USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=31 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 88 ASN : amide:sc= 0.199 X(o=0.42,f=0.27) USER MOD Set 1.2: A 142 TYR OH : rot 126:sc= 0.216 USER MOD Set 2.1: A 85 ASN : amide:sc= -0.0176 K(o=-0.018,f=-1) USER MOD Set 2.2: A 86 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 40 HIS : no HE2:sc= 1.41 K(o=1.4,f=-9.2!) USER MOD Set 3.2: A 179 HIS : no HE2:sc= 0.00913 K(o=1.4,f=-7.3!) USER MOD Single : A 32 THR OG1 : rot -26:sc= 0.275 USER MOD Single : A 33 THR OG1 : rot 120:sc= -0.0372 USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.0254 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0218 USER MOD Single : A 36 SER OG : rot -4:sc= 0.338 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 166:sc= 1.05 (180deg=0.693) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 170:sc= -0.699 (180deg=-1.01) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0.958 K(o=0.96,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) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.284 X(o=-0.28,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= -0.285 K(o=-0.28,f=-3.5!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl -177:sc= 0 (180deg=-0.0137) USER MOD Single : A 84 THR OG1 : rot -162:sc= 0.744 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 ASN : amide:sc= 0.498 K(o=0.5,f=-0.45) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 97 THR OG1 : rot 154:sc= 1.22 USER MOD Single : A 101 ASN : amide:sc= -0.46 X(o=-0.46,f=-0.1) USER MOD Single : A 105 GLN : amide:sc= -0.193 X(o=-0.19,f=0) USER MOD Single : A 106 THR OG1 : rot -160:sc= -0.36 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 170:sc= 0.6 USER MOD Single : A 113 MET CE :methyl 144:sc= -0.415 (180deg=-0.799) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.0494 USER MOD Single : A 118 MET CE :methyl 168:sc= -1.24 (180deg=-1.69) 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 1:sc= -0.887 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 ASN : amide:sc= 0.894 K(o=0.89,f=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 TYR OH : rot 6:sc= 1.07 USER MOD Single : A 140 LYS NZ :NH3+ 159:sc= 0.526 (180deg=-1.73) USER MOD Single : A 145 HIS : no HD1:sc= -0.362 X(o=-0.36,f=-0.36) USER MOD Single : A 146 SER OG : rot 180:sc=-0.00581 USER MOD Single : A 162 LYS NZ :NH3+ 160:sc= 0.998 (180deg=0.722) USER MOD Single : A 173 ASN : amide:sc= 0.022 K(o=0.022,f=-2.6!) USER MOD Single : A 181 TYR OH : rot 30:sc= 0.215 USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 184 ASN : amide:sc= -0.45 K(o=-0.45,f=-3.2!) USER MOD Single : A 185 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 167 N THR A 32 -0.735 -19.710 -1.539 1.00 1.04 N ATOM 168 CA THR A 32 0.030 -18.563 -2.062 1.00 0.85 C ATOM 169 C THR A 32 1.513 -18.903 -2.253 1.00 0.93 C ATOM 170 O THR A 32 2.011 -19.878 -1.677 1.00 1.14 O ATOM 171 CB THR A 32 -0.123 -17.338 -1.140 1.00 0.85 C ATOM 172 OG1 THR A 32 -0.070 -17.687 0.227 1.00 1.16 O ATOM 173 CG2 THR A 32 -1.439 -16.597 -1.357 1.00 0.83 C ATOM 0 HA THR A 32 -0.383 -18.321 -3.041 1.00 0.85 H new ATOM 0 HB THR A 32 0.716 -16.694 -1.403 1.00 0.85 H new ATOM 0 HG1 THR A 32 -0.352 -18.619 0.338 1.00 1.16 H new ATOM 0 HG21 THR A 32 -1.492 -15.744 -0.681 1.00 0.83 H new ATOM 0 HG22 THR A 32 -1.494 -16.247 -2.388 1.00 0.83 H new ATOM 0 HG23 THR A 32 -2.273 -17.270 -1.158 1.00 0.83 H new ATOM 181 N THR A 33 2.239 -18.125 -3.069 1.00 0.81 N ATOM 182 CA THR A 33 3.647 -18.408 -3.449 1.00 0.82 C ATOM 183 C THR A 33 4.694 -17.712 -2.565 1.00 0.82 C ATOM 184 O THR A 33 5.894 -17.989 -2.660 1.00 1.09 O ATOM 185 CB THR A 33 3.890 -18.162 -4.947 1.00 0.86 C ATOM 186 OG1 THR A 33 3.495 -16.868 -5.337 1.00 1.31 O ATOM 187 CG2 THR A 33 3.089 -19.149 -5.799 1.00 1.13 C ATOM 0 H THR A 33 1.870 -17.273 -3.492 1.00 0.81 H new ATOM 0 HA THR A 33 3.791 -19.472 -3.259 1.00 0.82 H new ATOM 0 HB THR A 33 4.961 -18.289 -5.104 1.00 0.86 H new ATOM 0 HG1 THR A 33 4.268 -16.384 -5.696 1.00 1.31 H new ATOM 0 HG21 THR A 33 3.278 -18.955 -6.855 1.00 1.13 H new ATOM 0 HG22 THR A 33 3.392 -20.168 -5.558 1.00 1.13 H new ATOM 0 HG23 THR A 33 2.026 -19.029 -5.592 1.00 1.13 H new ATOM 195 N THR A 34 4.233 -16.835 -1.671 1.00 0.76 N ATOM 196 CA THR A 34 4.979 -16.257 -0.545 1.00 0.80 C ATOM 197 C THR A 34 3.997 -15.889 0.572 1.00 0.65 C ATOM 198 O THR A 34 2.825 -15.607 0.316 1.00 0.70 O ATOM 199 CB THR A 34 5.839 -15.043 -0.934 1.00 1.13 C ATOM 200 OG1 THR A 34 6.540 -14.594 0.210 1.00 2.35 O ATOM 201 CG2 THR A 34 5.026 -13.862 -1.457 1.00 0.89 C ATOM 0 H THR A 34 3.275 -16.488 -1.713 1.00 0.76 H new ATOM 0 HA THR A 34 5.681 -17.015 -0.199 1.00 0.80 H new ATOM 0 HB THR A 34 6.501 -15.378 -1.732 1.00 1.13 H new ATOM 0 HG1 THR A 34 7.093 -13.821 -0.028 1.00 2.35 H new ATOM 0 HG21 THR A 34 5.698 -13.042 -1.712 1.00 0.89 H new ATOM 0 HG22 THR A 34 4.472 -14.166 -2.345 1.00 0.89 H new ATOM 0 HG23 THR A 34 4.327 -13.533 -0.688 1.00 0.89 H new ATOM 209 N THR A 35 4.486 -15.857 1.807 1.00 0.67 N ATOM 210 CA THR A 35 3.758 -15.540 3.049 1.00 0.64 C ATOM 211 C THR A 35 3.860 -14.077 3.501 1.00 0.54 C ATOM 212 O THR A 35 3.406 -13.735 4.596 1.00 0.59 O ATOM 213 CB THR A 35 4.253 -16.453 4.180 1.00 0.81 C ATOM 214 OG1 THR A 35 5.666 -16.446 4.219 1.00 0.93 O ATOM 215 CG2 THR A 35 3.764 -17.887 4.001 1.00 0.96 C ATOM 0 H THR A 35 5.468 -16.065 1.989 1.00 0.67 H new ATOM 0 HA THR A 35 2.705 -15.711 2.824 1.00 0.64 H new ATOM 0 HB THR A 35 3.849 -16.067 5.116 1.00 0.81 H new ATOM 0 HG1 THR A 35 5.976 -17.029 4.943 1.00 0.93 H new ATOM 0 HG21 THR A 35 4.135 -18.503 4.821 1.00 0.96 H new ATOM 0 HG22 THR A 35 2.674 -17.902 4.000 1.00 0.96 H new ATOM 0 HG23 THR A 35 4.133 -18.282 3.055 1.00 0.96 H new ATOM 223 N SER A 36 4.488 -13.185 2.728 1.00 0.51 N ATOM 224 CA SER A 36 4.595 -11.754 3.049 1.00 0.49 C ATOM 225 C SER A 36 4.747 -10.865 1.806 1.00 0.50 C ATOM 226 O SER A 36 5.266 -11.295 0.773 1.00 0.70 O ATOM 227 CB SER A 36 5.774 -11.495 3.998 1.00 0.62 C ATOM 228 OG SER A 36 5.659 -12.247 5.194 1.00 1.93 O ATOM 0 H SER A 36 4.943 -13.437 1.851 1.00 0.51 H new ATOM 0 HA SER A 36 3.656 -11.487 3.534 1.00 0.49 H new ATOM 0 HB2 SER A 36 6.708 -11.750 3.496 1.00 0.62 H new ATOM 0 HB3 SER A 36 5.821 -10.433 4.239 1.00 0.62 H new ATOM 0 HG SER A 36 4.807 -12.731 5.195 1.00 1.93 H new ATOM 234 N VAL A 37 4.326 -9.607 1.932 1.00 0.40 N ATOM 235 CA VAL A 37 4.269 -8.565 0.891 1.00 0.36 C ATOM 236 C VAL A 37 4.940 -7.273 1.384 1.00 0.36 C ATOM 237 O VAL A 37 4.866 -6.955 2.571 1.00 0.38 O ATOM 238 CB VAL A 37 2.810 -8.330 0.442 1.00 0.33 C ATOM 239 CG1 VAL A 37 1.926 -7.912 1.601 1.00 0.33 C ATOM 240 CG2 VAL A 37 2.658 -7.318 -0.700 1.00 0.34 C ATOM 0 H VAL A 37 3.989 -9.257 2.829 1.00 0.40 H new ATOM 0 HA VAL A 37 4.826 -8.904 0.018 1.00 0.36 H new ATOM 0 HB VAL A 37 2.486 -9.298 0.059 1.00 0.33 H new ATOM 0 HG11 VAL A 37 0.908 -7.756 1.244 1.00 0.33 H new ATOM 0 HG12 VAL A 37 1.929 -8.693 2.361 1.00 0.33 H new ATOM 0 HG13 VAL A 37 2.305 -6.985 2.032 1.00 0.33 H new ATOM 0 HG21 VAL A 37 1.603 -7.212 -0.954 1.00 0.34 H new ATOM 0 HG22 VAL A 37 3.055 -6.353 -0.386 1.00 0.34 H new ATOM 0 HG23 VAL A 37 3.208 -7.669 -1.573 1.00 0.34 H new ATOM 250 N THR A 38 5.576 -6.511 0.484 1.00 0.41 N ATOM 251 CA THR A 38 6.212 -5.217 0.798 1.00 0.47 C ATOM 252 C THR A 38 5.485 -4.072 0.099 1.00 0.51 C ATOM 253 O THR A 38 5.452 -4.018 -1.127 1.00 0.53 O ATOM 254 CB THR A 38 7.701 -5.180 0.412 1.00 0.63 C ATOM 255 OG1 THR A 38 8.385 -6.317 0.881 1.00 0.78 O ATOM 256 CG2 THR A 38 8.408 -3.987 1.052 1.00 0.74 C ATOM 0 H THR A 38 5.666 -6.776 -0.497 1.00 0.41 H new ATOM 0 HA THR A 38 6.141 -5.097 1.879 1.00 0.47 H new ATOM 0 HB THR A 38 7.721 -5.125 -0.676 1.00 0.63 H new ATOM 0 HG1 THR A 38 9.327 -6.264 0.618 1.00 0.78 H new ATOM 0 HG21 THR A 38 9.458 -3.988 0.761 1.00 0.74 H new ATOM 0 HG22 THR A 38 7.939 -3.063 0.715 1.00 0.74 H new ATOM 0 HG23 THR A 38 8.332 -4.058 2.137 1.00 0.74 H new ATOM 264 N VAL A 39 4.911 -3.136 0.853 1.00 0.55 N ATOM 265 CA VAL A 39 4.327 -1.894 0.312 1.00 0.56 C ATOM 266 C VAL A 39 5.364 -0.766 0.385 1.00 0.58 C ATOM 267 O VAL A 39 6.071 -0.605 1.381 1.00 0.57 O ATOM 268 CB VAL A 39 2.984 -1.552 0.984 1.00 0.58 C ATOM 269 CG1 VAL A 39 3.066 -1.522 2.502 1.00 0.66 C ATOM 270 CG2 VAL A 39 2.404 -0.219 0.504 1.00 0.60 C ATOM 0 H VAL A 39 4.834 -3.212 1.867 1.00 0.55 H new ATOM 0 HA VAL A 39 4.080 -2.037 -0.740 1.00 0.56 H new ATOM 0 HB VAL A 39 2.321 -2.363 0.683 1.00 0.58 H new ATOM 0 HG11 VAL A 39 2.088 -1.275 2.914 1.00 0.66 H new ATOM 0 HG12 VAL A 39 3.378 -2.500 2.869 1.00 0.66 H new ATOM 0 HG13 VAL A 39 3.791 -0.769 2.812 1.00 0.66 H new ATOM 0 HG21 VAL A 39 1.458 -0.030 1.011 1.00 0.60 H new ATOM 0 HG22 VAL A 39 3.104 0.585 0.731 1.00 0.60 H new ATOM 0 HG23 VAL A 39 2.236 -0.262 -0.572 1.00 0.60 H new ATOM 280 N HIS A 40 5.461 -0.004 -0.695 1.00 0.61 N ATOM 281 CA HIS A 40 6.418 1.093 -0.902 1.00 0.67 C ATOM 282 C HIS A 40 5.690 2.454 -0.992 1.00 0.90 C ATOM 283 O HIS A 40 4.467 2.500 -0.867 1.00 1.90 O ATOM 284 CB HIS A 40 7.196 0.761 -2.189 1.00 0.80 C ATOM 285 CG HIS A 40 7.992 -0.523 -2.101 1.00 0.75 C ATOM 286 ND1 HIS A 40 9.289 -0.645 -1.663 1.00 0.80 N ATOM 287 CD2 HIS A 40 7.559 -1.790 -2.398 1.00 0.71 C ATOM 288 CE1 HIS A 40 9.623 -1.942 -1.683 1.00 0.81 C ATOM 289 NE2 HIS A 40 8.599 -2.688 -2.125 1.00 0.74 N ATOM 0 H HIS A 40 4.845 -0.135 -1.498 1.00 0.61 H new ATOM 0 HA HIS A 40 7.106 1.184 -0.062 1.00 0.67 H new ATOM 0 HB2 HIS A 40 6.494 0.687 -3.019 1.00 0.80 H new ATOM 0 HB3 HIS A 40 7.874 1.584 -2.417 1.00 0.80 H new ATOM 0 HD1 HIS A 40 9.895 0.122 -1.372 1.00 0.80 H new ATOM 0 HD2 HIS A 40 6.582 -2.051 -2.778 1.00 0.71 H new ATOM 0 HE1 HIS A 40 10.584 -2.333 -1.384 1.00 0.81 H new ATOM 297 N LYS A 41 6.399 3.579 -1.196 1.00 0.49 N ATOM 298 CA LYS A 41 5.754 4.850 -1.595 1.00 0.54 C ATOM 299 C LYS A 41 6.549 5.587 -2.674 1.00 0.51 C ATOM 300 O LYS A 41 7.678 6.021 -2.439 1.00 0.60 O ATOM 301 CB LYS A 41 5.410 5.778 -0.410 1.00 0.74 C ATOM 302 CG LYS A 41 4.518 6.921 -0.960 1.00 1.09 C ATOM 303 CD LYS A 41 3.783 7.804 0.055 1.00 1.36 C ATOM 304 CE LYS A 41 3.079 8.931 -0.722 1.00 1.32 C ATOM 305 NZ LYS A 41 2.167 9.734 0.127 1.00 2.21 N ATOM 0 H LYS A 41 7.412 3.637 -1.093 1.00 0.49 H new ATOM 0 HA LYS A 41 4.797 4.557 -2.028 1.00 0.54 H new ATOM 0 HB2 LYS A 41 4.888 5.226 0.371 1.00 0.74 H new ATOM 0 HB3 LYS A 41 6.318 6.181 0.038 1.00 0.74 H new ATOM 0 HG2 LYS A 41 5.143 7.567 -1.576 1.00 1.09 H new ATOM 0 HG3 LYS A 41 3.773 6.477 -1.619 1.00 1.09 H new ATOM 0 HD2 LYS A 41 3.057 7.216 0.617 1.00 1.36 H new ATOM 0 HD3 LYS A 41 4.485 8.220 0.778 1.00 1.36 H new ATOM 0 HE2 LYS A 41 3.830 9.587 -1.161 1.00 1.32 H new ATOM 0 HE3 LYS A 41 2.513 8.498 -1.547 1.00 1.32 H new ATOM 0 HZ1 LYS A 41 1.907 10.608 -0.373 1.00 2.21 H new ATOM 0 HZ2 LYS A 41 1.309 9.183 0.332 1.00 2.21 H new ATOM 0 HZ3 LYS A 41 2.645 9.975 1.019 1.00 2.21 H new ATOM 319 N LEU A 42 5.911 5.766 -3.832 1.00 0.46 N ATOM 320 CA LEU A 42 6.448 6.481 -4.989 1.00 0.49 C ATOM 321 C LEU A 42 5.759 7.844 -5.169 1.00 0.51 C ATOM 322 O LEU A 42 4.599 8.015 -4.794 1.00 0.51 O ATOM 323 CB LEU A 42 6.292 5.612 -6.254 1.00 0.46 C ATOM 324 CG LEU A 42 6.866 4.188 -6.204 1.00 0.46 C ATOM 325 CD1 LEU A 42 6.919 3.628 -7.625 1.00 0.55 C ATOM 326 CD2 LEU A 42 8.279 4.092 -5.645 1.00 0.50 C ATOM 0 H LEU A 42 4.972 5.403 -3.995 1.00 0.46 H new ATOM 0 HA LEU A 42 7.508 6.673 -4.820 1.00 0.49 H new ATOM 0 HB2 LEU A 42 5.229 5.540 -6.485 1.00 0.46 H new ATOM 0 HB3 LEU A 42 6.764 6.137 -7.085 1.00 0.46 H new ATOM 0 HG LEU A 42 6.207 3.631 -5.538 1.00 0.46 H new ATOM 0 HD11 LEU A 42 7.325 2.617 -7.603 1.00 0.55 H new ATOM 0 HD12 LEU A 42 5.913 3.606 -8.045 1.00 0.55 H new ATOM 0 HD13 LEU A 42 7.556 4.261 -8.242 1.00 0.55 H new ATOM 0 HD21 LEU A 42 8.601 3.051 -5.648 1.00 0.50 H new ATOM 0 HD22 LEU A 42 8.955 4.683 -6.262 1.00 0.50 H new ATOM 0 HD23 LEU A 42 8.293 4.473 -4.624 1.00 0.50 H new ATOM 338 N LEU A 43 6.468 8.798 -5.775 1.00 0.57 N ATOM 339 CA LEU A 43 5.956 10.093 -6.243 1.00 0.66 C ATOM 340 C LEU A 43 6.658 10.508 -7.551 1.00 0.65 C ATOM 341 O LEU A 43 7.629 9.878 -7.977 1.00 0.62 O ATOM 342 CB LEU A 43 6.153 11.172 -5.153 1.00 0.80 C ATOM 343 CG LEU A 43 5.181 11.143 -3.960 1.00 0.81 C ATOM 344 CD1 LEU A 43 5.496 12.343 -3.066 1.00 1.42 C ATOM 345 CD2 LEU A 43 3.713 11.258 -4.375 1.00 1.18 C ATOM 0 H LEU A 43 7.464 8.686 -5.963 1.00 0.57 H new ATOM 0 HA LEU A 43 4.889 9.995 -6.443 1.00 0.66 H new ATOM 0 HB2 LEU A 43 7.168 11.082 -4.766 1.00 0.80 H new ATOM 0 HB3 LEU A 43 6.079 12.151 -5.627 1.00 0.80 H new ATOM 0 HG LEU A 43 5.314 10.185 -3.457 1.00 0.81 H new ATOM 0 HD11 LEU A 43 4.820 12.347 -2.211 1.00 1.42 H new ATOM 0 HD12 LEU A 43 6.526 12.275 -2.715 1.00 1.42 H new ATOM 0 HD13 LEU A 43 5.367 13.264 -3.634 1.00 1.42 H new ATOM 0 HD21 LEU A 43 3.081 11.231 -3.487 1.00 1.18 H new ATOM 0 HD22 LEU A 43 3.557 12.198 -4.903 1.00 1.18 H new ATOM 0 HD23 LEU A 43 3.454 10.426 -5.030 1.00 1.18 H new ATOM 357 N ALA A 44 6.182 11.585 -8.177 1.00 0.72 N ATOM 358 CA ALA A 44 6.829 12.241 -9.314 1.00 0.71 C ATOM 359 C ALA A 44 7.639 13.489 -8.888 1.00 0.74 C ATOM 360 O ALA A 44 7.420 14.022 -7.796 1.00 0.80 O ATOM 361 CB ALA A 44 5.730 12.595 -10.317 1.00 0.73 C ATOM 0 H ALA A 44 5.311 12.038 -7.899 1.00 0.72 H new ATOM 0 HA ALA A 44 7.557 11.568 -9.767 1.00 0.71 H new ATOM 0 HB1 ALA A 44 6.172 13.088 -11.183 1.00 0.73 H new ATOM 0 HB2 ALA A 44 5.223 11.685 -10.637 1.00 0.73 H new ATOM 0 HB3 ALA A 44 5.010 13.265 -9.847 1.00 0.73 H new ATOM 367 N THR A 45 8.535 14.006 -9.740 1.00 0.78 N ATOM 368 CA THR A 45 9.261 15.271 -9.472 1.00 0.84 C ATOM 369 C THR A 45 8.572 16.531 -10.009 1.00 0.91 C ATOM 370 O THR A 45 8.814 17.612 -9.475 1.00 1.02 O ATOM 371 CB THR A 45 10.725 15.250 -9.937 1.00 0.83 C ATOM 372 OG1 THR A 45 10.851 15.180 -11.338 1.00 0.92 O ATOM 373 CG2 THR A 45 11.539 14.100 -9.342 1.00 0.89 C ATOM 0 H THR A 45 8.781 13.570 -10.629 1.00 0.78 H new ATOM 0 HA THR A 45 9.243 15.330 -8.384 1.00 0.84 H new ATOM 0 HB THR A 45 11.123 16.197 -9.573 1.00 0.83 H new ATOM 0 HG1 THR A 45 11.800 15.171 -11.581 1.00 0.92 H new ATOM 0 HG21 THR A 45 12.562 14.148 -9.714 1.00 0.89 H new ATOM 0 HG22 THR A 45 11.544 14.182 -8.255 1.00 0.89 H new ATOM 0 HG23 THR A 45 11.092 13.149 -9.632 1.00 0.89 H new ATOM 381 N ASP A 46 7.704 16.435 -11.024 1.00 0.90 N ATOM 382 CA ASP A 46 6.908 17.561 -11.545 1.00 0.97 C ATOM 383 C ASP A 46 5.457 17.142 -11.878 1.00 0.98 C ATOM 384 O ASP A 46 4.894 17.512 -12.912 1.00 1.27 O ATOM 385 CB ASP A 46 7.654 18.225 -12.718 1.00 1.07 C ATOM 386 CG ASP A 46 7.018 19.543 -13.174 1.00 1.27 C ATOM 387 OD1 ASP A 46 6.643 20.388 -12.321 1.00 1.78 O ATOM 388 OD2 ASP A 46 6.909 19.776 -14.399 1.00 2.38 O ATOM 0 H ASP A 46 7.530 15.559 -11.517 1.00 0.90 H new ATOM 0 HA ASP A 46 6.800 18.316 -10.766 1.00 0.97 H new ATOM 0 HB2 ASP A 46 8.687 18.411 -12.424 1.00 1.07 H new ATOM 0 HB3 ASP A 46 7.682 17.533 -13.560 1.00 1.07 H new ATOM 