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 130 ASN : amide:sc= -0.0424 K(o=0.33,f=-0.36) USER MOD Set 1.2: A 133 ASN : amide:sc= 0.374 K(o=0.33,f=-0.36) USER MOD Set 2.1: A 88 ASN : amide:sc= 0.259 X(o=0.52,f=0.42) USER MOD Set 2.2: A 142 TYR OH : rot 180:sc= 0.259 USER MOD Set 3.1: A 41 LYS NZ :NH3+ -174:sc= 1.47! (180deg=-0.133!) USER MOD Set 3.2: A 184 ASN : amide:sc= 1.02 K(o=2.5,f=-7.9!) USER MOD Set 4.1: A 40 HIS : no HE2:sc= 1.91 K(o=0.57,f=-13!) USER MOD Set 4.2: A 179 HIS : no HE2:sc= -1.34 K(o=0.57,f=-8.2!) USER MOD Single : A 32 THR OG1 : rot 118:sc= 1.24 USER MOD Single : A 33 THR OG1 : rot 163:sc= 1.21 USER MOD Single : A 34 THR OG1 : rot 27:sc= 0.682 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 120:sc= -0.53 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 170:sc= 0.00705 USER MOD Single : A 49 MET CE :methyl 172:sc= -0.6 (180deg=-0.674) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0.572 K(o=0.57,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.132 X(o=-0.13,f=-0.036) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= -0.225 X(o=-0.22,f=-0.39) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl -175:sc= 0 (180deg=-0.0348) USER MOD Single : A 84 THR OG1 : rot -159:sc= 0.351 USER MOD Single : A 85 ASN : amide:sc= -0.0129 X(o=-0.013,f=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -0.0139 K(o=-0.014,f=-0.92) USER MOD Single : A 94 ASN : amide:sc= 0.156 K(o=0.16,f=-1.4) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.557 X(o=-0.56,f=-0.19) USER MOD Single : A 105 GLN : amide:sc= -0.194 X(o=-0.19,f=-0.053) USER MOD Single : A 106 THR OG1 : rot -160:sc= -0.369 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0.498 USER MOD Single : A 113 MET CE :methyl -109:sc= 0 (180deg=-0.546) USER MOD Single : A 116 THR OG1 : rot 180:sc=-0.000541 USER MOD Single : A 118 MET CE :methyl 153:sc= -0.207 (180deg=-1.85!) 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 174:sc= -0.6 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 TYR OH : rot -166:sc= 1.03 USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 HIS : no HD1:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 162 LYS NZ :NH3+ 171:sc= -0.0188 (180deg=-0.115) USER MOD Single : A 173 ASN : amide:sc= 0 K(o=0,f=-2.5!) USER MOD Single : A 181 TYR OH : rot 130:sc= -0.165 USER MOD Single : A 183 LYS NZ :NH3+ 152:sc= 1.21 (180deg=0.362) USER MOD Single : A 185 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 167 N THR A 32 -1.077 -19.886 -1.353 1.00 1.09 N ATOM 168 CA THR A 32 -0.254 -18.913 -2.101 1.00 0.79 C ATOM 169 C THR A 32 1.134 -19.442 -2.492 1.00 0.76 C ATOM 170 O THR A 32 1.608 -20.450 -1.960 1.00 0.88 O ATOM 171 CB THR A 32 -0.051 -17.611 -1.301 1.00 0.72 C ATOM 172 OG1 THR A 32 0.503 -17.832 -0.020 1.00 1.02 O ATOM 173 CG2 THR A 32 -1.330 -16.809 -1.123 1.00 0.78 C ATOM 0 HA THR A 32 -0.820 -18.726 -3.013 1.00 0.79 H new ATOM 0 HB THR A 32 0.650 -17.040 -1.910 1.00 0.72 H new ATOM 0 HG1 THR A 32 1.376 -17.390 0.040 1.00 1.02 H new ATOM 0 HG21 THR A 32 -1.116 -15.906 -0.552 1.00 0.78 H new ATOM 0 HG22 THR A 32 -1.727 -16.535 -2.101 1.00 0.78 H new ATOM 0 HG23 THR A 32 -2.065 -17.411 -0.589 1.00 0.78 H new ATOM 181 N THR A 33 1.837 -18.726 -3.383 1.00 0.75 N ATOM 182 CA THR A 33 3.226 -19.028 -3.803 1.00 0.82 C ATOM 183 C THR A 33 4.281 -18.324 -2.938 1.00 0.80 C ATOM 184 O THR A 33 5.483 -18.556 -3.088 1.00 1.04 O ATOM 185 CB THR A 33 3.460 -18.688 -5.287 1.00 0.99 C ATOM 186 OG1 THR A 33 3.141 -17.338 -5.547 1.00 1.43 O ATOM 187 CG2 THR A 33 2.608 -19.543 -6.224 1.00 1.35 C ATOM 0 H THR A 33 1.453 -17.902 -3.845 1.00 0.75 H new ATOM 0 HA THR A 33 3.345 -20.102 -3.661 1.00 0.82 H new ATOM 0 HB THR A 33 4.515 -18.887 -5.474 1.00 0.99 H new ATOM 0 HG1 THR A 33 3.538 -17.067 -6.401 1.00 1.43 H new ATOM 0 HG21 THR A 33 2.811 -19.263 -7.258 1.00 1.35 H new ATOM 0 HG22 THR A 33 2.852 -20.595 -6.078 1.00 1.35 H new ATOM 0 HG23 THR A 33 1.553 -19.381 -6.005 1.00 1.35 H new ATOM 195 N THR A 34 3.854 -17.449 -2.022 1.00 0.76 N ATOM 196 CA THR A 34 4.677 -16.688 -1.063 1.00 0.75 C ATOM 197 C THR A 34 3.813 -16.280 0.143 1.00 0.62 C ATOM 198 O THR A 34 2.592 -16.178 0.008 1.00 0.68 O ATOM 199 CB THR A 34 5.297 -15.486 -1.805 1.00 0.99 C ATOM 200 OG1 THR A 34 6.456 -15.942 -2.462 1.00 2.23 O ATOM 201 CG2 THR A 34 5.723 -14.298 -0.954 1.00 1.09 C ATOM 0 H THR A 34 2.862 -17.236 -1.920 1.00 0.76 H new ATOM 0 HA THR A 34 5.495 -17.290 -0.667 1.00 0.75 H new ATOM 0 HB THR A 34 4.502 -15.120 -2.455 1.00 0.99 H new ATOM 0 HG1 THR A 34 6.369 -16.899 -2.652 1.00 2.23 H new ATOM 0 HG21 THR A 34 6.142 -13.523 -1.595 1.00 1.09 H new ATOM 0 HG22 THR A 34 4.857 -13.901 -0.424 1.00 1.09 H new ATOM 0 HG23 THR A 34 6.475 -14.618 -0.233 1.00 1.09 H new ATOM 209 N THR A 35 4.416 -16.071 1.321 1.00 0.58 N ATOM 210 CA THR A 35 3.724 -15.868 2.619 1.00 0.57 C ATOM 211 C THR A 35 3.803 -14.440 3.191 1.00 0.49 C ATOM 212 O THR A 35 3.315 -14.188 4.299 1.00 0.50 O ATOM 213 CB THR A 35 4.240 -16.871 3.667 1.00 0.75 C ATOM 214 OG1 THR A 35 5.640 -16.810 3.751 1.00 0.82 O ATOM 215 CG2 THR A 35 3.848 -18.312 3.354 1.00 0.89 C ATOM 0 H THR A 35 5.432 -16.036 1.409 1.00 0.58 H new ATOM 0 HA THR A 35 2.670 -16.040 2.399 1.00 0.57 H new ATOM 0 HB THR A 35 3.777 -16.586 4.611 1.00 0.75 H new ATOM 0 HG1 THR A 35 5.956 -17.451 4.422 1.00 0.82 H new ATOM 0 HG21 THR A 35 4.240 -18.972 4.128 1.00 0.89 H new ATOM 0 HG22 THR A 35 2.762 -18.395 3.323 1.00 0.89 H new ATOM 0 HG23 THR A 35 4.262 -18.600 2.388 1.00 0.89 H new ATOM 223 N SER A 36 4.392 -13.495 2.451 1.00 0.48 N ATOM 224 CA SER A 36 4.518 -12.073 2.797 1.00 0.44 C ATOM 225 C SER A 36 4.485 -11.163 1.562 1.00 0.43 C ATOM 226 O SER A 36 4.744 -11.590 0.439 1.00 0.56 O ATOM 227 CB SER A 36 5.831 -11.825 3.548 1.00 0.56 C ATOM 228 OG SER A 36 5.696 -12.157 4.914 1.00 1.74 O ATOM 0 H SER A 36 4.816 -13.711 1.549 1.00 0.48 H new ATOM 0 HA SER A 36 3.662 -11.829 3.426 1.00 0.44 H new ATOM 0 HB2 SER A 36 6.629 -12.419 3.102 1.00 0.56 H new ATOM 0 HB3 SER A 36 6.120 -10.778 3.450 1.00 0.56 H new ATOM 0 HG SER A 36 6.336 -12.863 5.144 1.00 1.74 H new ATOM 234 N VAL A 37 4.208 -9.880 1.787 1.00 0.35 N ATOM 235 CA VAL A 37 4.209 -8.797 0.792 1.00 0.34 C ATOM 236 C VAL A 37 4.942 -7.574 1.354 1.00 0.35 C ATOM 237 O VAL A 37 4.801 -7.258 2.536 1.00 0.36 O ATOM 238 CB VAL A 37 2.773 -8.475 0.329 1.00 0.31 C ATOM 239 CG1 VAL A 37 1.890 -8.023 1.477 1.00 0.31 C ATOM 240 CG2 VAL A 37 2.708 -7.428 -0.789 1.00 0.31 C ATOM 0 H VAL A 37 3.963 -9.544 2.718 1.00 0.35 H new ATOM 0 HA VAL A 37 4.751 -9.120 -0.097 1.00 0.34 H new ATOM 0 HB VAL A 37 2.399 -9.418 -0.071 1.00 0.31 H new ATOM 0 HG11 VAL A 37 0.889 -7.808 1.103 1.00 0.31 H new ATOM 0 HG12 VAL A 37 1.835 -8.812 2.227 1.00 0.31 H new ATOM 0 HG13 VAL A 37 2.310 -7.124 1.927 1.00 0.31 H new ATOM 0 HG21 VAL A 37 1.668 -7.252 -1.063 1.00 0.31 H new ATOM 0 HG22 VAL A 37 3.154 -6.496 -0.441 1.00 0.31 H new ATOM 0 HG23 VAL A 37 3.256 -7.790 -1.659 1.00 0.31 H new ATOM 250 N THR A 38 5.712 -6.869 0.520 1.00 0.38 N ATOM 251 CA THR A 38 6.374 -5.608 0.901 1.00 0.38 C ATOM 252 C THR A 38 5.741 -4.440 0.148 1.00 0.38 C ATOM 253 O THR A 38 5.803 -4.357 -1.076 1.00 0.38 O ATOM 254 CB THR A 38 7.898 -5.670 0.707 1.00 0.47 C ATOM 255 OG1 THR A 38 8.431 -6.773 1.412 1.00 0.72 O ATOM 256 CG2 THR A 38 8.610 -4.438 1.268 1.00 0.46 C ATOM 0 H THR A 38 5.897 -7.153 -0.442 1.00 0.38 H new ATOM 0 HA THR A 38 6.219 -5.449 1.968 1.00 0.38 H new ATOM 0 HB THR A 38 8.059 -5.741 -0.369 1.00 0.47 H new ATOM 0 HG1 THR A 38 9.402 -6.806 1.282 1.00 0.72 H new ATOM 0 HG21 THR A 38 9.684 -4.533 1.105 1.00 0.46 H new ATOM 0 HG22 THR A 38 8.244 -3.544 0.763 1.00 0.46 H new ATOM 0 HG23 THR A 38 8.411 -4.358 2.337 1.00 0.46 H new ATOM 264 N VAL A 39 5.094 -3.531 0.871 1.00 0.47 N ATOM 265 CA VAL A 39 4.472 -2.319 0.314 1.00 0.51 C ATOM 266 C VAL A 39 5.466 -1.161 0.391 1.00 0.54 C ATOM 267 O VAL A 39 6.058 -0.896 1.437 1.00 0.61 O ATOM 268 CB VAL A 39 3.107 -2.029 0.971 1.00 0.56 C ATOM 269 CG1 VAL A 39 3.119 -2.193 2.487 1.00 0.68 C ATOM 270 CG2 VAL A 39 2.546 -0.657 0.588 1.00 0.57 C ATOM 0 H VAL A 39 4.981 -3.611 1.882 1.00 0.47 H new ATOM 0 HA VAL A 39 4.240 -2.470 -0.740 1.00 0.51 H new ATOM 0 HB VAL A 39 2.440 -2.791 0.568 1.00 0.56 H new ATOM 0 HG11 VAL A 39 2.128 -1.974 2.885 1.00 0.68 H new ATOM 0 HG12 VAL A 39 3.393 -3.217 2.740 1.00 0.68 H new ATOM 0 HG13 VAL A 39 3.844 -1.505 2.922 1.00 0.68 H new ATOM 0 HG21 VAL A 39 1.585 -0.507 1.079 1.00 0.57 H new ATOM 0 HG22 VAL A 39 3.240 0.121 0.905 1.00 0.57 H new ATOM 0 HG23 VAL A 39 2.413 -0.607 -0.493 1.00 0.57 H new ATOM 280 N HIS A 40 5.668 -0.491 -0.737 1.00 0.52 N ATOM 281 CA HIS A 40 6.588 0.640 -0.894 1.00 0.57 C ATOM 282 C HIS A 40 5.794 1.955 -1.027 1.00 0.81 C ATOM 283 O HIS A 40 4.566 1.946 -0.949 1.00 1.79 O ATOM 284 CB HIS A 40 7.497 0.344 -2.104 1.00 0.54 C ATOM 285 CG HIS A 40 8.284 -0.945 -1.981 1.00 0.47 C ATOM 286 ND1 HIS A 40 9.585 -1.073 -1.556 1.00 0.54 N ATOM 287 CD2 HIS A 40 7.835 -2.211 -2.242 1.00 0.46 C ATOM 288 CE1 HIS A 40 9.912 -2.374 -1.554 1.00 0.56 C ATOM 289 NE2 HIS A 40 8.868 -3.114 -1.958 1.00 0.49 N ATOM 0 H HIS A 40 5.180 -0.725 -1.602 1.00 0.52 H new ATOM 0 HA HIS A 40 7.223 0.767 -0.017 1.00 0.57 H new ATOM 0 HB2 HIS A 40 6.884 0.299 -3.004 1.00 0.54 H new ATOM 0 HB3 HIS A 40 8.194 1.172 -2.234 1.00 0.54 H new ATOM 0 HD1 HIS A 40 10.200 -0.305 -1.287 1.00 0.54 H new ATOM 0 HD2 HIS A 40 6.851 -2.470 -2.605 1.00 0.46 H new ATOM 0 HE1 HIS A 40 10.876 -2.769 -1.269 1.00 0.56 H new ATOM 297 N LYS A 41 6.459 3.100 -1.223 1.00 0.42 N ATOM 298 CA LYS A 41 5.805 4.360 -1.614 1.00 0.45 C ATOM 299 C LYS A 41 6.629 5.106 -2.657 1.00 0.54 C ATOM 300 O LYS A 41 7.782 5.462 -2.413 1.00 0.64 O ATOM 301 CB LYS A 41 5.528 5.241 -0.386 1.00 0.58 C ATOM 302 CG LYS A 41 4.825 6.572 -0.737 1.00 1.02 C ATOM 303 CD LYS A 41 3.433 6.434 -1.372 1.00 1.28 C ATOM 304 CE LYS A 41 2.913 7.807 -1.810 1.00 0.79 C ATOM 305 NZ LYS A 41 1.534 7.707 -2.333 1.00 1.60 N ATOM 0 H LYS A 41 7.470 3.182 -1.115 1.00 0.42 H new ATOM 0 HA LYS A 41 4.845 4.113 -2.068 1.00 0.45 H new ATOM 0 HB2 LYS A 41 4.909 4.686 0.319 1.00 0.58 H new ATOM 0 HB3 LYS A 41 6.470 5.457 0.118 1.00 0.58 H new ATOM 0 HG2 LYS A 41 4.734 7.166 0.172 1.00 1.02 H new ATOM 0 HG3 LYS A 41 5.464 7.132 -1.420 1.00 1.02 H new ATOM 0 HD2 LYS A 41 3.482 5.765 -2.231 1.00 1.28 H new ATOM 0 HD3 LYS A 41 2.742 5.986 -0.658 1.00 1.28 H new ATOM 0 HE2 LYS A 41 2.937 8.496 -0.965 1.00 0.79 H new ATOM 0 HE3 LYS A 41 3.568 8.221 -2.577 1.00 0.79 H new ATOM 0 HZ1 LYS A 41 1.241 8.628 -2.717 1.00 1.60 H new ATOM 0 HZ2 LYS A 41 1.500 6.991 -3.087 1.00 1.60 H new ATOM 0 HZ3 LYS A 41 0.890 7.431 -1.564 1.00 1.60 H new ATOM 319 N LEU A 42 6.002 5.376 -3.802 1.00 0.53 N ATOM 320 CA LEU A 42 6.590 6.147 -4.897 1.00 0.55 C ATOM 321 C LEU A 42 5.945 7.532 -4.999 1.00 0.53 C ATOM 322 O LEU A 42 4.787 7.722 -4.626 1.00 0.54 O ATOM 323 CB LEU A 42 6.482 5.397 -6.237 1.00 0.52 C ATOM 324 CG LEU A 42 7.004 3.951 -6.269 1.00 0.56 C ATOM 325 CD1 LEU A 42 7.167 3.510 -7.722 1.00 0.58 C ATOM 326 CD2 LEU A 42 8.368 3.747 -5.615 1.00 0.67 C ATOM 0 H LEU A 42 5.053 5.059 -3.998 1.00 0.53 H new ATOM 0 HA LEU A 42 7.649 6.277 -4.674 1.00 0.55 H new ATOM 0 HB2 LEU A 42 5.434 5.386 -6.536 1.00 0.52 H new ATOM 0 HB3 LEU A 42 7.023 5.970 -6.991 1.00 0.52 H new ATOM 0 HG LEU A 42 6.268 3.374 -5.710 1.00 0.56 H new ATOM 0 HD11 LEU A 42 7.537 2.485 -7.752 1.00 0.58 H new ATOM 0 HD12 LEU A 42 6.203 3.563 -8.229 1.00 0.58 H new ATOM 0 HD13 LEU A 42 7.877 4.167 -8.224 1.00 0.58 H new ATOM 0 HD21 LEU A 42 8.652 2.697 -5.686 1.00 0.67 H new ATOM 0 HD22 LEU A 42 9.111 4.360 -6.125 1.00 0.67 H new ATOM 0 HD23 LEU A 42 8.316 4.038 -4.566 1.00 0.67 H new ATOM 338 N LEU A 43 6.700 8.480 -5.549 1.00 0.54 N ATOM 339 CA LEU A 43 6.284 9.855 -5.822 1.00 0.52 C ATOM 340 C LEU A 43 6.929 10.353 -7.126 1.00 0.47 C ATOM 341 O LEU A 43 7.867 9.739 -7.640 1.00 0.47 O ATOM 342 CB LEU A 43 6.681 10.739 -4.618 1.00 0.70 C ATOM 343 CG LEU A 43 5.558 11.561 -3.971 1.00 0.72 C ATOM 344 CD1 LEU A 43 4.862 12.516 -4.943 1.00 1.91 C ATOM 345 CD2 LEU A 43 4.512 10.668 -3.314 1.00 1.00 C ATOM 0 H LEU A 43 7.664 8.303 -5.830 1.00 0.54 H new ATOM 0 HA LEU A 43 5.203 9.905 -5.954 1.00 0.52 H new ATOM 0 HB2 LEU A 43 7.118 10.097 -3.853 1.00 0.70 H new ATOM 0 HB3 LEU A 43 7.463 11.426 -4.942 1.00 0.70 H new ATOM 0 HG LEU A 43 6.055 12.165 -3.211 1.00 0.72 H new ATOM 0 HD11 LEU A 43 4.080 13.064 -4.417 1.00 1.91 H new ATOM 0 HD12 LEU A 43 5.590 13.220 -5.346 1.00 1.91 H new ATOM 0 HD13 LEU A 43 4.419 11.945 -5.759 1.00 1.91 H new ATOM 0 HD21 LEU A 43 3.734 11.287 -2.867 1.00 1.00 H new ATOM 0 HD22 LEU A 43 4.069 10.014 -4.065 1.00 1.00 H new ATOM 0 HD23 LEU A 43 4.984 10.064 -2.539 1.00 1.00 H new ATOM 357 N ALA A 44 6.451 11.483 -7.645 1.00 0.50 N ATOM 358 CA ALA A 44 7.074 12.191 -8.761 1.00 0.50 C ATOM 359 C ALA A 44 7.892 13.408 -8.295 1.00 0.59 C ATOM 360 O ALA A 44 7.637 13.966 -7.225 1.00 0.68 O ATOM 361 CB ALA A 44 5.997 12.587 -9.771 1.00 0.52 C ATOM 0 H ALA A 44 5.608 11.939 -7.296 1.00 0.50 H new ATOM 0 HA ALA A 44 7.785 11.520 -9.243 1.00 0.50 H new ATOM 0 HB1 ALA A 44 6.458 13.116 -10.606 1.00 0.52 H new ATOM 0 HB2 ALA A 44 5.497 11.691 -10.140 1.00 0.52 H new ATOM 0 HB3 ALA A 44 5.267 13.237 -9.288 1.00 0.52 H new ATOM 367 N THR A 45 8.836 13.851 -9.123 1.00 0.66 N ATOM 368 CA THR A 45 9.636 15.068 -8.899 1.00 0.72 C ATOM 369 C THR A 45 8.887 16.344 -9.300 1.00 0.77 C ATOM 370 O THR A 45 8.922 17.337 -8.570 1.00 0.94 O ATOM 371 CB THR A 45 10.952 14.989 -9.684 1.00 0.72 C ATOM 372 OG1 THR A 45 10.668 14.709 -11.036 1.00 0.77 O ATOM 373 CG2 THR A 45 11.862 13.873 -9.168 1.00 0.82 C ATOM 0 H THR A 45 9.076 13.368 -9.989 1.00 0.66 H new ATOM 0 HA THR A 45 9.837 15.120 -7.829 1.00 0.72 H new ATOM 0 HB THR A 45 11.459 15.946 -9.564 1.00 0.72 H new ATOM 0 HG1 THR A 45 11.483 14.816 -11.570 1.00 0.77 H new ATOM 0 HG21 THR A 45 12.782 13.854 -9.753 1.00 0.82 H new ATOM 0 HG22 THR A 45 12.102 14.054 -8.120 1.00 0.82 H new ATOM 0 HG23 THR A 45 11.352 12.914 -9.263 1.00 0.82 H new ATOM 381 N ASP A 46 8.162 16.336 -10.423 1.00 0.74 N ATOM 382 CA ASP A 46 7.444 17.504 -10.954 1.00 0.84 C ATOM 383 C ASP A 46 5.984 17.189 -11.342 1.00 0.84 C ATOM 384 O ASP A 46 5.479 17.676 -12.357 1.00 1.10 O ATOM 385 CB ASP A 46 8.274 18.157 -12.076 1.00 0.95 C ATOM 386 CG ASP A 46 7.955 19.645 -12.200 1.00 1.34 C ATOM 387 OD1 ASP A 46 8.146 20.357 -11.183 1.00 2.68 O ATOM 388 OD2 ASP A 46 7.481 20.085 -13.273 1.00 1.55 O ATOM 0 H ASP A 46 8.054 15.503 -11.001 1.00 0.74 H new ATOM 0 HA ASP A 46 7.340 18.243 -10.159 1.00 0.84 H new ATOM 0 HB2 ASP A 46 9.336 18.025 -11.870 1.00 0.95 H new ATOM 0 HB3 ASP A 46 8.068 17.658 -13.023 1.00 0.95 H new ATOM 393 N GLY A 47 5.304 16.348 -10.552 1.00 0.77 N ATOM 394 CA GLY A 47 3.901 15.944 -10.749 1.00 0.78 C ATOM 395 C GLY A 47 3.678 14.838 -11.788 1.00 0.70 C ATOM 396 O GLY A 47 2.546 14.572 -12.194 1.00 0.79 O ATOM 0 H GLY A 47 5.727 15.915 -9.731 1.00 0.77 H new ATOM 0 HA2 GLY A 47 3.499 15.608 -9.793 1.00 0.78 H new ATOM 0 HA3 GLY A 47 3.326 16.821 -11.046 1.00 0.78 H new ATOM 400 N ASP A 48 4.747 14.176 -12.225 1.00 0.60 N ATOM 401 CA ASP A 48 4.809 13.203 -13.329 1.00 0.58 C ATOM 402 C ASP A 48 4.152 11.833 -13.063 1.00 0.54 C ATOM 403 O ASP A 48 4.438 10.865 -13.766 1.00 0.55 O ATOM 404 CB ASP A 48 6.281 13.027 -13.733 1.00 0.59 C ATOM 405 CG ASP A 48 6.927 14.384 -13.989 1.00 0.81 C ATOM 406 OD1 ASP A 48 6.704 14.958 -15.080 1.00 1.95 O ATOM 407 OD2 ASP A 48 7.596 14.920 -13.082 1.00 1.55 O ATOM 0 H ASP A 48 5.660 14.310 -11.791 1.00 0.60 H new ATOM 0 HA ASP A 48 4.209 13.622 -14.136 1.00 0.58 H new ATOM 0 HB2 ASP A 48 6.821 12.503 -12.945 1.00 0.59 H new ATOM 0 HB3 ASP A 48 6.348 12.410 -14.629 1.00 0.59 H new ATOM 412 N MET A 49 3.273 11.706 -12.061 1.00 0.54 N ATOM 413 CA MET A 49 2.677 10.410 -11.698 1.00 0.53 C ATOM 414 C MET A 49 1.876 9.773 -12.847 1.00 0.55 C ATOM 415 O MET A 49 1.789 8.553 -12.916 1.00 0.57 O ATOM 416 CB MET A 49 1.788 10.534 -10.453 1.00 0.56 C ATOM 417 CG MET A 49 2.510 10.966 -9.168 1.00 0.59 C ATOM 418 SD MET A 49 3.049 9.642 -8.038 1.00 0.60 S ATOM 419 CE MET A 49 4.242 8.722 -9.036 1.00 0.55 C ATOM 0 H MET A 49 2.957 12.486 -11.485 1.00 0.54 H new ATOM 0 HA MET A 49 3.516 9.749 -11.478 1.00 0.53 H new ATOM 0 HB2 MET A 49 0.996 11.252 -10.663 1.00 0.56 H new ATOM 0 HB3 MET A 49 1.307 9.572 -10.274 1.00 0.56 H new ATOM 0 HG2 MET A 49 3.387 11.548 -9.451 1.00 0.59 H new ATOM 0 HG3 MET A 49 1.849 11.634 -8.616 1.00 0.59 H new ATOM 0 HE1 MET A 49 4.743 7.981 -8.413 1.00 0.55 H new ATOM 0 HE2 MET A 49 3.723 8.219 -9.852 1.00 0.55 H new ATOM 0 HE3 MET A 49 4.981 9.410 -9.446 1.00 0.55 H new ATOM 429 N ASP A 50 1.352 10.579 -13.775 1.00 0.61 N ATOM 430 CA ASP A 50 0.578 10.129 -14.940 1.00 0.70 C ATOM 431 C ASP A 50 1.429 9.317 -15.945 1.00 0.66 C ATOM 432 O ASP A 50 1.070 8.181 -16.283 1.00 0.70 O ATOM 433 CB ASP A 50 -0.079 11.356 -15.599 1.00 0.87 C ATOM 434 CG ASP A 50 -0.964 12.154 -14.635 1.00 1.20 C ATOM 435 OD1 ASP A 50 -2.172 11.839 -14.490 1.00 1.90 O ATOM 436 OD2 ASP A 50 -0.467 13.130 -14.022 1.00 2.33 O ATOM 0 H ASP A 50 1.457 11.593 -13.737 1.00 0.61 H new ATOM 0 HA ASP A 50 -0.196 9.441 -14.601 1.00 0.70 H new ATOM 0 HB2 ASP A 50 0.699 12.009 -15.994 1.00 0.87 H new ATOM 0 HB3 ASP A 50 -0.680 11.027 -16.447 1.00 0.87 H new ATOM 441 N LYS A 51 2.603 9.825 -16.368 1.00 0.60 N ATOM 442 CA LYS A 51 3.550 9.061 -17.194 1.00 0.58 C ATOM 443 C LYS A 51 4.182 7.906 -16.427 1.00 0.55 C ATOM 444 O LYS A 51 4.264 6.815 -16.987 1.00 0.58 O ATOM 445 CB LYS A 51 4.577 9.981 -17.871 1.00 0.58 C ATOM 446 CG LYS A 51 5.373 10.860 -16.898 1.00 0.58 C ATOM 447 CD LYS A 51 6.182 11.941 -17.617 1.00 0.70 C ATOM 448 CE LYS A 51 7.344 11.338 -18.394 1.00 1.92 C ATOM 449 NZ LYS A 51 8.239 12.400 -18.908 1.00 2.30 N ATOM 0 H LYS A 51 2.917 10.770 -16.147 1.00 0.60 H new ATOM 0 HA LYS A 51 2.983 8.596 -18.000 1.00 0.58 H new ATOM 0 HB2 LYS A 51 5.274 9.369 -18.443 1.00 0.58 H new ATOM 0 HB3 LYS A 51 4.059 10.624 -18.582 1.00 0.58 H new ATOM 0 HG2 LYS A 51 4.687 11.331 -16.194 1.00 0.58 H new ATOM 0 HG3 LYS A 51 6.047 10.233 -16.315 1.00 0.58 H new ATOM 0 HD2 LYS A 51 5.533 12.491 -18.298 1.00 0.70 H new ATOM 0 HD3 LYS A 51 6.562 12.658 -16.889 1.00 0.70 H new ATOM 0 HE2 LYS A 51 7.906 10.662 -17.750 1.00 1.92 H new ATOM 0 HE3 LYS A 51 6.963 10.744 -19.224 1.00 1.92 H new ATOM 0 HZ1 LYS A 51 9.024 11.967 -19.435 1.00 2.30 H new ATOM 0 HZ2 LYS A 51 7.704 13.029 -19.540 1.00 2.30 H new ATOM 0 HZ3 LYS A 51 8.618 12.950 -18.111 1.00 2.30 H new ATOM 463 N ILE A 52 4.540 8.083 -15.149 1.00 0.51 N ATOM 464 CA ILE A 52 4.991 6.995 -14.267 1.00 0.49 C ATOM 465 C ILE A 52 3.968 5.850 -14.233 1.00 0.51 C ATOM 466 O ILE A 52 4.341 4.710 -14.473 1.00 0.53 O ATOM 467 CB ILE A 52 5.310 7.526 -12.851 1.00 0.46 C ATOM 468 CG1 ILE A 52 6.474 8.542 -12.927 1.00 0.48 C ATOM 469 CG2 ILE A 52 5.667 6.369 -11.894 1.00 0.49 C ATOM 470 CD1 ILE A 52 6.791 9.270 -11.626 1.00 0.47 C ATOM 0 H ILE A 52 4.525 8.995 -14.692 1.00 0.51 H new ATOM 0 HA ILE A 52 5.916 6.588 -14.676 1.00 0.49 H new ATOM 0 HB ILE A 52 4.424 8.024 -12.457 1.00 0.46 H new ATOM 0 HG12 ILE A 52 7.370 8.018 -13.258 1.00 0.48 H new ATOM 0 HG13 ILE A 52 6.238 9.283 -13.690 1.00 0.48 H new ATOM 0 HG21 ILE A 52 5.887 6.770 -10.905 1.00 0.49 H new ATOM 0 HG22 ILE A 52 4.826 5.679 -11.827 1.00 0.49 H new ATOM 0 HG23 ILE A 52 6.541 5.839 -12.273 1.00 0.49 H new ATOM 0 HD11 ILE A 52 7.621 9.958 -11.787 1.00 0.47 H new ATOM 0 HD12 ILE A 52 5.914 9.829 -11.299 1.00 0.47 H new ATOM 0 HD13 ILE A 52 7.065 8.544 -10.860 1.00 0.47 H new ATOM 482 N ALA A 53 2.678 6.108 -14.017 1.00 0.54 N ATOM 483 CA ALA A 53 1.667 5.049 -13.961 1.00 0.59 C ATOM 484 C ALA A 53 1.478 4.310 -15.302 1.00 0.65 C ATOM 485 O ALA A 53 1.075 3.146 -15.306 1.00 0.76 O ATOM 486 CB ALA A 53 0.354 5.663 -13.470 1.00 0.68 C ATOM 0 H ALA A 53 2.306 7.047 -13.877 1.00 0.54 H new ATOM 0 HA ALA A 53 2.012 4.284 -13.265 1.00 0.59 H new ATOM 0 HB1 ALA A 53 -0.413 4.890 -13.421 1.00 0.68 H new ATOM 0 HB2 ALA A 53 0.501 6.092 -12.479 1.00 0.68 H new ATOM 0 HB3 ALA A 53 0.038 6.445 -14.160 1.00 0.68 H new ATOM 492 N ASN A 54 1.816 4.932 -16.436 1.00 0.65 N ATOM 493 CA ASN A 54 1.878 4.251 -17.733 1.00 0.72 C ATOM 494 C ASN A 54 3.208 3.489 -17.948 1.00 0.71 C ATOM 495 O ASN A 54 3.225 2.435 -18.586 1.00 0.78 O ATOM 496 CB ASN A 54 1.573 5.260 -18.846 1.00 0.79 C ATOM 497 CG ASN A 54 0.083 5.527 -18.960 1.00 0.89 C ATOM 498 OD1 ASN A 54 -0.630 4.866 -19.707 1.00 1.12 O ATOM 499 ND2 ASN A 54 -0.448 6.451 -18.197 1.00 0.86 N ATOM 0 H ASN A 54 2.055 5.923 -16.480 1.00 0.65 H new ATOM 0 HA ASN A 54 1.115 3.473 -17.757 1.00 0.72 H new ATOM 0 HB2 ASN A 54 2.097 6.194 -18.645 1.00 0.79 H new ATOM 0 HB3 ASN A 54 1.950 4.881 -19.796 1.00 0.79 H new ATOM 0 HD21 ASN A 54 -1.454 6.620 -18.225 1.00 0.86 H new ATOM 0 HD22 ASN A 54 0.144 7.001 -17.575 1.00 0.86 H new ATOM 506 N GLU A 55 4.303 3.972 -17.355 1.00 0.68 N ATOM 507 CA GLU A 55 5.598 3.276 -17.246 1.00 0.72 C ATOM 508 C GLU A 55 5.573 2.075 -16.272 1.00 0.73 C ATOM 509 O GLU A 55 6.515 1.280 -16.261 1.00 0.94 O ATOM 510 CB GLU A 55 6.708 4.263 -16.838 1.00 0.81 C ATOM 511 CG GLU A 55 7.115 5.281 -17.907 1.00 0.87 C ATOM 512 CD GLU A 55 7.350 4.628 -19.271 1.00 0.90 C ATOM 513 OE1 GLU A 55 8.377 3.928 -19.441 1.00 1.47 O ATOM 514 OE2 GLU A 55 6.496 4.784 -20.175 1.00 2.07 O ATOM 0 H GLU A 55 4.317 4.894 -16.919 1.00 0.68 H new ATOM 0 HA GLU A 55 5.808 2.870 -18.236 1.00 0.72 H new ATOM 0 HB2 GLU A 55 6.379 4.806 -15.952 1.00 0.81 H new ATOM 0 HB3 GLU A 55 7.591 3.691 -16.552 1.00 0.81 H new ATOM 0 HG2 GLU A 55 6.337 6.039 -17.999 1.00 0.87 H new ATOM 0 HG3 GLU A 55 8.024 5.793 -17.591 1.00 0.87 H new ATOM 521 N LEU A 56 4.513 1.932 -15.466 1.00 0.67 N ATOM 522 CA LEU A 56 4.261 0.794 -14.573 1.00 0.68 C ATOM 523 C LEU A 56 3.148 -0.148 -15.051 1.00 0.75 C ATOM 524 O LEU A 56 3.261 -1.349 -14.817 1.00 0.80 O ATOM 525 CB LEU A 56 3.972 1.320 -13.164 1.00 0.65 C ATOM 526 CG LEU A 56 5.122 2.121 -12.528 1.00 0.63 C ATOM 527 CD1 LEU A 56 4.721 2.432 -11.102 1.00 0.72 C ATOM 528 CD2 LEU A 56 6.460 1.404 -12.469 1.00 0.58 C ATOM 0 H LEU A 56 3.777 2.636 -15.416 1.00 0.67 H new ATOM 0 HA LEU A 56 5.162 0.181 -14.573 1.00 0.68 H new ATOM 0 HB2 LEU A 56 3.085 1.952 -13.202 1.00 0.65 H new ATOM 0 HB3 LEU A 56 3.735 0.475 -12.517 1.00 0.65 H new ATOM 0 HG LEU A 56 5.268 2.997 -13.160 1.00 0.63 H new ATOM 0 HD11 LEU A 56 5.514 3.001 -10.617 1.00 0.72 H new ATOM 0 HD12 LEU A 56 3.802 3.018 -11.102 1.00 0.72 H new ATOM 0 HD13 LEU A 56 4.558 1.501 -10.559 1.00 0.72 H new ATOM 0 HD21 LEU A 56 7.201 2.054 -12.004 1.00 0.58 H new ATOM 0 HD22 LEU A 56 6.358 0.491 -11.882 1.00 0.58 H new ATOM 0 HD23 LEU A 56 6.782 1.151 -13.479 1.00 0.58 H new ATOM 540 N GLU A 57 2.109 0.328 -15.750 1.00 0.79 N ATOM 541 CA GLU A 57 1.070 -0.570 -16.309 1.00 0.88 C ATOM 542 C GLU A 57 1.609 -1.515 -17.404 1.00 0.91 C ATOM 543 O GLU A 57 1.020 -2.563 -17.684 1.00 0.99 O ATOM 544 CB GLU A 57 -0.154 0.218 -16.817 1.00 0.98 C ATOM 545 CG GLU A 57 -0.028 0.772 -18.244 1.00 1.04 C ATOM 546 CD GLU A 57 -1.315 1.437 -18.742 1.00 1.47 C ATOM 547 OE1 GLU A 57 -2.041 2.075 -17.936 1.00 2.41 O ATOM 548 OE2 GLU A 57 -1.583 1.348 -19.966 1.00 2.40 O ATOM 0 H GLU A 57 1.959 1.318 -15.945 1.00 0.79 H new ATOM 0 HA GLU A 57 0.749 -1.202 -15.480 1.00 0.88 H new ATOM 0 HB2 GLU A 57 -1.028 -0.431 -16.772 1.00 0.98 H new ATOM 0 HB3 GLU A 57 -0.339 1.049 -16.137 1.00 0.98 H new ATOM 0 HG2 GLU A 57 0.785 1.497 -18.276 1.00 1.04 H new ATOM 0 HG3 GLU A 57 0.241 -0.039 -18.921 1.00 1.04 H new ATOM 555 N THR A 58 2.728 -1.141 -18.033 1.00 0.88 N ATOM 556 CA THR A 58 3.481 -1.992 -18.969 1.00 0.95 C ATOM 557 C THR A 58 4.210 -3.144 -18.259 1.00 0.89 C ATOM 558 O THR A 58 4.323 -4.234 -18.823 1.00 0.98 O ATOM 559 CB THR A 58 4.432 -1.130 -19.819 1.00 1.04 C ATOM 560 OG1 THR A 58 5.139 -1.905 -20.758 1.00 1.38 O ATOM 561 CG2 THR A 58 5.466 -0.362 -19.001 1.00 1.01 C ATOM 0 H THR A 58 3.147 -0.220 -17.905 1.00 0.88 H new ATOM 0 HA THR A 58 2.767 -2.470 -19.640 1.00 0.95 H new ATOM 0 HB THR A 58 3.772 -0.417 -20.314 1.00 1.04 H new ATOM 0 HG1 THR A 58 5.732 -1.325 -21.281 1.00 1.38 H new ATOM 0 HG21 THR A 58 6.099 0.221 -19.670 1.00 1.01 H new ATOM 0 HG22 THR A 58 4.957 0.307 -18.307 1.00 1.01 H new ATOM 0 HG23 THR A 58 6.082 -1.065 -18.441 1.00 1.01 H new ATOM 569 N GLY A 59 4.645 -2.962 -17.008 1.00 0.86 N ATOM 570 CA GLY A 59 5.311 -3.995 -16.207 1.00 0.84 C ATOM 571 C GLY A 59 4.334 -4.895 -15.452 1.00 0.82 C ATOM 572 O GLY A 59 3.171 -4.541 -15.250 1.00 0.87 O ATOM 0 H GLY A 59 4.542 -2.076 -16.514 1.00 0.86 H new ATOM 0 HA2 GLY A 59 5.930 -4.610 -16.861 1.00 0.84 H new ATOM 0 HA3 GLY A 59 5.980 -3.516 -15.492 1.00 0.84 H new ATOM 576 N ASN A 60 4.787 -6.062 -14.987 1.00 0.82 N ATOM 577 CA ASN A 60 3.924 -7.029 -14.285 1.00 0.85 C ATOM 578 C ASN A 60 3.758 -6.704 -12.783 1.00 0.82 C ATOM 579 O ASN A 60 3.594 -7.598 -11.957 1.00 0.94 O ATOM 580 CB ASN A 60 4.384 -8.472 -14.575 1.00 0.97 C ATOM 581 CG ASN A 60 4.347 -8.824 -16.056 1.00 1.24 C ATOM 582 OD1 ASN A 60 3.543 -8.295 -16.820 1.00 1.61 O ATOM 583 ND2 ASN A 60 5.177 -9.738 -16.499 1.00 1.53 N ATOM 0 H ASN A 60 5.756 -6.367 -15.083 1.00 0.82 H new ATOM 0 HA ASN A 60 2.914 -6.939 -14.685 1.00 0.85 H new ATOM 0 HB2 ASN A 60 5.399 -8.606 -14.201 1.00 0.97 H new ATOM 0 HB3 ASN A 60 3.748 -9.167 -14.026 1.00 0.97 H new ATOM 0 HD21 ASN A 60 5.157 -10.012 -17.481 1.00 1.53 H new ATOM 0 HD22 ASN A 60 5.843 -10.174 -15.861 1.00 1.53 H new ATOM 590 N TYR A 61 3.808 -5.426 -12.399 1.00 0.75 N ATOM 591 CA TYR A 61 3.914 -4.972 -11.002 1.00 0.75 C ATOM 592 C TYR A 61 2.651 -5.151 -10.131 1.00 0.79 C ATOM 593 O TYR A 61 2.504 -4.522 -9.082 1.00 0.99 O ATOM 594 CB TYR A 61 4.553 -3.575 -10.951 1.00 0.66 C ATOM 595 CG TYR A 61 5.778 -3.402 -11.835 1.00 0.64 C ATOM 596 CD1 TYR A 61 6.782 -4.390 -11.881 1.00 1.83 C ATOM 597 CD2 TYR A 61 5.908 -2.244 -12.621 1.00 1.80 C ATOM 598 CE1 TYR A 61 7.875 -4.249 -12.754 1.00 1.96 C ATOM 599 CE2 TYR A 61 7.040 -2.057 -13.435 1.00 1.73 C ATOM 600 CZ TYR A 61 8.010 -3.082 -13.539 1.00 0.75 C ATOM 601 OH TYR A 61 9.069 -2.961 -14.383 1.00 0.90 O ATOM 0 H TYR A 61 3.775 -4.655 -13.066 1.00 0.75 H new ATOM 0 HA TYR A 61 4.590 -5.664 -10.500 1.00 0.75 H new ATOM 0 HB2 TYR A 61 3.805 -2.838 -11.242 1.00 0.66 H new ATOM 0 HB3 TYR A 61 4.832 -3.356 -9.920 1.00 0.66 H new ATOM 0 HD1 TYR A 61 6.711 -5.259 -11.243 1.00 1.83 H new ATOM 0 HD2 TYR A 61 5.133 -1.492 -12.600 1.00 1.80 H new ATOM 0 HE1 TYR A 61 8.613 -5.034 -12.825 1.00 1.96 H new ATOM 0 HE2 TYR A 61 7.168 -1.133 -13.979 1.00 1.73 H new ATOM 0 HH TYR A 61 9.017 -2.102 -14.852 1.00 0.90 H new ATOM 611 N ALA A 62 1.737 -6.028 -10.559 1.00 0.76 N ATOM 612 CA ALA A 62 0.657 -6.563 -9.733 1.00 0.82 C ATOM 613 C ALA A 62 1.232 -7.557 -8.699 1.00 0.75 C ATOM 614 O ALA A 62 0.654 -7.725 -7.620 1.00 0.83 O ATOM 615 CB ALA A 62 -0.339 -7.286 -10.650 1.00 0.94 C ATOM 0 H ALA A 62 1.730 -6.392 -11.512 1.00 0.76 H new ATOM 0 HA ALA A 62 0.157 -5.754 -9.199 1.00 0.82 H new ATOM 0 HB1 ALA A 62 -1.154 -7.693 -10.052 1.00 0.94 H new ATOM 0 HB2 ALA A 62 -0.740 -6.582 -11.379 1.00 0.94 H new ATOM 0 HB3 ALA A 62 0.169 -8.097 -11.171 1.00 0.94 H new ATOM 621 N GLY A 63 2.363 -8.201 -9.038 1.00 0.69 N ATOM 622 CA GLY A 63 3.088 -9.145 -8.181 1.00 0.67 C ATOM 623 C GLY A 63 4.527 -8.713 -7.884 1.00 0.58 C ATOM 624 O GLY A 63 4.874 -8.482 -6.726 1.00 0.53 O ATOM 0 H GLY A 63 2.809 -8.072 -9.946 1.00 0.69 H new ATOM 0 HA2 GLY A 63 2.549 -9.259 -7.240 1.00 0.67 H new ATOM 0 HA3 GLY A 63 3.102 -10.124 -8.661 1.00 0.67 H new ATOM 628 N ASN A 64 5.368 -8.635 -8.920 1.00 0.69 N ATOM 629 CA ASN A 64 6.814 -8.422 -8.775 1.00 0.67 C ATOM 630 C ASN A 64 7.239 -6.962 -8.496 1.00 0.59 C ATOM 631 O ASN A 64 6.517 -6.008 -8.790 1.00 0.63 O ATOM 632 CB ASN A 64 7.608 -9.099 -9.907 1.00 0.87 C ATOM 633 CG ASN A 64 7.680 -8.200 -11.106 1.00 1.18 C ATOM 634 OD1 ASN A 64 8.651 -7.503 -11.354 1.00 1.81 O ATOM 635 ND2 ASN A 64 6.596 -8.094 -11.815 1.00 1.31 N ATOM 0 H ASN A 64 5.064 -8.718 -9.890 1.00 0.69 H new ATOM 0 HA ASN A 64 7.088 -8.931 -7.851 1.00 0.67 H new ATOM 0 HB2 ASN A 64 8.614 -9.337 -9.562 1.00 0.87 H new ATOM 0 HB3 ASN A 64 7.133 -10.042 -10.179 1.00 0.87 H new ATOM 0 HD21 ASN A 64 6.553 -7.425 -12.584 1.00 1.31 H new ATOM 0 HD22 ASN A 64 5.788 -8.679 -11.602 1.00 1.31 H new ATOM 642 N LYS A 65 8.444 -6.806 -7.938 1.00 0.53 N ATOM 643 CA LYS A 65 9.075 -5.522 -7.584 1.00 0.48 C ATOM 644 C LYS A 65 9.510 -4.712 -8.808 1.00 0.54 C ATOM 645 O LYS A 65 10.139 -5.262 -9.713 1.00 0.81 O ATOM 646 CB LYS A 65 10.237 -5.819 -6.625 1.00 0.59 C ATOM 647 CG LYS A 65 11.313 -4.739 -6.447 1.00 1.65 C ATOM 648 CD LYS A 65 12.136 -5.070 -5.195 1.00 2.18 C ATOM 649 CE LYS A 65 13.154 -3.973 -4.900 1.00 2.03 C ATOM 650 NZ LYS A 65 13.948 -4.320 -3.702 1.00 3.27 N ATOM 0 H LYS A 65 9.036 -7.605 -7.709 1.00 0.53 H new ATOM 0 HA LYS A 65 8.344 -4.883 -7.089 1.00 0.48 H new ATOM 0 HB2 LYS A 65 9.814 -6.035 -5.644 1.00 0.59 H new ATOM 0 HB3 LYS A 65 10.730 -6.729 -6.968 1.00 0.59 H new ATOM 0 HG2 LYS A 65 11.958 -4.700 -7.325 1.00 1.65 H new ATOM 0 HG3 LYS A 65 10.851 -3.757 -6.347 1.00 1.65 H new ATOM 0 HD2 LYS A 65 11.470 -5.192 -4.340 1.00 2.18 H new ATOM 0 HD3 LYS A 65 12.651 -6.020 -5.336 1.00 2.18 H new ATOM 0 HE2 LYS A 65 13.815 -3.840 -5.757 1.00 2.03 H new ATOM 0 HE3 LYS A 65 12.641 -3.024 -4.743 1.00 2.03 H new ATOM 0 HZ1 LYS A 65 14.638 -3.565 -3.512 1.00 3.27 H new ATOM 0 HZ2 LYS A 65 13.314 -4.424 -2.884 1.00 3.27 H new ATOM 0 HZ3 LYS A 65 14.451 -5.215 -3.866 1.00 3.27 H new ATOM 664 N VAL A 66 9.232 -3.400 -8.801 1.00 0.46 N ATOM 665 CA VAL A 66 9.478 -2.498 -9.949 1.00 0.47 C ATOM 666 C VAL A 66 10.936 -2.576 -10.414 1.00 0.58 C ATOM 667 O VAL A 66 11.840 -2.100 -9.725 1.00 0.80 O ATOM 668 CB VAL