USER MOD reduce.3.24.130724 H: found=0, std=0, add=1015, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1017 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 90 THR OG1 : rot 180:sc= 0.567 USER MOD Set 1.2: A 93 ASN : amide:sc= -0.406! C(o=0.16!,f=-5.2!) USER MOD Set 2.1: A 43 TYR OH : rot -136:sc= 0.323 USER MOD Set 2.2: A 68 HIS : no HD1:sc= -2.11! X(o=-1.8!,f=-1.7) USER MOD Single : A 14 GLN : amide:sc= -5.34 X(o=-5.3,f=-5.7!) USER MOD Single : A 15 THR OG1 : rot 180:sc=-0.00554 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl 142:sc= -4.66! (180deg=-10.3!) USER MOD Single : A 39 LYS NZ :NH3+ -140:sc= -0.153 (180deg=-2.26!) USER MOD Single : A 48 GLN : amide:sc= -1.32 K(o=-1.3,f=-4.7!) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot -169:sc= -1.4 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 MET CE :methyl 167:sc= -8.24! (180deg=-9.17!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 HIS : no HD1:sc= -0.633 X(o=-0.63,f=-0.23) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot -22:sc= -0.137 USER MOD Single : A 88 MET CE :methyl -152:sc= -8.13! (180deg=-10.1!) USER MOD Single : A 98 CYS SG : rot 180:sc= -0.0425 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 ASN : amide:sc= -2.38 X(o=-2.4,f=-2.7) USER MOD Single : A 104 GLN : amide:sc= 0.528 K(o=0.53,f=0) USER MOD Single : A 106 TYR OH : rot -87:sc= 0.0353 USER MOD Single : A 108 SER OG : rot -148:sc= -1.53 USER MOD Single : A 109 TYR OH : rot -30:sc= 1.24 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= -4.9! C(o=-4.9!,f=-4.7!) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 90:sc= -0.466 USER MOD Single : A 121 LYS NZ :NH3+ -160:sc= -0.0637 (180deg=-0.379) USER MOD Single : A 127 ASN : amide:sc= -2.13 X(o=-2.1,f=-2.1) USER MOD Single : A 133 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 140 LYS NZ :NH3+ -157:sc= -0.026 (180deg=-0.248) USER MOD Single : A 144 GLN : amide:sc= -2.32 X(o=-2.3,f=-1.8!) USER MOD Single : A 145 TYR OH : rot 130:sc= -0.869 USER MOD Single : A 147 ASN : amide:sc= -4.14! K(o=-4.1!,f=-2.7) USER MOD ----------------------------------------------------------------- ATOM 22 N ILE A 10 -10.731 -2.856 -18.330 1.00 0.00 N ATOM 23 CA ILE A 10 -9.488 -2.287 -17.834 1.00 0.00 C ATOM 24 C ILE A 10 -9.654 -1.783 -16.404 1.00 0.00 C ATOM 25 O ILE A 10 -8.990 -2.262 -15.486 1.00 0.00 O ATOM 26 CB ILE A 10 -9.013 -1.123 -18.725 1.00 0.00 C ATOM 27 CG1 ILE A 10 -8.940 -1.560 -20.191 1.00 0.00 C ATOM 28 CG2 ILE A 10 -7.664 -0.612 -18.250 1.00 0.00 C ATOM 29 CD1 ILE A 10 -8.238 -2.884 -20.400 1.00 0.00 C ATOM 0 HA ILE A 10 -8.740 -3.080 -17.855 1.00 0.00 H new ATOM 0 HB ILE A 10 -9.736 -0.311 -18.649 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -9.952 -1.629 -20.591 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -8.423 -0.791 -20.764 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -7.341 0.210 -18.889 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -7.750 -0.261 -17.222 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -6.932 -1.418 -18.298 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -8.226 -3.126 -21.463 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -7.214 -2.815 -20.032 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -8.767 -3.666 -19.856 1.00 0.00 H new ATOM 41 N ARG A 11 -10.551 -0.816 -16.223 1.00 0.00 N ATOM 42 CA ARG A 11 -10.813 -0.249 -14.904 1.00 0.00 C ATOM 43 C ARG A 11 -11.065 -1.356 -13.883 1.00 0.00 C ATOM 44 O ARG A 11 -10.776 -1.204 -12.695 1.00 0.00 O ATOM 45 CB ARG A 11 -12.015 0.694 -14.962 1.00 0.00 C ATOM 46 CG ARG A 11 -12.355 1.334 -13.626 1.00 0.00 C ATOM 47 CD ARG A 11 -11.276 2.312 -13.180 1.00 0.00 C ATOM 48 NE ARG A 11 -11.822 3.635 -12.890 1.00 0.00 N ATOM 49 CZ ARG A 11 -12.071 4.555 -13.819 1.00 0.00 C ATOM 50 NH1 ARG A 11 -11.826 4.303 -15.098 1.00 0.00 N ATOM 51 NH2 ARG A 11 -12.566 5.734 -13.466 1.00 0.00 N ATOM 0 H ARG A 11 -11.108 -0.409 -16.974 1.00 0.00 H new ATOM 0 HA ARG A 11 -9.934 0.316 -14.593 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -11.814 1.480 -15.690 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -12.883 0.141 -15.321 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -13.309 1.855 -13.704 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -12.477 0.557 -12.871 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -10.779 1.923 -12.292 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -10.518 2.395 -13.959 1.00 0.00 H new ATOM 0 HE ARG A 11 -12.025 3.868 -11.918 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -11.444 3.399 -15.376 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -12.020 5.013 -15.804 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -12.755 5.934 -12.484 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -12.757 6.440 -14.177 1.00 0.00 H new ATOM 65 N GLU A 12 -11.599 -2.474 -14.362 1.00 0.00 N ATOM 66 CA GLU A 12 -11.884 -3.612 -13.501 1.00 0.00 C ATOM 67 C GLU A 12 -10.597 -4.160 -12.899 1.00 0.00 C ATOM 68 O GLU A 12 -10.498 -4.345 -11.687 1.00 0.00 O ATOM 69 CB GLU A 12 -12.604 -4.708 -14.289 1.00 0.00 C ATOM 70 CG GLU A 12 -14.079 -4.424 -14.519 1.00 0.00 C ATOM 71 CD GLU A 12 -14.979 -5.261 -13.631 1.00 0.00 C ATOM 72 OE1 GLU A 12 -14.779 -5.244 -12.398 1.00 0.00 O ATOM 73 OE2 GLU A 12 -15.885 -5.932 -14.169 1.00 0.00 O ATOM 0 H GLU A 12 -11.843 -2.615 -15.342 1.00 0.00 H new ATOM 0 HA GLU A 12 -12.533 -3.277 -12.692 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -12.112 -4.833 -15.254 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -12.504 -5.653 -13.755 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -14.275 -3.367 -14.336 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -14.324 -4.617 -15.563 1.00 0.00 H new ATOM 80 N ARG A 13 -9.607 -4.408 -13.755 1.00 0.00 N ATOM 81 CA ARG A 13 -8.317 -4.926 -13.308 1.00 0.00 C ATOM 82 C ARG A 13 -7.748 -4.061 -12.189 1.00 0.00 C ATOM 83 O ARG A 13 -7.139 -4.564 -11.243 1.00 0.00 O ATOM 84 CB ARG A 13 -7.333 -4.981 -14.476 1.00 0.00 C ATOM 85 CG ARG A 13 -7.787 -5.879 -15.614 1.00 0.00 C ATOM 86 CD ARG A 13 -6.631 -6.253 -16.525 1.00 0.00 C ATOM 87 NE ARG A 13 -7.074 -7.021 -17.686 1.00 0.00 N ATOM 88 CZ ARG A 13 -6.373 -7.137 -18.812 1.00 0.00 C ATOM 89 NH1 ARG A 13 -5.194 -6.540 -18.933 1.00 0.00 N ATOM 90 NH2 ARG A 13 -6.851 -7.854 -19.819 1.00 0.00 N ATOM 0 H ARG A 13 -9.674 -4.258 -14.762 1.00 0.00 H new ATOM 0 HA ARG A 13 -8.469 -5.935 -12.925 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -7.181 -3.972 -14.859 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -6.368 -5.332 -14.111 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -8.238 -6.784 -15.207 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -8.558 -5.372 -16.193 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -6.127 -5.347 -16.861 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -5.900 -6.835 -15.963 1.00 0.00 H new ATOM 0 HE ARG A 13 -7.974 -7.497 -17.631 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -4.820 -5.988 -18.161 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -4.662 -6.633 -19.798 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -7.756 -8.317 -19.731 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -6.314 -7.943 -20.682 1.00 0.00 H new ATOM 104 N GLN A 14 -7.960 -2.753 -12.304 1.00 0.00 N ATOM 105 CA GLN A 14 -7.480 -1.809 -11.304 1.00 0.00 C ATOM 106 C GLN A 14 -7.975 -2.197 -9.917 1.00 0.00 C ATOM 107 O GLN A 14 -7.193 -2.309 -8.973 1.00 0.00 O ATOM 108 CB GLN A 14 -7.956 -0.397 -11.638 1.00 0.00 C ATOM 109 CG GLN A 14 -7.537 0.079 -13.016 1.00 0.00 C ATOM 110 CD GLN A 14 -7.432 1.586 -13.095 1.00 0.00 C ATOM 111 OE1 GLN A 14 -8.258 2.247 -13.724 1.00 0.00 O ATOM 112 NE2 GLN A 14 -6.410 2.140 -12.452 1.00 0.00 N ATOM 0 H GLN A 14 -8.462 -2.324 -13.081 1.00 0.00 H new ATOM 0 HA GLN A 14 -6.390 -1.834 -11.310 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -9.043 -0.364 -11.567 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -7.566 0.294 -10.891 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -6.575 -0.364 -13.274 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -8.258 -0.272 -13.754 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -5.749 1.553 -11.943 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -6.286 3.152 -12.467 1.00 0.00 H new ATOM 121 N THR A 15 -9.285 -2.394 -9.802 1.00 0.00 N ATOM 122 CA THR A 15 -9.892 -2.764 -8.532 1.00 0.00 C ATOM 123 C THR A 15 -9.405 -4.131 -8.056 1.00 0.00 C ATOM 124 O THR A 15 -9.435 -4.423 -6.862 1.00 0.00 O ATOM 125 CB THR A 15 -11.418 -2.761 -8.648 1.00 0.00 C ATOM 126 OG1 THR A 15 -11.825 -2.380 -9.951 1.00 0.00 O ATOM 127 CG2 THR A 15 -12.084 -1.822 -7.667 1.00 0.00 C ATOM 0 H THR A 15 -9.945 -2.303 -10.574 1.00 0.00 H new ATOM 0 HA THR A 15 -9.589 -2.022 -7.793 1.00 0.00 H new ATOM 0 