USER MOD reduce.3.24.130724 H: found=0, std=0, add=794, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 790 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 87 ASN : amide:sc= -1.51 X(o=-1.6,f=-1.6) USER MOD Set 1.2: A 90 GLN : amide:sc= -0.112 K(o=-1.6,f=-3.7!) USER MOD Set 2.1: A 48 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 49 LYS NZ :NH3+ -169:sc= -0.476 (180deg=-0.651) USER MOD Set 3.1: A 0 SER OG : rot 180:sc= -0.0768 USER MOD Set 3.2: A 3 GLN : amide:sc= -2.97 K(o=-3.1,f=-3.7!) USER MOD Single : A 0 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot -63:sc= 0.675 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 71:sc= 0.959 USER MOD Single : A 13 THR OG1 : rot -48:sc= 0.446 USER MOD Single : A 15 GLN : amide:sc= -3.9! C(o=-3.9!,f=-4.8!) USER MOD Single : A 16 GLN : amide:sc= -0.785 X(o=-0.78,f=-0.39) USER MOD Single : A 19 ASN : amide:sc= -0.268 X(o=-0.27,f=-0.27) USER MOD Single : A 22 SER OG : rot 180:sc= -0.746 USER MOD Single : A 31 THR OG1 : rot 84:sc= 1.15 USER MOD Single : A 38 ASN : amide:sc= -1.34 K(o=-1.3,f=-1.9) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.0488 USER MOD Single : A 47 HIS : no HE2:sc= -6.91! C(o=-6.9!,f=-7!) USER MOD Single : A 51 GLN : amide:sc= -0.45 X(o=-0.45,f=-0.86) USER MOD Single : A 54 THR OG1 : rot -82:sc= 1.21 USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -2.38 X(o=-2.4,f=-1.9) USER MOD Single : A 74 GLN : amide:sc= -0.0805 K(o=-0.081,f=-2.1!) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 8 N SER A 0 2.811 -1.261 -3.281 1.00 0.00 N ATOM 9 CA SER A 0 2.252 -2.003 -4.405 1.00 0.00 C ATOM 10 C SER A 0 3.168 -3.155 -4.804 1.00 0.00 C ATOM 11 O SER A 0 3.509 -3.313 -5.976 1.00 0.00 O ATOM 12 CB SER A 0 2.033 -1.072 -5.599 1.00 0.00 C ATOM 13 OG SER A 0 1.135 -0.026 -5.272 1.00 0.00 O ATOM 0 H1 SER A 0 2.171 -0.482 -3.027 1.00 0.00 H new ATOM 0 H2 SER A 0 2.923 -1.897 -2.466 1.00 0.00 H new ATOM 0 H3 SER A 0 3.739 -0.874 -3.548 1.00 0.00 H new ATOM 0 HA SER A 0 1.292 -2.416 -4.095 1.00 0.00 H new ATOM 0 HB2 SER A 0 2.987 -0.651 -5.915 1.00 0.00 H new ATOM 0 HB3 SER A 0 1.641 -1.642 -6.441 1.00 0.00 H new ATOM 0 HG SER A 0 1.013 0.556 -6.051 1.00 0.00 H new ATOM 19 N ALA A 1 3.564 -3.957 -3.821 1.00 0.00 N ATOM 20 CA ALA A 1 4.439 -5.096 -4.069 1.00 0.00 C ATOM 21 C ALA A 1 3.632 -6.369 -4.295 1.00 0.00 C ATOM 22 O ALA A 1 3.746 -7.011 -5.340 1.00 0.00 O ATOM 23 CB ALA A 1 5.406 -5.281 -2.910 1.00 0.00 C ATOM 0 H ALA A 1 3.292 -3.839 -2.845 1.00 0.00 H new ATOM 0 HA ALA A 1 5.010 -4.893 -4.975 1.00 0.00 H new ATOM 0 HB1 ALA A 1 6.053 -6.135 -3.109 1.00 0.00 H new ATOM 0 HB2 ALA A 1 6.014 -4.384 -2.797 1.00 0.00 H new ATOM 0 HB3 ALA A 1 4.845 -5.457 -1.992 1.00 0.00 H new ATOM 29 N ARG A 2 2.816 -6.730 -3.310 1.00 0.00 N ATOM 30 CA ARG A 2 1.991 -7.929 -3.401 1.00 0.00 C ATOM 31 C ARG A 2 1.048 -7.850 -4.598 1.00 0.00 C ATOM 32 O ARG A 2 0.920 -8.805 -5.363 1.00 0.00 O ATOM 33 CB ARG A 2 1.185 -8.118 -2.115 1.00 0.00 C ATOM 34 CG ARG A 2 0.199 -9.273 -2.178 1.00 0.00 C ATOM 35 CD ARG A 2 0.899 -10.586 -2.493 1.00 0.00 C ATOM 36 NE ARG A 2 0.120 -11.741 -2.054 1.00 0.00 N ATOM 37 CZ ARG A 2 -0.020 -12.093 -0.781 1.00 0.00 C ATOM 38 NH1 ARG A 2 0.564 -11.383 0.174 1.00 0.00 N ATOM 39 NH2 ARG A 2 -0.746 -13.157 -0.461 1.00 0.00 N ATOM 0 H ARG A 2 2.708 -6.209 -2.440 1.00 0.00 H new ATOM 0 HA ARG A 2 2.652 -8.785 -3.537 1.00 0.00 H new ATOM 0 HB2 ARG A 2 1.873 -8.284 -1.286 1.00 0.00 H new ATOM 0 HB3 ARG A 2 0.641 -7.198 -1.899 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -0.325 -9.358 -1.226 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -0.554 -9.069 -2.939 1.00 0.00 H new ATOM 0 HD2 ARG A 2 1.075 -10.654 -3.567 1.00 0.00 H new ATOM 0 HD3 ARG A 2 1.875 -10.602 -2.008 1.00 0.00 H new ATOM 0 HE ARG A 2 -0.342 -12.309 -2.764 1.00 0.00 H new ATOM 0 HH11 ARG A 2 1.122 -10.564 -0.068 1.00 0.00 H new ATOM 0 HH12 ARG A 2 0.455 -11.655 1.151 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -1.197 -13.705 -1.193 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -0.853 -13.426 0.517 1.00 0.00 H new ATOM 53 N GLN A 3 0.391 -6.705 -4.753 1.00 0.00 N ATOM 54 CA GLN A 3 -0.541 -6.503 -5.856 1.00 0.00 C ATOM 55 C GLN A 3 0.148 -6.724 -7.198 1.00 0.00 C ATOM 56 O GLN A 3 -0.468 -7.200 -8.153 1.00 0.00 O ATOM 57 CB GLN A 3 -1.133 -5.093 -5.799 1.00 0.00 C ATOM 58 CG GLN A 3 -0.094 -4.006 -5.578 1.00 0.00 C ATOM 59 CD GLN A 3 -0.633 -2.618 -5.865 1.00 0.00 C ATOM 60 OE1 GLN A 3 -0.727 -2.202 -7.020 1.00 0.00 O ATOM 61 NE2 GLN A 3 -0.990 -1.892 -4.811 1.00 0.00 N ATOM 0 H GLN A 3 0.487 -5.904 -4.129 1.00 0.00 H new ATOM 0 HA GLN A 3 -1.346 -7.232 -5.757 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -1.664 -4.893 -6.730 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -1.869 -5.049 -4.996 1.00 0.00 H new ATOM 0 HG2 GLN A 3 0.258 -4.049 -4.547 1.00 0.00 H new ATOM 0 HG3 GLN A 3 0.768 -4.197 -6.218 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -0.895 -2.277 -3.871 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -1.359 -0.950 -4.942 1.00 0.00 H new ATOM 70 N LEU A 4 1.428 -6.375 -7.265 1.00 0.00 N ATOM 71 CA LEU A 4 2.201 -6.535 -8.491 1.00 0.00 C ATOM 72 C LEU A 4 2.920 -7.881 -8.510 1.00 0.00 C ATOM 73 O LEU A 4 3.490 -8.277 -9.526 1.00 0.00 O ATOM 74 CB LEU A 4 3.217 -5.400 -8.629 1.00 0.00 C ATOM 75 CG LEU A 4 2.721 -4.138 -9.336 1.00 0.00 C ATOM 76 CD1 LEU A 4 1.480 -3.593 -8.647 1.00 0.00 C ATOM 77 CD2 LEU A 4 3.817 -3.083 -9.377 1.00 0.00 C ATOM 0 H LEU A 4 1.952 -5.979 -6.485 1.00 0.00 H new ATOM 0 HA LEU A 4 1.510 -6.501 -9.333 1.00 0.00 H new ATOM 0 HB2 LEU A 4 3.560 -5.123 -7.632 1.00 0.00 H new ATOM 0 HB3 LEU A 4 4.084 -5.779 -9.170 1.00 0.00 H new ATOM 0 HG LEU A 4 2.458 -4.399 -10.361 1.00 0.00 H new ATOM 0 HD11 LEU A 4 1.142 -2.695 -9.164 1.00 0.00 H new ATOM 0 HD12 LEU A 4 0.691 -4.345 -8.671 1.00 0.00 H new ATOM 0 HD13 LEU A 4 1.717 -3.348 -7.612 1.00 0.00 H new ATOM 0 HD21 LEU A 4 3.446 -2.192 -9.884 1.00 0.00 H new ATOM 0 HD22 LEU A 4 4.112 -2.825 -8.360 1.00 0.00 H new ATOM 0 HD23 LEU A 4 4.679 -3.475 -9.917 1.00 0.00 H new ATOM 89 N SER A 5 2.887 -8.579 -7.379 1.00 0.00 N ATOM 90 CA SER A 5 3.537 -9.879 -7.265 1.00 0.00 C ATOM 91 C SER A 5 2.874 -10.901 -8.185 1.00 0.00 C ATOM 92 O SER A 5 3.423 -11.973 -8.439 1.00 0.00 O ATOM 93 CB SER A 5 3.487 -10.372 -5.818 1.00 0.00 C ATOM 94 OG SER A 5 2.246 -10.993 -5.532 1.00 0.00 O ATOM 0 H SER A 5 2.417 -8.266 -6.529 1.00 0.00 H new ATOM 0 HA SER A 5 4.578 -9.765 -7.567 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.299 -11.078 -5.643 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.642 -9.533 -5.139 1.00 0.00 H new ATOM 0 HG SER A 5 1.523 -10.338 -5.625 1.00 0.00 H new ATOM 100 N LYS A 6 1.690 -10.559 -8.682 1.00 0.00 N ATOM 101 CA LYS A 6 0.951 -11.443 -9.575 1.00 0.00 C ATOM 102 C LYS A 6 1.861 -12.001 -10.664 1.00 0.00 C ATOM 103 O LYS A 6 1.716 -13.152 -11.080 1.00 0.00 O ATOM 104 CB LYS A 6 -0.224 -10.695 -10.209 1.00 0.00 C ATOM 105 CG LYS A 6 -1.064 -11.556 -11.137 1.00 0.00 C ATOM 106 CD LYS A 6 -2.104 -10.731 -11.875 1.00 0.00 C ATOM 107 CE LYS A 6 -1.474 -9.907 -12.988 1.00 0.00 C ATOM 108 NZ LYS A 6 -1.291 -10.705 -14.232 1.00 0.00 N ATOM 0 H LYS A 6 1.222 -9.675 -8.481 1.00 0.00 H new ATOM 0 HA LYS A 6 0.567 -12.276 -8.986 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -0.861 -10.299 -9.418 1.00 0.00 H new ATOM 0 HB3 LYS A 6 0.159 -9.841 -10.767 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -0.416 -12.055 -11.858 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -1.560 -12.337 -10.560 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -2.863 -11.391 -12.295 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -2.610 -10.069 -11.173 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -2.103 -9.042 -13.200 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -0.509 -9.525 -12.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -0.859 -10.109 -14.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -0.671 -11.516 -14.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -2.215 -11.048 -14.563 1.00 0.00 H new ATOM 122 N LEU A 7 2.799 -11.180 -11.123 1.00 0.00 N ATOM 123 CA LEU A 7 3.734 -11.592 -12.164 1.00 0.00 C ATOM 124 C LEU A 7 5.010 -12.165 -11.554 1.00 0.00 C ATOM 125 O LEU A 7 5.671 -13.013 -12.153 1.00 0.00 O ATOM 126 CB LEU A 7 4.076 -10.406 -13.068 1.00 0.00 C ATOM 127 CG LEU A 7 5.186 -10.642 -14.093 1.00 0.00 C ATOM 128 CD1 LEU A 7 4.606 -10.741 -15.495 1.00 0.00 C ATOM 129 CD2 LEU A 7 6.223 -9.531 -14.021 1.00 0.00 C ATOM 0 H LEU A 7 2.932 -10.225 -10.791 1.00 0.00 H new ATOM 0 HA LEU A 7 3.257 -12.370 -12.760 1.00 0.00 H new ATOM 0 HB2 LEU A 7 3.173 -10.109 -13.602 1.00 0.00 H new ATOM 0 HB3 LEU A 7 4.364 -9.565 -12.437 1.00 0.00 H new ATOM 0 HG LEU A 7 5.677 -11.586 -13.857 1.00 0.00 H new ATOM 0 HD11 LEU A 7 5.411 -10.909 -16.211 1.00 0.00 H new ATOM 0 HD12 LEU A 7 3.902 -11.572 -15.540 1.00 0.00 H new ATOM 0 HD13 LEU A 7 4.089 -9.813 -15.741 1.00 0.00 H new ATOM 0 HD21 LEU A 7 7.005 -9.715 -14.757 1.00 0.00 H new ATOM 0 HD22 LEU A 7 5.746 -8.574 -14.230 1.00 0.00 H new ATOM 0 HD23 LEU A 7 6.662 -9.507 -13.024 1.00 0.00 H new ATOM 141 N LYS A 8 5.349 -11.697 -10.358 1.00 0.00 N ATOM 142 CA LYS A 8 6.543 -12.164 -9.663 1.00 0.00 C ATOM 143 C LYS A 8 6.667 -13.682 -9.755 1.00 0.00 C ATOM 144 O LYS A 8 7.650 -14.203 -10.284 1.00 0.00 O ATOM 145 CB LYS A 8 6.507 -11.733 -8.196 1.00 0.00 C ATOM 146 CG LYS A 8 7.751 -12.122 -7.416 1.00 0.00 C ATOM 147 CD LYS A 8 7.414 -12.510 -5.986 1.00 0.00 C ATOM 148 CE LYS A 8 7.454 -14.019 -5.795 1.00 0.00 C ATOM 149 NZ LYS A 8 6.794 -14.434 -4.526 1.00 0.00 N ATOM 0 H LYS A 8 4.813 -10.994 -9.849 1.00 0.00 H new ATOM 0 HA LYS A 8 7.412 -11.716 -10.145 1.00 0.00 H new ATOM 0 HB2 LYS A 8 6.381 -10.651 -8.147 1.00 0.00 H new ATOM 0 HB3 LYS A 8 5.635 -12.177 -7.717 1.00 0.00 H new ATOM 0 HG2 LYS A 8 8.247 -12.956 -7.913 1.00 0.00 H new ATOM 0 HG3 LYS A 8 8.454 -11.289 -7.412 1.00 0.00 H new ATOM 0 HD2 LYS A 8 8.120 -12.037 -5.303 1.00 0.00 H new ATOM 0 HD3 LYS A 8 6.423 -12.136 -5.730 1.00 0.00 H new ATOM 0 HE2 LYS A 8 6.961 -14.505 -6.637 1.00 0.00 H new ATOM 0 HE3 LYS A 8 8.490 -14.358 -5.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 6.842 -15.469 -4.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 7.280 -13.990 -3.