USER MOD reduce.3.24.130724 H: found=0, std=0, add=1021, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1019 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 143 GLN : amide:sc= 0.144 X(o=0.33,f=0.045) USER MOD Set 1.2: A 144 ASN : amide:sc= 0.185 X(o=0.33,f=-0.094) USER MOD Set 2.1: A 40 THR OG1 : rot -161:sc= 0.28 USER MOD Set 2.2: A 98 TYR OH : rot 30:sc= 0.221 USER MOD Set 3.1: A 15 LYS NZ :NH3+ -120:sc= -0.112 (180deg=-0.0697) USER MOD Set 3.2: A 79 THR OG1 : rot -120:sc= 0.195 USER MOD Set 4.1: A 66 LYS NZ :NH3+ 163:sc= 0.0641 (180deg=0) USER MOD Set 4.2: A 163 TYR OH : rot 180:sc= 0.0554 USER MOD Set 5.1: A 37 HIS : no HD1:sc= -0.251 X(o=0.59,f=0.46) USER MOD Set 5.2: A 53 SER OG : rot 74:sc= 0.844 USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 GLN : amide:sc= -0.171 X(o=-0.17,f=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0.18) USER MOD Single : A 32 THR OG1 : rot 180:sc=-0.00607 USER MOD Single : A 33 LYS NZ :NH3+ 151:sc= -0.0848 (180deg=-1.31!) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl -163:sc= -0.845 (180deg=-1.95) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 CYS SG : rot -23:sc= 0.122 USER MOD Single : A 80 MET CE :methyl 171:sc= -0.802 (180deg=-1.07) USER MOD Single : A 87 GLN : amide:sc= -0.357 X(o=-0.36,f=-0.24) USER MOD Single : A 90 CYS SG : rot 100:sc= -1.44 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 HIS : no HD1:sc= -0.234 X(o=-0.23,f=-0.25) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot -19:sc= 0.569 USER MOD Single : A 142 GLN : amide:sc= -0.0545 X(o=-0.055,f=0) USER MOD Single : A 146 GLN : amide:sc= 0.0622 K(o=0.062,f=-1.8) USER MOD Single : A 151 HIS : no HD1:sc= -0.408 X(o=-0.41,f=-0.041) USER MOD Single : A 152 MET CE :methyl 172:sc=-0.00458 (180deg=-0.0127) USER MOD Single : A 154 MET CE :methyl 169:sc= -0.111 (180deg=-0.478) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 SER OG : rot -138:sc= 0.0687 USER MOD Single : A 162 THR OG1 : rot -122:sc= 0.658 USER MOD ----------------------------------------------------------------- ATOM 42 N ILE A 5 21.208 -5.003 -10.860 1.00 0.00 N ATOM 43 CA ILE A 5 22.033 -3.912 -10.243 1.00 0.00 C ATOM 44 C ILE A 5 22.864 -3.082 -11.283 1.00 0.00 C ATOM 45 O ILE A 5 22.893 -1.851 -11.189 1.00 0.00 O ATOM 46 CB ILE A 5 22.920 -4.519 -9.084 1.00 0.00 C ATOM 47 CG1 ILE A 5 22.118 -5.230 -7.947 1.00 0.00 C ATOM 48 CG2 ILE A 5 23.937 -3.527 -8.454 1.00 0.00 C ATOM 49 CD1 ILE A 5 21.217 -4.321 -7.109 1.00 0.00 C ATOM 0 HA ILE A 5 21.351 -3.178 -9.813 1.00 0.00 H new ATOM 0 HB ILE A 5 23.484 -5.281 -9.621 1.00 0.00 H new ATOM 0 HG12 ILE A 5 21.502 -6.010 -8.394 1.00 0.00 H new ATOM 0 HG13 ILE A 5 22.826 -5.724 -7.281 1.00 0.00 H new ATOM 0 HG21 ILE A 5 24.500 -4.032 -7.669 1.00 0.00 H new ATOM 0 HG22 ILE A 5 24.624 -3.173 -9.223 1.00 0.00 H new ATOM 0 HG23 ILE A 5 23.401 -2.679 -8.028 1.00 0.00 H new ATOM 0 HD11 ILE A 5 20.707 -4.914 -6.350 1.00 0.00 H new ATOM 0 HD12 ILE A 5 21.823 -3.555 -6.625 1.00 0.00 H new ATOM 0 HD13 ILE A 5 20.479 -3.846 -7.755 1.00 0.00 H new ATOM 61 N ALA A 6 23.510 -3.753 -12.258 1.00 0.00 N ATOM 62 CA ALA A 6 24.213 -3.081 -13.376 1.00 0.00 C ATOM 63 C ALA A 6 23.330 -2.307 -14.396 1.00 0.00 C ATOM 64 O ALA A 6 23.803 -1.285 -14.895 1.00 0.00 O ATOM 65 CB ALA A 6 25.105 -4.113 -14.083 1.00 0.00 C ATOM 0 H ALA A 6 23.561 -4.771 -12.295 1.00 0.00 H new ATOM 0 HA ALA A 6 24.799 -2.284 -12.917 1.00 0.00 H new ATOM 0 HB1 ALA A 6 25.630 -3.634 -14.910 1.00 0.00 H new ATOM 0 HB2 ALA A 6 25.831 -4.513 -13.375 1.00 0.00 H new ATOM 0 HB3 ALA A 6 24.488 -4.925 -14.467 1.00 0.00 H new ATOM 71 N ARG A 7 22.084 -2.746 -14.691 1.00 0.00 N ATOM 72 CA ARG A 7 21.110 -1.934 -15.477 1.00 0.00 C ATOM 73 C ARG A 7 20.409 -0.775 -14.692 1.00 0.00 C ATOM 74 O ARG A 7 20.096 0.236 -15.323 1.00 0.00 O ATOM 75 CB ARG A 7 20.152 -2.835 -16.309 1.00 0.00 C ATOM 76 CG ARG A 7 18.908 -3.456 -15.629 1.00 0.00 C ATOM 77 CD ARG A 7 17.618 -2.609 -15.611 1.00 0.00 C ATOM 78 NE ARG A 7 17.045 -2.346 -16.953 1.00 0.00 N ATOM 79 CZ ARG A 7 16.033 -1.489 -17.188 1.00 0.00 C ATOM 80 NH1 ARG A 7 15.389 -0.818 -16.234 1.00 0.00 N ATOM 81 NH2 ARG A 7 15.655 -1.303 -18.439 1.00 0.00 N ATOM 0 H ARG A 7 21.725 -3.655 -14.400 1.00 0.00 H new ATOM 0 HA ARG A 7 21.709 -1.376 -16.197 1.00 0.00 H new ATOM 0 HB2 ARG A 7 19.801 -2.245 -17.155 1.00 0.00 H new ATOM 0 HB3 ARG A 7 20.745 -3.654 -16.716 1.00 0.00 H new ATOM 0 HG2 ARG A 7 18.686 -4.399 -16.128 1.00 0.00 H new ATOM 0 HG3 ARG A 7 19.170 -3.694 -14.598 1.00 0.00 H new ATOM 0 HD2 ARG A 7 16.871 -3.118 -15.003 1.00 0.00 H new ATOM 0 HD3 ARG A 7 17.829 -1.656 -15.125 1.00 0.00 H new ATOM 0 HE ARG A 7 17.442 -2.846 -17.748 1.00 0.00 H new ATOM 0 HH11 ARG A 7 15.655 -0.939 -15.257 1.00 0.00 H new ATOM 0 HH12 ARG A 7 14.630 -0.183 -16.481 1.00 0.00 H new ATOM 0 HH21 ARG A 7 16.126 -1.802 -19.194 1.00 0.00 H new ATOM 0 HH22 ARG A 7 14.892 -0.661 -18.651 1.00 0.00 H new ATOM 95 N LEU A 8 20.163 -0.884 -13.361 1.00 0.00 N ATOM 96 CA LEU A 8 19.556 0.207 -12.546 1.00 0.00 C ATOM 97 C LEU A 8 20.440 1.488 -12.428 1.00 0.00 C ATOM 98 O LEU A 8 19.915 2.587 -12.613 1.00 0.00 O ATOM 99 CB LEU A 8 19.136 -0.258 -11.118 1.00 0.00 C ATOM 100 CG LEU A 8 18.079 -1.388 -10.903 1.00 0.00 C ATOM 101 CD1 LEU A 8 17.257 -1.118 -9.632 1.00 0.00 C ATOM 102 CD2 LEU A 8 17.116 -1.684 -12.067 1.00 0.00 C ATOM 0 H LEU A 8 20.377 -1.724 -12.823 1.00 0.00 H new ATOM 0 HA LEU A 8 18.662 0.473 -13.110 1.00 0.00 H new ATOM 0 HB2 LEU A 8 20.046 -0.575 -10.608 1.00 0.00 H new ATOM 0 HB3 LEU A 8 18.767 0.624 -10.594 1.00 0.00 H new ATOM 0 HG LEU A 8 18.693 -2.285 -10.818 1.00 0.00 H new ATOM 0 HD11 LEU A 8 16.525 -1.914 -9.496 1.00 0.00 H new ATOM 0 HD12 LEU A 8 17.922 -1.085 -8.769 1.00 0.00 H new ATOM 0 HD13 LEU A 8 16.741 -0.163 -9.729 1.00 0.00 H new ATOM 0 HD21 LEU A 8 16.438 -2.488 -11.782 1.00 0.00 H new ATOM 0 HD22 LEU A 8 16.540 -0.788 -12.299 1.00 0.00 H new ATOM 0 HD23 LEU A 8 17.688 -1.985 -12.945 1.00 0.00 H new ATOM 114 N ARG A 9 21.756 1.364 -12.149 1.00 0.00 N ATOM 115 CA ARG A 9 22.708 2.512 -12.165 1.00 0.00 C ATOM 116 C ARG A 9 22.770 3.338 -13.496 1.00 0.00 C ATOM 117 O ARG A 9 22.727 4.570 -13.439 1.00 0.00 O ATOM 118 CB ARG A 9 24.092 2.049 -11.628 1.00 0.00 C ATOM 119 CG ARG A 9 24.903 1.083 -12.528 1.00 0.00 C ATOM 120 CD ARG A 9 26.006 0.315 -11.779 1.00 0.00 C ATOM 121 NE ARG A 9 26.853 -0.450 -12.725 1.00 0.00 N ATOM 122 CZ ARG A 9 27.627 -1.498 -12.381 1.00 0.00 C ATOM 123 NH1 ARG A 9 27.733 -1.970 -11.140 1.00 0.00 N ATOM 124 NH2 ARG A 9 28.318 -2.096 -13.334 1.00 0.00 N ATOM 0 H ARG A 9 22.193 0.474 -11.907 1.00 0.00 H new ATOM 0 HA ARG A 9 22.305 3.260 -11.483 1.00 0.00 H new ATOM 0 HB2 ARG A 9 24.700 2.935 -11.447 1.00 0.00 H new ATOM 0 HB3 ARG A 9 23.938 1.566 -10.663 1.00 0.00 H new ATOM 0 HG2 ARG A 9 24.220 0.366 -12.984 1.00 0.00 H new ATOM 0 HG3 ARG A 9 25.356 1.652 -13.340 1.00 0.00 H new ATOM 0 HD2 ARG A 9 26.623 1.015 -11.216 1.00 0.00 H new ATOM 0 HD3 ARG A 9 25.555 -0.365 -11.057 1.00 0.00 H new ATOM 0 HE ARG A 9 26.850 -0.163 -13.704 1.00 0.00 H new ATOM 0 HH11 ARG A 9 27.209 -1.533 -10.382 1.00 0.00 H new ATOM 0 HH12 ARG A 9 28.338 -2.768 -10.948 1.00 0.00 H new ATOM 0 HH21 ARG A 9 28.256 -1.761 -14.296 1.00 0.00 H new ATOM 0 HH22 ARG A 9 28.914 -2.892 -13.109 1.00 0.00 H new ATOM 138 N GLU A 10 22.795 2.667 -14.669 1.00 0.00 N ATOM 139 CA GLU A 10 22.575 3.317 -15.996 1.00 0.00 C ATOM 140 C GLU A 10 21.112 3.697 -16.404 1.00 0.00 C ATOM 141 O GLU A 10 20.948 4.339 -17.447 1.00 0.00 O ATOM 142 CB GLU A 10 23.262 2.475 -17.109 1.00 0.00 C ATOM 143 CG GLU A 10 22.749 1.027 -17.295 1.00 0.00 C ATOM 144 CD GLU A 10 23.305 0.345 -18.546 1.00 0.00 C ATOM 145 OE1 GLU A 10 22.695 0.485 -19.630 1.00 0.00 O ATOM 146 OE2 GLU A 10 24.352 -0.332 -18.452 1.00 0.00 O ATOM 0 H GLU A 10 22.967 1.663 -14.731 1.00 0.00 H new ATOM 0 HA GLU A 10 23.037 4.297 -15.879 1.00 0.00 H new ATOM 0 HB2 GLU A 10 23.146 3.002 -18.056 1.00 0.00 H new ATOM 0 HB3 GLU A 10 24.330 2.434 -16.895 1.00 0.00 H new ATOM 0 HG2 GLU A 10 23.018 0.438 -16.418 1.00 0.00 H new ATOM 0 HG3 GLU A 10 21.660 1.039 -17.349 1.00 0.00 H new ATOM 153 N ASP A 11 20.069 3.356 -15.618 1.00 0.00 N ATOM 154 CA ASP A 11 18.670 3.803 -15.893 1.00 0.00 C ATOM 155 C ASP A 11 18.314 5.259 -15.444 1.00 0.00 C ATOM 156 O ASP A 11 17.194 5.694 -15.721 1.00 0.00 O ATOM 157 CB ASP A 11 17.722 2.694 -15.351 1.00 0.00 C ATOM 158 CG ASP A 11 16.244 2.786 -15.755 1.00 0.00 C ATOM 159 OD1 ASP A 11 15.928 2.574 -16.946 1.00 0.00 O ATOM 160 OD2 ASP A 11 15.394 3.064 -14.881 1.00 0.00 O ATOM 0 H ASP A 11 20.160 2.773 -14.786 1.00 0.00 H new ATOM 0 HA ASP A 11 18.539 3.910 -16.970 1.00 0.00 H new ATOM 0 HB2 ASP A 11 18.105 1.729 -15.682 1.00 0.00 H new ATOM 0 HB3 ASP A 11 17.777 2.702 -14.262 1.00 0.00 H new ATOM 165 N GLY A 12 19.228 6.017 -14.803 1.00 0.00 N ATOM 166 CA GLY A 12 18.872 7.274 -14.104 1.00 0.00 C ATOM 167 C GLY A 12 18.717 7.157 -12.565 1.00 0.00 C ATOM 168 O GLY A 12 19.131 8.052 -11.824 1.00 0.00 O ATOM 0 H GLY A 12 20.219 5.782 -14.754 1.00 0.00 H new ATOM 0 HA2 GLY A 12 19.638 8.019 -14.320 1.00 0.00 H new ATOM 0 HA3 GLY A 12 17.936 7.649 -14.519 1.00 0.00 H new ATOM 172 N ILE A 13 18.121 6.044 -12.108 1.00 0.00 N ATOM 173 CA ILE A 13 17.995 5.659 -10.672 1.00 0.00 C ATOM 174 C ILE A 13 19.355 5.142 -10.087 1.00 0.00 C ATOM 175 O ILE A 13 20.309 4.849 -10.818 1.00 0.00 O ATOM 176 CB ILE A 13 16.818 4.616 -10.535 1.00 0.00 C ATOM 177 CG1 ILE A 13 17.122 3.270 -11.268 1.00 0.00 C ATOM 178 CG2 ILE A 13 15.449 5.221 -10.934 1.00 0.00 C ATOM 179 CD1 ILE A 13 15.980 2.309 -11.595 1.00 0.00 C ATOM 0 H ILE A 13 17.698 5.361 -12.736 1.00 0.00 H new ATOM 0 HA ILE A 13 17.749 6.534 -10.071 1.00 0.00 H new ATOM 0 HB ILE A 13 16.745 4.369 -9.476 1.00 0.00 H new ATOM 0 HG12 ILE A 13 17.619 3.516 -12.206 1.00 0.00 H new ATOM 0 HG13 ILE A 13 17.843 2.724 -10.659 1.00 0.00 H new ATOM 0 HG21 ILE A 13 14.671 4.466 -10.823 1.00 0.00 H new ATOM 0 HG22 ILE A 13 15.225 6.070 -10.289 1.00 0.00 H new ATOM 0 HG23 ILE A 13 15.487 5.554 -11.971 1.00 0.00 H new ATOM 0 HD11 ILE A 13 16.378 1.430 -12.102 1.00 0.00 H new ATOM 0 HD12 ILE A 13 15.487 2.003 -10.673 1.00 0.00 H new ATOM 0 HD13 ILE A 13 15.260 2.807 -12.244 1.00 0.00 H new ATOM 191 N GLN A 14 19.421 5.032 -8.750 1.00 0.00 N ATOM 192 CA GLN A 14 20.619 4.524 -8.035 1.00 0.00 C ATOM 193 C GLN A 14 20.107 3.716 -6.819 1.00 0.00 C ATOM 194 O GLN A 14 19.506 4.317 -5.919 1.00 0.00 O ATOM 195 CB GLN A 14 21.510 5.724 -7.605 1.00 0.00 C ATOM 196 CG GLN A 14 22.817 5.367 -6.864 1.00 0.00 C ATOM 197 CD GLN A 14 23.940 4.858 -7.785 1.00 0.00 C ATOM 198 OE1 GLN A 14 24.658 5.640 -8.410 1.00 0.00 O ATOM 199 NE2 GLN A 14 24.112 3.550 -7.896 1.00 0.00 N ATOM 0 H GLN A 14 18.653 5.290 -8.130 1.00 0.00 H new ATOM 0 HA GLN A 14 21.233 3.881 -8.666 1.00 0.00 H new ATOM 0 HB2 GLN A 14 21.766 6.298 -8.496 1.00 0.00 H new ATOM 0 HB3 GLN A 14 20.919 6.378 -6.963 1.00 0.00 H new ATOM 0 HG2 GLN A 14 23.171 6.248 -6.329 1.00 0.00 H new ATOM 0 HG3 GLN A 14 22.602 4.605 -6.115 1.00 0.00 H new ATOM 0 HE21 GLN A 14 23.512 2.911 -7.374 1.00 0.00 H new ATOM 0 HE22 GLN A 14 24.844 3.182 -8.503 1.00 0.00 H new ATOM 208 N LYS A 15 20.350 2.384 -6.774 1.00 0.00 N ATOM 209 CA LYS A 15 19.802 1.522 -5.693 1.00 0.00 C ATOM 210 C LYS A 15 20.805 1.159 -4.563 1.00 0.00 C ATOM 211 O LYS A 15 22.026 1.160 -4.753 1.00 0.00 O ATOM 212 CB LYS A 15 18.983 0.332 -6.257 1.00 0.00 C ATOM 213 CG LYS A 15 19.620 -1.065 -6.451 1.00 0.00 C ATOM 214 CD LYS A 15 18.697 -2.201 -5.944 1.00 0.00 C ATOM 215 CE LYS A 15 18.765 -2.453 -4.425 1.00 0.00 C ATOM 216 NZ LYS A 15 18.020 -3.665 -4.041 1.00 0.00 N ATOM 0 H LYS A 15 20.914 1.886 -7.463 1.00 0.00 H new ATOM 0 HA LYS A 15 19.085 2.144 -5.157 1.00 0.00 H new ATOM 0 HB2 LYS A 15 18.122 0.200 -5.601 1.00 0.00 H new ATOM 0 HB3 LYS A 15 18.599 0.643 -7.228 1.00 0.00 H new ATOM 0 HG2 LYS A 15 19.838 -1.220 -7.508 1.00 0.00 H new ATOM 0 HG3 LYS A 15 20.571 -1.106 -5.920 1.00 0.00 H new ATOM 0 HD2 LYS A 15 17.668 -1.963 -6.214 1.00 0.00 H new ATOM 0 HD3 LYS A 15 18.958 -3.123 -6.464 1.00 0.00 H new ATOM 0 HE2 LYS A 15 19.806 -2.553 -4.119 1.00 0.00 H new ATOM 0 HE3 LYS A 15 18.358 -1.592 -3.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 17.265 -3.411 -3.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 17.601 -4.098 -4.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 18.668 -4.342 -3.590 1.00 0.00 H new ATOM 230 N ARG A 16 20.237 0.820 -3.389 1.00 0.00 N ATOM 231 CA ARG A 16 21.013 0.368 -2.208 1.00 0.00 C ATOM 232 C ARG A 16 20.116 -0.607 -1.397 1.00 0.00 C ATOM 233 O ARG A 16 19.025 -0.236 -0.949 1.00 0.00 O ATOM 234 CB ARG A 16 21.454 1.594 -1.354 1.00 0.00 C ATOM 235 CG ARG A 16 22.275 1.251 -0.090 1.00 0.00 C ATOM 236 CD ARG A 16 22.508 2.460 0.839 1.00 0.00 C ATOM 237 NE ARG A 16 23.133 2.052 2.124 1.00 0.00 N ATOM 238 CZ ARG A 16 22.456 1.589 3.196 1.00 0.00 C ATOM 239 NH1 ARG A 16 21.127 1.510 3.263 1.00 0.00 N ATOM 240 NH2 ARG A 16 23.151 1.185 4.244 1.00 0.00 N ATOM 0 H ARG A 16 19.230 0.850 -3.229 1.00 0.00 H new ATOM 0 HA ARG A 16 21.923 -0.149 -2.513 1.00 0.00 H new ATOM 0 HB2 ARG A 16 22.044 2.261 -1.982 1.00 0.00 H new ATOM 0 HB3 ARG A 16 20.564 2.146 -1.052 1.00 0.00 H new ATOM 0 HG2 ARG A 16 21.760 0.469 0.467 1.00 0.00 H new ATOM 0 HG3 ARG A 16 23.240 0.844 -0.392 1.00 0.00 H new ATOM 0 HD2 ARG A 16 23.147 3.187 0.338 1.00 0.00 H new ATOM 0 HD3 ARG A 16 21.557 2.955 1.037 1.00 0.00 H new ATOM 0 HE ARG A 16 24.147 2.127 2.202 1.00 0.00 H new ATOM 0 HH11 ARG A 16 20.558 1.810 2.472 1.00 0.00 H new ATOM 0 HH12 ARG A 16 20.679 1.149 4.106 1.00 0.00 H new ATOM 0 HH21 ARG A 16 24.170 1.228 4.228 1.00 0.00 H new ATOM 0 HH22 ARG A 16 22.669 0.830 5.070 1.00 0.00 H new ATOM 254 N VAL A 17 20.637 -1.825 -1.148 1.00 0.00 N ATOM 255 CA VAL A 17 20.013 -2.803 -0.214 1.00 0.00 C ATOM 256 C VAL A 17 20.586 -2.624 1.222 1.00 0.00 C ATOM 257 O VAL A 17 21.800 -2.521 1.428 1.00 0.00 O ATOM 258 CB VAL A 17 20.087 -4.261 -0.781 1.00 0.00 C ATOM 259 CG1 VAL A 17 21.493 -4.888 -0.841 1.00 0.00 C ATOM 260 CG2 VAL A 17 19.153 -5.238 -0.039 1.00 0.00 C ATOM 0 H VAL A 17 21.496 -2.164 -1.582 1.00 0.00 H new ATOM 0 HA VAL A 17 18.946 -2.599 -0.129 1.00 0.00 H new ATOM 0 HB VAL A 17 19.755 -4.121 -1.810 1.00 0.00 H new ATOM 0 HG11 VAL A 17 21.425 -5.896 -1.249 1.00 0.00 H new ATOM 0 HG12 VAL A 17 22.135 -4.281 -1.479 1.00 0.00 H new ATOM 0 HG13 VAL A 17 21.915 -4.931 0.163 1.00 0.00 H new ATOM 0 HG21 VAL A 17 19.246 -6.233 -0.475 1.00 0.00 H new ATOM 0 HG22 VAL A 17 19.429 -5.276 1.015 1.00 