USER MOD reduce.3.24.130724 H: found=0, std=0, add=962, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 960 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 98 SER OG : rot 78:sc= 0.596 USER MOD Set 1.2: A 121 LYS NZ :NH3+ -119:sc= 0 (180deg=-0.159) USER MOD Set 2.1: A 62 ASN : amide:sc= -5.32! C(o=-16!,f=-7.3!) USER MOD Set 2.2: A 68 SER OG : rot 140:sc= -1.56! USER MOD Set 2.3: A 86 THR OG1 : rot 71:sc= -9.34! USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -0.0432 K(o=-0.043,f=-1.2) USER MOD Single : A 4 MET CE :methyl 142:sc= -0.129 (180deg=-0.863) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= 0.0484 USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 22 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot -114:sc= 0.295 USER MOD Single : A 29 CYS SG : rot -91:sc= -0.579! USER MOD Single : A 33 HIS : no HD1:sc= -8.75! C(o=-8.7!,f=-7.2!) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 14:sc= 1.11 USER MOD Single : A 42 MET CE :methyl 172:sc= 0 (180deg=-0.047) USER MOD Single : A 43 GLN : amide:sc= -0.0795 K(o=-0.079,f=-0.71) USER MOD Single : A 51 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.333) USER MOD Single : A 53 GLN : amide:sc= -1.11 K(o=-1.1,f=-0.33) USER MOD Single : A 69 TYR OH : rot -100:sc= -2.57! USER MOD Single : A 79 ASN : amide:sc= -6.64! C(o=-6.6!,f=-11!) USER MOD Single : A 88 TYR OH : rot 130:sc= -2.03! USER MOD Single : A 90 SER OG : rot 180:sc= -0.536 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot 158:sc= -4.82! USER MOD Single : A 97 TYR OH : rot 102:sc= 0.119 USER MOD Single : A 99 ASN : amide:sc= -3.36 K(o=-3.4,f=-0.62) USER MOD Single : A 104 THR OG1 : rot 180:sc= -0.213! USER MOD Single : A 105 LYS NZ :NH3+ -150:sc= 0.106! (180deg=-1.83!) USER MOD Single : A 110 SER OG : rot 37:sc= -5.23! USER MOD Single : A 118 GLN : amide:sc= -0.511 X(o=-0.51,f=-0.028) USER MOD Single : A 120 SER OG : rot 3:sc= 0.51 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 15.655 28.957 9.418 1.00 0.00 N ATOM 2 CA GLY A 1 15.140 27.700 8.802 1.00 0.00 C ATOM 3 C GLY A 1 13.807 27.325 9.452 1.00 0.00 C ATOM 4 O GLY A 1 13.751 26.510 10.350 1.00 0.00 O ATOM 0 H1 GLY A 1 16.561 29.214 8.977 1.00 0.00 H new ATOM 0 H2 GLY A 1 14.968 29.724 9.269 1.00 0.00 H new ATOM 0 H3 GLY A 1 15.795 28.812 10.438 1.00 0.00 H new ATOM 0 HA2 GLY A 1 15.008 27.835 7.728 1.00 0.00 H new ATOM 0 HA3 GLY A 1 15.862 26.894 8.936 1.00 0.00 H new ATOM 10 N SER A 2 12.734 27.918 9.006 1.00 0.00 N ATOM 11 CA SER A 2 11.403 27.601 9.599 1.00 0.00 C ATOM 12 C SER A 2 10.742 26.451 8.831 1.00 0.00 C ATOM 13 O SER A 2 11.408 25.586 8.300 1.00 0.00 O ATOM 14 CB SER A 2 10.590 28.886 9.448 1.00 0.00 C ATOM 15 OG SER A 2 11.366 29.989 9.899 1.00 0.00 O ATOM 0 H SER A 2 12.721 28.609 8.256 1.00 0.00 H new ATOM 0 HA SER A 2 11.477 27.285 10.639 1.00 0.00 H new ATOM 0 HB2 SER A 2 10.305 29.029 8.406 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.667 28.816 10.024 1.00 0.00 H new ATOM 0 HG SER A 2 10.848 30.815 9.802 1.00 0.00 H new ATOM 21 N HIS A 3 9.436 26.439 8.770 1.00 0.00 N ATOM 22 CA HIS A 3 8.727 25.348 8.036 1.00 0.00 C ATOM 23 C HIS A 3 9.117 23.977 8.598 1.00 0.00 C ATOM 24 O HIS A 3 10.265 23.582 8.563 1.00 0.00 O ATOM 25 CB HIS A 3 9.180 25.485 6.582 1.00 0.00 C ATOM 26 CG HIS A 3 8.557 26.713 5.980 1.00 0.00 C ATOM 27 ND1 HIS A 3 9.076 27.980 6.189 1.00 0.00 N ATOM 28 CD2 HIS A 3 7.457 26.884 5.176 1.00 0.00 C ATOM 29 CE1 HIS A 3 8.296 28.852 5.524 1.00 0.00 C ATOM 30 NE2 HIS A 3 7.294 28.237 4.889 1.00 0.00 N ATOM 0 H HIS A 3 8.829 27.138 9.197 1.00 0.00 H new ATOM 0 HA HIS A 3 7.644 25.427 8.134 1.00 0.00 H new ATOM 0 HB2 HIS A 3 10.267 25.553 6.533 1.00 0.00 H new ATOM 0 HB3 HIS A 3 8.890 24.601 6.014 1.00 0.00 H new ATOM 0 HD2 HIS A 3 6.816 26.091 4.821 1.00 0.00 H new ATOM 0 HE1 HIS A 3 8.460 29.919 5.506 1.00 0.00 H new ATOM 0 HE2 HIS A 3 6.566 28.666 4.317 1.00 0.00 H new ATOM 38 N MET A 4 8.166 23.247 9.117 1.00 0.00 N ATOM 39 CA MET A 4 8.477 21.901 9.682 1.00 0.00 C ATOM 40 C MET A 4 7.713 20.811 8.919 1.00 0.00 C ATOM 41 O MET A 4 6.554 20.968 8.587 1.00 0.00 O ATOM 42 CB MET A 4 8.010 21.972 11.138 1.00 0.00 C ATOM 43 CG MET A 4 8.278 20.634 11.830 1.00 0.00 C ATOM 44 SD MET A 4 7.591 20.678 13.505 1.00 0.00 S ATOM 45 CE MET A 4 5.849 20.542 13.037 1.00 0.00 C ATOM 0 H MET A 4 7.186 23.525 9.174 1.00 0.00 H new ATOM 0 HA MET A 4 9.535 21.652 9.603 1.00 0.00 H new ATOM 0 HB2 MET A 4 8.533 22.774 11.659 1.00 0.00 H new ATOM 0 HB3 MET A 4 6.946 22.207 11.178 1.00 0.00 H new ATOM 0 HG2 MET A 4 7.828 19.821 11.261 1.00 0.00 H new ATOM 0 HG3 MET A 4 9.350 20.440 11.869 1.00 0.00 H new ATOM 0 HE1 MET A 4 5.327 19.912 13.757 1.00 0.00 H new ATOM 0 HE2 MET A 4 5.396 21.534 13.027 1.00 0.00 H new ATOM 0 HE3 MET A 4 5.773 20.099 12.044 1.00 0.00 H new ATOM 55 N THR A 5 8.354 19.705 8.647 1.00 0.00 N ATOM 56 CA THR A 5 7.676 18.594 7.914 1.00 0.00 C ATOM 57 C THR A 5 7.889 17.282 8.670 1.00 0.00 C ATOM 58 O THR A 5 8.741 17.191 9.532 1.00 0.00 O ATOM 59 CB THR A 5 8.351 18.542 6.542 1.00 0.00 C ATOM 60 OG1 THR A 5 9.736 18.276 6.709 1.00 0.00 O ATOM 61 CG2 THR A 5 8.170 19.881 5.825 1.00 0.00 C ATOM 0 H THR A 5 9.324 19.522 8.903 1.00 0.00 H new ATOM 0 HA THR A 5 6.601 18.748 7.822 1.00 0.00 H new ATOM 0 HB THR A 5 7.896 17.752 5.945 1.00 0.00 H new ATOM 0 HG1 THR A 5 10.170 18.240 5.831 1.00 0.00 H new ATOM 0 HG21 THR A 5 8.652 19.839 4.848 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.107 20.084 5.696 1.00 0.00 H new ATOM 0 HG23 THR A 5 8.622 20.676 6.419 1.00 0.00 H new ATOM 69 N GLU A 6 7.123 16.268 8.374 1.00 0.00 N ATOM 70 CA GLU A 6 7.301 14.981 9.105 1.00 0.00 C ATOM 71 C GLU A 6 7.117 13.779 8.169 1.00 0.00 C ATOM 72 O GLU A 6 6.415 12.841 8.487 1.00 0.00 O ATOM 73 CB GLU A 6 6.221 15.004 10.184 1.00 0.00 C ATOM 74 CG GLU A 6 4.839 14.954 9.528 1.00 0.00 C ATOM 75 CD GLU A 6 3.933 14.008 10.318 1.00 0.00 C ATOM 76 OE1 GLU A 6 4.194 13.814 11.494 1.00 0.00 O ATOM 77 OE2 GLU A 6 2.992 13.495 9.735 1.00 0.00 O ATOM 0 H GLU A 6 6.389 16.273 7.666 1.00 0.00 H new ATOM 0 HA GLU A 6 8.303 14.880 9.522 1.00 0.00 H new ATOM 0 HB2 GLU A 6 6.346 14.155 10.856 1.00 0.00 H new ATOM 0 HB3 GLU A 6 6.315 15.906 10.788 1.00 0.00 H new ATOM 0 HG2 GLU A 6 4.403 15.952 9.498 1.00 0.00 H new ATOM 0 HG3 GLU A 6 4.927 14.614 8.496 1.00 0.00 H new ATOM 84 N ARG A 7 7.759 13.795 7.028 1.00 0.00 N ATOM 85 CA ARG A 7 7.644 12.647 6.073 1.00 0.00 C ATOM 86 C ARG A 7 6.216 12.095 6.058 1.00 0.00 C ATOM 87 O ARG A 7 5.901 11.148 6.750 1.00 0.00 O ATOM 88 CB ARG A 7 8.614 11.591 6.605 1.00 0.00 C ATOM 89 CG ARG A 7 9.912 12.264 7.054 1.00 0.00 C ATOM 90 CD ARG A 7 11.006 11.207 7.209 1.00 0.00 C ATOM 91 NE ARG A 7 12.050 11.861 8.042 1.00 0.00 N ATOM 92 CZ ARG A 7 12.813 12.783 7.523 1.00 0.00 C ATOM 93 NH1 ARG A 7 13.396 12.574 6.374 1.00 0.00 N ATOM 94 NH2 ARG A 7 12.990 13.913 8.150 1.00 0.00 N ATOM 0 H ARG A 7 8.361 14.556 6.714 1.00 0.00 H new ATOM 0 HA ARG A 7 7.876 12.945 5.051 1.00 0.00 H new ATOM 0 HB2 ARG A 7 8.162 11.056 7.440 1.00 0.00 H new ATOM 0 HB3 ARG A 7 8.824 10.853 5.831 1.00 0.00 H new ATOM 0 HG2 ARG A 7 10.217 13.014 6.324 1.00 0.00 H new ATOM 0 HG3 ARG A 7 9.757 12.784 7.999 1.00 0.00 H new ATOM 0 HD2 ARG A 7 10.622 10.308 7.690 1.00 0.00 H new ATOM 0 HD3 ARG A 7 11.404 10.905 6.240 1.00 0.00 H new ATOM 0 HE ARG A 7 12.169 11.589 9.018 1.00 0.00 H new ATOM 0 HH11 ARG A 7 13.255 11.691 5.884 1.00 0.00 H new ATOM 0 HH12 ARG A 7 13.993 13.294 5.967 1.00 0.00 H new ATOM 0 HH21 ARG A 7 12.532 14.076 9.047 1.00 0.00 H new ATOM 0 HH22 ARG A 7 13.587 14.634 7.744 1.00 0.00 H new ATOM 108 N ARG A 8 5.347 12.687 5.288 1.00 0.00 N ATOM 109 CA ARG A 8 3.938 12.200 5.249 1.00 0.00 C ATOM 110 C ARG A 8 3.667 11.313 4.022 1.00 0.00 C ATOM 111 O ARG A 8 2.634 10.681 3.933 1.00 0.00 O ATOM 112 CB ARG A 8 3.097 13.476 5.173 1.00 0.00 C ATOM 113 CG ARG A 8 1.619 13.110 5.043 1.00 0.00 C ATOM 114 CD ARG A 8 0.841 13.712 6.216 1.00 0.00 C ATOM 115 NE ARG A 8 -0.593 13.537 5.855 1.00 0.00 N ATOM 116 CZ ARG A 8 -1.341 14.582 5.631 1.00 0.00 C ATOM 117 NH1 ARG A 8 -1.647 15.386 6.611 1.00 0.00 N ATOM 118 NH2 ARG A 8 -1.786 14.822 4.428 1.00 0.00 N ATOM 0 H ARG A 8 5.549 13.485 4.685 1.00 0.00 H new ATOM 0 HA ARG A 8 3.707 11.583 6.117 1.00 0.00 H new ATOM 0 HB2 ARG A 8 3.255 14.081 6.066 1.00 0.00 H new ATOM 0 HB3 ARG A 8 3.409 14.079 4.320 1.00 0.00 H new ATOM 0 HG2 ARG A 8 1.222 13.484 4.099 1.00 0.00 H new ATOM 0 HG3 ARG A 8 1.501 12.026 5.032 1.00 0.00 H new ATOM 0 HD2 ARG A 8 1.078 13.203 7.150 1.00 0.00 H new ATOM 0 HD3 ARG A 8 1.088 14.765 6.355 1.00 0.00 H new ATOM 0 HE ARG A 8 -0.990 12.600 5.783 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -1.302 15.198 7.552 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -2.232 16.203 6.437 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -1.549 14.192 3.661 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -2.371 15.639 4.254 1.00 0.00 H new ATOM 132 N LEU A 9 4.553 11.275 3.063 1.00 0.00 N ATOM 133 CA LEU A 9 4.274 10.449 1.856 1.00 0.00 C ATOM 134 C LEU A 9 5.291 9.314 1.661 1.00 0.00 C ATOM 135 O LEU A 9 6.373 9.520 1.148 1.00 0.00 O ATOM 136 CB LEU A 9 4.352 11.432 0.683 1.00 0.00 C ATOM 137 CG LEU A 9 3.232 12.478 0.783 1.00 0.00 C ATOM 138 CD1 LEU A 9 1.934 11.819 1.258 1.00 0.00 C ATOM 139 CD2 LEU A 9 3.636 13.575 1.770 1.00 0.00 C ATOM 0 H LEU A 9 5.444 11.772 3.063 1.00 0.00 H new ATOM 0 HA LEU A 9 3.305 9.957 1.944 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.322 11.929 0.681 1.00 0.00 H new ATOM 0 HB3 LEU A 9 4.269 10.890 -0.259 1.00 0.00 H new ATOM 0 HG LEU A 9 3.071 12.915 -0.203 1.00 0.00 H new ATOM 0 HD11 LEU A 9 1.148 12.571 1.325 1.00 0.00 H new ATOM 0 HD12 LEU A 9 1.638 11.046 0.549 1.00 0.00 H new ATOM 0 HD13 LEU A 9 2.091 11.370 2.239 1.00 0.00 H new ATOM 0 HD21 LEU A 9 2.839 14.315 1.838 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.808 13.135 2.752 1.00 0.00 H new ATOM 0 HD23 LEU A 9 4.550 14.057 1.424 1.00 0.00 H new ATOM 151 N ARG A 10 4.932 8.108 2.032 1.00 0.00 N ATOM 152 CA ARG A 10 5.853 6.952 1.829 1.00 0.00 C ATOM 153 C ARG A 10 5.036 5.757 1.317 1.00 0.00 C ATOM 154 O ARG A 10 3.844 5.681 1.526 1.00 0.00 O ATOM 155 CB ARG A 10 6.448 6.660 3.208 1.00 0.00 C ATOM 156 CG ARG A 10 7.061 7.941 3.783 1.00 0.00 C ATOM 157 CD ARG A 10 5.950 8.830 4.353 1.00 0.00 C ATOM 158 NE ARG A 10 6.256 8.945 5.807 1.00 0.00 N ATOM 159 CZ ARG A 10 5.668 8.155 6.665 1.00 0.00 C ATOM 160 NH1 ARG A 10 4.366 8.117 6.735 1.00 0.00 N ATOM 161 NH2 ARG A 10 6.383 7.402 7.455 1.00 0.00 N ATOM 0 H ARG A 10 4.039 7.877 2.467 1.00 0.00 H new ATOM 0 HA ARG A 10 6.639 7.153 1.101 1.00 0.00 H new ATOM 0 HB2 ARG A 10 5.674 6.283 3.877 1.00 0.00 H new ATOM 0 HB3 ARG A 10 7.209 5.883 3.130 1.00 0.00 H new ATOM 0 HG2 ARG A 10 7.780 7.694 4.564 1.00 0.00 H new ATOM 0 HG3 ARG A 10 7.606 8.476 3.006 1.00 0.00 H new ATOM 0 HD2 ARG A 10 5.942 9.808 3.873 1.00 0.00 H new ATOM 0 HD3 ARG A 10 4.967 8.387 4.190 1.00 0.00 H new ATOM 0 HE ARG A 10 6.926 9.642 6.133 1.00 0.00 H new ATOM 0 HH11 ARG A 10 3.805 8.705 6.119 1.00 0.00 H new ATOM 0 HH12 ARG A 10 3.909 7.499 7.406 1.00 0.00 H new ATOM 0 HH21 ARG A 10 7.401 7.430 7.403 1.00 0.00 H new ATOM 0 HH22 ARG A 10 5.924 6.785 8.125 1.00 0.00 H new ATOM 175 N VAL A 11 5.632 4.827 0.631 1.00 0.00 N ATOM 176 CA VAL A 11 4.809 3.689 0.139 1.00 0.00 C ATOM 177 C VAL A 11 5.668 2.476 -0.226 1.00 0.00 C ATOM 178 O VAL A 11 6.396 2.481 -1.199 1.00 0.00 O ATOM 179 CB VAL A 11 4.070 4.237 -1.087 1.00 0.00 C ATOM 180 CG1 VAL A 11 5.012 4.298 -2.291 1.00 0.00 C ATOM 181 CG2 VAL A 11 2.887 3.324 -1.411 1.00 0.00 C ATOM 0 H VAL A 11 6.624 4.801 0.394 1.00 0.00 H new ATOM 0 HA VAL A 11 4.123 3.331 0.907 1.00 0.00 H new ATOM 0 HB VAL A 11 3.713 5.243 -0.868 1.00 0.00 H new ATOM 0 HG11 VAL A 11 4.474 4.689 -3.155 1.00 0.00 H new ATOM 0 HG12 VAL A 11 5.854 4.951 -2.062 1.00 0.00 H new ATOM 0 HG13 VAL A 11 5.380 3.297 -2.516 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.358 3.710 -2.282 1.00 0.00 H new ATOM 0 HG22 VAL A 11 3.251 2.319 -1.623 1.00 0.00 H new ATOM 0 HG23 VAL A 11 2.208 3.292 -0.559 1.00 0.00 H new ATOM 191 N LEU A 12 5.562 1.418 0.530 1.00 0.00 N ATOM 192 CA LEU A 12 6.335 0.194 0.200 1.00 0.00 C ATOM 193 C LEU A 12 5.359 -0.842 -0.362 1.00 0.00 C ATOM 194 O LEU A 12 4.751 -1.596 0.370 1.00 0.00 O ATOM 195 CB LEU A 12 6.937 -0.276 1.524 1.00 0.00 C ATOM 196 CG LEU A 12 7.563 0.907 2.270 1.00 0.00 C ATOM 197 CD1 LEU A 12 8.504 0.376 3.352 1.00 0.00 C ATOM 198 CD2 LEU A 12 8.356 1.781 1.292 1.00 0.00 C ATOM 0 H LEU A 12 4.974 1.351 1.360 1.00 0.00 H new ATOM 0 HA LEU A 12 7.119 0.358 -0.539 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.165 -0.736 2.140 1.00 0.00 H new ATOM 0 HB3 LEU A 12 7.693 -1.039 1.338 1.00 0.00 H new ATOM 0 HG LEU A 12 6.774 1.505 2.725 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.953 1.213 3.887 1.00 0.00 H new ATOM 0 HD12 LEU A 12 7.942 -0.242 4.052 1.00 0.00 H new ATOM 0 HD13 LEU A 12 9.289 -0.222 2.890 1.00 0.00 H new ATOM 0 HD21 LEU A 12 8.798 2.620 1.830 1.00 0.00 H new ATOM 0 HD22 LEU A 12 9.146 1.188 0.832 1.00 0.00 H new ATOM 0 HD23 LEU A 12 7.688 2.158 0.517 1.00 0.00 H new ATOM 210 N VAL A 13 5.184 -0.864 -1.654 1.00 0.00 N ATOM 211 CA VAL A 13 4.224 -1.828 -2.263 1.00 0.00 C ATOM 212 C VAL A 13 4.986 -2.994 -2.864 1.00 0.00 C ATOM 213 O VAL A 13 6.035 -2.821 -3.451 1.00 0.00 O ATOM 214 CB VAL A 13 3.508 -1.030 -3.351 1.00 0.00 C ATOM 215 CG1 VAL A 13 2.263 -1.787 -3.802 1.00 0.00 C ATOM 216 CG2 VAL A 13 3.096 0.334 -2.792 1.00 0.00 C ATOM 0 H VAL A 13 5.665 -0.255 -2.316 1.00 0.00 H new ATOM 0 HA VAL A 13 3.523 -2.243 -1.539 1.00 0.00 H new ATOM 0 HB VAL A 13 4.178 -0.891 -4.200 1.00 0.00 H new ATOM 0 HG11 VAL A 13 1.752 -1.217 -4.578 1.00 0.00 H new ATOM 0 HG12 VAL A 13 2.552 -2.761 -4.197 1.00 0.00 H new ATOM 0 HG13 VAL A 13 1.593 -1.925 -2.953 1.00 0.00 H new ATOM 0 HG21 VAL A 13 2.585 0.905 -3.567 1.00 0.00 H new ATOM 0 HG22 VAL A 13 2.426 0.192 -1.944 1.00 0.00 H new ATOM 0 HG23 VAL A 13 3.983 0.877 -2.467 1.00 0.00 H new ATOM 226 N VAL A 14 4.494 -4.187 -2.705 