USER MOD reduce.3.24.130724 H: found=0, std=0, add=1035, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1038 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 94 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 95 LYS NZ :NH3+ 152:sc= 0.0372 (180deg=0) USER MOD Set 2.1: A 17 THR OG1 : rot -85:sc= 0.113 USER MOD Set 2.2: A 136 THR OG1 : rot 180:sc= 0.113 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 36:sc= 0.17 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN :FLIP amide:sc= 0.416 F(o=-2.4!,f=0.42) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 43:sc= 0.0406 USER MOD Single : A 38 SER OG : rot 138:sc= 1.25 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 CYS SG : rot -24:sc= -1.28 USER MOD Single : A 52 ASN : amide:sc= -2.62 X(o=-2.6,f=-2.6!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 170:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= -0.142 USER MOD Single : A 67 TYR OH : rot 180:sc= -0.128 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 CYS SG : rot 106:sc= -0.0562 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ -119:sc= -0.431 (180deg=-1.6) USER MOD Single : A 83 LYS NZ :NH3+ -157:sc= -0.0615 (180deg=-0.383) USER MOD Single : A 85 SER OG : rot -130:sc= -5.89! USER MOD Single : A 88 ASN : amide:sc= -2.1! C(o=-2.1!,f=-17!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl -164:sc= -2.54 (180deg=-3.61) USER MOD Single : A 99 SER OG : rot 173:sc= 0.837 USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= -0.127 K(o=-0.13,f=-2.2!) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ -161:sc= 0.766 (180deg=0.521) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 ASN : amide:sc= -4.53! C(o=-4.5!,f=-6.2!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 CYS SG : rot 85:sc= -0.68 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 88 N VAL A 9 1.340 14.804 13.957 1.00 0.00 N ATOM 89 CA VAL A 9 1.470 13.955 12.779 1.00 0.00 C ATOM 90 C VAL A 9 0.107 13.663 12.160 1.00 0.00 C ATOM 91 O VAL A 9 -0.851 13.345 12.863 1.00 0.00 O ATOM 92 CB VAL A 9 2.162 12.622 13.122 1.00 0.00 C ATOM 93 CG1 VAL A 9 1.404 11.894 14.222 1.00 0.00 C ATOM 94 CG2 VAL A 9 2.284 11.751 11.881 1.00 0.00 C ATOM 0 HA VAL A 9 2.083 14.500 12.061 1.00 0.00 H new ATOM 0 HB VAL A 9 3.166 12.837 13.487 1.00 0.00 H new ATOM 0 HG11 VAL A 9 1.908 10.955 14.451 1.00 0.00 H new ATOM 0 HG12 VAL A 9 1.374 12.517 15.116 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.387 11.688 13.888 1.00 0.00 H new ATOM 0 HG21 VAL A 9 2.775 10.813 12.141 1.00 0.00 H new ATOM 0 HG22 VAL A 9 1.291 11.542 11.484 1.00 0.00 H new ATOM 0 HG23 VAL A 9 2.874 12.272 11.127 1.00 0.00 H new ATOM 104 N VAL A 10 0.029 13.772 10.837 1.00 0.00 N ATOM 105 CA VAL A 10 -1.216 13.518 10.122 1.00 0.00 C ATOM 106 C VAL A 10 -1.215 12.129 9.495 1.00 0.00 C ATOM 107 O VAL A 10 -0.578 11.899 8.467 1.00 0.00 O ATOM 108 CB VAL A 10 -1.453 14.567 9.019 1.00 0.00 C ATOM 109 CG1 VAL A 10 -2.743 14.272 8.270 1.00 0.00 C ATOM 110 CG2 VAL A 10 -1.479 15.967 9.612 1.00 0.00 C ATOM 0 H VAL A 10 0.813 14.034 10.239 1.00 0.00 H new ATOM 0 HA VAL A 10 -2.021 13.583 10.854 1.00 0.00 H new ATOM 0 HB VAL A 10 -0.628 14.514 8.308 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -2.894 15.023 7.495 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -2.680 13.285 7.811 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.581 14.296 8.966 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -1.647 16.695 8.819 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -2.283 16.037 10.345 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -0.526 16.174 10.098 1.00 0.00 H new ATOM 120 N LYS A 11 -1.936 11.204 10.120 1.00 0.00 N ATOM 121 CA LYS A 11 -2.021 9.835 9.624 1.00 0.00 C ATOM 122 C LYS A 11 -3.449 9.497 9.206 1.00 0.00 C ATOM 123 O LYS A 11 -4.398 10.180 9.591 1.00 0.00 O ATOM 124 CB LYS A 11 -1.545 8.852 10.695 1.00 0.00 C ATOM 125 CG LYS A 11 -2.505 8.715 11.865 1.00 0.00 C ATOM 126 CD LYS A 11 -2.188 9.714 12.965 1.00 0.00 C ATOM 127 CE LYS A 11 -1.170 9.157 13.948 1.00 0.00 C ATOM 128 NZ LYS A 11 -1.798 8.235 14.935 1.00 0.00 N ATOM 0 H LYS A 11 -2.470 11.378 10.971 1.00 0.00 H new ATOM 0 HA LYS A 11 -1.375 9.750 8.750 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -1.400 7.873 10.239 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -0.574 9.177 11.069 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -3.527 8.866 11.518 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -2.451 7.702 12.265 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -1.803 10.633 12.523 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -3.103 9.974 13.496 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.390 8.627 13.401 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.687 9.979 14.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -1.071 7.877 15.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -2.525 8.747 15.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -2.237 7.436 14.434 1.00 0.00 H new ATOM 142 N PHE A 12 -3.594 8.437 8.417 1.00 0.00 N ATOM 143 CA PHE A 12 -4.906 8.007 7.948 1.00 0.00 C ATOM 144 C PHE A 12 -4.904 6.518 7.616 1.00 0.00 C ATOM 145 O PHE A 12 -3.913 5.983 7.118 1.00 0.00 O ATOM 146 CB PHE A 12 -5.320 8.815 6.716 1.00 0.00 C ATOM 147 CG PHE A 12 -4.230 8.946 5.691 1.00 0.00 C ATOM 148 CD1 PHE A 12 -3.283 9.953 5.791 1.00 0.00 C ATOM 149 CD2 PHE A 12 -4.152 8.063 4.626 1.00 0.00 C ATOM 150 CE1 PHE A 12 -2.278 10.076 4.850 1.00 0.00 C ATOM 151 CE2 PHE A 12 -3.149 8.181 3.682 1.00 0.00 C ATOM 152 CZ PHE A 12 -2.212 9.189 3.794 1.00 0.00 C ATOM 0 H PHE A 12 -2.819 7.860 8.089 1.00 0.00 H new ATOM 0 HA PHE A 12 -5.626 8.182 8.748 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -6.186 8.341 6.255 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.632 9.810 7.032 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -3.331 10.650 6.614 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -4.883 7.274 4.532 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -1.546 10.865 4.941 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -3.098 7.485 2.858 1.00 0.00 H new ATOM 0 HZ PHE A 12 -1.429 9.283 3.057 1.00 0.00 H new ATOM 162 N SER A 13 -6.021 5.854 7.896 1.00 0.00 N ATOM 163 CA SER A 13 -6.148 4.426 7.632 1.00 0.00 C ATOM 164 C SER A 13 -7.117 4.170 6.482 1.00 0.00 C ATOM 165 O SER A 13 -8.260 4.628 6.504 1.00 0.00 O ATOM 166 CB SER A 13 -6.625 3.694 8.888 1.00 0.00 C ATOM 167 OG SER A 13 -7.878 4.192 9.323 1.00 0.00 O ATOM 0 H SER A 13 -6.851 6.282 8.306 1.00 0.00 H new ATOM 0 HA SER A 13 -5.167 4.046 7.349 1.00 0.00 H new ATOM 0 HB2 SER A 13 -6.706 2.627 8.682 1.00 0.00 H new ATOM 0 HB3 SER A 13 -5.888 3.810 9.683 1.00 0.00 H new ATOM 0 HG SER A 13 -8.422 4.433 8.545 1.00 0.00 H new ATOM 173 N TYR A 14 -6.652 3.435 5.477 1.00 0.00 N ATOM 174 CA TYR A 14 -7.475 3.120 4.316 1.00 0.00 C ATOM 175 C TYR A 14 -7.745 1.620 4.231 1.00 0.00 C ATOM 176 O TYR A 14 -6.841 0.830 3.963 1.00 0.00 O ATOM 177 CB TYR A 14 -6.792 3.599 3.035 1.00 0.00 C ATOM 178 CG TYR A 14 -7.488 3.147 1.771 1.00 0.00 C ATOM 179 CD1 TYR A 14 -8.785 3.556 1.485 1.00 0.00 C ATOM 180 CD2 TYR A 14 -6.850 2.311 0.864 1.00 0.00 C ATOM 181 CE1 TYR A 14 -9.426 3.145 0.333 1.00 0.00 C ATOM 182 CE2 TYR A 14 -7.483 1.896 -0.292 1.00 0.00 C ATOM 183 CZ TYR A 14 -8.771 2.315 -0.553 1.00 0.00 C ATOM 184 OH TYR A 14 -9.405 1.903 -1.703 1.00 0.00 O ATOM 0 H TYR A 14 -5.709 3.047 5.444 1.00 0.00 H new ATOM 0 HA TYR A 14 -8.428 3.637 4.427 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -6.745 4.688 3.044 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -5.764 3.236 3.024 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -9.301 4.207 2.176 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -5.842 1.980 1.066 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -10.435 3.472 0.127 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -6.972 1.247 -0.988 1.00 0.00 H new ATOM 0 HH TYR A 14 -8.805 1.324 -2.218 1.00 0.00 H new ATOM 194 N MET A 15 -8.997 1.238 4.461 1.00 0.00 N ATOM 195 CA MET A 15 -9.388 -0.166 4.409 1.00 0.00 C ATOM 196 C MET A 15 -9.725 -0.584 2.981 1.00 0.00 C ATOM 197 O MET A 15 -10.658 -0.057 2.374 1.00 0.00 O ATOM 198 CB MET A 15 -10.589 -0.418 5.323 1.00 0.00 C ATOM 199 CG MET A 15 -10.733 -1.869 5.751 1.00 0.00 C ATOM 200 SD MET A 15 -12.333 -2.214 6.508 1.00 0.00 S ATOM 201 CE MET A 15 -12.102 -1.493 8.131 1.00 0.00 C ATOM 0 H MET A 15 -9.757 1.880 4.685 1.00 0.00 H new ATOM 0 HA MET A 15 -8.545 -0.765 4.755 1.00 0.00 H new ATOM 0 HB2 MET A 15 -10.496 0.207 6.211 1.00 0.00 H new ATOM 0 HB3 MET A 15 -11.498 -0.108 4.808 1.00 0.00 H new ATOM 0 HG2 MET A 15 -10.599 -2.515 4.883 1.00 0.00 H new ATOM 0 HG3 MET A 15 -9.940 -2.116 6.457 1.00 0.00 H new ATOM 0 HE1 MET A 15 -13.009 -1.626 8.721 1.00 0.00 H new ATOM 0 HE2 MET A 15 -11.268 -1.984 8.632 1.00 0.00 H new ATOM 0 HE3 MET A 15 -11.888 -0.429 8.029 1.00 0.00 H new ATOM 211 N TRP A 16 -8.961 -1.532 2.451 1.00 0.00 N ATOM 212 CA TRP A 16 -9.179 -2.020 1.094 1.00 0.00 C ATOM 213 C TRP A 16 -9.665 -3.465 1.106 1.00 0.00 C ATOM 214 O TRP A 16 -8.876 -4.395 1.280 1.00 0.00 O ATOM 215 CB TRP A 16 -7.891 -1.909 0.277 1.00 0.00 C ATOM 216 CG TRP A 16 -7.993 -2.534 -1.082 1.00 0.00 C ATOM 217 CD1 TRP A 16 -9.130 -2.973 -1.698 1.00 0.00 C ATOM 218 CD2 TRP A 16 -6.917 -2.791 -1.990 1.00 0.00 C ATOM 219 NE1 TRP A 16 -8.825 -3.488 -2.935 1.00 0.00 N ATOM 220 CE2 TRP A 16 -7.474 -3.387 -3.138 1.00 0.00 C ATOM 221 CE3 TRP A 16 -5.537 -2.573 -1.946 1.00 0.00 C ATOM 222 CZ2 TRP A 16 -6.698 -3.768 -4.230 1.00 0.00 C ATOM 223 CZ3 TRP A 16 -4.768 -2.953 -3.030 1.00 0.00 C ATOM 224 CH2 TRP A 16 -5.350 -3.543 -4.160 1.00 0.00 C ATOM 0 H TRP A 16 -8.185 -1.978 2.940 1.00 0.00 H new ATOM 0 HA TRP A 16 -9.949 -1.402 0.632 1.00 0.00 H new ATOM 0 HB2 TRP A 16 -7.629 -0.857 0.166 1.00 0.00 H new ATOM 0 HB3 TRP A 16 -7.078 -2.383 0.827 1.00 0.00 H new ATOM 0 HD1 TRP A 16 -10.123 -2.923 -1.275 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -9.496 -3.882 -3.595 1.00 0.00 H new ATOM 0 HE3 TRP A 16 -5.080 -2.116 -1.081 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -7.144 -4.225 -5.101 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 -3.700 -2.792 -3.006 1.00 0.00 H new ATOM 0 HH2 TRP A 16 -4.722 -3.826 -4.992 1.00 0.00 H new ATOM 235 N THR A 17 -10.968 -3.649 0.921 1.00 0.00 N ATOM 236 CA THR A 17 -11.559 -4.981 0.911 1.00 0.00 C ATOM 237 C THR A 17 -11.757 -5.484 -0.514 1.00 0.00 C ATOM 238 O THR A 17 -12.578 -4.952 -1.261 1.00 0.00 O ATOM 239 CB THR A 17 -12.914 -5.000 1.644 1.00 0.00 C ATOM 240 OG1 THR A 17 -12.738 -4.606 3.009 1.00 0.00 O ATOM 241 CG2 THR A 17 -13.541 -6.385 1.587 1.00 0.00 C ATOM 0 H THR A 17 -11.635 -2.891 0.776 1.00 0.00 H new ATOM 0 HA THR A 17 -10.864 -5.639 1.432 1.00 0.00 H new ATOM 0 HB THR A 17 -13.581 -4.296 1.146 1.00 0.00 H new ATOM 0 HG1 THR A 17 -12.486 -5.387 3.545 1.00 0.00 H new ATOM 0 HG21 THR A 17 -14.497 -6.374 2.111 1.00 0.00 H new ATOM 0 HG22 THR A 17 -13.701 -6.669 0.547 1.00 0.00 H new ATOM 0 HG23 THR A 17 -12.875 -7.106 2.062 1.00 0.00 H new ATOM 249 N ILE A 18 -11.002 -6.513 -0.883 1.00 0.00 N ATOM 250 CA ILE A 18 -11.097 -7.089 -2.219 1.00 0.00 C ATOM 251 C ILE A 18 -12.025 -8.299 -2.231 1.00 0.00 C ATOM 252 O ILE A 18 -11.630 -9.401 -1.851 1.00 0.00 O ATOM 253 CB ILE A 18 -9.714 -7.512 -2.749 1.00 0.00 C ATOM 254 CG1 ILE A 18 -8.771 -6.308 -2.793 1.00 0.00 C ATOM 255 CG2 ILE A 18 -9.846 -8.139 -4.129 1.00 0.00 C ATOM 256 CD1 ILE A 18 -7.309 -6.682 -2.699 1.00 0.00 C ATOM 0 H ILE A 18 -10.318 -6.965 -0.276 1.00 0.00 H new ATOM 0 HA ILE A 18 -11.505 -6.314 -2.868 1.00 0.00 H new ATOM 0 HB ILE A 18 -9.293 -8.255 -2.072 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -8.938 -5.759 -3.720 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -9.018 -5.633 -1.974 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -8.861 -8.433 -4.491 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -10.488 -9.018 -4.069 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -10.284 -7.416 -4.817 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -6.699 -5.779 -2.736 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -7.127 -7.204 -1.760 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -7.046 -7.333 -3.533 1.00 0.00 H new ATOM 268 N ASN A 19 -13.261 -8.086 -2.671 1.00 0.00 N ATOM 269 CA ASN A 19 -14.246 -9.160 -2.734 1.00 0.00 C ATOM 270 C ASN A 19 -13.785 -10.266 -3.679 1.00 0.00 C ATOM 271 O ASN A 19 -13.248 -9.995 -4.752 1.00 0.00 O ATOM 272 CB ASN A 19 -15.599 -8.613 -3.193 1.00 0.00 C ATOM 273 CG ASN A 19 -15.457 -7.410 -4.105 1.00 0.00 C ATOM 274 OD1 ASN A 19 -15.169 -6.254 -3.518 1.00 0.00 O flip ATOM 275 ND2 ASN A 19 -15.604 -7.519 -5.322 1.00 0.00 N flip ATOM 0 H ASN A 19 -13.604 -7.180 -2.989 1.00 0.00 H new ATOM 0 HA ASN A 19 -14.352 -9.581 -1.734 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -16.147 -9.398 -3.714 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -16.191 -8.336 -2.321 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -15.825 -8.428 -5.730 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -15.505 -6.701 -5.923 1.00 0.00 H new ATOM 282 N ASN A 20 -13.999 -11.513 -3.271 1.00 0.00 N ATOM 283 CA ASN A 20 -13.606 -12.660 -4.081 1.00 0.00 C ATOM 284 C ASN A 20 -12.115 -12.615 -4.401 1.00 0.00 C ATOM 285 O ASN A 20 -11.715 -12.726 -5.560 1.00 0.00 O ATOM 286 CB ASN A 20 -14.417 -12.697 -5.378 1.00 0.00 C ATOM 287 CG ASN A 20 -15.890 -12.959 -5.132 1.00 0.00 C ATOM 288 OD1 ASN A 20 -16.264 -13.996 -4.584 1.00 0.00 O ATOM 289 ND2 ASN A 20 -16.735 -12.018 -5.537 1.00 0.00 N ATOM 0 H ASN A 20 -14.442 -11.755 -2.385 1.00 0.00 H new ATOM 0 HA ASN A 20 -13.809 -13.565 -3.508 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -14.302 -11.748 -5.902 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -14.017 -13.472 -6.031 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -17.738 -12.139 -5.398 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -16.381 -11.174 -5.987 1.00 0.00 H new ATOM 296 N PHE A 21 -11.298 -12.451 -3.366 1.00 0.00 N ATOM 297 CA PHE A 21 -9.851 -12.391 -3.536 1.00 0.00 C ATOM 298 C PHE A 21 -9.339 -13.621 -4.279 1.00 0.00 C ATOM 299 O PHE A 21 -8.202 -13.647 -4.750 1.00 0.00 O ATOM 300 CB PHE A 21 -9.160 -12.279 -2.175 1.00 0.00 C ATOM 301 CG PHE A 21 -7.662 -12.233 -2.266 1.00 0.00 C ATOM 302 CD1 PHE A 21 -7.016 -11.084 -2.695 1.00 0.00 C ATOM 303 CD2 PHE A 21 -6.899 -13.337 -1.922 1.00 0.00 C ATOM 304 CE1 PHE A 21 -5.637 -11.039 -2.780 1.00 0.00 C ATOM 305 CE2 PHE A 21 -5.520 -13.298 -2.004 1.00 0.00 C ATOM 306 CZ PHE A 21 -4.888 -12.147 -2.433 1.00 0.00 C ATOM 0 H PHE A 21 -11.613 -12.357 -2.401 1.00 0.00 H new ATOM 0 HA PHE A 21 -9.617 -11.507 -4.129 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -9.513 -11.380 -1.670 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -9.453 -13.128 -1.557 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -7.596 -10.214 -2.966 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.388 -14.239 -1.586 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -5.145 -10.138 -3.117 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -4.937 -14.166 -1.733 1.00 0.00 H new ATOM 0 HZ PHE A 21 -3.810 -12.113 -2.497 1.00 0.00 H