0.00 H new ATOM 0 HG23 VAL A 17 18.122 -4.897 -0.132 1.00 0.00 H new ATOM 270 N ILE A 18 19.674 -2.640 2.208 1.00 0.00 N ATOM 271 CA ILE A 18 20.020 -2.641 3.652 1.00 0.00 C ATOM 272 C ILE A 18 20.377 -4.107 4.080 1.00 0.00 C ATOM 273 O ILE A 18 21.534 -4.367 4.421 1.00 0.00 O ATOM 274 CB ILE A 18 18.895 -1.975 4.521 1.00 0.00 C ATOM 275 CG1 ILE A 18 18.338 -0.603 4.017 1.00 0.00 C ATOM 276 CG2 ILE A 18 19.366 -1.789 5.987 1.00 0.00 C ATOM 277 CD1 ILE A 18 16.807 -0.558 4.019 1.00 0.00 C ATOM 0 H ILE A 18 18.669 -2.653 2.032 1.00 0.00 H new ATOM 0 HA ILE A 18 20.899 -2.021 3.830 1.00 0.00 H new ATOM 0 HB ILE A 18 18.072 -2.685 4.435 1.00 0.00 H new ATOM 0 HG12 ILE A 18 18.723 0.197 4.650 1.00 0.00 H new ATOM 0 HG13 ILE A 18 18.703 -0.415 3.007 1.00 0.00 H new ATOM 0 HG21 ILE A 18 18.569 -1.326 6.569 1.00 0.00 H new ATOM 0 HG22 ILE A 18 19.611 -2.760 6.416 1.00 0.00 H new ATOM 0 HG23 ILE A 18 20.249 -1.150 6.007 1.00 0.00 H new ATOM 0 HD11 ILE A 18 16.471 0.415 3.661 1.00 0.00 H new ATOM 0 HD12 ILE A 18 16.419 -1.339 3.365 1.00 0.00 H new ATOM 0 HD13 ILE A 18 16.440 -0.718 5.033 1.00 0.00 H new ATOM 289 N GLN A 19 19.394 -5.035 4.051 1.00 0.00 N ATOM 290 CA GLN A 19 19.589 -6.459 4.418 1.00 0.00 C ATOM 291 C GLN A 19 19.262 -7.325 3.177 1.00 0.00 C ATOM 292 O GLN A 19 18.100 -7.436 2.778 1.00 0.00 O ATOM 293 CB GLN A 19 18.683 -6.866 5.612 1.00 0.00 C ATOM 294 CG GLN A 19 18.996 -6.204 6.981 1.00 0.00 C ATOM 295 CD GLN A 19 17.868 -5.314 7.525 1.00 0.00 C ATOM 296 OE1 GLN A 19 17.351 -5.515 8.624 1.00 0.00 O ATOM 297 NE2 GLN A 19 17.472 -4.320 6.754 1.00 0.00 N ATOM 0 H GLN A 19 18.438 -4.817 3.771 1.00 0.00 H new ATOM 0 HA GLN A 19 20.622 -6.614 4.730 1.00 0.00 H new ATOM 0 HB2 GLN A 19 17.650 -6.635 5.350 1.00 0.00 H new ATOM 0 HB3 GLN A 19 18.746 -7.947 5.734 1.00 0.00 H new ATOM 0 HG2 GLN A 19 19.209 -6.986 7.709 1.00 0.00 H new ATOM 0 HG3 GLN A 19 19.901 -5.604 6.883 1.00 0.00 H new ATOM 0 HE21 GLN A 19 17.914 -4.171 5.847 1.00 0.00 H new ATOM 0 HE22 GLN A 19 16.724 -3.700 7.065 1.00 0.00 H new ATOM 306 N GLU A 20 20.290 -7.989 2.616 1.00 0.00 N ATOM 307 CA GLU A 20 20.116 -9.047 1.582 1.00 0.00 C ATOM 308 C GLU A 20 19.360 -10.279 2.163 1.00 0.00 C ATOM 309 O GLU A 20 19.807 -10.885 3.144 1.00 0.00 O ATOM 310 CB GLU A 20 21.497 -9.465 1.011 1.00 0.00 C ATOM 311 CG GLU A 20 22.152 -8.409 0.099 1.00 0.00 C ATOM 312 CD GLU A 20 23.488 -8.861 -0.488 1.00 0.00 C ATOM 313 OE1 GLU A 20 23.490 -9.522 -1.550 1.00 0.00 O ATOM 314 OE2 GLU A 20 24.546 -8.557 0.107 1.00 0.00 O ATOM 0 H GLU A 20 21.265 -7.814 2.860 1.00 0.00 H new ATOM 0 HA GLU A 20 19.511 -8.641 0.771 1.00 0.00 H new ATOM 0 HB2 GLU A 20 22.170 -9.679 1.841 1.00 0.00 H new ATOM 0 HB3 GLU A 20 21.379 -10.391 0.449 1.00 0.00 H new ATOM 0 HG2 GLU A 20 21.468 -8.168 -0.715 1.00 0.00 H new ATOM 0 HG3 GLU A 20 22.305 -7.492 0.668 1.00 0.00 H new ATOM 321 N GLY A 21 18.194 -10.598 1.574 1.00 0.00 N ATOM 322 CA GLY A 21 17.209 -11.515 2.189 1.00 0.00 C ATOM 323 C GLY A 21 17.526 -13.020 2.103 1.00 0.00 C ATOM 324 O GLY A 21 18.578 -13.465 2.572 1.00 0.00 O ATOM 0 H GLY A 21 17.906 -10.233 0.666 1.00 0.00 H new ATOM 0 HA2 GLY A 21 17.104 -11.248 3.240 1.00 0.00 H new ATOM 0 HA3 GLY A 21 16.241 -11.342 1.718 1.00 0.00 H new ATOM 328 N ARG A 22 16.578 -13.796 1.549 1.00 0.00 N ATOM 329 CA ARG A 22 16.665 -15.278 1.508 1.00 0.00 C ATOM 330 C ARG A 22 16.070 -15.814 0.176 1.00 0.00 C ATOM 331 O ARG A 22 15.062 -15.318 -0.345 1.00 0.00 O ATOM 332 CB ARG A 22 15.963 -15.876 2.755 1.00 0.00 C ATOM 333 CG ARG A 22 16.277 -17.366 3.006 1.00 0.00 C ATOM 334 CD ARG A 22 15.673 -17.881 4.323 1.00 0.00 C ATOM 335 NE ARG A 22 15.856 -19.343 4.502 1.00 0.00 N ATOM 336 CZ ARG A 22 16.935 -19.925 5.066 1.00 0.00 C ATOM 337 NH1 ARG A 22 17.986 -19.253 5.534 1.00 0.00 N ATOM 338 NH2 ARG A 22 16.954 -21.242 5.156 1.00 0.00 N ATOM 0 H ARG A 22 15.732 -13.423 1.118 1.00 0.00 H new ATOM 0 HA ARG A 22 17.709 -15.590 1.538 1.00 0.00 H new ATOM 0 HB2 ARG A 22 16.257 -15.302 3.634 1.00 0.00 H new ATOM 0 HB3 ARG A 22 14.885 -15.758 2.643 1.00 0.00 H new ATOM 0 HG2 ARG A 22 15.892 -17.960 2.177 1.00 0.00 H new ATOM 0 HG3 ARG A 22 17.358 -17.508 3.025 1.00 0.00 H new ATOM 0 HD2 ARG A 22 16.134 -17.356 5.160 1.00 0.00 H new ATOM 0 HD3 ARG A 22 14.609 -17.646 4.347 1.00 0.00 H new ATOM 0 HE ARG A 22 15.109 -19.955 4.173 1.00 0.00 H new ATOM 0 HH11 ARG A 22 18.007 -18.235 5.477 1.00 0.00 H new ATOM 0 HH12 ARG A 22 18.770 -19.757 5.949 1.00 0.00 H new ATOM 0 HH21 ARG A 22 16.168 -21.789 4.805 1.00 0.00 H new ATOM 0 HH22 ARG A 22 17.755 -21.713 5.577 1.00 0.00 H new ATOM 393 N PRO A 26 12.953 -14.498 -8.289 1.00 0.00 N ATOM 394 CA PRO A 26 12.020 -15.029 -9.326 1.00 0.00 C ATOM 395 C PRO A 26 11.982 -14.201 -10.652 1.00 0.00 C ATOM 396 O PRO A 26 12.831 -13.336 -10.896 1.00 0.00 O ATOM 397 CB PRO A 26 10.694 -15.089 -8.534 1.00 0.00 C ATOM 398 CG PRO A 26 10.774 -13.951 -7.524 1.00 0.00 C ATOM 399 CD PRO A 26 12.248 -13.918 -7.127 1.00 0.00 C ATOM 0 HA PRO A 26 12.313 -15.995 -9.736 1.00 0.00 H new ATOM 0 HB2 PRO A 26 9.836 -14.968 -9.195 1.00 0.00 H new ATOM 0 HB3 PRO A 26 10.578 -16.051 -8.034 1.00 0.00 H new ATOM 0 HG2 PRO A 26 10.457 -13.005 -7.962 1.00 0.00 H new ATOM 0 HG3 PRO A 26 10.132 -14.135 -6.663 1.00 0.00 H new ATOM 0 HD2 PRO A 26 12.583 -12.900 -6.926 1.00 0.00 H new ATOM 0 HD3 PRO A 26 12.429 -14.498 -6.222 1.00 0.00 H new ATOM 407 N ASP A 27 11.004 -14.508 -11.526 1.00 0.00 N ATOM 408 CA ASP A 27 10.900 -13.928 -12.898 1.00 0.00 C ATOM 409 C ASP A 27 10.822 -12.370 -12.962 1.00 0.00 C ATOM 410 O ASP A 27 11.621 -11.763 -13.680 1.00 0.00 O ATOM 411 CB ASP A 27 9.715 -14.563 -13.684 1.00 0.00 C ATOM 412 CG ASP A 27 9.778 -16.081 -13.912 1.00 0.00 C ATOM 413 OD1 ASP A 27 10.604 -16.537 -14.733 1.00 0.00 O ATOM 414 OD2 ASP A 27 8.998 -16.820 -13.271 1.00 0.00 O ATOM 0 H ASP A 27 10.256 -15.167 -11.309 1.00 0.00 H new ATOM 0 HA ASP A 27 11.846 -14.185 -13.374 1.00 0.00 H new ATOM 0 HB2 ASP A 27 8.792 -14.336 -13.151 1.00 0.00 H new ATOM 0 HB3 ASP A 27 9.650 -14.075 -14.656 1.00 0.00 H new ATOM 419 N PHE A 28 9.862 -11.742 -12.248 1.00 0.00 N ATOM 420 CA PHE A 28 9.537 -10.288 -12.374 1.00 0.00 C ATOM 421 C PHE A 28 9.166 -9.824 -13.819 1.00 0.00 C ATOM 422 O PHE A 28 9.722 -8.858 -14.353 1.00 0.00 O ATOM 423 CB PHE A 28 10.595 -9.385 -11.676 1.00 0.00 C ATOM 424 CG PHE A 28 10.609 -9.446 -10.141 1.00 0.00 C ATOM 425 CD1 PHE A 28 9.669 -8.710 -9.411 1.00 0.00 C ATOM 426 CD2 PHE A 28 11.580 -10.186 -9.462 1.00 0.00 C ATOM 427 CE1 PHE A 28 9.698 -8.719 -8.021 1.00 0.00 C ATOM 428 CE2 PHE A 28 11.608 -10.191 -8.070 1.00 0.00 C ATOM 429 CZ PHE A 28 10.662 -9.465 -7.351 1.00 0.00 C ATOM 0 H PHE A 28 9.282 -12.225 -11.562 1.00 0.00 H new ATOM 0 HA PHE A 28 8.607 -10.154 -11.821 1.00 0.00 H new ATOM 0 HB2 PHE A 28 11.583 -9.664 -12.042 1.00 0.00 H new ATOM 0 HB3 PHE A 28 10.422 -8.352 -11.979 1.00 0.00 H new ATOM 0 HD1 PHE A 28 8.918 -8.133 -9.929 1.00 0.00 H new ATOM 0 HD2 PHE A 28 12.310 -10.755 -10.018 1.00 0.00 H new ATOM 0 HE1 PHE A 28 8.972 -8.147 -7.462 1.00 0.00 H new ATOM 0 HE2 PHE A 28 12.364 -10.758 -7.548 1.00 0.00 H new ATOM 0 HZ PHE A 28 10.677 -9.481 -6.271 1.00 0.00 H new ATOM 439 N GLN A 29 8.195 -10.531 -14.424 1.00 0.00 N ATOM 440 CA GLN A 29 7.704 -10.271 -15.798 1.00 0.00 C ATOM 441 C GLN A 29 6.166 -10.012 -15.779 1.00 0.00 C ATOM 442 O GLN A 29 5.546 -9.952 -14.712 1.00 0.00 O ATOM 443 CB GLN A 29 8.117 -11.464 -16.719 1.00 0.00 C ATOM 444 CG GLN A 29 9.613 -11.864 -16.784 1.00 0.00 C ATOM 445 CD GLN A 29 10.598 -10.778 -17.240 1.00 0.00 C ATOM 446 OE1 GLN A 29 11.405 -10.279 -16.456 1.00 0.00 O ATOM 447 NE2 GLN A 29 10.566 -10.395 -18.504 1.00 0.00 N ATOM 0 H GLN A 29 7.720 -11.311 -13.970 1.00 0.00 H new ATOM 0 HA GLN A 29 8.160 -9.369 -16.206 1.00 0.00 H new ATOM 0 HB2 GLN A 29 7.553 -12.340 -16.399 1.00 0.00 H new ATOM 0 HB3 GLN A 29 7.792 -11.228 -17.733 1.00 0.00 H new ATOM 0 HG2 GLN A 29 9.917 -12.206 -15.795 1.00 0.00 H new ATOM 0 HG3 GLN A 29 9.709 -12.715 -17.458 1.00 0.00 H new ATOM 0 HE21 GLN A 29 9.894 -10.814 -19.147 1.00 0.00 H new ATOM 0 HE22 GLN A 29 11.213 -9.681 -18.837 1.00 0.00 H new ATOM 456 N ASP A 30 5.549 -9.812 -16.964 1.00 0.00 N ATOM 457 CA ASP A 30 4.164 -9.266 -17.079 1.00 0.00 C ATOM 458 C ASP A 30 3.086 -10.249 -16.518 1.00 0.00 C ATOM 459 O ASP A 30 2.714 -11.241 -17.153 1.00 0.00 O ATOM 460 CB ASP A 30 3.829 -8.832 -18.532 1.00 0.00 C ATOM 461 CG ASP A 30 4.748 -7.763 -19.150 1.00 0.00 C ATOM 462 OD1 ASP A 30 4.614 -6.569 -18.802 1.00 0.00 O ATOM 463 OD2 ASP A 30 5.612 -8.119 -19.982 1.00 0.00 O ATOM 0 H ASP A 30 5.985 -10.019 -17.863 1.00 0.00 H new ATOM 0 HA ASP A 30 4.136 -8.373 -16.455 1.00 0.00 H new ATOM 0 HB2 ASP A 30 3.856 -9.716 -19.169 1.00 0.00 H new ATOM 0 HB3 ASP A 30 2.806 -8.457 -18.550 1.00 0.00 H new ATOM 468 N GLY A 31 2.646 -9.946 -15.287 1.00 0.00 N ATOM 469 CA GLY A 31 1.768 -10.809 -14.472 1.00 0.00 C ATOM 470 C GLY A 31 2.440 -11.463 -13.240 1.00 0.00 C ATOM 471 O GLY A 31 2.094 -12.603 -12.936 1.00 0.00 O ATOM 0 H GLY A 31 2.895 -9.075 -14.817 1.00 0.00 H new ATOM 0 HA2 GLY A 31 0.920 -10.216 -14.130 1.00 0.00 H new ATOM 0 HA3 GLY A 31 1.369 -11.598 -15.109 1.00 0.00 H new ATOM 475 N THR A 32 3.339 -10.774 -12.501 1.00 0.00 N ATOM 476 CA THR A 32 3.947 -11.303 -11.255 1.00 0.00 C ATOM 477 C THR A 32 3.319 -10.488 -10.089 1.00 0.00 C ATOM 478 O THR A 32 3.351 -9.255 -10.070 1.00 0.00 O ATOM 479 CB THR A 32 5.501 -11.214 -11.365 1.00 0.00 C ATOM 480 OG1 THR A 32 5.981 -12.222 -12.248 1.00 0.00 O ATOM 481 CG2 THR A 32 6.273 -11.348 -10.043 1.00 0.00 C ATOM 0 H THR A 32 3.664 -9.839 -12.749 1.00 0.00 H new ATOM 0 HA THR A 32 3.742 -12.358 -11.075 1.00 0.00 H new ATOM 0 HB THR A 32 5.686 -10.205 -11.733 1.00 0.00 H new ATOM 0 HG1 THR A 32 6.957 -12.161 -12.315 1.00 0.00 H new ATOM 0 HG21 THR A 32 7.343 -11.271 -10.237 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.970 -10.552 -9.362 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.055 -12.315 -9.591 1.00 0.00 H new ATOM 489 N LYS A 33 2.789 -11.203 -9.088 1.00 0.00 N ATOM 490 CA LYS A 33 2.282 -10.589 -7.837 1.00 0.00 C ATOM 491 C LYS A 33 3.438 -10.428 -6.813 1.00 0.00 C ATOM 492 O LYS A 33 3.739 -11.352 -6.056 1.00 0.00 O ATOM 493 CB LYS A 33 1.142 -11.521 -7.332 1.00 0.00 C ATOM 494 CG LYS A 33 0.517 -11.232 -5.941 1.00 0.00 C ATOM 495 CD LYS A 33 -0.879 -10.587 -5.931 1.00 0.00 C ATOM 496 CE LYS A 33 -0.926 -9.141 -6.449 1.00 0.00 C ATOM 497 NZ LYS A 33 -2.270 -8.573 -6.239 1.00 0.00 N ATOM 0 H LYS A 33 2.696 -12.218 -9.114 1.00 0.00 H new ATOM 0 HA LYS A 33 1.890 -9.584 -7.992 1.00 0.00 H new ATOM 0 HB2 LYS A 33 0.339 -11.494 -8.069 1.00 0.00 H new ATOM 0 HB3 LYS A 33 1.528 -12.540 -7.318 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.462 -12.172 -5.391 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.197 -10.581 -5.391 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.550 -11.197 -6.537 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -1.265 -10.605 -4.912 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.182 -8.536 -5.931 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -0.674 -9.118 -7.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.196 -7.543 -6.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -2.867 -8.779 -7.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -2.697 -8.995 -5.390 1.00 0.00 H new ATOM 511 N ALA A 34 4.031 -9.226 -6.767 1.00 0.00 N ATOM 512 CA ALA A 34 5.026 -8.858 -5.731 1.00 0.00 C ATOM 513 C ALA A 34 4.324 -8.152 -4.540 1.00 0.00 C ATOM 514 O ALA A 34 3.776 -7.053 -4.677 1.00 0.00 O ATOM 515 CB ALA A 34 6.111 -7.991 -6.392 1.00 0.00 C ATOM 0 H ALA A 34 3.841 -8.482 -7.438 1.00 0.00 H new ATOM 0 HA ALA A 34 5.507 -9.744 -5.316 1.00 0.00 H new ATOM 0 HB1 ALA A 34 6.855 -7.708 -5.647 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.593 -8.557 -7.189 1.00 0.00 H new ATOM 0 HB3 ALA A 34 5.655 -7.093 -6.809 1.00 0.00 H new ATOM 521 N THR A 35 4.356 -8.821 -3.375 1.00 0.00 N ATOM 522 CA THR A 35 3.738 -8.332 -2.111 1.00 0.00 C ATOM 523 C THR A 35 4.881 -7.833 -1.181 1.00 0.00 C ATOM 524 O THR A 35 5.819 -8.568 -0.857 1.00 0.00 O ATOM 525 CB THR A 35 2.897 -9.472 -1.463 1.00 0.00 C ATOM 526 OG1 THR A 35 1.869 -9.890 -2.359 1.00 0.00 O ATOM 527 CG2 THR A 35 2.215 -9.069 -0.144 1.00 0.00 C ATOM 0 H THR A 35 4.814 -9.727 -3.274 1.00 0.00 H new ATOM 0 HA THR A 35 3.055 -7.503 -2.296 1.00 0.00 H new ATOM 0 HB THR A 35 3.608 -10.270 -1.250 1.00 0.00 H new ATOM 0 HG1 THR A 35 1.346 -10.608 -1.945 1.00 0.00 H new ATOM 0 HG21 THR A 35 1.649 -9.915 0.246 1.00 0.00 H new ATOM 0 HG22 THR A 35 2.973 -8.774 0.582 1.00 0.00 H new ATOM 0 HG23 THR A 35 1.540 -8.232 -0.324 1.00 0.00 H new ATOM 535 N PHE A 36 4.778 -6.562 -0.765 1.00 0.00 N ATOM 536 CA PHE A 36 5.858 -5.860 -0.016 1.00 0.00 C ATOM 537 C PHE A 36 5.278 -4.645 0.771 1.00 0.00 C ATOM 538 O PHE A 36 4.144 -4.215 0.556 1.00 0.00 O ATOM 539 CB PHE A 36 7.055 -5.487 -0.954 1.00 0.00 C ATOM 540 CG PHE A 36 6.789 -4.696 -2.242 1.00 0.00 C ATOM 541 CD1 PHE A 36 6.436 -5.379 -3.408 1.00 0.00 C ATOM 542 CD2 PHE A 36 6.924 -3.306 -2.276 1.00 0.00 C ATOM 543 CE1 PHE A 36 6.191 -4.679 -4.582 1.00 0.00 C ATOM 544 CE2 PHE A 36 6.671 -2.607 -3.452 1.00 0.00 C ATOM 545 CZ PHE A 36 6.304 -3.293 -4.601 1.00 0.00 C ATOM 0 H PHE A 36 3.953 -5.985 -0.932 1.00 0.00 H new ATOM 0 HA PHE A 36 6.272 -6.541 0.728 1.00 0.00 H new ATOM 0 HB2 PHE A 36 7.768 -4.915 -0.361 1.00 0.00 H new ATOM 0 HB3 PHE A 36 7.549 -6.416 -1.238 1.00 0.00 H new ATOM 0 HD1 PHE A 36 6.353 -6.456 -3.397 1.00 0.00 H new ATOM 0 HD2 PHE A 36 7.226 -2.772 -1.387 1.00 0.00 H new ATOM 0 HE1 PHE A 36 5.913 -5.211 -5.480 1.00 0.00 H new ATOM 0 HE2 PHE A 36 6.760 -1.531 -3.471 1.00 0.00 H new ATOM 0 HZ PHE A 36 6.106 -2.749 -5.513 1.00 0.00 H new ATOM 555 N HIS A 37 6.076 -4.072 1.685 1.00 0.00 N ATOM 556 CA HIS A 37 5.791 -2.747 2.307 1.00 0.00 C ATOM 557 C HIS A 37 6.477 -1.582 1.540 1.00 0.00 C ATOM 558 O HIS A 37 7.370 -1.795 0.723 1.00 0.00 O ATOM 559 CB HIS A 37 6.277 -2.789 3.776 1.00 0.00 C ATOM 560 CG HIS A 37 5.352 -3.532 4.732 1.00 0.00 C ATOM 561 ND1 HIS A 37 4.166 -2.998 5.171 1.00 0.00 N ATOM 562 CD2 HIS A 37 5.613 -4.732 5.414 1.00 0.00 C ATOM 563 CE1 HIS A 37 3.826 -3.922 6.104 1.00 0.00 C ATOM 564 NE2 HIS A 37 4.613 -5.020 6.329 1.00 0.00 N ATOM 0 H HIS A 37 6.937 -4.504 2.020 1.00 0.00 H new ATOM 0 HA HIS A 37 4.718 -2.559 2.263 1.00 0.00 H new ATOM 0 HB2 HIS A 37 7.260 -3.258 3.806 1.00 0.00 H new ATOM 0 HB3 HIS A 37 6.401 -1.767 4.133 1.00 0.00 H new ATOM 0 HD2 HIS A 37 6.482 -5.351 5.247 1.00 