1.00 0.00 N ATOM 227 CA VAL A 14 5.239 -5.338 -3.256 1.00 0.00 C ATOM 228 C VAL A 14 4.304 -6.477 -3.694 1.00 0.00 C ATOM 229 O VAL A 14 3.272 -6.740 -3.101 1.00 0.00 O ATOM 230 CB VAL A 14 6.151 -5.788 -2.108 1.00 0.00 C ATOM 231 CG1 VAL A 14 6.725 -4.577 -1.369 1.00 0.00 C ATOM 232 CG2 VAL A 14 5.356 -6.640 -1.124 1.00 0.00 C ATOM 0 H VAL A 14 3.622 -4.410 -2.225 1.00 0.00 H new ATOM 0 HA VAL A 14 5.794 -5.064 -4.153 1.00 0.00 H new ATOM 0 HB VAL A 14 6.971 -6.370 -2.528 1.00 0.00 H new ATOM 0 HG11 VAL A 14 7.369 -4.917 -0.558 1.00 0.00 H new ATOM 0 HG12 VAL A 14 7.305 -3.969 -2.063 1.00 0.00 H new ATOM 0 HG13 VAL A 14 5.910 -3.981 -0.959 1.00 0.00 H new ATOM 0 HG21 VAL A 14 6.007 -6.958 -0.310 1.00 0.00 H new ATOM 0 HG22 VAL A 14 4.530 -6.055 -0.721 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.962 -7.517 -1.638 1.00 0.00 H new ATOM 242 N GLU A 15 4.704 -7.155 -4.732 1.00 0.00 N ATOM 243 CA GLU A 15 3.937 -8.311 -5.280 1.00 0.00 C ATOM 244 C GLU A 15 4.796 -8.949 -6.390 1.00 0.00 C ATOM 245 O GLU A 15 5.606 -8.284 -6.994 1.00 0.00 O ATOM 246 CB GLU A 15 2.618 -7.727 -5.825 1.00 0.00 C ATOM 247 CG GLU A 15 2.276 -8.360 -7.175 1.00 0.00 C ATOM 248 CD GLU A 15 2.065 -9.857 -6.977 1.00 0.00 C ATOM 249 OE1 GLU A 15 2.250 -10.318 -5.866 1.00 0.00 O ATOM 250 OE2 GLU A 15 1.732 -10.518 -7.932 1.00 0.00 O ATOM 0 H GLU A 15 5.563 -6.948 -5.242 1.00 0.00 H new ATOM 0 HA GLU A 15 3.712 -9.083 -4.544 1.00 0.00 H new ATOM 0 HB2 GLU A 15 1.811 -7.909 -5.115 1.00 0.00 H new ATOM 0 HB3 GLU A 15 2.708 -6.646 -5.935 1.00 0.00 H new ATOM 0 HG2 GLU A 15 1.377 -7.904 -7.589 1.00 0.00 H new ATOM 0 HG3 GLU A 15 3.080 -8.184 -7.889 1.00 0.00 H new ATOM 257 N ASP A 16 4.650 -10.228 -6.636 1.00 0.00 N ATOM 258 CA ASP A 16 5.482 -10.909 -7.687 1.00 0.00 C ATOM 259 C ASP A 16 5.334 -10.259 -9.077 1.00 0.00 C ATOM 260 O ASP A 16 5.025 -10.923 -10.045 1.00 0.00 O ATOM 261 CB ASP A 16 4.955 -12.346 -7.733 1.00 0.00 C ATOM 262 CG ASP A 16 3.465 -12.345 -8.111 1.00 0.00 C ATOM 263 OD1 ASP A 16 3.142 -11.886 -9.196 1.00 0.00 O ATOM 264 OD2 ASP A 16 2.667 -12.798 -7.307 1.00 0.00 O ATOM 0 H ASP A 16 3.988 -10.836 -6.154 1.00 0.00 H new ATOM 0 HA ASP A 16 6.541 -10.841 -7.439 1.00 0.00 H new ATOM 0 HB2 ASP A 16 5.523 -12.928 -8.459 1.00 0.00 H new ATOM 0 HB3 ASP A 16 5.093 -12.824 -6.763 1.00 0.00 H new ATOM 269 N GLU A 17 5.573 -8.984 -9.198 1.00 0.00 N ATOM 270 CA GLU A 17 5.455 -8.333 -10.534 1.00 0.00 C ATOM 271 C GLU A 17 6.354 -7.096 -10.611 1.00 0.00 C ATOM 272 O GLU A 17 6.650 -6.468 -9.615 1.00 0.00 O ATOM 273 CB GLU A 17 3.985 -7.925 -10.650 1.00 0.00 C ATOM 274 CG GLU A 17 3.127 -9.166 -10.891 1.00 0.00 C ATOM 275 CD GLU A 17 1.661 -8.755 -11.045 1.00 0.00 C ATOM 276 OE1 GLU A 17 1.344 -7.623 -10.717 1.00 0.00 O ATOM 277 OE2 GLU A 17 0.879 -9.582 -11.486 1.00 0.00 O ATOM 0 H GLU A 17 5.844 -8.365 -8.434 1.00 0.00 H new ATOM 0 HA GLU A 17 5.763 -9.000 -11.339 1.00 0.00 H new ATOM 0 HB2 GLU A 17 3.664 -7.420 -9.739 1.00 0.00 H new ATOM 0 HB3 GLU A 17 3.857 -7.217 -11.469 1.00 0.00 H new ATOM 0 HG2 GLU A 17 3.465 -9.686 -11.787 1.00 0.00 H new ATOM 0 HG3 GLU A 17 3.235 -9.862 -10.059 1.00 0.00 H new ATOM 284 N SER A 18 6.776 -6.733 -11.792 1.00 0.00 N ATOM 285 CA SER A 18 7.634 -5.522 -11.939 1.00 0.00 C ATOM 286 C SER A 18 6.762 -4.346 -12.376 1.00 0.00 C ATOM 287 O SER A 18 7.165 -3.202 -12.317 1.00 0.00 O ATOM 288 CB SER A 18 8.655 -5.873 -13.021 1.00 0.00 C ATOM 289 OG SER A 18 7.988 -6.480 -14.119 1.00 0.00 O ATOM 0 H SER A 18 6.564 -7.222 -12.661 1.00 0.00 H new ATOM 0 HA SER A 18 8.130 -5.240 -11.010 1.00 0.00 H new ATOM 0 HB2 SER A 18 9.177 -4.974 -13.350 1.00 0.00 H new ATOM 0 HB3 SER A 18 9.409 -6.550 -12.619 1.00 0.00 H new ATOM 0 HG SER A 18 8.641 -6.704 -14.815 1.00 0.00 H new ATOM 295 N MET A 19 5.559 -4.623 -12.801 1.00 0.00 N ATOM 296 CA MET A 19 4.651 -3.526 -13.225 1.00 0.00 C ATOM 297 C MET A 19 4.219 -2.723 -11.997 1.00 0.00 C ATOM 298 O MET A 19 3.730 -1.615 -12.106 1.00 0.00 O ATOM 299 CB MET A 19 3.451 -4.224 -13.869 1.00 0.00 C ATOM 300 CG MET A 19 2.831 -3.304 -14.923 1.00 0.00 C ATOM 301 SD MET A 19 3.269 -3.899 -16.577 1.00 0.00 S ATOM 302 CE MET A 19 1.643 -4.562 -17.017 1.00 0.00 C ATOM 0 H MET A 19 5.168 -5.563 -12.872 1.00 0.00 H new ATOM 0 HA MET A 19 5.124 -2.831 -13.918 1.00 0.00 H new ATOM 0 HB2 MET A 19 3.765 -5.161 -14.328 1.00 0.00 H new ATOM 0 HB3 MET A 19 2.711 -4.474 -13.109 1.00 0.00 H new ATOM 0 HG2 MET A 19 1.747 -3.281 -14.808 1.00 0.00 H new ATOM 0 HG3 MET A 19 3.188 -2.283 -14.786 1.00 0.00 H new ATOM 0 HE1 MET A 19 1.683 -4.988 -18.020 1.00 0.00 H new ATOM 0 HE2 MET A 19 1.361 -5.337 -16.304 1.00 0.00 H new ATOM 0 HE3 MET A 19 0.905 -3.761 -16.992 1.00 0.00 H new ATOM 312 N ILE A 20 4.413 -3.267 -10.822 1.00 0.00 N ATOM 313 CA ILE A 20 4.029 -2.521 -9.590 1.00 0.00 C ATOM 314 C ILE A 20 5.122 -1.516 -9.255 1.00 0.00 C ATOM 315 O ILE A 20 4.920 -0.577 -8.511 1.00 0.00 O ATOM 316 CB ILE A 20 3.913 -3.570 -8.483 1.00 0.00 C ATOM 317 CG1 ILE A 20 3.778 -2.862 -7.133 1.00 0.00 C ATOM 318 CG2 ILE A 20 5.153 -4.465 -8.467 1.00 0.00 C ATOM 319 CD1 ILE A 20 2.690 -3.550 -6.308 1.00 0.00 C ATOM 0 H ILE A 20 4.818 -4.190 -10.665 1.00 0.00 H new ATOM 0 HA ILE A 20 3.094 -1.974 -9.712 1.00 0.00 H new ATOM 0 HB ILE A 20 3.035 -4.189 -8.669 1.00 0.00 H new ATOM 0 HG12 ILE A 20 4.728 -2.889 -6.599 1.00 0.00 H new ATOM 0 HG13 ILE A 20 3.527 -1.812 -7.284 1.00 0.00 H new ATOM 0 HG21 ILE A 20 5.056 -5.207 -7.674 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.249 -4.971 -9.428 1.00 0.00 H new ATOM 0 HG23 ILE A 20 6.039 -3.856 -8.288 1.00 0.00 H new ATOM 0 HD11 ILE A 20 2.591 -3.048 -5.345 1.00 0.00 H new ATOM 0 HD12 ILE A 20 1.741 -3.500 -6.843 1.00 0.00 H new ATOM 0 HD13 ILE A 20 2.961 -4.594 -6.147 1.00 0.00 H new ATOM 331 N ALA A 21 6.281 -1.710 -9.810 1.00 0.00 N ATOM 332 CA ALA A 21 7.399 -0.774 -9.543 1.00 0.00 C ATOM 333 C ALA A 21 7.170 0.525 -10.309 1.00 0.00 C ATOM 334 O ALA A 21 6.942 1.572 -9.730 1.00 0.00 O ATOM 335 CB ALA A 21 8.636 -1.505 -10.053 1.00 0.00 C ATOM 0 H ALA A 21 6.502 -2.481 -10.440 1.00 0.00 H new ATOM 0 HA ALA A 21 7.495 -0.506 -8.491 1.00 0.00 H new ATOM 0 HB1 ALA A 21 9.517 -0.883 -9.895 1.00 0.00 H new ATOM 0 HB2 ALA A 21 8.753 -2.444 -9.512 1.00 0.00 H new ATOM 0 HB3 ALA A 21 8.524 -1.712 -11.117 1.00 0.00 H new ATOM 341 N MET A 22 7.209 0.470 -11.609 1.00 0.00 N ATOM 342 CA MET A 22 6.971 1.711 -12.391 1.00 0.00 C ATOM 343 C MET A 22 5.612 2.284 -11.994 1.00 0.00 C ATOM 344 O MET A 22 5.364 3.467 -12.107 1.00 0.00 O ATOM 345 CB MET A 22 6.984 1.282 -13.859 1.00 0.00 C ATOM 346 CG MET A 22 6.458 2.423 -14.732 1.00 0.00 C ATOM 347 SD MET A 22 6.009 1.772 -16.358 1.00 0.00 S ATOM 348 CE MET A 22 6.816 3.056 -17.345 1.00 0.00 C ATOM 0 H MET A 22 7.393 -0.370 -12.158 1.00 0.00 H new ATOM 0 HA MET A 22 7.721 2.481 -12.210 1.00 0.00 H new ATOM 0 HB2 MET A 22 7.997 1.016 -14.162 1.00 0.00 H new ATOM 0 HB3 MET A 22 6.367 0.393 -13.994 1.00 0.00 H new ATOM 0 HG2 MET A 22 5.591 2.887 -14.261 1.00 0.00 H new ATOM 0 HG3 MET A 22 7.218 3.198 -14.835 1.00 0.00 H new ATOM 0 HE1 MET A 22 6.664 2.850 -18.404 1.00 0.00 H new ATOM 0 HE2 MET A 22 6.387 4.027 -17.099 1.00 0.00 H new ATOM 0 HE3 MET A 22 7.884 3.065 -17.127 1.00 0.00 H new ATOM 358 N LEU A 23 4.743 1.445 -11.500 1.00 0.00 N ATOM 359 CA LEU A 23 3.408 1.921 -11.055 1.00 0.00 C ATOM 360 C LEU A 23 3.576 2.723 -9.760 1.00 0.00 C ATOM 361 O LEU A 23 2.638 3.293 -9.241 1.00 0.00 O ATOM 362 CB LEU A 23 2.601 0.632 -10.826 1.00 0.00 C ATOM 363 CG LEU A 23 1.371 0.878 -9.934 1.00 0.00 C ATOM 364 CD1 LEU A 23 1.800 1.006 -8.470 1.00 0.00 C ATOM 365 CD2 LEU A 23 0.633 2.151 -10.367 1.00 0.00 C ATOM 0 H LEU A 23 4.904 0.444 -11.386 1.00 0.00 H new ATOM 0 HA LEU A 23 2.910 2.575 -11.770 1.00 0.00 H new ATOM 0 HB2 LEU A 23 2.279 0.230 -11.786 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.241 -0.120 -10.364 1.00 0.00 H new ATOM 0 HG LEU A 23 0.697 0.028 -10.040 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.922 1.180 -7.848 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.293 0.087 -8.154 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.491 1.843 -8.365 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -0.233 2.306 -9.724 1.00 0.00 H new ATOM 0 HD22 LEU A 23 1.304 3.006 -10.285 1.00 0.00 H new ATOM 0 HD23 LEU A 23 0.303 2.046 -11.401 1.00 0.00 H new ATOM 377 N ILE A 24 4.777 2.773 -9.236 1.00 0.00 N ATOM 378 CA ILE A 24 5.010 3.537 -7.979 1.00 0.00 C ATOM 379 C ILE A 24 5.607 4.912 -8.291 1.00 0.00 C ATOM 380 O ILE A 24 5.128 5.926 -7.825 1.00 0.00 O ATOM 381 CB ILE A 24 5.979 2.671 -7.150 1.00 0.00 C ATOM 382 CG1 ILE A 24 5.604 2.798 -5.672 1.00 0.00 C ATOM 383 CG2 ILE A 24 7.437 3.118 -7.331 1.00 0.00 C ATOM 384 CD1 ILE A 24 6.002 1.524 -4.924 1.00 0.00 C ATOM 0 H ILE A 24 5.602 2.317 -9.626 1.00 0.00 H new ATOM 0 HA ILE A 24 4.086 3.726 -7.432 1.00 0.00 H new ATOM 0 HB ILE A 24 5.896 1.639 -7.492 1.00 0.00 H new ATOM 0 HG12 ILE A 24 6.106 3.660 -5.233 1.00 0.00 H new ATOM 0 HG13 ILE A 24 4.532 2.969 -5.573 1.00 0.00 H new ATOM 0 HG21 ILE A 24 8.089 2.484 -6.731 1.00 0.00 H new ATOM 0 HG22 ILE A 24 7.716 3.034 -8.381 1.00 0.00 H new ATOM 0 HG23 ILE A 24 7.543 4.154 -7.009 1.00 0.00 H new ATOM 0 HD11 ILE A 24 5.733 1.620 -3.872 1.00 0.00 H new ATOM 0 HD12 ILE A 24 5.480 0.670 -5.356 1.00 0.00 H new ATOM 0 HD13 ILE A 24 7.078 1.372 -5.010 1.00 0.00 H new ATOM 396 N GLU A 25 6.653 4.958 -9.070 1.00 0.00 N ATOM 397 CA GLU A 25 7.269 6.275 -9.392 1.00 0.00 C ATOM 398 C GLU A 25 6.238 7.180 -10.072 1.00 0.00 C ATOM 399 O GLU A 25 6.289 8.389 -9.954 1.00 0.00 O ATOM 400 CB GLU A 25 8.437 5.958 -10.325 1.00 0.00 C ATOM 401 CG GLU A 25 9.651 5.531 -9.489 1.00 0.00 C ATOM 402 CD GLU A 25 10.832 6.459 -9.790 1.00 0.00 C ATOM 403 OE1 GLU A 25 10.945 7.477 -9.127 1.00 0.00 O ATOM 404 OE2 GLU A 25 11.607 6.132 -10.674 1.00 0.00 O ATOM 0 H GLU A 25 7.104 4.147 -9.494 1.00 0.00 H new ATOM 0 HA GLU A 25 7.611 6.806 -8.503 1.00 0.00 H new ATOM 0 HB2 GLU A 25 8.159 5.163 -11.017 1.00 0.00 H new ATOM 0 HB3 GLU A 25 8.685 6.832 -10.927 1.00 0.00 H new ATOM 0 HG2 GLU A 25 9.406 5.569 -8.428 1.00 0.00 H new ATOM 0 HG3 GLU A 25 9.918 4.499 -9.717 1.00 0.00 H new ATOM 411 N ASP A 26 5.286 6.610 -10.764 1.00 0.00 N ATOM 412 CA ASP A 26 4.249 7.455 -11.420 1.00 0.00 C ATOM 413 C ASP A 26 3.269 7.959 -10.357 1.00 0.00 C ATOM 414 O ASP A 26 2.961 9.129 -10.293 1.00 0.00 O ATOM 415 CB ASP A 26 3.560 6.543 -12.443 1.00 0.00 C ATOM 416 CG ASP A 26 2.518 5.666 -11.747 1.00 0.00 C ATOM 417 OD1 ASP A 26 2.875 5.014 -10.781 1.00 0.00 O ATOM 418 OD2 ASP A 26 1.382 5.661 -12.193 1.00 0.00 O ATOM 0 H ASP A 26 5.183 5.605 -10.902 1.00 0.00 H new ATOM 0 HA ASP A 26 4.664 8.334 -11.914 1.00 0.00 H new ATOM 0 HB2 ASP A 26 3.082 7.146 -13.215 1.00 0.00 H new ATOM 0 HB3 ASP A 26 4.301 5.916 -12.940 1.00 0.00 H new ATOM 423 N THR A 27 2.800 7.096 -9.499 1.00 0.00 N ATOM 424 CA THR A 27 1.875 7.556 -8.430 1.00 0.00 C ATOM 425 C THR A 27 2.637 8.513 -7.517 1.00 0.00 C ATOM 426 O THR A 27 2.109 9.498 -7.029 1.00 0.00 O ATOM 427 CB THR A 27 1.468 6.289 -7.680 1.00 0.00 C ATOM 428 OG1 THR A 27 2.543 5.359 -7.707 1.00 0.00 O ATOM 429 CG2 THR A 27 0.242 5.677 -8.356 1.00 0.00 C ATOM 0 H THR A 27 3.016 6.099 -9.493 1.00 0.00 H new ATOM 0 HA THR A 27 0.998 8.081 -8.809 1.00 0.00 H new ATOM 0 HB THR A 27 1.229 6.534 -6.645 1.00 0.00 H new ATOM 0 HG1 THR A 27 2.282 4.573 -8.231 1.00 0.00 H new ATOM 0 HG21 THR A 27 -0.053 4.772 -7.825 1.00 0.00 H new ATOM 0 HG22 THR A 27 -0.580 6.393 -8.337 1.00 0.00 H new ATOM 0 HG23 THR A 27 0.483 5.429 -9.390 1.00 0.00 H new ATOM 437 N LEU A 28 3.894 8.234 -7.309 1.00 0.00 N ATOM 438 CA LEU A 28 4.727 9.119 -6.459 1.00 0.00 C ATOM 439 C LEU A 28 4.834 10.493 -7.131 1.00 0.00 C ATOM 440 O LEU A 28 5.086 11.490 -6.486 1.00 0.00 O ATOM 441 CB LEU A 28 6.089 8.406 -6.378 1.00 0.00 C ATOM 442 CG LEU A 28 7.231 9.429 -6.344 1.00 0.00 C ATOM 443 CD1 LEU A 28 8.484 8.773 -5.762 1.00 0.00 C ATOM 444 CD2 LEU A 28 7.525 9.919 -7.766 1.00 0.00 C ATOM 0 H LEU A 28 4.380 7.425 -7.696 1.00 0.00 H new ATOM 0 HA LEU A 28 4.319 9.289 -5.463 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.126 7.781 -5.486 1.00 0.00 H new ATOM 0 HB3 LEU A 28 6.211 7.744 -7.236 1.00 0.00 H new ATOM 0 HG LEU A 28 6.940 10.276 -5.723 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.297 9.499 -5.737 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.276 8.426 -4.750 1.00 0.00 H new ATOM 0 HD13 LEU A 28 8.773 7.926 -6.384 1.00 0.00 H new ATOM 0 HD21 LEU A 28 8.337 10.646 -7.740 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.815 9.073 -8.390 1.00 0.00 H new ATOM 0 HD23 LEU A 28 6.632 10.387 -8.181 1.00 0.00 H new ATOM 456 N CYS A 29 4.631 10.554 -8.422 1.00 0.00 N ATOM 457 CA CYS A 29 4.708 11.869 -9.115 1.00 0.00 C ATOM 458 C CYS A 29 3.640 12.801 -8.534 1.00 0.00 C ATOM 459 O CYS A 29 3.764 14.009 -8.560 1.00 0.00 O ATOM 460 CB CYS A 29 4.463 11.564 -10.609 1.00 0.00 C ATOM 461 SG CYS A 29 2.706 11.732 -11.041 1.00 0.00 S ATOM 0 H CYS A 29 4.417 9.756 -9.020 1.00 0.00 H new ATOM 0 HA CYS A 29 5.668 12.369 -8.985 1.00 0.00 H new ATOM 0 HB2 CYS A 29 5.056 12.242 -11.222 1.00 0.00 H new ATOM 0 HB3 CYS A 29 4.800 10.552 -10.835 1.00 0.00 H new ATOM 0 HG CYS A 29 2.111 10.586 -10.892 1.00 0.00 H new ATOM 467 N GLU A 30 2.587 12.231 -8.009 1.00 0.00 N ATOM 468 CA GLU A 30 1.498 13.051 -7.420 1.00 0.00 C ATOM 469 C GLU A 30 1.837 13.428 -5.977 1.00 0.00 C ATOM 470 O GLU A 30 1.825 14.587 -5.610 1.00 0.00 O ATOM 471 CB GLU A 30 0.263 12.150 -7.459 1.00 0.00 C ATOM 472 CG GLU A 30 -0.981 12.974 -7.123 1.00 0.00 C ATOM 473 CD GLU A 30 -2.012 12.823 -8.243 1.00 0.00 C ATOM 474 OE1 GLU A 30 -1.699 13.185 -9.365 1.00 0.00 O ATOM 475 OE2 GLU A 30 -3.100 12.348 -7.958 1.00 0.00 O ATOM 0 H GLU A 30 2.438 11.223 -7.965 1.00 0.00 H new ATOM 0 HA GLU A 30 1.344 13.983 -7.963 1.00 0.00 H new ATOM 0 HB2 GLU A 30 0.159 11.701 -8.447 1.00 0.00 H new ATOM 0 HB3 GLU A 30 0.374 11.332 -6.747 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -1.406 12.641 -6.176 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -0.713 