393 N GLY A 47 4.840 16.327 -11.017 1.00 0.86 N ATOM 394 CA GLY A 47 3.458 15.853 -11.179 1.00 0.86 C ATOM 395 C GLY A 47 3.270 14.750 -12.231 1.00 0.80 C ATOM 396 O GLY A 47 2.143 14.464 -12.632 1.00 0.89 O ATOM 0 H GLY A 47 5.292 15.971 -10.174 1.00 0.86 H new ATOM 0 HA2 GLY A 47 3.102 15.482 -10.218 1.00 0.86 H new ATOM 0 HA3 GLY A 47 2.828 16.701 -11.447 1.00 0.86 H new ATOM 400 N ASP A 48 4.356 14.120 -12.683 1.00 0.74 N ATOM 401 CA ASP A 48 4.437 13.104 -13.748 1.00 0.75 C ATOM 402 C ASP A 48 3.769 11.737 -13.439 1.00 0.70 C ATOM 403 O ASP A 48 4.094 10.727 -14.063 1.00 0.72 O ATOM 404 CB ASP A 48 5.922 12.899 -14.115 1.00 0.78 C ATOM 405 CG ASP A 48 6.672 14.212 -14.333 1.00 0.99 C ATOM 406 OD1 ASP A 48 6.620 14.752 -15.465 1.00 2.38 O ATOM 407 OD2 ASP A 48 7.316 14.698 -13.377 1.00 1.51 O ATOM 0 H ASP A 48 5.275 14.318 -12.287 1.00 0.74 H new ATOM 0 HA ASP A 48 3.856 13.499 -14.581 1.00 0.75 H new ATOM 0 HB2 ASP A 48 6.412 12.335 -13.321 1.00 0.78 H new ATOM 0 HB3 ASP A 48 5.986 12.296 -15.021 1.00 0.78 H new ATOM 412 N MET A 49 2.846 11.649 -12.473 1.00 0.67 N ATOM 413 CA MET A 49 2.312 10.359 -12.012 1.00 0.62 C ATOM 414 C MET A 49 1.554 9.566 -13.089 1.00 0.63 C ATOM 415 O MET A 49 1.563 8.342 -13.035 1.00 0.60 O ATOM 416 CB MET A 49 1.406 10.534 -10.786 1.00 0.62 C ATOM 417 CG MET A 49 2.127 10.982 -9.513 1.00 0.61 C ATOM 418 SD MET A 49 2.672 9.650 -8.390 1.00 0.69 S ATOM 419 CE MET A 49 3.952 8.813 -9.350 1.00 0.62 C ATOM 0 H MET A 49 2.452 12.458 -11.993 1.00 0.67 H new ATOM 0 HA MET A 49 3.195 9.776 -11.748 1.00 0.62 H new ATOM 0 HB2 MET A 49 0.633 11.264 -11.025 1.00 0.62 H new ATOM 0 HB3 MET A 49 0.901 9.589 -10.587 1.00 0.62 H new ATOM 0 HG2 MET A 49 3.000 11.567 -9.801 1.00 0.61 H new ATOM 0 HG3 MET A 49 1.465 11.648 -8.960 1.00 0.61 H new ATOM 0 HE1 MET A 49 4.479 8.103 -8.713 1.00 0.62 H new ATOM 0 HE2 MET A 49 3.493 8.281 -10.183 1.00 0.62 H new ATOM 0 HE3 MET A 49 4.658 9.549 -9.735 1.00 0.62 H new ATOM 429 N ASP A 50 0.939 10.223 -14.076 1.00 0.71 N ATOM 430 CA ASP A 50 0.212 9.541 -15.161 1.00 0.76 C ATOM 431 C ASP A 50 1.148 8.829 -16.159 1.00 0.72 C ATOM 432 O ASP A 50 0.940 7.649 -16.465 1.00 0.71 O ATOM 433 CB ASP A 50 -0.703 10.536 -15.885 1.00 0.94 C ATOM 434 CG ASP A 50 -1.950 10.894 -15.062 1.00 1.46 C ATOM 435 OD1 ASP A 50 -2.871 10.044 -14.958 1.00 2.70 O ATOM 436 OD2 ASP A 50 -2.045 12.036 -14.544 1.00 1.86 O ATOM 0 H ASP A 50 0.928 11.240 -14.150 1.00 0.71 H new ATOM 0 HA ASP A 50 -0.393 8.760 -14.701 1.00 0.76 H new ATOM 0 HB2 ASP A 50 -0.144 11.445 -16.105 1.00 0.94 H new ATOM 0 HB3 ASP A 50 -1.012 10.112 -16.841 1.00 0.94 H new ATOM 441 N LYS A 51 2.231 9.475 -16.618 1.00 0.74 N ATOM 442 CA LYS A 51 3.237 8.807 -17.458 1.00 0.72 C ATOM 443 C LYS A 51 4.004 7.736 -16.678 1.00 0.65 C ATOM 444 O LYS A 51 4.246 6.666 -17.240 1.00 0.64 O ATOM 445 CB LYS A 51 4.117 9.825 -18.193 1.00 0.81 C ATOM 446 CG LYS A 51 4.905 10.755 -17.269 1.00 0.82 C ATOM 447 CD LYS A 51 5.377 12.036 -17.971 1.00 1.05 C ATOM 448 CE LYS A 51 6.346 11.740 -19.113 1.00 1.84 C ATOM 449 NZ LYS A 51 7.012 12.966 -19.606 1.00 2.09 N ATOM 0 H LYS A 51 2.432 10.456 -16.422 1.00 0.74 H new ATOM 0 HA LYS A 51 2.724 8.258 -18.247 1.00 0.72 H new ATOM 0 HB2 LYS A 51 4.817 9.288 -18.833 1.00 0.81 H new ATOM 0 HB3 LYS A 51 3.487 10.429 -18.846 1.00 0.81 H new ATOM 0 HG2 LYS A 51 4.283 11.023 -16.415 1.00 0.82 H new ATOM 0 HG3 LYS A 51 5.771 10.221 -16.877 1.00 0.82 H new ATOM 0 HD2 LYS A 51 4.513 12.576 -18.359 1.00 1.05 H new ATOM 0 HD3 LYS A 51 5.861 12.690 -17.245 1.00 1.05 H new ATOM 0 HE2 LYS A 51 7.100 11.029 -18.774 1.00 1.84 H new ATOM 0 HE3 LYS A 51 5.806 11.266 -19.933 1.00 1.84 H new ATOM 0 HZ1 LYS A 51 7.661 12.721 -20.381 1.00 2.09 H new ATOM 0 HZ2 LYS A 51 6.295 13.635 -19.953 1.00 2.09 H new ATOM 0 HZ3 LYS A 51 7.548 13.405 -18.831 1.00 2.09 H new ATOM 463 N ILE A 52 4.291 7.945 -15.386 1.00 0.64 N ATOM 464 CA ILE A 52 4.780 6.900 -14.473 1.00 0.61 C ATOM 465 C ILE A 52 3.777 5.736 -14.398 1.00 0.60 C ATOM 466 O ILE A 52 4.184 4.588 -14.528 1.00 0.57 O ATOM 467 CB ILE A 52 5.084 7.490 -13.073 1.00 0.59 C ATOM 468 CG1 ILE A 52 6.260 8.489 -13.173 1.00 0.63 C ATOM 469 CG2 ILE A 52 5.417 6.373 -12.058 1.00 0.57 C ATOM 470 CD1 ILE A 52 6.603 9.246 -11.894 1.00 0.61 C ATOM 0 H ILE A 52 4.189 8.856 -14.939 1.00 0.64 H new ATOM 0 HA ILE A 52 5.716 6.503 -14.867 1.00 0.61 H new ATOM 0 HB ILE A 52 4.195 8.011 -12.718 1.00 0.59 H new ATOM 0 HG12 ILE A 52 7.147 7.945 -13.499 1.00 0.63 H new ATOM 0 HG13 ILE A 52 6.028 9.216 -13.951 1.00 0.63 H new ATOM 0 HG21 ILE A 52 5.626 6.816 -11.084 1.00 0.57 H new ATOM 0 HG22 ILE A 52 4.569 5.694 -11.973 1.00 0.57 H new ATOM 0 HG23 ILE A 52 6.292 5.820 -12.400 1.00 0.57 H new ATOM 0 HD11 ILE A 52 7.441 9.917 -12.082 1.00 0.61 H new ATOM 0 HD12 ILE A 52 5.739 9.827 -11.572 1.00 0.61 H new ATOM 0 HD13 ILE A 52 6.874 8.536 -11.113 1.00 0.61 H new ATOM 482 N ALA A 53 2.468 5.979 -14.270 1.00 0.65 N ATOM 483 CA ALA A 53 1.465 4.909 -14.248 1.00 0.68 C ATOM 484 C ALA A 53 1.477 4.064 -15.535 1.00 0.69 C ATOM 485 O ALA A 53 1.384 2.836 -15.462 1.00 0.70 O ATOM 486 CB ALA A 53 0.082 5.519 -13.973 1.00 0.77 C ATOM 0 H ALA A 53 2.076 6.916 -14.179 1.00 0.65 H new ATOM 0 HA ALA A 53 1.715 4.217 -13.443 1.00 0.68 H new ATOM 0 HB1 ALA A 53 -0.668 4.728 -13.956 1.00 0.77 H new ATOM 0 HB2 ALA A 53 0.094 6.029 -13.010 1.00 0.77 H new ATOM 0 HB3 ALA A 53 -0.163 6.234 -14.759 1.00 0.77 H new ATOM 492 N ASN A 54 1.708 4.701 -16.689 1.00 0.72 N ATOM 493 CA ASN A 54 1.943 4.015 -17.961 1.00 0.74 C ATOM 494 C ASN A 54 3.289 3.252 -17.982 1.00 0.69 C ATOM 495 O ASN A 54 3.346 2.146 -18.522 1.00 0.75 O ATOM 496 CB ASN A 54 1.832 5.028 -19.116 1.00 0.76 C ATOM 497 CG ASN A 54 0.402 5.410 -19.464 1.00 0.84 C ATOM 498 OD1 ASN A 54 -0.180 4.918 -20.421 1.00 0.95 O ATOM 499 ND2 ASN A 54 -0.206 6.292 -18.715 1.00 0.85 N ATOM 0 H ASN A 54 1.737 5.718 -16.765 1.00 0.72 H new ATOM 0 HA ASN A 54 1.175 3.252 -18.088 1.00 0.74 H new ATOM 0 HB2 ASN A 54 2.384 5.929 -18.850 1.00 0.76 H new ATOM 0 HB3 ASN A 54 2.312 4.610 -20.001 1.00 0.76 H new ATOM 0 HD21 ASN A 54 -1.164 6.569 -18.929 1.00 0.85 H new ATOM 0 HD22 ASN A 54 0.278 6.703 -17.917 1.00 0.85 H new ATOM 506 N GLU A 55 4.351 3.772 -17.350 1.00 0.63 N ATOM 507 CA GLU A 55 5.612 3.037 -17.135 1.00 0.64 C ATOM 508 C GLU A 55 5.442 1.784 -16.245 1.00 0.65 C ATOM 509 O GLU A 55 6.307 0.904 -16.279 1.00 0.75 O ATOM 510 CB GLU A 55 6.722 3.932 -16.553 1.00 0.62 C ATOM 511 CG GLU A 55 7.275 5.022 -17.478 1.00 0.63 C ATOM 512 CD GLU A 55 7.856 4.465 -18.784 1.00 0.75 C ATOM 513 OE1 GLU A 55 8.981 3.895 -18.753 1.00 1.90 O ATOM 514 OE2 GLU A 55 7.171 4.571 -19.833 1.00 1.57 O ATOM 0 H GLU A 55 4.362 4.719 -16.971 1.00 0.63 H new ATOM 0 HA GLU A 55 5.912 2.706 -18.129 1.00 0.64 H new ATOM 0 HB2 GLU A 55 6.337 4.411 -15.653 1.00 0.62 H new ATOM 0 HB3 GLU A 55 7.550 3.293 -16.245 1.00 0.62 H new ATOM 0 HG2 GLU A 55 6.479 5.728 -17.714 1.00 0.63 H new ATOM 0 HG3 GLU A 55 8.050 5.579 -16.951 1.00 0.63 H new ATOM 521 N LEU A 56 4.362 1.675 -15.452 1.00 0.69 N ATOM 522 CA LEU A 56 4.079 0.511 -14.600 1.00 0.72 C ATOM 523 C LEU A 56 3.025 -0.471 -15.139 1.00 0.79 C ATOM 524 O LEU A 56 3.188 -1.681 -14.972 1.00 0.84 O ATOM 525 CB LEU A 56 3.719 0.978 -13.185 1.00 0.69 C ATOM 526 CG LEU A 56 4.747 1.899 -12.503 1.00 0.64 C ATOM 527 CD1 LEU A 56 4.341 2.032 -11.050 1.00 0.67 C ATOM 528 CD2 LEU A 56 6.198 1.421 -12.549 1.00 0.62 C ATOM 0 H LEU A 56 3.652 2.404 -15.385 1.00 0.69 H new ATOM 0 HA LEU A 56 5.001 -0.070 -14.591 1.00 0.72 H new ATOM 0 HB2 LEU A 56 2.763 1.500 -13.227 1.00 0.69 H new ATOM 0 HB3 LEU A 56 3.575 0.098 -12.558 1.00 0.69 H new ATOM 0 HG LEU A 56 4.732 2.837 -13.057 1.00 0.64 H new ATOM 0 HD11 LEU A 56 5.049 2.680 -10.532 1.00 0.67 H new ATOM 0 HD12 LEU A 56 3.342 2.464 -10.989 1.00 0.67 H new ATOM 0 HD13 LEU A 56 4.340 1.048 -10.581 1.00 0.67 H new ATOM 0 HD21 LEU A 56 6.836 2.144 -12.040 1.00 0.62 H new ATOM 0 HD22 LEU A 56 6.278 0.454 -12.053 1.00 0.62 H new ATOM 0 HD23 LEU A 56 6.516 1.324 -13.587 1.00 0.62 H new ATOM 540 N GLU A 57 1.969 -0.002 -15.813 1.00 0.84 N ATOM 541 CA GLU A 57 0.921 -0.892 -16.363 1.00 0.93 C ATOM 542 C GLU A 57 1.464 -1.839 -17.460 1.00 0.96 C ATOM 543 O GLU A 57 0.942 -2.931 -17.694 1.00 1.04 O ATOM 544 CB GLU A 57 -0.297 -0.067 -16.839 1.00 1.03 C ATOM 545 CG GLU A 57 -0.210 0.455 -18.277 1.00 1.13 C ATOM 546 CD GLU A 57 -1.500 1.165 -18.705 1.00 1.45 C ATOM 547 OE1 GLU A 57 -2.570 0.523 -18.820 1.00 2.34 O ATOM 548 OE2 GLU A 57 -1.439 2.387 -18.980 1.00 2.27 O ATOM 0 H GLU A 57 1.811 0.989 -15.995 1.00 0.84 H new ATOM 0 HA GLU A 57 0.583 -1.544 -15.558 1.00 0.93 H new ATOM 0 HB2 GLU A 57 -1.191 -0.683 -16.747 1.00 1.03 H new ATOM 0 HB3 GLU A 57 -0.425 0.783 -16.168 1.00 1.03 H new ATOM 0 HG2 GLU A 57 0.630 1.144 -18.363 1.00 1.13 H new ATOM 0 HG3 GLU A 57 -0.011 -0.376 -18.954 1.00 1.13 H new ATOM 555 N THR A 58 2.559 -1.420 -18.100 1.00 0.91 N ATOM 556 CA THR A 58 3.340 -2.150 -19.112 1.00 0.95 C ATOM 557 C THR A 58 4.207 -3.292 -18.547 1.00 0.91 C ATOM 558 O THR A 58 4.592 -4.187 -19.299 1.00 1.02 O ATOM 559 CB THR A 58 4.206 -1.113 -19.850 1.00 1.00 C ATOM 560 OG1 THR A 58 4.836 -1.641 -20.994 1.00 1.25 O ATOM 561 CG2 THR A 58 5.301 -0.537 -18.953 1.00 0.99 C ATOM 0 H THR A 58 2.954 -0.498 -17.914 1.00 0.91 H new ATOM 0 HA THR A 58 2.644 -2.651 -19.785 1.00 0.95 H new ATOM 0 HB THR A 58 3.506 -0.331 -20.146 1.00 1.00 H new ATOM 0 HG1 THR A 58 5.371 -0.942 -21.425 1.00 1.25 H new ATOM 0 HG21 THR A 58 5.887 0.190 -19.515 1.00 0.99 H new ATOM 0 HG22 THR A 58 4.846 -0.048 -18.092 1.00 0.99 H new ATOM 0 HG23 THR A 58 5.952 -1.342 -18.611 1.00 0.99 H new ATOM 569 N GLY A 59 4.524 -3.291 -17.244 1.00 0.85 N ATOM 570 CA GLY A 59 5.372 -4.302 -16.590 1.00 0.86 C ATOM 571 C GLY A 59 4.580 -5.405 -15.878 1.00 0.93 C ATOM 572 O GLY A 59 3.364 -5.300 -15.725 1.00 1.03 O ATOM 0 H GLY A 59 4.192 -2.573 -16.601 1.00 0.85 H new ATOM 0 HA2 GLY A 59 6.021 -4.758 -17.338 1.00 0.86 H new ATOM 0 HA3 GLY A 59 6.019 -3.807 -15.866 1.00 0.86 H new ATOM 576 N ASN A 60 5.259 -6.452 -15.393 1.00 0.99 N ATOM 577 CA ASN A 60 4.665 -7.536 -14.583 1.00 1.10 C ATOM 578 C ASN A 60 4.573 -7.186 -13.077 1.00 0.97 C ATOM 579 O ASN A 60 4.680 -8.064 -12.213 1.00 1.03 O ATOM 580 CB ASN A 60 5.419 -8.861 -14.802 1.00 1.31 C ATOM 581 CG ASN A 60 5.596 -9.263 -16.256 1.00 1.60 C ATOM 582 OD1 ASN A 60 4.688 -9.169 -17.074 1.00 1.76 O ATOM 583 ND2 ASN A 60 6.766 -9.736 -16.618 1.00 2.13 N ATOM 0 H ASN A 60 6.259 -6.577 -15.553 1.00 0.99 H new ATOM 0 HA ASN A 60 3.639 -7.658 -14.931 1.00 1.10 H new ATOM 0 HB2 ASN A 60 6.403 -8.783 -14.339 1.00 1.31 H new ATOM 0 HB3 ASN A 60 4.885 -9.656 -14.283 1.00 1.31 H new ATOM 0 HD21 ASN A 60 6.922 -10.027 -17.583 1.00 2.13 H new ATOM 0 HD22 ASN A 60 7.519 -9.813 -15.934 1.00 2.13 H new ATOM 590 N TYR A 61 4.437 -5.903 -12.731 1.00 0.85 N ATOM 591 CA TYR A 61 4.576 -5.409 -11.353 1.00 0.76 C ATOM 592 C TYR A 61 3.381 -5.713 -10.431 1.00 0.82 C ATOM 593 O TYR A 61 3.380 -5.316 -9.263 1.00 0.82 O ATOM 594 CB TYR A 61 4.938 -3.921 -11.362 1.00 0.66 C ATOM 595 CG TYR A 61 6.070 -3.506 -12.296 1.00 0.63 C ATOM 596 CD1 TYR A 61 7.269 -4.246 -12.387 1.00 1.79 C ATOM 597 CD2 TYR A 61 5.928 -2.326 -13.046 1.00 1.83 C ATOM 598 CE1 TYR A 61 8.307 -3.812 -13.242 1.00 1.74 C ATOM 599 CE2 TYR A 61 6.977 -1.865 -13.860 1.00 1.92 C ATOM 600 CZ TYR A 61 8.164 -2.613 -13.977 1.00 0.72 C ATOM 601 OH TYR A 61 9.154 -2.160 -14.794 1.00 0.86 O ATOM 0 H TYR A 61 4.225 -5.168 -13.405 1.00 0.85 H new ATOM 0 HA TYR A 61 5.395 -5.975 -10.909 1.00 0.76 H new ATOM 0 HB2 TYR A 61 4.047 -3.354 -11.631 1.00 0.66 H new ATOM 0 HB3 TYR A 61 5.207 -3.628 -10.347 1.00 0.66 H new ATOM 0 HD1 TYR A 61 7.393 -5.145 -11.802 1.00 1.79 H new ATOM 0 HD2 TYR A 61 5.004 -1.768 -12.996 1.00 1.83 H new ATOM 0 HE1 TYR A 61 9.210 -4.397 -13.334 1.00 1.74 H new ATOM 0 HE2 TYR A 61 6.872 -0.934 -14.397 1.00 1.92 H new ATOM 0 HH TYR A 61 8.872 -1.321 -15.216 1.00 0.86 H new ATOM 611 N ALA A 62 2.372 -6.450 -10.910 1.00 0.93 N ATOM 612 CA ALA A 62 1.322 -7.001 -10.054 1.00 1.00 C ATOM 613 C ALA A 62 1.891 -8.020 -9.041 1.00 0.93 C ATOM 614 O ALA A 62 1.323 -8.187 -7.958 1.00 0.96 O ATOM 615 CB ALA A 62 0.243 -7.630 -10.943 1.00 1.19 C ATOM 0 H ALA A 62 2.263 -6.679 -11.898 1.00 0.93 H new ATOM 0 HA ALA A 62 0.879 -6.199 -9.464 1.00 1.00 H new ATOM 0 HB1 ALA A 62 -0.547 -8.045 -10.318 1.00 1.19 H new ATOM 0 HB2 ALA A 62 -0.177 -6.868 -11.600 1.00 1.19 H new ATOM 0 HB3 ALA A 62 0.685 -8.424 -11.545 1.00 1.19 H new ATOM 621 N GLY A 63 3.018 -8.673 -9.370 1.00 0.88 N ATOM 622 CA GLY A 63 3.742 -9.584 -8.478 1.00 0.84 C ATOM 623 C GLY A 63 5.072 -9.007 -7.985 1.00 0.67 C ATOM 624 O GLY A 63 5.168 -8.509 -6.861 1.00 0.54 O ATOM 0 H GLY A 63 3.458 -8.578 -10.285 1.00 0.88 H new ATOM 0 HA2 GLY A 63 3.113 -9.819 -7.619 1.00 0.84 H new ATOM 0 HA3 GLY A 63 3.931 -10.522 -9.001 1.00 0.84 H new ATOM 628 N ASN A 64 6.110 -9.124 -8.822 1.00 0.85 N ATOM 629 CA ASN A 64 7.494 -8.783 -8.461 1.00 0.83 C ATOM 630 C ASN A 64 7.780 -7.267 -8.387 1.00 0.67 C ATOM 631 O ASN A 64 7.015 -6.457 -8.913 1.00 0.66 O ATOM 632 CB ASN A 64 8.496 -9.590 -9.307 1.00 1.20 C ATOM 633 CG ASN A 64 8.891 -8.896 -10.580 1.00 1.35 C ATOM 634 OD1 ASN A 64 10.063 -8.749 -10.897 1.00 1.79 O ATOM 635 ND2 ASN A 64 7.936 -8.415 -11.326 1.00 1.49 N ATOM 0 H ASN A 64 6.013 -9.462 -9.780 1.00 0.85 H new ATOM 0 HA ASN A 64 7.640 -9.095 -7.427 1.00 0.83 H new ATOM 0 HB2 ASN A 64 9.390 -9.783 -8.714 1.00 1.20 H new ATOM 0 HB3 ASN A 64 8.059 -10.559 -9.550 1.00 1.20 H new ATOM 0 HD21 ASN A 64 8.163 -7.911 -12.183 1.00 1.49 H new ATOM 0 HD22 ASN A 64 6.962 -8.543 -11.053 1.00 1.49 H new ATOM 642 N LYS A 65 8.893 -6.892 -7.735 1.00 0.64 N ATOM 643 CA LYS A 65 9.289 -5.489 -7.504 1.00 0.55 C ATOM 644 C LYS A 65 9.386 -4.672 -8.797 1.00 0.53 C ATOM 645 O LYS A 65 9.730 -5.213 -9.852 1.00 0.59 O ATOM 646 CB LYS A 65 10.598 -5.413 -6.686 1.00 0.63 C ATOM 647 CG LYS A 65 11.889 -5.749 -7.453 1.00 1.07 C ATOM 648 CD LYS A 65 13.147 -5.619 -6.578 1.00 1.41 C ATOM 649 CE LYS A 65 13.455 -4.160 -6.212 1.00 1.37 C ATOM 650 NZ LYS A 65 14.773 -4.029 -5.543 1.00 2.37 N ATOM 0 H LYS A 65 9.555 -7.564 -7.347 1.00 0.64 H new ATOM 0 HA LYS A 65 8.491 -5.031 -6.919 1.00 0.55 H new ATOM 0 HB2 LYS A 65 10.692 -4.406 -6.279 1.00 0.63 H new ATOM 0 HB3 LYS A 65 10.514 -6.093 -5.838 1.00 0.63 H new ATOM 0 HG2 LYS A 65 11.823 -6.766 -7.840 1.00 1.07 H new ATOM 0 HG3 LYS A 65 11.979 -5.086 -8.313 1.00 1.07 H new ATOM 0 HD2 LYS A 65 13.013 -6.200 -5.665 1.00 1.41 H new ATOM 0 HD3 LYS A 65 14.000 -6.046 -7.106 1.00 1.41 H new ATOM 0 HE2 LYS A 65 13.442 -3.548 -7.114 1.00 1.37 H new ATOM 0 HE3 LYS A 65 12.674 -3.777 -5.556 1.00 1.37 H new ATOM 0 HZ1 LYS A 65 14.947 -3.030 -5.311 1.00 2.37 H new ATOM 0 HZ2 LYS A 65 14.776 -4.593 -4.669 1.00 2.37 H new ATOM 0 HZ3 LYS A 65 15.521 -4.372 -6.179 1.00 2.37 H new ATOM 664 N VAL A 66 9.183 -3.355 -8.714 1.00 0.51 N ATOM 