0.00 H new ATOM 0 HE1 HIS A 37 2.921 -3.790 6.678 1.00 0.00 H new ATOM 0 HE2 HIS A 37 4.499 -5.805 6.970 1.00 0.00 H new ATOM 572 N TYR A 38 6.044 -0.340 1.818 1.00 0.00 N ATOM 573 CA TYR A 38 6.556 0.886 1.146 1.00 0.00 C ATOM 574 C TYR A 38 6.548 2.082 2.144 1.00 0.00 C ATOM 575 O TYR A 38 5.612 2.242 2.936 1.00 0.00 O ATOM 576 CB TYR A 38 5.719 1.155 -0.152 1.00 0.00 C ATOM 577 CG TYR A 38 4.402 1.969 -0.078 1.00 0.00 C ATOM 578 CD1 TYR A 38 3.228 1.398 0.415 1.00 0.00 C ATOM 579 CD2 TYR A 38 4.367 3.284 -0.556 1.00 0.00 C ATOM 580 CE1 TYR A 38 2.026 2.101 0.376 1.00 0.00 C ATOM 581 CE2 TYR A 38 3.170 3.995 -0.583 1.00 0.00 C ATOM 582 CZ TYR A 38 1.996 3.396 -0.134 1.00 0.00 C ATOM 583 OH TYR A 38 0.805 4.067 -0.217 1.00 0.00 O ATOM 0 H TYR A 38 5.326 -0.148 2.517 1.00 0.00 H new ATOM 0 HA TYR A 38 7.592 0.750 0.836 1.00 0.00 H new ATOM 0 HB2 TYR A 38 6.374 1.664 -0.859 1.00 0.00 H new ATOM 0 HB3 TYR A 38 5.475 0.185 -0.586 1.00 0.00 H new ATOM 0 HD1 TYR A 38 3.252 0.402 0.831 1.00 0.00 H new ATOM 0 HD2 TYR A 38 5.276 3.751 -0.907 1.00 0.00 H new ATOM 0 HE1 TYR A 38 1.119 1.642 0.741 1.00 0.00 H new ATOM 0 HE2 TYR A 38 3.152 5.010 -0.952 1.00 0.00 H new ATOM 0 HH TYR A 38 0.957 4.959 -0.594 1.00 0.00 H new ATOM 593 N ARG A 39 7.569 2.950 2.061 1.00 0.00 N ATOM 594 CA ARG A 39 7.659 4.168 2.908 1.00 0.00 C ATOM 595 C ARG A 39 8.325 5.275 2.061 1.00 0.00 C ATOM 596 O ARG A 39 9.553 5.348 1.937 1.00 0.00 O ATOM 597 CB ARG A 39 8.428 3.864 4.217 1.00 0.00 C ATOM 598 CG ARG A 39 8.127 4.794 5.417 1.00 0.00 C ATOM 599 CD ARG A 39 9.213 5.840 5.747 1.00 0.00 C ATOM 600 NE ARG A 39 10.540 5.269 6.106 1.00 0.00 N ATOM 601 CZ ARG A 39 10.863 4.753 7.309 1.00 0.00 C ATOM 602 NH1 ARG A 39 10.028 4.699 8.345 1.00 0.00 N ATOM 603 NH2 ARG A 39 12.080 4.269 7.468 1.00 0.00 N ATOM 0 H ARG A 39 8.351 2.837 1.416 1.00 0.00 H new ATOM 0 HA ARG A 39 6.671 4.509 3.219 1.00 0.00 H new ATOM 0 HB2 ARG A 39 8.207 2.839 4.514 1.00 0.00 H new ATOM 0 HB3 ARG A 39 9.496 3.912 4.006 1.00 0.00 H new ATOM 0 HG2 ARG A 39 7.192 5.319 5.220 1.00 0.00 H new ATOM 0 HG3 ARG A 39 7.965 4.175 6.300 1.00 0.00 H new ATOM 0 HD2 ARG A 39 9.337 6.498 4.887 1.00 0.00 H new ATOM 0 HD3 ARG A 39 8.863 6.458 6.574 1.00 0.00 H new ATOM 0 HE ARG A 39 11.262 5.268 5.385 1.00 0.00 H new ATOM 0 HH11 ARG A 39 9.079 5.062 8.255 1.00 0.00 H new ATOM 0 HH12 ARG A 39 10.337 4.295 9.229 1.00 0.00 H new ATOM 0 HH21 ARG A 39 12.743 4.293 6.694 1.00 0.00 H new ATOM 0 HH22 ARG A 39 12.357 3.871 8.365 1.00 0.00 H new ATOM 617 N THR A 40 7.481 6.135 1.477 1.00 0.00 N ATOM 618 CA THR A 40 7.930 7.240 0.601 1.00 0.00 C ATOM 619 C THR A 40 8.149 8.501 1.461 1.00 0.00 C ATOM 620 O THR A 40 7.217 9.010 2.091 1.00 0.00 O ATOM 621 CB THR A 40 6.941 7.496 -0.565 1.00 0.00 C ATOM 622 OG1 THR A 40 5.611 7.711 -0.110 1.00 0.00 O ATOM 623 CG2 THR A 40 6.941 6.339 -1.563 1.00 0.00 C ATOM 0 H THR A 40 6.469 6.090 1.594 1.00 0.00 H new ATOM 0 HA THR A 40 8.873 6.961 0.132 1.00 0.00 H new ATOM 0 HB THR A 40 7.291 8.403 -1.058 1.00 0.00 H new ATOM 0 HG1 THR A 40 4.985 7.569 -0.850 1.00 0.00 H new ATOM 0 HG21 THR A 40 6.237 6.552 -2.367 1.00 0.00 H new ATOM 0 HG22 THR A 40 7.941 6.218 -1.979 1.00 0.00 H new ATOM 0 HG23 THR A 40 6.645 5.421 -1.056 1.00 0.00 H new ATOM 631 N LEU A 41 9.397 8.986 1.478 1.00 0.00 N ATOM 632 CA LEU A 41 9.771 10.228 2.183 1.00 0.00 C ATOM 633 C LEU A 41 10.676 11.106 1.278 1.00 0.00 C ATOM 634 O LEU A 41 11.390 10.622 0.396 1.00 0.00 O ATOM 635 CB LEU A 41 10.347 9.884 3.586 1.00 0.00 C ATOM 636 CG LEU A 41 11.810 9.361 3.701 1.00 0.00 C ATOM 637 CD1 LEU A 41 12.434 9.788 5.043 1.00 0.00 C ATOM 638 CD2 LEU A 41 11.922 7.836 3.523 1.00 0.00 C ATOM 0 H LEU A 41 10.178 8.532 1.005 1.00 0.00 H new ATOM 0 HA LEU A 41 8.897 10.848 2.381 1.00 0.00 H new ATOM 0 HB2 LEU A 41 10.270 10.781 4.201 1.00 0.00 H new ATOM 0 HB3 LEU A 41 9.695 9.134 4.033 1.00 0.00 H new ATOM 0 HG LEU A 41 12.365 9.816 2.880 1.00 0.00 H new ATOM 0 HD11 LEU A 41 13.456 9.413 5.105 1.00 0.00 H new ATOM 0 HD12 LEU A 41 12.442 10.876 5.111 1.00 0.00 H new ATOM 0 HD13 LEU A 41 11.847 9.377 5.864 1.00 0.00 H new ATOM 0 HD21 LEU A 41 12.966 7.535 3.614 1.00 0.00 H new ATOM 0 HD22 LEU A 41 11.332 7.336 4.291 1.00 0.00 H new ATOM 0 HD23 LEU A 41 11.548 7.556 2.538 1.00 0.00 H new ATOM 650 N HIS A 42 10.666 12.420 1.539 1.00 0.00 N ATOM 651 CA HIS A 42 11.468 13.414 0.780 1.00 0.00 C ATOM 652 C HIS A 42 12.989 13.269 1.083 1.00 0.00 C ATOM 653 O HIS A 42 13.395 13.008 2.219 1.00 0.00 O ATOM 654 CB HIS A 42 10.915 14.832 1.101 1.00 0.00 C ATOM 655 CG HIS A 42 9.597 15.148 0.381 1.00 0.00 C ATOM 656 ND1 HIS A 42 8.336 14.777 0.815 1.00 0.00 N ATOM 657 CD2 HIS A 42 9.503 15.737 -0.886 1.00 0.00 C ATOM 658 CE1 HIS A 42 7.581 15.206 -0.241 1.00 0.00 C ATOM 659 NE2 HIS A 42 8.184 15.799 -1.320 1.00 0.00 N ATOM 0 H HIS A 42 10.103 12.834 2.282 1.00 0.00 H new ATOM 0 HA HIS A 42 11.373 13.238 -0.292 1.00 0.00 H new ATOM 0 HB2 HIS A 42 10.763 14.920 2.177 1.00 0.00 H new ATOM 0 HB3 HIS A 42 11.661 15.577 0.822 1.00 0.00 H new ATOM 0 HD2 HIS A 42 10.348 16.097 -1.454 1.00 0.00 H new ATOM 0 HE1 HIS A 42 6.509 15.078 -0.225 1.00 0.00 H new ATOM 0 HE2 HIS A 42 7.785 16.173 -2.181 1.00 0.00 H new ATOM 667 N SER A 43 13.813 13.379 0.026 1.00 0.00 N ATOM 668 CA SER A 43 15.255 13.010 0.084 1.00 0.00 C ATOM 669 C SER A 43 16.130 14.049 0.842 1.00 0.00 C ATOM 670 O SER A 43 16.683 13.710 1.893 1.00 0.00 O ATOM 671 CB SER A 43 15.753 12.679 -1.345 1.00 0.00 C ATOM 672 OG SER A 43 17.067 12.137 -1.311 1.00 0.00 O ATOM 0 H SER A 43 13.511 13.721 -0.886 1.00 0.00 H new ATOM 0 HA SER A 43 15.363 12.111 0.691 1.00 0.00 H new ATOM 0 HB2 SER A 43 15.074 11.968 -1.816 1.00 0.00 H new ATOM 0 HB3 SER A 43 15.743 13.582 -1.956 1.00 0.00 H new ATOM 0 HG SER A 43 17.361 11.934 -2.224 1.00 0.00 H new ATOM 678 N ASP A 44 16.246 15.287 0.322 1.00 0.00 N ATOM 679 CA ASP A 44 16.996 16.392 0.991 1.00 0.00 C ATOM 680 C ASP A 44 16.287 17.790 0.963 1.00 0.00 C ATOM 681 O ASP A 44 16.796 18.714 1.606 1.00 0.00 O ATOM 682 CB ASP A 44 18.434 16.432 0.390 1.00 0.00 C ATOM 683 CG ASP A 44 19.480 17.181 1.228 1.00 0.00 C ATOM 684 OD1 ASP A 44 19.991 16.603 2.213 1.00 0.00 O ATOM 685 OD2 ASP A 44 19.792 18.349 0.907 1.00 0.00 O ATOM 0 H ASP A 44 15.828 15.558 -0.568 1.00 0.00 H new ATOM 0 HA ASP A 44 17.036 16.170 2.057 1.00 0.00 H new ATOM 0 HB2 ASP A 44 18.777 15.408 0.244 1.00 0.00 H new ATOM 0 HB3 ASP A 44 18.384 16.895 -0.596 1.00 0.00 H new ATOM 690 N ASP A 45 15.124 17.966 0.294 1.00 0.00 N ATOM 691 CA ASP A 45 14.334 19.230 0.335 1.00 0.00 C ATOM 692 C ASP A 45 13.771 19.567 1.752 1.00 0.00 C ATOM 693 O ASP A 45 14.030 20.665 2.251 1.00 0.00 O ATOM 694 CB ASP A 45 13.218 19.154 -0.739 1.00 0.00 C ATOM 695 CG ASP A 45 12.580 20.506 -1.092 1.00 0.00 C ATOM 696 OD1 ASP A 45 11.622 20.921 -0.402 1.00 0.00 O ATOM 697 OD2 ASP A 45 13.028 21.151 -2.065 1.00 0.00 O ATOM 0 H ASP A 45 14.704 17.242 -0.289 1.00 0.00 H new ATOM 0 HA ASP A 45 15.004 20.059 0.107 1.00 0.00 H new ATOM 0 HB2 ASP A 45 13.634 18.715 -1.646 1.00 0.00 H new ATOM 0 HB3 ASP A 45 12.438 18.479 -0.387 1.00 0.00 H new ATOM 702 N GLU A 46 13.028 18.631 2.377 1.00 0.00 N ATOM 703 CA GLU A 46 12.598 18.738 3.795 1.00 0.00 C ATOM 704 C GLU A 46 13.112 17.538 4.651 1.00 0.00 C ATOM 705 O GLU A 46 13.455 17.736 5.820 1.00 0.00 O ATOM 706 CB GLU A 46 11.049 18.909 3.886 1.00 0.00 C ATOM 707 CG GLU A 46 10.516 19.801 5.034 1.00 0.00 C ATOM 708 CD GLU A 46 10.855 19.360 6.463 1.00 0.00 C ATOM 709 OE1 GLU A 46 10.272 18.369 6.952 1.00 0.00 O ATOM 710 OE2 GLU A 46 11.717 20.004 7.101 1.00 0.00 O ATOM 0 H GLU A 46 12.707 17.779 1.917 1.00 0.00 H new ATOM 0 HA GLU A 46 13.055 19.632 4.220 1.00 0.00 H new ATOM 0 HB2 GLU A 46 10.696 19.322 2.941 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.602 17.920 3.988 1.00 0.00 H new ATOM 0 HG2 GLU A 46 10.902 20.810 4.889 1.00 0.00 H new ATOM 0 HG3 GLU A 46 9.431 19.859 4.944 1.00 0.00 H new ATOM 717 N GLY A 47 13.103 16.304 4.109 1.00 0.00 N ATOM 718 CA GLY A 47 13.108 15.071 4.927 1.00 0.00 C ATOM 719 C GLY A 47 11.741 14.547 5.453 1.00 0.00 C ATOM 720 O GLY A 47 11.743 13.642 6.291 1.00 0.00 O ATOM 0 H GLY A 47 13.092 16.133 3.104 1.00 0.00 H new ATOM 0 HA2 GLY A 47 13.566 14.278 4.336 1.00 0.00 H new ATOM 0 HA3 GLY A 47 13.755 15.242 5.787 1.00 0.00 H new ATOM 724 N THR A 48 10.600 15.091 4.979 1.00 0.00 N ATOM 725 CA THR A 48 9.241 14.734 5.480 1.00 0.00 C ATOM 726 C THR A 48 8.708 13.418 4.850 1.00 0.00 C ATOM 727 O THR A 48 8.839 13.197 3.645 1.00 0.00 O ATOM 728 CB THR A 48 8.265 15.931 5.270 1.00 0.00 C ATOM 729 OG1 THR A 48 7.057 15.698 5.988 1.00 0.00 O ATOM 730 CG2 THR A 48 7.895 16.269 3.812 1.00 0.00 C ATOM 0 H THR A 48 10.587 15.791 4.238 1.00 0.00 H new ATOM 0 HA THR A 48 9.312 14.539 6.550 1.00 0.00 H new ATOM 0 HB THR A 48 8.823 16.791 5.641 1.00 0.00 H new ATOM 0 HG1 THR A 48 6.447 16.453 5.855 1.00 0.00 H new ATOM 0 HG21 THR A 48 7.212 17.118 3.798 1.00 0.00 H new ATOM 0 HG22 THR A 48 8.798 16.521 3.256 1.00 0.00 H new ATOM 0 HG23 THR A 48 7.413 15.407 3.350 1.00 0.00 H new ATOM 738 N VAL A 49 8.048 12.589 5.672 1.00 0.00 N ATOM 739 CA VAL A 49 7.407 11.329 5.208 1.00 0.00 C ATOM 740 C VAL A 49 5.971 11.653 4.719 1.00 0.00 C ATOM 741 O VAL A 49 5.091 12.039 5.495 1.00 0.00 O ATOM 742 CB VAL A 49 7.557 10.162 6.238 1.00 0.00 C ATOM 743 CG1 VAL A 49 7.054 10.476 7.664 1.00 0.00 C ATOM 744 CG2 VAL A 49 6.936 8.837 5.748 1.00 0.00 C ATOM 0 H VAL A 49 7.938 12.762 6.671 1.00 0.00 H new ATOM 0 HA VAL A 49 7.933 10.921 4.345 1.00 0.00 H new ATOM 0 HB VAL A 49 8.638 10.043 6.307 1.00 0.00 H new ATOM 0 HG11 VAL A 49 7.202 9.605 8.302 1.00 0.00 H new ATOM 0 HG12 VAL A 49 7.612 11.321 8.069 1.00 0.00 H new ATOM 0 HG13 VAL A 49 5.993 10.725 7.629 1.00 0.00 H new ATOM 0 HG21 VAL A 49 7.074 8.068 6.508 1.00 0.00 H new ATOM 0 HG22 VAL A 49 5.871 8.980 5.565 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.424 8.526 4.824 1.00 0.00 H new ATOM 754 N LEU A 50 5.782 11.479 3.402 1.00 0.00 N ATOM 755 CA LEU A 50 4.465 11.619 2.741 1.00 0.00 C ATOM 756 C LEU A 50 3.548 10.360 2.861 1.00 0.00 C ATOM 757 O LEU A 50 2.327 10.518 2.944 1.00 0.00 O ATOM 758 CB LEU A 50 4.676 12.103 1.273 1.00 0.00 C ATOM 759 CG LEU A 50 5.189 11.062 0.232 1.00 0.00 C ATOM 760 CD1 LEU A 50 4.096 10.664 -0.773 1.00 0.00 C ATOM 761 CD2 LEU A 50 6.450 11.532 -0.507 1.00 0.00 C ATOM 0 H LEU A 50 6.536 11.237 2.760 1.00 0.00 H new ATOM 0 HA LEU A 50 3.900 12.380 3.279 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.727 12.499 0.911 1.00 0.00 H new ATOM 0 HB3 LEU A 50 5.382 12.934 1.292 1.00 0.00 H new ATOM 0 HG LEU A 50 5.459 10.178 0.810 1.00 0.00 H new ATOM 0 HD11 LEU A 50 4.498 9.937 -1.479 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.254 10.224 -0.239 1.00 0.00 H new ATOM 0 HD13 LEU A 50 3.760 11.548 -1.314 1.00 0.00 H new ATOM 0 HD21 LEU A 50 6.761 10.767 -1.219 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.235 12.458 -1.040 1.00 0.00 H new ATOM 0 HD23 LEU A 50 7.250 11.705 0.213 1.00 0.00 H new ATOM 773 N ASP A 51 4.130 9.136 2.839 1.00 0.00 N ATOM 774 CA ASP A 51 3.376 7.866 2.936 1.00 0.00 C ATOM 775 C ASP A 51 4.228 6.813 3.708 1.00 0.00 C ATOM 776 O ASP A 51 5.460 6.794 3.635 1.00 0.00 O ATOM 777 CB ASP A 51 2.947 7.361 1.525 1.00 0.00 C ATOM 778 CG ASP A 51 1.544 6.743 1.484 1.00 0.00 C ATOM 779 OD1 ASP A 51 1.302 5.731 2.180 1.00 0.00 O ATOM 780 OD2 ASP A 51 0.677 7.263 0.748 1.00 0.00 O ATOM 0 H ASP A 51 5.138 9.004 2.753 1.00 0.00 H new ATOM 0 HA ASP A 51 2.456 8.033 3.496 1.00 0.00 H new ATOM 0 HB2 ASP A 51 2.986 8.195 0.824 1.00 0.00 H new ATOM 0 HB3 ASP A 51 3.669 6.621 1.180 1.00 0.00 H new ATOM 785 N ASP A 52 3.545 5.941 4.468 1.00 0.00 N ATOM 786 CA ASP A 52 4.195 4.991 5.410 1.00 0.00 C ATOM 787 C ASP A 52 3.231 3.804 5.667 1.00 0.00 C ATOM 788 O ASP A 52 2.170 3.979 6.271 1.00 0.00 O ATOM 789 CB ASP A 52 4.682 5.686 6.718 1.00 0.00 C ATOM 790 CG ASP A 52 3.686 6.574 7.495 1.00 0.00 C ATOM 791 OD1 ASP A 52 2.864 6.042 8.273 1.00 0.00 O ATOM 792 OD2 ASP A 52 3.726 7.811 7.318 1.00 0.00 O ATOM 0 H ASP A 52 2.528 5.868 4.453 1.00 0.00 H new ATOM 0 HA ASP A 52 5.106 4.602 4.957 1.00 0.00 H new ATOM 0 HB2 ASP A 52 5.032 4.908 7.397 1.00 0.00 H new ATOM 0 HB3 ASP A 52 5.546 6.300 6.465 1.00 0.00 H new ATOM 797 N SER A 53 3.606 2.603 5.193 1.00 0.00 N ATOM 798 CA SER A 53 2.748 1.381 5.282 1.00 0.00 C ATOM 799 C SER A 53 3.173 0.379 6.383 1.00 0.00 C ATOM 800 O SER A 53 2.333 -0.031 7.186 1.00 0.00 O ATOM 801 CB SER A 53 2.599 0.711 3.908 1.00 0.00 C ATOM 802 OG SER A 53 3.754 -0.004 3.508 1.00 0.00 O ATOM 0 H SER A 53 4.504 2.440 4.738 1.00 0.00 H new ATOM 0 HA SER A 53 1.765 1.730 5.600 1.00 0.00 H new ATOM 0 HB2 SER A 53 1.749 0.030 3.933 1.00 0.00 H new ATOM 0 HB3 SER A 53 2.375 1.473 3.162 1.00 0.00 H new ATOM 0 HG SER A 53 3.822 -0.832 4.027 1.00 0.00 H new ATOM 808 N ARG A 54 4.468 0.007 6.437 1.00 0.00 N ATOM 809 CA ARG A 54 5.081 -0.691 7.597 1.00 0.00 C ATOM 810 C ARG A 54 5.040 0.031 8.974 1.00 0.00 C ATOM 811 O ARG A 54 5.185 -0.631 10.006 1.00 0.00 O ATOM 812 CB ARG A 54 6.547 -1.101 7.259 1.00 0.00 C ATOM 813 CG ARG A 54 7.485 -0.084 6.544 1.00 0.00 C ATOM 814 CD ARG A 54 7.862 1.225 7.271 1.00 0.00 C ATOM 815 NE ARG A 54 8.520 1.039 8.590 1.00 0.00 N ATOM 816 CZ ARG A 54 9.847 0.888 8.777 1.00 0.00 C ATOM 817 NH1 ARG A 54 10.741 0.859 7.791 1.00 0.00 N ATOM 818 NH2 ARG A 54 10.286 0.756 10.014 1.00 0.00 N ATOM 0 H ARG A 54 5.125 0.181 5.676 1.00 0.00 H new ATOM 0 HA ARG A 54 4.434 -1.556 7.741 1.00 0.00 H new ATOM 0 HB2 ARG A 54 7.029 -1.388 8.194 1.00 0.00 H new ATOM 0 HB3 ARG A 54 6.500 -1.995 6.637 1.00 0.00 H new ATOM 0 HG2 ARG A 54 8.412 -0.605 6.302 1.00 0.00 H new ATOM 0 HG3 ARG A 54 7.016 0.188 5.598 1.00 0.00 H new ATOM 0 HD2 ARG A 54 8.526 1.803 6.628 1.00 0.00 H new ATOM 0 HD3 ARG A 54 6.959 1.819 7.412 1.00 0.00 H new ATOM 0 HE ARG A 54 7.923 1.024 9.417 1.00 0.00 H new ATOM 0 HH11 ARG A 54 10.435 0.954 6.823 1.00 0.00 H new ATOM 0 HH12 ARG A 54 11.732 0.742 8.004 1.00 0.00 H new ATOM 0 HH21 ARG A 54 9.628 0.770 10.793 1.00 0.00 H new ATOM 0 HH22 ARG A 54 11.284 0.640 10.191 1.00 0.00 H new ATOM 832 N ALA A 55 4.811 1.357 8.986 1.00 0.00 N ATOM 833 CA ALA A 55 4.516 2.118 10.220 1.00 0.00 C ATOM 834 C ALA A 55 3.239 1.674 11.005 1.00 0.00 C ATOM 835 O ALA A 55 3.282 1.589 12.235 1.00 0.00 O ATOM 836 CB ALA A 55 4.456 3.603 9.841 1.00 0.00 C ATOM 0 H ALA A 55 4.825 1.932 8.144 1.00 0.00 H new ATOM 0 HA ALA A 55 5.319 1.910 10.928 1.00 0.00 H new ATOM 0 HB1 ALA A 55 4.240 4.197 10.729 1.00 0.00 H new ATOM 0 HB2 ALA A 55 