14.023 -7.000 1.00 0.00 H new ATOM 482 N LEU A 31 2.133 12.460 -5.151 1.00 0.00 N ATOM 483 CA LEU A 31 2.464 12.778 -3.729 1.00 0.00 C ATOM 484 C LEU A 31 3.934 13.168 -3.589 1.00 0.00 C ATOM 485 O LEU A 31 4.287 14.040 -2.819 1.00 0.00 O ATOM 486 CB LEU A 31 2.226 11.484 -2.950 1.00 0.00 C ATOM 487 CG LEU A 31 0.847 10.913 -3.268 1.00 0.00 C ATOM 488 CD1 LEU A 31 1.014 9.575 -3.989 1.00 0.00 C ATOM 489 CD2 LEU A 31 0.086 10.692 -1.958 1.00 0.00 C ATOM 0 H LEU A 31 2.160 11.470 -5.395 1.00 0.00 H new ATOM 0 HA LEU A 31 1.859 13.609 -3.367 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.995 10.754 -3.203 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.308 11.676 -1.880 1.00 0.00 H new ATOM 0 HG LEU A 31 0.294 11.605 -3.903 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.032 9.161 -4.219 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.570 9.727 -4.914 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.559 8.882 -3.348 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -0.901 10.284 -2.175 1.00 0.00 H new ATOM 0 HD22 LEU A 31 0.638 9.992 -1.330 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.021 11.642 -1.435 1.00 0.00 H new ATOM 501 N GLY A 32 4.798 12.503 -4.301 1.00 0.00 N ATOM 502 CA GLY A 32 6.250 12.803 -4.179 1.00 0.00 C ATOM 503 C GLY A 32 6.830 11.859 -3.127 1.00 0.00 C ATOM 504 O GLY A 32 7.739 12.197 -2.395 1.00 0.00 O ATOM 0 H GLY A 32 4.561 11.764 -4.963 1.00 0.00 H new ATOM 0 HA2 GLY A 32 6.752 12.664 -5.137 1.00 0.00 H new ATOM 0 HA3 GLY A 32 6.403 13.842 -3.887 1.00 0.00 H new ATOM 508 N HIS A 33 6.281 10.674 -3.050 1.00 0.00 N ATOM 509 CA HIS A 33 6.749 9.670 -2.051 1.00 0.00 C ATOM 510 C HIS A 33 8.264 9.760 -1.846 1.00 0.00 C ATOM 511 O HIS A 33 8.989 10.244 -2.692 1.00 0.00 O ATOM 512 CB HIS A 33 6.364 8.320 -2.658 1.00 0.00 C ATOM 513 CG HIS A 33 4.904 8.056 -2.407 1.00 0.00 C ATOM 514 ND1 HIS A 33 4.015 7.773 -3.433 1.00 0.00 N ATOM 515 CD2 HIS A 33 4.161 8.033 -1.253 1.00 0.00 C ATOM 516 CE1 HIS A 33 2.801 7.594 -2.882 1.00 0.00 C ATOM 517 NE2 HIS A 33 2.834 7.741 -1.554 1.00 0.00 N ATOM 0 H HIS A 33 5.517 10.356 -3.646 1.00 0.00 H new ATOM 0 HA HIS A 33 6.303 9.829 -1.069 1.00 0.00 H new ATOM 0 HB2 HIS A 33 6.566 8.320 -3.729 1.00 0.00 H new ATOM 0 HB3 HIS A 33 6.969 7.526 -2.220 1.00 0.00 H new ATOM 0 HD2 HIS A 33 4.548 8.214 -0.261 1.00 0.00 H new ATOM 0 HE1 HIS A 33 1.909 7.360 -3.444 1.00 0.00 H new ATOM 0 HE2 HIS A 33 2.054 7.657 -0.902 1.00 0.00 H new ATOM 525 N GLU A 34 8.742 9.297 -0.723 1.00 0.00 N ATOM 526 CA GLU A 34 10.207 9.352 -0.451 1.00 0.00 C ATOM 527 C GLU A 34 10.801 7.943 -0.481 1.00 0.00 C ATOM 528 O GLU A 34 11.950 7.750 -0.823 1.00 0.00 O ATOM 529 CB GLU A 34 10.325 9.948 0.951 1.00 0.00 C ATOM 530 CG GLU A 34 11.452 10.981 0.975 1.00 0.00 C ATOM 531 CD GLU A 34 10.865 12.365 1.252 1.00 0.00 C ATOM 532 OE1 GLU A 34 10.497 12.613 2.388 1.00 0.00 O ATOM 533 OE2 GLU A 34 10.793 13.154 0.324 1.00 0.00 O ATOM 0 H GLU A 34 8.180 8.882 0.020 1.00 0.00 H new ATOM 0 HA GLU A 34 10.744 9.942 -1.194 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.383 10.415 1.239 1.00 0.00 H new ATOM 0 HB3 GLU A 34 10.525 9.160 1.677 1.00 0.00 H new ATOM 0 HG2 GLU A 34 12.181 10.723 1.743 1.00 0.00 H new ATOM 0 HG3 GLU A 34 11.980 10.982 0.021 1.00 0.00 H new ATOM 540 N VAL A 35 10.025 6.958 -0.123 1.00 0.00 N ATOM 541 CA VAL A 35 10.544 5.560 -0.128 1.00 0.00 C ATOM 542 C VAL A 35 9.560 4.637 -0.848 1.00 0.00 C ATOM 543 O VAL A 35 8.589 4.186 -0.273 1.00 0.00 O ATOM 544 CB VAL A 35 10.652 5.168 1.344 1.00 0.00 C ATOM 545 CG1 VAL A 35 11.522 3.919 1.474 1.00 0.00 C ATOM 546 CG2 VAL A 35 11.287 6.312 2.137 1.00 0.00 C ATOM 0 H VAL A 35 9.054 7.060 0.173 1.00 0.00 H new ATOM 0 HA VAL A 35 11.501 5.480 -0.644 1.00 0.00 H new ATOM 0 HB VAL A 35 9.656 4.964 1.737 1.00 0.00 H new ATOM 0 HG11 VAL A 35 11.600 3.638 2.524 1.00 0.00 H new ATOM 0 HG12 VAL A 35 11.071 3.101 0.912 1.00 0.00 H new ATOM 0 HG13 VAL A 35 12.517 4.126 1.079 1.00 0.00 H new ATOM 0 HG21 VAL A 35 11.363 6.029 3.187 1.00 0.00 H new ATOM 0 HG22 VAL A 35 12.283 6.518 1.744 1.00 0.00 H new ATOM 0 HG23 VAL A 35 10.669 7.205 2.046 1.00 0.00 H new ATOM 556 N ALA A 36 9.796 4.353 -2.099 1.00 0.00 N ATOM 557 CA ALA A 36 8.870 3.466 -2.841 1.00 0.00 C ATOM 558 C ALA A 36 9.435 2.045 -2.929 1.00 0.00 C ATOM 559 O ALA A 36 10.611 1.847 -3.157 1.00 0.00 O ATOM 560 CB ALA A 36 8.765 4.088 -4.234 1.00 0.00 C ATOM 0 H ALA A 36 10.591 4.699 -2.636 1.00 0.00 H new ATOM 0 HA ALA A 36 7.900 3.384 -2.351 1.00 0.00 H new ATOM 0 HB1 ALA A 36 8.094 3.489 -4.850 1.00 0.00 H new ATOM 0 HB2 ALA A 36 8.373 5.102 -4.151 1.00 0.00 H new ATOM 0 HB3 ALA A 36 9.752 4.117 -4.695 1.00 0.00 H new ATOM 566 N ALA A 37 8.599 1.056 -2.768 1.00 0.00 N ATOM 567 CA ALA A 37 9.077 -0.353 -2.863 1.00 0.00 C ATOM 568 C ALA A 37 8.304 -1.059 -3.977 1.00 0.00 C ATOM 569 O ALA A 37 7.158 -0.750 -4.237 1.00 0.00 O ATOM 570 CB ALA A 37 8.778 -0.985 -1.504 1.00 0.00 C ATOM 0 H ALA A 37 7.603 1.163 -2.574 1.00 0.00 H new ATOM 0 HA ALA A 37 10.139 -0.425 -3.096 1.00 0.00 H new ATOM 0 HB1 ALA A 37 9.106 -2.025 -1.506 1.00 0.00 H new ATOM 0 HB2 ALA A 37 9.309 -0.439 -0.724 1.00 0.00 H new ATOM 0 HB3 ALA A 37 7.706 -0.943 -1.311 1.00 0.00 H new ATOM 576 N THR A 38 8.931 -1.977 -4.659 1.00 0.00 N ATOM 577 CA THR A 38 8.235 -2.666 -5.788 1.00 0.00 C ATOM 578 C THR A 38 8.471 -4.179 -5.759 1.00 0.00 C ATOM 579 O THR A 38 9.331 -4.673 -5.059 1.00 0.00 O ATOM 580 CB THR A 38 8.853 -2.058 -7.050 1.00 0.00 C ATOM 581 OG1 THR A 38 10.101 -2.685 -7.308 1.00 0.00 O ATOM 582 CG2 THR A 38 9.073 -0.556 -6.855 1.00 0.00 C ATOM 0 H THR A 38 9.890 -2.280 -4.487 1.00 0.00 H new ATOM 0 HA THR A 38 7.155 -2.529 -5.735 1.00 0.00 H new ATOM 0 HB THR A 38 8.177 -2.214 -7.891 1.00 0.00 H new ATOM 0 HG1 THR A 38 10.500 -2.300 -8.116 1.00 0.00 H new ATOM 0 HG21 THR A 38 9.513 -0.132 -7.758 1.00 0.00 H new ATOM 0 HG22 THR A 38 8.117 -0.071 -6.655 1.00 0.00 H new ATOM 0 HG23 THR A 38 9.746 -0.393 -6.013 1.00 0.00 H new ATOM 590 N ALA A 39 7.691 -4.907 -6.523 1.00 0.00 N ATOM 591 CA ALA A 39 7.815 -6.396 -6.564 1.00 0.00 C ATOM 592 C ALA A 39 7.720 -6.957 -5.154 1.00 0.00 C ATOM 593 O ALA A 39 7.986 -6.279 -4.197 1.00 0.00 O ATOM 594 CB ALA A 39 9.182 -6.701 -7.159 1.00 0.00 C ATOM 0 H ALA A 39 6.964 -4.525 -7.128 1.00 0.00 H new ATOM 0 HA ALA A 39 7.020 -6.846 -7.159 1.00 0.00 H new ATOM 0 HB1 ALA A 39 9.323 -7.781 -7.211 1.00 0.00 H new ATOM 0 HB2 ALA A 39 9.245 -6.278 -8.162 1.00 0.00 H new ATOM 0 HB3 ALA A 39 9.958 -6.263 -6.531 1.00 0.00 H new ATOM 600 N SER A 40 7.318 -8.181 -5.011 1.00 0.00 N ATOM 601 CA SER A 40 7.201 -8.750 -3.640 1.00 0.00 C ATOM 602 C SER A 40 8.589 -9.087 -3.098 1.00 0.00 C ATOM 603 O SER A 40 9.290 -9.923 -3.634 1.00 0.00 O ATOM 604 CB SER A 40 6.356 -10.007 -3.788 1.00 0.00 C ATOM 605 OG SER A 40 7.092 -10.994 -4.497 1.00 0.00 O ATOM 0 H SER A 40 7.066 -8.811 -5.773 1.00 0.00 H new ATOM 0 HA SER A 40 6.745 -8.049 -2.940 1.00 0.00 H new ATOM 0 HB2 SER A 40 6.073 -10.385 -2.806 1.00 0.00 H new ATOM 0 HB3 SER A 40 5.432 -9.776 -4.319 1.00 0.00 H new ATOM 0 HG SER A 40 8.036 -10.734 -4.535 1.00 0.00 H new ATOM 611 N ARG A 41 9.003 -8.432 -2.046 1.00 0.00 N ATOM 612 CA ARG A 41 10.350 -8.707 -1.492 1.00 0.00 C ATOM 613 C ARG A 41 10.288 -8.795 0.036 1.00 0.00 C ATOM 614 O ARG A 41 9.949 -7.843 0.711 1.00 0.00 O ATOM 615 CB ARG A 41 11.199 -7.515 -1.934 1.00 0.00 C ATOM 616 CG ARG A 41 12.641 -7.970 -2.167 1.00 0.00 C ATOM 617 CD ARG A 41 12.667 -9.053 -3.252 1.00 0.00 C ATOM 618 NE ARG A 41 13.244 -8.386 -4.451 1.00 0.00 N ATOM 619 CZ ARG A 41 12.732 -8.614 -5.631 1.00 0.00 C ATOM 620 NH1 ARG A 41 12.847 -9.795 -6.176 1.00 0.00 N ATOM 621 NH2 ARG A 41 12.107 -7.662 -6.268 1.00 0.00 N ATOM 0 H ARG A 41 8.464 -7.721 -1.551 1.00 0.00 H new ATOM 0 HA ARG A 41 10.761 -9.654 -1.841 1.00 0.00 H new ATOM 0 HB2 ARG A 41 10.791 -7.084 -2.848 1.00 0.00 H new ATOM 0 HB3 ARG A 41 11.172 -6.734 -1.174 1.00 0.00 H new ATOM 0 HG2 ARG A 41 13.256 -7.123 -2.469 1.00 0.00 H new ATOM 0 HG3 ARG A 41 13.065 -8.358 -1.241 1.00 0.00 H new ATOM 0 HD2 ARG A 41 13.274 -9.905 -2.944 1.00 0.00 H new ATOM 0 HD3 ARG A 41 11.665 -9.432 -3.455 1.00 0.00 H new ATOM 0 HE ARG A 41 14.037 -7.752 -4.352 1.00 0.00 H new ATOM 0 HH11 ARG A 41 13.337 -10.540 -5.680 1.00 0.00 H new ATOM 0 HH12 ARG A 41 12.447 -9.973 -7.097 1.00 0.00 H new ATOM 0 HH21 ARG A 41 12.018 -6.738 -5.845 1.00 0.00 H new ATOM 0 HH22 ARG A 41 11.708 -7.842 -7.189 1.00 0.00 H new ATOM 635 N MET A 42 10.613 -9.933 0.585 1.00 0.00 N ATOM 636 CA MET A 42 10.574 -10.085 2.067 1.00 0.00 C ATOM 637 C MET A 42 11.448 -9.018 2.728 1.00 0.00 C ATOM 638 O MET A 42 11.138 -8.523 3.794 1.00 0.00 O ATOM 639 CB MET A 42 11.131 -11.482 2.337 1.00 0.00 C ATOM 640 CG MET A 42 10.283 -12.519 1.599 1.00 0.00 C ATOM 641 SD MET A 42 11.361 -13.792 0.897 1.00 0.00 S ATOM 642 CE MET A 42 11.778 -14.617 2.453 1.00 0.00 C ATOM 0 H MET A 42 10.904 -10.765 0.071 1.00 0.00 H new ATOM 0 HA MET A 42 9.568 -9.965 2.470 1.00 0.00 H new ATOM 0 HB2 MET A 42 12.168 -11.542 2.006 1.00 0.00 H new ATOM 0 HB3 MET A 42 11.125 -11.687 3.408 1.00 0.00 H new ATOM 0 HG2 MET A 42 9.566 -12.972 2.284 1.00 0.00 H new ATOM 0 HG3 MET A 42 9.708 -12.038 0.808 1.00 0.00 H new ATOM 0 HE1 MET A 42 12.331 -15.533 2.243 1.00 0.00 H new ATOM 0 HE2 MET A 42 12.392 -13.954 3.063 1.00 0.00 H new ATOM 0 HE3 MET A 42 10.863 -14.861 2.992 1.00 0.00 H new ATOM 652 N GLN A 43 12.536 -8.656 2.104 1.00 0.00 N ATOM 653 CA GLN A 43 13.422 -7.617 2.700 1.00 0.00 C ATOM 654 C GLN A 43 12.670 -6.287 2.793 1.00 0.00 C ATOM 655 O GLN A 43 12.520 -5.721 3.858 1.00 0.00 O ATOM 656 CB GLN A 43 14.607 -7.499 1.738 1.00 0.00 C ATOM 657 CG GLN A 43 15.856 -7.080 2.516 1.00 0.00 C ATOM 658 CD GLN A 43 17.015 -8.018 2.172 1.00 0.00 C ATOM 659 OE1 GLN A 43 17.130 -8.475 1.053 1.00 0.00 O ATOM 660 NE2 GLN A 43 17.884 -8.328 3.096 1.00 0.00 N ATOM 0 H GLN A 43 12.849 -9.034 1.210 1.00 0.00 H new ATOM 0 HA GLN A 43 13.747 -7.876 3.708 1.00 0.00 H new ATOM 0 HB2 GLN A 43 14.780 -8.452 1.238 1.00 0.00 H new ATOM 0 HB3 GLN A 43 14.387 -6.767 0.961 1.00 0.00 H new ATOM 0 HG2 GLN A 43 16.122 -6.052 2.270 1.00 0.00 H new ATOM 0 HG3 GLN A 43 15.656 -7.110 3.587 1.00 0.00 H new ATOM 0 HE21 GLN A 43 17.788 -7.944 4.036 1.00 0.00 H new ATOM 0 HE22 GLN A 43 18.659 -8.954 2.878 1.00 0.00 H new ATOM 669 N GLU A 44 12.193 -5.785 1.687 1.00 0.00 N ATOM 670 CA GLU A 44 11.451 -4.497 1.717 1.00 0.00 C ATOM 671 C GLU A 44 10.117 -4.672 2.450 1.00 0.00 C ATOM 672 O GLU A 44 9.768 -3.898 3.318 1.00 0.00 O ATOM 673 CB GLU A 44 11.209 -4.132 0.250 1.00 0.00 C ATOM 674 CG GLU A 44 12.512 -4.261 -0.542 1.00 0.00 C ATOM 675 CD GLU A 44 13.655 -3.606 0.238 1.00 0.00 C ATOM 676 OE1 GLU A 44 13.519 -2.444 0.585 1.00 0.00 O ATOM 677 OE2 GLU A 44 14.644 -4.278 0.476 1.00 0.00 O ATOM 0 H GLU A 44 12.286 -6.212 0.765 1.00 0.00 H new ATOM 0 HA GLU A 44 12.006 -3.719 2.241 1.00 0.00 H new ATOM 0 HB2 GLU A 44 10.448 -4.787 -0.176 1.00 0.00 H new ATOM 0 HB3 GLU A 44 10.829 -3.113 0.178 1.00 0.00 H new ATOM 0 HG2 GLU A 44 12.737 -5.312 -0.722 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.405 -3.786 -1.517 1.00 0.00 H new ATOM 684 N ALA A 45 9.367 -5.684 2.112 1.00 0.00 N ATOM 685 CA ALA A 45 8.062 -5.899 2.799 1.00 0.00 C ATOM 686 C ALA A 45 8.247 -5.733 4.306 1.00 0.00 C ATOM 687 O ALA A 45 7.622 -4.902 4.934 1.00 0.00 O ATOM 688 CB ALA A 45 7.666 -7.334 2.459 1.00 0.00 C ATOM 0 H ALA A 45 9.600 -6.369 1.393 1.00 0.00 H new ATOM 0 HA ALA A 45 7.298 -5.188 2.485 1.00 0.00 H new ATOM 0 HB1 ALA A 45 6.712 -7.569 2.930 1.00 0.00 H new ATOM 0 HB2 ALA A 45 7.573 -7.439 1.378 1.00 0.00 H new ATOM 0 HB3 ALA A 45 8.430 -8.019 2.826 1.00 0.00 H new ATOM 694 N LEU A 46 9.119 -6.508 4.882 1.00 0.00 N ATOM 695 CA LEU A 46 9.370 -6.396 6.343 1.00 0.00 C ATOM 696 C LEU A 46 9.515 -4.926 6.724 1.00 0.00 C ATOM 697 O LEU A 46 9.012 -4.478 7.737 1.00 0.00 O ATOM 698 CB LEU A 46 10.689 -7.135 6.563 1.00 0.00 C ATOM 699 CG LEU A 46 11.178 -6.894 7.990 1.00 0.00 C ATOM 700 CD1 LEU A 46 10.896 -8.129 8.845 1.00 0.00 C ATOM 701 CD2 LEU A 46 12.683 -6.620 7.973 1.00 0.00 C ATOM 0 H LEU A 46 9.672 -7.218 4.401 1.00 0.00 H new ATOM 0 HA LEU A 46 8.562 -6.810 6.946 1.00 0.00 H new ATOM 0 HB2 LEU A 46 10.553 -8.202 6.390 1.00 0.00 H new ATOM 0 HB3 LEU A 46 11.436 -6.789 5.848 1.00 0.00 H new ATOM 0 HG LEU A 46 10.655 -6.035 8.411 1.00 0.00 H new ATOM 0 HD11 LEU A 46 11.246 -7.955 9.863 1.00 0.00 H new ATOM 0 HD12 LEU A 46 9.824 -8.325 8.858 1.00 0.00 H new ATOM 0 HD13 LEU A 46 11.417 -8.989 8.425 1.00 0.00 H new ATOM 0 HD21 LEU A 46 13.033 -6.448 8.991 1.00 0.00 H new ATOM 0 HD22 LEU A 46 13.204 -7.479 7.550 1.00 0.00 H new ATOM 0 HD23 LEU A 46 12.885 -5.738 7.366 1.00 0.00 H new ATOM 713 N ASP A 47 10.206 -4.174 5.916 1.00 0.00 N ATOM 714 CA ASP A 47 10.394 -2.729 6.221 1.00 0.00 C ATOM 715 C ASP A 47 9.041 -2.011 6.219 1.00 0.00 C ATOM 716 O ASP A 47 8.866 -0.997 6.866 1.00 0.00 O ATOM 717 CB ASP A 47 11.294 -2.192 5.106 1.00 0.00 C ATOM 718 CG ASP A 47 12.602 -2.985 5.080 1.00 0.00 C ATOM 719 OD1 ASP A 47 13.021 -3.434 6.135 1.00 0.00 O ATOM 720 OD2 ASP A 47 13.164 -3.129 4.007 1.00 0.00 O ATOM 0 H ASP A 47 10.650 -4.497 5.056 1.00 0.00 H new ATOM 0 HA ASP A 47 10.837 -2.570 7.204 1.00 0.00 H new ATOM 0 HB2 ASP A 47 10.788 -2.274 4.144 1.00 0.00 H new ATOM 0 HB3 ASP A 47 11.501 -1.134 5.269 1.00 0.00 H new ATOM 725 N ILE A 48 8.080 -2.527 5.499 1.00 0.00 N ATOM 726 CA ILE A 48 6.747 -1.868 5.467 1.00 0.00 C ATOM 727 C ILE A 48 5.926 -2.294 6.689 1.00 0.00 C ATOM 728 O ILE A 48 4.983 -1.645 7.055 1.00 0.00 O ATOM 729 CB ILE A 48 6.065 -2.296 4.142 1.00 0.00 C ATOM 730 CG1 ILE A 48 5.169 -3.530 4.361 1.00 0.00 C ATOM 731 CG2 ILE A 48 7.120 -2.606 3.081 1.00 0.00 C ATOM 732 CD1 ILE A 48 4.927 -4.259 3.030 1.00 0.00 C ATOM 0 H ILE A 48 8.162 -3.373 4.935 1.00 0.00 H new ATOM 0 HA ILE A 48 6.833 -0.782 5.506 1.00 0.00 H new ATOM 0 HB ILE A 48 5.442 -1.470 3.799 1.00 0.00 H new ATOM 0 HG12 ILE A 48 5.640 -4.207 5.074 1.00 0.00 H new ATOM 0 HG13 ILE A 48 4.217 -3.224 4.794 1.00 0.00 H new ATOM 0 