new ATOM 316 N SER A 22 -10.188 -14.640 -4.381 1.00 0.00 N ATOM 317 CA SER A 22 -9.821 -15.875 -5.063 1.00 0.00 C ATOM 318 C SER A 22 -9.674 -15.645 -6.564 1.00 0.00 C ATOM 319 O SER A 22 -9.013 -16.415 -7.260 1.00 0.00 O ATOM 320 CB SER A 22 -10.870 -16.958 -4.801 1.00 0.00 C ATOM 321 OG SER A 22 -10.689 -18.064 -5.669 1.00 0.00 O ATOM 0 H SER A 22 -11.134 -14.634 -4.000 1.00 0.00 H new ATOM 0 HA SER A 22 -8.860 -16.207 -4.669 1.00 0.00 H new ATOM 0 HB2 SER A 22 -10.803 -17.290 -3.765 1.00 0.00 H new ATOM 0 HB3 SER A 22 -11.868 -16.543 -4.939 1.00 0.00 H new ATOM 0 HG SER A 22 -11.370 -18.743 -5.481 1.00 0.00 H new ATOM 436 N GLU A 30 2.118 -8.105 -13.094 1.00 0.00 N ATOM 437 CA GLU A 30 0.904 -7.317 -12.912 1.00 0.00 C ATOM 438 C GLU A 30 0.706 -6.955 -11.443 1.00 0.00 C ATOM 439 O GLU A 30 1.262 -7.599 -10.553 1.00 0.00 O ATOM 440 CB GLU A 30 -0.313 -8.087 -13.428 1.00 0.00 C ATOM 441 CG GLU A 30 -0.507 -7.982 -14.931 1.00 0.00 C ATOM 442 CD GLU A 30 -1.360 -6.793 -15.328 1.00 0.00 C ATOM 443 OE1 GLU A 30 -2.560 -6.782 -14.981 1.00 0.00 O ATOM 444 OE2 GLU A 30 -0.829 -5.874 -15.985 1.00 0.00 O ATOM 0 HA GLU A 30 1.010 -6.395 -13.484 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -0.210 -9.137 -13.156 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -1.207 -7.714 -12.928 1.00 0.00 H new ATOM 0 HG2 GLU A 30 0.467 -7.903 -15.415 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -0.972 -8.897 -15.298 1.00 0.00 H new ATOM 451 N VAL A 31 -0.091 -5.920 -11.197 1.00 0.00 N ATOM 452 CA VAL A 31 -0.364 -5.472 -9.837 1.00 0.00 C ATOM 453 C VAL A 31 -1.686 -4.716 -9.762 1.00 0.00 C ATOM 454 O VAL A 31 -2.029 -3.955 -10.667 1.00 0.00 O ATOM 455 CB VAL A 31 0.764 -4.566 -9.307 1.00 0.00 C ATOM 456 CG1 VAL A 31 0.843 -3.282 -10.119 1.00 0.00 C ATOM 457 CG2 VAL A 31 0.553 -4.261 -7.832 1.00 0.00 C ATOM 0 H VAL A 31 -0.559 -5.376 -11.922 1.00 0.00 H new ATOM 0 HA VAL A 31 -0.424 -6.366 -9.216 1.00 0.00 H new ATOM 0 HB VAL A 31 1.711 -5.094 -9.414 1.00 0.00 H new ATOM 0 HG11 VAL A 31 1.645 -2.655 -9.730 1.00 0.00 H new ATOM 0 HG12 VAL A 31 1.044 -3.523 -11.163 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -0.104 -2.747 -10.046 1.00 0.00 H new ATOM 0 HG21 VAL A 31 1.359 -3.620 -7.474 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -0.402 -3.752 -7.699 1.00 0.00 H new ATOM 0 HG23 VAL A 31 0.551 -5.192 -7.265 1.00 0.00 H new ATOM 467 N ILE A 32 -2.423 -4.931 -8.678 1.00 0.00 N ATOM 468 CA ILE A 32 -3.707 -4.268 -8.485 1.00 0.00 C ATOM 469 C ILE A 32 -3.534 -2.930 -7.775 1.00 0.00 C ATOM 470 O ILE A 32 -3.299 -2.881 -6.567 1.00 0.00 O ATOM 471 CB ILE A 32 -4.677 -5.146 -7.671 1.00 0.00 C ATOM 472 CG1 ILE A 32 -4.918 -6.476 -8.388 1.00 0.00 C ATOM 473 CG2 ILE A 32 -5.991 -4.414 -7.445 1.00 0.00 C ATOM 474 CD1 ILE A 32 -5.418 -7.573 -7.474 1.00 0.00 C ATOM 0 H ILE A 32 -2.154 -5.559 -7.920 1.00 0.00 H new ATOM 0 HA ILE A 32 -4.127 -4.099 -9.477 1.00 0.00 H new ATOM 0 HB ILE A 32 -4.228 -5.354 -6.700 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.642 -6.322 -9.188 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -3.989 -6.800 -8.857 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -6.666 -5.047 -6.869 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -5.803 -3.490 -6.897 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -6.447 -4.179 -8.407 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -5.567 -8.487 -8.050 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -4.684 -7.755 -6.688 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -6.363 -7.269 -7.024 1.00 0.00 H new ATOM 486 N LYS A 33 -3.653 -1.845 -8.532 1.00 0.00 N ATOM 487 CA LYS A 33 -3.512 -0.504 -7.977 1.00 0.00 C ATOM 488 C LYS A 33 -4.862 0.039 -7.520 1.00 0.00 C ATOM 489 O LYS A 33 -5.739 0.317 -8.338 1.00 0.00 O ATOM 490 CB LYS A 33 -2.896 0.438 -9.013 1.00 0.00 C ATOM 491 CG LYS A 33 -1.379 0.489 -8.962 1.00 0.00 C ATOM 492 CD LYS A 33 -0.846 1.805 -9.503 1.00 0.00 C ATOM 493 CE LYS A 33 -0.951 1.869 -11.019 1.00 0.00 C ATOM 494 NZ LYS A 33 -0.237 3.051 -11.575 1.00 0.00 N ATOM 0 H LYS A 33 -3.847 -1.868 -9.533 1.00 0.00 H new ATOM 0 HA LYS A 33 -2.851 -0.563 -7.112 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.207 0.123 -10.009 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.290 1.442 -8.859 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -1.044 0.355 -7.933 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -0.967 -0.337 -9.541 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.403 2.632 -9.064 1.00 0.00 H new ATOM 0 HD3 LYS A 33 0.195 1.927 -9.204 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.536 0.958 -11.450 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -2.001 1.910 -11.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -0.332 3.059 -12.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -0.649 3.922 -11.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 0.770 3.000 -11.320 1.00 0.00 H new ATOM 508 N SER A 34 -5.022 0.190 -6.209 1.00 0.00 N ATOM 509 CA SER A 34 -6.266 0.698 -5.644 1.00 0.00 C ATOM 510 C SER A 34 -6.398 2.200 -5.882 1.00 0.00 C ATOM 511 O SER A 34 -5.457 2.852 -6.334 1.00 0.00 O ATOM 512 CB SER A 34 -6.329 0.401 -4.144 1.00 0.00 C ATOM 513 OG SER A 34 -5.553 1.330 -3.407 1.00 0.00 O ATOM 0 H SER A 34 -4.305 -0.032 -5.518 1.00 0.00 H new ATOM 0 HA SER A 34 -7.094 0.194 -6.142 1.00 0.00 H new ATOM 0 HB2 SER A 34 -7.365 0.438 -3.806 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.968 -0.610 -3.955 1.00 0.00 H new ATOM 0 HG SER A 34 -5.611 1.120 -2.452 1.00 0.00 H new ATOM 519 N SER A 35 -7.572 2.741 -5.574 1.00 0.00 N ATOM 520 CA SER A 35 -7.829 4.164 -5.758 1.00 0.00 C ATOM 521 C SER A 35 -6.848 5.003 -4.945 1.00 0.00 C ATOM 522 O SER A 35 -5.944 4.471 -4.299 1.00 0.00 O ATOM 523 CB SER A 35 -9.265 4.501 -5.350 1.00 0.00 C ATOM 524 OG SER A 35 -10.191 4.043 -6.319 1.00 0.00 O ATOM 0 H SER A 35 -8.360 2.215 -5.196 1.00 0.00 H new ATOM 0 HA SER A 35 -7.693 4.399 -6.814 1.00 0.00 H new ATOM 0 HB2 SER A 35 -9.489 4.046 -4.385 1.00 0.00 H new ATOM 0 HB3 SER A 35 -9.368 5.579 -5.225 1.00 0.00 H new ATOM 0 HG SER A 35 -11.101 4.269 -6.034 1.00 0.00 H new ATOM 530 N THR A 36 -7.032 6.319 -4.982 1.00 0.00 N ATOM 531 CA THR A 36 -6.163 7.233 -4.251 1.00 0.00 C ATOM 532 C THR A 36 -6.802 7.666 -2.937 1.00 0.00 C ATOM 533 O THR A 36 -7.942 8.130 -2.912 1.00 0.00 O ATOM 534 CB THR A 36 -5.835 8.485 -5.086 1.00 0.00 C ATOM 535 OG1 THR A 36 -7.036 9.031 -5.643 1.00 0.00 O ATOM 536 CG2 THR A 36 -4.859 8.150 -6.204 1.00 0.00 C ATOM 0 H THR A 36 -7.775 6.776 -5.511 1.00 0.00 H new ATOM 0 HA THR A 36 -5.240 6.692 -4.042 1.00 0.00 H new ATOM 0 HB THR A 36 -5.372 9.221 -4.429 1.00 0.00 H new ATOM 0 HG1 THR A 36 -7.744 9.022 -4.966 1.00 0.00 H new ATOM 0 HG21 THR A 36 -4.643 9.050 -6.780 1.00 0.00 H new ATOM 0 HG22 THR A 36 -3.935 7.762 -5.776 1.00 0.00 H new ATOM 0 HG23 THR A 36 -5.300 7.398 -6.858 1.00 0.00 H new ATOM 544 N PHE A 37 -6.060 7.513 -1.845 1.00 0.00 N ATOM 545 CA PHE A 37 -6.555 7.888 -0.525 1.00 0.00 C ATOM 546 C PHE A 37 -5.532 8.744 0.216 1.00 0.00 C ATOM 547 O PHE A 37 -4.328 8.505 0.129 1.00 0.00 O ATOM 548 CB PHE A 37 -6.882 6.639 0.295 1.00 0.00 C ATOM 549 CG PHE A 37 -5.682 5.785 0.591 1.00 0.00 C ATOM 550 CD1 PHE A 37 -5.154 4.949 -0.379 1.00 0.00 C ATOM 551 CD2 PHE A 37 -5.083 5.819 1.840 1.00 0.00 C ATOM 552 CE1 PHE A 37 -4.050 4.162 -0.110 1.00 0.00 C ATOM 553 CE2 PHE A 37 -3.978 5.036 2.115 1.00 0.00 C ATOM 554 CZ PHE A 37 -3.462 4.205 1.139 1.00 0.00 C ATOM 0 H PHE A 37 -5.114 7.132 -1.848 1.00 0.00 H new ATOM 0 HA PHE A 37 -7.464 8.474 -0.659 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -7.343 6.942 1.235 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -7.618 6.043 -0.244 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -5.610 4.912 -1.357 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -5.484 6.465 2.607 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -3.648 3.515 -0.875 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -3.518 5.074 3.092 1.00 0.00 H new ATOM 0 HZ PHE A 37 -2.600 3.590 1.353 1.00 0.00 H new ATOM 564 N SER A 38 -6.021 9.742 0.945 1.00 0.00 N ATOM 565 CA SER A 38 -5.150 10.636 1.699 1.00 0.00 C ATOM 566 C SER A 38 -5.757 10.966 3.060 1.00 0.00 C ATOM 567 O SER A 38 -6.815 10.452 3.421 1.00 0.00 O ATOM 568 CB SER A 38 -4.903 11.925 0.912 1.00 0.00 C ATOM 569 OG SER A 38 -3.636 12.478 1.223 1.00 0.00 O ATOM 0 H SER A 38 -7.016 9.952 1.029 1.00 0.00 H new ATOM 0 HA SER A 38 -4.199 10.128 1.858 1.00 0.00 H new ATOM 0 HB2 SER A 38 -4.961 11.719 -0.157 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.685 12.649 1.140 1.00 0.00 H new ATOM 0 HG SER A 38 -3.205 12.791 0.400 1.00 0.00 H new ATOM 629 N LYS A 44 -4.034 17.703 -1.792 1.00 0.00 N ATOM 630 CA LYS A 44 -3.210 17.658 -2.994 1.00 0.00 C ATOM 631 C LYS A 44 -2.444 16.342 -3.080 1.00 0.00 C ATOM 632 O LYS A 44 -2.443 15.679 -4.118 1.00 0.00 O ATOM 633 CB LYS A 44 -2.230 18.834 -3.010 1.00 0.00 C ATOM 634 CG LYS A 44 -2.902 20.184 -3.189 1.00 0.00 C ATOM 635 CD LYS A 44 -3.331 20.407 -4.629 1.00 0.00 C ATOM 636 CE LYS A 44 -2.211 21.021 -5.455 1.00 0.00 C ATOM 637 NZ LYS A 44 -2.538 21.037 -6.908 1.00 0.00 N ATOM 0 HA LYS A 44 -3.869 17.731 -3.859 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -1.667 18.839 -2.077 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -1.511 18.686 -3.816 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -3.772 20.248 -2.535 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.217 20.976 -2.886 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.632 19.457 -5.071 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -4.203 21.061 -4.653 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -2.024 22.039 -5.114 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -1.292 20.458 -5.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -1.750 21.463 -7.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -2.691 20.063 -7.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -3.401 21.596 -7.063 1.00 0.00 H new ATOM 651 N LEU A 45 -1.794 15.969 -1.983 1.00 0.00 N ATOM 652 CA LEU A 45 -1.025 14.731 -1.933 1.00 0.00 C ATOM 653 C LEU A 45 -1.948 13.519 -1.845 1.00 0.00 C ATOM 654 O LEU A 45 -2.933 13.528 -1.107 1.00 0.00 O ATOM 655 CB LEU A 45 -0.071 14.747 -0.737 1.00 0.00 C ATOM 656 CG LEU A 45 1.179 13.876 -0.864 1.00 0.00 C ATOM 657 CD1 LEU A 45 2.101 14.090 0.327 1.00 0.00 C ATOM 658 CD2 LEU A 45 0.796 12.409 -0.988 1.00 0.00 C ATOM 0 H LEU A 45 -1.784 16.506 -1.116 1.00 0.00 H new ATOM 0 HA LEU A 45 -0.444 14.657 -2.852 1.00 0.00 H new ATOM 0 HB2 LEU A 45 0.244 15.776 -0.563 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -0.623 14.428 0.147 1.00 0.00 H new ATOM 0 HG LEU A 45 1.713 14.169 -1.768 1.00 0.00 H new ATOM 0 HD11 LEU A 45 2.986 13.462 0.220 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.402 15.137 0.371 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.577 13.825 1.245 1.00 0.00 H new ATOM 0 HD21 LEU A 45 1.698 11.804 -1.077 1.00 0.00 H new ATOM 0 HD22 LEU A 45 0.239 12.102 -0.102 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.176 12.269 -1.873 1.00 0.00 H new ATOM 670 N LYS A 46 -1.621 12.477 -2.602 1.00 0.00 N ATOM 671 CA LYS A 46 -2.418 11.256 -2.608 1.00 0.00 C ATOM 672 C LYS A 46 -1.543 10.034 -2.347 1.00 0.00 C ATOM 673 O LYS A 46 -0.316 10.113 -2.410 1.00 0.00 O ATOM 674 CB LYS A 46 -3.142 11.101 -3.947 1.00 0.00 C ATOM 675 CG LYS A 46 -4.143 12.208 -4.230 1.00 0.00 C ATOM 676 CD LYS A 46 -5.441 11.993 -3.471 1.00 0.00 C ATOM 677 CE LYS A 46 -6.452 13.088 -3.773 1.00 0.00 C ATOM 678 NZ LYS A 46 -6.315 14.241 -2.840 1.00 0.00 N ATOM 0 H LYS A 46 -0.809 12.454 -3.219 1.00 0.00 H new ATOM 0 HA LYS A 46 -3.156 11.330 -1.809 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -2.404 11.077 -4.749 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -3.660 10.142 -3.961 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -3.712 13.170 -3.951 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -4.348 12.249 -5.300 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -5.863 11.024 -3.737 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -5.238 11.969 -2.400 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -6.319 13.433 -4.798 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -7.461 12.681 -3.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -7.021 14.966 -3.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -6.467 13.917 -1.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -5.361 14.646 -2.926 1.00 0.00 H new ATOM 692 N TRP A 47 -2.181 8.907 -2.055 1.00 0.00 N ATOM 693 CA TRP A 47 -1.460 7.668 -1.785 1.00 0.00 C ATOM 694 C TRP A 47 -2.237 6.462 -2.302 1.00 0.00 C ATOM 695 O TRP A 47 -3.461 6.401 -2.176 1.00 0.00 O ATOM 696 CB TRP A 47 -1.202 7.520 -0.285 1.00 0.00 C ATOM 697 CG TRP A 47 -0.457 8.678 0.307 1.00 0.00 C ATOM 698 CD1 TRP A 47 -0.995 9.826 0.812 1.00 0.00 C ATOM 699 CD2 TRP A 47 0.962 8.799 0.453 1.00 0.00 C ATOM 700 NE1 TRP A 47 0.004 10.655 1.264 1.00 0.00 N ATOM 701 CE2 TRP A 47 1.214 10.047 1.055 1.00 0.00 C ATOM 702 CE3 TRP A 47 2.044 7.974 0.135 1.00 0.00 C ATOM 703 CZ2 TRP A 47 2.502 10.488 1.344 1.00 0.00 C ATOM 704 CZ3 TRP A 47 3.323 8.413 0.422 1.00 0.00 C ATOM 705 CH2 TRP A 47 3.543 9.660 1.022 1.00 0.00 C ATOM 0 H TRP A 47 -3.196 8.825 -1.999 1.00 0.00 H new ATOM 0 HA TRP A 47 -0.504 7.712 -2.308 1.00 0.00 H new ATOM 0 HB2 TRP A 47 -2.156 7.409 0.231 1.00 0.00 H new ATOM 0 HB3 TRP A 47 -0.636 6.605 -0.110 1.00 0.00 H new ATOM 0 HD1 TRP A 47 -2.051 10.050 0.851 1.00 0.00 H new ATOM 0 HE1 TRP A 47 -0.133 11.573 1.686 1.00 0.00 H new ATOM 0 HE3 TRP A 47 1.884 7.011 -0.327 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 2.674 11.449 1.806 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 4.167 7.784 0.180 1.00 0.00 H new ATOM 0 HH2 TRP A 47 4.554 9.974 1.235 1.00 0.00 H new ATOM 716 N CYS A 48 -1.521 5.506 -2.882 1.00 0.00 N ATOM 717 CA CYS A 48 -2.144 4.302 -3.418 1.00 0.00 C ATOM 718 C CYS A 48 -1.452 3.049 -2.890 1.00 0.00 C ATOM 719 O CYS A 48 -0.352 3.121 -2.339 1.00 0.00 O ATOM 720 CB CYS A 48 -2.102 4.317 -4.946 1.00 0.00 C ATOM 721 SG CYS A 48 -0.438 4.172 -5.640 1.00 0.00 S ATOM 0 H CYS A 48 -0.508 5.541 -2.993 1.00 0.00 H new ATOM 0 HA CYS A 48 -3.184 4.285 -3.091 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -2.714 3.498 -5.324 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -2.553 5.243 -5.302 1.00 0.00 H new ATOM 0 HG CYS A 48 0.434 4.574 -4.764 1.00 0.00 H new ATOM 727 N LEU A 49 -2.102 1.904 -3.061 1.00 0.00 N ATOM 728 CA LEU A 49 -1.549 0.635 -2.600 1.00 0.00 C ATOM 729 C LEU A 49 -1.391 -0.344 -3.760 1.00 0.00 C ATOM 730 O LEU A 49 -2.312 -0.532 -4.556 1.00 0.00 O ATOM 731 CB LEU A 49 -2.448 0.025 -1.523 1.00 0.00 C ATOM 732 CG LEU A 49 -2.326 0.633 -0.125 1.00 0.00 C ATOM 733 CD1 LEU A 49 -3.185 -0.135 0.868 1.00 0.00 C ATOM 734 CD2 LEU A 49 -0.872 0.648 0.326 1.00 0.00 C ATOM 0 H LEU A 49 -3.012 1.828 -3.515 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.564 0.830 -2.175 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -3.484 0.116 -1.848 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.228 -1.040 -1.455 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.684 1.662 -0.165 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -3.085 0.312 1.857 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -4.228 -0.094 0.555 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.858 -1.174 0.905 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -0.805 1.084 1.323 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.488 -0.372 0.349 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.281 1.243 -0.371 1.00 0.00 H new ATOM 746 N ARG A 50 -0.220 -0.965 -3.848 1.00 0.00 N ATOM 747 CA ARG A 50 0.058 -1.925 -4.910 1.00 0.00 C ATOM 748 C ARG A 50 0.127 -3.345 -4.355 1.00 0.00 C ATOM 749 O ARG A 50 1.097 -3.719 -3.696 1.00 0.00 O ATOM 750 CB ARG A 50 1.372 -1.576 -5.611 1.00 0.00 C ATOM 751 CG ARG A 50 1.212 -0.568 -6.737 1.00 0.00 C ATOM 752 CD ARG A 50 2.560 -0.120 -7.279 1.00 0.00 C ATOM 753 NE ARG A 50 2.475 0.305 -8.674 1.00 0.00 N ATOM 754 CZ ARG A 50 3.534 0.620 -9.412 1.00 0.00 C ATOM 755 NH1 ARG A 50 4.751 0.559 -8.890 1.00 0.00 N ATOM 756 NH2 ARG A 50 3.376 0.998 -10.674 1.00 0.00 N ATOM 0 H ARG A 50 0.552 -0.821 -3.197 1.00 0.00 H new ATOM 0 HA ARG A 50 -0.756 -1.875 -5.633 1.00 0.00 H new ATOM 0 HB2 ARG A 50 2.072 -1.179 -4.876 1.00 0.00 H new ATOM 0 HB3 ARG A 50 1.814 -2.488 -6.011 1.00 0.00 H new ATOM 0 HG2 ARG A 50 0.624 -1.010 -7.541 1.00 0.00 H new ATOM 0 HG3 ARG A 50 0.658 0.298 -6.375 1.00 0.00 H new ATOM 0 HD2 ARG A 50 2.940 0.702 -6.672 1.00 0.00 H new ATOM 0 HD3 ARG A 50 3.276 -0.938 -7.192 1.00 0.00 H new ATOM 0 HE ARG A 50 1.552 0.363 -9.105 1.00 0.00 H new ATOM 0 HH11 ARG A 50 4.876 0.270 -7.920 1.00 0.00 H new ATOM 0 HH12 ARG A 50 5.562 0.801 -9.458 1.00 0.00 H new ATOM 0 HH21 ARG A 50 2.441 1.047 -11.078 1.00 0.00 H new ATOM 0 HH22 ARG A 50 4.190 1.240 -11.240 1.00 0.00 H new ATOM 770 N VAL A 51 -0.910 -4.132 -4.626 1.00 0.00 N ATOM 771 CA VAL A 51 -0.967 -5.510 -4.154 1.00 0.00 C ATOM 772 C VAL A 51 -0.762 -6.492 -5.302 1.00 0.00 C ATOM 773 O VAL A 51 -1.375 -6.363 -6.360 1.00 0.00 O ATOM 774 CB VAL A 51 -2.313 -5.813 -3.469 1.00 0.00 C ATOM 775 CG1 VAL A 51 -2.482 -7.311 -3.262 1.00 0.00 C ATOM 776 CG2 VAL A 51 -2.416 -5.070 -2.146 1.00 0.00 C ATOM 0 H VAL A 51 -1.721 -3.838 -5.170 1.00 0.00 H new ATOM 0 HA VAL A 51 -0.163 -5.630 -3.428 1.00 0.00 H new ATOM 0 HB VAL A 51 -3.117 -5.467 -4.118 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.439 -7.506 -2.777 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -2.455 -7.817 -4.227 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -1.674 -7.685 -2.634 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.373 -5.295 -1.676 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -1.605 -5.384 -1.488 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.343 -3.997 -2.325 1.00 0.00 H new ATOM 786 N ASN A 52 0.106 -7.475 -5.084 1.00 0.00 N ATOM 787 CA ASN A 52 0.394 -8.480 -6.101 1.00 0.00 C ATOM 788 C ASN A 52 0.076 -9.881 -5.586 1.00 0.00 C ATOM 789 O ASN A 52 0.839 -10.477 -4.824 1.00 0.00 O ATOM 790 CB ASN A 52 1.862 -8.401 -6.525 1.00 0.00 C ATOM 791 CG ASN A 52 2.371 -6.974 -6.583 1.00 0.00 C ATOM 792 OD1 ASN A 52 2.312 -6.241 -5.596 1.00 0.00 O ATOM 793 ND2 ASN A 52 2.874 -6.572 -7.745 1.00 0.00 N ATOM 0 H ASN A 52 0.622 -7.597 -4.213 1.00 0.00 H new ATOM 0 HA ASN A 52 -0.238 -8.278 -6.966 1.00 0.00 H new ATOM 0 HB2 ASN A 52 2.471 -8.973 -5.825 1.00 0.00 H new ATOM 0 HB3 ASN A 52 1.980 -8.866 -7.504 1.00 0.00 H new ATOM 0 HD21 ASN A 52 3.231 -5.622 -7.845 1.00 0.00 H new ATOM 0 HD22 ASN A 52 2.903 -7.214 -8.537 1.00 0.00 H new ATOM 800 N PRO A 53 -1.075 -10.421 -6.011 1.00 0.00 N ATOM 801 CA PRO A 53 -1.520 -11.758 -5.607 1.00 0.00 C ATOM 802 C PRO A 53 -0.663 -12.862 -6.216 1.00 0.00 C ATOM 803 O PRO A 53 -0.650 -13.993 -5.729 1.00 0.00 O ATOM 804 CB PRO A 53 -2.951 -11.833 -6.143 1.00 0.00 C ATOM 805 CG PRO A 53 -2.978 -10.878 -7.286 1.00 0.00 C ATOM 806 CD PRO A 53 -2.032 -9.768 -6.920 1.00 0.00 C ATOM 0 HA PRO A 53 -1.447 -11.904 -4.529 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -3.200 -12.844 -6.466 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -3.676 -11.555 -5.378 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -2.668 -11.366 -8.210 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -3.985 -10.494 -7.450 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -1.535 -9.357 -7.799 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -2.551 -8.943 -6.432 1.00 0.00 H new ATOM 814 N LYS A 54 0.052 -12.528 -7.285 1.00 0.00 N ATOM 815 CA LYS A 54 0.913 -13.491 -7.962 1.00 0.00 C ATOM 816 C LYS A 54 2.383 -13.198 -7.680 1.00 0.00 C ATOM 817 O LYS A 54 3.266 -13.944 -8.099 1.00 0.00 O ATOM 818 CB LYS A 54 0.657 -13.464 -9.470 1.00 0.00 C ATOM 819 CG LYS A 54 -0.603 -14.204 -9.887 1.00 0.00 C ATOM 820 CD LYS A 54 -0.494 -14.736 -11.306 1.00 0.00 C ATOM 821 CE LYS A 54 -1.478 -15.868 -11.554 1.00 0.00 C ATOM 822 NZ LYS A 54 -1.059 -16.728 -12.695 1.00 0.00 N ATOM 0 H LYS A 54 0.052 -11.597 -7.702 1.00 0.00 H new ATOM 0 HA LYS A 54 0.678 -14.484 -7.578 1.00 0.00 H new ATOM 0 HB2 LYS A 54 0.585 -12.427 -9.799 1.00 0.00 H new ATOM 0 HB3 LYS A 54 1.513 -13.903 -9.983 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -0.784 -15.031 -9.200 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -1.460 -13.535 -9.813 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -0.681 -13.928 -12.014 1.00 0.00 H new ATOM 0 HD3 LYS A 54 0.521 -15.089 -11.486 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -1.566 -16.476 -10.654 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -2.466 -15.453 -11.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -1.756 -17.488 -12.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -1.000 -16.153 -13.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -0.128 -17.145 -12.492 1.00 0.00 H new ATOM 836 N GLY A 55 2.638 -12.105 -6.965 1.00 0.00 N ATOM 837 CA GLY A 55 4.002 -11.734 -6.639 1.00 0.00 C ATOM 838 C GLY A 55 4.759 -11.196 -7.837 1.00 0.00 C ATOM 839 O GLY A 55 4.490 -11.582 -8.975 1.00 0.00 O ATOM 0 H GLY A 55 1.924 -11.471 -6.606 1.00 0.00 H new ATOM 0 HA2 GLY A 55 3.992 -10.981 -5.851 1.00 0.00 H new ATOM 0 HA3 GLY A 55 4.527 -12.603 -6.242 1.00 0.00 H new ATOM 843 N LEU A 56 5.709 -10.303 -7.582 1.00 0.00 N ATOM 844 CA LEU A 56 6.507 -9.709 -8.649 1.00 0.00 C ATOM 845 C LEU A 56 7.310 -10.776 -9.387 1.00 0.00 C ATOM 846 O LEU A 56 7.152 -10.963 -10.593 1.00 0.00 O ATOM 847 CB LEU A 56 7.450 -8.649 -8.078 1.00 0.00 C ATOM 848 CG LEU A 56 6.789 -7.367 -7.569 1.00 0.00 C ATOM 849 CD1 LEU A 56 7.784 -6.532 -6.778 1.00 0.00 C ATOM 850 CD2 LEU A 56 6.219 -6.564 -8.728 1.00 0.00 C ATOM 0 H LEU A 56 5.945 -9.974 -6.646 1.00 0.00 H new ATOM 0 HA LEU A 56 5.827 -9.237 -9.358 1.00 0.00 H new ATOM 0 HB2 LEU A 56 8.011 -9.095 -7.257 1.00 0.00 H new ATOM 0 HB3 LEU A 56 8.172 -8.380 -8.849 1.00 0.00 H new ATOM 0 HG LEU A 56 5.969 -7.642 -6.906 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.296 -5.624 -6.424 1.00 0.00 H new ATOM 0 HD12 LEU A 56 8.144 -7.107 -5.925 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.625 -6.266 -7.418 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.753 -5.656 -8.347 1.00 0.00 H new ATOM 0 HD22 LEU A 56 7.021 -6.299 -9.416 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.474 -7.162 -9.253 1.00 0.00 H new ATOM 862 N ASP A 57 8.169 -11.475 -8.653 1.00 0.00 N ATOM 863 CA ASP A 57 8.994 -12.526 -9.237 1.00 0.00 C ATOM 864 C ASP A 57 8.664 -13.882 -8.619 1.00 0.00 C ATOM 865 O ASP A 57 7.941 -13.962 -7.627 1.00 0.00 O ATOM 866 CB ASP A 57 10.477 -12.209 -9.039 1.00 0.00 C ATOM 867 CG ASP A 57 10.767 -10.723 -9.119 1.00 0.00 C ATOM 868 OD1 ASP A 57 10.047 -10.017 -9.857 1.00 0.00 O ATOM 869 OD2 ASP A 57 11.713 -10.266 -8.445 1.00 0.00 O ATOM 0 H ASP A 57 8.312 -11.333 -7.653 1.00 0.00 H new ATOM 0 HA ASP A 57 8.780 -12.571 -10.305 1.00 0.00 H new ATOM 0 HB2 ASP A 57 10.800 -12.588 -8.069 1.00 0.00 H new ATOM 0 HB3 ASP A 57 11.062 -12.732 -9.796 1.00 0.00 H new ATOM 874 N GLU A 58 9.200 -14.943 -9.213 1.00 0.00 N ATOM 875 CA GLU A 58 8.960 -16.295 -8.722 1.00 0.00 C ATOM 876 C GLU A 58 9.392 -16.428 -7.264 1.00 0.00 C ATOM 877 O GLU A 58 9.053 -17.402 -6.593 1.00 0.00 O ATOM 878 CB GLU A 58 9.710 -17.315 -9.582 1.00 0.00 C ATOM 879 CG GLU A 58 9.200 -17.397 -11.011 1.00 0.00 C ATOM 880 CD GLU A 58 7.846 -18.073 -11.109 1.00 0.00 C ATOM 881 OE1 GLU A 58 6.894 -17.589 -10.461 1.00 0.00 O ATOM 882 OE2 GLU A 58 7.738 -19.084 -11.833 1.00 0.00 O ATOM 0 H GLU A 58 9.803 -14.893 -10.034 1.00 0.00 H new ATOM 0 HA GLU A 58 7.890 -16.493 -8.787 1.00 0.00 H new ATOM 0 HB2 GLU A 58 10.769 -17.057 -9.597 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.628 -18.298 -9.119 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.131 -16.392 -11.426 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.920 -17.944 -11.619 1.00 0.00 H new ATOM 889 N GLU A 59 10.142 -15.442 -6.783 1.00 0.00 N ATOM 890 CA GLU A 59 10.621 -15.450 -5.405 1.00 0.00 C ATOM 891 C GLU A 59 9.455 -15.376 -4.424 1.00 0.00 C ATOM 892 O GLU A 59 9.375 -16.159 -3.478 1.00 0.00 O ATOM 893 CB GLU A 59 11.577 -14.280 -5.168 1.00 0.00 C ATOM 894 CG GLU A 59 11.901 -14.047 -3.702 1.00 0.00 C ATOM 895 CD GLU A 59 13.239 -13.360 -3.502 1.00 0.00 C ATOM 896 OE1 GLU A 59 13.289 -12.117 -3.611 1.00 0.00 O ATOM 897 OE2 GLU A 59 14.234 -14.065 -3.236 1.00 0.00 O ATOM 0 H GLU A 59 10.431 -14.628 -7.326 1.00 0.00 H new ATOM 0 HA GLU A 59 11.155 -16.385 -5.238 1.00 0.00 H new ATOM 0 HB2 GLU A 59 12.504 -14.463 -5.712 1.00 0.00 H new ATOM 0 HB3 GLU A 59 11.138 -13.373 -5.583 1.00 0.00 H new ATOM 0 HG2 GLU A 59 11.115 -13.441 -3.252 1.00 0.00 H new ATOM 0 HG3 GLU A 59 11.906 -15.003 -3.178 1.00 0.00 H new ATOM 904 N SER A 60 8.553 -14.427 -4.656 1.00 0.00 N ATOM 905 CA SER A 60 7.394 -14.246 -3.790 1.00 0.00 C ATOM 906 C SER A 60 6.099 -14.510 -4.554 1.00 0.00 C ATOM 907 O SER A 60 5.142 -13.742 -4.460 1.00 0.00 O ATOM 908 CB SER A 60 7.378 -12.830 -3.212 1.00 0.00 C ATOM 909 OG SER A 60 7.292 -11.860 -4.241 1.00 0.00 O ATOM 0 H SER A 60 8.603 -13.772 -5.436 1.00 0.00 H new ATOM 0 HA SER A 60 7.467 -14.963 -2.973 1.00 0.00 H new ATOM 0 HB2 SER A 60 6.532 -12.721 -2.533 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.281 -12.663 -2.625 1.00 0.00 H new ATOM 0 HG SER A 60 7.121 -10.979 -3.847 1.00 0.00 H new ATOM 915 N LYS A 61 6.078 -15.603 -5.310 1.00 0.00 N ATOM 916 CA LYS A 61 4.902 -15.971 -6.089 1.00 0.00 C ATOM 917 C LYS A 61 3.834 -16.599 -5.200 1.00 0.00 C ATOM 918 O LYS A 61 2.638 -16.458 -5.456 1.00 0.00 O ATOM 919 CB LYS A 61 5.289 -16.945 -7.205 1.00 0.00 C ATOM 920 CG LYS A 61 5.860 -18.257 -6.695 1.00 0.00 C ATOM 921 CD LYS A 61 6.617 -18.997 -7.786 1.00 0.00 C ATOM 922 CE LYS A 61 5.681 -19.485 -8.881 1.00 0.00 C ATOM 923 NZ LYS A 61 5.057 -20.792 -8.536 1.00 0.00 N ATOM 0 H LYS A 61 6.862 -16.249 -5.399 1.00 0.00 H new ATOM 0 HA LYS A 61 4.492 -15.063 -6.532 1.00 0.00 H new ATOM 0 HB2 LYS A 61 4.410 -17.153 -7.815 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.022 -16.467 -7.855 1.00 0.00 H new ATOM 0 HG2 LYS A 61 6.527 -18.063 -5.855 1.00 0.00 H new ATOM 0 HG3 LYS A 61 5.052 -18.886 -6.321 1.00 0.00 H new ATOM 0 HD2 LYS A 61 7.371 -18.339 -8.217 1.00 0.00 H new ATOM 0 HD3 LYS A 61 7.145 -19.846 -7.352 1.00 0.00 H new ATOM 0 HE2 LYS A 61 4.900 -18.743 -9.049 1.00 0.00 H new ATOM 0 HE3 LYS A 61 6.234 -19.582 -9.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 4.426 -21.090 -9.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 5.800 -21.507 -8.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 4.508 -20.694 -7.658 1.00 0.00 H new ATOM 937 N ASP A 62 4.273 -17.290 -4.154 1.00 0.00 N ATOM 938 CA ASP A 62 3.354 -17.937 -3.225 1.00 0.00 C ATOM 939 C ASP A 62 2.928 -16.973 -2.122 1.00 0.00 C ATOM 940 O ASP A 62 1.979 -17.239 -1.384 1.00 0.00 O ATOM 941 CB ASP A 62 4.005 -19.178 -2.611 1.00 0.00 C ATOM 942 CG ASP A 62 4.279 -20.257 -3.640 1.00 0.00 C ATOM 943 OD1 ASP A 62 3.305 -20.824 -4.177 1.00 0.00 O ATOM 944 OD2 ASP A 62 5.467 -20.536 -3.907 1.00 0.00 O ATOM 0 H ASP A 62 5.260 -17.417 -3.928 1.00 0.00 H new ATOM 0 HA ASP A 62 2.467 -18.239 -3.782 1.00 0.00 H new ATOM 0 HB2 ASP A 62 4.940 -18.893 -2.129 1.00 0.00 H new ATOM 0 HB3 ASP A 62 3.355 -19.579 -1.833 1.00 0.00 H new ATOM 949 N TYR A 63 3.635 -15.854 -2.016 1.00 0.00 N ATOM 950 CA TYR A 63 3.332 -14.852 -1.001 1.00 0.00 C ATOM 951 C TYR A 63 2.696 -13.616 -1.629 1.00 0.00 C ATOM 952 O TYR A 63 2.745 -13.427 -2.845 1.00 0.00 O ATOM 953 CB TYR A 63 4.604 -14.457 -0.248 1.00 0.00 C ATOM 954 CG TYR A 63 5.422 -15.640 0.220 1.00 0.00 C ATOM 955 CD1 TYR A 63 6.193 -16.373 -0.673 1.00 0.00 C ATOM 956 CD2 TYR A 63 5.423 -16.023 1.555 1.00 0.00 C ATOM 957 CE1 TYR A 63 6.941 -17.455 -0.250 1.00 0.00 C ATOM 958 CE2 TYR A 63 6.169 -17.102 1.988 1.00 0.00 C ATOM 959 CZ TYR A 63 6.927 -17.815 1.082 1.00 0.00 C ATOM 960 OH TYR A 63 7.670 -18.891 1.508 1.00 0.00 O ATOM 0 H TYR A 63 4.422 -15.618 -2.620 1.00 0.00 H new ATOM 0 HA TYR A 63 2.622 -15.287 -0.298 1.00 0.00 H new ATOM 0 HB2 TYR A 63 5.220 -13.833 -0.895 1.00 0.00 H new ATOM 0 HB3 TYR A 63 4.332 -13.850 0.615 1.00 0.00 H new ATOM 0 HD1 TYR A 63 6.208 -16.092 -1.716 1.00 0.00 H new ATOM 0 HD2 TYR A 63 4.830 -15.468 2.267 1.00 0.00 H new ATOM 0 HE1 TYR A 63 7.533 -18.016 -0.958 1.00 0.00 H new ATOM 0 HE2 TYR A 63 6.159 -17.386 3.030 1.00 0.00 H new ATOM 0 HH TYR A 63 7.550 -19.009 2.473 1.00 0.00 H new ATOM 970 N LEU A 64 2.098 -12.776 -0.791 1.00 0.00 N ATOM 971 CA LEU A 64 1.451 -11.556 -1.262 1.00 0.00 C ATOM 972 C LEU A 64 2.400 -10.365 -1.166 1.00 0.00 C ATOM 973 O LEU A 64 2.943 -10.075 -0.100 1.00 0.00 O ATOM 974 CB LEU A 64 0.185 -11.281 -0.450 1.00 0.00 C ATOM 975 CG LEU A 64 -0.822 -10.320 -1.082 1.00 0.00 C ATOM 976 CD1 LEU A 64 -0.334 -8.884 -0.968 1.00 0.00 C ATOM 977 CD2 LEU A 64 -1.068 -10.687 -2.538 1.00 0.00 C ATOM 0 H LEU A 64 2.048 -12.917 0.218 1.00 0.00 H new ATOM 0 HA LEU A 64 1.180 -11.698 -2.308 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.317 -12.231 -0.264 1.00 0.00 H new ATOM 0 HB3 LEU A 64 0.479 -10.881 0.520 1.00 0.00 H new ATOM 0 HG LEU A 64 -1.765 -10.406 -0.542 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -1.064 -8.214 -1.423 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -0.210 -8.624 0.083 1.00 0.00 H new ATOM 0 HD13 LEU A 64 0.622 -8.783 -1.482 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -1.787 -9.992 -2.972 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -0.130 -10.631 -3.091 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.463 -11.701 -2.596 1.00 0.00 H new ATOM 989 N SER A 65 2.592 -9.677 -2.287 1.00 0.00 N ATOM 990 CA SER A 65 3.476 -8.517 -2.330 1.00 0.00 C ATOM 991 C SER A 65 2.675 -7.221 -2.257 1.00 0.00 C ATOM 992 O SER A 65 1.923 -6.889 -3.175 1.00 0.00 O ATOM 993 CB SER A 65 4.318 -8.539 -3.607 1.00 0.00 C ATOM 994 OG SER A 65 5.537 -7.839 -3.426 1.00 0.00 O ATOM 0 H SER A 65 2.148 -9.902 -3.177 1.00 0.00 H new ATOM 0 HA SER A 65 4.139 -8.563 -1.466 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.526 -9.570 -3.891 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.755 -8.090 -4.425 1.00 0.00 H new ATOM 0 HG SER A 65 6.058 -7.869 -4.256 1.00 0.00 H new ATOM 1000 N LEU A 66 2.841 -6.491 -1.159 1.00 0.00 N ATOM 1001 CA LEU A 66 2.135 -5.230 -0.964 