USER MOD reduce.3.24.130724 H: found=0, std=0, add=909, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 912 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 66 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 105 ASN : amide:sc= -10.6! C(o=-11!,f=-15!) USER MOD Single : A 8 MET CE :methyl -153:sc= -3.41 (180deg=-6.03!) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 CYS SG : rot 130:sc= -1.11 USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 64:sc= -0.841! USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 146:sc= -1.66! USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0.0953 K(o=0.095,f=-4!) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 LYS NZ :NH3+ -167:sc= -0.0493 (180deg=-0.284) USER MOD Single : A 65 ASN : amide:sc= -2.58 K(o=-2.6,f=-7.7!) USER MOD Single : A 67 LYS NZ :NH3+ -111:sc= -7.26! (180deg=-13.2!) USER MOD Single : A 77 TYR OH : rot 64:sc= 1.18 USER MOD Single : A 82 LYS NZ :NH3+ -170:sc= -1.29 (180deg=-2.08) USER MOD Single : A 85 CYS SG : rot -168:sc= -2.23 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 70:sc= -2.12! USER MOD Single : A 94 SER OG : rot 158:sc= -1.2! USER MOD Single : A 102 SER OG : rot 180:sc= 0.00144 USER MOD Single : A 118 LYS NZ :NH3+ -140:sc= -0.423 (180deg=-1.71!) USER MOD Single : A 125 SER OG : rot -53:sc= 0.125 USER MOD ----------------------------------------------------------------- ATOM 102 N MET A 8 -3.861 6.644 -11.533 1.00 0.00 N ATOM 103 CA MET A 8 -2.615 7.079 -10.921 1.00 0.00 C ATOM 104 C MET A 8 -1.967 5.952 -10.125 1.00 0.00 C ATOM 105 O MET A 8 -2.600 5.333 -9.269 1.00 0.00 O ATOM 106 CB MET A 8 -2.858 8.305 -10.033 1.00 0.00 C ATOM 107 CG MET A 8 -3.666 8.034 -8.768 1.00 0.00 C ATOM 108 SD MET A 8 -5.446 8.028 -9.065 1.00 0.00 S ATOM 109 CE MET A 8 -6.044 8.871 -7.603 1.00 0.00 C ATOM 0 HA MET A 8 -1.925 7.358 -11.717 1.00 0.00 H new ATOM 0 HB2 MET A 8 -1.894 8.725 -9.747 1.00 0.00 H new ATOM 0 HB3 MET A 8 -3.375 9.064 -10.621 1.00 0.00 H new ATOM 0 HG2 MET A 8 -3.368 7.072 -8.351 1.00 0.00 H new ATOM 0 HG3 MET A 8 -3.429 8.792 -8.021 1.00 0.00 H new ATOM 0 HE1 MET A 8 -7.061 8.545 -7.386 1.00 0.00 H new ATOM 0 HE2 MET A 8 -5.398 8.635 -6.757 1.00 0.00 H new ATOM 0 HE3 MET A 8 -6.037 9.947 -7.775 1.00 0.00 H new ATOM 119 N ARG A 9 -0.701 5.677 -10.428 1.00 0.00 N ATOM 120 CA ARG A 9 0.032 4.610 -9.749 1.00 0.00 C ATOM 121 C ARG A 9 1.408 5.070 -9.274 1.00 0.00 C ATOM 122 O ARG A 9 2.079 5.857 -9.940 1.00 0.00 O ATOM 123 CB ARG A 9 0.177 3.394 -10.674 1.00 0.00 C ATOM 124 CG ARG A 9 1.374 3.466 -11.614 1.00 0.00 C ATOM 125 CD ARG A 9 2.577 2.723 -11.047 1.00 0.00 C ATOM 126 NE ARG A 9 3.278 1.953 -12.073 1.00 0.00 N ATOM 127 CZ ARG A 9 3.898 2.500 -13.117 1.00 0.00 C ATOM 128 NH1 ARG A 9 3.912 3.818 -13.275 1.00 0.00 N ATOM 129 NH2 ARG A 9 4.509 1.725 -14.003 1.00 0.00 N ATOM 0 H ARG A 9 -0.162 6.176 -11.136 1.00 0.00 H new ATOM 0 HA ARG A 9 -0.545 4.331 -8.867 1.00 0.00 H new ATOM 0 HB2 ARG A 9 0.262 2.495 -10.064 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -0.732 3.292 -11.267 1.00 0.00 H new ATOM 0 HG2 ARG A 9 1.105 3.040 -12.580 1.00 0.00 H new ATOM 0 HG3 ARG A 9 1.639 4.509 -11.788 1.00 0.00 H new ATOM 0 HD2 ARG A 9 3.265 3.438 -10.597 1.00 0.00 H new ATOM 0 HD3 ARG A 9 2.248 2.053 -10.252 1.00 0.00 H new ATOM 0 HE ARG A 9 3.293 0.937 -11.984 1.00 0.00 H new ATOM 0 HH11 ARG A 9 3.446 4.418 -12.595 1.00 0.00 H new ATOM 0 HH12 ARG A 9 4.389 4.230 -14.077 1.00 0.00 H new ATOM 0 HH21 ARG A 9 4.503 0.712 -13.884 1.00 0.00 H new ATOM 0 HH22 ARG A 9 4.984 2.142 -14.803 1.00 0.00 H new ATOM 143 N LEU A 10 1.831 4.537 -8.130 1.00 0.00 N ATOM 144 CA LEU A 10 3.147 4.855 -7.576 1.00 0.00 C ATOM 145 C LEU A 10 4.036 3.620 -7.627 1.00 0.00 C ATOM 146 O LEU A 10 3.547 2.501 -7.785 1.00 0.00 O ATOM 147 CB LEU A 10 3.072 5.384 -6.127 1.00 0.00 C ATOM 148 CG LEU A 10 1.682 5.443 -5.486 1.00 0.00 C ATOM 149 CD1 LEU A 10 1.801 5.670 -3.979 1.00 0.00 C ATOM 150 CD2 LEU A 10 0.854 6.549 -6.121 1.00 0.00 C ATOM 0 H LEU A 10 1.284 3.884 -7.569 1.00 0.00 H new ATOM 0 HA LEU A 10 3.570 5.652 -8.187 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.708 4.757 -5.503 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.498 6.387 -6.109 1.00 0.00 H new ATOM 0 HG LEU A 10 1.181 4.490 -5.656 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.805 5.710 -3.537 1.00 0.00 H new ATOM 0 HD12 LEU A 10 2.364 4.851 -3.531 1.00 0.00 H new ATOM 0 HD13 LEU A 10 2.318 6.611 -3.793 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.131 6.579 -5.655 1.00 0.00 H new ATOM 0 HD22 LEU A 10 1.353 7.507 -5.975 1.00 0.00 H new ATOM 0 HD23 LEU A 10 0.745 6.355 -7.188 1.00 0.00 H new ATOM 162 N ARG A 11 5.338 3.826 -7.504 1.00 0.00 N ATOM 163 CA ARG A 11 6.287 2.721 -7.546 1.00 0.00 C ATOM 164 C ARG A 11 6.804 2.394 -6.145 1.00 0.00 C ATOM 165 O ARG A 11 7.031 3.292 -5.333 1.00 0.00 O ATOM 166 CB ARG A 11 7.454 3.069 -8.474 1.00 0.00 C ATOM 167 CG ARG A 11 7.673 2.054 -9.585 1.00 0.00 C ATOM 168 CD ARG A 11 8.352 0.796 -9.068 1.00 0.00 C ATOM 169 NE ARG A 11 9.806 0.871 -9.183 1.00 0.00 N ATOM 170 CZ ARG A 11 10.469 0.681 -10.320 1.00 0.00 C ATOM 171 NH1 ARG A 11 9.817 0.402 -11.440 1.00 0.00 N ATOM 172 NH2 ARG A 11 11.794 0.772 -10.337 1.00 0.00 N ATOM 0 H ARG A 11 5.762 4.745 -7.375 1.00 0.00 H new ATOM 0 HA ARG A 11 5.774 1.840 -7.933 1.00 0.00 H new ATOM 0 HB2 ARG A 11 7.274 4.048 -8.918 1.00 0.00 H new ATOM 0 HB3 ARG A 11 8.366 3.150 -7.882 1.00 0.00 H new ATOM 0 HG2 ARG A 11 6.715 1.793 -10.034 1.00 0.00 H new ATOM 0 HG3 ARG A 11 8.282 2.500 -10.371 1.00 0.00 H new ATOM 0 HD2 ARG A 11 8.079 0.640 -8.024 1.00 0.00 H new ATOM 0 HD3 ARG A 11 7.988 -0.067 -9.626 1.00 0.00 H new ATOM 0 HE ARG A 11 10.344 1.081 -8.342 1.00 0.00 H new ATOM 0 HH11 ARG A 11 8.799 0.332 -11.434 1.00 0.00 H new ATOM 0 HH12 ARG A 11 10.333 0.258 -12.308 1.00 0.00 H new ATOM 0 HH21 ARG A 11 12.301 0.987 -9.479 1.00 0.00 H new ATOM 0 HH22 ARG A 11 12.304 0.627 -11.208 1.00 0.00 H new ATOM 186 N ILE A 12 7.003 1.107 -5.872 1.00 0.00 N ATOM 187 CA ILE A 12 7.507 0.669 -4.576 1.00 0.00 C ATOM 188 C ILE A 12 8.530 -0.447 -4.772 1.00 0.00 C ATOM 189 O ILE A 12 8.178 -1.592 -5.056 1.00 0.00 O ATOM 190 CB ILE A 12 6.353 0.222 -3.625 1.00 0.00 C ATOM 191 CG1 ILE A 12 6.085 1.313 -2.588 1.00 0.00 C ATOM 192 CG2 ILE A 12 6.658 -1.099 -2.926 1.00 0.00 C ATOM 193 CD1 ILE A 12 4.646 1.362 -2.122 1.00 0.00 C ATOM 0 H ILE A 12 6.823 0.350 -6.532 1.00 0.00 H new ATOM 0 HA ILE A 12 7.997 1.515 -4.094 1.00 0.00 H new ATOM 0 HB ILE A 12 5.465 0.066 -4.238 1.00 0.00 H new ATOM 0 HG12 ILE A 12 6.732 1.151 -1.726 1.00 0.00 H new ATOM 0 HG13 ILE A 12 6.355 2.280 -3.012 1.00 0.00 H new ATOM 0 HG21 ILE A 12 5.825 -1.367 -2.276 1.00 0.00 H new ATOM 0 HG22 ILE A 12 6.802 -1.881 -3.672 1.00 0.00 H new ATOM 0 HG23 ILE A 12 7.565 -0.994 -2.330 1.00 0.00 H new ATOM 0 HD11 ILE A 12 4.528 2.159 -1.388 1.00 0.00 H new ATOM 0 HD12 ILE A 12 3.994 1.555 -2.974 1.00 0.00 H new ATOM 0 HD13 ILE A 12 4.378 0.408 -1.668 1.00 0.00 H new ATOM 205 N ARG A 13 9.805 -0.093 -4.644 1.00 0.00 N ATOM 206 CA ARG A 13 10.885 -1.058 -4.827 1.00 0.00 C ATOM 207 C ARG A 13 11.438 -1.541 -3.491 1.00 0.00 C ATOM 208 O ARG A 13 11.333 -0.859 -2.472 1.00 0.00 O ATOM 209 CB ARG A 13 12.015 -0.456 -5.671 1.00 0.00 C ATOM 210 CG ARG A 13 12.579 0.840 -5.110 1.00 0.00 C ATOM 211 CD ARG A 13 12.862 1.853 -6.209 1.00 0.00 C ATOM 212 NE ARG A 13 14.291 2.126 -6.345 1.00 0.00 N ATOM 213 CZ ARG A 13 15.149 1.304 -6.950 1.00 0.00 C ATOM 214 NH1 ARG A 13 14.725 0.163 -7.477 1.00 0.00 N ATOM 215 NH2 ARG A 13 16.432 1.628 -7.030 1.00 0.00 N ATOM 0 H ARG A 13 10.115 0.851 -4.415 1.00 0.00 H new ATOM 0 HA ARG A 13 10.466 -1.916 -5.353 1.00 0.00 H new ATOM 0 HB2 ARG A 13 12.821 -1.185 -5.755 1.00 0.00 H new ATOM 0 HB3 ARG A 13 11.644 -0.273 -6.680 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.873 1.265 -4.396 1.00 0.00 H new ATOM 0 HG3 ARG A 13 13.498 0.630 -4.563 1.00 0.00 H new ATOM 0 HD2 ARG A 13 12.472 1.479 -7.156 1.00 0.00 H new ATOM 0 HD3 ARG A 13 12.334 2.782 -5.991 1.00 0.00 H new ATOM 0 HE ARG A 13 14.653 2.996 -5.954 1.00 0.00 H new ATOM 0 HH11 ARG A 13 13.738 -0.089 -7.421 1.00 0.00 H new ATOM 0 HH12 ARG A 13 15.386 -0.462 -7.939 1.00 0.00 H new ATOM 0 HH21 ARG A 13 16.762 2.506 -6.629 1.00 0.00 H new ATOM 0 HH22 ARG A 13 17.089 1.000 -7.493 1.00 0.00 H new ATOM 229 N PHE A 14 12.036 -2.725 -3.521 1.00 0.00 N ATOM 230 CA PHE A 14 12.627 -3.335 -2.339 1.00 0.00 C ATOM 231 C PHE A 14 13.969 -3.957 -2.704 1.00 0.00 C ATOM 232 O PHE A 14 14.110 -4.568 -3.764 1.00 0.00 O ATOM 233 CB PHE A 14 11.693 -4.403 -1.759 1.00 0.00 C ATOM 234 CG PHE A 14 10.832 -3.910 -0.630 1.00 0.00 C ATOM 235 CD1 PHE A 14 9.944 -2.865 -0.824 1.00 0.00 C ATOM 236 CD2 PHE A 14 10.908 -4.494 0.626 1.00 0.00 C ATOM 237 CE1 PHE A 14 9.147 -2.411 0.211 1.00 0.00 C ATOM 238 CE2 PHE A 14 10.115 -4.044 1.664 1.00 0.00 C ATOM 239 CZ PHE A 14 9.234 -3.002 1.456 1.00 0.00 C ATOM 0 H PHE A 14 12.125 -3.289 -4.366 1.00 0.00 H new ATOM 0 HA PHE A 14 12.778 -2.565 -1.583 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.051 -4.781 -2.555 1.00 0.00 H new ATOM 0 HB3 PHE A 14 12.292 -5.243 -1.407 1.00 0.00 H new ATOM 0 HD1 PHE A 14 9.873 -2.399 -1.796 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.595 -5.310 0.794 1.00 0.00 H new ATOM 0 HE1 PHE A 14 8.458 -1.596 0.046 1.00 0.00 H new ATOM 0 HE2 PHE A 14 10.184 -4.507 2.637 1.00 0.00 H new ATOM 0 HZ PHE A 14 8.613 -2.649 2.266 1.00 0.00 H new ATOM 249 N GLU A 15 14.956 -3.784 -1.836 1.00 0.00 N ATOM 250 CA GLU A 15 16.298 -4.317 -2.076 1.00 0.00 C ATOM 251 C GLU A 15 16.270 -5.744 -2.624 1.00 0.00 C ATOM 252 O GLU A 15 17.179 -6.155 -3.342 1.00 0.00 O ATOM 253 CB GLU A 15 17.130 -4.292 -0.787 1.00 0.00 C ATOM 254 CG GLU A 15 18.075 -3.104 -0.673 1.00 0.00 C ATOM 255 CD GLU A 15 17.498 -1.825 -1.250 1.00 0.00 C ATOM 256 OE1 GLU A 15 16.753 -1.131 -0.525 1.00 0.00 O ATOM 257 OE2 GLU A 15 17.790 -1.517 -2.424 1.00 0.00 O ATOM 0 H GLU A 15 14.856 -3.278 -0.956 1.00 0.00 H new ATOM 0 HA GLU A 15 16.755 -3.673 -2.827 1.00 0.00 H new ATOM 0 HB2 GLU A 15 16.454 -4.286 0.068 1.00 0.00 H new ATOM 0 HB3 GLU A 15 17.712 -5.211 -0.727 1.00 0.00 H new ATOM 0 HG2 GLU A 15 18.321 -2.943 0.377 1.00 0.00 H new ATOM 0 HG3 GLU A 15 19.007 -3.339 -1.187 1.00 0.00 H new ATOM 264 N SER A 16 15.237 -6.499 -2.268 1.00 0.00 N ATOM 265 CA SER A 16 15.125 -7.882 -2.717 1.00 0.00 C ATOM 266 C SER A 16 13.787 -8.155 -3.402 1.00 0.00 C ATOM 267 O SER A 16 13.354 -9.304 -3.480 1.00 0.00 O ATOM 268 CB SER A 16 15.294 -8.833 -1.531 1.00 0.00 C ATOM 269 OG SER A 16 16.656 -9.178 -1.344 1.00 0.00 O ATOM 0 H SER A 16 14.471 -6.180 -1.675 1.00 0.00 H new ATOM 0 HA SER A 16 15.917 -8.052 -3.447 1.00 0.00 H new ATOM 0 HB2 SER A 16 14.907 -8.364 -0.627 1.00 0.00 H new ATOM 0 HB3 SER A 16 14.707 -9.736 -1.698 1.00 0.00 H new ATOM 0 HG SER A 16 16.738 -9.785 -0.579 1.00 0.00 H new ATOM 275 N ALA A 17 13.134 -7.108 -3.902 1.00 0.00 N ATOM 276 CA ALA A 17 11.844 -7.292 -4.578 1.00 0.00 C ATOM 277 C ALA A 17 11.304 -5.992 -5.168 1.00 0.00 C ATOM 278 O ALA A 17 11.609 -4.903 -4.687 1.00 0.00 O ATOM 279 CB ALA A 17 10.824 -7.899 -3.619 1.00 0.00 C ATOM 0 H ALA A 17 13.464 -6.144 -3.856 1.00 0.00 H new ATOM 0 HA ALA A 17 12.014 -7.977 -5.409 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.873 -8.029 -4.135 1.00 0.00 H new ATOM 0 HB2 ALA A 17 11.184 -8.867 -3.270 1.00 0.00 H new ATOM 0 HB3 ALA A 17 10.686 -7.235 -2.766 1.00 0.00 H new ATOM 285 N GLU A 18 10.491 -6.123 -6.219 1.00 0.00 N ATOM 286 CA GLU A 18 9.892 -4.961 -6.885 1.00 0.00 C ATOM 287 C GLU A 18 8.405 -5.189 -7.157 1.00 0.00 C ATOM 288 O GLU A 18 7.985 -6.310 -7.446 1.00 0.00 O ATOM 289 CB GLU A 18 10.623 -4.668 -8.197 1.00 0.00 C ATOM 290 CG GLU A 18 10.489 -5.775 -9.229 1.00 0.00 C ATOM 291 CD GLU A 18 9.537 -5.414 -10.353 1.00 0.00 C ATOM 292 OE1 GLU A 18 8.313 -5.378 -10.105 1.00 0.00 O ATOM 293 OE2 GLU A 18 10.015 -5.168 -11.481 1.00 0.00 O ATOM 0 H GLU A 18 10.232 -7.021 -6.628 1.00 0.00 H new ATOM 0 HA GLU A 18 9.991 -4.103 -6.220 1.00 0.00 H new ATOM 0 HB2 GLU A 18 10.236 -3.740 -8.619 1.00 0.00 H new ATOM 0 HB3 GLU A 18 11.680 -4.506 -7.986 1.00 0.00 H new ATOM 0 HG2 GLU A 18 11.471 -5.997 -9.647 1.00 0.00 H new ATOM 0 HG3 GLU A 18 10.138 -6.683 -8.739 1.00 0.00 H new ATOM 300 N CYS A 19 7.606 -4.122 -7.064 1.00 0.00 N ATOM 301 CA CYS A 19 6.161 -4.230 -7.303 1.00 0.00 C ATOM 302 C CYS A 19 5.530 -2.857 -7.544 1.00 0.00 C ATOM 303 O CYS A 19 5.988 -1.853 -6.998 1.00 0.00 O ATOM 304 CB CYS A 19 5.453 -4.930 -6.125 1.00 0.00 C ATOM 305 SG CYS A 19 6.491 -5.219 -4.669 1.00 0.00 S ATOM 0 H CYS A 19 7.929 -3.184 -6.828 1.00 0.00 H new ATOM 0 HA CYS A 19 6.030 -4.834 -8.201 1.00 0.00 H new ATOM 0 HB2 CYS A 19 4.595 -4.327 -5.827 1.00 0.00 H new ATOM 0 HB3 CYS A 19 5.065 -5.888 -6.472 1.00 0.00 H new ATOM 0 HG CYS A 19 5.879 -4.786 -3.607 1.00 0.00 H new ATOM 311 N GLU A 20 4.473 -2.821 -8.360 1.00 0.00 N ATOM 312 CA GLU A 20 3.781 -1.570 -8.659 1.00 0.00 C ATOM 313 C GLU A 20 2.333 -1.631 -8.179 1.00 0.00 C ATOM 314 O GLU A 20 1.772 -2.715 -8.018 1.00 0.00 O ATOM 315 CB GLU A 20 3.821 -1.278 -10.165 1.00 0.00 C ATOM 316 CG GLU A 20 5.059 -1.820 -10.863 1.00 0.00 C ATOM 317 CD GLU A 20 5.255 -1.230 -12.244 1.00 0.00 C ATOM 318 OE1 GLU A 20 4.448 -1.545 -13.145 1.00 0.00 O ATOM 319 OE2 GLU A 20 6.216 -0.454 -12.427 1.00 0.00 O ATOM 0 H