HG21 ILE A 48 6.628 -2.905 2.155 1.00 0.00 H new ATOM 0 HG22 ILE A 48 7.725 -1.718 2.899 1.00 0.00 H new ATOM 0 HG23 ILE A 48 7.760 -3.416 3.430 1.00 0.00 H new ATOM 0 HD11 ILE A 48 4.292 -5.128 3.202 1.00 0.00 H new ATOM 0 HD12 ILE A 48 4.436 -3.584 2.329 1.00 0.00 H new ATOM 0 HD13 ILE A 48 5.881 -4.583 2.614 1.00 0.00 H new ATOM 744 N ALA A 49 6.267 -3.384 7.319 1.00 0.00 N ATOM 745 CA ALA A 49 5.480 -3.819 8.506 1.00 0.00 C ATOM 746 C ALA A 49 6.126 -3.340 9.816 1.00 0.00 C ATOM 747 O ALA A 49 5.585 -2.508 10.519 1.00 0.00 O ATOM 748 CB ALA A 49 5.456 -5.347 8.443 1.00 0.00 C ATOM 0 H ALA A 49 7.049 -3.987 7.066 1.00 0.00 H new ATOM 0 HA ALA A 49 4.476 -3.394 8.491 1.00 0.00 H new ATOM 0 HB1 ALA A 49 4.891 -5.737 9.290 1.00 0.00 H new ATOM 0 HB2 ALA A 49 4.983 -5.665 7.514 1.00 0.00 H new ATOM 0 HB3 ALA A 49 6.476 -5.729 8.481 1.00 0.00 H new ATOM 754 N ARG A 50 7.268 -3.879 10.159 1.00 0.00 N ATOM 755 CA ARG A 50 7.942 -3.479 11.433 1.00 0.00 C ATOM 756 C ARG A 50 7.936 -1.958 11.600 1.00 0.00 C ATOM 757 O ARG A 50 7.874 -1.445 12.700 1.00 0.00 O ATOM 758 CB ARG A 50 9.378 -3.992 11.303 1.00 0.00 C ATOM 759 CG ARG A 50 9.524 -5.308 12.069 1.00 0.00 C ATOM 760 CD ARG A 50 9.954 -6.415 11.102 1.00 0.00 C ATOM 761 NE ARG A 50 10.961 -7.219 11.850 1.00 0.00 N ATOM 762 CZ ARG A 50 12.120 -6.701 12.158 1.00 0.00 C ATOM 763 NH1 ARG A 50 12.648 -5.780 11.398 1.00 0.00 N ATOM 764 NH2 ARG A 50 12.748 -7.102 13.230 1.00 0.00 N ATOM 0 H ARG A 50 7.765 -4.581 9.611 1.00 0.00 H new ATOM 0 HA ARG A 50 7.433 -3.891 12.304 1.00 0.00 H new ATOM 0 HB2 ARG A 50 9.628 -4.141 10.253 1.00 0.00 H new ATOM 0 HB3 ARG A 50 10.076 -3.252 11.695 1.00 0.00 H new ATOM 0 HG2 ARG A 50 10.261 -5.199 12.865 1.00 0.00 H new ATOM 0 HG3 ARG A 50 8.579 -5.572 12.544 1.00 0.00 H new ATOM 0 HD2 ARG A 50 9.104 -7.028 10.803 1.00 0.00 H new ATOM 0 HD3 ARG A 50 10.382 -5.997 10.191 1.00 0.00 H new ATOM 0 HE ARG A 50 10.745 -8.178 12.123 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.155 -5.464 10.563 1.00 0.00 H new ATOM 0 HH12 ARG A 50 13.553 -5.376 11.640 1.00 0.00 H new ATOM 0 HH21 ARG A 50 12.334 -7.819 13.826 1.00 0.00 H new ATOM 0 HH22 ARG A 50 13.653 -6.699 13.472 1.00 0.00 H new ATOM 778 N LYS A 51 8.009 -1.237 10.519 1.00 0.00 N ATOM 779 CA LYS A 51 8.017 0.248 10.607 1.00 0.00 C ATOM 780 C LYS A 51 6.775 0.761 11.332 1.00 0.00 C ATOM 781 O LYS A 51 6.839 1.724 12.070 1.00 0.00 O ATOM 782 CB LYS A 51 8.012 0.722 9.155 1.00 0.00 C ATOM 783 CG LYS A 51 7.900 2.246 9.119 1.00 0.00 C ATOM 784 CD LYS A 51 9.269 2.852 8.812 1.00 0.00 C ATOM 785 CE LYS A 51 9.976 3.202 10.122 1.00 0.00 C ATOM 786 NZ LYS A 51 9.687 4.647 10.345 1.00 0.00 N ATOM 0 H LYS A 51 8.064 -1.614 9.573 1.00 0.00 H new ATOM 0 HA LYS A 51 8.877 0.616 11.167 1.00 0.00 H new ATOM 0 HB2 LYS A 51 8.925 0.401 8.653 1.00 0.00 H new ATOM 0 HB3 LYS A 51 7.178 0.272 8.617 1.00 0.00 H new ATOM 0 HG2 LYS A 51 7.178 2.550 8.361 1.00 0.00 H new ATOM 0 HG3 LYS A 51 7.533 2.617 10.076 1.00 0.00 H new ATOM 0 HD2 LYS A 51 9.871 2.147 8.239 1.00 0.00 H new ATOM 0 HD3 LYS A 51 9.154 3.745 8.198 1.00 0.00 H new ATOM 0 HE2 LYS A 51 9.603 2.594 10.946 1.00 0.00 H new ATOM 0 HE3 LYS A 51 11.049 3.021 10.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 9.832 4.879 11.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 10.326 5.223 9.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 8.701 4.848 10.082 1.00 0.00 H new ATOM 800 N GLY A 52 5.635 0.155 11.111 1.00 0.00 N ATOM 801 CA GLY A 52 4.402 0.666 11.778 1.00 0.00 C ATOM 802 C GLY A 52 4.380 2.180 11.579 1.00 0.00 C ATOM 803 O GLY A 52 3.840 2.929 12.370 1.00 0.00 O ATOM 0 H GLY A 52 5.507 -0.658 10.508 1.00 0.00 H new ATOM 0 HA2 GLY A 52 3.512 0.208 11.346 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.406 0.417 12.839 1.00 0.00 H new ATOM 807 N GLN A 53 5.007 2.620 10.521 1.00 0.00 N ATOM 808 CA GLN A 53 5.098 4.069 10.220 1.00 0.00 C ATOM 809 C GLN A 53 5.670 4.233 8.806 1.00 0.00 C ATOM 810 O GLN A 53 6.660 4.900 8.587 1.00 0.00 O ATOM 811 CB GLN A 53 6.066 4.598 11.283 1.00 0.00 C ATOM 812 CG GLN A 53 6.290 6.096 11.099 1.00 0.00 C ATOM 813 CD GLN A 53 5.029 6.854 11.517 1.00 0.00 C ATOM 814 OE1 GLN A 53 4.951 7.370 12.614 1.00 0.00 O ATOM 815 NE2 GLN A 53 4.031 6.943 10.682 1.00 0.00 N ATOM 0 H GLN A 53 5.469 2.017 9.840 1.00 0.00 H new ATOM 0 HA GLN A 53 4.146 4.599 10.245 1.00 0.00 H new ATOM 0 HB2 GLN A 53 5.666 4.403 12.278 1.00 0.00 H new ATOM 0 HB3 GLN A 53 7.017 4.070 11.213 1.00 0.00 H new ATOM 0 HG2 GLN A 53 7.140 6.424 11.698 1.00 0.00 H new ATOM 0 HG3 GLN A 53 6.530 6.314 10.058 1.00 0.00 H new ATOM 0 HE21 GLN A 53 4.097 6.510 9.761 1.00 0.00 H new ATOM 0 HE22 GLN A 53 3.185 7.446 10.950 1.00 0.00 H new ATOM 824 N PHE A 54 5.053 3.597 7.849 1.00 0.00 N ATOM 825 CA PHE A 54 5.543 3.672 6.442 1.00 0.00 C ATOM 826 C PHE A 54 4.415 4.152 5.525 1.00 0.00 C ATOM 827 O PHE A 54 4.300 3.728 4.395 1.00 0.00 O ATOM 828 CB PHE A 54 5.924 2.231 6.093 1.00 0.00 C ATOM 829 CG PHE A 54 4.725 1.350 6.333 1.00 0.00 C ATOM 830 CD1 PHE A 54 4.485 0.802 7.599 1.00 0.00 C ATOM 831 CD2 PHE A 54 3.836 1.104 5.290 1.00 0.00 C ATOM 832 CE1 PHE A 54 3.351 0.012 7.816 1.00 0.00 C ATOM 833 CE2 PHE A 54 2.708 0.310 5.503 1.00 0.00 C ATOM 834 CZ PHE A 54 2.462 -0.235 6.765 1.00 0.00 C ATOM 0 H PHE A 54 4.221 3.022 7.982 1.00 0.00 H new ATOM 0 HA PHE A 54 6.377 4.364 6.323 1.00 0.00 H new ATOM 0 HB2 PHE A 54 6.241 2.164 5.052 1.00 0.00 H new ATOM 0 HB3 PHE A 54 6.764 1.902 6.704 1.00 0.00 H new ATOM 0 HD1 PHE A 54 5.175 0.989 8.408 1.00 0.00 H new ATOM 0 HD2 PHE A 54 4.020 1.528 4.314 1.00 0.00 H new ATOM 0 HE1 PHE A 54 3.162 -0.406 8.794 1.00 0.00 H new ATOM 0 HE2 PHE A 54 2.024 0.117 4.690 1.00 0.00 H new ATOM 0 HZ PHE A 54 1.587 -0.846 6.929 1.00 0.00 H new ATOM 844 N ASP A 55 3.585 5.031 6.016 1.00 0.00 N ATOM 845 CA ASP A 55 2.450 5.554 5.214 1.00 0.00 C ATOM 846 C ASP A 55 1.589 4.409 4.667 1.00 0.00 C ATOM 847 O ASP A 55 0.502 4.189 5.141 1.00 0.00 O ATOM 848 CB ASP A 55 3.092 6.346 4.094 1.00 0.00 C ATOM 849 CG ASP A 55 2.103 7.392 3.575 1.00 0.00 C ATOM 850 OD1 ASP A 55 0.911 7.137 3.646 1.00 0.00 O ATOM 851 OD2 ASP A 55 2.552 8.429 3.117 1.00 0.00 O ATOM 0 H ASP A 55 3.650 5.414 6.959 1.00 0.00 H new ATOM 0 HA ASP A 55 1.778 6.171 5.810 1.00 0.00 H new ATOM 0 HB2 ASP A 55 3.998 6.834 4.453 1.00 0.00 H new ATOM 0 HB3 ASP A 55 3.388 5.678 3.285 1.00 0.00 H new ATOM 856 N ILE A 56 2.053 3.689 3.672 1.00 0.00 N ATOM 857 CA ILE A 56 1.220 2.567 3.109 1.00 0.00 C ATOM 858 C ILE A 56 2.084 1.361 2.678 1.00 0.00 C ATOM 859 O ILE A 56 3.258 1.498 2.398 1.00 0.00 O ATOM 860 CB ILE A 56 0.531 3.186 1.896 1.00 0.00 C ATOM 861 CG1 ILE A 56 -0.561 4.146 2.368 1.00 0.00 C ATOM 862 CG2 ILE A 56 -0.090 2.084 1.039 1.00 0.00 C ATOM 863 CD1 ILE A 56 -1.278 4.735 1.151 1.00 0.00 C ATOM 0 H ILE A 56 2.961 3.824 3.227 1.00 0.00 H new ATOM 0 HA ILE A 56 0.522 2.176 3.849 1.00 0.00 H new ATOM 0 HB ILE A 56 1.264 3.732 1.302 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -1.273 3.620 3.005 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -0.125 4.944 2.969 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -0.581 2.529 0.174 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.690 1.402 0.702 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -0.823 1.534 1.629 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -2.057 5.420 1.484 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -0.561 5.274 0.532 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -1.727 3.930 0.569 1.00 0.00 H new ATOM 875 N ALA A 57 1.501 0.175 2.609 1.00 0.00 N ATOM 876 CA ALA A 57 2.284 -1.039 2.187 1.00 0.00 C ATOM 877 C ALA A 57 1.329 -2.064 1.578 1.00 0.00 C ATOM 878 O ALA A 57 0.280 -2.335 2.124 1.00 0.00 O ATOM 879 CB ALA A 57 2.915 -1.597 3.462 1.00 0.00 C ATOM 0 H ALA A 57 0.520 -0.000 2.827 1.00 0.00 H new ATOM 0 HA ALA A 57 3.045 -0.801 1.443 1.00 0.00 H new ATOM 0 HB1 ALA A 57 3.500 -2.485 3.220 1.00 0.00 H new ATOM 0 HB2 ALA A 57 3.566 -0.844 3.906 1.00 0.00 H new ATOM 0 HB3 ALA A 57 2.130 -1.862 4.171 1.00 0.00 H new ATOM 885 N ILE A 58 1.653 -2.620 0.443 1.00 0.00 N ATOM 886 CA ILE A 58 0.704 -3.589 -0.176 1.00 0.00 C ATOM 887 C ILE A 58 1.389 -4.859 -0.685 1.00 0.00 C ATOM 888 O ILE A 58 2.187 -4.831 -1.601 1.00 0.00 O ATOM 889 CB ILE A 58 0.089 -2.828 -1.350 1.00 0.00 C ATOM 890 CG1 ILE A 58 -0.628 -1.579 -0.833 1.00 0.00 C ATOM 891 CG2 ILE A 58 -0.917 -3.726 -2.071 1.00 0.00 C ATOM 892 CD1 ILE A 58 0.399 -0.484 -0.541 1.00 0.00 C ATOM 0 H ILE A 58 2.516 -2.451 -0.074 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.026 -3.929 0.558 1.00 0.00 H new ATOM 0 HB ILE A 58 0.879 -2.535 -2.042 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.349 -1.229 -1.572 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -1.189 -1.817 0.071 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.355 -3.183 -2.908 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.409 -4.616 -2.442 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -1.705 -4.020 -1.377 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -0.112 0.405 -0.173 1.00 0.00 H new ATOM 0 HD12 ILE A 58 1.102 -0.837 0.213 1.00 0.00 H new ATOM 0 HD13 ILE A 58 0.940 -0.239 -1.455 1.00 0.00 H new ATOM 904 N ILE A 59 1.023 -5.979 -0.129 1.00 0.00 N ATOM 905 CA ILE A 59 1.575 -7.284 -0.600 1.00 0.00 C ATOM 906 C ILE A 59 0.476 -7.945 -1.423 1.00 0.00 C ATOM 907 O ILE A 59 -0.148 -8.899 -1.001 1.00 0.00 O ATOM 908 CB ILE A 59 1.848 -8.115 0.655 1.00 0.00 C ATOM 909 CG1 ILE A 59 2.281 -7.211 1.813 1.00 0.00 C ATOM 910 CG2 ILE A 59 2.951 -9.123 0.349 1.00 0.00 C ATOM 911 CD1 ILE A 59 3.576 -6.501 1.453 1.00 0.00 C ATOM 0 H ILE A 59 0.357 -6.049 0.641 1.00 0.00 H new ATOM 0 HA ILE A 59 2.484 -7.181 -1.193 1.00 0.00 H new ATOM 0 HB ILE A 59 0.936 -8.636 0.947 1.00 0.00 H new ATOM 0 HG12 ILE A 59 1.502 -6.480 2.027 1.00 0.00 H new ATOM 0 HG13 ILE A 59 2.419 -7.804 2.717 1.00 0.00 H new ATOM 0 HG21 ILE A 59 3.154 -9.721 1.237 1.00 0.00 H new ATOM 0 HG22 ILE A 59 2.632 -9.776 -0.463 1.00 0.00 H new ATOM 0 HG23 ILE A 59 3.857 -8.593 0.054 1.00 0.00 H new ATOM 0 HD11 ILE A 59 3.881 -5.859 2.279 1.00 0.00 H new ATOM 0 HD12 ILE A 59 4.355 -7.239 1.261 1.00 0.00 H new ATOM 0 HD13 ILE A 59 3.423 -5.895 0.560 1.00 0.00 H new ATOM 923 N ASP A 60 0.193 -7.405 -2.568 1.00 0.00 N ATOM 924 CA ASP A 60 -0.917 -7.952 -3.397 1.00 0.00 C ATOM 925 C ASP A 60 -0.642 -9.368 -3.879 1.00 0.00 C ATOM 926 O ASP A 60 0.446 -9.897 -3.769 1.00 0.00 O ATOM 927 CB ASP A 60 -1.051 -6.971 -4.577 1.00 0.00 C ATOM 928 CG ASP A 60 -1.227 -7.732 -5.899 1.00 0.00 C ATOM 929 OD1 ASP A 60 -0.259 -8.321 -6.351 1.00 0.00 O ATOM 930 OD2 ASP A 60 -2.326 -7.717 -6.430 1.00 0.00 O ATOM 0 H ASP A 60 0.682 -6.605 -2.971 1.00 0.00 H new ATOM 0 HA ASP A 60 -1.838 -8.032 -2.819 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -1.905 -6.313 -4.414 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -0.166 -6.337 -4.632 1.00 0.00 H new ATOM 935 N VAL A 61 -1.665 -9.952 -4.436 1.00 0.00 N ATOM 936 CA VAL A 61 -1.591 -11.324 -4.986 1.00 0.00 C ATOM 937 C VAL A 61 -1.757 -12.373 -3.876 1.00 0.00 C ATOM 938 O VAL A 61 -0.879 -12.608 -3.071 1.00 0.00 O ATOM 939 CB VAL A 61 -0.245 -11.406 -5.723 1.00 0.00 C ATOM 940 CG1 VAL A 61 0.757 -12.290 -4.970 1.00 0.00 C ATOM 941 CG2 VAL A 61 -0.477 -11.990 -7.120 1.00 0.00 C ATOM 0 H VAL A 61 -2.581 -9.514 -4.533 1.00 0.00 H new ATOM 0 HA VAL A 61 -2.403 -11.540 -5.681 1.00 0.00 H new ATOM 0 HB VAL A 61 0.171 -10.401 -5.788 1.00 0.00 H new ATOM 0 HG11 VAL A 61 1.697 -12.325 -5.521 1.00 0.00 H new ATOM 0 HG12 VAL A 61 0.933 -11.876 -3.977 1.00 0.00 H new ATOM 0 HG13 VAL A 61 0.354 -13.298 -4.876 1.00 0.00 H new ATOM 0 HG21 VAL A 61 0.473 -12.052 -7.651 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -0.908 -12.987 -7.031 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.161 -11.347 -7.674 1.00 0.00 H new ATOM 951 N ASN A 62 -2.901 -13.000 -3.845 1.00 0.00 N ATOM 952 CA ASN A 62 -3.176 -14.041 -2.817 1.00 0.00 C ATOM 953 C ASN A 62 -3.805 -15.246 -3.512 1.00 0.00 C ATOM 954 O ASN A 62 -4.793 -15.795 -3.069 1.00 0.00 O ATOM 955 CB ASN A 62 -4.172 -13.396 -1.855 1.00 0.00 C ATOM 956 CG ASN A 62 -3.444 -12.925 -0.593 1.00 0.00 C ATOM 957 OD1 ASN A 62 -3.796 -13.312 0.504 1.00 0.00 O ATOM 958 ND2 ASN A 62 -2.436 -12.103 -0.700 1.00 0.00 N ATOM 0 H ASN A 62 -3.667 -12.832 -4.498 1.00 0.00 H new ATOM 0 HA ASN A 62 -2.282 -14.379 -2.292 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -4.664 -12.552 -2.338 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -4.951 -14.111 -1.591 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -1.945 -11.786 0.136 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -2.139 -11.777 -1.620 1.00 0.00 H new ATOM 965 N LEU A 63 -3.229 -15.648 -4.608 1.00 0.00 N ATOM 966 CA LEU A 63 -3.761 -16.804 -5.372 1.00 0.00 C ATOM 967 C LEU A 63 -2.587 -17.683 -5.783 1.00 0.00 C ATOM 968 O LEU A 63 -1.481 -17.495 -5.315 1.00 0.00 O ATOM 969 CB LEU A 63 -4.436 -16.189 -6.602 1.00 0.00 C ATOM 970 CG LEU A 63 -5.919 -16.570 -6.624 1.00 0.00 C ATOM 971 CD1 LEU A 63 -6.672 -15.765 -5.563 1.00 0.00 C ATOM 972 CD2 LEU A 63 -6.507 -16.261 -8.004 1.00 0.00 C ATOM 0 H LEU A 63 -2.398 -15.216 -5.012 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.461 -17.417 -4.805 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -4.330 -15.104 -6.582 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.947 -16.541 -7.511 1.00 0.00 H new ATOM 0 HG LEU A 63 -6.020 -17.635 -6.413 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -7.727 -16.038 -5.580 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -6.257 -15.983 -4.579 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -6.569 -14.700 -5.773 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -7.563 -16.532 -8.019 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -6.403 -15.196 -8.214 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -5.974 -16.834 -8.763 1.00 0.00 H new ATOM 984 N ASP A 64 -2.798 -18.637 -6.641 1.00 0.00 N ATOM 985 CA ASP A 64 -1.659 -19.504 -7.045 1.00 0.00 C ATOM 986 C