1.00 0.00 C ATOM 1002 C LEU A 66 3.112 -4.100 -0.658 1.00 0.00 C ATOM 1003 O LEU A 66 3.765 -4.096 0.386 1.00 0.00 O ATOM 1004 CB LEU A 66 1.118 -5.362 0.171 1.00 0.00 C ATOM 1005 CG LEU A 66 -0.053 -4.379 0.141 1.00 0.00 C ATOM 1006 CD1 LEU A 66 -1.117 -4.787 1.148 1.00 0.00 C ATOM 1007 CD2 LEU A 66 0.432 -2.964 0.419 1.00 0.00 C ATOM 0 H LEU A 66 3.459 -6.751 -0.390 1.00 0.00 H new ATOM 0 HA LEU A 66 1.609 -4.990 -1.888 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.716 -6.375 0.156 1.00 0.00 H new ATOM 0 HB3 LEU A 66 1.643 -5.241 1.118 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.496 -4.401 -0.855 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.943 -4.076 1.113 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -1.485 -5.784 0.904 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -0.687 -4.794 2.149 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.414 -2.278 0.394 1.00 0.00 H new ATOM 0 HD22 LEU A 66 0.900 -2.927 1.403 1.00 0.00 H new ATOM 0 HD23 LEU A 66 1.158 -2.673 -0.340 1.00 0.00 H new ATOM 1019 N TYR A 67 3.206 -3.142 -1.573 1.00 0.00 N ATOM 1020 CA TYR A 67 4.104 -2.006 -1.401 1.00 0.00 C ATOM 1021 C TYR A 67 3.324 -0.695 -1.364 1.00 0.00 C ATOM 1022 O TYR A 67 2.174 -0.631 -1.800 1.00 0.00 O ATOM 1023 CB TYR A 67 5.134 -1.967 -2.531 1.00 0.00 C ATOM 1024 CG TYR A 67 6.266 -2.954 -2.352 1.00 0.00 C ATOM 1025 CD1 TYR A 67 6.118 -4.285 -2.724 1.00 0.00 C ATOM 1026 CD2 TYR A 67 7.482 -2.556 -1.811 1.00 0.00 C ATOM 1027 CE1 TYR A 67 7.149 -5.190 -2.562 1.00 0.00 C ATOM 1028 CE2 TYR A 67 8.519 -3.454 -1.647 1.00 0.00 C ATOM 1029 CZ TYR A 67 8.347 -4.770 -2.024 1.00 0.00 C ATOM 1030 OH TYR A 67 9.377 -5.668 -1.861 1.00 0.00 O ATOM 0 H TYR A 67 2.671 -3.129 -2.442 1.00 0.00 H new ATOM 0 HA TYR A 67 4.622 -2.127 -0.450 1.00 0.00 H new ATOM 0 HB2 TYR A 67 4.632 -2.171 -3.477 1.00 0.00 H new ATOM 0 HB3 TYR A 67 5.548 -0.961 -2.600 1.00 0.00 H new ATOM 0 HD1 TYR A 67 5.181 -4.617 -3.147 1.00 0.00 H new ATOM 0 HD2 TYR A 67 7.619 -1.527 -1.513 1.00 0.00 H new ATOM 0 HE1 TYR A 67 7.017 -6.221 -2.855 1.00 0.00 H new ATOM 0 HE2 TYR A 67 9.459 -3.128 -1.226 1.00 0.00 H new ATOM 0 HH TYR A 67 10.151 -5.211 -1.470 1.00 0.00 H new ATOM 1040 N LEU A 68 3.957 0.348 -0.840 1.00 0.00 N ATOM 1041 CA LEU A 68 3.325 1.659 -0.746 1.00 0.00 C ATOM 1042 C LEU A 68 3.879 2.609 -1.803 1.00 0.00 C ATOM 1043 O LEU A 68 4.966 3.166 -1.643 1.00 0.00 O ATOM 1044 CB LEU A 68 3.536 2.250 0.649 1.00 0.00 C ATOM 1045 CG LEU A 68 2.667 3.457 1.006 1.00 0.00 C ATOM 1046 CD1 LEU A 68 2.989 4.634 0.098 1.00 0.00 C ATOM 1047 CD2 LEU A 68 1.191 3.097 0.912 1.00 0.00 C ATOM 0 H LEU A 68 4.908 0.312 -0.473 1.00 0.00 H new ATOM 0 HA LEU A 68 2.257 1.533 -0.923 1.00 0.00 H new ATOM 0 HB2 LEU A 68 3.354 1.467 1.385 1.00 0.00 H new ATOM 0 HB3 LEU A 68 4.582 2.540 0.744 1.00 0.00 H new ATOM 0 HG LEU A 68 2.886 3.747 2.034 1.00 0.00 H new ATOM 0 HD11 LEU A 68 2.361 5.483 0.367 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.038 4.907 0.214 1.00 0.00 H new ATOM 0 HD13 LEU A 68 2.799 4.356 -0.939 1.00 0.00 H new ATOM 0 HD21 LEU A 68 0.587 3.967 1.169 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.958 2.781 -0.105 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.970 2.285 1.604 1.00 0.00 H new ATOM 1059 N LEU A 69 3.126 2.791 -2.881 1.00 0.00 N ATOM 1060 CA LEU A 69 3.541 3.675 -3.965 1.00 0.00 C ATOM 1061 C LEU A 69 2.940 5.067 -3.791 1.00 0.00 C ATOM 1062 O LEU A 69 1.799 5.212 -3.351 1.00 0.00 O ATOM 1063 CB LEU A 69 3.122 3.091 -5.315 1.00 0.00 C ATOM 1064 CG LEU A 69 3.561 3.878 -6.551 1.00 0.00 C ATOM 1065 CD1 LEU A 69 4.927 3.409 -7.025 1.00 0.00 C ATOM 1066 CD2 LEU A 69 2.532 3.739 -7.664 1.00 0.00 C ATOM 0 H LEU A 69 2.224 2.338 -3.029 1.00 0.00 H new ATOM 0 HA LEU A 69 4.627 3.761 -3.936 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.522 2.080 -5.391 1.00 0.00 H new ATOM 0 HB3 LEU A 69 2.035 3.005 -5.330 1.00 0.00 H new ATOM 0 HG LEU A 69 3.635 4.931 -6.280 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.223 3.980 -7.905 1.00 0.00 H new ATOM 0 HD12 LEU A 69 5.659 3.560 -6.232 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.880 2.350 -7.279 1.00 0.00 H new ATOM 0 HD21 LEU A 69 2.860 4.305 -8.536 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.426 2.688 -7.933 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.572 4.124 -7.322 1.00 0.00 H new ATOM 1078 N LEU A 70 3.715 6.087 -4.143 1.00 0.00 N ATOM 1079 CA LEU A 70 3.259 7.468 -4.028 1.00 0.00 C ATOM 1080 C LEU A 70 2.617 7.939 -5.330 1.00 0.00 C ATOM 1081 O LEU A 70 3.292 8.477 -6.208 1.00 0.00 O ATOM 1082 CB LEU A 70 4.429 8.384 -3.663 1.00 0.00 C ATOM 1083 CG LEU A 70 4.122 9.881 -3.620 1.00 0.00 C ATOM 1084 CD1 LEU A 70 3.058 10.178 -2.575 1.00 0.00 C ATOM 1085 CD2 LEU A 70 5.387 10.677 -3.337 1.00 0.00 C ATOM 0 H LEU A 70 4.661 5.984 -4.510 1.00 0.00 H new ATOM 0 HA LEU A 70 2.510 7.513 -3.237 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.809 8.083 -2.687 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.232 8.219 -4.382 1.00 0.00 H new ATOM 0 HG LEU A 70 3.738 10.182 -4.595 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.853 11.248 -2.559 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.145 9.637 -2.822 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.413 9.862 -1.594 1.00 0.00 H new ATOM 0 HD21 LEU A 70 5.149 11.740 -3.310 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.801 10.373 -2.375 1.00 0.00 H new ATOM 0 HD23 LEU A 70 6.119 10.489 -4.123 1.00 0.00 H new ATOM 1097 N VAL A 71 1.309 7.736 -5.446 1.00 0.00 N ATOM 1098 CA VAL A 71 0.575 8.142 -6.638 1.00 0.00 C ATOM 1099 C VAL A 71 1.012 9.525 -7.108 1.00 0.00 C ATOM 1100 O VAL A 71 1.601 9.671 -8.179 1.00 0.00 O ATOM 1101 CB VAL A 71 -0.945 8.155 -6.385 1.00 0.00 C ATOM 1102 CG1 VAL A 71 -1.239 8.446 -4.921 1.00 0.00 C ATOM 1103 CG2 VAL A 71 -1.626 9.173 -7.287 1.00 0.00 C ATOM 0 H VAL A 71 0.736 7.292 -4.728 1.00 0.00 H new ATOM 0 HA VAL A 71 0.801 7.409 -7.413 1.00 0.00 H new ATOM 0 HB VAL A 71 -1.345 7.169 -6.622 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -2.317 8.451 -4.760 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -0.783 7.676 -4.298 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -0.828 9.419 -4.654 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -2.699 9.169 -7.095 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -1.225 10.166 -7.083 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -1.443 8.915 -8.330 1.00 0.00 H new ATOM 1113 N SER A 72 0.721 10.539 -6.298 1.00 0.00 N ATOM 1114 CA SER A 72 1.081 11.912 -6.632 1.00 0.00 C ATOM 1115 C SER A 72 1.484 12.687 -5.382 1.00 0.00 C ATOM 1116 O SER A 72 0.892 12.518 -4.315 1.00 0.00 O ATOM 1117 CB SER A 72 -0.087 12.614 -7.327 1.00 0.00 C ATOM 1118 OG SER A 72 0.220 13.970 -7.596 1.00 0.00 O ATOM 0 H SER A 72 0.237 10.435 -5.406 1.00 0.00 H new ATOM 0 HA SER A 72 1.933 11.883 -7.311 1.00 0.00 H new ATOM 0 HB2 SER A 72 -0.322 12.099 -8.259 1.00 0.00 H new ATOM 0 HB3 SER A 72 -0.976 12.557 -6.698 1.00 0.00 H new ATOM 0 HG SER A 72 -0.542 14.396 -8.042 1.00 0.00 H new ATOM 1124 N CYS A 73 2.496 13.537 -5.521 1.00 0.00 N ATOM 1125 CA CYS A 73 2.981 14.338 -4.403 1.00 0.00 C ATOM 1126 C CYS A 73 3.397 15.729 -4.871 1.00 0.00 C ATOM 1127 O CYS A 73 4.159 15.887 -5.826 1.00 0.00 O ATOM 1128 CB CYS A 73 4.159 13.642 -3.722 1.00 0.00 C ATOM 1129 SG CYS A 73 5.747 13.900 -4.547 1.00 0.00 S ATOM 0 H CYS A 73 2.996 13.689 -6.397 1.00 0.00 H new ATOM 0 HA CYS A 73 2.168 14.444 -3.685 1.00 0.00 H new ATOM 0 HB2 CYS A 73 4.233 13.999 -2.695 1.00 0.00 H new ATOM 0 HB3 CYS A 73 3.956 12.572 -3.674 1.00 0.00 H new ATOM 0 HG CYS A 73 6.467 14.730 -3.853 1.00 0.00 H new ATOM 1135 N PRO A 74 2.886 16.762 -4.186 1.00 0.00 N ATOM 1136 CA PRO A 74 3.191 18.158 -4.514 1.00 0.00 C ATOM 1137 C PRO A 74 4.634 18.529 -4.188 1.00 0.00 C ATOM 1138 O PRO A 74 5.309 19.190 -4.977 1.00 0.00 O ATOM 1139 CB PRO A 74 2.223 18.949 -3.631 1.00 0.00 C ATOM 1140 CG PRO A 74 1.931 18.045 -2.484 1.00 0.00 C ATOM 1141 CD PRO A 74 1.972 16.648 -3.037 1.00 0.00 C ATOM 0 HA PRO A 74 3.080 18.360 -5.579 1.00 0.00 H new ATOM 0 HB2 PRO A 74 2.669 19.885 -3.294 1.00 0.00 H new ATOM 0 HB3 PRO A 74 1.313 19.207 -4.173 1.00 0.00 H new ATOM 0 HG2 PRO A 74 2.667 18.172 -1.690 1.00 0.00 H new ATOM 0 HG3 PRO A 74 0.955 18.265 -2.052 1.00 0.00 H new ATOM 0 HD2 PRO A 74 2.341 15.935 -2.300 1.00 0.00 H new ATOM 0 HD3 PRO A 74 0.983 16.308 -3.343 1.00 0.00 H new ATOM 1149 N LYS A 75 5.101 18.099 -3.021 1.00 0.00 N ATOM 1150 CA LYS A 75 6.465 18.384 -2.591 1.00 0.00 C ATOM 1151 C LYS A 75 7.450 17.404 -3.221 1.00 0.00 C ATOM 1152 O LYS A 75 7.136 16.229 -3.411 1.00 0.00 O ATOM 1153 CB LYS A 75 6.565 18.314 -1.065 1.00 0.00 C ATOM 1154 CG LYS A 75 5.594 17.330 -0.436 1.00 0.00 C ATOM 1155 CD LYS A 75 5.885 17.126 1.041 1.00 0.00 C ATOM 1156 CE LYS A 75 4.672 16.580 1.778 1.00 0.00 C ATOM 1157 NZ LYS A 75 4.650 17.007 3.205 1.00 0.00 N ATOM 0 H LYS A 75 4.555 17.552 -2.356 1.00 0.00 H new ATOM 0 HA LYS A 75 6.721 19.391 -2.920 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.582 18.035 -0.788 1.00 0.00 H new ATOM 0 HB3 LYS A 75 6.383 19.306 -0.652 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.574 17.694 -0.560 1.00 0.00 H new ATOM 0 HG3 LYS A 75 5.656 16.374 -0.955 1.00 0.00 H new ATOM 0 HD2 LYS A 75 6.722 16.438 1.156 1.00 0.00 H new ATOM 0 HD3 LYS A 75 6.187 18.073 1.488 1.00 0.00 H new ATOM 0 HE2 LYS A 75 3.763 16.921 1.283 1.00 0.00 H new ATOM 0 HE3 LYS A 75 4.675 15.491 1.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 3.808 16.614 3.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 5.505 16.660 3.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 4.621 18.045 3.256 1.00 0.00 H new ATOM 1171 N SER A 76 8.642 17.896 -3.542 1.00 0.00 N ATOM 1172 CA SER A 76 9.673 17.064 -4.153 1.00 0.00 C ATOM 1173 C SER A 76 9.599 15.634 -3.626 1.00 0.00 C ATOM 1174 O SER A 76 9.536 14.680 -4.400 1.00 0.00 O ATOM 1175 CB SER A 76 11.059 17.650 -3.879 1.00 0.00 C ATOM 1176 OG SER A 76 11.277 18.823 -4.643 1.00 0.00 O ATOM 0 H SER A 76 8.918 18.866 -3.389 1.00 0.00 H new ATOM 0 HA SER A 76 9.501 17.046 -5.229 1.00 0.00 H new ATOM 0 HB2 SER A 76 11.157 17.880 -2.818 1.00 0.00 H new ATOM 0 HB3 SER A 76 11.823 16.910 -4.117 1.00 0.00 H new ATOM 0 HG SER A 76 12.169 19.179 -4.448 1.00 0.00 H new ATOM 1182 N GLU A 77 9.608 15.496 -2.304 1.00 0.00 N ATOM 1183 CA GLU A 77 9.544 14.182 -1.674 1.00 0.00 C ATOM 1184 C GLU A 77 8.599 14.200 -0.475 1.00 0.00 C ATOM 1185 O GLU A 77 8.069 15.247 -0.104 1.00 0.00 O ATOM 1186 CB GLU A 77 10.939 13.735 -1.231 1.00 0.00 C ATOM 1187 CG GLU A 77 11.632 14.725 -0.311 1.00 0.00 C ATOM 1188 CD GLU A 77 13.141 14.698 -0.456 1.00 0.00 C ATOM 1189 OE1 GLU A 77 13.639 13.961 -1.331 1.00 0.00 O ATOM 1190 OE2 GLU A 77 13.824 15.414 0.306 1.00 0.00 O ATOM 0 H GLU A 77 9.659 16.276 -1.649 1.00 0.00 H new ATOM 0 HA GLU A 77 9.160 13.474 -2.408 1.00 0.00 H new ATOM 0 HB2 GLU A 77 10.859 12.774 -0.723 1.00 0.00 H new ATOM 0 HB3 GLU A 77 11.558 13.578 -2.114 1.00 0.00 H new ATOM 0 HG2 GLU A 77 11.268 15.730 -0.525 1.00 0.00 H new ATOM 0 HG3 GLU A 77 11.366 14.503 0.722 1.00 0.00 H new ATOM 1197 N VAL A 78 8.394 13.032 0.126 1.00 0.00 N ATOM 1198 CA VAL A 78 7.515 12.913 1.283 1.00 0.00 C ATOM 1199 C VAL A 78 7.993 11.813 2.225 1.00 0.00 C ATOM 1200 O VAL A 78 8.255 10.688 1.800 1.00 0.00 O ATOM 1201 CB VAL A 78 6.065 12.614 0.858 1.00 0.00 C ATOM 1202 CG1 VAL A 78 5.088 13.086 1.923 1.00 0.00 C ATOM 1203 CG2 VAL A 78 5.759 13.264 -0.483 1.00 0.00 C ATOM 0 H VAL A 78 8.824 12.156 -0.169 1.00 0.00 H new ATOM 0 HA VAL A 78 7.544 13.871 1.802 1.00 0.00 H new ATOM 0 HB VAL A 78 5.952 11.535 0.748 1.00 0.00 H new ATOM 0 HG11 VAL A 78 4.069 12.866 1.605 1.00 0.00 H new ATOM 0 HG12 VAL A 78 5.295 12.570 2.861 1.00 0.00 H new ATOM 0 HG13 VAL A 78 5.199 14.161 2.068 1.00 0.00 H new ATOM 0 HG21 VAL A 78 4.731 13.043 -0.768 1.00 0.00 H new ATOM 0 HG22 VAL A 78 5.889 14.343 -0.402 1.00 0.00 H new ATOM 0 HG23 VAL A 78 6.438 12.872 -1.241 1.00 0.00 H new ATOM 1213 N ARG A 79 8.104 12.147 3.507 1.00 0.00 N ATOM 1214 CA ARG A 79 8.551 11.188 4.510 1.00 0.00 C ATOM 1215 C ARG A 79 7.391 10.752 5.400 1.00 0.00 C ATOM 1216 O ARG A 79 6.899 11.526 6.220 1.00 0.00 O ATOM 1217 CB ARG A 79 9.664 11.795 5.366 1.00 0.00 C ATOM 1218 CG ARG A 79 11.061 11.515 4.836 1.00 0.00 C ATOM 1219 CD ARG A 79 12.035 12.617 5.223 1.00 0.00 C ATOM 1220 NE ARG A 79 13.400 12.118 5.360 1.00 0.00 N ATOM 1221 CZ ARG A 79 13.867 11.548 6.466 1.00 0.00 C ATOM 1222 NH1 ARG A 79 13.082 11.405 7.524 1.00 0.00 N ATOM 1223 NH2 ARG A 79 15.122 11.118 6.513 1.00 0.00 N ATOM 0 H ARG A 79 7.891 13.074 3.875 1.00 0.00 H new ATOM 0 HA ARG A 79 8.938 10.311 3.991 1.00 0.00 H new ATOM 0 HB2 ARG A 79 9.517 12.873 5.427 1.00 0.00 H new ATOM 0 HB3 ARG A 79 9.584 11.405 6.381 1.00 0.00 H new ATOM 0 HG2 ARG A 79 11.415 10.561 5.227 1.00 0.00 H new ATOM 0 HG3 ARG A 79 11.028 11.422 3.750 1.00 0.00 H new ATOM 0 HD2 ARG A 79 12.011 13.404 4.469 1.00 0.00 H new ATOM 0 HD3 ARG A 79 11.718 13.067 6.164 1.00 0.00 H new ATOM 0 HE ARG A 79 14.030 12.212 4.563 1.00 0.00 H new ATOM 0 HH11 ARG A 79 12.117 11.733 7.491 1.00 0.00 H new ATOM 0 HH12 ARG A 79 13.443 10.967 8.372 1.00 0.00 H new ATOM 0 HH21 ARG A 79 15.729 11.225 5.700 1.00 0.00 H new ATOM 0 HH22 ARG A 79 15.480 10.681 7.362 1.00 0.00 H new ATOM 1237 N ALA A 80 6.959 9.506 5.232 1.00 0.00 N ATOM 1238 CA ALA A 80 5.858 8.966 6.020 1.00 0.00 C ATOM 1239 C ALA A 80 6.104 7.504 6.376 1.00 0.00 C ATOM 1240 O ALA A 80 7.069 6.895 5.914 1.00 0.00 O ATOM 1241 CB ALA A 80 4.546 9.115 5.265 1.00 0.00 C ATOM 0 H ALA A 80 7.355 8.852 4.557 1.00 0.00 H new ATOM 0 HA ALA A 80 5.795 9.533 6.949 1.00 0.00 H new ATOM 0 HB1 ALA A 80 3.732 8.708 5.865 1.00 0.00 H new ATOM 0 HB2 ALA A 80 4.358 10.170 5.067 1.00 0.00 H new ATOM 0 HB3 ALA A 80 4.606 8.574 4.321 1.00 0.00 H new ATOM 1247 N LYS A 81 5.224 6.945 7.201 1.00 0.00 N ATOM 1248 CA LYS A 81 5.344 5.553 7.619 1.00 0.00 C ATOM 1249 C LYS A 81 4.124 4.748 7.185 1.00 0.00 C ATOM 1250 O LYS A 81 2.987 5.122 7.472 1.00 0.00 O ATOM 1251 CB LYS A 81 5.511 5.468 9.138 1.00 0.00 C ATOM 1252 CG LYS A 81 6.740 6.195 9.657 1.00 0.00 C ATOM 1253 CD LYS A 81 6.550 6.657 11.092 1.00 0.00 C ATOM 1254 CE LYS A 81 7.465 7.824 11.427 1.00 0.00 C ATOM 1255 NZ LYS A 81 8.838 7.369 11.783 1.00 0.00 N ATOM 0 H LYS A 81 4.420 7.435 7.593 1.00 0.00 H new ATOM 0 HA LYS A 81 6.226 5.130 7.139 1.00 0.00 H new ATOM 0 HB2 LYS A 81 4.624 5.884 9.616 1.00 0.00 H new ATOM 0 HB3 LYS A 81 5.569 4.420 9.431 1.00 0.00 H new ATOM 0 HG2 LYS A 81 7.606 5.536 9.598 1.00 0.00 H new ATOM 0 HG3 LYS A 81 6.950 7.055 9.022 1.00 0.00 H new ATOM 0 HD2 LYS A 81 5.512 6.951 11.246 1.00 0.00 H new ATOM 0 HD3 LYS A 81 6.751 5.829 11.772 1.00 0.00 H new ATOM 0 HE2 LYS A 81 7.517 8.501 10.574 1.00 0.00 H new ATOM 0 HE3 LYS A 81 7.043 8.389 12.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 9.058 7.660 12.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 8.890 6.333 11.