A 66 9.106 -1.022 -9.685 1.00 0.47 C ATOM 669 CG1 VAL A 66 9.505 -0.105 -10.856 1.00 0.54 C ATOM 670 CG2 VAL A 66 7.593 -0.862 -9.549 1.00 0.43 C ATOM 0 H VAL A 66 8.827 -2.926 -7.994 1.00 0.46 H new ATOM 0 HA VAL A 66 8.813 -2.859 -10.734 1.00 0.47 H new ATOM 0 HB VAL A 66 9.637 -0.746 -8.774 1.00 0.47 H new ATOM 0 HG11 VAL A 66 9.224 0.923 -10.626 1.00 0.54 H new ATOM 0 HG12 VAL A 66 10.583 -0.160 -11.011 1.00 0.54 H new ATOM 0 HG13 VAL A 66 8.991 -0.427 -11.762 1.00 0.54 H new ATOM 0 HG21 VAL A 66 7.353 0.185 -9.363 1.00 0.43 H new ATOM 0 HG22 VAL A 66 7.108 -1.188 -10.469 1.00 0.43 H new ATOM 0 HG23 VAL A 66 7.236 -1.469 -8.717 1.00 0.43 H new ATOM 680 N GLY A 67 11.157 -3.148 -11.600 1.00 0.66 N ATOM 681 CA GLY A 67 12.497 -3.342 -12.171 1.00 0.77 C ATOM 682 C GLY A 67 13.111 -2.089 -12.804 1.00 0.75 C ATOM 683 O GLY A 67 14.335 -1.980 -12.873 1.00 1.06 O ATOM 0 H GLY A 67 10.406 -3.493 -12.198 1.00 0.66 H new ATOM 0 HA2 GLY A 67 13.163 -3.700 -11.386 1.00 0.77 H new ATOM 0 HA3 GLY A 67 12.445 -4.126 -12.927 1.00 0.77 H new ATOM 687 N VAL A 68 12.277 -1.142 -13.251 1.00 0.90 N ATOM 688 CA VAL A 68 12.701 0.076 -13.960 1.00 1.39 C ATOM 689 C VAL A 68 11.860 1.299 -13.553 1.00 1.15 C ATOM 690 O VAL A 68 10.717 1.477 -13.984 1.00 1.17 O ATOM 691 CB VAL A 68 12.750 -0.174 -15.488 1.00 2.13 C ATOM 692 CG1 VAL A 68 11.520 -0.900 -16.054 1.00 4.25 C ATOM 693 CG2 VAL A 68 13.009 1.115 -16.279 1.00 3.29 C ATOM 0 H VAL A 68 11.266 -1.201 -13.128 1.00 0.90 H new ATOM 0 HA VAL A 68 13.718 0.322 -13.656 1.00 1.39 H new ATOM 0 HB VAL A 68 13.596 -0.849 -15.619 1.00 2.13 H new ATOM 0 HG11 VAL A 68 11.639 -1.033 -17.129 1.00 4.25 H new ATOM 0 HG12 VAL A 68 11.421 -1.875 -15.576 1.00 4.25 H new ATOM 0 HG13 VAL A 68 10.626 -0.308 -15.858 1.00 4.25 H new ATOM 0 HG21 VAL A 68 13.035 0.889 -17.345 1.00 3.29 H new ATOM 0 HG22 VAL A 68 12.212 1.831 -16.079 1.00 3.29 H new ATOM 0 HG23 VAL A 68 13.965 1.542 -15.976 1.00 3.29 H new ATOM 703 N LEU A 69 12.459 2.161 -12.726 1.00 1.03 N ATOM 704 CA LEU A 69 11.972 3.479 -12.328 1.00 0.77 C ATOM 705 C LEU A 69 12.467 4.577 -13.290 1.00 0.77 C ATOM 706 O LEU A 69 13.618 4.519 -13.744 1.00 0.96 O ATOM 707 CB LEU A 69 12.484 3.817 -10.911 1.00 0.83 C ATOM 708 CG LEU A 69 11.953 2.932 -9.774 1.00 0.81 C ATOM 709 CD1 LEU A 69 12.661 3.309 -8.471 1.00 1.13 C ATOM 710 CD2 LEU A 69 10.451 3.124 -9.576 1.00 0.60 C ATOM 0 H LEU A 69 13.354 1.940 -12.290 1.00 1.03 H new ATOM 0 HA LEU A 69 10.883 3.447 -12.351 1.00 0.77 H new ATOM 0 HB2 LEU A 69 13.572 3.755 -10.915 1.00 0.83 H new ATOM 0 HB3 LEU A 69 12.225 4.852 -10.690 1.00 0.83 H new ATOM 0 HG LEU A 69 12.145 1.892 -10.038 1.00 0.81 H new ATOM 0 HD11 LEU A 69 12.288 2.684 -7.660 1.00 1.13 H new ATOM 0 HD12 LEU A 69 13.734 3.156 -8.583 1.00 1.13 H new ATOM 0 HD13 LEU A 69 12.466 4.356 -8.241 1.00 1.13 H new ATOM 0 HD21 LEU A 69 10.106 2.484 -8.764 1.00 0.60 H new ATOM 0 HD22 LEU A 69 10.247 4.166 -9.328 1.00 0.60 H new ATOM 0 HD23 LEU A 69 9.926 2.860 -10.494 1.00 0.60 H new ATOM 722 N PRO A 70 11.662 5.632 -13.522 1.00 0.56 N ATOM 723 CA PRO A 70 12.095 6.828 -14.240 1.00 0.54 C ATOM 724 C PRO A 70 12.877 7.814 -13.357 1.00 0.55 C ATOM 725 O PRO A 70 12.707 7.836 -12.138 1.00 0.57 O ATOM 726 CB PRO A 70 10.806 7.437 -14.780 1.00 0.53 C ATOM 727 CG PRO A 70 9.742 7.043 -13.774 1.00 0.47 C ATOM 728 CD PRO A 70 10.263 5.752 -13.130 1.00 0.46 C ATOM 0 HA PRO A 70 12.801 6.581 -15.033 1.00 0.54 H new ATOM 0 HB2 PRO A 70 10.886 8.521 -14.867 1.00 0.53 H new ATOM 0 HB3 PRO A 70 10.573 7.054 -15.773 1.00 0.53 H new ATOM 0 HG2 PRO A 70 9.595 7.824 -13.028 1.00 0.47 H new ATOM 0 HG3 PRO A 70 8.780 6.881 -14.260 1.00 0.47 H new ATOM 0 HD2 PRO A 70 10.166 5.793 -12.045 1.00 0.46 H new ATOM 0 HD3 PRO A 70 9.689 4.890 -13.469 1.00 0.46 H new ATOM 736 N ALA A 71 13.688 8.695 -13.953 1.00 0.63 N ATOM 737 CA ALA A 71 14.430 9.735 -13.226 1.00 0.74 C ATOM 738 C ALA A 71 13.502 10.829 -12.657 1.00 0.67 C ATOM 739 O ALA A 71 13.833 11.467 -11.651 1.00 0.84 O ATOM 740 CB ALA A 71 15.509 10.314 -14.147 1.00 0.93 C ATOM 0 H ALA A 71 13.850 8.708 -14.960 1.00 0.63 H new ATOM 0 HA ALA A 71 14.910 9.282 -12.358 1.00 0.74 H new ATOM 0 HB1 ALA A 71 16.065 11.087 -13.616 1.00 0.93 H new ATOM 0 HB2 ALA A 71 16.192 9.521 -14.451 1.00 0.93 H new ATOM 0 HB3 ALA A 71 15.039 10.747 -15.030 1.00 0.93 H new ATOM 746 N ASN A 72 12.307 10.989 -13.242 1.00 0.54 N ATOM 747 CA ASN A 72 11.213 11.807 -12.708 1.00 0.53 C ATOM 748 C ASN A 72 10.400 11.125 -11.579 1.00 0.48 C ATOM 749 O ASN A 72 9.450 11.717 -11.067 1.00 0.57 O ATOM 750 CB ASN A 72 10.338 12.317 -13.869 1.00 0.54 C ATOM 751 CG ASN A 72 9.778 11.221 -14.757 1.00 0.55 C ATOM 752 OD1 ASN A 72 10.341 10.879 -15.781 1.00 1.31 O ATOM 753 ND2 ASN A 72 8.685 10.595 -14.395 1.00 1.14 N ATOM 0 H ASN A 72 12.069 10.539 -14.126 1.00 0.54 H new ATOM 0 HA ASN A 72 11.660 12.666 -12.207 1.00 0.53 H new ATOM 0 HB2 ASN A 72 9.510 12.894 -13.458 1.00 0.54 H new ATOM 0 HB3 ASN A 72 10.928 12.999 -14.481 1.00 0.54 H new ATOM 0 HD21 ASN A 72 8.319 9.835 -14.968 1.00 1.14 H new ATOM 0 HD22 ASN A 72 8.200 10.868 -13.540 1.00 1.14 H new ATOM 760 N ALA A 73 10.749 9.893 -11.183 1.00 0.44 N ATOM 761 CA ALA A 73 10.230 9.220 -9.983 1.00 0.43 C ATOM 762 C ALA A 73 11.222 9.263 -8.804 1.00 0.49 C ATOM 763 O ALA A 73 12.439 9.367 -8.996 1.00 0.57 O ATOM 764 CB ALA A 73 9.878 7.765 -10.311 1.00 0.43 C ATOM 0 H ALA A 73 11.417 9.322 -11.701 1.00 0.44 H new ATOM 0 HA ALA A 73 9.336 9.761 -9.674 1.00 0.43 H new ATOM 0 HB1 ALA A 73 9.494 7.273 -9.417 1.00 0.43 H new ATOM 0 HB2 ALA A 73 9.118 7.742 -11.092 1.00 0.43 H new ATOM 0 HB3 ALA A 73 10.771 7.244 -10.657 1.00 0.43 H new ATOM 770 N LYS A 74 10.704 9.106 -7.582 1.00 0.53 N ATOM 771 CA LYS A 74 11.464 8.969 -6.325 1.00 0.68 C ATOM 772 C LYS A 74 10.692 8.128 -5.298 1.00 0.58 C ATOM 773 O LYS A 74 9.524 7.803 -5.513 1.00 0.58 O ATOM 774 CB LYS A 74 11.800 10.370 -5.788 1.00 0.90 C ATOM 775 CG LYS A 74 10.593 11.026 -5.110 1.00 0.81 C ATOM 776 CD LYS A 74 10.825 12.535 -5.004 1.00 0.95 C ATOM 777 CE LYS A 74 9.619 13.249 -4.402 1.00 1.26 C ATOM 778 NZ LYS A 74 9.974 14.622 -3.991 1.00 1.81 N ATOM 0 H LYS A 74 9.696 9.069 -7.430 1.00 0.53 H new ATOM 0 HA LYS A 74 12.396 8.437 -6.518 1.00 0.68 H new ATOM 0 HB2 LYS A 74 12.622 10.298 -5.076 1.00 0.90 H new ATOM 0 HB3 LYS A 74 12.143 11.001 -6.608 1.00 0.90 H new ATOM 0 HG2 LYS A 74 9.687 10.826 -5.683 1.00 0.81 H new ATOM 0 HG3 LYS A 74 10.443 10.600 -4.118 1.00 0.81 H new ATOM 0 HD2 LYS A 74 11.705 12.726 -4.390 1.00 0.95 H new ATOM 0 HD3 LYS A 74 11.033 12.942 -5.994 1.00 0.95 H new ATOM 0 HE2 LYS A 74 8.809 13.281 -5.130 1.00 1.26 H new ATOM 0 HE3 LYS A 74 9.252 12.690 -3.541 1.00 1.26 H new ATOM 0 HZ1 LYS A 74 9.139 15.089 -3.584 1.00 1.81 H new ATOM 0 HZ2 LYS A 74 10.732 14.586 -3.280 1.00 1.81 H new ATOM 0 HZ3 LYS A 74 10.302 15.159 -4.819 1.00 1.81 H new ATOM 792 N GLU A 75 11.339 7.796 -4.188 1.00 0.58 N ATOM 793 CA GLU A 75 10.823 6.904 -3.138 1.00 0.57 C ATOM 794 C GLU A 75 10.888 7.582 -1.755 1.00 0.60 C ATOM 795 O GLU A 75 11.825 8.350 -1.499 1.00 0.68 O ATOM 796 CB GLU A 75 11.659 5.616 -3.131 1.00 0.68 C ATOM 797 CG GLU A 75 11.815 4.919 -4.496 1.00 0.64 C ATOM 798 CD GLU A 75 12.927 3.858 -4.417 1.00 0.96 C ATOM 799 OE1 GLU A 75 14.095 4.183 -4.077 1.00 1.51 O ATOM 800 OE2 GLU A 75 12.656 2.643 -4.572 1.00 2.25 O ATOM 0 H GLU A 75 12.273 8.150 -3.979 1.00 0.58 H new ATOM 0 HA GLU A 75 9.779 6.673 -3.347 1.00 0.57 H new ATOM 0 HB2 GLU A 75 12.652 5.850 -2.747 1.00 0.68 H new ATOM 0 HB3 GLU A 75 11.205 4.913 -2.433 1.00 0.68 H new ATOM 0 HG2 GLU A 75 10.874 4.451 -4.785 1.00 0.64 H new ATOM 0 HG3 GLU A 75 12.055 5.654 -5.264 1.00 0.64 H new ATOM 807 N ILE A 76 9.937 7.297 -0.852 1.00 0.60 N ATOM 808 CA ILE A 76 9.863 7.932 0.483 1.00 0.59 C ATOM 809 C ILE A 76 9.552 6.949 1.630 1.00 0.55 C ATOM 810 O ILE A 76 8.583 6.186 1.591 1.00 0.62 O ATOM 811 CB ILE A 76 8.884 9.140 0.494 1.00 0.61 C ATOM 812 CG1 ILE A 76 7.438 8.766 0.091 1.00 0.66 C ATOM 813 CG2 ILE A 76 9.408 10.284 -0.394 1.00 0.77 C ATOM 814 CD1 ILE A 76 6.452 9.943 0.076 1.00 0.75 C ATOM 0 H ILE A 76 9.194 6.619 -1.023 1.00 0.60 H new ATOM 0 HA ILE A 76 10.869 8.305 0.678 1.00 0.59 H new ATOM 0 HB ILE A 76 8.841 9.478 1.529 1.00 0.61 H new ATOM 0 HG12 ILE A 76 7.457 8.313 -0.900 1.00 0.66 H new ATOM 0 HG13 ILE A 76 7.067 8.008 0.781 1.00 0.66 H new ATOM 0 HG21 ILE A 76 8.704 11.116 -0.368 1.00 0.77 H new ATOM 0 HG22 ILE A 76 10.378 10.617 -0.024 1.00 0.77 H new ATOM 0 HG23 ILE A 76 9.513 9.930 -1.419 1.00 0.77 H new ATOM 0 HD11 ILE A 76 5.465 9.587 -0.218 1.00 0.75 H new ATOM 0 HD12 ILE A 76 6.397 10.385 1.071 1.00 0.75 H new ATOM 0 HD13 ILE A 76 6.793 10.694 -0.636 1.00 0.75 H new ATOM 826 N ALA A 77 10.348 7.014 2.702 1.00 0.63 N ATOM 827 CA ALA A 77 10.071 6.322 3.965 1.00 0.58 C ATOM 828 C ALA A 77 9.251 7.207 4.935 1.00 0.51 C ATOM 829 O ALA A 77 9.284 8.436 4.852 1.00 0.59 O ATOM 830 CB ALA A 77 11.376 5.800 4.577 1.00 0.63 C ATOM 0 H ALA A 77 11.213 7.555 2.717 1.00 0.63 H new ATOM 0 HA ALA A 77 9.442 5.455 3.762 1.00 0.58 H new ATOM 0 HB1 ALA A 77 11.159 5.288 5.514 1.00 0.63 H new ATOM 0 HB2 ALA A 77 11.850 5.104 3.885 1.00 0.63 H new ATOM 0 HB3 ALA A 77 12.048 6.636 4.768 1.00 0.63 H new ATOM 836 N GLY A 78 8.535 6.598 5.883 1.00 0.46 N ATOM 837 CA GLY A 78 7.763 7.313 6.907 1.00 0.48 C ATOM 838 C GLY A 78 6.303 7.635 6.551 1.00 0.52 C ATOM 839 O GLY A 78 5.710 8.483 7.217 1.00 0.62 O ATOM 0 H GLY A 78 8.473 5.583 5.964 1.00 0.46 H new ATOM 0 HA2 GLY A 78 7.770 6.718 7.820 1.00 0.48 H new ATOM 0 HA3 GLY A 78 8.275 8.248 7.132 1.00 0.48 H new ATOM 843 N VAL A 79 5.707 7.011 5.527 1.00 0.52 N ATOM 844 CA VAL A 79 4.247 7.061 5.274 1.00 0.50 C ATOM 845 C VAL A 79 3.571 5.901 6.008 1.00 0.37 C ATOM 846 O VAL A 79 4.166 4.833 6.118 1.00 0.34 O ATOM 847 CB VAL A 79 3.903 7.047 3.769 1.00 0.65 C ATOM 848 CG1 VAL A 79 4.380 5.805 3.014 1.00 0.94 C ATOM 849 CG2 VAL A 79 2.400 7.205 3.539 1.00 0.54 C ATOM 0 H VAL A 79 6.219 6.453 4.844 1.00 0.52 H new ATOM 0 HA VAL A 79 3.868 8.008 5.658 1.00 0.50 H new ATOM 0 HB VAL A 79 4.450 7.899 3.366 1.00 0.65 H new ATOM 0 HG11 VAL A 79 4.093 5.884 1.965 1.00 0.94 H new ATOM 0 HG12 VAL A 79 5.465 5.728 3.089 1.00 0.94 H new ATOM 0 HG13 VAL A 79 3.922 4.917 3.449 1.00 0.94 H new ATOM 0 HG21 VAL A 79 2.192 7.191 2.469 1.00 0.54 H new ATOM 0 HG22 VAL A 79 1.870 6.385 4.022 1.00 0.54 H new ATOM 0 HG23 VAL A 79 2.065 8.152 3.961 1.00 0.54 H new ATOM 859 N MET A 80 2.347 6.102 6.505 1.00 0.36 N ATOM 860 CA MET A 80 1.521 5.066 7.136 1.00 0.34 C ATOM 861 C MET A 80 0.426 4.558 6.192 1.00 0.33 C ATOM 862 O MET A 80 -0.261 5.344 5.537 1.00 0.37 O ATOM 863 CB MET A 80 0.923 5.623 8.441 1.00 0.37 C ATOM 864 CG MET A 80 -0.063 4.678 9.139 1.00 0.39 C ATOM 865 SD MET A 80 0.591 3.032 9.529 1.00 0.45 S ATOM 866 CE MET A 80 0.415 3.030 11.328 1.00 0.39 C ATOM 0 H MET A 80 1.890 7.014 6.479 1.00 0.36 H new ATOM 0 HA MET A 80 2.151 4.207 7.368 1.00 0.34 H new ATOM 0 HB2 MET A 80 1.736 5.854 9.130 1.00 0.37 H new ATOM 0 HB3 MET A 80 0.415 6.562 8.222 1.00 0.37 H new ATOM 0 HG2 MET A 80 -0.398 5.147 10.064 1.00 0.39 H new ATOM 0 HG3 MET A 80 -0.941 4.562 8.504 1.00 0.39 H new ATOM 0 HE1 MET A 80 0.855 2.120 11.736 1.00 0.39 H new ATOM 0 HE2 MET A 80 0.926 3.898 11.744 1.00 0.39 H new ATOM 0 HE3 MET A 80 -0.642 3.070 11.590 1.00 0.39 H new ATOM 876 N PHE A 81 0.214 3.242 6.173 1.00 0.31 N ATOM 877 CA PHE A 81 -0.918 2.606 5.496 1.00 0.31 C ATOM 878 C PHE A 81 -1.522 1.448 6.303 1.00 0.29 C ATOM 879 O PHE A 81 -0.855 0.786 7.103 1.00 0.31 O ATOM 880 CB PHE A 81 -0.554 2.181 4.059 1.00 0.34 C ATOM 881 CG PHE A 81 0.904 1.869 3.834 1.00 0.38 C ATOM 882 CD1 PHE A 81 1.447 0.745 4.469 1.00 1.59 C ATOM 883 CD2 PHE A 81 1.720 2.703 3.041 1.00 1.58 C ATOM 884 CE1 PHE A 81 2.801 0.446 4.311 1.00 1.59 C ATOM 885 CE2 PHE A 81 3.062 2.349 2.821 1.00 1.74 C ATOM 886 CZ PHE A 81 3.600 1.216 3.456 1.00 0.86 C ATOM 0 H PHE A 81 0.834 2.576 6.635 1.00 0.31 H new ATOM 0 HA PHE A 81 -1.700 3.362 5.425 1.00 0.31 H new ATOM 0 HB2 PHE A 81 -1.142 1.302 3.797 1.00 0.34 H new ATOM 0 HB3 PHE A 81 -0.849 2.977 3.376 1.00 0.34 H new ATOM 0 HD1 PHE A 81 0.820 0.112 5.079 1.00 1.59 H new ATOM 0 HD2 PHE A 81 1.317 3.606 2.607 1.00 1.58 H new ATOM 0 HE1 PHE A 81 3.235 -0.383 4.850 1.00 1.59 H new ATOM 0 HE2 PHE A 81 3.679 2.946 2.166 1.00 1.74 H new ATOM 0 HZ PHE A 81 4.630 0.939 3.285 1.00 0.86 H new ATOM 896 N VAL A 82 -2.808 1.204 6.050 1.00 0.29 N ATOM 897 CA VAL A 82 -3.647 0.160 6.660 1.00 0.27 C ATOM 898 C VAL A 82 -4.144 -0.799 5.556 1.00 0.26 C ATOM 899 O VAL A 82 -4.410 -0.357 4.434 1.00 0.26 O ATOM 900 CB VAL A 82 -4.829 0.782 7.438 1.00 0.28 C ATOM 901 CG1 VAL A 82 -4.392 1.912 8.385 1.00 0.33 C ATOM 902 CG2 VAL A 82 -5.903 1.376 6.525 1.00 0.26 C ATOM 0 H VAL A 82 -3.328 1.762 5.373 1.00 0.29 H new ATOM 0 HA VAL A 82 -3.053 -0.404 7.379 1.00 0.27 H new ATOM 0 HB VAL A 82 -5.233 -0.058 8.003 1.00 0.28 H new ATOM 0 HG11 VAL A 82 -5.264 2.310 8.904 1.00 0.33 H new ATOM 0 HG12 VAL A 82 -3.683 1.521 9.115 1.00 0.33 H new ATOM 0 HG13 VAL A 82 -3.919 2.707 7.809 1.00 0.33 H new ATOM 0 HG21 VAL A 82 -6.705 1.796 7.132 1.00 0.26 H new ATOM 0 HG22 VAL A 82 -5.464 2.161 5.910 1.00 0.26 H new ATOM 0 HG23 VAL A 82 -6.307 0.594 5.882 1.00 0.26 H new ATOM 912 N TRP A 83 -4.308 -2.092 5.846 1.00 0.25 N ATOM 913 CA TRP A 83 -4.982 -3.049 4.957 1.00 0.23 C ATOM 914 C TRP A 83 -6.503 -3.082 5.195 1.00 0.23 C ATOM 915 O TRP A 83 -7.001 -2.919 6.310 1.00 0.25 O ATOM 916 CB TRP A 83 -4.363 -4.450 5.081 1.00 0.23 C ATOM 917 CG TRP A 83 -3.186 -4.748 4.192 1.00 0.24 C ATOM 918 CD1 TRP A 83 -2.023 -4.055 4.130 1.00 0.27 C ATOM 919 CD2 TRP A 83 -3.049 -5.834 3.217 1.00 0.25 C ATOM 920 NE1 TRP A 83 -1.185 -4.635 3.194 1.00 0.29 N ATOM 921 CE2 TRP A 83 -1.770 -5.728 2.588 1.00 0.27 C ATOM 922 CE3 TRP A 83 -3.877 -6.900 2.800 1.00 0.27 C ATOM 923 CZ2 TRP A 83 -1.344 -6.624 1.591 1.00 0.30 C ATOM 924 CZ3 TRP A 83 -3.452 -7.816 1.818 1.00 0.28 C ATOM 925 CH2 TRP A 83 -2.189 -7.682 1.213 1.00 0.30 C ATOM 0 H TRP A 83 -3.974 -2.511 6.714 1.00 0.25 H new ATOM 0 HA TRP A 83 -4.828 -2.706 3.934 1.00 0.23 H new ATOM 0 HB2 TRP A 83 -4.053 -4.595 6.116 1.00 0.23 H new ATOM 0 HB3 TRP A 83 -5.141 -5.185 4.875 1.00 0.23 H new ATOM 0 HD1 TRP A 83 -1.786 -3.183 4.721 1.00 0.27 H new ATOM 0 HE1 TRP A 83 -0.248 -4.295 2.978 1.00 0.29 H new ATOM 0 HE3 TRP A 83 -4.855 -7.015 3.243 1.00 0.27 H new ATOM 0 HZ2 TRP A 83 -0.379 -6.501 1.121 1.00 0.30 H new ATOM 0 HZ3 TRP A 83 -4.101 -8.628 1.527 1.00 0.28 H new ATOM 0 HH2 TRP A 83 -1.870 -8.389 0.461 1.00 0.30 H new ATOM 936 N THR A 84 -7.249 -3.322 4.118 1.00 0.24 N ATOM 937 CA THR A 84 -8.715 -3.342 4.063 1.00 0.24 C ATOM 938 C THR A 84 -9.243 -4.452 3.145 1.00 0.24 C ATOM 939 O THR A 84 -8.487 -5.136 2.452 1.00 0.27 O ATOM 940 CB THR A 84 -9.273 -1.996 3.547 1.00 0.28 C ATOM 941 OG1 THR A 84 -8.564 -1.603 2.406 1.00 0.40 O ATOM 942 CG2 THR A 84 -9.201 -0.822 