 -2.029 -3.925 4.388 1.00 0.36 C ATOM 919 CD2 TRP A 83 -3.099 -5.573 3.293 1.00 0.30 C ATOM 920 NE1 TRP A 83 -1.198 -4.445 3.409 1.00 0.35 N ATOM 921 CE2 TRP A 83 -1.800 -5.473 2.712 1.00 0.33 C ATOM 922 CE3 TRP A 83 -3.938 -6.603 2.806 1.00 0.30 C ATOM 923 CZ2 TRP A 83 -1.370 -6.323 1.678 1.00 0.35 C ATOM 924 CZ3 TRP A 83 -3.502 -7.496 1.807 1.00 0.32 C ATOM 925 CH2 TRP A 83 -2.223 -7.350 1.232 1.00 0.35 C ATOM 0 H TRP A 83 -4.037 -2.334 6.862 1.00 0.33 H new ATOM 0 HA TRP A 83 -4.901 -2.494 4.086 1.00 0.31 H new ATOM 0 HB2 TRP A 83 -4.155 -4.451 6.232 1.00 0.29 H new ATOM 0 HB3 TRP A 83 -5.210 -4.991 4.941 1.00 0.29 H new ATOM 0 HD1 TRP A 83 -1.760 -3.147 5.088 1.00 0.36 H new ATOM 0 HE1 TRP A 83 -0.253 -4.108 3.225 1.00 0.35 H new ATOM 0 HE3 TRP A 83 -4.935 -6.707 3.209 1.00 0.30 H new ATOM 0 HZ2 TRP A 83 -0.396 -6.189 1.231 1.00 0.35 H new ATOM 0 HZ3 TRP A 83 -4.150 -8.296 1.480 1.00 0.32 H new ATOM 0 HH2 TRP A 83 -1.899 -8.024 0.452 1.00 0.35 H new ATOM 936 N THR A 84 -7.316 -3.143 4.302 1.00 0.33 N ATOM 937 CA THR A 84 -8.775 -3.310 4.290 1.00 0.32 C ATOM 938 C THR A 84 -9.200 -4.432 3.342 1.00 0.30 C ATOM 939 O THR A 84 -8.415 -4.896 2.512 1.00 0.31 O ATOM 940 CB THR A 84 -9.503 -2.027 3.839 1.00 0.35 C ATOM 941 OG1 THR A 84 -9.024 -1.602 2.589 1.00 0.38 O ATOM 942 CG2 THR A 84 -9.398 -0.844 4.790 1.00 0.43 C ATOM 0 H THR A 84 -6.911 -3.233 3.370 1.00 0.33 H new ATOM 0 HA THR A 84 -9.052 -3.550 5.317 1.00 0.32 H new ATOM 0 HB THR A 84 -10.552 -2.322 3.806 1.00 0.35 H new ATOM 0 HG1 THR A 84 -8.128 -1.970 2.440 1.00 0.38 H new ATOM 0 HG21 THR A 84 -9.944 0.004 4.377 1.00 0.43 H new ATOM 0 HG22 THR A 84 -9.824 -1.115 5.756 1.00 0.43 H new ATOM 0 HG23 THR A 84 -8.350 -0.573 4.919 1.00 0.43 H new ATOM 950 N ASN A 85 -10.458 -4.869 3.434 1.00 0.36 N ATOM 951 CA ASN A 85 -11.050 -5.761 2.434 1.00 0.39 C ATOM 952 C ASN A 85 -11.599 -4.999 1.216 1.00 0.44 C ATOM 953 O ASN A 85 -11.679 -3.772 1.240 1.00 0.46 O ATOM 954 CB ASN A 85 -12.108 -6.664 3.084 1.00 0.39 C ATOM 955 CG ASN A 85 -11.911 -8.060 2.546 1.00 0.73 C ATOM 956 OD1 ASN A 85 -12.612 -8.526 1.667 1.00 1.99 O ATOM 957 ND2 ASN A 85 -10.843 -8.691 2.965 1.00 0.60 N ATOM 0 H ASN A 85 -11.089 -4.618 4.195 1.00 0.36 H new ATOM 0 HA ASN A 85 -10.256 -6.399 2.046 1.00 0.39 H new ATOM 0 HB2 ASN A 85 -12.005 -6.654 4.169 1.00 0.39 H new ATOM 0 HB3 ASN A 85 -13.111 -6.304 2.856 1.00 0.39 H new ATOM 0 HD21 ASN A 85 -10.587 -9.588 2.554 1.00 0.60 H new ATOM 0 HD22 ASN A 85 -10.267 -8.285 3.703 1.00 0.60 H new ATOM 964 N THR A 86 -12.037 -5.702 0.164 1.00 0.55 N ATOM 965 CA THR A 86 -12.558 -5.037 -1.047 1.00 0.68 C ATOM 966 C THR A 86 -13.807 -4.167 -0.809 1.00 0.62 C ATOM 967 O THR A 86 -14.019 -3.181 -1.512 1.00 0.67 O ATOM 968 CB THR A 86 -12.736 -6.019 -2.211 1.00 1.02 C ATOM 969 OG1 THR A 86 -12.821 -5.294 -3.410 1.00 2.90 O ATOM 970 CG2 THR A 86 -13.975 -6.887 -2.057 1.00 1.73 C ATOM 0 H THR A 86 -12.043 -6.721 0.122 1.00 0.55 H new ATOM 0 HA THR A 86 -11.784 -4.327 -1.338 1.00 0.68 H new ATOM 0 HB THR A 86 -11.873 -6.685 -2.218 1.00 1.02 H new ATOM 0 HG1 THR A 86 -12.933 -5.914 -4.160 1.00 2.90 H new ATOM 0 HG21 THR A 86 -14.053 -7.564 -2.908 1.00 1.73 H new ATOM 0 HG22 THR A 86 -13.901 -7.467 -1.137 1.00 1.73 H new ATOM 0 HG23 THR A 86 -14.861 -6.253 -2.015 1.00 1.73 H new ATOM 978 N ASN A 87 -14.576 -4.451 0.251 1.00 0.58 N ATOM 979 CA ASN A 87 -15.698 -3.627 0.737 1.00 0.61 C ATOM 980 C ASN A 87 -15.263 -2.527 1.744 1.00 0.53 C ATOM 981 O ASN A 87 -16.059 -2.036 2.546 1.00 0.62 O ATOM 982 CB ASN A 87 -16.796 -4.561 1.276 1.00 0.85 C ATOM 983 CG ASN A 87 -17.300 -5.534 0.223 1.00 1.45 C ATOM 984 OD1 ASN A 87 -17.728 -5.158 -0.862 1.00 1.76 O ATOM 985 ND2 ASN A 87 -17.206 -6.818 0.478 1.00 2.26 N ATOM 0 H ASN A 87 -14.431 -5.289 0.815 1.00 0.58 H new ATOM 0 HA ASN A 87 -16.106 -3.056 -0.097 1.00 0.61 H new ATOM 0 HB2 ASN A 87 -16.407 -5.121 2.127 1.00 0.85 H new ATOM 0 HB3 ASN A 87 -17.630 -3.963 1.642 1.00 0.85 H new ATOM 0 HD21 ASN A 87 -17.489 -7.500 -0.226 1.00 2.26 H new ATOM 0 HD22 ASN A 87 -16.850 -7.134 1.380 1.00 2.26 H new ATOM 992 N ASN A 88 -13.976 -2.166 1.722 1.00 0.49 N ATOM 993 CA ASN A 88 -13.307 -1.104 2.480 1.00 0.52 C ATOM 994 C ASN A 88 -13.452 -1.215 4.015 1.00 0.52 C ATOM 995 O ASN A 88 -13.416 -0.209 4.719 1.00 0.56 O ATOM 996 CB ASN A 88 -13.645 0.290 1.907 1.00 0.54 C ATOM 997 CG ASN A 88 -14.052 0.308 0.445 1.00 0.57 C ATOM 998 OD1 ASN A 88 -13.130 0.424 -0.472 1.00 0.65 O flip ATOM 999 ND2 ASN A 88 -15.222 0.212 0.109 1.00 0.61 N flip ATOM 0 H ASN A 88 -13.316 -2.655 1.118 1.00 0.49 H new ATOM 0 HA ASN A 88 -12.237 -1.252 2.334 1.00 0.52 H new ATOM 0 HB2 ASN A 88 -14.453 0.721 2.498 1.00 0.54 H new ATOM 0 HB3 ASN A 88 -12.777 0.937 2.034 1.00 0.54 H new ATOM 0 HD21 ASN A 88 -15.950 0.121 0.817 1.00 0.61 H new ATOM 0 HD22 ASN A 88 -15.471 0.223 -0.880 1.00 0.61 H new ATOM 1006 N GLU A 89 -13.629 -2.430 4.545 1.00 0.51 N ATOM 1007 CA GLU A 89 -13.624 -2.706 5.989 1.00 0.51 C ATOM 1008 C GLU A 89 -12.192 -2.854 6.495 1.00 0.44 C ATOM 1009 O GLU A 89 -11.386 -3.498 5.825 1.00 0.38 O ATOM 1010 CB GLU A 89 -14.395 -3.995 6.337 1.00 0.55 C ATOM 1011 CG GLU A 89 -15.886 -3.719 6.590 1.00 0.65 C ATOM 1012 CD GLU A 89 -16.617 -4.903 7.245 1.00 1.09 C ATOM 1013 OE1 GLU A 89 -16.408 -5.156 8.457 1.00 2.16 O ATOM 1014 OE2 GLU A 89 -17.482 -5.539 6.599 1.00 1.71 O ATOM 0 H GLU A 89 -13.782 -3.263 3.976 1.00 0.51 H new ATOM 0 HA GLU A 89 -14.117 -1.861 6.471 1.00 0.51 H new ATOM 0 HB2 GLU A 89 -14.291 -4.711 5.522 1.00 0.55 H new ATOM 0 HB3 GLU A 89 -13.955 -4.454 7.223 1.00 0.55 H new ATOM 0 HG2 GLU A 89 -15.983 -2.841 7.229 1.00 0.65 H new ATOM 0 HG3 GLU A 89 -16.371 -3.479 5.643 1.00 0.65 H new ATOM 1021 N ILE A 90 -11.888 -2.330 7.685 1.00 0.45 N ATOM 1022 CA ILE A 90 -10.564 -2.473 8.296 1.00 0.41 C ATOM 1023 C ILE A 90 -10.420 -3.889 8.862 1.00 0.38 C ATOM 1024 O ILE A 90 -11.250 -4.325 9.663 1.00 0.43 O ATOM 1025 CB ILE A 90 -10.293 -1.407 9.377 1.00 0.49 C ATOM 1026 CG1 ILE A 90 -10.659 0.008 8.878 1.00 0.51 C ATOM 1027 CG2 ILE A 90 -8.805 -1.491 9.774 1.00 0.51 C ATOM 1028 CD1 ILE A 90 -10.315 1.118 9.873 1.00 0.59 C ATOM 0 H ILE A 90 -12.549 -1.797 8.250 1.00 0.45 H new ATOM 0 HA ILE A 90 -9.813 -2.312 7.522 1.00 0.41 H new ATOM 0 HB ILE A 90 -10.920 -1.601 10.247 1.00 0.49 H new ATOM 0 HG12 ILE A 90 -10.138 0.199 7.940 1.00 0.51 H new ATOM 0 HG13 ILE A 90 -11.727 0.043 8.663 1.00 0.51 H new ATOM 0 HG21 ILE A 90 -8.590 -0.745 10.539 1.00 0.51 H new ATOM 0 HG22 ILE A 90 -8.588 -2.485 10.166 1.00 0.51 H new ATOM 0 HG23 ILE A 90 -8.184 -1.303 8.898 1.00 0.51 H new ATOM 0 HD11 ILE A 90 -10.600 2.083 9.454 1.00 0.59 H new ATOM 0 HD12 ILE A 90 -10.856 0.952 10.804 1.00 0.59 H new ATOM 0 HD13 ILE A 90 -9.243 1.111 10.070 1.00 0.59 H new ATOM 1040 N ILE A 91 -9.364 -4.594 8.455 1.00 0.32 N ATOM 1041 CA ILE A 91 -9.092 -5.985 8.850 1.00 0.30 C ATOM 1042 C ILE A 91 -7.734 -6.201 9.553 1.00 0.32 C ATOM 1043 O ILE A 91 -6.795 -5.416 9.425 1.00 0.32 O ATOM 1044 CB ILE A 91 -9.300 -6.949 7.659 1.00 0.28 C ATOM 1045 CG1 ILE A 91 -8.253 -6.789 6.535 1.00 0.26 C ATOM 1046 CG2 ILE A 91 -10.685 -6.769 7.030 1.00 0.30 C ATOM 1047 CD1 ILE A 91 -7.889 -8.139 5.919 1.00 0.52 C ATOM 0 H ILE A 91 -8.657 -4.210 7.828 1.00 0.32 H new ATOM 0 HA ILE A 91 -9.828 -6.224 9.617 1.00 0.30 H new ATOM 0 HB ILE A 91 -9.192 -7.943 8.092 1.00 0.28 H new ATOM 0 HG12 ILE A 91 -8.644 -6.128 5.762 1.00 0.26 H new ATOM 0 HG13 ILE A 91 -7.356 -6.316 6.935 1.00 0.26 H new ATOM 0 HG21 ILE A 91 -10.799 -7.461 6.196 1.00 0.30 H new ATOM 0 HG22 ILE A 91 -11.453 -6.971 7.777 1.00 0.30 H new ATOM 0 HG23 ILE A 91 -10.791 -5.746 6.669 1.00 0.30 H new ATOM 0 HD11 ILE A 91 -7.150 -7.992 5.131 1.00 0.52 H new ATOM 0 HD12 ILE A 91 -7.474 -8.790 6.689 1.00 0.52 H new ATOM 0 HD13 ILE A 91 -8.783 -8.599 5.497 1.00 0.52 H new ATOM 1059 N ASP A 92 -7.657 -7.281 10.326 1.00 0.38 N ATOM 1060 CA ASP A 92 -6.451 -7.872 10.925 1.00 0.43 C ATOM 1061 C ASP A 92 -5.837 -8.920 9.963 1.00 0.47 C ATOM 1062 O ASP A 92 -6.502 -9.405 9.046 1.00 0.47 O ATOM 1063 CB ASP A 92 -6.896 -8.455 12.277 1.00 0.44 C ATOM 1064 CG ASP A 92 -5.833 -8.946 13.258 1.00 0.58 C ATOM 1065 OD1 ASP A 92 -4.658 -9.147 12.878 1.00 1.36 O ATOM 1066 OD2 ASP A 92 -6.195 -9.170 14.439 1.00 1.57 O ATOM 0 H ASP A 92 -8.494 -7.809 10.572 1.00 0.38 H new ATOM 0 HA ASP A 92 -5.657 -7.144 11.091 1.00 0.43 H new ATOM 0 HB2 ASP A 92 -7.486 -7.693 12.786 1.00 0.44 H new ATOM 0 HB3 ASP A 92 -7.565 -9.291 12.071 1.00 0.44 H new ATOM 1071 N GLU A 93 -4.585 -9.323 10.179 1.00 0.56 N ATOM 1072 CA GLU A 93 -3.771 -10.129 9.236 1.00 0.56 C ATOM 1073 C GLU A 93 -4.209 -11.591 9.018 1.00 0.60 C ATOM 1074 O GLU A 93 -3.571 -12.326 8.266 1.00 0.63 O ATOM 1075 CB GLU A 93 -2.260 -9.990 9.514 1.00 0.67 C ATOM 1076 CG GLU A 93 -1.741 -10.674 10.788 1.00 0.78 C ATOM 1077 CD GLU A 93 -0.207 -10.609 10.891 1.00 1.29 C ATOM 1078 OE1 GLU A 93 0.349 -9.485 11.011 1.00 1.93 O ATOM 1079 OE2 GLU A 93 0.456 -11.678 10.896 1.00 2.40 O ATOM 0 H GLU A 93 -4.083 -9.097 11.038 1.00 0.56 H new ATOM 0 HA GLU A 93 -3.982 -9.676 8.267 1.00 0.56 H new ATOM 0 HB2 GLU A 93 -1.716 -10.395 8.661 1.00 0.67 H new ATOM 0 HB3 GLU A 93 -2.018 -8.929 9.572 1.00 0.67 H new ATOM 0 HG2 GLU A 93 -2.184 -10.197 11.662 1.00 0.78 H new ATOM 0 HG3 GLU A 93 -2.061 -11.716 10.797 1.00 0.78 H new ATOM 1086 N ASN A 94 -5.313 -12.019 9.636 1.00 0.74 N ATOM 1087 CA ASN A 94 -6.007 -13.280 9.359 1.00 0.87 C ATOM 1088 C ASN A 94 -7.389 -13.106 8.688 1.00 0.79 C ATOM 1089 O ASN A 