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 5.799 -14.133 -4.538 1.00 0.00 H new ATOM 163 N ARG A 9 5.665 -14.385 -9.239 1.00 0.00 N ATOM 164 CA ARG A 9 5.663 -15.843 -9.263 1.00 0.00 C ATOM 165 C ARG A 9 5.929 -16.363 -10.672 1.00 0.00 C ATOM 166 O ARG A 9 6.883 -17.107 -10.901 1.00 0.00 O ATOM 167 CB ARG A 9 4.324 -16.380 -8.753 1.00 0.00 C ATOM 168 CG ARG A 9 3.891 -15.777 -7.427 1.00 0.00 C ATOM 169 CD ARG A 9 2.640 -16.454 -6.889 1.00 0.00 C ATOM 170 NE ARG A 9 2.940 -17.736 -6.258 1.00 0.00 N ATOM 171 CZ ARG A 9 2.018 -18.648 -5.972 1.00 0.00 C ATOM 172 NH1 ARG A 9 0.744 -18.420 -6.258 1.00 0.00 N ATOM 173 NH2 ARG A 9 2.370 -19.791 -5.397 1.00 0.00 N ATOM 0 H ARG A 9 4.844 -13.969 -8.799 1.00 0.00 H new ATOM 0 HA ARG A 9 6.461 -16.194 -8.608 1.00 0.00 H new ATOM 0 HB2 ARG A 9 3.555 -16.183 -9.500 1.00 0.00 H new ATOM 0 HB3 ARG A 9 4.394 -17.462 -8.645 1.00 0.00 H new ATOM 0 HG2 ARG A 9 4.699 -15.873 -6.701 1.00 0.00 H new ATOM 0 HG3 ARG A 9 3.703 -14.711 -7.555 1.00 0.00 H new ATOM 0 HD2 ARG A 9 2.156 -15.798 -6.165 1.00 0.00 H new ATOM 0 HD3 ARG A 9 1.932 -16.608 -7.704 1.00 0.00 H new ATOM 0 HE ARG A 9 3.911 -17.942 -6.024 1.00 0.00 H new ATOM 0 HH11 ARG A 9 0.470 -17.542 -6.699 1.00 0.00 H new ATOM 0 HH12 ARG A 9 0.038 -19.122 -6.037 1.00 0.00 H new ATOM 0 HH21 ARG A 9 3.349 -19.970 -5.174 1.00 0.00 H new ATOM 0 HH22 ARG A 9 1.661 -20.491 -5.178 1.00 0.00 H new ATOM 187 N PHE A 10 5.078 -15.968 -11.614 1.00 0.00 N ATOM 188 CA PHE A 10 5.220 -16.396 -13.001 1.00 0.00 C ATOM 189 C PHE A 10 6.650 -16.186 -13.491 1.00 0.00 C ATOM 190 O PHE A 10 7.303 -17.123 -13.954 1.00 0.00 O ATOM 191 CB PHE A 10 4.245 -15.628 -13.896 1.00 0.00 C ATOM 192 CG PHE A 10 4.519 -15.795 -15.363 1.00 0.00 C ATOM 193 CD1 PHE A 10 5.027 -16.987 -15.855 1.00 0.00 C ATOM 194 CD2 PHE A 10 4.268 -14.761 -16.250 1.00 0.00 C ATOM 195 CE1 PHE A 10 5.280 -17.144 -17.204 1.00 0.00 C ATOM 196 CE2 PHE A 10 4.518 -14.913 -17.601 1.00 0.00 C ATOM 197 CZ PHE A 10 5.026 -16.106 -18.078 1.00 0.00 C ATOM 0 H PHE A 10 4.283 -15.352 -11.442 1.00 0.00 H new ATOM 0 HA PHE A 10 4.989 -17.460 -13.052 1.00 0.00 H new ATOM 0 HB2 PHE A 10 3.229 -15.962 -13.684 1.00 0.00 H new ATOM 0 HB3 PHE A 10 4.291 -14.568 -13.644 1.00 0.00 H new ATOM 0 HD1 PHE A 10 5.227 -17.803 -15.176 1.00 0.00 H new ATOM 0 HD2 PHE A 10 3.873 -13.826 -15.882 1.00 0.00 H new ATOM 0 HE1 PHE A 10 5.676 -18.078 -17.575 1.00 0.00 H new ATOM 0 HE2 PHE A 10 4.316 -14.100 -18.283 1.00 0.00 H new ATOM 0 HZ PHE A 10 5.224 -16.226 -19.133 1.00 0.00 H new ATOM 207 N LEU A 11 7.130 -14.952 -13.386 1.00 0.00 N ATOM 208 CA LEU A 11 8.483 -14.618 -13.819 1.00 0.00 C ATOM 209 C LEU A 11 9.506 -15.547 -13.172 1.00 0.00 C ATOM 210 O LEU A 11 10.377 -16.096 -13.847 1.00 0.00 O ATOM 211 CB LEU A 11 8.806 -13.164 -13.472 1.00 0.00 C ATOM 212 CG LEU A 11 9.586 -12.380 -14.528 1.00 0.00 C ATOM 213 CD1 LEU A 11 10.932 -13.035 -14.793 1.00 0.00 C ATOM 214 CD2 LEU A 11 8.780 -12.271 -15.815 1.00 0.00 C ATOM 0 H LEU A 11 6.603 -14.166 -13.005 1.00 0.00 H new ATOM 0 HA LEU A 11 8.535 -14.747 -14.900 1.00 0.00 H new ATOM 0 HB2 LEU A 11 7.870 -12.641 -13.278 1.00 0.00 H new ATOM 0 HB3 LEU A 11 9.377 -13.151 -12.543 1.00 0.00 H new ATOM 0 HG LEU A 11 9.764 -11.374 -14.148 1.00 0.00 H new ATOM 0 HD11 LEU A 11 11.473 -12.463 -15.547 1.00 0.00 H new ATOM 0 HD12 LEU A 11 11.513 -13.060 -13.871 1.00 0.00 H new ATOM 0 HD13 LEU A 11 10.777 -14.053 -15.151 1.00 0.00 H new ATOM 0 HD21 LEU A 11 9.351 -11.710 -16.555 1.00 0.00 H new ATOM 0 HD22 LEU A 11 8.571 -13.269 -16.199 1.00 0.00 H new ATOM 0 HD23 LEU A 11 7.841 -11.755 -15.614 1.00 0.00 H new ATOM 226 N THR A 12 9.394 -15.720 -11.859 1.00 0.00 N ATOM 227 CA THR A 12 10.308 -16.582 -11.120 1.00 0.00 C ATOM 228 C THR A 12 10.388 -17.967 -11.752 1.00 0.00 C ATOM 229 O THR A 12 11.472 -18.450 -12.079 1.00 0.00 O ATOM 230 CB THR A 12 9.878 -16.726 -9.648 1.00 0.00 C ATOM 231 OG1 THR A 12 9.847 -15.440 -9.019 1.00 0.00 O ATOM 232 CG2 THR A 12 10.831 -17.641 -8.894 1.00 0.00 C ATOM 0 H THR A 12 8.679 -15.274 -11.285 1.00 0.00 H new ATOM 0 HA THR A 12 11.290 -16.110 -11.159 1.00 0.00 H new ATOM 0 HB THR A 12 8.881 -17.166 -9.625 1.00 0.00 H new ATOM 0 HG1 THR A 12 9.090 -14.924 -9.366 1.00 0.00 H new ATOM 0 HG21 THR A 12 10.508 -17.728 -7.857 1.00 0.00 H new ATOM 0 HG22 THR A 12 10.832 -18.627 -9.358 1.00 0.00 H new ATOM 0 HG23 THR A 12 11.838 -17.224 -8.927 1.00 0.00 H new ATOM 240 N THR A 13 9.233 -18.603 -11.922 1.00 0.00 N ATOM 241 CA THR A 13 9.172 -19.933 -12.514 1.00 0.00 C ATOM 242 C THR A 13 9.576 -19.899 -13.984 1.00 0.00 C ATOM 243 O THR A 13 10.152 -20.857 -14.502 1.00 0.00 O ATOM 244 CB THR A 13 7.761 -20.537 -12.395 1.00 0.00 C ATOM 245 OG1 THR A 13 6.934 -20.066 -13.465 1.00 0.00 O ATOM 246 CG2 THR A 13 7.127 -20.175 -11.061 1.00 0.00 C ATOM 0 H THR A 13 8.326 -18.218 -11.658 1.00 0.00 H new ATOM 0 HA THR A 13 9.874 -20.558 -11.961 1.00 0.00 H new ATOM 0 HB THR A 13 7.849 -21.622 -12.455 1.00 0.00 H new ATOM 0 HG1 THR A 13 7.020 -19.093 -13.541 1.00 0.00 H new ATOM 0 HG21 THR A 13 6.131 -20.613 -11.001 1.00 0.00 H new ATOM 0 HG22 THR A 13 7.743 -20.561 -10.249 1.00 0.00 H new ATOM 0 HG23 THR A 13 7.052 -19.091 -10.976 1.00 0.00 H new ATOM 254 N LEU A 14 9.272 -18.791 -14.651 1.00 0.00 N ATOM 255 CA LEU A 14 9.605 -18.632 -16.062 1.00 0.00 C ATOM 256 C LEU A 14 11.116 -18.598 -16.265 1.00 0.00 C ATOM 257 O LEU A 14 11.639 -19.201 -17.202 1.00 0.00 O ATOM 258 CB LEU A 14 8.976 -17.351 -16.614 1.00 0.00 C ATOM 259 CG LEU A 14 9.618 -16.779 -17.878 1.00 0.00 C ATOM 260 CD1 LEU A 14 8.550 -16.296 -18.847 1.00 0.00 C ATOM 261 CD2 LEU A 14 10.572 -15.647 -17.525 1.00 0.00 C ATOM 0 H LEU A 14 8.796 -17.990 -14.237 1.00 0.00 H new ATOM 0 HA LEU A 14 9.204 -19.489 -16.603 1.00 0.00 H new ATOM 0 HB2 LEU A 14 7.924 -17.547 -16.822 1.00 0.00 H new ATOM 0 HB3 LEU A 14 9.011 -16.588 -15.836 1.00 0.00 H new ATOM 0 HG LEU A 14 10.189 -17.571 -18.364 1.00 0.00 H new ATOM 0 HD11 LEU A 14 9.025 -15.892 -19.741 1.00 0.00 H new ATOM 0 HD12 LEU A 14 7.906 -17.131 -19.124 1.00 0.00 H new ATOM 0 HD13 LEU A 14 7.952 -15.519 -18.371 1.00 0.00 H new ATOM 0 HD21 LEU A 14 11.020 -15.251 -18.436 1.00 0.00 H new ATOM 0 HD22 LEU A 14 10.023 -14.854 -17.017 1.00 0.00 H new ATOM 0 HD23 LEU A 14 11.357 -16.024 -16.869 1.00 0.00 H new ATOM 273 N GLN A 15 11.811 -17.892 -15.380 1.00 0.00 N ATOM 274 CA GLN A 15 13.263 -17.781 -15.462 1.00 0.00 C ATOM 275 C GLN A 15 13.936 -19.024 -14.888 1.00 0.00 C ATOM 276 O GLN A 15 15.001 -19.432 -15.351 1.00 0.00 O ATOM 277 CB GLN A 15 13.743 -16.536 -14.715 1.00 0.00 C ATOM 278 CG GLN A 15 13.517 -16.601 -13.213 1.00 0.00 C ATOM 279 CD GLN A 15 14.128 -15.425 -12.479 1.00 0.00 C ATOM 280 OE1 GLN A 15 15.332 -15.397 -12.221 1.00 0.00 O ATOM 281 NE2 GLN A 15 13.300 -14.444 -12.138 1.00 0.00 N ATOM 0 H GLN A 15 11.393 -17.388 -14.598 1.00 0.00 H new ATOM 0 HA GLN A 15 13.538 -17.693 -16.513 1.00 0.00 H new ATOM 0 HB2 GLN A 15 14.806 -16.394 -14.908 1.00 0.00 H new ATOM 0 HB3 GLN A 15 13.228 -15.662 -15.114 1.00 0.00 H new ATOM 0 HG2 GLN A 15 12.446 -16.633 -13.012 1.00 0.00 H new ATOM 0 HG3 GLN A 15 13.942 -17.527 -12.825 1.00 0.00 H new ATOM 0 HE21 GLN A 15 12.309 -14.508 -12.372 1.00 0.00 H new ATOM 0 HE22 GLN A 15 13.655 -13.626 -11.642 1.00 0.00 H new ATOM 290 N GLN A 16 13.309 -19.619 -13.879 1.00 0.00 N ATOM 291 CA GLN A 16 13.849 -20.814 -13.243 1.00 0.00 C ATOM 292 C GLN A 16 13.715 -22.027 -14.159 1.00 0.00 C ATOM 293 O GLN A 16 14.661 -22.795 -14.331 1.00 0.00 O ATOM 294 CB GLN A 16 13.133 -21.080 -11.917 1.00 0.00 C ATOM 295 CG GLN A 16 13.195 -22.532 -11.473 1.00 0.00 C ATOM 296 CD GLN A 16 14.617 -23.037 -11.326 1.00 0.00 C ATOM 297 OE1 GLN A 16 15.438 -22.426 -10.641 1.00 0.00 O ATOM 298 NE2 GLN A 16 14.917 -24.159 -11.970 1.00 0.00 N ATOM 0 H GLN A 16 12.427 -19.293 -13.484 1.00 0.00 H new ATOM 0 HA GLN A 16 14.908 -20.644 -13.048 1.00 0.00 H new ATOM 0 HB2 GLN A 16 13.575 -20.453 -11.143 1.00 0.00 H new ATOM 0 HB3 GLN A 16 12.089 -20.782 -12.011 1.00 0.00 H new ATOM 0 HG2 GLN A 16 12.675 -22.639 -10.521 1.00 0.00 H new ATOM 0 HG3 GLN A 16 12.666 -23.152 -12.197 1.00 0.00 H new ATOM 0 HE21 GLN A 16 14.206 -24.633 -12.527 1.00 0.00 H new ATOM 0 HE22 GLN A 16 15.858 -24.547 -11.908 1.00 0.00 H new ATOM 307 N PHE A 17 12.533 -22.193 -14.743 1.00 0.00 N ATOM 308 CA PHE A 17 12.274 -23.313 -15.640 1.00 0.00 C ATOM 309 C PHE A 17 12.615 -22.945 -17.081 1.00 0.00 C ATOM 310 O PHE A 17 12.627 -23.800 -17.966 1.00 0.00 O ATOM 311 CB PHE A 17 10.809 -23.742 -15.545 1.00 0.00 C ATOM 312 CG PHE A 17 10.610 -25.226 -15.669 1.00 0.00 C ATOM 313 CD1 PHE A 17 10.799 -26.057 -14.577 1.00 0.00 C ATOM 314 CD2 PHE A 17 10.234 -25.789 -16.878 1.00 0.00 C ATOM 315 CE1 PHE A 17 10.616 -27.423 -14.688 1.00 0.00 C ATOM 316 CE2 PHE A 17 10.049 -27.153 -16.995 1.00 0.00 C ATOM 317 CZ PHE A 17 10.242 -27.972 -15.899 1.00 0.00 C ATOM 0 H PHE A 17 11.739 -21.566 -14.611 1.00 0.00 H new ATOM 0 HA PHE A 17 12.909 -24.145 -15.335 1.00 0.00 H new ATOM 0 HB2 PHE A 17 10.402 -23.407 -14.591 1.00 0.00 H new ATOM 0 HB3 PHE A 17 10.240 -23.240 -16.328 1.00 0.00 H new ATOM 0 HD1 PHE A 17 11.093 -25.633 -13.628 1.00 0.00 H new ATOM 0 HD2 PHE A 17 10.084 -25.154 -17.739 1.00 0.00 H new ATOM 0 HE1 PHE A 17 10.765 -28.060 -13.829 1.00 0.00 H new ATOM 0 HE2 PHE A 17 9.754 -27.579 -17.943 1.00 0.00 H new ATOM 0 HZ PHE A 17 10.101 -29.039 -15.989 1.00 0.00 H new ATOM 327 N GLY A 18 12.892 -21.664 -17.310 1.00 0.00 N ATOM 328 CA GLY A 18 13.229 -21.205 -18.644 1.00 0.00 C ATOM 329 C GLY A 18 14.417 -21.943 -19.229 1.00 0.00 C ATOM 330 O GLY A 18 14.590 -21.988 -20.446 1.00 0.00 O ATOM 0 H GLY A 18 12.889 -20.937 -16.595 1.00 0.00 H new ATOM 0 HA2 GLY A 18 12.367 -21.335 -19.298 1.00 0.00 H new ATOM 0 HA3 GLY A 18 13.448 -20.138 -18.613 1.00 0.00 H new ATOM 334 N ASN A 19 15.238 -22.523 -18.360 1.00 0.00 N ATOM 335 CA ASN A 19 16.417 -23.261 -18.797 1.00 0.00 C ATOM 336 C ASN A 19 16.053 -24.693 -19.177 1.00 0.00 C ATOM 337 O ASN A 19 16.827 -25.387 -19.837 1.00 0.00 O ATOM 338 CB ASN A 19 17.478 -23.268 -17.695 1.00 0.00 C ATOM 339 CG ASN A 19 18.532 -24.337 -17.913 1.00 0.00 C ATOM 340 OD1 ASN A 19 19.441 -24.172 -18.726 1.00 0.00 O ATOM 341 ND2 ASN A 19 18.413 -25.442 -17.186 1.00 0.00 N ATOM 0 H ASN A 19 15.108 -22.496 -17.349 1.00 0.00 H new ATOM 0 HA ASN A 19 16.821 -22.762 -19.678 1.00 0.00 H new ATOM 0 HB2 ASN A 19 17.959 -22.291 -17.652 1.00 0.00 H new ATOM 0 HB3 ASN A 19 16.995 -23.429 -16.731 1.00 0.00 H new ATOM 0 HD21 ASN A 19 19.091 -26.196 -17.290 1.00 0.00 H new ATOM 0 HD22 ASN A 19 17.643 -25.536 -16.524 1.00 0.00 H new ATOM 348 N ASP A 20 14.870 -25.128 -18.757 1.00 0.00 N ATOM 349 CA ASP A 20 14.402 -26.476 -19.054 1.00 0.00 C ATOM 350 C ASP A 20 13.792 -26.544 -20.451 1.00 0.00 C ATOM 351 O ASP A 20 14.111 -27.438 -21.235 1.00 0.00 O ATOM 352 CB ASP A 20 13.374 -26.923 -18.014 1.00 0.00 C ATOM 353 CG ASP A 20 13.263 -28.432 -17.920 1.00 0.00 C ATOM 354 OD1 ASP A 20 13.512 -29.110 -18.940 1.00 0.00 O ATOM 355 OD2 ASP A 20 12.928 -28.936 -16.828 1.00 0.00 O ATOM 0 H ASP A 20 14.218 -24.566 -18.210 1.00 0.00 H new ATOM 0 HA ASP A 20 15.260 -27.148 -19.018 1.00 0.00 H new ATOM 0 HB2 ASP A 20 13.649 -26.521 -17.039 1.00 0.00 H new ATOM 0 HB3 ASP A 20 12.400 -26.505 -18.268 1.00 0.00 H new ATOM 360 N ILE A 21 12.913 -25.594 -20.754 1.00 0.00 N ATOM 361 CA ILE A 21 12.259 -25.547 -22.056 1.00 0.00 C ATOM 362 C ILE A 21 13.276 -25.661 -23.187 1.00 0.00 C ATOM 363 O ILE A 21 13.054 -26.373 -24.166 1.00 0.00 O ATOM 364 CB ILE A 21 11.454 -24.246 -22.234 1.00 0.00 C ATOM 365 CG1 ILE A 21 10.940 -24.132 -23.671 1.00 0.00 C ATOM 366 CG2 ILE A 21 12.310 -23.040 -21.875 1.00 0.00 C ATOM 367 CD1 ILE A 21 10.101 -22.897 -23.916 1.00 0.00 C ATOM 0 H ILE A 21 12.638 -24.847 -20.116 1.00 0.00 H new ATOM 0 HA ILE A 21 11.577 -26.396 -22.098 1.00 0.00 H new ATOM 0 HB ILE A 21 10.596 -24.271 -21.562 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.790 -24.125 -24.353 1.00 0.00 H new ATOM 0 HG13 ILE A 21 10.348 -25.016 -23.908 1.00 0.00 H new ATOM 0 HG21 ILE A 21 11.727 -22.128 -22.006 1.00 0.00 H new ATOM 0 HG22 