4.513 1.00 0.28 C ATOM 0 H THR A 84 -6.827 -3.519 3.210 1.00 0.24 H new ATOM 0 HA THR A 84 -9.050 -3.526 5.084 1.00 0.24 H new ATOM 0 HB THR A 84 -10.328 -2.205 3.370 1.00 0.28 H new ATOM 0 HG1 THR A 84 -8.664 -0.637 2.275 1.00 0.40 H new ATOM 0 HG21 THR A 84 -9.621 0.065 4.039 1.00 0.28 H new ATOM 0 HG22 THR A 84 -9.769 -1.056 5.413 1.00 0.28 H new ATOM 0 HG23 THR A 84 -8.161 -0.633 4.779 1.00 0.28 H new ATOM 950 N ASN A 85 -10.562 -4.634 3.132 1.00 0.35 N ATOM 951 CA ASN A 85 -11.294 -5.514 2.224 1.00 0.37 C ATOM 952 C ASN A 85 -11.958 -4.768 1.052 1.00 0.41 C ATOM 953 O ASN A 85 -11.881 -3.543 0.952 1.00 0.45 O ATOM 954 CB ASN A 85 -12.267 -6.362 3.055 1.00 0.46 C ATOM 955 CG ASN A 85 -12.090 -7.831 2.739 1.00 0.70 C ATOM 956 OD1 ASN A 85 -12.902 -8.470 2.085 1.00 1.81 O ATOM 957 ND2 ASN A 85 -10.966 -8.378 3.129 1.00 0.66 N ATOM 0 H ASN A 85 -11.178 -4.149 3.785 1.00 0.35 H new ATOM 0 HA ASN A 85 -10.591 -6.180 1.723 1.00 0.37 H new ATOM 0 HB2 ASN A 85 -12.094 -6.189 4.117 1.00 0.46 H new ATOM 0 HB3 ASN A 85 -13.293 -6.060 2.845 1.00 0.46 H new ATOM 0 HD21 ASN A 85 -10.760 -9.347 2.888 1.00 0.66 H new ATOM 0 HD22 ASN A 85 -10.297 -7.835 3.674 1.00 0.66 H new ATOM 964 N THR A 86 -12.606 -5.506 0.148 1.00 0.51 N ATOM 965 CA THR A 86 -13.142 -4.970 -1.119 1.00 0.55 C ATOM 966 C THR A 86 -14.315 -4.006 -0.939 1.00 0.57 C ATOM 967 O THR A 86 -14.562 -3.165 -1.800 1.00 0.73 O ATOM 968 CB THR A 86 -13.540 -6.113 -2.065 1.00 0.75 C ATOM 969 OG1 THR A 86 -14.420 -7.012 -1.428 1.00 1.41 O ATOM 970 CG2 THR A 86 -12.322 -6.941 -2.445 1.00 1.06 C ATOM 0 H THR A 86 -12.779 -6.504 0.270 1.00 0.51 H new ATOM 0 HA THR A 86 -12.332 -4.388 -1.559 1.00 0.55 H new ATOM 0 HB THR A 86 -14.003 -5.647 -2.935 1.00 0.75 H new ATOM 0 HG1 THR A 86 -14.661 -7.730 -2.050 1.00 1.41 H new ATOM 0 HG21 THR A 86 -12.624 -7.746 -3.115 1.00 1.06 H new ATOM 0 HG22 THR A 86 -11.592 -6.306 -2.946 1.00 1.06 H new ATOM 0 HG23 THR A 86 -11.876 -7.366 -1.546 1.00 1.06 H new ATOM 978 N ASN A 87 -14.986 -4.077 0.210 1.00 0.57 N ATOM 979 CA ASN A 87 -15.994 -3.110 0.675 1.00 0.68 C ATOM 980 C ASN A 87 -15.418 -2.073 1.667 1.00 0.48 C ATOM 981 O ASN A 87 -16.140 -1.508 2.490 1.00 0.50 O ATOM 982 CB ASN A 87 -17.242 -3.860 1.172 1.00 1.06 C ATOM 983 CG ASN A 87 -18.006 -4.537 0.043 1.00 1.61 C ATOM 984 OD1 ASN A 87 -17.977 -4.130 -1.118 1.00 2.12 O ATOM 985 ND2 ASN A 87 -18.702 -5.609 0.324 1.00 2.06 N ATOM 0 H ASN A 87 -14.840 -4.838 0.873 1.00 0.57 H new ATOM 0 HA ASN A 87 -16.313 -2.495 -0.167 1.00 0.68 H new ATOM 0 HB2 ASN A 87 -16.943 -4.610 1.904 1.00 1.06 H new ATOM 0 HB3 ASN A 87 -17.902 -3.160 1.684 1.00 1.06 H new ATOM 0 HD21 ASN A 87 -19.211 -6.095 -0.415 1.00 2.06 H new ATOM 0 HD22 ASN A 87 -18.736 -5.959 1.282 1.00 2.06 H new ATOM 992 N ASN A 88 -14.108 -1.810 1.566 1.00 0.41 N ATOM 993 CA ASN A 88 -13.365 -0.734 2.231 1.00 0.39 C ATOM 994 C ASN A 88 -13.369 -0.816 3.769 1.00 0.39 C ATOM 995 O ASN A 88 -13.205 0.192 4.454 1.00 0.43 O ATOM 996 CB ASN A 88 -13.772 0.647 1.666 1.00 0.42 C ATOM 997 CG ASN A 88 -14.283 0.626 0.236 1.00 0.45 C ATOM 998 OD1 ASN A 88 -15.479 0.593 -0.028 1.00 0.56 O ATOM 999 ND2 ASN A 88 -13.397 0.597 -0.723 1.00 0.40 N ATOM 0 H ASN A 88 -13.501 -2.381 0.979 1.00 0.41 H new ATOM 0 HA ASN A 88 -12.313 -0.879 1.986 1.00 0.39 H new ATOM 0 HB2 ASN A 88 -14.545 1.072 2.307 1.00 0.42 H new ATOM 0 HB3 ASN A 88 -12.911 1.313 1.719 1.00 0.42 H new ATOM 0 HD21 ASN A 88 -13.700 0.547 -1.696 1.00 0.40 H new ATOM 0 HD22 ASN A 88 -12.402 0.625 -0.499 1.00 0.40 H new ATOM 1006 N GLU A 89 -13.573 -2.010 4.328 1.00 0.39 N ATOM 1007 CA GLU A 89 -13.516 -2.262 5.773 1.00 0.39 C ATOM 1008 C GLU A 89 -12.082 -2.507 6.232 1.00 0.35 C ATOM 1009 O GLU A 89 -11.344 -3.217 5.550 1.00 0.33 O ATOM 1010 CB GLU A 89 -14.376 -3.475 6.158 1.00 0.45 C ATOM 1011 CG GLU A 89 -15.826 -3.049 6.441 1.00 0.58 C ATOM 1012 CD GLU A 89 -16.649 -4.149 7.123 1.00 1.00 C ATOM 1013 OE1 GLU A 89 -16.902 -5.214 6.508 1.00 1.62 O ATOM 1014 OE2 GLU A 89 -17.055 -3.939 8.297 1.00 2.55 O ATOM 0 H GLU A 89 -13.786 -2.845 3.782 1.00 0.39 H new ATOM 0 HA GLU A 89 -13.906 -1.372 6.268 1.00 0.39 H new ATOM 0 HB2 GLU A 89 -14.359 -4.209 5.352 1.00 0.45 H new ATOM 0 HB3 GLU A 89 -13.956 -3.959 7.040 1.00 0.45 H new ATOM 0 HG2 GLU A 89 -15.822 -2.161 7.073 1.00 0.58 H new ATOM 0 HG3 GLU A 89 -16.307 -2.771 5.503 1.00 0.58 H new ATOM 1021 N ILE A 90 -11.705 -1.979 7.400 1.00 0.37 N ATOM 1022 CA ILE A 90 -10.379 -2.193 7.991 1.00 0.35 C ATOM 1023 C ILE A 90 -10.323 -3.591 8.607 1.00 0.34 C ATOM 1024 O ILE A 90 -11.164 -3.950 9.433 1.00 0.38 O ATOM 1025 CB ILE A 90 -9.992 -1.114 9.024 1.00 0.40 C ATOM 1026 CG1 ILE A 90 -10.315 0.293 8.486 1.00 0.43 C ATOM 1027 CG2 ILE A 90 -8.489 -1.252 9.357 1.00 0.42 C ATOM 1028 CD1 ILE A 90 -9.852 1.415 9.409 1.00 0.50 C ATOM 0 H ILE A 90 -12.314 -1.388 7.966 1.00 0.37 H new ATOM 0 HA ILE A 90 -9.643 -2.110 7.191 1.00 0.35 H new ATOM 0 HB ILE A 90 -10.573 -1.256 9.935 1.00 0.40 H new ATOM 0 HG12 ILE A 90 -9.845 0.418 7.511 1.00 0.43 H new ATOM 0 HG13 ILE A 90 -11.391 0.378 8.334 1.00 0.43 H new ATOM 0 HG21 ILE A 90 -8.207 -0.493 10.087 1.00 0.42 H new ATOM 0 HG22 ILE A 90 -8.297 -2.242 9.771 1.00 0.42 H new ATOM 0 HG23 ILE A 90 -7.901 -1.118 8.449 1.00 0.42 H new ATOM 0 HD11 ILE A 90 -10.111 2.378 8.969 1.00 0.50 H new ATOM 0 HD12 ILE A 90 -10.342 1.315 10.378 1.00 0.50 H new ATOM 0 HD13 ILE A 90 -8.772 1.355 9.541 1.00 0.50 H new ATOM 1040 N ILE A 91 -9.322 -4.368 8.206 1.00 0.31 N ATOM 1041 CA ILE A 91 -9.135 -5.764 8.623 1.00 0.33 C ATOM 1042 C ILE A 91 -7.833 -6.031 9.401 1.00 0.31 C ATOM 1043 O ILE A 91 -6.850 -5.293 9.314 1.00 0.28 O ATOM 1044 CB ILE A 91 -9.298 -6.720 7.419 1.00 0.37 C ATOM 1045 CG1 ILE A 91 -8.181 -6.586 6.360 1.00 0.33 C ATOM 1046 CG2 ILE A 91 -10.635 -6.476 6.712 1.00 0.51 C ATOM 1047 CD1 ILE A 91 -7.866 -7.925 5.690 1.00 0.59 C ATOM 0 H ILE A 91 -8.598 -4.042 7.566 1.00 0.31 H new ATOM 0 HA ILE A 91 -9.927 -5.969 9.343 1.00 0.33 H new ATOM 0 HB ILE A 91 -9.247 -7.722 7.846 1.00 0.37 H new ATOM 0 HG12 ILE A 91 -8.484 -5.863 5.602 1.00 0.33 H new ATOM 0 HG13 ILE A 91 -7.279 -6.195 6.831 1.00 0.33 H new ATOM 0 HG21 ILE A 91 -10.730 -7.159 5.868 1.00 0.51 H new ATOM 0 HG22 ILE A 91 -11.453 -6.648 7.411 1.00 0.51 H new ATOM 0 HG23 ILE A 91 -10.674 -5.448 6.353 1.00 0.51 H new ATOM 0 HD11 ILE A 91 -7.076 -7.786 4.953 1.00 0.59 H new ATOM 0 HD12 ILE A 91 -7.537 -8.641 6.444 1.00 0.59 H new ATOM 0 HD13 ILE A 91 -8.761 -8.304 5.196 1.00 0.59 H new ATOM 1059 N ASP A 92 -7.839 -7.106 10.187 1.00 0.40 N ATOM 1060 CA ASP A 92 -6.652 -7.704 10.815 1.00 0.45 C ATOM 1061 C ASP A 92 -5.956 -8.688 9.845 1.00 0.45 C ATOM 1062 O ASP A 92 -6.530 -9.132 8.852 1.00 0.45 O ATOM 1063 CB ASP A 92 -7.058 -8.373 12.143 1.00 0.50 C ATOM 1064 CG ASP A 92 -5.880 -8.847 13.008 1.00 0.58 C ATOM 1065 OD1 ASP A 92 -4.725 -8.413 12.795 1.00 1.44 O ATOM 1066 OD2 ASP A 92 -6.108 -9.683 13.909 1.00 1.32 O ATOM 0 H ASP A 92 -8.699 -7.606 10.415 1.00 0.40 H new ATOM 0 HA ASP A 92 -5.923 -6.926 11.041 1.00 0.45 H new ATOM 0 HB2 ASP A 92 -7.656 -7.669 12.721 1.00 0.50 H new ATOM 0 HB3 ASP A 92 -7.697 -9.228 11.923 1.00 0.50 H new ATOM 1071 N GLU A 93 -4.719 -9.076 10.152 1.00 0.48 N ATOM 1072 CA GLU A 93 -3.800 -9.901 9.348 1.00 0.44 C ATOM 1073 C GLU A 93 -4.246 -11.359 9.097 1.00 0.47 C ATOM 1074 O GLU A 93 -3.515 -12.121 8.467 1.00 0.51 O ATOM 1075 CB GLU A 93 -2.412 -9.835 10.011 1.00 0.57 C ATOM 1076 CG GLU A 93 -2.326 -10.622 11.327 1.00 0.76 C ATOM 1077 CD GLU A 93 -1.473 -9.898 12.378 1.00 1.55 C ATOM 1078 OE1 GLU A 93 -0.323 -9.471 12.117 1.00 1.75 O ATOM 1079 OE2 GLU A 93 -1.959 -9.685 13.511 1.00 3.05 O ATOM 0 H GLU A 93 -4.294 -8.803 11.038 1.00 0.48 H new ATOM 0 HA GLU A 93 -3.787 -9.480 8.343 1.00 0.44 H new ATOM 0 HB2 GLU A 93 -1.667 -10.222 9.316 1.00 0.57 H new ATOM 0 HB3 GLU A 93 -2.158 -8.792 10.203 1.00 0.57 H new ATOM 0 HG2 GLU A 93 -3.330 -10.779 11.721 1.00 0.76 H new ATOM 0 HG3 GLU A 93 -1.902 -11.607 11.133 1.00 0.76 H new ATOM 1086 N ASN A 94 -5.442 -11.732 9.573 1.00 0.74 N ATOM 1087 CA ASN A 94 -6.148 -12.996 9.330 1.00 0.87 C ATOM 1088 C ASN A 94 -7.509 -12.837 8.595 1.00 0.85 C ATOM 1089 O ASN A 94 -8.170 -13.834 8.286 1.00 1.03 O ATOM 1090 CB ASN A 94 -6.317 -13.747 10.653 1.00 0.99 C ATOM 1091 CG ASN A 94 -7.072 -12.879 11.620 1.00 1.73 C ATOM 1092 OD1 ASN A 94 -8.270 -12.665 11.505 1.00 2.98 O ATOM 1093 ND2 ASN A 94 -6.362 -12.261 12.516 1.00 1.52 N ATOM 0 H ASN A 94 -5.979 -11.114 10.181 1.00 0.74 H new ATOM 0 HA ASN A 94 -5.528 -13.576 8.646 1.00 0.87 H new ATOM 0 HB2 ASN A 94 -6.854 -14.681 10.489 1.00 0.99 H new ATOM 0 HB3 ASN A 94 -5.342 -14.008 11.064 1.00 0.99 H new ATOM 0 HD21 ASN A 94 -6.803 -11.584 13.138 1.00 1.52 H new ATOM 0 HD22 ASN A 94 -5.363 -12.453 12.597 1.00 1.52 H new ATOM 1100 N GLY A 95 -7.944 -11.598 8.320 1.00 0.71 N ATOM 1101 CA GLY A 95 -9.197 -11.271 7.623 1.00 0.71 C ATOM 1102 C GLY A 95 -10.409 -10.942 8.511 1.00 0.73 C ATOM 1103 O GLY A 95 -11.502 -10.745 7.980 1.00 0.81 O ATOM 0 H GLY A 95 -7.415 -10.768 8.586 1.00 0.71 H new ATOM 0 HA2 GLY A 95 -9.012 -10.419 6.969 1.00 0.71 H new ATOM 0 HA3 GLY A 95 -9.461 -12.113 6.983 1.00 0.71 H new ATOM 1107 N GLN A 96 -10.263 -10.849 9.838 1.00 0.74 N ATOM 1108 CA GLN A 96 -11.326 -10.336 10.712 1.00 0.81 C ATOM 1109 C GLN A 96 -11.476 -8.819 10.540 1.00 0.66 C ATOM 1110 O GLN A 96 -10.482 -8.100 10.465 1.00 0.52 O ATOM 1111 CB GLN A 96 -11.073 -10.741 12.173 1.00 0.95 C ATOM 1112 CG GLN A 96 -12.166 -10.184 13.107 1.00 1.12 C ATOM 1113 CD GLN A 96 -12.335 -10.972 14.401 1.00 1.50 C ATOM 1114 OE1 GLN A 96 -11.454 -11.689 14.859 1.00 2.05 O ATOM 1115 NE2 GLN A 96 -13.483 -10.881 15.028 1.00 2.05 N ATOM 0 H GLN A 96 -9.414 -11.124 10.333 1.00 0.74 H new ATOM 0 HA GLN A 96 -12.274 -10.787 10.420 1.00 0.81 H new ATOM 0 HB2 GLN A 96 -11.044 -11.828 12.251 1.00 0.95 H new ATOM 0 HB3 GLN A 96 -10.098 -10.372 12.491 1.00 0.95 H new ATOM 0 HG2 GLN A 96 -11.927 -9.149 13.352 1.00 1.12 H new ATOM 0 HG3 GLN A 96 -13.116 -10.174 12.573 1.00 1.12 H new ATOM 0 HE21 GLN A 96 -14.223 -10.286 14.654 1.00 2.05 H new ATOM 0 HE22 GLN A 96 -13.636 -11.405 15.890 1.00 2.05 H new ATOM 1124 N THR A 97 -12.713 -8.328 10.477 1.00 0.75 N ATOM 1125 CA THR A 97 -13.039 -6.919 10.222 1.00 0.68 C ATOM 1126 C THR A 97 -13.287 -6.149 11.528 1.00 0.67 C ATOM 1127 O THR A 97 -13.991 -6.634 12.417 1.00 0.91 O ATOM 1128 CB THR A 97 -14.191 -6.790 9.212 1.00 0.80 C ATOM 1129 OG1 THR A 97 -15.445 -7.162 9.750 1.00 0.99 O ATOM 1130 CG2 THR A 97 -14.006 -7.644 7.952 1.00 0.84 C ATOM 0 H THR A 97 -13.540 -8.911 10.605 1.00 0.75 H new ATOM 0 HA THR A 97 -12.172 -6.448 9.760 1.00 0.68 H new ATOM 0 HB THR A 97 -14.171 -5.730 8.959 1.00 0.80 H new ATOM 0 HG1 THR A 97 -16.138 -7.058 9.065 1.00 0.99 H new ATOM 0 HG21 THR A 97 -14.858 -7.501 7.287 1.00 0.84 H new ATOM 0 HG22 THR A 97 -13.092 -7.344 7.440 1.00 0.84 H new ATOM 0 HG23 THR A 97 -13.937 -8.695 8.232 1.00 0.84 H new ATOM 1138 N LEU A 98 -12.708 -4.953 11.662 1.00 0.48 N ATOM 1139 CA LEU A 98 -12.621 -4.194 12.926 1.00 0.46 C ATOM 1140 C LEU A 98 -13.831 -3.293 13.245 1.00 0.50 C ATOM 1141 O LEU A 98 -13.822 -2.615 14.273 1.00 0.62 O ATOM 1142 CB LEU A 98 -11.312 -3.368 12.927 1.00 0.41 C ATOM 1143 CG LEU A 98 -10.008 -4.102 13.287 1.00 0.42 C ATOM 1144 CD1 LEU A 98 -9.971 -4.602 14.727 1.00 0.51 C ATOM 1145 CD2 LEU A 98 -9.669 -5.275 12.373 1.00 0.40 C ATOM 0 H LEU A 98 -12.273 -4.467 10.877 1.00 0.48 H new ATOM 0 HA LEU A 98 -12.624 -4.937 13.723 1.00 0.46 H new ATOM 0 HB2 LEU A 98 -11.189 -2.931 11.936 1.00 0.41 H new ATOM 0 HB3 LEU A 98 -11.437 -2.541 13.626 1.00 0.41 H new ATOM 0 HG LEU A 98 -9.256 -3.326 13.148 1.00 0.42 H new ATOM 0 HD11 LEU A 98 -9.024 -5.109 14.912 1.00 0.51 H new ATOM 0 HD12 LEU A 98 -10.069 -3.757 15.408 1.00 0.51 H new ATOM 0 HD13 LEU A 98 -10.794 -5.298 14.892 1.00 0.51 H new ATOM 0 HD21 LEU A 98 -8.735 -5.733 12.700 1.00 0.40 H new ATOM 0 HD22 LEU A 98 -10.470 -6.013 12.416 1.00 0.40 H new ATOM 0 HD23 LEU A 98 -9.559 -4.918 11.349 1.00 0.40 H new ATOM 1157 N GLY A 99 -14.845 -3.236 12.382 1.00 0.51 N ATOM 1158 CA GLY A 99 -16.013 -2.362 12.546 1.00 0.60 C ATOM 1159 C GLY A 99 -15.795 -0.931 12.040 1.00 0.61 C ATOM 1160 O GLY A 99 -16.567 -0.031 12.371 1.00 0.72 O ATOM 0 H GLY A 99 -14.881 -3.803 11.535 1.00 0.51 H new ATOM 0 HA2 GLY A 99 -16.859 -2.799 12.016 1.00 0.60 H new ATOM 0 HA3 GLY A 99 -16.282 -2.326 13.602 1.00 0.60 H new ATOM 1164 N VAL A 100 -14.749 -0.696 11.239 1.00 0.57 N ATOM 1165 CA VAL A 100 -14.408 0.615 10.659 1.00 0.59 C ATOM 1166 C VAL A 100 -14.302 0.483 9.140 1.00 0.51 C ATOM 1167 O VAL A 100 -13.898 -0.566 8.627 1.00 0.43 O ATOM 1168 CB VAL A 100 -13.121 1.203 11.275 1.00 0.63 C ATOM 1169 CG1 VAL A 100 -12.845 2.632 10.778 1.00 1.10 C ATOM 1170 CG2 VAL A 100 -13.191 1.269 12.808 1.00 1.09 C ATOM 0 H VAL A 100 -14.096 -1.431 10.967 1.00 0.57 H new ATOM 0 HA VAL A 100 -15.204 1.320 10.897 1.00 0.59 H new ATOM 0 HB VAL A 100 -12.324 0.530 10.961 1.00 0.63 H new ATOM 0 HG11 VAL A 100 -11.930 3.006 11.237 1.00 1.10 H new ATOM 0 HG12 VAL A 100 -12.730 2.624 9.694 1.00 1.10 H new ATOM 0 HG13 VAL A 100 -13.679 3.279 11.050 1.00 1.10 H new ATOM 0 HG21 VAL A 100 -12.263 1.689 13.197 1.00 1.09 H new ATOM 0 HG22 VAL A 100 -14.028 1.899 13.107 1.00 1.09 H new ATOM 0 HG23 VAL A 100 -13.331 0.265 13.209 1.00 1.09 H new ATOM 1180 N ASN A 101 -14.668 1.540 8.423 1.00 0.56 N ATOM 1181 CA ASN A 101 -14.714 1.669 6.989 1.00 0.50 C ATOM 1182 C ASN A 101 -14.063 2.999 6.554 1.00 0.49 C ATOM 1183 O ASN A 101 -13.942 3.927 7.359 1.00 0.55 O ATOM 1184 CB ASN A 101 -16.206 1.580 6.647 1.00 0.58 C ATOM 1185 CG ASN A 101 -16.503 1.996 5.240 1.00 0.82 C ATOM 1186 OD1 ASN A 101 -17.008 3.077 4.973 1.00 1.33 O ATOM 1187 ND2 ASN A 101 -16.135 1.197 4.286 1.00 0.76 N ATOM 0 H ASN A 101 -14.965 2.401 8.882 1.00 0.56 H new ATOM 0 HA ASN A 101 -14.154 0.898 6.460 1.00 0.50 H new ATOM 0 HB2 ASN A 101 -16.549 0.556 6.799 1.00 0.58 H new ATOM 0 HB3 ASN A 101 -16.770 2.210 7.334 1.00 0.58 H new ATOM 0 HD21 ASN A 101 -16.267 1.471 3.312 1.00 0.76 H new ATOM 0 HD22 ASN A 101 -15.714 0.295 4.510 1.00 0.76 H new ATOM 1194 N ILE A 102 -13.619 3.067 5.295 1.00 0.45 N ATOM 1195 CA ILE A 102 -12.875 4.201 4.724 1.00 0.45 C ATOM 1196 C ILE A 102 -13.410 4.547 3.323 1.00 0.46 C ATOM 1197 O ILE A 102 -13.584 3.659 2.489 1.00 0.49 O ATOM 1198 CB ILE A 102 -11.351 3.907 4.695 1.00 0.42 C ATOM 1199 CG1 ILE A 102 -10.790 3.489 6.077 1.00 0.43 C ATOM 1200 CG2 ILE A 102 -10.618 5.171 4.214 1.00 0.44 C ATOM 1201 CD1 ILE A 102 -9.362 2.922 6.052 1.00 0.43 C ATOM 0 H ILE A 102 -13.770 2.314 4.623 1.00 0.45 H new ATOM 0 HA ILE A 102 -13.027 5.070 5.364 1.00 0.45 H new ATOM 0 HB ILE A 102 -11.189 3.068 4.018 1.00 0.42 H new ATOM 0 HG12 ILE A 102 -10.809 4.356 6.738 1.00 0.43 H new ATOM 0 HG13 ILE A 102 -11.454 2.742 6.511 1.00 0.43 H new ATOM 0 HG21 ILE A 102 -9.545 4.982 4.188 1.00 0.44 H new ATOM 0 HG22 ILE A 102 -10.965 5.434 