HB THR A 15 -11.728 -3.782 -8.424 1.00 0.00 H new ATOM 0 HG1 THR A 15 -12.804 -2.386 -10.003 1.00 0.00 H new ATOM 0 HG21 THR A 15 -13.165 -1.865 -7.799 1.00 0.00 H new ATOM 0 HG22 THR A 15 -11.830 -2.119 -6.649 1.00 0.00 H new ATOM 0 HG23 THR A 15 -11.737 -0.804 -7.845 1.00 0.00 H new ATOM 135 N VAL A 16 -8.954 -4.966 -8.989 1.00 0.00 N ATOM 136 CA VAL A 16 -8.461 -6.294 -8.634 1.00 0.00 C ATOM 137 C VAL A 16 -7.311 -6.191 -7.641 1.00 0.00 C ATOM 138 O VAL A 16 -7.388 -6.716 -6.530 1.00 0.00 O ATOM 139 CB VAL A 16 -7.988 -7.081 -9.872 1.00 0.00 C ATOM 140 CG1 VAL A 16 -7.556 -8.487 -9.479 1.00 0.00 C ATOM 141 CG2 VAL A 16 -9.081 -7.133 -10.925 1.00 0.00 C ATOM 0 H VAL A 16 -8.920 -4.750 -9.985 1.00 0.00 H new ATOM 0 HA VAL A 16 -9.294 -6.831 -8.180 1.00 0.00 H new ATOM 0 HB VAL A 16 -7.128 -6.564 -10.298 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -7.225 -9.027 -10.366 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -6.736 -8.429 -8.763 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -8.397 -9.013 -9.026 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -8.726 -7.693 -11.790 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -9.962 -7.624 -10.511 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -9.341 -6.119 -11.230 1.00 0.00 H new ATOM 151 N ALA A 17 -6.247 -5.506 -8.045 1.00 0.00 N ATOM 152 CA ALA A 17 -5.086 -5.329 -7.181 1.00 0.00 C ATOM 153 C ALA A 17 -5.470 -4.581 -5.908 1.00 0.00 C ATOM 154 O ALA A 17 -4.936 -4.848 -4.832 1.00 0.00 O ATOM 155 CB ALA A 17 -3.983 -4.584 -7.917 1.00 0.00 C ATOM 0 H ALA A 17 -6.164 -5.066 -8.961 1.00 0.00 H new ATOM 0 HA ALA A 17 -4.715 -6.316 -6.903 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.124 -4.461 -7.257 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.685 -5.153 -8.798 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.348 -3.604 -8.224 1.00 0.00 H new ATOM 161 N LEU A 18 -6.398 -3.640 -6.045 1.00 0.00 N ATOM 162 CA LEU A 18 -6.859 -2.844 -4.913 1.00 0.00 C ATOM 163 C LEU A 18 -7.679 -3.686 -3.942 1.00 0.00 C ATOM 164 O LEU A 18 -7.269 -3.916 -2.805 1.00 0.00 O ATOM 165 CB LEU A 18 -7.700 -1.666 -5.406 1.00 0.00 C ATOM 166 CG LEU A 18 -6.921 -0.575 -6.142 1.00 0.00 C ATOM 167 CD1 LEU A 18 -7.848 0.223 -7.049 1.00 0.00 C ATOM 168 CD2 LEU A 18 -6.224 0.340 -5.145 1.00 0.00 C ATOM 0 H LEU A 18 -6.847 -3.409 -6.931 1.00 0.00 H new ATOM 0 HA LEU A 18 -5.980 -2.471 -4.387 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -8.476 -2.047 -6.070 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -8.204 -1.216 -4.550 1.00 0.00 H new ATOM 0 HG LEU A 18 -6.161 -1.049 -6.764 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.277 0.995 -7.565 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -8.302 -0.444 -7.782 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -8.630 0.690 -6.450 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.673 1.112 -5.683 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -6.967 0.808 -4.499 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -5.532 -0.243 -4.538 1.00 0.00 H new ATOM 180 N LYS A 19 -8.844 -4.137 -4.400 1.00 0.00 N ATOM 181 CA LYS A 19 -9.739 -4.951 -3.579 1.00 0.00 C ATOM 182 C LYS A 19 -8.973 -6.036 -2.829 1.00 0.00 C ATOM 183 O LYS A 19 -9.269 -6.328 -1.673 1.00 0.00 O ATOM 184 CB LYS A 19 -10.821 -5.590 -4.450 1.00 0.00 C ATOM 185 CG LYS A 19 -12.030 -4.698 -4.670 1.00 0.00 C ATOM 186 CD LYS A 19 -13.144 -5.438 -5.393 1.00 0.00 C ATOM 187 CE LYS A 19 -13.137 -5.135 -6.883 1.00 0.00 C ATOM 188 NZ LYS A 19 -14.348 -5.671 -7.564 1.00 0.00 N ATOM 0 H LYS A 19 -9.193 -3.952 -5.341 1.00 0.00 H new ATOM 0 HA LYS A 19 -10.206 -4.294 -2.845 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -10.391 -5.850 -5.417 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -11.146 -6.521 -3.986 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -12.396 -4.336 -3.709 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -11.737 -3.823 -5.250 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -13.030 -6.511 -5.238 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -14.107 -5.155 -4.967 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -13.083 -4.057 -7.034 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -12.245 -5.566 -7.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -14.305 -5.444 -8.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -14.387 -6.703 -7.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -15.199 -5.241 -7.148 1.00 0.00 H new ATOM 202 N ARG A 20 -7.985 -6.626 -3.489 1.00 0.00 N ATOM 203 CA ARG A 20 -7.183 -7.674 -2.874 1.00 0.00 C ATOM 204 C ARG A 20 -6.521 -7.167 -1.598 1.00 0.00 C ATOM 205 O ARG A 20 -6.641 -7.777 -0.537 1.00 0.00 O ATOM 206 CB ARG A 20 -6.116 -8.169 -3.854 1.00 0.00 C ATOM 207 CG ARG A 20 -6.563 -9.356 -4.693 1.00 0.00 C ATOM 208 CD ARG A 20 -5.393 -9.988 -5.433 1.00 0.00 C ATOM 209 NE ARG A 20 -5.366 -11.440 -5.276 1.00 0.00 N ATOM 210 CZ ARG A 20 -4.489 -12.235 -5.884 1.00 0.00 C ATOM 211 NH1 ARG A 20 -3.567 -11.725 -6.691 1.00 0.00 N ATOM 212 NH2 ARG A 20 -4.532 -13.545 -5.685 1.00 0.00 N ATOM 0 H ARG A 20 -7.721 -6.397 -4.447 1.00 0.00 H new ATOM 0 HA ARG A 20 -7.843 -8.503 -2.618 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -5.836 -7.351 -4.517 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -5.222 -8.446 -3.295 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -7.033 -10.100 -4.051 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -7.317 -9.032 -5.411 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -5.457 -9.739 -6.492 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -4.459 -9.566 -5.062 1.00 0.00 H new ATOM 0 HE ARG A 20 -6.060 -11.870 -4.664 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -3.528 -10.718 -6.848 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -2.898 -12.340 -7.154 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -5.238 -13.944 -5.066 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -3.860 -14.154 -6.151 1.00 0.00 H new ATOM 226 N MET A 21 -5.822 -6.045 -1.713 1.00 0.00 N ATOM 227 CA MET A 21 -5.135 -5.452 -0.573 1.00 0.00 C ATOM 228 C MET A 21 -6.104 -4.682 0.318 1.00 0.00 C ATOM 229 O MET A 21 -5.817 -4.428 1.488 1.00 0.00 O ATOM 230 CB MET A 21 -4.032 -4.518 -1.063 1.00 0.00 C ATOM 231 CG MET A 21 -4.543 -3.397 -1.950 1.00 0.00 C ATOM 232 SD MET A 21 -3.252 -2.226 -2.399 1.00 0.00 S ATOM 233 CE MET A 21 -3.818 -0.766 -1.536 1.00 0.00 C ATOM 0 H MET A 21 -5.716 -5.527 -2.585 1.00 0.00 H new ATOM 0 HA MET A 21 -4.699 -6.258 0.017 1.00 0.00 H new ATOM 0 HB2 MET A 21 -3.522 -4.086 -0.202 1.00 0.00 H new ATOM 0 HB3 MET A 21 -3.292 -5.099 -1.614 1.00 0.00 H new ATOM 0 HG2 MET A 21 -4.973 -3.823 -2.856 1.00 0.00 H new ATOM 0 HG3 MET A 21 -5.345 -2.868 -1.435 1.00 0.00 H new ATOM 0 HE1 MET A 21 -2.961 -0.229 -1.129 1.00 0.00 H new ATOM 0 HE2 MET A 21 -4.356 -0.119 -2.229 1.00 0.00 H new ATOM 0 HE3 MET A 21 -4.482 -1.059 -0.723 1.00 0.00 H new ATOM 487 N TRP A 38 -7.216 -4.934 11.344 1.00 0.00 N ATOM 488 CA TRP A 38 -7.231 -3.641 10.674 1.00 0.00 C ATOM 489 C TRP A 38 -6.131 -3.584 9.619 1.00 0.00 C ATOM 490 O TRP A 38 -5.090 -4.223 9.766 1.00 0.00 O ATOM 491 CB TRP A 38 -7.036 -2.511 11.685 1.00 0.00 C ATOM 492 CG TRP A 38 -8.295 -2.113 12.396 1.00 0.00 C ATOM 493 CD1 TRP A 38 -8.661 -2.460 13.664 1.00 0.00 C ATOM 494 CD2 TRP A 38 -9.348 -1.289 11.884 1.00 0.00 C ATOM 495 NE1 TRP A 38 -9.880 -1.907 13.971 1.00 0.00 N ATOM 496 CE2 TRP A 38 -10.322 -1.182 12.896 1.00 0.00 C ATOM 497 CE3 TRP A 38 -9.565 -0.630 10.670 1.00 0.00 C ATOM 498 CZ2 TRP A 38 -11.492 -0.445 12.731 1.00 0.00 C ATOM 499 CZ3 TRP A 38 -10.727 0.102 10.508 1.00 0.00 C ATOM 500 CH2 TRP A 38 -11.676 0.190 11.534 1.00 0.00 C ATOM 0 HA TRP A 38 -8.199 -3.516 10.190 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -6.295 -2.819 12.422 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -6.630 -1.641 11.170 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -8.077 -3.079 14.329 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -10.376 -2.018 14.856 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -8.838 -0.692 9.873 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -12.227 -0.377 13.519 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -10.906 0.615 9.574 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -12.572 0.772 11.377 1.00 0.00 H new ATOM 511 N LYS A 39 -6.363 -2.821 8.559 1.00 0.00 N ATOM 512 CA LYS A 39 -5.379 -2.695 7.491 1.00 0.00 C ATOM 513 C LYS A 39 -5.165 -1.237 7.107 1.00 0.00 C ATOM 514 O LYS A 39 -6.116 -0.515 6.804 1.00 0.00 O ATOM 515 CB LYS A 39 -5.813 -3.502 6.266 1.00 0.00 C ATOM 516 CG LYS A 39 -4.647 -4.102 5.499 1.00 0.00 C ATOM 517 CD LYS A 39 -4.931 -5.533 5.072 1.00 0.00 C ATOM 518 CE LYS A 39 -3.652 -6.353 5.004 1.00 0.00 C ATOM 519 NZ LYS A 39 -3.263 -6.889 6.338 1.00 0.00 N ATOM 0 H LYS A 39 -7.218 -2.283 8.416 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.434 -3.092 7.861 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -6.480 -4.303 6.585 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.385 -2.857 5.599 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -4.439 -3.494 4.618 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -3.752 -4.079 6.121 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -5.624 -5.994 5.776 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -5.419 -5.534 4.097 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -3.788 -7.179 4.306 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -2.845 -5.734 4.