94 -8.059 -14.102 8.420 1.00 0.94 O ATOM 1090 CB ASN A 94 -6.050 -14.154 10.608 1.00 1.10 C ATOM 1091 CG ASN A 94 -6.960 -13.550 11.634 1.00 1.73 C ATOM 1092 OD1 ASN A 94 -8.152 -13.828 11.702 1.00 2.84 O ATOM 1093 ND2 ASN A 94 -6.428 -12.645 12.400 1.00 1.66 N ATOM 0 H ASN A 94 -5.766 -11.476 10.371 1.00 0.74 H new ATOM 0 HA ASN A 94 -5.419 -13.804 8.606 1.00 0.87 H new ATOM 0 HB2 ASN A 94 -6.397 -15.154 10.348 1.00 1.10 H new ATOM 0 HB3 ASN A 94 -5.047 -14.261 11.020 1.00 1.10 H new ATOM 0 HD21 ASN A 94 -7.005 -12.147 13.078 1.00 1.66 H new ATOM 0 HD22 ASN A 94 -5.433 -12.433 12.323 1.00 1.66 H new ATOM 1100 N GLY A 95 -7.816 -11.868 8.410 1.00 0.62 N ATOM 1101 CA GLY A 95 -9.081 -11.538 7.743 1.00 0.58 C ATOM 1102 C GLY A 95 -10.250 -11.185 8.673 1.00 0.55 C ATOM 1103 O GLY A 95 -11.340 -10.904 8.174 1.00 0.59 O ATOM 0 H GLY A 95 -7.271 -11.040 8.652 1.00 0.62 H new ATOM 0 HA2 GLY A 95 -8.908 -10.697 7.071 1.00 0.58 H new ATOM 0 HA3 GLY A 95 -9.376 -12.385 7.124 1.00 0.58 H new ATOM 1107 N GLN A 96 -10.038 -11.139 9.997 1.00 0.57 N ATOM 1108 CA GLN A 96 -11.029 -10.637 10.958 1.00 0.55 C ATOM 1109 C GLN A 96 -11.251 -9.147 10.708 1.00 0.49 C ATOM 1110 O GLN A 96 -10.280 -8.392 10.656 1.00 0.41 O ATOM 1111 CB GLN A 96 -10.538 -10.846 12.405 1.00 0.57 C ATOM 1112 CG GLN A 96 -11.419 -10.179 13.486 1.00 0.59 C ATOM 1113 CD GLN A 96 -12.784 -10.835 13.671 1.00 1.97 C ATOM 1114 OE1 GLN A 96 -12.897 -12.001 14.033 1.00 2.88 O ATOM 1115 NE2 GLN A 96 -13.859 -10.110 13.466 1.00 2.85 N ATOM 0 H GLN A 96 -9.170 -11.451 10.432 1.00 0.57 H new ATOM 0 HA GLN A 96 -11.962 -11.185 10.826 1.00 0.55 H new ATOM 0 HB2 GLN A 96 -10.487 -11.916 12.606 1.00 0.57 H new ATOM 0 HB3 GLN A 96 -9.524 -10.456 12.490 1.00 0.57 H new ATOM 0 HG2 GLN A 96 -10.886 -10.200 14.437 1.00 0.59 H new ATOM 0 HG3 GLN A 96 -11.564 -9.131 13.225 1.00 0.59 H new ATOM 0 HE21 GLN A 96 -13.770 -9.140 13.165 1.00 2.85 H new ATOM 0 HE22 GLN A 96 -14.783 -10.517 13.608 1.00 2.85 H new ATOM 1124 N THR A 97 -12.503 -8.703 10.634 1.00 0.57 N ATOM 1125 CA THR A 97 -12.828 -7.284 10.464 1.00 0.46 C ATOM 1126 C THR A 97 -13.124 -6.613 11.808 1.00 0.52 C ATOM 1127 O THR A 97 -13.702 -7.228 12.714 1.00 0.69 O ATOM 1128 CB THR A 97 -13.896 -7.049 9.391 1.00 0.58 C ATOM 1129 OG1 THR A 97 -15.186 -6.991 9.933 1.00 0.92 O ATOM 1130 CG2 THR A 97 -13.916 -8.084 8.261 1.00 0.53 C ATOM 0 H THR A 97 -13.320 -9.311 10.690 1.00 0.57 H new ATOM 0 HA THR A 97 -11.941 -6.784 10.075 1.00 0.46 H new ATOM 0 HB THR A 97 -13.607 -6.089 8.964 1.00 0.58 H new ATOM 0 HG1 THR A 97 -15.631 -6.172 9.630 1.00 0.92 H new ATOM 0 HG21 THR A 97 -14.705 -7.833 7.552 1.00 0.53 H new ATOM 0 HG22 THR A 97 -12.954 -8.083 7.749 1.00 0.53 H new ATOM 0 HG23 THR A 97 -14.104 -9.074 8.677 1.00 0.53 H new ATOM 1138 N LEU A 98 -12.690 -5.360 11.963 1.00 0.49 N ATOM 1139 CA LEU A 98 -12.666 -4.640 13.245 1.00 0.63 C ATOM 1140 C LEU A 98 -13.983 -3.903 13.584 1.00 0.78 C ATOM 1141 O LEU A 98 -14.161 -3.468 14.723 1.00 1.10 O ATOM 1142 CB LEU A 98 -11.460 -3.666 13.238 1.00 0.60 C ATOM 1143 CG LEU A 98 -10.056 -4.240 13.545 1.00 0.53 C ATOM 1144 CD1 LEU A 98 -9.940 -4.860 14.938 1.00 0.66 C ATOM 1145 CD2 LEU A 98 -9.560 -5.278 12.541 1.00 0.38 C ATOM 0 H LEU A 98 -12.337 -4.803 11.185 1.00 0.49 H new ATOM 0 HA LEU A 98 -12.558 -5.381 14.037 1.00 0.63 H new ATOM 0 HB2 LEU A 98 -11.419 -3.193 12.257 1.00 0.60 H new ATOM 0 HB3 LEU A 98 -11.664 -2.878 13.963 1.00 0.60 H new ATOM 0 HG LEU A 98 -9.427 -3.353 13.477 1.00 0.53 H new ATOM 0 HD11 LEU A 98 -8.929 -5.242 15.083 1.00 0.66 H new ATOM 0 HD12 LEU A 98 -10.154 -4.103 15.692 1.00 0.66 H new ATOM 0 HD13 LEU A 98 -10.654 -5.678 15.033 1.00 0.66 H new ATOM 0 HD21 LEU A 98 -8.569 -5.625 12.835 1.00 0.38 H new ATOM 0 HD22 LEU A 98 -10.249 -6.123 12.521 1.00 0.38 H new ATOM 0 HD23 LEU A 98 -9.507 -4.829 11.549 1.00 0.38 H new ATOM 1157 N GLY A 99 -14.903 -3.752 12.627 1.00 0.61 N ATOM 1158 CA GLY A 99 -16.160 -2.997 12.773 1.00 0.68 C ATOM 1159 C GLY A 99 -16.087 -1.540 12.295 1.00 0.70 C ATOM 1160 O GLY A 99 -16.862 -0.694 12.749 1.00 0.78 O ATOM 0 H GLY A 99 -14.794 -4.163 11.700 1.00 0.61 H new ATOM 0 HA2 GLY A 99 -16.944 -3.510 12.216 1.00 0.68 H new ATOM 0 HA3 GLY A 99 -16.456 -3.008 13.822 1.00 0.68 H new ATOM 1164 N VAL A 100 -15.138 -1.220 11.408 1.00 0.64 N ATOM 1165 CA VAL A 100 -14.920 0.124 10.837 1.00 0.65 C ATOM 1166 C VAL A 100 -14.706 0.027 9.321 1.00 0.62 C ATOM 1167 O VAL A 100 -14.181 -0.974 8.825 1.00 0.59 O ATOM 1168 CB VAL A 100 -13.737 0.839 11.532 1.00 0.66 C ATOM 1169 CG1 VAL A 100 -13.551 2.285 11.043 1.00 1.07 C ATOM 1170 CG2 VAL A 100 -13.915 0.913 13.057 1.00 1.26 C ATOM 0 H VAL A 100 -14.476 -1.909 11.053 1.00 0.64 H new ATOM 0 HA VAL A 100 -15.811 0.726 11.016 1.00 0.65 H new ATOM 0 HB VAL A 100 -12.867 0.236 11.274 1.00 0.66 H new ATOM 0 HG11 VAL A 100 -12.708 2.739 11.563 1.00 1.07 H new ATOM 0 HG12 VAL A 100 -13.358 2.284 9.970 1.00 1.07 H new ATOM 0 HG13 VAL A 100 -14.455 2.858 11.248 1.00 1.07 H new ATOM 0 HG21 VAL A 100 -13.059 1.423 13.499 1.00 1.26 H new ATOM 0 HG22 VAL A 100 -14.826 1.464 13.291 1.00 1.26 H new ATOM 0 HG23 VAL A 100 -13.986 -0.096 13.464 1.00 1.26 H new ATOM 1180 N ASN A 101 -15.106 1.065 8.588 1.00 0.64 N ATOM 1181 CA ASN A 101 -15.015 1.249 7.158 1.00 0.59 C ATOM 1182 C ASN A 101 -14.354 2.597 6.808 1.00 0.59 C ATOM 1183 O ASN A 101 -14.368 3.533 7.612 1.00 0.64 O ATOM 1184 CB ASN A 101 -16.465 1.170 6.657 1.00 0.61 C ATOM 1185 CG ASN A 101 -16.622 1.718 5.269 1.00 0.78 C ATOM 1186 OD1 ASN A 101 -16.934 2.885 5.071 1.00 1.29 O ATOM 1187 ND2 ASN A 101 -16.284 0.956 4.268 1.00 0.76 N ATOM 0 H ASN A 101 -15.543 1.872 9.034 1.00 0.64 H new ATOM 0 HA ASN A 101 -14.388 0.494 6.684 1.00 0.59 H new ATOM 0 HB2 ASN A 101 -16.796 0.132 6.674 1.00 0.61 H new ATOM 0 HB3 ASN A 101 -17.112 1.722 7.338 1.00 0.61 H new ATOM 0 HD21 ASN A 101 -16.279 1.332 3.320 1.00 0.76 H new ATOM 0 HD22 ASN A 101 -16.024 -0.016 4.432 1.00 0.76 H new ATOM 1194 N ILE A 102 -13.798 2.689 5.596 1.00 0.56 N ATOM 1195 CA ILE A 102 -13.090 3.866 5.070 1.00 0.56 C ATOM 1196 C ILE A 102 -13.557 4.174 3.635 1.00 0.59 C ATOM 1197 O ILE A 102 -13.500 3.306 2.764 1.00 0.63 O ATOM 1198 CB ILE A 102 -11.554 3.647 5.144 1.00 0.54 C ATOM 1199 CG1 ILE A 102 -11.081 3.257 6.568 1.00 0.55 C ATOM 1200 CG2 ILE A 102 -10.858 4.945 4.711 1.00 0.57 C ATOM 1201 CD1 ILE A 102 -9.621 2.793 6.671 1.00 0.56 C ATOM 0 H ILE A 102 -13.828 1.919 4.928 1.00 0.56 H new ATOM 0 HA ILE A 102 -13.329 4.733 5.686 1.00 0.56 H new ATOM 0 HB ILE A 102 -11.295 2.821 4.482 1.00 0.54 H new ATOM 0 HG12 ILE A 102 -11.220 4.115 7.226 1.00 0.55 H new ATOM 0 HG13 ILE A 102 -11.725 2.461 6.941 1.00 0.55 H new ATOM 0 HG21 ILE A 102 -9.777 4.811 4.756 1.00 0.57 H new ATOM 0 HG22 ILE A 102 -11.151 5.192 3.690 1.00 0.57 H new ATOM 0 HG23 ILE A 102 -11.151 5.755 5.378 1.00 0.57 H new ATOM 0 HD11 ILE A 102 -9.391 2.544 7.707 1.00 0.56 H new ATOM 0 HD12 ILE A 102 -9.474 1.913 6.045 1.00 0.56 H new ATOM 0 HD13 ILE A 102 -8.961 3.592 6.334 1.00 0.56 H new ATOM 1213 N ASP A 103 -13.987 5.409 3.351 1.00 0.70 N ATOM 1214 CA ASP A 103 -14.386 5.807 1.986 1.00 0.77 C ATOM 1215 C ASP A 103 -13.164 5.853 1.042 1.00 0.69 C ATOM 1216 O ASP A 103 -12.143 6.422 1.435 1.00 0.65 O ATOM 1217 CB ASP A 103 -15.016 7.208 1.989 1.00 0.91 C ATOM 1218 CG ASP A 103 -15.981 7.401 0.827 1.00 1.06 C ATOM 1219 OD1 ASP A 103 -15.487 7.704 -0.283 1.00 1.77 O ATOM 1220 OD2 ASP A 103 -17.215 7.245 1.002 1.00 2.33 O ATOM 0 H ASP A 103 -14.069 6.153 4.044 1.00 0.70 H new ATOM 0 HA ASP A 103 -15.105 5.065 1.638 1.00 0.77 H new ATOM 0 HB2 ASP A 103 -15.544 7.366 2.929 1.00 0.91 H new ATOM 0 HB3 ASP A 103 -14.229 7.960 1.935 1.00 0.91 H new ATOM 1225 N PRO A 104 -13.216 5.369 -0.217 1.00 0.71 N ATOM 1226 CA PRO A 104 -12.075 5.485 -1.130 1.00 0.65 C ATOM 1227 C PRO A 104 -11.833 6.912 -1.640 1.00 0.74 C ATOM 1228 O PRO A 104 -10.781 7.190 -2.205 1.00 0.77 O ATOM 1229 CB PRO A 104 -12.361 4.502 -2.259 1.00 0.69 C ATOM 1230 CG PRO A 104 -13.886 4.433 -2.315 1.00 0.79 C ATOM 1231 CD PRO A 104 -14.347 4.734 -0.888 1.00 0.85 C ATOM 0 HA PRO A 104 -11.145 5.248 -0.612 1.00 0.65 H new ATOM 0 HB2 PRO A 104 -11.943 4.848 -3.204 1.00 0.69 H new ATOM 0 HB3 PRO A 104 -11.925 3.524 -2.056 1.00 0.69 H new ATOM 0 HG2 PRO A 104 -14.289 5.159 -3.021 1.00 0.79 H new ATOM 0 HG3 PRO A 104 -14.225 3.450 -2.640 1.00 0.79 H new ATOM 0 HD2 PRO A 104 -15.216 5.391 -0.891 1.00 0.85 H new ATOM 0 HD3 PRO A 104 -14.641 3.819 -0.373 1.00 0.85 H new ATOM 1239 N GLN A 105 -12.802 7.814 -1.485 1.00 0.84 N ATOM 1240 CA GLN A 105 -12.745 9.210 -1.921 1.00 0.95 C ATOM 1241 C GLN A 105 -12.343 10.141 -0.769 1.00 0.99 C ATOM 1242 O GLN A 105 -11.437 10.959 -0.915 1.00 1.04 O ATOM 1243 CB GLN A 105 -14.096 9.593 -2.543 1.00 1.06 C ATOM 1244 CG GLN A 105 -14.651 8.541 -3.504 1.00 1.14 C ATOM 1245 CD GLN A 105 -13.845 8.310 -4.778 1.00 1.22 C ATOM 1246 OE1 GLN A 105 -12.638 7.792 -4.697 1.00 2.15 O flip ATOM 1247 NE2 GLN A 105 -14.302 8.582 -5.881 1.00 0.90 N flip ATOM 0 H GLN A 105 -13.686 7.582 -1.033 1.00 0.84 H new ATOM 0 HA GLN A 105 -11.971 9.325 -2.680 1.00 0.95 H new ATOM 0 HB2 GLN A 105 -14.819 9.760 -1.745 1.00 1.06 H new ATOM 0 HB3 GLN A 105 -13.986 10.537 -3.076 1.00 1.06 H new ATOM 0 HG2 GLN A 105 -14.729 7.594 -2.970 1.00 1.14 H new ATOM 0 HG3 GLN A 105 -15.663 8.832 -3.785 1.00 1.14 H new ATOM 0 HE21 GLN A 105 -15.236 8.984 -5.961 1.00 0.90 H new ATOM 0 HE22 GLN A 105 -13.749 8.406 -6.720 1.00 0.90 H new ATOM 1256 N THR A 106 -12.977 9.980 