ASP A 64 -0.886 -19.934 -5.798 1.00 0.00 C ATOM 987 O ASP A 64 0.284 -20.258 -5.861 1.00 0.00 O ATOM 988 CB ASP A 64 -0.781 -18.616 -7.926 1.00 0.00 C ATOM 989 CG ASP A 64 -0.934 -19.035 -9.389 1.00 0.00 C ATOM 990 OD1 ASP A 64 -0.266 -19.974 -9.788 1.00 0.00 O ATOM 991 OD2 ASP A 64 -1.716 -18.409 -10.085 1.00 0.00 O ATOM 0 H ASP A 64 -3.695 -18.853 -7.075 1.00 0.00 H new ATOM 0 HA ASP A 64 -1.980 -20.406 -7.567 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -1.066 -17.571 -7.805 1.00 0.00 H new ATOM 0 HB3 ASP A 64 0.262 -18.700 -7.620 1.00 0.00 H new ATOM 996 N GLY A 65 -1.528 -19.930 -4.661 1.00 0.00 N ATOM 997 CA GLY A 65 -0.825 -20.327 -3.415 1.00 0.00 C ATOM 998 C GLY A 65 -1.099 -19.306 -2.314 1.00 0.00 C ATOM 999 O GLY A 65 -1.128 -19.634 -1.143 1.00 0.00 O ATOM 0 H GLY A 65 -2.507 -19.669 -4.545 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -1.159 -21.315 -3.098 1.00 0.00 H new ATOM 0 HA3 GLY A 65 0.247 -20.397 -3.599 1.00 0.00 H new ATOM 1003 N GLU A 66 -1.294 -18.071 -2.671 1.00 0.00 N ATOM 1004 CA GLU A 66 -1.560 -17.038 -1.633 1.00 0.00 C ATOM 1005 C GLU A 66 -0.378 -16.951 -0.670 1.00 0.00 C ATOM 1006 O GLU A 66 -0.420 -17.479 0.424 1.00 0.00 O ATOM 1007 CB GLU A 66 -2.817 -17.520 -0.910 1.00 0.00 C ATOM 1008 CG GLU A 66 -3.384 -16.389 -0.051 1.00 0.00 C ATOM 1009 CD GLU A 66 -4.663 -16.867 0.638 1.00 0.00 C ATOM 1010 OE1 GLU A 66 -5.408 -17.603 0.014 1.00 0.00 O ATOM 1011 OE2 GLU A 66 -4.875 -16.491 1.780 1.00 0.00 O ATOM 0 H GLU A 66 -1.281 -17.731 -3.633 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.696 -16.043 -2.057 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -3.562 -17.847 -1.635 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -2.581 -18.381 -0.285 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -2.650 -16.080 0.694 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -3.595 -15.518 -0.671 1.00 0.00 H new ATOM 1018 N PRO A 67 0.641 -16.285 -1.125 1.00 0.00 N ATOM 1019 CA PRO A 67 1.861 -16.110 -0.317 1.00 0.00 C ATOM 1020 C PRO A 67 1.691 -14.938 0.659 1.00 0.00 C ATOM 1021 O PRO A 67 1.169 -15.095 1.745 1.00 0.00 O ATOM 1022 CB PRO A 67 2.930 -15.807 -1.366 1.00 0.00 C ATOM 1023 CG PRO A 67 2.194 -15.223 -2.537 1.00 0.00 C ATOM 1024 CD PRO A 67 0.746 -15.637 -2.434 1.00 0.00 C ATOM 0 HA PRO A 67 2.106 -16.976 0.298 1.00 0.00 H new ATOM 0 HB2 PRO A 67 3.670 -15.107 -0.980 1.00 0.00 H new ATOM 0 HB3 PRO A 67 3.466 -16.712 -1.652 1.00 0.00 H new ATOM 0 HG2 PRO A 67 2.280 -14.136 -2.537 1.00 0.00 H new ATOM 0 HG3 PRO A 67 2.626 -15.577 -3.473 1.00 0.00 H new ATOM 0 HD2 PRO A 67 0.081 -14.776 -2.505 1.00 0.00 H new ATOM 0 HD3 PRO A 67 0.470 -16.320 -3.238 1.00 0.00 H new ATOM 1032 N SER A 68 2.122 -13.765 0.277 1.00 0.00 N ATOM 1033 CA SER A 68 1.986 -12.572 1.172 1.00 0.00 C ATOM 1034 C SER A 68 2.732 -12.768 2.507 1.00 0.00 C ATOM 1035 O SER A 68 2.673 -11.922 3.374 1.00 0.00 O ATOM 1036 CB SER A 68 0.482 -12.437 1.416 1.00 0.00 C ATOM 1037 OG SER A 68 -0.225 -13.193 0.439 1.00 0.00 O ATOM 0 H SER A 68 2.566 -13.578 -0.622 1.00 0.00 H new ATOM 0 HA SER A 68 2.421 -11.682 0.717 1.00 0.00 H new ATOM 0 HB2 SER A 68 0.232 -12.790 2.416 1.00 0.00 H new ATOM 0 HB3 SER A 68 0.187 -11.389 1.365 1.00 0.00 H new ATOM 0 HG SER A 68 -0.985 -13.644 0.862 1.00 0.00 H new ATOM 1043 N TYR A 69 3.442 -13.861 2.672 1.00 0.00 N ATOM 1044 CA TYR A 69 4.194 -14.118 3.944 1.00 0.00 C ATOM 1045 C TYR A 69 3.317 -13.850 5.172 1.00 0.00 C ATOM 1046 O TYR A 69 2.232 -13.304 5.075 1.00 0.00 O ATOM 1047 CB TYR A 69 5.424 -13.182 3.967 1.00 0.00 C ATOM 1048 CG TYR A 69 5.442 -12.241 2.785 1.00 0.00 C ATOM 1049 CD1 TYR A 69 5.779 -12.717 1.513 1.00 0.00 C ATOM 1050 CD2 TYR A 69 5.126 -10.890 2.967 1.00 0.00 C ATOM 1051 CE1 TYR A 69 5.800 -11.842 0.421 1.00 0.00 C ATOM 1052 CE2 TYR A 69 5.146 -10.014 1.877 1.00 0.00 C ATOM 1053 CZ TYR A 69 5.484 -10.490 0.602 1.00 0.00 C ATOM 1054 OH TYR A 69 5.506 -9.627 -0.476 1.00 0.00 O ATOM 0 H TYR A 69 3.533 -14.595 1.970 1.00 0.00 H new ATOM 0 HA TYR A 69 4.499 -15.164 3.979 1.00 0.00 H new ATOM 0 HB2 TYR A 69 5.422 -12.603 4.891 1.00 0.00 H new ATOM 0 HB3 TYR A 69 6.335 -13.781 3.968 1.00 0.00 H new ATOM 0 HD1 TYR A 69 6.023 -13.760 1.374 1.00 0.00 H new ATOM 0 HD2 TYR A 69 4.867 -10.524 3.949 1.00 0.00 H new ATOM 0 HE1 TYR A 69 6.060 -12.209 -0.561 1.00 0.00 H new ATOM 0 HE2 TYR A 69 4.901 -8.971 2.017 1.00 0.00 H new ATOM 0 HH TYR A 69 6.343 -9.118 -0.471 1.00 0.00 H new ATOM 1064 N PRO A 70 3.833 -14.240 6.302 1.00 0.00 N ATOM 1065 CA PRO A 70 3.113 -14.030 7.575 1.00 0.00 C ATOM 1066 C PRO A 70 3.171 -12.548 7.944 1.00 0.00 C ATOM 1067 O PRO A 70 2.531 -12.102 8.875 1.00 0.00 O ATOM 1068 CB PRO A 70 3.893 -14.875 8.577 1.00 0.00 C ATOM 1069 CG PRO A 70 5.267 -14.986 7.998 1.00 0.00 C ATOM 1070 CD PRO A 70 5.123 -14.911 6.499 1.00 0.00 C ATOM 0 HA PRO A 70 2.060 -14.308 7.538 1.00 0.00 H new ATOM 0 HB2 PRO A 70 3.915 -14.403 9.559 1.00 0.00 H new ATOM 0 HB3 PRO A 70 3.438 -15.857 8.705 1.00 0.00 H new ATOM 0 HG2 PRO A 70 5.906 -14.182 8.364 1.00 0.00 H new ATOM 0 HG3 PRO A 70 5.735 -15.925 8.294 1.00 0.00 H new ATOM 0 HD2 PRO A 70 5.939 -14.348 6.047 1.00 0.00 H new ATOM 0 HD3 PRO A 70 5.131 -15.903 6.047 1.00 0.00 H new ATOM 1078 N VAL A 71 3.928 -11.778 7.204 1.00 0.00 N ATOM 1079 CA VAL A 71 4.021 -10.323 7.496 1.00 0.00 C ATOM 1080 C VAL A 71 2.777 -9.628 6.962 1.00 0.00 C ATOM 1081 O VAL A 71 2.004 -9.056 7.701 1.00 0.00 O ATOM 1082 CB VAL A 71 5.264 -9.840 6.750 1.00 0.00 C ATOM 1083 CG1 VAL A 71 5.607 -8.416 7.194 1.00 0.00 C ATOM 1084 CG2 VAL A 71 6.438 -10.766 7.062 1.00 0.00 C ATOM 0 H VAL A 71 4.484 -12.098 6.411 1.00 0.00 H new ATOM 0 HA VAL A 71 4.090 -10.111 8.563 1.00 0.00 H new ATOM 0 HB VAL A 71 5.068 -9.849 5.678 1.00 0.00 H new ATOM 0 HG11 VAL A 71 6.494 -8.072 6.661 1.00 0.00 H new ATOM 0 HG12 VAL A 71 4.770 -7.754 6.971 1.00 0.00 H new ATOM 0 HG13 VAL A 71 5.801 -8.406 8.266 1.00 0.00 H new ATOM 0 HG21 VAL A 71 7.325 -10.421 6.530 1.00 0.00 H new ATOM 0 HG22 VAL A 71 6.633 -10.758 8.134 1.00 0.00 H new ATOM 0 HG23 VAL A 71 6.196 -11.780 6.745 1.00 0.00 H new ATOM 1094 N ALA A 72 2.572 -9.695 5.678 1.00 0.00 N ATOM 1095 CA ALA A 72 1.368 -9.064 5.084 1.00 0.00 C ATOM 1096 C ALA A 72 0.135 -9.515 5.855 1.00 0.00 C ATOM 1097 O ALA A 72 -0.612 -8.714 6.380 1.00 0.00 O ATOM 1098 CB ALA A 72 1.320 -9.591 3.656 1.00 0.00 C ATOM 0 H ALA A 72 3.190 -10.162 5.014 1.00 0.00 H new ATOM 0 HA ALA A 72 1.398 -7.975 5.115 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.455 -9.172 3.142 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.230 -9.301 3.130 1.00 0.00 H new ATOM 0 HB3 ALA A 72 1.241 -10.678 3.672 1.00 0.00 H new ATOM 1104 N ASP A 73 -0.079 -10.801 5.939 1.00 0.00 N ATOM 1105 CA ASP A 73 -1.257 -11.294 6.694 1.00 0.00 C ATOM 1106 C ASP A 73 -1.299 -10.605 8.053 1.00 0.00 C ATOM 1107 O ASP A 73 -2.270 -9.971 8.416 1.00 0.00 O ATOM 1108 CB ASP A 73 -1.029 -12.790 6.855 1.00 0.00 C ATOM 1109 CG ASP A 73 -1.674 -13.539 5.688 1.00 0.00 C ATOM 1110 OD1 ASP A 73 -2.814 -13.238 5.374 1.00 0.00 O ATOM 1111 OD2 ASP A 73 -1.018 -14.402 5.129 1.00 0.00 O ATOM 0 H ASP A 73 0.508 -11.523 5.520 1.00 0.00 H new ATOM 0 HA ASP A 73 -2.202 -11.089 6.190 1.00 0.00 H new ATOM 0 HB2 ASP A 73 0.039 -13.003 6.890 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -1.454 -13.133 7.799 1.00 0.00 H new ATOM 1116 N ILE A 74 -0.232 -10.703 8.796 1.00 0.00 N ATOM 1117 CA ILE A 74 -0.191 -10.026 10.121 1.00 0.00 C ATOM 1118 C ILE A 74 -0.485 -8.543 9.905 1.00 0.00 C ATOM 1119 O ILE A 74 -1.289 -7.942 10.591 1.00 0.00 O ATOM 1120 CB ILE A 74 1.238 -10.236 10.636 1.00 0.00 C ATOM 1121 CG1 ILE A 74 1.336 -11.608 11.308 1.00 0.00 C ATOM 1122 CG2 ILE A 74 1.590 -9.149 11.656 1.00 0.00 C ATOM 1123 CD1 ILE A 74 2.806 -12.017 11.431 1.00 0.00 C ATOM 0 H ILE A 74 0.610 -11.221 8.544 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.919 -10.414 10.833 1.00 0.00 H new ATOM 0 HB ILE A 74 1.933 -10.182 9.798 1.00 0.00 H new ATOM 0 HG12 ILE A 74 0.874 -11.575 12.295 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.790 -12.349 10.725 1.00 0.00 H new ATOM 0 HG21 ILE A 74 2.606 -9.305 12.017 1.00 0.00 H new ATOM 0 HG22 ILE A 74 1.519 -8.170 11.183 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.895 -9.198 12.494 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.873 -12.994 11.910 1.00 0.00 H new ATOM 0 HD12 ILE A 74 3.254 -12.068 10.439 1.00 0.00 H new ATOM 0 HD13 ILE A 74 3.339 -11.281 12.033 1.00 0.00 H new ATOM 1135 N LEU A 75 0.153 -7.964 8.928 1.00 0.00 N ATOM 1136 CA LEU A 75 -0.080 -6.532 8.616 1.00 0.00 C ATOM 1137 C LEU A 75 -1.575 -6.305 8.380 1.00 0.00 C ATOM 1138 O LEU A 75 -2.092 -5.229 8.594 1.00 0.00 O ATOM 1139 CB LEU A 75 0.715 -6.296 7.330 1.00 0.00 C ATOM 1140 CG LEU A 75 1.240 -4.862 7.294 1.00 0.00 C ATOM 1141 CD1 LEU A 75 2.542 -4.778 8.091 1.00 0.00 C ATOM 1142 CD2 LEU A 75 1.510 -4.463 5.842 1.00 0.00 C ATOM 0 H LEU A 75 0.833 -8.429 8.327 1.00 0.00 H new ATOM 0 HA LEU A 75 0.226 -5.857 9.415 1.00 0.00 H new ATOM 0 HB2 LEU A 75 1.547 -6.998 7.274 1.00 0.00 H new ATOM 0 HB3 LEU A 75 0.082 -6.482 6.462 1.00 0.00 H new ATOM 0 HG LEU A 75 0.501 -4.190 7.730 1.00 0.00 H new ATOM 0 HD11 LEU A 75 2.918 -3.755 8.066 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.356 -5.071 9.124 1.00 0.00 H new ATOM 0 HD13 LEU A 75 3.282 -5.447 7.651 1.00 0.00 H new ATOM 0 HD21 LEU A 75 1.885 -3.440 5.809 1.00 0.00 H new ATOM 0 HD22 LEU A 75 2.252 -5.135 5.412 1.00 0.00 H new ATOM 0 HD23 LEU A 75 0.585 -4.529 5.269 1.00 0.00 H new ATOM 1154 N ALA A 76 -2.270 -7.321 7.943 1.00 0.00 N ATOM 1155 CA ALA A 76 -3.727 -7.182 7.695 1.00 0.00 C ATOM 1156 C ALA A 76 -4.519 -7.644 8.923 1.00 0.00 C ATOM 1157 O ALA A 76 -5.680 -7.325 9.081 1.00 0.00 O ATOM 1158 CB ALA A 76 -4.012 -8.083 6.491 1.00 0.00 C ATOM 0 H ALA A 76 -1.885 -8.245 7.747 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.019 -6.149 7.504 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -5.073 -8.035 6.244 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -3.425 -7.745 5.637 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -3.742 -9.111 6.734 1.00 0.00 H new ATOM 1164 N GLU A 77 -3.900 -8.393 9.795 1.00 0.00 N ATOM 1165 CA GLU A 77 -4.620 -8.866 11.010 1.00 0.00 C ATOM 1166 C GLU A 77 -4.892 -7.682 11.942 1.00 0.00 C ATOM 1167 O GLU A 77 -5.816 -7.696 12.731 1.00 0.00 O ATOM 1168 CB GLU A 77 -3.678 -9.872 11.673 1.00 0.00 C ATOM 1169 CG GLU A 77 -3.721 -11.196 10.904 1.00 0.00 C ATOM 1170 CD GLU A 77 -3.832 -12.360 11.891 1.00 0.00 C ATOM 1171 OE1 GLU A 77 -3.511 -12.162 13.052 1.00 0.00 O ATOM 1172 OE2 GLU A 77 -4.237 -13.431 11.470 1.00 0.00 O ATOM 0 H GLU A 77 -2.929 -8.697 9.718 1.00 0.00 H new ATOM 0 HA GLU A 77 -5.583 -9.318 10.773 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -2.661 -9.480 11.686 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -3.972 -10.032 12.710 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -4.570 -11.204 10.220 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -2.822 -11.305 10.297 1.00 0.00 H new ATOM 1179 N ARG A 78 -4.097 -6.652 11.844 1.00 0.00 N ATOM 1180 CA ARG A 78 -4.305 -5.456 12.704 1.00 0.00 C ATOM 1181 C ARG A 78 -4.136 -4.172 11.877 1.00 0.00 C ATOM 1182 O ARG A 78 -4.237 -3.076 12.390 1.00 0.00 O ATOM 1183 CB ARG A 78 -3.264 -5.543 13.830 1.00 0.00 C ATOM 1184 CG ARG A 78 -1.919 -6.072 13.311 1.00 0.00 C ATOM 1185 CD ARG A 78 -1.234 -6.872 14.424 1.00 0.00 C ATOM 1186 NE ARG A 78 -1.625 -8.289 14.176 1.00 0.00 N ATOM 1187 CZ ARG A 78 -2.067 -9.028 15.158 1.00 0.00 C ATOM 1188 NH1 ARG A 78 -3.247 -8.800 15.669 1.00 0.00 N ATOM 1189 NH2 ARG A 78 -1.329 -9.997 15.629 1.00 0.00 N ATOM 0 H ARG A 78 -3.308 -6.589 11.201 1.00 0.00 H new ATOM 0 HA ARG A 78 -5.312 -5.429 13.120 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -3.122 -4.557 14.273 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -3.634 -6.197 14.619 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -2.075 -6.703 12.436 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -1.284 -5.243 12.998 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -0.151 -6.749 14.390 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -1.561 -6.539 15.409 1.00 0.00 H new ATOM 0 HE ARG A 78 -1.547 -8.682 13.238 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -3.825 -8.044 15.301 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -3.591 -9.378 16.436 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -0.408 -10.177 15.230 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -1.674 -10.574 16.396 1.00 0.00 H new ATOM 1203 N ASN A 79 -3.910 -4.323 10.597 1.00 0.00 N ATOM 1204 CA ASN A 79 -3.756 -3.160 9.664 1.00 0.00 C ATOM 1205 C ASN A 79 -3.344 -1.861 10.364 1.00 0.00 C ATOM 1206 O ASN A 79 -4.138 -1.212 11.015 1.00 0.00 O ATOM 1207 CB ASN A 79 -5.136 -2.985 9.029 1.00 0.00 C ATOM 1208 CG ASN A 79 -5.716 -4.354 8.676 1.00 0.00 C ATOM 1209 OD1 ASN A 79 -5.613 -4.799 7.550 1.00 0.00 O ATOM 1210 ND2 ASN A 79 -6.321 -5.046 9.601 1.00 0.00 N ATOM 0 H ASN A 79 -3.823 -5.233 10.144 1.00 0.00 H new ATOM 0 HA ASN A 79 -2.961 -3.361 8.947 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -5.801 -2.464 9.718 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -5.060 -2.369 8.133 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -6.709 -5.963 9.380 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -6.406 -4.670 10.545 1.00 0.00 H new ATOM 1217 N VAL A 80 -2.122 -1.451 10.173 1.00 0.00 N ATOM 1218 CA VAL A 80 -1.654 -0.162 10.757 1.00 0.00 C ATOM 1219 C VAL A 80 -1.978 0.927 9.716 1.00 0.00 C ATOM 1220 O VAL A 80 -2.493 0.592 8.671 1.00 0.00 O ATOM 1221 CB VAL A 80 -0.141 -0.386 10.973 1.00 0.00 C ATOM 1222 CG1 VAL A 80 0.702 0.386 9.947 1.00 0.00 C ATOM 1223 CG2 VAL A 80 0.235 0.054 12.390 1.00 0.00 C ATOM 0 H VAL A 80 -1.421 -1.958 9.633 1.00 0.00 H new ATOM 0 HA VAL A 80 -2.115 0.145 11.696 1.00 0.00 H new ATOM 0 HB VAL A 80 0.069 -1.447 10.839 1.00 0.00 H new ATOM 0 HG11 VAL A 80 1.760 0.202 10.133 1.00 0.00 H new ATOM 0 HG12 VAL A 80 0.447 0.052 8.941 1.00 0.00 H new ATOM 0 HG13 VAL A 80 0.498 