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -2.231 -6.822 6.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -3.730 -6.336 7.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -3.555 -7.884 6.411 1.00 0.00 H new ATOM 533 N VAL A 40 -3.908 -0.812 7.119 1.00 0.00 N ATOM 534 CA VAL A 40 -3.554 0.554 6.771 1.00 0.00 C ATOM 535 C VAL A 40 -3.244 0.661 5.281 1.00 0.00 C ATOM 536 O VAL A 40 -2.966 -0.343 4.625 1.00 0.00 O ATOM 537 CB VAL A 40 -2.342 1.031 7.611 1.00 0.00 C ATOM 538 CG1 VAL A 40 -1.316 1.764 6.759 1.00 0.00 C ATOM 539 CG2 VAL A 40 -2.809 1.905 8.765 1.00 0.00 C ATOM 0 H VAL A 40 -3.113 -1.400 7.368 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.404 1.198 6.995 1.00 0.00 H new ATOM 0 HB VAL A 40 -1.852 0.146 8.017 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.483 2.082 7.386 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -0.949 1.098 5.978 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.780 2.638 6.302 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.947 2.232 9.346 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.334 2.776 8.373 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -3.482 1.334 9.405 1.00 0.00 H new ATOM 549 N LEU A 41 -3.292 1.878 4.749 1.00 0.00 N ATOM 550 CA LEU A 41 -3.011 2.095 3.341 1.00 0.00 C ATOM 551 C LEU A 41 -2.210 3.385 3.137 1.00 0.00 C ATOM 552 O LEU A 41 -2.449 4.394 3.802 1.00 0.00 O ATOM 553 CB LEU A 41 -4.326 2.126 2.545 1.00 0.00 C ATOM 554 CG LEU A 41 -4.590 3.392 1.723 1.00 0.00 C ATOM 555 CD1 LEU A 41 -4.022 3.243 0.319 1.00 0.00 C ATOM 556 CD2 LEU A 41 -6.078 3.691 1.668 1.00 0.00 C ATOM 0 H LEU A 41 -3.522 2.723 5.272 1.00 0.00 H new ATOM 0 HA LEU A 41 -2.402 1.270 2.972 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -4.338 1.270 1.870 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.152 1.992 3.243 1.00 0.00 H new ATOM 0 HG LEU A 41 -4.090 4.229 2.209 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -4.218 4.151 -0.251 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -2.946 3.077 0.377 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -4.494 2.394 -0.176 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -6.246 4.593 1.080 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.600 2.854 1.205 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.457 3.841 2.679 1.00 0.00 H new ATOM 568 N ILE A 42 -1.270 3.339 2.202 1.00 0.00 N ATOM 569 CA ILE A 42 -0.427 4.483 1.872 1.00 0.00 C ATOM 570 C ILE A 42 -0.381 4.653 0.369 1.00 0.00 C ATOM 571 O ILE A 42 0.250 3.861 -0.334 1.00 0.00 O ATOM 572 CB ILE A 42 1.014 4.317 2.396 1.00 0.00 C ATOM 573 CG1 ILE A 42 1.030 3.648 3.770 1.00 0.00 C ATOM 574 CG2 ILE A 42 1.717 5.664 2.458 1.00 0.00 C ATOM 575 CD1 ILE A 42 0.137 4.309 4.791 1.00 0.00 C ATOM 0 H ILE A 42 -1.069 2.506 1.649 1.00 0.00 H new ATOM 0 HA ILE A 42 -0.862 5.359 2.352 1.00 0.00 H new ATOM 0 HB ILE A 42 1.550 3.672 1.700 1.00 0.00 H new ATOM 0 HG12 ILE A 42 0.727 2.607 3.658 1.00 0.00 H new ATOM 0 HG13 ILE A 42 2.053 3.643 4.147 1.00 0.00 H new ATOM 0 HG21 ILE A 42 2.732 5.528 2.830 1.00 0.00 H new ATOM 0 HG22 ILE A 42 1.752 6.103 1.461 1.00 0.00 H new ATOM 0 HG23 ILE A 42 1.171 6.329 3.128 1.00 0.00 H new ATOM 0 HD11 ILE A 42 0.207 3.773 5.737 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.452 5.342 4.935 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -0.894 4.290 4.439 1.00 0.00 H new ATOM 587 N TYR A 43 -1.063 5.672 -0.131 1.00 0.00 N ATOM 588 CA TYR A 43 -1.095 5.906 -1.565 1.00 0.00 C ATOM 589 C TYR A 43 -0.408 7.208 -1.943 1.00 0.00 C ATOM 590 O TYR A 43 -0.159 8.075 -1.098 1.00 0.00 O ATOM 591 CB TYR A 43 -2.533 5.895 -2.091 1.00 0.00 C ATOM 592 CG TYR A 43 -3.512 6.672 -1.243 1.00 0.00 C ATOM 593 CD1 TYR A 43 -3.236 7.969 -0.843 1.00 0.00 C ATOM 594 CD2 TYR A 43 -4.716 6.106 -0.851 1.00 0.00 C ATOM 595 CE1 TYR A 43 -4.132 8.685 -0.073 1.00 0.00 C ATOM 596 CE2 TYR A 43 -5.619 6.813 -0.080 1.00 0.00 C ATOM 597 CZ TYR A 43 -5.322 8.103 0.306 1.00 0.00 C ATOM 598 OH TYR A 43 -6.218 8.812 1.074 1.00 0.00 O ATOM 0 H TYR A 43 -1.594 6.341 0.426 1.00 0.00 H new ATOM 0 HA TYR A 43 -0.544 5.090 -2.033 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -2.541 6.304 -3.101 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -2.873 4.862 -2.163 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -2.304 8.428 -1.138 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -4.952 5.096 -1.153 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -3.901 9.695 0.230 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -6.552 6.358 0.218 1.00 0.00 H new ATOM 0 HH TYR A 43 -6.560 8.238 1.791 1.00 0.00 H new ATOM 608 N ASP A 44 -0.092 7.318 -3.227 1.00 0.00 N ATOM 609 CA ASP A 44 0.565 8.491 -3.775 1.00 0.00 C ATOM 610 C ASP A 44 -0.391 9.219 -4.710 1.00 0.00 C ATOM 611 O ASP A 44 -1.578 8.898 -4.760 1.00 0.00 O ATOM 612 CB ASP A 44 1.825 8.074 -4.532 1.00 0.00 C ATOM 613 CG ASP A 44 2.974 9.044 -4.328 1.00 0.00 C ATOM 614 OD1 ASP A 44 2.952 9.787 -3.325 1.00 0.00 O ATOM 615 OD2 ASP A 44 3.894 9.058 -5.173 1.00 0.00 O ATOM 0 H ASP A 44 -0.286 6.592 -3.917 1.00 0.00 H new ATOM 0 HA ASP A 44 0.849 9.160 -2.963 1.00 0.00 H new ATOM 0 HB2 ASP A 44 2.130 7.080 -4.204 1.00 0.00 H new ATOM 0 HB3 ASP A 44 1.599 8.003 -5.596 1.00 0.00 H new ATOM 620 N ARG A 45 0.121 10.187 -5.459 1.00 0.00 N ATOM 621 CA ARG A 45 -0.711 10.933 -6.398 1.00 0.00 C ATOM 622 C ARG A 45 -1.465 9.972 -7.316 1.00 0.00 C ATOM 623 O ARG A 45 -2.635 10.189 -7.634 1.00 0.00 O ATOM 624 CB ARG A 45 0.140 11.897 -7.229 1.00 0.00 C ATOM 625 CG ARG A 45 1.485 11.323 -7.640 1.00 0.00 C ATOM 626 CD ARG A 45 2.605 11.817 -6.738 1.00 0.00 C ATOM 627 NE ARG A 45 3.334 12.937 -7.331 1.00 0.00 N ATOM 628 CZ ARG A 45 3.122 14.216 -7.020 1.00 0.00 C ATOM 629 NH1 ARG A 45 2.201 14.553 -6.125 1.00 0.00 N ATOM 630 NH2 ARG A 45 3.835 15.165 -7.611 1.00 0.00 N ATOM 0 H ARG A 45 1.100 10.473 -5.437 1.00 0.00 H new ATOM 0 HA ARG A 45 -1.433 11.516 -5.827 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -0.414 12.178 -8.124 1.00 0.00 H new ATOM 0 HB3 ARG A 45 0.304 12.810 -6.656 1.00 0.00 H new ATOM 0 HG2 ARG A 45 1.442 10.234 -7.605 1.00 0.00 H new ATOM 0 HG3 ARG A 45 1.699 11.600 -8.672 1.00 0.00 H new ATOM 0 HD2 ARG A 45 2.189 12.123 -5.778 1.00 0.00 H new ATOM 0 HD3 ARG A 45 3.297 10.999 -6.539 1.00 0.00 H new ATOM 0 HE ARG A 45 4.050 12.727 -8.026 1.00 0.00 H new ATOM 0 HH11 ARG A 45 1.646 13.830 -5.667 1.00 0.00 H new ATOM 0 HH12 ARG A 45 2.048 15.535 -5.896 1.00 0.00 H new ATOM 0 HH21 ARG A 45 4.543 14.916 -8.301 1.00 0.00 H new ATOM 0 HH22 ARG A 45 3.675 16.144 -7.375 1.00 0.00 H new ATOM 644 N PHE A 46 -0.790 8.900 -7.721 1.00 0.00 N ATOM 645 CA PHE A 46 -1.399 7.896 -8.586 1.00 0.00 C ATOM 646 C PHE A 46 -2.221 6.914 -7.758 1.00 0.00 C ATOM 647 O PHE A 46 -3.322 6.527 -8.151 1.00 0.00 O ATOM 648 CB PHE A 46 -0.327 7.152 -9.385 1.00 0.00 C ATOM 649 CG PHE A 46 -0.235 7.594 -10.818 1.00 0.00 C ATOM 650 CD1 PHE A 46 0.524 8.699 -11.167 1.00 0.00 C ATOM 651 CD2 PHE A 46 -0.910 6.907 -11.816 1.00 0.00 C ATOM 652 CE1 PHE A 46 0.608 9.112 -12.484 1.00 0.00 C ATOM 653 CE2 PHE A 46 -0.828 7.315 -13.135 1.00 0.00 C ATOM 654 CZ PHE A 46 -0.068 8.419 -13.469 1.00 0.00 C ATOM 0 H PHE A 46 0.178 8.705 -7.464 1.00 0.00 H new ATOM 0 HA PHE A 46 -2.062 8.402 -9.288 1.00 0.00 H new ATOM 0 HB2 PHE A 46 0.640 7.299 -8.905 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -0.539 6.083 -9.355 1.00 0.00 H new ATOM 0 HD1 PHE A 46 1.056 9.244 -10.402 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -1.506 6.044 -11.560 1.00 0.00 H new ATOM 0 HE1 PHE A 46 1.202 9.976 -12.742 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -1.358 6.771 -13.903 1.00 0.00 H new ATOM 0 HZ PHE A 46 -0.003 8.740 -14.498 1.00 0.00 H new ATOM 664 N GLY A 47 -1.687 6.525 -6.601 1.00 0.00 N ATOM 665 CA GLY A 47 -2.399 5.603 -5.730 1.00 0.00 C ATOM 666 C GLY A 47 -3.809 6.079 -5.456 1.00 0.00 C ATOM 667 O GLY A 47 -4.756 5.293 -5.466 1.00 0.00 O ATOM 0 H GLY A 47 -0.778 6.830 -6.253 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -2.430 4.616 -6.191 