USER MOD reduce.3.24.130724 H: found=0, std=0, add=575, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 579 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 Single : A 6 SER OG : rot -29:sc= -1.36! USER MOD Single : A 10 GLN : amide:sc= -0.446 X(o=-0.45,f=-0.067) USER MOD Single : A 12 HIS : no HD1:sc= -0.39 X(o=-0.39,f=-0.35) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -114:sc= 1.32 (180deg=-0.485) USER MOD Single : A 29 SER OG : rot -86:sc= 1.14 USER MOD Single : A 30 THR OG1 : rot -32:sc= 1.26 USER MOD Single : A 32 GLN :FLIP amide:sc= -0.187 F(o=-0.8,f=-0.19) USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 GLN : amide:sc= -0.28 X(o=-0.28,f=-0.32) USER MOD Single : A 38 THR OG1 : rot 76:sc= 1.21 USER MOD Single : A 40 CYS SG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 158:sc= -0.103 (180deg=-0.583) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 26:sc= 0.211 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= -1.31 K(o=-1.3,f=-3.7!) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 CYS SG : rot 32:sc= 0.125 USER MOD Single : A 90 GLN : amide:sc=-0.00109 X(o=-0.0011,f=-0.0011) USER MOD Single : A 92 GLN : amide:sc= -0.059 K(o=-0.059,f=-0.9) USER MOD Single : A 93 SER OG : rot -1:sc= 1.12 USER MOD Single : A 94 LYS NZ :NH3+ 153:sc= 0.403 (180deg=0.148) USER MOD Single : A 96 LYS NZ :NH3+ 152:sc= 1.16 (180deg=0.63) USER MOD Single : A 100 LYS NZ :NH3+ 179:sc= 1.11 (180deg=1.04) USER MOD Single : A 104 LYS NZ :NH3+ -164:sc= -0.0474 (180deg=-0.265) USER MOD Single : A 106 LYS NZ :NH3+ -164:sc= 1.24 (180deg=0.904) USER MOD ----------------------------------------------------------------- ATOM 70 N SER A 6 -221.333 75.485 59.244 1.00 0.00 N ATOM 71 CA SER A 6 -222.114 76.603 58.765 1.00 0.00 C ATOM 72 C SER A 6 -223.360 76.127 58.036 1.00 0.00 C ATOM 73 O SER A 6 -223.351 75.093 57.371 1.00 0.00 O ATOM 74 CB SER A 6 -221.257 77.476 57.847 1.00 0.00 C ATOM 75 OG SER A 6 -220.689 76.710 56.797 1.00 0.00 O ATOM 0 HA SER A 6 -222.436 77.194 59.622 1.00 0.00 H new ATOM 0 HB2 SER A 6 -221.867 78.277 57.428 1.00 0.00 H new ATOM 0 HB3 SER A 6 -220.464 77.949 58.426 1.00 0.00 H new ATOM 0 HG SER A 6 -220.558 75.787 57.099 1.00 0.00 H new ATOM 81 N PHE A 7 -224.425 76.884 58.185 1.00 0.00 N ATOM 82 CA PHE A 7 -225.671 76.609 57.518 1.00 0.00 C ATOM 83 C PHE A 7 -226.199 77.916 56.952 1.00 0.00 C ATOM 84 O PHE A 7 -225.970 78.990 57.516 1.00 0.00 O ATOM 85 CB PHE A 7 -226.667 75.963 58.496 1.00 0.00 C ATOM 86 CG PHE A 7 -227.485 76.914 59.326 1.00 0.00 C ATOM 87 CD1 PHE A 7 -226.978 77.455 60.488 1.00 0.00 C ATOM 88 CD2 PHE A 7 -228.777 77.241 58.948 1.00 0.00 C ATOM 89 CE1 PHE A 7 -227.739 78.304 61.263 1.00 0.00 C ATOM 90 CE2 PHE A 7 -229.543 78.094 59.718 1.00 0.00 C ATOM 91 CZ PHE A 7 -229.024 78.625 60.878 1.00 0.00 C ATOM 0 H PHE A 7 -224.447 77.714 58.778 1.00 0.00 H new ATOM 0 HA PHE A 7 -225.525 75.900 56.703 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -227.348 75.331 57.926 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -226.113 75.309 59.169 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -225.972 77.211 60.795 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -229.190 76.824 58.041 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -227.329 78.718 62.172 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -230.548 78.344 59.411 1.00 0.00 H new ATOM 0 HZ PHE A 7 -229.621 79.290 61.484 1.00 0.00 H new ATOM 101 N PHE A 8 -226.869 77.834 55.832 1.00 0.00 N ATOM 102 CA PHE A 8 -227.352 79.032 55.168 1.00 0.00 C ATOM 103 C PHE A 8 -228.700 79.440 55.741 1.00 0.00 C ATOM 104 O PHE A 8 -229.563 78.594 55.966 1.00 0.00 O ATOM 105 CB PHE A 8 -227.493 78.816 53.656 1.00 0.00 C ATOM 106 CG PHE A 8 -226.188 78.818 52.919 1.00 0.00 C ATOM 107 CD1 PHE A 8 -225.572 80.013 52.591 1.00 0.00 C ATOM 108 CD2 PHE A 8 -225.583 77.629 52.556 1.00 0.00 C ATOM 109 CE1 PHE A 8 -224.367 80.023 51.920 1.00 0.00 C ATOM 110 CE2 PHE A 8 -224.379 77.631 51.880 1.00 0.00 C ATOM 111 CZ PHE A 8 -223.769 78.830 51.563 1.00 0.00 C ATOM 0 H PHE A 8 -227.095 76.960 55.358 1.00 0.00 H new ATOM 0 HA PHE A 8 -226.621 79.822 55.340 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -227.997 77.866 53.480 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -228.133 79.597 53.245 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -226.040 80.948 52.863 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -226.056 76.690 52.803 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -223.892 80.961 51.674 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -223.915 76.697 51.599 1.00 0.00 H new ATOM 0 HZ PHE A 8 -222.826 78.834 51.037 1.00 0.00 H new ATOM 121 N VAL A 9 -228.885 80.726 55.976 1.00 0.00 N ATOM 122 CA VAL A 9 -230.162 81.215 56.461 1.00 0.00 C ATOM 123 C VAL A 9 -230.710 82.269 55.533 1.00 0.00 C ATOM 124 O VAL A 9 -229.968 83.075 54.982 1.00 0.00 O ATOM 125 CB VAL A 9 -230.100 81.866 57.856 1.00 0.00 C ATOM 126 CG1 VAL A 9 -231.417 81.684 58.582 1.00 0.00 C ATOM 127 CG2 VAL A 9 -228.966 81.340 58.693 1.00 0.00 C ATOM 0 H VAL A 9 -228.174 81.445 55.840 1.00 0.00 H new ATOM 0 HA VAL A 9 -230.792 80.327 56.511 1.00 0.00 H new ATOM 0 HB VAL A 9 -229.914 82.929 57.701 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -231.357 82.149 59.566 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -232.217 82.151 58.007 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -231.626 80.620 58.696 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -228.971 81.834 59.665 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -229.084 80.265 58.832 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -228.020 81.539 58.190 1.00 0.00 H new ATOM 137 N GLN A 10 -232.006 82.251 55.358 1.00 0.00 N ATOM 138 CA GLN A 10 -232.699 83.342 54.748 1.00 0.00 C ATOM 139 C GLN A 10 -233.535 84.011 55.831 1.00 0.00 C ATOM 140 O GLN A 10 -234.514 83.440 56.305 1.00 0.00 O ATOM 141 CB GLN A 10 -233.563 82.799 53.618 1.00 0.00 C ATOM 142 CG GLN A 10 -232.796 81.887 52.671 1.00 0.00 C ATOM 143 CD GLN A 10 -233.647 81.334 51.546 1.00 0.00 C ATOM 144 OE1 GLN A 10 -234.284 80.290 51.687 1.00 0.00 O ATOM 145 NE2 GLN A 10 -233.636 82.010 50.408 1.00 0.00 N ATOM 0 H GLN A 10 -232.606 81.475 55.637 1.00 0.00 H new ATOM 0 HA GLN A 10 -232.017 84.077 54.321 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -234.404 82.250 54.042 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -233.980 83.633 53.053 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -231.959 82.440 52.245 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -232.375 81.058 53.239 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -233.095 82.871 50.332 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -234.168 81.670 49.607 1.00 0.00 H new ATOM 154 N VAL A 11 -233.118 85.194 56.264 1.00 0.00 N ATOM 155 CA VAL A 11 -233.815 85.893 57.330 1.00 0.00 C ATOM 156 C VAL A 11 -234.241 87.269 56.845 1.00 0.00 C ATOM 157 O VAL A 11 -233.512 87.926 56.127 1.00 0.00 O ATOM 158 CB VAL A 11 -232.978 86.027 58.646 1.00 0.00 C ATOM 159 CG1 VAL A 11 -231.934 84.932 58.778 1.00 0.00 C ATOM 160 CG2 VAL A 11 -232.327 87.392 58.787 1.00 0.00 C ATOM 0 H VAL A 11 -232.304 85.686 55.894 1.00 0.00 H new ATOM 0 HA VAL A 11 -234.686 85.288 57.582 1.00 0.00 H new ATOM 0 HB VAL A 11 -233.694 85.914 59.460 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -231.379 85.068 59.706 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -232.426 83.959 58.788 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -231.246 84.981 57.934 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -231.759 87.430 59.717 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -231.656 87.564 57.945 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -233.097 88.163 58.801 1.00 0.00 H new ATOM 170 N HIS A 12 -235.436 87.686 57.200 1.00 0.00 N ATOM 171 CA HIS A 12 -235.910 88.997 56.796 1.00 0.00 C ATOM 172 C HIS A 12 -235.491 90.055 57.804 1.00 0.00 C ATOM 173 O HIS A 12 -235.949 90.048 58.950 1.00 0.00 O ATOM 174 CB HIS A 12 -237.433 89.009 56.653 1.00 0.00 C ATOM 175 CG HIS A 12 -237.933 88.589 55.309 1.00 0.00 C ATOM 176 ND1 HIS A 12 -238.341 89.485 54.347 1.00 0.00 N ATOM 177 CD2 HIS A 12 -238.104 87.360 54.770 1.00 0.00 C ATOM 178 CE1 HIS A 12 -238.742 88.829 53.277 1.00 0.00 C ATOM 179 NE2 HIS A 12 -238.610 87.536 53.506 1.00 0.00 N ATOM 0 H HIS A 12 -236.094 87.145 57.762 1.00 0.00 H new ATOM 0 HA HIS A 12 -235.461 89.224 55.829 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -237.861 88.350 57.408 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -237.797 90.014 56.864 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -237.883 86.416 55.246 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -239.116 89.274 52.367 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -238.845 86.790 52.851 1.00 0.00 H new ATOM 287 N LEU A 20 -235.398 89.571 51.661 1.00 0.00 N ATOM 288 CA LEU A 20 -235.011 88.304 52.240 1.00 0.00 C ATOM 289 C LEU A 20 -233.503 88.277 52.376 1.00 0.00 C ATOM 290 O LEU A 20 -232.786 87.946 51.431 1.00 0.00 O ATOM 291 CB LEU A 20 -235.489 87.118 