3.215 1.00 0.44 H new ATOM 0 HG23 ILE A 102 -10.824 5.994 4.898 1.00 0.44 H new ATOM 0 HD11 ILE A 102 -9.057 2.658 7.065 1.00 0.43 H new ATOM 0 HD12 ILE A 102 -9.334 2.033 5.422 1.00 0.43 H new ATOM 0 HD13 ILE A 102 -8.680 3.672 5.652 1.00 0.43 H new ATOM 1213 N ASP A 103 -13.636 5.831 3.022 1.00 0.47 N ATOM 1214 CA ASP A 103 -14.013 6.279 1.683 1.00 0.48 C ATOM 1215 C ASP A 103 -12.801 6.205 0.733 1.00 0.45 C ATOM 1216 O ASP A 103 -11.736 6.708 1.096 1.00 0.46 O ATOM 1217 CB ASP A 103 -14.479 7.735 1.753 1.00 0.55 C ATOM 1218 CG ASP A 103 -15.417 8.118 0.617 1.00 0.79 C ATOM 1219 OD1 ASP A 103 -14.959 8.118 -0.544 1.00 1.80 O ATOM 1220 OD2 ASP A 103 -16.578 8.510 0.880 1.00 1.62 O ATOM 0 H ASP A 103 -13.562 6.587 3.703 1.00 0.47 H new ATOM 0 HA ASP A 103 -14.810 5.636 1.310 1.00 0.48 H new ATOM 0 HB2 ASP A 103 -14.983 7.903 2.705 1.00 0.55 H new ATOM 0 HB3 ASP A 103 -13.608 8.390 1.733 1.00 0.55 H new ATOM 1225 N PRO A 104 -12.913 5.691 -0.502 1.00 0.46 N ATOM 1226 CA PRO A 104 -11.826 5.748 -1.481 1.00 0.46 C ATOM 1227 C PRO A 104 -11.494 7.170 -1.957 1.00 0.51 C ATOM 1228 O PRO A 104 -10.375 7.412 -2.404 1.00 0.58 O ATOM 1229 CB PRO A 104 -12.243 4.823 -2.621 1.00 0.49 C ATOM 1230 CG PRO A 104 -13.564 4.179 -2.188 1.00 0.99 C ATOM 1231 CD PRO A 104 -14.089 5.077 -1.077 1.00 0.58 C ATOM 0 HA PRO A 104 -10.891 5.420 -1.027 1.00 0.46 H new ATOM 0 HB2 PRO A 104 -12.368 5.381 -3.549 1.00 0.49 H new ATOM 0 HB3 PRO A 104 -11.482 4.065 -2.805 1.00 0.49 H new ATOM 0 HG2 PRO A 104 -14.268 4.124 -3.018 1.00 0.99 H new ATOM 0 HG3 PRO A 104 -13.410 3.160 -1.833 1.00 0.99 H new ATOM 0 HD2 PRO A 104 -14.775 5.828 -1.468 1.00 0.58 H new ATOM 0 HD3 PRO A 104 -14.638 4.502 -0.331 1.00 0.58 H new ATOM 1239 N GLN A 105 -12.438 8.109 -1.849 1.00 0.55 N ATOM 1240 CA GLN A 105 -12.328 9.495 -2.310 1.00 0.63 C ATOM 1241 C GLN A 105 -11.925 10.462 -1.191 1.00 0.68 C ATOM 1242 O GLN A 105 -11.054 11.314 -1.382 1.00 0.80 O ATOM 1243 CB GLN A 105 -13.670 9.909 -2.937 1.00 0.71 C ATOM 1244 CG GLN A 105 -14.156 8.907 -3.987 1.00 0.71 C ATOM 1245 CD GLN A 105 -13.126 8.729 -5.097 1.00 0.70 C ATOM 1246 OE1 GLN A 105 -12.624 9.689 -5.672 1.00 1.12 O ATOM 1247 NE2 GLN A 105 -12.701 7.519 -5.368 1.00 0.80 N ATOM 0 H GLN A 105 -13.342 7.914 -1.418 1.00 0.55 H new ATOM 0 HA GLN A 105 -11.531 9.549 -3.052 1.00 0.63 H new ATOM 0 HB2 GLN A 105 -14.421 10.003 -2.153 1.00 0.71 H new ATOM 0 HB3 GLN A 105 -13.565 10.892 -3.397 1.00 0.71 H new ATOM 0 HG2 GLN A 105 -14.353 7.946 -3.512 1.00 0.71 H new ATOM 0 HG3 GLN A 105 -15.098 9.251 -4.413 1.00 0.71 H new ATOM 0 HE21 GLN A 105 -13.113 6.716 -4.894 1.00 0.80 H new ATOM 0 HE22 GLN A 105 -11.958 7.381 -6.053 1.00 0.80 H new ATOM 1256 N THR A 106 -12.555 10.329 -0.019 1.00 0.66 N ATOM 1257 CA THR A 106 -12.347 11.213 1.155 1.00 0.71 C ATOM 1258 C THR A 106 -11.252 10.725 2.100 1.00 0.67 C ATOM 1259 O THR A 106 -10.711 11.522 2.871 1.00 0.75 O ATOM 1260 CB THR A 106 -13.642 11.436 1.965 1.00 0.75 C ATOM 1261 OG1 THR A 106 -13.893 10.402 2.873 1.00 0.70 O ATOM 1262 CG2 THR A 106 -14.870 11.564 1.083 1.00 0.79 C ATOM 0 H THR A 106 -13.239 9.592 0.153 1.00 0.66 H new ATOM 0 HA THR A 106 -12.025 12.160 0.722 1.00 0.71 H new ATOM 0 HB THR A 106 -13.467 12.370 2.499 1.00 0.75 H new ATOM 0 HG1 THR A 106 -14.840 10.410 3.124 1.00 0.70 H new ATOM 0 HG21 THR A 106 -15.751 11.719 1.706 1.00 0.79 H new ATOM 0 HG22 THR A 106 -14.748 12.412 0.410 1.00 0.79 H new ATOM 0 HG23 THR A 106 -14.995 10.652 0.499 1.00 0.79 H new ATOM 1270 N PHE A 107 -10.952 9.420 2.069 1.00 0.59 N ATOM 1271 CA PHE A 107 -10.077 8.715 3.022 1.00 0.57 C ATOM 1272 C PHE A 107 -10.477 8.917 4.510 1.00 0.61 C ATOM 1273 O PHE A 107 -9.662 8.687 5.408 1.00 0.66 O ATOM 1274 CB PHE A 107 -8.589 9.016 2.716 1.00 0.63 C ATOM 1275 CG PHE A 107 -7.849 8.178 1.681 1.00 0.53 C ATOM 1276 CD1 PHE A 107 -8.482 7.471 0.635 1.00 1.99 C ATOM 1277 CD2 PHE A 107 -6.444 8.144 1.761 1.00 2.01 C ATOM 1278 CE1 PHE A 107 -7.720 6.708 -0.254 1.00 1.95 C ATOM 1279 CE2 PHE A 107 -5.681 7.414 0.836 1.00 2.05 C ATOM 1280 CZ PHE A 107 -6.319 6.675 -0.168 1.00 0.54 C ATOM 0 H PHE A 107 -11.326 8.799 1.351 1.00 0.59 H new ATOM 0 HA PHE A 107 -10.223 7.645 2.871 1.00 0.57 H new ATOM 0 HB2 PHE A 107 -8.525 10.057 2.399 1.00 0.63 H new ATOM 0 HB3 PHE A 107 -8.040 8.935 3.654 1.00 0.63 H new ATOM 0 HD1 PHE A 107 -9.555 7.520 0.522 1.00 1.99 H new ATOM 0 HD2 PHE A 107 -5.944 8.689 2.548 1.00 2.01 H new ATOM 0 HE1 PHE A 107 -8.218 6.133 -1.021 1.00 1.95 H new ATOM 0 HE2 PHE A 107 -4.603 7.422 0.899 1.00 2.05 H new ATOM 0 HZ PHE A 107 -5.741 6.088 -0.866 1.00 0.54 H new ATOM 1290 N LYS A 108 -11.724 9.331 4.802 1.00 0.62 N ATOM 1291 CA LYS A 108 -12.225 9.512 6.174 1.00 0.66 C ATOM 1292 C LYS A 108 -12.667 8.185 6.789 1.00 0.55 C ATOM 1293 O LYS A 108 -13.206 7.321 6.091 1.00 0.51 O ATOM 1294 CB LYS A 108 -13.292 10.626 6.224 1.00 0.85 C ATOM 1295 CG LYS A 108 -14.754 10.219 5.939 1.00 0.92 C ATOM 1296 CD LYS A 108 -15.560 9.614 7.105 1.00 1.38 C ATOM 1297 CE LYS A 108 -15.447 10.360 8.439 1.00 1.93 C ATOM 1298 NZ LYS A 108 -16.037 11.715 8.389 1.00 2.76 N ATOM 0 H LYS A 108 -12.416 9.551 4.086 1.00 0.62 H new ATOM 0 HA LYS A 108 -11.408 9.856 6.808 1.00 0.66 H new ATOM 0 HB2 LYS A 108 -13.256 11.084 7.213 1.00 0.85 H new ATOM 0 HB3 LYS A 108 -13.010 11.396 5.506 1.00 0.85 H new ATOM 0 HG2 LYS A 108 -15.286 11.101 5.583 1.00 0.92 H new ATOM 0 HG3 LYS A 108 -14.750 9.498 5.122 1.00 0.92 H new ATOM 0 HD2 LYS A 108 -16.611 9.576 6.817 1.00 1.38 H new ATOM 0 HD3 LYS A 108 -15.233 8.585 7.255 1.00 1.38 H new ATOM 0 HE2 LYS A 108 -15.944 9.781 9.217 1.00 1.93 H new ATOM 0 HE3 LYS A 108 -14.397 10.436 8.720 1.00 1.93 H new ATOM 0 HZ1 LYS A 108 -15.933 12.173 9.317 1.00 2.76 H new ATOM 0 HZ2 LYS A 108 -15.547 12.280 7.666 1.00 2.76 H new ATOM 0 HZ3 LYS A 108 -17.046 11.645 8.149 1.00 2.76 H new ATOM 1312 N LEU A 109 -12.484 8.050 8.100 1.00 0.60 N ATOM 1313 CA LEU A 109 -12.843 6.868 8.885 1.00 0.61 C ATOM 1314 C LEU A 109 -14.270 6.973 9.426 1.00 0.69 C ATOM 1315 O LEU A 109 -14.638 7.980 10.033 1.00 0.84 O ATOM 1316 CB LEU A 109 -11.869 6.709 10.064 1.00 0.66 C ATOM 1317 CG LEU A 109 -10.440 6.338 9.642 1.00 0.62 C ATOM 1318 CD1 LEU A 109 -9.416 6.679 10.719 1.00 0.67 C ATOM 1319 CD2 LEU A 109 -10.327 4.837 9.426 1.00 0.60 C ATOM 0 H LEU A 109 -12.066 8.787 8.668 1.00 0.60 H new ATOM 0 HA LEU A 109 -12.782 6.000 8.229 1.00 0.61 H new ATOM 0 HB2 LEU A 109 -11.841 7.641 10.628 1.00 0.66 H new ATOM 0 HB3 LEU A 109 -12.250 5.941 10.737 1.00 0.66 H new ATOM 0 HG LEU A 109 -10.240 6.904 8.732 1.00 0.62 H new ATOM 0 HD11 LEU A 109 -8.420 6.399 10.376 1.00 0.67 H new ATOM 0 HD12 LEU A 109 -9.443 7.750 10.920 1.00 0.67 H new ATOM 0 HD13 LEU A 109 -9.652 6.132 11.632 1.00 0.67 H new ATOM 0 HD21 LEU A 109 -9.309 4.588 9.127 1.00 0.60 H new ATOM 0 HD22 LEU A 109 -10.571 4.317 10.352 1.00 0.60 H new ATOM 0 HD23 LEU A 109 -11.020 4.529 8.643 1.00 0.60 H new ATOM 1331 N SER A 110 -15.032 5.887 9.324 1.00 0.67 N ATOM 1332 CA SER A 110 -16.397 5.769 9.875 1.00 0.74 C ATOM 1333 C SER A 110 -16.467 5.804 11.414 1.00 0.83 C ATOM 1334 O SER A 110 -17.556 5.718 11.991 1.00 1.04 O ATOM 1335 CB SER A 110 -17.061 4.487 9.358 1.00 0.77 C ATOM 1336 OG SER A 110 -16.397 3.356 9.890 1.00 1.33 O ATOM 0 H SER A 110 -14.719 5.041 8.847 1.00 0.67 H new ATOM 0 HA SER A 110 -16.934 6.652 9.528 1.00 0.74 H new ATOM 0 HB2 SER A 110 -18.113 4.471 9.644 1.00 0.77 H new ATOM 0 HB3 SER A 110 -17.026 4.462 8.269 1.00 0.77 H new ATOM 0 HG SER A 110 -16.825 2.539 9.559 1.00 1.33 H new ATOM 1342 N GLY A 111 -15.321 5.922 12.089 1.00 0.78 N ATOM 1343 CA GLY A 111 -15.167 5.921 13.539 1.00 0.85 C ATOM 1344 C GLY A 111 -13.729 6.239 13.970 1.00 0.83 C ATOM 1345 O GLY A 111 -12.988 6.915 13.250 1.00 0.86 O ATOM 0 H GLY A 111 -14.428 6.026 11.608 1.00 0.78 H new ATOM 0 HA2 GLY A 111 -15.846 6.654 13.975 1.00 0.85 H new ATOM 0 HA3 GLY A 111 -15.455 4.946 13.932 1.00 0.85 H new ATOM 1349 N ALA A 112 -13.332 5.742 15.141 1.00 0.85 N ATOM 1350 CA ALA A 112 -12.004 5.934 15.732 1.00 0.85 C ATOM 1351 C ALA A 112 -10.989 4.843 15.329 1.00 0.79 C ATOM 1352 O ALA A 112 -11.370 3.750 14.896 1.00 0.78 O ATOM 1353 CB ALA A 112 -12.180 6.014 17.250 1.00 0.94 C ATOM 0 H ALA A 112 -13.946 5.175 15.726 1.00 0.85 H new ATOM 0 HA ALA A 112 -11.576 6.859 15.346 1.00 0.85 H new ATOM 0 HB1 ALA A 112 -11.208 6.157 17.722 1.00 0.94 H new ATOM 0 HB2 ALA A 112 -12.830 6.853 17.497 1.00 0.94 H new ATOM 0 HB3 ALA A 112 -12.627 5.089 17.614 1.00 0.94 H new ATOM 1359 N MET A 113 -9.692 5.117 15.517 1.00 0.82 N ATOM 1360 CA MET A 113 -8.585 4.208 15.179 1.00 0.79 C ATOM 1361 C MET A 113 -8.735 2.805 15.819 1.00 0.73 C ATOM 1362 O MET A 113 -8.941 2.700 17.036 1.00 0.89 O ATOM 1363 CB MET A 113 -7.241 4.856 15.575 1.00 0.95 C ATOM 1364 CG MET A 113 -6.581 5.560 14.381 1.00 1.01 C ATOM 1365 SD MET A 113 -5.786 4.408 13.219 1.00 1.51 S ATOM 1366 CE MET A 113 -5.757 5.401 11.709 1.00 1.19 C ATOM 0 H MET A 113 -9.373 5.999 15.918 1.00 0.82 H new ATOM 0 HA MET A 113 -8.611 4.050 14.101 1.00 0.79 H new ATOM 0 HB2 MET A 113 -7.405 5.575 16.377 1.00 0.95 H new ATOM 0 HB3 MET A 113 -6.569 4.092 15.965 1.00 0.95 H new ATOM 0 HG2 MET A 113 -7.334 6.141 13.848 1.00 1.01 H new ATOM 0 HG3 MET A 113 -5.836 6.265 14.750 1.00 1.01 H new ATOM 0 HE1 MET A 113 -6.475 4.998 10.994 1.00 1.19 H new ATOM 0 HE2 MET A 113 -6.021 6.432 11.946 1.00 1.19 H new ATOM 0 HE3 MET A 113 -4.758 5.373 11.275 1.00 1.19 H new ATOM 1376 N PRO A 114 -8.640 1.713 15.031 1.00 0.56 N ATOM 1377 CA PRO A 114 -8.849 0.338 15.501 1.00 0.51 C ATOM 1378 C PRO A 114 -7.707 -0.176 16.388 1.00 0.60 C ATOM 1379 O PRO A 114 -6.590 0.339 16.336 1.00 0.74 O ATOM 1380 CB PRO A 114 -8.927 -0.503 14.226 1.00 0.43 C ATOM 1381 CG PRO A 114 -7.971 0.239 13.300 1.00 0.48 C ATOM 1382 CD PRO A 114 -8.263 1.690 13.622 1.00 0.55 C ATOM 0 HA PRO A 114 -9.745 0.282 16.119 1.00 0.51 H new ATOM 0 HB2 PRO A 114 -8.613 -1.533 14.396 1.00 0.43 H new ATOM 0 HB3 PRO A 114 -9.939 -0.541 13.823 1.00 0.43 H new ATOM 0 HG2 PRO A 114 -6.931 -0.019 13.499 1.00 0.48 H new ATOM 0 HG3 PRO A 114 -8.162 0.010 12.252 1.00 0.48 H new ATOM 0 HD2 PRO A 114 -7.389 2.315 13.440 1.00 0.55 H new ATOM 0 HD3 PRO A 114 -9.067 2.076 12.995 1.00 0.55 H new ATOM 1390 N ALA A 115 -7.962 -1.259 17.126 1.00 0.61 N ATOM 1391 CA ALA A 115 -6.969 -1.946 17.941 1.00 0.71 C ATOM 1392 C ALA A 115 -6.032 -2.829 17.093 1.00 0.68 C ATOM 1393 O ALA A 115 -4.935 -2.415 16.724 1.00 1.07 O ATOM 1394 CB ALA A 115 -7.709 -2.724 19.038 1.00 0.82 C ATOM 0 H ALA A 115 -8.886 -1.689 17.172 1.00 0.61 H new ATOM 0 HA ALA A 115 -6.306 -1.221 18.412 1.00 0.71 H new ATOM 0 HB1 ALA A 115 -6.986 -3.248 19.663 1.00 0.82 H new ATOM 0 HB2 ALA A 115 -8.284 -2.030 19.652 1.00 0.82 H new ATOM 0 HB3 ALA A 115 -8.384 -3.447 18.579 1.00 0.82 H new ATOM 1400 N THR A 116 -6.468 -4.038 16.730 1.00 0.63 N ATOM 1401 CA THR A 116 -5.600 -5.087 16.152 1.00 0.60 C ATOM 1402 C THR A 116 -5.348 -4.997 14.638 1.00 0.49 C ATOM 1403 O THR A 116 -4.639 -5.845 14.096 1.00 0.55 O ATOM 1404 CB THR A 116 -6.103 -6.486 16.557 1.00 0.66 C ATOM 1405 OG1 THR A 116 -7.418 -6.712 16.098 1.00 0.73 O ATOM 1406 CG2 THR A 116 -6.155 -6.637 18.078 1.00 0.78 C ATOM 0 H THR A 116 -7.442 -4.327 16.827 1.00 0.63 H new ATOM 0 HA THR A 116 -4.617 -4.903 16.586 1.00 0.60 H new ATOM 0 HB THR A 116 -5.404 -7.195 16.113 1.00 0.66 H new ATOM 0 HG1 THR A 116 -7.709 -7.608 16.368 1.00 0.73 H new ATOM 0 HG21 THR A 116 -6.514 -7.634 18.333 1.00 0.78 H new ATOM 0 HG22 THR A 116 -5.157 -6.494 18.492 1.00 0.78 H new ATOM 0 HG23 THR A 116 -6.831 -5.891 18.495 1.00 0.78 H new ATOM 1414 N ALA A 117 -5.881 -3.975 13.954 1.00 0.47 N ATOM 1415 CA ALA A 117 -5.818 -3.802 12.496 1.00 0.41 C ATOM 1416 C ALA A 117 -4.407 -3.947 11.882 1.00 0.38 C ATOM 1417 O ALA A 117 -3.395 -3.584 12.483 1.00 0.44 O ATOM 1418 CB ALA A 117 -6.394 -2.425 12.139 1.00 0.41 C ATOM 0 H ALA A 117 -6.386 -3.219 14.417 1.00 0.47 H new ATOM 0 HA ALA A 117 -6.404 -4.615 12.067 1.00 0.41 H new ATOM 0 HB1 ALA A 117 -6.354 -2.283 11.059 1.00 0.41 H new ATOM 0 HB2 ALA A 117 -7.429 -2.366 12.474 1.00 0.41 H new ATOM 0 HB3 ALA A 117 -5.809 -1.647 12.630 1.00 0.41 H new ATOM 1424 N MET A 118 -4.360 -4.426 10.637 1.00 0.31 N ATOM 1425 CA MET A 118 -3.159 -4.662 9.833 1.00 0.30 C ATOM 1426 C MET A 118 -2.606 -3.345 9.255 1.00 0.30 C ATOM 1427 O MET A 118 -3.101 -2.845 8.248 1.00 0.33 O ATOM 1428 CB MET A 118 -3.574 -5.660 8.738 1.00 0.28 C ATOM 1429 CG MET A 118 -2.468 -6.075 7.770 1.00 0.32 C ATOM 1430 SD MET A 118 -1.018 -6.863 8.518 1.00 1.58 S ATOM 1431 CE MET A 118 -0.652 -8.065 7.209 1.00 0.65 C ATOM 0 H MET A 118 -5.211 -4.675 10.133 1.00 0.31 H new ATOM 0 HA MET A 118 -2.345 -5.071 10.432 1.00 0.30 H new ATOM 0 HB2 MET A 118 -3.967 -6.556 9.218 1.00 0.28 H new ATOM 0 HB3 MET A 118 -4.390 -5.222 8.163 1.00 0.28 H new ATOM 0 HG2 MET A 118 -2.892 -6.760 7.036 1.00 0.32 H new ATOM 0 HG3 MET A 118 -2.137 -5.190 7.226 1.00 0.32 H new ATOM 0 HE1 MET A 118 0.411 -8.304 7.221 1.00 0.65 H new ATOM 0 HE2 MET A 118 -1.230 -8.974 7.377 1.00 0.65 H new ATOM 0 HE3 MET A 118 -0.917 -7.640 6.241 1.00 0.65 H new ATOM 1441 N LYS A 119 -1.594 -2.757 9.899 1.00 0.36 N ATOM 1442 CA LYS A 119 -1.039 -1.415 9.587 1.00 0.36 C ATOM 1443 C LYS A 119 0.456 -1.311 9.927 1.00 0.41 C ATOM 1444 O LYS A 119 0.906 -1.955 10.877 1.00 0.58 O ATOM 1445 CB LYS A 119 -1.851 -0.352 10.346 1.00 0.43 C ATOM 1446 CG LYS A 119 -1.908 -0.534 11.878 1.00 0.54 C ATOM 1447 CD LYS A 119 -3.242 0.003 12.417 1.00 0.65 C ATOM 1448 CE LYS A 119 -3.491 -0.313 13.904 1.00 0.81 C ATOM 1449 NZ LYS A 119 -2.453 0.231 14.816 1.00 1.04 N ATOM 0 H LYS A 119 -1.115 -3.207 10.679 1.00 0.36 H new ATOM 0 HA LYS A 119 -1.122 -1.247 8.513 1.00 0.36 H new ATOM 0 HB2 LYS A 119 -1.427 0.629 10.129 1.00 0.43 H new ATOM 0 HB3 LYS A 119 -2.870 -0.352 9.959 1.00 0.43 H new ATOM 0 HG2 LYS A 119 -1.801 -1.588 12.132 1.00 0.54 H new ATOM 0 HG3 LYS A 119 -1.077 -0.007 12.347 1.00 0.54 H new ATOM 0 HD2 LYS A 119 -3.270 1.084 12.276 1.00 0.65 H new ATOM 0 HD3 LYS A 119 -4.056 -0.417 11.826 1.00 0.65 H new ATOM 0 HE2 LYS A 119 -4.462 0.089 14.193 1.00 0.81 H new ATOM 0 HE3 LYS A 119 -3.543 -1.394 14.032 1.00 0.81 H new ATOM 0 HZ1 LYS A 119 -2.687 -0.021 15.798 1.00 1.04 H new ATOM 0 HZ2 LYS A 119 -1.527 -0.171 14.567 1.00 1.04 H new ATOM 0 HZ3 LYS A 119 -2.417 1.266 14.723 1.00 1.04 H new ATOM 1463 N LYS A 120 1.225 -0.516 9.170 1.00 0.33 N ATOM 1464 CA LYS A 120 2.668 -0.249 9.394 1.00 0.33 C ATOM 1465 C LYS A 120 3.151 0.942 8.552 1.00 0.32 C ATOM 1466 O LYS A 120 2.558 1.231 7.513 1.00 0.42 O ATOM 1467 CB LYS A 120 3.494 -1.512 9.054 1.00 0.46 C ATOM 1468 CG LYS A 120 4.930 -1.465 9.592 1.00 0.50 C ATOM 1469 CD LYS A 120 5.715 -2.740 9.280 1.00 0.67 C ATOM 1470 CE LYS A 120 7.224 -2.501 9.423 1.00 0.94 C ATOM 1471 NZ LYS A 120 7.669 -2.371 10.834 1.00 1.79 N ATOM 0 H LYS A 120 0.856 -0.022 8.358 1.00 0.33 H new ATOM 0 HA LYS A 120 2.810 0.004 