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -1.859 5.499 -4.789 1.00 0.00 H new ATOM 671 N GLN A 48 -3.944 7.381 -5.234 1.00 0.00 N ATOM 672 CA GLN A 48 -5.243 7.987 -4.982 1.00 0.00 C ATOM 673 C GLN A 48 -6.003 8.141 -6.294 1.00 0.00 C ATOM 674 O GLN A 48 -7.233 8.111 -6.323 1.00 0.00 O ATOM 675 CB GLN A 48 -5.073 9.351 -4.307 1.00 0.00 C ATOM 676 CG GLN A 48 -4.257 10.341 -5.124 1.00 0.00 C ATOM 677 CD GLN A 48 -3.728 11.488 -4.287 1.00 0.00 C ATOM 678 OE1 GLN A 48 -2.589 11.459 -3.820 1.00 0.00 O ATOM 679 NE2 GLN A 48 -4.556 12.507 -4.092 1.00 0.00 N ATOM 0 H GLN A 48 -3.165 8.039 -5.224 1.00 0.00 H new ATOM 0 HA GLN A 48 -5.811 7.339 -4.314 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -6.058 9.777 -4.115 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.593 9.210 -3.339 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -3.421 9.820 -5.590 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -4.874 10.738 -5.930 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -5.492 12.489 -4.498 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -4.257 13.308 -3.536 1.00 0.00 H new ATOM 688 N ASP A 49 -5.250 8.297 -7.380 1.00 0.00 N ATOM 689 CA ASP A 49 -5.827 8.446 -8.709 1.00 0.00 C ATOM 690 C ASP A 49 -6.539 7.170 -9.154 1.00 0.00 C ATOM 691 O ASP A 49 -7.249 7.167 -10.159 1.00 0.00 O ATOM 692 CB ASP A 49 -4.730 8.796 -9.718 1.00 0.00 C ATOM 693 CG ASP A 49 -5.275 9.496 -10.947 1.00 0.00 C ATOM 694 OD1 ASP A 49 -6.429 9.211 -11.330 1.00 0.00 O ATOM 695 OD2 ASP A 49 -4.546 10.328 -11.528 1.00 0.00 O ATOM 0 H ASP A 49 -4.230 8.323 -7.362 1.00 0.00 H new ATOM 0 HA ASP A 49 -6.561 9.251 -8.666 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -3.989 9.436 -9.238 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -4.215 7.884 -10.021 1.00 0.00 H new ATOM 700 N ILE A 50 -6.332 6.083 -8.415 1.00 0.00 N ATOM 701 CA ILE A 50 -6.942 4.804 -8.753 1.00 0.00 C ATOM 702 C ILE A 50 -7.824 4.285 -7.623 1.00 0.00 C ATOM 703 O ILE A 50 -8.909 3.756 -7.862 1.00 0.00 O ATOM 704 CB ILE A 50 -5.855 3.760 -9.067 1.00 0.00 C ATOM 705 CG1 ILE A 50 -4.976 4.253 -10.215 1.00 0.00 C ATOM 706 CG2 ILE A 50 -6.474 2.411 -9.400 1.00 0.00 C ATOM 707 CD1 ILE A 50 -3.506 3.989 -10.004 1.00 0.00 C ATOM 0 H ILE A 50 -5.747 6.064 -7.580 1.00 0.00 H new ATOM 0 HA ILE A 50 -7.566 4.965 -9.632 1.00 0.00 H new ATOM 0 HB ILE A 50 -5.234 3.628 -8.181 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -5.295 3.771 -11.139 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -5.130 5.324 -10.345 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.684 1.692 -9.618 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -7.060 2.060 -8.551 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -7.122 2.513 -10.271 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.943 4.365 -10.858 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -3.172 4.494 -9.098 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -3.340 2.916 -9.904 1.00 0.00 H new ATOM 719 N ILE A 51 -7.349 4.431 -6.394 1.00 0.00 N ATOM 720 CA ILE A 51 -8.101 3.967 -5.235 1.00 0.00 C ATOM 721 C ILE A 51 -9.416 4.733 -5.092 1.00 0.00 C ATOM 722 O ILE A 51 -10.461 4.146 -4.820 1.00 0.00 O ATOM 723 CB ILE A 51 -7.265 4.083 -3.931 1.00 0.00 C ATOM 724 CG1 ILE A 51 -7.415 2.813 -3.089 1.00 0.00 C ATOM 725 CG2 ILE A 51 -7.661 5.311 -3.117 1.00 0.00 C ATOM 726 CD1 ILE A 51 -6.122 2.358 -2.444 1.00 0.00 C ATOM 0 H ILE A 51 -6.452 4.864 -6.174 1.00 0.00 H new ATOM 0 HA ILE A 51 -8.329 2.914 -5.397 1.00 0.00 H new ATOM 0 HB ILE A 51 -6.219 4.199 -4.216 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -8.158 2.989 -2.311 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -7.798 2.011 -3.720 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -7.055 5.359 -2.212 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -7.497 6.210 -3.711 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -8.714 5.243 -2.845 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -6.304 1.454 -1.863 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -5.383 2.150 -3.218 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -5.748 3.142 -1.786 1.00 0.00 H new ATOM 738 N SER A 52 -9.354 6.047 -5.273 1.00 0.00 N ATOM 739 CA SER A 52 -10.538 6.893 -5.156 1.00 0.00 C ATOM 740 C SER A 52 -11.607 6.521 -6.187 1.00 0.00 C ATOM 741 O SER A 52 -12.742 6.213 -5.825 1.00 0.00 O ATOM 742 CB SER A 52 -10.155 8.366 -5.311 1.00 0.00 C ATOM 743 OG SER A 52 -10.886 9.181 -4.412 1.00 0.00 O ATOM 0 H SER A 52 -8.497 6.551 -5.501 1.00 0.00 H new ATOM 0 HA SER A 52 -10.959 6.730 -4.164 1.00 0.00 H new ATOM 0 HB2 SER A 52 -9.087 8.488 -5.131 1.00 0.00 H new ATOM 0 HB3 SER A 52 -10.344 8.688 -6.335 1.00 0.00 H new ATOM 0 HG SER A 52 -10.621 10.117 -4.530 1.00 0.00 H new ATOM 749 N PRO A 53 -11.276 6.553 -7.492 1.00 0.00 N ATOM 750 CA PRO A 53 -12.237 6.226 -8.549 1.00 0.00 C ATOM 751 C PRO A 53 -13.003 4.935 -8.264 1.00 0.00 C ATOM 752 O PRO A 53 -14.110 4.739 -8.766 1.00 0.00 O ATOM 753 CB PRO A 53 -11.375 6.076 -9.813 1.00 0.00 C ATOM 754 CG PRO A 53 -9.952 6.233 -9.379 1.00 0.00 C ATOM 755 CD PRO A 53 -9.968 6.923 -8.043 1.00 0.00 C ATOM 0 HA PRO A 53 -13.003 6.996 -8.641 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -11.534 5.103 -10.277 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.640 6.830 -10.555 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -9.463 5.262 -9.304 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -9.390 6.818 -10.107 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -9.152 6.585 -7.405 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -9.865 8.003 -8.146 1.00 0.00 H new ATOM 763 N LEU A 54 -12.414 4.060 -7.454 1.00 0.00 N ATOM 764 CA LEU A 54 -13.053 2.795 -7.103 1.00 0.00 C ATOM 765 C LEU A 54 -13.223 2.662 -5.590 1.00 0.00 C ATOM 766 O LEU A 54 -13.472 1.571 -5.079 1.00 0.00 O ATOM 767 CB LEU A 54 -12.228 1.620 -7.631 1.00 0.00 C ATOM 768 CG LEU A 54 -11.685 1.793 -9.051 1.00 0.00 C ATOM 769 CD1 LEU A 54 -10.240 1.324 -9.134 1.00 0.00 C ATOM 770 CD2 LEU A 54 -12.550 1.035 -10.046 1.00 0.00 C ATOM 0 H LEU A 54 -11.498 4.203 -7.029 1.00 0.00 H new ATOM 0 HA LEU A 54 -14.040 2.782 -7.564 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -11.389 1.453 -6.956 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -12.844 0.721 -7.601 1.00 0.00 H new ATOM 0 HG LEU A 54 -11.715 2.853 -9.304 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -9.873 1.455 -10.152 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -9.627 1.910 -8.449 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -10.183 0.270 -8.861 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -12.150 1.168 -11.051 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -12.551 -0.025 -9.794 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -13.570 1.418 -10.007 1.00 0.00 H new ATOM 782 N LEU A 55 -13.072 3.775 -4.874 1.00 0.00 N ATOM 783 CA LEU A 55 -13.193 3.772 -3.424 1.00 0.00 C ATOM 784 C LEU A 55 -13.343 5.191 -2.875 1.00 0.00 C ATOM 785 O LEU A 55 -12.901 6.155 -3.494 1.00 0.00 O ATOM 786 CB LEU A 55 -11.964 3.101 -2.824 1.00 0.00 C ATOM 787 CG LEU A 55 -12.263 2.049 -1.770 1.00 0.00 C ATOM 788 CD1 LEU A 55 -11.133 1.040 -1.708 1.00 0.00 C ATOM 789 CD2 LEU A 55 -12.480 2.714 -0.427 1.00 0.00 C ATOM 0 H LEU A 55 -12.866 4.689 -5.278 1.00 0.00 H new ATOM 0 HA LEU A 55 -14.090 3.217 -3.148 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -11.392 2.637 -3.628 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -11.328 3.868 -2.381 1.00 0.00 H new ATOM 0 HG LEU A 55 -13.176 1.516 -2.037 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -11.356 0.290 -0.950 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -11.025 0.555 -2.678 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -10.204 1.549 -1.452 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -12.694 1.954 0.325 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -11.582 3.262 -0.143 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -13.321 3.405 -0.495 1.00 0.00 H new ATOM 801 N SER A 56 -13.965 5.316 -1.706 1.00 0.00 N ATOM 802 CA SER A 56 -14.158 6.627 -1.090 1.00 0.00 C ATOM 803 C SER A 56 -13.602 6.651 0.332 1.00 0.00 C ATOM 804 O SER A 56 -13.262 5.613 0.896 1.00 0.00 O ATOM 805 CB SER A 56 -15.642 7.008 -1.085 1.00 0.00 C ATOM 806 OG SER A 56 -16.407 6.099 -1.858 1.00 0.00 O ATOM 0 H SER A 56 -14.341 4.534 -1.170 1.00 0.00 H new ATOM 0 HA SER A 56 -13.611 7.359 -1.684 1.00 0.00 H new ATOM 0 HB2 SER A 56 -16.014 7.020 -0.060 1.00 0.00 H new ATOM 0 HB3 SER A 56 -15.763 8.017 -1.480 1.00 0.00 H new ATOM 0 HG SER A 56 -17.311 6.456 -1.983 1.00 0.00 H new ATOM 812 N VAL A 57 -13.506 7.849 0.901 1.00 0.00 N ATOM 813 CA VAL A 57 -12.982 8.023 2.253 1.00 0.00 C ATOM 814 C VAL A 57 -13.832 7.290 3.280 1.00 0.00 C ATOM 815 O VAL A 57 -13.318 6.547 4.116 1.00 