665 CA VAL A 66 9.473 -2.447 -9.834 1.00 0.52 C ATOM 666 C VAL A 66 10.994 -2.378 -10.003 1.00 0.85 C ATOM 667 O VAL A 66 11.677 -1.678 -9.255 1.00 1.24 O ATOM 668 CB VAL A 66 8.852 -1.049 -9.664 1.00 0.59 C ATOM 669 CG1 VAL A 66 9.314 -0.101 -10.778 1.00 0.63 C ATOM 670 CG2 VAL A 66 7.330 -1.110 -9.800 1.00 0.65 C ATOM 0 H VAL A 66 8.818 -2.890 -7.883 1.00 0.51 H new ATOM 0 HA VAL A 66 9.008 -2.845 -10.736 1.00 0.52 H new ATOM 0 HB VAL A 66 9.161 -0.698 -8.680 1.00 0.59 H new ATOM 0 HG11 VAL A 66 8.860 0.879 -10.633 1.00 0.63 H new ATOM 0 HG12 VAL A 66 10.399 -0.006 -10.748 1.00 0.63 H new ATOM 0 HG13 VAL A 66 9.011 -0.502 -11.745 1.00 0.63 H new ATOM 0 HG21 VAL A 66 6.913 -0.110 -9.676 1.00 0.65 H new ATOM 0 HG22 VAL A 66 7.068 -1.493 -10.786 1.00 0.65 H new ATOM 0 HG23 VAL A 66 6.922 -1.770 -9.035 1.00 0.65 H new ATOM 680 N GLY A 67 11.541 -3.147 -10.948 1.00 1.15 N ATOM 681 CA GLY A 67 12.992 -3.292 -11.128 1.00 1.59 C ATOM 682 C GLY A 67 13.685 -2.040 -11.677 1.00 1.15 C ATOM 683 O GLY A 67 14.872 -1.827 -11.417 1.00 1.20 O ATOM 0 H GLY A 67 10.990 -3.689 -11.613 1.00 1.15 H new ATOM 0 HA2 GLY A 67 13.442 -3.552 -10.170 1.00 1.59 H new ATOM 0 HA3 GLY A 67 13.181 -4.125 -11.805 1.00 1.59 H new ATOM 687 N VAL A 68 12.950 -1.196 -12.407 1.00 0.94 N ATOM 688 CA VAL A 68 13.426 0.070 -12.983 1.00 0.82 C ATOM 689 C VAL A 68 12.319 1.120 -12.864 1.00 0.79 C ATOM 690 O VAL A 68 11.205 0.904 -13.340 1.00 1.10 O ATOM 691 CB VAL A 68 13.838 -0.115 -14.464 1.00 1.26 C ATOM 692 CG1 VAL A 68 14.296 1.204 -15.100 1.00 1.56 C ATOM 693 CG2 VAL A 68 14.986 -1.121 -14.627 1.00 1.94 C ATOM 0 H VAL A 68 11.970 -1.380 -12.622 1.00 0.94 H new ATOM 0 HA VAL A 68 14.307 0.402 -12.434 1.00 0.82 H new ATOM 0 HB VAL A 68 12.943 -0.486 -14.964 1.00 1.26 H new ATOM 0 HG11 VAL A 68 14.576 1.029 -16.139 1.00 1.56 H new ATOM 0 HG12 VAL A 68 13.483 1.929 -15.060 1.00 1.56 H new ATOM 0 HG13 VAL A 68 15.155 1.593 -14.553 1.00 1.56 H new ATOM 0 HG21 VAL A 68 15.239 -1.216 -15.683 1.00 1.94 H new ATOM 0 HG22 VAL A 68 15.858 -0.770 -14.075 1.00 1.94 H new ATOM 0 HG23 VAL A 68 14.677 -2.092 -14.239 1.00 1.94 H new ATOM 703 N LEU A 69 12.624 2.262 -12.250 1.00 0.69 N ATOM 704 CA LEU A 69 11.801 3.471 -12.221 1.00 0.78 C ATOM 705 C LEU A 69 12.182 4.429 -13.368 1.00 0.97 C ATOM 706 O LEU A 69 13.301 4.356 -13.894 1.00 1.22 O ATOM 707 CB LEU A 69 11.994 4.156 -10.848 1.00 0.81 C ATOM 708 CG LEU A 69 11.400 3.384 -9.659 1.00 0.73 C ATOM 709 CD1 LEU A 69 11.666 4.107 -8.340 1.00 0.99 C ATOM 710 CD2 LEU A 69 9.890 3.243 -9.791 1.00 0.68 C ATOM 0 H LEU A 69 13.496 2.375 -11.733 1.00 0.69 H new ATOM 0 HA LEU A 69 10.753 3.205 -12.360 1.00 0.78 H new ATOM 0 HB2 LEU A 69 13.061 4.299 -10.675 1.00 0.81 H new ATOM 0 HB3 LEU A 69 11.541 5.147 -10.884 1.00 0.81 H new ATOM 0 HG LEU A 69 11.878 2.405 -9.663 1.00 0.73 H new ATOM 0 HD11 LEU A 69 11.234 3.536 -7.518 1.00 0.99 H new ATOM 0 HD12 LEU A 69 12.741 4.204 -8.188 1.00 0.99 H new ATOM 0 HD13 LEU A 69 11.213 5.098 -8.371 1.00 0.99 H new ATOM 0 HD21 LEU A 69 9.500 2.693 -8.935 1.00 0.68 H new ATOM 0 HD22 LEU A 69 9.434 4.232 -9.825 1.00 0.68 H new ATOM 0 HD23 LEU A 69 9.654 2.703 -10.708 1.00 0.68 H new ATOM 722 N PRO A 70 11.308 5.373 -13.752 1.00 0.88 N ATOM 723 CA PRO A 70 11.704 6.459 -14.642 1.00 0.92 C ATOM 724 C PRO A 70 12.589 7.484 -13.909 1.00 0.91 C ATOM 725 O PRO A 70 12.681 7.477 -12.679 1.00 0.89 O ATOM 726 CB PRO A 70 10.392 7.053 -15.131 1.00 0.86 C ATOM 727 CG PRO A 70 9.400 6.791 -14.017 1.00 0.77 C ATOM 728 CD PRO A 70 9.924 5.537 -13.314 1.00 0.74 C ATOM 0 HA PRO A 70 12.315 6.118 -15.478 1.00 0.92 H new ATOM 0 HB2 PRO A 70 10.492 8.121 -15.327 1.00 0.86 H new ATOM 0 HB3 PRO A 70 10.071 6.586 -16.062 1.00 0.86 H new ATOM 0 HG2 PRO A 70 9.344 7.636 -13.330 1.00 0.77 H new ATOM 0 HG3 PRO A 70 8.396 6.633 -14.410 1.00 0.77 H new ATOM 0 HD2 PRO A 70 9.869 5.646 -12.231 1.00 0.74 H new ATOM 0 HD3 PRO A 70 9.326 4.664 -13.577 1.00 0.74 H new ATOM 736 N ALA A 71 13.247 8.385 -14.639 1.00 0.99 N ATOM 737 CA ALA A 71 14.069 9.439 -14.030 1.00 0.99 C ATOM 738 C ALA A 71 13.234 10.586 -13.412 1.00 0.91 C ATOM 739 O ALA A 71 13.724 11.279 -12.516 1.00 0.98 O ATOM 740 CB ALA A 71 15.086 9.932 -15.060 1.00 1.06 C ATOM 0 H ALA A 71 13.228 8.408 -15.659 1.00 0.99 H new ATOM 0 HA ALA A 71 14.604 9.013 -13.181 1.00 0.99 H new ATOM 0 HB1 ALA A 71 15.702 10.715 -14.617 1.00 1.06 H new ATOM 0 HB2 ALA A 71 15.722 9.102 -15.370 1.00 1.06 H new ATOM 0 HB3 ALA A 71 14.561 10.330 -15.928 1.00 1.06 H new ATOM 746 N ASN A 72 11.972 10.751 -13.831 1.00 0.83 N ATOM 747 CA ASN A 72 10.976 11.642 -13.216 1.00 0.76 C ATOM 748 C ASN A 72 10.302 11.068 -11.945 1.00 0.64 C ATOM 749 O ASN A 72 9.542 11.783 -11.291 1.00 0.61 O ATOM 750 CB ASN A 72 9.959 12.093 -14.290 1.00 0.80 C ATOM 751 CG ASN A 72 9.178 10.972 -14.954 1.00 0.82 C ATOM 752 OD1 ASN A 72 9.034 9.887 -14.425 1.00 1.82 O ATOM 753 ND2 ASN A 72 8.694 11.173 -16.158 1.00 1.69 N ATOM 0 H ASN A 72 11.602 10.249 -14.638 1.00 0.83 H new ATOM 0 HA ASN A 72 11.508 12.517 -12.843 1.00 0.76 H new ATOM 0 HB2 ASN A 72 9.252 12.784 -13.830 1.00 0.80 H new ATOM 0 HB3 ASN A 72 10.492 12.649 -15.061 1.00 0.80 H new ATOM 0 HD21 ASN A 72 8.202 10.422 -16.642 1.00 1.69 H new ATOM 0 HD22 ASN A 72 8.810 12.080 -16.609 1.00 1.69 H new ATOM 760 N ALA A 73 10.584 9.815 -11.565 1.00 0.63 N ATOM 761 CA ALA A 73 10.106 9.201 -10.319 1.00 0.58 C ATOM 762 C ALA A 73 11.043 9.428 -9.104 1.00 0.60 C ATOM 763 O ALA A 73 12.262 9.600 -9.246 1.00 0.64 O ATOM 764 CB ALA A 73 9.845 7.714 -10.594 1.00 0.57 C ATOM 0 H ALA A 73 11.161 9.188 -12.125 1.00 0.63 H new ATOM 0 HA ALA A 73 9.181 9.694 -10.022 1.00 0.58 H new ATOM 0 HB1 ALA A 73 9.488 7.233 -9.683 1.00 0.57 H new ATOM 0 HB2 ALA A 73 9.092 7.615 -11.376 1.00 0.57 H new ATOM 0 HB3 ALA A 73 10.769 7.236 -10.919 1.00 0.57 H new ATOM 770 N LYS A 74 10.475 9.388 -7.889 1.00 0.59 N ATOM 771 CA LYS A 74 11.166 9.503 -6.585 1.00 0.67 C ATOM 772 C LYS A 74 10.497 8.642 -5.498 1.00 0.59 C ATOM 773 O LYS A 74 9.350 8.226 -5.661 1.00 0.54 O ATOM 774 CB LYS A 74 11.264 10.989 -6.192 1.00 0.93 C ATOM 775 CG LYS A 74 9.955 11.550 -5.620 1.00 1.26 C ATOM 776 CD LYS A 74 9.957 13.082 -5.652 1.00 1.39 C ATOM 777 CE LYS A 74 8.709 13.636 -4.957 1.00 1.87 C ATOM 778 NZ LYS A 74 8.831 15.084 -4.698 1.00 2.52 N ATOM 0 H LYS A 74 9.468 9.268 -7.778 1.00 0.59 H new ATOM 0 HA LYS A 74 12.177 9.107 -6.682 1.00 0.67 H new ATOM 0 HB2 LYS A 74 12.057 11.112 -5.455 1.00 0.93 H new ATOM 0 HB3 LYS A 74 11.550 11.572 -7.068 1.00 0.93 H new ATOM 0 HG2 LYS A 74 9.110 11.171 -6.195 1.00 1.26 H new ATOM 0 HG3 LYS A 74 9.823 11.204 -4.595 1.00 1.26 H new ATOM 0 HD2 LYS A 74 10.853 13.461 -5.159 1.00 1.39 H new ATOM 0 HD3 LYS A 74 9.990 13.430 -6.684 1.00 1.39 H new ATOM 0 HE2 LYS A 74 7.833 13.449 -5.578 1.00 1.87 H new ATOM 0 HE3 LYS A 74 8.551 13.109 -4.016 1.00 1.87 H new ATOM 0 HZ1 LYS A 74 7.969 15.426 -4.227 1.00 2.52 H new ATOM 0 HZ2 LYS A 74 9.653 15.259 -4.086 1.00 2.52 H new ATOM 0 HZ3 LYS A 74 8.957 15.588 -5.599 1.00 2.52 H new ATOM 792 N GLU A 75 11.207 8.357 -4.403 1.00 0.65 N ATOM 793 CA GLU A 75 10.810 7.368 -3.379 1.00 0.62 C ATOM 794 C GLU A 75 10.963 7.913 -1.944 1.00 0.59 C ATOM 795 O GLU A 75 12.068 8.284 -1.540 1.00 0.72 O ATOM 796 CB GLU A 75 11.695 6.116 -3.522 1.00 0.77 C ATOM 797 CG GLU A 75 11.652 5.421 -4.890 1.00 0.78 C ATOM 798 CD GLU A 75 12.924 4.588 -5.078 1.00 1.06 C ATOM 799 OE1 GLU A 75 13.929 5.135 -5.590 1.00 2.23 O ATOM 800 OE2 GLU A 75 12.973 3.397 -4.680 1.00 1.76 O ATOM 0 H GLU A 75 12.094 8.814 -4.193 1.00 0.65 H new ATOM 0 HA GLU A 75 9.758 7.134 -3.540 1.00 0.62 H new ATOM 0 HB2 GLU A 75 12.727 6.397 -3.311 1.00 0.77 H new ATOM 0 HB3 GLU A 75 11.398 5.395 -2.760 1.00 0.77 H new ATOM 0 HG2 GLU A 75 10.772 4.781 -4.958 1.00 0.78 H new ATOM 0 HG3 GLU A 75 11.569 6.163 -5.685 1.00 0.78 H new ATOM 807 N ILE A 76 9.894 7.913 -1.138 1.00 0.67 N ATOM 808 CA ILE A 76 9.890 8.462 0.239 1.00 0.66 C ATOM 809 C ILE A 76 9.511 7.399 1.286 1.00 0.65 C ATOM 810 O ILE A 76 8.653 6.549 1.032 1.00 0.72 O ATOM 811 CB ILE A 76 9.008 9.737 0.350 1.00 0.68 C ATOM 812 CG1 ILE A 76 7.547 9.486 -0.094 1.00 0.67 C ATOM 813 CG2 ILE A 76 9.645 10.914 -0.418 1.00 0.73 C ATOM 814 CD1 ILE A 76 6.671 10.741 -0.017 1.00 0.81 C ATOM 0 H ILE A 76 8.992 7.529 -1.420 1.00 0.67 H new ATOM 0 HA ILE A 76 10.913 8.765 0.463 1.00 0.66 H new ATOM 0 HB ILE A 76 8.963 10.008 1.405 1.00 0.68 H new ATOM 0 HG12 ILE A 76 7.544 9.110 -1.117 1.00 0.67 H new ATOM 0 HG13 ILE A 76 7.112 8.707 0.533 1.00 0.67 H new ATOM 0 HG21 ILE A 76 9.010 11.795 -0.326 1.00 0.73 H new ATOM 0 HG22 ILE A 76 10.629 11.131 -0.001 1.00 0.73 H new ATOM 0 HG23 ILE A 76 9.747 10.649 -1.470 1.00 0.73 H new ATOM 0 HD11 ILE A 76 5.659 10.499 -0.341 1.00 0.81 H new ATOM 0 HD12 ILE A 76 6.646 11.105 1.010 1.00 0.81 H new ATOM 0 HD13 ILE A 76 7.084 11.514 -0.665 1.00 0.81 H new ATOM 826 N ALA A 77 10.129 7.449 2.470 1.00 0.62 N ATOM 827 CA ALA A 77 9.795 6.601 3.624 1.00 0.61 C ATOM 828 C ALA A 77 9.233 7.420 4.810 1.00 0.51 C ATOM 829 O ALA A 77 9.367 8.645 4.846 1.00 0.59 O ATOM 830 CB ALA A 77 11.009 5.738 4.000 1.00 0.72 C ATOM 0 H ALA A 77 10.895 8.096 2.660 1.00 0.62 H new ATOM 0 HA ALA A 77 8.985 5.927 3.343 1.00 0.61 H new ATOM 0 HB1 ALA A 77 10.759 5.111 4.855 1.00 0.72 H new ATOM 0 HB2 ALA A 77 11.282 5.107 3.155 1.00 0.72 H new ATOM 0 HB3 ALA A 77 11.849 6.384 4.257 1.00 0.72 H new ATOM 836 N GLY A 78 8.585 6.745 5.768 1.00 0.48 N ATOM 837 CA GLY A 78 7.966 7.325 6.969 1.00 0.46 C ATOM 838 C GLY A 78 6.446 7.535 6.906 1.00 0.46 C ATOM 839 O GLY A 78 5.888 8.081 7.856 1.00 0.72 O ATOM 0 H GLY A 78 8.472 5.732 5.726 1.00 0.48 H new ATOM 0 HA2 GLY A 78 8.189 6.678 7.817 1.00 0.46 H new ATOM 0 HA3 GLY A 78 8.438 8.287 7.169 1.00 0.46 H new ATOM 843 N VAL A 79 5.772 7.120 5.824 1.00 0.40 N ATOM 844 CA VAL A 79 4.304 7.209 5.631 1.00 0.40 C ATOM 845 C VAL A 79 3.563 6.044 6.295 1.00 0.39 C ATOM 846 O VAL A 79 4.080 4.932 6.293 1.00 0.39 O ATOM 847 CB VAL A 79 3.940 7.305 4.131 1.00 0.49 C ATOM 848 CG1 VAL A 79 4.555 6.192 3.277 1.00 0.68 C ATOM 849 CG2 VAL A 79 2.434 7.353 3.881 1.00 0.53 C ATOM 0 H VAL A 79 6.245 6.696 5.026 1.00 0.40 H new ATOM 0 HA VAL A 79 3.977 8.125 6.122 1.00 0.40 H new ATOM 0 HB VAL A 79 4.377 8.254 3.819 1.00 0.49 H new ATOM 0 HG11 VAL A 79 4.256 6.324 2.237 1.00 0.68 H new ATOM 0 HG12 VAL A 79 5.642 6.235 3.351 1.00 0.68 H new ATOM 0 HG13 VAL A 79 4.205 5.224 3.635 1.00 0.68 H new ATOM 0 HG21 VAL A 79 2.245 7.420 2.810 1.00 0.53 H new ATOM 0 HG22 VAL A 79 1.971 6.449 4.275 1.00 0.53 H new ATOM 0 HG23 VAL A 79 2.010 8.225 4.379 1.00 0.53 H new ATOM 859 N MET A 80 2.352 6.290 6.817 1.00 0.42 N ATOM 860 CA MET A 80 1.457 5.286 7.417 1.00 0.42 C ATOM 861 C MET A 80 0.312 4.852 6.486 1.00 0.44 C ATOM 862 O MET A 80 -0.376 5.682 5.889 1.00 0.50 O ATOM 863 CB MET A 80 0.895 5.848 8.734 1.00 0.45 C ATOM 864 CG MET A 80 -0.065 4.898 9.466 1.00 0.49 C ATOM 865 SD MET A 80 0.614 3.253 9.817 1.00 0.56 S ATOM 866 CE MET A 80 0.392 3.177 11.609 1.00 0.52 C ATOM 0 H MET A 80 1.953 7.229 6.834 1.00 0.42 H new ATOM 0 HA MET A 80 2.047 4.388 7.601 1.00 0.42 H new ATOM 0 HB2 MET A 80 1.726 6.088 9.397 1.00 0.45 H new ATOM 0 HB3 MET A 80 0.374 6.782 8.524 1.00 0.45 H new ATOM 0 HG2 MET A 80 -0.364 5.360 10.407 1.00 0.49 H new ATOM 0 HG3 MET A 80 -0.968 4.783 8.866 1.00 0.49 H new ATOM 0 HE1 MET A 80 0.811 2.245 11.988 1.00 0.52 H new ATOM 0 HE2 MET A 80 0.902 4.020 12.075 1.00 0.52 H new ATOM 0 HE3 MET A 80 -0.671 3.220 11.846 1.00 0.52 H new ATOM 876 N PHE A 81 0.049 3.546 6.431 1.00 0.42 N ATOM 877 CA PHE A 81 -1.078 2.929 5.717 1.00 0.46 C ATOM 878 C PHE A 81 -1.685 1.749 6.493 1.00 0.46 C ATOM 879 O PHE A 81 -1.040 1.137 7.348 1.00 0.51 O ATOM 880 CB PHE A 81 -0.685 2.518 4.284 1.00 0.49 C ATOM 881 CG PHE A 81 0.775 2.177 4.123 1.00 0.46 C ATOM 882 CD1 PHE A 81 1.272 1.050 4.793 1.00 1.59 C ATOM 883 CD2 PHE A 81 1.653 3.030 3.422 1.00 1.58 C ATOM 884 CE1 PHE A 81 2.645 0.800 4.803 1.00 1.58 C ATOM 885 CE2 PHE A 81 3.016 2.713 3.354 1.00 1.62 C ATOM 886 CZ PHE A 81 3.517 1.613 4.069 1.00 0.59 C ATOM 0 H PHE A 81 0.637 2.858 6.901 1.00 0.42 H new ATOM 0 HA PHE A 81 -1.854 3.690 5.641 1.00 0.46 H new ATOM 0 HB2 PHE A 81 -1.284 1.657 3.987 1.00 0.49 H new ATOM 0 HB3 PHE A 81 -0.935 3.331 3.602 1.00 0.49 H new ATOM 0 HD1 PHE A 81 0.595 0.378 5.299 1.00 1.59 H new ATOM 0 HD2 PHE A 81 1.277 3.921 2.941 1.00 1.58 H new ATOM 0 HE1 PHE A 81 3.037 -0.025 5.380 1.00 1.58 H new ATOM 0 HE2 PHE A 81 3.681 3.314 2.752 1.00 1.62 H new ATOM 0 HZ PHE A 81 4.575 1.394 4.053 1.00 0.59 H new ATOM 896 N VAL A 82 -2.938 1.429 6.164 1.00 0.41 N ATOM 897 CA VAL A 82 -3.765 0.367 6.762 1.00 0.38 C ATOM 898 C VAL A 82 -4.259 -0.594 5.657 1.00 0.34 C ATOM 899 O VAL A 82 -4.536 -0.143 4.541 1.00 0.34 O ATOM 900 CB VAL A 82 -4.944 0.970 7.560 1.00 0.38 C ATOM 901 CG1 VAL A 82 -4.502 2.103 8.504 1.00 0.43 C ATOM 902 CG2 VAL A 82 -6.045 1.553 6.668 1.00 0.35 C ATOM 0 H VAL A 82 -3.437 1.931 5.430 1.00 0.41 H new ATOM 0 HA VAL A 82 -3.159 -0.203 7.466 1.00 0.38 H new ATOM 0 HB VAL A 82 -5.330 0.122 8.126 1.00 0.38 H new ATOM 0 HG11 VAL A 82 -5.369 2.490 9.039 1.00 0.43 H new ATOM 0 HG12 VAL A 82 -3.776 1.718 9.220 1.00 0.43 H new ATOM 0 HG13 VAL A 82 -4.047 2.905 7.922 1.00 0.43 H new ATOM 0 HG21 VAL A 82 -6.841 1.959 7.292 1.00 0.35 H new ATOM 0 HG22 VAL A 82 -5.629 2.347 6.048 1.00 0.35 H new ATOM 0 HG23 VAL A 82 -6.449 0.768 6.029 1.00 0.35 H new ATOM 912 N TRP A 83 -4.405 -1.893 5.937 1.00 0.31 N ATOM 913 CA TRP A 83 -5.058 -2.861 5.037 1.00 0.28 C ATOM 914 C TRP A 83 -6.586 -2.924 5.254 1.00 0.26 C ATOM 915 O TRP A 83 -7.102 -2.755 6.361 1.00 0.30 O ATOM 916 CB TRP A 83 -4.420 -4.260 5.149 1.00 0.27 C ATOM 917 CG TRP A 83 -3.193 -4.535 4.318 1.00 0.29 C ATOM 918 CD1 TRP A 83 -1.995 -3.911 4.428 1.00 0.39 C ATOM 919 CD2 TRP A 83 -3.003 -5.577 3.300 1.00 0.29 C ATOM 920 NE1 TRP A 83 -1.099 -4.466 3.529 1.00 0.43 N ATOM 921 CE2 TRP A 83 -1.661 -5.506 2.815 1.00 0.38 C ATOM 922 CE3 TRP A 83 -3.818 -6.601 2.757 1.00 0.28 C ATOM 923 CZ2 TRP A 83 -1.166 -6.389 1.838 1.00 0.42 C ATOM 924 CZ3 TRP A 83 -3.311 -7.538 1.834 1.00 0.31 C ATOM 925 CH2 TRP A 83 -1.991 -7.423 1.360 1.00 0.38 C ATOM 0 H TRP A 83 -4.070 -2.311 6.805 1.00 0.31 H new ATOM 0 HA TRP A 83 -4.895 -2.501 4.021 1.00 0.28 H new ATOM 0 HB2 TRP A 83 -4.163 -4.429 6.195 1.00 0.27 H new ATOM 0 HB3 TRP A 83 -5.178 -4.997 4.884 1.00 0.27 H new ATOM 0 HD1 TRP A 83 -1.773 -3.105 5.112 1.00 0.39 H new ATOM 0 HE1 TRP A 83 -0.138 -4.145 3.409 1.00 0.43 H new ATOM 0 HE3 TRP A 83 -4.853 -6.665 3.058 1.00 0.28 H new ATOM 0 HZ2 TRP A 83 -0.161 -6.274 1.458 1.00 0.42 H new ATOM 0 HZ3 TRP A 83 -3.938 -8.347 1.489 1.00 0.31 H new ATOM 0 HH2 TRP A 83 -1.613 -8.126 0.632 1.00 0.38 H new ATOM 936 N THR A 84 -7.314 -3.196 4.169 1.00 0.25 N ATOM 937 CA THR A 84 -8.783 -3.293 4.098 1.00 0.25 C ATOM 938 C THR A 84 -9.265 -4.404 3.153 1.00 0.26 C ATOM 939 O THR A 84 -8.476 -4.984 2.405 1.00 0.24 O ATOM 940 