USER MOD reduce.3.24.130724 H: found=0, std=0, add=672, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 675 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 53 LYS NZ :NH3+ 140:sc= 1.21 (180deg=0.437) USER MOD Set 1.2: A 69 TYR OH : rot 165:sc= 1.12 USER MOD Set 2.1: A 39 SER OG : rot 77:sc= 1.24 USER MOD Set 2.2: A 40 LYS NZ :NH3+ -174:sc= 2.48 (180deg=2.3) USER MOD Set 2.3: A 63 SER OG : rot -90:sc= 1.16 USER MOD Set 2.4: A 65 THR OG1 : rot 95:sc= 2.22 USER MOD Set 3.1: A 32 LYS NZ :NH3+ 174:sc= 1.21 (180deg=-0.0264) USER MOD Set 3.2: A 36 GLN : amide:sc= 1.08 K(o=2.3,f=-6!) USER MOD Set 4.1: A 30 THR OG1 : rot 162:sc= 1.24 USER MOD Set 4.2: A 91 SER OG : rot -27:sc= 1.44 USER MOD Set 5.1: A 24 THR OG1 : rot 166:sc= 1.25 USER MOD Set 5.2: A 33 SER OG : rot 68:sc= 2.16 USER MOD Set 6.1: A 19 LYS NZ :NH3+ -149:sc= 3.31 (180deg=1.55) USER MOD Set 6.2: A 20 SER OG : rot 165:sc= 0.979 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.0994 K(o=-0.099,f=-2.5!) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 145:sc= 0.47 (180deg=-0.465!) USER MOD Single : A 22 LYS NZ :NH3+ 151:sc= 1.25 (180deg=1.06) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot -22:sc= 1.64 USER MOD Single : A 28 LYS NZ :NH3+ 174:sc= 0.998 (180deg=0.9) USER MOD Single : A 29 SER OG : rot -154:sc= 1.21 USER MOD Single : A 38 LYS NZ :NH3+ -167:sc= 3.68 (180deg=3.12) USER MOD Single : A 47 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 THR OG1 : rot 95:sc= 1.21 USER MOD Single : A 54 SER OG : rot 54:sc= 1.21 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 154:sc= 1.91 USER MOD Single : A 61 MET CE :methyl -167:sc= -0.0274 (180deg=-0.254) USER MOD Single : A 64 LYS NZ :NH3+ 173:sc= 2.27 (180deg=2.13) USER MOD Single : A 66 LYS NZ :NH3+ 162:sc= 1.25 (180deg=0.819) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.039 USER MOD Single : A 98 SER OG : rot -116:sc= 1.02 USER MOD ----------------------------------------------------------------- ATOM 108 N SER A 9 8.352 8.341 -25.443 1.00 0.00 N ATOM 109 CA SER A 9 7.432 7.553 -26.276 1.00 0.00 C ATOM 110 C SER A 9 6.437 6.729 -25.470 1.00 0.00 C ATOM 111 O SER A 9 5.258 6.783 -25.799 1.00 0.00 O ATOM 112 CB SER A 9 8.157 6.599 -27.224 1.00 0.00 C ATOM 113 OG SER A 9 8.666 7.285 -28.341 1.00 0.00 O ATOM 0 HA SER A 9 6.895 8.310 -26.848 1.00 0.00 H new ATOM 0 HB2 SER A 9 8.972 6.105 -26.695 1.00 0.00 H new ATOM 0 HB3 SER A 9 7.471 5.819 -27.554 1.00 0.00 H new ATOM 0 HG SER A 9 9.127 6.653 -28.931 1.00 0.00 H new ATOM 119 N ILE A 10 6.857 5.967 -24.445 1.00 0.00 N ATOM 120 CA ILE A 10 5.891 5.235 -23.606 1.00 0.00 C ATOM 121 C ILE A 10 4.937 6.212 -22.903 1.00 0.00 C ATOM 122 O ILE A 10 3.732 5.986 -22.950 1.00 0.00 O ATOM 123 CB ILE A 10 6.558 4.176 -22.687 1.00 0.00 C ATOM 124 CG1 ILE A 10 5.551 3.287 -21.917 1.00 0.00 C ATOM 125 CG2 ILE A 10 7.642 4.733 -21.765 1.00 0.00 C ATOM 126 CD1 ILE A 10 4.970 3.845 -20.611 1.00 0.00 C ATOM 0 H ILE A 10 7.834 5.843 -24.181 1.00 0.00 H new ATOM 0 HA ILE A 10 5.264 4.625 -24.256 1.00 0.00 H new ATOM 0 HB ILE A 10 7.071 3.522 -23.392 1.00 0.00 H new ATOM 0 HG12 ILE A 10 4.720 3.062 -22.586 1.00 0.00 H new ATOM 0 HG13 ILE A 10 6.042 2.341 -21.690 1.00 0.00 H new ATOM 0 HG21 ILE A 10 8.054 3.926 -21.159 1.00 0.00 H new ATOM 0 HG22 ILE A 10 8.436 5.178 -22.364 1.00 0.00 H new ATOM 0 HG23 ILE A 10 7.210 5.492 -21.113 1.00 0.00 H new ATOM 0 HD11 ILE A 10 4.281 3.119 -20.180 1.00 0.00 H new ATOM 0 HD12 ILE A 10 5.779 4.040 -19.907 1.00 0.00 H new ATOM 0 HD13 ILE A 10 4.436 4.773 -20.817 1.00 0.00 H new ATOM 138 N ASN A 11 5.435 7.331 -22.355 1.00 0.00 N ATOM 139 CA ASN A 11 4.612 8.409 -21.782 1.00 0.00 C ATOM 140 C ASN A 11 3.564 8.918 -22.800 1.00 0.00 C ATOM 141 O ASN A 11 2.357 8.848 -22.560 1.00 0.00 O ATOM 142 CB ASN A 11 5.561 9.529 -21.282 1.00 0.00 C ATOM 143 CG ASN A 11 5.095 10.253 -20.027 1.00 0.00 C ATOM 144 OD1 ASN A 11 3.920 10.370 -19.724 1.00 0.00 O ATOM 145 ND2 ASN A 11 6.025 10.761 -19.246 1.00 0.00 N ATOM 0 H ASN A 11 6.436 7.516 -22.296 1.00 0.00 H new ATOM 0 HA ASN A 11 4.035 8.036 -20.935 1.00 0.00 H new ATOM 0 HB2 ASN A 11 6.542 9.095 -21.090 1.00 0.00 H new ATOM 0 HB3 ASN A 11 5.687 10.261 -22.080 1.00 0.00 H new ATOM 0 HD21 ASN A 11 5.761 11.250 -18.391 1.00 0.00 H new ATOM 0 HD22 ASN A 11 7.009 10.665 -19.496 1.00 0.00 H new ATOM 152 N GLN A 12 4.034 9.368 -23.970 1.00 0.00 N ATOM 153 CA GLN A 12 3.242 9.865 -25.095 1.00 0.00 C ATOM 154 C GLN A 12 2.189 8.837 -25.538 1.00 0.00 C ATOM 155 O GLN A 12 0.999 9.145 -25.582 1.00 0.00 O ATOM 156 CB GLN A 12 4.190 10.238 -26.256 1.00 0.00 C ATOM 157 CG GLN A 12 3.460 11.035 -27.348 1.00 0.00 C ATOM 158 CD GLN A 12 4.199 11.131 -28.683 1.00 0.00 C ATOM 159 OE1 GLN A 12 3.604 11.018 -29.743 1.00 0.00 O ATOM 160 NE2 GLN A 12 5.494 11.368 -28.752 1.00 0.00 N ATOM 0 H GLN A 12 5.035 9.395 -24.165 1.00 0.00 H new ATOM 0 HA GLN A 12 2.697 10.755 -24.781 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.024 10.826 -25.871 1.00 0.00 H new ATOM 0 HB3 GLN A 12 4.612 9.331 -26.688 1.00 0.00 H new ATOM 0 HG2 GLN A 12 2.486 10.577 -27.521 1.00 0.00 H new ATOM 0 HG3 GLN A 12 3.276 12.044 -26.979 1.00 0.00 H new ATOM 0 HE21 GLN A 12 6.040 11.471 -27.897 1.00 0.00 H new ATOM 0 HE22 GLN A 12 5.950 11.448 -29.661 1.00 0.00 H new ATOM 169 N LYS A 13 2.628 7.616 -25.865 1.00 0.00 N ATOM 170 CA LYS A 13 1.794 6.519 -26.357 1.00 0.00 C ATOM 171 C LYS A 13 0.760 6.078 -25.322 1.00 0.00 C ATOM 172 O LYS A 13 -0.366 5.765 -25.696 1.00 0.00 O ATOM 173 CB LYS A 13 2.708 5.363 -26.784 1.00 0.00 C ATOM 174 CG LYS A 13 2.007 4.291 -27.627 1.00 0.00 C ATOM 175 CD LYS A 13 3.033 3.208 -27.974 1.00 0.00 C ATOM 176 CE LYS A 13 2.481 2.183 -28.960 1.00 0.00 C ATOM 177 NZ LYS A 13 3.475 1.124 -29.221 1.00 0.00 N ATOM 0 H LYS A 13 3.612 7.358 -25.790 1.00 0.00 H new ATOM 0 HA LYS A 13 1.221 6.862 -27.219 1.00 0.00 H new ATOM 0 HB2 LYS A 13 3.546 5.767 -27.352 1.00 0.00 H new ATOM 0 HB3 LYS A 13 3.124 4.894 -25.892 1.00 0.00 H new ATOM 0 HG2 LYS A 13 1.171 3.860 -27.076 1.00 0.00 H new ATOM 0 HG3 LYS A 13 1.596 4.731 -28.536 1.00 0.00 H new ATOM 0 HD2 LYS A 13 3.922 3.675 -28.398 1.00 0.00 H new ATOM 0 HD3 LYS A 13 3.345 2.700 -27.061 1.00 0.00 H new ATOM 0 HE2 LYS A 13 1.568 1.741 -28.561 1.00 0.00 H new ATOM 0 HE3 LYS A 13 2.214 2.677 -29.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 2.987 0.215 -29.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 4.014 1.358 -30.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 4.125 1.051 -28.413 1.00 0.00 H new ATOM 191 N LEU A 14 1.102 6.084 -24.029 1.00 0.00 N ATOM 192 CA LEU A 14 0.156 5.754 -22.966 1.00 0.00 C ATOM 193 C LEU A 14 -0.946 6.817 -22.839 1.00 0.00 C ATOM 194 O LEU A 14 -2.107 6.453 -22.665 1.00 0.00 O ATOM 195 CB LEU A 14 0.914 5.487 -21.659 1.00 0.00 C ATOM 196 CG LEU A 14 0.046 4.730 -20.640 1.00 0.00 C ATOM 197 CD1 LEU A 14 0.887 3.713 -19.874 1.00 0.00 C ATOM 198 CD2 LEU A 14 -0.594 5.677 -19.633 1.00 0.00 C ATOM 0 H LEU A 14 2.037 6.317 -23.695 1.00 0.00 H new ATOM 0 HA LEU A 14 -0.369 4.834 -23.222 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.813 4.908 -21.872 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.239 6.434 -21.227 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.738 4.225 -21.204 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.257 3.186 -19.157 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.318 2.997 -20.573 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.687 4.229 -19.343 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -1.199 5.105 -18.930 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.185 6.212 -19.090 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -1.227 6.393 -20.158 1.00 0.00 H new ATOM 210 N ALA A 15 -0.629 8.109 -22.998 1.00 0.00 N ATOM 211 CA ALA A 15 -1.663 9.143 -23.115 1.00 0.00 C ATOM 212 C ALA A 15 -2.477 9.017 -24.418 1.00 0.00 C ATOM 213 O ALA A 15 -3.705 9.110 -24.385 1.00 0.00 O ATOM 214 CB ALA A 15 -1.037 10.529 -22.990 1.00 0.00 C ATOM 0 H ALA A 15 0.327 8.460 -23.048 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.367 8.997 -22.296 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -1.814 11.288 -23.078 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -0.548 10.621 -22.020 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -0.301 10.669 -23.782 1.00 0.00 H new ATOM 220 N LEU A 16 -1.808 8.752 -25.553 1.00 0.00 N ATOM 221 CA LEU A 16 -2.432 8.462 -26.853 1.00 0.00 C ATOM 222 C LEU A 16 -3.451 7.320 -26.729 1.00 0.00 C ATOM 223 O LEU A 16 -4.540 7.433 -27.284 1.00 0.00 O ATOM 224 CB LEU A 16 -1.322 8.180 -27.889 1.00 0.00 C ATOM 225 CG LEU A 16 -1.721 8.214 -29.381 1.00 0.00 C ATOM 226 CD1 LEU A 16 -0.443 8.308 -30.224 1.00 0.00 C ATOM 227 CD2 LEU A 16 -2.463 6.959 -29.856 1.00 0.00 C ATOM 0 H LEU A 16 -0.789 8.733 -25.591 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.000 9.325 -27.201 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.525 8.908 -27.736 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.902 7.197 -27.674 1.00 0.00 H new ATOM 0 HG LEU A 16 -2.387 9.069 -29.498 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -0.706 8.333 -31.282 1.00 0.00 H new ATOM 0 HD12 LEU A 16 0.099 9.217 -29.963 1.00 0.00 H new ATOM 0 HD13 LEU A 16 0.187 7.441 -30.027 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -2.709 7.060 -30.913 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.828 6.085 -29.713 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -3.381 6.839 -29.280 1.00 0.00 H new ATOM 239 N VAL A 17 -3.130 6.282 -25.947 1.00 0.00 N ATOM 240 CA VAL A 17 -4.055 5.244 -25.469 1.00 0.00 C ATOM 241 C VAL A 17 -5.157 5.825 -24.577 1.00 0.00 C ATOM 242 O VAL A 17 -6.323 5.745 -24.950 1.00 0.00 O ATOM 243 CB VAL A 17 -3.269 4.098 -24.796 1.00 0.00 C ATOM 244 CG1 VAL A 17 -4.139 3.180 -23.930 1.00 0.00 C ATOM 245 CG2 VAL A 17 -2.595 3.253 -25.881 1.00 0.00 C ATOM 0 H VAL A 17 -2.177 6.135 -25.615 1.00 0.00 H new ATOM 0 HA VAL A 17 -4.574 4.819 -26.328 1.00 0.00 H new ATOM 0 HB VAL A 17 -2.541 4.565 -24.133 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -3.518 2.399 -23.490 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.605 3.763 -23.136 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -4.913 2.724 -24.547 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -2.037 2.441 -25.415 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -3.355 2.838 -26.544 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.913 3.878 -26.457 1.00 0.00 H new ATOM 255 N ILE A 18 -4.830 6.400 -23.414 1.00 0.00 N ATOM 256 CA ILE A 18 -5.779 6.901 -22.396 1.00 0.00 C ATOM 257 C ILE A 18 -6.790 7.948 -22.917 1.00 0.00 C ATOM 258 O ILE A 18 -7.875 8.080 -22.354 1.00 0.00 O ATOM 259 CB ILE A 18 -4.979 7.317 -21.141 1.00 0.00 C ATOM 260 CG1 ILE A 18 -4.572 6.012 -20.409 1.00 0.00 C ATOM 261 CG2 ILE A 18 -5.784 8.244 -20.228 1.00 0.00 C ATOM 262 CD1 ILE A 18 -3.920 6.219 -19.046 1.00 0.00 C ATOM 0 H ILE A 18 -3.858 6.538 -23.139 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.452 6.092 -22.112 1.00 0.00 H new ATOM 0 HB ILE A 18 -4.096 7.887 -21.431 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -5.459 5.392 -20.281 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -3.883 5.455 -21.045 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -5.183 8.511 -19.359 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -6.054 9.148 -20.774 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.690 7.735 -19.900 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -3.671 5.251 -18.611 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -3.011 6.809 -19.163 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.612 6.745 -18.388 1.00 0.00 H new ATOM 274 N LYS A 19 -6.518 8.572 -24.068 1.00 0.00 N ATOM 275 CA LYS A 19 -7.480 9.296 -24.914 1.00 0.00 C ATOM 276 C LYS A 19 -8.786 8.519 -25.167 1.00 0.00 C ATOM 277 O LYS A 19 -9.844 9.130 -25.280 1.00 0.00 O ATOM 278 CB LYS A 19 -6.755 9.512 -26.248 1.00 0.00 C ATOM 279 CG LYS A 19 -7.523 10.232 -27.363 1.00 0.00 C ATOM 280 CD LYS A 19 -6.715 10.217 -28.675 1.00 0.00 C ATOM 281 CE LYS A 19 -6.981 9.023 -29.612 1.00 0.00 C ATOM 282 NZ LYS A 19 -6.597 7.696 -29.073 1.00 0.00 N ATOM 0 H LYS A 19 -5.575 8.588 -24.456 1.00 0.00 H new ATOM 0 HA LYS A 19 -7.781 10.219 -24.419 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -5.844 10.077 -26.048 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -6.449 8.537 -26.626 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -8.488 9.749 -27.518 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -7.726 11.261 -27.066 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -6.926 11.137 -29.220 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -5.654 10.230 -28.426 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -8.043 9.004 -29.856 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -6.442 9.188 -30.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -6.309 7.074 -29.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -5.804 7.807 -28.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -7.408 7.275 -28.576 1.00 0.00 H new ATOM 296 N SER A 20 -8.696 7.193 -25.322 1.00 0.00 N ATOM 297 CA SER A 20 -9.780 6.323 -25.806 1.00 0.00 C ATOM 298 C SER A 20 -9.773 4.886 -25.253 1.00 0.00 C ATOM 299 O SER A 20 -10.759 4.175 -25.434 1.00 0.00 O ATOM 300 CB SER A 20 -9.730 6.289 -27.341 1.00 0.00 C ATOM 301 OG SER A 20 -8.425 5.992 -27.818 1.00 0.00 O ATOM 0 H SER A 20 -7.842 6.678 -25.108 1.00 0.00 H new ATOM 0 HA SER A 20 -10.707 6.759 -25.433 1.00 0.00 H new ATOM 0 HB2 SER A 20 -10.432 5.542 -27.711 1.00 0.00 H new ATOM 0 HB3 SER A 20 -10.052 7.252 -27.737 1.00 0.00 H new ATOM 0 HG SER A 20 -8.472 5.742 -28.764 1.00 0.00 H new ATOM 307 N GLY A 21 -8.694 4.445 -24.597 1.00 0.00 N ATOM 308 CA GLY A 21 -8.524 3.108 -24.029 1.00 0.00 C ATOM 309 C GLY A 21 -8.787 3.051 -22.520 1.00 0.00 C ATOM 310 O GLY A 21 -8.868 4.072 -21.835 1.00 0.00 O ATOM 0 H GLY A 21 -7.880 5.039 -24.442 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -9.199 2.418 -24.535 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -7.509 2.763 -24.227 1.00 0.00 H new ATOM 314 N LYS A 22 -8.909 1.827 -21.997 1.00 0.00 N ATOM 315 CA LYS A 22 -9.384 1.536 -20.636 1.00 0.00 C ATOM 316 C LYS A 22 -8.220 1.260 -19.683 1.00 0.00 C ATOM 317 O LYS A 22 -7.475 0.300 -19.886 1.00 0.00 O ATOM 318 CB LYS A 22 -10.365 0.354 -20.689 1.00 0.00 C ATOM 319 CG LYS A 22 -11.722 0.782 -21.279 1.00 0.00 C ATOM 320 CD LYS A 22 -12.604 -0.406 -21.675 1.00 0.00 C ATOM 321 CE LYS A 22 -12.926 -1.333 -20.495 1.00 0.00 C ATOM 322 NZ LYS A 22 -13.688 -2.515 -20.953 1.00 0.00 N ATOM 0 H LYS A 22 -8.674 0.985 -22.522 1.00 0.00 H new ATOM 0 HA LYS A 22 -9.903 2.411 -20.244 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -9.940 -0.448 -21.292 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -10.512 -0.046 -19.686 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -12.252 1.394 -20.549 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -11.550 1.408 -22.155 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -13.535 -0.034 -22.102 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -12.103 -0.980 -22.454 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -12.001 -1.654 -20.015 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -13.502 -0.790 -19.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -13.485 -3.322 -20.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -14.706 -2.304 -20.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -13.409 -2.752 -21.926 1.00 0.00 H new ATOM 336 N TYR A 23 -8.083 2.095 -18.646 1.00 0.00 N ATOM 337 CA TYR A 23 -6.989 2.065 -17.674 1.00 0.00 C ATOM 338 C TYR A 23 -7.450 2.053 -16.199 1.00 0.00 C ATOM 339 O TYR A 23 -8.617 2.288 -15.895 1.00 0.00 O ATOM 340 CB TYR A 23 -6.083 3.276 -17.949 1.00 0.00 C ATOM 341 CG TYR A 23 -6.723 4.619 -17.648 1.00 0.00 C ATOM 342 CD1 TYR A 23 -7.613 5.204 -18.571 1.00 0.00 C ATOM 343 CD2 TYR A 23 -6.425 5.279 -16.440 1.00 0.00 C ATOM 344 CE1 TYR A 23 -8.225 6.436 -18.282 1.00 0.00 C ATOM 345 CE2 TYR A 23 -7.032 6.516 -16.149 1.00 0.00 C ATOM 346 CZ TYR A 23 -7.931 7.098 -17.069 1.00 0.00 C ATOM 347 OH TYR A 23 -8.497 8.302 -16.788 1.00 0.00 O ATOM 0 H TYR A 23 -8.757 2.837 -18.456 1.00 0.00 H new ATOM 0 HA TYR A 23 -6.453 1.125 -17.805 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -5.175 3.178 -17.353 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -5.781 3.258 -18.996 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -7.826 4.704 -19.504 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -5.733 4.838 -15.739 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -8.918 6.875 -18.985 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -6.809 7.020 -15.220 1.00 0.00 H new ATOM 0 HH TYR A 23 -8.186 8.613 -15.912 1.00 0.00 H new ATOM 357 N THR A 24 -6.498 1.819 -15.288 1.00 0.00 N ATOM 358 CA THR A 24 -6.593 1.966 -13.824 1.00 0.00 C ATOM 359 C THR A 24 -5.289 2.576 -13.266 1.00 0.00 C ATOM 360 O THR A 24 -4.261 2.571 -13.952 1.00 0.00 O ATOM 361 CB THR A 24 -6.947 0.614 -13.169 1.00 0.00 C ATOM 362 OG1 THR A 24 -7.123 0.771 -11.778 1.00 0.00 O ATOM 363 CG2 THR A 24 -5.882 -0.459 -13.399 1.00 0.00 C ATOM 0 H THR A 24 -5.572 1.498 -15.572 1.00 0.00 H new ATOM 0 HA THR A 24 -7.400 2.656 -13.578 1.00 0.00 H new ATOM 0 HB THR A 24 -7.871 0.284 -13.643 1.00 0.00 H new ATOM 0 HG1 THR A 24 -7.554 -0.029 -11.410 1.00 0.00 H new ATOM 0 HG21 THR A 24 -6.189 -1.386 -12.914 1.00 0.00 H new ATOM 0 HG22 THR A 24 -5.764 -0.631 -14.469 1.00 0.00 H new ATOM 0 HG23 THR A 24 -4.933 -0.126 -12.978 1.00 0.00 H new ATOM 371 N LEU A 25 -5.329 3.118 -12.038 1.00 0.00 N ATOM 372 CA LEU A 25 -4.265 3.920 -11.405 1.00 0.00 C ATOM 373 C LEU A 25 -4.144 3.649 -9.902 1.00 0.00 C ATOM 374 O LEU A 25 -5.158 3.405 -9.250 1.00 0.00 O ATOM 375 CB LEU A 25 -4.584 5.424 -11.540 1.00 0.00 C ATOM 376 CG LEU A 25 -4.668 5.985 -12.963 1.00 0.00 C ATOM 377 CD1 LEU A 25 -5.085 7.456 -12.903 1.00 0.00 C ATOM 378 CD2 LEU A 25 -3.322 5.908 -13.675 1.00 0.00 C ATOM 0 H LEU A 25 -6.140 3.005 -11.430 1.00 0.00 H new ATOM 0 HA LEU A 25 -3.340 3.643 -11.911 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -5.534 5.616 -11.042 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.821 5.983 -10.998 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.397 5.388 -13.512 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.146 7.858 -13.914 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -6.059 7.539 -12.420 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.348 8.020 -12.332 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.419 6.315 -14.682 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.583 6.486 -13.120 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.000 4.868 -13.733 1.00 0.00 H new ATOM 390 N GLY A 26 -2.936 3.822 -9.346 1.00 0.00 N ATOM 391 CA GLY A 26 -2.645 3.732 -7.905 1.00 0.00 C ATOM 392 C GLY A 26 -2.395 2.290 -7.445 1.00 0.00 C ATOM 393 O GLY A 26 -2.838 1.359 -8.107 1.00 0.00 O ATOM 0 H GLY A 26 -2.108 4.035 -9.903 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -1.770 4.340 -7.676 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.480 4.150 -7.342 1.00 0.00 H new ATOM 397 N TYR A 27 -1.690 2.075 -6.324 1.00 0.00 N ATOM 398 CA TYR A 27 -1.131 0.755 -5.980 1.00 0.00 C ATOM 399 C TYR A 27 -2.187 -0.323 -5.665 1.00 0.00 C ATOM 400 O TYR A 27 -2.453 -1.196 -6.490 1.00 0.00 O ATOM 401 CB TYR A 27 -0.087 0.884 -4.855 1.00 0.00 C ATOM 402 CG TYR A 27 0.614 -0.436 -4.585 1.00 0.00 C ATOM 403 CD1 TYR A 27 1.716 -0.813 -5.375 1.00 0.00 C ATOM 404 CD2 TYR A 27 0.122 -1.322 -3.604 1.00 0.00 C ATOM 405 CE1 TYR A 27 2.285 -2.084 -5.235 1.00 0.00 C ATOM 406 CE2 TYR A 27 0.691 -2.599 -3.461 1.00 0.00 C ATOM 407 CZ TYR A 27 1.759 -2.986 -4.292 1.00 0.00 C ATOM 408 OH TYR A 27 2.347 -4.191 -4.101 1.00 0.00 O ATOM 0 H TYR A 27 -1.492 2.801 -5.636 1.00 0.00 H new ATOM 0 HA TYR A 27 -0.635 0.395 -6.881 1.00 0.00 H new ATOM 0 HB2 TYR A 27 0.651 1.639 -5.128 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -0.575 1.230 -3.944 1.00 0.00 H new ATOM 0 HD1 TYR A 27 2.125 -0.118 -6.093 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -0.692 -1.019 -2.963 1.00 0.00 H new ATOM 0 HE1 TYR A 27 3.126 -2.372 -5.849 1.00 0.00 H new ATOM 0 HE2 TYR A 27 0.310 -3.281 -2.716 1.00 0.00 H new ATOM 0 HH TYR A 27 2.872 -4.428 -4.894 1.00 0.00 H new ATOM 418 N LYS A 28 -2.800 -0.304 -4.469 1.00 0.00 N ATOM 419 CA LYS A 28 -3.783 -1.328 -4.062 1.00 0.00 C ATOM 420 C LYS A 28 -5.070 -1.257 -4.904 1.00 0.00 C ATOM 421 O LYS A 28 -5.765 -2.255 -5.062 1.00 0.00 O ATOM 422 CB LYS A 28 -4.009 -1.245 -2.541 1.00 0.00 C ATOM 423 CG LYS A 28 -4.645 -2.487 -1.884 1.00 0.00 C ATOM 424 CD LYS A 28 -3.910 -3.837 -2.029 1.00 0.00 C ATOM 425 CE LYS A 28 -2.399 -3.796 -1.739 1.00 0.00 C ATOM 426 NZ LYS A 28 -1.820 -5.155 -1.557 1.00 0.00 N ATOM 0 H LYS A 28 -2.632 0.412 -3.763 1.00 0.00 H new ATOM 0 HA LYS A 28 -3.386 -2.322 -4.269 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -3.049 -1.056 -2.061 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -4.644 -0.384 -2.334 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -4.759 -2.281 -0.820 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -5.648 -2.606 -2.295 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -4.373 -4.559 -1.356 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -4.059 -4.206 -3.044 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -1.888 -3.293 -2.560 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -2.220 -3.204 -0.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -0.787 -5.083 -1.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -2.214 -5.588 -0.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -2.054 -5.745 -2.381 1.00 0.00 H new ATOM 440 N SER A 29 -5.291 -0.105 -5.539 1.00 0.00 N ATOM 441 CA SER A 29 -6.217 0.164 -6.638 1.00 0.00 C ATOM 442 C SER A 29 -5.970 -0.723 -7.866 1.00 0.00 C ATOM 443 O SER A 29 -6.867 -1.477 -8.262 1.00 0.00 O ATOM 444 CB SER A 29 -6.016 1.616 -7.029 1.00 0.00 C ATOM 445 OG SER A 29 -6.873 1.993 -8.074 1.00 0.00 O ATOM 0 H SER A 29 -4.781 0.737 -5.273 1.00 0.00 H new ATOM 0 HA SER A 29 -7.232 -0.050 -6.303 1.00 0.00 H new ATOM 0 HB2 SER A 29 -6.194 2.254 -6.164 1.00 0.00 H new ATOM 0 HB3 SER A 29 -4.981 1.772 -7.333 1.00 0.00 H new ATOM 0 HG SER A 29 -6.473 2.735 -8.574 1.00 0.00 H new ATOM 451 N THR A 30 -4.773 -0.668 -8.481 1.00 0.00 N ATOM 452 CA THR A 30 -4.459 -1.608 -9.559 1.00 0.00 C ATOM 453 C THR A 30 -4.439 -3.047 -9.040 1.00 0.00 C ATOM 454 O THR A 30 -5.070 -3.878 -9.668 1.00 0.00 O ATOM 455 CB THR A 30 -3.243 -1.234 -10.419 1.00 0.00 C ATOM 456 OG1 THR A 30 -3.234 -2.130 -11.506 1.00 0.00 O ATOM 457 CG2 THR A 30 -1.908 -1.314 -9.693 1.00 0.00 C ATOM 0 H THR A 30 -4.033 -0.003 -8.255 1.00 0.00 H new ATOM 0 HA THR A 30 -5.278 -1.532 -10.274 1.00 0.00 H new ATOM 0 HB THR A 30 -3.346 -0.190 -10.716 1.00 0.00 H new ATOM 0 HG1 THR A 30 -2.675 -1.767 -12.224 1.00 0.00 H new ATOM 0 HG21 THR A 30 -1.105 -1.034 -10.375 1.00 0.00 H new ATOM 0 HG22 THR A 30 -1.915 -0.633 -8.842 1.00 0.00 H new ATOM 0 HG23 THR A 30 -1.746 -2.333 -9.341 1.00 0.00 H new ATOM 465 N VAL A 31 -3.901 -3.364 -7.847 1.00 0.00 N ATOM 466 CA VAL A 31 -4.028 -4.725 -7.266 1.00 0.00 C ATOM 467 C VAL A 31 -5.475 -5.239 -7.304 1.00 0.00 C ATOM 468 O VAL A 31 -5.744 -6.299 -7.868 1.00 0.00 O ATOM 469 CB VAL A 31 -3.488 -4.795 -5.824 1.00 0.00 C ATOM 470 CG1 VAL A 31 -3.836 -6.126 -5.139 1.00 0.00 C ATOM 471 CG2 VAL A 31 -1.977 -4.555 -5.775 1.00 0.00 C ATOM 0 H VAL A 31 -3.378 -2.707 -7.267 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.416 -5.373 -7.894 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.982 -3.995 -5.273 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.435 -6.129 -4.125 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -4.919 -6.244 -5.101 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -3.401 -6.951 -5.704 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.633 -4.612 -4.742 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.469 -5.314 -6.369 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -1.752 -3.568 -6.178 1.00 0.00 H new ATOM 481 N LYS A 32 -6.411 -4.476 -6.726 1.00 0.00 N ATOM 482 CA LYS A 32 -7.854 -4.736 -6.731 1.00 0.00 C ATOM 483 C LYS A 32 -8.405 -4.881 -8.160 1.00 0.00 C ATOM 484 O LYS A 32 -9.134 -5.832 -8.448 1.00 0.00 O ATOM 485 CB LYS A 32 -8.495 -3.587 -5.931 1.00 0.00 C ATOM 486 CG LYS A 32 -10.014 -3.654 -5.730 1.00 0.00 C ATOM 487 CD LYS A 32 -10.467 -4.883 -4.923 1.00 0.00 C ATOM 488 CE LYS A 32 -11.804 -4.638 -4.208 1.00 0.00 C ATOM 489 NZ LYS A 32 -12.888 -4.273 -5.146 1.00 0.00 N ATOM 0 H LYS A 32 -6.172 -3.623 -6.220 1.00 0.00 H new ATOM 0 HA LYS A 32 -8.095 -5.691 -6.264 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -8.023 -3.551 -4.949 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -8.259 -2.649 -6.433 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -10.346 -2.750 -5.219 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -10.502 -3.668 -6.704 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -10.564 -5.740 -5.590 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.703 -5.136 -4.188 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -12.089 -5.536 -3.660 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -11.679 -3.842 -3.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -13.789 -4.218 -4.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -12.678 -3.350 -5.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -12.960 -4.995 -5.892 1.00 0.00 H new ATOM 503 N SER A 33 -8.005 -3.974 -9.055 1.00 0.00 N ATOM 504 CA SER A 33 -8.342 -3.989 -10.485 1.00 0.00 C ATOM 505 C SER A 33 -7.888 -5.292 -11.162 1.00 0.00 C ATOM 506 O SER A 33 -8.712 -6.004 -11.722 1.00 0.00 O ATOM 507 CB SER A 33 -7.732 -2.785 -11.224 1.00 0.00 C ATOM 508 OG SER A 33 -7.985 -1.529 -10.605 1.00 0.00 O ATOM 0 H SER A 33 -7.417 -3.181 -8.797 1.00 0.00 H new ATOM 0 HA SER A 33 -9.428 -3.924 -10.547 1.00 0.00 H new ATOM 0 HB2 SER A 33 -6.654 -2.929 -11.301 1.00 0.00 H new ATOM 0 HB3 SER A 33 -8.124 -2.761 -12.241 1.00 0.00 H new ATOM 0 HG SER A 33 -7.499 -1.479 -9.755 1.00 0.00 H new ATOM 514 N LEU A 34 -6.594 -5.627 -11.086 1.00 0.00 N ATOM 515 CA LEU A 34 -5.950 -6.811 -11.668 1.00 0.00 C ATOM 516 C LEU A 34 -6.510 -8.118 -11.086 1.00 0.00 C ATOM 517 O LEU A 34 -6.641 -9.104 -11.808 1.00 0.00 O ATOM 518 CB LEU A 34 -4.427 -6.744 -11.414 1.00 0.00 C ATOM 519 CG LEU A 34 -3.694 -5.503 -11.964 1.00 0.00 C ATOM 520 CD1 LEU A 34 -2.292 -5.398 -11.359 1.00 0.00 C ATOM 521 CD2 LEU A 34 -3.591 -5.501 -13.476 1.00 0.00 C ATOM 0 H LEU A 34 -5.927 -5.041 -10.584 1.00 0.00 H new ATOM 0 HA LEU A 34 -6.158 -6.810 -12.738 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.258 -6.792 -10.338 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -3.969 -7.632 -11.849 1.00 0.00 H new ATOM 0 HG LEU A 34 -4.292 -4.639 -11.675 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.789 -4.517 -11.758 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.369 -5.313 -10.275 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.718 -6.290 -11.613 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.066 -4.604 -13.804 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -3.042 -6.383 -13.804 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -4.591 -5.514 -13.909 1.00 0.00 H new ATOM 533 N ARG A 35 -6.864 -8.124 -9.790 1.00 0.00 N ATOM 534 CA ARG A 35 -7.570 -9.233 -9.133 1.00 0.00 C ATOM 535 C ARG A 35 -8.980 -9.459 -9.688 1.00 0.00 C ATOM 536 O ARG A 35 -9.420 -10.605 -9.701 1.00 0.00 O ATOM 537 CB ARG A 35 -7.626 -8.990 -7.616 1.00 0.00 C ATOM 538 CG ARG A 35 -6.302 -9.333 -6.914 1.00 0.00 C ATOM 539 CD ARG A 35 -6.289 -8.746 -5.497 1.00 0.00 C ATOM 540 NE ARG A 35 -5.193 -9.295 -4.675 1.00 0.00 N ATOM 541 CZ ARG A 35 -5.237 -10.344 -3.861 1.00 0.00 C ATOM 542 NH1 ARG A 35 -6.325 -11.059 -3.692 1.00 0.00 N ATOM 543 NH2 ARG A 35 -4.159 -10.699 -3.205 1.00 0.00 N ATOM 0 H ARG A 35 -6.664 -7.346 -9.161 1.00 0.00 H new ATOM 0 HA ARG A 35 -7.005 -10.141 -9.344 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -7.873 -7.945 -7.428 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -8.428 -9.590 -7.185 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -6.175 -10.415 -6.869 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -5.464 -8.937 -7.488 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -6.189 -7.662 -5.556 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -7.243 -8.952 -5.012 1.00 0.00 H new ATOM 0 HE ARG A 35 -4.297 -8.812 -4.739 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -7.178 -10.816 -4.195 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -6.317 -11.857 -3.057 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -3.294 -10.171 -3.321 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -4.185 -11.503 -2.578 1.00 0.00 H new ATOM 557 N GLN A 36 -9.692 -8.405 -10.117 1.00 0.00 N ATOM 558 CA GLN A 36 -11.073 -8.520 -10.614 1.00 0.00 C ATOM 559 C GLN A 36 -11.265 -8.402 -12.138 1.00 0.00 C ATOM 560 O GLN A 36 -12.337 -8.774 -12.616 1.00 0.00 O ATOM 561 CB GLN A 36 -11.978 -7.525 -9.875 1.00 0.00 C ATOM 562 CG GLN A 36 -12.139 -7.898 -8.393 1.00 0.00 C ATOM 563 CD GLN A 36 -13.308 -7.163 -7.751 1.00 0.00 C ATOM 564 OE1 GLN A 36 -13.138 -6.234 -6.972 1.00 0.00 O ATOM 565 NE2 GLN A 36 -14.535 -7.551 -8.043 1.00 0.00 N ATOM 