0.00 O ATOM 816 CB VAL A 57 -12.927 9.512 2.644 1.00 0.00 C ATOM 817 CG1 VAL A 57 -11.979 9.724 3.815 1.00 0.00 C ATOM 818 CG2 VAL A 57 -12.521 10.371 1.458 1.00 0.00 C ATOM 0 H VAL A 57 -13.785 8.718 0.445 1.00 0.00 H new ATOM 0 HA VAL A 57 -11.975 7.606 2.249 1.00 0.00 H new ATOM 0 HB VAL A 57 -13.926 9.818 2.953 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -11.954 10.782 4.076 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -12.325 9.147 4.672 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -10.978 9.395 3.537 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -12.490 11.418 1.761 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -11.535 10.065 1.108 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -13.246 10.247 0.654 1.00 0.00 H new ATOM 828 N LYS A 58 -15.134 7.521 3.225 1.00 0.00 N ATOM 829 CA LYS A 58 -16.062 6.899 4.163 1.00 0.00 C ATOM 830 C LYS A 58 -16.085 5.384 4.008 1.00 0.00 C ATOM 831 O LYS A 58 -16.236 4.658 4.991 1.00 0.00 O ATOM 832 CB LYS A 58 -17.468 7.472 3.978 1.00 0.00 C ATOM 833 CG LYS A 58 -18.047 7.227 2.594 1.00 0.00 C ATOM 834 CD LYS A 58 -18.697 8.480 2.030 1.00 0.00 C ATOM 835 CE LYS A 58 -19.965 8.152 1.258 1.00 0.00 C ATOM 836 NZ LYS A 58 -20.181 9.087 0.120 1.00 0.00 N ATOM 0 H LYS A 58 -15.575 8.135 2.541 1.00 0.00 H new ATOM 0 HA LYS A 58 -15.715 7.125 5.171 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -18.131 7.033 4.723 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -17.442 8.545 4.167 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -17.257 6.893 1.922 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -18.784 6.425 2.644 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -18.933 9.166 2.843 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -17.993 8.992 1.374 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -19.907 7.130 0.882 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -20.821 8.196 1.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -21.056 8.829 -0.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -20.262 10.059 0.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -19.376 9.027 -0.536 1.00 0.00 H new ATOM 850 N GLU A 59 -15.918 4.902 2.783 1.00 0.00 N ATOM 851 CA GLU A 59 -15.904 3.461 2.544 1.00 0.00 C ATOM 852 C GLU A 59 -14.601 2.883 3.068 1.00 0.00 C ATOM 853 O GLU A 59 -14.558 1.764 3.577 1.00 0.00 O ATOM 854 CB GLU A 59 -16.069 3.119 1.055 1.00 0.00 C ATOM 855 CG GLU A 59 -16.539 4.276 0.191 1.00 0.00 C ATOM 856 CD GLU A 59 -17.855 4.864 0.664 1.00 0.00 C ATOM 857 OE1 GLU A 59 -18.340 4.451 1.738 1.00 0.00 O ATOM 858 OE2 GLU A 59 -18.401 5.739 -0.042 1.00 0.00 O ATOM 0 H GLU A 59 -15.792 5.476 1.949 1.00 0.00 H new ATOM 0 HA GLU A 59 -16.752 3.023 3.071 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -15.115 2.759 0.670 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -16.781 2.299 0.960 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -15.777 5.056 0.190 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -16.648 3.934 -0.838 1.00 0.00 H new ATOM 865 N LEU A 60 -13.539 3.672 2.946 1.00 0.00 N ATOM 866 CA LEU A 60 -12.223 3.268 3.413 1.00 0.00 C ATOM 867 C LEU A 60 -12.263 2.913 4.890 1.00 0.00 C ATOM 868 O LEU A 60 -11.830 1.834 5.294 1.00 0.00 O ATOM 869 CB LEU A 60 -11.215 4.386 3.170 1.00 0.00 C ATOM 870 CG LEU A 60 -10.741 4.503 1.728 1.00 0.00 C ATOM 871 CD1 LEU A 60 -10.252 5.911 1.431 1.00 0.00 C ATOM 872 CD2 LEU A 60 -9.660 3.474 1.454 1.00 0.00 C ATOM 0 H LEU A 60 -13.567 4.600 2.524 1.00 0.00 H new ATOM 0 HA LEU A 60 -11.915 2.384 2.854 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -11.662 5.333 3.471 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -10.349 4.224 3.812 1.00 0.00 H new ATOM 0 HG LEU A 60 -11.582 4.304 1.064 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -9.919 5.969 0.395 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -11.064 6.620 1.591 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -9.422 6.155 2.094 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -9.326 3.564 0.420 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -8.817 3.644 2.124 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -10.059 2.474 1.621 1.00 0.00 H new ATOM 884 N ARG A 61 -12.790 3.827 5.691 1.00 0.00 N ATOM 885 CA ARG A 61 -12.893 3.608 7.125 1.00 0.00 C ATOM 886 C ARG A 61 -14.005 2.614 7.446 1.00 0.00 C ATOM 887 O ARG A 61 -14.017 2.002 8.514 1.00 0.00 O ATOM 888 CB ARG A 61 -13.162 4.931 7.842 1.00 0.00 C ATOM 889 CG ARG A 61 -12.239 6.059 7.406 1.00 0.00 C ATOM 890 CD ARG A 61 -11.120 6.285 8.409 1.00 0.00 C ATOM 891 NE ARG A 61 -11.631 6.658 9.726 1.00 0.00 N ATOM 892 CZ ARG A 61 -10.931 7.341 10.630 1.00 0.00 C ATOM 893 NH1 ARG A 61 -9.685 7.721 10.369 1.00 0.00 N ATOM 894 NH2 ARG A 61 -11.477 7.643 11.800 1.00 0.00 N ATOM 0 H ARG A 61 -13.152 4.726 5.373 1.00 0.00 H new ATOM 0 HA ARG A 61 -11.946 3.194 7.473 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -14.195 5.228 7.662 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -13.056 4.781 8.916 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -11.812 5.825 6.431 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -12.815 6.977 7.290 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -10.523 5.377 8.496 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -10.457 7.069 8.042 1.00 0.00 H new ATOM 0 HE ARG A 61 -12.582 6.378 9.968 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -9.259 7.490 9.472 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -9.155 8.244 11.066 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -12.432 7.352 12.007 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -10.942 8.166 12.493 1.00 0.00 H new ATOM 908 N ASP A 62 -14.948 2.472 6.520 1.00 0.00 N ATOM 909 CA ASP A 62 -16.077 1.568 6.707 1.00 0.00 C ATOM 910 C ASP A 62 -15.771 0.148 6.229 1.00 0.00 C ATOM 911 O ASP A 62 -16.555 -0.769 6.477 1.00 0.00 O ATOM 912 CB ASP A 62 -17.307 2.105 5.974 1.00 0.00 C ATOM 913 CG ASP A 62 -18.054 3.147 6.783 1.00 0.00 C ATOM 914 OD1 ASP A 62 -18.225 2.940 8.003 1.00 0.00 O ATOM 915 OD2 ASP A 62 -18.469 4.169 6.197 1.00 0.00 O ATOM 0 H ASP A 62 -14.952 2.972 5.631 1.00 0.00 H new ATOM 0 HA ASP A 62 -16.275 1.519 7.778 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -16.999 2.540 5.023 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -17.979 1.278 5.743 1.00 0.00 H new ATOM 920 N MET A 63 -14.644 -0.048 5.546 1.00 0.00 N ATOM 921 CA MET A 63 -14.288 -1.375 5.059 1.00 0.00 C ATOM 922 C MET A 63 -13.334 -2.076 6.023 1.00 0.00 C ATOM 923 O MET A 63 -13.209 -3.300 6.001 1.00 0.00 O ATOM 924 CB MET A 63 -13.658 -1.279 3.665 1.00 0.00 C ATOM 925 CG MET A 63 -12.174 -1.604 3.636 1.00 0.00 C ATOM 926 SD MET A 63 -11.461 -1.427 1.995 1.00 0.00 S ATOM 927 CE MET A 63 -11.599 0.342 1.791 1.00 0.00 C ATOM 0 H MET A 63 -13.972 0.685 5.321 1.00 0.00 H new ATOM 0 HA MET A 63 -15.201 -1.967 4.994 1.00 0.00 H new ATOM 0 HB2 MET A 63 -14.182 -1.959 2.993 1.00 0.00 H new ATOM 0 HB3 MET A 63 -13.807 -0.271 3.279 1.00 0.00 H new ATOM 0 HG2 MET A 63 -11.648 -0.948 4.330 1.00 0.00 H new ATOM 0 HG3 MET A 63 -12.022 -2.625 3.986 1.00 0.00 H new ATOM 0 HE1 MET A 63 -11.001 0.657 0.936 1.00 0.00 H new ATOM 0 HE2 MET A 63 -12.642 0.609 1.623 1.00 0.00 H new ATOM 0 HE3 MET A 63 -11.238 0.841 2.690 1.00 0.00 H new ATOM 937 N GLY A 64 -12.666 -1.298 6.868 1.00 0.00 N ATOM 938 CA GLY A 64 -11.738 -1.876 7.818 1.00 0.00 C ATOM 939 C GLY A 64 -10.348 -1.274 7.736 1.00 0.00 C ATOM 940 O GLY A 64 -9.354 -1.985 7.882 1.00 0.00 O ATOM 0 H GLY A 64 -12.751 -0.282 6.911 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -12.128 -1.739 8.827 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -11.673 -2.950 7.645 1.00 0.00 H new ATOM 944 N ILE A 65 -10.273 0.033 7.511 1.00 0.00 N ATOM 945 CA ILE A 65 -8.985 0.710 7.422 1.00 0.00 C ATOM 946 C ILE A 65 -8.679 1.477 8.708 1.00 0.00 C ATOM 947 O ILE A 65 -9.493 2.268 9.183 1.00 0.00 O ATOM 948 CB ILE A 65 -8.924 1.660 6.201 1.00 0.00 C ATOM 949 CG1 ILE A 65 -7.573 1.526 5.504 1.00 0.00 C ATOM 950 CG2 ILE A 65 -9.177 3.111 6.599 1.00 0.00 C ATOM 951 CD1 ILE A 65 -7.438 2.406 4.283 1.00 0.00 C ATOM 0 H ILE A 65 -11.083 0.641 7.388 1.00 0.00 H new ATOM 0 HA ILE A 65 -8.224 -0.059 7.287 1.00 0.00 H new ATOM 0 HB ILE A 65 -9.716 1.369 5.511 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -6.781 1.774 6.211 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -7.425 0.486 5.212 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -9.126 3.745 5.714 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -10.165 3.197 7.050 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -8.421 3.428 7.317 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -6.454 2.261 3.837 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -8.208 2.143 3.558 