5.415 3.911 9.423 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.671 3.758 9.101 1.00 0.00 H new ATOM 842 N ARG A 56 2.144 1.363 10.286 1.00 0.00 N ATOM 843 CA ARG A 56 0.965 0.635 10.841 1.00 0.00 C ATOM 844 C ARG A 56 0.991 -0.930 10.704 1.00 0.00 C ATOM 845 O ARG A 56 0.134 -1.585 11.305 1.00 0.00 O ATOM 846 CB ARG A 56 -0.349 1.240 10.266 1.00 0.00 C ATOM 847 CG ARG A 56 -0.513 1.368 8.724 1.00 0.00 C ATOM 848 CD ARG A 56 -0.173 2.743 8.109 1.00 0.00 C ATOM 849 NE ARG A 56 -1.133 3.800 8.522 1.00 0.00 N ATOM 850 CZ ARG A 56 -1.140 5.063 8.050 1.00 0.00 C ATOM 851 NH1 ARG A 56 -0.311 5.516 7.113 1.00 0.00 N ATOM 852 NH2 ARG A 56 -2.027 5.903 8.547 1.00 0.00 N ATOM 0 H ARG A 56 2.042 1.606 9.301 1.00 0.00 H new ATOM 0 HA ARG A 56 1.014 0.791 11.919 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -1.178 0.636 10.635 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -0.466 2.236 10.692 1.00 0.00 H new ATOM 0 HG2 ARG A 56 0.118 0.616 8.250 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -1.545 1.125 8.469 1.00 0.00 H new ATOM 0 HD2 ARG A 56 0.834 3.033 8.408 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -0.171 2.662 7.022 1.00 0.00 H new ATOM 0 HE ARG A 56 -1.839 3.551 9.214 1.00 0.00 H new ATOM 0 HH11 ARG A 56 0.386 4.894 6.705 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -0.373 6.486 6.803 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -2.680 5.590 9.266 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -2.060 6.866 8.213 1.00 0.00 H new ATOM 866 N GLY A 57 1.925 -1.529 9.939 1.00 0.00 N ATOM 867 CA GLY A 57 1.942 -2.986 9.657 1.00 0.00 C ATOM 868 C GLY A 57 0.959 -3.528 8.590 1.00 0.00 C ATOM 869 O GLY A 57 0.562 -4.692 8.690 1.00 0.00 O ATOM 0 H GLY A 57 2.691 -1.020 9.497 1.00 0.00 H new ATOM 0 HA2 GLY A 57 2.952 -3.255 9.349 1.00 0.00 H new ATOM 0 HA3 GLY A 57 1.743 -3.510 10.592 1.00 0.00 H new ATOM 873 N LYS A 58 0.599 -2.715 7.576 1.00 0.00 N ATOM 874 CA LYS A 58 -0.385 -3.088 6.528 1.00 0.00 C ATOM 875 C LYS A 58 0.346 -3.109 5.145 1.00 0.00 C ATOM 876 O LYS A 58 0.590 -2.026 4.602 1.00 0.00 O ATOM 877 CB LYS A 58 -1.598 -2.108 6.532 1.00 0.00 C ATOM 878 CG LYS A 58 -2.348 -1.872 7.866 1.00 0.00 C ATOM 879 CD LYS A 58 -2.833 -3.149 8.572 1.00 0.00 C ATOM 880 CE LYS A 58 -3.702 -2.858 9.806 1.00 0.00 C ATOM 881 NZ LYS A 58 -4.137 -4.104 10.459 1.00 0.00 N ATOM 0 H LYS A 58 0.981 -1.777 7.457 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.788 -4.080 6.729 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -1.245 -1.141 6.174 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -2.322 -2.473 5.804 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -1.691 -1.327 8.544 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.209 -1.232 7.673 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -3.403 -3.753 7.867 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -1.969 -3.741 8.874 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -3.139 -2.251 10.515 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.575 -2.276 9.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.722 -3.876 11.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -4.694 -4.671 9.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -3.303 -4.646 10.762 1.00 0.00 H new ATOM 895 N PRO A 59 0.722 -4.273 4.536 1.00 0.00 N ATOM 896 CA PRO A 59 1.521 -4.309 3.280 1.00 0.00 C ATOM 897 C PRO A 59 0.686 -4.070 1.996 1.00 0.00 C ATOM 898 O PRO A 59 -0.470 -4.492 1.878 1.00 0.00 O ATOM 899 CB PRO A 59 2.156 -5.713 3.323 1.00 0.00 C ATOM 900 CG PRO A 59 1.209 -6.566 4.170 1.00 0.00 C ATOM 901 CD PRO A 59 0.583 -5.599 5.166 1.00 0.00 C ATOM 0 HA PRO A 59 2.252 -3.502 3.233 1.00 0.00 H new ATOM 0 HB2 PRO A 59 2.264 -6.125 2.320 1.00 0.00 H new ATOM 0 HB3 PRO A 59 3.153 -5.679 3.763 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.448 -7.042 3.551 1.00 0.00 H new ATOM 0 HG3 PRO A 59 1.748 -7.363 4.681 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.463 -5.842 5.350 1.00 0.00 H new ATOM 0 HD3 PRO A 59 1.093 -5.636 6.128 1.00 0.00 H new ATOM 909 N MET A 60 1.335 -3.404 1.031 1.00 0.00 N ATOM 910 CA MET A 60 0.774 -3.176 -0.324 1.00 0.00 C ATOM 911 C MET A 60 0.990 -4.401 -1.270 1.00 0.00 C ATOM 912 O MET A 60 1.670 -5.382 -0.946 1.00 0.00 O ATOM 913 CB MET A 60 1.341 -1.835 -0.879 1.00 0.00 C ATOM 914 CG MET A 60 2.873 -1.706 -0.964 1.00 0.00 C ATOM 915 SD MET A 60 3.636 -3.035 -1.903 1.00 0.00 S ATOM 916 CE MET A 60 3.249 -2.559 -3.581 1.00 0.00 C ATOM 0 H MET A 60 2.265 -3.005 1.160 1.00 0.00 H new ATOM 0 HA MET A 60 -0.310 -3.081 -0.264 1.00 0.00 H new ATOM 0 HB2 MET A 60 0.932 -1.682 -1.878 1.00 0.00 H new ATOM 0 HB3 MET A 60 0.967 -1.024 -0.254 1.00 0.00 H new ATOM 0 HG2 MET A 60 3.127 -0.751 -1.424 1.00 0.00 H new ATOM 0 HG3 MET A 60 3.288 -1.695 0.044 1.00 0.00 H new ATOM 0 HE1 MET A 60 3.384 -3.415 -4.242 1.00 0.00 H new ATOM 0 HE2 MET A 60 2.215 -2.220 -3.634 1.00 0.00 H new ATOM 0 HE3 MET A 60 3.912 -1.752 -3.892 1.00 0.00 H new ATOM 926 N GLU A 61 0.376 -4.302 -2.457 1.00 0.00 N ATOM 927 CA GLU A 61 0.493 -5.313 -3.534 1.00 0.00 C ATOM 928 C GLU A 61 0.629 -4.585 -4.895 1.00 0.00 C ATOM 929 O GLU A 61 -0.223 -3.784 -5.296 1.00 0.00 O ATOM 930 CB GLU A 61 -0.721 -6.275 -3.564 1.00 0.00 C ATOM 931 CG GLU A 61 -0.756 -7.321 -2.432 1.00 0.00 C ATOM 932 CD GLU A 61 -1.513 -6.907 -1.164 1.00 0.00 C ATOM 933 OE1 GLU A 61 -2.738 -6.661 -1.241 1.00 0.00 O ATOM 934 OE2 GLU A 61 -0.890 -6.839 -0.082 1.00 0.00 O ATOM 0 H GLU A 61 -0.222 -3.514 -2.705 1.00 0.00 H new ATOM 0 HA GLU A 61 1.377 -5.919 -3.339 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -1.635 -5.683 -3.519 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -0.727 -6.798 -4.521 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -1.208 -8.234 -2.820 1.00 0.00 H new ATOM 0 HG3 GLU A 61 0.270 -7.565 -2.157 1.00 0.00 H new ATOM 941 N LEU A 62 1.720 -4.923 -5.595 1.00 0.00 N ATOM 942 CA LEU A 62 2.033 -4.414 -6.950 1.00 0.00 C ATOM 943 C LEU A 62 1.948 -5.626 -7.911 1.00 0.00 C ATOM 944 O LEU A 62 2.593 -6.664 -7.726 1.00 0.00 O ATOM 945 CB LEU A 62 3.423 -3.713 -6.936 1.00 0.00 C ATOM 946 CG LEU A 62 4.159 -3.486 -8.288 1.00 0.00 C ATOM 947 CD1 LEU A 62 3.748 -2.184 -8.975 1.00 0.00 C ATOM 948 CD2 LEU A 62 5.674 -3.636 -8.168 1.00 0.00 C ATOM 0 H LEU A 62 2.425 -5.567 -5.236 1.00 0.00 H new ATOM 0 HA LEU A 62 1.329 -3.655 -7.291 1.00 0.00 H new ATOM 0 HB2 LEU A 62 3.298 -2.740 -6.460 1.00 0.00 H new ATOM 0 HB3 LEU A 62 4.082 -4.299 -6.295 1.00 0.00 H new ATOM 0 HG LEU A 62 3.828 -4.289 -8.946 1.00 0.00 H new ATOM 0 HD11 LEU A 62 4.294 -2.079 -9.913 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.677 -2.202 -9.178 1.00 0.00 H new ATOM 0 HD13 LEU A 62 3.980 -1.341 -8.325 1.00 0.00 H new ATOM 0 HD21 LEU A 62 6.135 -3.467 -9.141 1.00 0.00 H new ATOM 0 HD22 LEU A 62 6.056 -2.907 -7.454 1.00 0.00 H new ATOM 0 HD23 LEU A 62 5.914 -4.642 -7.823 1.00 0.00 H new ATOM 960 N ILE A 63 1.200 -5.403 -8.996 1.00 0.00 N ATOM 961 CA ILE A 63 1.153 -6.318 -10.167 1.00 0.00 C ATOM 962 C ILE A 63 2.230 -5.771 -11.147 1.00 0.00 C ATOM 963 O ILE A 63 2.218 -4.598 -11.542 1.00 0.00 O ATOM 964 CB ILE A 63 -0.278 -6.412 -10.812 1.00 0.00 C ATOM 965 CG1 ILE A 63 -1.386 -7.032 -9.907 1.00 0.00 C ATOM 966 CG2 ILE A 63 -0.282 -7.239 -12.128 1.00 0.00 C ATOM 967 CD1 ILE A 63 -1.764 -6.225 -8.661 1.00 0.00 C ATOM 0 H ILE A 63 0.603 -4.582 -9.098 1.00 0.00 H new ATOM 0 HA ILE A 63 1.364 -7.348 -9.880 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.515 -5.362 -10.986 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -2.283 -7.173 -10.510 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.056 -8.021 -9.589 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.293 -7.273 -12.533 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.384 -6.771 -12.854 1.00 0.00 H new ATOM 0 HG23 ILE A 63 0.061 -8.253 -11.922 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -2.542 -6.751 -8.109 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -0.887 -6.105 -8.026 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -2.132 -5.244 -8.961 1.00 0.00 H new ATOM 979 N ILE A 64 3.128 -6.671 -11.569 1.00 0.00 N ATOM 980 CA ILE A 64 4.165 -6.355 -12.596 1.00 0.00 C ATOM 981 C ILE A 64 3.471 -6.255 -13.992 1.00 0.00 C ATOM 982 O ILE A 64 3.060 -7.273 -14.540 1.00 0.00 O ATOM 983 CB ILE A 64 5.365 -7.369 -12.603 1.00 0.00 C ATOM 984 CG1 ILE A 64 6.078 -7.612 -11.241 1.00 0.00 C ATOM 985 CG2 ILE A 64 6.429 -7.034 -13.683 1.00 0.00 C ATOM 986 CD1 ILE A 64 6.778 -6.425 -10.594 1.00 0.00 C ATOM 0 H ILE A 64 3.168 -7.629 -11.222 1.00 0.00 H new ATOM 0 HA ILE A 64 4.618 -5.397 -12.342 1.00 0.00 H new ATOM 0 HB ILE A 64 4.861 -8.304 -12.847 1.00 0.00 H new ATOM 0 HG12 ILE A 64 5.338 -7.991 -10.536 1.00 0.00 H new ATOM 0 HG13 ILE A 64 6.816 -8.401 -11.384 1.00 0.00 H new ATOM 0 HG21 ILE A 64 7.234 -7.768 -13.641 1.00 0.00 H new ATOM 0 HG22 ILE A 64 5.966 -7.059 -14.670 1.00 0.00 H new ATOM 0 HG23 ILE A 64 6.835 -6.039 -13.498 1.00 0.00 H new ATOM 0 HD11 ILE A 64 7.230 -6.738 -9.653 1.00 0.00 H new ATOM 0 HD12 ILE A 64 7.553 -6.051 -11.263 1.00 0.00 H new ATOM 0 HD13 ILE A 64 6.052 -5.635 -10.402 1.00 0.00 H new ATOM 998 N GLY A 65 3.362 -5.044 -14.559 1.00 0.00 N ATOM 999 CA GLY A 65 3.084 -4.845 -16.006 1.00 0.00 C ATOM 1000 C GLY A 65 1.822 -5.472 -16.644 1.00 0.00 C ATOM 1001 O GLY A 65 1.916 -6.019 -17.745 1.00 0.00 O ATOM 0 H GLY A 65 3.462 -4.173 -14.038 1.00 0.00 H new ATOM 0 HA2 GLY A 65 3.037 -3.770 -16.182 1.00 0.00 H new ATOM 0 HA3 GLY A 65 3.946 -5.221 -16.557 1.00 0.00 H new ATOM 1005 N LYS A 66 0.664 -5.392 -15.967 1.00 0.00 N ATOM 1006 CA LYS A 66 -0.601 -6.010 -16.448 1.00 0.00 C ATOM 1007 C LYS A 66 -1.813 -5.209 -15.892 1.00 0.00 C ATOM 1008 O LYS A 66 -2.555 -4.618 -16.682 1.00 0.00 O ATOM 1009 CB LYS A 66 -0.631 -7.542 -16.163 1.00 0.00 C ATOM 1010 CG LYS A 66 -1.728 -8.317 -16.926 1.00 0.00 C ATOM 1011 CD LYS A 66 -1.605 -9.853 -16.840 1.00 0.00 C ATOM 1012 CE LYS A 66 -1.985 -10.453 -15.473 1.00 0.00 C ATOM 1013 NZ LYS A 66 -1.779 -11.912 -15.457 1.00 0.00 N ATOM 0 H LYS A 66 0.570 -4.903 -15.077 1.00 0.00 H new ATOM 0 HA LYS A 66 -0.666 -5.944 -17.534 1.00 0.00 H new ATOM 0 HB2 LYS A 66 0.340 -7.965 -16.420 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -0.773 -7.697 -15.093 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -2.702 -8.021 -16.536 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -1.701 -8.021 -17.975 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -2.240 -10.298 -17.606 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -0.578 -10.135 -17.073 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -1.385 -9.990 -14.690 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -3.028 -10.228 -15.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -1.760 -12.249 -14.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -2.556 -12.378 -15.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -0.875 -12.140 -15.918 1.00 0.00 H new ATOM 1027 N LYS A 67 -2.003 -5.171 -14.555 1.00 0.00 N ATOM 1028 CA LYS A 67 -2.994 -4.290 -13.889 1.00 0.00 C ATOM 1029 C LYS A 67 -2.404 -2.890 -13.546 1.00 0.00 C ATOM 1030 O LYS A 67 -3.054 -1.883 -13.842 1.00 0.00 O ATOM 1031 CB LYS A 67 -3.611 -5.039 -12.669 1.00 0.00 C ATOM 1032 CG LYS A 67 -4.838 -4.387 -11.983 1.00 0.00 C ATOM 1033 CD LYS A 67 -4.508 -3.360 -10.875 1.00 0.00 C ATOM 1034 CE LYS A 67 -5.732 -2.697 -10.211 1.00 0.00 C ATOM 1035 NZ LYS A 67 -6.510 -3.611 -9.352 1.00 0.00 N ATOM 0 H LYS A 67 -1.474 -5.751 -13.904 1.00 0.00 H new ATOM 0 HA LYS A 67 -3.807 -4.071 -14.581 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -3.899 -6.038 -12.996 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -2.830 -5.162 -11.918 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.440 -3.893 -12.746 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -5.454 -5.176 -11.552 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -3.921 -3.858 -10.103 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -3.878 -2.579 -11.301 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -5.395 -1.850 -9.613 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -6.385 -2.300 -10.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -7.316 -3.098 -8.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -6.861 -4.408 -9.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -5.902 -3.972 -8.589 1.00 0.00 H new ATOM 1049 N PHE A 68 -1.224 -2.820 -12.890 1.00 0.00 N ATOM 1050 CA PHE A 68 -0.742 -1.596 -12.208 1.00 0.00 C ATOM 1051 C PHE A 68 -0.213 -0.509 -13.185 1.00 0.00 C ATOM 1052 O PHE A 68 0.456 -0.788 -14.185 1.00 0.00 O ATOM 1053 CB PHE A 68 0.352 -1.997 -11.181 1.00 0.00 C ATOM 1054 CG PHE A 68 0.361 -1.163 -9.893 1.00 0.00 C ATOM 1055 CD1 PHE A 68 -0.367 -1.619 -8.789 1.00 0.00 C ATOM 1056 CD2 PHE A 68 1.192 -0.043 -9.752 1.00 0.00 C ATOM 1057 CE1 PHE A 68 -0.241 -0.990 -7.557 1.00 0.00 C ATOM 1058 CE2 PHE A 68 1.318 0.584 -8.515 1.00 0.00 C ATOM 1059 CZ PHE A 68 0.613 0.096 -7.419 1.00 0.00 C ATOM 0 H PHE A 68 -0.580 -3.608 -12.818 1.00 0.00 H new ATOM 0 HA PHE A 68 -1.593 -1.141 -11.702 1.00 0.00 H new ATOM 0 HB2 PHE A 68 0.216 -3.046 -10.917 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.328 -1.912 -11.659 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -1.030 -2.465 -8.895 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.736 0.335 -10.605 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.806 -1.345 -6.708 1.00 0.00 H new ATOM 0 HE2 PHE A 68 1.960 1.445 -8.407 1.00 0.00 H new ATOM 0 HZ PHE A 68 0.731 0.566 -6.454 1.00 0.00 H new ATOM 1069 N LYS A 69 -0.529 0.739 -12.826 1.00 0.00 N ATOM 1070 CA LYS A 69 -0.226 1.941 -13.646 1.00 0.00 C ATOM 1071 C LYS A 69 1.211 2.532 -13.488 1.00 0.00 C ATOM 1072 O LYS A 69 1.698 3.123 -14.452 1.00 0.00 O ATOM 1073 CB LYS A 69 -1.284 3.040 -13.361 1.00 0.00 C ATOM 1074 CG LYS A 69 -2.706 2.837 -13.933 1.00 0.00 C ATOM 1075 CD LYS A 69 -3.577 1.690 -13.374 1.00 0.00 C ATOM 1076 CE LYS A 69 -3.814 1.755 -11.854 1.00 0.00 C ATOM 1077 NZ LYS A 69 -4.742 0.706 -11.395 1.00 0.00 N ATOM 0 H LYS A 69 -1.007 0.957 -11.952 1.00 0.00 H new ATOM 0 HA LYS A 69 -0.269 1.598 -14.680 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -1.370 3.150 -12.280 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -0.899 3.984 -13.747 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -3.255 3.768 -13.790 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -2.611 2.685 -15.008 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -4.542 1.702 -13.881 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -3.102 0.739 -13.615 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -2.862 1.650 -11.334 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -4.215 2.734 -11.