0 H GLN A 36 -9.329 -7.452 -10.129 1.00 0.00 H new ATOM 0 HA GLN A 36 -11.360 -9.549 -10.396 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -11.558 -6.522 -9.955 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -12.957 -7.499 -10.353 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -12.292 -8.973 -8.303 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -11.221 -7.660 -7.856 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -14.685 -8.324 -8.691 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -15.334 -7.078 -7.621 1.00 0.00 H new ATOM 574 N GLY A 37 -10.287 -7.911 -12.910 1.00 0.00 N ATOM 575 CA GLY A 37 -10.468 -7.608 -14.332 1.00 0.00 C ATOM 576 C GLY A 37 -9.237 -7.846 -15.213 1.00 0.00 C ATOM 577 O GLY A 37 -8.091 -7.809 -14.769 1.00 0.00 O ATOM 0 H GLY A 37 -9.348 -7.713 -12.564 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -11.290 -8.213 -14.714 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -10.768 -6.565 -14.429 1.00 0.00 H new ATOM 581 N LYS A 38 -9.507 -8.060 -16.507 1.00 0.00 N ATOM 582 CA LYS A 38 -8.532 -8.360 -17.561 1.00 0.00 C ATOM 583 C LYS A 38 -7.694 -7.128 -17.915 1.00 0.00 C ATOM 584 O LYS A 38 -8.066 -6.356 -18.798 1.00 0.00 O ATOM 585 CB LYS A 38 -9.295 -8.956 -18.764 1.00 0.00 C ATOM 586 CG LYS A 38 -8.442 -9.617 -19.868 1.00 0.00 C ATOM 587 CD LYS A 38 -7.874 -8.720 -20.985 1.00 0.00 C ATOM 588 CE LYS A 38 -8.948 -7.908 -21.729 1.00 0.00 C ATOM 589 NZ LYS A 38 -8.891 -6.482 -21.348 1.00 0.00 N ATOM 0 H LYS A 38 -10.462 -8.027 -16.865 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.808 -9.098 -17.216 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -9.998 -9.699 -18.387 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -9.885 -8.161 -19.220 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.603 -10.119 -19.385 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -9.048 -10.391 -20.339 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -7.146 -8.034 -20.553 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -7.339 -9.342 -21.702 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -8.804 -8.007 -22.805 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -9.935 -8.310 -21.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -9.748 -5.998 -21.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -8.831 -6.401 -20.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -8.054 -6.041 -21.779 1.00 0.00 H new ATOM 603 N SER A 39 -6.544 -6.950 -17.270 1.00 0.00 N ATOM 604 CA SER A 39 -5.444 -6.148 -17.815 1.00 0.00 C ATOM 605 C SER A 39 -4.762 -6.847 -18.993 1.00 0.00 C ATOM 606 O SER A 39 -4.944 -8.048 -19.216 1.00 0.00 O ATOM 607 CB SER A 39 -4.406 -5.893 -16.726 1.00 0.00 C ATOM 608 OG SER A 39 -4.007 -7.118 -16.147 1.00 0.00 O ATOM 0 H SER A 39 -6.345 -7.356 -16.356 1.00 0.00 H new ATOM 0 HA SER A 39 -5.866 -5.208 -18.170 1.00 0.00 H new ATOM 0 HB2 SER A 39 -3.541 -5.381 -17.148 1.00 0.00 H new ATOM 0 HB3 SER A 39 -4.822 -5.237 -15.961 1.00 0.00 H new ATOM 0 HG SER A 39 -3.384 -7.577 -16.749 1.00 0.00 H new ATOM 614 N LYS A 40 -3.895 -6.118 -19.704 1.00 0.00 N ATOM 615 CA LYS A 40 -2.840 -6.723 -20.520 1.00 0.00 C ATOM 616 C LYS A 40 -1.468 -6.044 -20.404 1.00 0.00 C ATOM 617 O LYS A 40 -0.469 -6.681 -20.738 1.00 0.00 O ATOM 618 CB LYS A 40 -3.357 -6.844 -21.959 1.00 0.00 C ATOM 619 CG LYS A 40 -2.600 -7.842 -22.853 1.00 0.00 C ATOM 620 CD LYS A 40 -2.443 -9.272 -22.303 1.00 0.00 C ATOM 621 CE LYS A 40 -3.769 -9.977 -21.969 1.00 0.00 C ATOM 622 NZ LYS A 40 -3.932 -10.222 -20.514 1.00 0.00 N ATOM 0 H LYS A 40 -3.905 -5.098 -19.729 1.00 0.00 H new ATOM 0 HA LYS A 40 -2.630 -7.718 -20.128 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -4.407 -7.136 -21.926 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -3.314 -5.860 -22.426 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -3.114 -7.900 -23.812 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -1.606 -7.440 -23.048 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -1.902 -9.872 -23.035 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -1.829 -9.236 -21.403 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -4.600 -9.369 -22.327 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -3.816 -10.927 -22.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -4.790 -10.787 -20.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -3.104 -10.738 -20.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -4.017 -9.313 -20.016 1.00 0.00 H new ATOM 636 N LEU A 41 -1.389 -4.832 -19.836 1.00 0.00 N ATOM 637 CA LEU A 41 -0.128 -4.135 -19.544 1.00 0.00 C ATOM 638 C LEU A 41 -0.227 -3.398 -18.195 1.00 0.00 C ATOM 639 O LEU A 41 -1.200 -2.681 -17.970 1.00 0.00 O ATOM 640 CB LEU A 41 0.158 -3.235 -20.768 1.00 0.00 C ATOM 641 CG LEU A 41 1.244 -2.146 -20.732 1.00 0.00 C ATOM 642 CD1 LEU A 41 0.829 -0.934 -19.901 1.00 0.00 C ATOM 643 CD2 LEU A 41 2.613 -2.658 -20.298 1.00 0.00 C ATOM 0 H LEU A 41 -2.214 -4.299 -19.562 1.00 0.00 H new ATOM 0 HA LEU A 41 0.719 -4.809 -19.412 1.00 0.00 H new ATOM 0 HB2 LEU A 41 0.402 -3.898 -21.598 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -0.779 -2.739 -21.022 1.00 0.00 H new ATOM 0 HG LEU A 41 1.347 -1.824 -21.768 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.631 -0.196 -19.909 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -0.073 -0.494 -20.325 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.633 -1.246 -18.875 1.00 0.00 H new ATOM 0 HD21 LEU A 41 3.326 -1.834 -20.297 1.00 0.00 H new ATOM 0 HD22 LEU A 41 2.543 -3.079 -19.295 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.950 -3.428 -20.992 1.00 0.00 H new ATOM 655 N ILE A 42 0.772 -3.548 -17.312 1.00 0.00 N ATOM 656 CA ILE A 42 0.982 -2.700 -16.127 1.00 0.00 C ATOM 657 C ILE A 42 2.261 -1.860 -16.269 1.00 0.00 C ATOM 658 O ILE A 42 3.260 -2.327 -16.821 1.00 0.00 O ATOM 659 CB ILE A 42 0.969 -3.496 -14.794 1.00 0.00 C ATOM 660 CG1 ILE A 42 2.225 -4.354 -14.522 1.00 0.00 C ATOM 661 CG2 ILE A 42 -0.274 -4.390 -14.652 1.00 0.00 C ATOM 662 CD1 ILE A 42 2.294 -4.825 -13.064 1.00 0.00 C ATOM 0 H ILE A 42 1.475 -4.281 -17.404 1.00 0.00 H new ATOM 0 HA ILE A 42 0.130 -2.022 -16.079 1.00 0.00 H new ATOM 0 HB ILE A 42 0.953 -2.704 -14.045 1.00 0.00 H new ATOM 0 HG12 ILE A 42 2.222 -5.221 -15.183 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.118 -3.775 -14.759 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -0.232 -4.924 -13.702 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.172 -3.772 -14.682 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.301 -5.109 -15.471 1.00 0.00 H new ATOM 0 HD11 ILE A 42 3.192 -5.425 -12.917 1.00 0.00 H new ATOM 0 HD12 ILE A 42 2.324 -3.959 -12.403 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.415 -5.427 -12.834 1.00 0.00 H new ATOM 674 N ILE A 43 2.253 -0.645 -15.709 1.00 0.00 N ATOM 675 CA ILE A 43 3.435 0.212 -15.574 1.00 0.00 C ATOM 676 C ILE A 43 3.646 0.554 -14.102 1.00 0.00 C ATOM 677 O ILE A 43 2.705 0.955 -13.416 1.00 0.00 O ATOM 678 CB ILE A 43 3.312 1.547 -16.344 1.00 0.00 C ATOM 679 CG1 ILE A 43 2.808 1.473 -17.799 1.00 0.00 C ATOM 680 CG2 ILE A 43 4.669 2.276 -16.286 1.00 0.00 C ATOM 681 CD1 ILE A 43 3.727 0.760 -18.795 1.00 0.00 C ATOM 0 H ILE A 43 1.406 -0.222 -15.329 1.00 0.00 H new ATOM 0 HA ILE A 43 4.270 -0.350 -15.992 1.00 0.00 H new ATOM 0 HB ILE A 43 2.520 2.096 -15.834 1.00 0.00 H new ATOM 0 HG12 ILE A 43 1.842 0.969 -17.802 1.00 0.00 H new ATOM 0 HG13 ILE A 43 2.638 2.489 -18.155 1.00 0.00 H new ATOM 0 HG21 ILE A 43 4.598 3.220 -16.825 1.00 0.00 H new ATOM 0 HG22 ILE A 43 4.933 2.471 -15.247 1.00 0.00 H new ATOM 0 HG23 ILE A 43 5.437 1.653 -16.745 1.00 0.00 H new ATOM 0 HD11 ILE A 43 3.269 0.770 -19.784 1.00 0.00 H new ATOM 0 HD12 ILE A 43 4.688 1.273 -18.835 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.879 -0.271 -18.476 1.00 0.00 H new ATOM 693 N ILE A 44 4.900 0.493 -13.655 1.00 0.00 N ATOM 694 CA ILE A 44 5.335 0.997 -12.359 1.00 0.00 C ATOM 695 C ILE A 44 6.275 2.197 -12.569 1.00 0.00 C ATOM 696 O ILE A 44 7.476 2.032 -12.786 1.00 0.00 O ATOM 697 CB ILE A 44 5.915 -0.162 -11.516 1.00 0.00 C ATOM 698 CG1 ILE A 44 4.869 -1.285 -11.280 1.00 0.00 C ATOM 699 CG2 ILE A 44 6.388 0.326 -10.146 1.00 0.00 C ATOM 700 CD1 ILE A 44 5.266 -2.601 -11.943 1.00 0.00 C ATOM 0 H ILE A 44 5.658 0.081 -14.200 1.00 0.00 H new ATOM 0 HA ILE A 44 4.499 1.381 -11.774 1.00 0.00 H new ATOM 0 HB ILE A 44 6.756 -0.555 -12.087 1.00 0.00 H new ATOM 0 HG12 ILE A 44 4.747 -1.444 -10.209 1.00 0.00 H new ATOM 0 HG13 ILE A 44 3.902 -0.964 -11.667 1.00 0.00 H new ATOM 0 HG21 ILE A 44 6.790 -0.514 -9.579 1.00 0.00 H new ATOM 0 HG22 ILE A 44 7.164 1.080 -10.276 1.00 0.00 H new ATOM 0 HG23 ILE A 44 5.548 0.760 -9.604 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.501 -3.352 -11.747 1.00 0.00 H new ATOM 0 HD12 ILE A 44 5.362 -2.452 -13.019 1.00 0.00 H new ATOM 0 HD13 ILE A 44 6.219 -2.940 -11.537 1.00 0.00 H new ATOM 712 N ALA A 45 5.710 3.410 -12.492 1.00 0.00 N ATOM 713 CA ALA A 45 6.408 4.675 -12.238 1.00 0.00 C ATOM 714 C ALA A 45 6.033 5.199 -10.833 1.00 0.00 C ATOM 715 O ALA A 45 5.675 6.358 -10.618 1.00 0.00 O ATOM 716 CB ALA A 45 6.164 5.684 -13.370 1.00 0.00 C ATOM 0 H ALA A 45 4.705 3.540 -12.611 1.00 0.00 H new ATOM 0 HA ALA A 45 7.486 4.511 -12.237 1.00 0.00 H new ATOM 0 HB1 ALA A 45 6.695 6.611 -13.152 1.00 0.00 H new ATOM 0 HB2 ALA A 45 6.528 5.270 -14.311 1.00 0.00 H new ATOM 0 HB3 ALA A 45 5.096 5.888 -13.452 1.00 0.00 H new ATOM 722 N ALA A 46 6.159 4.312 -9.845 1.00 0.00 N ATOM 723 CA ALA A 46 6.217 4.623 -8.422 1.00 0.00 C ATOM 724 C ALA A 46 7.471 3.935 -7.858 1.00 0.00 C ATOM 725 O ALA A 46 7.742 2.797 -8.248 1.00 0.00 O ATOM 726 CB ALA A 46 4.926 4.139 -7.754 1.00 0.00 C ATOM 0 H ALA A 46 6.226 3.311 -10.027 1.00 0.00 H new ATOM 0 HA ALA A 46 6.290 5.694 -8.232 1.00 0.00 H