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -7.555 3.450 4.573 1.00 0.00 H new ATOM 963 N THR A 66 -7.501 1.229 9.270 1.00 0.00 N ATOM 964 CA THR A 66 -7.088 1.887 10.506 1.00 0.00 C ATOM 965 C THR A 66 -6.471 3.257 10.230 1.00 0.00 C ATOM 966 O THR A 66 -6.435 4.114 11.113 1.00 0.00 O ATOM 967 CB THR A 66 -6.093 1.013 11.271 1.00 0.00 C ATOM 968 OG1 THR A 66 -5.430 1.766 12.271 1.00 0.00 O ATOM 969 CG2 THR A 66 -5.033 0.392 10.387 1.00 0.00 C ATOM 0 H THR A 66 -6.815 0.577 8.890 1.00 0.00 H new ATOM 0 HA THR A 66 -7.980 2.032 11.115 1.00 0.00 H new ATOM 0 HB THR A 66 -6.691 0.213 11.708 1.00 0.00 H new ATOM 0 HG1 THR A 66 -4.799 1.189 12.750 1.00 0.00 H new ATOM 0 HG21 THR A 66 -4.362 -0.214 10.995 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.509 -0.237 9.635 1.00 0.00 H new ATOM 0 HG23 THR A 66 -4.464 1.180 9.894 1.00 0.00 H new ATOM 977 N LEU A 67 -5.981 3.462 9.008 1.00 0.00 N ATOM 978 CA LEU A 67 -5.366 4.735 8.646 1.00 0.00 C ATOM 979 C LEU A 67 -4.978 4.759 7.170 1.00 0.00 C ATOM 980 O LEU A 67 -4.446 3.787 6.636 1.00 0.00 O ATOM 981 CB LEU A 67 -4.136 4.994 9.532 1.00 0.00 C ATOM 982 CG LEU A 67 -3.152 6.064 9.039 1.00 0.00 C ATOM 983 CD1 LEU A 67 -2.263 5.513 7.933 1.00 0.00 C ATOM 984 CD2 LEU A 67 -3.891 7.308 8.567 1.00 0.00 C ATOM 0 H LEU A 67 -5.998 2.769 8.259 1.00 0.00 H new ATOM 0 HA LEU A 67 -6.095 5.528 8.811 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -4.484 5.281 10.524 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -3.592 4.056 9.644 1.00 0.00 H new ATOM 0 HG LEU A 67 -2.516 6.347 9.878 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -1.574 6.289 7.599 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.696 4.663 8.312 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.882 5.192 7.095 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -3.171 8.050 8.223 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -4.560 7.045 7.748 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.472 7.721 9.392 1.00 0.00 H new ATOM 996 N HIS A 68 -5.245 5.889 6.528 1.00 0.00 N ATOM 997 CA HIS A 68 -4.925 6.072 5.116 1.00 0.00 C ATOM 998 C HIS A 68 -4.374 7.473 4.881 1.00 0.00 C ATOM 999 O HIS A 68 -5.057 8.463 5.146 1.00 0.00 O ATOM 1000 CB HIS A 68 -6.172 5.853 4.258 1.00 0.00 C ATOM 1001 CG HIS A 68 -7.277 6.821 4.550 1.00 0.00 C ATOM 1002 ND1 HIS A 68 -7.752 7.724 3.621 1.00 0.00 N ATOM 1003 CD2 HIS A 68 -8.004 7.024 5.674 1.00 0.00 C ATOM 1004 CE1 HIS A 68 -8.721 8.441 4.163 1.00 0.00 C ATOM 1005 NE2 HIS A 68 -8.893 8.035 5.407 1.00 0.00 N ATOM 0 H HIS A 68 -5.685 6.698 6.965 1.00 0.00 H new ATOM 0 HA HIS A 68 -4.168 5.340 4.832 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -5.898 5.933 3.206 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -6.538 4.838 4.415 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -7.903 6.490 6.607 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -9.277 9.226 3.672 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -9.576 8.412 6.064 1.00 0.00 H new ATOM 1014 N LEU A 69 -3.137 7.565 4.398 1.00 0.00 N ATOM 1015 CA LEU A 69 -2.529 8.867 4.159 1.00 0.00 C ATOM 1016 C LEU A 69 -1.504 8.838 3.021 1.00 0.00 C ATOM 1017 O LEU A 69 -1.134 7.775 2.512 1.00 0.00 O ATOM 1018 CB LEU A 69 -1.902 9.399 5.456 1.00 0.00 C ATOM 1019 CG LEU A 69 -0.508 8.868 5.808 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -0.418 7.367 5.586 1.00 0.00 C ATOM 1021 CD2 LEU A 69 0.548 9.599 5.000 1.00 0.00 C ATOM 0 H LEU A 69 -2.546 6.766 4.168 1.00 0.00 H new ATOM 0 HA LEU A 69 -3.320 9.546 3.840 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -1.846 10.485 5.388 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -2.575 9.166 6.281 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.328 9.054 6.867 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.583 7.020 5.844 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.151 6.862 6.215 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.621 7.141 4.539 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.535 9.214 5.258 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.365 9.444 3.937 1.00 0.00 H new ATOM 0 HD23 LEU A 69 0.505 10.665 5.224 1.00 0.00 H new ATOM 1033 N LEU A 70 -1.074 10.034 2.624 1.00 0.00 N ATOM 1034 CA LEU A 70 -0.108 10.218 1.545 1.00 0.00 C ATOM 1035 C LEU A 70 1.321 10.043 2.037 1.00 0.00 C ATOM 1036 O LEU A 70 1.723 10.641 3.034 1.00 0.00 O ATOM 1037 CB LEU A 70 -0.251 11.624 0.964 1.00 0.00 C ATOM 1038 CG LEU A 70 -1.007 11.718 -0.356 1.00 0.00 C ATOM 1039 CD1 LEU A 70 -0.908 13.131 -0.906 1.00 0.00 C ATOM 1040 CD2 LEU A 70 -0.464 10.713 -1.363 1.00 0.00 C ATOM 0 H LEU A 70 -1.389 10.908 3.045 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.313 9.463 0.786 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -0.758 12.251 1.698 1.00 0.00 H new ATOM 0 HB3 LEU A 70 0.746 12.042 0.822 1.00 0.00 H new ATOM 0 HG LEU A 70 -2.055 11.480 -0.176 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -1.450 13.193 -1.850 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -1.342 13.831 -0.192 1.00 0.00 H new ATOM 0 HD13 LEU A 70 0.139 13.384 -1.072 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -1.019 10.798 -2.297 1.00 0.00 H new ATOM 0 HD22 LEU A 70 0.591 10.916 -1.547 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -0.575 9.704 -0.966 1.00 0.00 H new ATOM 1052 N LEU A 71 2.104 9.256 1.313 1.00 0.00 N ATOM 1053 CA LEU A 71 3.504 9.048 1.686 1.00 0.00 C ATOM 1054 C LEU A 71 4.219 10.382 1.872 1.00 0.00 C ATOM 1055 O LEU A 71 5.211 10.477 2.593 1.00 0.00 O ATOM 1056 CB LEU A 71 4.228 8.225 0.628 1.00 0.00 C ATOM 1057 CG LEU A 71 3.422 7.066 0.067 1.00 0.00 C ATOM 1058 CD1 LEU A 71 2.959 7.380 -1.340 1.00 0.00 C ATOM 1059 CD2 LEU A 71 4.235 5.779 0.108 1.00 0.00 C ATOM 0 H LEU A 71 1.804 8.756 0.476 1.00 0.00 H new ATOM 0 HA LEU A 71 3.518 8.504 2.630 1.00 0.00 H new ATOM 0 HB2 LEU A 71 4.513 8.883 -0.193 1.00 0.00 H new ATOM 0 HB3 LEU A 71 5.150 7.834 1.059 1.00 0.00 H new ATOM 0 HG LEU A 71 2.538 6.920 0.688 1.00 0.00 H new ATOM 0 HD11 LEU A 71 2.383 6.541 -1.729 1.00 0.00 H new ATOM 0 HD12 LEU A 71 2.335 8.274 -1.327 1.00 0.00 H new ATOM 0 HD13 LEU A 71 3.826 7.552 -1.978 1.00 0.00 H new ATOM 0 HD21 LEU A 71 3.641 4.960 -0.298 1.00 0.00 H new ATOM 0 HD22 LEU A 71 5.140 5.901 -0.488 1.00 0.00 H new ATOM 0 HD23 LEU A 71 4.507 5.553 1.139 1.00 0.00 H new ATOM 1071 N HIS A 72 3.697 11.407 1.212 1.00 0.00 N ATOM 1072 CA HIS A 72 4.263 12.745 1.290 1.00 0.00 C ATOM 1073 C HIS A 72 3.559 13.565 2.366 1.00 0.00 C ATOM 1074 O HIS A 72 3.315 14.760 2.194 1.00 0.00 O ATOM 1075 CB HIS A 72 4.134 13.443 -0.063 1.00 0.00 C ATOM 1076 CG HIS A 72 5.420 14.025 -0.565 1.00 0.00 C ATOM 1077 ND1 HIS A 72 5.519 14.718 -1.753 1.00 0.00 N ATOM 1078 CD2 HIS A 72 6.666 14.014 -0.034 1.00 0.00 C ATOM 1079 CE1 HIS A 72 6.769 15.107 -1.932 1.00 0.00 C ATOM 1080 NE2 HIS A 72 7.484 14.694 -0.902 1.00 0.00 N ATOM 0 H HIS A 72 2.875 11.335 0.612 1.00 0.00 H new ATOM 0 HA HIS A 72 5.317 12.661 1.553 1.00 0.00 H new ATOM 0 HB2 HIS A 72 3.758 12.729 -0.796 1.00 0.00 H new ATOM 0 HB3 HIS A 72 3.393 14.238 0.017 1.00 0.00 H new ATOM 0 HD2 HIS A 72 6.961 13.556 0.898 1.00 0.00 H new ATOM 0 HE1 HIS A 72 7.142 15.667 -2.777 1.00 0.00 H new ATOM 0 HE2 HIS A 72 8.483 14.854 -0.772 1.00 0.00 H new ATOM 1089 N SER A 73 3.235 12.912 3.474 1.00 0.00 N ATOM 1090 CA SER A 73 2.557 13.575 4.579 1.00 0.00 C ATOM 1091 C SER A 73 3.014 13.003 5.917 1.00 0.00 C ATOM 1092 O SER A 73 3.831 12.084 5.962 1.00 0.00 O ATOM 1093 CB SER A 73 1.041 13.424 4.439 1.00 0.00 C ATOM 1094 OG SER A 73 0.368 14.594 4.873 1.00 0.00 O ATOM 0 H SER A 73 3.431 11.923 3.631 1.00 0.00 H new ATOM 0 HA SER A 73 2.814 14.634 4.548 1.00 0.00 H new ATOM 0 HB2 SER A 73 0.788 13.220 3.399 1.00 0.00 H new ATOM 0 HB3 SER A 73 0.702 12.568 5.023 1.00 0.00 H new ATOM 0 HG SER A 73 -0.599 14.472 4.771 1.00 0.00 H new ATOM 1100 N ASP A 74 2.479 13.548 7.005 1.00 0.00 N ATOM 1101 CA ASP A 74 2.833 13.085 8.341 1.00 0.00 C ATOM 1102 C ASP A 74 2.210 11.722 8.620 1.00 0.00 C ATOM 1103 O ASP A 74 1.012 11.617 8.880 1.00 0.00 O ATOM 1104 CB ASP A 74 2.378 14.094 9.396 1.00 0.00 C ATOM 1105 CG ASP A 74 0.927 14.498 9.221 1.00 0.00 C ATOM 1106 OD1 ASP A 74 0.650 15.357 8.357 1.00 0.00 O ATOM 1107 OD2 ASP A 74 0.068 13.956 9.948 1.00 0.00 O ATOM 0 H ASP A 74 1.800 14.309 6.987 1.00 0.00 H new ATOM 0 HA ASP A 74 3.918 12.990 8.391 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.516 13.665 10.389 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.009 14.981 9.342 1.00 0.00 H new ATOM 1112 N ARG A 75 3.032 10.679 8.563 1.00 0.00 N ATOM 1113 CA ARG A 75 2.561 9.321 8.806 1.00 0.00 C ATOM 1114 C ARG A 75 2.498 9.022 10.300 1.00 0.00 C ATOM 1115 O ARG A 75 3.454 9.269 11.034 1.00 0.00 O ATOM 1116 CB ARG A 75 3.476 8.309 8.112 1.00 0.00 