0.396 1.00 0.98 N ATOM 1257 CA THR A 106 -12.809 10.859 1.577 1.00 1.05 C ATOM 1258 C THR A 106 -11.698 10.401 2.524 1.00 1.00 C ATOM 1259 O THR A 106 -11.183 11.193 3.316 1.00 1.12 O ATOM 1260 CB THR A 106 -14.130 10.982 2.363 1.00 1.13 C ATOM 1261 OG1 THR A 106 -14.347 9.872 3.187 1.00 1.07 O ATOM 1262 CG2 THR A 106 -15.335 11.106 1.438 1.00 1.15 C ATOM 0 H THR A 106 -13.638 9.220 0.557 1.00 0.98 H new ATOM 0 HA THR A 106 -12.517 11.831 1.180 1.00 1.05 H new ATOM 0 HB THR A 106 -14.028 11.885 2.965 1.00 1.13 H new ATOM 0 HG1 THR A 106 -15.258 9.905 3.547 1.00 1.07 H new ATOM 0 HG21 THR A 106 -16.244 11.190 2.034 1.00 1.15 H new ATOM 0 HG22 THR A 106 -15.226 11.994 0.815 1.00 1.15 H new ATOM 0 HG23 THR A 106 -15.398 10.223 0.803 1.00 1.15 H new ATOM 1270 N PHE A 107 -11.345 9.111 2.458 1.00 0.86 N ATOM 1271 CA PHE A 107 -10.432 8.425 3.385 1.00 0.80 C ATOM 1272 C PHE A 107 -10.863 8.513 4.873 1.00 0.87 C ATOM 1273 O PHE A 107 -10.054 8.235 5.762 1.00 0.90 O ATOM 1274 CB PHE A 107 -8.967 8.855 3.117 1.00 0.86 C ATOM 1275 CG PHE A 107 -8.169 8.132 2.036 1.00 0.75 C ATOM 1276 CD1 PHE A 107 -8.746 7.272 1.075 1.00 1.74 C ATOM 1277 CD2 PHE A 107 -6.770 8.313 2.029 1.00 1.61 C ATOM 1278 CE1 PHE A 107 -7.927 6.575 0.178 1.00 1.67 C ATOM 1279 CE2 PHE A 107 -5.956 7.640 1.102 1.00 1.66 C ATOM 1280 CZ PHE A 107 -6.534 6.753 0.180 1.00 0.72 C ATOM 0 H PHE A 107 -11.701 8.491 1.730 1.00 0.86 H new ATOM 0 HA PHE A 107 -10.494 7.357 3.177 1.00 0.80 H new ATOM 0 HB2 PHE A 107 -8.976 9.915 2.865 1.00 0.86 H new ATOM 0 HB3 PHE A 107 -8.418 8.755 4.053 1.00 0.86 H new ATOM 0 HD1 PHE A 107 -9.818 7.152 1.032 1.00 1.74 H new ATOM 0 HD2 PHE A 107 -6.317 8.980 2.748 1.00 1.61 H new ATOM 0 HE1 PHE A 107 -8.374 5.889 -0.527 1.00 1.67 H new ATOM 0 HE2 PHE A 107 -4.889 7.805 1.099 1.00 1.66 H new ATOM 0 HZ PHE A 107 -5.914 6.213 -0.520 1.00 0.72 H new ATOM 1290 N LYS A 108 -12.122 8.875 5.173 1.00 0.91 N ATOM 1291 CA LYS A 108 -12.616 9.075 6.549 1.00 0.95 C ATOM 1292 C LYS A 108 -13.234 7.808 7.158 1.00 0.91 C ATOM 1293 O LYS A 108 -13.869 7.004 6.466 1.00 0.96 O ATOM 1294 CB LYS A 108 -13.516 10.328 6.620 1.00 1.06 C ATOM 1295 CG LYS A 108 -14.981 10.068 6.231 1.00 1.09 C ATOM 1296 CD LYS A 108 -15.905 9.844 7.437 1.00 1.42 C ATOM 1297 CE LYS A 108 -17.036 8.890 7.040 1.00 1.99 C ATOM 1298 NZ LYS A 108 -18.234 9.061 7.886 1.00 2.79 N ATOM 0 H LYS A 108 -12.834 9.039 4.461 1.00 0.91 H new ATOM 0 HA LYS A 108 -11.760 9.272 7.194 1.00 0.95 H new ATOM 0 HB2 LYS A 108 -13.485 10.728 7.634 1.00 1.06 H new ATOM 0 HB3 LYS A 108 -13.107 11.095 5.962 1.00 1.06 H new ATOM 0 HG2 LYS A 108 -15.351 10.915 5.653 1.00 1.09 H new ATOM 0 HG3 LYS A 108 -15.026 9.194 5.581 1.00 1.09 H new ATOM 0 HD2 LYS A 108 -15.339 9.428 8.271 1.00 1.42 H new ATOM 0 HD3 LYS A 108 -16.318 10.795 7.775 1.00 1.42 H new ATOM 0 HE2 LYS A 108 -17.303 9.060 5.997 1.00 1.99 H new ATOM 0 HE3 LYS A 108 -16.684 7.861 7.115 1.00 1.99 H new ATOM 0 HZ1 LYS A 108 -18.972 8.395 7.581 1.00 2.79 H new ATOM 0 HZ2 LYS A 108 -17.988 8.873 8.879 1.00 2.79 H new ATOM 0 HZ3 LYS A 108 -18.587 10.035 7.795 1.00 2.79 H new ATOM 1312 N LEU A 109 -13.062 7.649 8.467 1.00 0.87 N ATOM 1313 CA LEU A 109 -13.483 6.474 9.236 1.00 0.86 C ATOM 1314 C LEU A 109 -14.976 6.514 9.610 1.00 0.90 C ATOM 1315 O LEU A 109 -15.505 7.557 9.997 1.00 0.96 O ATOM 1316 CB LEU A 109 -12.606 6.378 10.500 1.00 0.86 C ATOM 1317 CG LEU A 109 -11.124 6.070 10.212 1.00 0.83 C ATOM 1318 CD1 LEU A 109 -10.214 6.514 11.354 1.00 0.90 C ATOM 1319 CD2 LEU A 109 -10.914 4.569 10.058 1.00 0.75 C ATOM 0 H LEU A 109 -12.610 8.358 9.045 1.00 0.87 H new ATOM 0 HA LEU A 109 -13.352 5.589 8.613 1.00 0.86 H new ATOM 0 HB2 LEU A 109 -12.671 7.318 11.047 1.00 0.86 H new ATOM 0 HB3 LEU A 109 -13.008 5.602 11.151 1.00 0.86 H new ATOM 0 HG LEU A 109 -10.875 6.611 9.299 1.00 0.83 H new ATOM 0 HD11 LEU A 109 -9.179 6.277 11.108 1.00 0.90 H new ATOM 0 HD12 LEU A 109 -10.315 7.589 11.503 1.00 0.90 H new ATOM 0 HD13 LEU A 109 -10.497 5.993 12.269 1.00 0.90 H new ATOM 0 HD21 LEU A 109 -9.862 4.368 9.855 1.00 0.75 H new ATOM 0 HD22 LEU A 109 -11.209 4.064 10.978 1.00 0.75 H new ATOM 0 HD23 LEU A 109 -11.520 4.200 9.231 1.00 0.75 H new ATOM 1331 N SER A 110 -15.641 5.357 9.588 1.00 0.89 N ATOM 1332 CA SER A 110 -17.032 5.172 10.061 1.00 0.95 C ATOM 1333 C SER A 110 -17.179 5.091 11.598 1.00 1.08 C ATOM 1334 O SER A 110 -18.271 4.816 12.109 1.00 1.31 O ATOM 1335 CB SER A 110 -17.633 3.921 9.409 1.00 0.94 C ATOM 1336 OG SER A 110 -16.991 2.770 9.917 1.00 1.37 O ATOM 0 H SER A 110 -15.225 4.496 9.234 1.00 0.89 H new ATOM 0 HA SER A 110 -17.577 6.067 9.761 1.00 0.95 H new ATOM 0 HB2 SER A 110 -18.703 3.872 9.610 1.00 0.94 H new ATOM 0 HB3 SER A 110 -17.514 3.969 8.327 1.00 0.94 H new ATOM 0 HG SER A 110 -17.376 1.970 9.502 1.00 1.37 H new ATOM 1342 N GLY A 111 -16.080 5.283 12.334 1.00 1.04 N ATOM 1343 CA GLY A 111 -15.987 5.172 13.792 1.00 1.14 C ATOM 1344 C GLY A 111 -14.566 5.430 14.308 1.00 1.16 C ATOM 1345 O GLY A 111 -13.734 6.004 13.599 1.00 1.16 O ATOM 0 H GLY A 111 -15.188 5.532 11.908 1.00 1.04 H new ATOM 0 HA2 GLY A 111 -16.673 5.883 14.252 1.00 1.14 H new ATOM 0 HA3 GLY A 111 -16.307 4.176 14.099 1.00 1.14 H new ATOM 1349 N ALA A 112 -14.277 5.016 15.542 1.00 1.23 N ATOM 1350 CA ALA A 112 -12.977 5.236 16.183 1.00 1.24 C ATOM 1351 C ALA A 112 -11.855 4.343 15.633 1.00 1.08 C ATOM 1352 O ALA A 112 -12.091 3.218 15.184 1.00 1.06 O ATOM 1353 CB ALA A 112 -13.115 5.027 17.690 1.00 1.39 C ATOM 0 H ALA A 112 -14.942 4.515 16.131 1.00 1.23 H new ATOM 0 HA ALA A 112 -12.686 6.262 15.957 1.00 1.24 H new ATOM 0 HB1 ALA A 112 -12.150 5.190 18.170 1.00 1.39 H new ATOM 0 HB2 ALA A 112 -13.843 5.733 18.090 1.00 1.39 H new ATOM 0 HB3 ALA A 112 -13.451 4.009 17.887 1.00 1.39 H new ATOM 1359 N MET A 113 -10.613 4.816 15.764 1.00 1.04 N ATOM 1360 CA MET A 113 -9.403 4.068 15.420 1.00 0.95 C ATOM 1361 C MET A 113 -9.361 2.665 16.079 1.00 0.88 C ATOM 1362 O MET A 113 -9.723 2.536 17.254 1.00 1.04 O ATOM 1363 CB MET A 113 -8.176 4.892 15.832 1.00 1.10 C ATOM 1364 CG MET A 113 -7.993 6.159 14.979 1.00 1.89 C ATOM 1365 SD MET A 113 -6.326 6.422 14.311 1.00 2.13 S ATOM 1366 CE MET A 113 -6.291 5.170 13.002 1.00 1.56 C ATOM 0 H MET A 113 -10.417 5.751 16.121 1.00 1.04 H new ATOM 0 HA MET A 113 -9.403 3.902 14.343 1.00 0.95 H new ATOM 0 HB2 MET A 113 -8.270 5.176 16.880 1.00 1.10 H new ATOM 0 HB3 MET A 113 -7.283 4.272 15.749 1.00 1.10 H new ATOM 0 HG2 MET A 113 -8.696 6.120 14.147 1.00 1.89 H new ATOM 0 HG3 MET A 113 -8.263 7.025 15.584 1.00 1.89 H new ATOM 0 HE1 MET A 113 -5.447 5.360 12.339 1.00 1.56 H new ATOM 0 HE2 MET A 113 -6.187 4.181 13.447 1.00 1.56 H new ATOM 0 HE3 MET A 113 -7.218 5.215 12.431 1.00 1.56 H new ATOM 1376 N PRO A 114 -8.931 1.614 15.348 1.00 0.72 N ATOM 1377 CA PRO A 114 -8.980 0.216 15.792 1.00 0.66 C ATOM 1378 C PRO A 114 -7.794 -0.198 16.676 1.00 0.69 C ATOM 1379 O PRO A 114 -6.786 0.507 16.761 1.00 0.83 O ATOM 1380 CB PRO A 114 -8.950 -0.590 14.490 1.00 0.55 C ATOM 1381 CG PRO A 114 -8.015 0.250 13.627 1.00 0.61 C ATOM 1382 CD PRO A 114 -8.445 1.665 13.974 1.00 0.68 C ATOM 0 HA PRO A 114 -9.863 0.048 16.409 1.00 0.66 H new ATOM 0 HB2 PRO A 114 -8.569 -1.600 14.643 1.00 0.55 H new ATOM 0 HB3 PRO A 114 -9.941 -0.687 14.046 1.00 0.55 H new ATOM 0 HG2 PRO A 114 -6.967 0.072 13.869 1.00 0.61 H new ATOM 0 HG3 PRO A 114 -8.138 0.036 12.565 1.00 0.61 H new ATOM 0 HD2 PRO A 114 -7.610 2.360 13.881 1.00 0.68 H new ATOM 0 HD3 PRO A 114 -9.226 2.012 13.297 1.00 0.68 H new ATOM 1390 N ALA A 115 -7.898 -1.403 17.247 1.00 0.69 N ATOM 1391 CA ALA A 115 -6.821 -2.119 17.918 1.00 0.79 C ATOM 1392 C ALA A 115 -6.010 -2.955 16.902 1.00 0.77 C ATOM 1393 O ALA A 115 -5.169 -2.418 16.181 1.00 1.39 O ATOM 1394 CB ALA A 115 -7.437 -2.933 19.068 1.00 0.94 C ATOM 0 H ALA A 115 -8.775 -1.924 17.251 1.00 0.69 H new ATOM 0 HA ALA A 115 -6.094 -1.435 18.355 1.00 0.79 H new ATOM 0 HB1 ALA A 115 -6.651 -3.480 19.588 1.00 0.94 H new ATOM 0 HB2 ALA A 115 -7.933 -2.259 19.766 1.00 0.94 H new ATOM 0 HB3 ALA A 115 -8.164 -3.638 18.666 1.00 0.94 H new ATOM 1400 N THR A 116 -6.324 -4.250 16.762 1.00 0.76 N ATOM 1401 CA THR A 116 -5.512 -5.256 16.038 1.00 0.68 C ATOM 1402 C THR A 116 -5.505 -5.161 14.505 1.00 0.59 C ATOM 1403 O THR A 116 -5.025 -6.070 13.827 1.00 0.63 O ATOM 1404 CB THR A 116 -5.798 -6.693 16.529 1.00 0.78 C ATOM 1405 OG1 THR A 116 -7.038 -7.195 16.079 1.00 1.02 O ATOM 1406 CG2 THR A 116 -5.829 -6.774 18.055 1.00 0.83 C ATOM 0 H THR A 116 -7.176 -4.646 17.160 1.00 0.76 H new ATOM 0 HA THR A 116 -4.490 -4.991 16.307 1.00 0.68 H new ATOM 0 HB THR A 116 -4.983 -7.288 16.116 1.00 0.78 H new ATOM 0 HG1 THR A 116 -6.894 -8.031 15.588 1.00 1.02 H new ATOM 0 HG21 THR A 116 -6.033 -7.800 18.361 1.00 0.83 H new ATOM 0 HG22 THR A 116 -4.865 -6.461 18.456 1.00 0.83 H new ATOM 0 HG23 THR A 116 -6.611 -6.119 18.438 1.00 0.83 H new ATOM 1414 N ALA A 117 -5.982 -4.052 13.932 1.00 0.53 N ATOM 1415 CA ALA A 117 -5.908 -3.783 12.497 1.00 0.41 C ATOM 1416 C ALA A 117 -4.469 -3.875 11.944 1.00 0.38 C ATOM 1417 O ALA A 117 -3.503 -3.490 12.609 1.00 0.47 O ATOM 1418 CB ALA A 117 -6.510 -2.399 12.227 1.00 0.46 C ATOM 0 H ALA A 117 -6.436 -3.307 14.461 1.00 0.53 H new ATOM 0 HA ALA A 117 -6.478 -4.552 11.975 1.00 0.41 H new ATOM 0 HB1 ALA A 117 -6.462 -2.183 11.160 1.00 0.46 H new ATOM 0 HB2 ALA A 117 -7.550 -2.384 12.554 1.00 0.46 H new ATOM 0 HB3 ALA A 117 -5.947 -1.644 12.775 1.00 0.46 H new ATOM 1424 N MET A 118 -4.354 -4.356 10.708 1.00 0.31 N ATOM 1425 CA MET