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -4.874 0.785 -10.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.659 0.821 -11.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -4.348 -0.229 -11.622 1.00 0.00 H new ATOM 1091 N LEU A 70 1.847 2.428 -12.300 1.00 0.00 N ATOM 1092 CA LEU A 70 3.134 3.097 -11.980 1.00 0.00 C ATOM 1093 C LEU A 70 4.323 2.105 -12.224 1.00 0.00 C ATOM 1094 O LEU A 70 4.514 1.211 -11.392 1.00 0.00 O ATOM 1095 CB LEU A 70 3.043 3.662 -10.527 1.00 0.00 C ATOM 1096 CG LEU A 70 4.052 4.711 -9.976 1.00 0.00 C ATOM 1097 CD1 LEU A 70 5.105 4.106 -9.042 1.00 0.00 C ATOM 1098 CD2 LEU A 70 4.667 5.645 -11.033 1.00 0.00 C ATOM 0 H LEU A 70 1.480 1.873 -11.527 1.00 0.00 H new ATOM 0 HA LEU A 70 3.329 3.944 -12.637 1.00 0.00 H new ATOM 0 HB2 LEU A 70 2.050 4.099 -10.423 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.085 2.805 -9.855 1.00 0.00 H new ATOM 0 HG LEU A 70 3.431 5.366 -9.365 1.00 0.00 H new ATOM 0 HD11 LEU A 70 5.776 4.891 -8.694 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.611 3.645 -8.187 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.678 3.351 -9.580 1.00 0.00 H new ATOM 0 HD21 LEU A 70 5.356 6.338 -10.550 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.207 5.053 -11.772 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.874 6.207 -11.528 1.00 0.00 H new ATOM 1110 N PRO A 71 5.132 2.202 -13.325 1.00 0.00 N ATOM 1111 CA PRO A 71 6.241 1.248 -13.625 1.00 0.00 C ATOM 1112 C PRO A 71 7.561 1.359 -12.798 1.00 0.00 C ATOM 1113 O PRO A 71 8.358 0.418 -12.822 1.00 0.00 O ATOM 1114 CB PRO A 71 6.497 1.523 -15.121 1.00 0.00 C ATOM 1115 CG PRO A 71 6.171 3.006 -15.310 1.00 0.00 C ATOM 1116 CD PRO A 71 4.982 3.226 -14.377 1.00 0.00 C ATOM 0 HA PRO A 71 5.935 0.238 -13.353 1.00 0.00 H new ATOM 0 HB2 PRO A 71 7.531 1.308 -15.391 1.00 0.00 H new ATOM 0 HB3 PRO A 71 5.866 0.896 -15.752 1.00 0.00 H new ATOM 0 HG2 PRO A 71 7.016 3.641 -15.042 1.00 0.00 H new ATOM 0 HG3 PRO A 71 5.917 3.233 -16.345 1.00 0.00 H new ATOM 0 HD2 PRO A 71 4.991 4.231 -13.955 1.00 0.00 H new ATOM 0 HD3 PRO A 71 4.037 3.112 -14.908 1.00 0.00 H new ATOM 1124 N VAL A 72 7.792 2.483 -12.091 1.00 0.00 N ATOM 1125 CA VAL A 72 8.978 2.668 -11.205 1.00 0.00 C ATOM 1126 C VAL A 72 8.976 1.757 -9.938 1.00 0.00 C ATOM 1127 O VAL A 72 10.047 1.258 -9.594 1.00 0.00 O ATOM 1128 CB VAL A 72 9.286 4.172 -10.936 1.00 0.00 C ATOM 1129 CG1 VAL A 72 8.239 4.941 -10.122 1.00 0.00 C ATOM 1130 CG2 VAL A 72 10.691 4.409 -10.333 1.00 0.00 C ATOM 0 H VAL A 72 7.169 3.290 -12.112 1.00 0.00 H new ATOM 0 HA VAL A 72 9.837 2.299 -11.766 1.00 0.00 H new ATOM 0 HB VAL A 72 9.249 4.589 -11.942 1.00 0.00 H new ATOM 0 HG11 VAL A 72 8.561 5.975 -9.999 1.00 0.00 H new ATOM 0 HG12 VAL A 72 7.283 4.919 -10.645 1.00 0.00 H new ATOM 0 HG13 VAL A 72 8.127 4.477 -9.142 1.00 0.00 H new ATOM 0 HG21 VAL A 72 10.842 5.476 -10.170 1.00 0.00 H new ATOM 0 HG22 VAL A 72 10.773 3.882 -9.382 1.00 0.00 H new ATOM 0 HG23 VAL A 72 11.450 4.036 -11.021 1.00 0.00 H new ATOM 1140 N TRP A 73 7.817 1.475 -9.297 1.00 0.00 N ATOM 1141 CA TRP A 73 7.678 0.374 -8.294 1.00 0.00 C ATOM 1142 C TRP A 73 8.149 -1.032 -8.763 1.00 0.00 C ATOM 1143 O TRP A 73 8.763 -1.744 -7.970 1.00 0.00 O ATOM 1144 CB TRP A 73 6.210 0.344 -7.764 1.00 0.00 C ATOM 1145 CG TRP A 73 5.865 1.383 -6.681 1.00 0.00 C ATOM 1146 CD1 TRP A 73 6.577 2.571 -6.410 1.00 0.00 C ATOM 1147 CD2 TRP A 73 4.804 1.391 -5.789 1.00 0.00 C ATOM 1148 NE1 TRP A 73 6.007 3.301 -5.367 1.00 0.00 N ATOM 1149 CE2 TRP A 73 4.908 2.560 -4.996 1.00 0.00 C ATOM 1150 CE3 TRP A 73 3.725 0.496 -5.596 1.00 0.00 C ATOM 1151 CZ2 TRP A 73 3.946 2.839 -4.003 1.00 0.00 C ATOM 1152 CZ3 TRP A 73 2.776 0.798 -4.613 1.00 0.00 C ATOM 1153 CH2 TRP A 73 2.887 1.951 -3.830 1.00 0.00 C ATOM 0 H TRP A 73 6.954 1.996 -9.454 1.00 0.00 H new ATOM 0 HA TRP A 73 8.372 0.613 -7.488 1.00 0.00 H new ATOM 0 HB2 TRP A 73 5.536 0.490 -8.608 1.00 0.00 H new ATOM 0 HB3 TRP A 73 6.009 -0.650 -7.364 1.00 0.00 H new ATOM 0 HD1 TRP A 73 7.461 2.879 -6.948 1.00 0.00 H new ATOM 0 HE1 TRP A 73 6.331 4.183 -4.970 1.00 0.00 H new ATOM 0 HE3 TRP A 73 3.636 -0.399 -6.193 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 4.029 3.724 -3.389 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 1.943 0.129 -4.456 1.00 0.00 H new ATOM 0 HH2 TRP A 73 2.139 2.157 -3.078 1.00 0.00 H new ATOM 1164 N GLU A 74 7.899 -1.384 -10.033 1.00 0.00 N ATOM 1165 CA GLU A 74 8.352 -2.667 -10.653 1.00 0.00 C ATOM 1166 C GLU A 74 9.891 -2.768 -10.897 1.00 0.00 C ATOM 1167 O GLU A 74 10.476 -3.816 -10.620 1.00 0.00 O ATOM 1168 CB GLU A 74 7.602 -2.903 -12.000 1.00 0.00 C ATOM 1169 CG GLU A 74 6.066 -2.714 -12.045 1.00 0.00 C ATOM 1170 CD GLU A 74 5.453 -2.707 -13.450 1.00 0.00 C ATOM 1171 OE1 GLU A 74 6.001 -3.345 -14.378 1.00 0.00 O ATOM 1172 OE2 GLU A 74 4.396 -2.062 -13.627 1.00 0.00 O ATOM 0 H GLU A 74 7.373 -0.791 -10.675 1.00 0.00 H new ATOM 0 HA GLU A 74 8.109 -3.440 -9.924 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.038 -2.234 -12.742 1.00 0.00 H new ATOM 0 HB3 GLU A 74 7.818 -3.921 -12.323 1.00 0.00 H new ATOM 0 HG2 GLU A 74 5.600 -3.512 -11.466 1.00 0.00 H new ATOM 0 HG3 GLU A 74 5.816 -1.775 -11.552 1.00 0.00 H new ATOM 1179 N THR A 75 10.528 -1.696 -11.405 1.00 0.00 N ATOM 1180 CA THR A 75 12.009 -1.577 -11.553 1.00 0.00 C ATOM 1181 C THR A 75 12.773 -1.451 -10.189 1.00 0.00 C ATOM 1182 O THR A 75 13.854 -2.034 -10.058 1.00 0.00 O ATOM 1183 CB THR A 75 12.300 -0.400 -12.538 1.00 0.00 C ATOM 1184 OG1 THR A 75 11.593 -0.574 -13.764 1.00 0.00 O ATOM 1185 CG2 THR A 75 13.780 -0.241 -12.917 1.00 0.00 C ATOM 0 H THR A 75 10.028 -0.869 -11.732 1.00 0.00 H new ATOM 0 HA THR A 75 12.401 -2.505 -11.969 1.00 0.00 H new ATOM 0 HB THR A 75 11.977 0.486 -11.992 1.00 0.00 H new ATOM 0 HG1 THR A 75 11.789 0.176 -14.364 1.00 0.00 H new ATOM 0 HG21 THR A 75 13.892 0.598 -13.603 1.00 0.00 H new ATOM 0 HG22 THR A 75 14.368 -0.056 -12.018 1.00 0.00 H new ATOM 0 HG23 THR A 75 14.132 -1.153 -13.399 1.00 0.00 H new ATOM 1193 N ILE A 76 12.203 -0.754 -9.176 1.00 0.00 N ATOM 1194 CA ILE A 76 12.623 -0.844 -7.743 1.00 0.00 C ATOM 1195 C ILE A 76 12.686 -2.332 -7.242 1.00 0.00 C ATOM 1196 O ILE A 76 13.751 -2.770 -6.794 1.00 0.00 O ATOM 1197 CB ILE A 76 11.721 0.112 -6.859 1.00 0.00 C ATOM 1198 CG1 ILE A 76 11.973 1.632 -7.126 1.00 0.00 C ATOM 1199 CG2 ILE A 76 11.807 -0.139 -5.330 1.00 0.00 C ATOM 1200 CD1 ILE A 76 10.860 2.582 -6.646 1.00 0.00 C ATOM 0 H ILE A 76 11.430 -0.105 -9.325 1.00 0.00 H new ATOM 0 HA ILE A 76 13.647 -0.486 -7.641 1.00 0.00 H new ATOM 0 HB ILE A 76 10.716 -0.152 -7.187 1.00 0.00 H new ATOM 0 HG12 ILE A 76 12.906 1.919 -6.641 1.00 0.00 H new ATOM 0 HG13 ILE A 76 12.113 1.777 -8.197 1.00 0.00 H new ATOM 0 HG21 ILE A 76 11.156 0.563 -4.809 1.00 0.00 H new ATOM 0 HG22 ILE A 76 11.491 -1.159 -5.110 1.00 0.00 H new ATOM 0 HG23 ILE A 76 12.835 0.003 -4.995 1.00 0.00 H new ATOM 0 HD11 ILE A 76 11.134 3.611 -6.879 1.00 0.00 H new ATOM 0 HD12 ILE A 76 9.926 2.332 -7.150 1.00 0.00 H new ATOM 0 HD13 ILE A 76 10.731 2.476 -5.569 1.00 0.00 H new ATOM 1212 N VAL A 77 11.568 -3.084 -7.323 1.00 0.00 N ATOM 1213 CA VAL A 77 11.489 -4.476 -6.789 1.00 0.00 C ATOM 1214 C VAL A 77 12.022 -5.632 -7.687 1.00 0.00 C ATOM 1215 O VAL A 77 12.140 -6.748 -7.172 1.00 0.00 O ATOM 1216 CB VAL A 77 10.079 -4.812 -6.217 1.00 0.00 C ATOM 1217 CG1 VAL A 77 9.706 -3.903 -5.026 1.00 0.00 C ATOM 1218 CG2 VAL A 77 8.929 -4.991 -7.230 1.00 0.00 C ATOM 0 H VAL A 77 10.702 -2.757 -7.752 1.00 0.00 H new ATOM 0 HA VAL A 77 12.217 -4.440 -5.979 1.00 0.00 H new ATOM 0 HB VAL A 77 10.200 -5.829 -5.844 1.00 0.00 H new ATOM 0 HG11 VAL A 77 8.716 -4.172 -4.659 1.00 0.00 H new ATOM 0 HG12 VAL A 77 10.436 -4.032 -4.227 1.00 0.00 H new ATOM 0 HG13 VAL A 77 9.702 -2.862 -5.350 1.00 0.00 H new ATOM 0 HG21 VAL A 77 8.007 -5.221 -6.697 1.00 0.00 H new ATOM 0 HG22 VAL A 77 8.799 -4.071 -7.799 1.00 0.00 H new ATOM 0 HG23 VAL A 77 9.168 -5.808 -7.911 1.00 0.00 H new ATOM 1228 N CYS A 78 12.372 -5.412 -8.970 1.00 0.00 N ATOM 1229 CA CYS A 78 13.020 -6.458 -9.811 1.00 0.00 C ATOM 1230 C CYS A 78 14.387 -7.015 -9.284 1.00 0.00 C ATOM 1231 O CYS A 78 14.680 -8.195 -9.486 1.00 0.00 O ATOM 1232 CB CYS A 78 13.150 -5.937 -11.257 1.00 0.00 C ATOM 1233 SG CYS A 78 13.717 -7.270 -12.368 1.00 0.00 S ATOM 0 H CYS A 78 12.221 -4.526 -9.452 1.00 0.00 H new ATOM 0 HA CYS A 78 12.360 -7.324 -9.764 1.00 0.00 H new ATOM 0 HB2 CYS A 78 12.189 -5.554 -11.600 1.00 0.00 H new ATOM 0 HB3 CYS A 78 13.854 -5.105 -11.288 1.00 0.00 H new ATOM 0 HG CYS A 78 14.333 -8.181 -11.674 1.00 0.00 H new ATOM 1239 N THR A 79 15.177 -6.182 -8.576 1.00 0.00 N ATOM 1240 CA THR A 79 16.381 -6.612 -7.804 1.00 0.00 C ATOM 1241 C THR A 79 16.124 -7.335 -6.429 1.00 0.00 C ATOM 1242 O THR A 79 17.082 -7.827 -5.826 1.00 0.00 O ATOM 1243 CB THR A 79 17.283 -5.358 -7.552 1.00 0.00 C ATOM 1244 OG1 THR A 79 16.580 -4.406 -6.755 1.00 0.00 O ATOM 1245 CG2 THR A 79 17.801 -4.631 -8.805 1.00 0.00 C ATOM 0 H THR A 79 15.002 -5.179 -8.518 1.00 0.00 H new ATOM 0 HA THR A 79 16.854 -7.371 -8.427 1.00 0.00 H new ATOM 0 HB THR A 79 18.162 -5.764 -7.052 1.00 0.00 H new ATOM 0 HG1 THR A 79 16.496 -3.564 -7.249 1.00 0.00 H new ATOM 0 HG21 THR A 79 18.413 -3.780 -8.505 1.00 0.00 H new ATOM 0 HG22 THR A 79 18.401 -5.318 -9.402 1.00 0.00 H new ATOM 0 HG23 THR A 79 16.956 -4.279 -9.397 1.00 0.00 H new ATOM 1253 N MET A 80 14.874 -7.374 -5.922 1.00 0.00 N ATOM 1254 CA MET A 80 14.543 -7.747 -4.520 1.00 0.00 C ATOM 1255 C MET A 80 13.906 -9.163 -4.446 1.00 0.00 C ATOM 1256 O MET A 80 13.033 -9.511 -5.244 1.00 0.00 O ATOM 1257 CB MET A 80 13.584 -6.687 -3.914 1.00 0.00 C ATOM 1258 CG MET A 80 14.236 -5.351 -3.498 1.00 0.00 C ATOM 1259 SD MET A 80 14.404 -5.299 -1.703 1.00 0.00 S ATOM 1260 CE MET A 80 12.748 -4.743 -1.259 1.00 0.00 C ATOM 0 H MET A 80 14.051 -7.145 -6.479 1.00 0.00 H new ATOM 0 HA MET A 80 15.466 -7.773 -3.942 1.00 0.00 H new ATOM 0 HB2 MET A 80 12.800 -6.476 -4.641 1.00 0.00 H new ATOM 0 HB3 MET A 80 13.099 -7.121 -3.039 1.00 0.00 H new ATOM 0 HG2 MET A 80 15.214 -5.249 -3.969 1.00 0.00 H new ATOM 0 HG3 MET A 80 13.628 -4.514 -3.842 1.00 0.00 H new ATOM 0 HE1 MET A 80 12.620 -4.807 -0.178 1.00 0.00 H new ATOM 0 HE2 MET A 80 12.613 -3.710 -1.579 1.00 0.00 H new ATOM 0 HE3 MET A 80 12.008 -5.375 -1.750 1.00 0.00 H new ATOM 1270 N ARG A 81 14.344 -9.960 -3.458 1.00 0.00 N ATOM 1271 CA ARG A 81 13.870 -11.361 -3.234 1.00 0.00 C ATOM 1272 C ARG A 81 13.049 -11.480 -1.913 1.00 0.00 C ATOM 1273 O ARG A 81 12.977 -10.536 -1.126 1.00 0.00 O ATOM 1274 CB ARG A 81 15.094 -12.321 -3.283 1.00 0.00 C ATOM 1275 CG ARG A 81 16.193 -12.067 -2.227 1.00 0.00 C ATOM 1276 CD ARG A 81 17.364 -13.044 -2.337 1.00 0.00 C ATOM 1277 NE ARG A 81 18.396 -12.698 -1.335 1.00 0.00 N ATOM 1278 CZ ARG A 81 19.513 -13.418 -1.113 1.00 0.00 C ATOM 1279 NH1 ARG A 81 19.813 -14.543 -1.758 1.00 0.00 N ATOM 1280 NH2 ARG A 81 20.363 -12.987 -0.201 1.00 0.00 N ATOM 0 H ARG A 81 15.043 -9.660 -2.779 1.00 0.00 H new ATOM 0 HA ARG A 81 13.182 -11.651 -4.028 1.00 0.00 H new ATOM 0 HB2 ARG A 81 14.734 -13.343 -3.166 1.00 0.00 H new ATOM 0 HB3 ARG A 81 15.545 -12.253 -4.273 1.00 0.00 H new ATOM 0 HG2 ARG A 81 16.565 -11.048 -2.336 1.00 0.00 H new ATOM 0 HG3 ARG A 81 15.757 -12.142 -1.231 1.00 0.00 H new ATOM 0 HD2 ARG A 81 17.015 -14.064 -2.177 1.00 0.00 H new ATOM 0 HD3 ARG A 81 17.789 -13.006 -3.340 1.00 0.00 H new ATOM 0 HE ARG A 81 18.252 -11.858 -0.775 1.00 0.00 H new ATOM 0 HH11 ARG A 81 19.179 -14.908 -2.469 1.00 0.00 H new ATOM 0 HH12 ARG A 81 20.677 -15.040 -1.541 1.00 0.00 H new ATOM 0 HH21 ARG A 81 20.166 -12.129 0.315 1.00 0.00 H new ATOM 0 HH22 ARG A 81 21.217 -13.511 -0.011 1.00 0.00 H new ATOM 1294 N GLU A 82 12.445 -12.660 -1.659 1.00 0.00 N ATOM 1295 CA GLU A 82 11.543 -12.908 -0.494 1.00 0.00 C ATOM 1296 C GLU A 82 12.279 -12.723 0.866 1.00 0.00 C ATOM 1297 O GLU A 82 13.144 -13.527 1.232 1.00 0.00 O ATOM 1298 CB GLU A 82 10.912 -14.333 -0.568 1.00 0.00 C ATOM 1299 CG GLU A 82 10.038 -14.675 -1.798 1.00 0.00 C ATOM 1300 CD GLU A 82 10.811 -15.276 -2.982 1.00 0.00 C ATOM 1301 OE1 GLU A 82 11.307 -14.512 -3.839 1.00 0.00 O ATOM 1302 OE2 GLU A 82 10.928 -16.519 -3.056 1.00 0.00 O ATOM 0 H GLU A 82 12.565 -13.479 -2.256 1.00 0.00 H new ATOM 0 HA GLU A 82 10.748 -12.164 -0.549 1.00 0.00 H new ATOM 0 HB2 GLU A 82 11.722 -15.060 -0.521 1.00 0.00 H new ATOM 0 HB3 GLU A 82 10.303 -14.476 0.325 1.00 0.00 H new ATOM 0 HG2 GLU A 82 9.262 -15.377 -1.493 1.00 0.00 H new ATOM 0 HG3 GLU A 82 9.533 -13.769 -2.133 1.00 0.00 H new ATOM 1309 N GLY A 83 11.949 -11.624 1.568 1.00 0.00 N ATOM 1310 CA GLY A 83 12.683 -11.212 2.792 1.00 0.00 C ATOM 1311 C GLY A 83 13.825 -10.165 2.660 1.00 0.00 C ATOM 1312 O GLY A 83 14.543 -9.970 3.643 1.00 0.00 O ATOM 0 H GLY A 83 11.181 -11.002 1.314 1.00 0.00 H new ATOM 0 HA2 GLY A 83 11.953 -10.817 3.498 1.00 0.00 H new ATOM 0 HA3 GLY A 83 13.108 -12.110 3.241 1.00 0.00 H new ATOM 1316 N GLU A 84 14.003 -9.500 1.499 1.00 0.00 N ATOM 1317 CA GLU A 84 15.072 -8.495 1.265 1.00 0.00 C ATOM 1318 C GLU A 84 14.508 -7.068 1.478 1.00 0.00 C ATOM 1319 O GLU A 84 13.385 -6.769 1.074 1.00 0.00 O ATOM 1320 CB GLU A 84 15.636 -8.707 -0.170 1.00 0.00 C ATOM 1321 CG GLU A 84 16.845 -7.814 -0.517 1.00 0.00 C ATOM 1322 CD GLU A 84 17.642 -8.234 -1.755 1.00 0.00 C ATOM 1323 OE1 GLU A 84 18.308 -9.292 -1.714 1.00 0.00 O ATOM 1324 OE2 GLU A 84 17.646 -7.484 -2.755 1.00 0.00 O ATOM 0 H GLU A 84 13.404 -9.644 0.686 1.00 0.00 H new ATOM 0 HA GLU A 84 15.889 -8.618 1.976 1.00 0.00 H new ATOM 0 HB2 GLU A 84 15.927 -9.751 -0.282 1.00 0.00 H new ATOM 0 HB3 GLU A 84 14.841 -8.518 -0.891 1.00 0.00 H new ATOM 0 HG2 GLU A 84 16.490 -6.794 -0.664 1.00 0.00 H new ATOM 0 HG3 GLU A 84 17.519 -7.797 0.339 1.00 0.00 H new ATOM 1331 N ILE A 85 15.307 -6.195 2.109 1.00 0.00 N ATOM 1332 CA ILE A 85 14.872 -4.829 2.512 1.00 0.00 C ATOM 1333 C ILE A 85 15.854 -3.842 1.824 1.00 0.00 C ATOM 1334 O ILE A 85 17.054 -3.889 2.103 1.00 0.00 O ATOM 1335 CB ILE A 85 14.824 -4.664 4.075 1.00 0.00 C ATOM 1336 CG1 ILE A 85 13.974 -5.736 4.837 1.00 0.00 C ATOM 1337 CG2 ILE A 85 14.274 -3.271 4.461 1.00 0.00 C ATOM 1338 CD1 ILE A 85 14.755 -6.981 5.288 1.00 0.00 C ATOM 0 H ILE A 85 16.273 -6.406 2.359 1.00 0.00 H new ATOM 0 HA ILE A 85 13.850 -4.627 2.191 1.00 0.00 H new ATOM 0 HB ILE A 85 15.861 -4.797 4.383 1.00 0.00 H new ATOM 0 HG12 ILE