C ATOM 1117 CG ARG A 75 3.683 8.591 6.632 1.00 0.00 C ATOM 1118 CD ARG A 75 3.323 7.386 5.776 1.00 0.00 C ATOM 1119 NE ARG A 75 4.197 7.258 4.615 1.00 0.00 N ATOM 1120 CZ ARG A 75 5.513 7.063 4.693 1.00 0.00 C ATOM 1121 NH1 ARG A 75 6.110 6.974 5.875 1.00 0.00 N ATOM 1122 NH2 ARG A 75 6.234 6.953 3.586 1.00 0.00 N ATOM 0 H ARG A 75 4.027 10.749 8.351 1.00 0.00 H new ATOM 0 HA ARG A 75 1.555 9.236 8.395 1.00 0.00 H new ATOM 0 HB2 ARG A 75 4.445 8.305 8.612 1.00 0.00 H new ATOM 0 HB3 ARG A 75 3.054 7.311 8.228 1.00 0.00 H new ATOM 0 HG2 ARG A 75 3.073 9.444 6.335 1.00 0.00 H new ATOM 0 HG3 ARG A 75 4.723 8.866 6.455 1.00 0.00 H new ATOM 0 HD2 ARG A 75 3.387 6.481 6.380 1.00 0.00 H new ATOM 0 HD3 ARG A 75 2.289 7.474 5.443 1.00 0.00 H new ATOM 0 HE ARG A 75 3.776 7.322 3.688 1.00 0.00 H new ATOM 0 HH11 ARG A 75 5.561 7.055 6.731 1.00 0.00 H new ATOM 0 HH12 ARG A 75 7.118 6.825 5.927 1.00 0.00 H new ATOM 0 HH21 ARG A 75 5.782 7.018 2.674 1.00 0.00 H new ATOM 0 HH22 ARG A 75 7.241 6.804 3.646 1.00 0.00 H new ATOM 1136 N ASP A 76 1.366 8.485 10.742 1.00 0.00 N ATOM 1137 CA ASP A 76 1.177 8.145 12.147 1.00 0.00 C ATOM 1138 C ASP A 76 1.816 6.796 12.463 1.00 0.00 C ATOM 1139 O ASP A 76 1.996 5.963 11.574 1.00 0.00 O ATOM 1140 CB ASP A 76 -0.314 8.113 12.491 1.00 0.00 C ATOM 1141 CG ASP A 76 -0.769 9.368 13.208 1.00 0.00 C ATOM 1142 OD1 ASP A 76 -0.246 10.457 12.890 1.00 0.00 O ATOM 1143 OD2 ASP A 76 -1.648 9.262 14.090 1.00 0.00 O ATOM 0 H ASP A 76 0.565 8.276 10.147 1.00 0.00 H new ATOM 0 HA ASP A 76 1.662 8.910 12.753 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -0.893 7.991 11.575 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.521 7.245 13.117 1.00 0.00 H new ATOM 1148 N PRO A 77 2.177 6.562 13.735 1.00 0.00 N ATOM 1149 CA PRO A 77 2.805 5.315 14.158 1.00 0.00 C ATOM 1150 C PRO A 77 1.793 4.234 14.534 1.00 0.00 C ATOM 1151 O PRO A 77 1.121 4.328 15.561 1.00 0.00 O ATOM 1152 CB PRO A 77 3.596 5.751 15.385 1.00 0.00 C ATOM 1153 CG PRO A 77 2.775 6.840 15.993 1.00 0.00 C ATOM 1154 CD PRO A 77 2.016 7.499 14.864 1.00 0.00 C ATOM 0 HA PRO A 77 3.402 4.864 13.365 1.00 0.00 H new ATOM 0 HB2 PRO A 77 3.736 4.924 16.081 1.00 0.00 H new ATOM 0 HB3 PRO A 77 4.589 6.108 15.111 1.00 0.00 H new ATOM 0 HG2 PRO A 77 2.088 6.436 16.737 1.00 0.00 H new ATOM 0 HG3 PRO A 77 3.410 7.563 16.505 1.00 0.00 H new ATOM 0 HD2 PRO A 77 0.966 7.642 15.118 1.00 0.00 H new ATOM 0 HD3 PRO A 77 2.424 8.482 14.629 1.00 0.00 H new ATOM 1162 N ILE A 78 1.706 3.200 13.703 1.00 0.00 N ATOM 1163 CA ILE A 78 0.794 2.086 13.951 1.00 0.00 C ATOM 1164 C ILE A 78 1.493 0.752 13.692 1.00 0.00 C ATOM 1165 O ILE A 78 1.056 -0.044 12.860 1.00 0.00 O ATOM 1166 CB ILE A 78 -0.471 2.172 13.073 1.00 0.00 C ATOM 1167 CG1 ILE A 78 -0.984 3.610 13.013 1.00 0.00 C ATOM 1168 CG2 ILE A 78 -1.549 1.243 13.610 1.00 0.00 C ATOM 1169 CD1 ILE A 78 -0.334 4.436 11.927 1.00 0.00 C ATOM 0 H ILE A 78 2.257 3.109 12.849 1.00 0.00 H new ATOM 0 HA ILE A 78 0.493 2.149 14.997 1.00 0.00 H new ATOM 0 HB ILE A 78 -0.214 1.857 12.061 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -2.062 3.597 12.852 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -0.811 4.090 13.976 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -2.436 1.314 12.981 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -1.181 0.217 13.605 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -1.803 1.532 14.630 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -0.745 5.445 11.942 1.00 0.00 H new ATOM 0 HD12 ILE A 78 0.742 4.480 12.098 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -0.529 3.979 10.957 1.00 0.00 H new ATOM 1181 N ARG A 79 2.590 0.527 14.406 1.00 0.00 N ATOM 1182 CA ARG A 79 3.372 -0.698 14.260 1.00 0.00 C ATOM 1183 C ARG A 79 2.561 -1.940 14.619 1.00 0.00 C ATOM 1184 O ARG A 79 2.893 -3.047 14.200 1.00 0.00 O ATOM 1185 CB ARG A 79 4.624 -0.633 15.137 1.00 0.00 C ATOM 1186 CG ARG A 79 4.365 -0.138 16.554 1.00 0.00 C ATOM 1187 CD ARG A 79 3.928 -1.268 17.470 1.00 0.00 C ATOM 1188 NE ARG A 79 2.984 -0.815 18.489 1.00 0.00 N ATOM 1189 CZ ARG A 79 3.343 -0.199 19.613 1.00 0.00 C ATOM 1190 NH1 ARG A 79 4.623 0.045 19.865 1.00 0.00 N ATOM 1191 NH2 ARG A 79 2.419 0.175 20.488 1.00 0.00 N ATOM 0 H ARG A 79 2.961 1.180 15.096 1.00 0.00 H new ATOM 0 HA ARG A 79 3.659 -0.776 13.211 1.00 0.00 H new ATOM 0 HB2 ARG A 79 5.072 -1.625 15.186 1.00 0.00 H new ATOM 0 HB3 ARG A 79 5.354 0.023 14.662 1.00 0.00 H new ATOM 0 HG2 ARG A 79 5.270 0.323 16.950 1.00 0.00 H new ATOM 0 HG3 ARG A 79 3.596 0.634 16.535 1.00 0.00 H new ATOM 0 HD2 ARG A 79 3.469 -2.058 16.876 1.00 0.00 H new ATOM 0 HD3 ARG A 79 4.803 -1.701 17.954 1.00 0.00 H new ATOM 0 HE ARG A 79 1.990 -0.981 18.329 1.00 0.00 H new ATOM 0 HH11 ARG A 79 5.338 -0.240 19.196 1.00 0.00 H new ATOM 0 HH12 ARG A 79 4.892 0.517 20.728 1.00 0.00 H new ATOM 0 HH21 ARG A 79 1.434 -0.009 20.299 1.00 0.00 H new ATOM 0 HH22 ARG A 79 2.694 0.647 21.349 1.00 0.00 H new ATOM 1205 N ASP A 80 1.509 -1.756 15.408 1.00 0.00 N ATOM 1206 CA ASP A 80 0.671 -2.874 15.835 1.00 0.00 C ATOM 1207 C ASP A 80 -0.449 -3.167 14.835 1.00 0.00 C ATOM 1208 O ASP A 80 -1.411 -3.861 15.165 1.00 0.00 O ATOM 1209 CB ASP A 80 0.073 -2.586 17.214 1.00 0.00 C ATOM 1210 CG ASP A 80 0.608 -3.520 18.283 1.00 0.00 C ATOM 1211 OD1 ASP A 80 0.927 -4.680 17.950 1.00 0.00 O ATOM 1212 OD2 ASP A 80 0.706 -3.091 19.451 1.00 0.00 O ATOM 0 H ASP A 80 1.215 -0.847 15.765 1.00 0.00 H new ATOM 0 HA ASP A 80 1.308 -3.757 15.887 1.00 0.00 H new ATOM 0 HB2 ASP A 80 0.291 -1.555 17.494 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -1.012 -2.680 17.163 1.00 0.00 H new ATOM 1217 N VAL A 81 -0.332 -2.640 13.618 1.00 0.00 N ATOM 1218 CA VAL A 81 -1.350 -2.860 12.602 1.00 0.00 C ATOM 1219 C VAL A 81 -0.736 -2.965 11.204 1.00 0.00 C ATOM 1220 O VAL A 81 0.082 -2.130 10.817 1.00 0.00 O ATOM 1221 CB VAL A 81 -2.373 -1.713 12.606 1.00 0.00 C ATOM 1222 CG1 VAL A 81 -3.507 -1.995 11.632 1.00 0.00 C ATOM 1223 CG2 VAL A 81 -2.912 -1.481 14.009 1.00 0.00 C ATOM 0 H VAL A 81 0.453 -2.062 13.316 1.00 0.00 H new ATOM 0 HA VAL A 81 -1.844 -3.801 12.843 1.00 0.00 H new ATOM 0 HB VAL A 81 -1.867 -0.805 12.280 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -4.218 -1.169 11.653 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -3.104 -2.101 10.625 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -4.013 -2.917 11.920 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -3.635 -0.665 13.991 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -3.398 -2.389 14.367 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.090 -1.223 14.677 1.00 0.00 H new ATOM 1233 N PRO A 82 -1.127 -3.989 10.419 1.00 0.00 N ATOM 1234 CA PRO A 82 -0.612 -4.178 9.057 1.00 0.00 C ATOM 1235 C PRO A 82 -0.879 -2.960 8.180 1.00 0.00 C ATOM 1236 O PRO A 82 -1.946 -2.351 8.262 1.00 0.00 O ATOM 1237 CB PRO A 82 -1.389 -5.392 8.537 1.00 0.00 C ATOM 1238 CG PRO A 82 -1.863 -6.100 9.759 1.00 0.00 C ATOM 1239 CD PRO A 82 -2.103 -5.031 10.786 1.00 0.00 C ATOM 0 HA PRO A 82 0.469 -4.320 9.043 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -2.226 -5.085 7.909 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -0.754 -6.036 7.929 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -2.776 -6.660 9.557 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -1.120 -6.817 10.108 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -3.126 -4.657 10.747 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -1.937 -5.400 11.798 1.00 0.00 H new ATOM 1247 N ALA A 83 0.095 -2.597 7.352 1.00 0.00 N ATOM 1248 CA ALA A 83 -0.049 -1.438 6.478 1.00 0.00 C ATOM 1249 C ALA A 83 0.045 -1.812 5.003 1.00 0.00 C ATOM 1250 O ALA A 83 0.607 -2.846 4.641 1.00 0.00 O ATOM 1251 CB ALA A 83 1.003 -0.396 6.819 1.00 0.00 C ATOM 0 H ALA A 83 0.987 -3.085 7.268 1.00 0.00 H new ATOM 0 HA ALA A 83 -1.044 -1.025 6.646 1.00 0.00 H new ATOM 0 HB1 ALA A 83 0.888 0.466 6.162 1.00 0.00 H new ATOM 0 HB2 ALA A 83 0.880 -0.081 7.855 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.996 -0.824 6.685 1.00 0.00 H new ATOM 1257 N VAL A 84 -0.506 -0.944 4.162 1.00 0.00 N ATOM 1258 CA VAL A 84 -0.495 -1.136 2.717 1.00 0.00 C ATOM 1259 C VAL A 84 0.062 0.104 2.034 1.00 0.00 C ATOM 1260 O VAL A 84 -0.326 1.218 2.365 1.00 0.00 O ATOM 1261 CB VAL A 84 -1.913 -1.404 2.178 1.00 0.00 C ATOM 1262 CG1 VAL A 84 -1.882 -1.711 0.689 1.00 0.00 C ATOM 1263 CG2 VAL A 84 -2.573 -2.531 2.952 1.00 0.00 C ATOM 0 H VAL A 84 -0.972 -0.088 4.463 1.00 0.00 H new ATOM 0 HA VAL A 84 0.133 -2.000 2.502 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.507 -0.501 2.318 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -2.896 -1.896 0.335 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -1.459 -0.862 0.151 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.269 -2.595 0.512 