51.402 1.00 0.00 C ATOM 292 CG LEU A 20 -235.091 85.752 51.962 1.00 0.00 C ATOM 293 CD1 LEU A 20 -235.710 85.531 53.333 1.00 0.00 C ATOM 294 CD2 LEU A 20 -235.493 84.641 51.013 1.00 0.00 C ATOM 0 HA LEU A 20 -235.484 88.210 53.218 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -236.575 87.161 51.318 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -235.088 87.215 50.393 1.00 0.00 H new ATOM 0 HG LEU A 20 -234.006 85.735 52.068 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -235.414 84.553 53.713 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -235.365 86.306 54.017 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -236.796 85.575 53.253 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -235.199 83.679 51.433 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -236.573 84.659 50.868 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -234.996 84.784 50.054 1.00 0.00 H new ATOM 306 N THR A 21 -233.030 88.672 53.541 1.00 0.00 N ATOM 307 CA THR A 21 -231.611 88.754 53.797 1.00 0.00 C ATOM 308 C THR A 21 -230.996 87.357 53.879 1.00 0.00 C ATOM 309 O THR A 21 -231.232 86.617 54.831 1.00 0.00 O ATOM 310 CB THR A 21 -231.346 89.520 55.108 1.00 0.00 C ATOM 311 OG1 THR A 21 -232.148 90.711 55.141 1.00 0.00 O ATOM 312 CG2 THR A 21 -229.876 89.892 55.236 1.00 0.00 C ATOM 0 H THR A 21 -233.616 88.943 54.331 1.00 0.00 H new ATOM 0 HA THR A 21 -231.147 89.292 52.971 1.00 0.00 H new ATOM 0 HB THR A 21 -231.611 88.872 55.943 1.00 0.00 H new ATOM 0 HG1 THR A 21 -231.980 91.196 55.976 1.00 0.00 H new ATOM 0 HG21 THR A 21 -229.717 90.431 56.170 1.00 0.00 H new ATOM 0 HG22 THR A 21 -229.270 88.986 55.233 1.00 0.00 H new ATOM 0 HG23 THR A 21 -229.587 90.525 54.397 1.00 0.00 H new ATOM 320 N VAL A 22 -230.210 86.996 52.875 1.00 0.00 N ATOM 321 CA VAL A 22 -229.563 85.695 52.855 1.00 0.00 C ATOM 322 C VAL A 22 -228.201 85.783 53.535 1.00 0.00 C ATOM 323 O VAL A 22 -227.342 86.571 53.128 1.00 0.00 O ATOM 324 CB VAL A 22 -229.386 85.161 51.418 1.00 0.00 C ATOM 325 CG1 VAL A 22 -228.804 83.754 51.439 1.00 0.00 C ATOM 326 CG2 VAL A 22 -230.710 85.181 50.669 1.00 0.00 C ATOM 0 H VAL A 22 -230.006 87.584 52.067 1.00 0.00 H new ATOM 0 HA VAL A 22 -230.207 85.000 53.395 1.00 0.00 H new ATOM 0 HB VAL A 22 -228.688 85.815 50.894 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -228.686 83.394 50.417 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -227.832 83.770 51.933 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -229.476 83.090 51.982 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -230.562 84.801 49.658 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -231.433 84.554 51.191 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -231.085 86.203 50.621 1.00 0.00 H new ATOM 336 N ILE A 23 -228.017 84.995 54.577 1.00 0.00 N ATOM 337 CA ILE A 23 -226.774 84.989 55.322 1.00 0.00 C ATOM 338 C ILE A 23 -226.257 83.572 55.494 1.00 0.00 C ATOM 339 O ILE A 23 -226.987 82.606 55.289 1.00 0.00 O ATOM 340 CB ILE A 23 -226.931 85.630 56.718 1.00 0.00 C ATOM 341 CG1 ILE A 23 -228.139 85.045 57.460 1.00 0.00 C ATOM 342 CG2 ILE A 23 -227.045 87.146 56.599 1.00 0.00 C ATOM 343 CD1 ILE A 23 -228.315 85.601 58.857 1.00 0.00 C ATOM 0 H ILE A 23 -228.720 84.345 54.929 1.00 0.00 H new ATOM 0 HA ILE A 23 -226.063 85.580 54.744 1.00 0.00 H new ATOM 0 HB ILE A 23 -226.040 85.399 57.302 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -229.042 85.243 56.882 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -228.030 83.962 57.519 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -227.155 87.582 57.592 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -226.146 87.542 56.126 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -227.915 87.399 55.993 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -229.188 85.144 59.323 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -227.428 85.380 59.451 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -228.456 86.681 58.804 1.00 0.00 H new ATOM 355 N LYS A 24 -224.999 83.453 55.863 1.00 0.00 N ATOM 356 CA LYS A 24 -224.414 82.160 56.165 1.00 0.00 C ATOM 357 C LYS A 24 -223.967 82.156 57.625 1.00 0.00 C ATOM 358 O LYS A 24 -222.976 82.791 57.986 1.00 0.00 O ATOM 359 CB LYS A 24 -223.232 81.883 55.238 1.00 0.00 C ATOM 360 CG LYS A 24 -222.864 80.416 55.112 1.00 0.00 C ATOM 361 CD LYS A 24 -221.414 80.283 54.655 1.00 0.00 C ATOM 362 CE LYS A 24 -220.933 78.840 54.594 1.00 0.00 C ATOM 363 NZ LYS A 24 -221.682 78.017 53.614 1.00 0.00 N ATOM 0 H LYS A 24 -224.357 84.240 55.962 1.00 0.00 H new ATOM 0 HA LYS A 24 -225.152 81.373 56.008 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -223.464 82.273 54.247 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -222.364 82.433 55.602 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -223.000 79.914 56.070 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -223.526 79.926 54.398 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -221.308 80.736 53.669 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -220.773 80.844 55.335 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -219.874 78.827 54.336 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -221.026 78.391 55.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -222.223 77.285 54.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -222.335 78.624 53.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -221.014 77.564 52.958 1.00 0.00 H new ATOM 377 N ALA A 25 -224.724 81.469 58.460 1.00 0.00 N ATOM 378 CA ALA A 25 -224.498 81.473 59.892 1.00 0.00 C ATOM 379 C ALA A 25 -224.027 80.110 60.351 1.00 0.00 C ATOM 380 O ALA A 25 -224.038 79.161 59.588 1.00 0.00 O ATOM 381 CB ALA A 25 -225.785 81.886 60.599 1.00 0.00 C ATOM 0 H ALA A 25 -225.512 80.893 58.164 1.00 0.00 H new ATOM 0 HA ALA A 25 -223.717 82.191 60.143 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -225.622 81.891 61.677 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -226.076 82.884 60.271 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -226.577 81.178 60.355 1.00 0.00 H new ATOM 387 N PRO A 26 -223.568 80.001 61.589 1.00 0.00 N ATOM 388 CA PRO A 26 -223.136 78.734 62.142 1.00 0.00 C ATOM 389 C PRO A 26 -224.312 77.839 62.502 1.00 0.00 C ATOM 390 O PRO A 26 -225.322 78.314 63.005 1.00 0.00 O ATOM 391 CB PRO A 26 -222.314 79.128 63.373 1.00 0.00 C ATOM 392 CG PRO A 26 -222.415 80.613 63.516 1.00 0.00 C ATOM 393 CD PRO A 26 -223.438 81.101 62.540 1.00 0.00 C ATOM 0 HA PRO A 26 -222.557 78.146 61.430 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -222.693 78.629 64.265 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -221.274 78.823 63.255 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -222.701 80.880 64.533 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -221.450 81.081 63.323 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -224.386 81.319 63.031 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -223.115 82.019 62.048 1.00 0.00 H new ATOM 401 N ARG A 27 -224.174 76.536 62.248 1.00 0.00 N ATOM 402 CA ARG A 27 -225.235 75.557 62.548 1.00 0.00 C ATOM 403 C ARG A 27 -225.521 75.532 64.056 1.00 0.00 C ATOM 404 O ARG A 27 -226.435 74.867 64.537 1.00 0.00 O ATOM 405 CB ARG A 27 -224.796 74.168 62.100 1.00 0.00 C ATOM 406 CG ARG A 27 -224.481 74.085 60.621 1.00 0.00 C ATOM 407 CD ARG A 27 -223.952 72.710 60.237 1.00 0.00 C ATOM 408 NE ARG A 27 -224.902 71.635 60.525 1.00 0.00 N ATOM 409 CZ ARG A 27 -224.685 70.668 61.422 1.00 0.00 C ATOM 410 NH1 ARG A 27 -223.617 70.712 62.211 1.00 0.00 N ATOM 411 NH2 ARG A 27 -225.549 69.669 61.543 1.00 0.00 N ATOM 0 H ARG A 27 -223.336 76.128 61.834 1.00 0.00 H new ATOM 0 HA ARG A 27 -226.140 75.847 62.014 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -223.914 73.873 62.669 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -225.583 73.452 62.337 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -225.380 74.304 60.044 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -223.743 74.845 60.362 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -223.713 72.702 59.174 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -223.023 72.521 60.774 1.00 0.00 H new ATOM 0 HE ARG A 27 -225.783 71.623 60.010 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -222.958 71.486 62.134 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -223.456 69.971 62.894 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -226.379 69.638 60.951 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -225.383 68.931 62.228 1.00 0.00 H new ATOM 425 N VAL A 28 -224.700 76.268 64.777 1.00 0.00 N ATOM 426 CA VAL A 28 -224.763 76.376 66.218 1.00 0.00 C ATOM 427 C VAL A 28 -225.383 77.717 66.621 1.00 0.00 C ATOM 428 O VAL A 28 -225.894 77.863 67.734 1.00 0.00 O ATOM 429 CB VAL A 28 -223.346 76.217 66.836 1.00 0.00 C ATOM 430 CG1 VAL A 28 -222.349 77.147 66.159 1.00 0.00 C ATOM 431 CG2 VAL A 28 -223.355 76.462 68.336 1.00 0.00 C ATOM 0 H VAL A 28 -223.950 76.822 64.364 1.00 0.00 H new ATOM 0 HA VAL A 28 -225.394 75.575 66.603 1.00 0.00 H new ATOM 0 HB VAL A 28 -223.036 75.186 66.666 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -221.365 