ILE A 21 12.632 -23.119 -20.837 1.00 0.00 H new ATOM 0 HG23 ILE A 21 13.184 -23.008 -22.525 1.00 0.00 H new ATOM 0 HD11 ILE A 21 9.771 -22.882 -24.955 1.00 0.00 H new ATOM 0 HD12 ILE A 21 9.231 -22.912 -23.259 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.696 -22.007 -23.711 1.00 0.00 H new ATOM 379 N SER A 22 14.394 -24.955 -23.044 1.00 0.00 N ATOM 380 CA SER A 22 15.445 -24.976 -24.054 1.00 0.00 C ATOM 381 C SER A 22 16.607 -24.074 -23.647 1.00 0.00 C ATOM 382 O SER A 22 16.474 -23.192 -22.799 1.00 0.00 O ATOM 383 CB SER A 22 14.889 -24.531 -25.408 1.00 0.00 C ATOM 384 OG SER A 22 13.831 -23.602 -25.245 1.00 0.00 O ATOM 0 H SER A 22 14.595 -24.362 -22.239 1.00 0.00 H new ATOM 0 HA SER A 22 15.813 -25.998 -24.139 1.00 0.00 H new ATOM 0 HB2 SER A 22 15.685 -24.080 -26.001 1.00 0.00 H new ATOM 0 HB3 SER A 22 14.532 -25.400 -25.961 1.00 0.00 H new ATOM 0 HG SER A 22 13.494 -23.332 -26.125 1.00 0.00 H new ATOM 390 N PRO A 23 17.775 -24.300 -24.267 1.00 0.00 N ATOM 391 CA PRO A 23 18.983 -23.519 -23.987 1.00 0.00 C ATOM 392 C PRO A 23 18.878 -22.086 -24.497 1.00 0.00 C ATOM 393 O PRO A 23 19.143 -21.136 -23.762 1.00 0.00 O ATOM 394 CB PRO A 23 20.078 -24.277 -24.742 1.00 0.00 C ATOM 395 CG PRO A 23 19.361 -24.986 -25.838 1.00 0.00 C ATOM 396 CD PRO A 23 18.006 -25.336 -25.288 1.00 0.00 C ATOM 0 HA PRO A 23 19.170 -23.426 -22.917 1.00 0.00 H new ATOM 0 HB2 PRO A 23 20.831 -23.595 -25.138 1.00 0.00 H new ATOM 0 HB3 PRO A 23 20.596 -24.979 -24.089 1.00 0.00 H new ATOM 0 HG2 PRO A 23 19.272 -24.352 -26.720 1.00 0.00 H new ATOM 0 HG3 PRO A 23 19.902 -25.882 -26.142 1.00 0.00 H new ATOM 0 HD2 PRO A 23 17.240 -25.314 -26.063 1.00 0.00 H new ATOM 0 HD3 PRO A 23 17.994 -26.336 -24.855 1.00 0.00 H new ATOM 404 N GLU A 24 18.490 -21.939 -25.760 1.00 0.00 N ATOM 405 CA GLU A 24 18.351 -20.621 -26.367 1.00 0.00 C ATOM 406 C GLU A 24 17.461 -19.721 -25.515 1.00 0.00 C ATOM 407 O GLU A 24 17.950 -18.846 -24.799 1.00 0.00 O ATOM 408 CB GLU A 24 17.770 -20.743 -27.777 1.00 0.00 C ATOM 409 CG GLU A 24 16.806 -21.906 -27.940 1.00 0.00 C ATOM 410 CD GLU A 24 17.413 -23.064 -28.708 1.00 0.00 C ATOM 411 OE1 GLU A 24 18.066 -22.812 -29.742 1.00 0.00 O ATOM 412 OE2 GLU A 24 17.236 -24.222 -28.275 1.00 0.00 O ATOM 0 H GLU A 24 18.267 -22.716 -26.382 1.00 0.00 H new ATOM 0 HA GLU A 24 19.342 -20.171 -26.428 1.00 0.00 H new ATOM 0 HB2 GLU A 24 17.254 -19.817 -28.030 1.00 0.00 H new ATOM 0 HB3 GLU A 24 18.587 -20.857 -28.489 1.00 0.00 H new ATOM 0 HG2 GLU A 24 16.491 -22.253 -26.956 1.00 0.00 H new ATOM 0 HG3 GLU A 24 15.911 -21.561 -28.458 1.00 0.00 H new ATOM 419 N ILE A 25 16.154 -19.941 -25.599 1.00 0.00 N ATOM 420 CA ILE A 25 15.196 -19.150 -24.836 1.00 0.00 C ATOM 421 C ILE A 25 15.587 -19.084 -23.364 1.00 0.00 C ATOM 422 O ILE A 25 15.351 -18.080 -22.693 1.00 0.00 O ATOM 423 CB ILE A 25 13.772 -19.726 -24.952 1.00 0.00 C ATOM 424 CG1 ILE A 25 12.784 -18.626 -25.347 1.00 0.00 C ATOM 425 CG2 ILE A 25 13.354 -20.374 -23.640 1.00 0.00 C ATOM 426 CD1 ILE A 25 12.833 -17.416 -24.440 1.00 0.00 C ATOM 0 H ILE A 25 15.734 -20.660 -26.188 1.00 0.00 H new ATOM 0 HA ILE A 25 15.208 -18.145 -25.258 1.00 0.00 H new ATOM 0 HB ILE A 25 13.767 -20.490 -25.730 1.00 0.00 H new ATOM 0 HG12 ILE A 25 12.992 -18.312 -26.370 1.00 0.00 H new ATOM 0 HG13 ILE A 25 11.774 -19.036 -25.339 1.00 0.00 H new ATOM 0 HG21 ILE A 25 12.346 -20.776 -23.738 1.00 0.00 H new ATOM 0 HG22 ILE A 25 14.045 -21.181 -23.397 1.00 0.00 H new ATOM 0 HG23 ILE A 25 13.372 -19.629 -22.844 1.00 0.00 H new ATOM 0 HD11 ILE A 25 12.107 -16.677 -24.779 1.00 0.00 H new ATOM 0 HD12 ILE A 25 12.595 -17.716 -23.420 1.00 0.00 H new ATOM 0 HD13 ILE A 25 13.832 -16.981 -24.467 1.00 0.00 H new ATOM 438 N GLY A 26 16.188 -20.161 -22.867 1.00 0.00 N ATOM 439 CA GLY A 26 16.604 -20.204 -21.478 1.00 0.00 C ATOM 440 C GLY A 26 17.642 -19.149 -21.150 1.00 0.00 C ATOM 441 O GLY A 26 17.402 -18.268 -20.326 1.00 0.00 O ATOM 0 H GLY A 26 16.394 -21.005 -23.402 1.00 0.00 H new ATOM 0 HA2 GLY A 26 15.734 -20.064 -20.837 1.00 0.00 H new ATOM 0 HA3 GLY A 26 17.010 -21.190 -21.254 1.00 0.00 H new ATOM 445 N GLU A 27 18.800 -19.240 -21.797 1.00 0.00 N ATOM 446 CA GLU A 27 19.879 -18.286 -21.567 1.00 0.00 C ATOM 447 C GLU A 27 19.371 -16.852 -21.680 1.00 0.00 C ATOM 448 O GLU A 27 19.770 -15.978 -20.910 1.00 0.00 O ATOM 449 CB GLU A 27 21.015 -18.516 -22.566 1.00 0.00 C ATOM 450 CG GLU A 27 20.845 -17.752 -23.868 1.00 0.00 C ATOM 451 CD GLU A 27 21.799 -18.221 -24.949 1.00 0.00 C ATOM 452 OE1 GLU A 27 22.551 -19.186 -24.698 1.00 0.00 O ATOM 453 OE2 GLU A 27 21.795 -17.623 -26.046 1.00 0.00 O ATOM 0 H GLU A 27 19.015 -19.963 -22.483 1.00 0.00 H new ATOM 0 HA GLU A 27 20.256 -18.441 -20.556 1.00 0.00 H new ATOM 0 HB2 GLU A 27 21.958 -18.224 -22.104 1.00 0.00 H new ATOM 0 HB3 GLU A 27 21.084 -19.581 -22.786 1.00 0.00 H new ATOM 0 HG2 GLU A 27 19.820 -17.865 -24.220 1.00 0.00 H new ATOM 0 HG3 GLU A 27 21.004 -16.689 -23.685 1.00 0.00 H new ATOM 460 N ARG A 28 18.489 -16.617 -22.647 1.00 0.00 N ATOM 461 CA ARG A 28 17.927 -15.289 -22.862 1.00 0.00 C ATOM 462 C ARG A 28 17.058 -14.868 -21.681 1.00 0.00 C ATOM 463 O ARG A 28 17.324 -13.857 -21.031 1.00 0.00 O ATOM 464 CB ARG A 28 17.103 -15.264 -24.151 1.00 0.00 C ATOM 465 CG ARG A 28 17.327 -14.020 -24.994 1.00 0.00 C ATOM 466 CD ARG A 28 18.244 -14.304 -26.173 1.00 0.00 C ATOM 467 NE ARG A 28 18.478 -13.113 -26.984 1.00 0.00 N ATOM 468 CZ ARG A 28 19.518 -12.971 -27.799 1.00 0.00 C ATOM 469 NH1 ARG A 28 20.415 -13.941 -27.910 1.00 0.00 N ATOM 470 NH2 ARG A 28 19.662 -11.856 -28.505 1.00 0.00 N ATOM 0 H ARG A 28 18.149 -17.329 -23.293 1.00 0.00 H new ATOM 0 HA ARG A 28 18.752 -14.583 -22.952 1.00 0.00 H new ATOM 0 HB2 ARG A 28 17.348 -16.144 -24.746 1.00 0.00 H new ATOM 0 HB3 ARG A 28 16.045 -15.335 -23.897 1.00 0.00 H new ATOM 0 HG2 ARG A 28 16.369 -13.648 -25.358 1.00 0.00 H new ATOM 0 HG3 ARG A 28 17.760 -13.233 -24.376 1.00 0.00 H new ATOM 0 HD2 ARG A 28 19.197 -14.686 -25.807 1.00 0.00 H new ATOM 0 HD3 ARG A 28 17.805 -15.085 -26.794 1.00 0.00 H new ATOM 0 HE ARG A 28 17.806 -12.348 -26.922 1.00 0.00 H new ATOM 0 HH11 ARG A 28 20.308 -14.799 -27.369 1.00 0.00 H new ATOM 0 HH12 ARG A 28 21.212 -13.829 -28.536 1.00 0.00 H new ATOM 0 HH21 ARG A 28 18.974 -11.107 -28.422 1.00 0.00 H new ATOM 0 HH22 ARG A 28 20.461 -11.748 -29.130 1.00 0.00 H new ATOM 484 N VAL A 29 16.018 -15.650 -21.410 1.00 0.00 N ATOM 485 CA VAL A 29 15.110 -15.358 -20.307 1.00 0.00 C ATOM 486 C VAL A 29 15.880 -14.983 -19.046 1.00 0.00 C ATOM 487 O VAL A 29 15.704 -13.894 -18.500 1.00 0.00 O ATOM 488 CB VAL A 29 14.197 -16.560 -19.999 1.00 0.00 C ATOM 489 CG1 VAL A 29 13.426 -16.329 -18.708 1.00 0.00 C ATOM 490 CG2 VAL A 29 13.247 -16.817 -21.159 1.00 0.00 C ATOM 0 H VAL A 29 15.783 -16.490 -21.939 1.00 0.00 H new ATOM 0 HA VAL A 29 14.495 -14.514 -20.618 1.00 0.00 H new ATOM 0 HB VAL A 29 14.821 -17.444 -19.867 1.00 0.00 H new ATOM 0 HG11 VAL A 29 12.787 -17.189 -18.507 1.00 0.00 H new ATOM 0 HG12 VAL A 29 14.127 -16.198 -17.884 1.00 0.00 H new ATOM 0 HG13 VAL A 29 12.811 -15.435 -18.807 1.00 0.00 H new ATOM 0 HG21 VAL A 29 12.609 -17.669 -20.925 1.00 0.00 H new ATOM 0 HG22 VAL A 29 12.628 -15.935 -21.325 1.00 0.00 H new ATOM 0 HG23 VAL A 29 13.822 -17.031 -22.060 1.00 0.00 H new ATOM 500 N ARG A 30 16.735 -15.892 -18.588 1.00 0.00 N ATOM 501 CA ARG A 30 17.532 -15.656 -17.390 1.00 0.00 C ATOM 502 C ARG A 30 18.401 -14.413 -17.552 1.00 0.00 C ATOM 503 O ARG A 30 18.471 -13.570 -16.657 1.00 0.00 O ATOM 504 CB ARG A 30 18.412 -16.871 -17.091 1.00 0.00 C ATOM 505 CG ARG A 30 19.393 -17.202 -18.204 1.00 0.00 C ATOM 506 CD ARG A 30 19.906 -18.629 -18.088 1.00 0.00 C ATOM 507 NE ARG A 30 20.223 -18.986 -16.707 1.00 0.00 N ATOM 508 CZ ARG A 30 21.360 -18.658 -16.105 1.00 0.00 C ATOM 509 NH1 ARG A 30 22.285 -17.967 -16.759 1.00 0.00 N ATOM 510 NH2 ARG A 30 21.575 -19.019 -14.847 1.00 0.00 N ATOM 0 H ARG A 30 16.893 -16.798 -19.028 1.00 0.00 H new ATOM 0 HA ARG A 30 16.850 -15.495 -16.555 1.00 0.00 H new ATOM 0 HB2 ARG A 30 18.967 -16.689 -16.171 1.00 0.00 H new ATOM 0 HB3 ARG A 30 17.774 -17.736 -16.912 1.00 0.00 H new ATOM 0 HG2 ARG A 30 18.908 -17.066 -19.171 1.00 0.00 H new ATOM 0 HG3 ARG A 30 20.233 -16.508 -18.169 1.00 0.00 H new ATOM 0 HD2 ARG A 30 19.155 -19.317 -18.477 1.00 0.00 H new ATOM 0 HD3 ARG A 30 20.796 -18.746 -18.706 1.00 0.00 H new ATOM 0 HE ARG A 30 19.532 -19.517 -16.176 1.00 0.00 H new ATOM 0 HH11 ARG A 30 22.123 -17.687 -17.726 1.00 0.00 H new ATOM 0 HH12 ARG A 30 23.158 -17.716 -16.294 1.00 0.00 H new ATOM 0 HH21 ARG A 30 20.866 -19.550 -14.340 1.00 0.00 H new ATOM 0 HH22 ARG A 30 22.449 -18.766 -14.386 1.00 0.00 H new ATOM 524 N THR A 31 19.064 -14.305 -18.699 1.00 0.00 N ATOM 525 CA THR A 31 19.929 -13.166 -18.978 1.00 0.00 C ATOM 526 C THR A 31 19.190 -11.849 -18.768 1.00 0.00 C ATOM 527 O THR A 31 19.599 -11.018 -17.956 1.00 0.00 O ATOM 528 CB THR A 31 20.474 -13.212 -20.418 1.00 0.00 C ATOM 529 OG1 THR A 31 21.496 -14.210 -20.523 1.00 0.00 O ATOM 530 CG2 THR A 31 21.034 -11.859 -20.829 1.00 0.00 C ATOM 0 H THR A 31 19.018 -14.993 -19.450 1.00 0.00 H new ATOM 0 HA THR A 31 20.764 -13.226 -18.280 1.00 0.00 H new ATOM 0 HB THR A 31 19.651 -13.464 -21.087 1.00 0.00 H new ATOM 0 HG1 THR A 31 21.083 -15.086 -20.672 1.00 0.00 H new ATOM 0 HG21 THR A 31 21.413 -11.917 -21.849 1.00 0.00 H new ATOM 0 HG22 THR A 31 20.246 -11.108 -20.776 1.00 0.00 H new ATOM 0 HG23 THR A 31 21.845 -11.581 -20.156 1.00 0.00 H new ATOM 538 N LEU A 32 18.100 -11.664 -19.504 1.00 0.00 N ATOM 539 CA LEU A 32 17.303 -10.448 -19.398 1.00 0.00 C ATOM 540 C LEU A 32 16.772 -10.266 -17.980 1.00 0.00 C ATOM 541 O LEU A 32 17.029 -9.249 -17.335 1.00 0.00 O ATOM 542 CB LEU A 32 16.138 -10.490 -20.389 1.00 0.00 C ATOM 543 CG LEU A 32 16.464 -11.019 -21.786 1.00 0.00 C ATOM 544 CD1 LEU A 32 15.307 -10.760 -22.738 1.00 0.00 C ATOM 545 CD2 LEU A 32 17.742 -10.382 -22.312 1.00 0.00 C ATOM 0 H LEU A 32 17.748 -12.341 -20.181 1.00 0.00 H new ATOM 0 HA LEU A 32 17.946 -9.601 -19.637 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.347 -11.108 -19.964 1.00 0.00 H new ATOM 0 HB3 LEU A 32 15.736 -9.482 -20.489 1.00 0.00 H new ATOM 0 HG LEU A 32 16.619 -12.096 -21.719 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.557 -11.143 -23.727 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.413 -11.263 -22.369 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.120 -9.688 -22.801 1.00 0.00 H new ATOM 0 HD21 LEU A 32 17.959 -10.770 -23.307 1.00 0.00 H new ATOM 0 HD22 LEU A 32 17.615 -9.301 -22.364 1.00 0.00 H new ATOM 0 HD23 LEU A 32 18.569 -10.618 -21.642 1.00 0.00 H new ATOM 557 N VAL A 33 16.032 -11.260 -17.498 1.00 0.00 N ATOM 558 CA VAL A 33 15.468 -11.211 -16.155 1.00 0.00 C ATOM 559 C VAL A 33 16.525 -10.819 -15.129 1.00 0.00 C ATOM 560 O VAL A 33 16.497 -9.716 -14.582 1.00 0.00 O ATOM 561 CB VAL A 33 14.857 -12.567 -15.753 1.00 0.00 C ATOM 562 CG1 VAL A 33 14.406 -12.540 -14.301 1.00 0.00 C ATOM 563 CG2 VAL A 33 13.699 -12.922 -16.674 1.00 0.00 C ATOM 0 H VAL A 33 15.809 -12.109 -18.018 1.00 0.00 H new ATOM 0 HA VAL A 33 14.682 -10.456 -16.169 1.00 0.00 H new ATOM 0 HB VAL A 33 15.622 -13.336 -15.856 1.00 0.00 H new ATOM 0 HG11 VAL A 33 13.977 -13.506 -14.035 