GLU A 20 4.081 -3.641 -8.822 1.00 0.00 H new ATOM 0 HA GLU A 20 4.293 -0.765 -8.132 1.00 0.00 H new ATOM 0 HB2 GLU A 20 2.935 -1.707 -10.632 1.00 0.00 H new ATOM 0 HB3 GLU A 20 3.772 -0.200 -10.318 1.00 0.00 H new ATOM 0 HG2 GLU A 20 5.937 -1.608 -10.253 1.00 0.00 H new ATOM 0 HG3 GLU A 20 4.981 -2.904 -10.943 1.00 0.00 H new ATOM 326 N VAL A 21 1.737 -0.467 -7.942 1.00 0.00 N ATOM 327 CA VAL A 21 0.355 -0.403 -7.470 1.00 0.00 C ATOM 328 C VAL A 21 -0.321 0.898 -7.903 1.00 0.00 C ATOM 329 O VAL A 21 0.260 1.979 -7.804 1.00 0.00 O ATOM 330 CB VAL A 21 0.274 -0.563 -5.926 1.00 0.00 C ATOM 331 CG1 VAL A 21 1.653 -0.454 -5.293 1.00 0.00 C ATOM 332 CG2 VAL A 21 -0.682 0.449 -5.302 1.00 0.00 C ATOM 0 H VAL A 21 2.185 0.441 -8.068 1.00 0.00 H new ATOM 0 HA VAL A 21 -0.179 -1.236 -7.928 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.121 -1.559 -5.726 1.00 0.00 H new ATOM 0 HG11 VAL A 21 1.568 -0.569 -4.213 1.00 0.00 H new ATOM 0 HG12 VAL A 21 2.299 -1.236 -5.692 1.00 0.00 H new ATOM 0 HG13 VAL A 21 2.082 0.522 -5.521 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -0.711 0.304 -4.222 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -0.338 1.459 -5.524 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -1.681 0.307 -5.714 1.00 0.00 H new ATOM 342 N GLU A 22 -1.558 0.777 -8.376 1.00 0.00 N ATOM 343 CA GLU A 22 -2.335 1.929 -8.818 1.00 0.00 C ATOM 344 C GLU A 22 -3.155 2.491 -7.664 1.00 0.00 C ATOM 345 O GLU A 22 -3.074 1.994 -6.542 1.00 0.00 O ATOM 346 CB GLU A 22 -3.257 1.538 -9.976 1.00 0.00 C ATOM 347 CG GLU A 22 -2.531 0.878 -11.136 1.00 0.00 C ATOM 348 CD GLU A 22 -3.105 -0.482 -11.490 1.00 0.00 C ATOM 349 OE1 GLU A 22 -4.085 -0.529 -12.263 1.00 0.00 O ATOM 350 OE2 GLU A 22 -2.575 -1.497 -10.994 1.00 0.00 O ATOM 0 H GLU A 22 -2.046 -0.114 -8.463 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.644 2.698 -9.164 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -4.024 0.859 -9.605 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -3.769 2.429 -10.339 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -2.584 1.528 -12.009 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -1.476 0.768 -10.884 1.00 0.00 H new ATOM 357 N LEU A 23 -3.941 3.530 -7.935 1.00 0.00 N ATOM 358 CA LEU A 23 -4.761 4.139 -6.898 1.00 0.00 C ATOM 359 C LEU A 23 -6.037 4.731 -7.488 1.00 0.00 C ATOM 360 O LEU A 23 -6.044 5.216 -8.620 1.00 0.00 O ATOM 361 CB LEU A 23 -3.952 5.212 -6.150 1.00 0.00 C ATOM 362 CG LEU A 23 -4.761 6.299 -5.427 1.00 0.00 C ATOM 363 CD1 LEU A 23 -5.349 5.770 -4.125 1.00 0.00 C ATOM 364 CD2 LEU A 23 -3.879 7.508 -5.154 1.00 0.00 C ATOM 0 H LEU A 23 -4.026 3.962 -8.855 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.054 3.366 -6.188 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -3.319 4.713 -5.416 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -3.288 5.699 -6.864 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.587 6.597 -6.073 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.917 6.561 -3.634 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -6.009 4.929 -4.339 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -4.543 5.441 -3.469 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.460 8.274 -4.641 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -3.038 7.211 -4.528 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.506 7.907 -6.097 1.00 0.00 H new ATOM 376 N TYR A 24 -7.114 4.684 -6.712 1.00 0.00 N ATOM 377 CA TYR A 24 -8.400 5.219 -7.155 1.00 0.00 C ATOM 378 C TYR A 24 -8.896 6.304 -6.200 1.00 0.00 C ATOM 379 O TYR A 24 -8.649 6.248 -4.997 1.00 0.00 O ATOM 380 CB TYR A 24 -9.435 4.090 -7.284 1.00 0.00 C ATOM 381 CG TYR A 24 -8.975 2.936 -8.146 1.00 0.00 C ATOM 382 CD1 TYR A 24 -8.164 3.148 -9.255 1.00 0.00 C ATOM 383 CD2 TYR A 24 -9.351 1.632 -7.850 1.00 0.00 C ATOM 384 CE1 TYR A 24 -7.742 2.094 -10.043 1.00 0.00 C ATOM 385 CE2 TYR A 24 -8.933 0.572 -8.632 1.00 0.00 C ATOM 386 CZ TYR A 24 -8.129 0.809 -9.728 1.00 0.00 C ATOM 387 OH TYR A 24 -7.712 -0.243 -10.510 1.00 0.00 O ATOM 0 H TYR A 24 -7.124 4.282 -5.775 1.00 0.00 H new ATOM 0 HA TYR A 24 -8.263 5.673 -8.136 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -9.676 3.715 -6.289 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -10.355 4.499 -7.702 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -7.859 4.153 -9.505 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -9.981 1.443 -6.994 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -7.112 2.276 -10.901 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -9.234 -0.436 -8.387 1.00 0.00 H new ATOM 0 HH TYR A 24 -8.072 -1.081 -10.150 1.00 0.00 H new ATOM 397 N GLU A 25 -9.583 7.304 -6.755 1.00 0.00 N ATOM 398 CA GLU A 25 -10.103 8.425 -5.961 1.00 0.00 C ATOM 399 C GLU A 25 -11.078 7.981 -4.866 1.00 0.00 C ATOM 400 O GLU A 25 -11.475 8.792 -4.028 1.00 0.00 O ATOM 401 CB GLU A 25 -10.794 9.457 -6.857 1.00 0.00 C ATOM 402 CG GLU A 25 -9.861 10.168 -7.828 1.00 0.00 C ATOM 403 CD GLU A 25 -10.601 10.776 -9.003 1.00 0.00 C ATOM 404 OE1 GLU A 25 -11.459 10.081 -9.589 1.00 0.00 O ATOM 405 OE2 GLU A 25 -10.323 11.946 -9.339 1.00 0.00 O ATOM 0 H GLU A 25 -9.794 7.363 -7.751 1.00 0.00 H new ATOM 0 HA GLU A 25 -9.236 8.873 -5.475 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -11.580 8.959 -7.425 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -11.279 10.202 -6.226 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -9.320 10.952 -7.299 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -9.118 9.461 -8.197 1.00 0.00 H new ATOM 412 N GLU A 26 -11.478 6.711 -4.875 1.00 0.00 N ATOM 413 CA GLU A 26 -12.424 6.199 -3.882 1.00 0.00 C ATOM 414 C GLU A 26 -12.055 6.658 -2.470 1.00 0.00 C ATOM 415 O GLU A 26 -12.927 6.819 -1.615 1.00 0.00 O ATOM 416 CB GLU A 26 -12.478 4.668 -3.939 1.00 0.00 C ATOM 417 CG GLU A 26 -11.255 3.983 -3.347 1.00 0.00 C ATOM 418 CD GLU A 26 -11.225 2.495 -3.632 1.00 0.00 C ATOM 419 OE1 GLU A 26 -12.290 1.849 -3.528 1.00 0.00 O ATOM 420 OE2 GLU A 26 -10.138 1.974 -3.959 1.00 0.00 O ATOM 0 H GLU A 26 -11.164 6.019 -5.555 1.00 0.00 H new ATOM 0 HA GLU A 26 -13.408 6.602 -4.122 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -13.366 4.326 -3.408 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -12.589 4.357 -4.978 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.354 4.445 -3.750 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.240 4.143 -2.269 1.00 0.00 H new ATOM 427 N TRP A 27 -10.767 6.895 -2.235 1.00 0.00 N ATOM 428 CA TRP A 27 -10.307 7.364 -0.938 1.00 0.00 C ATOM 429 C TRP A 27 -10.550 8.867 -0.828 1.00 0.00 C ATOM 430 O TRP A 27 -11.246 9.325 0.077 1.00 0.00 O ATOM 431 CB TRP A 27 -8.820 7.028 -0.744 1.00 0.00 C ATOM 432 CG TRP A 27 -8.182 7.690 0.441 1.00 0.00 C ATOM 433 CD1 TRP A 27 -6.865 8.021 0.574 1.00 0.00 C ATOM 434 CD2 TRP A 27 -8.821 8.091 1.662 1.00 0.00 C ATOM 435 NE1 TRP A 27 -6.644 8.603 1.796 1.00 0.00 N ATOM 436 CE2 TRP A 27 -7.828 8.658 2.483 1.00 0.00 C ATOM 437 CE3 TRP A 27 -10.133 8.027 2.142 1.00 0.00 C ATOM 438 CZ2 TRP A 27 -8.106 9.158 3.753 1.00 0.00 C ATOM 439 CZ3 TRP A 27 -10.406 8.525 3.401 1.00 0.00 C ATOM 440 CH2 TRP A 27 -9.398 9.085 4.194 1.00 0.00 C ATOM 0 H TRP A 27 -10.028 6.769 -2.926 1.00 0.00 H new ATOM 0 HA TRP A 27 -10.866 6.860 -0.150 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -8.715 5.948 -0.641 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -8.275 7.317 -1.643 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -6.106 7.849 -0.175 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -5.744 8.940 2.138 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -10.919 7.596 1.539 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -7.329 9.588 4.367 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -11.416 8.481 3.781 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -9.646 9.467 5.173 1.00 0.00 H new ATOM 451 N ALA A 28 -10.001 9.628 -1.783 1.00 0.00 N ATOM 452 CA ALA A 28 -10.182 11.086 -1.823 1.00 0.00 C ATOM 453 C ALA A 28 -9.061 11.777 -2.601 1.00 0.00 C ATOM 454 O ALA A 28 -7.899 11.733 -2.194 1.00 0.00 O ATOM 455 CB ALA A 28 -10.270 11.675 -0.418 1.00 0.00 C ATOM 0 H ALA A 28 -9.426 9.258 -2.540 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.124 11.268 -2.341 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -10.404 12.755 -0.484 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -11.118 11.236 0.108 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -9.352 11.456 0.127 1.00 0.00 H new ATOM 461 N PRO A 29 -9.393 12.435 -3.733 1.00 0.00 N ATOM 462 CA PRO A 29 -8.404 13.139 -4.554 1.00 0.00 C ATOM 463 C PRO A 29 -7.470 14.019 -3.720 1.00 0.00 C ATOM 464 O PRO A 29 -6.318 14.240 -4.091 1.00 0.00 O ATOM 465 CB PRO A 29 -9.242 14.015 -5.500 1.00 0.00 C ATOM 466 CG PRO A 29 -10.680 13.777 -5.152 1.00 0.00 C ATOM 467 CD PRO A 29 -10.746 12.540 -4.295 1.00 0.00 C ATOM 0 HA PRO A 29 -7.757 12.433 -5.074 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -8.985 15.068 -5.381 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -9.048 13.755 -6.541 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -11.091 14.634 -4.619 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -11.276 13.648 -6.056 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -11.499 12.634 -3.512 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -11.005 11.659 -4.882 1.00 0.00 H new ATOM 475 N GLU A 30 -7.977 14.522 -2.598 1.00 0.00 N ATOM 476 CA GLU A 30 -7.190 15.384 -1.718 1.00 0.00 C ATOM 477 C GLU A 30 -6.048 14.610 -1.065 1.00 0.00 C ATOM 478 O GLU A 30 -4.921 15.101 -0.989 1.00 0.00 O ATOM 479 CB GLU A 30 -8.083 16.003 -0.635 1.00 0.00 C ATOM 480 CG GLU A 30 -8.977 17.137 -1.124 1.00 0.00 C ATOM 481 CD GLU A 30 -8.696 18.447 -0.413 1.00 0.00 C ATOM 482 OE1 GLU A 30 -7.590 18.998 -0.598 1.00 0.00 O ATOM 483 OE2 GLU A 30 -9.582 18.924 0.325 1.00 0.00 O ATOM 0 H GLU A 30 -8.929 14.348 -2.276 1.00 0.00 H new ATOM 0 HA GLU A 30 -6.763 16.180 -2.328 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -8.711 15.221 -0.209 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -7.450 16.377 0.170 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -8.834 17.271 -2.196 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -10.021 16.863 -0.974 1.00 0.00 H new ATOM 490 N THR A 31 -6.341 13.402 -0.597 1.00 0.00 N ATOM 491 CA THR A 31 -5.322 12.569 0.050 1.00 0.00 C ATOM 492 C THR A 31 -4.266 12.139 -0.964 1.00 0.00 C ATOM 493 O THR A 31 -3.067 12.224 -0.699 1.00 0.00 O ATOM 494 CB THR A 31 -5.959 11.336 0.709 1.00 0.00 C ATOM 495 OG1 THR A 31 -7.314 11.203 0.316 1.00 0.00 O ATOM 496 CG2 THR A 31 -5.926 11.357 2.228 1.00 0.00 C ATOM 0 H THR A 31 -7.266 12.976 -0.650 1.00 0.00 H new ATOM 0 HA THR A 31 -4.842 13.163 0.828 1.00 0.00 H new ATOM 0 HB THR A 31 -5.354 10.496 0.368 1.00 0.00 H new ATOM 0 HG1 THR A 31 -7.360 11.046 -0.650 1.00 0.00 H new ATOM 0 HG21 THR A 31 -6.395 10.452 2.615 1.00 0.00 H new ATOM 0 HG22 THR A 31 -4.892 11.404 2.569 1.00 0.00 H new ATOM 0 HG23 THR A 31 -6.468 12.230 2.592 1.00 0.00 H new ATOM 504 N VAL A 32 -4.720 11.681 -2.129 1.00 0.00 N ATOM 505 CA VAL A 32 -3.818 11.244 -3.190 1.00 0.00 C ATOM 506 C VAL A 32 -2.686 12.247 -3.397 1.00 0.00 C ATOM 507 O VAL A 32 -1.555 11.870 -3.703 1.00 0.00 O ATOM 508 CB VAL A 32 -4.573 11.066 -4.521 1.00 0.00 C ATOM 509 CG1 VAL A 32 -3.662 10.469 -5.581 1.00 0.00 C ATOM 510 CG2 VAL A 32 -5.810 10.202 -4.322 1.00 0.00 C ATOM 0 H VAL A 32 -5.710 11.603 -2.361 1.00 0.00 H new ATOM 0 HA VAL A 32 -3.401 10.286 -2.879 1.00 0.00 H new ATOM 0 HB VAL A 32 -4.895 12.048 -4.867 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -4.216 10.352 -6.513 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -2.812 11.131 -5.745 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -3.304 9.495 -5.247 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -6.330 10.087 -5.273 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -5.513 9.221 -3.950 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -6.474 10.678 -3.600 1.00 0.00 H new ATOM 520 N ARG A 33 -3.004 13.526 -3.230 1.00 0.00 N ATOM 521 CA ARG A 33 -2.019 14.592 -3.397 1.00 0.00 C ATOM 522 C ARG A 33 -0.816 14.383 -2.480 1.00 0.00 C ATOM 523 O ARG A 33 0.322 14.650 -2.865 1.00 0.00 O ATOM 524 CB ARG A 33 -2.656 15.957 -3.121 1.00 0.00 C ATOM 525 CG ARG A 33 -1.889 17.127 -3.720 1.00 0.00 C ATOM 526 CD ARG A 33 -2.373 18.454 -3.161 1.00 0.00 C ATOM 527 NE ARG A 33 -1.291 19.428 -3.042 1.00 0.00 N ATOM 528 CZ ARG A 33 -0.699 20.010 -4.083 1.00 0.00 C ATOM 529 NH1 ARG A 33 -1.083 19.722 -5.322 1.00 0.00 N ATOM 530 NH2 ARG A 33 0.279 20.883 -3.886 1.00 0.00 N ATOM 0 H ARG A 33 -3.937 13.852 -2.979 1.00 0.00 H new ATOM 0 HA ARG A 33 -1.670 14.563 -4.429 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -3.672 15.960 -3.517 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -2.734 16.100 -2.043 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -0.825 17.010 -3.513 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -2.005 17.123 -4.804 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -3.153 18.856 -3.808 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -2.823 18.292 -2.182 1.00 0.00 H new ATOM 0 HE ARG A 33 -0.970 19.677 -2.106 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -1.835 19.052 -5.480 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -0.625 20.171 -6.115 1.00 0.00 H new