USER MOD reduce.3.24.130724 H: found=0, std=0, add=800, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 801 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 5 GLN : amide:sc= -0.209 K(o=-0.21,f=-1.6!) USER MOD Single : A 10 ASN : amide:sc= -0.077 K(o=-0.077,f=-1.6!) USER MOD Single : A 11 THR OG1 : rot -176:sc= -4.83! USER MOD Single : A 14 HIS : no HD1:sc= -5.61! C(o=-5.6!,f=-8.1!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot -130:sc= -1.92! USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN : amide:sc= -1.08 K(o=-1.1,f=-1.6) USER MOD Single : A 58 THR OG1 : rot -63:sc= 1.16 USER MOD Single : A 62 GLN : amide:sc= -0.256 X(o=-0.26,f=-0.015) USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 64 GLN : amide:sc= -10.2! C(o=-10!,f=-20!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 CYS SG : rot 72:sc= -0.898! USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot -143:sc= -4.97! USER MOD Single : A 92 THR OG1 : rot -87:sc= -3.15! USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 55 N GLN A 5 3.840 31.491 -9.118 1.00 0.00 N ATOM 56 CA GLN A 5 2.539 31.551 -9.845 1.00 0.00 C ATOM 57 C GLN A 5 1.521 32.351 -9.027 1.00 0.00 C ATOM 58 O GLN A 5 1.842 32.914 -7.999 1.00 0.00 O ATOM 59 CB GLN A 5 2.091 30.094 -9.978 1.00 0.00 C ATOM 60 CG GLN A 5 1.520 29.856 -11.378 1.00 0.00 C ATOM 61 CD GLN A 5 1.773 28.403 -11.793 1.00 0.00 C ATOM 62 OE1 GLN A 5 2.795 27.837 -11.458 1.00 0.00 O ATOM 63 NE2 GLN A 5 0.885 27.770 -12.514 1.00 0.00 N ATOM 0 HA GLN A 5 2.628 32.039 -10.816 1.00 0.00 H new ATOM 0 HB2 GLN A 5 2.934 29.426 -9.800 1.00 0.00 H new ATOM 0 HB3 GLN A 5 1.338 29.865 -9.224 1.00 0.00 H new ATOM 0 HG2 GLN A 5 0.451 30.067 -11.387 1.00 0.00 H new ATOM 0 HG3 GLN A 5 1.985 30.536 -12.092 1.00 0.00 H new ATOM 0 HE21 GLN A 5 0.026 28.243 -12.796 1.00 0.00 H new ATOM 0 HE22 GLN A 5 1.051 26.803 -12.794 1.00 0.00 H new ATOM 72 N VAL A 6 0.294 32.399 -9.470 1.00 0.00 N ATOM 73 CA VAL A 6 -0.745 33.154 -8.711 1.00 0.00 C ATOM 74 C VAL A 6 -1.966 32.261 -8.478 1.00 0.00 C ATOM 75 O VAL A 6 -2.282 31.410 -9.286 1.00 0.00 O ATOM 76 CB VAL A 6 -1.111 34.342 -9.602 1.00 0.00 C ATOM 77 CG1 VAL A 6 -2.321 35.068 -9.012 1.00 0.00 C ATOM 78 CG2 VAL A 6 0.073 35.308 -9.677 1.00 0.00 C ATOM 0 H VAL A 6 -0.034 31.948 -10.324 1.00 0.00 H new ATOM 0 HA VAL A 6 -0.390 33.480 -7.733 1.00 0.00 H new ATOM 0 HB VAL A 6 -1.353 33.984 -10.603 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -2.582 35.915 -9.647 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -3.166 34.382 -8.957 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -2.078 35.426 -8.011 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -0.188 36.155 -10.312 1.00 0.00 H new ATOM 0 HG22 VAL A 6 0.315 35.666 -8.676 1.00 0.00 H new ATOM 0 HG23 VAL A 6 0.937 34.793 -10.096 1.00 0.00 H new ATOM 88 N VAL A 7 -2.651 32.435 -7.379 1.00 0.00 N ATOM 89 CA VAL A 7 -3.844 31.578 -7.109 1.00 0.00 C ATOM 90 C VAL A 7 -4.684 31.432 -8.378 1.00 0.00 C ATOM 91 O VAL A 7 -5.156 32.402 -8.939 1.00 0.00 O ATOM 92 CB VAL A 7 -4.642 32.293 -6.017 1.00 0.00 C ATOM 93 CG1 VAL A 7 -5.705 31.338 -5.468 1.00 0.00 C ATOM 94 CG2 VAL A 7 -3.705 32.712 -4.881 1.00 0.00 C ATOM 0 H VAL A 7 -2.439 33.128 -6.661 1.00 0.00 H new ATOM 0 HA VAL A 7 -3.555 30.575 -6.794 1.00 0.00 H new ATOM 0 HB VAL A 7 -5.118 33.179 -6.436 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -6.278 31.841 -4.689 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -6.374 31.037 -6.274 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -5.220 30.456 -5.050 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -4.278 33.221 -4.106 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -3.228 31.828 -4.458 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.941 33.386 -5.269 1.00 0.00 H new ATOM 104 N LEU A 8 -4.870 30.226 -8.834 1.00 0.00 N ATOM 105 CA LEU A 8 -5.673 30.009 -10.068 1.00 0.00 C ATOM 106 C LEU A 8 -7.165 30.147 -9.763 1.00 0.00 C ATOM 107 O LEU A 8 -7.574 30.115 -8.619 1.00 0.00 O ATOM 108 CB LEU A 8 -5.358 28.575 -10.492 1.00 0.00 C ATOM 109 CG LEU A 8 -4.112 28.543 -11.385 1.00 0.00 C ATOM 110 CD1 LEU A 8 -3.056 29.511 -10.848 1.00 0.00 C ATOM 111 CD2 LEU A 8 -3.538 27.123 -11.392 1.00 0.00 C ATOM 0 H LEU A 8 -4.499 29.379 -8.404 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.435 30.735 -10.845 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -5.197 27.955 -9.610 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.208 28.152 -11.028 1.00 0.00 H new ATOM 0 HG LEU A 8 -4.387 28.841 -12.397 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -2.175 29.481 -11.489 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -3.462 30.523 -10.837 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -2.778 29.220 -9.835 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.651 27.092 -12.025 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.269 26.834 -10.376 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -4.285 26.430 -11.780 1.00 0.00 H new ATOM 123 N PRO A 9 -7.929 30.283 -10.808 1.00 0.00 N ATOM 124 CA PRO A 9 -9.396 30.413 -10.666 1.00 0.00 C ATOM 125 C PRO A 9 -10.012 29.048 -10.344 1.00 0.00 C ATOM 126 O PRO A 9 -10.687 28.454 -11.160 1.00 0.00 O ATOM 127 CB PRO A 9 -9.846 30.903 -12.039 1.00 0.00 C ATOM 128 CG PRO A 9 -8.784 30.441 -12.988 1.00 0.00 C ATOM 129 CD PRO A 9 -7.498 30.330 -12.207 1.00 0.00 C ATOM 0 HA PRO A 9 -9.697 31.086 -9.863 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -10.819 30.490 -12.305 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -9.945 31.988 -12.057 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -9.052 29.479 -13.425 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -8.673 31.146 -13.812 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -6.941 29.434 -12.482 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -6.844 31.182 -12.394 1.00 0.00 H new ATOM 137 N ASN A 10 -9.778 28.547 -9.161 1.00 0.00 N ATOM 138 CA ASN A 10 -10.347 27.219 -8.788 1.00 0.00 C ATOM 139 C ASN A 10 -9.868 26.139 -9.765 1.00 0.00 C ATOM 140 O ASN A 10 -10.660 25.447 -10.373 1.00 0.00 O ATOM 141 CB ASN A 10 -11.864 27.399 -8.889 1.00 0.00 C ATOM 142 CG ASN A 10 -12.419 27.874 -7.544 1.00 0.00 C ATOM 143 OD1 ASN A 10 -11.671 28.234 -6.658 1.00 0.00 O ATOM 144 ND2 ASN A 10 -13.710 27.891 -7.357 1.00 0.00 N ATOM 0 H ASN A 10 -9.218 28.999 -8.438 1.00 0.00 H new ATOM 0 HA ASN A 10 -10.037 26.902 -7.792 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -12.103 28.123 -9.668 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -12.333 26.458 -9.175 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -14.092 28.207 -6.466 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -14.337 27.588 -8.102 1.00 0.00 H new ATOM 151 N THR A 11 -8.579 25.987 -9.923 1.00 0.00 N ATOM 152 CA THR A 11 -8.062 24.948 -10.864 1.00 0.00 C ATOM 153 C THR A 11 -6.892 24.195 -10.229 1.00 0.00 C ATOM 154 O THR A 11 -6.404 24.561 -9.178 1.00 0.00 O ATOM 155 CB THR A 11 -7.590 25.717 -12.101 1.00 0.00 C ATOM 156 OG1 THR A 11 -6.309 26.274 -11.847 1.00 0.00 O ATOM 157 CG2 THR A 11 -8.582 26.835 -12.431 1.00 0.00 C ATOM 0 H THR A 11 -7.864 26.534 -9.444 1.00 0.00 H new ATOM 0 HA THR A 11 -8.824 24.209 -11.112 1.00 0.00 H new ATOM 0 HB THR A 11 -7.531 25.035 -12.949 1.00 0.00 H new ATOM 0 HG1 THR A 11 -6.031 26.818 -12.613 1.00 0.00 H new ATOM 0 HG21 THR A 11 -8.239 27.377 -13.312 1.00 0.00 H new ATOM 0 HG22 THR A 11 -9.563 26.404 -12.629 1.00 0.00 H new ATOM 0 HG23 THR A 11 -8.651 27.521 -11.587 1.00 0.00 H new ATOM 165 N ALA A 12 -6.439 23.142 -10.855 1.00 0.00 N ATOM 166 CA ALA A 12 -5.302 22.369 -10.276 1.00 0.00 C ATOM 167 C ALA A 12 -4.408 21.813 -11.382 1.00 0.00 C ATOM 168 O ALA A 12 -4.826 21.646 -12.510 1.00 0.00 O ATOM 169 CB ALA A 12 -5.952 21.220 -9.503 1.00 0.00 C ATOM 0 H ALA A 12 -6.805 22.785 -11.738 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.673 22.993 -9.641 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -5.177 20.604 -9.047 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -6.599 21.625 -8.725 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -6.544 20.611 -10.186 1.00 0.00 H new ATOM 175 N LEU A 13 -3.184 21.510 -11.061 1.00 0.00 N ATOM 176 CA LEU A 13 -2.264 20.945 -12.085 1.00 0.00 C ATOM 177 C LEU A 13 -1.589 19.690 -11.521 1.00 0.00 C ATOM 178 O LEU A 13 -1.463 19.530 -10.323 1.00 0.00 O ATOM 179 CB LEU A 13 -1.253 22.068 -12.390 1.00 0.00 C ATOM 180 CG LEU A 13 0.017 21.914 -11.544 1.00 0.00 C ATOM 181 CD1 LEU A 13 1.091 22.876 -12.054 1.00 0.00 C ATOM 182 CD2 LEU A 13 -0.297 22.234 -10.083 1.00 0.00 C ATOM 0 H LEU A 13 -2.779 21.629 -10.132 1.00 0.00 H new ATOM 0 HA LEU A 13 -2.773 20.637 -12.998 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.993 22.049 -13.448 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.711 23.037 -12.191 1.00 0.00 H new ATOM 0 HG LEU A 13 0.379 20.889 -11.621 1.00 0.00 H new ATOM 0 HD11 LEU A 13 1.993 22.766 -11.452 1.00 0.00 H new ATOM 0 HD12 LEU A 13 1.319 22.648 -13.095 1.00 0.00 H new ATOM 0 HD13 LEU A 13 0.727 23.901 -11.978 1.00 0.00 H new ATOM 0 HD21 LEU A 13 0.607 22.124 -9.484 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.661 23.258 -10.005 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.061 21.548 -9.716 1.00 0.00 H new ATOM 194 N HIS A 14 -1.164 18.797 -12.368 1.00 0.00 N ATOM 195 CA HIS A 14 -0.507 17.555 -11.869 1.00 0.00 C ATOM 196 C HIS A 14 1.012 17.730 -11.855 1.00 0.00 C ATOM 197 O HIS A 14 1.605 18.172 -12.821 1.00 0.00 O ATOM 198 CB HIS A 14 -0.916 16.458 -12.853 1.00 0.00 C ATOM 199 CG HIS A 14 -2.416 16.390 -12.935 1.00 0.00 C ATOM 200 ND1 HIS A 14 -3.170 17.366 -13.570 1.00 0.00 N ATOM 201 CD2 HIS A 14 -3.318 15.469 -12.464 1.00 0.00 C ATOM 202 CE1 HIS A 14 -4.463 17.013 -13.462 1.00 0.00 C ATOM 203 NE2 HIS A 14 -4.610 15.865 -12.797 1.00 0.00 N ATOM 0 H HIS A 14 -1.242 18.871 -13.382 1.00 0.00 H new ATOM 0 HA HIS A 14 -0.807 17.313 -10.850 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -0.497 16.664 -13.838 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -0.515 15.497 -12.530 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -3.064 14.573 -11.918 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -5.283 17.589 -13.865 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -5.482 15.382 -12.580 1.00 0.00 H new ATOM 211 N LEU A 15 1.642 17.384 -10.763 1.00 0.00 N ATOM 212 CA LEU A 15 3.125 17.520 -10.668 1.00 0.00 C ATOM 213 C LEU A 15 3.759 16.153 -10.408 1.00 0.00 C ATOM 214 O LEU A 15 3.250 15.367 -9.635 1.00 0.00 O ATOM 215 CB LEU A 15 3.377 18.434 -9.463 1.00 0.00 C ATOM 216 CG LEU A 15 2.661 19.773 -9.644 1.00 0.00 C ATOM 217 CD1 LEU A 15 2.854 20.274 -11.076 1.00 0.00 C ATOM 218 CD2 LEU A 15 1.170 19.598 -9.357 1.00 0.00 C ATOM 0 H LEU A 15 1.190 17.011 -9.928 1.00 0.00 H new ATOM 0 HA LEU A 15 3.552 17.921 -11.587 1.00 0.00 H new ATOM 0 HB2 LEU A 15 3.027 17.949 -8.552 1.00 0.00 H new ATOM 0 HB3 LEU A 15 4.448 18.601 -9.344 1.00 0.00 H new ATOM 0 HG LEU A 15 3.080 20.502 -8.951 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.342 21.228 -11.200 1.00 0.00 H new ATOM 0 HD12 LEU A 15 3.918 20.404 -11.276 1.00 0.00 H new ATOM 0 HD13 LEU A 15 2.440 19.547 -11.775 1.00 0.00 H new ATOM 0 HD21 LEU A 15 0.660 20.553 -9.486 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.750 18.866 -10.047 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.035 19.250 -8.333 1.00 0.00 H new ATOM 230 N LYS A 16 4.873 15.865 -11.021 1.00 0.00 N ATOM 231 CA LYS A 16 5.524 14.551 -10.763 1.00 0.00 C ATOM 232 C LYS A 16 6.593 14.724 -9.691 1.00 0.00 C ATOM 233 O LYS A 16 7.552 15.448 -9.867 1.00 0.00 O ATOM 234 CB LYS A 16 6.152 14.123 -12.088 1.00 0.00 C ATOM 235 CG LYS A 16 6.255 12.596 -12.122 1.00 0.00 C ATOM 236 CD LYS A 16 7.176 12.174 -13.266 1.00 0.00 C ATOM 237 CE LYS A 16 6.358 12.028 -14.551 1.00 0.00 C ATOM 238 NZ LYS A 16 7.270 12.482 -15.637 1.00 0.00 N ATOM 0 H LYS A 16 5.356 16.474 -11.681 1.00 0.00 H new ATOM 0 HA LYS A 16 4.816 13.801 -10.410 1.00 0.00 H new ATOM 0 HB2 LYS A 16 5.548 14.478 -12.923 1.00 0.00 H new ATOM 0 HB3 LYS A 16 7.140 14.569 -12.197 1.00 0.00 H new ATOM 0 HG2 LYS A 16 6.643 12.226 -11.173 1.00 0.00 H new ATOM 0 HG3 LYS A 16 5.266 12.157 -12.256 1.00 0.00 H new ATOM 0 HD2 LYS A 16 7.963 12.915 -13.405 1.00 0.00 H new ATOM 0 HD3 LYS A 16 7.665 11.230 -13.024 1.00 0.00 H new ATOM 0 HE2 LYS A 16 6.044 10.996 -14.704 1.00 0.00 H new ATOM 0 HE3 LYS A 16 5.453 12.635 -14.