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 9.526 7.796 11.130 1.00 0.00 H new ATOM 1269 N PHE A 82 4.368 3.639 6.494 1.00 0.00 N ATOM 1270 CA PHE A 82 3.288 2.780 6.021 1.00 0.00 C ATOM 1271 C PHE A 82 3.231 1.486 6.826 1.00 0.00 C ATOM 1272 O PHE A 82 4.258 0.968 7.266 1.00 0.00 O ATOM 1273 CB PHE A 82 3.475 2.462 4.536 1.00 0.00 C ATOM 1274 CG PHE A 82 4.762 1.751 4.231 1.00 0.00 C ATOM 1275 CD1 PHE A 82 4.836 0.369 4.292 1.00 0.00 C ATOM 1276 CD2 PHE A 82 5.898 2.465 3.886 1.00 0.00 C ATOM 1277 CE1 PHE A 82 6.019 -0.289 4.013 1.00 0.00 C ATOM 1278 CE2 PHE A 82 7.084 1.812 3.605 1.00 0.00 C ATOM 1279 CZ PHE A 82 7.145 0.434 3.669 1.00 0.00 C ATOM 0 H PHE A 82 5.303 3.314 6.249 1.00 0.00 H new ATOM 0 HA PHE A 82 2.347 3.313 6.156 1.00 0.00 H new ATOM 0 HB2 PHE A 82 2.641 1.848 4.197 1.00 0.00 H new ATOM 0 HB3 PHE A 82 3.439 3.391 3.967 1.00 0.00 H new ATOM 0 HD1 PHE A 82 3.959 -0.201 4.561 1.00 0.00 H new ATOM 0 HD2 PHE A 82 5.857 3.543 3.836 1.00 0.00 H new ATOM 0 HE1 PHE A 82 6.063 -1.367 4.064 1.00 0.00 H new ATOM 0 HE2 PHE A 82 7.962 2.380 3.336 1.00 0.00 H new ATOM 0 HZ PHE A 82 8.071 -0.077 3.451 1.00 0.00 H new ATOM 1289 N LYS A 83 2.023 0.967 7.016 1.00 0.00 N ATOM 1290 CA LYS A 83 1.828 -0.267 7.767 1.00 0.00 C ATOM 1291 C LYS A 83 0.777 -1.150 7.102 1.00 0.00 C ATOM 1292 O LYS A 83 -0.360 -0.727 6.892 1.00 0.00 O ATOM 1293 CB LYS A 83 1.409 0.047 9.205 1.00 0.00 C ATOM 1294 CG LYS A 83 1.512 -1.143 10.143 1.00 0.00 C ATOM 1295 CD LYS A 83 0.252 -1.993 10.105 1.00 0.00 C ATOM 1296 CE LYS A 83 -0.764 -1.530 11.137 1.00 0.00 C ATOM 1297 NZ LYS A 83 -0.295 -1.780 12.528 1.00 0.00 N ATOM 0 H LYS A 83 1.163 1.383 6.659 1.00 0.00 H new ATOM 0 HA LYS A 83 2.775 -0.807 7.780 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.032 0.855 9.588 1.00 0.00 H new ATOM 0 HB3 LYS A 83 0.381 0.410 9.204 1.00 0.00 H new ATOM 0 HG2 LYS A 83 2.372 -1.753 9.866 1.00 0.00 H new ATOM 0 HG3 LYS A 83 1.685 -0.792 11.160 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -0.191 -1.945 9.110 1.00 0.00 H new ATOM 0 HD3 LYS A 83 0.510 -3.036 10.289 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -0.957 -0.465 11.005 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -1.709 -2.048 10.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -1.114 -1.827 13.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 0.224 -2.681 12.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 0.333 -1.007 12.827 1.00 0.00 H new ATOM 1311 N PHE A 84 1.165 -2.378 6.773 1.00 0.00 N ATOM 1312 CA PHE A 84 0.255 -3.320 6.132 1.00 0.00 C ATOM 1313 C PHE A 84 -0.170 -4.415 7.106 1.00 0.00 C ATOM 1314 O PHE A 84 0.645 -4.930 7.872 1.00 0.00 O ATOM 1315 CB PHE A 84 0.918 -3.945 4.903 1.00 0.00 C ATOM 1316 CG PHE A 84 1.684 -2.959 4.068 1.00 0.00 C ATOM 1317 CD1 PHE A 84 1.095 -1.773 3.659 1.00 0.00 C ATOM 1318 CD2 PHE A 84 2.992 -3.219 3.691 1.00 0.00 C ATOM 1319 CE1 PHE A 84 1.797 -0.863 2.891 1.00 0.00 C ATOM 1320 CE2 PHE A 84 3.699 -2.313 2.924 1.00 0.00 C ATOM 1321 CZ PHE A 84 3.100 -1.134 2.522 1.00 0.00 C ATOM 0 H PHE A 84 2.103 -2.744 6.940 1.00 0.00 H new ATOM 0 HA PHE A 84 -0.634 -2.772 5.819 1.00 0.00 H new ATOM 0 HB2 PHE A 84 1.594 -4.736 5.228 1.00 0.00 H new ATOM 0 HB3 PHE A 84 0.152 -4.414 4.286 1.00 0.00 H new ATOM 0 HD1 PHE A 84 0.076 -1.557 3.944 1.00 0.00 H new ATOM 0 HD2 PHE A 84 3.464 -4.140 4.000 1.00 0.00 H new ATOM 0 HE1 PHE A 84 1.327 0.058 2.580 1.00 0.00 H new ATOM 0 HE2 PHE A 84 4.719 -2.526 2.639 1.00 0.00 H new ATOM 0 HZ PHE A 84 3.650 -0.426 1.920 1.00 0.00 H new ATOM 1331 N SER A 85 -1.452 -4.764 7.072 1.00 0.00 N ATOM 1332 CA SER A 85 -1.988 -5.793 7.955 1.00 0.00 C ATOM 1333 C SER A 85 -3.167 -6.509 7.302 1.00 0.00 C ATOM 1334 O SER A 85 -3.557 -6.188 6.180 1.00 0.00 O ATOM 1335 CB SER A 85 -2.424 -5.178 9.286 1.00 0.00 C ATOM 1336 OG SER A 85 -2.333 -6.122 10.339 1.00 0.00 O ATOM 0 H SER A 85 -2.139 -4.349 6.442 1.00 0.00 H new ATOM 0 HA SER A 85 -1.200 -6.523 8.142 1.00 0.00 H new ATOM 0 HB2 SER A 85 -1.799 -4.314 9.513 1.00 0.00 H new ATOM 0 HB3 SER A 85 -3.449 -4.817 9.205 1.00 0.00 H new ATOM 0 HG SER A 85 -3.174 -6.133 10.842 1.00 0.00 H new ATOM 1342 N ILE A 86 -3.728 -7.480 8.014 1.00 0.00 N ATOM 1343 CA ILE A 86 -4.863 -8.241 7.505 1.00 0.00 C ATOM 1344 C ILE A 86 -5.907 -8.466 8.594 1.00 0.00 C ATOM 1345 O ILE A 86 -5.575 -8.836 9.721 1.00 0.00 O ATOM 1346 CB ILE A 86 -4.420 -9.606 6.945 1.00 0.00 C ATOM 1347 CG1 ILE A 86 -3.425 -9.413 5.799 1.00 0.00 C ATOM 1348 CG2 ILE A 86 -5.627 -10.404 6.477 1.00 0.00 C ATOM 1349 CD1 ILE A 86 -2.418 -10.535 5.677 1.00 0.00 C ATOM 0 H ILE A 86 -3.416 -7.759 8.944 1.00 0.00 H new ATOM 0 HA ILE A 86 -5.302 -7.652 6.700 1.00 0.00 H new ATOM 0 HB ILE A 86 -3.926 -10.165 7.740 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -3.975 -9.326 4.862 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -2.893 -8.473 5.945 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.297 -11.366 6.084 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -6.303 -10.567 7.316 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -6.147 -9.852 5.695 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.745 -10.331 4.844 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -1.842 -10.609 6.599 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -2.940 -11.475 5.500 1.00 0.00 H new ATOM 1361 N LEU A 87 -7.170 -8.241 8.249 1.00 0.00 N ATOM 1362 CA LEU A 87 -8.265 -8.421 9.197 1.00 0.00 C ATOM 1363 C LEU A 87 -8.860 -9.820 9.082 1.00 0.00 C ATOM 1364 O LEU A 87 -9.553 -10.134 8.116 1.00 0.00 O ATOM 1365 CB LEU A 87 -9.351 -7.371 8.956 1.00 0.00 C ATOM 1366 CG LEU A 87 -8.961 -5.922 9.250 1.00 0.00 C ATOM 1367 CD1 LEU A 87 -10.175 -5.122 9.695 1.00 0.00 C ATOM 1368 CD2 LEU A 87 -7.867 -5.868 10.307 1.00 0.00 C ATOM 0 H LEU A 87 -7.461 -7.934 7.321 1.00 0.00 H new ATOM 0 HA LEU A 87 -7.866 -8.298 10.204 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.667 -7.437 7.915 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -10.216 -7.625 9.569 1.00 0.00 H new ATOM 0 HG LEU A 87 -8.575 -5.477 8.333 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.878 -4.093 9.900 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -10.927 -5.132 8.906 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -10.592 -5.566 10.599 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -7.602 -4.829 10.504 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.226 -6.331 11.226 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.989 -6.405 9.949 1.00 0.00 H new ATOM 1380 N ASN A 88 -8.585 -10.658 10.077 1.00 0.00 N ATOM 1381 CA ASN A 88 -9.095 -12.024 10.089 1.00 0.00 C ATOM 1382 C ASN A 88 -10.620 -12.035 10.122 1.00 0.00 C ATOM 1383 O ASN A 88 -11.260 -10.986 10.072 1.00 0.00 O ATOM 1384 CB ASN A 88 -8.542 -12.787 11.294 1.00 0.00 C ATOM 1385 CG ASN A 88 -9.143 -12.314 12.604 1.00 0.00 C ATOM 1386 OD1 ASN A 88 -10.077 -11.512 12.617 1.00 0.00 O ATOM 1387 ND2 ASN A 88 -8.609 -12.811 13.714 1.00 0.00 N ATOM 0 H ASN A 88 -8.012 -10.415 10.885 1.00 0.00 H new ATOM 0 HA ASN A 88 -8.765 -12.516 9.174 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -8.742 -13.851 11.169 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -7.459 -12.668 11.330 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -8.972 -12.530 14.625 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -7.836 -13.473 13.656 1.00 0.00 H new ATOM 1394 N ALA A 89 -11.196 -13.230 10.208 1.00 0.00 N ATOM 1395 CA ALA A 89 -12.645 -13.378 10.252 1.00 0.00 C ATOM 1396 C ALA A 89 -13.246 -12.572 11.398 1.00 0.00 C ATOM 1397 O ALA A 89 -14.401 -12.151 11.337 1.00 0.00 O ATOM 1398 CB ALA A 89 -13.022 -14.847 10.382 1.00 0.00 C ATOM 0 H ALA A 89 -10.681 -14.109 10.249 1.00 0.00 H new ATOM 0 HA ALA A 89 -13.053 -12.991 9.318 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -14.107 -14.943 10.414 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -12.634 -15.399 9.526 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -12.595 -15.252 11.299 1.00 0.00 H new ATOM 1404 N LYS A 90 -12.455 -12.361 12.445 1.00 0.00 N ATOM 1405 CA LYS A 90 -12.907 -11.605 13.606 1.00 0.00 C ATOM 1406 C LYS A 90 -12.574 -10.124 13.455 1.00 0.00 C ATOM 1407 O LYS A 90 -12.643 -9.361 14.418 1.00 0.00 O ATOM 1408 CB LYS A 90 -12.264 -12.156 14.881 1.00 0.00 C ATOM 1409 CG LYS A 90 -12.804 -13.513 15.297 1.00 0.00 C ATOM 1410 CD LYS A 90 -12.159 -14.637 14.504 1.00 0.00 C ATOM 1411 CE LYS A 90 -13.049 -15.870 14.458 1.00 0.00 C ATOM 1412 NZ LYS A 90 -13.152 -16.529 15.789 1.00 0.00 N ATOM 0 H LYS A 90 -11.497 -12.704 12.513 1.00 0.00 H new ATOM 0 HA LYS A 90 -13.990 -11.710 13.677 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -11.187 -12.233 14.731 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -12.422 -11.447 15.693 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -12.623 -13.667 16.361 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -13.884 -13.536 15.150 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -11.955 -14.297 13.489 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -11.200 -14.896 14.952 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -14.044 -15.587 14.115 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -12.651 -16.579 13.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -13.767 -17.365 15.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -12.206 -16.822 16.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -13.556 -15.861 16.477 1.00 0.00 H new ATOM 1426 N GLY A 91 -12.214 -9.724 12.239 1.00 0.00 N ATOM 1427 CA GLY A 91 -11.877 -8.336 11.985 1.00 0.00 C ATOM 1428 C GLY A 91 -10.768 -7.834 12.888 1.00 0.00 C ATOM 1429 O GLY A 91 -10.740 -6.658 13.251 1.00 0.00 O ATOM 0 H GLY A 91 -12.150 -10.336 11.426 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -11.573 -8.224 10.944 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -12.764 -7.718 12.126 1.00 0.00 H new ATOM 1433 N GLU A 92 -9.853 -8.727 13.252 1.00 0.00 N ATOM 1434 CA GLU A 92 -8.738 -8.367 14.120 1.00 0.00 C ATOM 1435 C GLU A 92 -7.422 -8.373 13.347 1.00 0.00 C ATOM 1436 O GLU A 92 -7.029 -9.392 12.781 1.00 0.00 O ATOM 1437 CB GLU A 92 -8.652 -9.332 15.304 1.00 0.00 C ATOM 1438 CG GLU A 92 -9.900 -9.346 16.170 1.00 0.00 C ATOM 1439 CD GLU A 92 -9.628 -9.839 17.578 1.00 0.00 C ATOM 1440 OE1 GLU A 92 -9.452 -11.063 17.753 1.00 0.00 O ATOM 1441 OE2 GLU A 92 -9.592 -9.003 18.504 1.00 0.00 O ATOM 0 H GLU A 92 -9.862 -9.704 12.960 1.00 0.00 H new ATOM 0 HA GLU A 92 -8.914 -7.359 14.495 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -8.469 -10.339 14.929 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -7.795 -9.061 15.921 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -10.317 -8.340 16.216 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -10.653 -9.983 15.705 1.00 0.00 H new ATOM 1448 N GLU A 93 -6.747 -7.228 13.330 1.00 0.00 N ATOM 1449 CA GLU A 93 -5.476 -7.102 12.626 1.00 0.00 C ATOM 1450 C GLU A 93 -4.592 -8.321 12.876 1.00 0.00 C ATOM 1451 O GLU A 93 -4.469 -8.791 14.008 1.00 0.00 O ATOM 1452 CB GLU A 93 -4.748 -5.831 13.066 1.00 0.00 C ATOM 1453 CG GLU A 93 -5.174 -4.589 12.300 1.00 0.00 C ATOM 1454 CD GLU A 93 -5.001 -3.318 13.108 1.00 0.00 C ATOM 1455 OE1 GLU A 93 -3.884 -2.760 13.107 1.00 0.00 O ATOM 1456 OE2 GLU A 93 -5.985 -2.880 13.741 1.00 0.00 O ATOM 0 H GLU A 93 -7.059 -6.375 13.795 1.00 0.00 H new ATOM 0 HA GLU A 93 -5.686 -7.040 11.558 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -4.925 -5.670 14.129 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -3.675 -5.975 12.940 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.590 -4.514 11.383 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -6.219 -4.689 12.006 1.00 0.00 H new ATOM 1463 N THR A 94 -3.978 -8.828 11.812 1.00 0.00 N ATOM 1464 CA THR A 94 -3.107 -9.992 11.915 1.00 0.00 C ATOM 1465 C THR A 94 -2.025 -9.966 10.841 1.00 0.00 C ATOM 1466 O THR A 94 -2.242 -9.460 9.739 1.00 0.00 O ATOM 1467 CB THR A 94 -3.905 -11.304 11.792 1.00 0.00 C ATOM 1468 OG1 THR A 94 -3.118 -12.402 12.265 1.00 0.00 O ATOM 1469 CG2 THR A 94 -4.318 -11.553 10.349 1.00 0.00 C ATOM 0 H THR A 94 -4.068 -8.451 10.869 1.00 0.00 H new ATOM 0 HA THR A 94 -2.640 -9.951 12.899 1.00 0.00 H new ATOM 0 HB THR A 94 -4.805 -11.215 12.400 1.00 0.00 H new ATOM 0 HG1 THR A 94 -3.633 -13.232 12.185 1.00 0.00 H new ATOM 0 HG21 THR A 94 -4.880 -12.485 10.287 1.00 0.00 H new ATOM 0 HG22 THR A 94 -4.942 -10.729 10.002 1.00 0.00 H new ATOM 0 HG23 THR A 94 -3.429 -11.624 9.723 1.00 0.00 H new ATOM 1477 N LYS A 95 -0.860 -10.515 11.168 1.00 0.00 N ATOM 1478 CA LYS A 95 0.256 -10.557 10.230 1.00 0.00 C ATOM 1479 C LYS A 95 0.592 -9.159 9.721 1.00 0.00 C ATOM 1480 O LYS A 95 0.865 -8.969 8.536 1.00 0.00 O ATOM 1481 CB LYS A 95 -0.076 -11.474 9.051 1.00 0.00 C ATOM 1482 CG LYS A 95 -0.671 -12.808 9.468 1.00 0.00 C ATOM 1483 CD LYS A 95 0.282 -13.591 10.357 1.00 0.00 C ATOM 1484 CE LYS A 95 -0.142 -15.046 10.482 1.00 0.00 C ATOM 1485 NZ LYS A 95 -1.125 -15.246 11.582 1.00 0.00 N ATOM 0 H LYS A 95 -0.664 -10.937 12.076 1.00 0.00 H new ATOM 0 HA LYS A 95 1.125 -10.952 10.756 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -0.777 -10.964 8.390 1.00 0.00 H new ATOM 0 HB3 LYS A 95 0.832 -11.654 8.475 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -1.609 -12.639 9.998 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -0.907 -13.395 8.581 1.00 0.00 H new ATOM 0 HD2 LYS A 95 1.290 -13.539 9.946 1.00 0.00 H new ATOM 0 HD3 LYS A 95 0.317 -13.135 11.346 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -0.578 -15.379 9.540 1.00 0.00 H new ATOM 0 HE3 LYS A 95 0.736 -15.666 10.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -1.730 -16.063 11.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -0.618 -15.419 12.