77.016 66.610 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -222.295 76.911 65.096 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -222.672 78.180 66.286 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -222.346 76.341 68.730 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -223.705 77.475 68.537 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -224.021 75.746 68.818 1.00 0.00 H new ATOM 441 N SER A 29 -225.362 78.693 65.704 1.00 0.00 N ATOM 442 CA SER A 29 -225.982 79.991 65.973 1.00 0.00 C ATOM 443 C SER A 29 -227.447 79.809 66.298 1.00 0.00 C ATOM 444 O SER A 29 -228.180 79.149 65.561 1.00 0.00 O ATOM 445 CB SER A 29 -225.832 80.946 64.786 1.00 0.00 C ATOM 446 OG SER A 29 -226.531 80.485 63.645 1.00 0.00 O ATOM 0 H SER A 29 -224.929 78.609 64.784 1.00 0.00 H new ATOM 0 HA SER A 29 -225.468 80.431 66.827 1.00 0.00 H new ATOM 0 HB2 SER A 29 -226.203 81.932 65.065 1.00 0.00 H new ATOM 0 HB3 SER A 29 -224.776 81.060 64.543 1.00 0.00 H new ATOM 0 HG SER A 29 -225.961 79.869 63.139 1.00 0.00 H new ATOM 452 N THR A 30 -227.864 80.347 67.425 1.00 0.00 N ATOM 453 CA THR A 30 -229.256 80.318 67.782 1.00 0.00 C ATOM 454 C THR A 30 -229.909 81.618 67.336 1.00 0.00 C ATOM 455 O THR A 30 -229.328 82.360 66.542 1.00 0.00 O ATOM 456 CB THR A 30 -229.459 80.113 69.292 1.00 0.00 C ATOM 457 OG1 THR A 30 -229.071 81.289 70.010 1.00 0.00 O ATOM 458 CG2 THR A 30 -228.654 78.925 69.797 1.00 0.00 C ATOM 0 H THR A 30 -227.257 80.807 68.104 1.00 0.00 H new ATOM 0 HA THR A 30 -229.721 79.471 67.278 1.00 0.00 H new ATOM 0 HB THR A 30 -230.518 79.915 69.461 1.00 0.00 H new ATOM 0 HG1 THR A 30 -228.337 81.734 69.537 1.00 0.00 H new ATOM 0 HG21 THR A 30 -228.817 78.804 70.868 1.00 0.00 H new ATOM 0 HG22 THR A 30 -228.973 78.022 69.277 1.00 0.00 H new ATOM 0 HG23 THR A 30 -227.594 79.097 69.608 1.00 0.00 H new ATOM 466 N ALA A 31 -231.100 81.907 67.845 1.00 0.00 N ATOM 467 CA ALA A 31 -231.818 83.101 67.433 1.00 0.00 C ATOM 468 C ALA A 31 -231.035 84.350 67.787 1.00 0.00 C ATOM 469 O ALA A 31 -230.791 85.177 66.929 1.00 0.00 O ATOM 470 CB ALA A 31 -233.210 83.134 68.051 1.00 0.00 C ATOM 0 H ALA A 31 -231.584 81.335 68.537 1.00 0.00 H new ATOM 0 HA ALA A 31 -231.932 83.073 66.349 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -233.730 84.036 67.729 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -233.772 82.257 67.729 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -233.126 83.132 69.138 1.00 0.00 H new ATOM 476 N GLN A 32 -230.592 84.445 69.026 1.00 0.00 N ATOM 477 CA GLN A 32 -229.843 85.607 69.485 1.00 0.00 C ATOM 478 C GLN A 32 -228.564 85.783 68.656 1.00 0.00 C ATOM 479 O GLN A 32 -228.149 86.904 68.356 1.00 0.00 O ATOM 480 CB GLN A 32 -229.501 85.430 70.973 1.00 0.00 C ATOM 481 CG GLN A 32 -229.527 86.715 71.790 1.00 0.00 C ATOM 482 CD GLN A 32 -228.418 87.680 71.425 1.00 0.00 C ATOM 483 OE1 GLN A 32 -228.668 88.506 70.429 1.00 0.00 O flip ATOM 484 NE2 GLN A 32 -227.338 87.662 72.015 1.00 0.00 N flip ATOM 0 H GLN A 32 -230.737 83.730 69.738 1.00 0.00 H new ATOM 0 HA GLN A 32 -230.451 86.503 69.359 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -230.205 84.722 71.412 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -228.509 84.985 71.053 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -230.489 87.208 71.649 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -229.449 86.466 72.848 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -227.186 87.006 72.781 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -226.595 88.303 71.738 1.00 0.00 H new ATOM 493 N ASP A 33 -227.972 84.674 68.234 1.00 0.00 N ATOM 494 CA ASP A 33 -226.704 84.715 67.514 1.00 0.00 C ATOM 495 C ASP A 33 -226.917 85.319 66.148 1.00 0.00 C ATOM 496 O ASP A 33 -226.261 86.283 65.747 1.00 0.00 O ATOM 497 CB ASP A 33 -226.156 83.302 67.316 1.00 0.00 C ATOM 498 CG ASP A 33 -225.732 82.624 68.603 1.00 0.00 C ATOM 499 OD1 ASP A 33 -226.600 82.002 69.261 1.00 0.00 O ATOM 500 OD2 ASP A 33 -224.535 82.683 68.952 1.00 0.00 O ATOM 0 H ASP A 33 -228.347 83.736 68.377 1.00 0.00 H new ATOM 0 HA ASP A 33 -226.001 85.310 68.097 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -226.917 82.692 66.829 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -225.302 83.345 66.641 1.00 0.00 H new ATOM 505 N VAL A 34 -227.869 84.730 65.461 1.00 0.00 N ATOM 506 CA VAL A 34 -228.231 85.107 64.120 1.00 0.00 C ATOM 507 C VAL A 34 -228.893 86.491 64.115 1.00 0.00 C ATOM 508 O VAL A 34 -228.800 87.239 63.138 1.00 0.00 O ATOM 509 CB VAL A 34 -229.124 84.009 63.527 1.00 0.00 C ATOM 510 CG1 VAL A 34 -230.524 84.056 64.080 1.00 0.00 C ATOM 511 CG2 VAL A 34 -229.088 84.057 62.025 1.00 0.00 C ATOM 0 H VAL A 34 -228.424 83.958 65.831 1.00 0.00 H new ATOM 0 HA VAL A 34 -227.346 85.195 63.490 1.00 0.00 H new ATOM 0 HB VAL A 34 -228.722 83.043 63.832 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -231.119 83.261 63.631 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -230.493 83.920 65.161 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -230.975 85.021 63.848 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -229.727 83.272 61.620 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -229.446 85.028 61.683 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -228.065 83.906 61.681 1.00 0.00 H new ATOM 521 N ILE A 35 -229.535 86.826 65.230 1.00 0.00 N ATOM 522 CA ILE A 35 -230.058 88.168 65.467 1.00 0.00 C ATOM 523 C ILE A 35 -228.937 89.201 65.366 1.00 0.00 C ATOM 524 O ILE A 35 -228.979 90.104 64.533 1.00 0.00 O ATOM 525 CB ILE A 35 -230.698 88.253 66.874 1.00 0.00 C ATOM 526 CG1 ILE A 35 -232.109 87.677 66.857 1.00 0.00 C ATOM 527 CG2 ILE A 35 -230.720 89.686 67.396 1.00 0.00 C ATOM 528 CD1 ILE A 35 -233.135 88.610 66.280 1.00 0.00 C ATOM 0 H ILE A 35 -229.708 86.174 65.996 1.00 0.00 H new ATOM 0 HA ILE A 35 -230.813 88.378 64.710 1.00 0.00 H new ATOM 0 HB ILE A 35 -230.082 87.660 67.550 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -232.107 86.752 66.281 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -232.398 87.418 67.875 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -231.176 89.706 68.386 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -229.700 90.066 67.459 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -231.299 90.312 66.717 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -234.114 88.132 66.301 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -233.166 89.526 66.870 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -232.870 88.850 65.250 1.00 0.00 H new ATOM 540 N GLN A 36 -227.912 89.023 66.191 1.00 0.00 N ATOM 541 CA GLN A 36 -226.806 89.972 66.276 1.00 0.00 C ATOM 542 C GLN A 36 -225.980 89.965 64.994 1.00 0.00 C ATOM 543 O GLN A 36 -225.438 90.992 64.593 1.00 0.00 O ATOM 544 CB GLN A 36 -225.923 89.623 67.479 1.00 0.00 C ATOM 545 CG GLN A 36 -224.675 90.480 67.611 1.00 0.00 C ATOM 546 CD GLN A 36 -223.730 89.965 68.681 1.00 0.00 C ATOM 547 OE1 GLN A 36 -222.867 89.131 68.409 1.00 0.00 O ATOM 548 NE2 GLN A 36 -223.880 90.457 69.900 1.00 0.00 N ATOM 0 H GLN A 36 -227.823 88.222 66.817 1.00 0.00 H new ATOM 0 HA GLN A 36 -227.215 90.974 66.405 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -226.515 89.721 68.389 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -225.625 88.577 67.404 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -224.154 90.509 66.654 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -224.964 91.504 67.848 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -224.608 91.147 70.085 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -223.268 90.146 70.654 1.00 0.00 H new ATOM 557 N GLN A 37 -225.865 88.805 64.357 1.00 0.00 N ATOM 558 CA GLN A 37 -225.179 88.714 63.090 1.00 0.00 C ATOM 559 C GLN A 37 -225.844 89.614 62.054 1.00 0.00 C ATOM 560 O GLN A 37 -225.170 90.311 61.295 1.00 0.00 O ATOM 561 CB GLN A 37 -225.157 87.276 62.604 1.00 0.00 C ATOM 562 CG GLN A 37 -224.099 87.056 61.556 1.00 0.00 C ATOM 563 CD GLN A 37 -223.923 85.601 61.182 1.00 0.00 C ATOM 564 OE1 GLN A 37 -223.117 84.887 61.778 1.00 0.00 O ATOM 565 NE2 GLN A 37 -224.679 85.143 60.195 1.00 0.00 N ATOM 0 H GLN A 37 -226.239 87.921 64.703 1.00 0.00 H new ATOM 0 HA GLN A 37 -224.152 89.051 63.230 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -224.977 86.610 63.448 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -226.133 87.016 62.195 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -224.358 87.625 60.663 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -223.149 87.448 61.920 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -225.336 85.766 59.725 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -224.604 84.168 59.906 1.00 0.00 H new ATOM 574 N THR A 38 -227.170 89.604 62.037 1.00 0.00 N ATOM 575 CA THR A 38 -227.922 90.466 61.146 1.00 0.00 C ATOM 576 C THR A 38 -227.794 91.921 61.598 1.00 0.00 C ATOM 577 O THR A 38 -227.690 92.831 60.776 1.00 0.00 O ATOM 578 CB THR A 38 -229.400 90.042 61.091 1.00 0.00 C ATOM 579 OG1 THR A 38 -229.485 88.626 60.873 1.00 0.00 O ATOM 580 CG2 THR A 38 -230.130 90.766 59.972 1.00 0.00 C ATOM 0 H THR A 38 -227.744 89.007 