1.453 10.037 1.00 0.00 H new ATOM 0 HG21 VAL A 80 1.302 -0.102 12.548 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.000 1.111 12.517 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -0.329 -0.533 13.115 1.00 0.00 H new ATOM 1233 N PRO A 81 -1.681 2.179 9.980 1.00 0.00 N ATOM 1234 CA PRO A 81 -1.991 3.234 8.974 1.00 0.00 C ATOM 1235 C PRO A 81 -1.347 2.848 7.652 1.00 0.00 C ATOM 1236 O PRO A 81 -0.143 2.723 7.556 1.00 0.00 O ATOM 1237 CB PRO A 81 -1.409 4.499 9.592 1.00 0.00 C ATOM 1238 CG PRO A 81 -0.400 3.994 10.568 1.00 0.00 C ATOM 1239 CD PRO A 81 -1.014 2.746 11.151 1.00 0.00 C ATOM 0 HA PRO A 81 -3.050 3.371 8.754 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -0.949 5.137 8.837 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -2.179 5.093 10.085 1.00 0.00 H new ATOM 0 HG2 PRO A 81 0.549 3.776 10.078 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -0.196 4.733 11.343 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -0.263 2.072 11.562 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -1.715 2.970 11.955 1.00 0.00 H new ATOM 1247 N PHE A 82 -2.150 2.612 6.642 1.00 0.00 N ATOM 1248 CA PHE A 82 -1.586 2.165 5.339 1.00 0.00 C ATOM 1249 C PHE A 82 -2.686 1.825 4.343 1.00 0.00 C ATOM 1250 O PHE A 82 -3.774 2.358 4.365 1.00 0.00 O ATOM 1251 CB PHE A 82 -0.811 0.876 5.673 1.00 0.00 C ATOM 1252 CG PHE A 82 -1.780 -0.285 5.881 1.00 0.00 C ATOM 1253 CD1 PHE A 82 -3.108 -0.054 6.289 1.00 0.00 C ATOM 1254 CD2 PHE A 82 -1.343 -1.599 5.673 1.00 0.00 C ATOM 1255 CE1 PHE A 82 -3.985 -1.125 6.483 1.00 0.00 C ATOM 1256 CE2 PHE A 82 -2.225 -2.672 5.870 1.00 0.00 C ATOM 1257 CZ PHE A 82 -3.543 -2.434 6.276 1.00 0.00 C ATOM 0 H PHE A 82 -3.165 2.710 6.667 1.00 0.00 H new ATOM 0 HA PHE A 82 -0.972 2.945 4.889 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -0.118 0.640 4.865 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -0.213 1.025 6.572 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -3.451 0.957 6.453 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -0.326 -1.787 5.361 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -5.003 -0.941 6.793 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -1.886 -3.685 5.708 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.219 -3.263 6.429 1.00 0.00 H new ATOM 1267 N ILE A 83 -2.390 0.895 3.491 1.00 0.00 N ATOM 1268 CA ILE A 83 -3.367 0.436 2.486 1.00 0.00 C ATOM 1269 C ILE A 83 -2.909 -0.927 1.997 1.00 0.00 C ATOM 1270 O ILE A 83 -1.735 -1.254 2.085 1.00 0.00 O ATOM 1271 CB ILE A 83 -3.315 1.495 1.395 1.00 0.00 C ATOM 1272 CG1 ILE A 83 -4.562 2.369 1.498 1.00 0.00 C ATOM 1273 CG2 ILE A 83 -3.258 0.850 0.006 1.00 0.00 C ATOM 1274 CD1 ILE A 83 -5.804 1.480 1.436 1.00 0.00 C ATOM 0 H ILE A 83 -1.487 0.423 3.450 1.00 0.00 H new ATOM 0 HA ILE A 83 -4.388 0.324 2.852 1.00 0.00 H new ATOM 0 HB ILE A 83 -2.416 2.096 1.529 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -4.550 2.933 2.431 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -4.579 3.096 0.686 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -3.222 1.629 -0.756 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -2.367 0.227 -0.069 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -4.145 0.235 -0.146 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -6.698 2.099 1.509 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -5.815 0.936 0.491 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -5.785 0.770 2.263 1.00 0.00 H new ATOM 1286 N PHE A 84 -3.815 -1.729 1.515 1.00 0.00 N ATOM 1287 CA PHE A 84 -3.421 -3.084 1.058 1.00 0.00 C ATOM 1288 C PHE A 84 -4.402 -3.633 0.016 1.00 0.00 C ATOM 1289 O PHE A 84 -5.557 -3.226 -0.086 1.00 0.00 O ATOM 1290 CB PHE A 84 -3.486 -3.908 2.337 1.00 0.00 C ATOM 1291 CG PHE A 84 -2.643 -5.159 2.224 1.00 0.00 C ATOM 1292 CD1 PHE A 84 -3.096 -6.246 1.466 1.00 0.00 C ATOM 1293 CD2 PHE A 84 -1.422 -5.246 2.909 1.00 0.00 C ATOM 1294 CE1 PHE A 84 -2.332 -7.416 1.393 1.00 0.00 C ATOM 1295 CE2 PHE A 84 -0.659 -6.415 2.829 1.00 0.00 C ATOM 1296 CZ PHE A 84 -1.117 -7.500 2.072 1.00 0.00 C ATOM 0 H PHE A 84 -4.805 -1.505 1.419 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.444 -3.099 0.576 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -3.139 -3.307 3.178 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -4.521 -4.181 2.545 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -4.036 -6.181 0.937 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -1.072 -4.411 3.498 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -2.684 -8.255 0.810 1.00 0.00 H new ATOM 0 HE2 PHE A 84 0.284 -6.481 3.351 1.00 0.00 H new ATOM 0 HZ PHE A 84 -0.528 -8.404 2.014 1.00 0.00 H new ATOM 1306 N ALA A 85 -3.955 -4.572 -0.754 1.00 0.00 N ATOM 1307 CA ALA A 85 -4.849 -5.162 -1.767 1.00 0.00 C ATOM 1308 C ALA A 85 -4.363 -6.558 -2.143 1.00 0.00 C ATOM 1309 O ALA A 85 -3.209 -6.875 -1.983 1.00 0.00 O ATOM 1310 CB ALA A 85 -4.786 -4.217 -2.967 1.00 0.00 C ATOM 0 H ALA A 85 -3.010 -4.955 -0.725 1.00 0.00 H new ATOM 0 HA ALA A 85 -5.871 -5.271 -1.403 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -5.429 -4.595 -3.762 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -5.124 -3.225 -2.667 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -3.760 -4.156 -3.329 1.00 0.00 H new ATOM 1316 N THR A 86 -5.241 -7.398 -2.622 1.00 0.00 N ATOM 1317 CA THR A 86 -4.841 -8.787 -3.003 1.00 0.00 C ATOM 1318 C THR A 86 -6.096 -9.638 -3.243 1.00 0.00 C ATOM 1319 O THR A 86 -7.209 -9.158 -3.148 1.00 0.00 O ATOM 1320 CB THR A 86 -4.029 -9.339 -1.820 1.00 0.00 C ATOM 1321 OG1 THR A 86 -4.123 -10.751 -1.813 1.00 0.00 O ATOM 1322 CG2 THR A 86 -4.567 -8.792 -0.490 1.00 0.00 C ATOM 0 H THR A 86 -6.227 -7.181 -2.767 1.00 0.00 H new ATOM 0 HA THR A 86 -4.252 -8.804 -3.920 1.00 0.00 H new ATOM 0 HB THR A 86 -2.990 -9.028 -1.932 1.00 0.00 H new ATOM 0 HG1 THR A 86 -3.613 -11.117 -2.566 1.00 0.00 H new ATOM 0 HG21 THR A 86 -3.978 -9.195 0.334 1.00 0.00 H new ATOM 0 HG22 THR A 86 -4.496 -7.704 -0.489 1.00 0.00 H new ATOM 0 HG23 THR A 86 -5.609 -9.088 -0.370 1.00 0.00 H new ATOM 1330 N GLY A 87 -5.927 -10.893 -3.561 1.00 0.00 N ATOM 1331 CA GLY A 87 -7.109 -11.768 -3.815 1.00 0.00 C ATOM 1332 C GLY A 87 -7.978 -11.857 -2.559 1.00 0.00 C ATOM 1333 O GLY A 87 -9.120 -12.267 -2.615 1.00 0.00 O ATOM 0 H GLY A 87 -5.021 -11.351 -3.656 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -7.694 -11.370 -4.644 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -6.777 -12.764 -4.108 1.00 0.00 H new ATOM 1337 N TYR A 88 -7.452 -11.480 -1.428 1.00 0.00 N ATOM 1338 CA TYR A 88 -8.259 -11.551 -0.176 1.00 0.00 C ATOM 1339 C TYR A 88 -9.198 -10.346 -0.084 1.00 0.00 C ATOM 1340 O TYR A 88 -10.272 -10.425 0.479 1.00 0.00 O ATOM 1341 CB TYR A 88 -7.234 -11.525 0.959 1.00 0.00 C ATOM 1342 CG TYR A 88 -7.947 -11.539 2.289 1.00 0.00 C ATOM 1343 CD1 TYR A 88 -9.125 -12.278 2.446 1.00 0.00 C ATOM 1344 CD2 TYR A 88 -7.425 -10.815 3.367 1.00 0.00 C ATOM 1345 CE1 TYR A 88 -9.782 -12.291 3.682 1.00 0.00 C ATOM 1346 CE2 TYR A 88 -8.080 -10.828 4.602 1.00 0.00 C ATOM 1347 CZ TYR A 88 -9.259 -11.567 4.761 1.00 0.00 C ATOM 1348 OH TYR A 88 -9.905 -11.585 5.981 1.00 0.00 O ATOM 0 H TYR A 88 -6.502 -11.127 -1.315 1.00 0.00 H new ATOM 0 HA TYR A 88 -8.885 -12.443 -0.137 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -6.570 -12.386 0.882 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -6.611 -10.634 0.879 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -9.527 -12.838 1.614 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -6.515 -10.246 3.245 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -10.692 -12.859 3.804 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -7.677 -10.268 5.433 1.00 0.00 H new ATOM 0 HH TYR A 88 -9.261 -11.795 6.689 1.00 0.00 H new ATOM 1358 N GLY A 89 -8.803 -9.230 -0.630 1.00 0.00 N ATOM 1359 CA GLY A 89 -9.677 -8.024 -0.570 1.00 0.00 C ATOM 1360 C GLY A 89 -9.358 -7.227 0.695 1.00 0.00 C ATOM 1361 O GLY A 89 -9.991 -6.231 0.988 1.00 0.00 O ATOM 0 H GLY A 89 -7.915 -9.100 -1.114 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -9.521 -7.404 -1.453 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -10.726 -8.321 -0.571 1.00 0.00 H new ATOM 1365 N SER A 90 -8.379 -7.660 1.448 1.00 0.00 N ATOM 1366 CA SER A 90 -8.004 -6.933 2.699 1.00 0.00 C ATOM 1367 C SER A 90 -9.057 -7.138 3.797 1.00 0.00 C ATOM 1368 O SER A 90 -8.878 -6.703 4.917 1.00 0.00 O ATOM 1369 CB SER A 90 -7.924 -5.459 2.297 1.00 0.00 C ATOM 1370 OG SER A 90 -6.756 -4.880 2.863 1.00 0.00 O ATOM 0 H SER A 90 -7.820 -8.490 1.249 1.00 0.00 H new ATOM 0 HA SER A 90 -7.062 -7.299 3.108 1.00 0.00 H new ATOM 0 HB2 SER A 90 -7.900 -5.367 1.211 1.00 0.00 H new ATOM 0 HB3 SER A 90 -8.811 -4.928 2.642 1.00 0.00 H new ATOM 0 HG SER A 90 -6.701 -3.936 2.606 1.00 0.00 H new ATOM 1376 N LYS A 91 -10.149 -7.799 3.496 1.00 0.00 N ATOM 1377 CA LYS A 91 -11.203 -8.022 4.534 1.00 0.00 C ATOM 1378 C LYS A 91 -11.835 -6.679 4.931 1.00 0.00 C ATOM 1379 O LYS A 91 -13.023 -6.468 4.793 1.00 0.00 O ATOM 1380 CB LYS A 91 -10.458 -8.683 5.716 1.00 0.00 C ATOM 1381 CG LYS A 91 -10.745 -7.957 7.039 1.00 0.00 C ATOM 1382 CD LYS A 91 -10.300 -8.833 8.213 1.00 0.00 C ATOM 1383 CE LYS A 91 -9.162 -8.140 8.971 1.00 0.00 C ATOM 1384 NZ LYS A 91 -9.344 -8.541 10.395 1.00 0.00 N ATOM 0 H LYS A 91 -10.355 -8.193 2.578 1.00 0.00 H new ATOM 0 HA LYS A 91 -12.022 -8.651 4.186 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -10.760 -9.727 5.800 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.386 -8.676 5.521 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.218 -7.003 7.064 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -11.809 -7.735 7.120 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -11.140 -9.013 8.884 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -9.968 -9.805 7.849 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -8.189 -8.454 8.594 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -9.214 -7.057 8.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -8.600 -8.104 10.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -10.276 -8.223 10.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -9.283 -9.576 10.475 1.00 0.00 H new ATOM 1398 N GLY A 92 -11.036 -5.782 5.429 1.00 0.00 N ATOM 1399 CA GLY A 92 -11.545 -4.453 5.853 1.00 0.00 C ATOM 1400 C GLY A 92 -10.425 -3.751 6.619 1.00 0.00 C ATOM 1401 O GLY A 92 -10.627 -3.243 7.703 1.00 0.00 O ATOM 0 H GLY A 92 -10.034 -5.917 5.562 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -11.844 -3.863 4.986 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -12.428 -4.564 6.483 1.00 0.00 H new ATOM 1405 N LEU A 93 -9.239 -3.749 6.056 1.00 0.00 N ATOM 1406 CA LEU A 93 -8.066 -3.109 6.726 1.00 0.00 C ATOM 1407 C LEU A 93 -8.502 -1.911 7.570 1.00 0.00 C ATOM 1408 O LEU A 93 -9.154 -1.001 7.098 1.00 0.00 O ATOM 1409 CB LEU A 93 -7.134 -2.687 5.581 1.00 0.00 C ATOM 1410 CG LEU A 93 -7.496 -1.288 5.065 1.00 0.00 C ATOM 1411 CD1 LEU A 93 -6.540 -0.908 3.934 1.00 0.00 C ATOM 1412 CD2 LEU A 93 -8.931 -1.280 4.530 1.00 0.00 C ATOM 0 H LEU A 93 -9.034 -4.169 5.150 1.00 0.00 H new ATOM 0 HA LEU A 93 -7.567 -3.788 7.418 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -6.100 -2.695 5.927 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -7.203 -3.408 4.767 1.00 0.00 H new ATOM 0 HG LEU A 93 -7.414 -0.573 5.883 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -6.792 0.085 3.563 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -5.516 -0.907 4.308 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -6.629 -1.631 3.124 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -9.178 -0.283 4.166 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -9.019 -1.996 3.713 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -9.619 -1.555 5.329 1.00 0.00 H new ATOM 1424 N ASP A 94 -8.145 -1.908 8.822 1.00 0.00 N ATOM 1425 CA ASP A 94 -8.541 -0.776 9.703 1.00 0.00 C ATOM 1426 C ASP A 94 -7.365 0.169 9.886 1.00 0.00 C ATOM 1427 O ASP A 94 -6.228 -0.247 9.981 1.00 0.00 O ATOM 1428 CB ASP A 94 -8.949 -1.422 11.027 1.00 0.00 C ATOM 1429 CG ASP A 94 -7.846 -2.369 11.501 1.00 0.00 C ATOM 1430 OD1 ASP A 94 -7.832 -3.503 11.052 1.00 0.00 O ATOM 1431 OD2 ASP A 94 -7.033 -1.943 12.305 1.00 0.00 O ATOM 0 H ASP A 94 -7.596 -2.640 9.274 1.00 0.00 H new ATOM 0 HA ASP A 94 -9.356 -0.184 9.287 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -9.128 -0.653 11.778 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -9.883 -1.970 10.903 1.00 0.00 H new ATOM 1436 N THR A 95 -7.620 1.444 9.906 1.00 0.00 N ATOM 1437 CA THR A 95 -6.499 2.403 10.050 1.00 0.00 C ATOM 1438 C THR A 95 -7.026 3.845 10.085 1.00 0.00 C ATOM 1439 O THR A 95 -8.218 4.079 10.078 1.00 0.00 O ATOM 1440 CB THR A 95 -5.624 2.094 8.817 1.00 0.00 C ATOM 1441 OG1 THR A 95 -4.311 1.824 9.248 1.00 0.00 O ATOM 1442 CG2 THR A 95 -5.599 3.246 7.811 1.00 0.00 C ATOM 0 H THR A 95 -8.548 1.860 9.829 1.00 0.00 H new ATOM 0 HA THR A 95 -5.934 2.306 10.977 1.00 0.00 H new ATOM 0 HB THR A 95 -6.056 1.231 8.310 1.00 0.00 H new ATOM 0 HG1 THR A 95 -3.844 1.300 8.564 1.00 0.00 H new ATOM 0 HG21 THR A 95 -4.969 2.975 6.964 1.00 0.00 H new ATOM 0 HG22 THR A 95 -6.612 3.446 7.461 1.00 0.00 H new ATOM 0 HG23 THR A 95 -5.198 4.139 8.290 1.00 0.00 H new ATOM 1450 N ARG A 96 -6.145 4.809 10.134 1.00 0.00 N ATOM 1451 CA ARG A 96 -6.576 6.242 10.185 1.00 0.00 C ATOM 1452 C ARG A 96 -7.252 6.678 8.885 1.00 0.00 C ATOM 1453 O ARG A 96 -7.575 7.835 8.707 1.00 0.00 O ATOM 1454 CB ARG A 96 -5.279 7.031 10.358 1.00 0.00 C ATOM 1455 CG ARG A 96 -4.938 7.153 11.841 1.00 0.00 C ATOM 1456 CD ARG A 96 -4.768 8.632 12.198 1.00 0.00 C ATOM 1457 NE ARG A 96 -3.514 8.690 12.996 1.00 0.00 N ATOM 1458 CZ ARG A 96 -2.361 8.798 12.392 1.00 0.00 C ATOM 1459 NH1 ARG A 96 -2.279 8.625 11.100 1.00 0.00 N ATOM 1460 NH2 ARG A 96 -1.290 9.078 13.081 1.00 0.00 N ATOM 0 H ARG A 96 -5.135 4.666 10.141 1.00 0.00 H new ATOM 0 HA ARG A 96 -7.297 6.404 10.986 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -4.467 6.532 9.829 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -5.385 8.022 9.918 