A 85 13.527 -5.268 5.714 1.00 0.00 H new ATOM 0 HG13 ILE A 85 13.154 -6.053 4.193 1.00 0.00 H new ATOM 0 HG21 ILE A 85 14.249 -3.178 5.547 1.00 0.00 H new ATOM 0 HG22 ILE A 85 14.919 -2.497 4.045 1.00 0.00 H new ATOM 0 HG23 ILE A 85 13.266 -3.155 4.064 1.00 0.00 H new ATOM 0 HD11 ILE A 85 14.082 -7.665 5.806 1.00 0.00 H new ATOM 0 HD12 ILE A 85 15.179 -7.480 4.417 1.00 0.00 H new ATOM 0 HD13 ILE A 85 15.558 -6.682 5.962 1.00 0.00 H new ATOM 1350 N ALA A 86 15.339 -2.944 0.959 1.00 0.00 N ATOM 1351 CA ALA A 86 16.166 -1.951 0.230 1.00 0.00 C ATOM 1352 C ALA A 86 15.510 -0.547 0.228 1.00 0.00 C ATOM 1353 O ALA A 86 14.320 -0.410 -0.076 1.00 0.00 O ATOM 1354 CB ALA A 86 16.390 -2.453 -1.210 1.00 0.00 C ATOM 0 H ALA A 86 14.344 -2.884 0.745 1.00 0.00 H new ATOM 0 HA ALA A 86 17.124 -1.849 0.740 1.00 0.00 H new ATOM 0 HB1 ALA A 86 16.997 -1.731 -1.757 1.00 0.00 H new ATOM 0 HB2 ALA A 86 16.904 -3.414 -1.185 1.00 0.00 H new ATOM 0 HB3 ALA A 86 15.428 -2.569 -1.709 1.00 0.00 H new ATOM 1360 N GLN A 87 16.314 0.491 0.543 1.00 0.00 N ATOM 1361 CA GLN A 87 15.862 1.910 0.538 1.00 0.00 C ATOM 1362 C GLN A 87 16.751 2.780 -0.375 1.00 0.00 C ATOM 1363 O GLN A 87 17.982 2.681 -0.319 1.00 0.00 O ATOM 1364 CB GLN A 87 15.684 2.485 1.956 1.00 0.00 C ATOM 1365 CG GLN A 87 16.934 2.871 2.776 1.00 0.00 C ATOM 1366 CD GLN A 87 17.705 4.163 2.431 1.00 0.00 C ATOM 1367 OE1 GLN A 87 18.934 4.183 2.439 1.00 0.00 O ATOM 1368 NE2 GLN A 87 17.022 5.253 2.114 1.00 0.00 N ATOM 0 H GLN A 87 17.292 0.376 0.808 1.00 0.00 H new ATOM 0 HA GLN A 87 14.863 1.931 0.104 1.00 0.00 H new ATOM 0 HB2 GLN A 87 15.059 3.374 1.873 1.00 0.00 H new ATOM 0 HB3 GLN A 87 15.123 1.754 2.538 1.00 0.00 H new ATOM 0 HG2 GLN A 87 16.629 2.942 3.820 1.00 0.00 H new ATOM 0 HG3 GLN A 87 17.639 2.042 2.705 1.00 0.00 H new ATOM 0 HE21 GLN A 87 16.002 5.232 2.109 1.00 0.00 H new ATOM 0 HE22 GLN A 87 17.516 6.113 1.875 1.00 0.00 H new ATOM 1377 N PHE A 88 16.121 3.620 -1.223 1.00 0.00 N ATOM 1378 CA PHE A 88 16.847 4.305 -2.325 1.00 0.00 C ATOM 1379 C PHE A 88 15.998 5.356 -3.092 1.00 0.00 C ATOM 1380 O PHE A 88 14.773 5.237 -3.197 1.00 0.00 O ATOM 1381 CB PHE A 88 17.471 3.290 -3.316 1.00 0.00 C ATOM 1382 CG PHE A 88 16.582 2.240 -4.007 1.00 0.00 C ATOM 1383 CD1 PHE A 88 16.408 0.982 -3.417 1.00 0.00 C ATOM 1384 CD2 PHE A 88 16.129 2.458 -5.312 1.00 0.00 C ATOM 1385 CE1 PHE A 88 15.824 -0.053 -4.138 1.00 0.00 C ATOM 1386 CE2 PHE A 88 15.572 1.411 -6.040 1.00 0.00 C ATOM 1387 CZ PHE A 88 15.445 0.153 -5.457 1.00 0.00 C ATOM 0 H PHE A 88 15.127 3.841 -1.172 1.00 0.00 H new ATOM 0 HA PHE A 88 17.645 4.859 -1.830 1.00 0.00 H new ATOM 0 HB2 PHE A 88 17.963 3.864 -4.101 1.00 0.00 H new ATOM 0 HB3 PHE A 88 18.251 2.751 -2.779 1.00 0.00 H new ATOM 0 HD1 PHE A 88 16.728 0.816 -2.399 1.00 0.00 H new ATOM 0 HD2 PHE A 88 16.212 3.439 -5.755 1.00 0.00 H new ATOM 0 HE1 PHE A 88 15.666 -1.015 -3.673 1.00 0.00 H new ATOM 0 HE2 PHE A 88 15.239 1.574 -7.054 1.00 0.00 H new ATOM 0 HZ PHE A 88 15.049 -0.668 -6.035 1.00 0.00 H new ATOM 1397 N LEU A 89 16.695 6.350 -3.690 1.00 0.00 N ATOM 1398 CA LEU A 89 16.053 7.414 -4.507 1.00 0.00 C ATOM 1399 C LEU A 89 15.785 6.990 -5.979 1.00 0.00 C ATOM 1400 O LEU A 89 16.538 6.205 -6.567 1.00 0.00 O ATOM 1401 CB LEU A 89 16.766 8.794 -4.374 1.00 0.00 C ATOM 1402 CG LEU A 89 18.296 8.930 -4.634 1.00 0.00 C ATOM 1403 CD1 LEU A 89 18.683 8.867 -6.126 1.00 0.00 C ATOM 1404 CD2 LEU A 89 18.816 10.248 -4.021 1.00 0.00 C ATOM 0 H LEU A 89 17.709 6.440 -3.623 1.00 0.00 H new ATOM 0 HA LEU A 89 15.062 7.556 -4.076 1.00 0.00 H new ATOM 0 HB2 LEU A 89 16.263 9.481 -5.055 1.00 0.00 H new ATOM 0 HB3 LEU A 89 16.580 9.154 -3.362 1.00 0.00 H new ATOM 0 HG LEU A 89 18.764 8.069 -4.156 1.00 0.00 H new ATOM 0 HD11 LEU A 89 19.764 8.969 -6.226 1.00 0.00 H new ATOM 0 HD12 LEU A 89 18.368 7.911 -6.543 1.00 0.00 H new ATOM 0 HD13 LEU A 89 18.191 9.677 -6.664 1.00 0.00 H new ATOM 0 HD21 LEU A 89 19.886 10.338 -4.206 1.00 0.00 H new ATOM 0 HD22 LEU A 89 18.297 11.091 -4.477 1.00 0.00 H new ATOM 0 HD23 LEU A 89 18.632 10.247 -2.947 1.00 0.00 H new ATOM 1416 N CYS A 90 14.708 7.555 -6.564 1.00 0.00 N ATOM 1417 CA CYS A 90 14.434 7.467 -8.019 1.00 0.00 C ATOM 1418 C CYS A 90 14.293 8.890 -8.607 1.00 0.00 C ATOM 1419 O CYS A 90 13.675 9.772 -7.999 1.00 0.00 O ATOM 1420 CB CYS A 90 13.158 6.652 -8.310 1.00 0.00 C ATOM 1421 SG CYS A 90 13.204 5.041 -7.454 1.00 0.00 S ATOM 0 H CYS A 90 14.005 8.083 -6.046 1.00 0.00 H new ATOM 0 HA CYS A 90 15.272 6.952 -8.489 1.00 0.00 H new ATOM 0 HB2 CYS A 90 12.281 7.214 -7.988 1.00 0.00 H new ATOM 0 HB3 CYS A 90 13.059 6.495 -9.384 1.00 0.00 H new ATOM 0 HG CYS A 90 12.490 5.105 -6.369 1.00 0.00 H new ATOM 1427 N ASP A 91 14.821 9.090 -9.831 1.00 0.00 N ATOM 1428 CA ASP A 91 14.724 10.385 -10.553 1.00 0.00 C ATOM 1429 C ASP A 91 13.256 10.710 -10.964 1.00 0.00 C ATOM 1430 O ASP A 91 12.470 9.818 -11.297 1.00 0.00 O ATOM 1431 CB ASP A 91 15.701 10.337 -11.762 1.00 0.00 C ATOM 1432 CG ASP A 91 15.990 11.700 -12.410 1.00 0.00 C ATOM 1433 OD1 ASP A 91 16.905 12.410 -11.938 1.00 0.00 O ATOM 1434 OD2 ASP A 91 15.300 12.068 -13.385 1.00 0.00 O ATOM 0 H ASP A 91 15.324 8.368 -10.348 1.00 0.00 H new ATOM 0 HA ASP A 91 15.017 11.205 -9.897 1.00 0.00 H new ATOM 0 HB2 ASP A 91 16.644 9.900 -11.433 1.00 0.00 H new ATOM 0 HB3 ASP A 91 15.288 9.671 -12.519 1.00 0.00 H new ATOM 1439 N ILE A 92 12.919 12.011 -10.930 1.00 0.00 N ATOM 1440 CA ILE A 92 11.589 12.554 -11.328 1.00 0.00 C ATOM 1441 C ILE A 92 11.019 12.162 -12.722 1.00 0.00 C ATOM 1442 O ILE A 92 9.801 12.034 -12.826 1.00 0.00 O ATOM 1443 CB ILE A 92 11.460 14.106 -11.095 1.00 0.00 C ATOM 1444 CG1 ILE A 92 12.779 14.940 -11.113 1.00 0.00 C ATOM 1445 CG2 ILE A 92 10.621 14.354 -9.830 1.00 0.00 C ATOM 1446 CD1 ILE A 92 12.612 16.463 -11.202 1.00 0.00 C ATOM 0 H ILE A 92 13.568 12.735 -10.621 1.00 0.00 H new ATOM 0 HA ILE A 92 10.945 12.018 -10.631 1.00 0.00 H new ATOM 0 HB ILE A 92 10.952 14.492 -11.978 1.00 0.00 H new ATOM 0 HG12 ILE A 92 13.344 14.709 -10.210 1.00 0.00 H new ATOM 0 HG13 ILE A 92 13.382 14.611 -11.959 1.00 0.00 H new ATOM 0 HG21 ILE A 92 10.526 15.427 -9.661 1.00 0.00 H new ATOM 0 HG22 ILE A 92 9.630 13.918 -9.959 1.00 0.00 H new ATOM 0 HG23 ILE A 92 11.111 13.893 -8.972 1.00 0.00 H new ATOM 0 HD11 ILE A 92 13.594 16.937 -11.207 1.00 0.00 H new ATOM 0 HD12 ILE A 92 12.081 16.718 -12.119 1.00 0.00 H new ATOM 0 HD13 ILE A 92 12.042 16.817 -10.343 1.00 0.00 H new ATOM 1458 N LYS A 93 11.845 11.921 -13.757 1.00 0.00 N ATOM 1459 CA LYS A 93 11.389 11.236 -15.012 1.00 0.00 C ATOM 1460 C LYS A 93 10.605 9.877 -14.864 1.00 0.00 C ATOM 1461 O LYS A 93 9.792 9.538 -15.728 1.00 0.00 O ATOM 1462 CB LYS A 93 12.595 11.095 -15.986 1.00 0.00 C ATOM 1463 CG LYS A 93 13.654 10.020 -15.622 1.00 0.00 C ATOM 1464 CD LYS A 93 14.960 10.061 -16.439 1.00 0.00 C ATOM 1465 CE LYS A 93 14.806 9.594 -17.900 1.00 0.00 C ATOM 1466 NZ LYS A 93 16.096 9.609 -18.611 1.00 0.00 N ATOM 0 H LYS A 93 12.831 12.184 -13.763 1.00 0.00 H new ATOM 0 HA LYS A 93 10.619 11.894 -15.415 1.00 0.00 H new ATOM 0 HB2 LYS A 93 12.207 10.870 -16.980 1.00 0.00 H new ATOM 0 HB3 LYS A 93 13.097 12.061 -16.051 1.00 0.00 H new ATOM 0 HG2 LYS A 93 13.904 10.127 -14.567 1.00 0.00 H new ATOM 0 HG3 LYS A 93 13.202 9.036 -15.744 1.00 0.00 H new ATOM 0 HD2 LYS A 93 15.347 11.080 -16.434 1.00 0.00 H new ATOM 0 HD3 LYS A 93 15.704 9.435 -15.946 1.00 0.00 H new ATOM 0 HE2 LYS A 93 14.391 8.586 -17.919 1.00 0.00 H new ATOM 0 HE3 LYS A 93 14.097 10.241 -18.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 15.956 9.289 -19.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 16.480 10.576 -18.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 16.764 8.973 -18.131 1.00 0.00 H new ATOM 1480 N HIS A 94 10.871 9.123 -13.781 1.00 0.00 N ATOM 1481 CA HIS A 94 10.192 7.847 -13.440 1.00 0.00 C ATOM 1482 C HIS A 94 9.008 8.085 -12.446 1.00 0.00 C ATOM 1483 O HIS A 94 7.934 7.512 -12.651 1.00 0.00 O ATOM 1484 CB HIS A 94 11.221 6.833 -12.866 1.00 0.00 C ATOM 1485 CG HIS A 94 12.482 6.552 -13.689 1.00 0.00 C ATOM 1486 ND1 HIS A 94 12.529 5.801 -14.849 1.00 0.00 N ATOM 1487 CD2 HIS A 94 13.756 7.069 -13.402 1.00 0.00 C ATOM 1488 CE1 HIS A 94 13.853 5.943 -15.162 1.00 0.00 C ATOM 1489 NE2 HIS A 94 14.681 6.688 -14.359 1.00 0.00 N ATOM 0 H HIS A 94 11.581 9.386 -13.098 1.00 0.00 H new ATOM 0 HA HIS A 94 9.767 7.425 -14.351 1.00 0.00 H new ATOM 0 HB2 HIS A 94 11.534 7.192 -11.886 1.00 0.00 H new ATOM 0 HB3 HIS A 94 10.706 5.886 -12.709 1.00 0.00 H new ATOM 0 HD2 HIS A 94 13.985 7.685 -12.545 1.00 0.00 H new ATOM 0 HE1 HIS A 94 14.250 5.466 -16.046 1.00 0.00 H new ATOM 0 HE2 HIS A 94 15.676 6.897 -14.442 1.00 0.00 H new ATOM 1497 N VAL A 95 9.193 8.920 -11.391 1.00 0.00 N ATOM 1498 CA VAL A 95 8.125 9.259 -10.395 1.00 0.00 C ATOM 1499 C VAL A 95 7.244 10.514 -10.750 1.00 0.00 C ATOM 1500 O VAL A 95 6.583 11.076 -9.869 1.00 0.00 O ATOM 1501 CB VAL A 95 8.743 9.336 -8.954 1.00 0.00 C ATOM 1502 CG1 VAL A 95 9.421 8.022 -8.518 1.00 0.00 C ATOM 1503 CG2 VAL A 95 9.721 10.506 -8.696 1.00 0.00 C ATOM 0 H VAL A 95 10.083 9.380 -11.201 1.00 0.00 H new ATOM 0 HA VAL A 95 7.405 8.441 -10.432 1.00 0.00 H new ATOM 0 HB VAL A 95 7.859 9.525 -8.344 1.00 0.00 H new ATOM 0 HG11 VAL A 95 9.829 8.139 -7.514 1.00 0.00 H new ATOM 0 HG12 VAL A 95 8.687 7.216 -8.521 1.00 0.00 H new ATOM 0 HG13 VAL A 95 10.227 7.781 -9.211 1.00 0.00 H new ATOM 0 HG21 VAL A 95 10.084 10.457 -7.669 1.00 0.00 H new ATOM 0 HG22 VAL A 95 10.564 10.433 -9.383 1.00 0.00 H new ATOM 0 HG23 VAL A 95 9.205 11.453 -8.854 1.00 0.00 H new ATOM 1513 N VAL A 96 7.176 10.911 -12.038 1.00 0.00 N ATOM 1514 CA VAL A 96 6.280 11.992 -12.553 1.00 0.00 C ATOM 1515 C VAL A 96 4.753 11.671 -12.384 1.00 0.00 C ATOM 1516 O VAL A 96 3.987 12.550 -11.980 1.00 0.00 O ATOM 1517 CB VAL A 96 6.751 12.422 -14.006 1.00 0.00 C ATOM 1518 CG1 VAL A 96 5.705 12.405 -15.149 1.00 0.00 C ATOM 1519 CG2 VAL A 96 7.428 13.812 -14.008 1.00 0.00 C ATOM 0 H VAL A 96 7.748 10.488 -12.769 1.00 0.00 H new ATOM 0 HA VAL A 96 6.384 12.878 -11.927 1.00 0.00 H new ATOM 0 HB VAL A 96 7.448 11.616 -14.237 1.00 0.00 H new ATOM 0 HG11 VAL A 96 6.177 12.723 -16.079 1.00 0.00 H new ATOM 0 HG12 VAL A 96 5.313 11.395 -15.268 1.00 0.00 H new ATOM 0 HG13 VAL A 96 4.889 13.085 -14.905 1.00 0.00 H new ATOM 0 HG21 VAL A 96 7.734 14.066 -15.023 1.00 0.00 H new ATOM 0 HG22 VAL A 96 6.724 14.560 -13.644 1.00 0.00 H new ATOM 0 HG23 VAL A 96 8.304 13.791 -13.359 1.00 0.00 H new ATOM 1529 N LEU A 97 4.347 10.425 -12.701 1.00 0.00 N ATOM 1530 CA LEU A 97 2.976 9.900 -12.458 1.00 0.00 C ATOM 1531 C LEU A 97 2.763 9.077 -11.143 1.00 0.00 C ATOM 1532 O LEU A 97 1.686 8.504 -10.970 1.00 0.00 O ATOM 1533 CB LEU A 97 2.512 9.119 -13.727 1.00 0.00 C ATOM 1534 CG LEU A 97 3.349 7.859 -14.132 1.00 0.00 C ATOM 1535 CD1 LEU A 97 2.463 6.632 -14.422 1.00 0.00 C ATOM 1536 CD2 LEU A 97 4.294 8.126 -15.320 1.00 0.00 C ATOM 0 H LEU A 97 4.965 9.742 -13.139 1.00 0.00 H new ATOM 0 HA LEU A 97 2.345 10.771 -12.281 1.00 0.00 H new ATOM 0 HB2 LEU A 97 1.480 8.805 -13.573 1.00 0.00 H new ATOM 0 HB3 LEU A 97 2.512 9.811 -14.569 1.00 0.00 H new ATOM 0 HG LEU A 97 3.966 7.633 -13.262 1.00 0.00 H new ATOM 0 HD11 LEU A 97 3.092 5.786 -14.698 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.887 6.380 -13.531 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.782 6.861 -15.242 1.00 0.00 H new ATOM 0 HD21 LEU A 97 4.848 7.217 -15.556 1.00 0.00 H new ATOM 0 HD22 LEU A 97 3.710 8.430 -16.188 1.00 0.00 H new ATOM 0 HD23 LEU A 97 4.994 8.920 -15.057 1.00 0.00 H new ATOM 1548 N TYR A 98 3.708 9.081 -10.180 1.00 0.00 N ATOM 1549 CA TYR A 98 3.448 8.653 -8.779 1.00 0.00 C ATOM 1550 C TYR A 98 2.315 9.441 -8.021 1.00 0.00 C ATOM 1551 O TYR A 98 1.493 8.739 -7.428 1.00 0.00 O ATOM 1552 CB TYR A 98 4.798 8.632 -8.008 1.00 0.00 C ATOM 1553 CG TYR A 98 4.719 8.160 -6.541 1.00 0.00 C ATOM 1554 CD1 TYR A 98 4.197 6.902 -6.215 1.00 0.00 C ATOM 1555 CD2 TYR A 98 5.011 9.066 -5.515 1.00 0.00 C ATOM 1556 CE1 TYR A 98 3.913 6.582 -4.890 1.00 0.00 C ATOM 1557 CE2 TYR A 98 4.747 8.736 -4.191 1.00 0.00 C ATOM 1558 CZ TYR A 98 4.174 7.504 -3.880 1.00 0.00 C ATOM 1559 OH TYR A 98 3.840 7.207 -2.583 1.00 0.00 O ATOM 0 H TYR A 98 4.670 9.378 -10.345 1.00 0.00 H new ATOM 0 HA TYR A 98 3.028 7.648 -8.825 1.00 0.00 H new ATOM 0 HB2 TYR A 98 5.492 7.983 -8.543 1.00 0.00 H new ATOM 0 HB3 TYR A 98 5.222 9.636 -8.026 1.00 0.00 H new ATOM 0 HD1 TYR A 98 4.014 6.177 -6.994 1.00 0.00 H new ATOM 0 HD2 TYR A 98 5.444 10.026 -5.753 1.00 0.00 H new ATOM 0 HE1 TYR A 98 3.490 5.619 -4.646 1.00 0.00 H new ATOM 0 HE2 TYR A 98 4.986 9.434 -3.403 1.00 0.00 H new ATOM 0 HH TYR A 98 3.892 6.238 -2.446 1.00 0.00 H new ATOM 1569 N PRO A 99 2.186 10.804 -7.987 1.00 0.00 N ATOM 1570 CA PRO A 99 0.975 11.481 -7.434 1.00 0.00 C ATOM 1571 C PRO A 99 -0.378 11.296 -8.193 1.00 0.00 C ATOM 1572 O PRO A 99 -1.414 11.666 -7.641 1.00 0.00 O ATOM 1573 CB PRO A 99 1.427 12.952 -7.400 1.00 0.00 C ATOM 1574 CG PRO A 99 2.409 13.095 -8.563 1.00 0.00 C ATOM 1575 CD PRO A 99 3.094 11.741 -8.676 1.00 0.00 C ATOM 0 HA PRO A 99 0.701 11.040 -6.476 1.00 0.00 H new ATOM 0 HB2 PRO A 99 0.579 13.627 -7.515 1.00 0.00 H new ATOM 0 HB3 PRO A 99 1.903 13.196 -6.450 1.00 0.00 H new ATOM 0 HG2 PRO A 99 1.891 13.352 -9.487 1.00 0.00 H new ATOM 0 HG3 PRO A 99 3.133 13.888 -8.372 1.00 0.00 H new ATOM 0 HD2 PRO A 99 3.240 11.457 -9.718 1.00 0.00 H new ATOM 0 HD3 PRO A 99 4.078 11.755 -8.208 1.00 0.00 H new ATOM 1583 N LEU A 100 -0.375 10.728 -9.416 1.00 0.00 N ATOM 1584 CA LEU A 100 -1.610 10.360 -10.162 1.00 0.00 C ATOM 1585 C LEU A 100 -2.088 8.912 -9.816 1.00 0.00 C ATOM 1586 O LEU A 100 -3.283 8.693 -9.603 1.00 0.00 O ATOM 1587 CB LEU A 100 -1.395 10.543 -11.699 1.00 0.00 C ATOM 1588 CG LEU A 100 -0.655 11.815 -12.219 1.00 0.00 C ATOM 1589 CD1 LEU A 100 -0.584 11.828 -13.758 1.00 0.00 C ATOM 1590 CD2 LEU A 100 -1.219 13.146 -11.687 1.00 0.00 C ATOM 0 H LEU A 100 0.483 10.508 -9.921 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.405 11.036 -9.848 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.845 9.674 -12.059 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -2.376 10.518 -12.173 1.00 0.00 H new ATOM 0 HG LEU A 100 0.354 11.742 -11.812 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -0.063 12.726 -14.091 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -0.045 10.946 -14.105 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -1.594 11.821 -14.169 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.645 13.975 -12.100 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -2.263 