A 118 -3.140 -4.489 9.907 1.00 0.28 C ATOM 1426 C MET A 118 -2.696 -3.117 9.378 1.00 0.34 C ATOM 1427 O MET A 118 -3.348 -2.525 8.521 1.00 0.62 O ATOM 1428 CB MET A 118 -3.487 -5.498 8.801 1.00 0.25 C ATOM 1429 CG MET A 118 -2.378 -5.854 7.807 1.00 0.27 C ATOM 1430 SD MET A 118 -2.715 -7.469 7.037 1.00 1.81 S ATOM 1431 CE MET A 118 -1.124 -7.945 6.309 1.00 0.83 C ATOM 0 H MET A 118 -5.174 -4.689 10.200 1.00 0.31 H new ATOM 0 HA MET A 118 -2.287 -4.853 10.480 1.00 0.28 H new ATOM 0 HB2 MET A 118 -3.823 -6.419 9.277 1.00 0.25 H new ATOM 0 HB3 MET A 118 -4.333 -5.104 8.237 1.00 0.25 H new ATOM 0 HG2 MET A 118 -2.308 -5.084 7.038 1.00 0.27 H new ATOM 0 HG3 MET A 118 -1.416 -5.881 8.319 1.00 0.27 H new ATOM 0 HE1 MET A 118 -1.089 -9.028 6.187 1.00 0.83 H new ATOM 0 HE2 MET A 118 -1.011 -7.466 5.336 1.00 0.83 H new ATOM 0 HE3 MET A 118 -0.314 -7.628 6.966 1.00 0.83 H new ATOM 1441 N LYS A 119 -1.608 -2.585 9.934 1.00 0.30 N ATOM 1442 CA LYS A 119 -1.045 -1.234 9.694 1.00 0.33 C ATOM 1443 C LYS A 119 0.448 -1.142 10.048 1.00 0.36 C ATOM 1444 O LYS A 119 0.881 -1.739 11.039 1.00 0.48 O ATOM 1445 CB LYS A 119 -1.853 -0.205 10.505 1.00 0.46 C ATOM 1446 CG LYS A 119 -1.939 -0.474 12.026 1.00 0.56 C ATOM 1447 CD LYS A 119 -3.341 -0.131 12.548 1.00 0.78 C ATOM 1448 CE LYS A 119 -3.552 -0.468 14.037 1.00 0.95 C ATOM 1449 NZ LYS A 119 -2.755 0.383 14.950 1.00 1.04 N ATOM 0 H LYS A 119 -1.052 -3.111 10.609 1.00 0.30 H new ATOM 0 HA LYS A 119 -1.122 -1.022 8.628 1.00 0.33 H new ATOM 0 HB2 LYS A 119 -1.411 0.780 10.352 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -2.865 -0.166 10.103 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -1.713 -1.521 12.231 1.00 0.56 H new ATOM 0 HG3 LYS A 119 -1.192 0.122 12.551 1.00 0.56 H new ATOM 0 HD2 LYS A 119 -3.524 0.933 12.397 1.00 0.78 H new ATOM 0 HD3 LYS A 119 -4.081 -0.669 11.955 1.00 0.78 H new ATOM 0 HE2 LYS A 119 -4.609 -0.359 14.281 1.00 0.95 H new ATOM 0 HE3 LYS A 119 -3.292 -1.513 14.206 1.00 0.95 H new ATOM 0 HZ1 LYS A 119 -2.942 0.106 15.935 1.00 1.04 H new ATOM 0 HZ2 LYS A 119 -1.743 0.262 14.743 1.00 1.04 H new ATOM 0 HZ3 LYS A 119 -3.019 1.380 14.815 1.00 1.04 H new ATOM 1463 N LYS A 120 1.236 -0.380 9.275 1.00 0.31 N ATOM 1464 CA LYS A 120 2.696 -0.191 9.471 1.00 0.33 C ATOM 1465 C LYS A 120 3.231 1.007 8.669 1.00 0.33 C ATOM 1466 O LYS A 120 2.633 1.385 7.666 1.00 0.43 O ATOM 1467 CB LYS A 120 3.427 -1.480 9.041 1.00 0.46 C ATOM 1468 CG LYS A 120 4.850 -1.643 9.598 1.00 0.51 C ATOM 1469 CD LYS A 120 5.429 -2.962 9.076 1.00 0.78 C ATOM 1470 CE LYS A 120 6.920 -3.155 9.377 1.00 0.93 C ATOM 1471 NZ LYS A 120 7.157 -3.857 10.657 1.00 1.87 N ATOM 0 H LYS A 120 0.874 0.138 8.474 1.00 0.31 H new ATOM 0 HA LYS A 120 2.879 0.017 10.525 1.00 0.33 H new ATOM 0 HB2 LYS A 120 2.831 -2.338 9.354 1.00 0.46 H new ATOM 0 HB3 LYS A 120 3.475 -1.505 7.952 1.00 0.46 H new ATOM 0 HG2 LYS A 120 5.476 -0.806 9.289 1.00 0.51 H new ATOM 0 HG3 LYS A 120 4.832 -1.642 10.688 1.00 0.51 H new ATOM 0 HD2 LYS A 120 4.871 -3.790 9.514 1.00 0.78 H new ATOM 0 HD3 LYS A 120 5.278 -3.011 7.998 1.00 0.78 H new ATOM 0 HE2 LYS A 120 7.380 -3.720 8.567 1.00 0.93 H new ATOM 0 HE3 LYS A 120 7.410 -2.182 9.405 1.00 0.93 H new ATOM 0 HZ1 LYS A 120 8.180 -3.961 10.812 1.00 1.87 H new ATOM 0 HZ2 LYS A 120 6.743 -3.307 11.437 1.00 1.87 H new ATOM 0 HZ3 LYS A 120 6.714 -4.798 10.624 1.00 1.87 H new ATOM 1485 N LEU A 121 4.378 1.556 9.084 1.00 0.35 N ATOM 1486 CA LEU A 121 5.091 2.647 8.395 1.00 0.38 C ATOM 1487 C LEU A 121 6.309 2.178 7.570 1.00 0.41 C ATOM 1488 O LEU A 121 7.041 1.291 8.018 1.00 0.47 O ATOM 1489 CB LEU A 121 5.528 3.731 9.393 1.00 0.42 C ATOM 1490 CG LEU A 121 4.348 4.431 10.093 1.00 0.44 C ATOM 1491 CD1 LEU A 121 4.033 3.813 11.455 1.00 0.49 C ATOM 1492 CD2 LEU A 121 4.655 5.910 10.297 1.00 0.53 C ATOM 0 H LEU A 121 4.853 1.247 9.932 1.00 0.35 H new ATOM 0 HA LEU A 121 4.373 3.059 7.686 1.00 0.38 H new ATOM 0 HB2 LEU A 121 6.173 3.281 10.148 1.00 0.42 H new ATOM 0 HB3 LEU A 121 6.124 4.478 8.869 1.00 0.42 H new ATOM 0 HG LEU A 121 3.482 4.304 9.444 1.00 0.44 H new ATOM 0 HD11 LEU A 121 3.194 4.341 11.909 1.00 0.49 H new ATOM 0 HD12 LEU A 121 3.774 2.762 11.327 1.00 0.49 H new ATOM 0 HD13 LEU A 121 4.906 3.895 12.102 1.00 0.49 H new ATOM 0 HD21 LEU A 121 3.812 6.392 10.793 1.00 0.53 H new ATOM 0 HD22 LEU A 121 5.547 6.015 10.914 1.00 0.53 H new ATOM 0 HD23 LEU A 121 4.826 6.383 9.330 1.00 0.53 H new ATOM 1504 N THR A 122 6.591 2.815 6.419 1.00 0.41 N ATOM 1505 CA THR A 122 7.810 2.543 5.616 1.00 0.40 C ATOM 1506 C THR A 122 9.106 2.918 6.357 1.00 0.42 C ATOM 1507 O THR A 122 9.204 3.979 6.978 1.00 0.50 O ATOM 1508 CB THR A 122 7.804 3.198 4.216 1.00 0.43 C ATOM 1509 OG1 THR A 122 7.436 4.554 4.296 1.00 0.54 O ATOM 1510 CG2 THR A 122 6.859 2.551 3.201 1.00 0.51 C ATOM 0 H THR A 122 5.987 3.531 6.016 1.00 0.41 H new ATOM 0 HA THR A 122 7.788 1.463 5.468 1.00 0.40 H new ATOM 0 HB THR A 122 8.827 3.061 3.866 1.00 0.43 H new ATOM 0 HG1 THR A 122 7.563 4.980 3.423 1.00 0.54 H new ATOM 0 HG21 THR A 122 6.927 3.081 2.251 1.00 0.51 H new ATOM 0 HG22 THR A 122 7.140 1.508 3.055 1.00 0.51 H new ATOM 0 HG23 THR A 122 5.836 2.602 3.573 1.00 0.51 H new ATOM 1518 N GLU A 123 10.117 2.044 6.287 1.00 0.43 N ATOM 1519 CA GLU A 123 11.385 2.159 7.054 1.00 0.53 C ATOM 1520 C GLU A 123 12.555 2.795 6.283 1.00 0.64 C ATOM 1521 O GLU A 123 13.118 3.804 6.717 1.00 0.79 O ATOM 1522 CB GLU A 123 11.817 0.803 7.655 1.00 0.59 C ATOM 1523 CG GLU A 123 11.400 -0.414 6.835 1.00 0.68 C ATOM 1524 CD GLU A 123 12.004 -1.722 7.349 1.00 1.20 C ATOM 1525 OE1 GLU A 123 11.364 -2.365 8.216 1.00 2.33 O ATOM 1526 OE2 GLU A 123 13.082 -2.134 6.853 1.00 1.99 O ATOM 0 H GLU A 123 10.087 1.219 5.688 1.00 0.43 H new ATOM 0 HA GLU A 123 11.145 2.854 7.859 1.00 0.53 H new ATOM 0 HB2 GLU A 123 12.901 0.797 7.764 1.00 0.59 H new ATOM 0 HB3 GLU A 123 11.395 0.713 8.656 1.00 0.59 H new ATOM 0 HG2 GLU A 123 10.313 -0.495 6.844 1.00 0.68 H new ATOM 0 HG3 GLU A 123 11.700 -0.265 5.798 1.00 0.68 H new ATOM 1533 N ALA A 124 12.950 2.197 5.158 1.00 0.65 N ATOM 1534 CA ALA A 124 14.037 2.687 4.301 1.00 0.77 C ATOM 1535 C ALA A 124 13.817 2.313 2.828 1.00 0.76 C ATOM 1536 O ALA A 124 14.021 3.139 1.932 1.00 1.00 O ATOM 1537 CB ALA A 124 15.367 2.116 4.817 1.00 1.00 C ATOM 0 H ALA A 124 12.517 1.342 4.808 1.00 0.65 H new ATOM 0 HA ALA A 124 14.058 3.776 4.347 1.00 0.77 H new ATOM 0 HB1 ALA A 124 16.184 2.472 4.189 1.00 1.00 H new ATOM 0 HB2 ALA A 124 15.529 2.443 5.844 1.00 1.00 H new ATOM 0 HB3 ALA A 124 15.333 1.027 4.784 1.00 1.00 H new ATOM 1543 N GLU A 125 13.325 1.100 2.577 1.00 0.84 N ATOM 1544 CA GLU A 125 12.945 0.626 1.239 1.00 1.19 C ATOM 1545 C GLU A 125 11.443 0.347 1.120 1.00 1.21 C ATOM 1546 O GLU A 125 10.886 0.511 0.036 1.00 2.17 O ATOM 1547 CB GLU A 125 13.784 -0.606 0.868 1.00 1.59 C ATOM 1548 CG GLU A 125 15.171 -0.263 0.289 1.00 2.14 C ATOM 1549 CD GLU A 125 15.152 0.294 -1.144 1.00 4.02 C ATOM 1550 OE1 GLU A 125 14.096 0.320 -1.812 1.00 5.20 O ATOM 1551 OE2 GLU A 125 16.220 0.711 -1.657 1.00 5.03 O ATOM 0 H GLU A 125 13.175 0.404 3.308 1.00 0.84 H new ATOM 0 HA GLU A 125 13.156 1.423 0.526 1.00 1.19 H new ATOM 0 HB2 GLU A 125 13.914 -1.226 1.755 1.00 1.59 H new ATOM 0 HB3 GLU A 125 13.234 -1.203 0.140 1.00 1.59 H new ATOM 0 HG2 GLU A 125 15.651 0.467 0.941 1.00 2.14 H new ATOM 0 HG3 GLU A 125 15.789 -1.161 0.307 1.00 2.14 H new ATOM 1558 N GLY A 126 10.764 0.014 2.218 1.00 0.53 N ATOM 1559 CA GLY A 126 9.335 -0.315 2.226 1.00 0.47 C ATOM 1560 C GLY A 126 8.828 -0.667 3.629 1.00 0.46 C ATOM 1561 O GLY A 126 9.415 -0.222 4.608 1.00 0.59 O ATOM 0 H GLY A 126 11.196 -0.036 3.141 1.00 0.53 H new ATOM 0 HA2 GLY A 126 8.767 0.531 1.838 1.00 0.47 H new ATOM 0 HA3 GLY A 126 9.154 -1.155 1.555 1.00 0.47 H new ATOM 1565 N ALA A 127 7.741 -1.429 3.734 1.00 0.39 N ATOM 1566 CA ALA A 127 7.190 -2.021 4.962 1.00 0.38 C ATOM 1567 C ALA A 127 6.640 -3.443 4.708 1.00 0.41 C ATOM 1568 O ALA A 127 5.864 -3.629 3.770 1.00 0.42 O ATOM 1569 CB ALA A 127 6.082 -1.095 5.485 1.00 0.37 C ATOM 0 H ALA A 127 7.183 -1.667 2.914 1.00 0.39 H new ATOM 0 HA ALA A 127 7.982 -2.117 5.705 1.00 0.38 H new ATOM 0 HB1 ALA A 127 5.658 -1.514 6.397 1.00 0.37 H new ATOM 0 HB2 ALA A 127 6.500 -0.111 5.698 1.00 0.37 H new ATOM 0 HB3 ALA A 127 5.300 -1.001 4.731 1.00 0.37 H new ATOM 1575 N LYS A 128 7.005 -4.432 5.542 1.00 0.43 N ATOM 1576 CA LYS A 128 6.554 -5.840 5.438 1.00 0.43 C ATOM 1577 C LYS A 128 5.185 -6.097 6.089 1.00 0.41 C ATOM 1578 O LYS A 128 4.901 -5.612 7.187 1.00 0.50 O ATOM 1579 CB LYS A 128 7.633 -6.777 6.017 1.00 0.55 C ATOM 1580 CG LYS A 128 7.211 -8.261 6.076 1.00 0.90 C ATOM 1581 CD LYS A 128 8.269 -9.152 6.733 1.00 0.87 C ATOM 1582 CE LYS A 128 7.728 -10.582 6.874 1.00 0.88 C ATOM 1583 NZ LYS A 128 8.689 -11.455 7.589 1.00 1.27 N ATOM 0 H LYS A 128 7.637 -4.276 6.327 1.00 0.43 H new ATOM 0 HA LYS A 128 6.415 -6.054 4.378 1.00 0.43 H new ATOM 0 HB2 LYS A 128 8.536 -6.691 5.413 1.00 0.55 H new ATOM 0 HB3 LYS A 128 7.888 -6.442 7.022 1.00 0.55 H new ATOM 0 HG2 LYS A 128 6.276 -8.347 6.629 1.00 0.90 H new ATOM 0 HG3 LYS A 128 7.017 -8.620 5.065 1.00 0.90 H new ATOM 0 HD2 LYS A 128 9.179 -9.155 6.133 1.00 0.87 H new ATOM 0 HD3 LYS A 128 8.535 -8.755 7.713 1.00 0.87 H new ATOM 0 HE2 LYS A 128 6.781 -10.563 7.413 1.00 0.88 H new ATOM 0 HE3 LYS A 128 7.524 -10.995 5.886 1.00 0.88 H new ATOM 0 HZ1 LYS A 128 8.294 -12.414 7.668 1.00 1.27 H new ATOM 0 HZ2 LYS A 128 9.584 -11.491 7.061 1.00 1.27 H new ATOM 0 HZ3 LYS A 128 8.864 -11.073 8.540 