1.00 0.00 H new ATOM 0 HG12 VAL A 33 15.262 -12.333 -13.658 1.00 0.00 H new ATOM 0 HG13 VAL A 33 13.655 -11.761 -14.168 1.00 0.00 H new ATOM 0 HG21 VAL A 33 13.279 -13.883 -16.376 1.00 0.00 H new ATOM 0 HG22 VAL A 33 12.930 -12.152 -16.605 1.00 0.00 H new ATOM 0 HG23 VAL A 33 14.058 -12.986 -17.701 1.00 0.00 H new ATOM 573 N LEU A 34 17.458 -11.730 -14.871 1.00 0.00 N ATOM 574 CA LEU A 34 18.527 -11.480 -13.910 1.00 0.00 C ATOM 575 C LEU A 34 19.242 -10.169 -14.220 1.00 0.00 C ATOM 576 O LEU A 34 19.677 -9.458 -13.315 1.00 0.00 O ATOM 577 CB LEU A 34 19.528 -12.636 -13.919 1.00 0.00 C ATOM 578 CG LEU A 34 19.117 -13.886 -13.141 1.00 0.00 C ATOM 579 CD1 LEU A 34 19.229 -13.645 -11.644 1.00 0.00 C ATOM 580 CD2 LEU A 34 17.702 -14.303 -13.512 1.00 0.00 C ATOM 0 H LEU A 34 17.496 -12.648 -15.314 1.00 0.00 H new ATOM 0 HA LEU A 34 18.081 -11.403 -12.919 1.00 0.00 H new ATOM 0 HB2 LEU A 34 19.713 -12.922 -14.954 1.00 0.00 H new ATOM 0 HB3 LEU A 34 20.473 -12.275 -13.514 1.00 0.00 H new ATOM 0 HG LEU A 34 19.795 -14.696 -13.408 1.00 0.00 H new ATOM 0 HD11 LEU A 34 18.932 -14.546 -11.107 1.00 0.00 H new ATOM 0 HD12 LEU A 34 20.260 -13.395 -11.392 1.00 0.00 H new ATOM 0 HD13 LEU A 34 18.576 -12.821 -11.358 1.00 0.00 H new ATOM 0 HD21 LEU A 34 17.426 -15.194 -12.949 1.00 0.00 H new ATOM 0 HD22 LEU A 34 17.010 -13.495 -13.274 1.00 0.00 H new ATOM 0 HD23 LEU A 34 17.654 -14.519 -14.579 1.00 0.00 H new ATOM 592 N GLY A 35 19.359 -9.854 -15.507 1.00 0.00 N ATOM 593 CA GLY A 35 20.021 -8.629 -15.914 1.00 0.00 C ATOM 594 C GLY A 35 19.370 -7.394 -15.321 1.00 0.00 C ATOM 595 O GLY A 35 19.950 -6.730 -14.461 1.00 0.00 O ATOM 0 H GLY A 35 19.007 -10.426 -16.275 1.00 0.00 H new ATOM 0 HA2 GLY A 35 21.067 -8.666 -15.610 1.00 0.00 H new ATOM 0 HA3 GLY A 35 20.008 -8.556 -17.001 1.00 0.00 H new ATOM 599 N LEU A 36 18.163 -7.085 -15.781 1.00 0.00 N ATOM 600 CA LEU A 36 17.433 -5.920 -15.292 1.00 0.00 C ATOM 601 C LEU A 36 17.298 -5.961 -13.774 1.00 0.00 C ATOM 602 O LEU A 36 17.134 -4.927 -13.126 1.00 0.00 O ATOM 603 CB LEU A 36 16.048 -5.854 -15.938 1.00 0.00 C ATOM 604 CG LEU A 36 15.203 -7.125 -15.846 1.00 0.00 C ATOM 605 CD1 LEU A 36 14.412 -7.147 -14.547 1.00 0.00 C ATOM 606 CD2 LEU A 36 14.270 -7.233 -17.043 1.00 0.00 C ATOM 0 H LEU A 36 17.669 -7.624 -16.492 1.00 0.00 H new ATOM 0 HA LEU A 36 17.996 -5.027 -15.564 1.00 0.00 H new ATOM 0 HB2 LEU A 36 15.492 -5.038 -15.476 1.00 0.00 H new ATOM 0 HB3 LEU A 36 16.172 -5.599 -16.991 1.00 0.00 H new ATOM 0 HG LEU A 36 15.873 -7.985 -15.854 1.00 0.00 H new ATOM 0 HD11 LEU A 36 13.817 -8.059 -14.499 1.00 0.00 H new ATOM 0 HD12 LEU A 36 15.100 -7.118 -13.702 1.00 0.00 H new ATOM 0 HD13 LEU A 36 13.752 -6.280 -14.508 1.00 0.00 H new ATOM 0 HD21 LEU A 36 13.676 -8.144 -16.961 1.00 0.00 H new ATOM 0 HD22 LEU A 36 13.607 -6.368 -17.067 1.00 0.00 H new ATOM 0 HD23 LEU A 36 14.858 -7.265 -17.961 1.00 0.00 H new ATOM 618 N VAL A 37 17.369 -7.163 -13.210 1.00 0.00 N ATOM 619 CA VAL A 37 17.258 -7.339 -11.767 1.00 0.00 C ATOM 620 C VAL A 37 18.456 -6.733 -11.046 1.00 0.00 C ATOM 621 O VAL A 37 18.306 -5.832 -10.221 1.00 0.00 O ATOM 622 CB VAL A 37 17.145 -8.828 -11.390 1.00 0.00 C ATOM 623 CG1 VAL A 37 17.336 -9.016 -9.893 1.00 0.00 C ATOM 624 CG2 VAL A 37 15.805 -9.390 -11.840 1.00 0.00 C ATOM 0 H VAL A 37 17.503 -8.030 -13.731 1.00 0.00 H new ATOM 0 HA VAL A 37 16.350 -6.823 -11.454 1.00 0.00 H new ATOM 0 HB VAL A 37 17.935 -9.376 -11.904 1.00 0.00 H new ATOM 0 HG11 VAL A 37 17.253 -10.074 -9.646 1.00 0.00 H new ATOM 0 HG12 VAL A 37 18.322 -8.652 -9.603 1.00 0.00 H new ATOM 0 HG13 VAL A 37 16.570 -8.456 -9.355 1.00 0.00 H new ATOM 0 HG21 VAL A 37 15.742 -10.443 -11.566 1.00 0.00 H new ATOM 0 HG22 VAL A 37 14.998 -8.840 -11.355 1.00 0.00 H new ATOM 0 HG23 VAL A 37 15.713 -9.291 -12.922 1.00 0.00 H new ATOM 634 N ASN A 38 19.646 -7.233 -11.363 1.00 0.00 N ATOM 635 CA ASN A 38 20.871 -6.740 -10.745 1.00 0.00 C ATOM 636 C ASN A 38 21.758 -6.044 -11.773 1.00 0.00 C ATOM 637 O ASN A 38 22.243 -4.936 -11.541 1.00 0.00 O ATOM 638 CB ASN A 38 21.637 -7.893 -10.092 1.00 0.00 C ATOM 639 CG ASN A 38 21.834 -9.064 -11.036 1.00 0.00 C ATOM 640 OD1 ASN A 38 22.778 -9.087 -11.826 1.00 0.00 O ATOM 641 ND2 ASN A 38 20.940 -10.043 -10.958 1.00 0.00 N ATOM 0 H ASN A 38 19.788 -7.979 -12.044 1.00 0.00 H new ATOM 0 HA ASN A 38 20.595 -6.015 -9.979 1.00 0.00 H new ATOM 0 HB2 ASN A 38 22.609 -7.534 -9.754 1.00 0.00 H new ATOM 0 HB3 ASN A 38 21.097 -8.230 -9.207 1.00 0.00 H new ATOM 0 HD21 ASN A 38 21.020 -10.856 -11.568 1.00 0.00 H new ATOM 0 HD22 ASN A 38 20.174 -9.981 -10.288 1.00 0.00 H new ATOM 648 N SER A 39 21.964 -6.701 -12.910 1.00 0.00 N ATOM 649 CA SER A 39 22.795 -6.147 -13.973 1.00 0.00 C ATOM 650 C SER A 39 22.165 -4.883 -14.551 1.00 0.00 C ATOM 651 O SER A 39 20.996 -4.587 -14.302 1.00 0.00 O ATOM 652 CB SER A 39 22.998 -7.181 -15.081 1.00 0.00 C ATOM 653 OG SER A 39 24.325 -7.142 -15.579 1.00 0.00 O ATOM 0 H SER A 39 21.567 -7.617 -13.119 1.00 0.00 H new ATOM 0 HA SER A 39 23.764 -5.887 -13.546 1.00 0.00 H new ATOM 0 HB2 SER A 39 22.780 -8.177 -14.697 1.00 0.00 H new ATOM 0 HB3 SER A 39 22.296 -6.991 -15.893 1.00 0.00 H new ATOM 0 HG SER A 39 24.429 -7.814 -16.285 1.00 0.00 H new ATOM 659 N THR A 40 22.950 -4.139 -15.324 1.00 0.00 N ATOM 660 CA THR A 40 22.472 -2.906 -15.937 1.00 0.00 C ATOM 661 C THR A 40 21.642 -3.197 -17.182 1.00 0.00 C ATOM 662 O THR A 40 22.176 -3.298 -18.288 1.00 0.00 O ATOM 663 CB THR A 40 23.641 -1.979 -16.319 1.00 0.00 C ATOM 664 OG1 THR A 40 24.334 -1.554 -15.140 1.00 0.00 O ATOM 665 CG2 THR A 40 23.140 -0.763 -17.085 1.00 0.00 C ATOM 0 H THR A 40 23.920 -4.369 -15.540 1.00 0.00 H new ATOM 0 HA THR A 40 21.848 -2.406 -15.196 1.00 0.00 H new ATOM 0 HB THR A 40 24.323 -2.537 -16.960 1.00 0.00 H new ATOM 0 HG1 THR A 40 25.077 -0.966 -15.391 1.00 0.00 H new ATOM 0 HG21 THR A 40 23.984 -0.123 -17.344 1.00 0.00 H new ATOM 0 HG22 THR A 40 22.638 -1.088 -17.996 1.00 0.00 H new ATOM 0 HG23 THR A 40 22.439 -0.205 -16.464 1.00 0.00 H new ATOM 673 N LEU A 41 20.333 -3.330 -16.997 1.00 0.00 N ATOM 674 CA LEU A 41 19.428 -3.609 -18.107 1.00 0.00 C ATOM 675 C LEU A 41 18.108 -2.865 -17.932 1.00 0.00 C ATOM 676 O LEU A 41 17.574 -2.776 -16.826 1.00 0.00 O ATOM 677 CB LEU A 41 19.169 -5.113 -18.214 1.00 0.00 C ATOM 678 CG LEU A 41 20.006 -5.865 -19.250 1.00 0.00 C ATOM 679 CD1 LEU A 41 21.140 -6.620 -18.573 1.00 0.00 C ATOM 680 CD2 LEU A 41 19.131 -6.819 -20.051 1.00 0.00 C ATOM 0 H LEU A 41 19.875 -3.249 -16.089 1.00 0.00 H new ATOM 0 HA LEU A 41 19.901 -3.262 -19.026 1.00 0.00 H new ATOM 0 HB2 LEU A 41 19.346 -5.563 -17.237 1.00 0.00 H new ATOM 0 HB3 LEU A 41 18.115 -5.264 -18.448 1.00 0.00 H new ATOM 0 HG LEU A 41 20.440 -5.138 -19.937 1.00 0.00 H new ATOM 0 HD11 LEU A 41 21.725 -7.149 -19.325 1.00 0.00 H new ATOM 0 HD12 LEU A 41 21.782 -5.915 -18.044 1.00 0.00 H new ATOM 0 HD13 LEU A 41 20.727 -7.337 -17.864 1.00 0.00 H new ATOM 0 HD21 LEU A 41 19.743 -7.346 -20.783 1.00 0.00 H new ATOM 0 HD22 LEU A 41 18.669 -7.541 -19.378 1.00 0.00 H new ATOM 0 HD23 LEU A 41 18.354 -6.254 -20.566 1.00 0.00 H new ATOM 692 N THR A 42 17.583 -2.335 -19.032 1.00 0.00 N ATOM 693 CA THR A 42 16.325 -1.600 -19.002 1.00 0.00 C ATOM 694 C THR A 42 15.176 -2.455 -19.524 1.00 0.00 C ATOM 695 O THR A 42 15.385 -3.375 -20.316 1.00 0.00 O ATOM 696 CB THR A 42 16.409 -0.307 -19.836 1.00 0.00 C ATOM 697 OG1 THR A 42 15.134 0.345 -19.858 1.00 0.00 O ATOM 698 CG2 THR A 42 16.855 -0.609 -21.258 1.00 0.00 C ATOM 0 H THR A 42 18.010 -2.401 -19.956 1.00 0.00 H new ATOM 0 HA THR A 42 16.136 -1.340 -17.961 1.00 0.00 H new ATOM 0 HB THR A 42 17.145 0.351 -19.374 1.00 0.00 H new ATOM 0 HG1 THR A 42 15.196 1.167 -20.388 1.00 0.00 H new ATOM 0 HG21 THR A 42 16.907 0.319 -21.828 1.00 0.00 H new ATOM 0 HG22 THR A 42 17.838 -1.079 -21.239 1.00 0.00 H new ATOM 0 HG23 THR A 42 16.140 -1.284 -21.728 1.00 0.00 H new ATOM 706 N ILE A 43 13.964 -2.145 -19.078 1.00 0.00 N ATOM 707 CA ILE A 43 12.782 -2.885 -19.502 1.00 0.00 C ATOM 708 C ILE A 43 12.745 -3.039 -21.019 1.00 0.00 C ATOM 709 O ILE A 43 12.532 -4.135 -21.536 1.00 0.00 O ATOM 710 CB ILE A 43 11.487 -2.192 -19.037 1.00 0.00 C ATOM 711 CG1 ILE A 43 11.468 -2.070 -17.512 1.00 0.00 C ATOM 712 CG2 ILE A 43 10.269 -2.962 -19.527 1.00 0.00 C ATOM 713 CD1 ILE A 43 11.029 -3.336 -16.809 1.00 0.00 C ATOM 0 H ILE A 43 13.774 -1.386 -18.423 1.00 0.00 H new ATOM 0 HA ILE A 43 12.844 -3.870 -19.040 1.00 0.00 H new ATOM 0 HB ILE A 43 11.455 -1.190 -19.464 1.00 0.00 H new ATOM 0 HG12 ILE A 43 12.465 -1.799 -17.165 1.00 0.00 H new ATOM 0 HG13 ILE A 43 10.800 -1.257 -17.229 1.00 0.00 H new ATOM 0 HG21 ILE A 43 9.362 -2.460 -19.191 1.00 0.00 H new ATOM 0 HG22 ILE A 43 10.278 -3.003 -20.616 1.00 0.00 H new ATOM 0 HG23 ILE A 43 10.293 -3.975 -19.126 1.00 0.00 H new ATOM 0 HD11 ILE A 43 11.040 -3.176 -15.731 1.00 0.00 H new ATOM 0 HD12 ILE A 43 10.020 -3.598 -17.127 1.00 0.00 H new ATOM 0 HD13 ILE A 43 11.711 -4.148 -17.062 1.00 0.00 H new ATOM 725 N GLU A 44 12.956 -1.933 -21.726 1.00 0.00 N ATOM 726 CA GLU A 44 12.949 -1.947 -23.184 1.00 0.00 C ATOM 727 C GLU A 44 13.913 -2.999 -23.724 1.00 0.00 C ATOM 728 O GLU A 44 13.543 -3.824 -24.559 1.00 0.00 O ATOM 729 CB GLU A 44 13.324 -0.568 -23.731 1.00 0.00 C ATOM 730 CG GLU A 44 12.138 0.219 -24.264 1.00 0.00 C ATOM 731 CD GLU A 44 12.479 1.668 -24.548 1.00 0.00 C ATOM 732 OE1 GLU A 44 13.648 1.948 -24.887 1.00 0.00 O ATOM 733 OE2 GLU A 44 11.577 2.524 -24.431 1.00 0.00 O ATOM 0 H GLU A 44 13.134 -1.017 -21.313 1.00 0.00 H new ATOM 0 HA GLU A 44 11.941 -2.200 -23.514 1.00 0.00 H new ATOM 0 HB2 GLU A 44 13.806 0.008 -22.941 1.00 0.00 H new ATOM 0 HB3 GLU A 44 14.056 -0.690 -24.529 1.00 0.00 H new ATOM 0 HG2 GLU A 44 11.776 -0.251 -25.179 1.00 0.00 H new ATOM 0 HG3 GLU A 44 11.324 0.176 -23.540 1.00 0.00 H new ATOM 740 N GLU A 45 15.150 -2.963 -23.240 1.00 0.00 N ATOM 741 CA GLU A 45 16.168 -3.913 -23.675 1.00 0.00 C ATOM 742 C GLU A 45 15.781 -5.338 -23.291 1.00 0.00 C ATOM 743 O GLU A 45 16.032 -6.284 -24.039 1.00 0.00 O ATOM 744 CB GLU A 45 17.524 -3.558 -23.061 1.00 0.00 C ATOM 745 CG GLU A 45 18.614 -4.571 -23.367 1.00 0.00 C ATOM 746 CD GLU A 45 19.602 -4.069 -24.403 1.00 0.00 C ATOM 747 OE1 GLU A 45 19.157 -3.479 -25.410 1.00 0.00 O ATOM 748 OE2 GLU A 45 20.819 -4.266 -24.206 1.00 0.00 O ATOM 0 H GLU A 45 15.472 -2.287 -22.547 1.00 0.00 H new ATOM 0 HA GLU A 45 16.243 -3.855 -24.761 1.00 0.00 H new ATOM 0 HB2 GLU A 45 17.835 -2.580 -23.428 1.00 0.00 H new ATOM 0 HB3 GLU A 45 17.413 -3.472 -21.980 1.00 0.00 H new ATOM 0 HG2 GLU A 45 19.148 -4.813 -22.448 1.00 0.00 H new ATOM 0 HG3 GLU A 45 18.157 -5.494 -23.723 1.00 0.00 H new ATOM 755 N PHE A 46 15.168 -5.484 -22.121 1.00 0.00 N ATOM 756 CA PHE A 46 14.748 -6.794 -21.637 1.00 0.00 C ATOM 757 C PHE A 46 13.646 -7.372 -22.519 1.00 0.00 C ATOM 758 O PHE A 46 13.480 -8.589 -22.608 1.00 0.00 O ATOM 759 CB PHE A 46 14.258 -6.693 -20.190 1.00 0.00 C ATOM 760 CG PHE A 46 13.014 -7.490 -19.922 1.00 0.00 C ATOM 761 CD1 PHE A 46 13.095 -8.820 -19.541 1.00 0.00 C ATOM 762 CD2 PHE A 46 11.762 -6.910 -20.050 1.00 0.00 C ATOM 763 CE1 PHE A 46 11.952 -9.556 -19.294 1.00 0.00 C ATOM 764 CE2 PHE A 46 10.615 -7.640 -19.804 1.00 0.00 C ATOM 765 CZ PHE A 46 10.710 -8.965 -19.425 1.00 0.00 C ATOM 0 H PHE A 46 14.951 -4.712 -21.491 1.00 0.00 H new ATOM 0 HA PHE A 46 15.609 -7.462 -21.677 1.00 0.00 H new ATOM 0 HB2 PHE A 46 15.049 -7.034 -19.522 1.00 0.00 H new ATOM 0 HB3 PHE A 46 14.068 -5.647 -19.951 1.00 0.00 H new ATOM 0 HD1 PHE A 46 14.063 -9.287 -19.436 1.00 0.00 H new ATOM 0 HD2 PHE A 46 11.682 -5.874 -20.346 1.00 0.00 H new ATOM 0 HE1 PHE A 46 12.029 -10.592 -18.999 1.00 0.00 H new ATOM 0 HE2 PHE A 46 9.646 -7.175 -19.908 1.00 0.00 H new ATOM 0 HZ PHE A 46 9.815 -9.538 -19.231 1.00 0.00 H new ATOM 775 N HIS A 47 12.894 -6.490 -23.171 1.00 0.00 N ATOM 776 CA HIS A 47 11.807 -6.912 -24.048 1.00 0.00 C ATOM 777 C HIS A 47 12.298 -7.070 -25.484 1.00 0.00 C ATOM 778 O HIS A 47 11.615 -7.659 -26.322 1.00 0.00 O ATOM 779 CB HIS A 47 10.661 -5.902 -23.996 1.00 0.00 C ATOM 780 CG HIS A 47 9.546 -6.212 -24.947 1.00 0.00 C ATOM 781 ND1 HIS A 47 8.809 -7.376 -24.889 1.00 0.00 N ATOM 782 CD2 HIS A 47 9.042 -5.501 -25.983 1.00 0.00 C ATOM 783 CE1 HIS A 47 7.901 -7.368 -25.848 1.00 0.00 C ATOM 784 NE2 HIS A 47 8.022 -6.241 -26.527 1.00 0.00 N ATOM 0 H HIS A 47 13.017 -5.479 -23.109 1.00 0.00 H new ATOM 0 HA HIS A 47 11.445 -7.879 -23.698 1.00 0.00 H new ATOM 0 HB2 HIS A 47 10.263 -5.868 -22.982 1.00 0.00 H new ATOM 0 HB3 HIS A 47 11.052 -4.909 -24.219 1.00 0.00 H new ATOM 0 HD1 HIS A 47 8.944 -8.126 -24.211 1.00 0.00 H new ATOM 0 HD2 HIS A 47 9.380 -4.532 -26.319 1.00 0.00 H new ATOM 0 HE1 HIS A 47 7.182 -8.150 -26.044 1.00 0.00 H new ATOM 792 N SER A 48 13.485 -6.540 -25.761 1.00 0.00 N ATOM 793 CA SER A 48 14.064 -6.619 -27.096 1.00 0.00 C ATOM 794 C SER A 48 14.707 -7.982 -27.330 1.00 0.00 C ATOM 795 O SER A 48 14.781 -8.462 -28.462 1.00 0.00 O ATOM 796 CB SER A 48 15.103 -5.512 -27.290 1.00 0.00 C ATOM 797 OG SER A 48 16.130 -5.927 -28.174 1.00 0.00 O ATOM 0 H SER A 48 14.064 -6.051 -25.078 1.00 0.00 H new ATOM 0 HA SER A 48 13.262 -6.486 -27.822 1.00 0.00 H new ATOM 0 HB2 SER A 48 14.618 -4.619 -27.684 1.00 0.00 H new ATOM 0 HB3 SER A 48 15.535 -5.241 -26.327 1.00 0.00 H new ATOM 0 HG SER A 48 16.780 -5.202 -28.283 1.00 0.00 H new ATOM 803 N LYS A 49 15.173 -8.603 -26.252 1.00 0.00 N ATOM 804 CA LYS A 49 15.809 -9.912 -26.336 1.00 0.00 C ATOM 805 C LYS A 49 14.808 -11.024 -26.038 1.00 0.00 C ATOM 806 O LYS A 49 14.997 -12.170 -26.448 1.00 0.00 O ATOM 807 CB LYS A 49 16.984 -9.994 -25.360 1.00 0.00 C ATOM 808 CG LYS A 49 18.339 -9.812 -26.022 1.00 0.00 C ATOM 809 CD LYS A 49 19.335 -9.154 -25.082 1.00 0.00 C ATOM 810 CE LYS A 49 18.937 -7.721 -24.762 1.00 0.00 C ATOM 811 NZ LYS A 49 18.656 -6.935 -25.996 1.00 0.00 N ATOM 0 H LYS A 49 15.122 -8.220 -25.308 1.00 0.00 H new ATOM 0 HA LYS A 49 16.179 -10.044 -27.353 1.00 0.00 H new ATOM 0 HB2 LYS A 49 16.860 -9.232 -24.590 1.00 0.00 H new ATOM 0 HB3 LYS A 49 16.961 -10.961 -24.858 1.00 0.00 H new ATOM 0 HG2 LYS A 49 18.723 -10.781 -26.340 1.00 0.00 H new ATOM 0 HG3 LYS A 49 18.228 -9.204 -26.920 1.00 0.00 H new ATOM 0 HD2 LYS A 49 19.400 -9.729 -24.159 1.00 0.00 H new ATOM 0 HD3 LYS A 49 20.326 -9.165 -25.535 1.00 0.00 H new ATOM 0 HE2 LYS A 49 18.053 -7.723 -24.124 1.00 0.00 H new ATOM 0 HE3 LYS A 49 19.736 -7.239 -24.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 18.572 -5.927 -25.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 19.433 -7.064 -26.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 17.766 -7.264 -26.422 1.00 0.00 H new ATOM 825 N LEU A 50 13.742 -10.678 -25.324 1.00 0.00 N ATOM 826 CA LEU A 50 12.710 -11.647 -24.973 1.00 0.00 C ATOM 827 C LEU A 50 11.718 -11.826 -26.118 1.00 0.00 C ATOM 828 O LEU A 50 11.283 -12.941 -26.405 1.00 0.00 O ATOM 829 CB LEU A 50 11.973 -11.201 -23.709 1.00 0.00 C ATOM 830 CG LEU A 50 11.441 -12.319 -22.812 1.00 0.00 C ATOM 831 CD1 LEU A 50 11.373 -11.855 -21.365 1.00 0.00 C ATOM 832 CD2 LEU A 50 10.072 -12.781 -23.290 1.00 0.00 C ATOM 0 H LEU A 50 13.570 -9.734 -24.977 1.00 0.00 H new ATOM 0 HA LEU A 50 13.195 -12.605 -24.785 1.00 0.00 H new ATOM 0 HB2 LEU A 50 12.647 -10.580 -23.120 1.00 0.00 H new ATOM 0 HB3 LEU A 50 11.135 -10.570 -24.005 1.00 0.00 H new ATOM 0 HG LEU A 50 12.128 -13.163 -22.870 1.00 0.00 H new ATOM 0 HD11 LEU A 50 10.992 -12.664 -20.741 1.00 0.00 H new ATOM 0 HD12 LEU A 50 12.370 -11.574 -21.026 1.00 0.00 H new ATOM 0 HD13 LEU A 50 10.708 -10.995 -21.290 1.00 0.00 H new ATOM 0 HD21 LEU A 50 9.709 -13.577 -22.640 1.00 0.00 H new ATOM 0 HD22 LEU A 50 9.375 -11.943 -23.262 1.00 0.00 H new ATOM 0 HD23 LEU A 50 10.150 -13.154 -24.311 1.00 0.00 H new ATOM 844 N GLN A 51 11.368 -10.721 -26.769 1.00 0.00 N ATOM 845 CA GLN A 51 10.429 -10.757 -27.883 1.00 0.00 C ATOM 846 C GLN A 51 11.022 -11.509 -29.071 1.00 0.00 C ATOM 847 O GLN A 51 10.298 -12.126 -29.850 1.00 0.00 O ATOM 848 CB GLN A 51 10.049 -9.336 -28.303 1.00 0.00 C ATOM 849 CG GLN A 51 11.153 -8.606 -29.049 1.00 0.00 C ATOM 850 CD GLN A 51 10.783 -7.174 -29.385 1.00 0.00 C ATOM 851 OE1 GLN A 51 9.627 -6.773 -29.255 1.00 0.00 O ATOM 852 NE2 GLN A 51 11.767 -6.395 -29.820 1.00 0.00 N ATOM 0 H GLN A 51 11.721 -9.791 -26.544 1.00 0.00 H new ATOM 0 HA GLN A 51 9.533 -11.283 -27.553 1.00 0.00 H new ATOM 0 HB2 GLN A 51 9.162 -9.378 -28.935 1.00 0.00 H new ATOM 0 HB3 GLN A 51 9.782 -8.763 -27.415 1.00 0.00 H new ATOM 0 HG2 GLN A 51 12.060 -8.610 -28.444 1.00 0.00 H new ATOM 0 HG3 GLN A 51 11.381 -9.144 -29.969 1.00 0.00 H new ATOM 0 HE21 GLN A 51 12.711 -6.770 -29.912 1.00 0.00 H new ATOM 0 HE22 GLN A 51 11.578 -5.422 -30.061 1.00 0.00 H new ATOM 861 N GLU A 52 12.344 -11.451 -29.201 1.00 0.00 N ATOM 862 CA GLU A 52 13.033 -12.126 -30.295 1.00 0.00 C ATOM 863 C GLU A 52 13.488 -13.520 -29.873 1.00 0.00 C ATOM 864 O GLU A 52 13.965 -14.303 -30.693 1.00 0.00 O ATOM 865 CB GLU A 52 14.237 -11.301 -30.754 1.00 0.00 C ATOM 866 CG GLU A 52 15.429 -11.389 -29.815 1.00 0.00 C ATOM 867 CD GLU A 52 16.602 -12.127 -30.429 1.00 0.00 C ATOM 868 OE1 GLU A 52 17.152 -11.634 -31.437 1.00 0.00 O ATOM 869 OE2 GLU A 52 16.971 -13.198 -29.904 1.00 0.00 O ATOM 0 H GLU A 52 12.958 -10.944 -28.563 1.00 0.00 H new ATOM 0 HA GLU A 52 12.333 -12.227 -31.125 1.00 0.00 H new ATOM 0 HB2 GLU A 52 14.541 -11.637 -31.745 1.00 0.00 H new ATOM 0 HB3 GLU A 52 13.937 -10.258 -30.850 1.00 0.00 H new ATOM 0 HG2 GLU A 52 15.743 -10.383 -29.537 1.00 0.00 H new ATOM 0 HG3 GLU A 52 15.127 -11.894 -28.897 1.00 0.00 H new ATOM 876 N ALA A 53 13.337 -13.822 -28.588 1.00 0.00 N ATOM 877 CA ALA A 53 13.730 -15.121 -28.056 1.00 0.00 C ATOM 878 C ALA A 53 12.526 -16.045 -27.919 1.00 0.00 C ATOM 879 O ALA A 53 12.577 -17.212 -28.309 1.00 0.00 O ATOM 880 CB ALA A 53 14.426 -14.953 -26.713 1.00 0.00 C ATOM 0 H ALA A 53 12.945 -13.184 -27.895 1.00 0.00 H new ATOM 0 HA ALA A 53 14.427 -15.578 -28.759 1.00 0.00 H new ATOM 0 HB1 ALA A 53 14.714 -15.931 -26.328 1.00 0.00 H new ATOM 0 HB2 ALA A 53 15.316 -14.336 -26.839 1.00 0.00 H new ATOM 0 HB3 ALA A 53 13.747 -14.471 -26.009 1.00 0.00 H new ATOM 886 N THR A 54 11.441 -15.517 -27.361 1.00 0.00 N ATOM 887 CA THR A 54 10.223 -16.295 -27.170 1.00 0.00 C ATOM 888 C THR A 54 9.742 -16.895 -28.486 1.00 0.00 C ATOM 889 O THR A 54 10.382 -16.732 -29.524 1.00 0.00 O ATOM 890 CB THR A 54 9.096 -15.436 -26.568 1.00 0.00 C ATOM 891 OG1 THR A 54 9.092 -14.139 -27.174 1.00 0.00 O ATOM 892 CG2 THR A 54 9.266 -15.298 -25.062 1.00 0.00 C ATOM 0 H THR A 54 11.381 -14.553 -27.033 1.00 0.00 H new ATOM 0 HA THR A 54 10.467 -17.099 -26.475 1.00 0.00 H new ATOM 0 HB THR A 54 8.146 -15.932 -26.766 1.00 0.00 H new ATOM 0 HG1 THR A 54 9.768 -13.575 -26.744 1.00 0.00 H new ATOM 0 HG21 THR A 54 8.458 -14.687 -24.659 1.00 0.00 H new ATOM 0 HG22 THR A 54 9.239 -16.285 -24.601 1.00 0.00 H new ATOM 0 HG23 THR A 54 10.223 -14.823 -24.846 1.00 0.00 H new ATOM 900 N ASN A 55 8.610 -17.589 -28.436 1.00 0.00 N ATOM 901 CA ASN A 55 8.043 -18.213 -29.626 1.00 0.00 C ATOM 902 C ASN A 55 8.198 -17.306 -30.843 1.00 0.00 C ATOM 903 O ASN A 55 8.978 -17.595 -31.750 1.00 0.00 O ATOM 904 CB ASN A 55 6.564 -18.536 -29.402 1.00 0.00 C ATOM 905 CG ASN A 55 6.361 -19.878 -28.724 1.00 0.00 C ATOM 906 OD1 ASN A 55 6.378 -19.974 -27.497 1.00 0.00 O ATOM 907 ND2 ASN A 55 6.169 -20.921 -29.522 1.00 0.00 N ATOM 0 H ASN A 55 8.067 -17.734 -27.585 1.00 0.00 H new ATOM 0 HA ASN A 55 8.586 -19.139 -29.814 1.00 0.00 H new ATOM 0 HB2 ASN A 55 6.112 -17.753 -28.794 1.00 0.00 H new ATOM 0 HB3 ASN A 55 6.045 -18.534 -30.361 1.00 0.00 H new ATOM 0 HD21 ASN A 55 6.028 -21.849 -29.123 1.00 0.00 H new ATOM 0 HD22 ASN A 55 6.163 -20.794 -30.534 1.00 0.00 H new ATOM 914 N PHE A 56 7.450 -16.208 -30.854 1.00 0.00 N ATOM 915 CA PHE A 56 7.504 -15.258 -31.959 1.00 0.00 C ATOM 916 C PHE A 56 6.539 -14.099 -31.728 1.00 0.00 C ATOM 917 O PHE A 56 6.932 -12.934 -31.665 1.00 0.00 O ATOM 918 CB PHE A 56 7.171 -15.958 -33.278 1.00 0.00 C ATOM 919 CG PHE A 56 8.286 -15.907 -34.282 1.00 0.00 C ATOM 920 CD1 PHE A 56 8.825 -14.694 -34.679 1.00 0.00 C ATOM 921 CD2 PHE A 56 8.797 -17.074 -34.830 1.00 0.00 C ATOM 922 CE1 PHE A 56 9.852 -14.644 -35.603 1.00 0.00 C ATOM 923 CE2 PHE A 56 9.824 -17.030 -35.753 1.00 0.00 C ATOM 924 CZ PHE A 56 10.352 -15.814 -36.141 1.00 0.00 C ATOM 0 H PHE A 56 6.799 -15.954 -30.111 1.00 0.00 H new ATOM 0 HA PHE A 56 8.517 -14.859 -32.013 1.00 0.00 H new ATOM 0 HB2 PHE A 56 6.923 -17.000 -33.075 1.00 0.00 H new ATOM 0 HB3 PHE A 56 6.282 -15.498 -33.710 1.00 0.00 H new ATOM 0 HD1 PHE A 56 8.438 -13.776 -34.261 1.00 0.00 H new ATOM 0 HD2 PHE A 56 8.388 -18.028 -34.532 1.00 0.00 H new ATOM 0 HE1 PHE A 56 10.263 -13.692 -35.904 1.00 0.00 H new ATOM 0 HE2 PHE A 56 10.214 -17.946 -36.171 1.00 0.00 H new ATOM 0 HZ PHE A 56 11.154 -15.778 -36.863 1.00 0.00 H new ATOM 934 N PRO A 57 5.244 -14.424 -31.598 1.00 0.00 N ATOM 935 CA PRO A 57 4.196 -13.425 -31.371 1.00 0.00 C ATOM 936 C PRO A 57 4.279 -12.802 -29.982 1.00 0.00 C ATOM 937 O PRO A 57 4.117 -13.488 -28.971 1.00 0.00 O ATOM 938 CB PRO A 57 2.902 -14.230 -31.519 1.00 0.00 C ATOM 939 CG PRO A 57 3.286 -15.631 -31.188 1.00 0.00 C ATOM 940 CD PRO A 57 4.704 -15.793 -31.661 1.00 0.00 C ATOM 0 HA PRO A 57 4.275 -12.587 -32.063 1.00 0.00 H new ATOM 0 HB2 PRO A 57 2.128 -13.862 -30.845 1.00 0.00 H new ATOM 0 HB3 PRO A 57 2.504 -14.157 -32.531 1.00 0.00 H new ATOM 0 HG2 PRO A 57 3.209 -15.814 -30.116 1.00 0.00 H new ATOM 0 HG3 PRO A 57 2.626 -16.344 -31.682 1.00 0.00 H new ATOM 0 HD2 PRO A 57 5.265 -16.476 -31.023 1.00 0.00 H new ATOM 0 HD3 PRO A 57 4.746 -16.195 -32.673 1.00 0.00 H new ATOM 948 N LEU A 58 4.533 -11.499 -29.938 1.00 0.00 N ATOM 949 CA LEU A 58 4.638 -10.782 -28.671 1.00 0.00 C ATOM 950 C LEU A 58 3.367 -10.948 -27.845 1.00 0.00 C ATOM 951 O LEU A 58 2.259 -10.930 -28.382 1.00 0.00 O ATOM 952 CB LEU A 58 4.906 -9.298 -28.924 1.00 0.00 C ATOM 953 CG LEU A 58 4.412 -8.333 -27.845 1.00 0.00 C ATOM 954 CD1 LEU A 58 5.351 -7.143 -27.722 1.00 0.00 C ATOM 955 CD2 LEU A 58 2.996 -7.869 -28.152 1.00 0.00 C ATOM 0 H LEU A 58 4.670 -10.917 -30.764 1.00 0.00 H new ATOM 0 HA LEU A 58 5.471 -11.205 -28.110 1.00 0.00 H new ATOM 0 HB2 LEU A 58 5.980 -9.159 -29.043 1.00 0.00 H new ATOM 0 HB3 LEU A 58 4.442 -9.022 -29.871 1.00 0.00 H new ATOM 0 HG LEU A 58 4.401 -8.860 -26.891 1.00 0.00 H new ATOM 0 HD11 LEU A 58 4.983 -6.468 -26.950 1.00 0.00 H new ATOM 0 HD12 LEU A 58 6.348 -7.492 -27.454 1.00 0.00 H new ATOM 0 HD13 LEU A 58 5.396 -6.615 -28.674 1.00 0.00 H new ATOM 0 HD21 LEU A 58 2.661 -7.183 -27.374 1.00 0.00 H new ATOM 0 HD22 LEU A 58 2.981 -7.360 -29.116 1.00 0.00 H new ATOM 0 HD23 LEU A 58 2.330 -8.731 -28.187 1.00 0.00 H new ATOM 967 N ARG A 59 3.535 -11.107 -26.536 1.00 0.00 N ATOM 968 CA ARG A 59 2.401 -11.274 -25.635 1.00 0.00 C ATOM 969 C ARG A 59 1.724 -9.935 -25.359 1.00 0.00 C ATOM 970 O ARG A 59 2.306 -8.866 -25.548 1.00 0.00 O ATOM 971 CB ARG A 59 2.856 -11.909 -24.320 1.00 0.00 C ATOM 972 CG ARG A 59 4.181 -11.367 -23.810 1.00 0.00 C ATOM 973 CD ARG A 59 4.113 -11.032 -22.328 1.00 0.00 C ATOM 974 NE ARG A 59 4.483 -12.171 -21.492 1.00 0.00 N ATOM 975 CZ ARG A 59 5.728 -12.619 -21.370 1.00 0.00 C ATOM 976 NH1 ARG A 59 6.716 -12.027 -22.026 1.00 0.00 N ATOM 977 NH2 ARG A 59 5.986 -13.660 -20.589 1.00 0.00 N ATOM 0 H ARG A 59 4.445 -11.124 -26.076 1.00 0.00 H new ATOM 0 HA ARG A 59 1.680 -11.933 -26.118 1.00 0.00 H new ATOM 0 HB2 ARG A 59 2.090 -11.745 -23.562 1.00 0.00 H new ATOM 0 HB3 ARG A 59 2.942 -12.987 -24.457 1.00 0.00 H new ATOM 0 HG2 ARG A 59 4.967 -12.103 -23.982 1.00 0.00 H new ATOM 0 HG3 ARG A 59 4.451 -10.474 -24.374 1.00 0.00 H new ATOM 0 HD2 ARG A 59 4.778 -10.195 -22.115 1.00 0.00 H new ATOM 0 HD3 ARG A 59 3.103 -10.710 -22.075 1.00 0.00 H new ATOM 0 HE ARG A 59 3.746 -12.649 -20.974 1.00 0.00 H new ATOM 0 HH11 ARG A 59 6.521 -11.226 -22.626 1.00 0.00 H new ATOM 0 HH12 ARG A 59 7.671 -12.373 -21.931 1.00 0.00 H new ATOM 0 HH21 ARG A 59 5.228 -14.117 -20.082 1.00 0.00 H new ATOM 0 HH22 ARG A 59 6.942 -14.003 -20.496 1.00 0.00 H new ATOM 991 N PRO A 60 0.464 -9.991 -24.901 1.00 0.00 N ATOM 992 CA PRO A 60 -0.319 -8.792 -24.588 1.00 0.00 C ATOM 993 C PRO A 60 0.202 -8.065 -23.353 1.00 0.00 C ATOM 994 O PRO A 60 0.208 -8.616 -22.252 1.00 0.00 O ATOM 995 CB PRO A 60 -1.724 -9.343 -24.332 1.00 0.00 C ATOM 996 CG PRO A 60 -1.505 -10.753 -23.903 1.00 0.00 C ATOM 997 CD PRO A 60 -0.292 -11.230 -24.652 1.00 0.00 C ATOM 0 HA PRO A 60 -0.275 -8.055 -25.390 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -2.240 -8.770 -23.561 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -2.339 -9.293 -25.231 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -1.347 -10.813 -22.826 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -2.373 -11.370 -24.133 1.00 0.00 H new ATOM 0 HD2 PRO A 60 0.287 -11.943 -24.066 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -0.564 -11.728 -25.582 1.00 0.00 H new ATOM 1005 N PHE A 61 0.638 -6.824 -23.543 1.00 0.00 N ATOM 1006 CA PHE A 61 1.161 -6.022 -22.443 1.00 0.00 C ATOM 1007 C PHE A 61 2.435 -6.641 -21.876 1.00 0.00 C ATOM 1008 O PHE A 61 2.413 -7.279 -20.823 1.00 0.00 O ATOM 1009 CB PHE A 61 0.111 -5.885 -21.339 1.00 0.00 C ATOM 1010 CG PHE A 61 -1.252 -5.515 -21.850 1.00 0.00 C ATOM 1011 CD1 PHE A 61 -1.497 -4.246 -22.351 1.00 0.00 C ATOM 1012 CD2 PHE A 61 -2.287 -6.435 -21.829 1.00 0.00 C ATOM 1013 CE1 PHE A 61 -2.750 -3.903 -22.823 1.00 0.00 C ATOM 1014 CE2 PHE A 61 -3.542 -6.097 -22.300 1.00 0.00 C ATOM 1015 CZ PHE A 61 -3.774 -4.829 -22.796 1.00 0.00 C ATOM 0 H PHE A 61 0.640 -6.352 -24.447 1.00 0.00 H new ATOM 0 HA PHE A 61 1.401 -5.032 -22.831 1.00 0.00 H new ATOM 0 HB2 PHE A 61 0.043 -6.827 -20.795 1.00 0.00 H new ATOM 0 HB3 PHE A 61 0.441 -5.129 -20.627 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -0.700 -3.517 -22.373 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.112 -7.427 -21.440 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -2.928 -2.912 -23.213 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -4.340 -6.824 -22.280 1.00 0.00 H new ATOM 0 HZ PHE A 61 -4.754 -4.562 -23.162 1.00 0.00 H new ATOM 1025 N VAL A 62 3.545 -6.449 -22.581 1.00 0.00 N ATOM 1026 CA VAL A 62 4.829 -6.988 -22.149 1.00 0.00 C ATOM 1027 C VAL A 62 5.625 -5.950 -21.366 1.00 0.00 C ATOM 1028 O VAL A 62 5.942 -6.151 -20.194 1.00 0.00 O ATOM 1029 CB VAL A 62 5.669 -7.466 -23.348 1.00 0.00 C ATOM 1030 CG1 VAL A 62 6.660 -8.535 -22.913 1.00 0.00 C ATOM 1031 CG2 VAL A 62 4.767 -7.984 -24.458 1.00 0.00 C ATOM 0 H VAL A 62 3.581 -5.924 -23.455 1.00 0.00 H new ATOM 0 HA VAL A 62 4.614 -7.839 -21.503 1.00 0.00 H new ATOM 0 HB VAL A 62 6.233 -6.617 -23.736 1.00 0.00 H new ATOM 0 HG11 VAL A 62 7.245 -8.861 -23.773 1.00 0.00 H new ATOM 0 HG12 VAL A 62 7.327 -8.126 -22.155 1.00 0.00 H new ATOM 0 HG13 VAL A 62 6.119 -9.386 -22.499 1.00 0.00 H new ATOM 0 HG21 VAL A 62 5.378 -8.317 -25.297 1.00 0.00 H new ATOM 0 HG22 VAL A 62 4.175 -8.820 -24.085 1.00 0.00 H new ATOM 0 HG23 VAL A 62 4.101 -7.186 -24.788 1.00 0.00 H new ATOM 1041 N ILE A 63 5.945 -4.839 -22.023 1.00 0.00 N ATOM 1042 CA ILE A 63 6.703 -3.769 -21.387 1.00 0.00 C ATOM 1043 C ILE A 63 6.039 -3.321 -20.089 1.00 0.00 C ATOM 1044 O ILE A 63 6.678 -3.209 -19.043 1.00 0.00 O ATOM 1045 CB ILE A 63 6.850 -2.553 -22.321 1.00 0.00 C ATOM 1046 CG1 ILE A 63 7.571 -2.956 -23.609 1.00 0.00 C ATOM 1047 CG2 ILE A 63 7.600 -1.432 -21.617 1.00 0.00 C ATOM 1048 CD1 ILE A 63 9.034 -3.282 -23.406 1.00 0.00 C ATOM 0 H ILE A 63 5.691 -4.657 -22.994 1.00 0.00 H new ATOM 0 HA ILE A 63 7.692 -4.170 -21.166 1.00 0.00 H new ATOM 0 HB ILE A 63 5.855 -2.191 -22.581 1.00 0.00 H new ATOM 0 HG12 ILE A 63 7.070 -3.823 -24.040 1.00 0.00 H new ATOM 0 HG13 ILE A 63 7.485 -2.146 -24.333 1.00 0.00 H new ATOM 0 HG21 ILE A 63 7.696 -0.580 -22.290 1.00 0.00 H new ATOM 0 HG22 ILE A 63 7.050 -1.130 -20.725 1.00 0.00 H new ATOM 0 HG23 ILE A 63 8.592 -1.782 -21.331 1.00 0.00 H new ATOM 0 HD11 ILE A 63 9.481 -3.559 -24.361 1.00 0.00 H new ATOM 0 HD12 ILE A 63 9.549 -2.409 -23.004 1.00 0.00 H new ATOM 0 HD13 ILE A 63 9.128 -4.113 -22.707 1.00 0.00 H new ATOM 1060 N PRO A 64 4.725 -3.059 -20.156 1.00 0.00 N ATOM 1061 CA PRO A 64 3.946 -2.622 -18.994 1.00 0.00 C ATOM 1062 C PRO A 64 3.772 -3.730 -17.962 1.00 0.00 C ATOM 1063 O PRO A 64 3.277 -3.494 -16.860 1.00 0.00 O ATOM 1064 CB PRO A 64 2.593 -2.238 -19.599 1.00 0.00 C ATOM 1065 CG PRO A 64 2.495 -3.043 -20.849 1.00 0.00 C ATOM 1066 CD PRO A 64 3.900 -3.171 -21.370 1.00 0.00 C ATOM 0 HA PRO A 64 4.436 -1.809 -18.458 1.00 0.00 H new ATOM 0 HB2 PRO A 64 1.775 -2.466 -18.916 1.00 0.00 H new ATOM 0 HB3 PRO A 64 2.543 -1.170 -19.811 1.00 0.00 H new ATOM 0 HG2 PRO A 64 2.062 -4.023 -20.649 1.00 0.00 H new ATOM 0 HG3 PRO A 64 1.851 -2.553 -21.579 1.00 0.00 H new ATOM 0 HD2 PRO A 64 4.056 -4.124 -21.875 1.00 0.00 H new ATOM 0 HD3 PRO A 64 4.135 -2.387 -22.089 1.00 0.00 H new ATOM 1074 N PHE A 65 4.184 -4.940 -18.324 1.00 0.00 N ATOM 1075 CA PHE A 65 4.074 -6.086 -17.429 1.00 0.00 C ATOM 1076 C PHE A 65 5.161 -6.046 -16.359 1.00 0.00 C ATOM 1077 O PHE A 65 4.872 -6.073 -15.162 1.00 0.00 O ATOM 1078 CB PHE A 65 4.171 -7.391 -18.222 1.00 0.00 C ATOM 1079 CG PHE A 65 3.118 -8.397 -17.851 1.00 0.00 C ATOM 1080 CD1 PHE A 65 2.622 -8.456 -16.558 1.00 0.00 C ATOM 1081 CD2 PHE A 65 2.624 -9.282 -18.795 1.00 0.00 C ATOM 1082 CE1 PHE A 65 1.655 -9.381 -16.215 1.00 0.00 C ATOM 1083 CE2 PHE A 65 1.656 -10.209 -18.457 1.00 0.00 C ATOM 1084 CZ PHE A 65 1.170 -10.258 -17.165 1.00 0.00 C ATOM 0 H PHE A 65 4.598 -5.153 -19.232 1.00 0.00 H new ATOM 0 HA PHE A 65 3.102 -6.039 -16.937 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.090 -7.167 -19.286 1.00 0.00 H new ATOM 0 HB3 PHE A 65 5.155 -7.831 -18.063 1.00 0.00 H new ATOM 0 HD1 PHE A 65 2.996 -7.772 -15.811 1.00 0.00 H new ATOM 0 HD2 PHE A 65 3.000 -9.247 -19.807 1.00 0.00 H new ATOM 0 HE1 PHE A 65 1.278 -9.418 -15.204 1.00 0.00 H new ATOM 0 HE2 PHE A 65 1.280 -10.894 -19.202 1.00 0.00 H new ATOM 0 HZ PHE A 65 0.413 -10.980 -16.898 1.00 0.00 H new ATOM 1094 N LEU A 66 6.413 -5.982 -16.798 1.00 0.00 N ATOM 1095 CA LEU A 66 7.545 -5.939 -15.879 1.00 0.00 C ATOM 1096 C LEU A 66 7.899 -4.500 -15.518 1.00 0.00 C ATOM 1097 O LEU A 66 8.684 -4.253 -14.602 1.00 0.00 O ATOM 1098 CB LEU A 66 8.758 -6.634 -16.500 1.00 0.00 C ATOM 1099 CG LEU A 66 9.516 -7.602 -15.591 1.00 0.00 C ATOM 1100 CD1 LEU A 66 9.299 -9.038 -16.042 1.00 0.00 C ATOM 1101 CD2 LEU A 66 11.000 -7.266 -15.572 1.00 0.00 C ATOM 0 H LEU A 66 6.670 -5.959 -17.785 1.00 0.00 H new ATOM 0 HA LEU A 66 7.261 -6.464 -14.967 1.00 0.00 H new ATOM 0 HB2 LEU A 66 8.426 -7.181 -17.383 1.00 0.00 H new ATOM 0 HB3 LEU A 66 9.454 -5.868 -16.843 1.00 0.00 H new ATOM 0 HG LEU A 66 9.128 -7.498 -14.578 1.00 0.00 H new ATOM 0 HD11 LEU A 66 9.846 -9.713 -15.383 1.00 0.00 H new ATOM 0 HD12 LEU A 66 8.236 -9.275 -16.003 1.00 0.00 H new ATOM 0 HD13 LEU A 66 9.659 -9.157 -17.064 1.00 0.00 H new ATOM 0 HD21 LEU A 66 11.523 -7.965 -14.920 1.00 0.00 H new ATOM 0 HD22 LEU A 66 11.403 -7.341 -16.582 1.00 0.00 H new ATOM 0 HD23 LEU A 66 11.138 -6.251 -15.200 1.00 0.00 H new ATOM 1113 N LYS A 67 7.314 -3.552 -16.243 1.00 0.00 N ATOM 1114 CA LYS A 67 7.564 -2.137 -15.998 1.00 0.00 C ATOM 1115 C LYS A 67 7.493 -1.822 -14.507 1.00 0.00 C ATOM 1116 O LYS A 67 8.399 -1.204 -13.950 1.00 0.00 O ATOM 1117 CB LYS A 67 6.550 -1.280 -16.760 1.00 0.00 C ATOM 1118 CG LYS A 67 7.191 -0.231 -17.653 1.00 0.00 C ATOM 1119 CD LYS A 67 8.059 0.727 -16.855 1.00 0.00 C ATOM 1120 CE LYS A 67 9.433 0.891 -17.485 1.00 0.00 C ATOM 1121 NZ LYS A 67 9.565 2.192 -18.197 1.00 0.00 N ATOM 0 H LYS A 67 6.663 -3.739 -17.006 1.00 0.00 H new ATOM 0 HA LYS A 67 8.568 -1.904 -16.353 1.00 0.00 H new ATOM 0 HB2 LYS A 67 5.923 -1.930 -17.370 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.894 -0.784 -16.044 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.796 -0.722 -18.416 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.414 0.329 -18.174 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.568 1.698 -16.792 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.167 0.358 -15.835 1.00 0.00 H new ATOM 0 HE2 LYS A 67 10.198 0.821 -16.712 1.00 0.00 H new ATOM 0 HE3 LYS A 67 9.612 0.074 -18.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.516 2.265 -18.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 8.852 2.249 -18.