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 6.782 12.412 -16.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 7.547 13.470 -15.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 8.119 11.882 -15.651 1.00 0.00 H new ATOM 252 N ALA A 17 6.431 14.077 -8.573 1.00 0.00 N ATOM 253 CA ALA A 17 7.432 14.219 -7.485 1.00 0.00 C ATOM 254 C ALA A 17 8.630 13.306 -7.735 1.00 0.00 C ATOM 255 O ALA A 17 8.563 12.105 -7.558 1.00 0.00 O ATOM 256 CB ALA A 17 6.695 13.812 -6.209 1.00 0.00 C ATOM 0 H ALA A 17 5.648 13.456 -8.366 1.00 0.00 H new ATOM 0 HA ALA A 17 7.825 15.234 -7.420 1.00 0.00 H new ATOM 0 HB1 ALA A 17 7.371 13.891 -5.358 1.00 0.00 H new ATOM 0 HB2 ALA A 17 5.841 14.471 -6.056 1.00 0.00 H new ATOM 0 HB3 ALA A 17 6.347 12.783 -6.302 1.00 0.00 H new ATOM 262 N LEU A 18 9.728 13.877 -8.136 1.00 0.00 N ATOM 263 CA LEU A 18 10.949 13.066 -8.390 1.00 0.00 C ATOM 264 C LEU A 18 11.872 13.165 -7.175 1.00 0.00 C ATOM 265 O LEU A 18 12.555 14.151 -6.983 1.00 0.00 O ATOM 266 CB LEU A 18 11.594 13.709 -9.618 1.00 0.00 C ATOM 267 CG LEU A 18 11.317 12.847 -10.851 1.00 0.00 C ATOM 268 CD1 LEU A 18 12.078 11.527 -10.731 1.00 0.00 C ATOM 269 CD2 LEU A 18 9.815 12.563 -10.948 1.00 0.00 C ATOM 0 H LEU A 18 9.834 14.878 -8.300 1.00 0.00 H new ATOM 0 HA LEU A 18 10.739 12.009 -8.556 1.00 0.00 H new ATOM 0 HB2 LEU A 18 11.197 14.713 -9.767 1.00 0.00 H new ATOM 0 HB3 LEU A 18 12.669 13.811 -9.466 1.00 0.00 H new ATOM 0 HG LEU A 18 11.646 13.376 -11.746 1.00 0.00 H new ATOM 0 HD11 LEU A 18 11.881 10.912 -11.609 1.00 0.00 H new ATOM 0 HD12 LEU A 18 13.147 11.728 -10.661 1.00 0.00 H new ATOM 0 HD13 LEU A 18 11.749 10.998 -9.837 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.617 11.949 -11.826 1.00 0.00 H new ATOM 0 HD22 LEU A 18 9.486 12.034 -10.054 1.00 0.00 H new ATOM 0 HD23 LEU A 18 9.272 13.504 -11.033 1.00 0.00 H new ATOM 281 N LEU A 19 11.886 12.164 -6.341 1.00 0.00 N ATOM 282 CA LEU A 19 12.751 12.226 -5.130 1.00 0.00 C ATOM 283 C LEU A 19 12.968 10.827 -4.548 1.00 0.00 C ATOM 284 O LEU A 19 12.111 9.970 -4.629 1.00 0.00 O ATOM 285 CB LEU A 19 11.962 13.094 -4.145 1.00 0.00 C ATOM 286 CG LEU A 19 12.927 13.873 -3.250 1.00 0.00 C ATOM 287 CD1 LEU A 19 13.503 15.057 -4.029 1.00 0.00 C ATOM 288 CD2 LEU A 19 12.175 14.392 -2.021 1.00 0.00 C ATOM 0 H LEU A 19 11.339 11.309 -6.444 1.00 0.00 H new ATOM 0 HA LEU A 19 13.740 12.629 -5.348 1.00 0.00 H new ATOM 0 HB2 LEU A 19 11.319 13.785 -4.690 1.00 0.00 H new ATOM 0 HB3 LEU A 19 11.311 12.467 -3.535 1.00 0.00 H new ATOM 0 HG LEU A 19 13.738 13.217 -2.933 1.00 0.00 H new ATOM 0 HD11 LEU A 19 14.191 15.612 -3.391 1.00 0.00 H new ATOM 0 HD12 LEU A 19 14.037 14.691 -4.906 1.00 0.00 H new ATOM 0 HD13 LEU A 19 12.692 15.713 -4.346 1.00 0.00 H new ATOM 0 HD21 LEU A 19 12.862 14.947 -1.382 1.00 0.00 H new ATOM 0 HD22 LEU A 19 11.365 15.048 -2.340 1.00 0.00 H new ATOM 0 HD23 LEU A 19 11.762 13.550 -1.465 1.00 0.00 H new ATOM 300 N ASP A 20 14.104 10.597 -3.949 1.00 0.00 N ATOM 301 CA ASP A 20 14.370 9.262 -3.344 1.00 0.00 C ATOM 302 C ASP A 20 13.772 9.224 -1.936 1.00 0.00 C ATOM 303 O ASP A 20 14.178 9.964 -1.063 1.00 0.00 O ATOM 304 CB ASP A 20 15.893 9.146 -3.286 1.00 0.00 C ATOM 305 CG ASP A 20 16.360 8.054 -4.250 1.00 0.00 C ATOM 306 OD1 ASP A 20 16.117 8.195 -5.437 1.00 0.00 O ATOM 307 OD2 ASP A 20 16.952 7.095 -3.784 1.00 0.00 O ATOM 0 H ASP A 20 14.859 11.276 -3.853 1.00 0.00 H new ATOM 0 HA ASP A 20 13.930 8.443 -3.913 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.351 10.099 -3.550 1.00 0.00 H new ATOM 0 HB3 ASP A 20 16.212 8.910 -2.271 1.00 0.00 H new ATOM 312 N PHE A 21 12.801 8.386 -1.707 1.00 0.00 N ATOM 313 CA PHE A 21 12.179 8.335 -0.354 1.00 0.00 C ATOM 314 C PHE A 21 12.010 6.890 0.117 1.00 0.00 C ATOM 315 O PHE A 21 10.908 6.394 0.213 1.00 0.00 O ATOM 316 CB PHE A 21 10.810 8.994 -0.528 1.00 0.00 C ATOM 317 CG PHE A 21 10.672 10.128 0.456 1.00 0.00 C ATOM 318 CD1 PHE A 21 10.847 9.890 1.823 1.00 0.00 C ATOM 319 CD2 PHE A 21 10.376 11.418 0.000 1.00 0.00 C ATOM 320 CE1 PHE A 21 10.728 10.944 2.736 1.00 0.00 C ATOM 321 CE2 PHE A 21 10.253 12.471 0.914 1.00 0.00 C ATOM 322 CZ PHE A 21 10.430 12.235 2.282 1.00 0.00 C ATOM 0 H PHE A 21 12.413 7.738 -2.392 1.00 0.00 H new ATOM 0 HA PHE A 21 12.794 8.837 0.393 1.00 0.00 H new ATOM 0 HB2 PHE A 21 10.700 9.366 -1.547 1.00 0.00 H new ATOM 0 HB3 PHE A 21 10.019 8.262 -0.369 1.00 0.00 H new ATOM 0 HD1 PHE A 21 11.074 8.894 2.174 1.00 0.00 H new ATOM 0 HD2 PHE A 21 10.243 11.601 -1.056 1.00 0.00 H new ATOM 0 HE1 PHE A 21 10.866 10.762 3.792 1.00 0.00 H new ATOM 0 HE2 PHE A 21 10.021 13.466 0.563 1.00 0.00 H new ATOM 0 HZ PHE A 21 10.337 13.048 2.987 1.00 0.00 H new ATOM 434 N VAL A 29 9.396 5.808 -2.033 1.00 0.00 N ATOM 435 CA VAL A 29 9.265 6.153 -3.482 1.00 0.00 C ATOM 436 C VAL A 29 10.657 6.284 -4.111 1.00 0.00 C ATOM 437 O VAL A 29 11.644 6.458 -3.424 1.00 0.00 O ATOM 438 CB VAL A 29 8.499 7.493 -3.533 1.00 0.00 C ATOM 439 CG1 VAL A 29 7.502 7.578 -2.373 1.00 0.00 C ATOM 440 CG2 VAL A 29 9.475 8.673 -3.439 1.00 0.00 C ATOM 0 HA VAL A 29 8.733 5.384 -4.042 1.00 0.00 H new ATOM 0 HB VAL A 29 7.963 7.541 -4.481 1.00 0.00 H new ATOM 0 HG11 VAL A 29 6.969 8.527 -2.421 1.00 0.00 H new ATOM 0 HG12 VAL A 29 6.789 6.757 -2.445 1.00 0.00 H new ATOM 0 HG13 VAL A 29 8.038 7.510 -1.427 1.00 0.00 H new ATOM 0 HG21 VAL A 29 8.918 9.609 -3.476 1.00 0.00 H new ATOM 0 HG22 VAL A 29 10.026 8.616 -2.500 1.00 0.00 H new ATOM 0 HG23 VAL A 29 10.175 8.633 -4.273 1.00 0.00 H new ATOM 450 N VAL A 30 10.748 6.202 -5.411 1.00 0.00 N ATOM 451 CA VAL A 30 12.081 6.325 -6.068 1.00 0.00 C ATOM 452 C VAL A 30 11.977 7.169 -7.340 1.00 0.00 C ATOM 453 O VAL A 30 11.836 6.653 -8.430 1.00 0.00 O ATOM 454 CB VAL A 30 12.487 4.892 -6.402 1.00 0.00 C ATOM 455 CG1 VAL A 30 12.652 4.099 -5.105 1.00 0.00 C ATOM 456 CG2 VAL A 30 11.401 4.243 -7.262 1.00 0.00 C ATOM 0 H VAL A 30 9.961 6.056 -6.044 1.00 0.00 H new ATOM 0 HA VAL A 30 12.812 6.818 -5.428 1.00 0.00 H new ATOM 0 HB VAL A 30 13.429 4.896 -6.950 1.00 0.00 H new ATOM 0 HG11 VAL A 30 12.942 3.075 -5.339 1.00 0.00 H new ATOM 0 HG12 VAL A 30 13.423 4.563 -4.490 1.00 0.00 H new ATOM 0 HG13 VAL A 30 11.708 4.093 -4.560 1.00 0.00 H new ATOM 0 HG21 VAL A 30 11.690 3.220 -7.501 1.00 0.00 H new ATOM 0 HG22 VAL A 30 10.459 4.236 -6.714 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.280 4.811 -8.184 1.00 0.00 H new ATOM 466 N ALA A 31 12.055 8.463 -7.203 1.00 0.00 N ATOM 467 CA ALA A 31 11.968 9.353 -8.397 1.00 0.00 C ATOM 468 C ALA A 31 10.905 8.844 -9.374 1.00 0.00 C ATOM 469 O ALA A 31 11.218 8.266 -10.397 1.00 0.00 O ATOM 470 CB ALA A 31 13.355 9.285 -9.039 1.00 0.00 C ATOM 0 H ALA A 31 12.176 8.946 -6.313 1.00 0.00 H new ATOM 0 HA ALA A 31 11.685 10.371 -8.128 1.00 0.00 H new ATOM 0 HB1 ALA A 31 13.376 9.915 -9.928 1.00 0.00 H new ATOM 0 HB2 ALA A 31 14.103 9.636 -8.328 1.00 0.00 H new ATOM 0 HB3 ALA A 31 13.576 8.255 -9.319 1.00 0.00 H new ATOM 476 N GLY A 32 9.651 9.055 -9.076 1.00 0.00 N ATOM 477 CA GLY A 32 8.585 8.579 -10.003 1.00 0.00 C ATOM 478 C GLY A 32 7.203 8.801 -9.384 1.00 0.00 C ATOM 479 O GLY A 32 6.280 8.048 -9.628 1.00 0.00 O ATOM 0 H GLY A 32 9.321 9.533 -8.237 1.00 0.00 H new ATOM 0 HA2 GLY A 32 8.655 9.111 -10.952 1.00 0.00 H new ATOM 0 HA3 GLY A 32 8.728 7.520 -10.219 1.00 0.00 H new ATOM 483 N ASP A 33 7.041 9.827 -8.593 1.00 0.00 N ATOM 484 CA ASP A 33 5.706 10.078 -7.978 1.00 0.00 C ATOM 485 C ASP A 33 4.953 11.161 -8.760 1.00 0.00 C ATOM 486 O ASP A 33 5.545 11.986 -9.425 1.00 0.00 O ATOM 487 CB ASP A 33 6.002 10.549 -6.554 1.00 0.00 C ATOM 488 CG ASP A 33 6.570 9.384 -5.739 1.00 0.00 C ATOM 489 OD1 ASP A 33 5.783 8.611 -5.218 1.00 0.00 O ATOM 490 OD2 ASP A 33 7.783 9.284 -5.652 1.00 0.00 O ATOM 0 H ASP A 33 7.769 10.498 -8.347 1.00 0.00 H new ATOM 0 HA ASP A 33 5.077 9.188 -7.988 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.714 11.375 -6.573 1.00 0.00 H new ATOM 0 HB3 ASP A 33 5.091 10.924 -6.087 1.00 0.00 H new ATOM 495 N GLU A 34 3.651 11.159 -8.682 1.00 0.00 N ATOM 496 CA GLU A 34 2.848 12.183 -9.414 1.00 0.00 C ATOM 497 C GLU A 34 1.534 12.444 -8.671 1.00 0.00 C ATOM 498 O GLU A 34 0.862 11.527 -8.239 1.00 0.00 O ATOM 499 CB GLU A 34 2.583 11.573 -10.796 1.00 0.00 C ATOM 500 CG GLU A 34 1.378 12.260 -11.446 1.00 0.00 C ATOM 501 CD GLU A 34 1.391 12.007 -12.955 1.00 0.00 C ATOM 502 OE1 GLU A 34 0.899 10.970 -13.366 1.00 0.00 O ATOM 503 OE2 GLU A 34 1.893 12.855 -13.674 1.00 0.00 O ATOM 0 H GLU A 34 3.105 10.489 -8.140 1.00 0.00 H new ATOM 0 HA GLU A 34 3.364 13.140 -9.492 1.00 0.00 H new ATOM 0 HB2 GLU A 34 3.463 11.688 -11.429 1.00 0.00 H new ATOM 0 HB3 GLU A 34 2.396 10.503 -10.701 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.453 11.880 -11.012 1.00 0.00 H new ATOM 0 HG3 GLU A 34 1.407 13.331 -11.247 1.00 0.00 H new ATOM 510 N TRP A 35 1.165 13.686 -8.511 1.00 0.00 N ATOM 511 CA TRP A 35 -0.102 13.995 -7.791 1.00 0.00 C ATOM 512 C TRP A 35 -0.742 15.270 -8.346 1.00 0.00 C ATOM 513 O TRP A 35 -0.128 16.016 -9.083 1.00 0.00 O ATOM 514 CB TRP A 35 0.313 14.184 -6.326 1.00 0.00 C ATOM 515 CG TRP A 35 0.879 15.555 -6.124 1.00 0.00 C ATOM 516 CD1 TRP A 35 0.196 16.607 -5.620 1.00 0.00 C ATOM 517 CD2 TRP A 35 2.224 16.040 -6.410 1.00 0.00 C ATOM 518 NE1 TRP A 35 1.034 17.707 -5.577 1.00 0.00 N ATOM 519 CE2 TRP A 35 2.295 17.407 -6.054 1.00 0.00 C ATOM 520 CE3 TRP A 35 3.376 15.433 -6.941 1.00 0.00 C ATOM 521 CZ2 TRP A 35 3.469 18.146 -6.215 1.00 0.00 C ATOM 522 CZ3 TRP A 35 4.557 16.174 -7.105 1.00 0.00 C ATOM 523 CH2 TRP A 35 4.604 17.526 -6.742 1.00 0.00 C ATOM 0 H TRP A 35 1.684 14.497 -8.847 1.00 0.00 H new ATOM 0 HA TRP A 35 -0.844 13.205 -7.906 1.00 0.00 H new ATOM 0 HB2 TRP A 35 -0.548 14.038 -5.674 1.00 0.00 H new ATOM 0 HB3 TRP A 35 1.053 13.433 -6.050 1.00 0.00 H new ATOM 0 HD1 TRP A 35 -0.836 16.591 -5.302 1.00 0.00 H new ATOM 0 HE1 TRP A 35 0.755 18.627 -5.235 1.00 0.00 H new ATOM 0 HE3 TRP A 35 3.352 14.391 -7.224 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 3.499 19.188 -5.934 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 5.436 15.698 -7.514 1.00 0.00 H new ATOM 0 HH2 TRP A 35 5.517 18.088 -6.870 1.00 0.00 H new ATOM 534 N LEU A 36 -1.969 15.529 -7.988 1.00 0.00 N ATOM 535 CA LEU A 36 -2.645 16.758 -8.486 1.00 0.00 C ATOM 536 C LEU A 36 -2.552 17.864 -7.431 1.00 0.00 C ATOM 537 O LEU A 36 -2.452 17.598 -6.249 1.00 0.00 O ATOM 538 CB LEU A 36 -4.101 16.357 -8.708 1.00 0.00 C ATOM 539 CG LEU A 36 -4.924 17.598 -9.061 1.00 0.00 C ATOM 540 CD1 LEU A 36 -4.336 18.267 -10.304 1.00 0.00 C ATOM 541 CD2 LEU A 36 -6.368 17.184 -9.344 1.00 0.00 C ATOM 0 H LEU A 36 -2.532 14.942 -7.372 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.188 17.139 -9.399 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -4.169 15.622 -9.510 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -4.501 15.886 -7.810 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.900 18.299 -8.226 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.923 19.151 -10.554 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.305 18.561 -10.106 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -4.360 17.567 -11.139 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -6.957 18.066 -9.596 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -6.389 16.484 -10.179 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -6.790 16.707 -8.459 1.00 0.00 H new ATOM 553 N PHE A 37 -2.589 19.100 -7.843 1.00 0.00 N ATOM 554 CA PHE A 37 -2.506 20.215 -6.857 1.00 0.00 C ATOM 555 C PHE A 37 -3.504 21.316 -7.229 