1.00 1.27 H new ATOM 1597 N PHE A 129 4.382 -6.928 5.430 1.00 0.36 N ATOM 1598 CA PHE A 129 3.068 -7.424 5.839 1.00 0.34 C ATOM 1599 C PHE A 129 3.005 -8.941 5.587 1.00 0.35 C ATOM 1600 O PHE A 129 3.139 -9.394 4.452 1.00 0.40 O ATOM 1601 CB PHE A 129 2.021 -6.644 5.036 1.00 0.29 C ATOM 1602 CG PHE A 129 1.822 -5.218 5.511 1.00 0.29 C ATOM 1603 CD1 PHE A 129 2.753 -4.229 5.157 1.00 1.55 C ATOM 1604 CD2 PHE A 129 0.738 -4.870 6.337 1.00 1.70 C ATOM 1605 CE1 PHE A 129 2.607 -2.920 5.630 1.00 1.57 C ATOM 1606 CE2 PHE A 129 0.567 -3.548 6.782 1.00 1.70 C ATOM 1607 CZ PHE A 129 1.499 -2.565 6.416 1.00 0.35 C ATOM 0 H PHE A 129 4.655 -7.303 4.522 1.00 0.36 H new ATOM 0 HA PHE A 129 2.877 -7.273 6.901 1.00 0.34 H new ATOM 0 HB2 PHE A 129 2.318 -6.629 3.987 1.00 0.29 H new ATOM 0 HB3 PHE A 129 1.069 -7.171 5.090 1.00 0.29 H new ATOM 0 HD1 PHE A 129 3.586 -4.479 4.517 1.00 1.55 H new ATOM 0 HD2 PHE A 129 0.028 -5.628 6.633 1.00 1.70 H new ATOM 0 HE1 PHE A 129 3.353 -2.177 5.389 1.00 1.57 H new ATOM 0 HE2 PHE A 129 -0.278 -3.290 7.403 1.00 1.70 H new ATOM 0 HZ PHE A 129 1.365 -1.542 6.737 1.00 0.35 H new ATOM 1617 N ASN A 130 2.811 -9.734 6.639 1.00 0.41 N ATOM 1618 CA ASN A 130 2.676 -11.190 6.568 1.00 0.43 C ATOM 1619 C ASN A 130 1.270 -11.550 6.046 1.00 0.44 C ATOM 1620 O ASN A 130 0.268 -11.314 6.721 1.00 0.63 O ATOM 1621 CB ASN A 130 2.919 -11.735 7.990 1.00 0.57 C ATOM 1622 CG ASN A 130 2.572 -13.204 8.141 1.00 0.88 C ATOM 1623 OD1 ASN A 130 1.753 -13.557 9.105 1.00 1.60 O flip ATOM 1624 ND2 ASN A 130 3.025 -14.051 7.389 1.00 1.40 N flip ATOM 0 H ASN A 130 2.741 -9.373 7.590 1.00 0.41 H new ATOM 0 HA ASN A 130 3.396 -11.634 5.880 1.00 0.43 H new ATOM 0 HB2 ASN A 130 3.967 -11.588 8.253 1.00 0.57 H new ATOM 0 HB3 ASN A 130 2.328 -11.155 8.699 1.00 0.57 H new ATOM 0 HD21 ASN A 130 3.661 -13.780 6.639 1.00 1.40 H new ATOM 0 HD22 ASN A 130 2.767 -15.031 7.510 1.00 1.40 H new ATOM 1631 N THR A 131 1.185 -12.130 4.850 1.00 0.43 N ATOM 1632 CA THR A 131 -0.077 -12.510 4.182 1.00 0.46 C ATOM 1633 C THR A 131 -0.364 -14.012 4.244 1.00 0.52 C ATOM 1634 O THR A 131 -1.411 -14.463 3.778 1.00 0.60 O ATOM 1635 CB THR A 131 -0.117 -11.993 2.736 1.00 0.58 C ATOM 1636 OG1 THR A 131 1.030 -12.378 2.015 1.00 0.70 O ATOM 1637 CG2 THR A 131 -0.190 -10.471 2.698 1.00 0.66 C ATOM 0 H THR A 131 2.010 -12.359 4.296 1.00 0.43 H new ATOM 0 HA THR A 131 -0.877 -12.026 4.742 1.00 0.46 H new ATOM 0 HB THR A 131 -1.007 -12.429 2.282 1.00 0.58 H new ATOM 0 HG1 THR A 131 0.971 -12.034 1.099 1.00 0.70 H new ATOM 0 HG21 THR A 131 -0.217 -10.134 1.662 1.00 0.66 H new ATOM 0 HG22 THR A 131 -1.091 -10.137 3.212 1.00 0.66 H new ATOM 0 HG23 THR A 131 0.686 -10.052 3.193 1.00 0.66 H new ATOM 1645 N ALA A 132 0.518 -14.787 4.884 1.00 0.55 N ATOM 1646 CA ALA A 132 0.484 -16.245 5.042 1.00 0.67 C ATOM 1647 C ALA A 132 -0.828 -16.815 5.628 1.00 0.84 C ATOM 1648 O ALA A 132 -1.103 -18.012 5.491 1.00 1.06 O ATOM 1649 CB ALA A 132 1.662 -16.593 5.962 1.00 0.69 C ATOM 0 H ALA A 132 1.336 -14.381 5.339 1.00 0.55 H new ATOM 0 HA ALA A 132 0.550 -16.698 4.053 1.00 0.67 H new ATOM 0 HB1 ALA A 132 1.693 -17.671 6.121 1.00 0.69 H new ATOM 0 HB2 ALA A 132 2.594 -16.267 5.499 1.00 0.69 H new ATOM 0 HB3 ALA A 132 1.537 -16.089 6.920 1.00 0.69 H new ATOM 1655 N ASN A 133 -1.626 -15.960 6.274 1.00 0.91 N ATOM 1656 CA ASN A 133 -2.851 -16.296 7.000 1.00 1.12 C ATOM 1657 C ASN A 133 -4.134 -15.878 6.249 1.00 1.11 C ATOM 1658 O ASN A 133 -5.194 -16.464 6.488 1.00 1.44 O ATOM 1659 CB ASN A 133 -2.802 -15.666 8.415 1.00 1.26 C ATOM 1660 CG ASN A 133 -1.437 -15.150 8.845 1.00 1.22 C ATOM 1661 OD1 ASN A 133 -0.535 -15.902 9.186 1.00 1.70 O ATOM 1662 ND2 ASN A 133 -1.223 -13.861 8.725 1.00 2.42 N ATOM 0 H ASN A 133 -1.422 -14.961 6.305 1.00 0.91 H new ATOM 0 HA ASN A 133 -2.897 -17.382 7.083 1.00 1.12 H new ATOM 0 HB2 ASN A 133 -3.514 -14.841 8.453 1.00 1.26 H new ATOM 0 HB3 ASN A 133 -3.137 -16.409 9.139 1.00 1.26 H new ATOM 0 HD21 ASN A 133 -0.297 -13.478 8.917 1.00 2.42 H new ATOM 0 HD22 ASN A 133 -1.982 -13.242 8.440 1.00 2.42 H new ATOM 1669 N LEU A 134 -4.073 -14.887 5.343 1.00 0.77 N ATOM 1670 CA LEU A 134 -5.260 -14.399 4.643 1.00 0.66 C ATOM 1671 C LEU A 134 -5.858 -15.452 3.697 1.00 0.76 C ATOM 1672 O LEU A 134 -5.115 -16.121 2.970 1.00 0.95 O ATOM 1673 CB LEU A 134 -4.948 -13.129 3.829 1.00 0.52 C ATOM 1674 CG LEU A 134 -4.944 -11.769 4.547 1.00 0.47 C ATOM 1675 CD1 LEU A 134 -5.919 -11.668 5.719 1.00 0.52 C ATOM 1676 CD2 LEU A 134 -3.553 -11.383 5.008 1.00 0.47 C ATOM 0 H LEU A 134 -3.209 -14.411 5.082 1.00 0.77 H new ATOM 0 HA LEU A 134 -5.990 -14.172 5.420 1.00 0.66 H new ATOM 0 HB2 LEU A 134 -3.968 -13.263 3.372 1.00 0.52 H new ATOM 0 HB3 LEU A 134 -5.673 -13.071 3.017 1.00 0.52 H new ATOM 0 HG LEU A 134 -5.291 -11.064 3.791 1.00 0.47 H new ATOM 0 HD11 LEU A 134 -5.849 -10.676 6.166 1.00 0.52 H new ATOM 0 HD12 LEU A 134 -6.935 -11.835 5.362 1.00 0.52 H new ATOM 0 HD13 LEU A 134 -5.669 -12.421 6.466 1.00 0.52 H new ATOM 0 HD21 LEU A 134 -3.591 -10.417 5.511 1.00 0.47 H new ATOM 0 HD22 LEU A 134 -3.177 -12.137 5.699 1.00 0.47 H new ATOM 0 HD23 LEU A 134 -2.889 -11.318 4.146 1.00 0.47 H new ATOM 1688 N PRO A 135 -7.197 -15.560 3.632 1.00 0.71 N ATOM 1689 CA PRO A 135 -7.870 -16.363 2.623 1.00 0.80 C ATOM 1690 C PRO A 135 -7.852 -15.675 1.255 1.00 0.83 C ATOM 1691 O PRO A 135 -7.543 -14.483 1.120 1.00 0.75 O ATOM 1692 CB PRO A 135 -9.294 -16.552 3.138 1.00 0.79 C ATOM 1693 CG PRO A 135 -9.550 -15.246 3.894 1.00 0.69 C ATOM 1694 CD PRO A 135 -8.178 -14.887 4.474 1.00 0.64 C ATOM 0 HA PRO A 135 -7.370 -17.320 2.473 1.00 0.80 H new ATOM 0 HB2 PRO A 135 -10.004 -16.695 2.324 1.00 0.79 H new ATOM 0 HB3 PRO A 135 -9.377 -17.421 3.790 1.00 0.79 H new ATOM 0 HG2 PRO A 135 -9.921 -14.465 3.230 1.00 0.69 H new ATOM 0 HG3 PRO A 135 -10.295 -15.377 4.679 1.00 0.69 H new ATOM 0 HD2 PRO A 135 -8.022 -13.808 4.468 1.00 0.64 H new ATOM 0 HD3 PRO A 135 -8.094 -15.216 5.510 1.00 0.64 H new ATOM 1702 N ALA A 136 -8.243 -16.434 0.238 1.00 0.99 N ATOM 1703 CA ALA A 136 -8.259 -16.019 -1.150 1.00 1.10 C ATOM 1704 C ALA A 136 -9.432 -15.059 -1.387 1.00 1.11 C ATOM 1705 O ALA A 136 -10.572 -15.476 -1.624 1.00 1.33 O ATOM 1706 CB ALA A 136 -8.329 -17.302 -1.980 1.00 1.28 C ATOM 0 H ALA A 136 -8.569 -17.392 0.368 1.00 0.99 H new ATOM 0 HA ALA A 136 -7.368 -15.462 -1.441 1.00 1.10 H new ATOM 0 HB1 ALA A 136 -8.344 -17.049 -3.040 1.00 1.28 H new ATOM 0 HB2 ALA A 136 -7.458 -17.921 -1.767 1.00 1.28 H new ATOM 0 HB3 ALA A 136 -9.235 -17.851 -1.725 1.00 1.28 H new ATOM 1712 N ALA A 137 -9.156 -13.761 -1.269 1.00 0.97 N ATOM 1713 CA ALA A 137 -10.097 -12.689 -1.558 1.00 0.95 C ATOM 1714 C ALA A 137 -9.377 -11.469 -2.177 1.00 0.86 C ATOM 1715 O ALA A 137 -8.148 -11.463 -2.308 1.00 0.81 O ATOM 1716 CB ALA A 137 -10.843 -12.333 -0.261 1.00 0.94 C ATOM 0 H ALA A 137 -8.245 -13.421 -0.961 1.00 0.97 H new ATOM 0 HA ALA A 137 -10.824 -13.018 -2.301 1.00 0.95 H new ATOM 0 HB1 ALA A 137 -11.553 -11.530 -0.459 1.00 0.94 H new ATOM 0 HB2 ALA A 137 -11.378 -13.210 0.103 1.00 0.94 H new ATOM 0 HB3 ALA A 137 -10.127 -12.006 0.493 1.00 0.94 H new ATOM 1722 N LYS A 138 -10.134 -10.417 -2.515 1.00 0.84 N ATOM 1723 CA LYS A 138 -9.600 -9.099 -2.904 1.00 0.74 C ATOM 1724 C LYS A 138 -9.548 -8.151 -1.701 1.00 0.69 C ATOM 1725 O LYS A 138 -10.440 -8.135 -0.853 1.00 0.83 O ATOM 1726 CB LYS A 138 -10.368 -8.510 -4.107 1.00 0.78 C ATOM 1727 CG LYS A 138 -9.882 -9.152 -5.420 1.00 0.81 C ATOM 1728 CD LYS A 138 -10.546 -8.621 -6.702 1.00 1.07 C ATOM 1729 CE LYS A 138 -10.292 -7.123 -6.916 1.00 2.66 C ATOM 1730 NZ LYS A 138 -10.506 -6.712 -8.326 1.00 3.29 N ATOM 0 H LYS A 138 -11.153 -10.456 -2.527 1.00 0.84 H new ATOM 0 HA LYS A 138 -8.572 -9.231 -3.240 1.00 0.74 H new ATOM 0 HB2 LYS A 138 -11.437 -8.683 -3.984 1.00 0.78 H new ATOM 0 HB3 LYS A 138 -10.222 -7.431 -4.147 1.00 0.78 H new ATOM 0 HG2 LYS A 138 -8.805 -9.002 -5.501 1.00 0.81 H new ATOM 0 HG3 LYS A 138 -10.051 -10.227 -5.363 1.00 0.81 H new ATOM 0 HD2 LYS A 138 -10.168 -9.177 -7.560 1.00 1.07 H new ATOM 0 HD3 LYS A 138 -11.620 -8.801 -6.653 1.00 1.07 H new ATOM 0 HE2 LYS A 138 -10.953 -6.548 -6.268 1.00 2.66 H new ATOM 0 HE3 LYS A 138 -9.270 -6.884 -6.621 1.00 2.66 H new ATOM 0 HZ1 LYS A 138 -9.825 -5.968 -8.578 1.00 3.29 H new ATOM 0 HZ2 LYS A 138 -10.370 -7.532 -8.951 1.00 3.29 H new ATOM 0 HZ3 LYS A 138 -11.474 -6.348 -8.438 1.00 3.29 H new ATOM 1744 N TYR A 139 -8.488 -7.352 -1.645 1.00 0.50 N ATOM 1745 CA TYR A 139 -8.125 -6.475 -0.533 1.00 0.40 C ATOM 1746 C TYR A 139 -7.709 -5.096 -1.058 1.00 0.37 C ATOM 1747 O TYR A 139 -7.475 -4.914 -2.257 1.00 0.42 O ATOM 1748 CB TYR A 139 -6.986 -7.114 0.281 1.00 0.37 C ATOM 1749 CG TYR A 139 -7.300 -8.468 0.890 1.00 0.44 C ATOM 1750 CD1 TYR A 139 -7.167 -9.631 0.111 1.00 0.61 C ATOM 1751 CD2 TYR A 139 -7.693 -8.572 2.238 1.00 0.38 C ATOM 1752 CE1 TYR A 139 -7.440 -10.895 0.666 1.00 0.63 C ATOM 1753 CE2 TYR A 139 -7.961 -9.840 2.791 1.00 0.41 C ATOM 1754 CZ TYR A 139 -7.839 -10.998 2.008 1.00 0.49 C ATOM 1755 OH TYR A 139 -8.110 -12.207 2.553 1.00 0.51 O ATOM 0 H TYR A 139 -7.822 -7.294 -2.415 1.00 0.50 H new ATOM 0 HA TYR A 139 -8.990 -6.344 0.117 1.00 0.40 H new ATOM 0 HB2 TYR A 139 -6.115 -7.219 -0.366 1.00 0.37 H new ATOM 0 HB3 TYR A 139 -6.707 -6.430 1.083 1.00 0.37 H new ATOM 0 HD1 TYR A 139 -6.853 -9.554 -0.920 1.00 0.61 H new ATOM 0 HD2 TYR A 139 -7.789 -7.684 2.845 1.00 0.38 H new ATOM 0 HE1 TYR A 139 -7.343 -11.784 0.061 1.00 0.63 H new ATOM 0 HE2 TYR A 139 -8.262 -9.921 3.825 1.00 0.41 H