62.632 1.00 0.00 H new ATOM 0 HA THR A 38 -227.510 90.372 60.141 1.00 0.00 H new ATOM 0 HB THR A 38 -229.869 90.303 62.040 1.00 0.00 H new ATOM 0 HG1 THR A 38 -229.281 88.154 61.707 1.00 0.00 H new ATOM 0 HG21 THR A 38 -231.173 90.449 59.953 1.00 0.00 H new ATOM 0 HG22 THR A 38 -230.080 91.842 60.141 1.00 0.00 H new ATOM 0 HG23 THR A 38 -229.661 90.527 59.017 1.00 0.00 H new ATOM 588 N LEU A 39 -227.772 92.127 62.916 1.00 0.00 N ATOM 589 CA LEU A 39 -227.501 93.446 63.493 1.00 0.00 C ATOM 590 C LEU A 39 -226.208 94.025 62.925 1.00 0.00 C ATOM 591 O LEU A 39 -226.156 95.179 62.500 1.00 0.00 O ATOM 592 CB LEU A 39 -227.365 93.359 65.021 1.00 0.00 C ATOM 593 CG LEU A 39 -228.589 93.792 65.828 1.00 0.00 C ATOM 594 CD1 LEU A 39 -229.684 92.745 65.800 1.00 0.00 C ATOM 595 CD2 LEU A 39 -228.201 94.115 67.259 1.00 0.00 C ATOM 0 H LEU A 39 -227.939 91.395 63.606 1.00 0.00 H new ATOM 0 HA LEU A 39 -228.341 94.092 63.237 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -227.125 92.329 65.287 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -226.517 93.973 65.326 1.00 0.00 H new ATOM 0 HG LEU A 39 -228.984 94.693 65.359 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -230.535 93.093 66.386 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -229.998 92.574 64.770 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -229.308 91.814 66.224 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -229.087 94.421 67.816 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -227.766 93.232 67.726 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -227.471 94.925 67.264 1.00 0.00 H new ATOM 607 N CYS A 40 -225.174 93.197 62.913 1.00 0.00 N ATOM 608 CA CYS A 40 -223.849 93.611 62.484 1.00 0.00 C ATOM 609 C CYS A 40 -223.810 93.866 60.977 1.00 0.00 C ATOM 610 O CYS A 40 -223.023 94.677 60.495 1.00 0.00 O ATOM 611 CB CYS A 40 -222.824 92.537 62.868 1.00 0.00 C ATOM 612 SG CYS A 40 -221.103 93.076 62.727 1.00 0.00 S ATOM 0 H CYS A 40 -225.231 92.220 63.200 1.00 0.00 H new ATOM 0 HA CYS A 40 -223.600 94.546 62.986 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -223.012 92.221 63.894 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -222.973 91.664 62.233 1.00 0.00 H new ATOM 0 HG CYS A 40 -220.314 92.103 63.074 1.00 0.00 H new ATOM 618 N LYS A 41 -224.651 93.163 60.231 1.00 0.00 N ATOM 619 CA LYS A 41 -224.687 93.320 58.784 1.00 0.00 C ATOM 620 C LYS A 41 -225.525 94.536 58.382 1.00 0.00 C ATOM 621 O LYS A 41 -225.261 95.176 57.364 1.00 0.00 O ATOM 622 CB LYS A 41 -225.229 92.053 58.123 1.00 0.00 C ATOM 623 CG LYS A 41 -224.903 91.972 56.644 1.00 0.00 C ATOM 624 CD LYS A 41 -225.277 90.622 56.057 1.00 0.00 C ATOM 625 CE LYS A 41 -224.664 90.433 54.680 1.00 0.00 C ATOM 626 NZ LYS A 41 -223.177 90.457 54.734 1.00 0.00 N ATOM 0 H LYS A 41 -225.314 92.482 60.601 1.00 0.00 H new ATOM 0 HA LYS A 41 -223.667 93.485 58.437 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -224.816 91.180 58.629 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -226.310 92.015 58.254 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -225.435 92.760 56.111 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -223.838 92.150 56.496 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -224.938 89.827 56.721 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -226.362 90.540 55.989 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -224.998 89.484 54.260 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -225.017 91.219 54.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -222.791 89.972 53.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -222.846 91.443 54.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -222.853 89.973 55.596 1.00 0.00 H new ATOM 640 N ALA A 42 -226.526 94.858 59.191 1.00 0.00 N ATOM 641 CA ALA A 42 -227.441 95.949 58.876 1.00 0.00 C ATOM 642 C ALA A 42 -227.143 97.193 59.701 1.00 0.00 C ATOM 643 O ALA A 42 -227.967 98.104 59.765 1.00 0.00 O ATOM 644 CB ALA A 42 -228.884 95.505 59.088 1.00 0.00 C ATOM 0 H ALA A 42 -226.725 94.380 60.070 1.00 0.00 H new ATOM 0 HA ALA A 42 -227.297 96.209 57.827 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -229.557 96.329 58.849 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -229.103 94.658 58.438 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -229.025 95.211 60.128 1.00 0.00 H new ATOM 852 N ASP A 56 -232.727 93.200 72.974 1.00 0.00 N ATOM 853 CA ASP A 56 -234.103 93.669 72.888 1.00 0.00 C ATOM 854 C ASP A 56 -234.810 93.012 71.717 1.00 0.00 C ATOM 855 O ASP A 56 -236.000 93.223 71.498 1.00 0.00 O ATOM 856 CB ASP A 56 -234.140 95.190 72.723 1.00 0.00 C ATOM 857 CG ASP A 56 -233.940 95.922 74.032 1.00 0.00 C ATOM 858 OD1 ASP A 56 -234.826 95.840 74.906 1.00 0.00 O ATOM 859 OD2 ASP A 56 -232.896 96.593 74.193 1.00 0.00 O ATOM 0 HA ASP A 56 -234.615 93.400 73.812 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -233.366 95.494 72.019 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -235.097 95.482 72.290 1.00 0.00 H new ATOM 864 N TYR A 57 -234.073 92.191 70.995 1.00 0.00 N ATOM 865 CA TYR A 57 -234.561 91.569 69.778 1.00 0.00 C ATOM 866 C TYR A 57 -234.965 90.134 70.037 1.00 0.00 C ATOM 867 O TYR A 57 -234.358 89.448 70.857 1.00 0.00 O ATOM 868 CB TYR A 57 -233.472 91.577 68.696 1.00 0.00 C ATOM 869 CG TYR A 57 -233.299 92.903 68.006 1.00 0.00 C ATOM 870 CD1 TYR A 57 -232.508 93.900 68.557 1.00 0.00 C ATOM 871 CD2 TYR A 57 -233.946 93.158 66.805 1.00 0.00 C ATOM 872 CE1 TYR A 57 -232.364 95.120 67.928 1.00 0.00 C ATOM 873 CE2 TYR A 57 -233.810 94.373 66.168 1.00 0.00 C ATOM 874 CZ TYR A 57 -233.017 95.354 66.733 1.00 0.00 C ATOM 875 OH TYR A 57 -232.869 96.568 66.104 1.00 0.00 O ATOM 0 H TYR A 57 -233.115 91.935 71.236 1.00 0.00 H new ATOM 0 HA TYR A 57 -235.425 92.140 69.439 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -232.523 91.289 69.149 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -233.712 90.820 67.949 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -231.998 93.719 69.491 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -234.566 92.392 66.362 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -231.744 95.888 68.367 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -234.320 94.557 65.234 1.00 0.00 H new ATOM 0 HH TYR A 57 -233.392 96.573 65.275 1.00 0.00 H new ATOM 885 N VAL A 58 -235.996 89.699 69.351 1.00 0.00 N ATOM 886 CA VAL A 58 -236.307 88.279 69.260 1.00 0.00 C ATOM 887 C VAL A 58 -236.554 87.898 67.818 1.00 0.00 C ATOM 888 O VAL A 58 -237.104 88.681 67.041 1.00 0.00 O ATOM 889 CB VAL A 58 -237.522 87.834 70.099 1.00 0.00 C ATOM 890 CG1 VAL A 58 -237.107 87.507 71.525 1.00 0.00 C ATOM 891 CG2 VAL A 58 -238.606 88.898 70.105 1.00 0.00 C ATOM 0 H VAL A 58 -236.640 90.306 68.843 1.00 0.00 H new ATOM 0 HA VAL A 58 -235.437 87.767 69.670 1.00 0.00 H new ATOM 0 HB VAL A 58 -237.926 86.933 69.636 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -237.982 87.196 72.096 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -236.374 86.700 71.515 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -236.667 88.391 71.988 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -239.449 88.555 70.705 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -238.209 89.820 70.531 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -238.939 89.084 69.084 1.00 0.00 H new ATOM 901 N LEU A 59 -236.137 86.708 67.461 1.00 0.00 N ATOM 902 CA LEU A 59 -236.261 86.253 66.097 1.00 0.00 C ATOM 903 C LEU A 59 -237.511 85.397 65.934 1.00 0.00 C ATOM 904 O LEU A 59 -237.890 84.645 66.832 1.00 0.00 O ATOM 905 CB LEU A 59 -235.019 85.465 65.699 1.00 0.00 C ATOM 906 CG LEU A 59 -234.885 85.181 64.209 1.00 0.00 C ATOM 907 CD1 LEU A 59 -234.546 86.453 63.455 1.00 0.00 C ATOM 908 CD2 LEU A 59 -233.828 84.133 63.972 1.00 0.00 C ATOM 0 H LEU A 59 -235.708 86.036 68.097 1.00 0.00 H new ATOM 0 HA LEU A 59 -236.353 87.120 65.442 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -234.138 86.015 66.029 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -235.022 84.516 66.235 1.00 0.00 H new ATOM 0 HG LEU A 59 -235.839 84.805 63.839 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -234.454 86.232 62.392 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -235.337 87.187 63.606 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -233.603 86.855 63.825 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -233.742 83.939 62.903 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -232.871 84.488 64.355 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -234.106 83.213 64.487 1.00 0.00 H new ATOM 920 N LEU A 60 -238.165 85.543 64.798 1.00 0.00 N ATOM 921 CA LEU A 60 -239.330 84.742 64.472 1.00 0.00 C ATOM 922 C LEU A 60 -238.916 83.596 63.570 1.00 0.00 C ATOM 923 O LEU A 60 -238.231 83.809 62.571 1.00 0.00 O ATOM 924 CB LEU A 60 -240.394 85.573 63.739 1.00 0.00 C ATOM 925 CG LEU A 60 -241.195 86.594 64.578 1.00 0.00 C ATOM 926 CD1 LEU A 60 -242.275 85.895 65.379 1.00 0.00 C ATOM 927 CD2 LEU A 60 -240.301 87.412 65.501 1.00 0.00 C ATOM 0 H LEU A 60 -237.906 86.217 64.078 1.00 0.00 H new ATOM 0 HA LEU A 60 -239.752 84.371 65.406 