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.420 2.972 -17.525 1.00 0.00 H new ATOM 1135 N ALA A 68 6.410 -2.252 -13.867 1.00 0.00 N ATOM 1136 CA ALA A 68 6.223 -2.019 -12.440 1.00 0.00 C ATOM 1137 C ALA A 68 6.625 -3.244 -11.626 1.00 0.00 C ATOM 1138 O ALA A 68 6.787 -3.166 -10.409 1.00 0.00 O ATOM 1139 CB ALA A 68 4.777 -1.642 -12.152 1.00 0.00 C ATOM 0 H ALA A 68 5.649 -2.763 -14.314 1.00 0.00 H new ATOM 0 HA ALA A 68 6.868 -1.192 -12.144 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.652 -1.471 -11.083 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.522 -0.733 -12.697 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.120 -2.452 -12.469 1.00 0.00 H new ATOM 1145 N ASN A 69 6.784 -4.374 -12.307 1.00 0.00 N ATOM 1146 CA ASN A 69 7.166 -5.617 -11.645 1.00 0.00 C ATOM 1147 C ASN A 69 8.683 -5.736 -11.546 1.00 0.00 C ATOM 1148 O ASN A 69 9.205 -6.653 -10.910 1.00 0.00 O ATOM 1149 CB ASN A 69 6.597 -6.818 -12.404 1.00 0.00 C ATOM 1150 CG ASN A 69 5.486 -7.511 -11.639 1.00 0.00 C ATOM 1151 OD1 ASN A 69 5.734 -8.423 -10.850 1.00 0.00 O ATOM 1152 ND2 ASN A 69 4.251 -7.080 -11.871 1.00 0.00 N ATOM 0 H ASN A 69 6.655 -4.455 -13.315 1.00 0.00 H new ATOM 0 HA ASN A 69 6.754 -5.605 -10.636 1.00 0.00 H new ATOM 0 HB2 ASN A 69 6.217 -6.487 -13.371 1.00 0.00 H new ATOM 0 HB3 ASN A 69 7.397 -7.531 -12.603 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.462 -7.508 -11.387 1.00 0.00 H new ATOM 0 HD22 ASN A 69 4.092 -6.321 -12.534 1.00 0.00 H new ATOM 1159 N LEU A 70 9.387 -4.804 -12.179 1.00 0.00 N ATOM 1160 CA LEU A 70 10.846 -4.803 -12.162 1.00 0.00 C ATOM 1161 C LEU A 70 11.374 -4.906 -10.735 1.00 0.00 C ATOM 1162 O LEU A 70 12.203 -5.758 -10.414 1.00 0.00 O ATOM 1163 CB LEU A 70 11.382 -3.534 -12.826 1.00 0.00 C ATOM 1164 CG LEU A 70 12.876 -3.262 -12.646 1.00 0.00 C ATOM 1165 CD1 LEU A 70 13.138 -2.582 -11.311 1.00 0.00 C ATOM 1166 CD2 LEU A 70 13.670 -4.557 -12.751 1.00 0.00 C ATOM 0 H LEU A 70 8.971 -4.039 -12.711 1.00 0.00 H new ATOM 0 HA LEU A 70 11.192 -5.672 -12.721 1.00 0.00 H new ATOM 0 HB2 LEU A 70 11.169 -3.589 -13.894 1.00 0.00 H new ATOM 0 HB3 LEU A 70 10.828 -2.681 -12.434 1.00 0.00 H new ATOM 0 HG LEU A 70 13.202 -2.593 -13.442 1.00 0.00 H new ATOM 0 HD11 LEU A 70 14.206 -2.396 -11.201 1.00 0.00 H new ATOM 0 HD12 LEU A 70 12.599 -1.635 -11.273 1.00 0.00 H new ATOM 0 HD13 LEU A 70 12.796 -3.226 -10.501 1.00 0.00 H new ATOM 0 HD21 LEU A 70 14.731 -4.345 -12.621 1.00 0.00 H new ATOM 0 HD22 LEU A 70 13.341 -5.250 -11.976 1.00 0.00 H new ATOM 0 HD23 LEU A 70 13.507 -5.005 -13.731 1.00 0.00 H new ATOM 1178 N PRO A 71 10.881 -4.021 -9.856 1.00 0.00 N ATOM 1179 CA PRO A 71 11.287 -3.994 -8.447 1.00 0.00 C ATOM 1180 C PRO A 71 10.769 -5.201 -7.672 1.00 0.00 C ATOM 1181 O PRO A 71 11.311 -5.557 -6.624 1.00 0.00 O ATOM 1182 CB PRO A 71 10.651 -2.706 -7.919 1.00 0.00 C ATOM 1183 CG PRO A 71 9.485 -2.465 -8.815 1.00 0.00 C ATOM 1184 CD PRO A 71 9.889 -2.979 -10.169 1.00 0.00 C ATOM 0 HA PRO A 71 12.371 -4.027 -8.334 1.00 0.00 H new ATOM 0 HB2 PRO A 71 10.337 -2.816 -6.881 1.00 0.00 H new ATOM 0 HB3 PRO A 71 11.355 -1.874 -7.952 1.00 0.00 H new ATOM 0 HG2 PRO A 71 8.599 -2.983 -8.450 1.00 0.00 H new ATOM 0 HG3 PRO A 71 9.239 -1.404 -8.858 1.00 0.00 H new ATOM 0 HD2 PRO A 71 9.038 -3.386 -10.715 1.00 0.00 H new ATOM 0 HD3 PRO A 71 10.317 -2.190 -10.787 1.00 0.00 H new ATOM 1192 N LEU A 72 9.718 -5.826 -8.191 1.00 0.00 N ATOM 1193 CA LEU A 72 9.127 -6.994 -7.547 1.00 0.00 C ATOM 1194 C LEU A 72 9.850 -8.270 -7.965 1.00 0.00 C ATOM 1195 O LEU A 72 9.828 -9.272 -7.249 1.00 0.00 O ATOM 1196 CB LEU A 72 7.642 -7.097 -7.898 1.00 0.00 C ATOM 1197 CG LEU A 72 6.683 -6.322 -6.993 1.00 0.00 C ATOM 1198 CD1 LEU A 72 6.948 -6.648 -5.532 1.00 0.00 C ATOM 1199 CD2 LEU A 72 6.808 -4.826 -7.240 1.00 0.00 C ATOM 0 H LEU A 72 9.257 -5.544 -9.056 1.00 0.00 H new ATOM 0 HA LEU A 72 9.232 -6.876 -6.468 1.00 0.00 H new ATOM 0 HB2 LEU A 72 7.506 -6.748 -8.922 1.00 0.00 H new ATOM 0 HB3 LEU A 72 7.357 -8.149 -7.880 1.00 0.00 H new ATOM 0 HG LEU A 72 5.663 -6.625 -7.232 1.00 0.00 H new ATOM 0 HD11 LEU A 72 6.256 -6.088 -4.903 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.806 -7.716 -5.366 1.00 0.00 H new ATOM 0 HD13 LEU A 72 7.972 -6.375 -5.278 1.00 0.00 H new ATOM 0 HD21 LEU A 72 6.118 -4.291 -6.587 1.00 0.00 H new ATOM 0 HD22 LEU A 72 7.829 -4.507 -7.030 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.567 -4.608 -8.280 1.00 0.00 H new ATOM 1211 N LEU A 73 10.492 -8.227 -9.128 1.00 0.00 N ATOM 1212 CA LEU A 73 11.224 -9.379 -9.641 1.00 0.00 C ATOM 1213 C LEU A 73 12.593 -9.494 -8.977 1.00 0.00 C ATOM 1214 O LEU A 73 13.105 -10.595 -8.777 1.00 0.00 O ATOM 1215 CB LEU A 73 11.388 -9.271 -11.158 1.00 0.00 C ATOM 1216 CG LEU A 73 10.757 -10.392 -11.983 1.00 0.00 C ATOM 1217 CD1 LEU A 73 11.328 -11.742 -11.576 1.00 0.00 C ATOM 1218 CD2 LEU A 73 9.243 -10.383 -11.826 1.00 0.00 C ATOM 0 H LEU A 73 10.520 -7.406 -9.733 1.00 0.00 H new ATOM 0 HA LEU A 73 10.650 -10.276 -9.407 1.00 0.00 H new ATOM 0 HB2 LEU A 73 10.960 -8.323 -11.483 1.00 0.00 H new ATOM 0 HB3 LEU A 73 12.453 -9.235 -11.386 1.00 0.00 H new ATOM 0 HG LEU A 73 10.995 -10.221 -13.033 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.867 -12.528 -12.174 1.00 0.00 H new ATOM 0 HD12 LEU A 73 12.405 -11.746 -11.741 1.00 0.00 H new ATOM 0 HD13 LEU A 73 11.122 -11.921 -10.521 1.00 0.00 H new ATOM 0 HD21 LEU A 73 8.811 -11.188 -12.420 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.985 -10.528 -10.777 1.00 0.00 H new ATOM 0 HD23 LEU A 73 8.847 -9.427 -12.168 1.00 0.00 H new ATOM 1230 N GLN A 74 13.177 -8.350 -8.636 1.00 0.00 N ATOM 1231 CA GLN A 74 14.486 -8.323 -7.993 1.00 0.00 C ATOM 1232 C GLN A 74 14.391 -8.795 -6.546 1.00 0.00 C ATOM 1233 O GLN A 74 15.404 -8.940 -5.862 1.00 0.00 O ATOM 1234 CB GLN A 74 15.074 -6.912 -8.044 1.00 0.00 C ATOM 1235 CG GLN A 74 14.105 -5.833 -7.589 1.00 0.00 C ATOM 1236 CD GLN A 74 14.812 -4.595 -7.073 1.00 0.00 C ATOM 1237 OE1 GLN A 74 14.598 -4.172 -5.936 1.00 0.00 O ATOM 1238 NE2 GLN A 74 15.661 -4.006 -7.907 1.00 0.00 N ATOM 0 H GLN A 74 12.765 -7.430 -8.794 1.00 0.00 H new ATOM 0 HA GLN A 74 15.143 -9.002 -8.535 1.00 0.00 H new ATOM 0 HB2 GLN A 74 15.965 -6.876 -7.418 1.00 0.00 H new ATOM 0 HB3 GLN A 74 15.392 -6.696 -9.064 1.00 0.00 H new ATOM 0 HG2 GLN A 74 13.457 -5.557 -8.421 1.00 0.00 H new ATOM 0 HG3 GLN A 74 13.463 -6.234 -6.805 1.00 0.00 H new ATOM 0 HE21 GLN A 74 15.808 -4.390 -8.840 1.00 0.00 H new ATOM 0 HE22 GLN A 74 16.166 -3.169 -7.614 1.00 0.00 H new ATOM 1247 N ARG A 75 13.167 -9.032 -6.085 1.00 0.00 N ATOM 1248 CA ARG A 75 12.940 -9.486 -4.718 1.00 0.00 C ATOM 1249 C ARG A 75 13.185 -10.987 -4.596 1.00 0.00 C ATOM 1250 O ARG A 75 13.856 -11.442 -3.670 1.00 0.00 O ATOM 1251 CB ARG A 75 11.512 -9.154 -4.279 1.00 0.00 C ATOM 1252 CG ARG A 75 11.019 -7.806 -4.778 1.00 0.00 C ATOM 1253 CD ARG A 75 11.647 -6.660 -3.999 1.00 0.00 C ATOM 1254 NE ARG A 75 13.087 -6.569 -4.225 1.00 0.00 N ATOM 1255 CZ ARG A 75 13.918 -5.923 -3.415 1.00 0.00 C ATOM 1256 NH1 ARG A 75 13.455 -5.315 -2.332 1.00 0.00 N ATOM 1257 NH2 ARG A 75 15.216 -5.885 -3.687 1.00 0.00 N ATOM 0 H ARG A 75 12.318 -8.917 -6.638 1.00 0.00 H new ATOM 0 HA ARG A 75 13.643 -8.967 -4.067 1.00 0.00 H new ATOM 0 HB2 ARG A 75 10.840 -9.933 -4.639 1.00 0.00 H new ATOM 0 HB3 ARG A 75 11.463 -9.169 -3.190 1.00 0.00 H new ATOM 0 HG2 ARG A 75 11.255 -7.700 -5.837 1.00 0.00 H new ATOM 0 HG3 ARG A 75 9.934 -7.758 -4.687 1.00 0.00 H new ATOM 0 HD2 ARG A 75 11.174 -5.722 -4.290 1.00 0.00 H new ATOM 0 HD3 ARG A 75 11.455 -6.797 -2.935 1.00 0.00 H new ATOM 0 HE ARG A 75 13.476 -7.026 -5.050 1.00 0.00 H new ATOM 0 HH11 ARG A 75 12.458 -5.342 -2.119 1.00 0.00 H new ATOM 0 HH12 ARG A 75 14.096 -4.820 -1.712 1.00 0.00 H new ATOM 0 HH21 ARG A 75 15.577 -6.352 -4.519 1.00 0.00 H new ATOM 0 HH22 ARG A 75 15.853 -5.389 -3.064 1.00 0.00 H new ATOM 1271 N GLU A 76 12.636 -11.750 -5.535 1.00 0.00 N ATOM 1272 CA GLU A 76 12.795 -13.200 -5.531 1.00 0.00 C ATOM 1273 C GLU A 76 14.254 -13.588 -5.750 1.00 0.00 C ATOM 1274 O GLU A 76 14.678 -14.686 -5.387 1.00 0.00 O ATOM 1275 CB GLU A 76 11.919 -13.834 -6.613 1.00 0.00 C ATOM 1276 CG GLU A 76 12.511 -13.738 -8.009 1.00 0.00 C ATOM 1277 CD GLU A 76 13.451 -14.885 -8.324 1.00 0.00 C ATOM 1278 OE1 GLU A 76 13.177 -16.018 -7.874 1.00 0.00 O ATOM 1279 OE2 GLU A 76 14.461 -14.652 -9.020 1.00 0.00 O ATOM 0 H GLU A 76 12.077 -11.389 -6.308 1.00 0.00 H new ATOM 0 HA GLU A 76 12.481 -13.572 -4.556 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.756 -14.884 -6.368 1.00 0.00 H new ATOM 0 HB3 GLU A 76 10.942 -13.350 -6.608 1.00 0.00 H new ATOM 0 HG2 GLU A 76 11.704 -13.723 -8.742 1.00 0.00 H new ATOM 0 HG3 GLU A 76 13.049 -12.795 -8.108 1.00 0.00 H new ATOM 1286 N LEU A 77 15.019 -12.680 -6.346 1.00 0.00 N ATOM 1287 CA LEU A 77 16.431 -12.926 -6.615 1.00 0.00 C ATOM 1288 C LEU A 77 17.177 -13.275 -5.331 1.00 0.00 C ATOM 1289 O LEU A 77 18.061 -14.133 -5.328 1.00 0.00 O ATOM 1290 CB LEU A 77 17.067 -11.698 -7.269 1.00 0.00 C ATOM 1291 CG LEU A 77 17.928 -11.967 -8.505 1.00 0.00 C ATOM 1292 CD1 LEU A 77 18.958 -13.047 -8.214 1.00 0.00 C ATOM 1293 CD2 LEU A 77 17.055 -12.364 -9.686 1.00 0.00 C ATOM 0 H LEU A 77 14.685 -11.766 -6.652 1.00 0.00 H new ATOM 0 HA LEU A 77 16.503 -13.773 -7.298 1.00 0.00 H new ATOM 0 HB2 LEU A 77 16.272 -11.007 -7.548 1.00 0.00 H new ATOM 0 HB3 LEU A 77 17.682 -11.192 -6.525 1.00 0.00 H new ATOM 0 HG LEU A 77 18.458 -11.050 -8.762 1.00 0.00 H new ATOM 0 HD11 LEU A 77 19.561 -13.224 -9.105 1.00 0.00 H new ATOM 0 HD12 LEU A 77 19.604 -12.724 -7.397 1.00 0.00 H new ATOM 0 HD13 LEU A 77 18.449 -13.968 -7.931 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.684 -12.552 -10.556 1.00 0.00 H new ATOM 0 HD22 LEU A 77 16.498 -13.268 -9.439 1.00 0.00 H new ATOM 0 HD23 LEU A 77 16.357 -11.557 -9.910 1.00 0.00 H new ATOM 1305 N LEU A 78 16.813 -12.608 -4.241 1.00 0.00 N ATOM 1306 CA LEU A 78 17.446 -12.849 -2.949 1.00 0.00 C ATOM 1307 C LEU A 78 17.029 -14.202 -2.383 1.00 0.00 C ATOM 1308 O LEU A 78 17.586 -14.670 -1.390 1.00 0.00 O ATOM 1309 CB LEU A 78 17.082 -11.737 -1.965 1.00 0.00 C ATOM 1310 CG LEU A 78 18.158 -10.678 -1.720 1.00 0.00 C ATOM 1311 CD1 LEU A 78 18.735 -10.189 -3.039 1.00 0.00 C ATOM 1312 CD2 LEU A 78 17.589 -9.515 -0.921 1.00 0.00 C ATOM 0 H LEU A 78 16.083 -11.896 -4.226 1.00 0.00 H new ATOM 0 HA LEU A 78 18.526 -12.855 -3.097 1.00 0.00 H new ATOM 0 HB2 LEU A 78 16.185 -11.237 -2.329 1.00 0.00 H new ATOM 0 HB3 LEU A 78 16.827 -12.194 -1.009 1.00 0.00 H new ATOM 0 HG LEU A 78 18.962 -11.132 -1.141 1.00 0.00 H new ATOM 0 HD11 LEU A 78 19.499 -9.436 -2.845 1.00 0.00 H new ATOM 0 HD12 LEU A 78 19.180 -11.028 -3.575 1.00 0.00 H new ATOM 0 HD13 LEU A 78 17.940 -9.752 -3.644 1.00 0.00 H new ATOM 0 HD21 LEU A 78 18.368 -8.771 -0.756 1.00 0.00 H new ATOM 0 HD22 LEU A 78 16.766 -9.062 -1.474 1.00 0.00 H new ATOM 0 HD23 LEU A 78 17.224 -9.878 0.040 1.00 0.00 H new ATOM 1324 N HIS A 79 16.045 -14.828 -3.022 1.00 0.00 N ATOM 1325 CA HIS A 79 15.554 -16.129 -2.583 1.00 0.00 C ATOM 1326 C HIS A 79 16.325 -17.257 -3.262 1.00 0.00 C ATOM 1327 O HIS A 79 16.612 -18.284 -2.647 1.00 0.00 O ATOM 1328 CB HIS A 79 14.061 -16.263 -2.884 1.00 0.00 C ATOM 1329 CG HIS A 79 13.239 -16.627 -1.686 1.00 0.00 C ATOM 1330 ND1 HIS A 79 13.358 -17.834 -1.030 1.00 0.00 N ATOM 1331 CD2 HIS A 79 12.283 -15.934 -1.025 1.00 0.00 C ATOM 1332 CE1 HIS A 79 12.510 -17.868 -0.018 1.00 0.00 C ATOM 1333 NE2 HIS A 79 11.845 -16.727 0.007 1.00 0.00 N ATOM 0 H HIS A 79 15.572 -14.455 -3.845 1.00 0.00 H new ATOM 0 HA HIS A 79 15.708 -16.203 -1.506 1.00 0.00 H new ATOM 0 HB2 HIS A 79 13.695 -15.321 -3.293 1.00 0.00 H new ATOM 0 HB3 HIS A 79 13.921 -17.021 -3.655 1.00 0.00 H new ATOM 0 HD2 HIS A 79 11.930 -14.942 -1.265 1.00 0.00 H new ATOM 0 HE1 HIS A 79 12.382 -18.689 0.672 1.00 0.00 H new ATOM 0 HE2 HIS A 79 11.124 -16.476 0.683 1.00 0.00 H new ATOM 1341 N ALA A 80 16.655 -17.060 -4.534 1.00 0.00 N ATOM 1342 CA ALA A 80 17.393 -18.060 -5.296 1.00 0.00 C ATOM 1343 C ALA A 80 18.774 -18.300 -4.694 1.00 0.00 C ATOM 1344 O ALA A 80 19.267 -19.427 -4.680 1.00 0.00 O ATOM 1345 CB ALA A 80 17.517 -17.630 -6.750 1.00 0.00 C ATOM 0 H ALA A 80 16.423 -16.217 -5.059 1.00 0.00 H new ATOM 0 HA ALA A 80 16.838 -18.997 -5.252 1.00 0.00 H new ATOM 0 HB1 ALA A 80 18.070 -18.386 -7.307 1.00 0.00 H new ATOM 0 HB2 ALA A 80 16.523 -17.516 -7.182 1.00 0.00 H new ATOM 0 HB3 ALA A 80 18.047 -16.679 -6.804 1.00 0.00 H new ATOM 1351 N ALA A 81 19.392 -17.233 -4.199 1.00 0.00 N ATOM 