new ATOM 0 HH TYR A 139 -7.869 -12.913 1.918 1.00 0.51 H new ATOM 1765 N LYS A 140 -7.617 -4.119 -0.153 1.00 0.35 N ATOM 1766 CA LYS A 140 -7.177 -2.749 -0.483 1.00 0.36 C ATOM 1767 C LYS A 140 -6.292 -2.123 0.596 1.00 0.37 C ATOM 1768 O LYS A 140 -6.484 -2.393 1.781 1.00 0.50 O ATOM 1769 CB LYS A 140 -8.378 -1.831 -0.791 1.00 0.38 C ATOM 1770 CG LYS A 140 -9.230 -2.303 -1.968 1.00 0.42 C ATOM 1771 CD LYS A 140 -10.239 -1.229 -2.376 1.00 0.50 C ATOM 1772 CE LYS A 140 -11.181 -1.870 -3.397 1.00 0.64 C ATOM 1773 NZ LYS A 140 -11.844 -0.880 -4.276 1.00 1.74 N ATOM 0 H LYS A 140 -7.844 -4.249 0.833 1.00 0.35 H new ATOM 0 HA LYS A 140 -6.565 -2.843 -1.380 1.00 0.36 H new ATOM 0 HB2 LYS A 140 -9.007 -1.762 0.096 1.00 0.38 H new ATOM 0 HB3 LYS A 140 -8.011 -0.826 -1.000 1.00 0.38 H new ATOM 0 HG2 LYS A 140 -8.587 -2.544 -2.814 1.00 0.42 H new ATOM 0 HG3 LYS A 140 -9.756 -3.218 -1.697 1.00 0.42 H new ATOM 0 HD2 LYS A 140 -10.795 -0.872 -1.509 1.00 0.50 H new ATOM 0 HD3 LYS A 140 -9.732 -0.366 -2.807 1.00 0.50 H new ATOM 0 HE2 LYS A 140 -10.618 -2.573 -4.011 1.00 0.64 H new ATOM 0 HE3 LYS A 140 -11.942 -2.446 -2.870 1.00 0.64 H new ATOM 0 HZ1 LYS A 140 -12.469 -1.373 -4.945 1.00 1.74 H new ATOM 0 HZ2 LYS A 140 -12.406 -0.224 -3.697 1.00 1.74 H new ATOM 0 HZ3 LYS A 140 -11.124 -0.347 -4.803 1.00 1.74 H new ATOM 1787 N ILE A 141 -5.368 -1.249 0.201 1.00 0.33 N ATOM 1788 CA ILE A 141 -4.525 -0.454 1.112 1.00 0.34 C ATOM 1789 C ILE A 141 -4.997 1.009 1.131 1.00 0.38 C ATOM 1790 O ILE A 141 -5.383 1.559 0.097 1.00 0.46 O ATOM 1791 CB ILE A 141 -3.019 -0.593 0.772 1.00 0.34 C ATOM 1792 CG1 ILE A 141 -2.513 -2.054 0.846 1.00 0.32 C ATOM 1793 CG2 ILE A 141 -2.142 0.234 1.725 1.00 0.35 C ATOM 1794 CD1 ILE A 141 -2.571 -2.765 -0.505 1.00 0.38 C ATOM 0 H ILE A 141 -5.175 -1.065 -0.783 1.00 0.33 H new ATOM 0 HA ILE A 141 -4.638 -0.849 2.122 1.00 0.34 H new ATOM 0 HB ILE A 141 -2.934 -0.228 -0.252 1.00 0.34 H new ATOM 0 HG12 ILE A 141 -1.486 -2.061 1.212 1.00 0.32 H new ATOM 0 HG13 ILE A 141 -3.113 -2.606 1.569 1.00 0.32 H new ATOM 0 HG21 ILE A 141 -1.093 0.110 1.454 1.00 0.35 H new ATOM 0 HG22 ILE A 141 -2.415 1.287 1.649 1.00 0.35 H new ATOM 0 HG23 ILE A 141 -2.295 -0.107 2.749 1.00 0.35 H new ATOM 0 HD11 ILE A 141 -2.205 -3.786 -0.395 1.00 0.38 H new ATOM 0 HD12 ILE A 141 -3.601 -2.786 -0.861 1.00 0.38 H new ATOM 0 HD13 ILE A 141 -1.949 -2.232 -1.224 1.00 0.38 H new ATOM 1806 N TYR A 142 -4.947 1.632 2.313 1.00 0.38 N ATOM 1807 CA TYR A 142 -5.368 3.012 2.576 1.00 0.41 C ATOM 1808 C TYR A 142 -4.280 3.800 3.319 1.00 0.43 C ATOM 1809 O TYR A 142 -3.800 3.365 4.365 1.00 0.53 O ATOM 1810 CB TYR A 142 -6.673 2.982 3.382 1.00 0.43 C ATOM 1811 CG TYR A 142 -7.902 2.827 2.522 1.00 0.44 C ATOM 1812 CD1 TYR A 142 -8.291 1.567 2.023 1.00 1.71 C ATOM 1813 CD2 TYR A 142 -8.655 3.972 2.214 1.00 1.90 C ATOM 1814 CE1 TYR A 142 -9.455 1.448 1.244 1.00 1.67 C ATOM 1815 CE2 TYR A 142 -9.821 3.854 1.447 1.00 1.96 C ATOM 1816 CZ TYR A 142 -10.233 2.591 0.985 1.00 0.57 C ATOM 1817 OH TYR A 142 -11.395 2.479 0.306 1.00 0.71 O ATOM 0 H TYR A 142 -4.596 1.167 3.150 1.00 0.38 H new ATOM 0 HA TYR A 142 -5.534 3.523 1.628 1.00 0.41 H new ATOM 0 HB2 TYR A 142 -6.632 2.160 4.096 1.00 0.43 H new ATOM 0 HB3 TYR A 142 -6.756 3.902 3.960 1.00 0.43 H new ATOM 0 HD1 TYR A 142 -7.694 0.693 2.239 1.00 1.71 H new ATOM 0 HD2 TYR A 142 -8.336 4.941 2.568 1.00 1.90 H new ATOM 0 HE1 TYR A 142 -9.749 0.487 0.848 1.00 1.67 H new ATOM 0 HE2 TYR A 142 -10.403 4.732 1.210 1.00 1.96 H new ATOM 0 HH TYR A 142 -11.659 1.536 0.263 1.00 0.71 H new ATOM 1827 N GLU A 143 -3.892 4.967 2.800 1.00 0.42 N ATOM 1828 CA GLU A 143 -2.749 5.750 3.299 1.00 0.42 C ATOM 1829 C GLU A 143 -3.158 6.783 4.366 1.00 0.51 C ATOM 1830 O GLU A 143 -3.246 7.986 4.101 1.00 1.05 O ATOM 1831 CB GLU A 143 -1.997 6.373 2.112 1.00 0.49 C ATOM 1832 CG GLU A 143 -0.606 6.833 2.555 1.00 0.61 C ATOM 1833 CD GLU A 143 0.065 7.686 1.484 1.00 0.76 C ATOM 1834 OE1 GLU A 143 0.610 7.109 0.520 1.00 1.75 O ATOM 1835 OE2 GLU A 143 0.054 8.934 1.630 1.00 1.95 O ATOM 0 H GLU A 143 -4.367 5.405 2.010 1.00 0.42 H new ATOM 0 HA GLU A 143 -2.066 5.077 3.817 1.00 0.42 H new ATOM 0 HB2 GLU A 143 -1.908 5.646 1.305 1.00 0.49 H new ATOM 0 HB3 GLU A 143 -2.560 7.219 1.718 1.00 0.49 H new ATOM 0 HG2 GLU A 143 -0.687 7.405 3.479 1.00 0.61 H new ATOM 0 HG3 GLU A 143 0.015 5.964 2.772 1.00 0.61 H new ATOM 1842 N ILE A 144 -3.428 6.295 5.581 1.00 0.69 N ATOM 1843 CA ILE A 144 -3.865 7.122 6.714 1.00 0.63 C ATOM 1844 C ILE A 144 -2.662 7.860 7.317 1.00 0.66 C ATOM 1845 O ILE A 144 -1.864 7.280 8.050 1.00 0.73 O ATOM 1846 CB ILE A 144 -4.569 6.250 7.784 1.00 0.62 C ATOM 1847 CG1 ILE A 144 -5.658 5.312 7.212 1.00 0.65 C ATOM 1848 CG2 ILE A 144 -5.140 7.136 8.908 1.00 0.63 C ATOM 1849 CD1 ILE A 144 -6.772 5.991 6.411 1.00 0.61 C ATOM 0 H ILE A 144 -3.349 5.304 5.809 1.00 0.69 H new ATOM 0 HA ILE A 144 -4.583 7.860 6.356 1.00 0.63 H new ATOM 0 HB ILE A 144 -3.802 5.593 8.193 1.00 0.62 H new ATOM 0 HG12 ILE A 144 -5.175 4.574 6.572 1.00 0.65 H new ATOM 0 HG13 ILE A 144 -6.112 4.767 8.040 1.00 0.65 H new ATOM 0 HG21 ILE A 144 -5.631 6.509 9.652 1.00 0.63 H new ATOM 0 HG22 ILE A 144 -4.330 7.692 9.380 1.00 0.63 H new ATOM 0 HG23 ILE A 144 -5.863 7.835 8.488 1.00 0.63 H new ATOM 0 HD11 ILE A 144 -7.478 5.238 6.059 1.00 0.61 H new ATOM 0 HD12 ILE A 144 -7.292 6.708 7.047 1.00 0.61 H new ATOM 0 HD13 ILE A 144 -6.340 6.511 5.556 1.00 0.61 H new ATOM 1861 N HIS A 145 -2.585 9.174 7.103 1.00 0.77 N ATOM 1862 CA HIS A 145 -1.436 9.996 7.517 1.00 0.86 C ATOM 1863 C HIS A 145 -1.621 10.677 8.889 1.00 0.82 C ATOM 1864 O HIS A 145 -0.820 11.525 9.277 1.00 1.06 O ATOM 1865 CB HIS A 145 -1.089 10.984 6.390 1.00 1.12 C ATOM 1866 CG HIS A 145 0.333 10.827 5.926 1.00 1.99 C ATOM 1867 ND1 HIS A 145 1.383 11.681 6.171 1.00 3.05 N ATOM 1868 CD2 HIS A 145 0.834 9.764 5.226 1.00 3.02 C ATOM 1869 CE1 HIS A 145 2.487 11.156 5.621 1.00 4.24 C ATOM 1870 NE2 HIS A 145 2.204 9.981 5.031 1.00 4.24 N ATOM 0 H HIS A 145 -3.319 9.705 6.635 1.00 0.77 H new ATOM 0 HA HIS A 145 -0.585 9.333 7.674 1.00 0.86 H new ATOM 0 HB2 HIS A 145 -1.765 10.828 5.549 1.00 1.12 H new ATOM 0 HB3 HIS A 145 -1.246 12.004 6.740 1.00 1.12 H new ATOM 0 HD1 HIS A 145 1.331 12.562 6.683 1.00 3.05 H new ATOM 0 HD2 HIS A 145 0.272 8.908 4.884 1.00 3.02 H new ATOM 0 HE1 HIS A 145 3.466 11.612 5.648 1.00 4.24 H new ATOM 1878 N SER A 146 -2.678 10.320 9.629 1.00 0.77 N ATOM 1879 CA SER A 146 -3.028 10.932 10.924 1.00 0.87 C ATOM 1880 C SER A 146 -2.059 10.567 12.065 1.00 0.96 C ATOM 1881 O SER A 146 -2.021 11.263 13.084 1.00 1.21 O ATOM 1882 CB SER A 146 -4.471 10.555 11.297 1.00 1.00 C ATOM 1883 OG SER A 146 -5.024 11.468 12.231 1.00 2.39 O ATOM 0 H SER A 146 -3.327 9.586 9.343 1.00 0.77 H new ATOM 0 HA SER A 146 -2.941 12.011 10.798 1.00 0.87 H new ATOM 0 HB2 SER A 146 -5.087 10.536 10.398 1.00 1.00 H new ATOM 0 HB3 SER A 146 -4.488 9.549 11.717 1.00 1.00 H new ATOM 0 HG SER A 146 -5.942 11.201 12.446 1.00 2.39 H new ATOM 2086 N LYS A 162 -2.158 14.130 -3.516 1.00 1.52 N ATOM 2087 CA LYS A 162 -3.197 13.372 -2.781 1.00 1.42 C ATOM 2088 C LYS A 162 -3.156 11.877 -3.118 1.00 1.08 C ATOM 2089 O LYS A 162 -3.357 11.512 -4.274 1.00 1.22 O ATOM 2090 CB LYS A 162 -4.557 14.019 -3.106 1.00 1.84 C ATOM 2091 CG LYS A 162 -5.713 13.666 -2.158 1.00 1.56 C ATOM 2092 CD LYS A 162 -6.440 12.351 -2.475 1.00 1.49 C ATOM 2093 CE LYS A 162 -7.011 12.249 -3.897 1.00 1.48 C ATOM 2094 NZ LYS A 162 -8.091 13.235 -4.150 1.00 2.29 N ATOM 0 HA LYS A 162 -3.018 13.422 -1.707 1.00 1.42 H new ATOM 0 HB2 LYS A 162 -4.431 15.102 -3.107 1.00 1.84 H new ATOM 0 HB3 LYS A 162 -4.842 13.731 -4.118 1.00 1.84 H new ATOM 0 HG2 LYS A 162 -5.324 13.612 -1.141 1.00 1.56 H new ATOM 0 HG3 LYS A 162 -6.440 14.478 -2.178 1.00 1.56 H new ATOM 0 HD2 LYS A 162 -5.747 11.524 -2.318 1.00 1.49 H new ATOM 0 HD3 LYS A 162 -7.255 12.224 -1.763 1.00 1.49 H new ATOM 0 HE2 LYS A 162 -6.208 12.401 -4.619 1.00 1.48 H new ATOM 0 HE3 LYS A 162 -7.398 11.243 -4.058 1.00 1.48 H new ATOM 0 HZ1 LYS A 162 -8.441 13.124 -5.123 1.00 2.29 H new ATOM 0 HZ2 LYS A 162 -8.871 13.075 -3.481 1.00 2.29 H new ATOM 0 HZ3 LYS A 162 -7.719 14.198 -4.024 1.00 2.29 H new ATOM 2108 N ALA A 163 -2.920 11.002 -2.143 1.00 0.95 N ATOM 2109 CA ALA A 163 -2.861 9.556 -2.358 1.00 0.79 C ATOM 2110 C ALA A 163 -4.257 8.957 -2.597 1.00 0.73 C ATOM 2111 O ALA A 163 -5.193 9.167 -1.821 1.00 0.79 O ATOM 2112 CB ALA A 163 -2.136 8.877 -1.187 1.00 1.04 C ATOM 0 H ALA A 163 -2.763 11.278 -1.174 1.00 0.95 H new ATOM 0 HA ALA A 163 -2.288 9.367 -3.266 1.00 0.79 H new ATOM 0 HB1 ALA A 163 -2.098 7.801 -1.357 1.00 1.04 H new ATOM 0 HB2 ALA A 163 -1.122 9.269 -1.111 1.00 1.04 H new ATOM 0 HB3 ALA A 163 -2.673 9.079 -0.260 1.00 1.04 H new ATOM 2118 N VAL A 164 -4.396 8.185 -3.675 1.00 0.76 N ATOM 2119 CA VAL A 164 -5.605 7.401 -3.983 1.00 0.69 C ATOM 2120 C VAL A 164 -5.400 5.924 -3.593 1.00 0.67 C ATOM 2121 O VAL A 164 -4.259 5.460 -3.597 1.00 0.75 O ATOM 2122 CB VAL A 164 -6.066 7.582 -5.445 1.00 0.67 C ATOM 2123 CG1 VAL A 164 -6.901 8.861 -5.554 1.00 0.73 C ATOM 2124 CG2 VAL A 164 -4.920 7.680 -6.455 1.00 0.70 C ATOM 0 H VAL A 164 -3.661 8.081 -4.375 1.00 0.76 H new ATOM 0 HA VAL A 164 -6.424 7.787 -3.376 1.00 0.69 H new ATOM 0 HB VAL A 164 -6.640 6.689 -5.692 1.00 0.67 H new ATOM 0 HG11 VAL A 164 -7.230 8.994 -6.585 1.00 0.73 H new ATOM 0 HG12 VAL A 164 -7.772 8.784 -4.903 1.00 0.73 H new ATOM 0 HG13 VAL A 164 -6.297 9.717 -5.252 1.00 0.73 H new ATOM 0 HG21 VAL A 164 -5.328 7.806 -7.458 1.00 0.70 H new ATOM 0 HG22 VAL A 164 -4.291 8.536 -6.209 1.00 0.70 H new ATOM 0 HG23 VAL A 164 -4.323 6.768 -6.418 1.00 0.70 H new ATOM 2134 N PRO A 165 -6.450 5.175 -3.201 1.00 0.59 N ATOM 2135 CA PRO A 165 -6.299 3.831 -2.630 1.00 0.57 C ATOM 2136 C PRO A 165 -5.853 2.783 -3.665 1.00 0.59 C ATOM 2137 O PRO A 165 -5.980 2.981 -4.878 1.00 0.75 O ATOM 2138 CB PRO A 165 -7.648 3.505 -1.980 1.00 0.51 C ATOM 2139 CG PRO A 165 -8.644 4.338 -2.786 1.00 0.51 C ATOM 2140 CD PRO A 165 -7.849 5.577 -3.203 1.00 0.58 C ATOM 0 HA PRO A 165 -5.497 3.806 -1.893 1.00 0.57 H new ATOM 0 HB2 PRO A 165 -7.875 2.441 -2.039 1.00 0.51 H new ATOM 0 HB3 PRO A 165 -7.660 3.776 -0.924 1.00 0.51 H new ATOM 0 HG2 PRO A 165 -9.011 3.790 -3.654 1.00 0.51 H new ATOM 0 HG3 PRO A 165 -9.514 4.607 -2.187 1.00 0.51 H new ATOM 0 HD2 PRO A 165 -8.154 5.922 -4.191 1.00 0.58 H new ATOM 0 HD3 PRO A 165 -8.019 6.401 -2.510 1.00 0.58 H new ATOM 2148 N ILE A 166 -5.326 1.654 -3.180 1.00 0.53 N ATOM 2149 CA ILE A 166 -4.651 0.632 -4.000 1.00 0.56 C ATOM 2150 C ILE A 166 -5.341 -0.727 -3.850 1.00 0.50 C ATOM 2151 O ILE A 166 -5.512 -1.203 -2.729 1.00 0.53 O ATOM 2152 CB ILE A 166 -3.144 0.503 -3.650 1.00 0.68 C ATOM 2153 CG1 ILE A 166 -2.425 1.837 -3.340 1.00 0.82 C ATOM 2154 CG2 ILE A 166 -2.425 -0.192 -4.816 1.00 0.78 C ATOM 2155 CD1 ILE A 166 -2.476 2.192 -1.846 1.00 1.55 C ATOM 0 H ILE A 166 -5.355 1.417 -2.188 1.00 0.53 H new ATOM 0 HA ILE A 166 -4.724 0.959 -5.037 1.00 0.56 H new ATOM 0 HB ILE A 166 -3.100 -0.077 -2.728 1.00 0.68 H new ATOM 0 HG12 ILE A 166 -1.385 1.770 -3.660 1.00 0.82 H new ATOM 0 HG13 ILE A 166 -2.885 2.638 -3.918 1.00 0.82 H new ATOM 0 HG21 ILE A 166 -1.365 -0.289 -4.583 1.00 0.78 H new ATOM 0 HG22 ILE A 166 -2.855 -1.182 -4.971 1.00 0.78 H new ATOM 0 HG23 ILE A 166 -2.545 0.401 -5.723 1.00 0.78 H new ATOM 0 HD11 ILE A 166 -1.958 3.136 -1.679 1.00 1.55 H new ATOM 0 HD12 ILE A 166 -3.515 2.287 -1.530 1.00 1.55 H new ATOM 0 HD13 ILE A 166 -1.991 1.405 -1.268 1.00 1.55 H new ATOM 2167 N GLU A 167 -5.702 -1.367 -4.964 1.00 0.54 N ATOM 2168 CA GLU A 167 -6.325 -2.698 -5.005 1.00 0.54 C ATOM 2169 C GLU A 167 -5.288 -3.830 -5.169 1.00 0.57 C ATOM 2170 O GLU A 167 -4.334 -3.713 -5.951 1.00 0.71 O ATOM 2171 CB GLU A 167 -7.382 -2.706 -6.125 1.00 0.70 C ATOM 2172 CG GLU A 167 -8.322 -3.916 -6.076 1.00 1.49 C ATOM 2173 CD GLU A 167 -9.250 -3.937 -7.294 1.00 1.84 C ATOM 2174 OE1 GLU A 167 -8.840 -4.451 -8.362 1.00 2.57 O ATOM 2175 OE2 GLU A 167 -10.428 -3.520 -7.193 1.00 2.72 O ATOM 0 H GLU A 167 -5.566 -0.964 -5.891 1.00 0.54 H new ATOM 0 HA GLU A 167 -6.810 -2.896 -4.049 1.00 0.54 H new ATOM 0 HB2 GLU A 167 -7.975 -1.794 -6.060 1.00 0.70 H new ATOM 0 HB3 GLU A 167 -6.876 -2.689 -7.090 1.00 0.70 H new ATOM 0 HG2 GLU A 167 -7.737 -4.835 -6.044 1.00 1.49 H new ATOM 0 HG3 GLU A 167 -8.915 -3.884 -5.162 1.00 1.49 H new ATOM 2182 N ILE A 168 -5.478 -4.944 -4.451 1.00 0.47 N ATOM 2183 CA ILE A 168 -4.585 -6.111 -4.455 1.00 0.43 C ATOM 2184 C ILE A 168 -5.358 -7.430 -4.245 1.00 0.46 C ATOM 2185 O ILE A 168 -6.347 -7.484 -3.514 1.00 0.49 O ATOM 2186 CB ILE A 168 -3.464 -5.897 -3.402 1.00 0.38 C ATOM 2187 CG1 ILE A 168 -2.355 -6.960 -3.533 1.00 0.42 C ATOM 2188 CG2 ILE A 168 -4.007 -5.861 -1.960 1.00 0.39 C ATOM 2189 CD1 ILE A 168 -1.080 -6.628 -2.745 1.00 0.40 C ATOM 0 H ILE A 168 -6.281 -5.062 -3.833 1.00 0.47 H new ATOM 0 HA ILE A 168 -4.120 -6.204 -5.437 1.00 0.43 H new ATOM 0 HB ILE A 168 -3.032 -4.919 -3.612 1.00 0.38 H new ATOM 0 HG12 ILE A 168 -2.743 -7.920 -3.191 1.00 0.42 H new ATOM 0 HG13 ILE A 168 -2.100 -7.077 -4.586 1.00 0.42 H new ATOM 0 HG21 ILE A 168 -3.182 -5.709 -1.264 1.00 0.39 H new ATOM 0 HG22 ILE A 168 -4.721 -5.043 -1.860 1.00 0.39 H new ATOM 0 HG23 ILE A 168 -4.503 -6.805 -1.734 1.00 0.39 H new ATOM 0 HD11 ILE A 168 -0.347 -7.422 -2.887 1.00 0.40 H new ATOM 0 HD12 ILE A 168 -0.667 -5.685 -3.102 1.00 0.40 H new ATOM 0 HD13 ILE A 168 -1.320 -6.541 -1.685 1.00 0.40 H new ATOM 2201 N GLU A 169 -4.897 -8.517 -4.863 1.00 0.53 N ATOM 2202 CA GLU A 169 -5.360 -9.890 -4.614 1.00 0.57 C ATOM 2203 C GLU A 169 -4.190 -10.783 -4.152 1.00 0.59 C ATOM 2204 O GLU A 169 -3.016 -10.498 -4.421 1.00 0.61 O ATOM 2205 CB GLU A 169 -6.077 -10.429 -5.867 1.00 0.63 C ATOM 2206 CG GLU A 169 -6.805 -11.759 -5.618 1.00 0.70 C ATOM 2207 CD GLU A 169 -7.806 -12.138 -6.718 1.00 1.05 C ATOM 2208 OE1 GLU A 169 -7.472 -12.062 -7.925 1.00 1.63 O ATOM 2209 OE2 GLU A 169 -8.912 -12.629 -6.386 1.00 2.30 O ATOM 0 H GLU A 169 -4.168 -8.469 -5.574 1.00 0.53 H new ATOM 0 HA GLU A 169 -6.085 -9.896 -3.800 1.00 0.57 H new ATOM 0 HB2 GLU A 169 -6.796 -9.687 -6.214 1.00 0.63 H new ATOM 0 HB3 GLU A 169 -5.348 -10.564 -6.666 1.00 0.63 H new ATOM 0 HG2 GLU A 169 -6.065 -12.554 -5.524 1.00 0.70 H new ATOM 0 HG3 GLU A 169 -7.332 -11.700 -4.666 1.00 0.70 H new ATOM 2216 N LEU A 170 -4.504 -11.863 -3.431 1.00 0.66 N ATOM 2217 CA LEU A 170 -3.512 -12.783 -2.866 1.00 0.74 C ATOM 2218 C LEU A 170 -2.758 -13.572 -3.962 1.00 0.82 C ATOM 2219 O LEU A 170 -3.327 -13.853 -5.027 1.00 0.90 O ATOM 2220 CB LEU A 170 -4.186 -13.688 -1.812 1.00 0.90 C ATOM 2221 CG LEU A 170 -4.224 -13.139 -0.367 1.00 0.73 C ATOM 2222 CD1 LEU A 170 -2.945 -13.461 0.396 1.00 1.30 C ATOM 2223 CD2 LEU A 170 -4.420 -11.626 -0.265 1.00 1.30 C ATOM 0 H LEU A 170 -5.467 -12.127 -3.220 1.00 0.66 H new ATOM 0 HA LEU A 170 -2.740 -12.205 -2.358 1.00 0.74 H new ATOM 0 HB2 LEU A 170 -5.210 -13.883 -2.132 1.00 0.90 H new ATOM 0 HB3 LEU A 170 -3.667 -14.647 -1.801 1.00 0.90 H new ATOM 0 HG LEU A 170 -5.091 -13.638 0.066 1.00 0.73 H new ATOM 0 HD11 LEU A 170 -3.013 -13.058 1.406 1.00 1.30 H new ATOM 0 HD12 LEU A 170 -2.813 -14.542 0.445 1.00 1.30 H new ATOM 0 HD13 LEU A 170 -2.093 -13.014 -0.117 1.00 1.30 H new ATOM 0 HD21 LEU A 170 -4.434 -11.331 0.784 1.00 1.30 H new ATOM 0 HD22 LEU A 170 -3.601 -11.118 -0.774 1.00 1.30 H new ATOM 0 HD23 LEU A 170 -5.365 -11.349 -0.732 1.00 1.30 H new ATOM 2235 N PRO A 171 -1.480 -13.927 -3.724 1.00 0.86 N ATOM 2236 CA PRO A 171 -0.584 -14.444 -4.750 1.00 0.94 C ATOM 2237 C PRO A 171 -0.805 -15.925 -5.083 1.00 0.99 C ATOM 2238 O PRO A 171 -0.494 -16.802 -4.282 1.00 1.14 O ATOM 2239 CB PRO A 171 0.830 -14.210 -4.198 1.00 0.94 C ATOM 2240 CG PRO A 171 0.640 -14.316 -2.688 1.00 0.90 C ATOM 2241 CD PRO A 171 -0.753 -13.738 -2.475 1.00 0.89 C ATOM 0 HA PRO A 171 -0.764 -13.932 -5.695 1.00 0.94 H new ATOM 0 HB2 PRO A 171 1.534 -14.955 -4.568 1.00 0.94 H new ATOM 0 HB3 PRO A 171 1.218 -13.233 -4.487 1.00 0.94 H new ATOM 0 HG2 PRO A 171 0.705 -15.349 -2.345 1.00 0.90 H new ATOM 0 HG3 PRO A 171 1.398 -13.751 -2.145 1.00 0.90 H new ATOM 0 HD2 PRO A 171 -1.260 -14.242 -1.652 1.00 0.89 H new ATOM 0 HD3 PRO A 171 -0.698 -12.681 -2.215 1.00 0.89 H new ATOM 2249 N LEU A 172 -1.289 -16.192 -6.295 1.00 0.97 N ATOM 2250 CA LEU A 172 -1.293 -17.520 -6.936 1.00 1.01 C ATOM 2251 C LEU A 172 -0.468 -17.501 -8.254 1.00 1.15 C ATOM 2252 O LEU A 172 -0.315 -18.512 -8.941 1.00 2.09 O ATOM 2253 CB LEU A 172 -2.758 -17.974 -7.089 1.00 1.08 C ATOM 2254 CG LEU A 172 -2.976 -19.445 -7.490 1.00 1.42 C ATOM 2255 CD1 LEU A 172 -2.330 -20.424 -6.505 1.00 2.10 C ATOM 2256 CD2 LEU A 172 -4.477 -19.731 -7.525 1.00 2.79 C ATOM 0 H LEU A 172 -1.705 -15.470 -6.883 1.00 0.97 H new ATOM 0 HA LEU A 172 -0.790 -18.265 -6.319 1.00 1.01 H new ATOM 0 HB2 LEU A 172 -3.272 -17.797 -6.144 1.00 1.08 H new ATOM 0 HB3 LEU A 172 -3.237 -17.341 -7.836 1.00 1.08 H new ATOM 0 HG LEU A 172 -2.512 -19.588 -8.466 1.00 1.42 H new ATOM 0 HD11 LEU A 172 -2.514 -21.446 -6.835 1.00 2.10 H new ATOM 0 HD12 LEU A 172 -1.256 -20.243 -6.464 1.00 2.10 H new ATOM 0 HD13 LEU A 172 -2.760 -20.280 -5.514 1.00 2.10 H new ATOM 0 HD21 LEU A 172 -4.643 -20.770 -7.808 1.00 2.79 H new ATOM 0 HD22 LEU A 172 -4.905 -19.551 -6.539 1.00 2.79 H new ATOM 0 HD23 LEU A 172 -4.955 -19.076 -8.253 1.00 2.79 H new ATOM 2268 N ASN A 173 0.100 -16.329 -8.556 1.00 1.18 N ATOM 2269 CA ASN A 173 0.930 -15.964 -9.703 1.00 1.22 C ATOM 2270 C ASN A 173 2.371 -16.499 -9.553 1.00 1.25 C ATOM 2271 O ASN A 173 2.772 -16.918 -8.465 1.00 1.99 O ATOM 2272 CB ASN A 173 0.858 -14.424 -9.761 1.00 1.39 C ATOM 2273 CG ASN A 173 1.325 -13.770 -11.045 1.00 1.63 C ATOM 2274 OD1 ASN A 173 1.718 -14.405 -12.012 1.00 2.90 O ATOM 2275 ND2 ASN A 173 1.273 -12.460 -11.074 1.00 1.45 N ATOM 0 H ASN A 173 -0.026 -15.530 -7.935 1.00 1.18 H new ATOM 0 HA ASN A 173 0.578 -16.408 -10.634 1.00 1.22 H new ATOM 0 HB2 ASN A 173 -0.175 -14.124 -9.582 1.00 1.39 H new ATOM 0 HB3 ASN A 173 1.452 -14.024 -8.939 1.00 1.39 H new ATOM 0 HD21 ASN A 173 1.563 -11.957 -11.912 1.00 1.45 H new ATOM 0 HD22 ASN A 173 0.942 -11.945 -10.258 1.00 1.45 H new ATOM 2282 N ASP A 174 3.181 -16.437 -10.612 1.00 1.17 N ATOM 2283 CA ASP A 174 4.516 -17.057 -10.687 1.00 1.27 C ATOM 2284 C ASP A 174 5.641 -16.365 -9.890 1.00 1.20 C ATOM 2285 O ASP A 174 6.827 -16.586 -10.162 1.00 1.36 O ATOM 2286 CB ASP A 174 4.922 -17.318 -12.150 1.00 1.47 C ATOM 2287 CG ASP A 174 5.196 -16.102 -13.051 1.00 2.77 C ATOM 2288 OD1 ASP A 174 5.032 -14.926 -12.641 1.00 4.21 O ATOM 2289 OD2 ASP A 174 5.593 -16.340 -14.219 1.00 3.48 O ATOM 0 H ASP A 174 2.925 -15.942 -11.466 1.00 1.17 H new ATOM 0 HA ASP A 174 4.398 -18.008 -10.168 1.00 1.27 H new ATOM 0 HB2 ASP A 174 5.819 -17.937 -12.142 1.00 1.47 H new ATOM 0 HB3 ASP A 174 4.132 -17.908 -12.616 1.00 1.47 H new ATOM 2294 N VAL A 175 5.305 -15.534 -8.901 1.00 1.10 N ATOM 2295 CA VAL A 175 6.267 -14.654 -8.224 1.00 1.06 C ATOM 2296 C VAL A 175 6.836 -15.245 -6.928 1.00 1.03 C ATOM 2297 O