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -1.715 -14.395 11.679 1.00 0.00 H new ATOM 1499 N ALA A 96 0.570 -8.184 10.624 1.00 0.00 N ATOM 1500 CA ALA A 96 0.876 -6.804 10.266 1.00 0.00 C ATOM 1501 C ALA A 96 2.380 -6.554 10.278 1.00 0.00 C ATOM 1502 O ALA A 96 3.126 -7.238 10.978 1.00 0.00 O ATOM 1503 CB ALA A 96 0.172 -5.845 11.214 1.00 0.00 C ATOM 0 H ALA A 96 0.344 -8.324 11.609 1.00 0.00 H new ATOM 0 HA ALA A 96 0.513 -6.628 9.253 1.00 0.00 H new ATOM 0 HB1 ALA A 96 0.409 -4.818 10.935 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -0.905 -5.998 11.153 1.00 0.00 H new ATOM 0 HB3 ALA A 96 0.507 -6.031 12.234 1.00 0.00 H new ATOM 1509 N MET A 97 2.818 -5.571 9.499 1.00 0.00 N ATOM 1510 CA MET A 97 4.234 -5.231 9.421 1.00 0.00 C ATOM 1511 C MET A 97 4.424 -3.724 9.275 1.00 0.00 C ATOM 1512 O MET A 97 4.032 -3.136 8.268 1.00 0.00 O ATOM 1513 CB MET A 97 4.890 -5.956 8.245 1.00 0.00 C ATOM 1514 CG MET A 97 4.731 -7.467 8.297 1.00 0.00 C ATOM 1515 SD MET A 97 6.048 -8.334 7.423 1.00 0.00 S ATOM 1516 CE MET A 97 6.321 -7.230 6.039 1.00 0.00 C ATOM 0 H MET A 97 2.213 -4.996 8.913 1.00 0.00 H new ATOM 0 HA MET A 97 4.711 -5.551 10.347 1.00 0.00 H new ATOM 0 HB2 MET A 97 4.460 -5.585 7.315 1.00 0.00 H new ATOM 0 HB3 MET A 97 5.952 -5.711 8.225 1.00 0.00 H new ATOM 0 HG2 MET A 97 4.716 -7.791 9.338 1.00 0.00 H new ATOM 0 HG3 MET A 97 3.770 -7.742 7.863 1.00 0.00 H new ATOM 0 HE1 MET A 97 6.889 -7.749 5.266 1.00 0.00 H new ATOM 0 HE2 MET A 97 5.361 -6.912 5.632 1.00 0.00 H new ATOM 0 HE3 MET A 97 6.880 -6.356 6.375 1.00 0.00 H new ATOM 1526 N GLU A 98 5.027 -3.108 10.287 1.00 0.00 N ATOM 1527 CA GLU A 98 5.268 -1.670 10.270 1.00 0.00 C ATOM 1528 C GLU A 98 6.760 -1.369 10.167 1.00 0.00 C ATOM 1529 O GLU A 98 7.595 -2.267 10.278 1.00 0.00 O ATOM 1530 CB GLU A 98 4.691 -1.019 11.529 1.00 0.00 C ATOM 1531 CG GLU A 98 4.723 -1.922 12.750 1.00 0.00 C ATOM 1532 CD GLU A 98 4.634 -1.147 14.051 1.00 0.00 C ATOM 1533 OE1 GLU A 98 5.272 -0.079 14.151 1.00 0.00 O ATOM 1534 OE2 GLU A 98 3.925 -1.610 14.969 1.00 0.00 O ATOM 0 H GLU A 98 5.357 -3.582 11.128 1.00 0.00 H new ATOM 0 HA GLU A 98 4.770 -1.255 9.394 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.250 -0.109 11.746 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.661 -0.722 11.334 1.00 0.00 H new ATOM 0 HG2 GLU A 98 3.896 -2.630 12.696 1.00 0.00 H new ATOM 0 HG3 GLU A 98 5.643 -2.506 12.741 1.00 0.00 H new ATOM 1541 N SER A 99 7.088 -0.098 9.954 1.00 0.00 N ATOM 1542 CA SER A 99 8.479 0.322 9.831 1.00 0.00 C ATOM 1543 C SER A 99 8.862 1.270 10.963 1.00 0.00 C ATOM 1544 O SER A 99 8.066 2.112 11.377 1.00 0.00 O ATOM 1545 CB SER A 99 8.712 1.001 8.481 1.00 0.00 C ATOM 1546 OG SER A 99 10.094 1.062 8.171 1.00 0.00 O ATOM 0 H SER A 99 6.409 0.658 9.863 1.00 0.00 H new ATOM 0 HA SER A 99 9.108 -0.566 9.896 1.00 0.00 H new ATOM 0 HB2 SER A 99 8.185 0.454 7.700 1.00 0.00 H new ATOM 0 HB3 SER A 99 8.296 2.008 8.501 1.00 0.00 H new ATOM 0 HG SER A 99 10.210 1.398 7.258 1.00 0.00 H new ATOM 1552 N GLN A 100 10.087 1.126 11.459 1.00 0.00 N ATOM 1553 CA GLN A 100 10.575 1.969 12.544 1.00 0.00 C ATOM 1554 C GLN A 100 10.488 3.444 12.168 1.00 0.00 C ATOM 1555 O GLN A 100 9.689 4.192 12.732 1.00 0.00 O ATOM 1556 CB GLN A 100 12.020 1.604 12.891 1.00 0.00 C ATOM 1557 CG GLN A 100 12.439 2.039 14.286 1.00 0.00 C ATOM 1558 CD GLN A 100 13.940 2.199 14.421 1.00 0.00 C ATOM 1559 OE1 GLN A 100 14.488 3.271 14.161 1.00 0.00 O ATOM 1560 NE2 GLN A 100 14.615 1.131 14.829 1.00 0.00 N ATOM 0 H GLN A 100 10.759 0.434 11.127 1.00 0.00 H new ATOM 0 HA GLN A 100 9.944 1.797 13.416 1.00 0.00 H new ATOM 0 HB2 GLN A 100 12.144 0.525 12.803 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.687 2.062 12.161 1.00 0.00 H new ATOM 0 HG2 GLN A 100 11.953 2.984 14.529 1.00 0.00 H new ATOM 0 HG3 GLN A 100 12.089 1.305 15.012 1.00 0.00 H new ATOM 0 HE21 GLN A 100 14.121 0.263 15.033 1.00 0.00 H new ATOM 0 HE22 GLN A 100 15.628 1.179 14.938 1.00 0.00 H new ATOM 1569 N ARG A 101 11.315 3.857 11.213 1.00 0.00 N ATOM 1570 CA ARG A 101 11.333 5.243 10.763 1.00 0.00 C ATOM 1571 C ARG A 101 10.584 5.396 9.442 1.00 0.00 C ATOM 1572 O ARG A 101 10.217 4.407 8.808 1.00 0.00 O ATOM 1573 CB ARG A 101 12.773 5.732 10.604 1.00 0.00 C ATOM 1574 CG ARG A 101 13.400 6.213 11.903 1.00 0.00 C ATOM 1575 CD ARG A 101 12.887 7.590 12.293 1.00 0.00 C ATOM 1576 NE ARG A 101 13.084 7.866 13.714 1.00 0.00 N ATOM 1577 CZ ARG A 101 12.477 8.854 14.362 1.00 0.00 C ATOM 1578 NH1 ARG A 101 11.639 9.656 13.720 1.00 0.00 N ATOM 1579 NH2 ARG A 101 12.708 9.041 15.655 1.00 0.00 N ATOM 0 H ARG A 101 11.982 3.250 10.736 1.00 0.00 H new ATOM 0 HA ARG A 101 10.832 5.849 11.518 1.00 0.00 H new ATOM 0 HB2 ARG A 101 13.379 4.924 10.195 1.00 0.00 H new ATOM 0 HB3 ARG A 101 12.794 6.544 9.878 1.00 0.00 H new ATOM 0 HG2 ARG A 101 13.180 5.502 12.700 1.00 0.00 H new ATOM 0 HG3 ARG A 101 14.484 6.245 11.795 1.00 0.00 H new ATOM 0 HD2 ARG A 101 13.400 8.349 11.702 1.00 0.00 H new ATOM 0 HD3 ARG A 101 11.826 7.663 12.053 1.00 0.00 H new ATOM 0 HE ARG A 101 13.723 7.267 14.237 1.00 0.00 H new ATOM 0 HH11 ARG A 101 11.459 9.515 12.726 1.00 0.00 H new ATOM 0 HH12 ARG A 101 11.174 10.414 14.220 1.00 0.00 H new ATOM 0 HH21 ARG A 101 13.352 8.426 16.152 1.00 0.00 H new ATOM 0 HH22 ARG A 101 12.242 9.800 16.152 1.00 0.00 H new ATOM 1593 N ALA A 102 10.361 6.641 9.035 1.00 0.00 N ATOM 1594 CA ALA A 102 9.658 6.923 7.789 1.00 0.00 C ATOM 1595 C ALA A 102 10.586 6.772 6.589 1.00 0.00 C ATOM 1596 O ALA A 102 11.808 6.745 6.736 1.00 0.00 O ATOM 1597 CB ALA A 102 9.061 8.322 7.825 1.00 0.00 C ATOM 0 H ALA A 102 10.657 7.471 9.550 1.00 0.00 H new ATOM 0 HA ALA A 102 8.851 6.198 7.684 1.00 0.00 H new ATOM 0 HB1 ALA A 102 8.539 8.519 6.889 1.00 0.00 H new ATOM 0 HB2 ALA A 102 8.358 8.396 8.655 1.00 0.00 H new ATOM 0 HB3 ALA A 102 9.858 9.054 7.958 1.00 0.00 H new ATOM 1603 N TYR A 103 9.998 6.673 5.402 1.00 0.00 N ATOM 1604 CA TYR A 103 10.772 6.521 4.176 1.00 0.00 C ATOM 1605 C TYR A 103 10.483 7.662 3.204 1.00 0.00 C ATOM 1606 O TYR A 103 9.408 8.260 3.234 1.00 0.00 O ATOM 1607 CB TYR A 103 10.458 5.179 3.512 1.00 0.00 C ATOM 1608 CG TYR A 103 11.139 4.003 4.174 1.00 0.00 C ATOM 1609 CD1 TYR A 103 10.998 3.771 5.537 1.00 0.00 C ATOM 1610 CD2 TYR A 103 11.922 3.123 3.438 1.00 0.00 C ATOM 1611 CE1 TYR A 103 11.618 2.698 6.147 1.00 0.00 C ATOM 1612 CE2 TYR A 103 12.544 2.046 4.039 1.00 0.00 C ATOM 1613 CZ TYR A 103 12.390 1.838 5.394 1.00 0.00 C ATOM 1614 OH TYR A 103 13.009 0.767 5.996 1.00 0.00 O ATOM 0 H TYR A 103 8.988 6.695 5.263 1.00 0.00 H new ATOM 0 HA TYR A 103 11.829 6.550 4.439 1.00 0.00 H new ATOM 0 HB2 TYR A 103 9.380 5.019 3.526 1.00 0.00 H new ATOM 0 HB3 TYR A 103 10.760 5.221 2.466 1.00 0.00 H new ATOM 0 HD1 TYR A 103 10.393 4.441 6.130 1.00 0.00 H new ATOM 0 HD2 TYR A 103 12.047 3.284 2.377 1.00 0.00 H new ATOM 0 HE1 TYR A 103 11.499 2.533 7.208 1.00 0.00 H new ATOM 0 HE2 TYR A 103 13.148 1.370 3.451 1.00 0.00 H new ATOM 0 HH TYR A 103 13.513 0.261 5.325 1.00 0.00 H new ATOM 1624 N ARG A 104 11.452 7.956 2.343 1.00 0.00 N ATOM 1625 CA ARG A 104 11.303 9.025 1.362 1.00 0.00 C ATOM 1626 C ARG A 104 10.371 8.600 0.232 1.00 0.00 C ATOM 1627 O ARG A 104 10.528 7.524 -0.345 1.00 0.00 O ATOM 1628 CB ARG A 104 12.668 9.416 0.792 1.00 0.00 C ATOM 1629 CG ARG A 104 12.674 10.771 0.104 1.00 0.00 C ATOM 1630 CD ARG A 104 13.038 11.886 1.071 1.00 0.00 C ATOM 1631 NE ARG A 104 14.475 12.148 1.090 1.00 0.00 N ATOM 1632 CZ ARG A 104 15.063 12.958 1.963 1.00 0.00 C ATOM 1633 NH1 ARG A 104 14.341 13.582 2.883 1.00 0.00 N ATOM 1634 NH2 ARG A 104 16.376 13.145 1.916 1.00 0.00 N ATOM 0 H ARG A 104 12.348 7.470 2.305 1.00 0.00 H new ATOM 0 HA ARG A 104 10.866 9.888 1.865 1.00 0.00 H new ATOM 0 HB2 ARG A 104 13.401 9.424 1.599 1.00 0.00 H new ATOM 0 HB3 ARG A 104 12.987 8.655 0.080 1.00 0.00 H new ATOM 0 HG2 ARG A 104 13.385 10.758 -0.722 1.00 0.00 H new ATOM 0 HG3 ARG A 104 11.691 10.967 -0.325 1.00 0.00 H new ATOM 0 HD2 ARG A 104 12.507 12.796 0.791 1.00 0.00 H new ATOM 0 HD3 ARG A 104 12.705 11.619 2.074 1.00 0.00 H new ATOM 0 HE ARG A 104 15.059 11.683 0.395 1.00 0.00 H new ATOM 0 HH11 ARG A 104 13.332 13.441 2.922 1.00 0.00 H new ATOM 0 HH12 ARG A 104 14.795 14.204 3.552 1.00 0.00 H new ATOM 0 HH21 ARG A 104 16.934 12.667 1.209 1.00 0.00 H new ATOM 0 HH22 ARG A 104 16.827 13.767 2.587 1.00 0.00 H new ATOM 1648 N PHE A 105 9.399 9.451 -0.079 1.00 0.00 N ATOM 1649 CA PHE A 105 8.440 9.163 -1.139 1.00 0.00 C ATOM 1650 C PHE A 105 8.496 10.231 -2.228 1.00 0.00 C ATOM 1651 O PHE A 105 8.557 11.426 -1.939 1.00 0.00 O ATOM 1652 CB PHE A 105 7.024 9.077 -0.565 1.00 0.00 C ATOM 1653 CG PHE A 105 6.754 7.800 0.177 1.00 0.00 C ATOM 1654 CD1 PHE A 105 6.986 6.572 -0.424 1.00 0.00 C ATOM 1655 CD2 PHE A 105 6.268 7.826 1.474 1.00 0.00 C ATOM 1656 CE1 PHE A 105 6.739 5.395 0.256 1.00 0.00 C ATOM 1657 CE2 PHE A 105 6.019 6.651 2.159 1.00 0.00 C ATOM 1658 CZ PHE A 105 6.254 5.434 1.549 1.00 0.00 C ATOM 0 H PHE A 105 9.255 10.346 0.388 1.00 0.00 H new ATOM 0 HA PHE A 105 8.704 8.203 -1.583 1.00 0.00 H new ATOM 0 HB2 PHE A 105 6.861 9.920 0.107 1.00 0.00 H new ATOM 0 HB3 PHE A 105 6.305 9.174 -1.378 1.00 0.00 H new ATOM 0 HD1 PHE A 105 7.364 6.535 -1.435 1.00 0.00 H new ATOM 0 HD2 PHE A 105 6.082 8.775 1.955 1.00 0.00 H new ATOM 0 HE1 PHE A 105 6.925 4.445 -0.223 1.00 0.00 H new ATOM 0 HE2 PHE A 105 5.641 6.685 3.170 1.00 0.00 H new ATOM 0 HZ PHE A 105 6.059 4.515 2.082 1.00 0.00 H new ATOM 1668 N VAL A 106 8.475 9.790 -3.482 1.00 0.00 N ATOM 1669 CA VAL A 106 8.523 10.706 -4.615 1.00 0.00 C ATOM 1670 C VAL A 106 7.640 10.215 -5.756 1.00 0.00 C ATOM 1671 O VAL A 106 7.526 9.012 -5.992 1.00 0.00 O ATOM 1672 CB VAL A 106 9.963 10.883 -5.133 1.00 0.00 C ATOM 1673 CG1 VAL A 106 10.884 11.330 -4.008 1.00 0.00 C ATOM 1674 CG2 VAL A 106 10.464 9.592 -5.763 1.00 0.00 C ATOM 0 H VAL A 106 8.425 8.804 -3.739 1.00 0.00 H new ATOM 0 HA VAL A 106 8.152 11.668 -4.261 1.00 0.00 H new ATOM 0 HB VAL A 106 9.963 11.658 -5.899 1.00 0.00 H new ATOM 0 HG11 VAL A 106 11.897 11.450 -4.393 1.00 0.00 H new ATOM 0 HG12 VAL A 106 10.533 12.281 -3.607 1.00 0.00 H new ATOM 0 HG13 VAL A 106 10.883 10.580 -3.217 1.00 0.00 H new ATOM 0 HG21 VAL A 106 11.483 9.735 -6.124 1.00 0.00 H new ATOM 0 HG22 VAL A 106 10.451 8.795 -5.019 1.00 0.00 H new ATOM 0 HG23 VAL A 106 9.818 9.320 -6.598 1.00 0.00 H new ATOM 1684 N GLN A 107 7.018 11.154 -6.462 1.00 0.00 N ATOM 1685 CA GLN A 107 6.145 10.816 -7.580 1.00 0.00 C ATOM 1686 C GLN A 107 6.718 9.654 -8.386 1.00 0.00 C ATOM 1687 O GLN A 107 7.513 9.855 -9.303 1.00 0.00 O ATOM 1688 CB GLN A 107 5.947 12.032 -8.486 1.00 0.00 C ATOM 1689 CG GLN A 107 4.669 11.977 -9.307 1.00 0.00 C ATOM 1690 CD GLN A 107 4.761 12.786 -10.586 1.00 0.00 C ATOM 1691 OE1 GLN A 107 5.832 13.272 -10.951 1.00 0.00 O ATOM 1692 NE2 GLN A 107 3.636 12.935 -11.275 1.00 0.00 N ATOM 0 H GLN A 107 7.102 12.154 -6.280 1.00 0.00 H new ATOM 0 HA GLN A 107 5.179 10.513 -7.175 1.00 0.00 H new ATOM 0 HB2 GLN A 107 5.937 12.933 -7.873 1.00 0.00 H new ATOM 0 HB3 GLN A 107 6.799 12.115 -9.161 1.00 0.00 H new ATOM 0 HG2 GLN A 107 4.445 10.939 -9.554 1.00 0.00 H new ATOM 0 HG3 GLN A 107 3.839 12.348 -8.706 1.00 0.00 H new ATOM 0 HE21 GLN A 107 2.771 12.515 -10.936 1.00 0.00 H new ATOM 0 HE22 GLN A 107 3.637 13.469 -12.144 1.00 0.00 H new ATOM 1701 N GLY A 108 6.307 8.439 -8.038 1.00 0.00 N ATOM 1702 CA GLY A 108 6.790 7.263 -8.739 1.00 0.00 C ATOM 1703 C GLY A 108 7.686 6.399 -7.873 1.00 0.00 C ATOM 1704 O GLY A 108 8.480 5.608 -8.383 1.00 0.00 O ATOM 0 H GLY A 108 5.648 8.247 -7.283 1.00 0.00 H new ATOM 0 HA2 GLY A 108 5.940 6.672 -9.080 1.00 0.00 H new ATOM 0 HA3 GLY A 108 7.339 7.574 -9.628 1.00 0.00 H new ATOM 1708 N LYS A 109 7.560 6.550 -6.559 1.00 0.00 N ATOM 1709 CA LYS A 109 8.364 5.778 -5.619 1.00 0.00 C ATOM 1710 C LYS A 109 7.525 4.698 -4.944 1.00 0.00 C ATOM 1711 O LYS A 109 6.337 4.893 -4.685 1.00 0.00 O ATOM 1712 CB LYS A 109 8.975 6.700 -4.561 1.00 0.00 C ATOM 1713 CG LYS A 109 10.253 6.158 -3.947 1.00 0.00 C ATOM 1714 CD LYS A 109 11.350 6.002 -4.987 1.00 0.00 C ATOM 1715 CE LYS A 109 12.725 5.924 -4.341 1.00 0.00 C ATOM 1716 NZ LYS A 109 13.817 6.063 -5.343 1.00 0.00 N ATOM 0 H LYS A 109 6.908 7.201 -6.121 1.00 0.00 H new ATOM 0 HA LYS A 109 9.166 5.294 -6.177 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.182 7.670 -5.013 1.00 0.00 H new ATOM 0 HB3 LYS A 109 8.244 6.866 -3.770 1.00 0.00 H new ATOM 0 HG2 LYS A 109 10.592 6.829 -3.158 1.00 0.00 H new ATOM 0 HG3 LYS A 109 10.053 5.193 -3.481 1.00 0.00 H new ATOM 0 HD2 LYS A 109 11.171 5.101 -5.574 1.00 0.00 H new ATOM 0 HD3 LYS A 109 11.319 6.844 -5.679 1.00 0.00 H new ATOM 0 HE2 LYS A 109 12.819 6.709 -3.591 1.00 0.00 H new ATOM 0 HE3 LYS A 109 12.828 4.972 -3.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 14.738 6.005 -4.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 13.743 5.299 -6.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 13.734 6.983 -5.822 1.00 0.00 H new ATOM 1730 N ASP A 110 8.150 3.560 -4.662 1.00 0.00 N ATOM 1731 CA ASP A 110 7.461 2.450 -4.014 1.00 0.00 C ATOM 1732 C ASP A 110 8.322 1.846 -2.909 1.00 0.00 C ATOM 1733 O ASP A 110 9.466 1.457 -3.142 1.00 0.00 O ATOM 1734 CB ASP A 110 7.102 1.375 -5.042 1.00 0.00 C ATOM 1735 CG ASP A 110 8.195 1.172 -6.072 1.00 0.00 C ATOM 1736 OD1 ASP A 110 8.358 2.049 -6.946 1.00 0.00 O ATOM 1737 OD2 ASP A 110 8.888 0.135 -6.005 1.00 0.00 O ATOM 0 H ASP A 110 9.132 3.382 -4.872 1.00 0.00 H new ATOM 0 HA ASP A 110 6.545 2.835 -3.567 1.00 0.00 H new ATOM 0 HB2 ASP A 110 6.912 0.433 -4.527 1.00 0.00 H new ATOM 0 HB3 ASP A 110 6.177 1.654 -5.548 1.00 0.00 H new ATOM 1742 N TRP A 111 7.764 1.774 -1.706 1.00 0.00 N ATOM 1743 CA TRP A 111 8.482 1.219 -0.563 1.00 0.00 C ATOM 1744 C TRP A 111 7.610 0.224 0.196 1.00 0.00 C ATOM 1745 O TRP A 111 6.433 0.481 0.446 1.00 0.00 O ATOM 1746 CB TRP A 111 8.935 2.339 0.374 1.00 0.00 C ATOM 1747 CG TRP A 111 10.105 3.115 -0.150 1.00 0.00 C ATOM 1748 CD1 TRP A 111 10.077 4.357 -0.718 1.00 0.00 C ATOM 1749 CD2 TRP A 111 11.475 2.700 -0.156 1.00 0.00 C ATOM 1750 NE1 TRP A 111 11.347 4.739 -1.076 1.00 0.00 N ATOM 1751 CE2 TRP A 111 12.223 3.740 -0.741 1.00 0.00 C ATOM 1752 CE3 TRP A 111 12.143 1.552 0.279 1.00 0.00 C ATOM 1753 CZ2 TRP A 111 13.604 3.664 -0.903 1.00 0.00 C ATOM 1754 CZ3 TRP A 111 13.513 1.478 0.117 1.00 0.00 C ATOM 1755 CH2 TRP A 111 14.232 2.528 -0.470 1.00 0.00 C ATOM 0 H TRP A 111 6.818 2.092 -1.496 1.00 0.00 H new ATOM 0 HA TRP A 111 9.360 0.692 -0.937 1.00 0.00 H new ATOM 0 HB2 TRP A 111 8.102 3.021 0.542 1.00 0.00 H new ATOM 0 HB3 TRP A 111 9.196 1.910 1.341 1.00 0.00 H new ATOM 0 HD1 TRP A 111 9.187 4.951 -0.864 1.00 0.00 H new ATOM 0 HE1 TRP A 111 11.597 5.623 -1.519 1.00 0.00 H new ATOM 0 HE3 TRP A 111 11.598 0.738 0.733 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 14.160 4.473 -1.354 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 14.039 0.595 0.449 1.00 0.00 H new ATOM 0 HH2 TRP A 111 15.302 2.439 -0.583 1.00 0.00 H new ATOM 1766 N GLY A 112 8.197 -0.912 0.562 1.00 0.00 N ATOM 1767 CA GLY A 112 7.458 -1.927 1.290 1.00 0.00 C ATOM 1768 C GLY A 112 8.242 -3.215 1.445 1.00 0.00 C ATOM 1769 O GLY A 112 9.471 -3.197 1.518 1.00 0.00 O ATOM 0 H GLY A 112 9.170 -1.147 0.367 1.00 0.00 H new ATOM 0 HA2 GLY A 112 7.196 -1.544 2.276 1.00 0.00 H new ATOM 0 HA3 GLY A 112 6.523 -2.135 0.770 1.00 0.00 H new ATOM 1773 N PHE A 113 7.530 -4.336 1.496 1.00 0.00 N ATOM 1774 CA PHE A 113 8.167 -5.639 1.646 1.00 0.00 C ATOM 1775 C PHE A 113 7.778 -6.570 0.501 1.00 0.00 C ATOM 1776 O PHE A 113 6.727 -6.406 -0.118 1.00 0.00 O ATOM 1777 CB PHE A 113 7.777 -6.270 2.985 1.00 0.00 C ATOM 1778 CG PHE A 113 7.913 -5.333 4.151 1.00 0.00 C ATOM 1779 CD1 PHE A 113 6.901 -4.437 4.458 1.00 0.00 C ATOM 1780 CD2 PHE A 113 9.052 -5.347 4.940 1.00 0.00 C ATOM 1781 CE1 PHE A 113 7.023 -3.573 5.530 1.00 0.00 C ATOM 1782 CE2 PHE A 113 9.180 -4.486 6.013 1.00 0.00 C ATOM 1783 CZ PHE A 113 8.163 -3.598 6.309 1.00 0.00 C ATOM 0 H PHE A 113 6.512 -4.368 1.436 1.00 0.00 H new ATOM 0 HA PHE A 113 9.247 -5.492 1.621 1.00 0.00 H new ATOM 0 HB2 PHE A 113 6.746 -6.618 2.927 1.00 0.00 H new ATOM 0 HB3 PHE A 113 8.400 -7.147 3.159 1.00 0.00 H new ATOM 0 HD1 PHE A 113 6.007 -4.414 3.853 1.00 0.00 H new ATOM 0 HD2 PHE A 113 9.849 -6.039 4.713 1.00 0.00 H new ATOM 0 HE1 PHE A 113 6.228 -2.879 5.758 1.00 0.00 H new ATOM 0 HE2 PHE A 113 10.073 -4.507 6.620 1.00 0.00 H new ATOM 0 HZ PHE A 113 8.260 -2.925 7.148 1.00 0.00 H new ATOM 1793 N LYS A 114 8.635 -7.547 0.224 1.00 0.00 N ATOM 1794 CA LYS A 114 8.383 -8.505 -0.846 1.00 0.00 C ATOM 1795 C LYS A 114 7.449 -9.614 -0.374 1.00 0.00 C ATOM 1796 O LYS A 114 6.405 -9.861 -0.980 1.00 0.00 O ATOM 1797 CB LYS A 114 9.701 -9.109 -1.338 1.00 0.00 C ATOM 1798 CG LYS A 114 9.665 -9.542 -2.794 1.00 0.00 C ATOM 1799 CD LYS A 114 11.064 -9.654 -3.376 1.00 0.00 C ATOM 1800 CE LYS A 114 11.041 -10.263 -4.770 1.00 0.00 C ATOM 1801 NZ LYS A 114 12.251 -9.896 -5.556 1.00 0.00 N ATOM 0 H LYS A 114 9.510 -7.696 0.726 1.00 0.00 H new ATOM 0 HA LYS A 114 7.903 -7.975 -1.669 1.00 0.00 H new ATOM 0 HB2 LYS A 114 10.498 -8.378 -1.205 1.00 0.00 H new ATOM 0 HB3 LYS A 114 9.951 -9.970 -0.718 1.00 0.00 H new ATOM 0 HG2 LYS A 114 9.157 -10.503 -2.876 1.00 0.00 H new ATOM 0 HG3 LYS A 114 9.085 -8.824 -3.374 1.00 0.00 H new ATOM 0 HD2 LYS A 114 11.522 -8.666 -3.417 1.00 0.00 H new ATOM 0 HD3 LYS A 114 11.684 -10.266 -2.721 1.00 0.00 H new ATOM 0 HE2 LYS A 114 10.975 -11.348 -4.691 1.00 0.00 H new ATOM 0 HE3 LYS A 114 10.149 -9.927 -5.