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -5.729 6.709 12.446 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -4.022 6.605 12.062 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -4.696 9.249 11.302 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -5.619 9.001 12.771 1.00 0.00 H new ATOM 0 HE ARG A 96 -3.555 8.645 14.014 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -3.116 8.405 10.561 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -1.378 8.710 10.630 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -1.353 9.212 14.090 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -0.389 9.163 12.611 1.00 0.00 H new ATOM 1474 N TYR A 97 -7.448 5.784 7.970 1.00 0.00 N ATOM 1475 CA TYR A 97 -8.072 6.172 6.688 1.00 0.00 C ATOM 1476 C TYR A 97 -9.596 6.225 6.856 1.00 0.00 C ATOM 1477 O TYR A 97 -10.167 7.296 6.843 1.00 0.00 O ATOM 1478 CB TYR A 97 -7.597 5.092 5.705 1.00 0.00 C ATOM 1479 CG TYR A 97 -6.107 5.288 5.424 1.00 0.00 C ATOM 1480 CD1 TYR A 97 -5.321 6.115 6.255 1.00 0.00 C ATOM 1481 CD2 TYR A 97 -5.506 4.652 4.329 1.00 0.00 C ATOM 1482 CE1 TYR A 97 -3.961 6.296 5.990 1.00 0.00 C ATOM 1483 CE2 TYR A 97 -4.141 4.842 4.067 1.00 0.00 C ATOM 1484 CZ TYR A 97 -3.370 5.661 4.898 1.00 0.00 C ATOM 1485 OH TYR A 97 -2.027 5.845 4.637 1.00 0.00 O ATOM 0 H TYR A 97 -7.202 4.798 8.055 1.00 0.00 H new ATOM 0 HA TYR A 97 -7.793 7.163 6.329 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -7.773 4.101 6.122 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -8.165 5.153 4.777 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -5.774 6.611 7.101 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -6.095 4.015 3.686 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -3.366 6.929 6.632 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -3.683 4.353 3.219 1.00 0.00 H new ATOM 0 HH TYR A 97 -1.524 5.063 4.945 1.00 0.00 H new ATOM 1495 N SER A 98 -10.240 5.089 7.063 1.00 0.00 N ATOM 1496 CA SER A 98 -11.741 5.052 7.286 1.00 0.00 C ATOM 1497 C SER A 98 -12.375 3.780 6.704 1.00 0.00 C ATOM 1498 O SER A 98 -13.476 3.824 6.192 1.00 0.00 O ATOM 1499 CB SER A 98 -12.348 6.269 6.575 1.00 0.00 C ATOM 1500 OG SER A 98 -12.399 7.364 7.481 1.00 0.00 O ATOM 0 H SER A 98 -9.788 4.175 7.088 1.00 0.00 H new ATOM 0 HA SER A 98 -11.937 5.064 8.358 1.00 0.00 H new ATOM 0 HB2 SER A 98 -11.749 6.531 5.703 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.349 6.033 6.215 1.00 0.00 H new ATOM 0 HG SER A 98 -11.509 7.767 7.558 1.00 0.00 H new ATOM 1506 N ASN A 99 -11.718 2.651 6.779 1.00 0.00 N ATOM 1507 CA ASN A 99 -12.334 1.401 6.222 1.00 0.00 C ATOM 1508 C ASN A 99 -13.011 1.699 4.882 1.00 0.00 C ATOM 1509 O ASN A 99 -14.188 1.987 4.841 1.00 0.00 O ATOM 1510 CB ASN A 99 -13.403 0.994 7.244 1.00 0.00 C ATOM 1511 CG ASN A 99 -12.788 0.185 8.388 1.00 0.00 C ATOM 1512 OD1 ASN A 99 -13.498 -0.287 9.254 1.00 0.00 O ATOM 1513 ND2 ASN A 99 -11.499 0.006 8.443 1.00 0.00 N ATOM 0 H ASN A 99 -10.794 2.537 7.195 1.00 0.00 H new ATOM 0 HA ASN A 99 -11.590 0.622 6.057 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -13.887 1.885 7.643 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -14.176 0.404 6.752 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -11.091 -0.528 9.210 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -10.898 0.400 7.719 1.00 0.00 H new ATOM 1520 N ILE A 100 -12.297 1.627 3.789 1.00 0.00 N ATOM 1521 CA ILE A 100 -12.953 1.914 2.472 1.00 0.00 C ATOM 1522 C ILE A 100 -12.052 1.650 1.240 1.00 0.00 C ATOM 1523 O ILE A 100 -12.565 1.262 0.209 1.00 0.00 O ATOM 1524 CB ILE A 100 -13.374 3.401 2.483 1.00 0.00 C ATOM 1525 CG1 ILE A 100 -12.478 4.260 3.394 1.00 0.00 C ATOM 1526 CG2 ILE A 100 -14.824 3.528 2.949 1.00 0.00 C ATOM 1527 CD1 ILE A 100 -11.443 4.989 2.535 1.00 0.00 C ATOM 0 H ILE A 100 -11.307 1.387 3.746 1.00 0.00 H new ATOM 0 HA ILE A 100 -13.799 1.234 2.370 1.00 0.00 H new ATOM 0 HB ILE A 100 -13.266 3.769 1.463 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -13.083 4.980 3.946 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -11.979 3.631 4.131 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -15.114 4.579 2.954 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -15.474 2.976 2.270 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -14.920 3.120 3.955 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -10.805 5.599 3.174 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -10.832 4.259 2.003 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -11.953 5.628 1.815 1.00 0.00 H new ATOM 1539 N PRO A 101 -10.760 1.901 1.334 1.00 0.00 N ATOM 1540 CA PRO A 101 -9.869 1.720 0.170 1.00 0.00 C ATOM 1541 C PRO A 101 -9.124 0.377 0.210 1.00 0.00 C ATOM 1542 O PRO A 101 -8.019 0.290 0.709 1.00 0.00 O ATOM 1543 CB PRO A 101 -8.880 2.865 0.354 1.00 0.00 C ATOM 1544 CG PRO A 101 -8.884 3.176 1.832 1.00 0.00 C ATOM 1545 CD PRO A 101 -9.985 2.366 2.474 1.00 0.00 C ATOM 0 HA PRO A 101 -10.407 1.720 -0.778 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -7.884 2.579 0.017 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -9.177 3.736 -0.230 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -7.920 2.929 2.276 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -9.048 4.241 1.997 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -9.587 1.535 3.057 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -10.588 2.971 3.152 1.00 0.00 H new ATOM 1553 N LEU A 102 -9.695 -0.661 -0.340 1.00 0.00 N ATOM 1554 CA LEU A 102 -8.982 -1.977 -0.358 1.00 0.00 C ATOM 1555 C LEU A 102 -9.416 -2.794 -1.580 1.00 0.00 C ATOM 1556 O LEU A 102 -10.504 -2.625 -2.091 1.00 0.00 O ATOM 1557 CB LEU A 102 -9.329 -2.702 0.959 1.00 0.00 C ATOM 1558 CG LEU A 102 -10.817 -2.567 1.324 1.00 0.00 C ATOM 1559 CD1 LEU A 102 -11.110 -1.151 1.814 1.00 0.00 C ATOM 1560 CD2 LEU A 102 -11.693 -2.877 0.111 1.00 0.00 C ATOM 0 H LEU A 102 -10.617 -0.658 -0.775 1.00 0.00 H new ATOM 0 HA LEU A 102 -7.903 -1.841 -0.433 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -9.074 -3.758 0.868 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.721 -2.295 1.767 1.00 0.00 H new ATOM 0 HG LEU A 102 -11.043 -3.279 2.118 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -12.166 -1.066 2.070 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -10.505 -0.938 2.695 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -10.869 -0.436 1.027 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -12.743 -2.777 0.386 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -11.460 -2.179 -0.694 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -11.501 -3.896 -0.225 1.00 0.00 H new ATOM 1572 N LEU A 103 -8.569 -3.664 -2.075 1.00 0.00 N ATOM 1573 CA LEU A 103 -8.967 -4.466 -3.287 1.00 0.00 C ATOM 1574 C LEU A 103 -7.803 -5.339 -3.779 1.00 0.00 C ATOM 1575 O LEU A 103 -6.961 -5.730 -3.014 1.00 0.00 O ATOM 1576 CB LEU A 103 -9.347 -3.421 -4.346 1.00 0.00 C ATOM 1577 CG LEU A 103 -8.280 -2.324 -4.405 1.00 0.00 C ATOM 1578 CD1 LEU A 103 -7.082 -2.816 -5.217 1.00 0.00 C ATOM 1579 CD2 LEU A 103 -8.868 -1.083 -5.077 1.00 0.00 C ATOM 0 H LEU A 103 -7.638 -3.855 -1.706 1.00 0.00 H new ATOM 0 HA LEU A 103 -9.788 -5.149 -3.069 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -9.444 -3.898 -5.321 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -10.317 -2.984 -4.107 1.00 0.00 H new ATOM 0 HG LEU A 103 -7.957 -2.078 -3.393 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -6.324 -2.034 -5.258 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -6.662 -3.704 -4.744 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -7.404 -3.062 -6.229 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -8.111 -0.300 -5.121 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -9.189 -1.334 -6.088 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -9.724 -0.729 -4.502 1.00 0.00 H new ATOM 1591 N THR A 104 -7.747 -5.651 -5.053 1.00 0.00 N ATOM 1592 CA THR A 104 -6.626 -6.492 -5.566 1.00 0.00 C ATOM 1593 C THR A 104 -5.758 -5.674 -6.533 1.00 0.00 C ATOM 1594 O THR A 104 -5.029 -4.796 -6.117 1.00 0.00 O ATOM 1595 CB THR A 104 -7.271 -7.701 -6.270 1.00 0.00 C ATOM 1596 OG1 THR A 104 -6.370 -8.218 -7.240 1.00 0.00 O ATOM 1597 CG2 THR A 104 -8.576 -7.290 -6.958 1.00 0.00 C ATOM 0 H THR A 104 -8.428 -5.359 -5.754 1.00 0.00 H new ATOM 0 HA THR A 104 -5.972 -6.829 -4.762 1.00 0.00 H new ATOM 0 HB THR A 104 -7.493 -8.464 -5.524 1.00 0.00 H new ATOM 0 HG1 THR A 104 -6.778 -8.988 -7.688 1.00 0.00 H new ATOM 0 HG21 THR A 104 -9.017 -8.157 -7.450 1.00 0.00 H new ATOM 0 HG22 THR A 104 -9.272 -6.901 -6.215 1.00 0.00 H new ATOM 0 HG23 THR A 104 -8.369 -6.519 -7.700 1.00 0.00 H new ATOM 1605 N LYS A 105 -5.815 -5.940 -7.813 1.00 0.00 N ATOM 1606 CA LYS A 105 -4.968 -5.147 -8.751 1.00 0.00 C ATOM 1607 C LYS A 105 -5.511 -5.180 -10.181 1.00 0.00 C ATOM 1608 O LYS A 105 -4.793 -5.496 -11.107 1.00 0.00 O ATOM 1609 CB LYS A 105 -3.586 -5.791 -8.691 1.00 0.00 C ATOM 1610 CG LYS A 105 -2.529 -4.687 -8.711 1.00 0.00 C ATOM 1611 CD LYS A 105 -1.628 -4.833 -7.488 1.00 0.00 C ATOM 1612 CE LYS A 105 -0.177 -4.534 -7.879 1.00 0.00 C ATOM 1613 NZ LYS A 105 0.207 -5.629 -8.817 1.00 0.00 N ATOM 0 H LYS A 105 -6.399 -6.657 -8.242 1.00 0.00 H new ATOM 0 HA LYS A 105 -4.950 -4.096 -8.464 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -3.488 -6.391 -7.787 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -3.446 -6.464 -9.537 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -1.937 -4.751 -9.624 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -3.008 -3.708 -8.710 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -1.951 -4.150 -6.702 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -1.706 -5.843 -7.085 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -0.091 -3.558 -8.356 1.00 0.00 H new ATOM 0 HE3 LYS A 105 0.472 -4.519 -7.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 1.228 -5.813 -8.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -0.320 -6.493 -8.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -0.018 -5.346 -9.792 1.00 0.00 H new ATOM 1627 N PRO A 106 -6.754 -4.816 -10.320 1.00 0.00 N ATOM 1628 CA PRO A 106 -7.376 -4.766 -11.661 1.00 0.00 C ATOM 1629 C PRO A 106 -6.815 -3.556 -12.415 1.00 0.00 C ATOM 1630 O PRO A 106 -6.732 -3.545 -13.625 1.00 0.00 O ATOM 1631 CB PRO A 106 -8.864 -4.593 -11.360 1.00 0.00 C ATOM 1632 CG PRO A 106 -8.909 -3.958 -10.005 1.00 0.00 C ATOM 1633 CD PRO A 106 -7.684 -4.422 -9.259 1.00 0.00 C ATOM 0 HA PRO A 106 -7.187 -5.644 -12.279 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -9.348 -3.965 -12.108 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -9.383 -5.552 -11.365 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -8.921 -2.871 -10.089 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -9.816 -4.247 -9.474 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -7.269 -3.628 -8.639 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -7.912 -5.257 -8.597 1.00 0.00 H new ATOM 1641 N PHE A 107 -6.423 -2.540 -11.681 1.00 0.00 N ATOM 1642 CA PHE A 107 -5.838 -1.298 -12.290 1.00 0.00 C ATOM 1643 C PHE A 107 -6.868 -0.482 -13.091 1.00 0.00 C ATOM 1644 O PHE A 107 -6.706 0.711 -13.256 1.00 0.00 O ATOM 1645 CB PHE A 107 -4.689 -1.771 -13.182 1.00 0.00 C ATOM 1646 CG PHE A 107 -3.415 -1.766 -12.374 1.00 0.00 C ATOM 1647 CD1 PHE A 107 -2.988 -0.587 -11.751 1.00 0.00 C ATOM 1648 CD2 PHE A 107 -2.668 -2.941 -12.238 1.00 0.00 C ATOM 1649 CE1 PHE A 107 -1.812 -0.584 -10.993 1.00 0.00 C ATOM 1650 CE2 PHE A 107 -1.491 -2.938 -11.479 1.00 0.00 C ATOM 1651 CZ PHE A 107 -1.063 -1.759 -10.857 1.00 0.00 C ATOM 0 H PHE A 107 -6.485 -2.518 -10.663 1.00 0.00 H new ATOM 0 HA PHE A 107 -5.494 -0.620 -11.509 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -4.892 -2.773 -13.560 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -4.589 -1.117 -14.048 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -3.566 0.319 -11.855 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -2.999 -3.850 -12.718 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -1.482 0.325 -10.513 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -0.914 -3.845 -11.374 1.00 0.00 H new ATOM 0 HZ PHE A 107 -0.155 -1.756 -10.272 1.00 0.00 H new ATOM 1661 N LEU A 108 -7.923 -1.078 -13.585 1.00 0.00 N ATOM 1662 CA LEU A 108 -8.918 -0.264 -14.346 1.00 0.00 C ATOM 1663 C LEU A 108 -9.973 0.323 -13.393 1.00 0.00 C ATOM 1664 O LEU A 108 -10.928 0.942 -13.817 1.00 0.00 O ATOM 1665 CB LEU A 108 -9.558 -1.189 -15.409 1.00 0.00 C ATOM 1666 CG LEU A 108 -10.062 -2.525 -14.825 1.00 0.00 C ATOM 1667 CD1 LEU A 108 -8.953 -3.573 -14.886 1.00 0.00 C ATOM 1668 CD2 LEU A 108 -10.531 -2.356 -13.379 1.00 0.00 C ATOM 0 H LEU A 108 -8.136 -2.072 -13.498 1.00 0.00 H new ATOM 0 HA LEU A 108 -8.436 0.581 -14.837 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -10.391 -0.668 -15.881 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -8.827 -1.394 -16.191 1.00 0.00 H new ATOM 0 HG LEU A 108 -10.911 -2.855 -15.424 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -9.317 -4.513 -14.472 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -8.653 -3.725 -15.923 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -8.096 -3.230 -14.307 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -10.880 -3.315 -12.995 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -9.702 -2.000 -12.767 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -11.345 -1.632 -13.343 1.00 0.00 H new ATOM 1680 N ASP A 109 -9.802 0.132 -12.107 1.00 0.00 N ATOM 1681 CA ASP A 109 -10.798 0.686 -11.130 1.00 0.00 C ATOM 1682 C ASP A 109 -10.366 0.480 -9.660 1.00 0.00 C ATOM 1683 O ASP A 109 -11.147 0.697 -8.754 1.00 0.00 O ATOM 1684 CB ASP A 109 -12.098 -0.080 -11.409 1.00 0.00 C ATOM 1685 CG ASP A 109 -12.065 -1.437 -10.697 1.00 0.00 C ATOM 1686 OD1 ASP A 109 -11.112 -2.170 -10.901 1.00 0.00 O ATOM 1687 OD2 ASP A 109 -12.991 -1.717 -9.953 1.00 0.00 O ATOM 0 H ASP A 109 -9.023 -0.379 -11.692 1.00 0.00 H new ATOM 0 HA ASP A 109 -10.901 1.764 -11.257 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -12.954 0.501 -11.065 