ATOM 0 HH21 ARG A 33 0.578 21.109 -2.937 1.00 0.00 H new ATOM 0 HH22 ARG A 33 0.733 21.329 -4.683 1.00 0.00 H new ATOM 544 N ALA A 34 -1.071 13.901 -1.264 1.00 0.00 N ATOM 545 CA ALA A 34 -0.001 13.660 -0.300 1.00 0.00 C ATOM 546 C ALA A 34 0.921 12.547 -0.776 1.00 0.00 C ATOM 547 O ALA A 34 2.144 12.694 -0.758 1.00 0.00 O ATOM 548 CB ALA A 34 -0.582 13.327 1.065 1.00 0.00 C ATOM 0 H ALA A 34 -2.005 13.671 -0.925 1.00 0.00 H new ATOM 0 HA ALA A 34 0.590 14.572 -0.213 1.00 0.00 H new ATOM 0 HB1 ALA A 34 0.228 13.150 1.772 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -1.192 14.160 1.414 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.199 12.432 0.989 1.00 0.00 H new ATOM 554 N ILE A 35 0.335 11.437 -1.216 1.00 0.00 N ATOM 555 CA ILE A 35 1.128 10.312 -1.710 1.00 0.00 C ATOM 556 C ILE A 35 2.047 10.789 -2.837 1.00 0.00 C ATOM 557 O ILE A 35 3.251 10.531 -2.818 1.00 0.00 O ATOM 558 CB ILE A 35 0.264 9.142 -2.246 1.00 0.00 C ATOM 559 CG1 ILE A 35 -1.195 9.262 -1.799 1.00 0.00 C ATOM 560 CG2 ILE A 35 0.846 7.812 -1.790 1.00 0.00 C ATOM 561 CD1 ILE A 35 -1.375 9.227 -0.297 1.00 0.00 C ATOM 0 H ILE A 35 -0.674 11.291 -1.241 1.00 0.00 H new ATOM 0 HA ILE A 35 1.698 9.939 -0.859 1.00 0.00 H new ATOM 0 HB ILE A 35 0.279 9.189 -3.335 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -1.608 10.194 -2.184 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.770 8.450 -2.244 1.00 0.00 H new ATOM 0 HG21 ILE A 35 0.232 6.996 -2.172 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.862 7.710 -2.171 1.00 0.00 H new ATOM 0 HG23 ILE A 35 0.861 7.776 -0.701 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -2.434 9.317 -0.055 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.993 8.284 0.093 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.828 10.055 0.154 1.00 0.00 H new ATOM 573 N ALA A 36 1.468 11.502 -3.813 1.00 0.00 N ATOM 574 CA ALA A 36 2.238 12.030 -4.934 1.00 0.00 C ATOM 575 C ALA A 36 3.265 13.039 -4.439 1.00 0.00 C ATOM 576 O ALA A 36 4.321 13.210 -5.040 1.00 0.00 O ATOM 577 CB ALA A 36 1.316 12.667 -5.960 1.00 0.00 C ATOM 0 H ALA A 36 0.473 11.723 -3.844 1.00 0.00 H new ATOM 0 HA ALA A 36 2.765 11.205 -5.413 1.00 0.00 H new ATOM 0 HB1 ALA A 36 1.907 13.055 -6.789 1.00 0.00 H new ATOM 0 HB2 ALA A 36 0.615 11.920 -6.333 1.00 0.00 H new ATOM 0 HB3 ALA A 36 0.763 13.483 -5.495 1.00 0.00 H new ATOM 583 N ASP A 37 2.956 13.705 -3.334 1.00 0.00 N ATOM 584 CA ASP A 37 3.877 14.684 -2.767 1.00 0.00 C ATOM 585 C ASP A 37 5.092 13.983 -2.151 1.00 0.00 C ATOM 586 O ASP A 37 6.170 14.568 -2.037 1.00 0.00 O ATOM 587 CB ASP A 37 3.172 15.532 -1.709 1.00 0.00 C ATOM 588 CG ASP A 37 3.857 16.867 -1.487 1.00 0.00 C ATOM 589 OD1 ASP A 37 3.640 17.789 -2.301 1.00 0.00 O ATOM 590 OD2 ASP A 37 4.611 16.989 -0.500 1.00 0.00 O ATOM 0 H ASP A 37 2.085 13.588 -2.816 1.00 0.00 H new ATOM 0 HA ASP A 37 4.218 15.337 -3.570 1.00 0.00 H new ATOM 0 HB2 ASP A 37 2.139 15.703 -2.013 1.00 0.00 H new ATOM 0 HB3 ASP A 37 3.140 14.982 -0.768 1.00 0.00 H new ATOM 595 N ALA A 38 4.901 12.727 -1.747 1.00 0.00 N ATOM 596 CA ALA A 38 5.953 11.933 -1.133 1.00 0.00 C ATOM 597 C ALA A 38 6.633 11.002 -2.144 1.00 0.00 C ATOM 598 O ALA A 38 6.778 9.804 -1.898 1.00 0.00 O ATOM 599 CB ALA A 38 5.363 11.127 0.014 1.00 0.00 C ATOM 0 H ALA A 38 4.012 12.236 -1.838 1.00 0.00 H new ATOM 0 HA ALA A 38 6.719 12.611 -0.757 1.00 0.00 H new ATOM 0 HB1 ALA A 38 6.147 10.529 0.479 1.00 0.00 H new ATOM 0 HB2 ALA A 38 4.937 11.805 0.753 1.00 0.00 H new ATOM 0 HB3 ALA A 38 4.582 10.469 -0.368 1.00 0.00 H new ATOM 605 N LEU A 39 7.066 11.564 -3.270 1.00 0.00 N ATOM 606 CA LEU A 39 7.752 10.789 -4.311 1.00 0.00 C ATOM 607 C LEU A 39 9.063 10.202 -3.736 1.00 0.00 C ATOM 608 O LEU A 39 9.162 10.077 -2.517 1.00 0.00 O ATOM 609 CB LEU A 39 7.962 11.651 -5.562 1.00 0.00 C ATOM 610 CG LEU A 39 6.679 12.233 -6.176 1.00 0.00 C ATOM 611 CD1 LEU A 39 6.912 12.596 -7.634 1.00 0.00 C ATOM 612 CD2 LEU A 39 5.516 11.248 -6.062 1.00 0.00 C ATOM 0 H LEU A 39 6.956 12.554 -3.489 1.00 0.00 H new ATOM 0 HA LEU A 39 7.138 9.945 -4.626 1.00 0.00 H new ATOM 0 HB2 LEU A 39 8.631 12.474 -5.309 1.00 0.00 H new ATOM 0 HB3 LEU A 39 8.468 11.050 -6.318 1.00 0.00 H new ATOM 0 HG LEU A 39 6.418 13.133 -5.620 1.00 0.00 H new ATOM 0 HD11 LEU A 39 5.996 13.007 -8.058 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.708 13.338 -7.702 1.00 0.00 H new ATOM 0 HD13 LEU A 39 7.200 11.704 -8.190 1.00 0.00 H new ATOM 0 HD21 LEU A 39 4.622 11.688 -6.505 1.00 0.00 H new ATOM 0 HD22 LEU A 39 5.766 10.327 -6.588 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.329 11.026 -5.011 1.00 0.00 H new ATOM 624 N PRO A 40 10.082 9.792 -4.555 1.00 0.00 N ATOM 625 CA PRO A 40 11.317 9.202 -4.026 1.00 0.00 C ATOM 626 C PRO A 40 11.687 9.683 -2.626 1.00 0.00 C ATOM 627 O PRO A 40 12.193 10.790 -2.442 1.00 0.00 O ATOM 628 CB PRO A 40 12.351 9.641 -5.049 1.00 0.00 C ATOM 629 CG PRO A 40 11.612 9.622 -6.348 1.00 0.00 C ATOM 630 CD PRO A 40 10.145 9.839 -6.034 1.00 0.00 C ATOM 0 HA PRO A 40 11.230 8.123 -3.901 1.00 0.00 H new ATOM 0 HB2 PRO A 40 12.736 10.636 -4.824 1.00 0.00 H new ATOM 0 HB3 PRO A 40 13.206 8.965 -5.067 1.00 0.00 H new ATOM 0 HG2 PRO A 40 11.982 10.403 -7.013 1.00 0.00 H new ATOM 0 HG3 PRO A 40 11.759 8.671 -6.860 1.00 0.00 H new ATOM 0 HD2 PRO A 40 9.792 10.796 -6.418 1.00 0.00 H new ATOM 0 HD3 PRO A 40 9.522 9.066 -6.484 1.00 0.00 H new ATOM 638 N ILE A 41 11.432 8.821 -1.646 1.00 0.00 N ATOM 639 CA ILE A 41 11.733 9.112 -0.250 1.00 0.00 C ATOM 640 C ILE A 41 12.152 7.824 0.458 1.00 0.00 C ATOM 641 O ILE A 41 11.731 6.735 0.076 1.00 0.00 O ATOM 642 CB ILE A 41 10.520 9.750 0.476 1.00 0.00 C ATOM 643 CG1 ILE A 41 10.337 11.207 0.032 1.00 0.00 C ATOM 644 CG2 ILE A 41 10.695 9.686 1.991 1.00 0.00 C ATOM 645 CD1 ILE A 41 9.233 11.939 0.768 1.00 0.00 C ATOM 0 H ILE A 41 11.012 7.904 -1.798 1.00 0.00 H new ATOM 0 HA ILE A 41 12.550 9.833 -0.220 1.00 0.00 H new ATOM 0 HB ILE A 41 9.630 9.182 0.207 1.00 0.00 H new ATOM 0 HG12 ILE A 41 11.275 11.742 0.179 1.00 0.00 H new ATOM 0 HG13 ILE A 41 10.123 11.227 -1.037 1.00 0.00 H new ATOM 0 HG21 ILE A 41 9.831 10.140 2.477 1.00 0.00 H new ATOM 0 HG22 ILE A 41 10.782 8.645 2.304 1.00 0.00 H new ATOM 0 HG23 ILE A 41 11.597 10.227 2.276 1.00 0.00 H new ATOM 0 HD11 ILE A 41 9.166 12.962 0.398 1.00 0.00 H new ATOM 0 HD12 ILE A 41 8.284 11.429 0.601 1.00 0.00 H new ATOM 0 HD13 ILE A 41 9.454 11.953 1.835 1.00 0.00 H new ATOM 657 N LYS A 42 12.997 7.950 1.474 1.00 0.00 N ATOM 658 CA LYS A 42 13.481 6.783 2.203 1.00 0.00 C ATOM 659 C LYS A 42 12.524 6.372 3.322 1.00 0.00 C ATOM 660 O LYS A 42 12.032 7.209 4.079 1.00 0.00 O ATOM 661 CB LYS A 42 14.871 7.056 2.779 1.00 0.00 C ATOM 662 CG LYS A 42 15.999 6.484 1.933 1.00 0.00 C ATOM 663 CD LYS A 42 17.092 7.511 1.682 1.00 0.00 C ATOM 664 CE LYS A 42 18.181 7.436 2.740 1.00 0.00 C ATOM 665 NZ LYS A 42 19.314 8.353 2.439 1.00 0.00 N ATOM 0 H LYS A 42 13.360 8.842 1.811 1.00 0.00 H new ATOM 0 HA LYS A 42 13.538 5.957 1.494 1.00 0.00 H new ATOM 0 HB2 LYS A 42 15.010 8.133 2.877 1.00 0.00 H new ATOM 0 HB3 LYS A 42 14.930 6.634 3.782 1.00 0.00 H new ATOM 0 HG2 LYS A 42 16.425 5.615 2.434 1.00 0.00 H new ATOM 0 HG3 LYS A 42 15.599 6.138 0.980 1.00 0.00 H new ATOM 0 HD2 LYS A 42 17.528 7.346 0.697 1.00 0.00 H new ATOM 0 HD3 LYS A 42 16.658 8.511 1.675 1.00 0.00 H new ATOM 0 HE2 LYS A 42 17.759 7.688 3.713 1.00 0.00 H new ATOM 0 HE3 LYS A 42 18.551 6.413 2.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 20.034 8.271 3.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 19.734 8.097 1.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 18.967 9.333 2.399 1.00 0.00 H new ATOM 679 N SER A 43 12.278 5.067 3.419 1.00 0.00 N ATOM 680 CA SER A 43 11.395 4.510 4.438 1.00 0.00 C ATOM 681 C SER A 43 11.896 3.135 4.877 1.00 0.00 C ATOM 682 O SER A 43 12.485 2.402 4.083 1.00 0.00 O ATOM 683 CB SER A 43 9.963 4.400 3.911 1.00 0.00 C ATOM 684 OG SER A 43 9.741 3.164 3.262 1.00 0.00 O ATOM 0 H SER A 43 12.684 4.369 2.795 1.00 0.00 H new ATOM 0 HA SER A 43 11.398 5.181 5.297 1.00 0.00 H new ATOM 0 HB2 SER A 43 9.261 4.509 4.738 1.00 0.00 H new ATOM 0 HB3 SER A 43 9.766 5.217 3.216 1.00 0.00 H new ATOM 0 HG SER A 43 8.816 2.877 3.413 1.00 0.00 H new ATOM 690 N THR A 44 11.659 2.783 6.139 1.00 0.00 N ATOM 691 CA THR A 44 12.092 1.485 6.654 1.00 0.00 C ATOM 692 C THR A 44 10.912 0.522 6.726 1.00 0.00 C ATOM 693 O THR A 44 9.877 0.830 7.318 1.00 0.00 O ATOM 694 CB THR A 44 12.737 1.634 8.032 1.00 0.00 C ATOM 695 OG1 THR A 44 13.176 2.965 8.238 1.00 0.00 O ATOM 696 CG2 THR A 44 13.929 0.720 8.232 1.00 0.00 C ATOM 0 H THR A 44 11.175 3.371 6.818 1.00 0.00 H new ATOM 0 HA THR A 44 12.836 1.079 5.969 1.00 0.00 H new ATOM 0 HB THR A 44 11.963 1.360 8.748 1.00 0.00 H new ATOM 0 HG1 THR A 44 13.584 3.041 9.126 1.00 0.00 H new ATOM 0 HG21 THR A 44 14.342 0.874 9.229 1.00 0.00 H new ATOM 0 HG22 THR A 44 13.614 -0.318 8.126 1.00 0.00 H new ATOM 0 HG23 THR A 44 14.690 0.946 7.485 1.00 0.00 H new ATOM 704 N ALA A 45 11.073 -0.633 6.093 1.00 0.00 N ATOM 705 CA ALA A 45 10.021 -1.643 6.047 1.00 0.00 C ATOM 706 C ALA A 45 10.001 -2.540 7.277 1.00 0.00 C ATOM 707 O ALA A 45 11.026 -3.082 7.693 1.00 0.00 O ATOM 708 CB ALA A 45 10.164 -2.499 4.793 1.00 0.00 C ATOM 0 H ALA A 45 11.927 -0.896 5.601 1.00 0.00 H new ATOM 0 HA ALA A 45 9.075 -1.102 6.027 1.00 0.00 H new ATOM 0 HB1 ALA A 45 9.373 -3.248 4.772 1.00 0.00 H new ATOM 0 HB2 ALA A 45 10.088 -1.865 3.909 1.00 0.00 H new ATOM 0 HB3 ALA A 45 11.134 -2.996 4.800 1.00 0.00 H new ATOM 714 N ASN A 46 8.805 -2.718 7.824 1.00 0.00 N ATOM 715 CA ASN A 46 8.598 -3.583 8.981 1.00 0.00 C ATOM 716 C ASN A 46 7.953 -4.890 8.511 1.00 0.00 C ATOM 717 O ASN A 46 6.869 -4.867 7.930 1.00 0.00 O ATOM 718 CB ASN A 46 7.701 -2.893 10.011 1.00 0.00 C ATOM 719 CG ASN A 46 8.311 -1.610 10.542 1.00 0.00 C ATOM 720 OD1 ASN A 46 9.319 -1.129 10.026 1.00 0.00 O ATOM 721 ND2 ASN A 46 7.700 -1.050 11.580 1.00 0.00 N ATOM 0 H ASN A 46 7.955 -2.270 7.481 1.00 0.00 H new ATOM 0 HA ASN A 46 9.557 -3.794 9.454 1.00 0.00 H new ATOM 0 HB2 ASN A 46 6.735 -2.672 9.557 1.00 0.00 H new ATOM 0 HB3 ASN A 46 7.515 -3.574 10.841 1.00 0.00 H new ATOM 0 HD21 ASN A 46 8.065 -0.186 11.981 1.00 0.00 H new ATOM 0 HD22 ASN A 46 6.866 -1.484 11.976 1.00 0.00 H new ATOM 728 N ARG A 47 8.625 -6.024 8.720 1.00 0.00 N ATOM 729 CA ARG A 47 8.093 -7.301 8.262 1.00 0.00 C ATOM 730 C ARG A 47 7.070 -7.896 9.231 1.00 0.00 C ATOM 731 O ARG A 47 7.271 -7.896 10.447 1.00 0.00 O ATOM 732 CB ARG A 47 9.240 -8.282 8.025 1.00 0.00 C ATOM 733 CG ARG A 47 9.644 -8.380 6.562 1.00 0.00 C ATOM 734 CD ARG A 47 9.370 -9.762 5.992 1.00 0.00 C ATOM 735 NE ARG A 47 8.074 -10.287 6.418 1.00 0.00 N ATOM 736 CZ ARG A 47 7.635 -11.509 6.121 1.00 0.00 C ATOM 737 NH1 ARG A 47 8.385 -12.333 5.398 1.00 0.00 N ATOM 738 NH2 ARG A 47 6.445 -11.908 6.547 1.00 0.00 N ATOM 0 H ARG A 47 9.525 -6.081 9.197 1.00 0.00 H new ATOM 0 HA ARG A 47 7.565 -7.118 7.326 1.00 0.00 H new ATOM 0 HB2 ARG A 47 10.103 -7.973 8.615 1.00 0.00 H new ATOM 0 HB3 ARG A 47 8.947 -9.269 8.382 1.00 0.00 H new ATOM 0 HG2 ARG A 47 9.099 -7.634 5.984 1.00 0.00 H new ATOM 0 HG3 ARG A 47 10.705 -8.149 6.462 1.00 0.00 H new ATOM 0 HD2 ARG A 47 9.402 -9.717 4.903 1.00 0.00 H new ATOM 0 HD3 ARG A 47 10.158 -10.446 6.306 1.00 0.00 H new ATOM 0 HE ARG A 47 7.471 -9.682 6.975 1.00 0.00 H new ATOM 0 HH11 ARG A 47 9.302 -12.031 5.068 1.00 0.00 H new ATOM 0 HH12 ARG A 47 8.044 -13.268 5.173 1.00 0.00 H new ATOM 0 HH21 ARG A 47 5.865 -11.279 7.102 1.00 0.00 H new ATOM 0 HH22 ARG A 47 6.109 -12.844 6.319 1.00 0.00 H new ATOM 752 N TRP A 48 5.979 -8.418 8.669 1.00 0.00 N ATOM 753 CA TRP A 48 4.916 -9.041 9.451 1.00 0.00 C ATOM 754 C TRP A 48 4.272 -10.158 8.639 1.00 0.00 C ATOM 755 O TRP A 48 4.218 -10.081 7.413 1.00 0.00 O ATOM 756 CB TRP A 48 3.854 -8.015 9.871 1.00 0.00 C ATOM 757 CG TRP A 48 2.687 -8.630 10.582 1.00 0.00 C ATOM 758 CD1 TRP A 48 1.653 -9.319 10.014 1.00 0.00 C ATOM 759 CD2 TRP A 48 2.435 -8.615 11.991 1.00 0.00 C ATOM 760 NE1 TRP A 48 0.772 -9.734 10.986 1.00 0.00 N ATOM 761 CE2 TRP A 48 1.232 -9.314 12.209 1.00 0.00 C ATOM 762 CE3 TRP A 48 3.111 -8.078 13.090 1.00 0.00 C ATOM 763 CZ2 TRP A 48 0.693 -9.489 13.481 1.00 0.00 C ATOM 764 CZ3 TRP A 48 2.575 -8.252 14.353 1.00 0.00 C ATOM 765 CH2 TRP A 48 1.377 -8.953 14.539 1.00 0.00 C ATOM 0 H TRP A 48 5.810 -8.420 7.663 1.00 0.00 H new ATOM 0 HA TRP A 48 5.356 -9.454 10.358 1.00 0.00 H new ATOM 0 HB2 TRP A 48 4.315 -7.270 10.520 1.00 0.00 H new ATOM 0 HB3 TRP A 48 3.496 -7.489 8.986 1.00 0.00 H new ATOM 0 HD1 TRP A 48 1.543 -9.510 8.957 1.00 0.00 H new ATOM 0 HE1 TRP A 48 -0.083 -10.266 10.824 1.00 0.00 H new ATOM 0 HE3 TRP A 48 4.036 -7.537 12.955 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 -0.231 -10.028 13.628 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 3.089 -7.841 15.209 1.00 0.00 H new ATOM 0 HH2 TRP A 48 0.984 -9.073 15.538 1.00 0.00 H new ATOM 776 N GLY A 49 3.795 -11.198 9.324 1.00 0.00 N ATOM 777 CA GLY A 49 3.168 -12.324 8.645 1.00 0.00 C ATOM 778 C GLY A 49 2.309 -11.907 7.465 1.00 0.00 C ATOM 779 O GLY A 49 1.130 -11.593 7.630 1.00 0.00 O ATOM 0 H GLY A 49 3.832 -11.281 10.340 1.00 0.00 H new ATOM 0 HA2 GLY A 49 3.943 -13.008 8.299 1.00 0.00 H new ATOM 0 HA3 GLY A 49 2.553 -12.873 9.358 1.00 0.00 H new ATOM 783 N ASP A 50 2.912 -11.896 6.275 1.00 0.00 N ATOM 784 CA ASP A 50 2.221 -11.512 5.040 1.00 0.00 C ATOM 785 C ASP A 50 2.111 -9.992 4.900 1.00 0.00 C ATOM 786 O ASP A 50 2.282 -9.452 3.808 1.00 0.00 O ATOM 787 CB ASP A 50 0.825 -12.139 4.968 1.00 0.00 C ATOM 788 CG ASP A 50 0.106 -11.794 3.682 1.00 0.00 C ATOM 789 OD1 ASP A 50 0.719 -11.932 2.604 1.00 0.00 O ATOM 790 OD2 ASP A 50 -1.071 -11.380 3.752 1.00 0.00 O ATOM 0 H ASP A 50 3.890 -12.152 6.139 1.00 0.00 H new ATOM 0 HA ASP A 50 2.822 -11.890 4.213 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.911 -13.222 5.054 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.232 -11.798 5.816 1.00 0.00 H new ATOM 795 N GLU A 51 1.809 -9.307 6.000 1.00 0.00 N ATOM 796 CA GLU A 51 1.664 -7.857 5.976 1.00 0.00 C ATOM 797 C GLU A 51 3.010 -7.156 6.124 1.00 0.00 C ATOM 798 O GLU A 51 3.938 -7.682 6.736 1.00 0.00 O ATOM 799 CB GLU A 51 0.712 -7.405 7.088 1.00 0.00 C ATOM 800 CG GLU A 51 -0.621 -6.889 6.573 1.00 0.00 C ATOM 801 CD GLU A 51 -1.264 -5.892 7.519 1.00 0.00 C ATOM 802 OE1 GLU A 51 -1.119 -6.062 8.748 1.00 0.00 O ATOM 803 OE2 GLU A 51 -1.912 -4.944 7.030 1.00 0.00 O ATOM 0 H GLU A 51 1.661 -9.732 6.915 1.00 0.00 H new ATOM 0 HA GLU A 51 1.248 -7.580 5.008 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.532 -8.241 7.764 1.00 0.00 H new ATOM 0 HB3 GLU A 51 1.195 -6.621 7.672 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -0.474 -6.419 5.601 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.298 -7.730 6.421 1.00 0.00 H new ATOM 810 N ILE A 52 3.094 -5.955 5.562 1.00 0.00 N ATOM 811 CA ILE A 52 4.309 -5.151 5.625 1.00 0.00 C ATOM 812 C ILE A 52 3.948 -3.670 5.598 1.00 0.00 C ATOM 813 O ILE A 52 3.372 -3.182 4.626 1.00 0.00 O ATOM 814 CB ILE A 52 5.279 -5.499 4.463 1.00 0.00 C ATOM 815 CG1 ILE A 52 6.506 -6.253 4.999 1.00 0.00 C ATOM 816 CG2 ILE A 52 5.722 -4.250 3.704 1.00 0.00 C ATOM 817 CD1 ILE A 52 6.455 -7.761 4.823 1.00 0.00 C ATOM 0 H ILE A 52 2.328 -5.514 5.053 1.00 0.00 H new ATOM 0 HA ILE A 52 4.823 -5.377 6.559 1.00 0.00 H new ATOM 0 HB ILE A 52 4.740 -6.140 3.766 1.00 0.00 H new ATOM 0 HG12 ILE A 52 7.396 -5.873 4.497 1.00 0.00 H new ATOM 0 HG13 ILE A 52 6.618 -6.029 6.060 1.00 0.00 H new ATOM 0 HG21 ILE A 52 6.400 -4.535 2.899 1.00 0.00 H new ATOM 0 HG22 ILE A 52 4.849 -3.751 3.284 1.00 0.00 H new ATOM 0 HG23 ILE A 52 6.234 -3.572 4.387 1.00 0.00 H new ATOM 0 HD11 ILE A 52 7.363 -8.206 5.231 1.00 0.00 H new ATOM 0 HD12 ILE A 52 5.588 -8.160 5.349 1.00 0.00 H new ATOM 0 HD13 ILE A 52 6.378 -8.001 3.763 1.00 0.00 H new ATOM 829 N TYR A 53 4.274 -2.965 6.672 1.00 0.00 N ATOM 830 CA TYR A 53 3.959 -1.537 6.764 1.00 0.00 C ATOM 831 C TYR A 53 5.193 -0.694 7.061 1.00 0.00 C ATOM 832 O TYR A 53 6.045 -1.071 7.864 1.00 0.00 O ATOM 833 CB TYR A 53 2.890 -1.290 7.837 1.00 0.00 C ATOM 834 CG TYR A 53 3.315 -1.705 9.232 1.00 0.00 C ATOM 835 CD1 TYR A 53 4.115 -0.877 10.014 1.00 0.00 C ATOM 836 CD2 TYR A 53 2.913 -2.925 9.767 1.00 0.00 C ATOM 837 CE1 TYR A 53 4.503 -1.255 11.286 1.00 0.00 C ATOM 838 CE2 TYR A 53 3.298 -3.306 11.039 1.00 0.00 C ATOM 839 CZ TYR A 53 4.091 -2.469 11.792 1.00 0.00 C ATOM 840 OH TYR A 53 4.476 -2.847 13.058 1.00 0.00 O ATOM 0 H TYR A 53 4.752 -3.349 7.487 1.00 0.00 H new ATOM 0 HA TYR A 53 3.575 -1.232 5.791 1.00 0.00 H new ATOM 0 HB2 TYR A 53 2.635 -0.230 7.845 1.00 0.00 H new ATOM 0 HB3 TYR A 53 1.985 -1.833 7.566 1.00 0.00 H new ATOM 0 HD1 TYR A 53 4.438 0.076 9.621 1.00 0.00 H new ATOM 0 HD2 TYR A 53 2.291 -3.584 9.180 1.00 0.00 H new ATOM 0 HE1 TYR A 53 5.126 -0.602 11.880 1.00 0.00 H new ATOM 0 HE2 TYR A 53 2.978 -4.256 11.440 1.00 0.00 H new ATOM 0 HH TYR A 53 4.101 -3.729 13.264 1.00 0.00 H new ATOM 850 N PHE A 54 5.262 0.461 6.405 1.00 0.00 N ATOM 851 CA PHE A 54 6.370 1.387 6.586 1.00 0.00 C ATOM 852 C PHE A 54 5.868 2.826 6.605 1.00 0.00 C ATOM 853 O PHE A 54 4.924 3.171 5.896 1.00 0.00 O ATOM 854 CB PHE A 54 7.412 1.212 5.471 1.00 0.00 C ATOM 855 CG PHE A 54 6.927 1.611 4.096 1.00 0.00 C ATOM 856 CD1 PHE A 54 6.645 2.937 3.796 1.00 0.00 C ATOM 857 CD2 PHE A 54 6.757 0.658 3.102 1.00 0.00 C ATOM 858 CE1 PHE A 54 6.204 3.300 2.538 1.00 0.00 C ATOM 859 CE2 PHE A 54 6.316 1.019 1.843 1.00 0.00 C ATOM 860 CZ PHE A 54 6.038 2.340 1.561 1.00 0.00 C ATOM 0 H PHE A 54 4.557 0.777 5.739 1.00 0.00 H new ATOM 0 HA PHE A 54 6.841 1.165 7.544 1.00 0.00 H new ATOM 0 HB2 PHE A 54 8.294 1.804 5.718 1.00 0.00 H new ATOM 0 HB3 PHE A 54 7.726 0.168 5.444 1.00 0.00 H new ATOM 0 HD1 PHE A 54 6.772 3.694 4.556 1.00 0.00 H new ATOM 0 HD2 PHE A 54 6.972 -0.379 3.315 1.00 0.00 H new ATOM 0 HE1 PHE A 54 5.989 4.336 2.319 1.00 0.00 H new ATOM 0 HE2 PHE A 54 6.189 0.266 1.079 1.00 0.00 H new ATOM 0 HZ PHE A 54 5.691 2.622 0.578 1.00 0.00 H new ATOM 870 N THR A 55 6.509 3.668 7.408 1.00 0.00 N ATOM 871 CA THR A 55 6.127 5.076 7.492 1.00 0.00 C ATOM 872 C THR A 55 6.974 5.896 6.522 1.00 0.00 C ATOM 873 O THR A 55 8.141 5.581 6.294 1.00 0.00 O ATOM 874 CB THR A 55 6.300 5.593 8.922 1.00 0.00 C ATOM 875 OG1 THR A 55 6.378 4.517 9.840 1.00 0.00 O ATOM 876 CG2 THR A 55 5.173 6.497 9.373 1.00 0.00 C ATOM 0 H THR A 55 7.291 3.404 8.007 1.00 0.00 H new ATOM 0 HA THR A 55 5.077 5.176 7.219 1.00 0.00 H new ATOM 0 HB THR A 55 7.225 6.169 8.909 1.00 0.00 H new ATOM 0 HG1 THR A 55 6.490 4.869 10.748 1.00 0.00 H new ATOM 0 HG21 THR A 55 5.359 6.828 10.395 1.00 0.00 H new ATOM 0 HG22 THR A 55 5.117 7.365 8.715 1.00 0.00 H new ATOM 0 HG23 THR A 55 4.231 5.951 9.334 1.00 0.00 H new ATOM 884 N THR A 56 6.385 6.938 5.940 1.00 0.00 N ATOM 885 CA THR A 56 7.109 7.773 4.981 1.00 0.00 C ATOM 886 C THR A 56 7.212 9.225 5.447 1.00 0.00 C ATOM 887 O THR A 56 7.685 10.086 4.708 1.00 0.00 O ATOM 888 CB THR A 56 6.429 7.716 3.613 1.00 0.00 C ATOM 889 OG1 THR A 56 5.181 7.050 3.697 1.00 0.00 O ATOM 890 CG2 THR A 56 7.257 7.007 2.560 1.00 0.00 C ATOM 0 H THR A 56 5.421 7.223 6.112 1.00 0.00 H new ATOM 0 HA THR A 56 8.121 7.376 4.905 1.00 0.00 H new ATOM 0 HB THR A 56 6.301 8.756 3.313 1.00 0.00 H new ATOM 0 HG1 THR A 56 4.763 7.026 2.811 1.00 0.00 H new ATOM 0 HG21 THR A 56 6.716 7.002 1.614 1.00 0.00 H new ATOM 0 HG22 THR A 56 8.206 7.527 2.433 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.445 5.981 2.875 1.00 0.00 H new ATOM 898 N GLN A 57 6.770 9.486 6.675 1.00 0.00 N ATOM 899 CA GLN A 57 6.813 10.838 7.249 1.00 0.00 C ATOM 900 C GLN A 57 5.631 11.689 6.781 1.00 0.00 C ATOM 901 O GLN A 57 5.422 12.792 7.286 1.00 0.00 O ATOM 902 CB GLN A 57 8.136 11.554 6.914 1.00 0.00 C ATOM 903 CG GLN A 57 9.348 10.635 6.881 1.00 0.00 C ATOM 904 CD GLN A 57 10.562 11.248 7.551 1.00 0.00 C ATOM 905 OE1 GLN A 57 10.820 11.012 8.731 1.00 0.00 O ATOM 906 NE2 GLN A 57 11.317 12.041 6.797 1.00 0.00 N ATOM 0 H GLN A 57 6.376 8.780 7.297 1.00 0.00 H new ATOM 0 HA GLN A 57 6.746 10.719 8.330 1.00 0.00 H new ATOM 0 HB2 GLN A 57 8.037 12.042 5.945 1.00 0.00 H new ATOM 0 HB3 GLN A 57 8.308 12.339 7.650 1.00 0.00 H new ATOM 0 HG2 GLN A 57 9.101 9.695 7.375 1.00 0.00 H new ATOM 0 HG3 GLN A 57 9.591 10.397 5.845 1.00 0.00 H new ATOM 0 HE21 GLN A 57 11.066 12.209 5.823 1.00 0.00 H new ATOM 0 HE22 GLN A 57 12.148 12.481 7.193 1.00 0.00 H new ATOM 915 N VAL A 58 4.847 11.177 5.832 1.00 0.00 N ATOM 916 CA VAL A 58 3.689 11.912 5.338 1.00 0.00 C ATOM 917 C VAL A 58 2.485 11.658 6.237 1.00 0.00 C ATOM 918 O VAL A 58 2.006 10.529 6.344 1.00 0.00 O ATOM 919 CB VAL A 58 3.340 11.535 3.879 1.00 0.00 C ATOM 920 CG1 VAL A 58 2.986 10.059 3.759 1.00 0.00 C ATOM 921 CG2 VAL A 58 2.205 12.404 3.360 1.00 0.00 C ATOM 0 H VAL A 58 4.992 10.266 5.396 1.00 0.00 H new ATOM 0 HA VAL A 58 3.945 12.971 5.355 1.00 0.00 H new ATOM 0 HB VAL A 58 4.223 11.716 3.266 1.00 0.00 H new ATOM 0 HG11 VAL A 58 2.746 9.826 2.722 1.00 0.00 H new ATOM 0 HG12 VAL A 58 3.834 9.454 4.080 1.00 0.00 H new ATOM 0 HG13 VAL A 58 2.124 9.839 4.389 1.00 0.00 H new ATOM 0 HG21 VAL A 58 1.973 12.124 2.332 1.00 0.00 H new ATOM 0 HG22 VAL A 58 1.322 12.260 3.983 1.00 0.00 H new ATOM 0 HG23 VAL A 58 2.505 13.451 3.392 1.00 0.00 H new ATOM 931 N ALA A 59 2.006 12.709 6.896 1.00 0.00 N ATOM 932 CA ALA A 59 0.865 12.577 7.799 1.00 0.00 C ATOM 933 C ALA A 59 -0.432 13.016 7.135 1.00 0.00 C ATOM 934 O ALA A 59 -0.778 14.199 7.138 1.00 0.00 O ATOM 935 CB ALA A 59 1.089 13.363 9.088 1.00 0.00 C ATOM 0 H ALA A 59 2.385 13.653 6.824 1.00 0.00 H new ATOM 0 HA ALA A 59 0.776 11.519 8.047 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.224 13.246 9.740 1.00 0.00 H new ATOM 0 HB2 ALA A 59 1.978 12.987 9.594 1.00 0.00 H new ATOM 0 HB3 ALA A 59 1.225 14.418 8.852 1.00 0.00 H new ATOM 941 N VAL A 60 -1.153 12.052 6.578 1.00 0.00 N ATOM 942 CA VAL A 60 -2.423 12.325 5.918 1.00 0.00 C ATOM 943 C VAL A 60 -3.505 11.375 6.426 1.00 0.00 C ATOM 944 O VAL A 60 -3.503 10.189 6.097 1.00 0.00 O ATOM 945 CB VAL A 60 -2.292 12.191 4.383 1.00 0.00 C ATOM 946 CG1 VAL A 60 -1.782 10.806 3.998 1.00 0.00 C ATOM 947 CG2 VAL A 60 -3.617 12.490 3.692 1.00 0.00 C ATOM 0 H VAL A 60 -0.878 11.070 6.570 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.706 13.351 6.155 1.00 0.00 H new ATOM 0 HB VAL A 60 -1.562 12.927 4.045 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -1.699 10.737 2.913 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -0.803 10.641 4.448 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -2.479 10.049 4.357 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -3.496 12.388 2.614 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -4.375 11.788 4.040 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -3.929 13.507 3.928 1.00 0.00 H new ATOM 957 N GLU A 61 -4.427 11.895 7.240 1.00 0.00 N ATOM 958 CA GLU A 61 -5.498 11.073 7.792 1.00 0.00 C ATOM 959 C GLU A 61 -6.841 11.798 7.739 1.00 0.00 C ATOM 960 O GLU A 61 -6.951 12.957 8.140 1.00 0.00 O ATOM 961 CB GLU A 61 -5.171 10.683 9.237 1.00 0.00 C ATOM 962 CG GLU A 61 -4.675 9.255 9.383 1.00 0.00 C ATOM 963 CD GLU A 61 -4.504 8.843 10.833 1.00 0.00 C ATOM 964 OE1 GLU A 61 -5.493 8.377 11.439 1.00 0.00 O ATOM 965 OE2 GLU A 61 -3.381 8.986 11.362 1.00 0.00 O ATOM 0 H GLU A 61 -4.451 12.873 7.528 1.00 0.00 H new ATOM 0 HA GLU A 61 -5.576 10.172 7.183 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.414 11.364 9.626 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -6.062 10.814 9.851 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -5.378 8.578 8.897 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -3.722 9.150 8.864 1.00 0.00 H new ATOM 972 N LYS A 62 -7.861 11.102 7.245 1.00 0.00 N ATOM 973 CA LYS A 62 -9.203 11.668 7.143 1.00 0.00 C ATOM 974 C LYS A 62 -10.253 10.613 7.492 1.00 0.00 C ATOM 975 O LYS A 62 -9.948 9.421 7.547 1.00 0.00 O ATOM 976 CB LYS A 62 -9.440 12.211 5.730 1.00 0.00 C ATOM 977 CG LYS A 62 -10.838 12.770 5.511 1.00 0.00 C ATOM 978 CD LYS A 62 -10.966 13.432 4.149 1.00 0.00 C ATOM 979 CE LYS A 62 -12.294 14.156 4.003 1.00 0.00 C ATOM 980 NZ LYS A 62 -13.444 13.294 4.398 1.00 0.00 N ATOM 0 H LYS A 62 -7.783 10.142 6.908 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.291 12.491 7.853 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.710 12.994 5.525 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -9.262 11.413 5.010 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.570 11.967 5.596 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -11.068 13.495 6.292 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -10.148 14.139 4.009 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -10.874 12.678 3.367 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -12.287 15.056 4.618 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.420 14.478 2.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -14.332 13.733 4.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -13.344 12.358 3.