13.244 -11.985 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -1.149 13.162 -10.599 1.00 0.00 H new ATOM 1602 N VAL A 101 -1.150 7.942 -9.751 1.00 0.00 N ATOM 1603 CA VAL A 101 -1.415 6.523 -9.362 1.00 0.00 C ATOM 1604 C VAL A 101 -1.628 6.297 -7.836 1.00 0.00 C ATOM 1605 O VAL A 101 -2.333 5.359 -7.473 1.00 0.00 O ATOM 1606 CB VAL A 101 -0.303 5.579 -9.928 1.00 0.00 C ATOM 1607 CG1 VAL A 101 -0.546 4.078 -9.601 1.00 0.00 C ATOM 1608 CG2 VAL A 101 -0.130 5.739 -11.455 1.00 0.00 C ATOM 0 H VAL A 101 -0.169 8.117 -9.969 1.00 0.00 H new ATOM 0 HA VAL A 101 -2.372 6.267 -9.818 1.00 0.00 H new ATOM 0 HB VAL A 101 0.611 5.892 -9.424 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.261 3.479 -10.022 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -0.574 3.941 -8.520 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -1.496 3.761 -10.031 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.652 5.065 -11.805 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -1.068 5.497 -11.955 1.00 0.00 H new ATOM 0 HG23 VAL A 101 0.148 6.768 -11.684 1.00 0.00 H new ATOM 1618 N ALA A 102 -1.069 7.132 -6.952 1.00 0.00 N ATOM 1619 CA ALA A 102 -1.548 7.262 -5.547 1.00 0.00 C ATOM 1620 C ALA A 102 -3.078 7.502 -5.338 1.00 0.00 C ATOM 1621 O ALA A 102 -3.627 7.011 -4.348 1.00 0.00 O ATOM 1622 CB ALA A 102 -0.769 8.406 -4.884 1.00 0.00 C ATOM 0 H ALA A 102 -0.279 7.737 -7.175 1.00 0.00 H new ATOM 0 HA ALA A 102 -1.368 6.287 -5.094 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -1.101 8.522 -3.852 1.00 0.00 H new ATOM 0 HB2 ALA A 102 0.297 8.177 -4.898 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.948 9.332 -5.430 1.00 0.00 H new ATOM 1628 N LYS A 103 -3.758 8.194 -6.282 1.00 0.00 N ATOM 1629 CA LYS A 103 -5.249 8.229 -6.341 1.00 0.00 C ATOM 1630 C LYS A 103 -5.939 6.969 -7.000 1.00 0.00 C ATOM 1631 O LYS A 103 -7.109 7.041 -7.391 1.00 0.00 O ATOM 1632 CB LYS A 103 -5.701 9.547 -7.047 1.00 0.00 C ATOM 1633 CG LYS A 103 -5.672 10.858 -6.227 1.00 0.00 C ATOM 1634 CD LYS A 103 -4.259 11.394 -5.907 1.00 0.00 C ATOM 1635 CE LYS A 103 -4.086 12.928 -5.951 1.00 0.00 C ATOM 1636 NZ LYS A 103 -4.185 13.493 -7.311 1.00 0.00 N ATOM 0 H LYS A 103 -3.303 8.737 -7.016 1.00 0.00 H new ATOM 0 HA LYS A 103 -5.590 8.200 -5.306 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -5.071 9.688 -7.925 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -6.720 9.401 -7.406 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -6.220 11.624 -6.775 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.204 10.695 -5.290 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -3.977 11.046 -4.913 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -3.556 10.950 -6.612 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -4.844 13.389 -5.318 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -3.116 13.189 -5.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -4.060 14.525 -7.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -3.445 13.079 -7.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -5.120 13.274 -7.711 1.00 0.00 H new ATOM 1650 N SER A 104 -5.261 5.807 -7.081 1.00 0.00 N ATOM 1651 CA SER A 104 -5.819 4.537 -7.616 1.00 0.00 C ATOM 1652 C SER A 104 -5.278 3.264 -6.891 1.00 0.00 C ATOM 1653 O SER A 104 -6.059 2.347 -6.639 1.00 0.00 O ATOM 1654 CB SER A 104 -5.621 4.453 -9.146 1.00 0.00 C ATOM 1655 OG SER A 104 -4.247 4.420 -9.517 1.00 0.00 O ATOM 0 H SER A 104 -4.293 5.717 -6.773 1.00 0.00 H new ATOM 0 HA SER A 104 -6.889 4.556 -7.407 1.00 0.00 H new ATOM 0 HB2 SER A 104 -6.118 3.560 -9.525 1.00 0.00 H new ATOM 0 HB3 SER A 104 -6.101 5.310 -9.619 1.00 0.00 H new ATOM 0 HG SER A 104 -3.700 4.751 -8.775 1.00 0.00 H new ATOM 1661 N LEU A 105 -3.984 3.193 -6.508 1.00 0.00 N ATOM 1662 CA LEU A 105 -3.469 2.186 -5.532 1.00 0.00 C ATOM 1663 C LEU A 105 -4.153 2.170 -4.118 1.00 0.00 C ATOM 1664 O LEU A 105 -4.198 1.119 -3.476 1.00 0.00 O ATOM 1665 CB LEU A 105 -1.914 2.262 -5.513 1.00 0.00 C ATOM 1666 CG LEU A 105 -1.199 3.314 -4.614 1.00 0.00 C ATOM 1667 CD1 LEU A 105 -0.962 2.821 -3.170 1.00 0.00 C ATOM 1668 CD2 LEU A 105 0.144 3.743 -5.238 1.00 0.00 C ATOM 0 H LEU A 105 -3.265 3.825 -6.860 1.00 0.00 H new ATOM 0 HA LEU A 105 -3.771 1.202 -5.890 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -1.545 1.279 -5.220 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.585 2.433 -6.538 1.00 0.00 H new ATOM 0 HG LEU A 105 -1.873 4.168 -4.558 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -0.461 3.601 -2.597 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -1.919 2.587 -2.704 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.339 1.927 -3.188 1.00 0.00 H new ATOM 0 HD21 LEU A 105 0.626 4.478 -4.594 1.00 0.00 H new ATOM 0 HD22 LEU A 105 0.791 2.872 -5.343 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.035 4.183 -6.219 1.00 0.00 H new ATOM 2135 N ASP A 137 0.489 16.267 0.878 1.00 0.00 N ATOM 2136 CA ASP A 137 1.823 15.611 0.971 1.00 0.00 C ATOM 2137 C ASP A 137 2.368 15.124 -0.409 1.00 0.00 C ATOM 2138 O ASP A 137 3.489 15.488 -0.777 1.00 0.00 O ATOM 2139 CB ASP A 137 1.783 14.443 1.992 1.00 0.00 C ATOM 2140 CG ASP A 137 1.382 14.783 3.437 1.00 0.00 C ATOM 2141 OD1 ASP A 137 2.257 15.202 4.226 1.00 0.00 O ATOM 2142 OD2 ASP A 137 0.190 14.630 3.782 1.00 0.00 O ATOM 0 HA ASP A 137 2.520 16.371 1.322 1.00 0.00 H new ATOM 0 HB2 ASP A 137 1.089 13.691 1.617 1.00 0.00 H new ATOM 0 HB3 ASP A 137 2.770 13.982 2.016 1.00 0.00 H new ATOM 2147 N LEU A 138 1.578 14.329 -1.162 1.00 0.00 N ATOM 2148 CA LEU A 138 1.870 13.991 -2.586 1.00 0.00 C ATOM 2149 C LEU A 138 1.450 15.074 -3.635 1.00 0.00 C ATOM 2150 O LEU A 138 2.018 15.069 -4.732 1.00 0.00 O ATOM 2151 CB LEU A 138 1.323 12.573 -2.921 1.00 0.00 C ATOM 2152 CG LEU A 138 -0.189 12.289 -2.661 1.00 0.00 C ATOM 2153 CD1 LEU A 138 -0.995 12.243 -3.966 1.00 0.00 C ATOM 2154 CD2 LEU A 138 -0.393 11.015 -1.819 1.00 0.00 C ATOM 0 H LEU A 138 0.722 13.901 -0.809 1.00 0.00 H new ATOM 0 HA LEU A 138 2.956 13.981 -2.677 1.00 0.00 H new ATOM 0 HB2 LEU A 138 1.522 12.379 -3.975 1.00 0.00 H new ATOM 0 HB3 LEU A 138 1.902 11.848 -2.348 1.00 0.00 H new ATOM 0 HG LEU A 138 -0.575 13.125 -2.078 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -2.042 12.043 -3.740 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -0.911 13.201 -4.479 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -0.605 11.452 -4.607 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -1.459 10.851 -1.659 1.00 0.00 H new ATOM 0 HD22 LEU A 138 0.031 10.160 -2.345 1.00 0.00 H new ATOM 0 HD23 LEU A 138 0.104 11.132 -0.856 1.00 0.00 H new ATOM 2166 N ASP A 139 0.526 16.015 -3.320 1.00 0.00 N ATOM 2167 CA ASP A 139 0.275 17.216 -4.175 1.00 0.00 C ATOM 2168 C ASP A 139 1.352 18.357 -4.088 1.00 0.00 C ATOM 2169 O ASP A 139 1.375 19.220 -4.970 1.00 0.00 O ATOM 2170 CB ASP A 139 -1.153 17.734 -3.879 1.00 0.00 C ATOM 2171 CG ASP A 139 -1.763 18.651 -4.949 1.00 0.00 C ATOM 2172 OD1 ASP A 139 -2.419 18.137 -5.882 1.00 0.00 O ATOM 2173 OD2 ASP A 139 -1.589 19.886 -4.860 1.00 0.00 O ATOM 0 H ASP A 139 -0.059 15.972 -2.485 1.00 0.00 H new ATOM 0 HA ASP A 139 0.363 16.890 -5.211 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -1.811 16.875 -3.745 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -1.135 18.273 -2.932 1.00 0.00 H new ATOM 2178 N ALA A 140 2.279 18.342 -3.104 1.00 0.00 N ATOM 2179 CA ALA A 140 3.578 19.068 -3.191 1.00 0.00 C ATOM 2180 C ALA A 140 4.447 18.815 -4.467 1.00 0.00 C ATOM 2181 O ALA A 140 5.126 19.736 -4.917 1.00 0.00 O ATOM 2182 CB ALA A 140 4.394 18.716 -1.937 1.00 0.00 C ATOM 0 H ALA A 140 2.155 17.831 -2.230 1.00 0.00 H new ATOM 0 HA ALA A 140 3.319 20.124 -3.262 1.00 0.00 H new ATOM 0 HB1 ALA A 140 5.353 19.233 -1.970 1.00 0.00 H new ATOM 0 HB2 ALA A 140 3.846 19.025 -1.047 1.00 0.00 H new ATOM 0 HB3 ALA A 140 4.563 17.640 -1.903 1.00 0.00 H new ATOM 2188 N LEU A 141 4.400 17.601 -5.052 1.00 0.00 N ATOM 2189 CA LEU A 141 5.007 17.290 -6.379 1.00 0.00 C ATOM 2190 C LEU A 141 4.309 17.949 -7.604 1.00 0.00 C ATOM 2191 O LEU A 141 4.985 18.387 -8.536 1.00 0.00 O ATOM 2192 CB LEU A 141 5.060 15.751 -6.638 1.00 0.00 C ATOM 2193 CG LEU A 141 5.471 14.808 -5.479 1.00 0.00 C ATOM 2194 CD1 LEU A 141 5.220 13.335 -5.843 1.00 0.00 C ATOM 2195 CD2 LEU A 141 6.922 15.023 -5.013 1.00 0.00 C ATOM 0 H LEU A 141 3.939 16.799 -4.622 1.00 0.00 H new ATOM 0 HA LEU A 141 6.006 17.720 -6.302 1.00 0.00 H new ATOM 0 HB2 LEU A 141 4.073 15.441 -6.980 1.00 0.00 H new ATOM 0 HB3 LEU A 141 5.752 15.580 -7.463 1.00 0.00 H new ATOM 0 HG LEU A 141 4.833 15.068 -4.634 1.00 0.00 H new ATOM 0 HD11 LEU A 141 5.518 12.698 -5.010 1.00 0.00 H new ATOM 0 HD12 LEU A 141 4.160 13.187 -6.051 1.00 0.00 H new ATOM 0 HD13 LEU A 141 5.803 13.074 -6.726 1.00 0.00 H new ATOM 0 HD21 LEU A 141 7.149 14.333 -4.200 1.00 0.00 H new ATOM 0 HD22 LEU A 141 7.602 14.840 -5.845 1.00 0.00 H new ATOM 0 HD23 LEU A 141 7.044 16.048 -4.664 1.00 0.00 H new ATOM 2207 N GLN A 142 2.966 18.011 -7.600 1.00 0.00 N ATOM 2208 CA GLN A 142 2.160 18.750 -8.615 1.00 0.00 C ATOM 2209 C GLN A 142 2.483 20.272 -8.785 1.00 0.00 C ATOM 2210 O GLN A 142 2.415 20.783 -9.906 1.00 0.00 O ATOM 2211 CB GLN A 142 0.653 18.557 -8.293 1.00 0.00 C ATOM 2212 CG GLN A 142 0.127 17.104 -8.251 1.00 0.00 C ATOM 2213 CD GLN A 142 -0.018 16.430 -9.625 1.00 0.00 C ATOM 2214 OE1 GLN A 142 -1.067 16.491 -10.264 1.00 0.00 O ATOM 2215 NE2 GLN A 142 1.027 15.775 -10.103 1.00 0.00 N ATOM 0 H GLN A 142 2.396 17.550 -6.891 1.00 0.00 H new ATOM 0 HA GLN A 142 2.436 18.315 -9.576 1.00 0.00 H new ATOM 0 HB2 GLN A 142 0.451 19.019 -7.327 1.00 0.00 H new ATOM 0 HB3 GLN A 142 0.074 19.106 -9.036 1.00 0.00 H new ATOM 0 HG2 GLN A 142 0.802 16.506 -7.638 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -0.844 17.098 -7.755 1.00 0.00 H new ATOM 0 HE21 GLN A 142 1.892 15.731 -9.564 1.00 0.00 H new ATOM 0 HE22 GLN A 142 0.968 15.314 -11.011 1.00 0.00 H new ATOM 2224 N GLN A 143 2.850 20.963 -7.690 1.00 0.00 N ATOM 2225 CA GLN A 143 3.460 22.318 -7.733 1.00 0.00 C ATOM 2226 C GLN A 143 5.010 22.321 -7.919 1.00 0.00 C ATOM 2227 O GLN A 143 5.513 23.254 -8.551 1.00 0.00 O ATOM 2228 CB GLN A 143 3.017 23.160 -6.501 1.00 0.00 C ATOM 2229 CG GLN A 143 3.298 22.572 -5.094 1.00 0.00 C ATOM 2230 CD GLN A 143 2.916 23.514 -3.944 1.00 0.00 C ATOM 2231 OE1 GLN A 143 1.748 23.644 -3.582 1.00 0.00 O ATOM 2232 NE2 GLN A 143 3.891 24.180 -3.343 1.00 0.00 N ATOM 0 H GLN A 143 2.734 20.601 -6.743 1.00 0.00 H new ATOM 0 HA GLN A 143 3.076 22.793 -8.636 1.00 0.00 H new ATOM 0 HB2 GLN A 143 3.507 24.132 -6.564 1.00 0.00 H new ATOM 0 HB3 GLN A 143 1.945 23.338 -6.583 1.00 0.00 H new ATOM 0 HG2 GLN A 143 2.748 21.637 -4.984 1.00 0.00 H new ATOM 0 HG3 GLN A 143 4.358 22.329 -5.016 1.00 0.00 H new ATOM 0 HE21 GLN A 143 4.855 24.063 -3.653 1.00 0.00 H new ATOM 0 HE22 GLN A 143 3.677 24.810 -2.570 1.00 0.00 H new ATOM 2241 N ASN A 144 5.766 21.343 -7.365 1.00 0.00 N ATOM 2242 CA ASN A 144 7.252 21.349 -7.416 1.00 0.00 C ATOM 2243 C ASN A 144 7.752 19.872 -7.341 1.00 0.00 C ATOM 2244 O ASN A 144 7.907 19.366 -6.228 1.00 0.00 O ATOM 2245 CB ASN A 144 7.937 22.323 -6.407 1.00 0.00 C ATOM 2246 CG ASN A 144 7.376 22.458 -4.976 1.00 0.00 C ATOM 2247 OD1 ASN A 144 6.707 23.438 -4.650 1.00 0.00 O ATOM 2248 ND2 ASN A 144 7.616 21.495 -4.106 1.00 0.00 N ATOM 0 H ASN A 144 5.373 20.538 -6.877 1.00 0.00 H new ATOM 0 HA ASN A 144 7.566 21.775 -8.369 1.00 0.00 H new ATOM 0 HB2 ASN A 144 8.981 22.022 -6.321 1.00 0.00 H new ATOM 0 HB3 ASN A 144 7.928 23.316 -6.856 1.00 0.00 H new ATOM 0 HD21 ASN A 144 7.246 21.561 -3.158 1.00 0.00 H new ATOM 0 HD22 ASN A 144 8.171 20.685 -4.382 1.00 0.00 H new ATOM 2255 N PRO A 145 8.009 19.132 -8.463 1.00 0.00 N ATOM 2256 CA PRO A 145 8.346 17.680 -8.419 1.00 0.00 C ATOM 2257 C PRO A 145 9.798 17.389 -7.934 1.00 0.00 C ATOM 2258 O PRO A 145 10.737 18.120 -8.269 1.00 0.00 O ATOM 2259 CB PRO A 145 8.025 17.233 -9.860 1.00 0.00 C ATOM 2260 CG PRO A 145 8.195 18.476 -10.733 1.00 0.00 C ATOM 2261 CD PRO A 145 7.752 19.625 -9.830 1.00 0.00 C ATOM 0 HA PRO A 145 7.781 17.115 -7.678 1.00 0.00 H new ATOM 0 HB2 PRO A 145 8.696 16.436 -10.180 1.00 0.00 H new ATOM 0 HB3 PRO A 145 7.010 16.842 -9.931 1.00 0.00 H new ATOM 0 HG2 PRO A 145 9.229 18.598 -11.056 1.00 0.00 H new ATOM 0 HG3 PRO A 145 7.584 18.418 -11.634 1.00 0.00 H new ATOM 0 HD2 PRO A 145 8.316 20.535 -10.038 1.00 0.00 H new ATOM 0 HD3 PRO A 145 6.698 19.863 -9.976 1.00 0.00 H new ATOM 2269 N GLN A 146 9.948 16.337 -7.101 1.00 0.00 N ATOM 2270 CA GLN A 146 11.194 16.069 -6.327 1.00 0.00 C ATOM 2271 C GLN A 146 11.561 14.547 -6.378 1.00 0.00 C ATOM 2272 O GLN A 146 10.644 13.724 -6.276 1.00 0.00 O ATOM 2273 CB GLN A 146 10.994 16.489 -4.841 1.00 0.00 C ATOM 2274 CG GLN A 146 10.838 18.009 -4.574 1.00 0.00 C ATOM 2275 CD GLN A 146 9.933 18.336 -3.376 1.00 0.00 C ATOM 2276 OE1 GLN A 146 10.392 18.650 -2.280 1.00 0.00 O ATOM 2277 NE2 GLN A 146 8.623 18.254 -3.554 1.00 0.00 N ATOM 0 H GLN A 146 9.214 15.647 -6.942 1.00 0.00 H new ATOM 0 HA GLN A 146 12.003 16.648 -6.773 1.00 0.00 H new ATOM 0 HB2 GLN A 146 10.109 15.981 -4.458 1.00 0.00 H new ATOM 0 HB3 GLN A 146 11.845 16.125 -4.265 1.00 0.00 H new ATOM 0 HG2 GLN A 146 11.824 18.442 -4.402 1.00 0.00 H new ATOM 0 HG3 GLN A 146 10.432 18.486 -5.466 1.00 0.00 H new ATOM 0 HE21 GLN A 146 8.248 17.993 -4.466 1.00 0.00 H new ATOM 0 HE22 GLN A 146 7.990 18.452 -2.779 1.00 0.00 H new ATOM 2286 N PRO A 147 12.853 14.107 -6.498 1.00 0.00 N ATOM 2287 CA PRO A 147 13.225 12.665 -6.524 1.00 0.00 C ATOM 2288 C PRO A 147 13.206 12.026 -5.097 1.00 0.00 C ATOM 2289 O PRO A 147 13.980 12.415 -4.217 1.00 0.00 O ATOM 2290 CB PRO A 147 14.630 12.714 -7.158 1.00 0.00 C ATOM 2291 CG PRO A 147 15.217 14.072 -6.773 1.00 0.00 C ATOM 2292 CD PRO A 147 14.005 15.003 -6.741 1.00 0.00 C ATOM 0 HA PRO A 147 12.531 12.033 -7.079 1.00 0.00 H new ATOM 0 HB2 PRO A 147 15.254 11.900 -6.788 1.00 0.00 H new ATOM 0 HB3 PRO A 147 14.574 12.606 -8.241 1.00 0.00 H new ATOM 0 HG2 PRO A 147 15.715 14.031 -5.804 1.00 0.00 H new ATOM 0 HG3 PRO A 147 15.958 14.407 -7.499 1.00 0.00 H new ATOM 0 HD2 PRO A 147 14.100 15.750 -5.953 1.00 0.00 H new ATOM 0 HD3 PRO A 147 13.895 15.544 -7.681 1.00 0.00 H new ATOM 2300 N LEU A 148 12.277 11.080 -4.879 1.00 0.00 N ATOM 2301 CA LEU A 148 11.886 10.626 -3.507 1.00 0.00 C ATOM 2302 C LEU A 148 12.597 9.311 -3.075 1.00 0.00 C ATOM 2303 O LEU A 148 12.968 8.485 -3.909 1.00 0.00 O ATOM 2304 CB LEU A 148 10.349 10.392 -3.426 1.00 0.00 C ATOM 2305 CG LEU A 148 9.418 11.568 -3.815 1.00 0.00 C ATOM 2306 CD1 LEU