1.00 0.00 C ATOM 556 O PHE A 37 -3.343 22.004 -8.217 1.00 0.00 O ATOM 557 CB PHE A 37 -1.066 20.725 -6.965 1.00 0.00 C ATOM 558 CG PHE A 37 -0.810 21.815 -5.947 1.00 0.00 C ATOM 559 CD1 PHE A 37 -1.795 22.166 -5.014 1.00 0.00 C ATOM 560 CD2 PHE A 37 0.425 22.475 -5.938 1.00 0.00 C ATOM 561 CE1 PHE A 37 -1.544 23.176 -4.077 1.00 0.00 C ATOM 562 CE2 PHE A 37 0.675 23.484 -5.002 1.00 0.00 C ATOM 563 CZ PHE A 37 -0.308 23.835 -4.070 1.00 0.00 C ATOM 0 H PHE A 37 -2.673 19.387 -8.818 1.00 0.00 H new ATOM 0 HA PHE A 37 -2.749 19.899 -5.842 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -0.370 19.901 -6.807 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -0.884 21.108 -7.969 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -2.748 21.658 -5.018 1.00 0.00 H new ATOM 0 HD2 PHE A 37 1.186 22.204 -6.655 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.304 23.447 -3.359 1.00 0.00 H new ATOM 0 HE2 PHE A 37 1.628 23.993 -4.999 1.00 0.00 H new ATOM 0 HZ PHE A 37 -0.114 24.613 -3.346 1.00 0.00 H new ATOM 573 N GLU A 38 -4.535 21.484 -6.445 1.00 0.00 N ATOM 574 CA GLU A 38 -5.544 22.537 -6.756 1.00 0.00 C ATOM 575 C GLU A 38 -5.259 23.805 -5.949 1.00 0.00 C ATOM 576 O GLU A 38 -4.922 23.753 -4.782 1.00 0.00 O ATOM 577 CB GLU A 38 -6.891 21.923 -6.365 1.00 0.00 C ATOM 578 CG GLU A 38 -6.977 21.774 -4.846 1.00 0.00 C ATOM 579 CD GLU A 38 -7.824 22.911 -4.269 1.00 0.00 C ATOM 580 OE1 GLU A 38 -7.443 24.056 -4.444 1.00 0.00 O ATOM 581 OE2 GLU A 38 -8.840 22.615 -3.661 1.00 0.00 O ATOM 0 H GLU A 38 -4.722 20.938 -5.604 1.00 0.00 H new ATOM 0 HA GLU A 38 -5.526 22.832 -7.805 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -7.705 22.553 -6.723 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -7.008 20.950 -6.841 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -7.418 20.811 -4.589 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -5.978 21.793 -4.411 1.00 0.00 H new ATOM 588 N GLY A 39 -5.383 24.943 -6.572 1.00 0.00 N ATOM 589 CA GLY A 39 -5.110 26.226 -5.868 1.00 0.00 C ATOM 590 C GLY A 39 -3.602 26.402 -5.632 1.00 0.00 C ATOM 591 O GLY A 39 -3.201 26.867 -4.584 1.00 0.00 O ATOM 0 H GLY A 39 -5.664 25.040 -7.548 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -5.491 27.059 -6.458 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -5.637 26.243 -4.914 1.00 0.00 H new ATOM 595 N PRO A 40 -2.804 26.047 -6.615 1.00 0.00 N ATOM 596 CA PRO A 40 -1.330 26.201 -6.488 1.00 0.00 C ATOM 597 C PRO A 40 -0.938 27.670 -6.713 1.00 0.00 C ATOM 598 O PRO A 40 -0.038 27.975 -7.474 1.00 0.00 O ATOM 599 CB PRO A 40 -0.783 25.320 -7.609 1.00 0.00 C ATOM 600 CG PRO A 40 -1.876 25.257 -8.628 1.00 0.00 C ATOM 601 CD PRO A 40 -3.184 25.470 -7.912 1.00 0.00 C ATOM 0 HA PRO A 40 -0.946 25.921 -5.507 1.00 0.00 H new ATOM 0 HB2 PRO A 40 0.127 25.743 -8.034 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -0.530 24.326 -7.241 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -1.730 26.020 -9.393 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -1.871 24.292 -9.135 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -3.837 26.142 -8.469 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -3.725 24.532 -7.786 1.00 0.00 H new ATOM 609 N GLY A 41 -1.624 28.576 -6.068 1.00 0.00 N ATOM 610 CA GLY A 41 -1.330 30.026 -6.246 1.00 0.00 C ATOM 611 C GLY A 41 0.174 30.289 -6.258 1.00 0.00 C ATOM 612 O GLY A 41 0.640 31.203 -6.908 1.00 0.00 O ATOM 0 H GLY A 41 -2.383 28.370 -5.419 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -1.770 30.377 -7.179 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -1.795 30.595 -5.441 1.00 0.00 H new ATOM 616 N THR A 42 0.942 29.521 -5.542 1.00 0.00 N ATOM 617 CA THR A 42 2.409 29.777 -5.530 1.00 0.00 C ATOM 618 C THR A 42 3.195 28.470 -5.647 1.00 0.00 C ATOM 619 O THR A 42 4.185 28.268 -4.972 1.00 0.00 O ATOM 620 CB THR A 42 2.674 30.456 -4.186 1.00 0.00 C ATOM 621 OG1 THR A 42 1.934 29.793 -3.170 1.00 0.00 O ATOM 622 CG2 THR A 42 2.241 31.921 -4.266 1.00 0.00 C ATOM 0 H THR A 42 0.625 28.737 -4.971 1.00 0.00 H new ATOM 0 HA THR A 42 2.725 30.394 -6.372 1.00 0.00 H new ATOM 0 HB THR A 42 3.737 30.405 -3.951 1.00 0.00 H new ATOM 0 HG1 THR A 42 2.103 30.225 -2.307 1.00 0.00 H new ATOM 0 HG21 THR A 42 2.428 32.409 -3.309 1.00 0.00 H new ATOM 0 HG22 THR A 42 2.808 32.426 -5.048 1.00 0.00 H new ATOM 0 HG23 THR A 42 1.177 31.974 -4.498 1.00 0.00 H new ATOM 630 N TYR A 43 2.775 27.585 -6.510 1.00 0.00 N ATOM 631 CA TYR A 43 3.518 26.303 -6.677 1.00 0.00 C ATOM 632 C TYR A 43 4.749 26.532 -7.561 1.00 0.00 C ATOM 633 O TYR A 43 4.635 26.799 -8.741 1.00 0.00 O ATOM 634 CB TYR A 43 2.528 25.350 -7.356 1.00 0.00 C ATOM 635 CG TYR A 43 3.280 24.236 -8.051 1.00 0.00 C ATOM 636 CD1 TYR A 43 3.819 23.180 -7.305 1.00 0.00 C ATOM 637 CD2 TYR A 43 3.443 24.266 -9.441 1.00 0.00 C ATOM 638 CE1 TYR A 43 4.518 22.154 -7.951 1.00 0.00 C ATOM 639 CE2 TYR A 43 4.144 23.240 -10.087 1.00 0.00 C ATOM 640 CZ TYR A 43 4.681 22.184 -9.341 1.00 0.00 C ATOM 641 OH TYR A 43 5.373 21.173 -9.976 1.00 0.00 O ATOM 0 H TYR A 43 1.953 27.693 -7.104 1.00 0.00 H new ATOM 0 HA TYR A 43 3.874 25.899 -5.729 1.00 0.00 H new ATOM 0 HB2 TYR A 43 1.845 24.933 -6.616 1.00 0.00 H new ATOM 0 HB3 TYR A 43 1.921 25.896 -8.078 1.00 0.00 H new ATOM 0 HD1 TYR A 43 3.695 23.158 -6.232 1.00 0.00 H new ATOM 0 HD2 TYR A 43 3.028 25.081 -10.016 1.00 0.00 H new ATOM 0 HE1 TYR A 43 4.932 21.338 -7.377 1.00 0.00 H new ATOM 0 HE2 TYR A 43 4.270 23.263 -11.159 1.00 0.00 H new ATOM 0 HH TYR A 43 6.047 21.562 -10.572 1.00 0.00 H new ATOM 651 N ILE A 44 5.924 26.429 -7.002 1.00 0.00 N ATOM 652 CA ILE A 44 7.156 26.639 -7.816 1.00 0.00 C ATOM 653 C ILE A 44 7.702 25.292 -8.296 1.00 0.00 C ATOM 654 O ILE A 44 7.810 24.357 -7.528 1.00 0.00 O ATOM 655 CB ILE A 44 8.150 27.309 -6.867 1.00 0.00 C ATOM 656 CG1 ILE A 44 7.663 28.721 -6.532 1.00 0.00 C ATOM 657 CG2 ILE A 44 9.522 27.387 -7.538 1.00 0.00 C ATOM 658 CD1 ILE A 44 6.943 28.703 -5.183 1.00 0.00 C ATOM 0 H ILE A 44 6.084 26.209 -6.019 1.00 0.00 H new ATOM 0 HA ILE A 44 6.968 27.245 -8.703 1.00 0.00 H new ATOM 0 HB ILE A 44 8.228 26.725 -5.950 1.00 0.00 H new ATOM 0 HG12 ILE A 44 8.507 29.410 -6.497 1.00 0.00 H new ATOM 0 HG13 ILE A 44 6.990 29.080 -7.311 1.00 0.00 H new ATOM 0 HG21 ILE A 44 10.231 27.865 -6.862 1.00 0.00 H new ATOM 0 HG22 ILE A 44 9.868 26.381 -7.776 1.00 0.00 H new ATOM 0 HG23 ILE A 44 9.446 27.971 -8.455 1.00 0.00 H new ATOM 0 HD11 ILE A 44 6.595 29.708 -4.943 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.090 28.027 -5.235 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.630 28.362 -4.408 1.00 0.00 H new ATOM 670 N PRO A 45 8.030 25.239 -9.559 1.00 0.00 N ATOM 671 CA PRO A 45 8.573 23.993 -10.151 1.00 0.00 C ATOM 672 C PRO A 45 10.012 23.761 -9.682 1.00 0.00 C ATOM 673 O PRO A 45 10.950 24.306 -10.232 1.00 0.00 O ATOM 674 CB PRO A 45 8.526 24.259 -11.653 1.00 0.00 C ATOM 675 CG PRO A 45 8.564 25.749 -11.784 1.00 0.00 C ATOM 676 CD PRO A 45 7.928 26.323 -10.542 1.00 0.00 C ATOM 0 HA PRO A 45 8.013 23.103 -9.864 1.00 0.00 H new ATOM 0 HB2 PRO A 45 9.371 23.796 -12.162 1.00 0.00 H new ATOM 0 HB3 PRO A 45 7.621 23.847 -12.099 1.00 0.00 H new ATOM 0 HG2 PRO A 45 9.591 26.100 -11.888 1.00 0.00 H new ATOM 0 HG3 PRO A 45 8.026 26.071 -12.676 1.00 0.00 H new ATOM 0 HD2 PRO A 45 8.449 27.219 -10.204 1.00 0.00 H new ATOM 0 HD3 PRO A 45 6.890 26.605 -10.719 1.00 0.00 H new ATOM 684 N ARG A 46 10.194 22.957 -8.672 1.00 0.00 N ATOM 685 CA ARG A 46 11.572 22.691 -8.170 1.00 0.00 C ATOM 686 C ARG A 46 12.044 21.306 -8.623 1.00 0.00 C ATOM 687 O ARG A 46 11.252 20.449 -8.965 1.00 0.00 O ATOM 688 CB ARG A 46 11.456 22.747 -6.646 1.00 0.00 C ATOM 689 CG ARG A 46 12.821 23.081 -6.042 1.00 0.00 C ATOM 690 CD ARG A 46 13.147 22.080 -4.931 1.00 0.00 C ATOM 691 NE ARG A 46 11.961 22.106 -4.030 1.00 0.00 N ATOM 692 CZ ARG A 46 11.736 23.147 -3.276 1.00 0.00 C ATOM 693 NH1 ARG A 46 12.439 23.332 -2.192 1.00 0.00 N ATOM 694 NH2 ARG A 46 10.809 24.002 -3.607 1.00 0.00 N ATOM 0 H ARG A 46 9.449 22.472 -8.172 1.00 0.00 H new ATOM 0 HA ARG A 46 12.296 23.412 -8.551 1.00 0.00 H new ATOM 0 HB2 ARG A 46 10.723 23.499 -6.354 1.00 0.00 H new ATOM 0 HB3 ARG A 46 11.101 21.791 -6.262 1.00 0.00 H new ATOM 0 HG2 ARG A 46 13.590 23.047 -6.814 1.00 0.00 H new ATOM 0 HG3 ARG A 46 12.815 24.095 -5.642 1.00 0.00 H new ATOM 0 HD2 ARG A 46 13.314 21.082 -5.335 1.00 0.00 H new ATOM 0 HD3 ARG A 46 14.054 22.364 -4.398 1.00 0.00 H new ATOM 0 HE ARG A 46 11.324 21.310 -4.002 1.00 0.00 H new ATOM 0 HH11 ARG A 46 13.164 22.663 -1.934 1.00 0.00 H new ATOM 0 HH12 ARG A 46 12.263 24.146 -1.603 1.00 0.00 H new ATOM 0 HH21 ARG A 46 10.260 23.857 -4.455 1.00 0.00 H new ATOM 0 HH22 ARG A 46 10.632 24.816 -3.018 1.00 0.00 H new ATOM 708 N LYS A 47 13.329 21.080 -8.633 1.00 0.00 N ATOM 709 CA LYS A 47 13.851 19.752 -9.067 1.00 0.00 C ATOM 710 C LYS A 47 13.117 18.624 -8.335 1.00 0.00 C ATOM 711 O LYS A 47 12.979 17.529 -8.842 1.00 0.00 O ATOM 712 CB LYS A 47 15.332 19.767 -8.690 1.00 0.00 C ATOM 713 CG LYS A 47 16.104 18.814 -9.604 1.00 0.00 C ATOM 714 CD LYS A 47 16.706 19.600 -10.771 1.00 0.00 C ATOM 715 CE LYS A 47 17.785 20.548 -10.245 1.00 0.00 C ATOM 716 NZ LYS A 47 19.047 19.757 -10.296 1.00 0.00 N ATOM 0 H LYS A 47 14.041 21.757 -8.359 1.00 0.00 H new ATOM 0 HA LYS A 47 13.704 19.580 -10.133 1.00 0.00 H new ATOM 0 HB2 LYS A 47 15.731 20.777 -8.781 1.00 0.00 H new ATOM 0 HB3 LYS A 47 15.456 19.469 -7.649 1.00 0.00 H new ATOM 0 HG2 LYS A 47 16.894 18.315 -9.042 1.00 0.00 H new ATOM 0 HG3 LYS A 47 15.440 18.036 -9.980 1.00 0.00 H new ATOM 0 HD2 LYS A 47 17.134 18.915 -11.502 1.00 0.00 H new ATOM 0 HD3 LYS A 47 15.927 20.166 -11.282 1.00 0.00 H new ATOM 0 HE2 LYS A 47 17.856 21.446 -10.859 1.00 0.00 H new ATOM 0 HE3 LYS A 47 17.564 20.874 -9.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 19.836 20.340 -9.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 18.952 18.912 -9.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 19.235 19.466 -11.277 1.00 0.00 H new ATOM 730 N GLU A 48 12.643 18.883 -7.145 1.00 0.00 N ATOM 731 CA GLU A 48 11.917 17.821 -6.388 1.00 0.00 C ATOM 732 C GLU A 48 10.834 17.194 -7.270 1.00 0.00 C ATOM 733 O GLU A 48 10.621 16.001 -7.250 1.00 0.00 O ATOM 734 CB GLU A 48 11.285 18.540 -5.194 1.00 0.00 C ATOM 735 CG GLU A 48 11.401 17.660 -3.948 1.00 0.00 C ATOM 736 CD GLU A 48 10.752 18.372 -2.758 1.00 0.00 C ATOM 737 OE1 GLU A 48 10.881 19.582 -2.676 1.00 0.00 O ATOM 738 OE2 GLU A 48 10.139 17.694 -1.951 1.00 0.00 O ATOM 0 H GLU A 48 12.726 19.780 -6.666 1.00 0.00 H new ATOM 0 HA GLU A 48 12.579 17.015 -6.072 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.783 19.495 -5.026 1.00 0.00 H new ATOM 0 HB3 GLU A 48 10.238 18.759 -5.401 1.00 0.00 H new ATOM 0 HG2 GLU A 48 10.914 16.700 -4.121 1.00 0.00 H new ATOM 0 HG3 GLU A 48 12.449 17.452 -3.733 1.00 0.00 H new ATOM 745 N VAL A 49 10.152 17.994 -8.043 1.00 0.00 N ATOM 746 CA VAL A 49 9.083 17.451 -8.930 1.00 0.00 C ATOM 747 C VAL A 49 9.094 18.187 -10.276 1.00 0.00 C ATOM 748 O VAL A 49 9.820 19.143 -10.464 1.00 0.00 O ATOM 749 CB VAL A 49 7.762 17.686 -8.180 1.00 0.00 C ATOM 750 CG1 VAL A 49 7.962 17.434 -6.682 1.00 0.00 C ATOM 751 CG2 VAL A 49 7.289 19.128 -8.389 1.00 0.00 C ATOM 0 H VAL A 49 10.289 19.003 -8.099 1.00 0.00 H new ATOM 0 HA VAL A 49 9.227 16.393 -9.148 1.00 0.00 H new ATOM 0 HB VAL A 49 7.011 16.998 -8.569 1.00 0.00 H new ATOM 0 HG11 VAL A 49 7.022 17.602 -6.156 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.286 16.405 -6.526 1.00 0.00 H new ATOM 0 HG13 VAL A 49 8.720 18.115 -6.297 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.352 19.285 -7.854 1.00 0.00 H new ATOM 0 HG22 VAL A 49 8.044 19.817 -8.010 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.134 19.310 -9.453 1.00 0.00 H new ATOM 761 N GLU A 50 8.302 17.747 -11.215 1.00 0.00 N ATOM 762 CA GLU A 50 8.278 18.424 -12.545 1.00 0.00 C ATOM 763 C GLU A 50 6.836 18.679 -12.986 1.00 0.00 C ATOM 764 O GLU A 50 5.978 17.827 -12.854 1.00 0.00 O ATOM 765 CB GLU A 50 