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -13.459 13.188 5.433 1.00 0.00 H new ATOM 994 N GLU A 63 -11.489 11.050 7.729 1.00 0.00 N ATOM 995 CA GLU A 63 -12.568 10.126 8.074 1.00 0.00 C ATOM 996 C GLU A 63 -13.440 9.812 6.862 1.00 0.00 C ATOM 997 O GLU A 63 -14.435 10.489 6.603 1.00 0.00 O ATOM 998 CB GLU A 63 -13.425 10.692 9.215 1.00 0.00 C ATOM 999 CG GLU A 63 -14.022 12.066 8.937 1.00 0.00 C ATOM 1000 CD GLU A 63 -13.071 13.196 9.281 1.00 0.00 C ATOM 1001 OE1 GLU A 63 -12.614 13.253 10.441 1.00 0.00 O ATOM 1002 OE2 GLU A 63 -12.788 14.023 8.390 1.00 0.00 O ATOM 0 H GLU A 63 -11.767 12.031 7.689 1.00 0.00 H new ATOM 0 HA GLU A 63 -12.110 9.196 8.410 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -14.235 9.994 9.424 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.814 10.751 10.116 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -14.294 12.133 7.884 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -14.941 12.182 9.512 1.00 0.00 H new ATOM 1009 N GLU A 64 -13.062 8.777 6.119 1.00 0.00 N ATOM 1010 CA GLU A 64 -13.809 8.372 4.933 1.00 0.00 C ATOM 1011 C GLU A 64 -13.306 7.023 4.412 1.00 0.00 C ATOM 1012 O GLU A 64 -12.175 6.624 4.689 1.00 0.00 O ATOM 1013 CB GLU A 64 -13.691 9.456 3.849 1.00 0.00 C ATOM 1014 CG GLU A 64 -13.752 8.932 2.420 1.00 0.00 C ATOM 1015 CD GLU A 64 -14.070 10.021 1.413 1.00 0.00 C ATOM 1016 OE1 GLU A 64 -13.164 10.822 1.100 1.00 0.00 O ATOM 1017 OE2 GLU A 64 -15.223 10.072 0.938 1.00 0.00 O ATOM 0 H GLU A 64 -12.242 8.203 6.317 1.00 0.00 H new ATOM 0 HA GLU A 64 -14.860 8.256 5.199 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -14.492 10.182 3.991 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -12.750 9.989 3.987 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -12.797 8.473 2.164 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -14.509 8.150 2.355 1.00 0.00 H new ATOM 1024 N ASN A 65 -14.152 6.327 3.653 1.00 0.00 N ATOM 1025 CA ASN A 65 -13.789 5.030 3.092 1.00 0.00 C ATOM 1026 C ASN A 65 -13.539 4.008 4.196 1.00 0.00 C ATOM 1027 O ASN A 65 -14.420 3.216 4.533 1.00 0.00 O ATOM 1028 CB ASN A 65 -12.545 5.169 2.203 1.00 0.00 C ATOM 1029 CG ASN A 65 -12.115 3.849 1.596 1.00 0.00 C ATOM 1030 OD1 ASN A 65 -11.920 2.860 2.303 1.00 0.00 O ATOM 1031 ND2 ASN A 65 -11.964 3.827 0.276 1.00 0.00 N ATOM 0 H ASN A 65 -15.092 6.641 3.414 1.00 0.00 H new ATOM 0 HA ASN A 65 -14.621 4.675 2.484 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -12.751 5.882 1.405 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -11.725 5.578 2.793 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -11.676 2.967 -0.190 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -12.136 4.670 -0.271 1.00 0.00 H new ATOM 1038 N SER A 66 -12.332 4.044 4.756 1.00 0.00 N ATOM 1039 CA SER A 66 -11.927 3.135 5.838 1.00 0.00 C ATOM 1040 C SER A 66 -12.637 1.775 5.761 1.00 0.00 C ATOM 1041 O SER A 66 -13.637 1.561 6.444 1.00 0.00 O ATOM 1042 CB SER A 66 -12.219 3.783 7.193 1.00 0.00 C ATOM 1043 OG SER A 66 -11.137 4.594 7.614 1.00 0.00 O ATOM 0 H SER A 66 -11.604 4.702 4.476 1.00 0.00 H new ATOM 0 HA SER A 66 -10.858 2.955 5.724 1.00 0.00 H new ATOM 0 HB2 SER A 66 -13.124 4.386 7.124 1.00 0.00 H new ATOM 0 HB3 SER A 66 -12.408 3.009 7.937 1.00 0.00 H new ATOM 0 HG SER A 66 -11.349 4.998 8.481 1.00 0.00 H new ATOM 1049 N LYS A 67 -12.110 0.851 4.952 1.00 0.00 N ATOM 1050 CA LYS A 67 -12.720 -0.482 4.841 1.00 0.00 C ATOM 1051 C LYS A 67 -11.915 -1.503 5.645 1.00 0.00 C ATOM 1052 O LYS A 67 -10.732 -1.294 5.915 1.00 0.00 O ATOM 1053 CB LYS A 67 -12.859 -0.945 3.377 1.00 0.00 C ATOM 1054 CG LYS A 67 -11.586 -0.855 2.548 1.00 0.00 C ATOM 1055 CD LYS A 67 -10.666 -2.038 2.807 1.00 0.00 C ATOM 1056 CE LYS A 67 -9.340 -1.881 2.086 1.00 0.00 C ATOM 1057 NZ LYS A 67 -8.308 -2.825 2.601 1.00 0.00 N ATOM 0 H LYS A 67 -11.281 0.993 4.375 1.00 0.00 H new ATOM 0 HA LYS A 67 -13.727 -0.409 5.253 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -13.206 -1.978 3.370 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -13.631 -0.346 2.895 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -11.842 -0.817 1.489 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -11.063 0.072 2.783 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -10.489 -2.135 3.878 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -11.153 -2.957 2.480 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -9.485 -2.050 1.019 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -8.984 -0.857 2.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -7.573 -2.293 3.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -8.753 -3.506 3.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -7.877 -3.336 1.805 1.00 0.00 H new ATOM 1071 N ASP A 68 -12.564 -2.596 6.045 1.00 0.00 N ATOM 1072 CA ASP A 68 -11.895 -3.628 6.840 1.00 0.00 C ATOM 1073 C ASP A 68 -11.846 -4.980 6.124 1.00 0.00 C ATOM 1074 O ASP A 68 -11.206 -5.913 6.609 1.00 0.00 O ATOM 1075 CB ASP A 68 -12.600 -3.790 8.189 1.00 0.00 C ATOM 1076 CG ASP A 68 -14.106 -3.901 8.046 1.00 0.00 C ATOM 1077 OD1 ASP A 68 -14.783 -2.850 8.058 1.00 0.00 O ATOM 1078 OD2 ASP A 68 -14.608 -5.038 7.922 1.00 0.00 O ATOM 0 H ASP A 68 -13.543 -2.790 5.835 1.00 0.00 H new ATOM 0 HA ASP A 68 -10.867 -3.298 6.990 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -12.219 -4.680 8.690 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -12.360 -2.938 8.826 1.00 0.00 H new ATOM 1083 N VAL A 69 -12.516 -5.097 4.979 1.00 0.00 N ATOM 1084 CA VAL A 69 -12.519 -6.356 4.238 1.00 0.00 C ATOM 1085 C VAL A 69 -12.091 -6.153 2.786 1.00 0.00 C ATOM 1086 O VAL A 69 -12.441 -5.152 2.161 1.00 0.00 O ATOM 1087 CB VAL A 69 -13.907 -7.039 4.277 1.00 0.00 C ATOM 1088 CG1 VAL A 69 -14.894 -6.348 3.343 1.00 0.00 C ATOM 1089 CG2 VAL A 69 -13.780 -8.515 3.931 1.00 0.00 C ATOM 0 H VAL A 69 -13.057 -4.346 4.549 1.00 0.00 H new ATOM 0 HA VAL A 69 -11.796 -7.007 4.730 1.00 0.00 H new ATOM 0 HB VAL A 69 -14.297 -6.950 5.291 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -15.859 -6.853 3.395 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -15.013 -5.307 3.644 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -14.517 -6.389 2.321 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -14.764 -8.982 3.963 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -13.361 -8.619 2.930 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -13.124 -9.003 4.652 1.00 0.00 H new ATOM 1099 N VAL A 70 -11.334 -7.113 2.258 1.00 0.00 N ATOM 1100 CA VAL A 70 -10.859 -7.035 0.876 1.00 0.00 C ATOM 1101 C VAL A 70 -10.500 -8.414 0.319 1.00 0.00 C ATOM 1102 O VAL A 70 -10.231 -9.347 1.073 1.00 0.00 O ATOM 1103 CB VAL A 70 -9.630 -6.110 0.747 1.00 0.00 C ATOM 1104 CG1 VAL A 70 -9.991 -4.688 1.141 1.00 0.00 C ATOM 1105 CG2 VAL A 70 -8.452 -6.618 1.578 1.00 0.00 C ATOM 0 H VAL A 70 -11.037 -7.949 2.761 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.683 -6.620 0.296 1.00 0.00 H new ATOM 0 HB VAL A 70 -9.320 -6.115 -0.298 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -9.113 -4.050 1.044 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -10.782 -4.319 0.488 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -10.338 -4.674 2.174 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -7.606 -5.941 1.462 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -8.740 -6.662 2.628 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -8.169 -7.614 1.237 1.00 0.00 H new ATOM 1115 N GLU A 71 -10.500 -8.532 -1.012 1.00 0.00 N ATOM 1116 CA GLU A 71 -10.176 -9.801 -1.669 1.00 0.00 C ATOM 1117 C GLU A 71 -8.700 -9.876 -2.047 1.00 0.00 C ATOM 1118 O GLU A 71 -8.053 -8.863 -2.302 1.00 0.00 O ATOM 1119 CB GLU A 71 -11.043 -10.020 -2.917 1.00 0.00 C ATOM 1120 CG GLU A 71 -12.467 -9.528 -2.755 1.00 0.00 C ATOM 1121 CD GLU A 71 -13.176 -9.339 -4.083 1.00 0.00 C ATOM 1122 OE1 GLU A 71 -12.766 -9.981 -5.071 1.00 0.00 O ATOM 1123 OE2 GLU A 71 -14.142 -8.548 -4.132 1.00 0.00 O ATOM 0 H GLU A 71 -10.719 -7.769 -1.652 1.00 0.00 H new ATOM 0 HA GLU A 71 -10.389 -10.592 -0.950 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -10.584 -9.509 -3.763 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -11.059 -11.083 -3.157 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -13.026 -10.240 -2.147 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.461 -8.582 -2.213 1.00 0.00 H new ATOM 1130 N LEU A 72 -8.184 -11.095 -2.075 1.00 0.00 N ATOM 1131 CA LEU A 72 -6.780 -11.348 -2.415 1.00 0.00 C ATOM 1132 C LEU A 72 -6.338 -10.573 -3.661 1.00 0.00 C ATOM 1133 O LEU A 72 -6.949 -10.694 -4.722 1.00 0.00 O ATOM 1134 CB LEU A 72 -6.570 -12.853 -2.654 1.00 0.00 C ATOM 1135 CG LEU A 72 -5.156 -13.280 -3.074 1.00 0.00 C ATOM 1136 CD1 LEU A 72 -4.383 -13.811 -1.877 1.00 0.00 C ATOM 1137 CD2 LEU A 72 -5.226 -14.337 -4.167 1.00 0.00 C ATOM 0 H LEU A 72 -8.719 -11.938 -1.865 1.00 0.00 H new ATOM 0 HA LEU A 72 -6.174 -11.006 -1.576 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.832 -13.385 -1.739 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -7.270 -13.179 -3.424 1.00 0.00 H new ATOM 0 HG LEU A 72 -4.633 -12.407 -3.465 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.383 -14.109 -2.193 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -4.307 -13.032 -1.118 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -4.904 -14.673 -1.461 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -4.216 -14.630 -4.455 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.765 -15.209 -3.796 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -5.747 -13.930 -5.034 1.00 0.00 H new ATOM 1149 N GLY A 73 -5.255 -9.800 -3.534 1.00 0.00 N ATOM 1150 CA GLY A 73 -4.743 -9.051 -4.678 1.00 0.00 C ATOM 1151 C GLY A 73 -4.837 -7.542 -4.532 1.00 0.00 C ATOM 1152 O GLY A 73 -4.001 -6.817 -5.074 1.00 0.00 O ATOM 0 H GLY A 73 -4.728 -9.680 -2.669 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -3.700 -9.324 -4.838 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -5.292 -9.353 -5.570 1.00 0.00 H new ATOM 1156 N ASP A 74 -5.850 -7.054 -3.827 1.00 0.00 N ATOM 1157 CA ASP A 74 -6.024 -5.611 -3.661 1.00 0.00 C ATOM 1158 C ASP A 74 -5.034 -5.025 -2.655 1.00 0.00 C ATOM 1159 O ASP A 74 -4.529 -5.724 -1.776 1.00 0.00 O ATOM 1160 CB ASP A 74 -7.459 -5.275 -3.245 1.00 0.00 C ATOM 1161 CG ASP A 74 -8.012 -6.232 -2.212 1.00 0.00 C ATOM 1162 OD1 ASP A 74 -7.294 -6.534 -1.237 1.00 0.00 O ATOM 1163 OD2 ASP A 74 -9.164 -6.681 -2.382 1.00 0.00 O ATOM 0 H ASP A 74 -6.557 -7.626 -3.365 1.00 0.00 H new ATOM 0 HA ASP A 74 -5.822 -5.156 -4.630 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -7.488 -4.261 -2.846 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -8.100 -5.289 -4.126 1.00 0.00 H new ATOM 1168 N VAL A 75 -4.769 -3.726 -2.800 1.00 0.00 N ATOM 1169 CA VAL A 75 -3.841 -3.008 -1.912 1.00 0.00 C ATOM 1170 C VAL A 75 -4.608 -1.979 -1.072 1.00 0.00 C ATOM 1171 O VAL A 75 -5.655 -1.495 -1.502 1.00 0.00 O ATOM 1172 CB VAL A 75 -2.735 -2.278 -2.719 1.00 0.00 C ATOM 1173 CG1 VAL A 75 -1.662 -1.700 -1.802 1.00 0.00 C ATOM 1174 CG2 VAL A 75 -2.114 -3.219 -3.740 1.00 0.00 C ATOM 0 H VAL A 75 -5.184 -3.143 -3.527 1.00 0.00 H new ATOM 0 HA VAL A 75 -3.370 -3.745 -1.262 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.202 -1.446 -3.246 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.904 -1.196 -2.402 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.116 -0.985 -1.116 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -1.198 -2.505 -1.232 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -1.340 -2.691 -4.298 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -1.673 -4.073 -3.226 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -2.884 -3.568 -4.429 1.00 0.00 H new ATOM 1184 N ALA A 76 -4.110 -1.641 0.126 1.00 0.00 N ATOM 1185 CA ALA A 76 -4.807 -0.678 0.970 1.00 0.00 C ATOM 1186 C ALA A 76 -3.847 0.148 1.823 1.00 0.00 C ATOM 1187 O ALA A 76 -2.815 -0.349 2.272 1.00 0.00 O ATOM 1188 CB ALA A 76 -5.811 -1.396 1.854 1.00 0.00 C ATOM 0 H ALA A 76 -3.246 -2.014 0.520 1.00 0.00 H new ATOM 0 HA ALA A 76 -5.329 0.016 0.311 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -6.328 -0.670 2.482 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -6.537 -1.918 1.231 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -5.290 -2.116 2.485 1.00 0.00 H new ATOM 1194 N TYR A 77 -4.206 1.413 2.056 1.00 0.00 N ATOM 1195 CA TYR A 77 -3.385 2.303 2.872 1.00 0.00 C ATOM 1196 C TYR A 77 -3.974 2.429 4.279 1.00 0.00 C ATOM 1197 O TYR A 77 -5.121 2.842 4.444 1.00 0.00 O ATOM 1198 CB TYR A 77 -3.261 3.683 2.201 1.00 0.00 C ATOM 1199 CG TYR A 77 -3.646 4.855 3.080 1.00 0.00 C ATOM 1200 CD1 TYR A 77 -2.823 5.263 4.121 1.00 0.00 C ATOM 1201 CD2 TYR A 77 -4.829 5.553 2.867 1.00 0.00 C ATOM 1202 CE1 TYR A 77 -3.167 6.330 4.927 1.00 0.00 C ATOM 1203 CE2 TYR A 77 -5.179 6.623 3.670 1.00 0.00 C ATOM 1204 CZ TYR A 77 -4.344 7.007 4.696 1.00 0.00 C ATOM 1205 OH TYR A 77 -4.691 8.072 5.497 1.00 0.00 O ATOM 0 H TYR A 77 -5.057 1.840 1.691 1.00 0.00 H new ATOM 0 HA TYR A 77 -2.385 1.877 2.959 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -2.232 3.819 1.869 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -3.887 3.695 1.309 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -1.898 4.737 4.304 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -5.485 5.255 2.062 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -2.516 6.632 5.734 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -6.102 7.155 3.494 1.00 0.00 H new ATOM 0 HH TYR A 77 -4.036 8.792 5.386 1.00 0.00 H new ATOM 1215 N TRP A 78 -3.184 2.068 5.286 1.00 0.00 N ATOM 1216 CA TRP A 78 -3.637 2.143 6.673 1.00 0.00 C ATOM 1217 C TRP A 78 -3.894 3.593 7.083 1.00 0.00 C ATOM 1218 O TRP A 78 -2.966 4.400 7.142 1.00 0.00 O ATOM 1219 CB TRP A 78 -2.600 1.515 7.611 1.00 0.00 C ATOM 1220 CG TRP A 78 -3.180 1.026 8.904 1.00 0.00 C ATOM 1221 CD1 TRP A 78 -4.401 1.339 9.420 1.00 0.00 C ATOM 1222 CD2 TRP A 78 -2.560 0.142 9.844 1.00 0.00 C ATOM 1223 NE1 TRP A 78 -4.584 0.706 10.625 1.00 0.00 N ATOM 1224 CE2 TRP A 78 -3.466 -0.036 10.907 1.00 0.00 C ATOM 1225 CE3 TRP A 78 -1.329 -0.517 9.890 1.00 0.00 C ATOM 1226 CZ2 TRP A 78 -3.177 -0.846 12.003 1.00 0.00 C ATOM 1227 CZ3 TRP A 78 -1.043 -1.320 10.979 1.00 0.00 C ATOM 1228 CH2 TRP A 78 -1.965 -1.479 12.023 1.00 0.00 C ATOM 0 H TRP A 78 -2.232 1.722 5.170 1.00 0.00 H new ATOM 0 HA TRP A 78 -4.571 1.587 6.752 1.00 0.00 H new ATOM 0 HB2 TRP A 78 -2.118 0.681 7.100 1.00 0.00 H new ATOM 0 HB3 TRP A 78 -1.824 2.250 7.825 1.00 0.00 H new ATOM 0 HD1 TRP A 78 -5.122 1.991 8.949 1.00 0.00 H new ATOM 0 HE1 TRP A 78 -5.414 0.776 11.213 1.00 0.00 H new ATOM 0 HE3 TRP A 78 -0.613 -0.401 9.089 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 -3.885 -0.970 12.809 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 -0.094 -1.833 11.026 1.00 0.00 H new ATOM 0 HH2 TRP A 78 -1.713 -2.114 12.860 1.00 0.00 H new ATOM 1239 N ILE A 79 -5.155 3.924 7.364 1.00 0.00 N ATOM 1240 CA ILE A 79 -5.507 5.283 7.761 1.00 0.00 C ATOM 1241 C ILE A 79 -4.981 5.591 9.168 1.00 0.00 C ATOM 1242 O ILE A 79 -4.077 6.413 9.316 1.00 0.00 O ATOM 1243 CB ILE A 79 -7.034 5.531 7.650 1.00 0.00 C ATOM 1244 CG1 ILE A 79 -7.379 5.936 6.211 1.00 0.00 C ATOM 1245 CG2 ILE A 79 -7.512 6.586 8.644 1.00 0.00 C ATOM 1246 CD1 ILE A 79 -8.500 6.951 6.093 1.00 0.00 C ATOM 0 H ILE A 79 -5.941 3.275 7.324 1.00 0.00 H new ATOM 0 HA ILE A 79 -5.024 5.972 7.068 1.00 0.00 H new ATOM 0 HB ILE A 79 -7.553 4.606 7.900 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -6.486 6.344 5.738 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -7.656 5.042 5.652 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -8.587 6.730 8.533 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -7.293 6.255 9.659 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -6.998 7.528 8.450 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -8.676 7.178 5.042 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -9.409 6.541 6.533 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -8.221 7.864 6.620 1.00 0.00 H new ATOM 1258 N PRO A 80 -5.512 4.937 10.226 1.00 0.00 N ATOM 1259 CA PRO A 80 -5.042 5.171 11.597 1.00 0.00 C ATOM 1260 C PRO A 80 -3.564 4.813 11.755 1.00 0.00 C ATOM 1261 O PRO A 80 -3.221 3.771 12.316 1.00 0.00 O ATOM 1262 CB PRO A 80 -5.909 4.240 12.454 1.00 0.00 C ATOM 1263 CG PRO A 80 -7.082 3.900 11.600 1.00 0.00 C ATOM 1264 CD PRO A 80 -6.588 3.930 10.183 1.00 0.00 C ATOM 0 HA PRO A 80 -5.127 6.220 11.882 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -5.359 3.344 12.742 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -6.222 4.731 13.375 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -7.477 2.916 11.854 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -7.891 4.616 11.746 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -6.216 2.956 9.865 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -7.377 4.213 9.487 1.00 0.00 H new ATOM 1272 N GLY A 81 -2.695 5.682 11.250 1.00 0.00 N ATOM 1273 CA GLY A 81 -1.264 5.444 11.335 1.00 0.00 C ATOM 1274 C GLY A 81 -0.505 5.997 10.136 1.00 0.00 C ATOM 1275 O GLY A 81 0.724 6.060 10.158 1.00 0.00 O ATOM 0 H GLY A 81 -2.956 6.550 10.782 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -0.877 5.900 12.247 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -1.082 4.372 11.413 1.00 0.00 H new ATOM 1279 N LYS A 82 -1.230 6.407 9.088 1.00 0.00 N ATOM 1280 CA LYS A 82 -0.590 6.964 7.888 1.00 0.00 C ATOM 1281 C LYS A 82 0.461 6.006 7.335 1.00 0.00 C ATOM 1282 O LYS A 82 1.459 6.431 6.752 1.00 0.00 O ATOM 1283 CB LYS A 82 0.069 8.316 8.201 1.00 0.00 C ATOM 1284 CG LYS A 82 -0.583 9.094 9.341 1.00 0.00 C ATOM 1285 CD LYS A 82 0.302 9.114 10.578 1.00 0.00 C ATOM 1286 CE LYS A 82 1.662 9.729 10.288 1.00 0.00 C ATOM 1287 NZ LYS A 82 1.855 11.018 11.006 1.00 0.00 N ATOM 0 H LYS A 82 -2.248 6.365 9.045 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.368 7.109 7.138 1.00 0.00 H new ATOM 0 HB2 LYS A 82 1.117 8.146 8.448 1.00 0.00 H new ATOM 0 HB3 LYS A 82 0.050 8.931 7.301 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -0.783 10.116 9.018 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -1.545 8.644 9.587 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -0.191 9.679 11.369 1.00 0.00 H new ATOM 0 HD3 LYS A 82 0.434 8.097 10.947 1.00 0.00 H new ATOM 0 HE2 LYS A 82 2.446 9.030 10.580 1.00 0.00 H new ATOM 0 HE3 LYS A 82 1.765 9.893 9.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 2.715 11.486 10.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 1.033 11.634 10.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 1.952 10.836 12.025 1.00 0.00 H new ATOM 1301 N ALA A 83 0.234 4.712 7.530 1.00 0.00 N ATOM 1302 CA ALA A 83 1.167 3.690 7.061 1.00 0.00 C ATOM 1303 C ALA A 83 0.544 2.811 5.974 1.00 0.00 C ATOM 1304 O ALA A 83 -0.605 2.390 6.087 1.00 0.00 O ATOM 1305 CB ALA A 83 1.624 2.840 8.240 1.00 0.00 C ATOM 0 H ALA A 83 -0.588 4.344 8.010 1.00 0.00 H new ATOM 0 HA ALA A 83 2.028 4.190 6.617 1.00 0.00 H new ATOM 0 HB1 ALA A 83 2.320 2.077 7.891 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.119 3.474 8.975 1.00 0.00 H new ATOM 0 HB3 ALA A 83 0.760 2.360 8.699 1.00 0.00 H new ATOM 1311 N ILE A 84 1.311 2.528 4.922 1.00 0.00 N ATOM 1312 CA ILE A 84 0.828 1.685 3.826 1.00 0.00 C ATOM 1313 C ILE A 84 1.118 0.215 4.122 1.00 0.00 C ATOM 1314 O ILE A 84 2.107 -0.098 4.782 1.00 0.00 O ATOM 1315 CB ILE A 84 1.484 2.071 2.485 1.00 0.00 C ATOM 1316 CG1 ILE A 84 1.536 3.594 2.329 1.00 0.00 C ATOM 1317 CG2 ILE A 84 0.729 1.438 1.325 1.00 0.00 C ATOM 1318 CD1 ILE A 84 2.147 4.049 1.020 1.00 0.00 C ATOM 0 H ILE A 84 2.266 2.868 4.804 1.00 0.00 H new ATOM 0 HA ILE A 84 -0.248 1.840 3.744 1.00 0.00 H new ATOM 0 HB ILE A 84 2.506 1.693 2.478 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.525 3.994 2.407 1.00 0.00 H new ATOM 0 HG13 ILE A 84 2.110 4.016 3.154 1.00 0.00 H new ATOM 0 HG21 ILE A 84 1.204 1.719 0.385 1.00 0.00 H new ATOM 0 HG22 ILE A 84 0.745 0.353 1.429 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -0.303 1.787 1.329 1.00 0.00 H new ATOM 0 HD11 ILE A 84 2.151 5.138 0.979 1.00 0.00 H new ATOM 0 HD12 ILE A 84 3.170 3.680 0.948 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.561 3.657 0.189 1.00 0.00 H new ATOM 1330 N CYS A 85 0.253 -0.688 3.657 1.00 0.00 N ATOM 1331 CA CYS A 85 0.449 -2.120 3.924 1.00 0.00 C ATOM 1332 C CYS A 85 0.052 -3.011 2.739 1.00 0.00 C ATOM 1333 O CYS A 85 -1.033 -2.865 2.177 1.00 0.00 O ATOM 1334 CB CYS A 85 -0.348 -2.531 5.169 1.00 0.00 C ATOM 1335 SG CYS A 85 -0.427 -1.263 6.460 1.00 0.00 S ATOM 0 H CYS A 85 -0.575 -0.464 3.105 1.00 0.00 H new ATOM 0 HA CYS A 85 1.516 -2.267 4.091 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -1.363 -2.788 4.867 1.00 0.00 H new ATOM 0 HB3 CYS A 85 0.098 -3.433 5.589 1.00 0.00 H new ATOM 0 HG CYS A 85 -0.894 -1.786 7.554 1.00 0.00 H new ATOM 1341 N LEU A 86 0.937 -3.958 2.384 1.00 0.00 N ATOM 1342 CA LEU A 86 0.674 -4.901 1.292 1.00 0.00 C ATOM 1343 C LEU A 86 -0.032 -6.145 1.833 1.00 0.00 C ATOM 1344 O LEU A 86 0.065 -6.448 3.022 1.00 0.00 O ATOM 1345 CB LEU A 86 1.988 -5.317 0.611 1.00 0.00 C ATOM 1346 CG LEU A 86 2.122 -4.930 -0.865 1.00 0.00 C ATOM 1347 CD1 LEU A 86 3.507 -4.369 -1.142 1.00 0.00 C ATOM 1348 CD2 LEU A 86 1.856 -6.132 -1.759 1.00 0.00 C ATOM 0 H LEU A 86 1.840 -4.088 2.840 1.00 0.00 H new ATOM 0 HA LEU A 86 0.034 -4.408 0.560 1.00 0.00 H new ATOM 0 HB2 LEU A 86 2.818 -4.873 1.161 1.00 0.00 H new ATOM 0 HB3 LEU A 86 2.093 -6.399 0.695 1.00 0.00 H new ATOM 0 HG LEU A 86 1.381 -4.161 -1.086 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.586 -4.099 -2.195 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.671 -3.484 -0.527 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.259 -5.121 -0.903 1.00 0.00 H new ATOM 0 HD21 LEU A 86 1.956 -5.838 -2.804 1.00 0.00 H new ATOM 0 HD22 LEU A 86 2.575 -6.919 -1.534 1.00 0.00 H new ATOM 0 HD23 LEU A 86 0.846 -6.501 -1.581 1.00 0.00 H new ATOM 1360 N PHE A 87 -0.734 -6.867 0.963 1.00 0.00 N ATOM 1361 CA PHE A 87 -1.437 -8.078 1.382 1.00 0.00 C ATOM 1362 C PHE A 87 -1.247 -9.211 0.379 1.00 0.00 C ATOM 1363 O PHE A 87 -1.375 -9.013 -0.828 1.00 0.00 O ATOM 1364 CB PHE A 87 -2.931 -7.805 1.559 1.00 0.00 C ATOM 1365 CG PHE A 87 -3.235 -6.475 2.179 1.00 0.00 C ATOM 1366 CD1 PHE A 87 -3.037 -6.263 3.534 1.00 0.00 C ATOM 1367 CD2 PHE A 87 -3.724 -5.440 1.405 1.00 0.00 C ATOM 1368 CE1 PHE A 87 -3.325 -5.038 4.105 1.00 0.00 C ATOM 1369 CE2 PHE A 87 -4.011 -4.215 1.969 1.00 0.00 C ATOM 1370 CZ PHE A 87 -3.813 -4.012 3.321 1.00 0.00 C ATOM 0 H PHE A 87 -0.831 -6.639 -0.026 1.00 0.00 H new ATOM 0 HA PHE A 87 -1.009 -8.382 2.337 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -3.419 -7.861 0.586 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -3.363 -8.591 2.178 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -2.654 -7.063 4.150 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -3.883 -5.592 0.348 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -3.169 -4.884 5.162 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -4.391 -3.413 1.353 1.00 0.00 H new ATOM 0 HZ PHE A 87 -4.039 -3.053 3.763 1.00 0.00 H new ATOM 1380 N PHE A 88 -0.958 -10.401 0.893 1.00 0.00 N ATOM 1381 CA PHE A 88 -0.769 -11.572 0.045 1.00 0.00 C ATOM 1382 C PHE A 88 -1.094 -12.851 0.811 1.00 0.00 C ATOM 1383 O PHE A 88 -0.536 -13.912 0.529 1.00 0.00 O ATOM 1384 CB PHE A 88 0.664 -11.623 -0.484 1.00 0.00 C ATOM 1385 CG PHE A 88 0.749 -11.642 -1.983 1.00 0.00 C ATOM 1386 CD1 PHE A 88 0.593 -10.475 -2.714 1.00 0.00 C ATOM 1387 CD2 PHE A 88 0.987 -12.828 -2.661 1.00 0.00 C ATOM 1388 CE1 PHE A 88 0.670 -10.491 -4.094 1.00 0.00 C ATOM 1389 CE2 PHE A 88 1.064 -12.848 -4.041 1.00 0.00 C ATOM 1390 CZ PHE A 88 0.906 -11.678 -4.759 1.00 0.00 C ATOM 0 H PHE A 88 -0.850 -10.580 1.891 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.452 -11.493 -0.801 1.00 0.00 H new ATOM 0 HB2 PHE A 88 1.213 -10.759 -0.108 1.00 0.00 H new ATOM 0 HB3 PHE A 88 1.157 -12.511 -0.089 1.00 0.00 H new ATOM 0 HD1 PHE A 88 0.409 -9.543 -2.200 1.00 0.00 H new ATOM 0 HD2 PHE A 88 1.113 -13.745 -2.105 1.00 0.00 H new ATOM 0 HE1 PHE A 88 0.546 -9.575 -4.652 1.00 0.00 H new ATOM 0 HE2 PHE A 88 1.248 -13.778 -4.558 1.00 0.00 H new ATOM 0 HZ PHE A 88 0.967 -11.692 -5.837 1.00 0.00 H new ATOM 1400 N GLY A 89 -1.996 -12.743 1.783 1.00 0.00 N ATOM 1401 CA GLY A 89 -2.375 -13.899 2.573 1.00 0.00 C ATOM 1402 C GLY A 89 -2.752 -13.533 4.000 1.00 0.00 C ATOM 1403 O GLY A 89 -3.273 -12.446 4.248 1.00 0.00 O ATOM 0 H GLY A 89 -2.470 -11.876 2.036 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -3.217 -14.401 2.096 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -1.549 -14.610 2.590 1.00 0.00 H new ATOM 1407 N LYS A 90 -2.508 -14.457 4.934 1.00 0.00 N ATOM 1408 CA LYS A 90 -2.837 -14.249 6.354 1.00 0.00 C ATOM 1409 C LYS A 90 -2.537 -12.820 6.824 1.00 0.00 C ATOM 1410 O LYS A 90 -1.893 -12.043 6.120 1.00 0.00 O ATOM 1411 CB LYS A 90 -2.081 -15.239 7.250 1.00 0.00 C ATOM 1412 CG LYS A 90 -0.562 -15.184 7.121 1.00 0.00 C ATOM 1413 CD LYS A 90 -0.081 -15.847 5.841 1.00 0.00 C ATOM 1414 CE LYS A 90 1.101 -16.760 6.101 1.00 0.00 C ATOM 1415 NZ LYS A 90 2.060 -16.770 4.962 1.00 0.00 N ATOM 0 H LYS A 90 -2.082 -15.362 4.734 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.910 -14.420 6.441 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.351 -15.047 8.288 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.416 -16.249 7.015 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -0.233 -14.145 7.138 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -0.106 -15.677 7.980 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.895 -16.421 5.398 1.00 0.00 H new ATOM 0 HD3 LYS A 90 0.200 -15.082 5.117 1.00 0.00 H new ATOM 0 HE2 LYS A 90 1.616 -16.437 7.006 1.00 0.00 H new ATOM 0 HE3 LYS A 90 0.743 -17.773 6.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 2.853 -17.407 5.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 1.576 -17.103 4.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 2.422 -15.808 4.805 1.00 0.00 H new ATOM 1429 N THR A 91 -3.003 -12.482 8.032 1.00 0.00 N ATOM 1430 CA THR A 91 -2.787 -11.162 8.603 1.00 0.00 C ATOM 1431 C THR A 91 -2.873 -11.253 10.125 1.00 0.00 C ATOM 1432 O THR A 91 -3.035 -12.346 10.668 1.00 0.00 O ATOM 1433 CB THR A 91 -3.832 -10.183 8.060 1.00 0.00 C ATOM 1434 OG1 THR A 91 -4.761 -10.851 7.225 1.00 0.00 O ATOM 1435 CG2 THR A 91 -3.229 -9.051 7.255 1.00 0.00 C ATOM 0 H THR A 91 -3.535 -13.114 8.631 1.00 0.00 H new ATOM 0 HA THR A 91 -1.798 -10.797 8.325 1.00 0.00 H new ATOM 0 HB THR A 91 -4.320 -9.766 8.941 1.00 0.00 H new ATOM 0 HG1 THR A 91 -5.328 -11.437 7.769 1.00 0.00 H new ATOM 0 HG21 THR A 91 -4.023 -8.394 6.900 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.542 -8.483 7.883 1.00 0.00 H new ATOM 0 HG23 THR A 91 -2.687 -9.460 6.402 1.00 0.00 H new ATOM 1443 N PRO A 92 -2.770 -10.120 10.849 1.00 0.00 N ATOM 1444 CA PRO A 92 -2.844 -10.122 12.313 1.00 0.00 C ATOM 1445 C PRO A 92 -3.947 -11.036 12.843 1.00 0.00 C ATOM 1446 O PRO A 92 -3.870 -11.527 13.969 1.00 0.00 O ATOM 1447 CB PRO A 92 -3.142 -8.661 12.637 1.00 0.00 C ATOM 1448 CG PRO A 92 -2.464 -7.901 11.551 1.00 0.00 C ATOM 1449 CD PRO A 92 -2.571 -8.756 10.314 1.00 0.00 C ATOM 0 HA PRO A 92 -1.932 -10.501 12.775 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -4.214 -8.467 12.650 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -2.756 -8.384 13.618 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -2.939 -6.932 11.398 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -1.421 -7.708 11.803 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -3.405 -8.447 9.684 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -1.670 -8.692 9.704 1.00 0.00 H new ATOM 1457 N ILE A 93 -4.972 -11.266 12.023 1.00 0.00 N ATOM 1458 CA ILE A 93 -6.082 -12.125 12.413 1.00 0.00 C ATOM 1459 C ILE A 93 -6.488 -13.067 11.278 1.00 0.00 C ATOM 1460 O ILE A 93 -7.659 -13.131 10.900 1.00 0.00 O ATOM 1461 CB ILE A 93 -7.308 -11.296 12.842 1.00 0.00 C ATOM 1462 CG1 ILE A 93 -6.894 -10.209 13.836 1.00 0.00 C ATOM 1463 CG2 ILE A 93 -8.372 -12.197 13.448 1.00 0.00 C ATOM 1464 CD1 ILE A 93 -6.617 -8.870 13.187 1.00 0.00 C ATOM 0 H ILE A 93 -5.054 -10.869 11.087 1.00 0.00 H new ATOM 0 HA ILE A 93 -5.736 -12.718 13.260 1.00 0.00 H new ATOM 0 HB ILE A 93 -7.728 -10.814 11.959 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -7.683 -10.088 14.578 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -6.002 -10.537 14.369 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -9.231 -11.596 13.746 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -8.685 -12.937 12.711 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -7.964 -12.705 14.322 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -6.329 -8.148 13.951 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -5.808 -8.976 12.465 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -7.515 -8.520 12.677 1.00 0.00 H new ATOM 1476 N SER A 94 -5.517 -13.804 10.736 1.00 0.00 N ATOM 1477 CA SER A 94 -5.783 -14.745 9.651 1.00 0.00 C ATOM 1478 C SER A 94 -6.914 -15.704 10.031 1.00 0.00 C ATOM 1479 O SER A 94 -8.046 -15.564 9.570 1.00 0.00 O ATOM 1480 CB SER A 94 -4.523 -15.544 9.314 1.00 0.00 C ATOM 1481 OG SER A 94 -3.432 -15.148 10.127 1.00 0.00 O ATOM 0 H SER A 94 -4.541 -13.766 11.031 1.00 0.00 H new ATOM 0 HA SER A 94 -6.086 -14.172 8.775 1.00 0.00 H new ATOM 0 HB2 SER A 94 -4.716 -16.608 9.453 1.00 0.00 H new ATOM 0 HB3 SER A 94 -4.268 -15.401 8.264 1.00 0.00 H new ATOM 0 HG SER A 94 -2.768 -15.868 10.158 1.00 0.00 H new ATOM 1533 N ILE A 98 -8.968 -12.946 6.132 1.00 0.00 N ATOM 1534 CA ILE A 98 -7.885 -11.973 6.087 1.00 0.00 C ATOM 1535 C ILE A 98 -8.344 -10.616 6.599 1.00 0.00 C ATOM 1536 O ILE A 98 -9.131 -9.927 5.948 1.00 0.00 O ATOM 1537 CB ILE A 98 -7.334 -11.812 4.657 1.00 0.00 C ATOM 1538 CG1 ILE A 98 -6.900 -13.167 4.103 1.00 0.00 C ATOM 1539 CG2 ILE A 98 -6.169 -10.831 4.635 1.00 0.00 C ATOM 1540 CD1 ILE A 98 -6.495 -13.113 2.649 1.00 0.00 C ATOM 0 HA ILE A 98 -7.093 -12.351 6.733 1.00 0.00 H new ATOM 0 HB ILE A 98 -8.127 -11.413 4.025 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -6.064 -13.542 4.693 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -7.717 -13.879 4.220 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -5.795 -10.733 3.616 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -6.506 -9.858 4.994 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -5.371 -11.199 5.280 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -6.198 -14.108 2.317 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -7.337 -12.767 2.049 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -5.658 -12.425 2.530 1.00 0.00 H new ATOM 1552 N ARG A 99 -7.836 -10.229 7.762 1.00 0.00 N ATOM 1553 CA ARG A 99 -8.185 -8.945 8.353 1.00 0.00 C ATOM 1554 C ARG A 99 -6.963 -8.027 8.383 1.00 0.00 C ATOM 1555 O ARG A 99 -6.112 -8.146 9.264 1.00 0.00 O ATOM 1556 CB ARG A 99 -8.728 -9.141 9.770 1.00 0.00 C ATOM 1557 CG ARG A 99 -10.230 -9.384 9.815 1.00 0.00 C ATOM 1558 CD ARG A 99 -10.550 -10.851 10.060 1.00 0.00 C ATOM 1559 NE ARG A 99 -11.956 -11.054 10.399 1.00 0.00 N ATOM 1560 CZ ARG A 99 -12.501 -10.687 11.556 1.00 0.00 C ATOM 1561 NH1 ARG A 99 -11.763 -10.095 12.487 1.00 0.00 N ATOM 1562 NH2 ARG A 99 -13.788 -10.910 11.784 1.00 0.00 N ATOM 0 H ARG A 99 -7.182 -10.785 8.313 1.00 0.00 H new ATOM 0 HA ARG A 99 -8.960 -8.481 7.742 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -8.217 -9.985 10.233 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -8.492 -8.260 10.366 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -10.674 -8.777 10.604 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -10.680 -9.064 8.875 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -10.304 -11.429 9.169 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -9.924 -11.229 10.868 1.00 0.00 H new ATOM 0 HE ARG A 99 -12.556 -11.504 9.708 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -10.773 -9.919 12.317 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -12.186 -9.816 13.372 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -14.361 -11.363 11.072 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -14.205 -10.628 12.671 1.00 0.00 H new ATOM 1576 N PRO A 100 -6.857 -7.103 7.413 1.00 0.00 N ATOM 1577 CA PRO A 100 -5.726 -6.170 7.332 1.00 0.00 C ATOM 1578 C PRO A 100 -5.722 -5.158 8.472 1.00 0.00 C ATOM 1579 O PRO A 100 -4.662 -4.698 8.901 1.00 0.00 O ATOM 1580 CB PRO A 100 -5.941 -5.467 5.989 1.00 0.00 C ATOM 1581 CG PRO A 100 -7.407 -5.568 5.747 1.00 0.00 C ATOM 1582 CD PRO A 100 -7.821 -6.895 6.315 1.00 0.00 C ATOM 0 HA PRO A 100 -4.768 -6.684 7.410 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -5.616 -4.427 6.028 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -5.373 -5.949 5.193 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -7.941 -4.751 6.231 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -7.633 -5.510 4.682 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -8.848 -6.875 6.679 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -7.762 -7.689 5.570 1.00 0.00 H new ATOM 1590 N ALA A 101 -6.910 -4.810 8.959 1.00 0.00 N ATOM 1591 CA ALA A 101 -7.035 -3.845 10.051 1.00 0.00 C ATOM 1592 C ALA A 101 -8.500 -3.611 10.403 1.00 0.00 C ATOM 1593 O ALA A 101 -9.367 -4.406 10.044 1.00 0.00 O ATOM 1594 CB ALA A 101 -6.360 -2.533 9.672 1.00 0.00 C ATOM 0 H ALA A 101 -7.797 -5.179 8.617 1.00 0.00 H new ATOM 0 HA ALA A 101 -6.538 -4.253 10.931 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -6.459 -1.822 10.492 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -5.303 -2.712 9.473 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -6.834 -2.125 8.779 1.00 0.00 H new ATOM 1600 N SER A 102 -8.771 -2.521 11.112 1.00 0.00 N ATOM 1601 CA SER A 102 -10.132 -2.190 11.514 1.00 0.00 C ATOM 1602 C SER A 102 -10.677 -0.991 10.735 1.00 0.00 C ATOM 1603 O SER A 102 -11.842 -0.628 10.890 1.00 0.00 O ATOM 1604 CB SER A 102 -10.187 -1.903 13.018 1.00 0.00 C ATOM 1605 OG SER A 102 -8.892 -1.937 13.593 1.00 0.00 O ATOM 0 H SER A 102 -8.066 -1.852 11.420 1.00 0.00 H new ATOM 0 HA SER A 102 -10.760 -3.051 11.286 1.00 0.00 H new ATOM 0 HB2 SER A 102 -10.638 -0.925 13.188 1.00 0.00 H new ATOM 0 HB3 SER A 102 -10.825 -2.638 13.508 1.00 0.00 H new ATOM 0 HG SER A 102 -8.955 -1.749 14.553 1.00 0.00 H new ATOM 1611 N ALA A 103 -9.839 -0.371 9.904 1.00 0.00 N ATOM 1612 CA ALA A 103 -10.275 0.785 9.126 1.00 0.00 C ATOM 1613 C ALA A 103 -9.208 1.259 8.141 1.00 0.00 C ATOM 1614 O ALA A 103 -8.569 2.290 8.356 1.00 0.00 O ATOM 1615 CB ALA A 103 -10.662 1.921 10.062 1.00 0.00 C ATOM 0 H ALA A 103 -8.868 -0.646 9.754 1.00 0.00 H new ATOM 0 HA ALA A 103 -11.141 0.476 8.540 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.986 2.781 9.476 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -11.475 1.597 10.711 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.802 2.200 10.670 1.00 0.00 H new ATOM 1621 N VAL A 104 -9.026 0.517 7.052 1.00 0.00 N ATOM 1622 CA VAL A 104 -8.037 0.896 6.034 1.00 0.00 C ATOM 1623 C VAL A 104 -8.674 1.061 4.654 1.00 0.00 C ATOM 1624 O VAL A 104 -9.585 0.323 4.285 1.00 0.00 O ATOM 1625 CB VAL A 104 -6.866 -0.110 5.958 1.00 0.00 C ATOM 1626 CG1 VAL A 104 -6.203 -0.243 7.316 1.00 0.00 C ATOM 1627 CG2 VAL A 104 -7.331 -1.469 5.457 1.00 0.00 C ATOM 0 H VAL A 104 -9.540 -0.340 6.848 1.00 0.00 H new ATOM 0 HA VAL A 104 -7.637 1.861 6.346 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.138 0.274 5.243 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -5.380 -0.954 7.251 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -5.820 0.728 7.631 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.932 -0.598 8.044 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -6.482 -2.152 5.416 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -8.085 -1.868 6.135 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -7.759 -1.362 4.460 1.00 0.00 H new ATOM 1637 N ASN A 105 -8.195 2.062 3.911 1.00 0.00 N ATOM 1638 CA ASN A 105 -8.716 2.372 2.576 1.00 0.00 C ATOM 1639 C ASN A 105 -8.115 1.483 1.490 1.00 0.00 C ATOM 1640 O ASN A 105 -6.977 1.031 1.599 1.00 0.00 O ATOM 1641 CB ASN A 105 -8.420 3.834 2.224 1.00 0.00 C ATOM 1642 CG ASN A 105 -8.557 4.763 3.415 1.00 0.00 C ATOM 1643 OD1 ASN A 105 -7.838 5.755 3.528 1.00 0.00 O ATOM 1644 ND2 ASN A 105 -9.486 4.445 4.309 1.00 0.00 N ATOM 0 H ASN A 105 -7.440 2.677 4.215 1.00 0.00 H new ATOM 0 HA ASN A 105 -9.790 2.189 2.611 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -7.409 3.909 1.824 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -9.099 4.158 1.436 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -9.626 5.033 5.130 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -10.060 3.612 4.174 1.00 0.00 H new ATOM 1651 N VAL A 106 -8.878 1.286 0.416 1.00 0.00 N ATOM 1652 CA VAL A 106 -8.418 0.504 -0.723 1.00 0.00 C ATOM 1653 C VAL A 106 -7.589 1.405 -1.626 1.00 0.00 C ATOM 1654 O VAL A 106 -8.114 2.082 -2.511 1.00 0.00 O ATOM 1655 CB VAL A 106 -9.581 -0.112 -1.547 1.00 0.00 C ATOM 1656 CG1 VAL A 106 -9.418 -1.620 -1.646 1.00 0.00 C ATOM 1657 CG2 VAL A 106 -10.943 0.246 -0.963 1.00 0.00 C ATOM 0 H VAL A 106 -9.821 1.660 0.314 1.00 0.00 H new ATOM 0 HA VAL A 106 -7.828 -0.327 -0.335 1.00 0.00 H new ATOM 0 HB VAL A 106 -9.537 0.314 -2.549 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -10.241 -2.038 -2.226 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -8.473 -1.852 -2.137 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -9.423 -2.053 -0.646 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -11.729 -0.205 -1.569 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -11.011 -0.130 0.058 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -11.064 1.329 -0.959 1.00 0.00 H new ATOM 1667 N ILE A 107 -6.296 1.437 -1.357 1.00 0.00 N ATOM 1668 CA ILE A 107 -5.363 2.281 -2.085 1.00 0.00 C ATOM 1669 C ILE A 107 -5.019 1.741 -3.482 1.00 0.00 C ATOM 1670 O ILE A 107 -4.014 2.138 -4.069 1.00 0.00 O ATOM 1671 CB ILE A 107 -4.081 2.475 -1.243 1.00 0.00 C ATOM 1672 CG1 ILE A 107 -3.488 3.872 -1.476 1.00 0.00 C ATOM 1673 CG2 ILE A 107 -3.062 1.375 -1.517 1.00 0.00 C ATOM 1674 CD1 ILE A 107 -2.507 3.952 -2.621 1.00 0.00 C ATOM 0 H ILE A 107 -5.861 0.876 -0.624 1.00 0.00 H new ATOM 0 HA ILE A 107 -5.853 3.241 -2.247 1.00 0.00 H new ATOM 0 HB ILE A 107 -4.352 2.400 -0.190 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -4.302 4.572 -1.662 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -2.989 4.198 -0.563 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -2.173 1.543 -0.909 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -3.496 0.407 -1.267 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.787 1.388 -2.572 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -2.138 4.974 -2.714 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -1.670 3.280 -2.431 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -3.003 3.660 -3.546 1.00 0.00 H new ATOM 1686 N GLY A 108 -5.857 0.856 -4.026 1.00 0.00 N ATOM 1687 CA GLY A 108 -5.596 0.326 -5.356 1.00 0.00 C ATOM 1688 C GLY A 108 -5.275 -1.157 -5.366 1.00 0.00 C ATOM 1689 O GLY A 108 -5.770 -1.913 -4.528 1.00 0.00 O ATOM 0 H GLY A 108 -6.701 0.501 -3.576 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -6.467 0.505 -5.987 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -4.763 0.873 -5.799 1.00 0.00 H new ATOM 1693 N ARG A 109 -4.449 -1.575 -6.327 1.00 0.00 N ATOM 1694 CA ARG A 109 -4.071 -2.980 -6.452 1.00 0.00 C ATOM 1695 C ARG A 109 -2.687 -3.133 -7.081 1.00 0.00 C ATOM 1696 O ARG A 109 -2.155 -2.197 -7.679 1.00 0.00 O ATOM 1697 CB ARG A 109 -5.100 -3.740 -7.299 1.00 0.00 C ATOM 1698 CG ARG A 109 -6.548 -3.504 -6.889 1.00 0.00 C ATOM 1699 CD ARG A 109 -7.514 -4.142 -7.876 1.00 0.00 C ATOM 1700 NE ARG A 109 -8.657 -3.275 -8.159 1.00 0.00 N ATOM 1701 CZ ARG A 109 -9.775 -3.691 -8.751 1.00 0.00 C ATOM 1702 NH1 ARG A 109 -9.905 -4.958 -9.123 1.00 0.00 N ATOM 1703 NH2 ARG A 109 -10.765 -2.838 -8.971 1.00 0.00 N ATOM 0 H ARG A 109 -4.031 -0.962 -7.027 1.00 0.00 H new ATOM 0 HA ARG A 109 -4.044 -3.400 -5.446 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -4.979 -3.451 -8.343 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -4.887 -4.807 -7.237 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -6.718 -3.915 -5.894 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -6.741 -2.433 -6.829 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -6.989 -4.365 -8.805 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -7.869 -5.091 -7.474 1.00 0.00 H new ATOM 0 HE ARG A 109 -8.594 -2.294 -7.887 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -9.146 -5.619 -8.956 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -10.764 -5.271 -9.576 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -10.671 -1.863 -8.687 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -11.621 -3.157 -9.424 1.00 0.00 H new ATOM 1717 N ILE A 110 -2.116 -4.328 -6.942 1.00 0.00 N ATOM 1718 CA ILE A 110 -0.797 -4.630 -7.493 1.00 0.00 C ATOM 1719 C ILE A 110 -0.925 -5.262 -8.879 1.00 0.00 C ATOM 1720 O ILE A 110 -1.468 -6.357 -9.021 1.00 0.00 O ATOM 1721 CB ILE A 110 -0.016 -5.594 -6.571 1.00 0.00 C ATOM 1722 CG1 ILE A 110 0.129 -4.992 -5.167 1.00 0.00 C ATOM 1723 CG2 ILE A 110 1.354 -5.912 -7.156 1.00 0.00 C ATOM 1724 CD1 ILE A 110 -0.596 -5.768 -4.085 1.00 0.00 C ATOM 0 H ILE A 110 -2.550 -5.108 -6.449 1.00 0.00 H new ATOM 0 HA ILE A 110 -0.252 -3.689 -7.569 1.00 0.00 H new ATOM 0 HB ILE A 110 -0.579 -6.524 -6.495 1.00 0.00 H new ATOM 0 HG12 ILE A 110 1.188 -4.938 -4.914 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -0.248 -3.969 -5.181 1.00 0.00 H new ATOM 0 HG21 ILE A 110 1.885 -6.592 -6.490 1.00 0.00 H new ATOM 0 HG22 ILE A 110 1.233 -6.381 -8.132 1.00 0.00 H new ATOM 0 HG23 ILE A 110 