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 12.065 -10.043 -6.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 12.484 -8.896 -5.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 13.051 -10.492 -5.261 1.00 0.00 H new ATOM 1815 N LYS A 115 7.828 -10.280 0.711 1.00 0.00 N ATOM 1816 CA LYS A 115 7.023 -11.361 1.267 1.00 0.00 C ATOM 1817 C LYS A 115 6.232 -10.882 2.480 1.00 0.00 C ATOM 1818 O LYS A 115 6.731 -10.899 3.605 1.00 0.00 O ATOM 1819 CB LYS A 115 7.916 -12.540 1.660 1.00 0.00 C ATOM 1820 CG LYS A 115 8.590 -13.214 0.477 1.00 0.00 C ATOM 1821 CD LYS A 115 9.893 -13.881 0.883 1.00 0.00 C ATOM 1822 CE LYS A 115 10.581 -14.531 -0.307 1.00 0.00 C ATOM 1823 NZ LYS A 115 11.483 -15.640 0.111 1.00 0.00 N ATOM 0 H LYS A 115 8.689 -10.090 1.224 1.00 0.00 H new ATOM 0 HA LYS A 115 6.319 -11.686 0.501 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.682 -12.190 2.352 1.00 0.00 H new ATOM 0 HB3 LYS A 115 7.316 -13.277 2.194 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.918 -13.958 0.049 1.00 0.00 H new ATOM 0 HG3 LYS A 115 8.785 -12.476 -0.301 1.00 0.00 H new ATOM 0 HD2 LYS A 115 10.558 -13.142 1.330 1.00 0.00 H new ATOM 0 HD3 LYS A 115 9.695 -14.634 1.646 1.00 0.00 H new ATOM 0 HE2 LYS A 115 9.829 -14.915 -0.996 1.00 0.00 H new ATOM 0 HE3 LYS A 115 11.156 -13.780 -0.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 11.933 -16.057 -0.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 12.216 -15.269 0.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 10.931 -16.369 0.606 1.00 0.00 H new ATOM 1837 N PHE A 116 4.995 -10.458 2.244 1.00 0.00 N ATOM 1838 CA PHE A 116 4.134 -9.975 3.317 1.00 0.00 C ATOM 1839 C PHE A 116 3.472 -11.139 4.049 1.00 0.00 C ATOM 1840 O PHE A 116 3.484 -11.200 5.279 1.00 0.00 O ATOM 1841 CB PHE A 116 3.064 -9.035 2.758 1.00 0.00 C ATOM 1842 CG PHE A 116 2.112 -8.523 3.801 1.00 0.00 C ATOM 1843 CD1 PHE A 116 2.584 -8.020 5.002 1.00 0.00 C ATOM 1844 CD2 PHE A 116 0.744 -8.545 3.579 1.00 0.00 C ATOM 1845 CE1 PHE A 116 1.709 -7.550 5.964 1.00 0.00 C ATOM 1846 CE2 PHE A 116 -0.135 -8.076 4.537 1.00 0.00 C ATOM 1847 CZ PHE A 116 0.348 -7.576 5.730 1.00 0.00 C ATOM 0 H PHE A 116 4.566 -10.439 1.319 1.00 0.00 H new ATOM 0 HA PHE A 116 4.754 -9.427 4.027 1.00 0.00 H new ATOM 0 HB2 PHE A 116 3.552 -8.188 2.276 1.00 0.00 H new ATOM 0 HB3 PHE A 116 2.499 -9.559 1.987 1.00 0.00 H new ATOM 0 HD1 PHE A 116 3.647 -7.995 5.189 1.00 0.00 H new ATOM 0 HD2 PHE A 116 0.361 -8.933 2.647 1.00 0.00 H new ATOM 0 HE1 PHE A 116 2.089 -7.163 6.898 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -1.199 -8.101 4.353 1.00 0.00 H new ATOM 0 HZ PHE A 116 -0.337 -7.206 6.479 1.00 0.00 H new ATOM 1857 N ILE A 117 2.896 -12.060 3.284 1.00 0.00 N ATOM 1858 CA ILE A 117 2.230 -13.222 3.858 1.00 0.00 C ATOM 1859 C ILE A 117 2.010 -14.305 2.808 1.00 0.00 C ATOM 1860 O ILE A 117 1.892 -14.015 1.617 1.00 0.00 O ATOM 1861 CB ILE A 117 0.872 -12.843 4.480 1.00 0.00 C ATOM 1862 CG1 ILE A 117 0.220 -14.069 5.121 1.00 0.00 C ATOM 1863 CG2 ILE A 117 -0.043 -12.240 3.425 1.00 0.00 C ATOM 1864 CD1 ILE A 117 0.961 -14.582 6.336 1.00 0.00 C ATOM 0 H ILE A 117 2.877 -12.024 2.265 1.00 0.00 H new ATOM 0 HA ILE A 117 2.885 -13.606 4.640 1.00 0.00 H new ATOM 0 HB ILE A 117 1.040 -12.097 5.257 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -0.802 -13.819 5.407 1.00 0.00 H new ATOM 0 HG13 ILE A 117 0.157 -14.866 4.380 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -0.998 -11.977 3.879 1.00 0.00 H new ATOM 0 HG22 ILE A 117 0.420 -11.345 3.010 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -0.207 -12.965 2.628 1.00 0.00 H new ATOM 0 HD11 ILE A 117 0.442 -15.452 6.738 1.00 0.00 H new ATOM 0 HD12 ILE A 117 1.975 -14.864 6.052 1.00 0.00 H new ATOM 0 HD13 ILE A 117 1.001 -13.800 7.095 1.00 0.00 H new ATOM 1876 N ARG A 118 1.954 -15.555 3.257 1.00 0.00 N ATOM 1877 CA ARG A 118 1.748 -16.682 2.356 1.00 0.00 C ATOM 1878 C ARG A 118 0.307 -16.721 1.855 1.00 0.00 C ATOM 1879 O ARG A 118 -0.621 -16.974 2.623 1.00 0.00 O ATOM 1880 CB ARG A 118 2.089 -17.996 3.061 1.00 0.00 C ATOM 1881 CG ARG A 118 3.543 -18.411 2.905 1.00 0.00 C ATOM 1882 CD ARG A 118 3.794 -19.791 3.492 1.00 0.00 C ATOM 1883 NE ARG A 118 4.185 -19.725 4.898 1.00 0.00 N ATOM 1884 CZ ARG A 118 4.161 -20.770 5.717 1.00 0.00 C ATOM 1885 NH1 ARG A 118 3.769 -21.956 5.273 1.00 0.00 N ATOM 1886 NH2 ARG A 118 4.532 -20.631 6.984 1.00 0.00 N ATOM 0 H ARG A 118 2.048 -15.812 4.239 1.00 0.00 H new ATOM 0 HA ARG A 118 2.410 -16.555 1.499 1.00 0.00 H new ATOM 0 HB2 ARG A 118 1.859 -17.899 4.122 1.00 0.00 H new ATOM 0 HB3 ARG A 118 1.450 -18.786 2.667 1.00 0.00 H new ATOM 0 HG2 ARG A 118 3.812 -18.409 1.849 1.00 0.00 H new ATOM 0 HG3 ARG A 118 4.186 -17.682 3.399 1.00 0.00 H new ATOM 0 HD2 ARG A 118 2.892 -20.396 3.394 1.00 0.00 H new ATOM 0 HD3 ARG A 118 4.577 -20.291 2.921 1.00 0.00 H new ATOM 0 HE ARG A 118 4.493 -18.827 5.271 1.00 0.00 H new ATOM 0 HH11 ARG A 118 3.485 -22.068 4.300 1.00 0.00 H new ATOM 0 HH12 ARG A 118 3.752 -22.757 5.905 1.00 0.00 H new ATOM 0 HH21 ARG A 118 4.836 -19.721 7.329 1.00 0.00 H new ATOM 0 HH22 ARG A 118 4.513 -21.434 7.612 1.00 0.00 H new ATOM 1900 N ARG A 119 0.128 -16.468 0.562 1.00 0.00 N ATOM 1901 CA ARG A 119 -1.199 -16.472 -0.041 1.00 0.00 C ATOM 1902 C ARG A 119 -1.975 -17.722 0.362 1.00 0.00 C ATOM 1903 O ARG A 119 -3.191 -17.676 0.553 1.00 0.00 O ATOM 1904 CB ARG A 119 -1.091 -16.395 -1.565 1.00 0.00 C ATOM 1905 CG ARG A 119 -2.264 -15.689 -2.224 1.00 0.00 C ATOM 1906 CD ARG A 119 -2.124 -15.672 -3.738 1.00 0.00 C ATOM 1907 NE ARG A 119 -2.743 -16.840 -4.358 1.00 0.00 N ATOM 1908 CZ ARG A 119 -2.569 -17.175 -5.632 1.00 0.00 C ATOM 1909 NH1 ARG A 119 -1.799 -16.434 -6.416 1.00 0.00 N ATOM 1910 NH2 ARG A 119 -3.166 -18.253 -6.123 1.00 0.00 N ATOM 0 H ARG A 119 0.886 -16.258 -0.088 1.00 0.00 H new ATOM 0 HA ARG A 119 -1.738 -15.597 0.322 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -0.170 -15.875 -1.830 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -1.014 -17.405 -1.967 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -3.193 -16.189 -1.949 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -2.330 -14.667 -1.852 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -2.582 -14.766 -4.134 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -1.068 -15.638 -4.004 1.00 0.00 H new ATOM 0 HE ARG A 119 -3.342 -17.431 -3.782 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -1.338 -15.604 -6.042 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -1.667 -16.693 -7.394 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -3.759 -18.826 -5.522 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -3.032 -18.509 -7.101 1.00 0.00 H new ATOM 1924 N ASP A 120 -1.265 -18.838 0.490 1.00 0.00 N ATOM 1925 CA ASP A 120 -1.887 -20.101 0.870 1.00 0.00 C ATOM 1926 C ASP A 120 -2.407 -20.040 2.303 1.00 0.00 C ATOM 1927 O ASP A 120 -3.420 -20.656 2.634 1.00 0.00 O ATOM 1928 CB ASP A 120 -0.888 -21.250 0.725 1.00 0.00 C ATOM 1929 CG ASP A 120 -0.877 -21.834 -0.674 1.00 0.00 C ATOM 1930 OD1 ASP A 120 -0.295 -21.198 -1.578 1.00 0.00 O ATOM 1931 OD2 ASP A 120 -1.449 -22.927 -0.865 1.00 0.00 O ATOM 0 H ASP A 120 -0.258 -18.893 0.336 1.00 0.00 H new ATOM 0 HA ASP A 120 -2.731 -20.278 0.203 1.00 0.00 H new ATOM 0 HB2 ASP A 120 0.111 -20.893 0.974 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -1.134 -22.034 1.441 1.00 0.00 H new ATOM 1936 N PHE A 121 -1.705 -19.296 3.151 1.00 0.00 N ATOM 1937 CA PHE A 121 -2.094 -19.157 4.550 1.00 0.00 C ATOM 1938 C PHE A 121 -3.412 -18.398 4.674 1.00 0.00 C ATOM 1939 O PHE A 121 -4.226 -18.686 5.552 1.00 0.00 O ATOM 1940 CB PHE A 121 -0.999 -18.432 5.336 1.00 0.00 C ATOM 1941 CG PHE A 121 -1.331 -18.239 6.788 1.00 0.00 C ATOM 1942 CD1 PHE A 121 -1.096 -19.250 7.706 1.00 0.00 C ATOM 1943 CD2 PHE A 121 -1.880 -17.048 7.234 1.00 0.00 C ATOM 1944 CE1 PHE A 121 -1.401 -19.076 9.043 1.00 0.00 C ATOM 1945 CE2 PHE A 121 -2.186 -16.868 8.570 1.00 0.00 C ATOM 1946 CZ PHE A 121 -1.948 -17.883 9.475 1.00 0.00 C ATOM 0 H PHE A 121 -0.864 -18.780 2.894 1.00 0.00 H new ATOM 0 HA PHE A 121 -2.229 -20.156 4.965 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -0.071 -18.997 5.256 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -0.820 -17.458 4.880 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -0.670 -20.185 7.373 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -2.071 -16.251 6.530 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -1.212 -19.871 9.749 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -2.611 -15.934 8.906 1.00 0.00 H new ATOM 0 HZ PHE A 121 -2.189 -17.745 10.519 1.00 0.00 H new ATOM 1956 N LEU A 122 -3.614 -17.427 3.791 1.00 0.00 N ATOM 1957 CA LEU A 122 -4.833 -16.625 3.801 1.00 0.00 C ATOM 1958 C LEU A 122 -6.049 -17.479 3.456 1.00 0.00 C ATOM 1959 O LEU A 122 -6.916 -17.714 4.299 1.00 0.00 O ATOM 1960 CB LEU A 122 -4.712 -15.465 2.811 1.00 0.00 C ATOM 1961 CG LEU A 122 -3.827 -14.298 3.250 1.00 0.00 C ATOM 1962 CD1 LEU A 122 -2.373 -14.569 2.896 1.00 0.00 C ATOM 1963 CD2 LEU A 122 -4.300 -13.000 2.612 1.00 0.00 C ATOM 0 H LEU A 122 -2.950 -17.176 3.059 1.00 0.00 H new ATOM 0 HA LEU A 122 -4.967 -16.224 4.806 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -4.324 -15.855 1.870 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -5.712 -15.081 2.608 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.904 -14.196 4.333 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.758 -13.728 3.216 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -2.039 -15.476 3.400 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.279 -14.698 1.818 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.658 -12.180 2.936 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -4.254 -13.090 1.527 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.327 -12.798 2.916 1.00 0.00 H new ATOM 1975 N LEU A 123 -6.106 -17.942 2.212 1.00 0.00 N ATOM 1976 CA LEU A 123 -7.216 -18.772 1.755 1.00 0.00 C ATOM 1977 C LEU A 123 -7.447 -19.943 2.704 1.00 0.00 C ATOM 1978 O LEU A 123 -8.513 -20.558 2.699 1.00 0.00 O ATOM 1979 CB LEU A 123 -6.941 -19.292 0.342 1.00 0.00 C ATOM 1980 CG LEU A 123 -6.529 -18.243 -0.691 1.00 0.00 C ATOM 1981 CD1 LEU A 123 -5.604 -18.853 -1.732 1.00 0.00 C ATOM 1982 CD2 LEU A 123 -7.757 -17.638 -1.355 1.00 0.00 C ATOM 0 H LEU A 123 -5.397 -17.757 1.502 1.00 0.00 H new ATOM 0 HA LEU A 123 -8.116 -18.157 1.741 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -6.154 -20.044 0.400 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -7.838 -19.796 -0.019 1.00 0.00 H new ATOM 0 HG LEU A 123 -5.989 -17.448 -0.177 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -5.321 -18.091 -2.459 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -4.709 -19.238 -1.243 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -6.117 -19.668 -2.242 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -7.445 -16.893 -2.087 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -8.324 -18.423 -1.855 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -8.383 -17.163 -0.599 1.00 0.00 H new ATOM 1994 N ASP A 124 -6.441 -20.245 3.519 1.00 0.00 N ATOM 1995 CA ASP A 124 -6.536 -21.340 4.477 1.00 0.00 C ATOM 1996 C ASP A 124 -7.830 -21.250 5.279 1.00 0.00 C ATOM 1997 O ASP A 124 -8.460 -20.194 5.342 1.00 0.00 O ATOM 1998 CB ASP A 124 -5.334 -21.324 5.422 1.00 0.00 C ATOM 1999 CG ASP A 124 -5.001 -22.703 5.958 1.00 0.00 C ATOM 2000 OD1 ASP A 124 -5.936 -23.420 6.372 1.00 0.00 O ATOM 2001 OD2 ASP A 124 -3.806 -23.064 5.964 1.00 0.00 O ATOM 0 H ASP A 124 -5.551 -19.747 3.535 1.00 0.00 H new ATOM 0 HA ASP A 124 -6.539 -22.277 3.921 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.468 -20.923 4.896 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -5.540 -20.653 6.256 1.00 0.00 H new ATOM 2006 N GLU A 125 -8.221 -22.364 5.890 1.00 0.00 N ATOM 2007 CA GLU A 125 -9.442 -22.410 6.686 1.00 0.00 C ATOM 2008 C GLU A 125 -9.128 -22.258 8.172 1.00 0.00 C ATOM 2009 O GLU A 125 -9.908 -21.676 8.925 1.00 0.00 O ATOM 2010 CB GLU A 125 -10.187 -23.725 6.442 1.00 0.00 C ATOM 2011 CG GLU A 125 -9.358 -24.960 6.751 1.00 0.00 C ATOM 2012 CD GLU A 125 -10.170 -26.239 6.685 1.00 0.00 C ATOM 2013 OE1 GLU A 125 -11.066 -26.329 5.820 1.00 0.00 O ATOM 2014 OE2 GLU A 125 -9.909 -27.150 7.498 1.00 0.00 O ATOM 0 H GLU A 125 -7.710 -23.246 5.849 1.00 0.00 H new ATOM 0 HA GLU A 125 -10.077 -21.579 6.380 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -11.089 -23.741 7.054 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -10.507 -23.764 5.401 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -8.530 -25.023 6.045 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -8.923 -24.861 7.745 1.00 0.00 H new ATOM 2021 N ALA A 126 -7.982 -22.788 8.585 1.00 0.00 N ATOM 2022 CA ALA A 126 -7.564 -22.710 9.980 1.00 0.00 C ATOM 2023 C ALA A 126 -7.519 -21.264 10.460 1.00 0.00 C ATOM 2024 O ALA A 126 -7.885 -20.966 11.596 1.00 0.00 O ATOM 2025 CB ALA A 126 -6.205 -23.370 10.161 1.00 0.00 C ATOM 0 H ALA A 126 -7.326 -23.276 7.974 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.299 -23.243 10.584 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -5.905 -23.305 11.207 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.267 -24.418 9.866 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -5.468 -22.861 9.540 1.00 0.00 H new ATOM 2031 N ASN A 127 -7.069 -20.369 9.587 1.00 0.00 N ATOM 2032 CA ASN A 127 -6.976 -18.953 9.923 1.00 0.00 C ATOM 2033 C ASN A 127 -8.247 -18.213 9.519 1.00 0.00 C ATOM 2034 O ASN A 127 -8.713 -17.324 10.231 1.00 0.00 O ATOM 2035 CB ASN A 127 -5.764 -18.322 9.233 1.00 0.00 C ATOM 2036 CG ASN A 127 -4.546 -19.225 9.263 1.00 0.00 C ATOM 2037 OD1 ASN A 127 -4.075 -19.614 10.332 1.00 0.00 O ATOM 2038 ND2 ASN A 127 -4.031 -19.562 8.087 1.00 0.00 N ATOM 0 H ASN A 127 -6.763 -20.599 8.642 1.00 0.00 H new ATOM 0 HA ASN A 127 -6.856 -18.869 11.003 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -6.017 -18.093 8.198 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -5.524 -17.377 9.719 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -3.211 -20.167 8.044 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -4.455 -19.216 7.226 1.00 0.00 H new ATOM 2045 N GLY A 128 -8.805 -18.587 8.371 1.00 0.00 N ATOM 2046 CA GLY A 128 -10.017 -17.950 7.893 1.00 0.00 C ATOM 2047 C GLY A 128 -9.830 -16.469 7.633 1.00 0.00 C ATOM 2048 O GLY A 128 -10.681 -15.655 7.995 1.00 0.00 O ATOM 0 H GLY A 128 -8.438 -19.320 7.764 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -10.343 -18.439 6.975 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -10.811 -18.089 8.627 1.00 0.00 H new ATOM 2052 N LEU A 129 -8.713 -16.116 7.005 1.00 0.00 N ATOM 2053 CA LEU A 129 -8.416 -14.721 6.699 1.00 0.00 C ATOM 2054 C LEU A 129 -9.469 -14.132 5.766 1.00 0.00 C ATOM 2055 O LEU A 129 -9.537 -12.917 5.579 1.00 0.00 O ATOM 2056 CB LEU A 129 -7.030 -14.604 6.061 1.00 0.00 C ATOM 2057 CG LEU A 129 -5.853 -14.483 7.030 1.00 0.00 C ATOM 2058 CD1 LEU A 129 -6.172 -13.487 8.135 1.00 0.00 C ATOM 2059 CD2 LEU A 129 -5.505 -15.842 7.618 1.00 0.00 C ATOM 0 H LEU A 129 -7.999 -16.776 6.698 1.00 0.00 H new ATOM 0 HA LEU A 129 -8.429 -14.158 7.632 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -6.867 -15.478 5.431 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -7.026 -13.733 5.406 1.00 0.00 H new ATOM 0 HG LEU A 129 -4.988 -14.117 6.478 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -5.323 -13.414 8.815 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -6.371 -12.509 7.697 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -7.050 -13.824 8.686 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -4.665 -15.737 8.305 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -6.367 -16.237 8.156 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -5.233 -16.527 6.815 1.00 0.00 H new ATOM 2071 N LEU A 130 -10.290 -15.000 5.186 1.00 0.00 N ATOM 2072 CA LEU A 130 -11.343 -14.566 4.274 1.00 0.00 C ATOM 2073 C LEU A 130 -12.664 -15.256 4.600 1.00 0.00 C ATOM 2074 O LEU A 130 -12.984 -16.319 4.069 1.00 0.00 O ATOM 2075 CB LEU A 130 -10.944 -14.860 2.827 1.00 0.00 C ATOM 2076 CG LEU A 130 -9.446 -14.819 2.521 1.00 0.00 C ATOM 2077 CD1 LEU A 130 -9.181 -15.261 1.090 1.00 0.00 C ATOM 2078 CD2 LEU A 130 -8.891 -13.423 2.762 1.00 0.00 C ATOM 0 H LEU A 130 -10.247 -16.009 5.331 1.00 0.00 H new ATOM 0 HA LEU A 130 -11.476 -13.491 4.396 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -11.322 -15.847 2.561 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -11.446 -14.141 2.180 1.00 0.00 H new ATOM 0 HG LEU A 130 -8.938 -15.511 3.193 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -8.110 -15.225 0.891 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -9.542 -16.280 0.951 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -9.701 -14.595 0.401 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -7.824 -13.412 2.539 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -9.404 -12.711 2.115 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -9.047 -13.144 3.804 1.00 0.00 H new ATOM 2090 N PRO A 131 -13.451 -14.636 5.491 1.00 0.00 N ATOM 2091 CA PRO A 131 -14.751 -15.171 5.906 1.00 0.00 C ATOM 2092 C PRO A 131 -15.790 -15.098 4.792 1.00 0.00 C ATOM 2093 O PRO A 131 -16.648 -15.972 4.672 1.00 0.00 O ATOM 2094 CB PRO A 131 -15.153 -14.263 7.071 1.00 0.00 C ATOM 2095 CG PRO A 131 -14.429 -12.985 6.823 1.00 0.00 C ATOM 2096 CD PRO A 131 -13.132 -13.365 6.164 1.00 0.00 C ATOM 0 HA PRO A 131 -14.691 -16.227 6.171 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -16.232 -14.108 7.098 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -14.869 -14.699 8.029 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -15.013 -12.324 6.183 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -14.251 -12.450 7.756 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -12.804 -12.606 5.454 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -12.331 -13.486 6.893 1.00 0.00 H new ATOM 2104 N ASP A 132 -15.705 -14.050 3.979 1.00 0.00 N ATOM 2105 CA ASP A 132 -16.637 -13.864 2.872 1.00 0.00 C ATOM 2106 C ASP A 132 -15.896 -13.810 1.540 1.00 0.00 C ATOM 2107 O ASP A 132 -16.369 -13.202 0.580 1.00 0.00 O ATOM 2108 CB ASP A 132 -17.449 -12.583 3.071 1.00 0.00 C ATOM 2109 CG ASP A 132 -18.727 -12.822 3.851 1.00 0.00 C ATOM 2110 OD1 ASP A 132 -19.439 -13.799 3.538 1.00 0.00 O ATOM 2111 OD2 ASP A 132 -19.015 -12.032 4.775 1.00 0.00 O ATOM 0 H ASP A 132 -15.001 -13.317 4.066 1.00 0.00 H new ATOM 0 HA ASP A 132 -17.316 -14.716 2.854 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -16.839 -11.848 3.596 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -17.695 -12.158 2.098 1.00 0.00 H new ATOM 2116 N ASP A 133 -14.732 -14.448 1.491 1.00 0.00 N ATOM 2117 CA ASP A 133 -13.924 -14.472 0.277 1.00 0.00 C ATOM 2118 C ASP A 133 -13.429 -13.073 -0.075 1.00 0.00 C ATOM 2119 O ASP A 133 -13.271 -12.735 -1.248 1.00 0.00 O ATOM 2120 CB ASP A 133 -14.733 -15.048 -0.887 1.00 0.00 C ATOM 2121 CG ASP A 133 -15.278 -16.430 -0.585 1.00 0.00 C ATOM 2122 OD1 ASP A 133 -16.336 -16.520 0.073 1.00 0.00 O ATOM 2123 OD2 ASP A 133 -14.648 -17.422 -1.008 1.00 0.00 O ATOM 0 H ASP A 133 -14.327 -14.955 2.278 1.00 0.00 H new ATOM 0 HA ASP A 133 -13.058 -15.109 0.459 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -15.560 -14.377 -1.118 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -14.103 -15.095 -1.775 1.00 0.00 H new ATOM 2128 N LYS A 134 -13.186 -12.262 0.949 1.00 0.00 N ATOM 2129 CA LYS A 134 -12.708 -10.899 0.750 1.00 0.00 C ATOM 2130 C LYS A 134 -11.455 -10.635 1.578 1.00 0.00 C ATOM 2131 O LYS A 134 -11.363 -11.052 2.734 1.00 0.00 O ATOM 2132 CB LYS A 134 -13.800 -9.894 1.124 1.00 0.00 C ATOM 2133 CG LYS A 134 -14.752 -10.400 2.195 1.00 0.00 C ATOM 2134 CD LYS A 134 -15.486 -9.257 2.874 1.00 0.00 C ATOM 2135 CE LYS A 134 -16.710 -8.829 2.079 1.00 0.00 C ATOM 2136 NZ LYS A 134 -17.559 -7.872 2.840 1.00 0.00 N ATOM 0 H LYS A 134 -13.312 -12.525 1.926 1.00 0.00 H new ATOM 0 HA LYS A 134 -12.457 -10.779 -0.304 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -13.331 -8.974 1.472 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -14.372 -9.642 0.231 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -15.474 -11.083 1.748 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -14.195 -10.969 2.939 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -15.790 -9.562 3.875 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -14.812 -8.409 2.990 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -16.393 -8.368 1.144 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -17.299 -9.708 1.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -18.383 -7.605 2.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -17.883 -8.320 3.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -17.005 -7.022 3.068 1.00 0.00 H new ATOM 2150 N LEU A 135 -10.493 -9.940 0.982 1.00 0.00 N ATOM 2151 CA LEU A 135 -9.245 -9.619 1.665 1.00 0.00 C ATOM 2152 C LEU A 135 -9.255 -8.179 2.171 1.00 0.00 C ATOM 2153 O LEU A 135 -8.943 -7.247 1.430 1.00 0.00 O ATOM 2154 CB LEU A 135 -8.056 -9.832 0.726 1.00 0.00 C ATOM 2155 CG LEU A 135 -6.695 -9.374 1.251 1.00 0.00 C ATOM 2156 CD1 LEU A 135 -6.269 -10.222 2.440 1.00 0.00 C ATOM 2157 CD2 LEU A 135 -5.650 -9.436 0.147 1.00 0.00 C ATOM 0 H LEU A 135 -10.553 -9.588 0.027 1.00 0.00 H new ATOM 0 HA LEU A 135 -9.148 -10.286 2.522 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -7.992 -10.894 0.488 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -8.258 -9.307 -0.208 1.00 0.00 H new ATOM 0 HG LEU A 135 -6.783 -8.339 1.582 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -5.298 -9.882 2.800 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -7.006 -10.127 3.237 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -6.197 -11.266 2.135 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -4.687 -9.107 0.538 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -5.563 -10.461 -0.215 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.950 -8.785 -0.675 1.00 0.00 H new ATOM 2169 N THR A 136 -9.615 -8.006 3.439 1.00 0.00 N ATOM 2170 CA THR A 136 -9.665 -6.681 4.044 1.00 0.00 C ATOM 2171 C THR A 136 -8.271 -6.198 4.426 1.00 0.00 C ATOM 2172 O THR A 136 -7.757 -6.535 5.494 1.00 0.00 O ATOM 2173 CB THR A 136 -10.561 -6.670 5.297 1.00 0.00 C ATOM 2174 OG1 THR A 136 -11.907 -7.005 4.941 1.00 0.00 O ATOM 2175 CG2 THR A 136 -10.535 -5.305 5.969 1.00 0.00 C ATOM 0 H THR A 136 -9.876 -8.767 4.066 1.00 0.00 H new ATOM 0 HA THR A 136 -10.087 -6.008 3.298 1.00 0.00 H new ATOM 0 HB THR A 136 -10.176 -7.411 5.998 1.00 0.00 H new ATOM 0 HG1 THR A 136 -12.469 -6.997 5.744 1.00 0.00 H new ATOM 0 HG21 THR A 136 -11.175 -5.322 6.851 1.00 0.00 H new ATOM 0 HG22 THR A 136 -9.514 -5.065 6.266 1.00 0.00 H new ATOM 0 HG23 THR A 136 -10.897 -4.549 5.272 1.00 0.00 H new ATOM 2183 N LEU A 137 -7.664 -5.406 3.550 1.00 0.00 N ATOM 2184 CA LEU A 137 -6.327 -4.875 3.796 1.00 0.00 C ATOM 2185 C LEU A 137 -6.399 -3.537 4.524 1.00 0.00 C ATOM 2186 O LEU A 137 -6.853 -2.538 3.965 1.00 0.00 O ATOM 2187 CB LEU A 137 -5.571 -4.711 2.476 1.00 0.00 C ATOM 2188 CG LEU A 137 -4.784 -5.931 1.997 1.00 0.00 C ATOM 2189 CD1 LEU A 137 -4.306 -5.730 0.567 1.00 0.00 C ATOM 2190 CD2 LEU A 137 -3.607 -6.203 2.922 1.00 0.00 C ATOM 0 H LEU A 137 -8.076 -5.117 2.663 1.00 0.00 H new ATOM 0 HA LEU A 137 -5.792 -5.583 4.428 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -6.288 -4.439 1.701 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -4.879 -3.875 2.578 1.00 0.00 H new ATOM 0 HG LEU A 137 -5.445 -6.798 2.019 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -3.748 -6.608 0.243 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -5.166 -5.585 -0.087 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -3.661 -4.852 0.519 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -3.058 -7.075 2.566 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -2.945 -5.337 2.933 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -3.973 -6.392 3.931 1.00 0.00 H new ATOM 2202 N PHE A 138 -5.945 -3.523 5.773 1.00 0.00 N ATOM 2203 CA PHE A 138 -5.956 -2.307 6.578 1.00 0.00 C ATOM 2204 C PHE A 138 -4.590 -1.628 6.556 1.00 0.00 C ATOM 2205 O PHE A 138 -3.646 -2.090 7.198 1.00 0.00 O ATOM 2206 CB PHE A 138 -6.357 -2.628 8.019 1.00 0.00 C ATOM 2207 CG PHE A 138 -6.845 -1.432 8.786 1.00 0.00 C ATOM 2208 CD1 PHE A 138 -5.947 -0.548 9.362 1.00 0.00 C ATOM 2209 CD2 PHE A 138 -8.202 -1.192 8.930 1.00 0.00 C ATOM 2210 CE1 PHE A 138 -6.393 0.553 10.068 1.00 0.00 C ATOM 2211 CE2 PHE A 138 -8.654 -0.092 9.634 1.00 0.00 C ATOM 2212 CZ PHE A 138 -7.749 0.781 10.205 1.00 0.00 C ATOM 0 H PHE A 138 -5.565 -4.341 6.250 1.00 0.00 H new ATOM 0 HA PHE A 138 -6.688 -1.623 6.149 1.00 0.00 H new ATOM 0 HB2 PHE A 138 -7.139 -3.387 8.010 1.00 0.00 H new ATOM 0 HB3 PHE A 138 -5.501 -3.058 8.539 1.00 0.00 H new ATOM 0 HD1 PHE A 138 -4.886 -0.721 9.258 1.00 0.00 H new ATOM 0 HD2 PHE A 138 -8.914 -1.872 8.487 1.00 0.00 H new ATOM 0 HE1 PHE A 138 -5.683 1.234 10.512 1.00 0.00 H new ATOM 0 HE2 PHE A 138 -9.714 0.085 9.738 1.00 0.00 H new ATOM 0 HZ PHE A 138 -8.100 1.640 10.757 1.00 0.00 H new ATOM 2222 N CYS A 139 -4.493 -0.531 5.813 1.00 0.00 N ATOM 2223 CA CYS A 139 -3.242 0.211 5.707 1.00 0.00 C ATOM 2224 C CYS A 139 -3.289 1.480 6.552 1.00 0.00 C ATOM 2225 O CYS A 139 -4.344 2.091 6.712 1.00 0.00 O ATOM 2226 CB CYS A 139 -2.960 0.568 4.246 1.00 0.00 C ATOM 2227 SG CYS A 139 -1.344 1.331 3.972 1.00 0.00 S ATOM 0 H CYS A 139 -5.265 -0.136 5.276 1.00 0.00 H new ATOM 0 HA CYS A 139 -2.439 -0.424 6.081 1.00 0.00 H new ATOM 0 HB2 CYS A 139 -3.030 -0.337 3.642 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -3.735 1.248 3.893 1.00 0.00 H new ATOM 0 HG CYS A 139 -0.444 0.403 3.832 1.00 0.00 H new ATOM 2233 N GLU A 140 -2.138 1.867 7.092 1.00 0.00 N ATOM 2234 CA GLU A 140 -2.049 3.062 7.924 1.00 0.00 C ATOM 2235 C GLU A 140 -0.822 3.891 7.557 1.00 0.00 C ATOM 2236 O GLU A 140 0.315 3.461 7.756 1.00 0.00 O ATOM 2237 CB GLU A 140 -1.993 2.676 9.404 1.00 0.00 C ATOM 2238 CG GLU A 140 -3.286 2.071 9.925 1.00 0.00 C ATOM 2239 CD GLU A 140 -3.476 2.293 11.412 1.00 0.00 C ATOM 2240 OE1 GLU A 140 -3.844 3.420 11.802 1.00 0.00 O ATOM 2241 OE2 GLU A 140 -3.258 1.337 12.187 1.00 0.00 O ATOM 0 H GLU A 140 -1.255 1.371 6.969 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.939 3.665 7.746 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -1.182 1.964 9.554 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -1.753 3.561 9.993 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -4.129 2.504 9.386 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -3.292 1.001 9.718 1.00 0.00 H new ATOM 2248 N VAL A 141 -1.059 5.082 7.017 1.00 0.00 N ATOM 2249 CA VAL A 141 0.025 5.972 6.622 1.00 0.00 C ATOM 2250 C VAL A 141 0.099 7.189 7.537 1.00 0.00 C ATOM 2251 O VAL A 141 -0.921 7.801 7.856 1.00 0.00 O ATOM 2252 CB VAL A 141 -0.142 6.448 5.166 1.00 0.00 C ATOM 2253 CG1 VAL A 141 1.114 7.162 4.690 1.00 0.00 C ATOM 2254 CG2 VAL A 141 -0.474 5.274 4.257 1.00 0.00 C ATOM 0 H VAL A 141 -1.993 5.453 6.843 1.00 0.00 H new ATOM 0 HA VAL A 141 0.950 5.401 6.707 1.00 0.00 H new ATOM 0 HB VAL A 141 -0.970 7.155 5.126 1.00 0.00 H new ATOM 0 HG11 VAL A 141 0.977 7.491 3.660 1.00 0.00 H new ATOM 0 HG12 VAL A 141 1.303 8.027 5.325 1.00 0.00 H new ATOM 0 HG13 VAL A 141 1.963 6.480 4.744 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -0.589 5.628 3.233 1.00 0.00 H new ATOM 0 HG22 VAL A 141 0.332 4.541 4.300 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -1.404 4.810 4.587 1.00 0.00 H new ATOM 2264 N SER A 142 1.312 7.536 7.956 1.00 0.00 N ATOM 2265 CA SER A 142 1.519 8.678 8.838 1.00 0.00 C ATOM 2266 C SER A 142 2.479 9.683 8.209 1.00 0.00 C ATOM 2267 O SER A 142 3.683 9.440 8.124 1.00 0.00 O ATOM 2268 CB SER A 142 2.063 8.214 10.190 1.00 0.00 C ATOM 2269 OG SER A 142 1.228 7.222 10.762 1.00 0.00 O ATOM 0 H SER A 142 2.166 7.042 7.698 1.00 0.00 H new ATOM 0 HA SER A 142 0.557 9.167 8.990 1.00 0.00 H new ATOM 0 HB2 SER A 142 3.070 7.817 10.064 1.00 0.00 H new ATOM 0 HB3 SER A 142 2.138 9.065 10.867 1.00 0.00 H new ATOM 0 HG SER A 142 1.598 6.941 11.625 1.00 0.00 H new ATOM 2275 N VAL A 143 1.937 10.814 7.768 1.00 0.00 N ATOM 2276 CA VAL A 143 2.744 11.858 7.147 1.00 0.00 C ATOM 2277 C VAL A 143 3.369 12.767 8.198 1.00 0.00 C ATOM 2278 O VAL A 143 2.681 13.280 9.081 1.00 0.00 O ATOM 2279 CB VAL A 143 1.906 12.713 6.177 1.00 0.00 C ATOM 2280 CG1 VAL A 143 2.754 13.824 5.576 1.00 0.00 C ATOM 2281 CG2 VAL A 143 1.302 11.842 5.086 1.00 0.00 C ATOM 0 H VAL A 143 0.942 11.031 7.829 1.00 0.00 H new ATOM 0 HA VAL A 143 3.534 11.357 6.588 1.00 0.00 H new ATOM 0 HB VAL A 143 1.091 13.173 6.736 1.00 0.00 H new ATOM 0 HG11 VAL A 143 2.146 14.417 4.894 1.00 0.00 H new ATOM 0 HG12 VAL A 143 3.134 14.463 6.373 1.00 0.00 H new ATOM 0 HG13 VAL A 143 3.591 13.388 5.030 1.00 0.00 H new ATOM 0 HG21 VAL A 143 0.713 12.462 4.410 1.00 0.00 H new ATOM 0 HG22 VAL A 143 2.100 11.353 4.528 1.00 0.00 H new ATOM 0 HG23 VAL A 143 0.659 11.086 5.538 1.00 0.00 H new ATOM 2291 N VAL A 144 4.680 12.964 8.098 1.00 0.00 N ATOM 2292 CA VAL A 144 5.400 13.814 9.039 1.00 0.00 C ATOM 2293 C VAL A 144 5.210 15.289 8.705 1.00 0.00 C ATOM 2294 O VAL A 144 5.607 15.748 7.634 1.00 0.00 O ATOM 2295 CB VAL A 144 6.906 13.490 9.049 1.00 0.00 C ATOM 2296 CG1 VAL A 144 7.131 12.004 9.284 1.00 0.00 C ATOM 2297 CG2 VAL A 144 7.555 13.937 7.748 1.00 0.00 C ATOM 0 H VAL A 144 5.265 12.546 7.374 1.00 0.00 H new ATOM 0 HA VAL A 144 4.986 13.613 10.027 1.00 0.00 H new ATOM 0 HB VAL A 144 7.373 14.037 9.868 1.00 0.00 H new ATOM 0 HG11 VAL A 144 8.201 11.794 9.288 1.00 0.00 H new ATOM 0 HG12 VAL A 144 6.702 11.718 10.244 1.00 0.00 H new ATOM 0 HG13 VAL A 144 6.652 11.433 8.488 1.00 0.00 H new ATOM 0 HG21 VAL A 144 8.619 13.701 7.772 1.00 0.00 H new ATOM 0 HG22 VAL A 144 7.087 13.419 6.911 1.00 0.00 H new ATOM 0 HG23 VAL A 144 7.425 15.012 7.627 1.00 0.00 H new