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -239.902 86.113 62.930 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -241.102 84.884 63.279 1.00 0.00 H new ATOM 0 HG LEU A 60 -241.660 87.287 63.877 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -242.828 86.630 65.963 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -242.957 85.383 64.701 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -241.817 85.168 66.050 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -240.911 88.115 66.069 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -239.781 86.745 66.188 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -239.571 87.962 64.907 1.00 0.00 H new ATOM 939 N GLU A 61 -239.312 82.391 63.923 1.00 0.00 N ATOM 940 CA GLU A 61 -239.138 81.275 63.030 1.00 0.00 C ATOM 941 C GLU A 61 -240.418 81.111 62.209 1.00 0.00 C ATOM 942 O GLU A 61 -241.360 80.428 62.605 1.00 0.00 O ATOM 943 CB GLU A 61 -238.762 79.981 63.794 1.00 0.00 C ATOM 944 CG GLU A 61 -239.885 79.364 64.626 1.00 0.00 C ATOM 945 CD GLU A 61 -239.536 78.007 65.209 1.00 0.00 C ATOM 946 OE1 GLU A 61 -239.395 77.037 64.438 1.00 0.00 O ATOM 947 OE2 GLU A 61 -239.436 77.895 66.449 1.00 0.00 O ATOM 0 H GLU A 61 -239.752 82.165 64.815 1.00 0.00 H new ATOM 0 HA GLU A 61 -238.303 81.471 62.357 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -238.417 79.240 63.073 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -237.922 80.199 64.453 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -240.139 80.044 65.439 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -240.774 79.265 64.003 1.00 0.00 H new ATOM 954 N GLU A 62 -240.504 81.805 61.092 1.00 0.00 N ATOM 955 CA GLU A 62 -241.628 81.623 60.235 1.00 0.00 C ATOM 956 C GLU A 62 -241.379 80.457 59.305 1.00 0.00 C ATOM 957 O GLU A 62 -240.371 80.412 58.613 1.00 0.00 O ATOM 958 CB GLU A 62 -241.845 82.877 59.421 1.00 0.00 C ATOM 959 CG GLU A 62 -243.211 82.946 58.816 1.00 0.00 C ATOM 960 CD GLU A 62 -243.226 83.663 57.484 1.00 0.00 C ATOM 961 OE1 GLU A 62 -242.986 82.997 56.456 1.00 0.00 O ATOM 962 OE2 GLU A 62 -243.476 84.887 57.454 1.00 0.00 O ATOM 0 H GLU A 62 -239.815 82.486 60.772 1.00 0.00 H new ATOM 0 HA GLU A 62 -242.512 81.419 60.839 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -241.690 83.749 60.057 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -241.099 82.924 58.628 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -243.596 81.935 58.684 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -243.884 83.456 59.506 1.00 0.00 H new ATOM 969 N VAL A 63 -242.287 79.507 59.312 1.00 0.00 N ATOM 970 CA VAL A 63 -242.208 78.385 58.406 1.00 0.00 C ATOM 971 C VAL A 63 -243.416 78.363 57.479 1.00 0.00 C ATOM 972 O VAL A 63 -244.555 78.173 57.914 1.00 0.00 O ATOM 973 CB VAL A 63 -242.070 77.042 59.163 1.00 0.00 C ATOM 974 CG1 VAL A 63 -242.918 77.041 60.422 1.00 0.00 C ATOM 975 CG2 VAL A 63 -242.433 75.873 58.262 1.00 0.00 C ATOM 0 H VAL A 63 -243.092 79.490 59.938 1.00 0.00 H new ATOM 0 HA VAL A 63 -241.308 78.510 57.804 1.00 0.00 H new ATOM 0 HB VAL A 63 -241.028 76.927 59.460 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -242.804 76.087 60.937 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -242.595 77.848 61.079 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -243.965 77.187 60.156 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -242.328 74.940 58.816 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -243.464 75.981 57.924 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -241.768 75.859 57.399 1.00 0.00 H new ATOM 985 N VAL A 64 -243.163 78.600 56.203 1.00 0.00 N ATOM 986 CA VAL A 64 -244.204 78.535 55.198 1.00 0.00 C ATOM 987 C VAL A 64 -244.517 77.082 54.888 1.00 0.00 C ATOM 988 O VAL A 64 -243.728 76.392 54.241 1.00 0.00 O ATOM 989 CB VAL A 64 -243.788 79.253 53.895 1.00 0.00 C ATOM 990 CG1 VAL A 64 -244.903 79.184 52.860 1.00 0.00 C ATOM 991 CG2 VAL A 64 -243.413 80.698 54.178 1.00 0.00 C ATOM 0 H VAL A 64 -242.241 78.840 55.840 1.00 0.00 H new ATOM 0 HA VAL A 64 -245.085 79.039 55.596 1.00 0.00 H new ATOM 0 HB VAL A 64 -242.914 78.743 53.490 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -244.588 79.696 51.951 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -245.123 78.141 52.631 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -245.797 79.665 53.256 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -243.123 81.187 53.248 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -244.268 81.218 54.610 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -242.579 80.727 54.879 1.00 0.00 H new ATOM 1199 N SER A 77 -248.026 81.071 55.647 1.00 0.00 N ATOM 1200 CA SER A 77 -246.851 81.164 56.491 1.00 0.00 C ATOM 1201 C SER A 77 -247.235 81.009 57.953 1.00 0.00 C ATOM 1202 O SER A 77 -248.030 81.785 58.484 1.00 0.00 O ATOM 1203 CB SER A 77 -246.154 82.508 56.258 1.00 0.00 C ATOM 1204 OG SER A 77 -247.041 83.600 56.454 1.00 0.00 O ATOM 0 HA SER A 77 -246.163 80.359 56.233 1.00 0.00 H new ATOM 0 HB2 SER A 77 -245.306 82.601 56.937 1.00 0.00 H new ATOM 0 HB3 SER A 77 -245.755 82.540 55.244 1.00 0.00 H new ATOM 0 HG SER A 77 -247.753 83.336 57.073 1.00 0.00 H new ATOM 1210 N SER A 78 -246.707 79.982 58.592 1.00 0.00 N ATOM 1211 CA SER A 78 -246.905 79.799 60.012 1.00 0.00 C ATOM 1212 C SER A 78 -245.737 80.423 60.755 1.00 0.00 C ATOM 1213 O SER A 78 -244.643 79.861 60.805 1.00 0.00 O ATOM 1214 CB SER A 78 -247.040 78.313 60.343 1.00 0.00 C ATOM 1215 OG SER A 78 -248.111 77.731 59.613 1.00 0.00 O ATOM 0 H SER A 78 -246.137 79.262 58.147 1.00 0.00 H new ATOM 0 HA SER A 78 -247.827 80.289 60.324 1.00 0.00 H new ATOM 0 HB2 SER A 78 -246.110 77.797 60.107 1.00 0.00 H new ATOM 0 HB3 SER A 78 -247.212 78.188 61.412 1.00 0.00 H new ATOM 0 HG SER A 78 -248.180 76.779 59.837 1.00 0.00 H new ATOM 1221 N GLN A 79 -245.961 81.605 61.300 1.00 0.00 N ATOM 1222 CA GLN A 79 -244.897 82.342 61.941 1.00 0.00 C ATOM 1223 C GLN A 79 -244.898 82.050 63.438 1.00 0.00 C ATOM 1224 O GLN A 79 -245.943 82.101 64.090 1.00 0.00 O ATOM 1225 CB GLN A 79 -245.086 83.834 61.679 1.00 0.00 C ATOM 1226 CG GLN A 79 -243.858 84.667 61.986 1.00 0.00 C ATOM 1227 CD GLN A 79 -244.055 86.139 61.673 1.00 0.00 C ATOM 1228 OE1 GLN A 79 -243.494 87.007 62.338 1.00 0.00 O ATOM 1229 NE2 GLN A 79 -244.841 86.432 60.647 1.00 0.00 N ATOM 0 H GLN A 79 -246.868 82.071 61.310 1.00 0.00 H new ATOM 0 HA GLN A 79 -243.935 82.034 61.532 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -245.360 83.978 60.634 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -245.920 84.197 62.280 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -243.602 84.555 63.040 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -243.013 84.287 61.411 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -245.290 85.684 60.118 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -244.997 87.406 60.386 1.00 0.00 H new ATOM 1238 N ARG A 80 -243.730 81.735 63.972 1.00 0.00 N ATOM 1239 CA ARG A 80 -243.580 81.418 65.380 1.00 0.00 C ATOM 1240 C ARG A 80 -242.527 82.337 65.979 1.00 0.00 C ATOM 1241 O ARG A 80 -241.660 82.816 65.263 1.00 0.00 O ATOM 1242 CB ARG A 80 -243.151 79.960 65.536 1.00 0.00 C ATOM 1243 CG ARG A 80 -243.184 79.464 66.967 1.00 0.00 C ATOM 1244 CD ARG A 80 -242.536 78.098 67.098 1.00 0.00 C ATOM 1245 NE ARG A 80 -242.682 77.548 68.442 1.00 0.00 N ATOM 1246 CZ ARG A 80 -241.661 77.219 69.240 1.00 0.00 C ATOM 1247 NH1 ARG A 80 -240.402 77.412 68.847 1.00 0.00 N ATOM 1248 NH2 ARG A 80 -241.904 76.700 70.434 1.00 0.00 N ATOM 0 H ARG A 80 -242.860 81.692 63.441 1.00 0.00 H new ATOM 0 HA ARG A 80 -244.529 81.561 65.897 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -243.803 79.332 64.928 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -242.141 79.844 65.144 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -242.668 80.176 67.612 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -244.217 79.412 67.311 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -242.983 77.414 66.376 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -241.477 78.174 66.851 1.00 0.00 H new ATOM 0 HE ARG A 80 -243.628 77.405 68.797 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -240.210 77.814 67.930 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -239.631 77.157 69.464 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -242.866 76.553 70.740 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -241.129 76.447 71.047 1.00 0.00 H new ATOM 1262 N VAL A 81 -242.592 82.600 67.273 1.00 0.00 N ATOM 1263 CA VAL A 81 -241.612 83.478 67.893 1.00 0.00 C ATOM 1264 C VAL A 81 -240.674 82.682 68.793 1.00 0.00 C ATOM 1265 O VAL A 81 -241.120 81.903 69.636 1.00 0.00 O ATOM 1266 CB VAL A 81 -242.268 84.599 68.716 1.00 0.00 C ATOM 1267 CG1 VAL A 81 -241.459 85.884 68.592 1.00 0.00 C ATOM 1268 CG2 VAL A 81 -243.715 84.821 68.301 1.00 0.00 C ATOM 0 H VAL A 81 -243.299 82.226 67.906 1.00 0.00 H new ATOM 0 HA VAL A 81 -241.049 83.939 67.081 1.00 0.00 H new ATOM 0 HB VAL A 81 -242.276 84.293 69.762 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -241.933 86.671 69.179 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -240.448 