VAL A 175 6.167 -15.998 -6.214 1.00 1.07 O ATOM 2298 CB VAL A 175 5.768 -13.201 -8.086 1.00 1.01 C ATOM 2299 CG1 VAL A 175 4.950 -12.767 -9.308 1.00 1.27 C ATOM 2300 CG2 VAL A 175 4.937 -12.913 -6.839 1.00 0.78 C ATOM 0 H VAL A 175 4.353 -15.450 -8.544 1.00 1.10 H new ATOM 0 HA VAL A 175 7.125 -14.594 -8.893 1.00 1.06 H new ATOM 0 HB VAL A 175 6.690 -12.626 -8.001 1.00 1.01 H new ATOM 0 HG11 VAL A 175 4.615 -11.738 -9.175 1.00 1.27 H new ATOM 0 HG12 VAL A 175 5.569 -12.835 -10.203 1.00 1.27 H new ATOM 0 HG13 VAL A 175 4.083 -13.419 -9.416 1.00 1.27 H new ATOM 0 HG21 VAL A 175 4.636 -11.866 -6.837 1.00 0.78 H new ATOM 0 HG22 VAL A 175 4.050 -13.546 -6.839 1.00 0.78 H new ATOM 0 HG23 VAL A 175 5.531 -13.122 -5.949 1.00 0.78 H new ATOM 2310 N VAL A 176 8.091 -14.909 -6.630 1.00 1.04 N ATOM 2311 CA VAL A 176 8.829 -15.359 -5.431 1.00 1.05 C ATOM 2312 C VAL A 176 8.611 -14.425 -4.234 1.00 0.85 C ATOM 2313 O VAL A 176 8.614 -14.870 -3.086 1.00 0.85 O ATOM 2314 CB VAL A 176 10.338 -15.468 -5.747 1.00 1.24 C ATOM 2315 CG1 VAL A 176 11.135 -16.039 -4.568 1.00 1.59 C ATOM 2316 CG2 VAL A 176 10.596 -16.385 -6.950 1.00 1.64 C ATOM 0 H VAL A 176 8.646 -14.298 -7.229 1.00 1.04 H new ATOM 0 HA VAL A 176 8.439 -16.340 -5.157 1.00 1.05 H new ATOM 0 HB VAL A 176 10.664 -14.450 -5.961 1.00 1.24 H new ATOM 0 HG11 VAL A 176 12.190 -16.097 -4.836 1.00 1.59 H new ATOM 0 HG12 VAL A 176 11.016 -15.390 -3.700 1.00 1.59 H new ATOM 0 HG13 VAL A 176 10.766 -17.036 -4.328 1.00 1.59 H new ATOM 0 HG21 VAL A 176 11.667 -16.438 -7.144 1.00 1.64 H new ATOM 0 HG22 VAL A 176 10.216 -17.384 -6.734 1.00 1.64 H new ATOM 0 HG23 VAL A 176 10.088 -15.985 -7.828 1.00 1.64 H new ATOM 2326 N ASP A 177 8.428 -13.132 -4.498 1.00 0.76 N ATOM 2327 CA ASP A 177 8.324 -12.065 -3.499 1.00 0.61 C ATOM 2328 C ASP A 177 7.359 -10.986 -4.029 1.00 0.48 C ATOM 2329 O ASP A 177 7.517 -10.538 -5.169 1.00 0.53 O ATOM 2330 CB ASP A 177 9.751 -11.529 -3.258 1.00 0.90 C ATOM 2331 CG ASP A 177 9.923 -10.638 -2.027 1.00 1.53 C ATOM 2332 OD1 ASP A 177 9.032 -10.611 -1.150 1.00 2.42 O ATOM 2333 OD2 ASP A 177 11.011 -10.024 -1.886 1.00 2.54 O ATOM 0 H ASP A 177 8.344 -12.783 -5.453 1.00 0.76 H new ATOM 0 HA ASP A 177 7.920 -12.414 -2.549 1.00 0.61 H new ATOM 0 HB2 ASP A 177 10.428 -12.378 -3.167 1.00 0.90 H new ATOM 0 HB3 ASP A 177 10.062 -10.966 -4.138 1.00 0.90 H new ATOM 2338 N ALA A 178 6.343 -10.612 -3.243 1.00 0.38 N ATOM 2339 CA ALA A 178 5.225 -9.761 -3.674 1.00 0.34 C ATOM 2340 C ALA A 178 5.378 -8.311 -3.203 1.00 0.39 C ATOM 2341 O ALA A 178 5.820 -8.083 -2.072 1.00 0.42 O ATOM 2342 CB ALA A 178 3.906 -10.340 -3.144 1.00 0.35 C ATOM 0 H ALA A 178 6.273 -10.899 -2.267 1.00 0.38 H new ATOM 0 HA ALA A 178 5.224 -9.750 -4.764 1.00 0.34 H new ATOM 0 HB1 ALA A 178 3.077 -9.709 -3.464 1.00 0.35 H new ATOM 0 HB2 ALA A 178 3.767 -11.347 -3.536 1.00 0.35 H new ATOM 0 HB3 ALA A 178 3.936 -10.376 -2.055 1.00 0.35 H new ATOM 2348 N HIS A 179 4.972 -7.337 -4.028 1.00 0.42 N ATOM 2349 CA HIS A 179 5.118 -5.915 -3.681 1.00 0.44 C ATOM 2350 C HIS A 179 3.916 -5.018 -4.050 1.00 0.45 C ATOM 2351 O HIS A 179 2.973 -5.447 -4.729 1.00 0.54 O ATOM 2352 CB HIS A 179 6.441 -5.363 -4.250 1.00 0.46 C ATOM 2353 CG HIS A 179 7.674 -6.173 -3.915 1.00 0.48 C ATOM 2354 ND1 HIS A 179 8.605 -5.826 -2.969 1.00 0.56 N ATOM 2355 CD2 HIS A 179 8.051 -7.396 -4.414 1.00 0.52 C ATOM 2356 CE1 HIS A 179 9.501 -6.817 -2.864 1.00 0.65 C ATOM 2357 NE2 HIS A 179 9.214 -7.797 -3.739 1.00 0.61 N ATOM 0 H HIS A 179 4.541 -7.505 -4.937 1.00 0.42 H new ATOM 0 HA HIS A 179 5.143 -5.879 -2.592 1.00 0.44 H new ATOM 0 HB2 HIS A 179 6.352 -5.298 -5.334 1.00 0.46 H new ATOM 0 HB3 HIS A 179 6.581 -4.347 -3.880 1.00 0.46 H new ATOM 0 HD1 HIS A 179 8.614 -4.958 -2.434 1.00 0.56 H new ATOM 0 HD2 HIS A 179 7.542 -7.951 -5.189 1.00 0.52 H new ATOM 0 HE1 HIS A 179 10.333 -6.827 -2.176 1.00 0.65 H new ATOM 2365 N VAL A 180 3.953 -3.766 -3.566 1.00 0.40 N ATOM 2366 CA VAL A 180 2.952 -2.699 -3.792 1.00 0.41 C ATOM 2367 C VAL A 180 3.627 -1.337 -4.012 1.00 0.41 C ATOM 2368 O VAL A 180 4.549 -0.998 -3.271 1.00 0.40 O ATOM 2369 CB VAL A 180 1.990 -2.517 -2.596 1.00 0.42 C ATOM 2370 CG1 VAL A 180 0.632 -2.001 -3.064 1.00 0.58 C ATOM 2371 CG2 VAL A 180 1.773 -3.744 -1.712 1.00 0.45 C ATOM 0 H VAL A 180 4.721 -3.449 -2.974 1.00 0.40 H new ATOM 0 HA VAL A 180 2.397 -3.018 -4.674 1.00 0.41 H new ATOM 0 HB VAL A 180 2.502 -1.788 -1.968 1.00 0.42 H new ATOM 0 HG11 VAL A 180 -0.028 -1.881 -2.205 1.00 0.58 H new ATOM 0 HG12 VAL A 180 0.760 -1.039 -3.561 1.00 0.58 H new ATOM 0 HG13 VAL A 180 0.193 -2.714 -3.762 1.00 0.58 H new ATOM 0 HG21 VAL A 180 1.080 -3.495 -0.908 1.00 0.45 H new ATOM 0 HG22 VAL A 180 1.358 -4.555 -2.311 1.00 0.45 H new ATOM 0 HG23 VAL A 180 2.726 -4.059 -1.286 1.00 0.45 H new ATOM 2381 N TYR A 181 3.120 -0.525 -4.947 1.00 0.45 N ATOM 2382 CA TYR A 181 3.646 0.810 -5.281 1.00 0.46 C ATOM 2383 C TYR A 181 2.537 1.891 -5.380 1.00 0.49 C ATOM 2384 O TYR A 181 2.070 2.210 -6.479 1.00 0.58 O ATOM 2385 CB TYR A 181 4.506 0.714 -6.547 1.00 0.50 C ATOM 2386 CG TYR A 181 5.824 -0.002 -6.307 1.00 0.55 C ATOM 2387 CD1 TYR A 181 5.918 -1.402 -6.425 1.00 1.78 C ATOM 2388 CD2 TYR A 181 6.955 0.741 -5.924 1.00 2.13 C ATOM 2389 CE1 TYR A 181 7.146 -2.048 -6.192 1.00 1.75 C ATOM 2390 CE2 TYR A 181 8.193 0.103 -5.717 1.00 2.23 C ATOM 2391 CZ TYR A 181 8.294 -1.297 -5.868 1.00 0.77 C ATOM 2392 OH TYR A 181 9.496 -1.918 -5.749 1.00 0.94 O ATOM 0 H TYR A 181 2.309 -0.783 -5.510 1.00 0.45 H new ATOM 0 HA TYR A 181 4.279 1.147 -4.460 1.00 0.46 H new ATOM 0 HB2 TYR A 181 3.948 0.189 -7.322 1.00 0.50 H new ATOM 0 HB3 TYR A 181 4.705 1.718 -6.923 1.00 0.50 H new ATOM 0 HD1 TYR A 181 5.047 -1.980 -6.695 1.00 1.78 H new ATOM 0 HD2 TYR A 181 6.873 1.809 -5.788 1.00 2.13 H new ATOM 0 HE1 TYR A 181 7.209 -3.124 -6.262 1.00 1.75 H new ATOM 0 HE2 TYR A 181 9.062 0.683 -5.444 1.00 2.23 H new ATOM 0 HH TYR A 181 10.184 -1.258 -5.523 1.00 0.94 H new ATOM 2402 N PRO A 182 2.109 2.467 -4.237 1.00 0.47 N ATOM 2403 CA PRO A 182 1.204 3.618 -4.171 1.00 0.53 C ATOM 2404 C PRO A 182 1.802 4.913 -4.738 1.00 0.52 C ATOM 2405 O PRO A 182 2.991 5.202 -4.561 1.00 0.54 O ATOM 2406 CB PRO A 182 0.824 3.806 -2.698 1.00 0.59 C ATOM 2407 CG PRO A 182 1.815 2.958 -1.907 1.00 0.52 C ATOM 2408 CD PRO A 182 2.375 1.950 -2.909 1.00 0.46 C ATOM 0 HA PRO A 182 0.336 3.411 -4.796 1.00 0.53 H new ATOM 0 HB2 PRO A 182 0.887 4.855 -2.408 1.00 0.59 H new ATOM 0 HB3 PRO A 182 -0.201 3.485 -2.514 1.00 0.59 H new ATOM 0 HG2 PRO A 182 2.609 3.574 -1.483 1.00 0.52 H new ATOM 0 HG3 PRO A 182 1.324 2.454 -1.075 1.00 0.52 H new ATOM 0 HD2 PRO A 182 3.446 1.813 -2.758 1.00 0.46 H new ATOM 0 HD3 PRO A 182 1.906 0.975 -2.776 1.00 0.46 H new ATOM 2416 N LYS A 183 0.928 5.691 -5.390 1.00 0.57 N ATOM 2417 CA LYS A 183 1.162 6.970 -6.090 1.00 0.60 C ATOM 2418 C LYS A 183 -0.003 7.954 -5.850 1.00 0.59 C ATOM 2419 O LYS A 183 -1.071 7.562 -5.366 1.00 0.94 O ATOM 2420 CB LYS A 183 1.335 6.685 -7.593 1.00 0.71 C ATOM 2421 CG LYS A 183 2.603 5.866 -7.901 1.00 1.04 C ATOM 2422 CD LYS A 183 2.766 5.424 -9.363 1.00 1.64 C ATOM 2423 CE LYS A 183 1.868 4.248 -9.778 1.00 1.42 C ATOM 2424 NZ LYS A 183 0.449 4.620 -9.963 1.00 1.90 N ATOM 0 H LYS A 183 -0.053 5.419 -5.449 1.00 0.57 H new ATOM 0 HA LYS A 183 2.066 7.437 -5.699 1.00 0.60 H new ATOM 0 HB2 LYS A 183 0.461 6.146 -7.959 1.00 0.71 H new ATOM 0 HB3 LYS A 183 1.377 7.630 -8.135 1.00 0.71 H new ATOM 0 HG2 LYS A 183 3.474 6.458 -7.619 1.00 1.04 H new ATOM 0 HG3 LYS A 183 2.603 4.978 -7.269 1.00 1.04 H new ATOM 0 HD2 LYS A 183 2.553 6.274 -10.012 1.00 1.64 H new ATOM 0 HD3 LYS A 183 3.807 5.147 -9.532 1.00 1.64 H new ATOM 0 HE2 LYS A 183 2.247 3.823 -10.707 1.00 1.42 H new ATOM 0 HE3 LYS A 183 1.934 3.467 -9.020 1.00 1.42 H new ATOM 0 HZ1 LYS A 183 0.089 4.192 -10.840 1.00 1.90 H new ATOM 0 HZ2 LYS A 183 -0.108 4.275 -9.156 1.00 1.90 H new ATOM 0 HZ3 LYS A 183 0.366 5.655 -10.023 1.00 1.90 H new ATOM 2438 N ASN A 184 0.190 9.232 -6.188 0.49 0.50 N ATOM 2439 CA ASN A 184 -0.744 10.320 -5.855 0.49 0.53 C ATOM 2440 C ASN A 184 -1.338 11.010 -7.102 0.49 0.66 C ATOM 2441 O ASN A 184 -0.918 10.762 -8.234 0.49 0.83 O ATOM 2442 CB ASN A 184 -0.051 11.313 -4.893 0.49 0.79 C ATOM 2443 CG ASN A 184 0.299 10.755 -3.523 0.49 1.96 C ATOM 2444 OD1 ASN A 184 0.482 9.567 -3.318 0.49 2.95 O ATOM 2445 ND2 ASN A 184 0.437 11.592 -2.525 0.49 2.64 N ATOM 0 H ASN A 184 1.009 9.548 -6.707 0.49 0.50 H new ATOM 0 HA ASN A 184 -1.606 9.888 -5.346 0.49 0.53 H new ATOM 0 HB2 ASN A 184 0.864 11.672 -5.365 0.49 0.79 H new ATOM 0 HB3 ASN A 184 -0.701 12.177 -4.759 0.49 0.79 H new ATOM 0 HD21 ASN A 184 0.692 11.245 -1.600 0.49 2.64 H new ATOM 0 HD22 ASN A 184 0.289 12.590 -2.673 0.49 2.64 H new ATOM 2452 N THR A 185 -2.350 11.855 -6.889 0.49 0.73 N ATOM 2453 CA THR A 185 -3.102 12.601 -7.911 0.49 0.94 C ATOM 2454 C THR A 185 -3.518 13.997 -7.408 0.49 1.24 C ATOM 2455 O THR A 185 -3.401 14.321 -6.225 0.49 2.54 O ATOM 2456 CB THR A 185 -4.322 11.772 -8.375 0.49 0.91 C ATOM 2457 OG1 THR A 185 -4.929 12.330 -9.522 0.49 1.27 O ATOM 2458 CG2 THR A 185 -5.418 11.656 -7.315 0.49 0.92 C ATOM 0 H THR A 185 -2.689 12.051 -5.947 0.49 0.73 H new ATOM 0 HA THR A 185 -2.450 12.764 -8.769 0.49 0.94 H new ATOM 0 HB THR A 185 -3.910 10.785 -8.584 0.49 0.91 H new ATOM 0 HG1 THR A 185 -5.695 11.779 -9.788 0.49 1.27 H new ATOM 0 HG21 THR A 185 -6.243 11.062 -7.708 0.49 0.92 H new ATOM 0 HG22 THR A 185 -5.014 11.173 -6.425 0.49 0.92 H new ATOM 0 HG23 THR A 185 -5.779 12.651 -7.055 0.49 0.92 H new