8.959 17.443 -13.500 1.00 0.00 C ATOM 766 CG GLU A 50 10.478 17.612 -13.414 1.00 0.00 C ATOM 767 CD GLU A 50 11.059 17.735 -14.825 1.00 0.00 C ATOM 768 OE1 GLU A 50 10.314 18.095 -15.722 1.00 0.00 O ATOM 769 OE2 GLU A 50 12.239 17.469 -14.983 1.00 0.00 O ATOM 0 H GLU A 50 7.672 16.951 -11.121 1.00 0.00 H new ATOM 0 HA GLU A 50 8.780 19.391 -12.522 1.00 0.00 H new ATOM 0 HB2 GLU A 50 8.682 16.420 -13.245 1.00 0.00 H new ATOM 0 HB3 GLU A 50 8.621 17.620 -14.521 1.00 0.00 H new ATOM 0 HG2 GLU A 50 10.723 18.499 -12.830 1.00 0.00 H new ATOM 0 HG3 GLU A 50 10.921 16.759 -12.900 1.00 0.00 H new ATOM 776 N VAL A 51 6.560 19.838 -13.518 1.00 0.00 N ATOM 777 CA VAL A 51 5.171 20.130 -13.972 1.00 0.00 C ATOM 778 C VAL A 51 4.716 19.040 -14.942 1.00 0.00 C ATOM 779 O VAL A 51 5.432 18.670 -15.851 1.00 0.00 O ATOM 780 CB VAL A 51 5.253 21.479 -14.683 1.00 0.00 C ATOM 781 CG1 VAL A 51 3.842 21.971 -15.007 1.00 0.00 C ATOM 782 CG2 VAL A 51 5.952 22.494 -13.776 1.00 0.00 C ATOM 0 H VAL A 51 7.233 20.592 -13.658 1.00 0.00 H new ATOM 0 HA VAL A 51 4.458 20.157 -13.148 1.00 0.00 H new ATOM 0 HB VAL A 51 5.820 21.368 -15.607 1.00 0.00 H new ATOM 0 HG11 VAL A 51 3.900 22.934 -15.514 1.00 0.00 H new ATOM 0 HG12 VAL A 51 3.345 21.249 -15.655 1.00 0.00 H new ATOM 0 HG13 VAL A 51 3.274 22.081 -14.083 1.00 0.00 H new ATOM 0 HG21 VAL A 51 6.010 23.457 -14.284 1.00 0.00 H new ATOM 0 HG22 VAL A 51 5.386 22.606 -12.851 1.00 0.00 H new ATOM 0 HG23 VAL A 51 6.958 22.144 -13.546 1.00 0.00 H new ATOM 792 N VAL A 52 3.538 18.510 -14.757 1.00 0.00 N ATOM 793 CA VAL A 52 3.067 17.437 -15.676 1.00 0.00 C ATOM 794 C VAL A 52 1.802 17.868 -16.415 1.00 0.00 C ATOM 795 O VAL A 52 1.769 17.911 -17.629 1.00 0.00 O ATOM 796 CB VAL A 52 2.776 16.241 -14.772 1.00 0.00 C ATOM 797 CG1 VAL A 52 2.191 15.100 -15.604 1.00 0.00 C ATOM 798 CG2 VAL A 52 4.073 15.777 -14.115 1.00 0.00 C ATOM 0 H VAL A 52 2.887 18.771 -14.016 1.00 0.00 H new ATOM 0 HA VAL A 52 3.808 17.205 -16.441 1.00 0.00 H new ATOM 0 HB VAL A 52 2.060 16.532 -14.004 1.00 0.00 H new ATOM 0 HG11 VAL A 52 1.984 14.247 -14.957 1.00 0.00 H new ATOM 0 HG12 VAL A 52 1.266 15.431 -16.076 1.00 0.00 H new ATOM 0 HG13 VAL A 52 2.906 14.807 -16.373 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.868 14.923 -13.469 1.00 0.00 H new ATOM 0 HG22 VAL A 52 4.787 15.486 -14.885 1.00 0.00 H new ATOM 0 HG23 VAL A 52 4.491 16.590 -13.521 1.00 0.00 H new ATOM 808 N GLU A 53 0.753 18.173 -15.702 1.00 0.00 N ATOM 809 CA GLU A 53 -0.505 18.581 -16.391 1.00 0.00 C ATOM 810 C GLU A 53 -1.156 19.777 -15.695 1.00 0.00 C ATOM 811 O GLU A 53 -0.847 20.105 -14.567 1.00 0.00 O ATOM 812 CB GLU A 53 -1.427 17.364 -16.292 1.00 0.00 C ATOM 813 CG GLU A 53 -0.768 16.152 -16.954 1.00 0.00 C ATOM 814 CD GLU A 53 -0.950 16.240 -18.469 1.00 0.00 C ATOM 815 OE1 GLU A 53 -1.529 17.215 -18.920 1.00 0.00 O ATOM 816 OE2 GLU A 53 -0.509 15.332 -19.154 1.00 0.00 O ATOM 0 H GLU A 53 0.711 18.158 -14.683 1.00 0.00 H new ATOM 0 HA GLU A 53 -0.311 18.882 -17.421 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -1.642 17.145 -15.246 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -2.380 17.579 -16.775 1.00 0.00 H new ATOM 0 HG2 GLU A 53 0.293 16.120 -16.705 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -1.212 15.231 -16.576 1.00 0.00 H new ATOM 823 N ILE A 54 -2.073 20.416 -16.365 1.00 0.00 N ATOM 824 CA ILE A 54 -2.783 21.580 -15.759 1.00 0.00 C ATOM 825 C ILE A 54 -4.273 21.447 -16.082 1.00 0.00 C ATOM 826 O ILE A 54 -4.642 21.078 -17.179 1.00 0.00 O ATOM 827 CB ILE A 54 -2.199 22.853 -16.403 1.00 0.00 C ATOM 828 CG1 ILE A 54 -0.851 22.565 -17.088 1.00 0.00 C ATOM 829 CG2 ILE A 54 -1.991 23.910 -15.316 1.00 0.00 C ATOM 830 CD1 ILE A 54 0.226 22.306 -16.032 1.00 0.00 C ATOM 0 H ILE A 54 -2.364 20.181 -17.314 1.00 0.00 H new ATOM 0 HA ILE A 54 -2.659 21.623 -14.677 1.00 0.00 H new ATOM 0 HB ILE A 54 -2.899 23.209 -17.159 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.944 21.700 -17.744 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -0.563 23.410 -17.714 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -1.578 24.815 -15.762 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -2.947 24.141 -14.846 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -1.300 23.528 -14.565 1.00 0.00 H new ATOM 0 HD11 ILE A 54 1.177 22.103 -16.524 1.00 0.00 H new ATOM 0 HD12 ILE A 54 0.328 23.184 -15.394 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -0.059 21.447 -15.425 1.00 0.00 H new ATOM 842 N ILE A 55 -5.136 21.716 -15.143 1.00 0.00 N ATOM 843 CA ILE A 55 -6.596 21.564 -15.427 1.00 0.00 C ATOM 844 C ILE A 55 -7.408 22.722 -14.830 1.00 0.00 C ATOM 845 O ILE A 55 -7.191 23.138 -13.707 1.00 0.00 O ATOM 846 CB ILE A 55 -6.978 20.217 -14.789 1.00 0.00 C ATOM 847 CG1 ILE A 55 -8.060 19.542 -15.637 1.00 0.00 C ATOM 848 CG2 ILE A 55 -7.499 20.418 -13.360 1.00 0.00 C ATOM 849 CD1 ILE A 55 -9.394 20.267 -15.446 1.00 0.00 C ATOM 0 H ILE A 55 -4.901 22.031 -14.202 1.00 0.00 H new ATOM 0 HA ILE A 55 -6.810 21.585 -16.496 1.00 0.00 H new ATOM 0 HB ILE A 55 -6.089 19.587 -14.748 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -7.774 19.558 -16.689 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -8.160 18.495 -15.350 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -7.763 19.452 -12.930 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -6.724 20.886 -12.753 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -8.381 21.059 -13.381 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -10.161 19.783 -16.051 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -9.682 20.228 -14.396 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -9.290 21.307 -15.755 1.00 0.00 H new ATOM 861 N GLN A 56 -8.353 23.231 -15.580 1.00 0.00 N ATOM 862 CA GLN A 56 -9.201 24.353 -15.078 1.00 0.00 C ATOM 863 C GLN A 56 -10.475 23.800 -14.430 1.00 0.00 C ATOM 864 O GLN A 56 -10.800 22.639 -14.574 1.00 0.00 O ATOM 865 CB GLN A 56 -9.547 25.170 -16.324 1.00 0.00 C ATOM 866 CG GLN A 56 -8.712 26.452 -16.347 1.00 0.00 C ATOM 867 CD GLN A 56 -7.246 26.114 -16.067 1.00 0.00 C ATOM 868 OE1 GLN A 56 -6.710 25.176 -16.624 1.00 0.00 O ATOM 869 NE2 GLN A 56 -6.572 26.845 -15.223 1.00 0.00 N ATOM 0 H GLN A 56 -8.574 22.915 -16.524 1.00 0.00 H new ATOM 0 HA GLN A 56 -8.693 24.953 -14.323 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -9.354 24.582 -17.221 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -10.609 25.416 -16.326 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -8.804 26.941 -17.317 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -9.083 27.153 -15.600 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -7.023 27.632 -14.756 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -5.594 26.630 -15.030 1.00 0.00 H new ATOM 878 N ALA A 57 -11.197 24.622 -13.716 1.00 0.00 N ATOM 879 CA ALA A 57 -12.448 24.140 -13.059 1.00 0.00 C ATOM 880 C ALA A 57 -13.611 24.156 -14.056 1.00 0.00 C ATOM 881 O ALA A 57 -13.742 25.067 -14.849 1.00 0.00 O ATOM 882 CB ALA A 57 -12.703 25.134 -11.924 1.00 0.00 C ATOM 0 H ALA A 57 -10.975 25.605 -13.559 1.00 0.00 H new ATOM 0 HA ALA A 57 -12.356 23.116 -12.695 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -13.609 24.850 -11.388 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -11.857 25.126 -11.236 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -12.825 26.135 -12.338 1.00 0.00 H new ATOM 888 N THR A 58 -14.459 23.159 -14.028 1.00 0.00 N ATOM 889 CA THR A 58 -15.602 23.142 -14.988 1.00 0.00 C ATOM 890 C THR A 58 -16.479 21.898 -14.804 1.00 0.00 C ATOM 891 O THR A 58 -16.933 21.315 -15.769 1.00 0.00 O ATOM 892 CB THR A 58 -14.944 23.104 -16.367 1.00 0.00 C ATOM 893 OG1 THR A 58 -15.947 22.963 -17.365 1.00 0.00 O ATOM 894 CG2 THR A 58 -13.982 21.914 -16.435 1.00 0.00 C ATOM 0 H THR A 58 -14.410 22.365 -13.389 1.00 0.00 H new ATOM 0 HA THR A 58 -16.254 24.003 -14.843 1.00 0.00 H new ATOM 0 HB THR A 58 -14.392 24.029 -16.536 1.00 0.00 H new ATOM 0 HG1 THR A 58 -16.408 22.107 -17.246 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.510 21.883 -17.417 1.00 0.00 H new ATOM 0 HG22 THR A 58 -13.215 22.022 -15.668 1.00 0.00 H new ATOM 0 HG23 THR A 58 -14.535 20.989 -16.269 1.00 0.00 H new ATOM 902 N ILE A 59 -16.731 21.473 -13.594 1.00 0.00 N ATOM 903 CA ILE A 59 -17.588 20.257 -13.429 1.00 0.00 C ATOM 904 C ILE A 59 -18.169 20.156 -12.012 1.00 0.00 C ATOM 905 O ILE A 59 -19.357 20.319 -11.819 1.00 0.00 O ATOM 906 CB ILE A 59 -16.672 19.065 -13.752 1.00 0.00 C ATOM 907 CG1 ILE A 59 -17.260 17.781 -13.160 1.00 0.00 C ATOM 908 CG2 ILE A 59 -15.270 19.287 -13.178 1.00 0.00 C ATOM 909 CD1 ILE A 59 -16.241 16.649 -13.297 1.00 0.00 C ATOM 0 H ILE A 59 -16.392 21.900 -12.732 1.00 0.00 H new ATOM 0 HA ILE A 59 -18.454 20.288 -14.090 1.00 0.00 H new ATOM 0 HB ILE A 59 -16.601 18.974 -14.836 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -17.513 17.933 -12.111 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -18.184 17.519 -13.676 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -14.639 18.431 -13.418 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -14.838 20.189 -13.611 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -15.333 19.398 -12.096 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -16.656 15.733 -12.877 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -16.010 16.493 -14.351 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -15.329 16.913 -12.761 1.00 0.00 H new ATOM 921 N ILE A 60 -17.361 19.868 -11.024 1.00 0.00 N ATOM 922 CA ILE A 60 -17.905 19.742 -9.638 1.00 0.00 C ATOM 923 C ILE A 60 -18.927 20.854 -9.364 1.00 0.00 C ATOM 924 O ILE A 60 -19.008 21.829 -10.085 1.00 0.00 O ATOM 925 CB ILE A 60 -16.687 19.857 -8.712 1.00 0.00 C ATOM 926 CG1 ILE A 60 -16.024 18.483 -8.588 1.00 0.00 C ATOM 927 CG2 ILE A 60 -17.125 20.330 -7.325 1.00 0.00 C ATOM 928 CD1 ILE A 60 -16.938 17.546 -7.795 1.00 0.00 C ATOM 0 H ILE A 60 -16.357 19.716 -11.115 1.00 0.00 H new ATOM 0 HA ILE A 60 -18.430 18.799 -9.483 1.00 0.00 H new ATOM 0 HB ILE A 60 -15.984 20.578 -9.130 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -15.832 18.069 -9.578 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -15.060 18.576 -8.089 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -16.253 20.408 -6.675 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -17.605 21.305 -7.408 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -17.830 19.614 -6.902 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -16.467 16.567 -7.706 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -17.108 17.959 -6.801 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -17.892 17.444 -8.313 1.00 0.00 H new ATOM 940 N ARG A 61 -19.722 20.706 -8.336 1.00 0.00 N ATOM 941 CA ARG A 61 -20.749 21.745 -8.031 1.00 0.00 C ATOM 942 C ARG A 61 -20.220 22.756 -7.009 1.00 0.00 C ATOM 943 O ARG A 61 -19.033 22.854 -6.768 1.00 0.00 O ATOM 944 CB ARG A 61 -21.933 20.973 -7.449 1.00 0.00 C ATOM 945 CG ARG A 61 -22.573 20.113 -8.540 1.00 0.00 C ATOM 946 CD ARG A 61 -22.419 18.634 -8.178 1.00 0.00 C ATOM 947 NE ARG A 61 -23.017 17.893 -9.322 1.00 0.00 N ATOM 948 CZ ARG A 61 -23.922 16.978 -9.104 1.00 0.00 C ATOM 949 NH1 ARG A 61 -23.610 15.896 -8.444 1.00 0.00 N ATOM 950 NH2 ARG A 61 -25.139 17.147 -9.547 1.00 0.00 N ATOM 0 H ARG A 61 -19.704 19.912 -7.696 1.00 0.00 H new ATOM 0 HA ARG A 61 -21.022 22.315 -8.919 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -21.599 20.343 -6.625 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -22.668 21.668 -7.042 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -23.628 20.365 -8.645 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -22.100 20.315 -9.501 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -21.371 18.368 -8.040 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -22.932 18.401 -7.245 1.00 0.00 H new ATOM 0 HE ARG A 61 -22.720 18.100 -10.276 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -22.659 15.766 -8.099 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -24.317 