CB THR A 84 -9.422 -1.977 3.604 1.00 0.26 C ATOM 941 OG1 THR A 84 -8.769 -1.552 2.438 1.00 0.30 O ATOM 942 CG2 THR A 84 -9.397 -0.809 4.579 1.00 0.34 C ATOM 0 H THR A 84 -6.875 -3.365 3.264 1.00 0.25 H new ATOM 0 HA THR A 84 -9.093 -3.517 5.119 1.00 0.25 H new ATOM 0 HB THR A 84 -10.471 -2.233 3.453 1.00 0.26 H new ATOM 0 HG1 THR A 84 -8.964 -0.605 2.280 1.00 0.30 H new ATOM 0 HG21 THR A 84 -9.873 0.058 4.121 1.00 0.34 H new ATOM 0 HG22 THR A 84 -9.935 -1.081 5.487 1.00 0.34 H new ATOM 0 HG23 THR A 84 -8.364 -0.566 4.829 1.00 0.34 H new ATOM 950 N ASN A 85 -10.572 -4.693 3.154 1.00 0.32 N ATOM 951 CA ASN A 85 -11.214 -5.639 2.229 1.00 0.32 C ATOM 952 C ASN A 85 -11.906 -4.999 1.007 1.00 0.39 C ATOM 953 O ASN A 85 -11.859 -3.783 0.819 1.00 0.51 O ATOM 954 CB ASN A 85 -12.136 -6.581 3.020 1.00 0.37 C ATOM 955 CG ASN A 85 -11.904 -7.987 2.520 1.00 0.74 C ATOM 956 OD1 ASN A 85 -12.624 -8.501 1.680 1.00 1.98 O ATOM 957 ND2 ASN A 85 -10.805 -8.573 2.923 1.00 0.57 N ATOM 0 H ASN A 85 -11.227 -4.268 3.810 1.00 0.32 H new ATOM 0 HA ASN A 85 -10.415 -6.221 1.769 1.00 0.32 H new ATOM 0 HB2 ASN A 85 -11.923 -6.516 4.087 1.00 0.37 H new ATOM 0 HB3 ASN A 85 -13.179 -6.296 2.885 1.00 0.37 H new ATOM 0 HD21 ASN A 85 -10.537 -9.477 2.534 1.00 0.57 H new ATOM 0 HD22 ASN A 85 -10.217 -8.126 3.626 1.00 0.57 H new ATOM 964 N THR A 86 -12.572 -5.804 0.165 1.00 0.54 N ATOM 965 CA THR A 86 -13.354 -5.313 -0.992 1.00 0.74 C ATOM 966 C THR A 86 -14.454 -4.327 -0.600 1.00 0.67 C ATOM 967 O THR A 86 -14.742 -3.392 -1.342 1.00 0.78 O ATOM 968 CB THR A 86 -14.033 -6.461 -1.762 1.00 1.10 C ATOM 969 OG1 THR A 86 -14.828 -7.212 -0.874 1.00 1.78 O ATOM 970 CG2 THR A 86 -13.027 -7.412 -2.401 1.00 1.22 C ATOM 0 H THR A 86 -12.587 -6.819 0.264 1.00 0.54 H new ATOM 0 HA THR A 86 -12.618 -4.810 -1.619 1.00 0.74 H new ATOM 0 HB THR A 86 -14.629 -6.004 -2.552 1.00 1.10 H new ATOM 0 HG1 THR A 86 -15.263 -7.942 -1.362 1.00 1.78 H new ATOM 0 HG21 THR A 86 -13.559 -8.202 -2.931 1.00 1.22 H new ATOM 0 HG22 THR A 86 -12.401 -6.861 -3.104 1.00 1.22 H new ATOM 0 HG23 THR A 86 -12.400 -7.853 -1.626 1.00 1.22 H new ATOM 978 N ASN A 87 -15.014 -4.483 0.601 1.00 0.59 N ATOM 979 CA ASN A 87 -16.039 -3.600 1.168 1.00 0.61 C ATOM 980 C ASN A 87 -15.449 -2.387 1.918 1.00 0.50 C ATOM 981 O ASN A 87 -16.129 -1.799 2.760 1.00 0.56 O ATOM 982 CB ASN A 87 -16.989 -4.440 2.038 1.00 0.76 C ATOM 983 CG ASN A 87 -17.651 -5.559 1.257 1.00 1.20 C ATOM 984 OD1 ASN A 87 -18.280 -5.331 0.232 1.00 1.55 O ATOM 985 ND2 ASN A 87 -17.510 -6.781 1.701 1.00 1.95 N ATOM 0 H ASN A 87 -14.761 -5.249 1.225 1.00 0.59 H new ATOM 0 HA ASN A 87 -16.608 -3.155 0.351 1.00 0.61 H new ATOM 0 HB2 ASN A 87 -16.432 -4.864 2.874 1.00 0.76 H new ATOM 0 HB3 ASN A 87 -17.757 -3.793 2.462 1.00 0.76 H new ATOM 0 HD21 ASN A 87 -17.927 -7.560 1.192 1.00 1.95 H new ATOM 0 HD22 ASN A 87 -16.983 -6.955 2.557 1.00 1.95 H new ATOM 992 N ASN A 88 -14.172 -2.052 1.672 1.00 0.43 N ATOM 993 CA ASN A 88 -13.411 -0.985 2.333 1.00 0.42 C ATOM 994 C ASN A 88 -13.386 -1.105 3.875 1.00 0.42 C ATOM 995 O ASN A 88 -13.179 -0.115 4.574 1.00 0.47 O ATOM 996 CB ASN A 88 -13.832 0.413 1.819 1.00 0.45 C ATOM 997 CG ASN A 88 -14.402 0.455 0.408 1.00 0.47 C ATOM 998 OD1 ASN A 88 -15.608 0.390 0.200 1.00 0.57 O ATOM 999 ND2 ASN A 88 -13.560 0.539 -0.591 1.00 0.43 N ATOM 0 H ASN A 88 -13.617 -2.544 0.972 1.00 0.43 H new ATOM 0 HA ASN A 88 -12.368 -1.118 2.044 1.00 0.42 H new ATOM 0 HB2 ASN A 88 -14.575 0.822 2.503 1.00 0.45 H new ATOM 0 HB3 ASN A 88 -12.964 1.071 1.860 1.00 0.45 H new ATOM 0 HD21 ASN A 88 -13.906 0.551 -1.550 1.00 0.43 H new ATOM 0 HD22 ASN A 88 -12.558 0.593 -0.410 1.00 0.43 H new ATOM 1006 N GLU A 89 -13.620 -2.310 4.413 1.00 0.41 N ATOM 1007 CA GLU A 89 -13.599 -2.606 5.853 1.00 0.41 C ATOM 1008 C GLU A 89 -12.166 -2.722 6.347 1.00 0.33 C ATOM 1009 O GLU A 89 -11.351 -3.341 5.666 1.00 0.29 O ATOM 1010 CB GLU A 89 -14.312 -3.931 6.181 1.00 0.46 C ATOM 1011 CG GLU A 89 -15.822 -3.769 6.394 1.00 0.62 C ATOM 1012 CD GLU A 89 -16.414 -5.002 7.097 1.00 1.08 C ATOM 1013 OE1 GLU A 89 -16.326 -5.092 8.347 1.00 2.10 O ATOM 1014 OE2 GLU A 89 -16.980 -5.891 6.419 1.00 1.77 O ATOM 0 H GLU A 89 -13.835 -3.128 3.843 1.00 0.41 H new ATOM 0 HA GLU A 89 -14.119 -1.785 6.346 1.00 0.41 H new ATOM 0 HB2 GLU A 89 -14.140 -4.639 5.370 1.00 0.46 H new ATOM 0 HB3 GLU A 89 -13.869 -4.362 7.079 1.00 0.46 H new ATOM 0 HG2 GLU A 89 -16.015 -2.878 6.991 1.00 0.62 H new ATOM 0 HG3 GLU A 89 -16.315 -3.622 5.433 1.00 0.62 H new ATOM 1021 N ILE A 90 -11.876 -2.201 7.541 1.00 0.35 N ATOM 1022 CA ILE A 90 -10.549 -2.293 8.151 1.00 0.32 C ATOM 1023 C ILE A 90 -10.382 -3.681 8.781 1.00 0.31 C ATOM 1024 O ILE A 90 -11.199 -4.089 9.609 1.00 0.35 O ATOM 1025 CB ILE A 90 -10.298 -1.158 9.167 1.00 0.39 C ATOM 1026 CG1 ILE A 90 -10.703 0.216 8.591 1.00 0.43 C ATOM 1027 CG2 ILE A 90 -8.807 -1.168 9.560 1.00 0.44 C ATOM 1028 CD1 ILE A 90 -10.404 1.379 9.535 1.00 0.53 C ATOM 0 H ILE A 90 -12.557 -1.702 8.113 1.00 0.35 H new ATOM 0 HA ILE A 90 -9.794 -2.166 7.376 1.00 0.32 H new ATOM 0 HB ILE A 90 -10.915 -1.327 10.050 1.00 0.39 H new ATOM 0 HG12 ILE A 90 -10.177 0.377 7.650 1.00 0.43 H new ATOM 0 HG13 ILE A 90 -11.769 0.207 8.363 1.00 0.43 H new ATOM 0 HG21 ILE A 90 -8.615 -0.371 10.278 1.00 0.44 H new ATOM 0 HG22 ILE A 90 -8.555 -2.129 10.009 1.00 0.44 H new ATOM 0 HG23 ILE A 90 -8.195 -1.011 8.671 1.00 0.44 H new ATOM 0 HD11 ILE A 90 -10.713 2.315 9.069 1.00 0.53 H new ATOM 0 HD12 ILE A 90 -10.951 1.240 10.468 1.00 0.53 H new ATOM 0 HD13 ILE A 90 -9.335 1.413 9.743 1.00 0.53 H new ATOM 1040 N ILE A 91 -9.332 -4.404 8.389 1.00 0.27 N ATOM 1041 CA ILE A 91 -9.081 -5.793 8.810 1.00 0.26 C ATOM 1042 C ILE A 91 -7.713 -6.012 9.484 1.00 0.25 C ATOM 1043 O ILE A 91 -6.776 -5.232 9.318 1.00 0.26 O ATOM 1044 CB ILE A 91 -9.323 -6.782 7.644 1.00 0.27 C ATOM 1045 CG1 ILE A 91 -8.329 -6.645 6.470 1.00 0.27 C ATOM 1046 CG2 ILE A 91 -10.731 -6.611 7.067 1.00 0.31 C ATOM 1047 CD1 ILE A 91 -8.030 -7.993 5.811 1.00 0.59 C ATOM 0 H ILE A 91 -8.617 -4.039 7.759 1.00 0.27 H new ATOM 0 HA ILE A 91 -9.811 -6.004 9.592 1.00 0.26 H new ATOM 0 HB ILE A 91 -9.183 -7.765 8.094 1.00 0.27 H new ATOM 0 HG12 ILE A 91 -8.738 -5.961 5.727 1.00 0.27 H new ATOM 0 HG13 ILE A 91 -7.400 -6.204 6.831 1.00 0.27 H new ATOM 0 HG21 ILE A 91 -10.877 -7.317 6.249 1.00 0.31 H new ATOM 0 HG22 ILE A 91 -11.469 -6.801 7.846 1.00 0.31 H new ATOM 0 HG23 ILE A 91 -10.850 -5.594 6.694 1.00 0.31 H new ATOM 0 HD11 ILE A 91 -7.327 -7.849 4.991 1.00 0.59 H new ATOM 0 HD12 ILE A 91 -7.595 -8.669 6.547 1.00 0.59 H new ATOM 0 HD13 ILE A 91 -8.955 -8.422 5.425 1.00 0.59 H new ATOM 1059 N ASP A 92 -7.615 -7.074 10.283 1.00 0.29 N ATOM 1060 CA ASP A 92 -6.360 -7.628 10.812 1.00 0.37 C ATOM 1061 C ASP A 92 -5.794 -8.694 9.841 1.00 0.39 C ATOM 1062 O ASP A 92 -6.497 -9.189 8.960 1.00 0.39 O ATOM 1063 CB ASP A 92 -6.634 -8.171 12.225 1.00 0.42 C ATOM 1064 CG ASP A 92 -5.411 -8.654 13.010 1.00 0.70 C ATOM 1065 OD1 ASP A 92 -4.249 -8.349 12.647 1.00 1.67 O ATOM 1066 OD2 ASP A 92 -5.620 -9.365 14.019 1.00 1.25 O ATOM 0 H ASP A 92 -8.435 -7.594 10.594 1.00 0.29 H new ATOM 0 HA ASP A 92 -5.590 -6.860 10.891 1.00 0.37 H new ATOM 0 HB2 ASP A 92 -7.126 -7.389 12.804 1.00 0.42 H new ATOM 0 HB3 ASP A 92 -7.338 -8.999 12.144 1.00 0.42 H new ATOM 1071 N GLU A 93 -4.532 -9.097 10.008 1.00 0.49 N ATOM 1072 CA GLU A 93 -3.763 -9.957 9.079 1.00 0.56 C ATOM 1073 C GLU A 93 -4.233 -11.429 8.997 1.00 0.54 C ATOM 1074 O GLU A 93 -3.633 -12.253 8.310 1.00 0.57 O ATOM 1075 CB GLU A 93 -2.253 -9.812 9.361 1.00 0.73 C ATOM 1076 CG GLU A 93 -1.790 -10.432 10.684 1.00 0.80 C ATOM 1077 CD GLU A 93 -0.331 -10.080 10.998 1.00 1.17 C ATOM 1078 OE1 GLU A 93 -0.050 -8.917 11.388 1.00 2.06 O ATOM 1079 OE2 GLU A 93 0.540 -10.982 10.951 1.00 2.05 O ATOM 0 H GLU A 93 -3.987 -8.826 10.826 1.00 0.49 H new ATOM 0 HA GLU A 93 -3.970 -9.590 8.074 1.00 0.56 H new ATOM 0 HB2 GLU A 93 -1.698 -10.274 8.544 1.00 0.73 H new ATOM 0 HB3 GLU A 93 -1.997 -8.753 9.362 1.00 0.73 H new ATOM 0 HG2 GLU A 93 -2.431 -10.082 11.493 1.00 0.80 H new ATOM 0 HG3 GLU A 93 -1.900 -11.515 10.636 1.00 0.80 H new ATOM 1086 N ASN A 94 -5.336 -11.751 9.672 1.00 0.63 N ATOM 1087 CA ASN A 94 -6.083 -13.017 9.646 1.00 0.63 C ATOM 1088 C ASN A 94 -7.491 -12.872 9.014 1.00 0.59 C ATOM 1089 O ASN A 94 -8.281 -13.824 9.006 1.00 0.65 O ATOM 1090 CB ASN A 94 -6.127 -13.608 11.063 1.00 0.64 C ATOM 1091 CG ASN A 94 -6.513 -12.542 12.057 1.00 1.39 C ATOM 1092 OD1 ASN A 94 -7.654 -12.114 12.142 1.00 2.74 O ATOM 1093 ND2 ASN A 94 -5.537 -11.976 12.717 1.00 1.17 N ATOM 0 H ASN A 94 -5.770 -11.079 10.305 1.00 0.63 H new ATOM 0 HA ASN A 94 -5.558 -13.715 8.994 1.00 0.63 H new ATOM 0 HB2 ASN A 94 -6.844 -14.428 11.101 1.00 0.64 H new ATOM 0 HB3 ASN A 94 -5.153 -14.023 11.323 1.00 0.64 H new ATOM 0 HD21 ASN A 94 -5.724 -11.168 13.311 1.00 1.17 H new ATOM 0 HD22 ASN A 94 -4.588 -12.342 12.638 1.00 1.17 H new ATOM 1100 N GLY A 95 -7.834 -11.686 8.494 1.00 0.54 N ATOM 1101 CA GLY A 95 -9.103 -11.408 7.819 1.00 0.53 C ATOM 1102 C GLY A 95 -10.281 -11.138 8.759 1.00 0.52 C ATOM 1103 O GLY A 95 -11.420 -11.094 8.291 1.00 0.58 O ATOM 0 H GLY A 95 -7.218 -10.874 8.534 1.00 0.54 H new ATOM 0 HA2 GLY A 95 -8.971 -10.545 7.167 1.00 0.53 H new ATOM 0 HA3 GLY A 95 -9.352 -12.255 7.180 1.00 0.53 H new ATOM 1107 N GLN A 96 -10.044 -10.958 10.064 1.00 0.49 N ATOM 1108 CA GLN A 96 -11.059 -10.465 10.995 1.00 0.50 C ATOM 1109 C GLN A 96 -11.261 -8.955 10.803 1.00 0.42 C ATOM 1110 O GLN A 96 -10.287 -8.220 10.635 1.00 0.36 O ATOM 1111 CB GLN A 96 -10.677 -10.823 12.439 1.00 0.60 C ATOM 1112 CG GLN A 96 -11.729 -10.296 13.427 1.00 0.74 C ATOM 1113 CD GLN A 96 -11.664 -10.918 14.813 1.00 1.30 C ATOM 1114 OE1 GLN A 96 -10.742 -11.627 15.201 1.00 2.09 O ATOM 1115 NE2 GLN A 96 -12.665 -10.661 15.616 1.00 1.67 N ATOM 0 H GLN A 96 -9.143 -11.151 10.501 1.00 0.49 H new ATOM 0 HA GLN A 96 -12.012 -10.951 10.785 1.00 0.50 H new ATOM 0 HB2 GLN A 96 -10.587 -11.905 12.539 1.00 0.60 H new ATOM 0 HB3 GLN A 96 -9.702 -10.399 12.678 1.00 0.60 H new ATOM 0 HG2 GLN A 96 -11.611 -9.217 13.522 1.00 0.74 H new ATOM 0 HG3 GLN A 96 -12.720 -10.473 13.010 1.00 0.74 H new ATOM 0 HE21 GLN A 96 -13.435 -10.072 15.299 1.00 1.67 H new ATOM 0 HE22 GLN A 96 -12.675 -11.050 16.559 1.00 1.67 H new ATOM 1124 N THR A 97 -12.512 -8.486 10.835 1.00 0.46 N ATOM 1125 CA THR A 97 -12.878 -7.093 10.538 1.00 0.43 C ATOM 1126 C THR A 97 -13.216 -6.298 11.802 1.00 0.48 C ATOM 1127 O THR A 97 -13.851 -6.812 12.728 1.00 0.66 O ATOM 1128 CB THR A 97 -13.957 -6.982 9.451 1.00 0.56 C ATOM 1129 OG1 THR A 97 -15.271 -6.971 9.957 1.00 0.93 O ATOM 1130 CG2 THR A 97 -13.903 -8.062 8.368 1.00 0.49 C ATOM 0 H THR A 97 -13.313 -9.071 11.071 1.00 0.46 H new ATOM 0 HA THR A 97 -11.989 -6.624 10.117 1.00 0.43 H new ATOM 0 HB THR A 97 -13.713 -6.019 9.002 1.00 0.56 H new ATOM 0 HG1 THR A 97 -15.860 -6.506 9.327 1.00 0.93 H new ATOM 0 HG21 THR A 97 -14.705 -7.896 7.648 1.00 0.49 H new ATOM 0 HG22 THR A 97 -12.941 -8.017 7.857 1.00 0.49 H new ATOM 0 HG23 THR A 97 -14.024 -9.043 8.826 1.00 0.49 H new ATOM 1138 N LEU A 98 -12.788 -5.034 11.853 1.00 0.42 N ATOM 1139 CA LEU A 98 -12.770 -4.206 13.067 1.00 0.47 C ATOM 1140 C LEU A 98 -13.995 -3.288 13.268 1.00 0.53 C ATOM 1141 O LEU A 98 -14.015 -2.476 14.196 1.00 0.66 O ATOM 1142 CB LEU A 98 -11.433 -3.433 13.107 1.00 0.45 C ATOM 1143 CG LEU A 98 -10.170 -4.227 13.507 1.00 0.54 C ATOM 1144 CD1 LEU A 98 -10.277 -4.858 14.892 1.00 0.77 C ATOM 1145 CD2 LEU A 98 -9.751 -5.317 12.529 1.00 0.43 C ATOM 0 H LEU A 98 -12.435 -4.543 11.031 1.00 0.42 H new ATOM 0 HA LEU A 98 -12.846 -4.882 13.919 1.00 0.47 H new ATOM 0 HB2 LEU A 98 -11.263 -3.002 12.121 1.00 0.45 H new ATOM 0 HB3 LEU A 98 -11.544 -2.602 13.803 1.00 0.45 H new ATOM 0 HG LEU A 98 -9.401 -3.455 13.499 1.00 0.54 H new ATOM 0 HD11 LEU A 98 -9.359 -5.402 15.116 1.00 0.77 H new ATOM 0 HD12 LEU A 98 -10.427 -4.077 15.637 1.00 0.77 H new ATOM 0 HD13 LEU A 98 -11.122 -5.547 14.914 1.00 0.77 H new ATOM 0 HD21 LEU A 98 -8.855 -5.815 12.901 1.00 0.43 H new ATOM 0 HD22 LEU A 98 -10.556 -6.045 12.429 1.00 0.43 H new ATOM 0 HD23 LEU A 98 -9.542 -4.872 11.556 1.00 0.43 H new ATOM 1157 N GLY A 99 -15.020 -3.397 12.422 1.00 0.51 N ATOM 1158 CA GLY A 99 -16.259 -2.616 12.522 1.00 0.56 C ATOM 1159 C GLY A 99 -16.107 -1.158 12.074 1.00 0.57 C ATOM 1160 O GLY A 99 -16.793 -0.279 12.600 1.00 0.64 O ATOM 0 H GLY A 99 -15.015 -4.042 11.632 1.00 0.51 H new ATOM 0 HA2 GLY A 99 -17.029 -3.094 11.917 1.00 0.56 H new ATOM 0 HA3 GLY A 99 -16.608 -2.635 13.555 1.00 0.56 H new ATOM 1164 N VAL A 100 -15.175 -0.891 11.149 1.00 0.53 N ATOM 1165 CA VAL A 100 -14.956 0.432 10.541 1.00 0.57 C ATOM 1166 C VAL A 100 -14.722 0.281 9.031 1.00 0.52 C ATOM 1167 O VAL A 100 -14.180 -0.729 8.575 1.00 0.47 O ATOM 1168 CB VAL A 100 -13.786 1.182 11.219 1.00 0.63 C ATOM 1169 CG1 VAL A 100 -13.664 2.629 10.718 1.00 1.22 C ATOM 1170 CG2 VAL A 100 -13.923 1.260 12.746 1.00 1.12 C ATOM 0 H VAL A 100 -14.537 -1.603 10.794 1.00 0.53 H new ATOM 0 HA VAL A 100 -15.851 1.035 10.696 1.00 0.57 H new ATOM 0 HB VAL A 100 -12.905 0.598 10.954 1.00 0.63 H new ATOM 0 HG11 VAL A 100 -12.830 3.119 11.220 1.00 1.22 H new ATOM 0 HG12 VAL A 100 -13.490 2.628 9.642 1.00 1.22 H new ATOM 0 HG13 VAL A 100 -14.586 3.168 10.936 1.00 1.22 H new ATOM 0 HG21 VAL A 100 -13.071 1.798 13.161 1.00 1.12 H new ATOM 0 HG22 VAL A 100 -14.843 1.785 13.002 1.00 1.12 H new ATOM 0 HG23 VAL A 100 -13.952 0.252 13.161 1.00 1.12 H new ATOM 1180 N ASN A 101 -15.118 1.292 8.257 1.00 0.56 N ATOM 1181 CA ASN A 101 -15.071 1.408 6.817 1.00 0.54 C ATOM 1182 C ASN A 101 -14.492 2.775 6.393 1.00 0.57 C ATOM 1183 O ASN A 101 -14.613 3.765 7.125 1.00 0.72 O ATOM 1184 CB ASN A 101 -16.536 1.252 6.391 1.00 0.61 C ATOM 1185 CG ASN A 101 -16.806 1.663 4.977 1.00 0.85 C ATOM 1186 OD1 ASN A 101 -17.208 2.779 4.704 1.00 1.33 O ATOM 1187 ND2 ASN A 101 -16.550 0.835 4.014 1.00 0.87 N ATOM 0 H ASN A 101 -15.519 2.131 8.676 1.00 0.56 H new ATOM 0 HA ASN A 101 -14.425 0.666 6.349 1.00 0.54 H new ATOM 0 HB2 ASN A 101 -16.832 0.211 6.519 1.00 0.61 H new ATOM 0 HB3 ASN A 101 -17.163 1.845 7.057 1.00 0.61 H new ATOM 0 HD21 ASN A 101 -16.686 1.122 3.045 1.00 0.87 H new ATOM 0 HD22 ASN A 101 -16.212 -0.104 4.225 1.00 0.87 H new ATOM 1194 N ILE A 102 -13.890 2.835 5.203 1.00 0.49 N ATOM 1195 CA ILE A 102 -13.153 4.010 4.684 1.00 0.48 C ATOM 1196 C ILE A 102 -13.569 4.363 3.240 1.00 0.48 C ATOM 1197 O ILE A 102 -13.520 3.514 2.350 1.00 0.55 O ATOM 1198 CB ILE A 102 -11.616 3.796 4.796 1.00 0.41 C ATOM 1199 CG1 ILE A 102 -11.147 3.398 6.218 1.00 0.42 C ATOM 1200 CG2 ILE A 102 -10.910 5.107 4.405 1.00 0.45 C ATOM 1201 CD1 ILE A 102 -9.696 2.894 6.294 1.00 0.41 C ATOM 0 H ILE A 102 -13.897 2.052 4.550 1.00 0.49 H new ATOM 0 HA ILE A 102 -13.421 4.863 5.307 1.00 0.48 H new ATOM 0 HB ILE A 102 -11.361 2.972 4.130 1.00 0.41 H new ATOM 0 HG12 ILE A 102 -11.254 4.260 6.876 1.00 0.42 H new ATOM 0 HG13 ILE A 102 -11.809 2.621 