1352 CA ALA A 81 20.715 -17.328 -3.595 1.00 0.00 C ATOM 1353 C ALA A 81 20.694 -18.233 -2.367 1.00 0.00 C ATOM 1354 O ALA A 81 21.514 -19.142 -2.241 1.00 0.00 O ATOM 1355 CB ALA A 81 21.227 -15.944 -3.225 1.00 0.00 C ATOM 0 H ALA A 81 18.997 -16.292 -4.204 1.00 0.00 H new ATOM 0 HA ALA A 81 21.391 -17.769 -4.327 1.00 0.00 H new ATOM 0 HB1 ALA A 81 22.216 -16.030 -2.775 1.00 0.00 H new ATOM 0 HB2 ALA A 81 21.289 -15.327 -4.122 1.00 0.00 H new ATOM 0 HB3 ALA A 81 20.543 -15.482 -2.513 1.00 0.00 H new ATOM 1361 N ARG A 82 19.752 -17.977 -1.466 1.00 0.00 N ATOM 1362 CA ARG A 82 19.625 -18.767 -0.247 1.00 0.00 C ATOM 1363 C ARG A 82 19.375 -20.236 -0.575 1.00 0.00 C ATOM 1364 O ARG A 82 19.885 -21.130 0.101 1.00 0.00 O ATOM 1365 CB ARG A 82 18.488 -18.226 0.621 1.00 0.00 C ATOM 1366 CG ARG A 82 18.586 -16.734 0.894 1.00 0.00 C ATOM 1367 CD ARG A 82 19.834 -16.396 1.695 1.00 0.00 C ATOM 1368 NE ARG A 82 19.992 -17.267 2.856 1.00 0.00 N ATOM 1369 CZ ARG A 82 19.355 -17.080 4.007 1.00 0.00 C ATOM 1370 NH1 ARG A 82 18.521 -16.059 4.149 1.00 0.00 N ATOM 1371 NH2 ARG A 82 19.551 -17.916 5.019 1.00 0.00 N ATOM 0 H ARG A 82 19.065 -17.228 -1.557 1.00 0.00 H new ATOM 0 HA ARG A 82 20.562 -18.690 0.305 1.00 0.00 H new ATOM 0 HB2 ARG A 82 17.537 -18.435 0.131 1.00 0.00 H new ATOM 0 HB3 ARG A 82 18.481 -18.761 1.571 1.00 0.00 H new ATOM 0 HG2 ARG A 82 18.600 -16.190 -0.051 1.00 0.00 H new ATOM 0 HG3 ARG A 82 17.702 -16.404 1.439 1.00 0.00 H new ATOM 0 HD2 ARG A 82 20.711 -16.484 1.054 1.00 0.00 H new ATOM 0 HD3 ARG A 82 19.783 -15.358 2.025 1.00 0.00 H new ATOM 0 HE ARG A 82 20.626 -18.062 2.779 1.00 0.00 H new ATOM 0 HH11 ARG A 82 18.367 -15.415 3.373 1.00 0.00 H new ATOM 0 HH12 ARG A 82 18.033 -15.918 5.034 1.00 0.00 H new ATOM 0 HH21 ARG A 82 20.191 -18.703 4.914 1.00 0.00 H new ATOM 0 HH22 ARG A 82 19.061 -17.771 5.902 1.00 0.00 H new ATOM 1385 N LEU A 83 18.586 -20.478 -1.617 1.00 0.00 N ATOM 1386 CA LEU A 83 18.267 -21.839 -2.035 1.00 0.00 C ATOM 1387 C LEU A 83 19.372 -22.410 -2.919 1.00 0.00 C ATOM 1388 O LEU A 83 19.369 -23.597 -3.243 1.00 0.00 O ATOM 1389 CB LEU A 83 16.934 -21.863 -2.785 1.00 0.00 C ATOM 1390 CG LEU A 83 16.293 -23.239 -2.969 1.00 0.00 C ATOM 1391 CD1 LEU A 83 16.084 -23.914 -1.622 1.00 0.00 C ATOM 1392 CD2 LEU A 83 14.973 -23.117 -3.716 1.00 0.00 C ATOM 0 H LEU A 83 18.156 -19.750 -2.187 1.00 0.00 H new ATOM 0 HA LEU A 83 18.186 -22.458 -1.142 1.00 0.00 H new ATOM 0 HB2 LEU A 83 16.229 -21.224 -2.253 1.00 0.00 H new ATOM 0 HB3 LEU A 83 17.086 -21.420 -3.769 1.00 0.00 H new ATOM 0 HG LEU A 83 16.968 -23.857 -3.562 1.00 0.00 H new ATOM 0 HD11 LEU A 83 15.627 -24.892 -1.772 1.00 0.00 H new ATOM 0 HD12 LEU A 83 17.045 -24.035 -1.123 1.00 0.00 H new ATOM 0 HD13 LEU A 83 15.430 -23.299 -1.004 1.00 0.00 H new ATOM 0 HD21 LEU A 83 14.531 -24.106 -3.838 1.00 0.00 H new ATOM 0 HD22 LEU A 83 14.292 -22.482 -3.149 1.00 0.00 H new ATOM 0 HD23 LEU A 83 15.149 -22.675 -4.697 1.00 0.00 H new ATOM 1404 N ALA A 84 20.315 -21.557 -3.303 1.00 0.00 N ATOM 1405 CA ALA A 84 21.428 -21.977 -4.145 1.00 0.00 C ATOM 1406 C ALA A 84 22.729 -22.026 -3.352 1.00 0.00 C ATOM 1407 O ALA A 84 23.772 -22.424 -3.873 1.00 0.00 O ATOM 1408 CB ALA A 84 21.570 -21.043 -5.338 1.00 0.00 C ATOM 0 H ALA A 84 20.331 -20.570 -3.044 1.00 0.00 H new ATOM 0 HA ALA A 84 21.216 -22.983 -4.508 1.00 0.00 H new ATOM 0 HB1 ALA A 84 22.405 -21.369 -5.958 1.00 0.00 H new ATOM 0 HB2 ALA A 84 20.652 -21.062 -5.926 1.00 0.00 H new ATOM 0 HB3 ALA A 84 21.754 -20.028 -4.986 1.00 0.00 H new ATOM 1414 N LYS A 85 22.662 -21.620 -2.089 1.00 0.00 N ATOM 1415 CA LYS A 85 23.835 -21.618 -1.222 1.00 0.00 C ATOM 1416 C LYS A 85 24.904 -20.669 -1.755 1.00 0.00 C ATOM 1417 O LYS A 85 26.094 -20.859 -1.505 1.00 0.00 O ATOM 1418 CB LYS A 85 24.407 -23.032 -1.100 1.00 0.00 C ATOM 1419 CG LYS A 85 23.448 -24.023 -0.464 1.00 0.00 C ATOM 1420 CD LYS A 85 22.735 -24.861 -1.512 1.00 0.00 C ATOM 1421 CE LYS A 85 23.680 -25.858 -2.165 1.00 0.00 C ATOM 1422 NZ LYS A 85 22.950 -27.034 -2.715 1.00 0.00 N ATOM 0 H LYS A 85 21.807 -21.288 -1.642 1.00 0.00 H new ATOM 0 HA LYS A 85 23.526 -21.272 -0.236 1.00 0.00 H new ATOM 0 HB2 LYS A 85 24.682 -23.391 -2.092 1.00 0.00 H new ATOM 0 HB3 LYS A 85 25.322 -22.995 -0.510 1.00 0.00 H new ATOM 0 HG2 LYS A 85 23.996 -24.677 0.214 1.00 0.00 H new ATOM 0 HG3 LYS A 85 22.713 -23.486 0.135 1.00 0.00 H new ATOM 0 HD2 LYS A 85 21.904 -25.394 -1.050 1.00 0.00 H new ATOM 0 HD3 LYS A 85 22.310 -24.208 -2.274 1.00 0.00 H new ATOM 0 HE2 LYS A 85 24.231 -25.365 -2.966 1.00 0.00 H new ATOM 0 HE3 LYS A 85 24.414 -26.196 -1.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 23.628 -27.690 -3.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 22.444 -27.519 -1.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 22.267 -26.715 -3.431 1.00 0.00 H new ATOM 1436 N GLN A 86 24.471 -19.649 -2.488 1.00 0.00 N ATOM 1437 CA GLN A 86 25.392 -18.671 -3.055 1.00 0.00 C ATOM 1438 C GLN A 86 24.878 -17.251 -2.843 1.00 0.00 C ATOM 1439 O GLN A 86 23.839 -17.044 -2.217 1.00 0.00 O ATOM 1440 CB GLN A 86 25.594 -18.935 -4.548 1.00 0.00 C ATOM 1441 CG GLN A 86 25.444 -20.398 -4.933 1.00 0.00 C ATOM 1442 CD GLN A 86 26.314 -20.783 -6.113 1.00 0.00 C ATOM 1443 OE1 GLN A 86 27.535 -20.886 -5.992 1.00 0.00 O ATOM 1444 NE2 GLN A 86 25.689 -20.998 -7.265 1.00 0.00 N ATOM 0 H GLN A 86 23.489 -19.478 -2.703 1.00 0.00 H new ATOM 0 HA GLN A 86 26.349 -18.771 -2.542 1.00 0.00 H new ATOM 0 HB2 GLN A 86 24.874 -18.343 -5.114 1.00 0.00 H new ATOM 0 HB3 GLN A 86 26.587 -18.592 -4.838 1.00 0.00 H new ATOM 0 HG2 GLN A 86 25.701 -21.023 -4.078 1.00 0.00 H new ATOM 0 HG3 GLN A 86 24.401 -20.601 -5.174 1.00 0.00 H new ATOM 0 HE21 GLN A 86 24.675 -20.902 -7.321 1.00 0.00 H new ATOM 0 HE22 GLN A 86 26.223 -21.260 -8.094 1.00 0.00 H new ATOM 1453 N ASN A 87 25.613 -16.276 -3.367 1.00 0.00 N ATOM 1454 CA ASN A 87 25.231 -14.875 -3.234 1.00 0.00 C ATOM 1455 C ASN A 87 24.096 -14.527 -4.193 1.00 0.00 C ATOM 1456 O ASN A 87 23.900 -15.173 -5.222 1.00 0.00 O ATOM 1457 CB ASN A 87 26.434 -13.969 -3.500 1.00 0.00 C ATOM 1458 CG ASN A 87 26.864 -13.201 -2.265 1.00 0.00 C ATOM 1459 OD1 ASN A 87 27.017 -13.774 -1.186 1.00 0.00 O ATOM 1460 ND2 ASN A 87 27.062 -11.896 -2.419 1.00 0.00 N ATOM 0 H ASN A 87 26.476 -16.430 -3.888 1.00 0.00 H new ATOM 0 HA ASN A 87 24.883 -14.715 -2.214 1.00 0.00 H new ATOM 0 HB2 ASN A 87 27.268 -14.573 -3.858 1.00 0.00 H new ATOM 0 HB3 ASN A 87 26.186 -13.265 -4.294 1.00 0.00 H new ATOM 0 HD21 ASN A 87 27.353 -11.327 -1.624 1.00 0.00 H new ATOM 0 HD22 ASN A 87 26.923 -11.463 -3.332 1.00 0.00 H new ATOM 1467 N PRO A 88 23.331 -13.480 -3.849 1.00 0.00 N ATOM 1468 CA PRO A 88 22.204 -13.021 -4.667 1.00 0.00 C ATOM 1469 C PRO A 88 22.658 -12.384 -5.976 1.00 0.00 C ATOM 1470 O PRO A 88 22.009 -12.539 -7.010 1.00 0.00 O ATOM 1471 CB PRO A 88 21.520 -11.982 -3.775 1.00 0.00 C ATOM 1472 CG PRO A 88 22.596 -11.490 -2.871 1.00 0.00 C ATOM 1473 CD PRO A 88 23.508 -12.663 -2.637 1.00 0.00 C ATOM 0 HA PRO A 88 21.553 -13.844 -4.963 1.00 0.00 H new ATOM 0 HB2 PRO A 88 21.098 -11.169 -4.366 1.00 0.00 H new ATOM 0 HB3 PRO A 88 20.700 -12.424 -3.210 1.00 0.00 H new ATOM 0 HG2 PRO A 88 23.137 -10.659 -3.324 1.00 0.00 H new ATOM 0 HG3 PRO A 88 22.180 -11.125 -1.932 1.00 0.00 H new ATOM 0 HD2 PRO A 88 24.544 -12.348 -2.513 1.00 0.00 H new ATOM 0 HD3 PRO A 88 23.232 -13.213 -1.738 1.00 0.00 H new ATOM 1481 N ALA A 89 23.777 -11.669 -5.923 1.00 0.00 N ATOM 1482 CA ALA A 89 24.319 -11.011 -7.106 1.00 0.00 C ATOM 1483 C ALA A 89 25.336 -11.902 -7.812 1.00 0.00 C ATOM 1484 O ALA A 89 25.655 -11.687 -8.981 1.00 0.00 O ATOM 1485 CB ALA A 89 24.953 -9.681 -6.725 1.00 0.00 C ATOM 0 H ALA A 89 24.326 -11.531 -5.074 1.00 0.00 H new ATOM 0 HA ALA A 89 23.497 -10.825 -7.797 1.00 0.00 H new ATOM 0 HB1 ALA A 89 25.354 -9.200 -7.617 1.00 0.00 H new ATOM 0 HB2 ALA A 89 24.200 -9.036 -6.272 1.00 0.00 H new ATOM 0 HB3 ALA A 89 25.760 -9.853 -6.012 1.00 0.00 H new ATOM 1491 N GLN A 90 25.841 -12.900 -7.094 1.00 0.00 N ATOM 1492 CA GLN A 90 26.822 -13.821 -7.653 1.00 0.00 C ATOM 1493 C GLN A 90 26.152 -15.103 -8.136 1.00 0.00 C ATOM 1494 O GLN A 90 26.770 -15.918 -8.822 1.00 0.00 O ATOM 1495 CB GLN A 90 27.893 -14.153 -6.611 1.00 0.00 C ATOM 1496 CG GLN A 90 28.453 -12.929 -5.904 1.00 0.00 C ATOM 1497 CD GLN A 90 29.568 -13.274 -4.936 1.00 0.00 C ATOM 1498 OE1 GLN A 90 29.477 -12.991 -3.741 1.00 0.00 O ATOM 1499 NE2 GLN A 90 30.627 -13.889 -5.448 1.00 0.00 N ATOM 0 H GLN A 90 25.587 -13.091 -6.125 1.00 0.00 H new ATOM 0 HA GLN A 90 27.294 -13.335 -8.507 1.00 0.00 H new ATOM 0 HB2 GLN A 90 27.469 -14.829 -5.869 1.00 0.00 H new ATOM 0 HB3 GLN A 90 28.709 -14.686 -7.098 1.00 0.00 H new ATOM 0 HG2 GLN A 90 28.827 -12.224 -6.647 1.00 0.00 H new ATOM 0 HG3 GLN A 90 27.650 -12.427 -5.364 1.00 0.00 H new ATOM 0 HE21 GLN A 90 30.660 -14.104 -6.445 1.00 0.00 H new ATOM 0 HE22 GLN A 90 31.408 -14.147 -4.845 1.00 0.00 H new ATOM 1508 N TYR A 91 24.886 -15.276 -7.773 1.00 0.00 N ATOM 1509 CA TYR A 91 24.133 -16.460 -8.168 1.00 0.00 C ATOM 1510 C TYR A 91 24.277 -16.725 -9.663 1.00 0.00 C ATOM 1511 O TYR A 91 24.674 -17.815 -10.078 1.00 0.00 O ATOM 1512 CB TYR A 91 22.655 -16.294 -7.808 1.00 0.00 C ATOM 1513 CG TYR A 91 21.775 -17.404 -8.337 1.00 0.00 C ATOM 1514 CD1 TYR A 91 22.109 -18.737 -8.137 1.00 0.00 C ATOM 1515 CD2 TYR A 91 20.609 -17.118 -9.037 1.00 0.00 C ATOM 1516 CE1 TYR A 91 21.308 -19.755 -8.619 1.00 0.00 C ATOM 1517 CE2 TYR A 91 19.801 -18.129 -9.521 1.00 0.00 C ATOM 1518 CZ TYR A 91 20.155 -19.445 -9.310 1.00 0.00 C ATOM 1519 OH TYR A 91 19.354 -20.455 -9.791 1.00 0.00 O ATOM 0 H TYR A 91 24.360 -14.611 -7.206 1.00 0.00 H new ATOM 0 HA TYR A 91 24.539 -17.314 -7.626 1.00 0.00 H new ATOM 0 HB2 TYR A 91 22.557 -16.249 -6.723 1.00 0.00 H new ATOM 0 HB3 TYR A 91 22.299 -15.341 -8.200 1.00 0.00 H new ATOM 0 HD1 TYR A 91 23.010 -18.983 -7.595 1.00 0.00 H new ATOM 0 HD2 TYR A 91 20.330 -16.088 -9.205 1.00 0.00 H new ATOM 0 HE1 TYR A 91 21.583 -20.787 -8.456 1.00 0.00 H new ATOM 0 HE2 TYR A 91 18.897 -17.890 -10.062 1.00 0.00 H new ATOM 0 HH TYR A 91 18.581 -20.068 -10.253 1.00 0.00 H new ATOM 1529 N LEU A 92 23.952 -15.720 -10.469 1.00 0.00 N ATOM 1530 CA LEU A 92 24.046 -15.841 -11.920 1.00 0.00 C ATOM 1531 C LEU A 92 25.410 -15.376 -12.418 1.00 0.00 C ATOM 1532 O LEU A 92 25.998 -15.988 -13.310 1.00 0.00 O ATOM 1533 CB LEU A 92 22.940 -15.026 -12.592 1.00 0.00 C ATOM 1534 CG LEU A 92 23.109 -14.772 -14.090 1.00 0.00 C ATOM 1535 CD1 LEU A 92 21.896 -15.274 -14.857 1.00 0.00 C ATOM 1536 CD2 LEU A 92 23.336 -13.291 -14.358 1.00 0.00 C ATOM 0 H LEU A 92 23.621 -14.812 -10.142 1.00 0.00 H new ATOM 0 HA LEU A 92 23.924 -16.892 -12.181 1.00 0.00 H new ATOM 0 HB2 LEU A 92 21.992 -15.540 -12.436 1.00 0.00 H new ATOM 0 HB3 LEU A 92 22.868 -14.063 -12.086 1.00 0.00 H new ATOM 0 HG LEU A 92 23.985 -15.322 -14.435 1.00 0.00 H new ATOM 0 HD11 LEU A 92 22.035 -15.084 -15.921 1.00 0.00 H new ATOM 0 HD12 LEU A 92 21.778 -16.345 -14.691 1.00 0.00 H new ATOM 0 HD13 LEU A 92 21.004 -14.753 -14.509 1.00 0.00 H new ATOM 0 HD21 LEU A 92 23.454 -13.129 -15.429 1.00 0.00 H new ATOM 0 HD22 LEU A 92 22.480 -12.721 -13.997 1.00 0.00 H new ATOM 0 HD23 LEU A 92 24.236 -12.961 -13.840 1.00 0.00 H new