15.181 -8.274 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -25.381 17.993 -10.063 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -25.847 16.433 -9.377 1.00 0.00 H new ATOM 964 N GLN A 62 -21.101 23.518 -6.418 1.00 0.00 N ATOM 965 CA GLN A 62 -20.671 24.537 -5.420 1.00 0.00 C ATOM 966 C GLN A 62 -20.104 23.878 -4.159 1.00 0.00 C ATOM 967 O GLN A 62 -18.930 23.986 -3.869 1.00 0.00 O ATOM 968 CB GLN A 62 -21.939 25.326 -5.091 1.00 0.00 C ATOM 969 CG GLN A 62 -21.639 26.826 -5.170 1.00 0.00 C ATOM 970 CD GLN A 62 -22.948 27.609 -5.280 1.00 0.00 C ATOM 971 OE1 GLN A 62 -23.185 28.527 -4.521 1.00 0.00 O ATOM 972 NE2 GLN A 62 -23.815 27.286 -6.202 1.00 0.00 N ATOM 0 H GLN A 62 -22.106 23.477 -6.586 1.00 0.00 H new ATOM 0 HA GLN A 62 -19.877 25.173 -5.811 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -22.734 25.066 -5.790 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -22.293 25.067 -4.093 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -21.088 27.143 -4.285 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -21.006 27.035 -6.032 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -23.617 26.515 -6.840 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -24.690 27.805 -6.284 1.00 0.00 H new ATOM 981 N ASN A 63 -20.927 23.212 -3.392 1.00 0.00 N ATOM 982 CA ASN A 63 -20.417 22.573 -2.143 1.00 0.00 C ATOM 983 C ASN A 63 -20.480 21.044 -2.236 1.00 0.00 C ATOM 984 O ASN A 63 -20.533 20.351 -1.238 1.00 0.00 O ATOM 985 CB ASN A 63 -21.331 23.090 -1.034 1.00 0.00 C ATOM 986 CG ASN A 63 -21.423 24.615 -1.115 1.00 0.00 C ATOM 987 OD1 ASN A 63 -20.426 25.286 -1.292 1.00 0.00 O ATOM 988 ND2 ASN A 63 -22.586 25.194 -0.990 1.00 0.00 N ATOM 0 H ASN A 63 -21.922 23.083 -3.574 1.00 0.00 H new ATOM 0 HA ASN A 63 -19.371 22.819 -1.960 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -22.323 22.650 -1.132 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -20.944 22.790 -0.060 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -22.658 26.210 -1.041 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -23.423 24.630 -0.841 1.00 0.00 H new ATOM 995 N GLN A 64 -20.463 20.507 -3.422 1.00 0.00 N ATOM 996 CA GLN A 64 -20.494 19.022 -3.564 1.00 0.00 C ATOM 997 C GLN A 64 -19.242 18.422 -2.901 1.00 0.00 C ATOM 998 O GLN A 64 -18.140 18.891 -3.110 1.00 0.00 O ATOM 999 CB GLN A 64 -20.514 18.778 -5.084 1.00 0.00 C ATOM 1000 CG GLN A 64 -19.642 17.572 -5.458 1.00 0.00 C ATOM 1001 CD GLN A 64 -20.214 16.306 -4.820 1.00 0.00 C ATOM 1002 OE1 GLN A 64 -19.526 15.612 -4.099 1.00 0.00 O ATOM 1003 NE2 GLN A 64 -21.452 15.970 -5.059 1.00 0.00 N ATOM 0 H GLN A 64 -20.429 21.028 -4.298 1.00 0.00 H new ATOM 0 HA GLN A 64 -21.353 18.555 -3.082 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -21.538 18.607 -5.415 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -20.155 19.666 -5.603 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -19.605 17.460 -6.542 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -18.619 17.732 -5.119 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -22.031 16.552 -5.664 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -21.841 15.125 -4.640 1.00 0.00 H new ATOM 1012 N ALA A 65 -19.393 17.392 -2.112 1.00 0.00 N ATOM 1013 CA ALA A 65 -18.202 16.782 -1.459 1.00 0.00 C ATOM 1014 C ALA A 65 -17.909 15.410 -2.071 1.00 0.00 C ATOM 1015 O ALA A 65 -18.775 14.561 -2.162 1.00 0.00 O ATOM 1016 CB ALA A 65 -18.583 16.640 0.014 1.00 0.00 C ATOM 0 H ALA A 65 -20.286 16.949 -1.893 1.00 0.00 H new ATOM 0 HA ALA A 65 -17.305 17.388 -1.590 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -17.753 16.196 0.563 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -18.808 17.623 0.428 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -19.461 16.000 0.103 1.00 0.00 H new ATOM 1022 N LEU A 66 -16.696 15.183 -2.486 1.00 0.00 N ATOM 1023 CA LEU A 66 -16.357 13.861 -3.084 1.00 0.00 C ATOM 1024 C LEU A 66 -15.152 13.255 -2.361 1.00 0.00 C ATOM 1025 O LEU A 66 -14.121 13.881 -2.219 1.00 0.00 O ATOM 1026 CB LEU A 66 -16.024 14.143 -4.554 1.00 0.00 C ATOM 1027 CG LEU A 66 -15.256 15.461 -4.676 1.00 0.00 C ATOM 1028 CD1 LEU A 66 -14.327 15.398 -5.891 1.00 0.00 C ATOM 1029 CD2 LEU A 66 -16.247 16.614 -4.851 1.00 0.00 C ATOM 0 H LEU A 66 -15.927 15.851 -2.438 1.00 0.00 H new ATOM 0 HA LEU A 66 -17.177 13.149 -2.994 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -15.428 13.327 -4.963 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -16.942 14.192 -5.140 1.00 0.00 H new ATOM 0 HG LEU A 66 -14.665 15.623 -3.774 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -13.779 16.336 -5.979 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -13.622 14.576 -5.767 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -14.918 15.237 -6.793 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -15.701 17.553 -4.938 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -16.837 16.453 -5.753 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -16.910 16.658 -3.987 1.00 0.00 H new ATOM 1041 N ARG A 67 -15.275 12.040 -1.900 1.00 0.00 N ATOM 1042 CA ARG A 67 -14.137 11.395 -1.186 1.00 0.00 C ATOM 1043 C ARG A 67 -13.270 10.632 -2.187 1.00 0.00 C ATOM 1044 O ARG A 67 -13.765 9.879 -3.000 1.00 0.00 O ATOM 1045 CB ARG A 67 -14.790 10.432 -0.194 1.00 0.00 C ATOM 1046 CG ARG A 67 -15.441 11.230 0.938 1.00 0.00 C ATOM 1047 CD ARG A 67 -16.878 10.746 1.145 1.00 0.00 C ATOM 1048 NE ARG A 67 -17.337 11.426 2.389 1.00 0.00 N ATOM 1049 CZ ARG A 67 -18.593 11.366 2.742 1.00 0.00 C ATOM 1050 NH1 ARG A 67 -19.525 11.717 1.901 1.00 0.00 N ATOM 1051 NH2 ARG A 67 -18.915 10.956 3.939 1.00 0.00 N ATOM 0 H ARG A 67 -16.114 11.467 -1.987 1.00 0.00 H new ATOM 0 HA ARG A 67 -13.492 12.116 -0.684 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -15.538 9.823 -0.701 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -14.044 9.749 0.211 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -14.869 11.108 1.858 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -15.435 12.293 0.697 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -17.509 11.008 0.296 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -16.918 9.662 1.250 1.00 0.00 H new ATOM 0 HE ARG A 67 -16.670 11.939 2.965 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -19.274 12.039 0.966 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -20.506 11.670 2.178 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -18.186 10.683 4.598 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -19.896 10.909 4.215 1.00 0.00 H new ATOM 1065 N LEU A 68 -11.982 10.831 -2.150 1.00 0.00 N ATOM 1066 CA LEU A 68 -11.103 10.122 -3.122 1.00 0.00 C ATOM 1067 C LEU A 68 -10.137 9.178 -2.402 1.00 0.00 C ATOM 1068 O LEU A 68 -9.460 9.553 -1.465 1.00 0.00 O ATOM 1069 CB LEU A 68 -10.330 11.230 -3.836 1.00 0.00 C ATOM 1070 CG LEU A 68 -11.185 11.819 -4.961 1.00 0.00 C ATOM 1071 CD1 LEU A 68 -11.350 10.785 -6.077 1.00 0.00 C ATOM 1072 CD2 LEU A 68 -12.562 12.200 -4.417 1.00 0.00 C ATOM 0 H LEU A 68 -11.503 11.448 -1.495 1.00 0.00 H new ATOM 0 HA LEU A 68 -11.679 9.506 -3.813 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -10.058 12.012 -3.126 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -9.400 10.833 -4.244 1.00 0.00 H new ATOM 0 HG LEU A 68 -10.692 12.707 -5.357 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -11.959 11.207 -6.877 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -10.370 10.515 -6.471 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -11.839 9.895 -5.679 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -13.168 12.619 -5.221 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -13.053 11.313 -4.017 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -12.448 12.940 -3.625 1.00 0.00 H new ATOM 1084 N ARG A 69 -10.066 7.954 -2.850 1.00 0.00 N ATOM 1085 CA ARG A 69 -9.142 6.972 -2.219 1.00 0.00 C ATOM 1086 C ARG A 69 -7.953 6.712 -3.150 1.00 0.00 C ATOM 1087 O ARG A 69 -8.041 6.913 -4.345 1.00 0.00 O ATOM 1088 CB ARG A 69 -9.978 5.704 -2.045 1.00 0.00 C ATOM 1089 CG ARG A 69 -9.164 4.653 -1.288 1.00 0.00 C ATOM 1090 CD ARG A 69 -10.059 3.457 -0.959 1.00 0.00 C ATOM 1091 NE ARG A 69 -9.251 2.262 -1.328 1.00 0.00 N ATOM 1092 CZ ARG A 69 -9.734 1.379 -2.159 1.00 0.00 C ATOM 1093 NH1 ARG A 69 -10.985 1.017 -2.071 1.00 0.00 N ATOM 1094 NH2 ARG A 69 -8.966 0.857 -3.076 1.00 0.00 N ATOM 0 H ARG A 69 -10.612 7.591 -3.631 1.00 0.00 H new ATOM 0 HA ARG A 69 -8.737 7.323 -1.270 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -10.894 5.932 -1.499 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -10.276 5.316 -3.019 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -8.315 4.331 -1.891 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -8.759 5.082 -0.371 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -10.326 3.442 0.098 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -10.991 3.494 -1.523 1.00 0.00 H new ATOM 0 HE ARG A 69 -8.320 2.133 -0.931 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -11.584 1.424 -1.353 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -11.363 0.327 -2.720 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -7.988 1.139 -3.143 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -9.344 0.167 -3.725 1.00 0.00 H new ATOM 1108 N ALA A 70 -6.845 6.273 -2.618 1.00 0.00 N ATOM 1109 CA ALA A 70 -5.657 6.011 -3.485 1.00 0.00 C ATOM 1110 C ALA A 70 -5.688 4.576 -4.020 1.00 0.00 C ATOM 1111 O ALA A 70 -6.065 3.653 -3.328 1.00 0.00 O ATOM 1112 CB ALA A 70 -4.443 6.212 -2.576 1.00 0.00 C ATOM 0 H ALA A 70 -6.709 6.085 -1.625 1.00 0.00 H new ATOM 0 HA ALA A 70 -5.634 6.672 -4.351 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -3.530 6.036 -3.144 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -4.441 7.232 -2.192 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -4.492 5.511 -1.743 1.00 0.00 H new ATOM 1118 N ARG A 71 -5.282 4.384 -5.247 1.00 0.00 N ATOM 1119 CA ARG A 71 -5.276 3.009 -5.825 1.00 0.00 C ATOM 1120 C ARG A 71 -3.836 2.579 -6.119 1.00 0.00 C ATOM 1121 O ARG A 71 -3.547 1.413 -6.300 1.00 0.00 O ATOM 1122 CB ARG A 71 -6.086 3.111 -7.120 1.00 0.00 C ATOM 1123 CG ARG A 71 -5.250 3.806 -8.201 1.00 0.00 C ATOM 1124 CD ARG A 71 -5.972 3.709 -9.547 1.00 0.00 C ATOM 1125 NE ARG A 71 -6.273 2.261 -9.719 1.00 0.00 N ATOM 1126 CZ ARG A 71 -5.313 1.381 -9.637 1.00 0.00 C ATOM 1127 NH1 ARG A 71 -4.187 1.582 -10.264 1.00 0.00 N ATOM 1128 NH2 ARG A 71 -5.479 0.299 -8.927 1.00 0.00 N ATOM 0 H ARG A 71 -4.955 5.119 -5.873 1.00 0.00 H new ATOM 0 HA ARG A 71 -5.701 2.270 -5.146 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -6.378 2.116 -7.457 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -7.005 3.670 -6.942 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -5.091 4.851 -7.936 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -4.266 3.341 -8.270 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -6.885 4.305 -9.549 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -5.346 4.081 -10.358 1.00 0.00 H new ATOM 0 HE ARG A 71 -7.229 1.957 -9.901 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -4.056 2.428 -10.819 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -3.437 0.893 -10.199 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -6.359 0.141 -8.436 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -4.729 -0.389 -8.863 1.00 0.00 H new ATOM 1142 N LYS A 72 -2.934 3.521 -6.171 1.00 0.00 N ATOM 1143 CA LYS A 72 -1.511 3.185 -6.455 1.00 0.00 C ATOM 1144 C LYS A 72 -0.595 3.902 -5.459 1.00 0.00 C ATOM 1145 O LYS A 72 -0.537 5.115 -5.419 1.00 0.00 O ATOM 1146 CB LYS A 72 -1.267 3.695 -7.876 1.00 0.00 C ATOM 1147 CG LYS A 72 0.212 3.545 -8.228 1.00 0.00 C ATOM 1148 CD LYS A 72 0.407 2.291 -9.081 1.00 0.00 C ATOM 1149 CE LYS A 72 0.917 1.152 -8.197 1.00 0.00 C ATOM 1150 NZ LYS A 72 0.478 -0.094 -8.883 1.00 0.00 N ATOM 0 H LYS A 72 -3.123 4.513 -6.028 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.306 2.118 -6.364 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.878 3.135 -8.584 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -1.566 4.740 -7.954 1.00 0.00 H new ATOM 0 HG2 LYS A 72 0.559 4.425 -8.770 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.808 3.476 -7.318 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -0.534 2.008 -9.552 1.00 0.00 H new ATOM 0 HD3 LYS A 72 1.117 2.490 -9.883 1.00 0.00 H new ATOM 0 HE2 LYS A 72 2.002 1.186 -8.096 1.00 0.00 H new ATOM 0 HE3 LYS A 72 0.501 1.216 -7.