new ATOM 0 HB1 ALA A 46 4.960 4.367 -6.689 1.00 0.00 H new ATOM 0 HB2 ALA A 46 4.072 4.643 -8.206 1.00 0.00 H new ATOM 0 HB3 ALA A 46 4.827 3.062 -7.891 1.00 0.00 H new ATOM 732 N ASN A 47 8.232 4.594 -6.975 1.00 0.00 N ATOM 733 CA ASN A 47 9.443 4.063 -6.331 1.00 0.00 C ATOM 734 C ASN A 47 9.117 2.843 -5.440 1.00 0.00 C ATOM 735 O ASN A 47 8.875 2.957 -4.239 1.00 0.00 O ATOM 736 CB ASN A 47 10.185 5.196 -5.593 1.00 0.00 C ATOM 737 CG ASN A 47 11.110 5.959 -6.532 1.00 0.00 C ATOM 738 OD1 ASN A 47 12.187 5.494 -6.863 1.00 0.00 O ATOM 739 ND2 ASN A 47 10.710 7.101 -7.049 1.00 0.00 N ATOM 0 H ASN A 47 8.015 5.545 -6.678 1.00 0.00 H new ATOM 0 HA ASN A 47 10.125 3.685 -7.092 1.00 0.00 H new ATOM 0 HB2 ASN A 47 9.460 5.883 -5.156 1.00 0.00 H new ATOM 0 HB3 ASN A 47 10.764 4.778 -4.770 1.00 0.00 H new ATOM 0 HD21 ASN A 47 11.300 7.591 -7.722 1.00 0.00 H new ATOM 0 HD22 ASN A 47 9.810 7.497 -6.777 1.00 0.00 H new ATOM 746 N THR A 48 9.036 1.680 -6.089 1.00 0.00 N ATOM 747 CA THR A 48 8.359 0.464 -5.622 1.00 0.00 C ATOM 748 C THR A 48 9.368 -0.613 -5.185 1.00 0.00 C ATOM 749 O THR A 48 10.020 -1.196 -6.053 1.00 0.00 O ATOM 750 CB THR A 48 7.439 -0.046 -6.743 1.00 0.00 C ATOM 751 OG1 THR A 48 6.486 0.941 -7.051 1.00 0.00 O ATOM 752 CG2 THR A 48 6.627 -1.280 -6.383 1.00 0.00 C ATOM 0 H THR A 48 9.464 1.552 -7.006 1.00 0.00 H new ATOM 0 HA THR A 48 7.761 0.698 -4.741 1.00 0.00 H new ATOM 0 HB THR A 48 8.113 -0.290 -7.564 1.00 0.00 H new ATOM 0 HG1 THR A 48 6.800 1.473 -7.811 1.00 0.00 H new ATOM 0 HG21 THR A 48 6.008 -1.568 -7.232 1.00 0.00 H new ATOM 0 HG22 THR A 48 7.301 -2.099 -6.131 1.00 0.00 H new ATOM 0 HG23 THR A 48 5.989 -1.059 -5.527 1.00 0.00 H new ATOM 760 N PRO A 49 9.518 -0.910 -3.877 1.00 0.00 N ATOM 761 CA PRO A 49 10.476 -1.908 -3.396 1.00 0.00 C ATOM 762 C PRO A 49 10.076 -3.353 -3.750 1.00 0.00 C ATOM 763 O PRO A 49 8.950 -3.631 -4.166 1.00 0.00 O ATOM 764 CB PRO A 49 10.572 -1.675 -1.883 1.00 0.00 C ATOM 765 CG PRO A 49 9.201 -1.106 -1.523 1.00 0.00 C ATOM 766 CD PRO A 49 8.827 -0.287 -2.757 1.00 0.00 C ATOM 0 HA PRO A 49 11.444 -1.789 -3.883 1.00 0.00 H new ATOM 0 HB2 PRO A 49 10.776 -2.602 -1.346 1.00 0.00 H new ATOM 0 HB3 PRO A 49 11.373 -0.979 -1.634 1.00 0.00 H new ATOM 0 HG2 PRO A 49 8.476 -1.896 -1.329 1.00 0.00 H new ATOM 0 HG3 PRO A 49 9.245 -0.487 -0.627 1.00 0.00 H new ATOM 0 HD2 PRO A 49 7.748 -0.289 -2.914 1.00 0.00 H new ATOM 0 HD3 PRO A 49 9.130 0.753 -2.641 1.00 0.00 H new ATOM 774 N VAL A 50 11.013 -4.293 -3.560 1.00 0.00 N ATOM 775 CA VAL A 50 10.973 -5.661 -4.109 1.00 0.00 C ATOM 776 C VAL A 50 9.671 -6.411 -3.806 1.00 0.00 C ATOM 777 O VAL A 50 9.050 -6.926 -4.734 1.00 0.00 O ATOM 778 CB VAL A 50 12.202 -6.481 -3.657 1.00 0.00 C ATOM 779 CG1 VAL A 50 12.207 -7.887 -4.276 1.00 0.00 C ATOM 780 CG2 VAL A 50 13.515 -5.791 -4.060 1.00 0.00 C ATOM 0 H VAL A 50 11.849 -4.119 -3.002 1.00 0.00 H new ATOM 0 HA VAL A 50 11.007 -5.545 -5.192 1.00 0.00 H new ATOM 0 HB VAL A 50 12.132 -6.554 -2.572 1.00 0.00 H new ATOM 0 HG11 VAL A 50 13.087 -8.432 -3.934 1.00 0.00 H new ATOM 0 HG12 VAL A 50 11.308 -8.422 -3.971 1.00 0.00 H new ATOM 0 HG13 VAL A 50 12.230 -7.806 -5.363 1.00 0.00 H new ATOM 0 HG21 VAL A 50 14.360 -6.394 -3.727 1.00 0.00 H new ATOM 0 HG22 VAL A 50 13.551 -5.683 -5.144 1.00 0.00 H new ATOM 0 HG23 VAL A 50 13.566 -4.806 -3.595 1.00 0.00 H new ATOM 790 N LEU A 51 9.226 -6.492 -2.547 1.00 0.00 N ATOM 791 CA LEU A 51 7.984 -7.200 -2.196 1.00 0.00 C ATOM 792 C LEU A 51 6.732 -6.521 -2.786 1.00 0.00 C ATOM 793 O LEU A 51 5.764 -7.186 -3.155 1.00 0.00 O ATOM 794 CB LEU A 51 7.860 -7.314 -0.666 1.00 0.00 C ATOM 795 CG LEU A 51 9.002 -8.091 0.023 1.00 0.00 C ATOM 796 CD1 LEU A 51 8.784 -8.075 1.538 1.00 0.00 C ATOM 797 CD2 LEU A 51 9.088 -9.547 -0.443 1.00 0.00 C ATOM 0 H LEU A 51 9.707 -6.075 -1.750 1.00 0.00 H new ATOM 0 HA LEU A 51 8.042 -8.196 -2.634 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.817 -6.310 -0.244 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.914 -7.801 -0.428 1.00 0.00 H new ATOM 0 HG LEU A 51 9.935 -7.597 -0.247 1.00 0.00 H new ATOM 0 HD11 LEU A 51 9.589 -8.623 2.027 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.778 -7.045 1.894 1.00 0.00 H new ATOM 0 HD13 LEU A 51 7.829 -8.546 1.773 1.00 0.00 H new ATOM 0 HD21 LEU A 51 9.908 -10.046 0.073 1.00 0.00 H new ATOM 0 HD22 LEU A 51 8.152 -10.057 -0.216 1.00 0.00 H new ATOM 0 HD23 LEU A 51 9.266 -9.575 -1.518 1.00 0.00 H new ATOM 809 N ARG A 52 6.770 -5.191 -2.912 1.00 0.00 N ATOM 810 CA ARG A 52 5.703 -4.344 -3.445 1.00 0.00 C ATOM 811 C ARG A 52 5.572 -4.527 -4.967 1.00 0.00 C ATOM 812 O ARG A 52 4.455 -4.752 -5.470 1.00 0.00 O ATOM 813 CB ARG A 52 6.011 -2.902 -2.978 1.00 0.00 C ATOM 814 CG ARG A 52 4.826 -1.938 -2.880 1.00 0.00 C ATOM 815 CD ARG A 52 3.909 -2.089 -1.652 1.00 0.00 C ATOM 816 NE ARG A 52 3.287 -3.424 -1.516 1.00 0.00 N ATOM 817 CZ ARG A 52 3.507 -4.360 -0.603 1.00 0.00 C ATOM 818 NH1 ARG A 52 4.390 -4.208 0.357 1.00 0.00 N ATOM 819 NH2 ARG A 52 2.843 -5.490 -0.640 1.00 0.00 N ATOM 0 H ARG A 52 7.588 -4.650 -2.630 1.00 0.00 H new ATOM 0 HA ARG A 52 4.718 -4.618 -3.068 1.00 0.00 H new ATOM 0 HB2 ARG A 52 6.486 -2.957 -1.998 1.00 0.00 H new ATOM 0 HB3 ARG A 52 6.742 -2.472 -3.663 1.00 0.00 H new ATOM 0 HG2 ARG A 52 5.214 -0.920 -2.891 1.00 0.00 H new ATOM 0 HG3 ARG A 52 4.217 -2.056 -3.776 1.00 0.00 H new ATOM 0 HD2 ARG A 52 4.488 -1.878 -0.753 1.00 0.00 H new ATOM 0 HD3 ARG A 52 3.121 -1.338 -1.707 1.00 0.00 H new ATOM 0 HE ARG A 52 2.591 -3.657 -2.224 1.00 0.00 H new ATOM 0 HH11 ARG A 52 4.934 -3.347 0.418 1.00 0.00 H new ATOM 0 HH12 ARG A 52 4.532 -4.951 1.042 1.00 0.00 H new ATOM 0 HH21 ARG A 52 2.153 -5.652 -1.374 1.00 0.00 H new ATOM 0 HH22 ARG A 52 3.016 -6.207 0.065 1.00 0.00 H new ATOM 833 N LYS A 53 6.712 -4.517 -5.679 1.00 0.00 N ATOM 834 CA LYS A 53 6.733 -4.824 -7.112 1.00 0.00 C ATOM 835 C LYS A 53 6.332 -6.280 -7.315 1.00 0.00 C ATOM 836 O LYS A 53 5.512 -6.543 -8.182 1.00 0.00 O ATOM 837 CB LYS A 53 8.067 -4.476 -7.813 1.00 0.00 C ATOM 838 CG LYS A 53 9.164 -5.553 -7.844 1.00 0.00 C ATOM 839 CD LYS A 53 10.399 -5.101 -8.636 1.00 0.00 C ATOM 840 CE LYS A 53 11.255 -6.281 -9.121 1.00 0.00 C ATOM 841 NZ LYS A 53 10.639 -7.005 -10.263 1.00 0.00 N ATOM 0 H LYS A 53 7.627 -4.300 -5.283 1.00 0.00 H new ATOM 0 HA LYS A 53 6.005 -4.175 -7.599 1.00 0.00 H new ATOM 0 HB2 LYS A 53 7.842 -4.198 -8.843 1.00 0.00 H new ATOM 0 HB3 LYS A 53 8.480 -3.592 -7.327 1.00 0.00 H new ATOM 0 HG2 LYS A 53 9.459 -5.798 -6.824 1.00 0.00 H new ATOM 0 HG3 LYS A 53 8.763 -6.464 -8.288 1.00 0.00 H new ATOM 0 HD2 LYS A 53 10.079 -4.512 -9.495 1.00 0.00 H new ATOM 0 HD3 LYS A 53 11.008 -4.448 -8.011 1.00 0.00 H new ATOM 0 HE2 LYS A 53 12.238 -5.914 -9.416 1.00 0.00 H new ATOM 0 HE3 LYS A 53 11.409 -6.976 -8.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 11.377 -7.264 -10.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 10.171 -7.866 -9.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.938 -6.392 -10.725 1.00 0.00 H new ATOM 855 N SER A 54 6.837 -7.194 -6.471 1.00 0.00 N ATOM 856 CA SER A 54 6.520 -8.624 -6.511 1.00 0.00 C ATOM 857 C SER A 54 5.019 -8.867 -6.420 1.00 0.00 C ATOM 858 O SER A 54 4.518 -9.663 -7.201 1.00 0.00 O ATOM 859 CB SER A 54 7.227 -9.423 -5.411 1.00 0.00 C ATOM 860 OG SER A 54 8.629 -9.282 -5.500 1.00 0.00 O ATOM 0 H SER A 54 7.491 -6.950 -5.727 1.00 0.00 H new ATOM 0 HA SER A 54 6.888 -8.977 -7.474 1.00 0.00 H new ATOM 0 HB2 SER A 54 6.886 -9.082 -4.434 1.00 0.00 H new ATOM 0 HB3 SER A 54 6.959 -10.476 -5.493 1.00 0.00 H new ATOM 0 HG SER A 54 8.863 -8.330 -5.502 1.00 0.00 H new ATOM 866 N GLU A 55 4.287 -8.160 -5.544 1.00 0.00 N ATOM 867 CA GLU A 55 2.819 -8.184 -5.559 1.00 0.00 C ATOM 868 C GLU A 55 2.270 -7.798 -6.945 1.00 0.00 C ATOM 869 O GLU A 55 1.537 -8.592 -7.536 1.00 0.00 O ATOM 870 CB GLU A 55 2.225 -7.258 -4.471 1.00 0.00 C ATOM 871 CG GLU A 55 1.303 -7.961 -3.465 1.00 0.00 C ATOM 872 CD GLU A 55 0.289 -6.991 -2.826 1.00 0.00 C ATOM 873 OE1 GLU A 55 0.684 -6.046 -2.095 1.00 0.00 O ATOM 874 OE2 GLU A 55 -0.936 -7.179 -3.054 1.00 0.00 O ATOM 0 H GLU A 55 4.689 -7.566 -4.818 1.00 0.00 H new ATOM 0 HA GLU A 55 2.513 -9.207 -5.338 1.00 0.00 H new ATOM 0 HB2 GLU A 55 3.044 -6.788 -3.926 1.00 0.00 H new ATOM 0 HB3 GLU A 55 1.667 -6.459 -4.958 1.00 0.00 H new ATOM 0 HG2 GLU A 55 0.766 -8.765 -3.968 1.00 0.00 H new ATOM 0 HG3 GLU A 55 1.906 -8.421 -2.682 1.00 0.00 H new ATOM 881 N LEU A 56 2.621 -6.615 -7.487 1.00 0.00 N ATOM 882 CA LEU A 56 2.087 -6.198 -8.807 1.00 0.00 C ATOM 883 C LEU A 56 2.410 -7.192 -9.926 1.00 0.00 C ATOM 884 O LEU A 56 1.559 -7.546 -10.742 1.00 0.00 O ATOM 885 CB LEU A 56 2.583 -4.804 -9.212 1.00 0.00 C ATOM 886 CG LEU A 56 2.080 -3.638 -8.346 1.00 0.00 C ATOM 887 CD1 LEU A 56 1.767 -2.436 -9.231 1.00 0.00 C ATOM 888 CD2 LEU A 56 0.804 -3.930 -7.556 1.00 0.00 C ATOM 0 H LEU A 56 3.254 -5.945 -7.049 1.00 0.00 H new ATOM 0 HA LEU A 56 1.005 -6.172 -8.680 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.673 -4.806 -9.189 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.287 -4.619 -10.245 1.00 0.00 H new ATOM 0 HG LEU A 56 2.887 -3.455 -7.636 1.00 0.00 H new ATOM 0 HD11 LEU A 56 1.411 -1.612 -8.613 1.00 0.00 H new ATOM 0 HD12 LEU A 56 2.669 -2.129 -9.760 1.00 0.00 H new ATOM 0 HD13 LEU A 56 0.997 -2.707 -9.953 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.526 -3.050 -6.976 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.002 -4.179 -8.246 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.977 -4.769 -6.882 1.00 0.00 H new ATOM 900 N GLU A 57 3.656 -7.634 -9.925 1.00 0.00 N ATOM 901 CA GLU A 57 4.259 -8.601 -10.840 1.00 0.00 C ATOM 902 C GLU A 57 3.588 -9.985 -10.730 1.00 0.00 C ATOM 903 O GLU A 57 3.356 -10.634 -11.750 1.00 0.00 O ATOM 904 CB GLU A 57 5.763 -8.602 -10.525 1.00 0.00 C ATOM 905 CG GLU A 