85.715 68.962 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -241.416 86.188 67.546 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -244.148 85.620 68.903 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -243.753 85.099 67.248 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -244.282 83.903 68.455 1.00 0.00 H new ATOM 1278 N LEU A 82 -239.381 82.895 68.610 1.00 0.00 N ATOM 1279 CA LEU A 82 -238.356 82.164 69.346 1.00 0.00 C ATOM 1280 C LEU A 82 -238.058 82.817 70.681 1.00 0.00 C ATOM 1281 O LEU A 82 -238.457 83.952 70.942 1.00 0.00 O ATOM 1282 CB LEU A 82 -237.067 82.126 68.529 1.00 0.00 C ATOM 1283 CG LEU A 82 -237.191 81.485 67.152 1.00 0.00 C ATOM 1284 CD1 LEU A 82 -236.039 81.916 66.273 1.00 0.00 C ATOM 1285 CD2 LEU A 82 -237.235 79.970 67.268 1.00 0.00 C ATOM 0 H LEU A 82 -239.010 83.578 67.949 1.00 0.00 H new ATOM 0 HA LEU A 82 -238.732 81.156 69.523 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -236.703 83.146 68.406 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -236.311 81.585 69.098 1.00 0.00 H new ATOM 0 HG LEU A 82 -238.123 81.818 66.696 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -236.137 81.452 65.291 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -236.050 83.001 66.165 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -235.098 81.606 66.728 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -237.324 79.531 66.274 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -236.320 79.615 67.741 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -238.093 79.676 67.872 1.00 0.00 H new ATOM 1297 N LEU A 83 -237.373 82.075 71.530 1.00 0.00 N ATOM 1298 CA LEU A 83 -236.758 82.638 72.708 1.00 0.00 C ATOM 1299 C LEU A 83 -235.409 83.197 72.294 1.00 0.00 C ATOM 1300 O LEU A 83 -235.033 83.093 71.122 1.00 0.00 O ATOM 1301 CB LEU A 83 -236.584 81.566 73.791 1.00 0.00 C ATOM 1302 CG LEU A 83 -237.872 80.852 74.210 1.00 0.00 C ATOM 1303 CD1 LEU A 83 -237.564 79.743 75.202 1.00 0.00 C ATOM 1304 CD2 LEU A 83 -238.861 81.837 74.810 1.00 0.00 C ATOM 0 H LEU A 83 -237.230 81.071 71.420 1.00 0.00 H new ATOM 0 HA LEU A 83 -237.387 83.424 73.126 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -235.874 80.821 73.432 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -236.141 82.030 74.672 1.00 0.00 H new ATOM 0 HG LEU A 83 -238.323 80.410 73.321 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -238.490 79.245 75.490 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -236.891 79.020 74.742 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -237.090 80.168 76.087 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -239.769 81.309 75.101 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -238.418 82.308 75.687 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -239.106 82.601 74.073 1.00 0.00 H new ATOM 1316 N ASP A 84 -234.683 83.783 73.226 1.00 0.00 N ATOM 1317 CA ASP A 84 -233.358 84.311 72.922 1.00 0.00 C ATOM 1318 C ASP A 84 -232.486 83.218 72.319 1.00 0.00 C ATOM 1319 O ASP A 84 -231.860 83.405 71.278 1.00 0.00 O ATOM 1320 CB ASP A 84 -232.695 84.893 74.174 1.00 0.00 C ATOM 1321 CG ASP A 84 -233.424 86.114 74.703 1.00 0.00 C ATOM 1322 OD1 ASP A 84 -233.353 87.184 74.065 1.00 0.00 O ATOM 1323 OD2 ASP A 84 -234.074 86.008 75.767 1.00 0.00 O ATOM 0 H ASP A 84 -234.981 83.907 74.194 1.00 0.00 H new ATOM 0 HA ASP A 84 -233.470 85.117 72.197 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -232.660 84.129 74.951 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -231.664 85.161 73.944 1.00 0.00 H new ATOM 1328 N GLN A 85 -232.470 82.060 72.956 1.00 0.00 N ATOM 1329 CA GLN A 85 -231.692 80.952 72.472 1.00 0.00 C ATOM 1330 C GLN A 85 -232.574 79.737 72.203 1.00 0.00 C ATOM 1331 O GLN A 85 -232.272 78.635 72.654 1.00 0.00 O ATOM 1332 CB GLN A 85 -230.616 80.615 73.495 1.00 0.00 C ATOM 1333 CG GLN A 85 -229.649 81.756 73.748 1.00 0.00 C ATOM 1334 CD GLN A 85 -228.636 81.438 74.828 1.00 0.00 C ATOM 1335 OE1 GLN A 85 -228.892 81.651 76.013 1.00 0.00 O ATOM 1336 NE2 GLN A 85 -227.468 80.962 74.433 1.00 0.00 N ATOM 0 H GLN A 85 -232.992 81.870 73.812 1.00 0.00 H new ATOM 0 HA GLN A 85 -231.224 81.232 71.528 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -231.093 80.337 74.435 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -230.058 79.744 73.151 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -229.124 81.993 72.823 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -230.210 82.646 74.033 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -227.293 80.798 73.442 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -226.742 80.758 75.120 1.00 0.00 H new ATOM 1345 N GLU A 86 -233.659 79.933 71.450 1.00 0.00 N ATOM 1346 CA GLU A 86 -234.516 78.817 71.036 1.00 0.00 C ATOM 1347 C GLU A 86 -233.815 77.962 69.979 1.00 0.00 C ATOM 1348 O GLU A 86 -234.338 76.935 69.556 1.00 0.00 O ATOM 1349 CB GLU A 86 -235.840 79.338 70.473 1.00 0.00 C ATOM 1350 CG GLU A 86 -237.071 78.893 71.253 1.00 0.00 C ATOM 1351 CD GLU A 86 -237.339 77.403 71.161 1.00 0.00 C ATOM 1352 OE1 GLU A 86 -236.735 76.638 71.939 1.00 0.00 O ATOM 1353 OE2 GLU A 86 -238.184 76.996 70.333 1.00 0.00 O ATOM 0 H GLU A 86 -233.964 80.847 71.116 1.00 0.00 H new ATOM 0 HA GLU A 86 -234.717 78.204 71.914 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -235.810 80.427 70.455 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -235.939 79.004 69.440 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -236.947 79.168 72.300 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -237.942 79.434 70.883 1.00 0.00 H new ATOM 1360 N CYS A 87 -232.625 78.410 69.569 1.00 0.00 N ATOM 1361 CA CYS A 87 -231.820 77.731 68.557 1.00 0.00 C ATOM 1362 C CYS A 87 -232.507 77.765 67.189 1.00 0.00 C ATOM 1363 O CYS A 87 -233.459 77.038 66.947 1.00 0.00 O ATOM 1364 CB CYS A 87 -231.515 76.285 68.980 1.00 0.00 C ATOM 1365 SG CYS A 87 -230.848 76.130 70.658 1.00 0.00 S ATOM 0 H CYS A 87 -232.193 79.259 69.934 1.00 0.00 H new ATOM 0 HA CYS A 87 -230.875 78.266 68.469 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -232.430 75.696 68.908 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -230.803 75.854 68.276 1.00 0.00 H new ATOM 0 HG CYS A 87 -231.346 77.066 71.411 1.00 0.00 H new ATOM 1371 N VAL A 88 -232.017 78.614 66.291 1.00 0.00 N ATOM 1372 CA VAL A 88 -232.620 78.751 64.973 1.00 0.00 C ATOM 1373 C VAL A 88 -232.293 77.572 64.085 1.00 0.00 C ATOM 1374 O VAL A 88 -233.049 77.257 63.180 1.00 0.00 O ATOM 1375 CB VAL A 88 -232.206 80.046 64.258 1.00 0.00 C ATOM 1376 CG1 VAL A 88 -232.770 81.234 64.992 1.00 0.00 C ATOM 1377 CG2 VAL A 88 -230.696 80.157 64.136 1.00 0.00 C ATOM 0 H VAL A 88 -231.208 79.214 66.452 1.00 0.00 H new ATOM 0 HA VAL A 88 -233.695 78.788 65.149 1.00 0.00 H new ATOM 0 HB VAL A 88 -232.612 80.024 63.247 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -232.474 82.151 64.482 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -233.858 81.165 65.014 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -232.387 81.247 66.012 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -230.439 81.085 63.625 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -230.249 80.155 65.130 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -230.314 79.311 63.565 1.00 0.00 H new ATOM 1387 N PHE A 89 -231.178 76.912 64.339 1.00 0.00 N ATOM 1388 CA PHE A 89 -230.869 75.704 63.587 1.00 0.00 C ATOM 1389 C PHE A 89 -231.806 74.596 64.046 1.00 0.00 C ATOM 1390 O PHE A 89 -232.263 73.774 63.250 1.00 0.00 O ATOM 1391 CB PHE A 89 -229.386 75.304 63.735 1.00 0.00 C ATOM 1392 CG PHE A 89 -229.111 73.854 63.424 1.00 0.00 C ATOM 1393 CD1 PHE A 89 -229.281 72.871 64.394 1.00 0.00 C ATOM 1394 CD2 PHE A 89 -228.682 73.476 62.160 1.00 0.00 C ATOM 1395 CE1 PHE A 89 -229.029 71.543 64.103 1.00 0.00 C ATOM 1396 CE2 PHE A 89 -228.428 72.149 61.869 1.00 0.00 C ATOM 1397 CZ PHE A 89 -228.601 71.183 62.840 1.00 0.00 C ATOM 0 H PHE A 89 -230.487 77.180 65.040 1.00 0.00 H new ATOM 0 HA PHE A 89 -231.024 75.887 62.524 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -228.784 75.928 63.074 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -229.063 75.515 64.754 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -229.613 73.148 65.384 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -228.545 74.226 61.395 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -229.167 70.788 64.863 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -228.094 71.868 60.881 1.00 0.00 H new ATOM 0 HZ PHE A 89 -228.402 70.146 62.612 1.00 0.00 H new ATOM 1407 N GLN A 90 -232.122 74.614 65.333 1.00 0.00 N ATOM 1408 CA GLN A 90 -233.084 73.690 65.903 1.00 0.00 C ATOM 1409 C GLN A 90 -234.461 73.986 65.331 1.00 0.00 C ATOM 1410 O GLN A 90 -235.160 73.089 64.870 1.00 0.00 O ATOM 1411 CB GLN A 90 -233.106 73.834 67.417 1.00 0.00 C ATOM 1412 CG GLN A 90 -233.284 72.524 68.150 1.00 0.00 C ATOM 1413 CD GLN A 90 -234.683 71.950 68.035 1.00 0.00 C ATOM 1414 OE1 GLN A 90 -235.569 72.274 68.826 1.00 0.00 O ATOM 1415 NE2 GLN A 90 -234.884 71.079 67.061 1.00 0.00 N ATOM 0 H GLN A 90 -231.720 75.267 66.006 1.00 0.00 H new