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 0.791 -0.921 -8.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -0.559 -0.102 -8.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 0.895 -0.131 -9.835 1.00 0.00 H new ATOM 1164 N GLU A 73 0.115 3.165 -4.649 1.00 0.00 N ATOM 1165 CA GLU A 73 1.017 3.811 -3.653 1.00 0.00 C ATOM 1166 C GLU A 73 2.098 4.628 -4.366 1.00 0.00 C ATOM 1167 O GLU A 73 3.057 4.092 -4.887 1.00 0.00 O ATOM 1168 CB GLU A 73 1.642 2.656 -2.870 1.00 0.00 C ATOM 1169 CG GLU A 73 2.863 3.164 -2.102 1.00 0.00 C ATOM 1170 CD GLU A 73 4.138 2.623 -2.750 1.00 0.00 C ATOM 1171 OE1 GLU A 73 4.351 1.424 -2.683 1.00 0.00 O ATOM 1172 OE2 GLU A 73 4.881 3.417 -3.305 1.00 0.00 O ATOM 0 H GLU A 73 0.110 2.145 -4.634 1.00 0.00 H new ATOM 0 HA GLU A 73 0.481 4.500 -3.000 1.00 0.00 H new ATOM 0 HB2 GLU A 73 0.913 2.235 -2.178 1.00 0.00 H new ATOM 0 HB3 GLU A 73 1.934 1.857 -3.551 1.00 0.00 H new ATOM 0 HG2 GLU A 73 2.877 4.254 -2.102 1.00 0.00 H new ATOM 0 HG3 GLU A 73 2.809 2.846 -1.061 1.00 0.00 H new ATOM 1179 N CYS A 74 1.951 5.927 -4.388 1.00 0.00 N ATOM 1180 CA CYS A 74 2.966 6.792 -5.063 1.00 0.00 C ATOM 1181 C CYS A 74 2.417 8.211 -5.231 1.00 0.00 C ATOM 1182 O CYS A 74 3.160 9.168 -5.330 1.00 0.00 O ATOM 1183 CB CYS A 74 3.201 6.147 -6.430 1.00 0.00 C ATOM 1184 SG CYS A 74 4.875 5.461 -6.494 1.00 0.00 S ATOM 0 H CYS A 74 1.169 6.428 -3.966 1.00 0.00 H new ATOM 0 HA CYS A 74 3.888 6.869 -4.487 1.00 0.00 H new ATOM 0 HB2 CYS A 74 2.467 5.360 -6.604 1.00 0.00 H new ATOM 0 HB3 CYS A 74 3.069 6.886 -7.220 1.00 0.00 H new ATOM 0 HG CYS A 74 4.939 4.402 -5.743 1.00 0.00 H new ATOM 1190 N TRP A 75 1.120 8.351 -5.271 1.00 0.00 N ATOM 1191 CA TRP A 75 0.517 9.704 -5.440 1.00 0.00 C ATOM 1192 C TRP A 75 0.613 10.499 -4.131 1.00 0.00 C ATOM 1193 O TRP A 75 -0.123 10.258 -3.195 1.00 0.00 O ATOM 1194 CB TRP A 75 -0.946 9.426 -5.823 1.00 0.00 C ATOM 1195 CG TRP A 75 -1.841 10.522 -5.328 1.00 0.00 C ATOM 1196 CD1 TRP A 75 -1.707 11.828 -5.646 1.00 0.00 C ATOM 1197 CD2 TRP A 75 -2.996 10.435 -4.439 1.00 0.00 C ATOM 1198 NE1 TRP A 75 -2.702 12.550 -5.014 1.00 0.00 N ATOM 1199 CE2 TRP A 75 -3.523 11.735 -4.258 1.00 0.00 C ATOM 1200 CE3 TRP A 75 -3.632 9.365 -3.778 1.00 0.00 C ATOM 1201 CZ2 TRP A 75 -4.640 11.969 -3.454 1.00 0.00 C ATOM 1202 CZ3 TRP A 75 -4.758 9.599 -2.969 1.00 0.00 C ATOM 1203 CH2 TRP A 75 -5.259 10.897 -2.808 1.00 0.00 C ATOM 0 H TRP A 75 0.451 7.585 -5.194 1.00 0.00 H new ATOM 0 HA TRP A 75 1.026 10.304 -6.194 1.00 0.00 H new ATOM 0 HB2 TRP A 75 -1.033 9.340 -6.906 1.00 0.00 H new ATOM 0 HB3 TRP A 75 -1.263 8.472 -5.401 1.00 0.00 H new ATOM 0 HD1 TRP A 75 -0.945 12.241 -6.290 1.00 0.00 H new ATOM 0 HE1 TRP A 75 -2.816 13.560 -5.096 1.00 0.00 H new ATOM 0 HE3 TRP A 75 -3.253 8.360 -3.893 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 -5.022 12.972 -3.333 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 -5.240 8.772 -2.468 1.00 0.00 H new ATOM 0 HH2 TRP A 75 -6.124 11.069 -2.184 1.00 0.00 H new ATOM 1214 N ASP A 76 1.503 11.451 -4.063 1.00 0.00 N ATOM 1215 CA ASP A 76 1.625 12.260 -2.815 1.00 0.00 C ATOM 1216 C ASP A 76 0.654 13.444 -2.868 1.00 0.00 C ATOM 1217 O ASP A 76 0.842 14.378 -3.623 1.00 0.00 O ATOM 1218 CB ASP A 76 3.072 12.753 -2.800 1.00 0.00 C ATOM 1219 CG ASP A 76 3.313 13.674 -3.998 1.00 0.00 C ATOM 1220 OD1 ASP A 76 2.982 13.275 -5.102 1.00 0.00 O ATOM 1221 OD2 ASP A 76 3.822 14.762 -3.790 1.00 0.00 O ATOM 0 H ASP A 76 2.148 11.703 -4.812 1.00 0.00 H new ATOM 0 HA ASP A 76 1.385 11.685 -1.920 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.275 13.287 -1.872 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.756 11.905 -2.837 1.00 0.00 H new ATOM 1226 N ARG A 77 -0.377 13.417 -2.070 1.00 0.00 N ATOM 1227 CA ARG A 77 -1.350 14.554 -2.082 1.00 0.00 C ATOM 1228 C ARG A 77 -0.931 15.632 -1.078 1.00 0.00 C ATOM 1229 O ARG A 77 -1.429 16.741 -1.102 1.00 0.00 O ATOM 1230 CB ARG A 77 -2.737 13.979 -1.729 1.00 0.00 C ATOM 1231 CG ARG A 77 -2.636 12.821 -0.727 1.00 0.00 C ATOM 1232 CD ARG A 77 -1.820 13.254 0.493 1.00 0.00 C ATOM 1233 NE ARG A 77 -2.292 12.373 1.597 1.00 0.00 N ATOM 1234 CZ ARG A 77 -3.237 12.780 2.399 1.00 0.00 C ATOM 1235 NH1 ARG A 77 -3.137 13.938 2.992 1.00 0.00 N ATOM 1236 NH2 ARG A 77 -4.281 12.027 2.610 1.00 0.00 N ATOM 0 H ARG A 77 -0.590 12.666 -1.414 1.00 0.00 H new ATOM 0 HA ARG A 77 -1.377 15.026 -3.064 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -3.362 14.768 -1.311 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -3.228 13.631 -2.638 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -3.633 12.510 -0.416 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -2.167 11.959 -1.201 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -0.751 13.131 0.318 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -1.986 14.306 0.727 1.00 0.00 H new ATOM 0 HE ARG A 77 -1.876 11.451 1.726 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -2.320 14.526 2.829 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -3.876 14.255 3.619 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -4.358 11.121 2.148 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -5.020 12.344 3.237 1.00 0.00 H new ATOM 1250 N ASP A 78 -0.017 15.325 -0.199 1.00 0.00 N ATOM 1251 CA ASP A 78 0.431 16.342 0.796 1.00 0.00 C ATOM 1252 C ASP A 78 1.949 16.518 0.727 1.00 0.00 C ATOM 1253 O ASP A 78 2.557 17.109 1.598 1.00 0.00 O ATOM 1254 CB ASP A 78 0.016 15.785 2.158 1.00 0.00 C ATOM 1255 CG ASP A 78 -1.037 16.702 2.784 1.00 0.00 C ATOM 1256 OD1 ASP A 78 -0.742 17.872 2.964 1.00 0.00 O ATOM 1257 OD2 ASP A 78 -2.119 16.219 3.073 1.00 0.00 O ATOM 0 H ASP A 78 0.439 14.415 -0.126 1.00 0.00 H new ATOM 0 HA ASP A 78 -0.011 17.321 0.608 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -0.385 14.778 2.044 1.00 0.00 H new ATOM 0 HB3 ASP A 78 0.884 15.711 2.813 1.00 0.00 H new ATOM 1262 N GLY A 79 2.568 16.009 -0.302 1.00 0.00 N ATOM 1263 CA GLY A 79 4.045 16.147 -0.427 1.00 0.00 C ATOM 1264 C GLY A 79 4.736 15.192 0.549 1.00 0.00 C ATOM 1265 O GLY A 79 5.883 15.375 0.905 1.00 0.00 O ATOM 0 H GLY A 79 2.114 15.503 -1.062 1.00 0.00 H new ATOM 0 HA2 GLY A 79 4.356 15.926 -1.448 1.00 0.00 H new ATOM 0 HA3 GLY A 79 4.343 17.174 -0.218 1.00 0.00 H new ATOM 1269 N LYS A 80 4.049 14.170 0.982 1.00 0.00 N ATOM 1270 CA LYS A 80 4.671 13.202 1.931 1.00 0.00 C ATOM 1271 C LYS A 80 4.691 11.802 1.313 1.00 0.00 C ATOM 1272 O LYS A 80 5.274 10.883 1.853 1.00 0.00 O ATOM 1273 CB LYS A 80 3.779 13.231 3.174 1.00 0.00 C ATOM 1274 CG LYS A 80 3.864 14.610 3.831 1.00 0.00 C ATOM 1275 CD LYS A 80 4.979 14.612 4.880 1.00 0.00 C ATOM 1276 CE LYS A 80 4.494 13.901 6.145 1.00 0.00 C ATOM 1277 NZ LYS A 80 5.735 13.556 6.893 1.00 0.00 N ATOM 0 H LYS A 80 3.085 13.963 0.720 1.00 0.00 H new ATOM 0 HA LYS A 80 5.703 13.460 2.169 1.00 0.00 H new ATOM 0 HB2 LYS A 80 2.747 13.010 2.900 1.00 0.00 H new ATOM 0 HB3 LYS A 80 4.093 12.461 3.878 1.00 0.00 H new ATOM 0 HG2 LYS A 80 4.060 15.372 3.076 1.00 0.00 H new ATOM 0 HG3 LYS A 80 2.911 14.861 4.298 1.00 0.00 H new ATOM 0 HD2 LYS A 80 5.864 14.112 4.486 1.00 0.00 H new ATOM 0 HD3 LYS A 80 5.270 15.636 5.115 1.00 0.00 H new ATOM 0 HE2 LYS A 80 3.844 14.546 6.736 1.00 0.00 H new ATOM 0 HE3 LYS A 80 3.920 13.008 5.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 5.484 13.065 7.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 6.331 12.936 6.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 6.258 14.426 7.119 1.00 0.00 H new ATOM 1291 N GLU A 81 4.062 11.636 0.182 1.00 0.00 N ATOM 1292 CA GLU A 81 4.046 10.301 -0.480 1.00 0.00 C ATOM 1293 C GLU A 81 3.384 9.264 0.434 1.00 0.00 C ATOM 1294 O GLU A 81 3.785 9.072 1.565 1.00 0.00 O ATOM 1295 CB GLU A 81 5.517 9.955 -0.714 1.00 0.00 C ATOM 1296 CG GLU A 81 6.221 11.127 -1.407 1.00 0.00 C ATOM 1297 CD GLU A 81 6.076 10.991 -2.923 1.00 0.00 C ATOM 1298 OE1 GLU A 81 5.536 9.988 -3.359 1.00 0.00 O ATOM 1299 OE2 GLU A 81 6.507 11.892 -3.624 1.00 0.00 O ATOM 0 H GLU A 81 3.557 12.370 -0.314 1.00 0.00 H new ATOM 0 HA GLU A 81 3.479 10.308 -1.411 1.00 0.00 H new ATOM 0 HB2 GLU A 81 6.004 9.736 0.236 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.596 9.057 -1.327 1.00 0.00 H new ATOM 0 HG2 GLU A 81 5.790 12.071 -1.074 1.00 0.00 H new ATOM 0 HG3 GLU A 81 7.276 11.144 -1.133 1.00 0.00 H new ATOM 1306 N ARG A 82 2.368 8.599 -0.048 1.00 0.00 N ATOM 1307 CA ARG A 82 1.674 7.580 0.793 1.00 0.00 C ATOM 1308 C ARG A 82 1.271 6.368 -0.060 1.00 0.00 C ATOM 1309 O ARG A 82 1.524 6.323 -1.247 1.00 0.00 O ATOM 1310 CB ARG A 82 0.438 8.296 1.336 1.00 0.00 C ATOM 1311 CG ARG A 82 0.410 8.190 2.862 1.00 0.00 C ATOM 1312 CD ARG A 82 1.530 9.047 3.457 1.00 0.00 C ATOM 1313 NE ARG A 82 1.281 9.041 4.924 1.00 0.00 N ATOM 1314 CZ ARG A 82 0.720 10.072 5.493 1.00 0.00 C ATOM 1315 NH1 ARG A 82 1.183 11.273 5.267 1.00 0.00 N ATOM 1316 NH2 ARG A 82 -0.302 9.905 6.287 1.00 0.00 N ATOM 0 H ARG A 82 1.989 8.717 -0.987 1.00 0.00 H new ATOM 0 HA ARG A 82 2.309 7.200 1.593 1.00 0.00 H new ATOM 0 HB2 ARG A 82 0.451 9.343 1.035 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -0.465 7.854 0.914 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -0.556 8.522 3.242 1.00 0.00 H new ATOM 0 HG3 ARG A 82 0.533 7.151 3.167 1.00 0.00 H new ATOM 0 HD2 ARG A 82 2.511 8.634 3.221 1.00 0.00 H new ATOM 0 HD3 ARG A 82 1.507 10.061 3.057 1.00 0.00 H new ATOM 0 HE ARG A 82 1.549 8.232 5.484 1.00 0.00 H new ATOM 0 HH11 ARG A 82 1.982 11.403 4.646 1.00 0.00 H new ATOM 0 HH12 ARG A 82 0.745 12.080 5.711 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -0.663 8.967 6.463 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -0.740 10.712 6.731 1.00 0.00 H new ATOM 1330 N VAL A 83 0.658 5.380 0.541 1.00 0.00 N ATOM 1331 CA VAL A 83 0.254 4.165 -0.233 1.00 0.00 C ATOM 1332 C VAL A 83 -1.209 4.254 -0.683 1.00 0.00 C ATOM 1333 O VAL A 83 -1.892 5.228 -0.434 1.00 0.00 O ATOM 1334 CB VAL A 83 0.438 3.004 0.742 1.00 0.00 C ATOM 1335 CG1 VAL A 83 1.831 3.081 1.365 1.00 0.00 C ATOM 1336 CG2 VAL A 83 -0.620 3.096 1.843 1.00 0.00 C ATOM 0 H VAL A 83 0.420 5.361 1.533 1.00 0.00 H new ATOM 0 HA VAL A 83 0.847 4.049 -1.140 1.00 0.00 H new ATOM 0 HB VAL A 83 0.330 2.058 0.211 1.00 0.00 H new ATOM 0 HG11 VAL A 83 1.964 2.253 2.061 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.585 3.020 0.580 1.00 0.00 H new ATOM 0 HG13 VAL A 83 1.939 4.025 1.899 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -0.492 2.269 2.541 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -0.510 4.041 2.376 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -1.614 3.044 1.398 1.00 0.00 H new ATOM 1346 N THR A 84 -1.690 3.234 -1.347 1.00 0.00 N ATOM 1347 CA THR A 84 -3.106 3.239 -1.823 1.00 0.00 C ATOM 1348 C THR A 84 -4.067 3.436 -0.648 1.00 0.00 C ATOM 1349 O THR A 84 -5.187 3.874 -0.816 1.00 0.00 O ATOM 1350 CB THR A 84 -3.322 1.862 -2.455 1.00 0.00 C ATOM 1351 OG1 THR A 84 -3.370 0.877 -1.431 1.00 0.00 O ATOM 1352 CG2 THR A 84 -2.172 1.547 -3.412 1.00 0.00 C ATOM 0 H THR A 84 -1.160 2.394 -1.581 1.00 0.00 H new ATOM 0 HA THR A 84 -3.293 4.049 -2.528 1.00 0.00 H new ATOM 0 HB THR A 84 -4.261 1.861 -3.009 1.00 0.00 H new ATOM 0 HG1 THR A 84 -3.510 -0.006 -1.833 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.330 0.566 -3.860 1.00 0.00 H new ATOM 0 HG22 THR A 84 -2.135 2.302 -4.197 1.00 0.00 H new ATOM 0 HG23 THR A 84 -1.231 1.548 -2.862 1.00 0.00 H new ATOM 1360 N GLY A 85 -3.639 3.112 0.539 1.00 0.00 N ATOM 1361 CA GLY A 85 -4.531 3.277 1.722 1.00 0.00 C ATOM 1362 C GLY A 85 -4.823 4.761 1.936 1.00 0.00 C ATOM 1363 O GLY A 85 -5.833 