57 6.708 -9.148 -11.597 1.00 0.00 C ATOM 906 CD GLU A 57 8.085 -8.505 -11.378 1.00 0.00 C ATOM 907 OE1 GLU A 57 8.800 -8.891 -10.425 1.00 0.00 O ATOM 908 OE2 GLU A 57 8.404 -7.501 -12.064 1.00 0.00 O ATOM 0 H GLU A 57 4.328 -7.303 -9.233 1.00 0.00 H new ATOM 0 HA GLU A 57 4.107 -8.327 -11.884 1.00 0.00 H new ATOM 0 HB2 GLU A 57 6.061 -7.577 -10.304 1.00 0.00 H new ATOM 0 HB3 GLU A 57 5.916 -9.182 -9.615 1.00 0.00 H new ATOM 0 HG2 GLU A 57 6.778 -10.234 -11.528 1.00 0.00 H new ATOM 0 HG3 GLU A 57 6.331 -8.915 -12.593 1.00 0.00 H new ATOM 915 N TYR A 58 3.172 -10.396 -9.523 1.00 0.00 N ATOM 916 CA TYR A 58 2.322 -11.566 -9.287 1.00 0.00 C ATOM 917 C TYR A 58 0.948 -11.401 -9.941 1.00 0.00 C ATOM 918 O TYR A 58 0.496 -12.299 -10.649 1.00 0.00 O ATOM 919 CB TYR A 58 2.171 -11.827 -7.779 1.00 0.00 C ATOM 920 CG TYR A 58 1.767 -13.243 -7.430 1.00 0.00 C ATOM 921 CD1 TYR A 58 0.416 -13.639 -7.448 1.00 0.00 C ATOM 922 CD2 TYR A 58 2.767 -14.163 -7.064 1.00 0.00 C ATOM 923 CE1 TYR A 58 0.072 -14.961 -7.107 1.00 0.00 C ATOM 924 CE2 TYR A 58 2.431 -15.488 -6.733 1.00 0.00 C ATOM 925 CZ TYR A 58 1.075 -15.888 -6.755 1.00 0.00 C ATOM 926 OH TYR A 58 0.729 -17.165 -6.439 1.00 0.00 O ATOM 0 H TYR A 58 3.426 -9.909 -8.663 1.00 0.00 H new ATOM 0 HA TYR A 58 2.808 -12.427 -9.746 1.00 0.00 H new ATOM 0 HB2 TYR A 58 3.116 -11.599 -7.286 1.00 0.00 H new ATOM 0 HB3 TYR A 58 1.427 -11.140 -7.376 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -0.353 -12.932 -7.722 1.00 0.00 H new ATOM 0 HD2 TYR A 58 3.800 -13.849 -7.037 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -0.964 -15.266 -7.115 1.00 0.00 H new ATOM 0 HE2 TYR A 58 3.203 -16.194 -6.464 1.00 0.00 H new ATOM 0 HH TYR A 58 1.535 -17.678 -6.221 1.00 0.00 H new ATOM 936 N TYR A 59 0.270 -10.265 -9.737 1.00 0.00 N ATOM 937 CA TYR A 59 -1.032 -10.032 -10.373 1.00 0.00 C ATOM 938 C TYR A 59 -0.925 -9.919 -11.898 1.00 0.00 C ATOM 939 O TYR A 59 -1.796 -10.435 -12.600 1.00 0.00 O ATOM 940 CB TYR A 59 -1.731 -8.816 -9.765 1.00 0.00 C ATOM 941 CG TYR A 59 -1.856 -8.876 -8.257 1.00 0.00 C ATOM 942 CD1 TYR A 59 -2.483 -9.971 -7.631 1.00 0.00 C ATOM 943 CD2 TYR A 59 -1.279 -7.863 -7.477 1.00 0.00 C ATOM 944 CE1 TYR A 59 -2.517 -10.059 -6.227 1.00 0.00 C ATOM 945 CE2 TYR A 59 -1.293 -7.954 -6.077 1.00 0.00 C ATOM 946 CZ TYR A 59 -1.931 -9.040 -5.443 1.00 0.00 C ATOM 947 OH TYR A 59 -2.062 -9.058 -4.086 1.00 0.00 O ATOM 0 H TYR A 59 0.596 -9.502 -9.144 1.00 0.00 H new ATOM 0 HA TYR A 59 -1.648 -10.908 -10.171 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -1.180 -7.916 -10.039 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -2.726 -8.725 -10.200 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -2.939 -10.745 -8.230 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -0.822 -7.010 -7.956 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -2.990 -10.904 -5.749 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -0.814 -7.190 -5.483 1.00 0.00 H new ATOM 0 HH TYR A 59 -1.305 -8.588 -3.678 1.00 0.00 H new ATOM 957 N ALA A 60 0.153 -9.325 -12.431 1.00 0.00 N ATOM 958 CA ALA A 60 0.497 -9.395 -13.848 1.00 0.00 C ATOM 959 C ALA A 60 0.683 -10.848 -14.336 1.00 0.00 C ATOM 960 O ALA A 60 0.095 -11.235 -15.345 1.00 0.00 O ATOM 961 CB ALA A 60 1.740 -8.544 -14.108 1.00 0.00 C ATOM 0 H ALA A 60 0.814 -8.778 -11.879 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.336 -8.994 -14.426 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.000 -8.594 -15.165 1.00 0.00 H new ATOM 0 HB2 ALA A 60 1.537 -7.509 -13.833 1.00 0.00 H new ATOM 0 HB3 ALA A 60 2.571 -8.922 -13.512 1.00 0.00 H new ATOM 967 N MET A 61 1.455 -11.668 -13.606 1.00 0.00 N ATOM 968 CA MET A 61 1.637 -13.103 -13.863 1.00 0.00 C ATOM 969 C MET A 61 0.308 -13.878 -13.851 1.00 0.00 C ATOM 970 O MET A 61 0.080 -14.703 -14.740 1.00 0.00 O ATOM 971 CB MET A 61 2.673 -13.660 -12.867 1.00 0.00 C ATOM 972 CG MET A 61 2.877 -15.183 -12.900 1.00 0.00 C ATOM 973 SD MET A 61 1.611 -16.213 -12.089 1.00 0.00 S ATOM 974 CE MET A 61 1.766 -15.687 -10.358 1.00 0.00 C ATOM 0 H MET A 61 1.984 -11.341 -12.798 1.00 0.00 H new ATOM 0 HA MET A 61 2.022 -13.239 -14.874 1.00 0.00 H new ATOM 0 HB2 MET A 61 3.632 -13.179 -13.061 1.00 0.00 H new ATOM 0 HB3 MET A 61 2.371 -13.374 -11.859 1.00 0.00 H new ATOM 0 HG2 MET A 61 2.946 -15.492 -13.943 1.00 0.00 H new ATOM 0 HG3 MET A 61 3.839 -15.405 -12.438 1.00 0.00 H new ATOM 0 HE1 MET A 61 1.227 -16.384 -9.716 1.00 0.00 H new ATOM 0 HE2 MET A 61 2.819 -15.673 -10.075 1.00 0.00 H new ATOM 0 HE3 MET A 61 1.345 -14.688 -10.242 1.00 0.00 H new ATOM 984 N LEU A 62 -0.590 -13.612 -12.892 1.00 0.00 N ATOM 985 CA LEU A 62 -1.940 -14.188 -12.861 1.00 0.00 C ATOM 986 C LEU A 62 -2.753 -13.768 -14.097 1.00 0.00 C ATOM 987 O LEU A 62 -3.165 -14.620 -14.885 1.00 0.00 O ATOM 988 CB LEU A 62 -2.681 -13.793 -11.570 1.00 0.00 C ATOM 989 CG LEU A 62 -2.171 -14.432 -10.264 1.00 0.00 C ATOM 990 CD1 LEU A 62 -3.030 -13.902 -9.112 1.00 0.00 C ATOM 991 CD2 LEU A 62 -2.265 -15.960 -10.268 1.00 0.00 C ATOM 0 H LEU A 62 -0.397 -12.986 -12.110 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.834 -15.273 -12.877 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -2.628 -12.710 -11.464 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.734 -14.050 -11.688 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.119 -14.170 -10.156 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.690 -14.339 -8.173 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -2.940 -12.817 -9.060 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -4.072 -14.172 -9.281 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.891 -16.350 -9.321 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.305 -16.260 -10.399 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -1.666 -16.359 -11.087 1.00 0.00 H new ATOM 1003 N SER A 63 -2.970 -12.462 -14.266 1.00 0.00 N ATOM 1004 CA SER A 63 -3.825 -11.821 -15.276 1.00 0.00 C ATOM 1005 C SER A 63 -3.219 -11.799 -16.696 1.00 0.00 C ATOM 1006 O SER A 63 -3.347 -10.795 -17.405 1.00 0.00 O ATOM 1007 CB SER A 63 -4.161 -10.395 -14.796 1.00 0.00 C ATOM 1008 OG SER A 63 -2.987 -9.618 -14.658 1.00 0.00 O ATOM 0 H SER A 63 -2.523 -11.774 -13.660 1.00 0.00 H new ATOM 0 HA SER A 63 -4.729 -12.423 -15.370 1.00 0.00 H new ATOM 0 HB2 SER A 63 -4.836 -9.918 -15.506 1.00 0.00 H new ATOM 0 HB3 SER A 63 -4.685 -10.443 -13.841 1.00 0.00 H new ATOM 0 HG SER A 63 -2.640 -9.708 -13.746 1.00 0.00 H new ATOM 1014 N LYS A 64 -2.592 -12.897 -17.164 1.00 0.00 N ATOM 1015 CA LYS A 64 -1.285 -12.893 -17.861 1.00 0.00 C ATOM 1016 C LYS A 64 -1.052 -11.617 -18.682 1.00 0.00 C ATOM 1017 O LYS A 64 -1.593 -11.427 -19.773 1.00 0.00 O ATOM 1018 CB LYS A 64 -1.129 -14.125 -18.780 1.00 0.00 C ATOM 1019 CG LYS A 64 -0.843 -15.446 -18.052 1.00 0.00 C ATOM 1020 CD LYS A 64 -2.107 -16.241 -17.691 1.00 0.00 C ATOM 1021 CE LYS A 64 -1.797 -17.353 -16.682 1.00 0.00 C ATOM 1022 NZ LYS A 64 -1.556 -16.799 -15.329 1.00 0.00 N ATOM 0 H LYS A 64 -2.987 -13.833 -17.067 1.00 0.00 H new ATOM 0 HA LYS A 64 -0.533 -12.930 -17.073 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -2.041 -14.240 -19.365 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -0.320 -13.934 -19.485 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -0.203 -16.065 -18.680 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -0.285 -15.234 -17.140 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -2.856 -15.568 -17.274 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -2.536 -16.676 -18.594 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -2.628 -18.057 -16.646 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -0.920 -17.911 -17.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -1.466 -17.578 -14.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -0.679 -16.240 -15.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -2.353 -16.189 -15.056 1.00 0.00 H new ATOM 1036 N THR A 65 -0.308 -10.704 -18.064 1.00 0.00 N ATOM 1037 CA THR A 65 -0.181 -9.280 -18.375 1.00 0.00 C ATOM 1038 C THR A 65 1.296 -8.874 -18.406 1.00 0.00 C ATOM 1039 O THR A 65 2.112 -9.391 -17.646 1.00 0.00 O ATOM 1040 CB THR A 65 -0.990 -8.498 -17.319 1.00 0.00 C ATOM 1041 OG1 THR A 65 -2.356 -8.486 -17.670 1.00 0.00 O ATOM 1042 CG2 THR A 65 -0.566 -7.057 -17.074 1.00 0.00 C ATOM 0 H THR A 65 0.271 -10.961 -17.265 1.00 0.00 H new ATOM 0 HA THR A 65 -0.579 -9.053 -19.364 1.00 0.00 H new ATOM 0 HB THR A 65 -0.791 -9.036 -16.392 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.818 -9.219 -17.212 1.00 0.00 H new ATOM 0 HG21 THR A 65 -1.208 -6.613 -16.313 1.00 0.00 H new ATOM 0 HG22 THR A 65 0.469 -7.035 -16.734 1.00 0.00 H new ATOM 0 HG23 THR A 65 -0.656 -6.489 -18.000 1.00 0.00 H new ATOM 1050 N LYS A 66 1.634 -7.927 -19.290 1.00 0.00 N ATOM 1051 CA LYS A 66 2.984 -7.394 -19.491 1.00 0.00 C ATOM 1052 C LYS A 66 3.330 -6.371 -18.398 1.00 0.00 C ATOM 1053 O LYS A 66 2.454 -5.642 -17.942 1.00 0.00 O ATOM 1054 CB LYS A 66 2.989 -6.768 -20.896 1.00 0.00 C ATOM 1055 CG LYS A 66 4.368 -6.321 -21.404 1.00 0.00 C ATOM 1056 CD LYS A 66 4.260 -5.789 -22.843 1.00 0.00 C ATOM 1057 CE LYS A 66 4.066 -6.902 -23.883 1.00 0.00 C ATOM 1058 NZ LYS A 66 3.417 -6.368 -25.098 1.00 0.00 N ATOM 0 H LYS A 66 0.947 -7.495 -19.908 1.00 0.00 H new ATOM 0 HA LYS A 66 3.744 -8.172 -19.420 1.00 0.00 H new ATOM 0 HB2 LYS A 66 2.576 -7.490 -21.600 1.00 0.00 H new ATOM 0 HB3 LYS A 66 2.322 -5.906 -20.895 1.00 0.00 H new ATOM 0 HG2 LYS A 66 4.770 -5.546 -20.752 1.00 0.00 H new ATOM 0 HG3 LYS A 66 5.065 -7.159 -21.370 1.00 0.00 H new ATOM 0 HD2 LYS A 66 3.424 -5.092 -22.905 1.00 0.00 H new ATOM 0 HD3 LYS A 66 5.162 -5.227 -23.085 1.00 0.00 H new ATOM 0 HE2 LYS A 66 5.031 -7.339 -24.141 1.00 0.00 H new ATOM 0 HE3 LYS A 66 3.457 -7.701 -23.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 3.564 -7.028 -25.