10.445 1.00 0.33 H new ATOM 0 HB2 LYS A 120 2.990 -2.388 9.462 1.00 0.46 H new ATOM 0 HB3 LYS A 120 3.523 -1.637 7.972 1.00 0.46 H new ATOM 0 HG2 LYS A 120 5.448 -0.609 9.161 1.00 0.50 H new ATOM 0 HG3 LYS A 120 4.905 -1.312 10.671 1.00 0.50 H new ATOM 0 HD2 LYS A 120 5.403 -3.538 9.954 1.00 0.67 H new ATOM 0 HD3 LYS A 120 5.489 -3.072 8.267 1.00 0.67 H new ATOM 0 HE2 LYS A 120 7.761 -3.326 8.955 1.00 0.94 H new ATOM 0 HE3 LYS A 120 7.494 -1.596 8.880 1.00 0.94 H new ATOM 0 HZ1 LYS A 120 8.696 -2.211 10.861 1.00 1.79 H new ATOM 0 HZ2 LYS A 120 7.182 -1.567 11.279 1.00 1.79 H new ATOM 0 HZ3 LYS A 120 7.441 -3.244 11.352 1.00 1.79 H new ATOM 1485 N LEU A 121 4.242 1.587 8.974 1.00 0.32 N ATOM 1486 CA LEU A 121 4.938 2.634 8.210 1.00 0.33 C ATOM 1487 C LEU A 121 6.125 2.126 7.363 1.00 0.34 C ATOM 1488 O LEU A 121 6.815 1.190 7.775 1.00 0.36 O ATOM 1489 CB LEU A 121 5.400 3.770 9.140 1.00 0.36 C ATOM 1490 CG LEU A 121 4.232 4.530 9.796 1.00 0.37 C ATOM 1491 CD1 LEU A 121 3.956 4.094 11.232 1.00 0.42 C ATOM 1492 CD2 LEU A 121 4.498 6.035 9.785 1.00 0.48 C ATOM 0 H LEU A 121 4.678 1.394 9.876 1.00 0.32 H new ATOM 0 HA LEU A 121 4.201 3.008 7.499 1.00 0.33 H new ATOM 0 HB2 LEU A 121 6.039 3.355 9.920 1.00 0.36 H new ATOM 0 HB3 LEU A 121 6.008 4.473 8.570 1.00 0.36 H new ATOM 0 HG LEU A 121 3.351 4.289 9.201 1.00 0.37 H new ATOM 0 HD11 LEU A 121 3.122 4.669 11.633 1.00 0.42 H new ATOM 0 HD12 LEU A 121 3.706 3.033 11.249 1.00 0.42 H new ATOM 0 HD13 LEU A 121 4.843 4.268 11.842 1.00 0.42 H new ATOM 0 HD21 LEU A 121 3.662 6.556 10.252 1.00 0.48 H new ATOM 0 HD22 LEU A 121 5.413 6.247 10.338 1.00 0.48 H new ATOM 0 HD23 LEU A 121 4.609 6.377 8.756 1.00 0.48 H new ATOM 1504 N THR A 122 6.437 2.778 6.231 1.00 0.35 N ATOM 1505 CA THR A 122 7.676 2.500 5.461 1.00 0.36 C ATOM 1506 C THR A 122 8.944 2.840 6.264 1.00 0.39 C ATOM 1507 O THR A 122 9.028 3.888 6.908 1.00 0.45 O ATOM 1508 CB THR A 122 7.720 3.160 4.063 1.00 0.39 C ATOM 1509 OG1 THR A 122 7.331 4.513 4.113 1.00 0.43 O ATOM 1510 CG2 THR A 122 6.816 2.501 3.022 1.00 0.47 C ATOM 0 H THR A 122 5.850 3.505 5.822 1.00 0.35 H new ATOM 0 HA THR A 122 7.653 1.425 5.285 1.00 0.36 H new ATOM 0 HB THR A 122 8.761 3.041 3.763 1.00 0.39 H new ATOM 0 HG1 THR A 122 7.463 4.924 3.233 1.00 0.43 H new ATOM 0 HG21 THR A 122 6.910 3.028 2.073 1.00 0.47 H new ATOM 0 HG22 THR A 122 7.112 1.460 2.890 1.00 0.47 H new ATOM 0 HG23 THR A 122 5.781 2.544 3.360 1.00 0.47 H new ATOM 1518 N GLU A 123 9.938 1.944 6.252 1.00 0.42 N ATOM 1519 CA GLU A 123 11.153 2.017 7.097 1.00 0.54 C ATOM 1520 C GLU A 123 12.356 2.729 6.463 1.00 0.60 C ATOM 1521 O GLU A 123 12.950 3.625 7.068 1.00 0.83 O ATOM 1522 CB GLU A 123 11.596 0.621 7.582 1.00 0.70 C ATOM 1523 CG GLU A 123 11.362 -0.532 6.611 1.00 0.79 C ATOM 1524 CD GLU A 123 12.101 -1.802 7.044 1.00 1.25 C ATOM 1525 OE1 GLU A 123 11.573 -2.539 7.910 1.00 2.19 O ATOM 1526 OE2 GLU A 123 13.221 -2.067 6.542 1.00 2.15 O ATOM 0 H GLU A 123 9.927 1.126 5.643 1.00 0.42 H new ATOM 0 HA GLU A 123 10.837 2.634 7.939 1.00 0.54 H new ATOM 0 HB2 GLU A 123 12.660 0.661 7.817 1.00 0.70 H new ATOM 0 HB3 GLU A 123 11.072 0.398 8.512 1.00 0.70 H new ATOM 0 HG2 GLU A 123 10.294 -0.739 6.543 1.00 0.79 H new ATOM 0 HG3 GLU A 123 11.694 -0.241 5.615 1.00 0.79 H new ATOM 1533 N ALA A 124 12.759 2.279 5.276 1.00 0.56 N ATOM 1534 CA ALA A 124 13.905 2.798 4.529 1.00 0.69 C ATOM 1535 C ALA A 124 13.765 2.528 3.024 1.00 0.72 C ATOM 1536 O ALA A 124 14.105 3.393 2.216 1.00 1.08 O ATOM 1537 CB ALA A 124 15.192 2.169 5.084 1.00 0.93 C ATOM 0 H ALA A 124 12.282 1.519 4.792 1.00 0.56 H new ATOM 0 HA ALA A 124 13.947 3.880 4.654 1.00 0.69 H new ATOM 0 HB1 ALA A 124 16.051 2.551 4.532 1.00 0.93 H new ATOM 0 HB2 ALA A 124 15.296 2.424 6.139 1.00 0.93 H new ATOM 0 HB3 ALA A 124 15.144 1.086 4.975 1.00 0.93 H new ATOM 1543 N GLU A 125 13.227 1.364 2.647 1.00 0.86 N ATOM 1544 CA GLU A 125 12.872 1.031 1.259 1.00 1.35 C ATOM 1545 C GLU A 125 11.383 0.725 1.050 1.00 1.43 C ATOM 1546 O GLU A 125 10.889 0.873 -0.069 1.00 2.41 O ATOM 1547 CB GLU A 125 13.743 -0.145 0.795 1.00 1.77 C ATOM 1548 CG GLU A 125 15.157 0.263 0.351 1.00 2.20 C ATOM 1549 CD GLU A 125 15.274 0.351 -1.176 1.00 4.04 C ATOM 1550 OE1 GLU A 125 15.617 -0.679 -1.812 1.00 4.85 O ATOM 1551 OE2 GLU A 125 15.037 1.438 -1.758 1.00 5.25 O ATOM 0 H GLU A 125 13.022 0.613 3.306 1.00 0.86 H new ATOM 0 HA GLU A 125 13.066 1.917 0.654 1.00 1.35 H new ATOM 0 HB2 GLU A 125 13.822 -0.868 1.607 1.00 1.77 H new ATOM 0 HB3 GLU A 125 13.244 -0.649 -0.033 1.00 1.77 H new ATOM 0 HG2 GLU A 125 15.411 1.227 0.791 1.00 2.20 H new ATOM 0 HG3 GLU A 125 15.879 -0.460 0.729 1.00 2.20 H new ATOM 1558 N GLY A 126 10.659 0.336 2.100 1.00 0.63 N ATOM 1559 CA GLY A 126 9.290 -0.183 2.049 1.00 0.55 C ATOM 1560 C GLY A 126 8.813 -0.625 3.442 1.00 0.50 C ATOM 1561 O GLY A 126 9.357 -0.144 4.430 1.00 0.65 O ATOM 0 H GLY A 126 11.026 0.375 3.051 1.00 0.63 H new ATOM 0 HA2 GLY A 126 8.621 0.584 1.659 1.00 0.55 H new ATOM 0 HA3 GLY A 126 9.243 -1.027 1.361 1.00 0.55 H new ATOM 1565 N ALA A 127 7.799 -1.487 3.549 1.00 0.39 N ATOM 1566 CA ALA A 127 7.302 -2.110 4.790 1.00 0.35 C ATOM 1567 C ALA A 127 6.765 -3.538 4.545 1.00 0.33 C ATOM 1568 O ALA A 127 5.960 -3.738 3.633 1.00 0.34 O ATOM 1569 CB ALA A 127 6.179 -1.235 5.363 1.00 0.33 C ATOM 0 H ALA A 127 7.270 -1.789 2.731 1.00 0.39 H new ATOM 0 HA ALA A 127 8.133 -2.187 5.491 1.00 0.35 H new ATOM 0 HB1 ALA A 127 5.801 -1.683 6.282 1.00 0.33 H new ATOM 0 HB2 ALA A 127 6.567 -0.239 5.578 1.00 0.33 H new ATOM 0 HB3 ALA A 127 5.370 -1.160 4.637 1.00 0.33 H new ATOM 1575 N LYS A 128 7.135 -4.520 5.383 1.00 0.35 N ATOM 1576 CA LYS A 128 6.682 -5.925 5.280 1.00 0.34 C ATOM 1577 C LYS A 128 5.353 -6.184 6.005 1.00 0.32 C ATOM 1578 O LYS A 128 5.143 -5.737 7.138 1.00 0.38 O ATOM 1579 CB LYS A 128 7.787 -6.879 5.773 1.00 0.41 C ATOM 1580 CG LYS A 128 7.395 -8.367 5.660 1.00 0.84 C ATOM 1581 CD LYS A 128 8.485 -9.281 6.223 1.00 0.88 C ATOM 1582 CE LYS A 128 8.006 -10.738 6.236 1.00 1.00 C ATOM 1583 NZ LYS A 128 9.060 -11.623 6.786 1.00 1.42 N ATOM 0 H LYS A 128 7.769 -4.361 6.166 1.00 0.35 H new ATOM 0 HA LYS A 128 6.489 -6.123 4.226 1.00 0.34 H new ATOM 0 HB2 LYS A 128 8.695 -6.703 5.196 1.00 0.41 H new ATOM 0 HB3 LYS A 128 8.021 -6.649 6.812 1.00 0.41 H new ATOM 0 HG2 LYS A 128 6.462 -8.540 6.196 1.00 0.84 H new ATOM 0 HG3 LYS A 128 7.213 -8.618 4.615 1.00 0.84 H new ATOM 0 HD2 LYS A 128 9.389 -9.194 5.620 1.00 0.88 H new ATOM 0 HD3 LYS A 128 8.745 -8.968 7.234 1.00 0.88 H new ATOM 0 HE2 LYS A 128 7.100 -10.824 6.836 1.00 1.00 H new ATOM 0 HE3 LYS A 128 7.750 -11.052 5.224 1.00 1.00 H new ATOM 0 HZ1 LYS A 128 8.721 -12.606 6.789 1.00 1.42 H new ATOM 0 HZ2 LYS A 128 9.914 -11.553 6.197 1.00 1.42 H new ATOM 0 HZ3 LYS A 128 9.285 -11.332 7.759 1.00 1.42 H new ATOM 1597 N PHE A 129 4.482 -6.950 5.349 1.00 0.32 N ATOM 1598 CA PHE A 129 3.200 -7.456 5.835 1.00 0.31 C ATOM 1599 C PHE A 129 3.149 -8.973 5.592 1.00 0.32 C ATOM 1600 O PHE A 129 3.313 -9.427 4.459 1.00 0.34 O ATOM 1601 CB PHE A 129 2.053 -6.725 5.102 1.00 0.31 C ATOM 1602 CG PHE A 129 1.850 -5.266 5.487 1.00 0.29 C ATOM 1603 CD1 PHE A 129 2.856 -4.318 5.242 1.00 1.58 C ATOM 1604 CD2 PHE A 129 0.660 -4.841 6.106 1.00 1.67 C ATOM 1605 CE1 PHE A 129 2.723 -3.005 5.705 1.00 1.61 C ATOM 1606 CE2 PHE A 129 0.503 -3.512 6.538 1.00 1.66 C ATOM 1607 CZ PHE A 129 1.547 -2.593 6.349 1.00 0.33 C ATOM 0 H PHE A 129 4.668 -7.255 4.394 1.00 0.32 H new ATOM 0 HA PHE A 129 3.087 -7.271 6.903 1.00 0.31 H new ATOM 0 HB2 PHE A 129 2.240 -6.776 4.029 1.00 0.31 H new ATOM 0 HB3 PHE A 129 1.124 -7.264 5.289 1.00 0.31 H new ATOM 0 HD1 PHE A 129 3.740 -4.605 4.692 1.00 1.58 H new ATOM 0 HD2 PHE A 129 -0.145 -5.546 6.252 1.00 1.67 H new ATOM 0 HE1 PHE A 129 3.532 -2.303 5.566 1.00 1.61 H new ATOM 0 HE2 PHE A 129 -0.416 -3.200 7.013 1.00 1.66 H new ATOM 0 HZ PHE A 129 1.445 -1.576 6.697 1.00 0.33 H new ATOM 1617 N ASN A 130 2.920 -9.772 6.632 1.00 0.41 N ATOM 1618 CA ASN A 130 2.758 -11.224 6.512 1.00 0.43 C ATOM 1619 C ASN A 130 1.348 -11.561 5.982 1.00 0.43 C ATOM 1620 O ASN A 130 0.359 -11.113 6.560 1.00 0.64 O ATOM 1621 CB ASN A 130 3.029 -11.844 7.894 1.00 0.57 C ATOM 1622 CG ASN A 130 2.526 -13.264 8.086 1.00 0.90 C ATOM 1623 OD1 ASN A 130 1.940 -13.593 9.105 1.00 2.53 O ATOM 1624 ND2 ASN A 130 2.719 -14.162 7.151 1.00 1.66 N ATOM 0 H ASN A 130 2.841 -9.430 7.590 1.00 0.41 H new ATOM 0 HA ASN A 130 3.465 -11.640 5.794 1.00 0.43 H new ATOM 0 HB2 ASN A 130 4.104 -11.831 8.074 1.00 0.57 H new ATOM 0 HB3 ASN A 130 2.571 -11.210 8.653 1.00 0.57 H new ATOM 0 HD21 ASN A 130 2.382 -15.116 7.282 1.00 1.66 H new ATOM 0 HD22 ASN A 130 3.206 -13.907 6.292 1.00 1.66 H new ATOM 1631 N THR A 131 1.240 -12.382 4.931 1.00 0.43 N ATOM 1632 CA THR A 131 -0.052 -12.779 4.336 1.00 0.45 C ATOM 1633 C THR A 131 -0.509 -14.199 4.633 1.00 0.51 C ATOM 1634 O THR A 131 -1.668 -14.500 4.358 1.00 0.65 O ATOM 1635 CB THR A 131 -0.095 -12.579 2.816 1.00 0.52 C ATOM 1636 OG1 THR A 131 0.940 -13.293 2.179 1.00 0.70 O ATOM 1637 CG2 THR A 131 -0.001 -11.101 2.467 1.00 0.53 C ATOM 0 H THR A 131 2.047 -12.794 4.463 1.00 0.43 H new ATOM 0 HA THR A 131 -0.745 -12.101 4.834 1.00 0.45 H new ATOM 0 HB THR A 131 -1.049 -12.966 2.457 1.00 0.52 H new ATOM 0 HG1 THR A 131 0.889 -13.149 1.211 1.00 0.70 H new ATOM 0 HG21 THR A 131 -0.033 -10.980 1.384 1.00 0.53 H new ATOM 0 HG22 THR A 131 -0.838 -10.567 2.917 1.00 0.53 H new ATOM 0 HG23 THR A 131 0.936 -10.696 2.850 1.00 0.53 H new ATOM 1645 N ALA A 132 0.337 -15.064 5.204 1.00 0.52 N ATOM 1646 CA ALA A 132 0.044 -16.494 5.389 1.00 0.60 C ATOM 1647 C ALA A 132 -1.327 -16.775 6.036 1.00 0.68 C ATOM 1648 O ALA A 132 -1.984 -17.757 5.685 1.00 0.97 O ATOM 1649 CB ALA A 132 1.150 -17.108 6.256 1.00 0.73 C ATOM 0 H ALA A 132 1.255 -14.790 5.555 1.00 0.52 H new ATOM 0 HA ALA A 132 0.008 -16.944 4.397 1.00 0.60 H new ATOM 0 HB1 ALA A 132 0.949 -18.169 6.404 1.00 0.73 H new ATOM 0 HB2 ALA A 132 2.112 -16.987 5.758 1.00 0.73 H new ATOM 0 HB3 ALA A 132 1.176 -16.605 7.223 1.00 0.73 H new ATOM 1655 N ASN A 133 -1.758 -15.892 6.941 1.00 0.64 N ATOM 1656 CA ASN A 133 -2.981 -16.005 7.729 1.00 0.74 C ATOM 1657 C ASN A 133 -4.228 -15.500 6.990 1.00 0.67 C ATOM 1658 O ASN A 133 -5.338 -15.829 7.414 1.00 0.77 O ATOM 1659 CB ASN A 133 -2.821 -15.325 9.109 1.00 0.94 C ATOM 1660 CG ASN A 133 -1.389 -14.995 9.484 1.00 0.90 C ATOM 1661 OD1 ASN A 133 -0.656 -15.803 10.033 1.00 1.57 O ATOM 1662 ND2 ASN A 133 -0.925 -13.836 9.071 1.00 2.24 N ATOM 0 H ASN A 133 -1.237 -15.041 7.151 1.00 0.64 H new ATOM 0 HA ASN A 133 -3.144 -17.070 7.892 1.00 0.74 H new ATOM 0 HB2 ASN A 133 -3.407 -14.406 9.117 1.00 0.94 H new ATOM 0 HB3 ASN A 133 -3.242 -15.978 9.873 1.00 0.94 H new ATOM 0 HD21 ASN A 133 0.058 -13.602 9.208 1.00 2.24 H new ATOM 0 HD22 ASN A 133 -1.549 -13.171 8.614 1.00 2.24 H new ATOM 1669 N LEU A 134 -4.095 -14.727 5.901 1.00 0.53 N ATOM 1670 CA LEU A 134 -5.249 -14.354 5.092 1.00 0.51 C ATOM 1671 C LEU A 134 -5.789 -15.534 4.276 1.00 0.57 C ATOM 1672 O LEU A 134 -4.998 -16.339 3.769 1.00 0.63 O ATOM 1673 CB LEU A 134 -4.918 -13.199 4.126 1.00 0.46 C ATOM 1674 CG LEU A 134 -4.810 -11.783 4.706 1.00 0.41 C ATOM 1675 CD1 LEU A 134 -5.770 -11.531 5.866 1.00 0.45 C ATOM 1676 CD2 LEU A 134 -3.382 -11.474 5.124 1.00 0.45 C ATOM 0 H LEU A 134 -3.205 -14.355 5.569 1.00 0.53 H new ATOM 0 HA LEU A 134 -6.014 -14.031 5.798 1.00 0.51 H new ATOM 0 HB2 LEU A 134 -3.972 -13.433 3.638 1.00 0.46 H new ATOM 0 HB3 LEU A 134 -5.682 -13.184 3.349 1.00 0.46 H new ATOM 0 HG LEU A 134 -5.104 -11.106 3.904 1.00 0.41 H new ATOM 0 HD11 LEU A 134 -5.642 -10.511 6.229 1.00 0.45 H new ATOM 0 HD12 LEU A 134 -6.796 -11.669 5.525 1.00 0.45 H new ATOM 0 HD13 LEU A 134 -5.558 -12.233 6.673 1.00 0.45 H new ATOM 0 HD21 LEU A 134 -3.333 -10.464 5.532 1.00 0.45 H new ATOM 0 HD22 LEU A 134 -3.063 -12.188 5.883 1.00 0.45 H new ATOM 0 HD23 LEU A 134 -2.725 -11.548 4.257 1.00 0.45 H new ATOM 1688 N PRO A 135 -7.117 -15.626 4.094 1.00 0.61 N ATOM 1689 CA PRO A 135 -7.709 -16.539 3.129 1.00 0.67 C ATOM 1690 C PRO A 135 -7.511 -16.013 1.701 1.00 0.65 C ATOM 1691 O PRO A 135 -7.190 -14.840 1.475 1.00 0.58 O ATOM 1692 CB PRO A 135 -9.190 -16.623 3.488 1.00 0.71 C ATOM 1693 CG PRO A 135 -9.480 -15.254 4.113 1.00 0.65 C ATOM 1694 CD PRO A 135 -8.148 -14.828 4.744 1.00 0.59 C ATOM 0 HA PRO A 135 -7.242 -17.523 3.163 1.00 0.67 H new ATOM 0 HB2 PRO A 135 -9.808 -16.802 2.608 1.00 0.71 H new ATOM 0 HB3 PRO A 135 -9.389 -17.435 4.188 1.00 0.71 H new ATOM 0 HG2 PRO A 135 -9.810 -14.537 3.361 1.00 0.65 H new ATOM 0 HG3 PRO A 135 -10.270 -15.319 4.861 1.00 0.65 H new ATOM 0 HD2 PRO A 135 -7.969 -13.763 4.594 1.00 0.59 H new ATOM 0 HD3 PRO A 135 -8.154 -15.001 5.820 1.00 0.59 H new ATOM 1702 N ALA A 136 -7.768 -16.878 0.728 1.00 0.73 N ATOM 1703 CA ALA A 136 -7.622 -16.608 -0.689 1.00 0.75 C ATOM 1704 C ALA A 136 -8.753 -15.683 -1.156 1.00 0.77 C ATOM 1705 O ALA A 136 -9.860 -16.152 -1.448 1.00 0.98 O ATOM 1706 CB ALA A 136 -7.637 -17.973 -1.376 1.00 0.85 C ATOM 0 H ALA A 136 -8.097 -17.825 0.917 1.00 0.73 H new ATOM 0 HA ALA A 136 -6.696 -16.088 -0.933 1.00 0.75 H new ATOM 0 HB1 ALA A 136 -7.530 -17.840 -2.453 1.00 0.85 H new ATOM 0 HB2 ALA A 136 -6.811 -18.578 -1.002 1.00 0.85 H new ATOM 0 HB3 ALA A 136 -8.580 -18.476 -1.165 1.00 0.85 H new ATOM 1712 N ALA A 137 -8.498 -14.372 -1.163 1.00 0.64 N ATOM 1713 CA ALA A 137 -9.449 -13.360 -1.607 1.00 0.64 C ATOM 1714 C ALA A 137 -8.749 -12.087 -2.146 1.00 0.58 C ATOM 1715 O ALA A 137 -7.515 -11.999 -2.173 1.00 0.55 O ATOM 1716 CB ALA A 137 -10.375 -13.032 -0.424 1.00 0.65 C ATOM 0 H ALA A 137 -7.608 -13.981 -0.854 1.00 0.64 H new ATOM 0 HA ALA A 137 -10.027 -13.753 -2.443 1.00 0.64 H new ATOM 0 HB1 ALA A 137 -11.099 -12.276 -0.727 1.00 0.65 H new ATOM 0 HB2 ALA A 137 -10.902 -13.934 -0.113 1.00 0.65 H new ATOM 0 HB3 ALA A 137 -9.782 -12.653 0.408 1.00 0.65 H new ATOM 1722 N LYS A 138 -9.546 -11.088 -2.544 1.00 0.58 N ATOM 1723 CA LYS A 138 -9.128 -9.711 -2.868 1.00 0.51 C ATOM 1724 C LYS A 138 -9.193 -8.786 -1.640 1.00 0.45 C ATOM 1725 O LYS A 138 -10.002 -8.993 -0.730 1.00 0.55 O ATOM 1726 CB LYS A 138 -9.989 -9.175 -4.023 1.00 0.56 C ATOM 1727 CG LYS A 138 -9.633 -9.830 -5.369 1.00 0.61 C ATOM 1728 CD LYS A 138 -10.583 -9.385 -6.490 1.00 0.77 C ATOM 1729 CE LYS A 138 -11.981 -10.002 -6.366 1.00 2.31 C ATOM 1730 NZ LYS A 138 -12.074 -11.311 -7.050 1.00 3.40 N ATOM 0 H LYS A 138 -10.551 -11.221 -2.656 1.00 0.58 H new ATOM 0 HA LYS A 138 -8.084 -9.730 -3.182 1.00 0.51 H new ATOM 0 HB2 LYS A 138 -11.041 -9.353 -3.802 1.00 0.56 H new ATOM 0 HB3 LYS A 138 -9.858 -8.096 -4.101 1.00 0.56 H new ATOM 0 HG2 LYS A 138 -8.608 -9.573 -5.638 1.00 0.61 H new ATOM 0 HG3 LYS A 138 -9.674 -10.914 -5.267 1.00 0.61 H new ATOM 0 HD2 LYS A 138 -10.668 -8.298 -6.477 1.00 0.77 H new ATOM 0 HD3 LYS A 138 -10.154 -9.660 -7.454 1.00 0.77 H new ATOM 0 HE2 LYS A 138 -12.230 -10.126 -5.312 1.00 2.31 H new ATOM 0 HE3 LYS A 138 -12.717 -9.319 -6.790 1.00 2.31 H new ATOM 0 HZ1 LYS A 138 -13.036 -11.692 -6.941 1.00 3.40 H new ATOM 0 HZ2 LYS A 138 -11.862 -11.190 -8.061 1.00 3.40 H new ATOM 0 HZ3 LYS A 138 -11.390 -11.972 -6.629 1.00 3.40 H new ATOM 1744 N TYR A 139 -8.349 -7.755 -1.645 1.00 0.37 N ATOM 1745 CA TYR A 139 -8.046 -6.835 -0.536 1.00 0.33 C ATOM 1746 C TYR A 139 -7.685 -5.440 -1.080 1.00 0.30 C ATOM 1747 O TYR A 139 -7.485 -5.259 -2.284 1.00 0.35 O ATOM 1748 CB TYR A 139 -6.849 -7.392 0.260 1.00 0.33 C ATOM 1749 CG TYR A 139 -7.076 -8.748 0.893 1.00 0.35 C ATOM 1750 CD1 TYR A 139 -7.704 -8.831 2.148 1.00 0.41 C ATOM 1751 CD2 TYR A 139 -6.686 -9.924 0.219 1.00 0.37 C ATOM 1752 CE1 TYR A 139 -7.979 -10.092 2.707 1.00 0.45 C ATOM 1753 CE2 TYR A 139 -6.968 -11.183 0.780 1.00 0.41 C ATOM 1754 CZ TYR A 139 -7.639 -11.263 2.012 1.00 0.43 C ATOM 1755 OH TYR A 139 -7.994 -12.462 2.534 1.00 0.49 O ATOM 0 H TYR A 139 -7.817 -7.519 -2.483 1.00 0.37 H new ATOM 0 HA TYR A 139 -8.922 -6.747 0.106 1.00 0.33 H new ATOM 0 HB2 TYR A 139 -5.989 -7.458 -0.406 1.00 0.33 H new ATOM 0 HB3 TYR A 139 -6.591 -6.680 1.044 1.00 0.33 H new ATOM 0 HD1 TYR A 139 -7.974 -7.931 2.680 1.00 0.41 H new ATOM 0 HD2 TYR A 139 -6.171 -9.858 -0.728 1.00 0.37 H new ATOM 0 HE1 TYR A 139 -8.454 -10.159 3.675 1.00 0.45 H new ATOM 0 HE2 TYR A 139 -6.670 -12.085 0.266 1.00 0.41 H new ATOM 0 HH TYR A 139 -7.508 -13.177 2.072 1.00 0.49 H new ATOM 1765 N LYS A 140 -7.567 -4.452 -0.188 1.00 0.29 N ATOM 1766 CA LYS A 140 -7.150 -3.072 -0.519 1.00 0.29 C ATOM 1767 C LYS A 140 -6.180 -2.468 0.505 1.00 0.29 C ATOM 1768 O LYS A 140 -6.121 -2.927 1.643 1.00 0.45 O ATOM 1769 CB LYS A 140 -8.389 -2.172 -0.719 1.00 0.33 C ATOM 1770 CG LYS A 140 -9.165 -2.494 -1.993 1.00 0.41 C ATOM 1771 CD LYS A 140 -10.161 -1.379 -2.313 1.00 0.45 C ATOM 1772 CE LYS A 140 -10.971 -1.882 -3.506 1.00 0.65 C ATOM 1773 NZ LYS A 140 -11.769 -0.815 -4.158 1.00 1.74 N ATOM 0 H LYS A 140 -7.761 -4.584 0.805 1.00 0.29 H new ATOM 0 HA LYS A 140 -6.594 -3.125 -1.455 1.00 0.29 H new ATOM 0 HB2 LYS A 140 -9.052 -2.280 0.140 1.00 0.33 H new ATOM 0 HB3 LYS A 140 -8.072 -1.129 -0.748 1.00 0.33 H new ATOM 0 HG2 LYS A 140 -8.472 -2.620 -2.825 1.00 0.41 H new ATOM 0 HG3 LYS A 140 -9.695 -3.439 -1.873 1.00 0.41 H new ATOM 0 HD2 LYS A 140 -10.807 -1.173 -1.459 1.00 0.45 H new ATOM 0 HD3 LYS A 140 -9.645 -0.449 -2.553 1.00 0.45 H new ATOM 0 HE2 LYS A 140 -10.294 -2.320 -4.239 1.00 0.65 H new ATOM 0 HE3 LYS A 140 -11.640 -2.677 -3.175 1.00 0.65 H new ATOM 0 HZ1 LYS A 140 -12.296 -1.216 -4.959 1.00 1.74 H new ATOM 0 HZ2 LYS A 140 -12.438 -0.412 -3.471 1.00 1.74 H new ATOM 0 HZ3 LYS A 140 -11.133 -0.067 -4.502 1.00 1.74 H new ATOM 1787 N ILE A 141 -5.445 -1.417 0.132 1.00 0.29 N ATOM 1788 CA ILE A 141 -4.544 -0.648 1.014 1.00 0.28 C ATOM 1789 C ILE A 141 -4.895 0.847 0.952 1.00 0.28 C ATOM 1790 O ILE A 141 -5.069 1.399 -0.136 1.00 0.33 O ATOM 1791 CB ILE A 141 -3.052 -0.900 0.674 1.00 0.30 C ATOM 1792 CG1 ILE A 141 -2.612 -2.370 0.874 1.00 0.33 C ATOM 1793 CG2 ILE A 141 -2.102 -0.043 1.527 1.00 0.30 C ATOM 1794 CD1 ILE A 141 -2.672 -3.192 -0.412 1.00 0.39 C ATOM 0 H ILE A 141 -5.457 -1.061 -0.824 1.00 0.29 H new ATOM 0 HA ILE A 141 -4.692 -0.994 2.037 1.00 0.28 H new ATOM 0 HB ILE A 141 -2.982 -0.631 -0.380 1.00 0.30 H new ATOM 0 HG12 ILE A 141 -1.594 -2.389 1.263 1.00 0.33 H new ATOM 0 HG13 ILE A 141 -3.250 -2.835 1.626 1.00 0.33 H new ATOM 0 HG21 ILE A 141 -1.070 -0.258 1.249 1.00 0.30 H new ATOM 0 HG22 ILE A 141 -2.312 1.013 1.356 1.00 0.30 H new ATOM 0 HG23 ILE A 141 -2.250 -0.276 2.582 1.00 0.30 H new ATOM 0 HD11 ILE A 141 -2.352 -4.213 -0.206 1.00 0.39 H new ATOM 0 HD12 ILE A 141 -3.694 -3.202 -0.790 1.00 0.39 H new ATOM 0 HD13 ILE A 141 -2.013 -2.748 -1.158 1.00 0.39 H new ATOM 1806 N TYR A 142 -4.964 1.492 2.123 1.00 0.27 N ATOM 1807 CA TYR A 142 -5.272 2.919 2.294 1.00 0.28 C ATOM 1808 C TYR A 142 -4.149 3.653 3.036 1.00 0.30 C ATOM 1809 O TYR A 142 -3.622 3.150 4.027 1.00 0.31 O ATOM 1810 CB TYR A 142 -6.612 3.097 3.022 1.00 0.32 C ATOM 1811 CG TYR A 142 -7.824 2.882 2.144 1.00 0.32 C ATOM 1812 CD1 TYR A 142 -8.197 1.577 1.764 1.00 1.69 C ATOM 1813 CD2 TYR A 142 -8.587 3.986 1.712 1.00 1.86 C ATOM 1814 CE1 TYR A 142 -9.326 1.361 0.962 1.00 1.72 C ATOM 1815 CE2 TYR A 142 -9.724 3.772 0.916 1.00 1.84 C ATOM 1816 CZ TYR A 142 -10.090 2.464 0.537 1.00 0.35 C ATOM 1817 OH TYR A 142 -11.186 2.275 -0.237 1.00 0.40 O ATOM 0 H TYR A 142 -4.801 1.018 3.011 1.00 0.27 H new ATOM 0 HA TYR A 142 -5.354 3.362 1.302 1.00 0.28 H new ATOM 0 HB2 TYR A 142 -6.654 2.400 3.859 1.00 0.32 H new ATOM 0 HB3 TYR A 142 -6.654 4.102 3.442 1.00 0.32 H new ATOM 0 HD1 TYR A 142 -7.607 0.735 2.094 1.00 1.69 H new ATOM 0 HD2 TYR A 142 -8.299 4.989 1.991 1.00 1.86 H new ATOM 0 HE1 TYR A 142 -9.607 0.359 0.673 1.00 1.72 H new ATOM 0 HE2 TYR A 142 -10.320 4.612 0.593 1.00 1.84 H new ATOM 0 HH TYR A 142 -11.597 3.141 -0.439 1.00 0.40 H new ATOM 1827 N GLU A 143 -3.803 4.850 2.564 1.00 0.37 N ATOM 1828 CA GLU A 143 -2.630 5.635 2.979 1.00 0.45 C ATOM 1829 C GLU A 143 -3.057 6.800 3.892 1.00 0.58 C ATOM 1830 O GLU A 143 -3.566 7.829 3.436 1.00 0.85 O ATOM 1831 CB GLU A 143 -1.924 6.060 1.685 1.00 0.64 C ATOM 1832 CG GLU A 143 -0.519 6.633 1.841 1.00 0.93 C ATOM 1833 CD GLU A 143 0.018 7.118 0.483 1.00 1.24 C ATOM 1834 OE1 GLU A 143 -0.166 6.438 -0.556 1.00 2.63 O ATOM 1835 OE2 GLU A 143 0.640 8.206 0.429 1.00 1.52 O ATOM 0 H GLU A 143 -4.355 5.325 1.849 1.00 0.37 H new ATOM 0 HA GLU A 143 -1.928 5.064 3.588 1.00 0.45 H new ATOM 0 HB2 GLU A 143 -1.870 5.195 1.024 1.00 0.64 H new ATOM 0 HB3 GLU A 143 -2.544 6.804 1.185 1.00 0.64 H new ATOM 0 HG2 GLU A 143 -0.534 7.461 2.550 1.00 0.93 H new ATOM 0 HG3 GLU A 143 0.146 5.874 2.252 1.00 0.93 H new ATOM 1842 N ILE A 144 -2.883 6.623 5.203 1.00 0.56 N ATOM 1843 CA ILE A 144 -3.456 7.486 6.245 1.00 0.60 C ATOM 1844 C ILE A 144 -2.369 8.362 6.880 1.00 0.65 C ATOM 1845 O ILE A 144 -1.519 7.867 7.614 1.00 0.74 O ATOM 1846 CB ILE A 144 -4.164 6.608 7.311 1.00 0.57 C ATOM 1847 CG1 ILE A 144 -5.122 5.534 6.740 1.00 0.54 C ATOM 1848 CG2 ILE A 144 -4.908 7.488 8.329 1.00 0.65 C ATOM 1849 CD1 ILE A 144 -6.275 6.056 5.878 1.00 0.58 C ATOM 0 H ILE A 144 -2.326 5.857 5.582 1.00 0.56 H new ATOM 0 HA ILE A 144 -4.192 8.153 5.796 1.00 0.60 H new ATOM 0 HB ILE A 144 -3.361 6.056 7.800 1.00 0.57 H new ATOM 0 HG12 ILE A 144 -4.537 4.833 6.144 1.00 0.54 H new ATOM 0 HG13 ILE A 144 -5.543 4.971 7.573 1.00 0.54 H new ATOM 0 HG21 ILE A 144 -5.398 6.854 9.068 1.00 0.65 H new ATOM 0 HG22 ILE A 144 -4.197 8.146 8.829 1.00 0.65 H new ATOM 0 HG23 ILE A 144 -5.657 8.088 7.812 1.00 0.65 H new ATOM 0 HD11 ILE A 144 -6.880 5.217 5.533 1.00 0.58 H new ATOM 0 HD12 ILE A 144 -6.894 6.731 6.469 1.00 0.58 H new ATOM 0 HD13 ILE A 144 -5.873 6.591 5.018 1.00 0.58 H new ATOM 1861 N HIS A 145 -2.431 9.682 6.695 1.00 0.75 N ATOM 1862 CA HIS A 145 -1.431 10.625 7.228 1.00 0.86 C ATOM 1863 C HIS A 145 -1.750 11.088 8.676 1.00 0.90 C ATOM 1864 O HIS A 145 -1.319 12.163 9.095 1.00 1.43 O ATOM 1865 CB HIS A 145 -1.227 11.781 6.221 1.00 1.12 C ATOM 1866 CG HIS A 145 -0.211 11.492 5.137 1.00 1.65 C ATOM 1867 ND1 HIS A 145 0.888 12.271 4.843 1.00 2.81 N ATOM 1868 CD2 HIS A 145 -0.194 10.438 4.259 1.00 2.55 C ATOM 1869 CE1 HIS A 145 1.547 11.710 3.819 1.00 3.78 C ATOM 1870 NE2 HIS A 145 0.924 10.584 3.420 1.00 3.67 N ATOM 0 H HIS A 145 -3.178 10.135 6.169 1.00 0.75 H new ATOM 0 HA HIS A 145 -0.476 10.109 7.330 1.00 0.86 H new ATOM 0 HB2 HIS A 145 -2.184 12.013 5.753 1.00 1.12 H new ATOM 0 HB3 HIS A 145 -0.915 12.672 6.767 1.00 1.12 H new ATOM 0 HD2 HIS A 145 -0.915 9.635 4.219 1.00 2.55 H new ATOM 0 HE1 HIS A 145 2.450 12.105 3.377 1.00 3.78 H new ATOM 0 HE2 HIS A 145 1.207 9.963 2.662 1.00 3.67 H new ATOM 1878 N SER A 146 -2.533 10.312 9.441 1.00 0.75 N ATOM 1879 CA SER A 146 -2.979 10.653 10.810 1.00 0.87 C ATOM 1880 C SER A 146 -2.019 10.207 11.925 1.00 0.89 C ATOM 1881 O SER A 146 -2.056 10.778 13.016 1.00 1.15 O ATOM 1882 CB SER A 146 -4.376 10.079 11.095 1.00 1.05 C ATOM 1883 OG SER A 146 -5.291 10.411 10.066 1.00 1.77 O ATOM 0 H SER A 146 -2.884 9.409 9.122 1.00 0.75 H new ATOM 0 HA SER A 146 -3.000 11.743 10.828 1.00 0.87 H new ATOM 0 HB2 SER A 146 -4.313 8.995 11.192 1.00 1.05 H new ATOM 0 HB3 SER A 146 -4.742 10.463 12.047 1.00 1.05 H new ATOM 0 HG SER A 146 -6.170 10.031 10.275 1.00 1.77 H new ATOM 2086 N LYS A 162 -2.434 14.470 -3.124 1.00 1.39 N ATOM 2087 CA LYS A 162 -3.316 13.355 -2.752 1.00 1.41 C ATOM 2088 C LYS A 162 -2.896 12.034 -3.405 1.00 1.23 C ATOM 2089 O LYS A 162 -2.772 11.941 -4.635 1.00 1.35 O ATOM 2090 CB LYS A 162 -4.760 13.740 -3.115 1.00 1.76 C ATOM 2091 CG LYS A 162 -5.837 12.677 -2.873 1.00 1.56 C ATOM 2092 CD LYS A 162 -6.254 12.027 -4.204 1.00 1.88 C ATOM 2093 CE LYS A 162 -7.356 10.982 -4.063 1.00 1.62 C ATOM 2094 NZ LYS A 162 -8.564 11.515 -3.392 1.00 1.71 N ATOM 0 HA LYS A 162 -3.240 13.183 -1.678 1.00 1.41 H new ATOM 0 HB2 LYS A 162 -5.028 14.631 -2.547 1.00 1.76 H new ATOM 0 HB3 LYS A 162 -4.784 14.015 -4.169 1.00 1.76 H new ATOM 0 HG2 LYS A 162 -5.459 11.915 -2.191 1.00 1.56 H new ATOM 0 HG3 LYS A 162 -6.705 13.131 -2.394 1.00 1.56 H new ATOM 0 HD2 LYS A 162 -6.591 12.806 -4.888 1.00 1.88 H new ATOM 0 HD3 LYS A 162 -5.380 11.560 -4.659 1.00 1.88 H new ATOM 0 HE2 LYS A 162 -7.628 10.610 -5.051 1.00 1.62 H new ATOM 0 HE3 LYS A 162 -6.975 10.132 -3.496 1.00 1.62 H new ATOM 0 HZ1 LYS A 162 -9.333 10.818 -3.457 1.00 1.71 H new ATOM 0 HZ2 LYS A 162 -8.351 11.704 -2.392 1.00 1.71 H new ATOM 0 HZ3 LYS A 162 -8.858 12.398 -3.856 1.00 1.71 H new ATOM 2108 N ALA A 163 -2.756 11.003 -2.574 1.00 1.09 N ATOM 2109 CA ALA A 163 -2.599 9.616 -2.997 1.00 0.94 C ATOM 2110 C ALA A 163 -3.960 8.976 -3.306 1.00 0.85 C ATOM 2111 O ALA A 163 -4.961 9.304 -2.661 1.00 0.87 O ATOM 2112 CB ALA A 163 -1.836 8.837 -1.924 1.00 1.03 C ATOM 0 H ALA A 163 -2.749 11.114 -1.560 1.00 1.09 H new ATOM 0 HA ALA A 163 -2.020 9.587 -3.920 1.00 0.94 H new ATOM 0 HB1 ALA A 163 -1.719 7.801 -2.241 1.00 1.03 H new ATOM 0 HB2 ALA A 163 -0.853 9.285 -1.779 1.00 1.03 H new ATOM 0 HB3 ALA A 163 -2.391 8.869 -0.987 1.00 1.03 H new ATOM 2118 N VAL A 164 -4.006 8.057 -4.274 1.00 0.82 N ATOM 2119 CA VAL A 164 -5.195 7.226 -4.546 1.00 0.69 C ATOM 2120 C VAL A 164 -5.003 5.805 -3.972 1.00 0.60 C ATOM 2121 O VAL A 164 -3.864 5.324 -3.931 1.00 0.66 O ATOM 2122 CB VAL A 164 -5.581 7.174 -6.040 1.00 0.68 C ATOM 2123 CG1 VAL A 164 -6.469 8.363 -6.410 1.00 0.95 C ATOM 2124 CG2 VAL A 164 -4.376 7.111 -6.977 1.00 0.75 C ATOM 0 H VAL A 164 -3.221 7.863 -4.896 1.00 0.82 H new ATOM 0 HA VAL A 164 -6.032 7.707 -4.039 1.00 0.69 H new ATOM 0 HB VAL A 164 -6.134 6.245 -6.176 1.00 0.68 H new ATOM 0 HG11 VAL A 164 -6.730 8.307 -7.467 1.00 0.95 H new ATOM 0 HG12 VAL A 164 -7.379 8.338 -5.810 1.00 0.95 H new ATOM 0 HG13 VAL A 164 -5.932 9.292 -6.217 1.00 0.95 H new ATOM 0 HG21 VAL A 164 -4.720 7.077 -8.011 1.00 0.75 H new ATOM 0 HG22 VAL A 164 -3.755 7.995 -6.831 1.00 0.75 H new ATOM 0 HG23 VAL A 164 -3.792 6.217 -6.759 1.00 0.75 H new ATOM 2134 N PRO A 165 -6.072 5.121 -3.518 1.00 0.57 N ATOM 2135 CA PRO A 165 -5.979 3.827 -2.826 1.00 0.60 C ATOM 2136 C PRO A 165 -5.582 2.666 -3.754 1.00 0.58 C ATOM 2137 O PRO A 165 -5.759 2.738 -4.974 1.00 0.71 O ATOM 2138 CB PRO A 165 -7.354 3.605 -2.183 1.00 0.60 C ATOM 2139 CG PRO A 165 -8.302 4.403 -3.080 1.00 0.56 C ATOM 2140 CD PRO A 165 -7.454 5.577 -3.565 1.00 0.56 C ATOM 0 HA PRO A 165 -5.182 3.849 -2.082 1.00 0.60 H new ATOM 0 HB2 PRO A 165 -7.619 2.548 -2.159 1.00 0.60 H new ATOM 0 HB3 PRO A 165 -7.378 3.964 -1.154 1.00 0.60 H new ATOM 0 HG2 PRO A 165 -8.664 3.801 -3.914 1.00 0.56 H new ATOM 0 HG3 PRO A 165 -9.179 4.745 -2.530 1.00 0.56 H new ATOM 0 HD2 PRO A 165 -7.734 5.869 -4.577 1.00 0.56 H new ATOM 0 HD3 PRO A 165 -7.598 6.451 -2.930 1.00 0.56 H new ATOM 2148 N ILE A 166 -5.066 1.577 -3.174 1.00 0.51 N ATOM 2149 CA ILE A 166 -4.570 0.395 -3.906 1.00 0.49 C ATOM 2150 C ILE A 166 -5.501 -0.811 -3.722 1.00 0.50 C ATOM 2151 O ILE A 166 -6.045 -1.015 -2.638 1.00 0.75 O ATOM 2152 CB ILE A 166 -3.140 -0.029 -3.473 1.00 0.54 C ATOM 2153 CG1 ILE A 166 -2.260 1.072 -2.836 1.00 0.91 C ATOM 2154 CG2 ILE A 166 -2.417 -0.635 -4.693 1.00 0.54 C ATOM 2155 CD1 ILE A 166 -0.947 0.509 -2.269 1.00 1.72 C ATOM 0 H ILE A 166 -4.977 1.486 -2.162 1.00 0.51 H new ATOM 0 HA ILE A 166 -4.544 0.697 -4.953 1.00 0.49 H new ATOM 0 HB ILE A 166 -3.283 -0.752 -2.670 1.00 0.54 H new ATOM 0 HG12 ILE A 166 -2.035 1.833 -3.584 1.00 0.91 H new ATOM 0 HG13 ILE A 166 -2.817 1.564 -2.039 1.00 0.91 H new ATOM 0 HG21 ILE A 166 -1.410 -0.938 -4.406 1.00 0.54 H new ATOM 0 HG22 ILE A 166 -2.970 -1.504 -5.049 1.00 0.54 H new ATOM 0 HG23 ILE A 166 -2.359 0.109 -5.488 1.00 0.54 H new ATOM 0 HD11 ILE A 166 -0.362 1.319 -1.832 1.00 1.72 H new ATOM 0 HD12 ILE A 166 -1.170 -0.232 -1.502 1.00 1.72 H new ATOM 0 HD13 ILE A 166 -0.376 0.041 -3.071 1.00 1.72 H new ATOM 2167 N GLU A 167 -5.595 -1.670 -4.736 1.00 0.59 N ATOM 2168 CA GLU A 167 -6.234 -2.990 -4.686 1.00 0.61 C ATOM 2169 C GLU A 167 -5.218 -4.113 -4.966 1.00 0.61 C ATOM 2170 O GLU A 167 -4.242 -3.909 -5.698 1.00 0.83 O ATOM 2171 CB GLU A 167 -7.452 -3.044 -5.621 1.00 0.70 C ATOM 2172 CG GLU A 167 -7.152 -2.823 -7.111 1.00 1.71 C ATOM 2173 CD GLU A 167 -6.767 -1.376 -7.434 1.00 3.43 C ATOM 2174 OE1 GLU A 167 -7.613 -0.464 -7.271 1.00 4.19 O ATOM 2175 OE2 GLU A 167 -5.615 -1.146 -7.876 1.00 4.83 O ATOM 0 H GLU A 167 -5.212 -1.458 -5.657 1.00 0.59 H new ATOM 0 HA GLU A 167 -6.605 -3.156 -3.675 1.00 0.61 H new ATOM 0 HB2 GLU A 167 -7.934 -4.015 -5.505 1.00 0.70 H new ATOM 0 HB3 GLU A 167 -8.170 -2.291 -5.297 1.00 0.70 H new ATOM 0 HG2 GLU A 167 -6.342 -3.486 -7.415 1.00 1.71 H new ATOM 0 HG3 GLU A 167 -8.028 -3.100 -7.698 1.00 1.71 H new ATOM 2182 N ILE A 168 -5.418 -5.288 -4.363 1.00 0.44 N ATOM 2183 CA ILE A 168 -4.483 -6.415 -4.426 1.00 0.42 C ATOM 2184 C ILE A 168 -5.210 -7.768 -4.284 1.00 0.41 C ATOM 2185 O ILE A 168 -6.187 -7.898 -3.544 1.00 0.45 O ATOM 2186 CB ILE A 168 -3.374 -6.204 -3.361 1.00 0.43 C ATOM 2187 CG1 ILE A 168 -2.187 -7.154 -3.596 1.00 0.45 C ATOM 2188 CG2 ILE A 168 -3.905 -6.339 -1.923 1.00 0.43 C ATOM 2189 CD1 ILE A 168 -0.947 -6.835 -2.751 1.00 0.49 C ATOM 0 H ILE A 168 -6.250 -5.486 -3.807 1.00 0.44 H new ATOM 0 HA ILE A 168 -4.011 -6.448 -5.408 1.00 0.42 H new ATOM 0 HB ILE A 168 -3.023 -5.179 -3.477 1.00 0.43 H new ATOM 0 HG12 ILE A 168 -2.505 -8.174 -3.382 1.00 0.45 H new ATOM 0 HG13 ILE A 168 -1.913 -7.120 -4.650 1.00 0.45 H new ATOM 0 HG21 ILE A 168 -3.089 -6.182 -1.218 1.00 0.43 H new ATOM 0 HG22 ILE A 168 -4.682 -5.594 -1.751 1.00 0.43 H new ATOM 0 HG23 ILE A 168 -4.321 -7.336 -1.781 1.00 0.43 H new ATOM 0 HD11 ILE A 168 -0.158 -7.552 -2.978 1.00 0.49 H new ATOM 0 HD12 ILE A 168 -0.599 -5.828 -2.981 1.00 0.49 H new ATOM 0 HD13 ILE A 168 -1.201 -6.899 -1.693 1.00 0.49 H new ATOM 2201 N GLU A 169 -4.697 -8.795 -4.958 1.00 0.47 N ATOM 2202 CA GLU A 169 -5.092 -10.201 -4.803 1.00 0.51 C ATOM 2203 C GLU