1.926 -4.990 -7.265 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -0.445 -5.279 -3.123 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -1.662 -5.800 -4.312 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -0.204 -6.784 -4.041 1.00 0.00 H new ATOM 1736 N VAL A 111 -0.423 -4.568 -9.897 1.00 0.00 N ATOM 1737 CA VAL A 111 -0.488 -5.077 -11.269 1.00 0.00 C ATOM 1738 C VAL A 111 0.205 -6.432 -11.379 1.00 0.00 C ATOM 1739 O VAL A 111 -0.450 -7.474 -11.397 1.00 0.00 O ATOM 1740 CB VAL A 111 0.135 -4.108 -12.313 1.00 0.00 C ATOM 1741 CG1 VAL A 111 -0.935 -3.558 -13.247 1.00 0.00 C ATOM 1742 CG2 VAL A 111 0.897 -2.968 -11.646 1.00 0.00 C ATOM 0 H VAL A 111 0.030 -3.659 -9.802 1.00 0.00 H new ATOM 0 HA VAL A 111 -1.549 -5.175 -11.497 1.00 0.00 H new ATOM 0 HB VAL A 111 0.850 -4.683 -12.901 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -0.476 -2.883 -13.969 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.415 -4.382 -13.775 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.681 -3.016 -12.666 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.316 -2.314 -12.411 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.217 -2.397 -11.013 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.703 -3.377 -11.036 1.00 0.00 H new ATOM 1816 N LEU A 117 5.519 -9.404 -2.718 1.00 0.00 N ATOM 1817 CA LEU A 117 6.416 -8.760 -1.758 1.00 0.00 C ATOM 1818 C LEU A 117 6.495 -9.555 -0.455 1.00 0.00 C ATOM 1819 O LEU A 117 7.525 -9.558 0.218 1.00 0.00 O ATOM 1820 CB LEU A 117 5.948 -7.328 -1.469 1.00 0.00 C ATOM 1821 CG LEU A 117 6.647 -6.642 -0.283 1.00 0.00 C ATOM 1822 CD1 LEU A 117 7.755 -5.711 -0.758 1.00 0.00 C ATOM 1823 CD2 LEU A 117 5.642 -5.885 0.573 1.00 0.00 C ATOM 0 HA LEU A 117 7.412 -8.729 -2.200 1.00 0.00 H new ATOM 0 HB2 LEU A 117 6.104 -6.724 -2.362 1.00 0.00 H new ATOM 0 HB3 LEU A 117 4.875 -7.344 -1.279 1.00 0.00 H new ATOM 0 HG LEU A 117 7.102 -7.421 0.329 1.00 0.00 H new ATOM 0 HD11 LEU A 117 8.230 -5.241 0.103 1.00 0.00 H new ATOM 0 HD12 LEU A 117 8.497 -6.283 -1.314 1.00 0.00 H new ATOM 0 HD13 LEU A 117 7.332 -4.941 -1.403 1.00 0.00 H new ATOM 0 HD21 LEU A 117 6.159 -5.408 1.406 1.00 0.00 H new ATOM 0 HD22 LEU A 117 5.149 -5.124 -0.032 1.00 0.00 H new ATOM 0 HD23 LEU A 117 4.897 -6.580 0.959 1.00 0.00 H new ATOM 1835 N LYS A 118 5.396 -10.216 -0.103 1.00 0.00 N ATOM 1836 CA LYS A 118 5.326 -11.009 1.129 1.00 0.00 C ATOM 1837 C LYS A 118 6.591 -11.849 1.382 1.00 0.00 C ATOM 1838 O LYS A 118 6.829 -12.276 2.511 1.00 0.00 O ATOM 1839 CB LYS A 118 4.095 -11.927 1.114 1.00 0.00 C ATOM 1840 CG LYS A 118 3.893 -12.691 -0.190 1.00 0.00 C ATOM 1841 CD LYS A 118 4.189 -14.174 -0.023 1.00 0.00 C ATOM 1842 CE LYS A 118 5.588 -14.525 -0.498 1.00 0.00 C ATOM 1843 NZ LYS A 118 5.868 -13.989 -1.857 1.00 0.00 N ATOM 0 H LYS A 118 4.537 -10.220 -0.653 1.00 0.00 H new ATOM 0 HA LYS A 118 5.245 -10.291 1.945 1.00 0.00 H new ATOM 0 HB2 LYS A 118 4.182 -12.644 1.931 1.00 0.00 H new ATOM 0 HB3 LYS A 118 3.207 -11.326 1.310 1.00 0.00 H new ATOM 0 HG2 LYS A 118 2.867 -12.561 -0.533 1.00 0.00 H new ATOM 0 HG3 LYS A 118 4.542 -12.275 -0.960 1.00 0.00 H new ATOM 0 HD2 LYS A 118 4.081 -14.451 1.026 1.00 0.00 H new ATOM 0 HD3 LYS A 118 3.458 -14.756 -0.583 1.00 0.00 H new ATOM 0 HE2 LYS A 118 6.320 -14.128 0.206 1.00 0.00 H new ATOM 0 HE3 LYS A 118 5.707 -15.608 -0.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 6.402 -14.693 -2.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 4.971 -13.783 -2.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 6.427 -13.116 -1.777 1.00 0.00 H new ATOM 1857 N GLY A 119 7.398 -12.094 0.346 1.00 0.00 N ATOM 1858 CA GLY A 119 8.605 -12.886 0.523 1.00 0.00 C ATOM 1859 C GLY A 119 9.828 -12.043 0.846 1.00 0.00 C ATOM 1860 O GLY A 119 10.955 -12.436 0.541 1.00 0.00 O ATOM 0 H GLY A 119 7.237 -11.760 -0.604 1.00 0.00 H new ATOM 0 HA2 GLY A 119 8.445 -13.607 1.325 1.00 0.00 H new ATOM 0 HA3 GLY A 119 8.794 -13.457 -0.386 1.00 0.00 H new ATOM 1864 N VAL A 120 9.611 -10.884 1.462 1.00 0.00 N ATOM 1865 CA VAL A 120 10.711 -9.991 1.824 1.00 0.00 C ATOM 1866 C VAL A 120 11.380 -10.425 3.130 1.00 0.00 C ATOM 1867 O VAL A 120 10.750 -11.058 3.977 1.00 0.00 O ATOM 1868 CB VAL A 120 10.236 -8.530 1.980 1.00 0.00 C ATOM 1869 CG1 VAL A 120 9.980 -7.897 0.622 1.00 0.00 C ATOM 1870 CG2 VAL A 120 9.000 -8.449 2.868 1.00 0.00 C ATOM 0 H VAL A 120 8.686 -10.541 1.721 1.00 0.00 H new ATOM 0 HA VAL A 120 11.430 -10.051 1.007 1.00 0.00 H new ATOM 0 HB VAL A 120 11.031 -7.966 2.467 1.00 0.00 H new ATOM 0 HG11 VAL A 120 9.646 -6.868 0.757 1.00 0.00 H new ATOM 0 HG12 VAL A 120 10.900 -7.906 0.037 1.00 0.00 H new ATOM 0 HG13 VAL A 120 9.210 -8.462 0.097 1.00 0.00 H new ATOM 0 HG21 VAL A 120 8.686 -7.409 2.961 1.00 0.00 H new ATOM 0 HG22 VAL A 120 8.194 -9.033 2.424 1.00 0.00 H new ATOM 0 HG23 VAL A 120 9.235 -8.847 3.855 1.00 0.00 H new ATOM 1880 N ALA A 121 12.656 -10.071 3.294 1.00 0.00 N ATOM 1881 CA ALA A 121 13.394 -10.414 4.509 1.00 0.00 C ATOM 1882 C ALA A 121 13.000 -9.476 5.646 1.00 0.00 C ATOM 1883 O ALA A 121 12.656 -8.320 5.412 1.00 0.00 O ATOM 1884 CB ALA A 121 14.897 -10.348 4.254 1.00 0.00 C ATOM 0 H ALA A 121 13.197 -9.550 2.604 1.00 0.00 H new ATOM 0 HA ALA A 121 13.140 -11.434 4.798 1.00 0.00 H new ATOM 0 HB1 ALA A 121 15.433 -10.606 5.168 1.00 0.00 H new ATOM 0 HB2 ALA A 121 15.164 -11.052 3.466 1.00 0.00 H new ATOM 0 HB3 ALA A 121 15.170 -9.339 3.946 1.00 0.00 H new ATOM 1890 N ASP A 122 13.032 -9.972 6.878 1.00 0.00 N ATOM 1891 CA ASP A 122 12.654 -9.157 8.029 1.00 0.00 C ATOM 1892 C ASP A 122 13.435 -7.845 8.084 1.00 0.00 C ATOM 1893 O ASP A 122 14.608 -7.818 8.456 1.00 0.00 O ATOM 1894 CB ASP A 122 12.842 -9.929 9.332 1.00 0.00 C ATOM 1895 CG ASP A 122 14.296 -10.259 9.612 1.00 0.00 C ATOM 1896 OD1 ASP A 122 14.845 -11.150 8.928 1.00 0.00 O ATOM 1897 OD2 ASP A 122 14.885 -9.628 10.513 1.00 0.00 O ATOM 0 H ASP A 122 13.313 -10.926 7.105 1.00 0.00 H new ATOM 0 HA ASP A 122 11.598 -8.914 7.909 1.00 0.00 H new ATOM 0 HB2 ASP A 122 12.441 -9.342 10.158 1.00 0.00 H new ATOM 0 HB3 ASP A 122 12.266 -10.853 9.288 1.00 0.00 H new ATOM 1902 N GLY A 123 12.760 -6.755 7.734 1.00 0.00 N ATOM 1903 CA GLY A 123 13.380 -5.442 7.770 1.00 0.00 C ATOM 1904 C GLY A 123 14.337 -5.178 6.617 1.00 0.00 C ATOM 1905 O GLY A 123 15.425 -5.752 6.562 1.00 0.00 O ATOM 0 H GLY A 123 11.788 -6.758 7.424 1.00 0.00 H new ATOM 0 HA2 GLY A 123 12.599 -4.682 7.761 1.00 0.00 H new ATOM 0 HA3 GLY A 123 13.921 -5.332 8.710 1.00 0.00 H new ATOM 1909 N GLU A 124 13.941 -4.287 5.707 1.00 0.00 N ATOM 1910 CA GLU A 124 14.782 -3.926 4.567 1.00 0.00 C ATOM 1911 C GLU A 124 14.412 -2.543 4.037 1.00 0.00 C ATOM 1912 O GLU A 124 13.235 -2.199 3.952 1.00 0.00 O ATOM 1913 CB GLU A 124 14.672 -4.971 3.446 1.00 0.00 C ATOM 1914 CG GLU A 124 13.253 -5.221 2.950 1.00 0.00 C ATOM 1915 CD GLU A 124 12.697 -6.543 3.428 1.00 0.00 C ATOM 1916 OE1 GLU A 124 13.333 -7.584 3.161 1.00 0.00 O ATOM 1917 OE2 GLU A 124 11.626 -6.539 4.070 1.00 0.00 O ATOM 0 H GLU A 124 13.044 -3.803 5.738 1.00 0.00 H new ATOM 0 HA GLU A 124 15.816 -3.901 4.912 1.00 0.00 H new ATOM 0 HB2 GLU A 124 15.285 -4.648 2.605 1.00 0.00 H new ATOM 0 HB3 GLU A 124 15.090 -5.913 3.802 1.00 0.00 H new ATOM 0 HG2 GLU A 124 12.605 -4.414 3.291 1.00 0.00 H new ATOM 0 HG3 GLU A 124 13.243 -5.199 1.860 1.00 0.00 H new ATOM 1924 N SER A 125 15.429 -1.746 3.689 1.00 0.00 N ATOM 1925 CA SER A 125 15.210 -0.389 3.171 1.00 0.00 C ATOM 1926 C SER A 125 14.015 -0.328 2.218 1.00 0.00 C ATOM 1927 O SER A 125 13.669 -1.316 1.570 1.00 0.00 O ATOM 1928 CB SER A 125 16.466 0.110 2.456 1.00 0.00 C ATOM 1929 OG SER A 125 17.615 -0.598 2.889 1.00 0.00 O ATOM 0 H SER A 125 16.410 -2.016 3.756 1.00 0.00 H new ATOM 0 HA SER A 125 14.991 0.255 4.023 1.00 0.00 H new ATOM 0 HB2 SER A 125 16.346 -0.008 1.379 1.00 0.00 H new ATOM 0 HB3 SER A 125 16.598 1.175 2.647 1.00 0.00 H new ATOM 0 HG SER A 125 17.671 -0.563 3.867 1.00 0.00 H new ATOM 1935 N VAL A 126 13.395 0.846 2.145 1.00 0.00 N ATOM 1936 CA VAL A 126 12.236 1.063 1.280 1.00 0.00 C ATOM 1937 C VAL A 126 12.247 2.478 0.700 1.00 0.00 C ATOM 1938 O VAL A 126 12.367 3.455 1.437 1.00 0.00 O ATOM 1939 CB VAL A 126 10.906 0.844 2.043 1.00 0.00 C ATOM 1940 CG1 VAL A 126 9.708 1.039 1.127 1.00 0.00 C ATOM 1941 CG2 VAL A 126 10.868 -0.533 2.680 1.00 0.00 C ATOM 0 H VAL A 126 13.677 1.668 2.678 1.00 0.00 H new ATOM 0 HA VAL A 126 12.304 0.335 0.472 1.00 0.00 H new ATOM 0 HB VAL A 126 10.852 1.591 2.835 1.00 0.00 H new ATOM 0 HG11 VAL A 126 8.789 0.879 1.691 1.00 0.00 H new ATOM 0 HG12 VAL A 126 9.717 2.053 0.728 1.00 0.00 H new ATOM 0 HG13 VAL A 126 9.759 0.325 0.305 1.00 0.00 H new ATOM 0 HG21 VAL A 126 9.924 -0.663 3.210 1.00 0.00 H new ATOM 0 HG22 VAL A 126 10.957 -1.295 1.905 1.00 0.00 H new ATOM 0 HG23 VAL A 126 11.695 -0.632 3.383 1.00 0.00 H new ATOM 1951 N VAL A 127 12.116 2.585 -0.621 1.00 0.00 N ATOM 1952 CA VAL A 127 12.107 3.888 -1.280 1.00 0.00 C ATOM 1953 C VAL A 127 10.849 4.064 -2.126 1.00 0.00 C ATOM 1954 O VAL A 127 10.708 3.450 -3.184 1.00 0.00 O ATOM 1955 CB VAL A 127 13.351 4.092 -2.171 1.00 0.00 C ATOM 1956 CG1 VAL A 127 14.615 4.158 -1.323 1.00 0.00 C ATOM 1957 CG2 VAL A 127 13.452 2.989 -3.214 1.00 0.00 C ATOM 0 H VAL A 127 12.015 1.790 -1.252 1.00 0.00 H new ATOM 0 HA VAL A 127 12.121 4.638 -0.489 1.00 0.00 H new ATOM 0 HB VAL A 127 13.246 5.042 -2.694 1.00 0.00 H new ATOM 0 HG11 VAL A 127 15.480 4.302 -1.970 1.00 0.00 H new ATOM 0 HG12 VAL A 127 14.541 4.992 -0.625 1.00 0.00 H new ATOM 0 HG13 VAL A 127 14.729 3.228 -0.767 1.00 0.00 H new ATOM 0 HG21 VAL A 127 14.335 3.152 -3.831 1.00 0.00 H new ATOM 0 HG22 VAL A 127 13.531 2.023 -2.715 1.00 0.00 H new ATOM 0 HG23 VAL A 127 12.562 3.001 -3.844 1.00 0.00 H new ATOM 1967 N VAL A 128 9.935 4.903 -1.647 1.00 0.00 N ATOM 1968 CA VAL A 128 8.681 5.164 -2.349 1.00 0.00 C ATOM 1969 C VAL A 128 8.883 6.220 -3.441 1.00 0.00 C ATOM 1970 O VAL A 128 9.422 7.294 -3.173 1.00 0.00 O ATOM 1971 CB VAL A 128 7.574 5.660 -1.385 1.00 0.00 C ATOM 1972 CG1 VAL A 128 6.215 5.080 -1.757 1.00 0.00 C ATOM 1973 CG2 VAL A 128 7.905 5.325 0.065 1.00 0.00 C ATOM 0 H VAL A 128 10.040 5.416 -0.772 1.00 0.00 H new ATOM 0 HA VAL A 128 8.367 4.219 -2.793 1.00 0.00 H new ATOM 0 HB VAL A 128 7.527 6.744 -1.485 1.00 0.00 H new ATOM 0 HG11 VAL A 128 5.460 5.447 -1.062 1.00 0.00 H new ATOM 0 HG12 VAL A 128 5.954 5.385 -2.770 1.00 0.00 H new ATOM 0 HG13 VAL A 128 6.257 3.992 -1.705 1.00 0.00 H new ATOM 0 HG21 VAL A 128 7.107 5.687 0.713 1.00 0.00 H new ATOM 0 HG22 VAL A 128 8.001 4.245 0.176 1.00 0.00 H new ATOM 0 HG23 VAL A 128 8.844 5.803 0.344 1.00 0.00 H new ATOM 1983 N GLU A 129 8.455 5.922 -4.668 1.00 0.00 N ATOM 1984 CA GLU A 129 8.604 6.859 -5.777 1.00 0.00 C ATOM 1985 C GLU A 129 7.516 6.646 -6.832 1.00 0.00 C ATOM 1986 O GLU A 129 7.283 5.523 -7.274 1.00 0.00 O ATOM 1987 CB GLU A 129 9.984 6.697 -6.418 1.00 0.00 C ATOM 1988 CG GLU A 129 10.350 5.253 -6.719 1.00 0.00 C ATOM 1989 CD GLU A 129 11.809 5.087 -7.093 1.00 0.00 C ATOM 1990 OE1 GLU A 129 12.672 5.255 -6.206 1.00 0.00 O ATOM 1991 OE2 GLU A 129 12.089 4.788 -8.274 1.00 0.00 O ATOM 0 H GLU A 129 8.004 5.042 -4.917 1.00 0.00 H new ATOM 0 HA GLU A 129 8.503 7.869 -5.380 1.00 0.00 H new ATOM 0 HB2 GLU A 129 10.015 7.271 -7.344 1.00 0.00 H new ATOM 0 HB3 GLU A 129 10.736 7.123 -5.754 1.00 0.00 H new ATOM 0 HG2 GLU A 129 10.130 4.637 -5.847 1.00 0.00 H new ATOM 0 HG3 GLU A 129 9.726 4.886 -7.534 1.00 0.00 H new ATOM 1998 N ARG A 130 6.855 7.732 -7.233 1.00 0.00 N ATOM 1999 CA ARG A 130 5.800 7.660 -8.239 1.00 0.00 C ATOM 2000 C ARG A 130 6.389 7.464 -9.632 1.00 0.00 C ATOM 2001 O ARG A 130 6.742 8.430 -10.307 1.00 0.00 O ATOM 2002 CB ARG A 130 4.953 8.934 -8.204 1.00 0.00 C ATOM 2003 CG ARG A 130 3.815 8.945 -9.213 1.00 0.00 C ATOM 2004 CD ARG A 130 4.212 9.649 -10.502 1.00 0.00 C ATOM 2005 NE ARG A 130 4.153 8.754 -11.655 1.00 0.00 N ATOM 2006 CZ ARG A 130 4.312 9.155 -12.915 1.00 0.00 C ATOM 2007 NH1 ARG A 130 4.547 10.432 -13.187 1.00 0.00 N ATOM 2008 NH2 ARG A 130 4.239 8.276 -13.905 1.00 0.00 N ATOM 0 H ARG A 130 7.033 8.671 -6.876 1.00 0.00 H new ATOM 0 HA ARG A 130 5.168 6.802 -8.010 1.00 0.00 H new ATOM 0 HB2 ARG A 130 4.539 9.056 -7.203 1.00 0.00 H new ATOM 0 HB3 ARG A 130 5.598 9.793 -8.389 1.00 0.00 H new ATOM 0 HG2 ARG A 130 3.516 7.921 -9.435 1.00 0.00 H new ATOM 0 HG3 ARG A 130 2.948 9.443 -8.778 1.00 0.00 H new ATOM 0 HD2 ARG A 130 3.551 10.499 -10.669 1.00 0.00 H new ATOM 0 HD3 ARG A 130 5.222 10.045 -10.402 1.00 0.00 H new ATOM 0 HE ARG A 130 3.980 7.763 -11.485 1.00 0.00 H new ATOM 0 HH11 ARG A 130 4.607 11.112 -12.429 1.00 0.00 H new ATOM 0 HH12 ARG A 130 4.668 10.734 -14.154 1.00 0.00 H new ATOM 0 HH21 ARG A 130 4.061 7.292 -13.702 1.00 0.00 H new ATOM 0 HH22 ARG A 130 4.361 8.583 -14.870 1.00 0.00 H new ATOM 2022 N ALA A 131 6.487 6.206 -10.055 1.00 0.00 N ATOM 2023 CA ALA A 131 7.029 5.866 -11.371 1.00 0.00 C ATOM 2024 C ALA A 131 8.236 6.730 -11.732 1.00 0.00 C ATOM 2025 O ALA A 131 9.365 6.351 -11.357 1.00 0.00 O ATOM 2026 CB ALA A 131 5.946 6.001 -12.426 1.00 0.00 C ATOM 2027 OXT ALA A 131 8.040 7.777 -12.384 1.00 0.00 O ATOM 0 H ALA A 131 6.196 5.399 -9.502 1.00 0.00 H new ATOM 0 HA ALA A 131 7.372 4.832 -11.334 1.00 0.00 H new ATOM 0 HB1 ALA A 131 6.356 5.746 -13.403 1.00 0.00 H new ATOM 0 HB2 ALA A 131 5.123 5.326 -12.191 1.00 0.00 H new ATOM 0 HB3 ALA A 131 5.580 7.028 -12.442 1.00 0.00 H new