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 2.398 -6.255 -24.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 3.832 -5.445 -25.336 1.00 0.00 H new ATOM 1072 N VAL A 67 4.604 -6.292 -17.998 1.00 0.00 N ATOM 1073 CA VAL A 67 5.098 -5.402 -16.931 1.00 0.00 C ATOM 1074 C VAL A 67 6.104 -4.398 -17.498 1.00 0.00 C ATOM 1075 O VAL A 67 6.905 -4.748 -18.364 1.00 0.00 O ATOM 1076 CB VAL A 67 5.768 -6.221 -15.801 1.00 0.00 C ATOM 1077 CG1 VAL A 67 6.112 -5.357 -14.579 1.00 0.00 C ATOM 1078 CG2 VAL A 67 4.878 -7.367 -15.311 1.00 0.00 C ATOM 0 H VAL A 67 5.342 -6.858 -18.416 1.00 0.00 H new ATOM 0 HA VAL A 67 4.244 -4.863 -16.519 1.00 0.00 H new ATOM 0 HB VAL A 67 6.680 -6.618 -16.247 1.00 0.00 H new ATOM 0 HG11 VAL A 67 6.580 -5.978 -13.815 1.00 0.00 H new ATOM 0 HG12 VAL A 67 6.801 -4.566 -14.875 1.00 0.00 H new ATOM 0 HG13 VAL A 67 5.200 -4.914 -14.179 1.00 0.00 H new ATOM 0 HG21 VAL A 67 5.391 -7.913 -14.519 1.00 0.00 H new ATOM 0 HG22 VAL A 67 3.942 -6.962 -14.926 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.667 -8.043 -16.139 1.00 0.00 H new ATOM 1088 N TYR A 68 6.104 -3.171 -16.968 1.00 0.00 N ATOM 1089 CA TYR A 68 7.120 -2.160 -17.253 1.00 0.00 C ATOM 1090 C TYR A 68 7.509 -1.357 -16.003 1.00 0.00 C ATOM 1091 O TYR A 68 6.691 -1.151 -15.106 1.00 0.00 O ATOM 1092 CB TYR A 68 6.567 -1.223 -18.323 1.00 0.00 C ATOM 1093 CG TYR A 68 7.613 -0.379 -19.014 1.00 0.00 C ATOM 1094 CD1 TYR A 68 8.461 -0.968 -19.968 1.00 0.00 C ATOM 1095 CD2 TYR A 68 7.742 0.989 -18.700 1.00 0.00 C ATOM 1096 CE1 TYR A 68 9.439 -0.189 -20.614 1.00 0.00 C ATOM 1097 CE2 TYR A 68 8.720 1.770 -19.337 1.00 0.00 C ATOM 1098 CZ TYR A 68 9.570 1.181 -20.298 1.00 0.00 C ATOM 1099 OH TYR A 68 10.524 1.919 -20.921 1.00 0.00 O ATOM 0 H TYR A 68 5.386 -2.850 -16.319 1.00 0.00 H new ATOM 0 HA TYR A 68 8.024 -2.660 -17.599 1.00 0.00 H new ATOM 0 HB2 TYR A 68 6.043 -1.816 -19.072 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.830 -0.564 -17.865 1.00 0.00 H new ATOM 0 HD1 TYR A 68 8.362 -2.017 -20.205 1.00 0.00 H new ATOM 0 HD2 TYR A 68 7.087 1.438 -17.968 1.00 0.00 H new ATOM 0 HE1 TYR A 68 10.089 -0.638 -21.351 1.00 0.00 H new ATOM 0 HE2 TYR A 68 8.821 2.817 -19.093 1.00 0.00 H new ATOM 0 HH TYR A 68 10.487 2.843 -20.597 1.00 0.00 H new ATOM 1109 N TYR A 69 8.743 -0.845 -15.991 1.00 0.00 N ATOM 1110 CA TYR A 69 9.352 -0.127 -14.871 1.00 0.00 C ATOM 1111 C TYR A 69 9.886 1.233 -15.332 1.00 0.00 C ATOM 1112 O TYR A 69 11.063 1.385 -15.660 1.00 0.00 O ATOM 1113 CB TYR A 69 10.437 -1.004 -14.225 1.00 0.00 C ATOM 1114 CG TYR A 69 9.870 -2.164 -13.433 1.00 0.00 C ATOM 1115 CD1 TYR A 69 9.390 -1.928 -12.132 1.00 0.00 C ATOM 1116 CD2 TYR A 69 9.784 -3.456 -13.993 1.00 0.00 C ATOM 1117 CE1 TYR A 69 8.823 -2.978 -11.394 1.00 0.00 C ATOM 1118 CE2 TYR A 69 9.208 -4.512 -13.260 1.00 0.00 C ATOM 1119 CZ TYR A 69 8.718 -4.269 -11.958 1.00 0.00 C ATOM 1120 OH TYR A 69 8.172 -5.275 -11.225 1.00 0.00 O ATOM 0 H TYR A 69 9.368 -0.923 -16.793 1.00 0.00 H new ATOM 0 HA TYR A 69 8.600 0.078 -14.109 1.00 0.00 H new ATOM 0 HB2 TYR A 69 11.095 -1.390 -15.004 1.00 0.00 H new ATOM 0 HB3 TYR A 69 11.050 -0.388 -13.567 1.00 0.00 H new ATOM 0 HD1 TYR A 69 9.458 -0.940 -11.702 1.00 0.00 H new ATOM 0 HD2 TYR A 69 10.162 -3.636 -14.989 1.00 0.00 H new ATOM 0 HE1 TYR A 69 8.465 -2.799 -10.391 1.00 0.00 H new ATOM 0 HE2 TYR A 69 9.142 -5.500 -13.691 1.00 0.00 H new ATOM 0 HH TYR A 69 7.943 -6.023 -11.815 1.00 0.00 H new ATOM 1130 N PHE A 70 9.013 2.244 -15.341 1.00 0.00 N ATOM 1131 CA PHE A 70 9.346 3.628 -15.696 1.00 0.00 C ATOM 1132 C PHE A 70 9.959 4.318 -14.458 1.00 0.00 C ATOM 1133 O PHE A 70 9.451 5.299 -13.919 1.00 0.00 O ATOM 1134 CB PHE A 70 8.073 4.287 -16.255 1.00 0.00 C ATOM 1135 CG PHE A 70 8.206 5.571 -17.062 1.00 0.00 C ATOM 1136 CD1 PHE A 70 9.267 6.485 -16.886 1.00 0.00 C ATOM 1137 CD2 PHE A 70 7.215 5.856 -18.019 1.00 0.00 C ATOM 1138 CE1 PHE A 70 9.333 7.657 -17.663 1.00 0.00 C ATOM 1139 CE2 PHE A 70 7.277 7.026 -18.792 1.00 0.00 C ATOM 1140 CZ PHE A 70 8.337 7.926 -18.617 1.00 0.00 C ATOM 0 H PHE A 70 8.031 2.121 -15.096 1.00 0.00 H new ATOM 0 HA PHE A 70 10.101 3.706 -16.478 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.570 3.552 -16.884 1.00 0.00 H new ATOM 0 HB3 PHE A 70 7.411 4.493 -15.414 1.00 0.00 H new ATOM 0 HD1 PHE A 70 10.032 6.284 -16.151 1.00 0.00 H new ATOM 0 HD2 PHE A 70 6.396 5.166 -18.161 1.00 0.00 H new ATOM 0 HE1 PHE A 70 10.150 8.350 -17.526 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.508 7.233 -19.522 1.00 0.00 H new ATOM 0 HZ PHE A 70 8.388 8.824 -19.214 1.00 0.00 H new ATOM 1224 N LEU A 77 5.421 9.787 -15.598 1.00 0.00 N ATOM 1225 CA LEU A 77 4.282 9.146 -16.256 1.00 0.00 C ATOM 1226 C LEU A 77 2.944 9.690 -15.748 1.00 0.00 C ATOM 1227 O LEU A 77 1.951 9.629 -16.468 1.00 0.00 O ATOM 1228 CB LEU A 77 4.376 7.630 -16.043 1.00 0.00 C ATOM 1229 CG LEU A 77 3.316 6.817 -16.813 1.00 0.00 C ATOM 1230 CD1 LEU A 77 3.435 6.971 -18.334 1.00 0.00 C ATOM 1231 CD2 LEU A 77 3.505 5.348 -16.473 1.00 0.00 C ATOM 0 HA LEU A 77 4.322 9.372 -17.322 1.00 0.00 H new ATOM 0 HB2 LEU A 77 5.367 7.293 -16.346 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.278 7.417 -14.978 1.00 0.00 H new ATOM 0 HG LEU A 77 2.336 7.191 -16.517 1.00 0.00 H new ATOM 0 HD11 LEU A 77 2.663 6.376 -18.821 1.00 0.00 H new ATOM 0 HD12 LEU A 77 3.310 8.019 -18.604 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.417 6.627 -18.659 1.00 0.00 H new ATOM 0 HD21 LEU A 77 2.765 4.753 -17.007 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.506 5.032 -16.768 1.00 0.00 H new ATOM 0 HD23 LEU A 77 3.380 5.204 -15.400 1.00 0.00 H new ATOM 1243 N GLY A 78 2.927 10.323 -14.565 1.00 0.00 N ATOM 1244 CA GLY A 78 1.818 11.157 -14.088 1.00 0.00 C ATOM 1245 C GLY A 78 1.323 12.153 -15.142 1.00 0.00 C ATOM 1246 O GLY A 78 0.138 12.482 -15.174 1.00 0.00 O ATOM 0 H GLY A 78 3.700 10.267 -13.902 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.991 10.514 -13.786 1.00 0.00 H new ATOM 0 HA3 GLY A 78 2.137 11.704 -13.201 1.00 0.00 H new ATOM 1250 N THR A 79 2.208 12.588 -16.044 1.00 0.00 N ATOM 1251 CA THR A 79 1.910 13.403 -17.229 1.00 0.00 C ATOM 1252 C THR A 79 0.900 12.744 -18.178 1.00 0.00 C ATOM 1253 O THR A 79 0.023 13.435 -18.684 1.00 0.00 O ATOM 1254 CB THR A 79 3.214 13.732 -17.979 1.00 0.00 C ATOM 1255 OG1 THR A 79 4.247 14.030 -17.058 1.00 0.00 O ATOM 1256 CG2 THR A 79 3.058 14.939 -18.903 1.00 0.00 C ATOM 0 H THR A 79 3.202 12.371 -15.965 1.00 0.00 H new ATOM 0 HA THR A 79 1.443 14.321 -16.873 1.00 0.00 H new ATOM 0 HB THR A 79 3.459 12.853 -18.575 1.00 0.00 H new ATOM 0 HG1 THR A 79 5.071 14.236 -17.546 1.00 0.00 H new ATOM 0 HG21 THR A 79 4.003 15.133 -19.411 1.00 0.00 H new ATOM 0 HG22 THR A 79 2.284 14.733 -19.643 1.00 0.00 H new ATOM 0 HG23 THR A 79 2.775 15.813 -18.316 1.00 0.00 H new ATOM 1264 N ALA A 80 0.977 11.423 -18.382 1.00 0.00 N ATOM 1265 CA ALA A 80 0.051 10.670 -19.231 1.00 0.00 C ATOM 1266 C ALA A 80 -1.305 10.375 -18.574 1.00 0.00 C ATOM 1267 O ALA A 80 -2.259 10.051 -19.280 1.00 0.00 O ATOM 1268 CB ALA A 80 0.717 9.349 -19.629 1.00 0.00 C ATOM 0 H ALA A 80 1.696 10.840 -17.954 1.00 0.00 H new ATOM 0 HA ALA A 80 -0.162 11.296 -20.097 1.00 0.00 H new ATOM 0 HB1 ALA A 80 0.039 8.776 -20.262 1.00 0.00 H new ATOM 0 HB2 ALA A 80 1.637 9.556 -20.176 1.00 0.00 H new ATOM 0 HB3 ALA A 80 0.949 8.774 -18.733 1.00 0.00 H new ATOM 1274 N VAL A 81 -1.394 10.462 -17.238 1.00 0.00 N ATOM 1275 CA VAL A 81 -2.561 10.008 -16.465 1.00 0.00 C ATOM 1276 C VAL A 81 -3.262 11.114 -15.666 1.00 0.00 C ATOM 1277 O VAL A 81 -4.402 10.900 -15.245 1.00 0.00 O ATOM 1278 CB VAL A 81 -2.209 8.789 -15.586 1.00 0.00 C ATOM 1279 CG1 VAL A 81 -1.868 7.564 -16.437 1.00 0.00 C ATOM 1280 CG2 VAL A 81 -1.035 9.029 -14.642 1.00 0.00 C ATOM 0 H VAL A 81 -0.651 10.853 -16.658 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.299 9.694 -17.204 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.106 8.617 -14.991 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -1.625 6.725 -15.785 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -2.724 7.304 -17.060 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.012 7.789 -17.073 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.848 8.128 -14.058 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -0.146 9.276 -15.222 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -1.271 9.854 -13.970 1.00 0.00 H new ATOM 1405 N VAL A 89 1.965 4.636 -11.059 1.00 0.00 N ATOM 1406 CA VAL A 89 1.607 3.220 -11.164 1.00 0.00 C ATOM 1407 C VAL A 89 0.255 3.094 -11.873 1.00 0.00 C ATOM 1408 O VAL A 89 -0.765 3.622 -11.418 1.00 0.00 O ATOM 1409 CB VAL A 89 1.701 2.515 -9.797 1.00 0.00 C ATOM 1410 CG1 VAL A 89 0.577 2.850 -8.814 1.00 0.00 C ATOM 1411 CG2 VAL A 89 1.748 0.997 -9.973 1.00 0.00 C ATOM 0 HA VAL A 89 2.328 2.686 -11.783 1.00 0.00 H new ATOM 0 HB VAL A 89 2.625 2.897 -9.362 1.00 0.00 H new ATOM 0 HG11 VAL A 89 0.733 2.305 -7.883 1.00 0.00 H new ATOM 0 HG12 VAL A 89 0.578 3.921 -8.612 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -0.382 2.563 -9.246 1.00 0.00 H new ATOM 0 HG21 VAL A 89 1.814 0.519 -8.996 1.00 0.00 H new ATOM 0 HG22 VAL A 89 0.844 0.661 -10.480 1.00 0.00 H new ATOM 0 HG23 VAL A 89 2.620 0.727 -10.569 1.00 0.00 H new ATOM 1421 N VAL A 90 0.284 2.453 -13.045 1.00 0.00 N ATOM 1422 CA VAL A 90 -0.794 2.439 -14.044 1.00 0.00 C ATOM 1423 C VAL A 90 -1.043 1.001 -14.488 1.00 0.00 C ATOM 1424 O VAL A 90 -0.154 0.144 -14.426 1.00 0.00 O ATOM 1425 CB VAL A 90 -0.425 3.304 -15.280 1.00 0.00 C ATOM 1426 CG1 VAL A 90 -1.643 3.584 -16.175 1.00 0.00 C ATOM 1427 CG2 VAL A 90 0.213 4.653 -14.919 1.00 0.00 C ATOM 0 H VAL A 90 1.093 1.906 -13.338 1.00 0.00 H new ATOM 0 HA VAL A 90 -1.693 2.858 -13.591 1.00 0.00 H new ATOM 0 HB VAL A 90 0.309 2.702 -15.816 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -1.337 