5.129 2.502 1.00 0.00 O ATOM 0 H GLY A 85 -2.711 2.740 0.743 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -5.462 2.731 1.568 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -4.058 2.857 2.609 1.00 0.00 H new ATOM 1367 N GLU A 86 -3.944 5.616 1.492 1.00 0.00 N ATOM 1368 CA GLU A 86 -4.173 7.077 1.676 1.00 0.00 C ATOM 1369 C GLU A 86 -5.393 7.538 0.871 1.00 0.00 C ATOM 1370 O GLU A 86 -5.744 6.956 -0.136 1.00 0.00 O ATOM 1371 CB GLU A 86 -2.885 7.741 1.173 1.00 0.00 C ATOM 1372 CG GLU A 86 -2.974 8.027 -0.330 1.00 0.00 C ATOM 1373 CD GLU A 86 -1.734 8.805 -0.774 1.00 0.00 C ATOM 1374 OE1 GLU A 86 -1.521 9.888 -0.252 1.00 0.00 O ATOM 1375 OE2 GLU A 86 -1.019 8.306 -1.627 1.00 0.00 O ATOM 0 H GLU A 86 -3.079 5.368 1.011 1.00 0.00 H new ATOM 0 HA GLU A 86 -4.383 7.339 2.713 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -2.713 8.671 1.716 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -2.033 7.092 1.375 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -3.048 7.092 -0.885 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -3.875 8.601 -0.549 1.00 0.00 H new ATOM 1382 N GLU A 87 -6.035 8.583 1.312 1.00 0.00 N ATOM 1383 CA GLU A 87 -7.230 9.098 0.583 1.00 0.00 C ATOM 1384 C GLU A 87 -7.475 10.560 0.965 1.00 0.00 C ATOM 1385 O GLU A 87 -7.198 10.972 2.074 1.00 0.00 O ATOM 1386 CB GLU A 87 -8.390 8.218 1.049 1.00 0.00 C ATOM 1387 CG GLU A 87 -8.522 8.312 2.570 1.00 0.00 C ATOM 1388 CD GLU A 87 -9.681 9.243 2.928 1.00 0.00 C ATOM 1389 OE1 GLU A 87 -10.757 9.053 2.386 1.00 0.00 O ATOM 1390 OE2 GLU A 87 -9.473 10.131 3.738 1.00 0.00 O ATOM 0 H GLU A 87 -5.783 9.106 2.151 1.00 0.00 H new ATOM 0 HA GLU A 87 -7.108 9.063 -0.500 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -9.317 8.537 0.572 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -8.218 7.184 0.751 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -8.694 7.322 2.992 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -7.594 8.686 3.003 1.00 0.00 H new ATOM 1397 N TRP A 88 -7.986 11.351 0.063 1.00 0.00 N ATOM 1398 CA TRP A 88 -8.235 12.784 0.397 1.00 0.00 C ATOM 1399 C TRP A 88 -9.627 13.213 -0.091 1.00 0.00 C ATOM 1400 O TRP A 88 -10.107 12.765 -1.114 1.00 0.00 O ATOM 1401 CB TRP A 88 -7.088 13.551 -0.293 1.00 0.00 C ATOM 1402 CG TRP A 88 -7.583 14.373 -1.446 1.00 0.00 C ATOM 1403 CD1 TRP A 88 -8.115 13.876 -2.585 1.00 0.00 C ATOM 1404 CD2 TRP A 88 -7.583 15.823 -1.592 1.00 0.00 C ATOM 1405 NE1 TRP A 88 -8.445 14.929 -3.420 1.00 0.00 N ATOM 1406 CE2 TRP A 88 -8.137 16.151 -2.852 1.00 0.00 C ATOM 1407 CE3 TRP A 88 -7.161 16.875 -0.759 1.00 0.00 C ATOM 1408 CZ2 TRP A 88 -8.266 17.477 -3.271 1.00 0.00 C ATOM 1409 CZ3 TRP A 88 -7.290 18.210 -1.178 1.00 0.00 C ATOM 1410 CH2 TRP A 88 -7.843 18.511 -2.431 1.00 0.00 C ATOM 0 H TRP A 88 -8.241 11.072 -0.884 1.00 0.00 H new ATOM 0 HA TRP A 88 -8.240 12.983 1.469 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -6.597 14.200 0.432 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -6.338 12.843 -0.646 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -8.259 12.829 -2.807 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -8.865 14.817 -4.343 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -6.735 16.655 0.209 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -8.690 17.702 -4.238 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -6.961 19.010 -0.531 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -7.942 19.539 -2.746 1.00 0.00 H new ATOM 1421 N LEU A 89 -10.278 14.070 0.648 1.00 0.00 N ATOM 1422 CA LEU A 89 -11.642 14.529 0.253 1.00 0.00 C ATOM 1423 C LEU A 89 -11.553 15.839 -0.535 1.00 0.00 C ATOM 1424 O LEU A 89 -10.785 16.722 -0.205 1.00 0.00 O ATOM 1425 CB LEU A 89 -12.373 14.736 1.586 1.00 0.00 C ATOM 1426 CG LEU A 89 -13.703 15.472 1.372 1.00 0.00 C ATOM 1427 CD1 LEU A 89 -13.444 16.967 1.162 1.00 0.00 C ATOM 1428 CD2 LEU A 89 -14.423 14.902 0.150 1.00 0.00 C ATOM 0 H LEU A 89 -9.922 14.475 1.514 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.158 13.818 -0.392 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -12.558 13.771 2.057 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -11.742 15.307 2.267 1.00 0.00 H new ATOM 0 HG LEU A 89 -14.328 15.335 2.254 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -14.392 17.483 1.011 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -12.944 17.376 2.040 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -12.811 17.107 0.286 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -15.366 15.429 0.005 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -13.797 15.028 -0.733 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -14.621 13.841 0.306 1.00 0.00 H new ATOM 1440 N VAL A 90 -12.333 15.974 -1.574 1.00 0.00 N ATOM 1441 CA VAL A 90 -12.289 17.229 -2.378 1.00 0.00 C ATOM 1442 C VAL A 90 -13.600 18.006 -2.241 1.00 0.00 C ATOM 1443 O VAL A 90 -14.680 17.458 -2.372 1.00 0.00 O ATOM 1444 CB VAL A 90 -12.092 16.772 -3.820 1.00 0.00 C ATOM 1445 CG1 VAL A 90 -11.745 17.980 -4.691 1.00 0.00 C ATOM 1446 CG2 VAL A 90 -10.952 15.757 -3.881 1.00 0.00 C ATOM 0 H VAL A 90 -12.997 15.272 -1.900 1.00 0.00 H new ATOM 0 HA VAL A 90 -11.493 17.895 -2.045 1.00 0.00 H new ATOM 0 HB VAL A 90 -13.009 16.310 -4.185 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -11.604 17.656 -5.722 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -12.557 18.706 -4.647 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -10.827 18.440 -4.326 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -10.811 15.430 -4.911 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -10.034 16.219 -3.518 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -11.197 14.897 -3.258 1.00 0.00 H new ATOM 1456 N THR A 91 -13.508 19.281 -1.979 1.00 0.00 N ATOM 1457 CA THR A 91 -14.731 20.114 -1.834 1.00 0.00 C ATOM 1458 C THR A 91 -14.550 21.432 -2.592 1.00 0.00 C ATOM 1459 O THR A 91 -14.846 22.496 -2.085 1.00 0.00 O ATOM 1460 CB THR A 91 -14.841 20.369 -0.334 1.00 0.00 C ATOM 1461 OG1 THR A 91 -14.691 19.143 0.367 1.00 0.00 O ATOM 1462 CG2 THR A 91 -16.204 20.976 -0.024 1.00 0.00 C ATOM 0 H THR A 91 -12.629 19.784 -1.858 1.00 0.00 H new ATOM 0 HA THR A 91 -15.623 19.634 -2.235 1.00 0.00 H new ATOM 0 HB THR A 91 -14.058 21.060 -0.021 1.00 0.00 H new ATOM 0 HG1 THR A 91 -15.289 19.135 1.144 1.00 0.00 H new ATOM 0 HG21 THR A 91 -16.285 21.159 1.047 1.00 0.00 H new ATOM 0 HG22 THR A 91 -16.314 21.917 -0.563 1.00 0.00 H new ATOM 0 HG23 THR A 91 -16.989 20.286 -0.335 1.00 0.00 H new ATOM 1470 N THR A 92 -14.054 21.371 -3.797 1.00 0.00 N ATOM 1471 CA THR A 92 -13.839 22.621 -4.583 1.00 0.00 C ATOM 1472 C THR A 92 -15.140 23.070 -5.254 1.00 0.00 C ATOM 1473 O THR A 92 -15.797 22.308 -5.935 1.00 0.00 O ATOM 1474 CB THR A 92 -12.793 22.249 -5.635 1.00 0.00 C ATOM 1475 OG1 THR A 92 -11.967 21.209 -5.130 1.00 0.00 O ATOM 1476 CG2 THR A 92 -11.936 23.473 -5.961 1.00 0.00 C ATOM 0 H THR A 92 -13.788 20.509 -4.273 1.00 0.00 H new ATOM 0 HA THR A 92 -13.513 23.449 -3.953 1.00 0.00 H new ATOM 0 HB THR A 92 -13.293 21.909 -6.542 1.00 0.00 H new ATOM 0 HG1 THR A 92 -11.224 21.598 -4.623 1.00 0.00 H new ATOM 0 HG21 THR A 92 -11.191 23.206 -6.711 1.00 0.00 H new ATOM 0 HG22 THR A 92 -12.572 24.269 -6.348 1.00 0.00 H new ATOM 0 HG23 THR A 92 -11.434 23.817 -5.057 1.00 0.00 H new ATOM 1484 N VAL A 93 -15.510 24.310 -5.074 1.00 0.00 N ATOM 1485 CA VAL A 93 -16.760 24.818 -5.709 1.00 0.00 C ATOM 1486 C VAL A 93 -16.559 24.926 -7.221 1.00 0.00 C ATOM 1487 O VAL A 93 -15.758 25.708 -7.693 1.00 0.00 O ATOM 1488 CB VAL A 93 -16.980 26.205 -5.100 1.00 0.00 C ATOM 1489 CG1 VAL A 93 -18.291 26.792 -5.628 1.00 0.00 C ATOM 1490 CG2 VAL A 93 -17.053 26.089 -3.576 1.00 0.00 C ATOM 0 H VAL A 93 -15.000 24.993 -4.514 1.00 0.00 H new ATOM 0 HA VAL A 93 -17.613 24.161 -5.538 1.00 0.00 H new ATOM 0 HB VAL A 93 -16.151 26.857 -5.376 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -18.448 27.780 -5.195 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -18.241 26.876 -6.714 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -19.119 26.139 -5.352 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -17.210 27.077 -3.143 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -17.881 25.436 -3.300 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -16.120 25.671 -3.198 1.00 0.00 H new ATOM 1500 N GLY A 94 -17.266 24.141 -7.987 1.00 0.00 N ATOM 1501 CA GLY A 94 -17.089 24.205 -9.465 1.00 0.00 C ATOM 1502 C GLY A 94 -15.620 23.944 -9.788 1.00 0.00 C ATOM 1503 O GLY A 94 -14.789 24.825 -9.698 1.00 0.00 O ATOM 0 H GLY A 94 -17.953 23.463 -7.657 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -17.722 23.465 -9.955 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -17.392 25.182 -9.841 1.00 0.00 H new ATOM 1507 N ALA A 95 -15.285 22.736 -10.147 1.00 0.00 N ATOM 1508 CA ALA A 95 -13.861 22.426 -10.456 1.00 0.00 C ATOM 1509 C ALA A 95 -13.682 20.929 -10.729 1.00 0.00 C ATOM 1510 O ALA A 95 -14.630 20.171 -10.737 1.00 0.00 O ATOM 1511 CB ALA A 95 -13.102 22.831 -9.196 1.00 0.00 C ATOM 0 H ALA A 95 -15.932 21.953 -10.240 1.00 0.00 H new ATOM 0 HA ALA A 95 -13.506 22.949 -11.344 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -12.038 22.637 -9.334 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -13.255 23.893 -9.005 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -13.470 22.253 -8.348 1.00 0.00 H new ATOM 1517 N TYR A 96 -12.467 20.500 -10.954 1.00 0.00 N ATOM 1518 CA TYR A 96 -12.224 19.054 -11.232 1.00 0.00 C ATOM 1519 C TYR A 96 -10.858 18.624 -10.684 1.00 0.00 C ATOM 1520 O TYR A 96 -9.831 18.887 -11.277 1.00 0.00 O ATOM 1521 CB TYR A 96 -12.244 18.947 -12.760 1.00 0.00 C ATOM 1522 CG TYR A 96 -12.655 17.554 -13.178 1.00 0.00 C ATOM 1523 CD1 TYR A 96 -12.553 16.488 -12.277 1.00 0.00 C ATOM 1524 CD2 TYR A 96 -13.135 17.330 -14.475 1.00 0.00 C ATOM 1525 CE1 TYR A 96 -12.933 15.198 -12.672 1.00 0.00 C ATOM 1526 CE2 TYR A 96 -13.515 16.041 -14.869 1.00 0.00 C ATOM 1527 CZ TYR A 96 -13.413 14.976 -13.967 1.00 0.00 C ATOM 1528 OH TYR A 96 -13.786 13.706 -14.356 1.00 0.00 O ATOM 0 H TYR A 96 -11.634 21.088 -10.957 1.00 0.00 H new ATOM 0 HA TYR A 96 -12.967 18.411 -10.760 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -12.937 19.679 -13.174 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -11.258 19.179 -13.161 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -12.182 16.659 -11.277 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -13.212 18.152 -15.171 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -12.855 14.375 -11.977 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -13.887 15.869 -15.868 1.00 0.00 H new ATOM 0 HH TYR A 96 -14.097 13.727 -15.285 1.00 0.00 H new ATOM 1538 N LEU A 97 -10.837 17.960 -9.560 1.00 0.00 N ATOM 1539 CA LEU A 97 -9.537 17.508 -8.981 1.00 0.00 C ATOM 1540 C LEU A 97 -9.580 16.002 -8.708 1.00 0.00 C ATOM 1541 O LEU A 97 -9.632 15.576 -7.571 1.00 0.00 O ATOM 1542 CB LEU A 97 -9.389 18.287 -7.672 1.00 0.00 C ATOM 1543 CG LEU A 97 -9.746 19.757 -7.904 1.00 0.00 C ATOM 1544 CD1 LEU A 97 -9.776 20.494 -6.564 1.00 0.00 C ATOM 1545 CD2 LEU A 97 -8.694 20.397 -8.812 1.00 0.00 C ATOM 0 H LEU A 97 -11.663 17.710 -9.017 1.00 0.00 H new ATOM 0 HA LEU A 97 -8.700 17.687 -9.655 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -10.040 17.861 -6.908 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.367 18.205 -7.302 1.00 0.00 H new ATOM 0 HG LEU A 97 -10.726 19.823 -8.376 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -10.030 21.541 -6.730 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -10.523 20.038 -5.914 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -8.796 20.429 -6.091 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -8.946 21.444 -8.979 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -7.715 20.330 -8.338 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -8.671 19.873 -9.767 1.00 0.00 H new ATOM 1557 N PRO A 98 -9.562 15.244 -9.772 1.00 0.00 N ATOM 1558 CA PRO A 98 -9.605 13.768 -9.663 1.00 0.00 C