6.601 1.00 0.42 H new ATOM 0 HG21 ILE A 102 -9.831 4.975 4.478 1.00 0.45 H new ATOM 0 HG22 ILE A 102 -11.175 5.372 3.381 1.00 0.45 H new ATOM 0 HG23 ILE A 102 -11.224 5.904 5.079 1.00 0.45 H new ATOM 0 HD11 ILE A 102 -9.453 2.638 7.325 1.00 0.41 H new ATOM 0 HD12 ILE A 102 -9.584 2.011 5.665 1.00 0.41 H new ATOM 0 HD13 ILE A 102 -9.021 3.675 5.945 1.00 0.41 H new ATOM 1213 N ASP A 103 -13.920 5.628 2.966 1.00 0.55 N ATOM 1214 CA ASP A 103 -14.187 6.100 1.592 1.00 0.54 C ATOM 1215 C ASP A 103 -12.897 6.179 0.752 1.00 0.45 C ATOM 1216 O ASP A 103 -11.905 6.680 1.282 1.00 0.48 O ATOM 1217 CB ASP A 103 -14.762 7.519 1.605 1.00 0.66 C ATOM 1218 CG ASP A 103 -15.597 7.763 0.358 1.00 0.89 C ATOM 1219 OD1 ASP A 103 -16.797 7.411 0.353 1.00 1.88 O ATOM 1220 OD2 ASP A 103 -15.039 8.262 -0.638 1.00 2.10 O ATOM 0 H ASP A 103 -14.027 6.349 3.680 1.00 0.55 H new ATOM 0 HA ASP A 103 -14.887 5.383 1.163 1.00 0.54 H new ATOM 0 HB2 ASP A 103 -15.375 7.662 2.495 1.00 0.66 H new ATOM 0 HB3 ASP A 103 -13.952 8.246 1.656 1.00 0.66 H new ATOM 1225 N PRO A 104 -12.860 5.825 -0.550 1.00 0.48 N ATOM 1226 CA PRO A 104 -11.638 5.989 -1.342 1.00 0.54 C ATOM 1227 C PRO A 104 -11.348 7.461 -1.704 1.00 0.60 C ATOM 1228 O PRO A 104 -10.193 7.839 -1.901 1.00 0.81 O ATOM 1229 CB PRO A 104 -11.841 5.078 -2.554 1.00 0.65 C ATOM 1230 CG PRO A 104 -13.350 5.064 -2.768 1.00 0.76 C ATOM 1231 CD PRO A 104 -13.944 5.306 -1.380 1.00 0.60 C ATOM 0 HA PRO A 104 -10.745 5.707 -0.784 1.00 0.54 H new ATOM 0 HB2 PRO A 104 -11.319 5.461 -3.431 1.00 0.65 H new ATOM 0 HB3 PRO A 104 -11.457 4.075 -2.366 1.00 0.65 H new ATOM 0 HG2 PRO A 104 -13.657 5.839 -3.470 1.00 0.76 H new ATOM 0 HG3 PRO A 104 -13.682 4.111 -3.180 1.00 0.76 H new ATOM 0 HD2 PRO A 104 -14.769 6.017 -1.430 1.00 0.60 H new ATOM 0 HD3 PRO A 104 -14.344 4.382 -0.963 1.00 0.60 H new ATOM 1239 N GLN A 105 -12.378 8.310 -1.739 1.00 0.56 N ATOM 1240 CA GLN A 105 -12.305 9.722 -2.124 1.00 0.65 C ATOM 1241 C GLN A 105 -12.057 10.657 -0.936 1.00 0.77 C ATOM 1242 O GLN A 105 -11.326 11.645 -1.050 1.00 1.04 O ATOM 1243 CB GLN A 105 -13.616 10.115 -2.815 1.00 0.68 C ATOM 1244 CG GLN A 105 -14.023 9.156 -3.929 1.00 0.67 C ATOM 1245 CD GLN A 105 -12.976 9.062 -5.033 1.00 0.73 C ATOM 1246 OE1 GLN A 105 -12.569 10.054 -5.625 1.00 1.22 O ATOM 1247 NE2 GLN A 105 -12.446 7.891 -5.297 1.00 0.71 N ATOM 0 H GLN A 105 -13.324 8.021 -1.490 1.00 0.56 H new ATOM 0 HA GLN A 105 -11.454 9.833 -2.797 1.00 0.65 H new ATOM 0 HB2 GLN A 105 -14.412 10.156 -2.072 1.00 0.68 H new ATOM 0 HB3 GLN A 105 -13.514 11.118 -3.228 1.00 0.68 H new ATOM 0 HG2 GLN A 105 -14.191 8.165 -3.507 1.00 0.67 H new ATOM 0 HG3 GLN A 105 -14.970 9.484 -4.358 1.00 0.67 H new ATOM 0 HE21 GLN A 105 -12.778 7.059 -4.809 1.00 0.71 H new ATOM 0 HE22 GLN A 105 -11.702 7.813 -5.990 1.00 0.71 H new ATOM 1256 N THR A 106 -12.672 10.349 0.207 1.00 0.70 N ATOM 1257 CA THR A 106 -12.565 11.151 1.447 1.00 0.81 C ATOM 1258 C THR A 106 -11.463 10.662 2.387 1.00 0.79 C ATOM 1259 O THR A 106 -10.892 11.457 3.134 1.00 0.86 O ATOM 1260 CB THR A 106 -13.911 11.248 2.198 1.00 0.89 C ATOM 1261 OG1 THR A 106 -14.181 10.119 2.984 1.00 0.86 O ATOM 1262 CG2 THR A 106 -15.087 11.418 1.243 1.00 0.89 C ATOM 0 H THR A 106 -13.268 9.527 0.309 1.00 0.70 H new ATOM 0 HA THR A 106 -12.286 12.152 1.117 1.00 0.81 H new ATOM 0 HB THR A 106 -13.804 12.124 2.837 1.00 0.89 H new ATOM 0 HG1 THR A 106 -15.141 10.076 3.176 1.00 0.86 H new ATOM 0 HG21 THR A 106 -16.013 11.482 1.814 1.00 0.89 H new ATOM 0 HG22 THR A 106 -14.955 12.331 0.662 1.00 0.89 H new ATOM 0 HG23 THR A 106 -15.135 10.563 0.569 1.00 0.89 H new ATOM 1270 N PHE A 107 -11.139 9.363 2.332 1.00 0.67 N ATOM 1271 CA PHE A 107 -10.271 8.658 3.299 1.00 0.67 C ATOM 1272 C PHE A 107 -10.759 8.803 4.770 1.00 0.75 C ATOM 1273 O PHE A 107 -9.993 8.578 5.712 1.00 0.83 O ATOM 1274 CB PHE A 107 -8.769 8.990 3.079 1.00 0.76 C ATOM 1275 CG PHE A 107 -7.993 8.330 1.938 1.00 0.69 C ATOM 1276 CD1 PHE A 107 -8.594 7.471 0.996 1.00 1.99 C ATOM 1277 CD2 PHE A 107 -6.597 8.542 1.848 1.00 2.12 C ATOM 1278 CE1 PHE A 107 -7.811 6.754 0.088 1.00 1.93 C ATOM 1279 CE2 PHE A 107 -5.823 7.866 0.893 1.00 2.18 C ATOM 1280 CZ PHE A 107 -6.423 6.941 0.030 1.00 0.75 C ATOM 0 H PHE A 107 -11.482 8.750 1.592 1.00 0.67 H new ATOM 0 HA PHE A 107 -10.361 7.591 3.096 1.00 0.67 H new ATOM 0 HB2 PHE A 107 -8.694 10.068 2.939 1.00 0.76 H new ATOM 0 HB3 PHE A 107 -8.246 8.751 4.005 1.00 0.76 H new ATOM 0 HD1 PHE A 107 -9.669 7.366 0.976 1.00 1.99 H new ATOM 0 HD2 PHE A 107 -6.120 9.235 2.525 1.00 2.12 H new ATOM 0 HE1 PHE A 107 -8.281 6.046 -0.578 1.00 1.93 H new ATOM 0 HE2 PHE A 107 -4.763 8.059 0.823 1.00 2.18 H new ATOM 0 HZ PHE A 107 -5.824 6.379 -0.671 1.00 0.75 H new ATOM 1290 N LYS A 108 -12.044 9.151 4.985 1.00 0.77 N ATOM 1291 CA LYS A 108 -12.648 9.341 6.317 1.00 0.88 C ATOM 1292 C LYS A 108 -13.194 8.028 6.883 1.00 0.77 C ATOM 1293 O LYS A 108 -13.691 7.182 6.135 1.00 0.71 O ATOM 1294 CB LYS A 108 -13.669 10.508 6.307 1.00 1.10 C ATOM 1295 CG LYS A 108 -15.135 10.139 5.988 1.00 1.16 C ATOM 1296 CD LYS A 108 -15.995 9.926 7.248 1.00 1.44 C ATOM 1297 CE LYS A 108 -17.189 8.977 7.048 1.00 2.03 C ATOM 1298 NZ LYS A 108 -18.210 9.500 6.108 1.00 3.13 N ATOM 0 H LYS A 108 -12.702 9.311 4.222 1.00 0.77 H new ATOM 0 HA LYS A 108 -11.866 9.643 7.014 1.00 0.88 H new ATOM 0 HB2 LYS A 108 -13.644 10.992 7.283 1.00 1.10 H new ATOM 0 HB3 LYS A 108 -13.336 11.246 5.577 1.00 1.10 H new ATOM 0 HG2 LYS A 108 -15.578 10.930 5.383 1.00 1.16 H new ATOM 0 HG3 LYS A 108 -15.152 9.230 5.387 1.00 1.16 H new ATOM 0 HD2 LYS A 108 -15.362 9.532 8.043 1.00 1.44 H new ATOM 0 HD3 LYS A 108 -16.367 10.893 7.587 1.00 1.44 H new ATOM 0 HE2 LYS A 108 -16.823 8.019 6.678 1.00 2.03 H new ATOM 0 HE3 LYS A 108 -17.658 8.788 8.013 1.00 2.03 H new ATOM 0 HZ1 LYS A 108 -18.985 8.812 6.019 1.00 3.13 H new ATOM 0 HZ2 LYS A 108 -18.585 10.400 6.469 1.00 3.13 H new ATOM 0 HZ3 LYS A 108 -17.776 9.655 5.175 1.00 3.13 H new ATOM 1312 N LEU A 109 -13.138 7.867 8.201 1.00 0.81 N ATOM 1313 CA LEU A 109 -13.550 6.666 8.933 1.00 0.78 C ATOM 1314 C LEU A 109 -15.036 6.689 9.323 1.00 0.83 C ATOM 1315 O LEU A 109 -15.565 7.700 9.792 1.00 0.92 O ATOM 1316 CB LEU A 109 -12.666 6.527 10.187 1.00 0.79 C ATOM 1317 CG LEU A 109 -11.191 6.212 9.875 1.00 0.75 C ATOM 1318 CD1 LEU A 109 -10.266 6.552 11.040 1.00 0.82 C ATOM 1319 CD2 LEU A 109 -11.000 4.726 9.622 1.00 0.68 C ATOM 0 H LEU A 109 -12.789 8.600 8.819 1.00 0.81 H new ATOM 0 HA LEU A 109 -13.420 5.806 8.276 1.00 0.78 H new ATOM 0 HB2 LEU A 109 -12.717 7.453 10.761 1.00 0.79 H new ATOM 0 HB3 LEU A 109 -13.071 5.737 10.820 1.00 0.79 H new ATOM 0 HG LEU A 109 -10.944 6.814 9.001 1.00 0.75 H new ATOM 0 HD11 LEU A 109 -9.238 6.312 10.770 1.00 0.82 H new ATOM 0 HD12 LEU A 109 -10.343 7.615 11.267 1.00 0.82 H new ATOM 0 HD13 LEU A 109 -10.556 5.972 11.916 1.00 0.82 H new ATOM 0 HD21 LEU A 109 -9.951 4.526 9.404 1.00 0.68 H new ATOM 0 HD22 LEU A 109 -11.300 4.165 10.507 1.00 0.68 H new ATOM 0 HD23 LEU A 109 -11.612 4.420 8.774 1.00 0.68 H new ATOM 1331 N SER A 110 -15.696 5.533 9.238 1.00 0.81 N ATOM 1332 CA SER A 110 -17.076 5.324 9.720 1.00 0.89 C ATOM 1333 C SER A 110 -17.188 5.213 11.256 1.00 1.00 C ATOM 1334 O SER A 110 -18.230 4.817 11.780 1.00 1.27 O ATOM 1335 CB SER A 110 -17.701 4.098 9.042 1.00 0.90 C ATOM 1336 OG SER A 110 -17.086 2.924 9.524 1.00 1.31 O ATOM 0 H SER A 110 -15.285 4.696 8.826 1.00 0.81 H new ATOM 0 HA SER A 110 -17.633 6.219 9.442 1.00 0.89 H new ATOM 0 HB2 SER A 110 -18.772 4.067 9.241 1.00 0.90 H new ATOM 0 HB3 SER A 110 -17.579 4.167 7.961 1.00 0.90 H new ATOM 0 HG SER A 110 -17.589 2.141 9.216 1.00 1.31 H new ATOM 1342 N GLY A 111 -16.109 5.528 11.981 1.00 0.93 N ATOM 1343 CA GLY A 111 -15.990 5.467 13.438 1.00 0.98 C ATOM 1344 C GLY A 111 -14.612 5.943 13.913 1.00 0.96 C ATOM 1345 O GLY A 111 -13.939 6.706 13.212 1.00 1.03 O ATOM 0 H GLY A 111 -15.248 5.850 11.540 1.00 0.93 H new ATOM 0 HA2 GLY A 111 -16.765 6.084 13.893 1.00 0.98 H new ATOM 0 HA3 GLY A 111 -16.158 4.444 13.775 1.00 0.98 H new ATOM 1349 N ALA A 112 -14.185 5.485 15.088 1.00 0.94 N ATOM 1350 CA ALA A 112 -12.869 5.751 15.674 1.00 0.94 C ATOM 1351 C ALA A 112 -11.857 4.620 15.402 1.00 0.93 C ATOM 1352 O ALA A 112 -12.232 3.499 15.044 1.00 0.98 O ATOM 1353 CB ALA A 112 -13.063 5.998 17.173 1.00 1.05 C ATOM 0 H ALA A 112 -14.767 4.895 15.683 1.00 0.94 H new ATOM 0 HA ALA A 112 -12.437 6.634 15.203 1.00 0.94 H new ATOM 0 HB1 ALA A 112 -12.097 6.199 17.637 1.00 1.05 H new ATOM 0 HB2 ALA A 112 -13.721 6.855 17.318 1.00 1.05 H new ATOM 0 HB3 ALA A 112 -13.509 5.116 17.632 1.00 1.05 H new ATOM 1359 N MET A 113 -10.566 4.907 15.600 1.00 0.95 N ATOM 1360 CA MET A 113 -9.451 3.991 15.317 1.00 0.97 C ATOM 1361 C MET A 113 -9.606 2.584 15.948 1.00 0.99 C ATOM 1362 O MET A 113 -10.027 2.462 17.103 1.00 1.19 O ATOM 1363 CB MET A 113 -8.125 4.630 15.772 1.00 1.11 C ATOM 1364 CG MET A 113 -7.461 5.429 14.645 1.00 1.23 C ATOM 1365 SD MET A 113 -6.516 4.397 13.488 1.00 1.52 S ATOM 1366 CE MET A 113 -6.357 5.515 12.080 1.00 1.10 C ATOM 0 H MET A 113 -10.258 5.806 15.971 1.00 0.95 H new ATOM 0 HA MET A 113 -9.454 3.835 14.238 1.00 0.97 H new ATOM 0 HB2 MET A 113 -8.311 5.287 16.622 1.00 1.11 H new ATOM 0 HB3 MET A 113 -7.445 3.850 16.114 1.00 1.11 H new ATOM 0 HG2 MET A 113 -8.229 5.971 14.093 1.00 1.23 H new ATOM 0 HG3 MET A 113 -6.796 6.175 15.081 1.00 1.23 H new ATOM 0 HE1 MET A 113 -5.383 5.374 11.612 1.00 1.10 H new ATOM 0 HE2 MET A 113 -7.142 5.301 11.355 1.00 1.10 H new ATOM 0 HE3 MET A 113 -6.450 6.546 12.422 1.00 1.10 H new ATOM 1376 N PRO A 114 -9.242 1.515 15.210 1.00 0.83 N ATOM 1377 CA PRO A 114 -9.306 0.125 15.670 1.00 0.77 C ATOM 1378 C PRO A 114 -8.149 -0.274 16.600 1.00 0.79 C ATOM 1379 O PRO A 114 -7.090 0.361 16.606 1.00 0.88 O ATOM 1380 CB PRO A 114 -9.228 -0.699 14.385 1.00 0.64 C ATOM 1381 CG PRO A 114 -8.318 0.144 13.505 1.00 0.65 C ATOM 1382 CD PRO A 114 -8.741 1.558 13.842 1.00 0.74 C ATOM 0 HA PRO A 114 -10.211 -0.035 16.257 1.00 0.77 H new ATOM 0 HB2 PRO A 114 -8.813 -1.691 14.564 1.00 0.64 H new ATOM 0 HB3 PRO A 114 -10.210 -0.841 13.934 1.00 0.64 H new ATOM 0 HG2 PRO A 114 -7.265 -0.028 13.730 1.00 0.65 H new ATOM 0 HG3 PRO A 114 -8.458 -0.079 12.447 1.00 0.65 H new ATOM 0 HD2 PRO A 114 -7.901 2.247 13.756 1.00 0.74 H new ATOM 0 HD3 PRO A 114 -9.512 1.908 13.156 1.00 0.74 H new ATOM 1390 N ALA A 115 -8.313 -1.391 17.311 1.00 0.78 N ATOM 1391 CA ALA A 115 -7.287 -1.989 18.168 1.00 0.81 C ATOM 1392 C ALA A 115 -6.181 -2.746 17.399 1.00 0.72 C ATOM 1393 O ALA A 115 -5.031 -2.308 17.381 1.00 1.03 O ATOM 1394 CB ALA A 115 -7.995 -2.899 19.180 1.00 0.92 C ATOM 0 H ALA A 115 -9.186 -1.919 17.307 1.00 0.78 H new ATOM 0 HA ALA A 115 -6.754 -1.183 18.673 1.00 0.81 H new ATOM 0 HB1 ALA A 115 -7.255 -3.360 19.834 1.00 0.92 H new ATOM 0 HB2 ALA A 115 -8.689 -2.308 19.777 1.00 0.92 H new ATOM 0 HB3 ALA A 115 -8.544 -3.676 18.649 1.00 0.92 H new ATOM 1400 N THR A 116 -6.525 -3.869 16.753 1.00 0.58 N ATOM 1401 CA THR A 116 -5.573 -4.854 16.187 1.00 0.52 C ATOM 1402 C THR A 116 -5.359 -4.783 14.669 1.00 0.44 C ATOM 1403 O THR A 116 -4.653 -5.623 14.109 1.00 0.53 O ATOM 1404 CB THR A 116 -6.013 -6.282 16.557 1.00 0.56 C ATOM 1405 OG1 THR A 116 -7.323 -6.469 16.080 1.00 0.65 O ATOM 1406 CG2 THR A 116 -6.041 -6.530 18.064 1.00 0.70 C ATOM 0 H THR A 116 -7.499 -4.131 16.602 1.00 0.58 H new ATOM 0 HA THR A 116 -4.614 -4.590 16.633 1.00 0.52 H new ATOM 0 HB THR A 116 -5.292 -6.969 16.115 1.00 0.56 H new ATOM 0 HG1 THR A 116 -7.626 -7.374 16.302 1.00 0.65 H new ATOM 0 HG21 THR A 116 -6.359 -7.554 18.258 1.00 0.70 H new ATOM 0 HG22 THR A 116 -5.044 -6.375 18.477 1.00 0.70 H new ATOM 0 HG23 THR A 116 -6.740 -5.838 18.534 1.00 0.70 H new ATOM 1414 N ALA A 117 -5.953 -3.796 13.987 1.00 0.42 N ATOM 1415 CA ALA A 117 -5.918 -3.661 12.523 1.00 0.38 C ATOM 1416 C ALA A 117 -4.500 -3.667 11.908 1.00 0.36 C ATOM 1417 O ALA A 117 -3.550 -3.136 12.487 1.00 0.46 O ATOM 1418 CB ALA A 117 -6.644 -2.372 12.124 1.00 0.47 C ATOM 0 H ALA A 117 -6.482 -3.054 14.445 1.00 0.42 H new ATOM 0 HA ALA A 117 -6.416 -4.545 12.123 1.00 0.38 H new ATOM 0 HB1 ALA A 117 -6.623 -2.263 11.040 1.00 0.47 H new ATOM 0 HB2 ALA A 117 -7.679 -2.417 12.464 1.00 0.47 H new ATOM 0 HB3 ALA A 117 -6.147 -1.518 12.584 1.00 0.47 H new ATOM 1424 N MET A 118 -4.389 -4.201 10.689 1.00 0.30 N ATOM 1425 CA MET A 118 -3.152 -4.367 9.918 1.00 0.32 C ATOM 1426 C MET A 118 -2.640 -3.021 9.373 1.00 0.36 C ATOM 1427 O MET A 118 -3.083 -2.554 8.327 1.00 0.38 O ATOM 1428 CB MET A 118 -3.474 -5.387 8.812 1.00 0.30 C ATOM 1429 CG MET A 118 -2.336 -5.717 7.842 1.00 0.34 C ATOM 1430 SD MET A 118 -2.641 -7.297 6.995 1.00 1.75 S ATOM 1431 CE MET A 118 -1.023 -7.720 6.298 1.00 0.83 C ATOM 0 H MET A 118 -5.205 -4.549 10.185 1.00 0.30 H new ATOM 0 HA MET A 118 -2.335 -4.735 10.539 1.00 0.32 H new ATOM 0 HB2 MET A 118 -3.800 -6.313 9.285 1.00 0.30 H new ATOM 0 HB3 MET A 118 -4.318 -5.010 8.234 1.00 0.30 H new ATOM 0 HG2 MET A 118 -2.237 -4.919 7.106 1.00 0.34 H new ATOM 0 HG3 MET A 118 -1.393 -5.768 8.386 1.00 0.34 H new ATOM 0 HE1 MET A 118 -1.036 -8.752 5.948 1.00 0.83 H new ATOM 0 HE2 MET A 118 -0.802 -7.056 5.462 1.00 0.83 H new ATOM 0 HE3 MET A 118 -0.256 -7.606 7.064 1.00 0.83 H new ATOM 1441 N LYS A 119 -1.719 -2.376 10.098 1.00 0.42 N ATOM 1442 CA LYS A 119 -1.191 -1.022 9.820 1.00 0.48 C ATOM 1443 C LYS A 119 0.280 -0.891 10.238 1.00 0.51 C ATOM 1444 O LYS A 119 0.649 -1.381 11.303 1.00 0.64 O ATOM 1445 CB LYS A 119 -2.076 0.016 10.534 1.00 0.52 C ATOM 1446 CG LYS A 119 -2.182 -0.116 12.071 1.00 0.56 C ATOM 1447 CD LYS A 119 -3.599 0.257 12.542 1.00 0.67 C ATOM 1448 CE LYS A 119 -3.826 0.016 14.047 1.00 0.76 C ATOM 1449 NZ LYS A 119 -3.102 0.968 14.927 1.00 1.18 N ATOM 0 H LYS A 119 -1.300 -2.794 10.929 1.00 0.42 H new ATOM 0 HA LYS A 119 -1.222 -0.841 8.746 1.00 0.48 H new ATOM 0 HB2 LYS A 119 -1.693 1.010 10.301 1.00 0.52 H new ATOM 0 HB3 LYS A 119 -3.081 -0.045 10.115 1.00 0.52 H new ATOM 0 HG2 LYS A 119 -1.948 -1.137 12.372 1.00 0.56 H new ATOM 0 HG3 LYS A 119 -1.449 0.533 12.550 1.00 0.56 H new ATOM 0 HD2 LYS A 119 -3.784 1.308 12.318 1.00 0.67 H new ATOM 0 HD3 LYS A 119 -4.327 -0.323 11.975 1.00 0.67 H new ATOM 0 HE2 LYS A 119 -4.893 0.082 14.258 1.00 0.76 H new ATOM 0 HE3 LYS A 119 -3.514 -0.999 14.293 1.00 0.76 H new ATOM 0 HZ1 LYS A 119 -3.304 0.743 15.922 1.00 1.18 H new ATOM 0 HZ2 LYS A 119 -2.079 0.891 14.755 1.00 1.18 H new ATOM 0 HZ3 LYS A 119 -3.415 1.938 14.721 1.00 1.18 H new ATOM 1463 N LYS A 120 1.118 -0.248 9.419 1.00 0.42 N ATOM 1464 CA LYS A 120 2.569 -0.042 9.655 1.00 0.43 C ATOM 1465 C LYS A 120 3.094 1.096 8.769 1.00 0.39 C ATOM 1466 O LYS A 120 2.490 1.395 7.743 1.00 0.47 O ATOM 1467 CB LYS A 120 3.340 -1.359 9.387 1.00 0.55 C ATOM 1468 CG LYS A 120 4.831 -1.297 9.765 1.00 0.57 C ATOM 1469 CD LYS A 120 5.568 -2.612 9.500 1.00 0.70 C ATOM 1470 CE LYS A 120 7.089 -2.404 9.514 1.00 0.95 C ATOM 1471 NZ LYS A 120 7.637 -2.159 10.869 1.00 1.87 N