ATOM 0 HA GLN A 90 -232.800 72.668 65.653 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -232.175 74.299 67.742 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -233.914 74.510 67.697 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -232.570 71.799 67.760 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -233.046 72.671 69.203 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -234.122 70.838 66.427 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -235.801 70.648 66.944 1.00 0.00 H new ATOM 1424 N ALA A 91 -234.818 75.266 65.349 1.00 0.00 N ATOM 1425 CA ALA A 91 -236.065 75.735 64.770 1.00 0.00 C ATOM 1426 C ALA A 91 -236.165 75.288 63.322 1.00 0.00 C ATOM 1427 O ALA A 91 -237.163 74.715 62.907 1.00 0.00 O ATOM 1428 CB ALA A 91 -236.147 77.254 64.863 1.00 0.00 C ATOM 0 H ALA A 91 -234.250 76.004 65.765 1.00 0.00 H new ATOM 0 HA ALA A 91 -236.898 75.307 65.327 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -237.086 77.595 64.426 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -236.102 77.557 65.909 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -235.312 77.697 64.320 1.00 0.00 H new ATOM 1434 N GLN A 92 -235.097 75.524 62.579 1.00 0.00 N ATOM 1435 CA GLN A 92 -235.016 75.162 61.180 1.00 0.00 C ATOM 1436 C GLN A 92 -235.259 73.665 60.974 1.00 0.00 C ATOM 1437 O GLN A 92 -236.050 73.266 60.116 1.00 0.00 O ATOM 1438 CB GLN A 92 -233.637 75.538 60.652 1.00 0.00 C ATOM 1439 CG GLN A 92 -233.623 75.818 59.173 1.00 0.00 C ATOM 1440 CD GLN A 92 -232.331 75.397 58.498 1.00 0.00 C ATOM 1441 OE1 GLN A 92 -231.262 75.431 59.097 1.00 0.00 O ATOM 1442 NE2 GLN A 92 -232.429 74.976 57.246 1.00 0.00 N ATOM 0 H GLN A 92 -234.256 75.977 62.936 1.00 0.00 H new ATOM 0 HA GLN A 92 -235.790 75.702 60.635 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -233.279 76.419 61.185 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -232.939 74.729 60.868 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -234.457 75.297 58.703 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -233.780 76.884 59.010 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -233.337 74.963 56.782 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -231.596 74.665 56.746 1.00 0.00 H new ATOM 1451 N SER A 93 -234.584 72.840 61.771 1.00 0.00 N ATOM 1452 CA SER A 93 -234.750 71.391 61.696 1.00 0.00 C ATOM 1453 C SER A 93 -236.125 70.971 62.230 1.00 0.00 C ATOM 1454 O SER A 93 -236.524 69.811 62.134 1.00 0.00 O ATOM 1455 CB SER A 93 -233.638 70.698 62.490 1.00 0.00 C ATOM 1456 OG SER A 93 -233.613 71.134 63.840 1.00 0.00 O ATOM 0 H SER A 93 -233.916 73.151 62.477 1.00 0.00 H new ATOM 0 HA SER A 93 -234.685 71.088 60.651 1.00 0.00 H new ATOM 0 HB2 SER A 93 -233.785 69.618 62.458 1.00 0.00 H new ATOM 0 HB3 SER A 93 -232.675 70.902 62.023 1.00 0.00 H new ATOM 0 HG SER A 93 -234.310 71.809 63.979 1.00 0.00 H new ATOM 1462 N LYS A 94 -236.841 71.937 62.777 1.00 0.00 N ATOM 1463 CA LYS A 94 -238.131 71.710 63.410 1.00 0.00 C ATOM 1464 C LYS A 94 -239.258 72.247 62.518 1.00 0.00 C ATOM 1465 O LYS A 94 -240.440 72.173 62.858 1.00 0.00 O ATOM 1466 CB LYS A 94 -238.099 72.397 64.785 1.00 0.00 C ATOM 1467 CG LYS A 94 -239.373 72.320 65.604 1.00 0.00 C ATOM 1468 CD LYS A 94 -239.115 72.724 67.051 1.00 0.00 C ATOM 1469 CE LYS A 94 -238.392 74.067 67.162 1.00 0.00 C ATOM 1470 NZ LYS A 94 -239.208 75.193 66.622 1.00 0.00 N ATOM 0 H LYS A 94 -236.541 72.912 62.795 1.00 0.00 H new ATOM 0 HA LYS A 94 -238.324 70.646 63.546 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -237.290 71.957 65.368 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -237.850 73.448 64.637 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -240.130 72.973 65.169 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -239.771 71.306 65.571 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -240.064 72.780 67.584 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -238.520 71.953 67.540 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -238.152 74.263 68.207 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -237.446 74.014 66.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -238.936 76.078 67.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -239.042 75.283 65.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -240.216 75.004 66.793 1.00 0.00 H new ATOM 1484 N TRP A 95 -238.873 72.796 61.372 1.00 0.00 N ATOM 1485 CA TRP A 95 -239.832 73.307 60.399 1.00 0.00 C ATOM 1486 C TRP A 95 -240.546 72.209 59.644 1.00 0.00 C ATOM 1487 O TRP A 95 -240.065 71.081 59.532 1.00 0.00 O ATOM 1488 CB TRP A 95 -239.154 74.249 59.411 1.00 0.00 C ATOM 1489 CG TRP A 95 -238.865 75.577 60.006 1.00 0.00 C ATOM 1490 CD1 TRP A 95 -239.131 75.965 61.277 1.00 0.00 C ATOM 1491 CD2 TRP A 95 -238.275 76.696 59.358 1.00 0.00 C ATOM 1492 NE1 TRP A 95 -238.732 77.251 61.470 1.00 0.00 N ATOM 1493 CE2 TRP A 95 -238.203 77.732 60.300 1.00 0.00 C ATOM 1494 CE3 TRP A 95 -237.793 76.914 58.071 1.00 0.00 C ATOM 1495 CZ2 TRP A 95 -237.674 78.980 59.990 1.00 0.00 C ATOM 1496 CZ3 TRP A 95 -237.267 78.152 57.762 1.00 0.00 C ATOM 1497 CH2 TRP A 95 -237.209 79.169 58.717 1.00 0.00 C ATOM 0 H TRP A 95 -237.898 72.899 61.092 1.00 0.00 H new ATOM 0 HA TRP A 95 -240.582 73.853 60.971 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -238.224 73.799 59.063 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -239.793 74.376 58.537 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -239.593 75.342 62.029 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -238.813 77.773 62.343 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -237.830 76.130 57.329 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -237.632 79.770 60.726 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -236.894 78.337 56.765 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -236.788 80.126 58.445 1.00 0.00 H new ATOM 1508 N LYS A 96 -241.704 72.574 59.127 1.00 0.00 N ATOM 1509 CA LYS A 96 -242.549 71.669 58.370 1.00 0.00 C ATOM 1510 C LYS A 96 -242.758 72.230 56.974 1.00 0.00 C ATOM 1511 O LYS A 96 -243.727 71.914 56.287 1.00 0.00 O ATOM 1512 CB LYS A 96 -243.884 71.480 59.087 1.00 0.00 C ATOM 1513 CG LYS A 96 -243.807 70.508 60.252 1.00 0.00 C ATOM 1514 CD LYS A 96 -243.117 71.084 61.482 1.00 0.00 C ATOM 1515 CE LYS A 96 -243.826 72.310 62.035 1.00 0.00 C ATOM 1516 NZ LYS A 96 -243.173 72.796 63.281 1.00 0.00 N ATOM 0 H LYS A 96 -242.088 73.514 59.221 1.00 0.00 H new ATOM 0 HA LYS A 96 -242.067 70.695 58.289 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -244.233 72.446 59.451 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -244.625 71.122 58.372 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -244.816 70.198 60.523 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -243.274 69.612 59.933 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -243.067 70.319 62.257 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -242.091 71.348 61.227 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -243.823 73.103 61.287 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -244.869 72.068 62.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -243.327 73.820 63.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -243.583 72.306 64.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -242.152 72.602 63.236 1.00 0.00 H new ATOM 1530 N GLY A 97 -241.812 73.063 56.574 1.00 0.00 N ATOM 1531 CA GLY A 97 -241.874 73.741 55.301 1.00 0.00 C ATOM 1532 C GLY A 97 -240.708 74.693 55.155 1.00 0.00 C ATOM 1533 O GLY A 97 -239.836 74.733 56.025 1.00 0.00 O ATOM 0 H GLY A 97 -240.983 73.285 57.125 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -241.860 73.011 54.492 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -242.812 74.289 55.219 1.00 0.00 H new ATOM 1537 N ALA A 98 -240.682 75.461 54.082 1.00 0.00 N ATOM 1538 CA ALA A 98 -239.600 76.405 53.859 1.00 0.00 C ATOM 1539 C ALA A 98 -240.010 77.813 54.263 1.00 0.00 C ATOM 1540 O ALA A 98 -240.780 78.471 53.562 1.00 0.00 O ATOM 1541 CB ALA A 98 -239.160 76.376 52.405 1.00 0.00 C ATOM 0 H ALA A 98 -241.395 75.451 53.352 1.00 0.00 H new ATOM 0 HA ALA A 98 -238.758 76.107 54.484 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -238.349 77.089 52.256 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -238.814 75.374 52.149 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -240.001 76.644 51.765 1.00 0.00 H new ATOM 1547 N GLY A 99 -239.505 78.269 55.399 1.00 0.00 N ATOM 1548 CA GLY A 99 -239.828 79.597 55.864 1.00 0.00 C ATOM 1549 C GLY A 99 -238.635 80.532 55.818 1.00 0.00 C ATOM 1550 O GLY A 99 -237.790 80.431 54.927 1.00 0.00 O ATOM 0 H GLY A 99 -238.877 77.741 56.006 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -240.632 80.008 55.253 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -240.202 79.540 56.886 1.00 0.00 H new ATOM 1554 N LYS A 100 -238.582 81.440 56.781 1.00 0.00 N ATOM 1555 CA LYS A 100 -237.461 82.357 56.954 1.00 0.00 C ATOM 1556 C LYS A 100 -237.481 82.928 58.362 1.00 0.00 C ATOM 1557 O LYS A 100 -238.554 83.114 58.948 1.00 0.00 O ATOM 1558 CB LYS A 100 -237.458 83.504 55.922 1.00 0.00 C ATOM 1559 CG LYS A 100 -238.715 83.647 55.088 1.00 0.00 C ATOM 1560 CD LYS A 100 -239.811 84.378 55.837 1.00 0.00 C ATOM 1561 CE LYS A 100 -240.932 84.758 54.891 1.00 0.00 C ATOM 1562 NZ LYS A 100 -241.616 83.565 54.323 1.00 0.00 N ATOM 0 H LYS A 100 -239.322 81.564 57.472 1.00 0.00 H new ATOM 0 HA LYS A 100 -236.549 81.783 56.791 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -237.287 84.442 56.450 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -236.613 83.359 55.249 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -238.482 84.186 54.170 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -239.071 82.659 54.796 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -240.199 83.746 56.636 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -239.404 85.273 56.308 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -241.659 85.374 55.420 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -240.531 85.365 54.