ATOM 1559 C PRO A 98 -8.210 13.198 -9.369 1.00 0.00 C ATOM 1560 O PRO A 98 -7.964 12.021 -9.546 1.00 0.00 O ATOM 1561 CB PRO A 98 -10.086 13.328 -11.042 1.00 0.00 C ATOM 1562 CG PRO A 98 -9.691 14.433 -11.978 1.00 0.00 C ATOM 1563 CD PRO A 98 -9.506 15.693 -11.166 1.00 0.00 C ATOM 0 HA PRO A 98 -10.246 13.421 -8.853 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -9.627 12.384 -11.334 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -11.165 13.174 -11.050 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -8.769 14.178 -12.500 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -10.458 14.580 -12.739 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -8.553 16.173 -11.390 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -10.288 16.421 -11.380 1.00 0.00 H new ATOM 1571 N ALA A 99 -7.297 14.019 -8.921 1.00 0.00 N ATOM 1572 CA ALA A 99 -5.923 13.519 -8.618 1.00 0.00 C ATOM 1573 C ALA A 99 -5.434 12.579 -9.723 1.00 0.00 C ATOM 1574 O ALA A 99 -5.974 12.551 -10.811 1.00 0.00 O ATOM 1575 CB ALA A 99 -6.054 12.773 -7.295 1.00 0.00 C ATOM 0 H ALA A 99 -7.443 15.014 -8.752 1.00 0.00 H new ATOM 0 HA ALA A 99 -5.198 14.331 -8.558 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -5.082 12.374 -7.004 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -6.411 13.457 -6.525 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -6.763 11.953 -7.408 1.00 0.00 H new ATOM 1581 N VAL A 100 -4.400 11.824 -9.461 1.00 0.00 N ATOM 1582 CA VAL A 100 -3.865 10.907 -10.514 1.00 0.00 C ATOM 1583 C VAL A 100 -4.005 9.429 -10.105 1.00 0.00 C ATOM 1584 O VAL A 100 -4.394 8.601 -10.905 1.00 0.00 O ATOM 1585 CB VAL A 100 -2.375 11.266 -10.693 1.00 0.00 C ATOM 1586 CG1 VAL A 100 -2.118 11.634 -12.154 1.00 0.00 C ATOM 1587 CG2 VAL A 100 -1.977 12.459 -9.809 1.00 0.00 C ATOM 0 H VAL A 100 -3.904 11.801 -8.570 1.00 0.00 H new ATOM 0 HA VAL A 100 -4.426 11.031 -11.440 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.781 10.400 -10.401 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -1.066 11.889 -12.286 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -2.369 10.787 -12.792 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -2.735 12.490 -12.428 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -0.922 12.687 -9.959 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -2.577 13.328 -10.079 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -2.150 12.210 -8.762 1.00 0.00 H new ATOM 1597 N PHE A 101 -3.675 9.077 -8.889 1.00 0.00 N ATOM 1598 CA PHE A 101 -3.781 7.637 -8.490 1.00 0.00 C ATOM 1599 C PHE A 101 -4.911 7.403 -7.480 1.00 0.00 C ATOM 1600 O PHE A 101 -4.758 6.640 -6.546 1.00 0.00 O ATOM 1601 CB PHE A 101 -2.443 7.291 -7.835 1.00 0.00 C ATOM 1602 CG PHE A 101 -1.312 7.436 -8.827 1.00 0.00 C ATOM 1603 CD1 PHE A 101 -1.532 7.206 -10.191 1.00 0.00 C ATOM 1604 CD2 PHE A 101 -0.037 7.796 -8.375 1.00 0.00 C ATOM 1605 CE1 PHE A 101 -0.475 7.337 -11.100 1.00 0.00 C ATOM 1606 CE2 PHE A 101 1.018 7.927 -9.283 1.00 0.00 C ATOM 1607 CZ PHE A 101 0.800 7.698 -10.646 1.00 0.00 C ATOM 0 H PHE A 101 -3.341 9.711 -8.163 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.002 7.019 -9.360 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.270 7.945 -6.980 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -2.471 6.270 -7.454 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -2.515 6.928 -10.541 1.00 0.00 H new ATOM 0 HD2 PHE A 101 0.132 7.973 -7.323 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -0.643 7.160 -12.152 1.00 0.00 H new ATOM 0 HE2 PHE A 101 2.001 8.205 -8.932 1.00 0.00 H new ATOM 0 HZ PHE A 101 1.615 7.800 -11.348 1.00 0.00 H new ATOM 1617 N GLU A 102 -6.040 8.028 -7.650 1.00 0.00 N ATOM 1618 CA GLU A 102 -7.153 7.794 -6.684 1.00 0.00 C ATOM 1619 C GLU A 102 -8.498 7.761 -7.410 1.00 0.00 C ATOM 1620 O GLU A 102 -8.613 8.170 -8.547 1.00 0.00 O ATOM 1621 CB GLU A 102 -7.100 8.962 -5.696 1.00 0.00 C ATOM 1622 CG GLU A 102 -7.063 10.286 -6.457 1.00 0.00 C ATOM 1623 CD GLU A 102 -8.488 10.793 -6.683 1.00 0.00 C ATOM 1624 OE1 GLU A 102 -9.179 10.218 -7.507 1.00 0.00 O ATOM 1625 OE2 GLU A 102 -8.861 11.756 -6.034 1.00 0.00 O ATOM 0 H GLU A 102 -6.242 8.683 -8.405 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.047 6.836 -6.175 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -7.970 8.934 -5.040 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -6.219 8.873 -5.061 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -6.490 11.023 -5.895 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -6.559 10.152 -7.414 1.00 0.00 H new ATOM 1632 N GLU A 103 -9.518 7.279 -6.754 1.00 0.00 N ATOM 1633 CA GLU A 103 -10.861 7.221 -7.397 1.00 0.00 C ATOM 1634 C GLU A 103 -11.915 7.805 -6.455 1.00 0.00 C ATOM 1635 O GLU A 103 -11.717 7.881 -5.259 1.00 0.00 O ATOM 1636 CB GLU A 103 -11.124 5.734 -7.639 1.00 0.00 C ATOM 1637 CG GLU A 103 -11.652 5.533 -9.060 1.00 0.00 C ATOM 1638 CD GLU A 103 -11.982 4.054 -9.275 1.00 0.00 C ATOM 1639 OE1 GLU A 103 -11.866 3.298 -8.324 1.00 0.00 O ATOM 1640 OE2 GLU A 103 -12.341 3.703 -10.387 1.00 0.00 O ATOM 0 H GLU A 103 -9.479 6.922 -5.799 1.00 0.00 H new ATOM 0 HA GLU A 103 -10.903 7.795 -8.323 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -10.206 5.164 -7.497 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -11.847 5.359 -6.915 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -12.542 6.142 -9.219 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -10.908 5.860 -9.786 1.00 0.00 H new ATOM 1647 N VAL A 104 -13.033 8.221 -6.979 1.00 0.00 N ATOM 1648 CA VAL A 104 -14.090 8.799 -6.103 1.00 0.00 C ATOM 1649 C VAL A 104 -14.915 7.687 -5.457 1.00 0.00 C ATOM 1650 O VAL A 104 -15.210 6.679 -6.069 1.00 0.00 O ATOM 1651 CB VAL A 104 -14.968 9.636 -7.031 1.00 0.00 C ATOM 1652 CG1 VAL A 104 -14.090 10.568 -7.863 1.00 0.00 C ATOM 1653 CG2 VAL A 104 -15.756 8.709 -7.960 1.00 0.00 C ATOM 0 H VAL A 104 -13.261 8.186 -7.973 1.00 0.00 H new ATOM 0 HA VAL A 104 -13.666 9.393 -5.294 1.00 0.00 H new ATOM 0 HB VAL A 104 -15.662 10.230 -6.436 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -14.718 11.165 -8.525 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -13.531 11.228 -7.201 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -13.394 9.977 -8.458 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -16.383 9.305 -8.623 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -15.062 8.114 -8.554 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -16.384 8.046 -7.365 1.00 0.00 H new ATOM 1663 N LEU A 105 -15.296 7.868 -4.225 1.00 0.00 N ATOM 1664 CA LEU A 105 -16.112 6.833 -3.534 1.00 0.00 C ATOM 1665 C LEU A 105 -17.597 7.130 -3.755 1.00 0.00 C ATOM 1666 O LEU A 105 -18.452 6.297 -3.524 1.00 0.00 O ATOM 1667 CB LEU A 105 -15.742 6.963 -2.053 1.00 0.00 C ATOM 1668 CG LEU A 105 -14.407 6.256 -1.781 1.00 0.00 C ATOM 1669 CD1 LEU A 105 -13.409 6.569 -2.899 1.00 0.00 C ATOM 1670 CD2 LEU A 105 -13.837 6.748 -0.450 1.00 0.00 C ATOM 0 H LEU A 105 -15.077 8.691 -3.664 1.00 0.00 H new ATOM 0 HA LEU A 105 -15.925 5.825 -3.904 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -15.668 8.015 -1.779 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -16.526 6.527 -1.434 1.00 0.00 H new ATOM 0 HG LEU A 105 -14.576 5.180 -1.741 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -12.465 6.063 -2.696 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -13.809 6.223 -3.852 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -13.241 7.645 -2.946 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -12.889 6.248 -0.253 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -13.676 7.825 -0.499 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -14.539 6.522 0.352 1.00 0.00 H new ATOM 1682 N ASP A 106 -17.902 8.319 -4.212 1.00 0.00 N ATOM 1683 CA ASP A 106 -19.326 8.703 -4.466 1.00 0.00 C ATOM 1684 C ASP A 106 -19.440 10.224 -4.601 1.00 0.00 C ATOM 1685 O ASP A 106 -18.452 10.931 -4.629 1.00 0.00 O ATOM 1686 CB ASP A 106 -20.109 8.219 -3.243 1.00 0.00 C ATOM 1687 CG ASP A 106 -20.967 7.014 -3.631 1.00 0.00 C ATOM 1688 OD1 ASP A 106 -20.752 6.480 -4.707 1.00 0.00 O ATOM 1689 OD2 ASP A 106 -21.826 6.645 -2.847 1.00 0.00 O ATOM 0 H ASP A 106 -17.219 9.047 -4.422 1.00 0.00 H new ATOM 0 HA ASP A 106 -19.708 8.263 -5.387 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -19.422 7.947 -2.442 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -20.741 9.021 -2.862 1.00 0.00 H new ATOM 1694 N LEU A 107 -20.639 10.736 -4.681 1.00 0.00 N ATOM 1695 CA LEU A 107 -20.811 12.211 -4.811 1.00 0.00 C ATOM 1696 C LEU A 107 -21.742 12.730 -3.713 1.00 0.00 C ATOM 1697 O LEU A 107 -22.809 12.194 -3.487 1.00 0.00 O ATOM 1698 CB LEU A 107 -21.441 12.415 -6.189 1.00 0.00 C ATOM 1699 CG LEU A 107 -22.747 11.623 -6.275 1.00 0.00 C ATOM 1700 CD1 LEU A 107 -23.888 12.564 -6.665 1.00 0.00 C ATOM 1701 CD2 LEU A 107 -22.607 10.525 -7.331 1.00 0.00 C ATOM 0 H LEU A 107 -21.505 10.197 -4.662 1.00 0.00 H new ATOM 0 HA LEU A 107 -19.869 12.749 -4.710 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -21.634 13.474 -6.359 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -20.752 12.087 -6.968 1.00 0.00 H new ATOM 0 HG LEU A 107 -22.964 11.171 -5.307 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -24.819 12.001 -6.727 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -23.987 13.347 -5.913 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -23.672 13.016 -7.633 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -23.537 9.960 -7.394 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -22.391 10.977 -8.299 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -21.793 9.855 -7.054 1.00 0.00 H new ATOM 1713 N VAL A 108 -21.348 13.767 -3.024 1.00 0.00 N ATOM 1714 CA VAL A 108 -22.217 14.308 -1.940 1.00 0.00 C ATOM 1715 C VAL A 108 -22.521 15.787 -2.173 1.00 0.00 C ATOM 1716 O VAL A 108 -21.720 16.522 -2.710 1.00 0.00 O ATOM 1717 CB VAL A 108 -21.398 14.142 -0.660 1.00 0.00 C ATOM 1718 CG1 VAL A 108 -21.991 15.015 0.449 1.00 0.00 C ATOM 1719 CG2 VAL A 108 -21.429 12.679 -0.225 1.00 0.00 C ATOM 0 H VAL A 108 -20.466 14.261 -3.164 1.00 0.00 H new ATOM 0 HA VAL A 108 -23.175 13.791 -1.896 1.00 0.00 H new ATOM 0 HB VAL A 108 -20.369 14.447 -0.848 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -21.405 14.894 1.360 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -21.970 16.060 0.140 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -23.021 14.713 0.638 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -20.845 12.558 0.688 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -22.460 12.376 -0.040 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -21.004 12.056 -1.012 1.00 0.00 H new ATOM 1729 N ASP A 109 -23.668 16.232 -1.750 1.00 0.00 N ATOM 1730 CA ASP A 109 -24.012 17.670 -1.913 1.00 0.00 C ATOM 1731 C ASP A 109 -24.065 18.326 -0.532 1.00 0.00 C ATOM 1732 O ASP A 109 -24.923 18.015 0.269 1.00 0.00 O ATOM 1733 CB ASP A 109 -25.394 17.678 -2.565 1.00 0.00 C ATOM 1734 CG ASP A 109 -25.419 18.702 -3.700 1.00 0.00 C ATOM 1735 OD1 ASP A 109 -24.360 19.199 -4.046 1.00 0.00 O ATOM 1736 OD2 ASP A 109 -26.497 18.972 -4.203 1.00 0.00 O ATOM 0 H ASP A 109 -24.383 15.662 -1.298 1.00 0.00 H new ATOM 0 HA ASP A 109 -23.285 18.217 -2.514 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -25.631 16.686 -2.951 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -26.155 17.922 -1.824 1.00 0.00 H new ATOM 1741 N ALA A 110 -23.167 19.227 -0.233 1.00 0.00 N ATOM 1742 CA ALA A 110 -23.213 19.869 1.112 1.00 0.00 C ATOM 1743 C ALA A 110 -24.516 20.660 1.266 1.00 0.00 C ATOM 1744 O ALA A 110 -24.682 21.718 0.693 1.00 0.00 O ATOM 1745 CB ALA A 110 -22.009 20.802 1.156 1.00 0.00 C ATOM 0 H ALA A 110 -22.417 19.541 -0.849 1.00 0.00 H new ATOM 0 HA ALA A 110 -23.182 19.139 1.920 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -21.978 21.311 2.120 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -21.095 20.223 1.021 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -22.092 21.540 0.359 1.00 0.00 H new