ATOM 0 H LYS A 120 0.803 0.162 8.539 1.00 0.42 H new ATOM 0 HA LYS A 120 2.727 0.241 10.696 1.00 0.43 H new ATOM 0 HB2 LYS A 120 2.867 -2.166 9.947 1.00 0.55 H new ATOM 0 HB3 LYS A 120 3.253 -1.611 8.330 1.00 0.55 H new ATOM 0 HG2 LYS A 120 5.311 -0.497 9.201 1.00 0.57 H new ATOM 0 HG3 LYS A 120 4.923 -1.041 10.821 1.00 0.57 H new ATOM 0 HD2 LYS A 120 5.291 -3.347 10.256 1.00 0.70 H new ATOM 0 HD3 LYS A 120 5.262 -3.016 8.535 1.00 0.70 H new ATOM 0 HE2 LYS A 120 7.572 -3.283 9.088 1.00 0.95 H new ATOM 0 HE3 LYS A 120 7.339 -1.560 8.871 1.00 0.95 H new ATOM 0 HZ1 LYS A 120 8.667 -2.027 10.808 1.00 1.87 H new ATOM 0 HZ2 LYS A 120 7.201 -1.304 11.270 1.00 1.87 H new ATOM 0 HZ3 LYS A 120 7.428 -2.974 11.481 1.00 1.87 H new ATOM 1485 N LEU A 121 4.219 1.704 9.153 1.00 0.39 N ATOM 1486 CA LEU A 121 4.912 2.745 8.378 1.00 0.38 C ATOM 1487 C LEU A 121 6.078 2.234 7.496 1.00 0.38 C ATOM 1488 O LEU A 121 6.766 1.288 7.884 1.00 0.38 O ATOM 1489 CB LEU A 121 5.382 3.871 9.313 1.00 0.40 C ATOM 1490 CG LEU A 121 4.221 4.559 10.056 1.00 0.42 C ATOM 1491 CD1 LEU A 121 4.007 4.017 11.468 1.00 0.47 C ATOM 1492 CD2 LEU A 121 4.469 6.058 10.148 1.00 0.47 C ATOM 0 H LEU A 121 4.687 1.483 10.032 1.00 0.39 H new ATOM 0 HA LEU A 121 4.176 3.127 7.670 1.00 0.38 H new ATOM 0 HB2 LEU A 121 6.082 3.462 10.042 1.00 0.40 H new ATOM 0 HB3 LEU A 121 5.926 4.615 8.732 1.00 0.40 H new ATOM 0 HG LEU A 121 3.323 4.347 9.475 1.00 0.42 H new ATOM 0 HD11 LEU A 121 3.175 4.543 11.937 1.00 0.47 H new ATOM 0 HD12 LEU A 121 3.781 2.952 11.419 1.00 0.47 H new ATOM 0 HD13 LEU A 121 4.911 4.169 12.057 1.00 0.47 H new ATOM 0 HD21 LEU A 121 3.641 6.532 10.675 1.00 0.47 H new ATOM 0 HD22 LEU A 121 5.397 6.241 10.690 1.00 0.47 H new ATOM 0 HD23 LEU A 121 4.547 6.476 9.144 1.00 0.47 H new ATOM 1504 N THR A 122 6.367 2.889 6.356 1.00 0.40 N ATOM 1505 CA THR A 122 7.592 2.627 5.548 1.00 0.41 C ATOM 1506 C THR A 122 8.871 3.018 6.301 1.00 0.40 C ATOM 1507 O THR A 122 8.950 4.098 6.886 1.00 0.43 O ATOM 1508 CB THR A 122 7.595 3.306 4.157 1.00 0.47 C ATOM 1509 OG1 THR A 122 7.117 4.626 4.233 1.00 0.52 O ATOM 1510 CG2 THR A 122 6.770 2.608 3.074 1.00 0.54 C ATOM 0 H THR A 122 5.766 3.613 5.963 1.00 0.40 H new ATOM 0 HA THR A 122 7.575 1.550 5.382 1.00 0.41 H new ATOM 0 HB THR A 122 8.644 3.254 3.866 1.00 0.47 H new ATOM 0 HG1 THR A 122 6.895 4.840 5.163 1.00 0.52 H new ATOM 0 HG21 THR A 122 6.844 3.169 2.142 1.00 0.54 H new ATOM 0 HG22 THR A 122 7.151 1.598 2.921 1.00 0.54 H new ATOM 0 HG23 THR A 122 5.727 2.559 3.386 1.00 0.54 H new ATOM 1518 N GLU A 123 9.894 2.157 6.270 1.00 0.42 N ATOM 1519 CA GLU A 123 11.171 2.362 6.982 1.00 0.49 C ATOM 1520 C GLU A 123 12.280 3.015 6.141 1.00 0.57 C ATOM 1521 O GLU A 123 12.718 4.124 6.449 1.00 0.71 O ATOM 1522 CB GLU A 123 11.672 1.080 7.666 1.00 0.55 C ATOM 1523 CG GLU A 123 11.456 -0.228 6.908 1.00 0.63 C ATOM 1524 CD GLU A 123 12.213 -1.381 7.587 1.00 1.05 C ATOM 1525 OE1 GLU A 123 13.468 -1.319 7.639 1.00 1.57 O ATOM 1526 OE2 GLU A 123 11.562 -2.338 8.081 1.00 2.30 O ATOM 0 H GLU A 123 9.863 1.284 5.743 1.00 0.42 H new ATOM 0 HA GLU A 123 10.929 3.089 7.757 1.00 0.49 H new ATOM 0 HB2 GLU A 123 12.739 1.191 7.857 1.00 0.55 H new ATOM 0 HB3 GLU A 123 11.181 0.997 8.636 1.00 0.55 H new ATOM 0 HG2 GLU A 123 10.392 -0.459 6.868 1.00 0.63 H new ATOM 0 HG3 GLU A 123 11.798 -0.118 5.879 1.00 0.63 H new ATOM 1533 N ALA A 124 12.752 2.334 5.095 1.00 0.58 N ATOM 1534 CA ALA A 124 13.815 2.823 4.207 1.00 0.69 C ATOM 1535 C ALA A 124 13.697 2.225 2.800 1.00 0.76 C ATOM 1536 O ALA A 124 13.741 2.952 1.803 1.00 0.96 O ATOM 1537 CB ALA A 124 15.176 2.478 4.826 1.00 0.76 C ATOM 0 H ALA A 124 12.402 1.412 4.835 1.00 0.58 H new ATOM 0 HA ALA A 124 13.717 3.904 4.104 1.00 0.69 H new ATOM 0 HB1 ALA A 124 15.973 2.837 4.175 1.00 0.76 H new ATOM 0 HB2 ALA A 124 15.263 2.955 5.802 1.00 0.76 H new ATOM 0 HB3 ALA A 124 15.260 1.397 4.941 1.00 0.76 H new ATOM 1543 N GLU A 125 13.478 0.910 2.715 1.00 0.79 N ATOM 1544 CA GLU A 125 13.204 0.230 1.446 1.00 1.04 C ATOM 1545 C GLU A 125 11.698 0.112 1.181 1.00 1.07 C ATOM 1546 O GLU A 125 11.264 0.283 0.047 1.00 1.99 O ATOM 1547 CB GLU A 125 13.911 -1.133 1.452 1.00 1.31 C ATOM 1548 CG GLU A 125 15.446 -1.056 1.394 1.00 1.62 C ATOM 1549 CD GLU A 125 15.961 -0.648 0.010 1.00 2.94 C ATOM 1550 OE1 GLU A 125 15.978 -1.508 -0.902 1.00 4.13 O ATOM 1551 OE2 GLU A 125 16.371 0.520 -0.178 1.00 3.84 O ATOM 0 H GLU A 125 13.486 0.287 3.523 1.00 0.79 H new ATOM 0 HA GLU A 125 13.600 0.822 0.621 1.00 1.04 H new ATOM 0 HB2 GLU A 125 13.621 -1.675 2.352 1.00 1.31 H new ATOM 0 HB3 GLU A 125 13.557 -1.716 0.602 1.00 1.31 H new ATOM 0 HG2 GLU A 125 15.799 -0.339 2.135 1.00 1.62 H new ATOM 0 HG3 GLU A 125 15.866 -2.025 1.663 1.00 1.62 H new ATOM 1558 N GLY A 126 10.892 -0.085 2.226 1.00 0.53 N ATOM 1559 CA GLY A 126 9.437 -0.216 2.156 1.00 0.46 C ATOM 1560 C GLY A 126 8.844 -0.522 3.539 1.00 0.50 C ATOM 1561 O GLY A 126 9.393 -0.080 4.547 1.00 0.65 O ATOM 0 H GLY A 126 11.249 -0.160 3.179 1.00 0.53 H new ATOM 0 HA2 GLY A 126 9.004 0.705 1.767 1.00 0.46 H new ATOM 0 HA3 GLY A 126 9.173 -1.012 1.459 1.00 0.46 H new ATOM 1565 N ALA A 127 7.725 -1.243 3.600 1.00 0.45 N ATOM 1566 CA ALA A 127 7.136 -1.820 4.816 1.00 0.47 C ATOM 1567 C ALA A 127 6.652 -3.254 4.551 1.00 0.45 C ATOM 1568 O ALA A 127 5.892 -3.474 3.604 1.00 0.42 O ATOM 1569 CB ALA A 127 5.959 -0.956 5.283 1.00 0.49 C ATOM 0 H ALA A 127 7.176 -1.453 2.766 1.00 0.45 H new ATOM 0 HA ALA A 127 7.899 -1.846 5.594 1.00 0.47 H new ATOM 0 HB1 ALA A 127 5.526 -1.388 6.185 1.00 0.49 H new ATOM 0 HB2 ALA A 127 6.311 0.053 5.497 1.00 0.49 H new ATOM 0 HB3 ALA A 127 5.202 -0.918 4.499 1.00 0.49 H new ATOM 1575 N LYS A 128 7.047 -4.217 5.395 1.00 0.47 N ATOM 1576 CA LYS A 128 6.659 -5.634 5.279 1.00 0.44 C ATOM 1577 C LYS A 128 5.368 -5.949 6.048 1.00 0.40 C ATOM 1578 O LYS A 128 5.172 -5.503 7.178 1.00 0.46 O ATOM 1579 CB LYS A 128 7.866 -6.518 5.654 1.00 0.54 C ATOM 1580 CG LYS A 128 7.610 -8.035 5.738 1.00 0.81 C ATOM 1581 CD LYS A 128 7.233 -8.479 7.159 1.00 1.67 C ATOM 1582 CE LYS A 128 6.994 -9.989 7.245 1.00 1.37 C ATOM 1583 NZ LYS A 128 6.648 -10.387 8.628 1.00 2.83 N ATOM 0 H LYS A 128 7.656 -4.032 6.192 1.00 0.47 H new ATOM 0 HA LYS A 128 6.401 -5.864 4.245 1.00 0.44 H new ATOM 0 HB2 LYS A 128 8.655 -6.346 4.922 1.00 0.54 H new ATOM 0 HB3 LYS A 128 8.247 -6.183 6.619 1.00 0.54 H new ATOM 0 HG2 LYS A 128 6.809 -8.306 5.050 1.00 0.81 H new ATOM 0 HG3 LYS A 128 8.503 -8.571 5.416 1.00 0.81 H new ATOM 0 HD2 LYS A 128 8.028 -8.198 7.849 1.00 1.67 H new ATOM 0 HD3 LYS A 128 6.334 -7.951 7.477 1.00 1.67 H new ATOM 0 HE2 LYS A 128 6.189 -10.274 6.567 1.00 1.37 H new ATOM 0 HE3 LYS A 128 7.887 -10.523 6.921 1.00 1.37 H new ATOM 0 HZ1 LYS A 128 6.490 -11.414 8.664 1.00 2.83 H new ATOM 0 HZ2 LYS A 128 7.428 -10.134 9.268 1.00 2.83 H new ATOM 0 HZ3 LYS A 128 5.782 -9.893 8.925 1.00 2.83 H new ATOM 1597 N PHE A 129 4.513 -6.752 5.422 1.00 0.37 N ATOM 1598 CA PHE A 129 3.204 -7.232 5.881 1.00 0.35 C ATOM 1599 C PHE A 129 3.134 -8.753 5.704 1.00 0.38 C ATOM 1600 O PHE A 129 3.461 -9.274 4.640 1.00 0.41 O ATOM 1601 CB PHE A 129 2.133 -6.506 5.068 1.00 0.31 C ATOM 1602 CG PHE A 129 1.905 -5.080 5.527 1.00 0.31 C ATOM 1603 CD1 PHE A 129 2.769 -4.071 5.077 1.00 1.85 C ATOM 1604 CD2 PHE A 129 0.887 -4.754 6.443 1.00 1.92 C ATOM 1605 CE1 PHE A 129 2.611 -2.757 5.534 1.00 1.84 C ATOM 1606 CE2 PHE A 129 0.699 -3.427 6.867 1.00 1.94 C ATOM 1607 CZ PHE A 129 1.561 -2.421 6.404 1.00 0.35 C ATOM 0 H PHE A 129 4.734 -7.119 4.496 1.00 0.37 H new ATOM 0 HA PHE A 129 3.044 -7.023 6.939 1.00 0.35 H new ATOM 0 HB2 PHE A 129 2.423 -6.501 4.017 1.00 0.31 H new ATOM 0 HB3 PHE A 129 1.196 -7.058 5.137 1.00 0.31 H new ATOM 0 HD1 PHE A 129 3.557 -4.308 4.377 1.00 1.85 H new ATOM 0 HD2 PHE A 129 0.243 -5.532 6.824 1.00 1.92 H new ATOM 0 HE1 PHE A 129 3.304 -1.993 5.214 1.00 1.84 H new ATOM 0 HE2 PHE A 129 -0.105 -3.183 7.546 1.00 1.94 H new ATOM 0 HZ PHE A 129 1.418 -1.396 6.714 1.00 0.35 H new ATOM 1617 N ASN A 130 2.718 -9.476 6.741 1.00 0.49 N ATOM 1618 CA ASN A 130 2.589 -10.933 6.744 1.00 0.54 C ATOM 1619 C ASN A 130 1.191 -11.330 6.242 1.00 0.56 C ATOM 1620 O ASN A 130 0.186 -10.905 6.803 1.00 0.76 O ATOM 1621 CB ASN A 130 2.860 -11.387 8.191 1.00 0.71 C ATOM 1622 CG ASN A 130 2.529 -12.837 8.480 1.00 1.05 C ATOM 1623 OD1 ASN A 130 3.173 -13.758 7.995 1.00 1.48 O ATOM 1624 ND2 ASN A 130 1.541 -13.077 9.307 1.00 1.75 N ATOM 0 H ASN A 130 2.453 -9.052 7.630 1.00 0.49 H new ATOM 0 HA ASN A 130 3.297 -11.420 6.073 1.00 0.54 H new ATOM 0 HB2 ASN A 130 3.913 -11.218 8.418 1.00 0.71 H new ATOM 0 HB3 ASN A 130 2.283 -10.757 8.868 1.00 0.71 H new ATOM 0 HD21 ASN A 130 1.303 -14.038 9.552 1.00 1.75 H new ATOM 0 HD22 ASN A 130 1.010 -12.303 9.706 1.00 1.75 H new ATOM 1631 N THR A 131 1.125 -12.155 5.198 1.00 0.52 N ATOM 1632 CA THR A 131 -0.122 -12.599 4.546 1.00 0.53 C ATOM 1633 C THR A 131 -0.442 -14.076 4.791 1.00 0.55 C ATOM 1634 O THR A 131 -1.458 -14.575 4.302 1.00 0.55 O ATOM 1635 CB THR A 131 -0.103 -12.294 3.040 1.00 0.54 C ATOM 1636 OG1 THR A 131 1.072 -12.799 2.449 1.00 0.56 O ATOM 1637 CG2 THR A 131 -0.146 -10.791 2.780 1.00 0.56 C ATOM 0 H THR A 131 1.960 -12.549 4.764 1.00 0.52 H new ATOM 0 HA THR A 131 -0.922 -12.025 5.013 1.00 0.53 H new ATOM 0 HB THR A 131 -0.983 -12.769 2.607 1.00 0.54 H new ATOM 0 HG1 THR A 131 1.068 -12.598 1.490 1.00 0.56 H new ATOM 0 HG21 THR A 131 -0.131 -10.607 1.706 1.00 0.56 H new ATOM 0 HG22 THR A 131 -1.058 -10.374 3.207 1.00 0.56 H new ATOM 0 HG23 THR A 131 0.721 -10.317 3.241 1.00 0.56 H new ATOM 1645 N ALA A 132 0.382 -14.769 5.587 1.00 0.61 N ATOM 1646 CA ALA A 132 0.281 -16.204 5.876 1.00 0.58 C ATOM 1647 C ALA A 132 -1.087 -16.669 6.411 1.00 0.55 C ATOM 1648 O ALA A 132 -1.401 -17.854 6.300 1.00 0.67 O ATOM 1649 CB ALA A 132 1.373 -16.551 6.899 1.00 0.74 C ATOM 0 H ALA A 132 1.167 -14.328 6.066 1.00 0.61 H new ATOM 0 HA ALA A 132 0.407 -16.727 4.928 1.00 0.58 H new ATOM 0 HB1 ALA A 132 1.325 -17.614 7.136 1.00 0.74 H new ATOM 0 HB2 ALA A 132 2.352 -16.316 6.480 1.00 0.74 H new ATOM 0 HB3 ALA A 132 1.218 -15.969 7.808 1.00 0.74 H new ATOM 1655 N ASN A 133 -1.891 -15.760 6.981 1.00 0.66 N ATOM 1656 CA ASN A 133 -3.179 -16.084 7.599 1.00 0.86 C ATOM 1657 C ASN A 133 -4.399 -15.598 6.788 1.00 0.79 C ATOM 1658 O ASN A 133 -5.520 -15.997 7.113 1.00 0.95 O ATOM 1659 CB ASN A 133 -3.200 -15.592 9.060 1.00 1.22 C ATOM 1660 CG ASN A 133 -2.015 -16.021 9.911 1.00 1.42 C ATOM 1661 OD1 ASN A 133 -1.266 -16.938 9.617 1.00 2.34 O ATOM 1662 ND2 ASN A 133 -1.769 -15.332 10.998 1.00 1.71 N ATOM 0 H ASN A 133 -1.660 -14.768 7.025 1.00 0.66 H new ATOM 0 HA ASN A 133 -3.274 -17.170 7.599 1.00 0.86 H new ATOM 0 HB2 ASN A 133 -3.249 -14.503 9.058 1.00 1.22 H new ATOM 0 HB3 ASN A 133 -4.114 -15.951 9.533 1.00 1.22 H new ATOM 0 HD21 ASN A 133 -0.964 -15.567 11.579 1.00 1.71 H new ATOM 0 HD22 ASN A 133 -2.382 -14.561 11.263 1.00 1.71 H new ATOM 1669 N LEU A 134 -4.235 -14.781 5.733 1.00 0.61 N ATOM 1670 CA LEU A 134 -5.356 -14.385 4.878 1.00 0.58 C ATOM 1671 C LEU A 134 -5.869 -15.528 3.974 1.00 0.63 C ATOM 1672 O LEU A 134 -5.070 -16.356 3.517 1.00 0.66 O ATOM 1673 CB LEU A 134 -4.977 -13.194 3.974 1.00 0.49 C ATOM 1674 CG LEU A 134 -4.971 -11.777 4.574 1.00 0.47 C ATOM 1675 CD1 LEU A 134 -6.024 -11.546 5.658 1.00 0.52 C ATOM 1676 CD2 LEU A 134 -3.598 -11.382 5.085 1.00 0.47 C ATOM 0 H LEU A 134 -3.337 -14.385 5.456 1.00 0.61 H new ATOM 0 HA LEU A 134 -6.153 -14.106 5.567 1.00 0.58 H new ATOM 0 HB2 LEU A 134 -3.981 -13.387 3.575 1.00 0.49 H new ATOM 0 HB3 LEU A 134 -5.664 -13.191 3.128 1.00 0.49 H new ATOM 0 HG LEU A 134 -5.241 -11.129 3.740 1.00 0.47 H new ATOM 0 HD11 LEU A 134 -5.949 -10.523 6.026 1.00 0.52 H new ATOM 0 HD12 LEU A 134 -7.018 -11.710 5.241 1.00 0.52 H new ATOM 0 HD13 LEU A 134 -5.857 -12.240 6.481 1.00 0.52 H new ATOM 0 HD21 LEU A 134 -3.640 -10.375 5.500 1.00 0.47 H new ATOM 0 HD22 LEU A 134 -3.283 -12.081 5.860 1.00 0.47 H new ATOM 0 HD23 LEU A 134 -2.883 -11.406 4.263 1.00 0.47 H new ATOM 1688 N PRO A 135 -7.177 -15.535 3.654 1.00 0.68 N ATOM 1689 CA PRO A 135 -7.755 -16.375 2.610 1.00 0.76 C ATOM 1690 C PRO A 135 -7.611 -15.724 1.224 1.00 0.73 C ATOM 1691 O PRO A 135 -7.306 -14.534 1.084 1.00 0.64 O ATOM 1692 CB PRO A 135 -9.225 -16.543 2.992 1.00 0.82 C ATOM 1693 CG PRO A 135 -9.549 -15.205 3.658 1.00 0.78 C ATOM 1694 CD PRO A 135 -8.236 -14.804 4.339 1.00 0.70 C ATOM 0 HA PRO A 135 -7.245 -17.336 2.541 1.00 0.76 H new ATOM 0 HB2 PRO A 135 -9.853 -16.725 2.120 1.00 0.82 H new ATOM 0 HB3 PRO A 135 -9.374 -17.382 3.672 1.00 0.82 H new ATOM 0 HG2 PRO A 135 -9.863 -14.460 2.927 1.00 0.78 H new ATOM 0 HG3 PRO A 135 -10.359 -15.304 4.380 1.00 0.78 H new ATOM 0 HD2 PRO A 135 -8.074 -13.728 4.268 1.00 0.70 H new ATOM 0 HD3 PRO A 135 -8.257 -15.054 5.400 1.00 0.70 H new ATOM 1702 N ALA A 136 -7.894 -16.505 0.189 1.00 0.83 N ATOM 1703 CA ALA A 136 -7.774 -16.165 -1.215 1.00 0.85 C ATOM 1704 C ALA A 136 -8.905 -15.217 -1.639 1.00 0.86 C ATOM 1705 O ALA A 136 -9.987 -15.663 -2.036 1.00 1.02 O ATOM 1706 CB ALA A 136 -7.804 -17.495 -1.973 1.00 0.97 C ATOM 0 H ALA A 136 -8.236 -17.457 0.322 1.00 0.83 H new ATOM 0 HA ALA A 136 -6.850 -15.630 -1.432 1.00 0.85 H new ATOM 0 HB1 ALA A 136 -7.717 -17.306 -3.043 1.00 0.97 H new ATOM 0 HB2 ALA A 136 -6.972 -18.119 -1.646 1.00 0.97 H new ATOM 0 HB3 ALA A 136 -8.744 -18.008 -1.770 1.00 0.97 H new ATOM 1712 N ALA A 137 -8.663 -13.911 -1.528 1.00 0.77 N ATOM 1713 CA ALA A 137 -9.615 -12.864 -1.878 1.00 0.77 C ATOM 1714 C ALA A 137 -8.905 -11.602 -2.419 1.00 0.69 C ATOM 1715 O ALA A 137 -7.671 -11.549 -2.487 1.00 0.65 O ATOM 1716 CB ALA A 137 -10.438 -12.548 -0.618 1.00 0.78 C ATOM 0 H ALA A 137 -7.776 -13.545 -1.183 1.00 0.77 H new ATOM 0 HA ALA A 137 -10.268 -13.207 -2.680 1.00 0.77 H new ATOM 0 HB1 ALA A 137 -11.163 -11.766 -0.844 1.00 0.78 H new ATOM 0 HB2 ALA A 137 -10.963 -13.446 -0.291 1.00 0.78 H new ATOM 0 HB3 ALA A 137 -9.773 -12.208 0.175 1.00 0.78 H new ATOM 1722 N LYS A 138 -9.684 -10.576 -2.789 1.00 0.70 N ATOM 1723 CA LYS A 138 -9.182 -9.220 -3.068 1.00 0.62 C ATOM 1724 C LYS A 138 -9.190 -8.369 -1.794 1.00 0.50 C ATOM 1725 O LYS A 138 -10.007 -8.558 -0.895 1.00 0.51 O ATOM 1726 CB LYS A 138 -9.993 -8.550 -4.183 1.00 0.73 C ATOM 1727 CG LYS A 138 -9.620 -9.074 -5.576 1.00 0.88 C ATOM 1728 CD LYS A 138 -10.654 -8.598 -6.604 1.00 1.06 C ATOM 1729 CE LYS A 138 -10.419 -7.163 -7.097 1.00 2.62 C ATOM 1730 NZ LYS A 138 -9.505 -7.127 -8.264 1.00 3.53 N ATOM 0 H LYS A 138 -10.694 -10.664 -2.905 1.00 0.70 H new ATOM 0 HA LYS A 138 -8.152 -9.304 -3.414 1.00 0.62 H new ATOM 0 HB2 LYS A 138 -11.055 -8.719 -4.007 1.00 0.73 H new ATOM 0 HB3 LYS A 138 -9.832 -7.473 -4.148 1.00 0.73 H new ATOM 0 HG2 LYS A 138 -8.627 -8.720 -5.854 1.00 0.88 H new ATOM 0 HG3 LYS A 138 -9.578 -10.163 -5.566 1.00 0.88 H new ATOM 0 HD2 LYS A 138 -10.640 -9.273 -7.459 1.00 1.06 H new ATOM 0 HD3 LYS A 138 -11.649 -8.663 -6.163 1.00 1.06 H new ATOM 0 HE2 LYS A 138 -11.373 -6.710 -7.368 1.00 2.62 H new ATOM 0 HE3 LYS A 138 -10.000 -6.564 -6.288 1.00 2.62 H new ATOM 0 HZ1 LYS A 138 -9.370 -6.142 -8.569 1.00 3.53 H new ATOM 0 HZ2 LYS A 138 -8.587 -7.536 -7.998 1.00 3.53 H new ATOM 0 HZ3 LYS A 138 -9.917 -7.678 -9.044 1.00 3.53 H new ATOM 1744 N TYR A 139 -8.291 -7.397 -1.751 1.00 0.45 N ATOM 1745 CA TYR A 139 -7.999 -6.540 -0.598 1.00 0.35 C ATOM 1746 C TYR A 139 -7.703 -5.118 -1.082 1.00 0.35 C ATOM 1747 O TYR A 139 -7.706 -4.857 -2.286 1.00 0.49 O ATOM 1748 CB TYR A 139 -6.809 -7.119 0.189 1.00 0.33 C ATOM 1749 CG TYR A 139 -7.058 -8.488 0.780 1.00 0.36 C ATOM 1750 CD1 TYR A 139 -6.761 -9.644 0.032 1.00 0.42 C ATOM 1751 CD2 TYR A 139 -7.618 -8.600 2.065 1.00 0.39 C ATOM 1752 CE1 TYR A 139 -7.055 -10.917 0.559 1.00 0.47 C ATOM 1753 CE2 TYR A 139 -7.907 -9.874 2.590 1.00 0.44 C ATOM 1754 CZ TYR A 139 -7.642 -11.026 1.834 1.00 0.46 C ATOM 1755 OH TYR A 139 -7.979 -12.233 2.346 1.00 0.53 O ATOM 0 H TYR A 139 -7.712 -7.168 -2.559 1.00 0.45 H new ATOM 0 HA TYR A 139 -8.862 -6.504 0.067 1.00 0.35 H new ATOM 0 HB2 TYR A 139 -5.944 -7.174 -0.472 1.00 0.33 H new ATOM 0 HB3 TYR A 139 -6.552 -6.430 0.994 1.00 0.33 H new ATOM 0 HD1 TYR A 139 -6.308 -9.555 -0.944 1.00 0.42 H new ATOM 0 HD2 TYR A 139 -7.825 -7.714 2.646 1.00 0.39 H new ATOM 0 HE1 TYR A 139 -6.831 -11.806 -0.013 1.00 0.47 H new ATOM 0 HE2 TYR A 139 -8.334 -9.965 3.578 1.00 0.44 H new ATOM 0 HH TYR A 139 -7.667 -12.942 1.745 1.00 0.53 H new ATOM 1765 N LYS A 140 -7.478 -4.187 -0.154 1.00 0.31 N ATOM 1766 CA LYS A 140 -7.086 -2.799 -0.457 1.00 0.33 C ATOM 1767 C LYS A 140 -6.138 -2.200 0.583 1.00 0.32 C ATOM 1768 O LYS A 140 -6.180 -2.603 1.743 1.00 0.36 O ATOM 1769 CB LYS A 140 -8.351 -1.931 -0.605 1.00 0.39 C ATOM 1770 CG LYS A 140 -8.841 -1.767 -2.050 1.00 0.78 C ATOM 1771 CD LYS A 140 -10.361 -1.572 -2.120 1.00 0.49 C ATOM 1772 CE LYS A 140 -11.069 -2.578 -3.043 1.00 0.82 C ATOM 1773 NZ LYS A 140 -10.619 -3.985 -2.916 1.00 3.26 N ATOM 0 H LYS A 140 -7.563 -4.373 0.845 1.00 0.31 H new ATOM 0 HA LYS A 140 -6.531 -2.814 -1.395 1.00 0.33 H new ATOM 0 HB2 LYS A 140 -9.151 -2.372 -0.011 1.00 0.39 H new ATOM 0 HB3 LYS A 140 -8.151 -0.944 -0.188 1.00 0.39 H new ATOM 0 HG2 LYS A 140 -8.344 -0.911 -2.507 1.00 0.78 H new ATOM 0 HG3 LYS A 140 -8.561 -2.646 -2.630 1.00 0.78 H new ATOM 0 HD2 LYS A 140 -10.777 -1.658 -1.116 1.00 0.49 H new ATOM 0 HD3 LYS A 140 -10.574 -0.561 -2.467 1.00 0.49 H new ATOM 0 HE2 LYS A 140 -12.140 -2.538 -2.843 1.00 0.82 H new ATOM 0 HE3 LYS A 140 -10.926 -2.261 -4.076 1.00 0.82 H new ATOM 0 HZ1 LYS A 140 -11.356 -4.620 -3.285 1.00 3.26 H new ATOM 0 HZ2 LYS A 140 -9.742 -4.120 -3.459 1.00 3.26 H new ATOM 0 HZ3 LYS A 140 -10.443 -4.204 -1.915 1.00 3.26 H new ATOM 1787 N ILE A 141 -5.345 -1.194 0.206 1.00 0.36 N ATOM 1788 CA ILE A 141 -4.492 -0.416 1.132 1.00 0.36 C ATOM 1789 C ILE A 141 -4.845 1.077 1.067 1.00 0.38 C ATOM 1790 O ILE A 141 -4.986 1.634 -0.022 1.00 0.45 O ATOM 1791 CB ILE A 141 -2.983 -0.676 0.890 1.00 0.38 C ATOM 1792 CG1 ILE A 141 -2.593 -2.155 1.121 1.00 0.44 C ATOM 1793 CG2 ILE A 141 -2.090 0.167 1.815 1.00 0.38 C ATOM 1794 CD1 ILE A 141 -2.575 -2.957 -0.175 1.00 0.46 C ATOM 0 H ILE A 141 -5.270 -0.886 -0.764 1.00 0.36 H new ATOM 0 HA ILE A 141 -4.698 -0.759 2.146 1.00 0.36 H new ATOM 0 HB ILE A 141 -2.822 -0.400 -0.152 1.00 0.38 H new ATOM 0 HG12 ILE A 141 -1.609 -2.200 1.588 1.00 0.44 H new ATOM 0 HG13 ILE A 141 -3.297 -2.610 1.818 1.00 0.44 H new ATOM 0 HG21 ILE A 141 -1.042 -0.051 1.607 1.00 0.38 H new ATOM 0 HG22 ILE A 141 -2.282 1.226 1.640 1.00 0.38 H new ATOM 0 HG23 ILE A 141 -2.311 -0.075 2.854 1.00 0.38 H new ATOM 0 HD11 ILE A 141 -2.296 -3.989 0.039 1.00 0.46 H new ATOM 0 HD12 ILE A 141 -3.565 -2.936 -0.630 1.00 0.46 H new ATOM 0 HD13 ILE A 141 -1.851 -2.521 -0.863 1.00 0.46 H new ATOM 1806 N TYR A 142 -4.968 1.714 2.236 1.00 0.36 N ATOM 1807 CA TYR A 142 -5.361 3.119 2.428 1.00 0.36 C ATOM 1808 C TYR A 142 -4.281 3.897 3.200 1.00 0.40 C ATOM 1809 O TYR A 142 -3.785 3.407 4.211 1.00 0.45 O ATOM 1810 CB TYR A 142 -6.706 3.163 3.171 1.00 0.36 C ATOM 1811 CG TYR A 142 -7.927 2.941 2.303 1.00 0.36 C ATOM 1812 CD1 TYR A 142 -8.268 1.648 1.849 1.00 1.64 C ATOM 1813 CD2 TYR A 142 -8.759 4.034 1.996 1.00 1.91 C ATOM 1814 CE1 TYR A 142 -9.444 1.442 1.108 1.00 1.67 C ATOM 1815 CE2 TYR A 142 -9.943 3.823 1.271 1.00 1.91 C ATOM 1816 CZ TYR A 142 -10.289 2.532 0.827 1.00 0.45 C ATOM 1817 OH TYR A 142 -11.446 2.338 0.150 1.00 0.58 O ATOM 0 H TYR A 142 -4.787 1.241 3.122 1.00 0.36 H new ATOM 0 HA TYR A 142 -5.468 3.598 1.455 1.00 0.36 H new ATOM 0 HB2 TYR A 142 -6.695 2.407 3.956 1.00 0.36 H new ATOM 0 HB3 TYR A 142 -6.800 4.131 3.663 1.00 0.36 H new ATOM 0 HD1 TYR A 142 -7.621 0.813 2.073 1.00 1.64 H new ATOM 0 HD2 TYR A 142 -8.488 5.029 2.316 1.00 1.91 H new ATOM 0 HE1 TYR A 142 -9.698 0.453 0.756 1.00 1.67 H new ATOM 0 HE2 TYR A 142 -10.593 4.657 1.052 1.00 1.91 H new ATOM 0 HH TYR A 142 -12.193 2.708 0.666 1.00 0.58 H new ATOM 1827 N GLU A 143 -3.928 5.113 2.759 1.00 0.46 N ATOM 1828 CA GLU A 143 -2.928 5.970 3.425 1.00 0.58 C ATOM 1829 C GLU A 143 -3.581 6.823 4.525 1.00 0.64 C ATOM 1830 O GLU A 143 -4.328 7.762 4.240 1.00 0.87 O ATOM 1831 CB GLU A 143 -2.179 6.834 2.392 1.00 0.82 C ATOM 1832 CG GLU A 143 -1.029 7.626 3.034 1.00 1.12 C ATOM 1833 CD GLU A 143 -0.269 8.499 2.026 1.00 1.35 C ATOM 1834 OE1 GLU A 143 0.372 7.953 1.105 1.00 1.37 O ATOM 1835 OE2 GLU A 143 -0.238 9.749 2.168 1.00 2.77 O ATOM 0 H GLU A 143 -4.330 5.536 1.923 1.00 0.46 H new ATOM 0 HA GLU A 143 -2.191 5.330 3.911 1.00 0.58 H new ATOM 0 HB2 GLU A 143 -1.783 6.195 1.603 1.00 0.82 H new ATOM 0 HB3 GLU A 143 -2.878 7.526 1.922 1.00 0.82 H new ATOM 0 HG2 GLU A 143 -1.428 8.259 3.826 1.00 1.12 H new ATOM 0 HG3 GLU A 143 -0.333 6.930 3.502 1.00 1.12 H new ATOM 1842 N ILE A 144 -3.285 6.512 5.791 1.00 0.66 N ATOM 1843 CA ILE A 144 -3.859 7.196 6.958 1.00 0.73 C ATOM 1844 C ILE A 144 -2.731 7.892 7.725 1.00 0.86 C ATOM 1845 O ILE A 144 -2.108 7.325 8.620 1.00 1.05 O ATOM 1846 CB ILE A 144 -4.668 6.213 7.837 1.00 0.70 C ATOM 1847 CG1 ILE A 144 -5.683 5.340 7.062 1.00 0.61 C ATOM 1848 CG2 ILE A 144 -5.387 6.998 8.948 1.00 0.79 C ATOM 1849 CD1 ILE A 144 -6.813 6.091 6.352 1.00 0.60 C ATOM 0 H ILE A 144 -2.632 5.769 6.039 1.00 0.66 H new ATOM 0 HA ILE A 144 -4.570 7.956 6.635 1.00 0.73 H new ATOM 0 HB ILE A 144 -3.945 5.513 8.255 1.00 0.70 H new ATOM 0 HG12 ILE A 144 -5.138 4.758 6.319 1.00 0.61 H new ATOM 0 HG13 ILE A 144 -6.128 4.630 7.759 1.00 0.61 H new ATOM 0 HG21 ILE A 144 -5.958 6.308 9.569 1.00 0.79 H new ATOM 0 HG22 ILE A 144 -4.651 7.516 9.563 1.00 0.79 H new ATOM 0 HG23 ILE A 144 -6.062 7.727 8.500 1.00 0.79 H new ATOM 0 HD11 ILE A 144 -7.461 5.377 5.843 1.00 0.60 H new ATOM 0 HD12 ILE A 144 -7.394 6.651 7.085 1.00 0.60 H new ATOM 0 HD13 ILE A 144 -6.389 6.780 5.622 1.00 0.60 H new ATOM 1861 N HIS A 145 -2.495 9.160 7.391 1.00 0.88 N ATOM 1862 CA HIS A 145 -1.383 9.965 7.913 1.00 1.01 C ATOM 1863 C HIS A 145 -1.668 10.606 9.288 1.00 0.97 C ATOM 1864 O HIS A 145 -0.820 11.324 9.823 1.00 1.20 O ATOM 1865 CB HIS A 145 -0.940 10.977 6.836 1.00 1.22 C ATOM 1866 CG HIS A 145 -2.041 11.574 5.992 1.00 2.00 C ATOM 1867 ND1 HIS A 145 -2.889 12.600 6.338 1.00 3.34 N ATOM 1868 CD2 HIS A 145 -2.374 11.190 4.721 1.00 3.02 C ATOM 1869 CE1 HIS A 145 -3.727 12.818 5.314 1.00 4.79 C ATOM 1870 NE2 HIS A 145 -3.458 11.971 4.304 1.00 4.66 N ATOM 0 H HIS A 145 -3.084 9.672 6.734 1.00 0.88 H new ATOM 0 HA HIS A 145 -0.547 9.297 8.121 1.00 1.01 H new ATOM 0 HB2 HIS A 145 -0.406 11.790 7.328 1.00 1.22 H new ATOM 0 HB3 HIS A 145 -0.229 10.484 6.173 1.00 1.22 H new ATOM 0 HD2 HIS A 145 -1.886 10.420 4.142 1.00 3.02 H new ATOM 0 HE1 HIS A 145 -4.506 13.566 5.302 1.00 4.79 H new ATOM 0 HE2 HIS A 145 -3.947 11.910 3.411 1.00 4.66 H new ATOM 1878 N SER A 146 -2.839 10.339 9.881 1.00 0.89 N ATOM 1879 CA SER A 146 -3.315 10.954 11.126 1.00 1.02 C ATOM 1880 C SER A 146 -2.580 10.504 12.397 1.00 1.28 C ATOM 1881 O SER A 146 -2.611 11.238 13.388 1.00 1.55 O ATOM 1882 CB SER A 146 -4.825 10.738 11.263 1.00 1.18 C ATOM 1883 OG SER A 146 -5.148 9.364 11.240 1.00 1.83 O ATOM 0 H SER A 146 -3.502 9.667 9.495 1.00 0.89 H new ATOM 0 HA SER A 146 -3.087 12.016 11.040 1.00 1.02 H new ATOM 0 HB2 SER A 146 -5.175 11.181 12.195 1.00 1.18 H new ATOM 0 HB3 SER A 146 -5.343 11.250 10.452 1.00 1.18 H new ATOM 0 HG SER A 146 -6.118 9.254 11.331 1.00 1.83 H new ATOM 2086 N LYS A 162 -2.623 13.997 -2.361 1.00 1.19 N ATOM 2087 CA LYS A 162 -3.441 12.806 -2.070 1.00 1.13 C ATOM 2088 C LYS A 162 -3.044 11.545 -2.852 1.00 0.92 C ATOM 2089 O LYS A 162 -3.209 11.459 -4.073 1.00 1.11 O ATOM 2090 CB LYS A 162 -4.937 13.168 -2.199 1.00 1.35 C ATOM 2091 CG LYS A 162 -5.898 12.055 -1.728 1.00 1.91 C ATOM 2092 CD LYS A 162 -6.430 11.187 -2.881 1.00 1.77 C ATOM 2093 CE LYS A 162 -7.175 9.943 -2.386 1.00 2.50 C ATOM 2094 NZ LYS A 162 -8.560 10.222 -1.949 1.00 2.78 N ATOM 0 HA LYS A 162 -3.239 12.517 -1.039 1.00 1.13 H new ATOM 0 HB2 LYS A 162 -5.132 14.071 -1.620 1.00 1.35 H new ATOM 0 HB3 LYS A 162 -5.154 13.404 -3.241 1.00 1.35 H new ATOM 0 HG2 LYS A 162 -5.382 11.418 -1.010 1.00 1.91 H new ATOM 0 HG3 LYS A 162 -6.740 12.508 -1.204 1.00 1.91 H new ATOM 0 HD2 LYS A 162 -7.099 11.784 -3.502 1.00 1.77 H new ATOM 0 HD3 LYS A 162 -5.597 10.880 -3.514 1.00 1.77 H new ATOM 0 HE2 LYS A 162 -7.196 9.200 -3.183 1.00 2.50 H new ATOM 0 HE3 LYS A 162 -6.622 9.504 -1.556 1.00 2.50 H new ATOM 0 HZ1 LYS A 162 -9.109 9.339 -1.951 1.00 2.78 H new ATOM 0 HZ2 LYS A 162 -8.547 10.619 -0.988 1.00 2.78 H new ATOM 0 HZ3 LYS A 162 -8.999 10.904 -2.600 1.00 2.78 H new ATOM 2108 N ALA A 163 -2.593 10.538 -2.106 1.00 0.78 N ATOM 2109 CA ALA A 163 -2.381 9.163 -2.556 1.00 0.68 C ATOM 2110 C ALA A 163 -3.732 8.466 -2.784 1.00 0.64 C ATOM 2111 O ALA A 163 -4.619 8.596 -1.946 1.00 0.86 O ATOM 2112 CB ALA A 163 -1.605 8.437 -1.452 1.00 0.82 C ATOM 0 H ALA A 163 -2.354 10.665 -1.123 1.00 0.78 H new ATOM 0 HA ALA A 163 -1.829 9.149 -3.495 1.00 0.68 H new ATOM 0 HB1 ALA A 163 -1.427 7.404 -1.751 1.00 0.82 H new ATOM 0 HB2 ALA A 163 -0.651 8.937 -1.289 1.00 0.82 H new ATOM 0 HB3 ALA A 163 -2.185 8.452 -0.529 1.00 0.82 H new ATOM 2118 N VAL A 164 -3.907 7.703 -3.866 1.00 0.55 N ATOM 2119 CA VAL A 164 -5.136 6.906 -4.084 1.00 0.49 C ATOM 2120 C VAL A 164 -5.016 5.484 -3.526 1.00 0.52 C ATOM 2121 O VAL A 164 -3.914 4.930 -3.498 1.00 0.59 O ATOM 2122 CB VAL A 164 -5.628 6.914 -5.544 1.00 0.56 C ATOM 2123 CG1 VAL A 164 -6.536 8.127 -5.746 1.00 0.65 C ATOM 2124 CG2 VAL A 164 -4.508 6.942 -6.584 1.00 0.66 C ATOM 0 H VAL A 164 -3.216 7.615 -4.611 1.00 0.55 H new ATOM 0 HA VAL A 164 -5.911 7.413 -3.509 1.00 0.49 H new ATOM 0 HB VAL A 164 -6.161 5.976 -5.701 1.00 0.56 H new ATOM 0 HG11 VAL A 164 -6.893 8.147 -6.776 1.00 0.65 H new ATOM 0 HG12 VAL A 164 -7.387 8.061 -5.068 1.00 0.65 H new ATOM 0 HG13 VAL A 164 -5.976 9.039 -5.538 1.00 0.65 H new ATOM 0 HG21 VAL A 164 -4.941 6.946 -7.584 1.00 0.66 H new ATOM 0 HG22 VAL A 164 -3.905 7.840 -6.446 1.00 0.66 H new ATOM 0 HG23 VAL A 164 -3.878 6.060 -6.464 1.00 0.66 H new ATOM 2134 N PRO A 165 -6.123 4.874 -3.060 1.00 0.54 N ATOM 2135 CA PRO A 165 -6.085 3.577 -2.390 1.00 0.61 C ATOM 2136 C PRO A 165 -5.807 2.448 -3.385 1.00 0.61 C ATOM 2137 O PRO A 165 -6.306 2.457 -4.516 1.00 0.70 O ATOM 2138 CB PRO A 165 -7.436 3.430 -1.689 1.00 0.67 C ATOM 2139 CG PRO A 165 -8.369 4.237 -2.589 1.00 0.61 C ATOM 2140 CD PRO A 165 -7.489 5.379 -3.099 1.00 0.56 C ATOM 0 HA PRO A 165 -5.274 3.516 -1.665 1.00 0.61 H new ATOM 0 HB2 PRO A 165 -7.744 2.387 -1.618 1.00 0.67 H new ATOM 0 HB3 PRO A 165 -7.411 3.825 -0.673 1.00 0.67 H new ATOM 0 HG2 PRO A 165 -8.755 3.632 -3.410 1.00 0.61 H new ATOM 0 HG3 PRO A 165 -9.231 4.612 -2.037 1.00 0.61 H new ATOM 0 HD2 PRO A 165 -7.771 5.668 -4.112 1.00 0.56 H new ATOM 0 HD3 PRO A 165 -7.597 6.265 -2.473 1.00 0.56 H new ATOM 2148 N ILE A 166 -4.993 1.481 -2.969 1.00 0.61 N ATOM 2149 CA ILE A 166 -4.470 0.425 -3.846 1.00 0.56 C ATOM 2150 C ILE A 166 -5.432 -0.763 -3.881 1.00 0.45 C ATOM 2151 O ILE A 166 -5.753 -1.297 -2.826 1.00 0.45 O ATOM 2152 CB ILE A 166 -3.069 -0.068 -3.410 1.00 0.60 C ATOM 2153 CG1 ILE A 166 -2.129 1.035 -2.870 1.00 0.92 C ATOM 2154 CG2 ILE A 166 -2.440 -0.788 -4.614 1.00 0.56 C ATOM 2155 CD1 ILE A 166 -0.802 0.484 -2.329 1.00 1.82 C ATOM 0 H ILE A 166 -4.672 1.404 -2.004 1.00 0.61 H new ATOM 0 HA ILE A 166 -4.377 0.862 -4.840 1.00 0.56 H new ATOM 0 HB ILE A 166 -3.202 -0.737 -2.560 1.00 0.60 H new ATOM 0 HG12 ILE A 166 -1.921 1.749 -3.667 1.00 0.92 H new ATOM 0 HG13 ILE A 166 -2.639 1.582 -2.077 1.00 0.92 H new ATOM 0 HG21 ILE A 166 -1.448 -1.151 -4.344 1.00 0.56 H new ATOM 0 HG22 ILE A 166 -3.068 -1.631 -4.903 1.00 0.56 H new ATOM 0 HG23 ILE A 166 -2.357 -0.094 -5.450 1.00 0.56 H new ATOM 0 HD11 ILE A 166 -0.187 1.307 -1.965 1.00 1.82 H new ATOM 0 HD12 ILE A 166 -1.002 -0.208 -1.511 1.00 1.82 H new ATOM 0 HD13 ILE A 166 -0.273 -0.039 -3.126 1.00 1.82 H new ATOM 2167 N GLU A 167 -5.838 -1.210 -5.066 1.00 0.61 N ATOM 2168 CA GLU A 167 -6.563 -2.471 -5.299 1.00 0.72 C ATOM 2169 C GLU A 167 -5.553 -3.626 -5.458 1.00 0.67 C ATOM 2170 O GLU A 167 -4.631 -3.518 -6.277 1.00 0.72 O ATOM 2171 CB GLU A 167 -7.427 -2.283 -6.560 1.00 1.11 C ATOM 2172 CG GLU A 167 -8.194 -3.511 -7.064 1.00 1.29 C ATOM 2173 CD GLU A 167 -9.401 -3.846 -6.190 1.00 2.28 C ATOM 2174 OE1 GLU A 167 -9.219 -4.468 -5.123 1.00 3.67 O ATOM 2175 OE2 GLU A 167 -10.551 -3.488 -6.550 1.00 3.01 O ATOM 0 H GLU A 167 -5.668 -0.690 -5.927 1.00 0.61 H new ATOM 0 HA GLU A 167 -7.208 -2.724 -4.458 1.00 0.72 H new ATOM 0 HB2 GLU A 167 -8.148 -1.490 -6.362 1.00 1.11 H new ATOM 0 HB3 GLU A 167 -6.781 -1.933 -7.365 1.00 1.11 H new ATOM 0 HG2 GLU A 167 -8.528 -3.332 -8.086 1.00 1.29 H new ATOM 0 HG3 GLU A 167 -7.522 -4.368 -7.094 1.00 1.29 H new ATOM 2182 N ILE A 168 -5.700 -4.728 -4.709 1.00 0.65 N ATOM 2183 CA ILE A 168 -4.722 -5.831 -4.687 1.00 0.64 C ATOM 2184 C ILE A 168 -5.382 -7.217 -4.542 1.00 0.64 C ATOM 2185 O ILE A 168 -6.397 -7.382 -3.868 1.00 0.58 O ATOM 2186 CB ILE A 168 -3.650 -5.557 -3.597 1.00 0.61 C ATOM 2187 CG1 ILE A 168 -2.422 -6.468 -3.801 1.00 0.65 C ATOM 2188 CG2 ILE A 168 -4.206 -5.703 -2.168 1.00 0.55 C ATOM 2189 CD1 ILE A 168 -1.244 -6.169 -2.864 1.00 0.57 C ATOM 0 H ILE A 168 -6.502 -4.882 -4.098 1.00 0.65 H new ATOM 0 HA ILE A 168 -4.224 -5.863 -5.656 1.00 0.64 H new ATOM 0 HB ILE A 168 -3.342 -4.517 -3.710 1.00 0.61 H new ATOM 0 HG12 ILE A 168 -2.727 -7.505 -3.660 1.00 0.65 H new ATOM 0 HG13 ILE A 168 -2.082 -6.373 -4.832 1.00 0.65 H new ATOM 0 HG21 ILE A 168 -3.414 -5.500 -1.447 1.00 0.55 H new ATOM 0 HG22 ILE A 168 -5.021 -4.994 -2.021 1.00 0.55 H new ATOM 0 HG23 ILE A 168 -4.577 -6.718 -2.024 1.00 0.55 H new ATOM 0 HD11 ILE A 168 -0.426 -6.857 -3.078 1.00 0.57 H new ATOM 0 HD12 ILE A 168 -0.907 -5.144 -3.019 1.00 0.57 H new ATOM 0 HD13 ILE A 168 -1.562 -6.294 -1.829 1.00 0.57 H new ATOM 2201 N GLU A 169 -4.765 -8.233 -5.146 1.00 0.74 N ATOM 2202 CA GLU A 169 -5.073 -9.656 -4.967 1.00 