A 169 -3.856 -11.045 -4.437 1.00 0.57 C ATOM 2204 O GLU A 169 -2.751 -10.766 -4.912 1.00 0.74 O ATOM 2205 CB GLU A 169 -5.792 -10.691 -6.086 1.00 0.53 C ATOM 2206 CG GLU A 169 -6.534 -12.020 -5.867 1.00 0.69 C ATOM 2207 CD GLU A 169 -7.407 -12.464 -7.053 1.00 0.82 C ATOM 2208 OE1 GLU A 169 -7.387 -11.837 -8.143 1.00 1.78 O ATOM 2209 OE2 GLU A 169 -8.129 -13.478 -6.893 1.00 1.84 O ATOM 0 H GLU A 169 -3.964 -8.670 -5.657 1.00 0.47 H new ATOM 0 HA GLU A 169 -5.809 -10.308 -3.989 1.00 0.51 H new ATOM 0 HB2 GLU A 169 -6.498 -9.933 -6.425 1.00 0.53 H new ATOM 0 HB3 GLU A 169 -5.053 -10.815 -6.877 1.00 0.53 H new ATOM 0 HG2 GLU A 169 -5.802 -12.800 -5.658 1.00 0.69 H new ATOM 0 HG3 GLU A 169 -7.164 -11.929 -4.982 1.00 0.69 H new ATOM 2216 N LEU A 170 -4.025 -12.051 -3.568 1.00 0.51 N ATOM 2217 CA LEU A 170 -2.908 -12.804 -2.975 1.00 0.54 C ATOM 2218 C LEU A 170 -2.090 -13.614 -4.000 1.00 0.51 C ATOM 2219 O LEU A 170 -2.674 -14.105 -4.971 1.00 0.63 O ATOM 2220 CB LEU A 170 -3.435 -13.760 -1.900 1.00 0.60 C ATOM 2221 CG LEU A 170 -4.007 -13.110 -0.630 1.00 0.69 C ATOM 2222 CD1 LEU A 170 -4.219 -14.190 0.427 1.00 0.92 C ATOM 2223 CD2 LEU A 170 -3.132 -12.024 -0.001 1.00 0.98 C ATOM 0 H LEU A 170 -4.943 -12.367 -3.255 1.00 0.51 H new ATOM 0 HA LEU A 170 -2.239 -12.058 -2.547 1.00 0.54 H new ATOM 0 HB2 LEU A 170 -4.212 -14.381 -2.346 1.00 0.60 H new ATOM 0 HB3 LEU A 170 -2.623 -14.426 -1.607 1.00 0.60 H new ATOM 0 HG LEU A 170 -4.931 -12.627 -0.948 1.00 0.69 H new ATOM 0 HD11 LEU A 170 -4.625 -13.738 1.332 1.00 0.92 H new ATOM 0 HD12 LEU A 170 -4.918 -14.937 0.049 1.00 0.92 H new ATOM 0 HD13 LEU A 170 -3.266 -14.668 0.655 1.00 0.92 H new ATOM 0 HD21 LEU A 170 -3.624 -11.630 0.888 1.00 0.98 H new ATOM 0 HD22 LEU A 170 -2.168 -12.449 0.277 1.00 0.98 H new ATOM 0 HD23 LEU A 170 -2.980 -11.218 -0.719 1.00 0.98 H new ATOM 2235 N PRO A 171 -0.774 -13.825 -3.775 1.00 0.52 N ATOM 2236 CA PRO A 171 0.132 -14.374 -4.779 1.00 0.56 C ATOM 2237 C PRO A 171 -0.137 -15.843 -5.118 1.00 0.59 C ATOM 2238 O PRO A 171 0.131 -16.743 -4.329 1.00 0.74 O ATOM 2239 CB PRO A 171 1.552 -14.173 -4.231 1.00 0.62 C ATOM 2240 CG PRO A 171 1.359 -14.096 -2.720 1.00 0.62 C ATOM 2241 CD PRO A 171 -0.015 -13.449 -2.589 1.00 0.63 C ATOM 0 HA PRO A 171 -0.016 -13.854 -5.726 1.00 0.56 H new ATOM 0 HB2 PRO A 171 2.207 -14.999 -4.508 1.00 0.62 H new ATOM 0 HB3 PRO A 171 2.005 -13.262 -4.622 1.00 0.62 H new ATOM 0 HG2 PRO A 171 1.387 -15.083 -2.258 1.00 0.62 H new ATOM 0 HG3 PRO A 171 2.135 -13.498 -2.243 1.00 0.62 H new ATOM 0 HD2 PRO A 171 -0.518 -13.790 -1.684 1.00 0.63 H new ATOM 0 HD3 PRO A 171 0.074 -12.365 -2.515 1.00 0.63 H new ATOM 2249 N LEU A 172 -0.623 -16.061 -6.334 1.00 0.64 N ATOM 2250 CA LEU A 172 -0.723 -17.343 -7.041 1.00 0.72 C ATOM 2251 C LEU A 172 -0.049 -17.126 -8.415 1.00 0.83 C ATOM 2252 O LEU A 172 -0.678 -17.145 -9.477 1.00 1.07 O ATOM 2253 CB LEU A 172 -2.197 -17.804 -7.071 1.00 0.81 C ATOM 2254 CG LEU A 172 -2.445 -19.323 -7.170 1.00 1.20 C ATOM 2255 CD1 LEU A 172 -1.818 -19.966 -8.407 1.00 2.20 C ATOM 2256 CD2 LEU A 172 -1.949 -20.070 -5.929 1.00 2.43 C ATOM 0 H LEU A 172 -0.986 -15.293 -6.898 1.00 0.64 H new ATOM 0 HA LEU A 172 -0.205 -18.167 -6.550 1.00 0.72 H new ATOM 0 HB2 LEU A 172 -2.687 -17.437 -6.169 1.00 0.81 H new ATOM 0 HB3 LEU A 172 -2.687 -17.323 -7.918 1.00 0.81 H new ATOM 0 HG LEU A 172 -3.528 -19.415 -7.249 1.00 1.20 H new ATOM 0 HD11 LEU A 172 -2.033 -21.035 -8.410 1.00 2.20 H new ATOM 0 HD12 LEU A 172 -2.234 -19.509 -9.305 1.00 2.20 H new ATOM 0 HD13 LEU A 172 -0.739 -19.813 -8.389 1.00 2.20 H new ATOM 0 HD21 LEU A 172 -2.145 -21.136 -6.044 1.00 2.43 H new ATOM 0 HD22 LEU A 172 -0.878 -19.908 -5.811 1.00 2.43 H new ATOM 0 HD23 LEU A 172 -2.471 -19.698 -5.047 1.00 2.43 H new ATOM 2268 N ASN A 173 1.241 -16.786 -8.345 1.00 0.99 N ATOM 2269 CA ASN A 173 2.071 -16.244 -9.427 1.00 1.10 C ATOM 2270 C ASN A 173 3.551 -16.639 -9.204 1.00 1.19 C ATOM 2271 O ASN A 173 3.985 -16.720 -8.053 1.00 1.96 O ATOM 2272 CB ASN A 173 1.845 -14.717 -9.362 1.00 1.12 C ATOM 2273 CG ASN A 173 2.330 -13.891 -10.535 1.00 1.66 C ATOM 2274 OD1 ASN A 173 3.053 -14.342 -11.417 1.00 3.10 O ATOM 2275 ND2 ASN A 173 1.944 -12.636 -10.540 1.00 1.36 N ATOM 0 H ASN A 173 1.768 -16.888 -7.477 1.00 0.99 H new ATOM 0 HA ASN A 173 1.811 -16.632 -10.412 1.00 1.10 H new ATOM 0 HB2 ASN A 173 0.776 -14.539 -9.244 1.00 1.12 H new ATOM 0 HB3 ASN A 173 2.332 -14.342 -8.462 1.00 1.12 H new ATOM 0 HD21 ASN A 173 2.246 -12.013 -11.289 1.00 1.36 H new ATOM 0 HD22 ASN A 173 1.342 -12.284 -9.795 1.00 1.36 H new ATOM 2282 N ASP A 174 4.341 -16.846 -10.264 1.00 1.21 N ATOM 2283 CA ASP A 174 5.739 -17.338 -10.228 1.00 1.34 C ATOM 2284 C ASP A 174 6.776 -16.307 -9.705 1.00 1.13 C ATOM 2285 O ASP A 174 7.966 -16.397 -10.016 1.00 1.36 O ATOM 2286 CB ASP A 174 6.114 -17.877 -11.629 1.00 1.73 C ATOM 2287 CG ASP A 174 7.368 -18.774 -11.689 1.00 2.75 C ATOM 2288 OD1 ASP A 174 7.680 -19.491 -10.706 1.00 4.01 O ATOM 2289 OD2 ASP A 174 8.030 -18.844 -12.756 1.00 3.11 O ATOM 0 H ASP A 174 4.017 -16.670 -11.215 1.00 1.21 H new ATOM 0 HA ASP A 174 5.780 -18.141 -9.492 1.00 1.34 H new ATOM 0 HB2 ASP A 174 5.267 -18.442 -12.019 1.00 1.73 H new ATOM 0 HB3 ASP A 174 6.265 -17.028 -12.296 1.00 1.73 H new ATOM 2294 N VAL A 175 6.356 -15.314 -8.917 1.00 0.92 N ATOM 2295 CA VAL A 175 7.242 -14.288 -8.336 1.00 0.91 C ATOM 2296 C VAL A 175 8.044 -14.835 -7.153 1.00 1.09 C ATOM 2297 O VAL A 175 7.586 -15.730 -6.438 1.00 1.21 O ATOM 2298 CB VAL A 175 6.514 -12.972 -7.998 1.00 0.75 C ATOM 2299 CG1 VAL A 175 5.644 -12.490 -9.165 1.00 0.91 C ATOM 2300 CG2 VAL A 175 5.639 -13.072 -6.752 1.00 0.57 C ATOM 0 H VAL A 175 5.377 -15.194 -8.658 1.00 0.92 H new ATOM 0 HA VAL A 175 7.958 -14.028 -9.116 1.00 0.91 H new ATOM 0 HB VAL A 175 7.309 -12.252 -7.803 1.00 0.75 H new ATOM 0 HG11 VAL A 175 5.147 -11.560 -8.889 1.00 0.91 H new ATOM 0 HG12 VAL A 175 6.271 -12.320 -10.040 1.00 0.91 H new ATOM 0 HG13 VAL A 175 4.895 -13.247 -9.397 1.00 0.91 H new ATOM 0 HG21 VAL A 175 5.155 -12.113 -6.569 1.00 0.57 H new ATOM 0 HG22 VAL A 175 4.879 -13.839 -6.902 1.00 0.57 H new ATOM 0 HG23 VAL A 175 6.257 -13.336 -5.894 1.00 0.57 H new ATOM 2310 N VAL A 176 9.250 -14.309 -6.939 1.00 1.23 N ATOM 2311 CA VAL A 176 10.131 -14.708 -5.828 1.00 1.44 C ATOM 2312 C VAL A 176 9.703 -14.051 -4.511 1.00 1.19 C ATOM 2313 O VAL A 176 9.773 -14.678 -3.451 1.00 1.36 O ATOM 2314 CB VAL A 176 11.595 -14.375 -6.171 1.00 1.76 C ATOM 2315 CG1 VAL A 176 12.534 -14.727 -5.015 1.00 2.10 C ATOM 2316 CG2 VAL A 176 12.057 -15.143 -7.417 1.00 2.17 C ATOM 0 H VAL A 176 9.652 -13.586 -7.535 1.00 1.23 H new ATOM 0 HA VAL A 176 10.045 -15.786 -5.689 1.00 1.44 H new ATOM 0 HB VAL A 176 11.636 -13.302 -6.359 1.00 1.76 H new ATOM 0 HG11 VAL A 176 13.559 -14.479 -5.291 1.00 2.10 H new ATOM 0 HG12 VAL A 176 12.249 -14.159 -4.129 1.00 2.10 H new ATOM 0 HG13 VAL A 176 12.463 -15.793 -4.801 1.00 2.10 H new ATOM 0 HG21 VAL A 176 13.094 -14.889 -7.637 1.00 2.17 H new ATOM 0 HG22 VAL A 176 11.976 -16.215 -7.235 1.00 2.17 H new ATOM 0 HG23 VAL A 176 11.429 -14.871 -8.266 1.00 2.17 H new ATOM 2326 N ASP A 177 9.223 -12.809 -4.585 1.00 0.87 N ATOM 2327 CA ASP A 177 8.633 -12.031 -3.490 1.00 0.65 C ATOM 2328 C ASP A 177 7.500 -11.137 -4.037 1.00 0.45 C ATOM 2329 O ASP A 177 7.600 -10.674 -5.178 1.00 0.49 O ATOM 2330 CB ASP A 177 9.699 -11.140 -2.833 1.00 0.81 C ATOM 2331 CG ASP A 177 10.745 -11.911 -2.034 1.00 1.66 C ATOM 2332 OD1 ASP A 177 10.356 -12.680 -1.121 1.00 2.51 O ATOM 2333 OD2 ASP A 177 11.964 -11.718 -2.270 1.00 3.00 O ATOM 0 H ASP A 177 9.235 -12.287 -5.461 1.00 0.87 H new ATOM 0 HA ASP A 177 8.235 -12.723 -2.748 1.00 0.65 H new ATOM 0 HB2 ASP A 177 10.202 -10.562 -3.608 1.00 0.81 H new ATOM 0 HB3 ASP A 177 9.205 -10.427 -2.173 1.00 0.81 H new ATOM 2338 N ALA A 178 6.456 -10.854 -3.244 1.00 0.38 N ATOM 2339 CA ALA A 178 5.356 -9.961 -3.642 1.00 0.34 C ATOM 2340 C ALA A 178 5.584 -8.519 -3.159 1.00 0.34 C ATOM 2341 O ALA A 178 6.043 -8.321 -2.026 1.00 0.37 O ATOM 2342 CB ALA A 178 4.030 -10.497 -3.091 1.00 0.39 C ATOM 0 H ALA A 178 6.350 -11.239 -2.305 1.00 0.38 H new ATOM 0 HA ALA A 178 5.321 -9.939 -4.731 1.00 0.34 H new ATOM 0 HB1 ALA A 178 3.218 -9.833 -3.388 1.00 0.39 H new ATOM 0 HB2 ALA A 178 3.847 -11.495 -3.490 1.00 0.39 H new ATOM 0 HB3 ALA A 178 4.081 -10.545 -2.003 1.00 0.39 H new ATOM 2348 N HIS A 179 5.222 -7.522 -3.979 1.00 0.34 N ATOM 2349 CA HIS A 179 5.370 -6.097 -3.645 1.00 0.35 C ATOM 2350 C HIS A 179 4.170 -5.215 -4.066 1.00 0.34 C ATOM 2351 O HIS A 179 3.257 -5.678 -4.755 1.00 0.43 O ATOM 2352 CB HIS A 179 6.710 -5.551 -4.189 1.00 0.39 C ATOM 2353 CG HIS A 179 7.925 -6.333 -3.758 1.00 0.45 C ATOM 2354 ND1 HIS A 179 8.854 -5.929 -2.834 1.00 0.54 N ATOM 2355 CD2 HIS A 179 8.341 -7.543 -4.244 1.00 0.46 C ATOM 2356 CE1 HIS A 179 9.788 -6.887 -2.730 1.00 0.60 C ATOM 2357 NE2 HIS A 179 9.526 -7.894 -3.581 1.00 0.54 N ATOM 0 H HIS A 179 4.815 -7.683 -4.900 1.00 0.34 H new ATOM 0 HA HIS A 179 5.382 -6.039 -2.557 1.00 0.35 H new ATOM 0 HB2 HIS A 179 6.668 -5.540 -5.278 1.00 0.39 H new ATOM 0 HB3 HIS A 179 6.825 -4.517 -3.864 1.00 0.39 H new ATOM 0 HD1 HIS A 179 8.838 -5.051 -2.315 1.00 0.54 H new ATOM 0 HD2 HIS A 179 7.844 -8.126 -5.005 1.00 0.46 H new ATOM 0 HE1 HIS A 179 10.632 -6.854 -2.057 1.00 0.60 H new ATOM 2365 N VAL A 180 4.147 -3.946 -3.623 1.00 0.30 N ATOM 2366 CA VAL A 180 3.056 -2.972 -3.874 1.00 0.36 C ATOM 2367 C VAL A 180 3.574 -1.544 -4.114 1.00 0.43 C ATOM 2368 O VAL A 180 4.463 -1.098 -3.385 1.00 0.43 O ATOM 2369 CB VAL A 180 2.060 -2.881 -2.694 1.00 0.44 C ATOM 2370 CG1 VAL A 180 0.657 -2.586 -3.206 1.00 0.57 C ATOM 2371 CG2 VAL A 180 1.955 -4.091 -1.767 1.00 0.46 C ATOM 0 H VAL A 180 4.905 -3.553 -3.065 1.00 0.30 H new ATOM 0 HA VAL A 180 2.563 -3.353 -4.768 1.00 0.36 H new ATOM 0 HB VAL A 180 2.484 -2.077 -2.092 1.00 0.44 H new ATOM 0 HG11 VAL A 180 -0.032 -2.525 -2.364 1.00 0.57 H new ATOM 0 HG12 VAL A 180 0.658 -1.638 -3.744 1.00 0.57 H new ATOM 0 HG13 VAL A 180 0.340 -3.384 -3.878 1.00 0.57 H new ATOM 0 HG21 VAL A 180 1.221 -3.889 -0.987 1.00 0.46 H new ATOM 0 HG22 VAL A 180 1.643 -4.963 -2.341 1.00 0.46 H new ATOM 0 HG23 VAL A 180 2.926 -4.285 -1.311 1.00 0.46 H new ATOM 2381 N TYR A 181 2.960 -0.800 -5.050 1.00 0.54 N ATOM 2382 CA TYR A 181 3.393 0.547 -5.471 1.00 0.60 C ATOM 2383 C TYR A 181 2.243 1.594 -5.509 1.00 0.64 C ATOM 2384 O TYR A 181 1.682 1.857 -6.578 1.00 0.79 O ATOM 2385 CB TYR A 181 4.129 0.414 -6.817 1.00 0.71 C ATOM 2386 CG TYR A 181 5.370 -0.449 -6.683 1.00 0.80 C ATOM 2387 CD1 TYR A 181 6.544 0.121 -6.158 1.00 1.42 C ATOM 2388 CD2 TYR A 181 5.325 -1.831 -6.960 1.00 2.13 C ATOM 2389 CE1 TYR A 181 7.658 -0.682 -5.866 1.00 1.43 C ATOM 2390 CE2 TYR A 181 6.414 -2.651 -6.611 1.00 2.25 C ATOM 2391 CZ TYR A 181 7.572 -2.078 -6.046 1.00 1.07 C ATOM 2392 OH TYR A 181 8.615 -2.873 -5.716 1.00 1.26 O ATOM 0 H TYR A 181 2.130 -1.124 -5.547 1.00 0.54 H new ATOM 0 HA TYR A 181 4.073 0.947 -4.719 1.00 0.60 H new ATOM 0 HB2 TYR A 181 3.459 -0.021 -7.559 1.00 0.71 H new ATOM 0 HB3 TYR A 181 4.408 1.403 -7.181 1.00 0.71 H new ATOM 0 HD1 TYR A 181 6.589 1.185 -5.978 1.00 1.42 H new ATOM 0 HD2 TYR A 181 4.457 -2.259 -7.439 1.00 2.13 H new ATOM 0 HE1 TYR A 181 8.573 -0.234 -5.507 1.00 1.43 H new ATOM 0 HE2 TYR A 181 6.363 -3.717 -6.776 1.00 2.25 H new ATOM 0 HH TYR A 181 8.299 -3.610 -5.153 1.00 1.26 H new ATOM 2402 N PRO A 182 1.880 2.223 -4.369 1.00 0.53 N ATOM 2403 CA PRO A 182 0.902 3.317 -4.301 1.00 0.53 C ATOM 2404 C PRO A 182 1.394 4.605 -4.971 1.00 0.55 C ATOM 2405 O PRO A 182 2.538 5.024 -4.768 1.00 0.60 O ATOM 2406 CB PRO A 182 0.624 3.585 -2.818 1.00 0.50 C ATOM 2407 CG PRO A 182 1.804 2.946 -2.083 1.00 0.49 C ATOM 2408 CD PRO A 182 2.386 1.910 -3.048 1.00 0.43 C ATOM 0 HA PRO A 182 0.004 3.016 -4.841 1.00 0.53 H new ATOM 0 HB2 PRO A 182 0.561 4.654 -2.613 1.00 0.50 H new ATOM 0 HB3 PRO A 182 -0.323 3.144 -2.506 1.00 0.50 H new ATOM 0 HG2 PRO A 182 2.550 3.695 -1.817 1.00 0.49 H new ATOM 0 HG3 PRO A 182 1.478 2.476 -1.155 1.00 0.49 H new ATOM 0 HD2 PRO A 182 3.475 1.942 -3.036 1.00 0.43 H new ATOM 0 HD3 PRO A 182 2.094 0.902 -2.753 1.00 0.43 H new ATOM 2416 N LYS A 183 0.498 5.269 -5.709 1.00 0.61 N ATOM 2417 CA LYS A 183 0.760 6.471 -6.524 1.00 0.66 C ATOM 2418 C LYS A 183 -0.162 7.644 -6.158 1.00 0.70 C ATOM 2419 O LYS A 183 -1.206 7.480 -5.521 1.00 1.03 O ATOM 2420 CB LYS A 183 0.615 6.101 -8.015 1.00 0.75 C ATOM 2421 CG LYS A 183 1.609 5.010 -8.459 1.00 0.80 C ATOM 2422 CD LYS A 183 1.273 4.442 -9.850 1.00 1.28 C ATOM 2423 CE LYS A 183 1.389 2.913 -9.896 1.00 1.53 C ATOM 2424 NZ LYS A 183 0.393 2.215 -9.056 1.00 1.93 N ATOM 0 H LYS A 183 -0.477 4.973 -5.760 1.00 0.61 H new ATOM 0 HA LYS A 183 1.776 6.810 -6.319 1.00 0.66 H new ATOM 0 HB2 LYS A 183 -0.402 5.757 -8.202 1.00 0.75 H new ATOM 0 HB3 LYS A 183 0.767 6.993 -8.622 1.00 0.75 H new ATOM 0 HG2 LYS A 183 2.617 5.424 -8.472 1.00 0.80 H new ATOM 0 HG3 LYS A 183 1.607 4.201 -7.729 1.00 0.80 H new ATOM 0 HD2 LYS A 183 0.260 4.736 -10.126 1.00 1.28 H new ATOM 0 HD3 LYS A 183 1.944 4.878 -10.590 1.00 1.28 H new ATOM 0 HE2 LYS A 183 1.278 2.580 -10.928 1.00 1.53 H new ATOM 0 HE3 LYS A 183 2.389 2.624 -9.574 1.00 1.53 H new ATOM 0 HZ1 LYS A 183 0.195 1.277 -9.459 1.00 1.93 H new ATOM 0 HZ2 LYS A 183 0.767 2.106 -8.092 1.00 1.93 H new ATOM 0 HZ3 LYS A 183 -0.486 2.771 -9.025 1.00 1.93 H new ATOM 2438 N ASN A 184 0.231 8.842 -6.588 0.49 0.59 N ATOM 2439 CA ASN A 184 -0.556 10.072 -6.472 0.49 0.70 C ATOM 2440 C ASN A 184 -1.185 10.447 -7.825 0.49 0.82 C ATOM 2441 O ASN A 184 -0.813 9.908 -8.866 0.49 0.86 O ATOM 2442 CB ASN A 184 0.307 11.193 -5.852 0.49 0.86 C ATOM 2443 CG ASN A 184 0.745 10.928 -4.421 0.49 1.56 C ATOM 2444 OD1 ASN A 184 0.621 9.843 -3.871 0.49 2.65 O ATOM 2445 ND2 ASN A 184 1.284 11.917 -3.764 0.49 1.93 N ATOM 0 H ASN A 184 1.133 8.990 -7.041 0.49 0.59 H new ATOM 0 HA ASN A 184 -1.394 9.914 -5.793 0.49 0.70 H new ATOM 0 HB2 ASN A 184 1.193 11.337 -6.470 0.49 0.86 H new ATOM 0 HB3 ASN A 184 -0.256 12.126 -5.880 0.49 0.86 H new ATOM 0 HD21 ASN A 184 1.596 11.780 -2.803 0.49 1.93 H new ATOM 0 HD22 ASN A 184 1.393 12.827 -4.211 0.49 1.93 H new ATOM 2452 N THR A 185 -2.169 11.350 -7.815 0.49 0.98 N ATOM 2453 CA THR A 185 -2.866 11.806 -9.045 0.49 1.22 C ATOM 2454 C THR A 185 -3.199 13.304 -9.056 0.49 1.55 C ATOM 2455 O THR A 185 -3.405 13.902 -10.114 0.49 2.95 O ATOM 2456 CB THR A 185 -4.103 10.925 -9.283 0.49 1.24 C ATOM 2457 OG1 THR A 185 -4.617 11.099 -10.585 0.49 1.72 O ATOM 2458 CG2 THR A 185 -5.238 11.158 -8.285 0.49 1.21 C ATOM 0 H THR A 185 -2.513 11.791 -6.962 0.49 0.98 H new ATOM 0 HA THR A 185 -2.174 11.686 -9.879 0.49 1.22 H new ATOM 0 HB THR A 185 -3.741 9.906 -9.144 0.49 1.24 H new ATOM 0 HG1 THR A 185 -5.402 10.525 -10.706 0.49 1.72 H new ATOM 0 HG21 THR A 185 -6.072 10.498 -8.522 0.49 1.21 H new ATOM 0 HG22 THR A 185 -4.884 10.947 -7.276 0.49 1.21 H new ATOM 0 HG23 THR A 185 -5.568 12.195 -8.344 0.49 1.21 H new