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -12.222 -0.225 -12.482 1.00 0.00 H new ATOM 1692 N SER A 110 -9.158 0.050 -9.401 1.00 0.00 N ATOM 1693 CA SER A 110 -8.742 -0.173 -7.982 1.00 0.00 C ATOM 1694 C SER A 110 -7.788 0.924 -7.505 1.00 0.00 C ATOM 1695 O SER A 110 -8.136 1.736 -6.672 1.00 0.00 O ATOM 1696 CB SER A 110 -8.032 -1.521 -7.991 1.00 0.00 C ATOM 1697 OG SER A 110 -8.974 -2.552 -7.730 1.00 0.00 O ATOM 0 H SER A 110 -8.447 -0.155 -10.103 1.00 0.00 H new ATOM 0 HA SER A 110 -9.596 -0.153 -7.305 1.00 0.00 H new ATOM 0 HB2 SER A 110 -7.554 -1.686 -8.956 1.00 0.00 H new ATOM 0 HB3 SER A 110 -7.244 -1.534 -7.238 1.00 0.00 H new ATOM 0 HG SER A 110 -9.826 -2.333 -8.161 1.00 0.00 H new ATOM 1703 N GLU A 111 -6.587 0.943 -8.022 1.00 0.00 N ATOM 1704 CA GLU A 111 -5.596 1.980 -7.601 1.00 0.00 C ATOM 1705 C GLU A 111 -6.301 3.317 -7.364 1.00 0.00 C ATOM 1706 O GLU A 111 -6.061 3.997 -6.385 1.00 0.00 O ATOM 1707 CB GLU A 111 -4.625 2.083 -8.778 1.00 0.00 C ATOM 1708 CG GLU A 111 -3.692 3.282 -8.587 1.00 0.00 C ATOM 1709 CD GLU A 111 -2.476 2.857 -7.763 1.00 0.00 C ATOM 1710 OE1 GLU A 111 -2.435 1.709 -7.351 1.00 0.00 O ATOM 1711 OE2 GLU A 111 -1.606 3.687 -7.558 1.00 0.00 O ATOM 0 H GLU A 111 -6.248 0.282 -8.721 1.00 0.00 H new ATOM 0 HA GLU A 111 -5.089 1.723 -6.671 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -4.040 1.167 -8.858 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -5.181 2.189 -9.710 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -3.372 3.665 -9.556 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -4.221 4.091 -8.083 1.00 0.00 H new ATOM 1718 N LEU A 112 -7.173 3.693 -8.253 1.00 0.00 N ATOM 1719 CA LEU A 112 -7.899 4.983 -8.079 1.00 0.00 C ATOM 1720 C LEU A 112 -8.644 4.997 -6.740 1.00 0.00 C ATOM 1721 O LEU A 112 -8.654 5.986 -6.046 1.00 0.00 O ATOM 1722 CB LEU A 112 -8.881 5.071 -9.256 1.00 0.00 C ATOM 1723 CG LEU A 112 -9.504 3.701 -9.536 1.00 0.00 C ATOM 1724 CD1 LEU A 112 -11.030 3.819 -9.523 1.00 0.00 C ATOM 1725 CD2 LEU A 112 -9.040 3.207 -10.909 1.00 0.00 C ATOM 0 H LEU A 112 -7.416 3.166 -9.092 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.218 5.834 -8.069 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.665 5.794 -9.031 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -8.362 5.430 -10.145 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.191 2.994 -8.768 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -11.472 2.843 -9.723 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -11.359 4.174 -8.546 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -11.347 4.525 -10.291 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -9.481 2.231 -11.113 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.355 3.915 -11.676 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.953 3.123 -10.917 1.00 0.00 H new ATOM 1737 N GLU A 113 -9.262 3.910 -6.368 1.00 0.00 N ATOM 1738 CA GLU A 113 -10.004 3.873 -5.068 1.00 0.00 C ATOM 1739 C GLU A 113 -9.092 4.259 -3.900 1.00 0.00 C ATOM 1740 O GLU A 113 -9.308 5.253 -3.236 1.00 0.00 O ATOM 1741 CB GLU A 113 -10.471 2.423 -4.925 1.00 0.00 C ATOM 1742 CG GLU A 113 -11.654 2.354 -3.955 1.00 0.00 C ATOM 1743 CD GLU A 113 -12.832 1.657 -4.639 1.00 0.00 C ATOM 1744 OE1 GLU A 113 -12.611 0.619 -5.240 1.00 0.00 O ATOM 1745 OE2 GLU A 113 -13.935 2.173 -4.551 1.00 0.00 O ATOM 0 H GLU A 113 -9.287 3.044 -6.906 1.00 0.00 H new ATOM 0 HA GLU A 113 -10.833 4.581 -5.055 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -10.763 2.027 -5.898 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -9.653 1.802 -4.560 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -11.369 1.810 -3.054 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -11.942 3.358 -3.644 1.00 0.00 H new ATOM 1752 N ALA A 114 -8.089 3.474 -3.627 1.00 0.00 N ATOM 1753 CA ALA A 114 -7.183 3.790 -2.483 1.00 0.00 C ATOM 1754 C ALA A 114 -6.839 5.284 -2.438 1.00 0.00 C ATOM 1755 O ALA A 114 -6.715 5.861 -1.376 1.00 0.00 O ATOM 1756 CB ALA A 114 -5.922 2.962 -2.732 1.00 0.00 C ATOM 0 H ALA A 114 -7.855 2.627 -4.145 1.00 0.00 H new ATOM 0 HA ALA A 114 -7.653 3.555 -1.528 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.205 3.141 -1.931 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -6.181 1.904 -2.758 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.480 3.251 -3.685 1.00 0.00 H new ATOM 1762 N VAL A 115 -6.669 5.915 -3.567 1.00 0.00 N ATOM 1763 CA VAL A 115 -6.315 7.368 -3.555 1.00 0.00 C ATOM 1764 C VAL A 115 -7.559 8.232 -3.807 1.00 0.00 C ATOM 1765 O VAL A 115 -7.552 9.426 -3.584 1.00 0.00 O ATOM 1766 CB VAL A 115 -5.296 7.548 -4.686 1.00 0.00 C ATOM 1767 CG1 VAL A 115 -4.482 8.818 -4.435 1.00 0.00 C ATOM 1768 CG2 VAL A 115 -4.346 6.343 -4.735 1.00 0.00 C ATOM 0 H VAL A 115 -6.758 5.494 -4.492 1.00 0.00 H new ATOM 0 HA VAL A 115 -5.910 7.677 -2.591 1.00 0.00 H new ATOM 0 HB VAL A 115 -5.827 7.626 -5.635 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -3.756 8.949 -5.237 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -5.150 9.679 -4.406 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -3.959 8.732 -3.483 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -3.626 6.480 -5.542 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -3.816 6.258 -3.786 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -4.920 5.434 -4.912 1.00 0.00 H new ATOM 1778 N LEU A 116 -8.620 7.638 -4.278 1.00 0.00 N ATOM 1779 CA LEU A 116 -9.862 8.419 -4.554 1.00 0.00 C ATOM 1780 C LEU A 116 -10.808 8.370 -3.352 1.00 0.00 C ATOM 1781 O LEU A 116 -11.816 9.042 -3.317 1.00 0.00 O ATOM 1782 CB LEU A 116 -10.499 7.739 -5.766 1.00 0.00 C ATOM 1783 CG LEU A 116 -11.685 8.569 -6.259 1.00 0.00 C ATOM 1784 CD1 LEU A 116 -11.409 9.044 -7.686 1.00 0.00 C ATOM 1785 CD2 LEU A 116 -12.951 7.709 -6.245 1.00 0.00 C ATOM 0 H LEU A 116 -8.682 6.641 -4.485 1.00 0.00 H new ATOM 0 HA LEU A 116 -9.648 9.471 -4.741 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -9.763 7.630 -6.563 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -10.831 6.736 -5.499 1.00 0.00 H new ATOM 0 HG LEU A 116 -11.825 9.431 -5.606 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -12.252 9.636 -8.042 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -10.506 9.654 -7.698 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -11.272 8.180 -8.337 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -13.797 8.300 -6.596 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -12.813 6.848 -6.899 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -13.146 7.365 -5.229 1.00 0.00 H new ATOM 1797 N VAL A 117 -10.494 7.574 -2.370 1.00 0.00 N ATOM 1798 CA VAL A 117 -11.378 7.479 -1.175 1.00 0.00 C ATOM 1799 C VAL A 117 -11.033 8.582 -0.172 1.00 0.00 C ATOM 1800 O VAL A 117 -11.698 8.754 0.831 1.00 0.00 O ATOM 1801 CB VAL A 117 -11.071 6.106 -0.579 1.00 0.00 C ATOM 1802 CG1 VAL A 117 -11.431 5.016 -1.587 1.00 0.00 C ATOM 1803 CG2 VAL A 117 -9.580 6.024 -0.254 1.00 0.00 C ATOM 0 H VAL A 117 -9.662 6.984 -2.343 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.432 7.597 -1.426 1.00 0.00 H new ATOM 0 HB VAL A 117 -11.656 5.963 0.330 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -11.211 4.038 -1.159 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -12.493 5.077 -1.825 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -10.846 5.154 -2.497 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.354 5.047 0.172 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -9.000 6.165 -1.166 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.321 6.802 0.465 1.00 0.00 H new ATOM 1813 N GLN A 118 -9.989 9.323 -0.425 1.00 0.00 N ATOM 1814 CA GLN A 118 -9.592 10.399 0.528 1.00 0.00 C ATOM 1815 C GLN A 118 -10.154 11.755 0.091 1.00 0.00 C ATOM 1816 O GLN A 118 -9.855 12.775 0.681 1.00 0.00 O ATOM 1817 CB GLN A 118 -8.061 10.430 0.488 1.00 0.00 C ATOM 1818 CG GLN A 118 -7.503 9.004 0.505 1.00 0.00 C ATOM 1819 CD GLN A 118 -6.018 9.027 0.131 1.00 0.00 C ATOM 1820 OE1 GLN A 118 -5.203 8.414 0.792 1.00 0.00 O ATOM 1821 NE2 GLN A 118 -5.628 9.713 -0.910 1.00 0.00 N ATOM 0 H GLN A 118 -9.395 9.231 -1.249 1.00 0.00 H new ATOM 0 HA GLN A 118 -9.978 10.205 1.529 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -7.724 10.950 -0.409 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -7.679 10.988 1.343 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -7.632 8.564 1.494 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -8.055 8.379 -0.197 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -6.310 10.228 -1.466 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -4.641 9.733 -1.167 1.00 0.00 H new ATOM 1830 N ILE A 119 -10.957 11.786 -0.935 1.00 0.00 N ATOM 1831 CA ILE A 119 -11.515 13.095 -1.392 1.00 0.00 C ATOM 1832 C ILE A 119 -13.008 13.193 -1.074 1.00 0.00 C ATOM 1833 O ILE A 119 -13.647 14.188 -1.350 1.00 0.00 O ATOM 1834 CB ILE A 119 -11.282 13.137 -2.905 1.00 0.00 C ATOM 1835 CG1 ILE A 119 -11.599 11.776 -3.535 1.00 0.00 C ATOM 1836 CG2 ILE A 119 -9.817 13.479 -3.177 1.00 0.00 C ATOM 1837 CD1 ILE A 119 -12.981 11.295 -3.086 1.00 0.00 C ATOM 0 H ILE A 119 -11.251 10.972 -1.474 1.00 0.00 H new ATOM 0 HA ILE A 119 -11.034 13.932 -0.886 1.00 0.00 H new ATOM 0 HB ILE A 119 -11.936 13.892 -3.341 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -11.568 11.854 -4.622 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -10.841 11.048 -3.246 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -9.644 13.510 -4.253 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -9.584 14.452 -2.743 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -9.177 12.719 -2.729 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -13.195 10.327 -3.540 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -12.998 11.198 -2.000 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -13.736 12.017 -3.397 1.00 0.00 H new ATOM 1849 N SER A 120 -13.569 12.165 -0.505 1.00 0.00 N ATOM 1850 CA SER A 120 -15.022 12.191 -0.180 1.00 0.00 C ATOM 1851 C SER A 120 -15.368 11.005 0.721 1.00 0.00 C ATOM 1852 O SER A 120 -15.006 9.879 0.443 1.00 0.00 O ATOM 1853 CB SER A 120 -15.727 12.063 -1.530 1.00 0.00 C ATOM 1854 OG SER A 120 -15.601 13.284 -2.248 1.00 0.00 O ATOM 0 H SER A 120 -13.083 11.305 -0.250 1.00 0.00 H new ATOM 0 HA SER A 120 -15.320 13.096 0.349 1.00 0.00 H new ATOM 0 HB2 SER A 120 -15.292 11.245 -2.104 1.00 0.00 H new ATOM 0 HB3 SER A 120 -16.780 11.823 -1.381 1.00 0.00 H new ATOM 0 HG SER A 120 -15.055 13.913 -1.731 1.00 0.00 H new ATOM 1860 N LYS A 121 -16.056 11.244 1.801 1.00 0.00 N ATOM 1861 CA LYS A 121 -16.406 10.121 2.715 1.00 0.00 C ATOM 1862 C LYS A 121 -17.797 10.334 3.318 1.00 0.00 C ATOM 1863 O LYS A 121 -18.668 9.493 3.205 1.00 0.00 O ATOM 1864 CB LYS A 121 -15.324 10.162 3.797 1.00 0.00 C ATOM 1865 CG LYS A 121 -15.672 9.178 4.916 1.00 0.00 C ATOM 1866 CD LYS A 121 -14.387 8.554 5.470 1.00 0.00 C ATOM 1867 CE LYS A 121 -13.368 9.654 5.787 1.00 0.00 C ATOM 1868 NZ LYS A 121 -13.882 10.315 7.019 1.00 0.00 N ATOM 0 H LYS A 121 -16.390 12.163 2.090 1.00 0.00 H new ATOM 0 HA LYS A 121 -16.441 9.158 2.205 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -14.356 9.909 3.366 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -15.239 11.171 4.201 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -16.211 9.692 5.712 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -16.332 8.398 4.536 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -14.609 7.982 6.371 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -13.969 7.857 4.744 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -12.374 9.236 5.949 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -13.285 10.364 4.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -14.076 11.317 6.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -14.759 9.847 7.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -13.170 10.243 7.774 1.00 0.00 H new ATOM 1882 N GLU A 122 -18.015 11.449 3.954 1.00 0.00 N ATOM 1883 CA GLU A 122 -19.351 11.712 4.562 1.00 0.00 C ATOM 1884 C GLU A 122 -19.593 13.219 4.667 1.00 0.00 C ATOM 1885 O GLU A 122 -20.153 13.704 5.631 1.00 0.00 O ATOM 1886 CB GLU A 122 -19.290 11.077 5.951 1.00 0.00 C ATOM 1887 CG GLU A 122 -17.952 11.416 6.618 1.00 0.00 C ATOM 1888 CD GLU A 122 -18.200 12.212 7.902 1.00 0.00 C ATOM 1889 OE1 GLU A 122 -19.354 12.427 8.233 1.00 0.00 O ATOM 1890 OE2 GLU A 122 -17.228 12.596 8.532 1.00 0.00 O ATOM 0 H GLU A 122 -17.327 12.191 4.080 1.00 0.00 H new ATOM 0 HA GLU A 122 -20.165 11.300 3.966 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -20.115 11.441 6.564 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -19.404 9.996 5.872 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -17.407 10.500 6.846 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -17.331 11.995 5.935 1.00 0.00 H new ATOM 1897 N VAL A 123 -19.172 13.959 3.678 1.00 0.00 N ATOM 1898 CA VAL A 123 -19.370 15.437 3.707 1.00 0.00 C ATOM 1899 C VAL A 123 -20.814 15.773 4.086 1.00 0.00 C ATOM 1900 O VAL A 123 -21.074 16.929 4.377 1.00 0.00 O ATOM 1901 CB VAL A 123 -19.069 15.907 2.283 1.00 0.00 C ATOM 1902 CG1 VAL A 123 -20.016 15.214 1.301 1.00 0.00 C ATOM 1903 CG2 VAL A 123 -19.265 17.423 2.199 1.00 0.00 C ATOM 0 H VAL A 123 -18.698 13.603 2.848 1.00 0.00 H new ATOM 0 HA VAL A 123 -18.728 15.922 4.442 1.00 0.00 H new ATOM 0 HB VAL A 123 -18.040 15.656 2.027 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -19.799 15.551 0.287 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -19.877 14.135 1.362 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -21.047 15.462 1.553 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -19.051 17.762 1.185 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -20.295 17.671 2.455 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -18.588 17.917 2.897 1.00 0.00 H new TER 1913 VAL A 123 HETATM 1914 CA CA A 201 1.057 -10.664 -9.497 1.00 0.00 CA HETATM 1915 BE BEF A 202 -1.192 -8.904 -7.999 1.00 0.00 BE HETATM 1916 F1 BEF A 202 -0.676 -7.538 -8.306 1.00 0.00 F HETATM 1917 F2 BEF A 202 -0.185 -8.804 -9.553 1.00 0.00 F HETATM 1918 F3 BEF A 202 -0.124 -9.735 -7.883 1.00 0.00 F