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -242.386 83.872 53.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -240.933 82.998 53.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -242.008 82.989 55.095 1.00 0.00 H new ATOM 1576 N PHE A 101 -236.305 83.163 58.925 1.00 0.00 N ATOM 1577 CA PHE A 101 -236.225 83.803 60.226 1.00 0.00 C ATOM 1578 C PHE A 101 -236.399 85.310 60.077 1.00 0.00 C ATOM 1579 O PHE A 101 -235.938 85.895 59.111 1.00 0.00 O ATOM 1580 CB PHE A 101 -234.909 83.429 60.899 1.00 0.00 C ATOM 1581 CG PHE A 101 -234.789 81.941 61.108 1.00 0.00 C ATOM 1582 CD1 PHE A 101 -235.315 81.338 62.240 1.00 0.00 C ATOM 1583 CD2 PHE A 101 -234.171 81.140 60.159 1.00 0.00 C ATOM 1584 CE1 PHE A 101 -235.221 79.970 62.423 1.00 0.00 C ATOM 1585 CE2 PHE A 101 -234.077 79.774 60.337 1.00 0.00 C ATOM 1586 CZ PHE A 101 -234.601 79.189 61.468 1.00 0.00 C ATOM 0 H PHE A 101 -235.406 82.924 58.507 1.00 0.00 H new ATOM 0 HA PHE A 101 -237.032 83.451 60.868 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -234.077 83.778 60.288 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -234.835 83.938 61.860 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -235.804 81.944 62.988 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -233.758 81.591 59.269 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -235.632 79.514 63.311 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -233.592 79.164 59.589 1.00 0.00 H new ATOM 0 HZ PHE A 101 -234.527 78.121 61.608 1.00 0.00 H new ATOM 1596 N ILE A 102 -237.112 85.931 61.003 1.00 0.00 N ATOM 1597 CA ILE A 102 -237.444 87.348 60.874 1.00 0.00 C ATOM 1598 C ILE A 102 -237.082 88.118 62.140 1.00 0.00 C ATOM 1599 O ILE A 102 -237.504 87.747 63.235 1.00 0.00 O ATOM 1600 CB ILE A 102 -238.951 87.533 60.579 1.00 0.00 C ATOM 1601 CG1 ILE A 102 -239.343 86.747 59.323 1.00 0.00 C ATOM 1602 CG2 ILE A 102 -239.290 89.009 60.415 1.00 0.00 C ATOM 1603 CD1 ILE A 102 -240.834 86.702 59.073 1.00 0.00 C ATOM 0 H ILE A 102 -237.471 85.484 61.847 1.00 0.00 H new ATOM 0 HA ILE A 102 -236.861 87.743 60.042 1.00 0.00 H new ATOM 0 HB ILE A 102 -239.520 87.147 61.424 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -238.852 87.193 58.458 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -238.968 85.727 59.412 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -240.355 89.117 60.208 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -239.043 89.543 61.332 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -238.716 89.424 59.587 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -241.034 86.129 58.168 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -241.331 86.228 59.920 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -241.213 87.717 58.951 1.00 0.00 H new ATOM 1615 N LEU A 103 -236.293 89.179 61.989 1.00 0.00 N ATOM 1616 CA LEU A 103 -235.886 89.994 63.131 1.00 0.00 C ATOM 1617 C LEU A 103 -237.036 90.858 63.629 1.00 0.00 C ATOM 1618 O LEU A 103 -237.675 91.572 62.855 1.00 0.00 O ATOM 1619 CB LEU A 103 -234.694 90.892 62.778 1.00 0.00 C ATOM 1620 CG LEU A 103 -233.306 90.324 63.102 1.00 0.00 C ATOM 1621 CD1 LEU A 103 -232.915 89.223 62.130 1.00 0.00 C ATOM 1622 CD2 LEU A 103 -232.264 91.432 63.102 1.00 0.00 C ATOM 0 H LEU A 103 -235.924 89.494 61.092 1.00 0.00 H new ATOM 0 HA LEU A 103 -235.589 89.306 63.923 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -234.734 91.113 61.711 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -234.809 91.839 63.305 1.00 0.00 H new ATOM 0 HG LEU A 103 -233.350 89.885 64.099 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -231.927 88.843 62.389 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -233.641 88.412 62.187 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -232.896 89.623 61.116 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -231.286 91.011 63.334 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -232.233 91.903 62.119 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -232.525 92.177 63.853 1.00 0.00 H new ATOM 1634 N LYS A 104 -237.295 90.781 64.924 1.00 0.00 N ATOM 1635 CA LYS A 104 -238.310 91.598 65.569 1.00 0.00 C ATOM 1636 C LYS A 104 -237.833 91.934 66.980 1.00 0.00 C ATOM 1637 O LYS A 104 -236.758 91.498 67.383 1.00 0.00 O ATOM 1638 CB LYS A 104 -239.648 90.857 65.598 1.00 0.00 C ATOM 1639 CG LYS A 104 -240.839 91.765 65.845 1.00 0.00 C ATOM 1640 CD LYS A 104 -242.145 91.002 65.777 1.00 0.00 C ATOM 1641 CE LYS A 104 -242.467 90.529 64.365 1.00 0.00 C ATOM 1642 NZ LYS A 104 -242.661 91.666 63.426 1.00 0.00 N ATOM 0 H LYS A 104 -236.807 90.149 65.559 1.00 0.00 H new ATOM 0 HA LYS A 104 -238.462 92.522 65.011 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -239.787 90.338 64.649 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -239.615 90.095 66.376 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -240.742 92.235 66.824 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -240.846 92.566 65.106 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -242.095 90.141 66.443 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -242.954 91.638 66.138 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -241.659 89.894 64.003 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -243.369 89.917 64.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -243.135 91.328 62.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -243.247 92.395 63.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -241.736 92.071 63.176 1.00 0.00 H new ATOM 1656 N LEU A 105 -238.599 92.711 67.724 1.00 0.00 N ATOM 1657 CA LEU A 105 -238.215 93.059 69.083 1.00 0.00 C ATOM 1658 C LEU A 105 -239.086 92.372 70.113 1.00 0.00 C ATOM 1659 O LEU A 105 -240.292 92.212 69.928 1.00 0.00 O ATOM 1660 CB LEU A 105 -238.258 94.565 69.305 1.00 0.00 C ATOM 1661 CG LEU A 105 -237.120 95.340 68.658 1.00 0.00 C ATOM 1662 CD1 LEU A 105 -237.118 96.763 69.143 1.00 0.00 C ATOM 1663 CD2 LEU A 105 -235.793 94.710 68.974 1.00 0.00 C ATOM 0 H LEU A 105 -239.485 93.111 67.415 1.00 0.00 H new ATOM 0 HA LEU A 105 -237.190 92.710 69.211 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -239.204 94.948 68.921 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -238.248 94.760 70.377 1.00 0.00 H new ATOM 0 HG LEU A 105 -237.274 95.320 67.579 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -236.299 97.307 68.672 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -238.065 97.237 68.884 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -236.989 96.778 70.225 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -234.996 95.283 68.500 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -235.642 94.702 70.053 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -235.777 93.687 68.598 1.00 0.00 H new ATOM 1675 N LYS A 106 -238.455 91.993 71.208 1.00 0.00 N ATOM 1676 CA LYS A 106 -239.118 91.302 72.297 1.00 0.00 C ATOM 1677 C LYS A 106 -239.800 92.300 73.218 1.00 0.00 C ATOM 1678 O LYS A 106 -240.658 91.946 74.020 1.00 0.00 O ATOM 1679 CB LYS A 106 -238.091 90.473 73.051 1.00 0.00 C ATOM 1680 CG LYS A 106 -236.985 91.307 73.630 1.00 0.00 C ATOM 1681 CD LYS A 106 -235.758 90.481 73.985 1.00 0.00 C ATOM 1682 CE LYS A 106 -236.005 89.579 75.173 1.00 0.00 C ATOM 1683 NZ LYS A 106 -234.760 88.900 75.623 1.00 0.00 N ATOM 0 H LYS A 106 -237.461 92.157 71.368 1.00 0.00 H new ATOM 0 HA LYS A 106 -239.888 90.640 71.902 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -238.588 89.929 73.854 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -237.665 89.729 72.377 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -236.704 92.080 72.914 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -237.347 91.816 74.523 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -235.467 89.877 73.126 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -234.923 91.147 74.203 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -236.416 90.165 75.995 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -236.752 88.830 74.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -235.005 88.103 76.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -234.239 88.547 74.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -234.165 89.575 76.144 1.00 0.00 H new