A 148 8.031 11.063 -4.248 1.00 0.00 C ATOM 2307 CD2 LEU A 148 9.343 12.616 -2.692 1.00 0.00 C ATOM 0 H LEU A 148 11.774 10.606 -5.629 1.00 0.00 H new ATOM 0 HA LEU A 148 12.196 11.423 -2.831 1.00 0.00 H new ATOM 0 HB2 LEU A 148 10.105 9.545 -4.067 1.00 0.00 H new ATOM 0 HB3 LEU A 148 10.108 10.098 -2.404 1.00 0.00 H new ATOM 0 HG LEU A 148 9.850 12.070 -4.681 1.00 0.00 H new ATOM 0 HD11 LEU A 148 7.402 11.912 -4.514 1.00 0.00 H new ATOM 0 HD12 LEU A 148 8.136 10.405 -5.110 1.00 0.00 H new ATOM 0 HD13 LEU A 148 7.571 10.514 -3.426 1.00 0.00 H new ATOM 0 HD21 LEU A 148 8.682 13.428 -2.996 1.00 0.00 H new ATOM 0 HD22 LEU A 148 8.954 12.151 -1.786 1.00 0.00 H new ATOM 0 HD23 LEU A 148 10.339 13.013 -2.497 1.00 0.00 H new ATOM 2319 N ILE A 149 12.686 9.108 -1.747 1.00 0.00 N ATOM 2320 CA ILE A 149 13.236 7.871 -1.114 1.00 0.00 C ATOM 2321 C ILE A 149 12.073 6.859 -0.939 1.00 0.00 C ATOM 2322 O ILE A 149 11.166 7.089 -0.143 1.00 0.00 O ATOM 2323 CB ILE A 149 13.983 8.174 0.236 1.00 0.00 C ATOM 2324 CG1 ILE A 149 15.240 9.081 0.078 1.00 0.00 C ATOM 2325 CG2 ILE A 149 14.357 6.896 1.034 1.00 0.00 C ATOM 2326 CD1 ILE A 149 16.475 8.440 -0.573 1.00 0.00 C ATOM 0 H ILE A 149 12.377 9.801 -1.066 1.00 0.00 H new ATOM 0 HA ILE A 149 13.996 7.435 -1.762 1.00 0.00 H new ATOM 0 HB ILE A 149 13.245 8.733 0.811 1.00 0.00 H new ATOM 0 HG12 ILE A 149 14.958 9.953 -0.512 1.00 0.00 H new ATOM 0 HG13 ILE A 149 15.525 9.443 1.066 1.00 0.00 H new ATOM 0 HG21 ILE A 149 14.869 7.178 1.954 1.00 0.00 H new ATOM 0 HG22 ILE A 149 13.451 6.342 1.279 1.00 0.00 H new ATOM 0 HG23 ILE A 149 15.014 6.269 0.430 1.00 0.00 H new ATOM 0 HD11 ILE A 149 17.280 9.173 -0.625 1.00 0.00 H new ATOM 0 HD12 ILE A 149 16.799 7.587 0.023 1.00 0.00 H new ATOM 0 HD13 ILE A 149 16.223 8.105 -1.579 1.00 0.00 H new ATOM 2338 N PHE A 150 12.180 5.717 -1.629 1.00 0.00 N ATOM 2339 CA PHE A 150 11.206 4.605 -1.552 1.00 0.00 C ATOM 2340 C PHE A 150 11.887 3.484 -0.729 1.00 0.00 C ATOM 2341 O PHE A 150 12.725 2.736 -1.250 1.00 0.00 O ATOM 2342 CB PHE A 150 10.859 4.114 -2.989 1.00 0.00 C ATOM 2343 CG PHE A 150 10.061 5.074 -3.884 1.00 0.00 C ATOM 2344 CD1 PHE A 150 10.711 6.152 -4.491 1.00 0.00 C ATOM 2345 CD2 PHE A 150 8.688 4.909 -4.075 1.00 0.00 C ATOM 2346 CE1 PHE A 150 9.984 7.093 -5.206 1.00 0.00 C ATOM 2347 CE2 PHE A 150 7.963 5.850 -4.806 1.00 0.00 C ATOM 2348 CZ PHE A 150 8.609 6.938 -5.373 1.00 0.00 C ATOM 0 H PHE A 150 12.954 5.530 -2.267 1.00 0.00 H new ATOM 0 HA PHE A 150 10.273 4.912 -1.080 1.00 0.00 H new ATOM 0 HB2 PHE A 150 11.792 3.874 -3.499 1.00 0.00 H new ATOM 0 HB3 PHE A 150 10.295 3.185 -2.902 1.00 0.00 H new ATOM 0 HD1 PHE A 150 11.783 6.253 -4.403 1.00 0.00 H new ATOM 0 HD2 PHE A 150 8.186 4.050 -3.655 1.00 0.00 H new ATOM 0 HE1 PHE A 150 10.485 7.948 -5.635 1.00 0.00 H new ATOM 0 HE2 PHE A 150 6.897 5.731 -4.931 1.00 0.00 H new ATOM 0 HZ PHE A 150 8.048 7.664 -5.943 1.00 0.00 H new ATOM 2358 N HIS A 151 11.511 3.370 0.558 1.00 0.00 N ATOM 2359 CA HIS A 151 11.957 2.255 1.427 1.00 0.00 C ATOM 2360 C HIS A 151 10.933 1.102 1.272 1.00 0.00 C ATOM 2361 O HIS A 151 9.902 1.059 1.949 1.00 0.00 O ATOM 2362 CB HIS A 151 12.161 2.759 2.881 1.00 0.00 C ATOM 2363 CG HIS A 151 12.681 1.764 3.935 1.00 0.00 C ATOM 2364 ND1 HIS A 151 13.589 2.119 4.916 1.00 0.00 N ATOM 2365 CD2 HIS A 151 12.307 0.410 4.115 1.00 0.00 C ATOM 2366 CE1 HIS A 151 13.701 0.932 5.587 1.00 0.00 C ATOM 2367 NE2 HIS A 151 12.971 -0.160 5.191 1.00 0.00 N ATOM 0 H HIS A 151 10.897 4.037 1.025 1.00 0.00 H new ATOM 0 HA HIS A 151 12.931 1.864 1.133 1.00 0.00 H new ATOM 0 HB2 HIS A 151 12.855 3.599 2.847 1.00 0.00 H new ATOM 0 HB3 HIS A 151 11.206 3.148 3.234 1.00 0.00 H new ATOM 0 HD2 HIS A 151 11.595 -0.112 3.493 1.00 0.00 H new ATOM 0 HE1 HIS A 151 14.368 0.854 6.433 1.00 0.00 H new ATOM 0 HE2 HIS A 151 12.929 -1.105 5.572 1.00 0.00 H new ATOM 2375 N MET A 152 11.292 0.146 0.409 1.00 0.00 N ATOM 2376 CA MET A 152 10.526 -1.100 0.199 1.00 0.00 C ATOM 2377 C MET A 152 11.061 -2.242 1.106 1.00 0.00 C ATOM 2378 O MET A 152 12.271 -2.356 1.342 1.00 0.00 O ATOM 2379 CB MET A 152 10.600 -1.525 -1.286 1.00 0.00 C ATOM 2380 CG MET A 152 9.985 -0.552 -2.305 1.00 0.00 C ATOM 2381 SD MET A 152 8.306 -0.103 -1.843 1.00 0.00 S ATOM 2382 CE MET A 152 7.850 0.911 -3.258 1.00 0.00 C ATOM 0 H MET A 152 12.128 0.210 -0.171 1.00 0.00 H new ATOM 0 HA MET A 152 9.487 -0.910 0.466 1.00 0.00 H new ATOM 0 HB2 MET A 152 11.648 -1.676 -1.547 1.00 0.00 H new ATOM 0 HB3 MET A 152 10.103 -2.489 -1.391 1.00 0.00 H new ATOM 0 HG2 MET A 152 10.599 0.346 -2.371 1.00 0.00 H new ATOM 0 HG3 MET A 152 9.983 -1.010 -3.294 1.00 0.00 H new ATOM 0 HE1 MET A 152 6.789 1.156 -3.203 1.00 0.00 H new ATOM 0 HE2 MET A 152 8.436 1.830 -3.251 1.00 0.00 H new ATOM 0 HE3 MET A 152 8.049 0.362 -4.178 1.00 0.00 H new ATOM 2392 N GLU A 153 10.145 -3.104 1.582 1.00 0.00 N ATOM 2393 CA GLU A 153 10.492 -4.276 2.414 1.00 0.00 C ATOM 2394 C GLU A 153 9.774 -5.490 1.762 1.00 0.00 C ATOM 2395 O GLU A 153 8.567 -5.663 1.942 1.00 0.00 O ATOM 2396 CB GLU A 153 10.163 -3.930 3.904 1.00 0.00 C ATOM 2397 CG GLU A 153 9.554 -5.048 4.769 1.00 0.00 C ATOM 2398 CD GLU A 153 9.654 -4.788 6.271 1.00 0.00 C ATOM 2399 OE1 GLU A 153 8.747 -4.136 6.834 1.00 0.00 O ATOM 2400 OE2 GLU A 153 10.643 -5.232 6.895 1.00 0.00 O ATOM 0 H GLU A 153 9.145 -3.011 1.403 1.00 0.00 H new ATOM 0 HA GLU A 153 11.547 -4.547 2.449 1.00 0.00 H new ATOM 0 HB2 GLU A 153 11.083 -3.595 4.384 1.00 0.00 H new ATOM 0 HB3 GLU A 153 9.474 -3.085 3.910 1.00 0.00 H new ATOM 0 HG2 GLU A 153 8.505 -5.172 4.500 1.00 0.00 H new ATOM 0 HG3 GLU A 153 10.056 -5.988 4.538 1.00 0.00 H new ATOM 2407 N MET A 154 10.518 -6.347 1.035 1.00 0.00 N ATOM 2408 CA MET A 154 9.971 -7.588 0.432 1.00 0.00 C ATOM 2409 C MET A 154 9.686 -8.670 1.502 1.00 0.00 C ATOM 2410 O MET A 154 10.507 -8.950 2.379 1.00 0.00 O ATOM 2411 CB MET A 154 10.907 -8.115 -0.682 1.00 0.00 C ATOM 2412 CG MET A 154 10.276 -9.138 -1.649 1.00 0.00 C ATOM 2413 SD MET A 154 8.814 -8.484 -2.485 1.00 0.00 S ATOM 2414 CE MET A 154 9.537 -7.217 -3.546 1.00 0.00 C ATOM 0 H MET A 154 11.510 -6.204 0.847 1.00 0.00 H new ATOM 0 HA MET A 154 9.013 -7.341 -0.026 1.00 0.00 H new ATOM 0 HB2 MET A 154 11.266 -7.266 -1.263 1.00 0.00 H new ATOM 0 HB3 MET A 154 11.779 -8.573 -0.214 1.00 0.00 H new ATOM 0 HG2 MET A 154 11.015 -9.434 -2.394 1.00 0.00 H new ATOM 0 HG3 MET A 154 10.003 -10.037 -1.096 1.00 0.00 H new ATOM 0 HE1 MET A 154 8.788 -6.867 -4.257 1.00 0.00 H new ATOM 0 HE2 MET A 154 9.876 -6.380 -2.935 1.00 0.00 H new ATOM 0 HE3 MET A 154 10.384 -7.637 -4.088 1.00 0.00 H new ATOM 2424 N LEU A 155 8.493 -9.257 1.370 1.00 0.00 N ATOM 2425 CA LEU A 155 8.033 -10.411 2.185 1.00 0.00 C ATOM 2426 C LEU A 155 7.810 -11.652 1.267 1.00 0.00 C ATOM 2427 O LEU A 155 8.475 -12.673 1.471 1.00 0.00 O ATOM 2428 CB LEU A 155 6.841 -10.092 3.150 1.00 0.00 C ATOM 2429 CG LEU A 155 5.902 -8.883 2.841 1.00 0.00 C ATOM 2430 CD1 LEU A 155 4.440 -9.157 3.215 1.00 0.00 C ATOM 2431 CD2 LEU A 155 6.390 -7.593 3.527 1.00 0.00 C ATOM 0 H LEU A 155 7.801 -8.948 0.687 1.00 0.00 H new ATOM 0 HA LEU A 155 8.831 -10.659 2.885 1.00 0.00 H new ATOM 0 HB2 LEU A 155 6.217 -10.984 3.204 1.00 0.00 H new ATOM 0 HB3 LEU A 155 7.259 -9.935 4.144 1.00 0.00 H new ATOM 0 HG LEU A 155 5.945 -8.743 1.761 1.00 0.00 H new ATOM 0 HD11 LEU A 155 3.834 -8.283 2.978 1.00 0.00 H new ATOM 0 HD12 LEU A 155 4.075 -10.015 2.651 1.00 0.00 H new ATOM 0 HD13 LEU A 155 4.371 -9.368 4.282 1.00 0.00 H new ATOM 0 HD21 LEU A 155 5.711 -6.775 3.288 1.00 0.00 H new ATOM 0 HD22 LEU A 155 6.414 -7.742 4.607 1.00 0.00 H new ATOM 0 HD23 LEU A 155 7.391 -7.349 3.172 1.00 0.00 H new ATOM 2443 N LYS A 156 6.874 -11.581 0.298 1.00 0.00 N ATOM 2444 CA LYS A 156 6.566 -12.700 -0.637 1.00 0.00 C ATOM 2445 C LYS A 156 6.430 -12.134 -2.080 1.00 0.00 C ATOM 2446 O LYS A 156 6.105 -10.964 -2.302 1.00 0.00 O ATOM 2447 CB LYS A 156 5.257 -13.456 -0.249 1.00 0.00 C ATOM 2448 CG LYS A 156 5.306 -14.444 0.943 1.00 0.00 C ATOM 2449 CD LYS A 156 5.154 -13.880 2.372 1.00 0.00 C ATOM 2450 CE LYS A 156 3.806 -13.191 2.662 1.00 0.00 C ATOM 2451 NZ LYS A 156 3.729 -12.731 4.060 1.00 0.00 N ATOM 0 H LYS A 156 6.306 -10.749 0.136 1.00 0.00 H new ATOM 0 HA LYS A 156 7.385 -13.417 -0.578 1.00 0.00 H new ATOM 0 HB2 LYS A 156 4.494 -12.709 -0.031 1.00 0.00 H new ATOM 0 HB3 LYS A 156 4.920 -14.009 -1.126 1.00 0.00 H new ATOM 0 HG2 LYS A 156 4.520 -15.184 0.793 1.00 0.00 H new ATOM 0 HG3 LYS A 156 6.257 -14.975 0.895 1.00 0.00 H new ATOM 0 HD2 LYS A 156 5.289 -14.694 3.084 1.00 0.00 H new ATOM 0 HD3 LYS A 156 5.956 -13.164 2.551 1.00 0.00 H new ATOM 0 HE2 LYS A 156 3.677 -12.342 1.990 1.00 0.00 H new ATOM 0 HE3 LYS A 156 2.990 -13.885 2.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 2.810 -12.272 4.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 3.828 -13.545 4.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 4.494 -12.051 4.244 1.00 0.00 H new ATOM 2465 N VAL A 157 6.658 -13.005 -3.077 1.00 0.00 N ATOM 2466 CA VAL A 157 6.503 -12.664 -4.515 1.00 0.00 C ATOM 2467 C VAL A 157 6.206 -13.992 -5.281 1.00 0.00 C ATOM 2468 O VAL A 157 6.946 -14.977 -5.168 1.00 0.00 O ATOM 2469 CB VAL A 157 7.658 -11.765 -5.089 1.00 0.00 C ATOM 2470 CG1 VAL A 157 9.089 -12.138 -4.649 1.00 0.00 C ATOM 2471 CG2 VAL A 157 7.587 -11.613 -6.621 1.00 0.00 C ATOM 0 H VAL A 157 6.955 -13.967 -2.917 1.00 0.00 H new ATOM 0 HA VAL A 157 5.653 -11.998 -4.662 1.00 0.00 H new ATOM 0 HB VAL A 157 7.460 -10.799 -4.625 1.00 0.00 H new ATOM 0 HG11 VAL A 157 9.801 -11.451 -5.106 1.00 0.00 H new ATOM 0 HG12 VAL A 157 9.165 -12.071 -3.564 1.00 0.00 H new ATOM 0 HG13 VAL A 157 9.313 -13.156 -4.966 1.00 0.00 H new ATOM 0 HG21 VAL A 157 8.408 -10.983 -6.963 1.00 0.00 H new ATOM 0 HG22 VAL A 157 7.665 -12.595 -7.088 1.00 0.00 H new ATOM 0 HG23 VAL A 157 6.638 -11.154 -6.897 1.00 0.00 H new ATOM 2481 N GLU A 158 5.115 -13.974 -6.072 1.00 0.00 N ATOM 2482 CA GLU A 158 4.612 -15.156 -6.823 1.00 0.00 C ATOM 2483 C GLU A 158 4.525 -14.844 -8.339 1.00 0.00 C ATOM 2484 O GLU A 158 4.186 -13.739 -8.764 1.00 0.00 O ATOM 2485 CB GLU A 158 3.218 -15.589 -6.289 1.00 0.00 C ATOM 2486 CG GLU A 158 3.187 -16.338 -4.941 1.00 0.00 C ATOM 2487 CD GLU A 158 3.923 -17.682 -4.871 1.00 0.00 C ATOM 2488 OE1 GLU A 158 5.168 -17.691 -4.745 1.00 0.00 O ATOM 2489 OE2 GLU A 158 3.255 -18.739 -4.916 1.00 0.00 O ATOM 0 H GLU A 158 4.550 -13.137 -6.213 1.00 0.00 H new ATOM 0 HA GLU A 158 5.315 -15.976 -6.675 1.00 0.00 H new ATOM 0 HB2 GLU A 158 2.599 -14.697 -6.195 1.00 0.00 H new ATOM 0 HB3 GLU A 158 2.750 -16.224 -7.041 1.00 0.00 H new ATOM 0 HG2 GLU A 158 3.608 -15.682 -4.180 1.00 0.00 H new ATOM 0 HG3 GLU A 158 2.144 -16.509 -4.673 1.00 0.00 H new ATOM 2496 N SER A 159 4.813 -15.874 -9.143 1.00 0.00 N ATOM 2497 CA SER A 159 4.922 -15.765 -10.628 1.00 0.00 C ATOM 2498 C SER A 159 3.588 -16.123 -11.381 1.00 0.00 C ATOM 2499 O SER A 159 2.715 -16.745 -10.765 1.00 0.00 O ATOM 2500 CB SER A 159 6.095 -16.693 -11.042 1.00 0.00 C ATOM 2501 OG SER A 159 7.344 -16.166 -10.605 1.00 0.00 O ATOM 0 H SER A 159 4.980 -16.818 -8.794 1.00 0.00 H new ATOM 0 HA SER A 159 5.112 -14.731 -10.915 1.00 0.00 H new ATOM 0 HB2 SER A 159 5.946 -17.685 -10.616 1.00 0.00 H new ATOM 0 HB3 SER A 159 6.105 -16.810 -12.126 1.00 0.00 H new ATOM 0 HG SER A 159 8.012 -16.278 -11.313 1.00 0.00 H new ATOM 2507 N PRO A 160 3.375 -15.783 -12.696 1.00 0.00 N ATOM 2508 CA PRO A 160 2.121 -16.103 -13.438 1.00 0.00 C ATOM 2509 C PRO A 160 1.909 -17.628 -13.665 1.00 0.00 C ATOM 2510 O PRO A 160 2.640 -18.263 -14.434 1.00 0.00 O ATOM 2511 CB PRO A 160 2.266 -15.313 -14.757 1.00 0.00 C ATOM 2512 CG PRO A 160 3.765 -15.063 -14.928 1.00 0.00 C ATOM 2513 CD PRO A 160 4.309 -14.970 -13.503 1.00 0.00 C ATOM 0 HA PRO A 160 1.230 -15.820 -12.877 1.00 0.00 H new ATOM 0 HB2 PRO A 160 1.865 -15.879 -15.598 1.00 0.00 H new ATOM 0 HB3 PRO A 160 1.715 -14.374 -14.713 1.00 0.00 H new ATOM 0 HG2 PRO A 160 4.241 -15.873 -15.481 1.00 0.00 H new ATOM 0 HG3 PRO A 160 3.952 -14.144 -15.484 1.00 0.00 H new ATOM 0 HD2 PRO A 160 5.327 -15.356 -13.441 1.00 0.00 H new ATOM 0 HD3 PRO A 160 4.338 -13.937 -13.156 1.00 0.00 H new ATOM 2521 N GLY A 161 0.930 -18.196 -12.944 1.00 0.00 N ATOM 2522 CA GLY A 161 0.796 -19.662 -12.803 1.00 0.00 C ATOM 2523 C GLY A 161 0.383 -20.076 -11.380 1.00 0.00 C ATOM 2524 O GLY A 161 -0.627 -20.763 -11.207 1.00 0.00 O ATOM 0 H GLY A 161 0.216 -17.664 -12.447 1.00 0.00 H new ATOM 0 HA2 GLY A 161 0.055 -20.027 -13.515 1.00 0.00 H new ATOM 0 HA3 GLY A 161 1.743 -20.137 -13.057 1.00 0.00 H new ATOM 2528 N THR A 162 1.186 -19.668 -10.381 1.00 0.00 N ATOM 2529 CA THR A 162 0.913 -19.934 -8.946 1.00 0.00 C ATOM 2530 C THR A 162 -0.034 -18.907 -8.259 1.00 0.00 C ATOM 2531 O THR A 162 -0.822 -19.325 -7.405 1.00 0.00 O ATOM 2532 CB THR A 162 2.245 -20.188 -8.177 1.00 0.00 C ATOM 2533 OG1 THR A 162 1.970 -20.546 -6.827 1.00 0.00 O ATOM 2534 CG2 THR A 162 3.294 -19.065 -8.189 1.00 0.00 C ATOM 0 H THR A 162 2.046 -19.143 -10.540 1.00 0.00 H new ATOM 0 HA THR A 162 0.328 -20.853 -8.903 1.00 0.00 H new ATOM 0 HB THR A 162 2.706 -20.999 -8.742 1.00 0.00 H new ATOM 0 HG1 THR A 162 2.419 -19.918 -6.224 1.00 0.00 H new ATOM 0 HG21 THR A 162 4.168 -19.377 -7.617 1.00 0.00 H new ATOM 0 HG22 THR A 162 3.590 -18.854 -9.217 1.00 0.00 H new ATOM 0 HG23 THR A 162 2.870 -18.166 -7.742 1.00 0.00 H new ATOM 2542 N TYR A 163 0.029 -17.601 -8.599 1.00 0.00 N ATOM 2543 CA TYR A 163 -0.788 -16.561 -7.927 1.00 0.00 C ATOM 2544 C TYR A 163 -2.289 -16.623 -8.360 1.00 0.00 C ATOM 2545 O TYR A 163 -2.593 -16.766 -9.551 1.00 0.00 O ATOM 2546 CB TYR A 163 -0.119 -15.158 -8.068 1.00 0.00 C ATOM 2547 CG TYR A 163 -0.577 -14.234 -9.212 1.00 0.00 C ATOM 2548 CD1 TYR A 163 -0.062 -14.373 -10.504 1.00 0.00 C ATOM 2549 CD2 TYR A 163 -1.562 -13.274 -8.964 1.00 0.00 C ATOM 2550 CE1 TYR A 163 -0.528 -13.555 -11.532 1.00 0.00 C ATOM 2551 CE2 TYR A 163 -2.005 -12.439 -9.985 1.00 0.00 C ATOM 2552 CZ TYR A 163 -1.485 -12.577 -11.268 1.00 0.00 C ATOM 2553 OH TYR A 163 -1.919 -11.750 -12.269 1.00 0.00 O ATOM 0 H TYR A 163 0.636 -17.240 -9.334 1.00 0.00 H new ATOM 0 HA TYR A 163 -0.813 -16.767 -6.857 1.00 0.00 H new ATOM 0 HB2 TYR A 163 -0.270 -14.623 -7.130 1.00 0.00 H new ATOM 0 HB3 TYR A 163 0.954 -15.313 -8.177 1.00 0.00 H new ATOM 0 HD1 TYR A 163 0.697 -15.114 -10.706 1.00 0.00 H new ATOM 0 HD2 TYR A 163 -1.982 -13.180 -7.973 1.00 0.00 H new ATOM 0 HE1 TYR A 163 -0.147 -13.679 -12.535 1.00 0.00 H new ATOM 0 HE2 TYR A 163 -2.751 -11.685 -9.782 1.00 0.00 H new ATOM 0 HH TYR A 163 -2.587 -11.128 -11.913 1.00 0.00 H new