0.75 C ATOM 2203 C GLU A 169 -3.793 -10.412 -4.543 1.00 0.82 C ATOM 2204 O GLU A 169 -2.681 -10.019 -4.904 1.00 0.91 O ATOM 2205 CB GLU A 169 -5.692 -10.209 -6.264 1.00 0.80 C ATOM 2206 CG GLU A 169 -6.389 -11.563 -6.088 1.00 0.88 C ATOM 2207 CD GLU A 169 -6.780 -12.143 -7.456 1.00 1.10 C ATOM 2208 OE1 GLU A 169 -7.805 -11.714 -8.040 1.00 1.84 O ATOM 2209 OE2 GLU A 169 -6.053 -13.009 -8.004 1.00 2.06 O ATOM 0 H GLU A 169 -4.001 -8.081 -5.804 1.00 0.74 H new ATOM 0 HA GLU A 169 -5.806 -9.796 -4.172 1.00 0.75 H new ATOM 0 HB2 GLU A 169 -6.413 -9.487 -6.648 1.00 0.80 H new ATOM 0 HB3 GLU A 169 -4.909 -10.309 -7.016 1.00 0.80 H new ATOM 0 HG2 GLU A 169 -5.727 -12.255 -5.567 1.00 0.88 H new ATOM 0 HG3 GLU A 169 -7.278 -11.444 -5.468 1.00 0.88 H new ATOM 2216 N LEU A 170 -3.940 -11.486 -3.760 1.00 0.82 N ATOM 2217 CA LEU A 170 -2.827 -12.215 -3.126 1.00 0.86 C ATOM 2218 C LEU A 170 -1.865 -12.907 -4.124 1.00 0.83 C ATOM 2219 O LEU A 170 -2.230 -13.106 -5.293 1.00 0.99 O ATOM 2220 CB LEU A 170 -3.425 -13.223 -2.122 1.00 0.91 C ATOM 2221 CG LEU A 170 -4.071 -12.595 -0.874 1.00 1.05 C ATOM 2222 CD1 LEU A 170 -4.415 -13.709 0.111 1.00 1.19 C ATOM 2223 CD2 LEU A 170 -3.187 -11.595 -0.123 1.00 1.08 C ATOM 0 H LEU A 170 -4.854 -11.884 -3.542 1.00 0.82 H new ATOM 0 HA LEU A 170 -2.198 -11.486 -2.615 1.00 0.86 H new ATOM 0 HB2 LEU A 170 -4.175 -13.824 -2.637 1.00 0.91 H new ATOM 0 HB3 LEU A 170 -2.637 -13.904 -1.801 1.00 0.91 H new ATOM 0 HG LEU A 170 -4.940 -12.049 -1.240 1.00 1.05 H new ATOM 0 HD11 LEU A 170 -4.874 -13.279 1.001 1.00 1.19 H new ATOM 0 HD12 LEU A 170 -5.112 -14.405 -0.356 1.00 1.19 H new ATOM 0 HD13 LEU A 170 -3.505 -14.240 0.392 1.00 1.19 H new ATOM 0 HD21 LEU A 170 -3.728 -11.207 0.740 1.00 1.08 H new ATOM 0 HD22 LEU A 170 -2.278 -12.094 0.213 1.00 1.08 H new ATOM 0 HD23 LEU A 170 -2.924 -10.771 -0.787 1.00 1.08 H new ATOM 2235 N PRO A 171 -0.638 -13.279 -3.690 1.00 0.71 N ATOM 2236 CA PRO A 171 0.392 -13.808 -4.577 1.00 0.67 C ATOM 2237 C PRO A 171 0.124 -15.267 -4.957 1.00 0.66 C ATOM 2238 O PRO A 171 0.458 -16.200 -4.224 1.00 0.77 O ATOM 2239 CB PRO A 171 1.723 -13.623 -3.839 1.00 0.69 C ATOM 2240 CG PRO A 171 1.319 -13.706 -2.372 1.00 0.72 C ATOM 2241 CD PRO A 171 -0.060 -13.055 -2.366 1.00 0.74 C ATOM 0 HA PRO A 171 0.407 -13.277 -5.529 1.00 0.67 H new ATOM 0 HB2 PRO A 171 2.442 -14.398 -4.104 1.00 0.69 H new ATOM 0 HB3 PRO A 171 2.186 -12.665 -4.076 1.00 0.69 H new ATOM 0 HG2 PRO A 171 1.281 -14.737 -2.020 1.00 0.72 H new ATOM 0 HG3 PRO A 171 2.020 -13.175 -1.728 1.00 0.72 H new ATOM 0 HD2 PRO A 171 -0.690 -13.491 -1.590 1.00 0.74 H new ATOM 0 HD3 PRO A 171 0.017 -11.989 -2.153 1.00 0.74 H new ATOM 2249 N LEU A 172 -0.458 -15.450 -6.138 1.00 0.67 N ATOM 2250 CA LEU A 172 -0.599 -16.720 -6.843 1.00 0.71 C ATOM 2251 C LEU A 172 0.073 -16.489 -8.209 1.00 0.78 C ATOM 2252 O LEU A 172 -0.561 -16.447 -9.263 1.00 1.09 O ATOM 2253 CB LEU A 172 -2.086 -17.126 -6.861 1.00 0.83 C ATOM 2254 CG LEU A 172 -2.335 -18.637 -7.011 1.00 1.12 C ATOM 2255 CD1 LEU A 172 -3.842 -18.884 -7.017 1.00 2.16 C ATOM 2256 CD2 LEU A 172 -1.741 -19.237 -8.286 1.00 2.24 C ATOM 0 H LEU A 172 -0.867 -14.673 -6.658 1.00 0.67 H new ATOM 0 HA LEU A 172 -0.112 -17.575 -6.374 1.00 0.71 H new ATOM 0 HB2 LEU A 172 -2.554 -16.784 -5.938 1.00 0.83 H new ATOM 0 HB3 LEU A 172 -2.581 -16.606 -7.681 1.00 0.83 H new ATOM 0 HG LEU A 172 -1.839 -19.123 -6.171 1.00 1.12 H new ATOM 0 HD11 LEU A 172 -4.035 -19.951 -7.123 1.00 2.16 H new ATOM 0 HD12 LEU A 172 -4.273 -18.528 -6.081 1.00 2.16 H new ATOM 0 HD13 LEU A 172 -4.295 -18.349 -7.851 1.00 2.16 H new ATOM 0 HD21 LEU A 172 -1.958 -20.305 -8.321 1.00 2.24 H new ATOM 0 HD22 LEU A 172 -2.180 -18.749 -9.156 1.00 2.24 H new ATOM 0 HD23 LEU A 172 -0.662 -19.085 -8.291 1.00 2.24 H new ATOM 2268 N ASN A 173 1.373 -16.206 -8.136 1.00 0.90 N ATOM 2269 CA ASN A 173 2.227 -15.715 -9.217 1.00 1.04 C ATOM 2270 C ASN A 173 3.600 -16.402 -9.117 1.00 1.19 C ATOM 2271 O ASN A 173 4.019 -16.771 -8.019 1.00 1.99 O ATOM 2272 CB ASN A 173 2.411 -14.185 -9.073 1.00 1.19 C ATOM 2273 CG ASN A 173 1.143 -13.347 -9.056 1.00 1.59 C ATOM 2274 OD1 ASN A 173 0.366 -13.346 -8.109 1.00 3.33 O ATOM 2275 ND2 ASN A 173 0.938 -12.527 -10.052 1.00 1.24 N ATOM 0 H ASN A 173 1.891 -16.321 -7.265 1.00 0.90 H new ATOM 0 HA ASN A 173 1.768 -15.937 -10.181 1.00 1.04 H new ATOM 0 HB2 ASN A 173 2.959 -13.993 -8.151 1.00 1.19 H new ATOM 0 HB3 ASN A 173 3.038 -13.838 -9.894 1.00 1.19 H new ATOM 0 HD21 ASN A 173 0.138 -11.895 -10.036 1.00 1.24 H new ATOM 0 HD22 ASN A 173 1.578 -12.519 -10.846 1.00 1.24 H new ATOM 2282 N ASP A 174 4.356 -16.481 -10.213 1.00 1.12 N ATOM 2283 CA ASP A 174 5.684 -17.119 -10.279 1.00 1.27 C ATOM 2284 C ASP A 174 6.827 -16.379 -9.549 1.00 1.20 C ATOM 2285 O ASP A 174 8.011 -16.624 -9.813 1.00 1.45 O ATOM 2286 CB ASP A 174 6.054 -17.388 -11.743 1.00 1.54 C ATOM 2287 CG ASP A 174 6.309 -16.136 -12.593 1.00 2.57 C ATOM 2288 OD1 ASP A 174 5.469 -15.203 -12.600 1.00 3.92 O ATOM 2289 OD2 ASP A 174 7.351 -16.099 -13.299 1.00 3.31 O ATOM 0 H ASP A 174 4.058 -16.094 -11.108 1.00 1.12 H new ATOM 0 HA ASP A 174 5.582 -18.052 -9.725 1.00 1.27 H new ATOM 0 HB2 ASP A 174 6.948 -18.012 -11.767 1.00 1.54 H new ATOM 0 HB3 ASP A 174 5.251 -17.963 -12.204 1.00 1.54 H new ATOM 2294 N VAL A 175 6.492 -15.462 -8.644 1.00 1.00 N ATOM 2295 CA VAL A 175 7.430 -14.519 -8.039 1.00 0.93 C ATOM 2296 C VAL A 175 7.962 -14.994 -6.691 1.00 0.97 C ATOM 2297 O VAL A 175 7.245 -15.620 -5.910 1.00 1.07 O ATOM 2298 CB VAL A 175 6.882 -13.085 -8.004 1.00 0.86 C ATOM 2299 CG1 VAL A 175 6.372 -12.685 -9.391 1.00 1.11 C ATOM 2300 CG2 VAL A 175 5.756 -12.880 -6.996 1.00 0.68 C ATOM 0 H VAL A 175 5.537 -15.351 -8.303 1.00 1.00 H new ATOM 0 HA VAL A 175 8.298 -14.488 -8.697 1.00 0.93 H new ATOM 0 HB VAL A 175 7.716 -12.457 -7.691 1.00 0.86 H new ATOM 0 HG11 VAL A 175 5.985 -11.667 -9.357 1.00 1.11 H new ATOM 0 HG12 VAL A 175 7.190 -12.738 -10.109 1.00 1.11 H new ATOM 0 HG13 VAL A 175 5.577 -13.365 -9.696 1.00 1.11 H new ATOM 0 HG21 VAL A 175 5.422 -11.843 -7.030 1.00 0.68 H new ATOM 0 HG22 VAL A 175 4.923 -13.538 -7.242 1.00 0.68 H new ATOM 0 HG23 VAL A 175 6.118 -13.112 -5.994 1.00 0.68 H new ATOM 2310 N VAL A 176 9.229 -14.698 -6.402 1.00 1.00 N ATOM 2311 CA VAL A 176 9.861 -15.056 -5.120 1.00 1.05 C ATOM 2312 C VAL A 176 9.347 -14.155 -3.991 1.00 0.87 C ATOM 2313 O VAL A 176 9.134 -14.622 -2.870 1.00 0.91 O ATOM 2314 CB VAL A 176 11.399 -14.987 -5.240 1.00 1.25 C ATOM 2315 CG1 VAL A 176 12.103 -15.408 -3.946 1.00 1.61 C ATOM 2316 CG2 VAL A 176 11.894 -15.908 -6.365 1.00 1.54 C ATOM 0 H VAL A 176 9.850 -14.205 -7.044 1.00 1.00 H new ATOM 0 HA VAL A 176 9.589 -16.082 -4.872 1.00 1.05 H new ATOM 0 HB VAL A 176 11.642 -13.946 -5.455 1.00 1.25 H new ATOM 0 HG11 VAL A 176 13.183 -15.342 -4.081 1.00 1.61 H new ATOM 0 HG12 VAL A 176 11.798 -14.747 -3.134 1.00 1.61 H new ATOM 0 HG13 VAL A 176 11.830 -16.434 -3.700 1.00 1.61 H new ATOM 0 HG21 VAL A 176 12.980 -15.846 -6.435 1.00 1.54 H new ATOM 0 HG22 VAL A 176 11.602 -16.936 -6.149 1.00 1.54 H new ATOM 0 HG23 VAL A 176 11.452 -15.597 -7.311 1.00 1.54 H new ATOM 2326 N ASP A 177 9.109 -12.878 -4.294 1.00 0.75 N ATOM 2327 CA ASP A 177 8.798 -11.824 -3.325 1.00 0.78 C ATOM 2328 C ASP A 177 7.705 -10.879 -3.875 1.00 0.59 C ATOM 2329 O ASP A 177 7.811 -10.437 -5.023 1.00 0.60 O ATOM 2330 CB ASP A 177 10.121 -11.089 -3.017 1.00 1.01 C ATOM 2331 CG ASP A 177 10.287 -10.671 -1.559 1.00 1.55 C ATOM 2332 OD1 ASP A 177 9.307 -10.193 -0.939 1.00 2.47 O ATOM 2333 OD2 ASP A 177 11.417 -10.802 -1.028 1.00 2.61 O ATOM 0 H ASP A 177 9.128 -12.536 -5.255 1.00 0.75 H new ATOM 0 HA ASP A 177 8.390 -12.239 -2.403 1.00 0.78 H new ATOM 0 HB2 ASP A 177 10.954 -11.735 -3.294 1.00 1.01 H new ATOM 0 HB3 ASP A 177 10.184 -10.201 -3.646 1.00 1.01 H new ATOM 2338 N ALA A 178 6.653 -10.576 -3.098 1.00 0.48 N ATOM 2339 CA ALA A 178 5.511 -9.757 -3.541 1.00 0.38 C ATOM 2340 C ALA A 178 5.645 -8.288 -3.116 1.00 0.34 C ATOM 2341 O ALA A 178 6.051 -8.025 -1.977 1.00 0.38 O ATOM 2342 CB ALA A 178 4.213 -10.340 -2.973 1.00 0.45 C ATOM 0 H ALA A 178 6.570 -10.896 -2.133 1.00 0.48 H new ATOM 0 HA ALA A 178 5.494 -9.781 -4.631 1.00 0.38 H new ATOM 0 HB1 ALA A 178 3.368 -9.734 -3.301 1.00 0.45 H new ATOM 0 HB2 ALA A 178 4.087 -11.362 -3.330 1.00 0.45 H new ATOM 0 HB3 ALA A 178 4.260 -10.339 -1.884 1.00 0.45 H new ATOM 2348 N HIS A 179 5.253 -7.339 -3.980 1.00 0.32 N ATOM 2349 CA HIS A 179 5.336 -5.902 -3.668 1.00 0.34 C ATOM 2350 C HIS A 179 4.106 -5.070 -4.084 1.00 0.33 C ATOM 2351 O HIS A 179 3.262 -5.518 -4.869 1.00 0.37 O ATOM 2352 CB HIS A 179 6.613 -5.273 -4.262 1.00 0.40 C ATOM 2353 CG HIS A 179 7.905 -5.974 -3.927 1.00 0.44 C ATOM 2354 ND1 HIS A 179 8.912 -5.467 -3.144 1.00 0.52 N ATOM 2355 CD2 HIS A 179 8.318 -7.203 -4.364 1.00 0.46 C ATOM 2356 CE1 HIS A 179 9.894 -6.379 -3.081 1.00 0.58 C ATOM 2357 NE2 HIS A 179 9.580 -7.465 -3.813 1.00 0.53 N ATOM 0 H HIS A 179 4.873 -7.542 -4.905 1.00 0.32 H new ATOM 0 HA HIS A 179 5.369 -5.866 -2.579 1.00 0.34 H new ATOM 0 HB2 HIS A 179 6.509 -5.241 -5.347 1.00 0.40 H new ATOM 0 HB3 HIS A 179 6.681 -4.241 -3.918 1.00 0.40 H new ATOM 0 HD1 HIS A 179 8.913 -4.554 -2.689 1.00 0.52 H new ATOM 0 HD2 HIS A 179 7.766 -7.859 -5.021 1.00 0.46 H new ATOM 0 HE1 HIS A 179 10.810 -6.259 -2.521 1.00 0.58 H new ATOM 2365 N VAL A 180 4.040 -3.835 -3.563 1.00 0.33 N ATOM 2366 CA VAL A 180 3.010 -2.819 -3.838 1.00 0.35 C ATOM 2367 C VAL A 180 3.588 -1.410 -4.029 1.00 0.41 C ATOM 2368 O VAL A 180 4.397 -0.965 -3.216 1.00 0.51 O ATOM 2369 CB VAL A 180 1.955 -2.711 -2.714 1.00 0.42 C ATOM 2370 CG1 VAL A 180 0.595 -2.610 -3.371 1.00 0.62 C ATOM 2371 CG2 VAL A 180 1.891 -3.817 -1.663 1.00 0.39 C ATOM 0 H VAL A 180 4.741 -3.499 -2.903 1.00 0.33 H new ATOM 0 HA VAL A 180 2.550 -3.168 -4.762 1.00 0.35 H new ATOM 0 HB VAL A 180 2.265 -1.835 -2.144 1.00 0.42 H new ATOM 0 HG11 VAL A 180 -0.175 -2.532 -2.603 1.00 0.62 H new ATOM 0 HG12 VAL A 180 0.563 -1.726 -4.008 1.00 0.62 H new ATOM 0 HG13 VAL A 180 0.416 -3.499 -3.976 1.00 0.62 H new ATOM 0 HG21 VAL A 180 1.100 -3.593 -0.947 1.00 0.39 H new ATOM 0 HG22 VAL A 180 1.681 -4.770 -2.149 1.00 0.39 H new ATOM 0 HG23 VAL A 180 2.846 -3.879 -1.141 1.00 0.39 H new ATOM 2381 N TYR A 181 3.092 -0.670 -5.024 1.00 0.43 N ATOM 2382 CA TYR A 181 3.550 0.677 -5.397 1.00 0.47 C ATOM 2383 C TYR A 181 2.363 1.660 -5.551 1.00 0.55 C ATOM 2384 O TYR A 181 1.820 1.775 -6.652 1.00 0.72 O ATOM 2385 CB TYR A 181 4.377 0.561 -6.688 1.00 0.51 C ATOM 2386 CG TYR A 181 5.647 -0.248 -6.501 1.00 0.54 C ATOM 2387 CD1 TYR A 181 6.783 0.365 -5.938 1.00 1.58 C ATOM 2388 CD2 TYR A 181 5.679 -1.614 -6.841 1.00 1.82 C ATOM 2389 CE1 TYR A 181 7.956 -0.383 -5.719 1.00 1.59 C ATOM 2390 CE2 TYR A 181 6.832 -2.375 -6.583 1.00 1.89 C ATOM 2391 CZ TYR A 181 7.971 -1.758 -6.030 1.00 0.74 C ATOM 2392 OH TYR A 181 9.095 -2.497 -5.875 1.00 0.90 O ATOM 0 H TYR A 181 2.331 -1.003 -5.616 1.00 0.43 H new ATOM 0 HA TYR A 181 4.174 1.089 -4.604 1.00 0.47 H new ATOM 0 HB2 TYR A 181 3.768 0.098 -7.464 1.00 0.51 H new ATOM 0 HB3 TYR A 181 4.636 1.560 -7.039 1.00 0.51 H new ATOM 0 HD1 TYR A 181 6.755 1.412 -5.673 1.00 1.58 H new ATOM 0 HD2 TYR A 181 4.818 -2.077 -7.300 1.00 1.82 H new ATOM 0 HE1 TYR A 181 8.838 0.093 -5.316 1.00 1.59 H new ATOM 0 HE2 TYR A 181 6.845 -3.431 -6.808 1.00 1.89 H new ATOM 0 HH TYR A 181 9.632 -2.126 -5.144 1.00 0.90 H new ATOM 2402 N PRO A 182 1.939 2.364 -4.479 1.00 0.51 N ATOM 2403 CA PRO A 182 0.890 3.390 -4.529 1.00 0.58 C ATOM 2404 C PRO A 182 1.323 4.646 -5.293 1.00 0.72 C ATOM 2405 O PRO A 182 2.511 4.983 -5.326 1.00 0.89 O ATOM 2406 CB PRO A 182 0.577 3.760 -3.076 1.00 0.61 C ATOM 2407 CG PRO A 182 1.866 3.417 -2.334 1.00 0.81 C ATOM 2408 CD PRO A 182 2.461 2.253 -3.129 1.00 0.59 C ATOM 0 HA PRO A 182 0.023 2.994 -5.058 1.00 0.58 H new ATOM 0 HB2 PRO A 182 0.326 4.816 -2.976 1.00 0.61 H new ATOM 0 HB3 PRO A 182 -0.270 3.193 -2.691 1.00 0.61 H new ATOM 0 HG2 PRO A 182 2.547 4.268 -2.305 1.00 0.81 H new ATOM 0 HG3 PRO A 182 1.667 3.132 -1.301 1.00 0.81 H new ATOM 0 HD2 PRO A 182 3.550 2.300 -3.129 1.00 0.59 H new ATOM 0 HD3 PRO A 182 2.184 1.298 -2.684 1.00 0.59 H new ATOM 2416 N LYS A 183 0.339 5.373 -5.843 1.00 0.75 N ATOM 2417 CA LYS A 183 0.529 6.615 -6.614 1.00 0.81 C ATOM 2418 C LYS A 183 -0.433 7.737 -6.183 1.00 0.84 C ATOM 2419 O LYS A 183 -1.430 7.519 -5.495 1.00 1.13 O ATOM 2420 CB LYS A 183 0.463 6.301 -8.126 1.00 0.83 C ATOM 2421 CG LYS A 183 1.595 5.339 -8.545 1.00 0.71 C ATOM 2422 CD LYS A 183 1.726 5.100 -10.057 1.00 1.32 C ATOM 2423 CE LYS A 183 0.492 4.503 -10.746 1.00 1.45 C ATOM 2424 NZ LYS A 183 0.021 3.232 -10.154 1.00 1.37 N ATOM 0 H LYS A 183 -0.642 5.106 -5.762 1.00 0.75 H new ATOM 0 HA LYS A 183 1.521 7.010 -6.396 1.00 0.81 H new ATOM 0 HB2 LYS A 183 -0.503 5.857 -8.366 1.00 0.83 H new ATOM 0 HB3 LYS A 183 0.539 7.227 -8.696 1.00 0.83 H new ATOM 0 HG2 LYS A 183 2.541 5.733 -8.173 1.00 0.71 H new ATOM 0 HG3 LYS A 183 1.434 4.379 -8.054 1.00 0.71 H new ATOM 0 HD2 LYS A 183 1.964 6.049 -10.537 1.00 1.32 H new ATOM 0 HD3 LYS A 183 2.573 4.435 -10.229 1.00 1.32 H new ATOM 0 HE2 LYS A 183 -0.319 5.231 -10.708 1.00 1.45 H new ATOM 0 HE3 LYS A 183 0.722 4.337 -11.798 1.00 1.45 H new ATOM 0 HZ1 LYS A 183 -0.814 2.895 -10.675 1.00 1.37 H new ATOM 0 HZ2 LYS A 183 0.777 2.520 -10.213 1.00 1.37 H new ATOM 0 HZ3 LYS A 183 -0.232 3.386 -9.157 1.00 1.37 H new ATOM 2438 N ASN A 184 -0.093 8.962 -6.575 0.49 0.67 N ATOM 2439 CA ASN A 184 -0.794 10.221 -6.291 0.49 0.62 C ATOM 2440 C ASN A 184 -1.639 10.652 -7.511 0.49 0.67 C ATOM 2441 O ASN A 184 -1.241 10.382 -8.646 0.49 0.74 O ATOM 2442 CB ASN A 184 0.323 11.208 -5.887 0.49 0.89 C ATOM 2443 CG ASN A 184 -0.031 12.673 -5.730 0.49 2.17 C ATOM 2444 OD1 ASN A 184 -1.166 13.112 -5.794 0.49 3.71 O ATOM 2445 ND2 ASN A 184 0.983 13.481 -5.543 0.49 2.43 N ATOM 0 H ASN A 184 0.741 9.117 -7.142 0.49 0.67 H new ATOM 0 HA ASN A 184 -1.525 10.153 -5.485 0.49 0.62 H new ATOM 0 HB2 ASN A 184 0.743 10.865 -4.941 0.49 0.89 H new ATOM 0 HB3 ASN A 184 1.115 11.136 -6.632 0.49 0.89 H new ATOM 0 HD21 ASN A 184 0.825 14.484 -5.450 0.49 2.43 H new ATOM 0 HD22 ASN A 184 1.930 13.107 -5.490 0.49 2.43 H new ATOM 2452 N THR A 185 -2.799 11.296 -7.306 0.49 0.82 N ATOM 2453 CA THR A 185 -3.576 11.908 -8.415 0.49 0.96 C ATOM 2454 C THR A 185 -4.112 13.314 -8.095 0.49 1.30 C ATOM 2455 O THR A 185 -3.885 14.222 -8.893 0.49 2.29 O ATOM 2456 CB THR A 185 -4.673 10.947 -8.923 0.49 1.07 C ATOM 2457 OG1 THR A 185 -5.207 11.362 -10.163 0.49 1.42 O ATOM 2458 CG2 THR A 185 -5.856 10.783 -7.974 0.49 1.25 C ATOM 0 H THR A 185 -3.226 11.411 -6.387 0.49 0.82 H new ATOM 0 HA THR A 185 -2.874 12.065 -9.234 0.49 0.96 H new ATOM 0 HB THR A 185 -4.151 9.994 -9.009 0.49 1.07 H new ATOM 0 HG1 THR A 185 -5.896 10.728 -10.451 0.49 1.42 H new ATOM 0 HG21 THR A 185 -6.578 10.092 -8.409 0.49 1.25 H new ATOM 0 HG22 THR A 185 -5.505 10.389 -7.020 0.49 1.25 H new ATOM 0 HG23 THR A 185 -6.331 11.751 -7.814 0.49 1.25 H new