4.192 -17.026 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -2.056 2.641 -16.533 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -2.401 4.118 -15.602 1.00 0.00 H new ATOM 0 HG21 VAL A 90 0.444 5.202 -15.832 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.482 5.233 -14.312 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.131 4.482 -14.356 1.00 0.00 H new ATOM 1437 N SER A 91 -2.242 0.693 -14.978 1.00 0.00 N ATOM 1438 CA SER A 91 -2.460 -0.538 -15.741 1.00 0.00 C ATOM 1439 C SER A 91 -3.537 -0.336 -16.805 1.00 0.00 C ATOM 1440 O SER A 91 -4.448 0.465 -16.614 1.00 0.00 O ATOM 1441 CB SER A 91 -2.791 -1.687 -14.787 1.00 0.00 C ATOM 1442 OG SER A 91 -1.832 -1.758 -13.740 1.00 0.00 O ATOM 0 H SER A 91 -3.073 1.273 -14.863 1.00 0.00 H new ATOM 0 HA SER A 91 -1.545 -0.800 -16.272 1.00 0.00 H new ATOM 0 HB2 SER A 91 -3.786 -1.543 -14.367 1.00 0.00 H new ATOM 0 HB3 SER A 91 -2.809 -2.629 -15.335 1.00 0.00 H new ATOM 0 HG SER A 91 -0.979 -1.391 -14.053 1.00 0.00 H new ATOM 1448 N ILE A 92 -3.417 -1.053 -17.927 1.00 0.00 N ATOM 1449 CA ILE A 92 -4.214 -0.889 -19.145 1.00 0.00 C ATOM 1450 C ILE A 92 -4.854 -2.237 -19.524 1.00 0.00 C ATOM 1451 O ILE A 92 -4.199 -3.289 -19.526 1.00 0.00 O ATOM 1452 CB ILE A 92 -3.361 -0.316 -20.305 1.00 0.00 C ATOM 1453 CG1 ILE A 92 -2.449 0.888 -19.947 1.00 0.00 C ATOM 1454 CG2 ILE A 92 -4.271 0.069 -21.485 1.00 0.00 C ATOM 1455 CD1 ILE A 92 -3.160 2.176 -19.534 1.00 0.00 C ATOM 0 H ILE A 92 -2.728 -1.800 -18.014 1.00 0.00 H new ATOM 0 HA ILE A 92 -5.008 -0.167 -18.954 1.00 0.00 H new ATOM 0 HB ILE A 92 -2.678 -1.124 -20.567 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -1.788 0.587 -19.135 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -1.817 1.107 -20.808 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -3.664 0.471 -22.296 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -4.806 -0.814 -21.835 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -4.988 0.823 -21.160 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -2.420 2.944 -19.308 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -3.799 2.516 -20.349 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -3.769 1.988 -18.650 1.00 0.00 H new ATOM 1467 N LEU A 93 -6.155 -2.175 -19.834 1.00 0.00 N ATOM 1468 CA LEU A 93 -7.060 -3.298 -20.059 1.00 0.00 C ATOM 1469 C LEU A 93 -7.335 -3.506 -21.554 1.00 0.00 C ATOM 1470 O LEU A 93 -7.074 -4.592 -22.076 1.00 0.00 O ATOM 1471 CB LEU A 93 -8.362 -3.089 -19.252 1.00 0.00 C ATOM 1472 CG LEU A 93 -8.182 -3.070 -17.714 1.00 0.00 C ATOM 1473 CD1 LEU A 93 -7.874 -1.676 -17.146 1.00 0.00 C ATOM 1474 CD2 LEU A 93 -9.458 -3.565 -17.026 1.00 0.00 C ATOM 0 H LEU A 93 -6.630 -1.278 -19.940 1.00 0.00 H new ATOM 0 HA LEU A 93 -6.583 -4.212 -19.705 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -8.816 -2.148 -19.561 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -9.064 -3.882 -19.511 1.00 0.00 H new ATOM 0 HG LEU A 93 -7.330 -3.721 -17.516 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -7.761 -1.741 -16.064 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -6.950 -1.300 -17.585 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -8.692 -0.997 -17.385 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -9.319 -3.547 -15.945 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -10.292 -2.917 -17.295 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -9.673 -4.584 -17.347 1.00 0.00 H new ATOM 1486 N GLU A 94 -7.822 -2.470 -22.242 1.00 0.00 N ATOM 1487 CA GLU A 94 -7.989 -2.418 -23.698 1.00 0.00 C ATOM 1488 C GLU A 94 -7.394 -1.102 -24.208 1.00 0.00 C ATOM 1489 O GLU A 94 -7.910 -0.030 -23.888 1.00 0.00 O ATOM 1490 CB GLU A 94 -9.465 -2.529 -24.120 1.00 0.00 C ATOM 1491 CG GLU A 94 -10.080 -3.929 -23.949 1.00 0.00 C ATOM 1492 CD GLU A 94 -11.033 -4.004 -22.754 1.00 0.00 C ATOM 1493 OE1 GLU A 94 -12.181 -3.525 -22.876 1.00 0.00 O ATOM 1494 OE2 GLU A 94 -10.630 -4.556 -21.706 1.00 0.00 O ATOM 0 H GLU A 94 -8.123 -1.610 -21.783 1.00 0.00 H new ATOM 0 HA GLU A 94 -7.471 -3.271 -24.136 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -10.050 -1.817 -23.538 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.553 -2.234 -25.166 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -10.618 -4.200 -24.857 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -9.282 -4.660 -23.821 1.00 0.00 H new ATOM 1501 N ALA A 95 -6.284 -1.179 -24.955 1.00 0.00 N ATOM 1502 CA ALA A 95 -5.541 0.002 -25.388 1.00 0.00 C ATOM 1503 C ALA A 95 -6.001 0.610 -26.722 1.00 0.00 C ATOM 1504 O ALA A 95 -5.840 1.811 -26.920 1.00 0.00 O ATOM 1505 CB ALA A 95 -4.054 -0.335 -25.497 1.00 0.00 C ATOM 0 H ALA A 95 -5.881 -2.060 -25.273 1.00 0.00 H new ATOM 0 HA ALA A 95 -5.737 0.754 -24.624 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -3.503 0.548 -25.820 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -3.682 -0.659 -24.525 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.915 -1.135 -26.224 1.00 0.00 H new ATOM 1511 N GLY A 96 -6.542 -0.214 -27.631 1.00 0.00 N ATOM 1512 CA GLY A 96 -5.934 -0.551 -28.932 1.00 0.00 C ATOM 1513 C GLY A 96 -5.491 0.554 -29.908 1.00 0.00 C ATOM 1514 O GLY A 96 -4.862 0.224 -30.910 1.00 0.00 O ATOM 0 H GLY A 96 -7.438 -0.678 -27.480 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -5.058 -1.165 -28.726 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -6.647 -1.181 -29.464 1.00 0.00 H new ATOM 1518 N ASP A 97 -5.758 1.827 -29.628 1.00 0.00 N ATOM 1519 CA ASP A 97 -5.215 2.988 -30.333 1.00 0.00 C ATOM 1520 C ASP A 97 -4.278 3.752 -29.376 1.00 0.00 C ATOM 1521 O ASP A 97 -4.715 4.678 -28.699 1.00 0.00 O ATOM 1522 CB ASP A 97 -6.361 3.863 -30.863 1.00 0.00 C ATOM 1523 CG ASP A 97 -5.836 5.139 -31.526 1.00 0.00 C ATOM 1524 OD1 ASP A 97 -4.828 5.044 -32.259 1.00 0.00 O ATOM 1525 OD2 ASP A 97 -6.433 6.208 -31.262 1.00 0.00 O ATOM 0 H ASP A 97 -6.387 2.091 -28.870 1.00 0.00 H new ATOM 0 HA ASP A 97 -4.632 2.677 -31.200 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -6.951 3.295 -31.582 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -7.028 4.127 -30.042 1.00 0.00 H new ATOM 1530 N SER A 98 -3.000 3.386 -29.225 1.00 0.00 N ATOM 1531 CA SER A 98 -2.214 2.397 -29.978 1.00 0.00 C ATOM 1532 C SER A 98 -1.960 1.082 -29.213 1.00 0.00 C ATOM 1533 O SER A 98 -2.350 0.882 -28.066 1.00 0.00 O ATOM 1534 CB SER A 98 -0.897 3.057 -30.435 1.00 0.00 C ATOM 1535 OG SER A 98 -0.352 2.425 -31.586 1.00 0.00 O ATOM 0 H SER A 98 -2.431 3.819 -28.498 1.00 0.00 H new ATOM 0 HA SER A 98 -2.803 2.095 -30.844 1.00 0.00 H new ATOM 0 HB2 SER A 98 -1.076 4.110 -30.651 1.00 0.00 H new ATOM 0 HB3 SER A 98 -0.171 3.017 -29.623 1.00 0.00 H new ATOM 0 HG SER A 98 0.509 2.017 -31.358 1.00 0.00 H new ATOM 1541 N ASP A 99 -1.219 0.203 -29.875 1.00 0.00 N ATOM 1542 CA ASP A 99 -0.701 -1.134 -29.574 1.00 0.00 C ATOM 1543 C ASP A 99 0.114 -1.319 -28.265 1.00 0.00 C ATOM 1544 O ASP A 99 0.909 -2.257 -28.191 1.00 0.00 O ATOM 1545 CB ASP A 99 0.177 -1.485 -30.797 1.00 0.00 C ATOM 1546 CG ASP A 99 1.395 -0.552 -30.893 1.00 0.00 C ATOM 1547 OD1 ASP A 99 1.200 0.662 -31.143 1.00 0.00 O ATOM 1548 OD2 ASP A 99 2.527 -0.999 -30.600 1.00 0.00 O ATOM 0 H ASP A 99 -0.910 0.462 -30.812 1.00 0.00 H new ATOM 0 HA ASP A 99 -1.555 -1.788 -29.396 1.00 0.00 H new ATOM 0 HB2 ASP A 99 0.513 -2.519 -30.722 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -0.416 -1.408 -31.708 1.00 0.00 H new ATOM 1553 N ILE A 100 -0.032 -0.474 -27.232 1.00 0.00 N ATOM 1554 CA ILE A 100 0.912 -0.415 -26.089 1.00 0.00 C ATOM 1555 C ILE A 100 0.996 -1.719 -25.260 1.00 0.00 C ATOM 1556 O ILE A 100 1.983 -1.958 -24.571 1.00 0.00 O ATOM 1557 CB ILE A 100 0.602 0.808 -25.190 1.00 0.00 C ATOM 1558 CG1 ILE A 100 1.871 1.306 -24.468 1.00 0.00 C ATOM 1559 CG2 ILE A 100 -0.460 0.476 -24.125 1.00 0.00 C ATOM 1560 CD1 ILE A 100 1.688 2.690 -23.844 1.00 0.00 C ATOM 0 H ILE A 100 -0.804 0.189 -27.159 1.00 0.00 H new ATOM 0 HA ILE A 100 1.903 -0.297 -26.527 1.00 0.00 H new ATOM 0 HB ILE A 100 0.222 1.587 -25.851 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.145 0.594 -23.689 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.699 1.338 -25.176 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -0.651 1.358 -23.514 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -1.383 0.168 -24.616 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -0.099 -0.333 -23.491 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.611 2.991 -23.349 1.00 0.00 H new ATOM 0 HD12 ILE A 100 1.442 3.411 -24.624 1.00 0.00 H new ATOM 0 HD13 ILE A 100 0.880 2.656 -23.114 1.00 0.00 H new ATOM 1572 N LEU A 101 -0.041 -2.562 -25.341 1.00 0.00 N ATOM 1573 CA LEU A 101 -0.108 -3.933 -24.821 1.00 0.00 C ATOM 1574 C LEU A 101 0.362 -5.038 -25.780 1.00 0.00 C ATOM 1575 O LEU A 101 0.687 -6.131 -25.315 1.00 0.00 O ATOM 1576 CB LEU A 101 -1.428 -4.250 -24.086 1.00 0.00 C ATOM 1577 CG LEU A 101 -2.706 -3.470 -24.466 1.00 0.00 C ATOM 1578 CD1 LEU A 101 -3.853 -4.258 -25.085 1.00 0.00 C ATOM 1579 CD2 LEU A 101 -3.194 -2.837 -23.163 1.00 0.00 C ATOM 0 H LEU A 101 -0.910 -2.288 -25.800 1.00 0.00 H new ATOM 0 HA LEU A 101 0.664 -3.948 -24.051 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -1.636 -5.311 -24.227 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -1.255 -4.098 -23.021 1.00 0.00 H new ATOM 0 HG LEU A 101 -2.426 -2.775 -25.257 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.683 -3.585 -25.300 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -3.516 -4.726 -26.010 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -4.183 -5.029 -24.388 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.102 -2.265 -23.354 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.405 -3.620 -22.435 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -2.423 -2.174 -22.770 1.00 0.00 H new