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -3.574 -2.706 2.557 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -1.979 -3.439 2.850 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -2.641 -2.258 4.005 1.00 0.00 H new ATOM 1273 N TYR A 85 0.977 -0.081 1.094 1.00 0.00 N ATOM 1274 CA TYR A 85 1.571 1.050 0.392 1.00 0.00 C ATOM 1275 C TYR A 85 1.350 0.946 -1.115 1.00 0.00 C ATOM 1276 O TYR A 85 2.267 0.604 -1.864 1.00 0.00 O ATOM 1277 CB TYR A 85 3.067 1.136 0.699 1.00 0.00 C ATOM 1278 CG TYR A 85 3.387 1.709 2.065 1.00 0.00 C ATOM 1279 CD1 TYR A 85 2.870 1.137 3.222 1.00 0.00 C ATOM 1280 CD2 TYR A 85 4.206 2.824 2.196 1.00 0.00 C ATOM 1281 CE1 TYR A 85 3.165 1.658 4.470 1.00 0.00 C ATOM 1282 CE2 TYR A 85 4.504 3.350 3.440 1.00 0.00 C ATOM 1283 CZ TYR A 85 3.983 2.763 4.573 1.00 0.00 C ATOM 1284 OH TYR A 85 4.278 3.283 5.811 1.00 0.00 O ATOM 0 H TYR A 85 1.323 -0.995 0.801 1.00 0.00 H new ATOM 0 HA TYR A 85 1.080 1.958 0.743 1.00 0.00 H new ATOM 0 HB2 TYR A 85 3.500 0.138 0.625 1.00 0.00 H new ATOM 0 HB3 TYR A 85 3.548 1.750 -0.062 1.00 0.00 H new ATOM 0 HD1 TYR A 85 2.228 0.272 3.146 1.00 0.00 H new ATOM 0 HD2 TYR A 85 4.617 3.288 1.311 1.00 0.00 H new ATOM 0 HE1 TYR A 85 2.756 1.201 5.359 1.00 0.00 H new ATOM 0 HE2 TYR A 85 5.142 4.217 3.523 1.00 0.00 H new ATOM 0 HH TYR A 85 3.591 3.009 6.453 1.00 0.00 H new ATOM 1294 N PHE A 86 0.135 1.261 -1.560 1.00 0.00 N ATOM 1295 CA PHE A 86 -0.190 1.219 -2.983 1.00 0.00 C ATOM 1296 C PHE A 86 0.232 2.529 -3.639 1.00 0.00 C ATOM 1297 O PHE A 86 -0.552 3.473 -3.725 1.00 0.00 O ATOM 1298 CB PHE A 86 -1.691 0.964 -3.191 1.00 0.00 C ATOM 1299 CG PHE A 86 -2.226 1.472 -4.504 1.00 0.00 C ATOM 1300 CD1 PHE A 86 -1.507 1.299 -5.674 1.00 0.00 C ATOM 1301 CD2 PHE A 86 -3.451 2.115 -4.564 1.00 0.00 C ATOM 1302 CE1 PHE A 86 -1.999 1.758 -6.877 1.00 0.00 C ATOM 1303 CE2 PHE A 86 -3.947 2.578 -5.767 1.00 0.00 C ATOM 1304 CZ PHE A 86 -3.219 2.398 -6.924 1.00 0.00 C ATOM 0 H PHE A 86 -0.637 1.547 -0.958 1.00 0.00 H new ATOM 0 HA PHE A 86 0.354 0.397 -3.449 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -1.879 -0.108 -3.125 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -2.244 1.435 -2.379 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -0.550 0.799 -5.644 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -4.025 2.256 -3.660 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -1.429 1.616 -7.783 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -4.903 3.080 -5.801 1.00 0.00 H new ATOM 0 HZ PHE A 86 -3.604 2.758 -7.866 1.00 0.00 H new ATOM 1314 N VAL A 87 1.485 2.587 -4.072 1.00 0.00 N ATOM 1315 CA VAL A 87 2.019 3.792 -4.689 1.00 0.00 C ATOM 1316 C VAL A 87 2.914 3.471 -5.880 1.00 0.00 C ATOM 1317 O VAL A 87 3.174 2.311 -6.180 1.00 0.00 O ATOM 1318 CB VAL A 87 2.813 4.618 -3.666 1.00 0.00 C ATOM 1319 CG1 VAL A 87 1.947 4.938 -2.463 1.00 0.00 C ATOM 1320 CG2 VAL A 87 4.065 3.882 -3.229 1.00 0.00 C ATOM 0 H VAL A 87 2.148 1.815 -4.007 1.00 0.00 H new ATOM 0 HA VAL A 87 1.167 4.371 -5.046 1.00 0.00 H new ATOM 0 HB VAL A 87 3.114 5.551 -4.143 1.00 0.00 H new ATOM 0 HG11 VAL A 87 2.522 5.524 -1.746 1.00 0.00 H new ATOM 0 HG12 VAL A 87 1.076 5.510 -2.783 1.00 0.00 H new ATOM 0 HG13 VAL A 87 1.619 4.010 -1.994 1.00 0.00 H new ATOM 0 HG21 VAL A 87 4.609 4.488 -2.505 1.00 0.00 H new ATOM 0 HG22 VAL A 87 3.788 2.932 -2.772 1.00 0.00 H new ATOM 0 HG23 VAL A 87 4.699 3.696 -4.096 1.00 0.00 H new ATOM 1330 N MET A 88 3.383 4.512 -6.558 1.00 0.00 N ATOM 1331 CA MET A 88 4.253 4.345 -7.715 1.00 0.00 C ATOM 1332 C MET A 88 5.688 4.091 -7.279 1.00 0.00 C ATOM 1333 O MET A 88 6.146 4.650 -6.289 1.00 0.00 O ATOM 1334 CB MET A 88 4.191 5.592 -8.600 1.00 0.00 C ATOM 1335 CG MET A 88 4.761 5.384 -9.992 1.00 0.00 C ATOM 1336 SD MET A 88 4.283 6.688 -11.138 1.00 0.00 S ATOM 1337 CE MET A 88 2.511 6.437 -11.185 1.00 0.00 C ATOM 0 H MET A 88 3.174 5.483 -6.325 1.00 0.00 H new ATOM 0 HA MET A 88 3.907 3.482 -8.284 1.00 0.00 H new ATOM 0 HB2 MET A 88 3.153 5.913 -8.687 1.00 0.00 H new ATOM 0 HB3 MET A 88 4.735 6.400 -8.112 1.00 0.00 H new ATOM 0 HG2 MET A 88 5.848 5.339 -9.932 1.00 0.00 H new ATOM 0 HG3 MET A 88 4.423 4.423 -10.379 1.00 0.00 H new ATOM 0 HE1 MET A 88 2.122 6.771 -12.147 1.00 0.00 H new ATOM 0 HE2 MET A 88 2.290 5.378 -11.052 1.00 0.00 H new ATOM 0 HE3 MET A 88 2.041 7.009 -10.385 1.00 0.00 H new ATOM 1347 N PRO A 89 6.429 3.245 -8.014 1.00 0.00 N ATOM 1348 CA PRO A 89 7.816 2.942 -7.688 1.00 0.00 C ATOM 1349 C PRO A 89 8.769 3.998 -8.229 1.00 0.00 C ATOM 1350 O PRO A 89 9.813 3.677 -8.796 1.00 0.00 O ATOM 1351 CB PRO A 89 8.045 1.603 -8.379 1.00 0.00 C ATOM 1352 CG PRO A 89 7.138 1.622 -9.565 1.00 0.00 C ATOM 1353 CD PRO A 89 5.978 2.525 -9.220 1.00 0.00 C ATOM 0 HA PRO A 89 7.999 2.918 -6.614 1.00 0.00 H new ATOM 0 HB2 PRO A 89 9.086 1.487 -8.680 1.00 0.00 H new ATOM 0 HB3 PRO A 89 7.810 0.771 -7.715 1.00 0.00 H new ATOM 0 HG2 PRO A 89 7.664 1.989 -10.446 1.00 0.00 H new ATOM 0 HG3 PRO A 89 6.788 0.617 -9.799 1.00 0.00 H new ATOM 0 HD2 PRO A 89 5.753 3.214 -10.034 1.00 0.00 H new ATOM 0 HD3 PRO A 89 5.071 1.952 -9.027 1.00 0.00 H new ATOM 1361 N THR A 90 8.398 5.261 -8.051 1.00 0.00 N ATOM 1362 CA THR A 90 9.209 6.371 -8.520 1.00 0.00 C ATOM 1363 C THR A 90 10.387 6.612 -7.584 1.00 0.00 C ATOM 1364 O THR A 90 10.348 6.229 -6.414 1.00 0.00 O ATOM 1365 CB THR A 90 8.349 7.627 -8.630 1.00 0.00 C ATOM 1366 OG1 THR A 90 7.516 7.764 -7.492 1.00 0.00 O ATOM 1367 CG2 THR A 90 7.455 7.632 -9.853 1.00 0.00 C ATOM 0 H THR A 90 7.536 5.539 -7.582 1.00 0.00 H new ATOM 0 HA THR A 90 9.606 6.124 -9.505 1.00 0.00 H new ATOM 0 HB THR A 90 9.053 8.455 -8.708 1.00 0.00 H new ATOM 0 HG1 THR A 90 6.973 8.575 -7.580 1.00 0.00 H new ATOM 0 HG21 THR A 90 6.870 8.551 -9.872 1.00 0.00 H new ATOM 0 HG22 THR A 90 8.068 7.573 -10.752 1.00 0.00 H new ATOM 0 HG23 THR A 90 6.783 6.775 -9.816 1.00 0.00 H new ATOM 1375 N GLU A 91 11.435 7.243 -8.107 1.00 0.00 N ATOM 1376 CA GLU A 91 12.637 7.535 -7.324 1.00 0.00 C ATOM 1377 C GLU A 91 12.282 8.033 -5.927 1.00 0.00 C ATOM 1378 O GLU A 91 12.765 7.505 -4.926 1.00 0.00 O ATOM 1379 CB GLU A 91 13.502 8.578 -8.035 1.00 0.00 C ATOM 1380 CG GLU A 91 13.610 8.365 -9.537 1.00 0.00 C ATOM 1381 CD GLU A 91 15.023 8.551 -10.052 1.00 0.00 C ATOM 1382 OE1 GLU A 91 15.677 9.536 -9.651 1.00 0.00 O ATOM 1383 OE2 GLU A 91 15.477 7.710 -10.857 1.00 0.00 O ATOM 0 H GLU A 91 11.478 7.564 -9.074 1.00 0.00 H new ATOM 0 HA GLU A 91 13.198 6.606 -7.228 1.00 0.00 H new ATOM 0 HB2 GLU A 91 13.088 9.569 -7.847 1.00 0.00 H new ATOM 0 HB3 GLU A 91 14.502 8.563 -7.602 1.00 0.00 H new ATOM 0 HG2 GLU A 91 13.267 7.360 -9.783 1.00 0.00 H new ATOM 0 HG3 GLU A 91 12.946 9.063 -10.048 1.00 0.00 H new ATOM 1390 N GLU A 92 11.438 9.055 -5.871 1.00 0.00 N ATOM 1391 CA GLU A 92 11.020 9.628 -4.597 1.00 0.00 C ATOM 1392 C GLU A 92 10.253 8.608 -3.760 1.00 0.00 C ATOM 1393 O GLU A 92 10.439 8.526 -2.546 1.00 0.00 O ATOM 1394 CB GLU A 92 10.160 10.872 -4.828 1.00 0.00 C ATOM 1395 CG GLU A 92 9.006 10.648 -5.790 1.00 0.00 C ATOM 1396 CD GLU A 92 8.840 11.785 -6.779 1.00 0.00 C ATOM 1397 OE1 GLU A 92 9.846 12.179 -7.404 1.00 0.00 O ATOM 1398 OE2 GLU A 92 7.703 12.282 -6.926 1.00 0.00 O ATOM 0 H GLU A 92 11.030 9.504 -6.691 1.00 0.00 H new ATOM 0 HA GLU A 92 11.917 9.914 -4.048 1.00 0.00 H new ATOM 0 HB2 GLU A 92 9.763 11.211 -3.871 1.00 0.00 H new ATOM 0 HB3 GLU A 92 10.792 11.673 -5.213 1.00 0.00 H new ATOM 0 HG2 GLU A 92 9.168 9.718 -6.335 1.00 0.00 H new ATOM 0 HG3 GLU A 92 8.083 10.528 -5.222 1.00 0.00 H new ATOM 1405 N ASN A 93 9.395 7.827 -4.410 1.00 0.00 N ATOM 1406 CA ASN A 93 8.613 6.815 -3.709 1.00 0.00 C ATOM 1407 C ASN A 93 9.529 5.788 -3.060 1.00 0.00 C ATOM 1408 O ASN A 93 9.397 5.484 -1.875 1.00 0.00 O ATOM 1409 CB ASN A 93 7.644 6.119 -4.661 1.00 0.00 C ATOM 1410 CG ASN A 93 6.217 6.594 -4.471 1.00 0.00 C ATOM 1411 OD1 ASN A 93 5.641 6.452 -3.391 1.00 0.00 O ATOM 1412 ND2 ASN A 93 5.637 7.164 -5.521 1.00 0.00 N ATOM 0 H ASN A 93 9.225 7.875 -5.415 1.00 0.00 H new ATOM 0 HA ASN A 93 8.036 7.316 -2.932 1.00 0.00 H new ATOM 0 HB2 ASN A 93 7.953 6.303 -5.690 1.00 0.00 H new ATOM 0 HB3 ASN A 93 7.691 5.042 -4.502 1.00 0.00 H new ATOM 0 HD21 ASN A 93 4.678 7.504 -5.452 1.00 0.00 H new ATOM 0 HD22 ASN A 93 6.151 7.262 -6.397 1.00 0.00 H new ATOM 1419 N ILE A 94 10.463 5.260 -3.844 1.00 0.00 N ATOM 1420 CA ILE A 94 11.408 4.271 -3.344 1.00 0.00 C ATOM 1421 C ILE A 94 12.070 4.763 -2.062 1.00 0.00 C ATOM 1422 O ILE A 94 12.392 3.975 -1.171 1.00 0.00 O ATOM 1423 CB ILE A 94 12.499 3.946 -4.389 1.00 0.00 C ATOM 1424 CG1 ILE A 94 11.893 3.724 -5.785 1.00 0.00 C ATOM 1425 CG2 ILE A 94 13.302 2.729 -3.957 1.00 0.00 C ATOM 1426 CD1 ILE A 94 10.478 3.181 -5.781 1.00 0.00 C ATOM 0 H ILE A 94 10.585 5.501 -4.828 1.00 0.00 H new ATOM 0 HA ILE A 94 10.843 3.362 -3.139 1.00 0.00 H new ATOM 0 HB ILE A 94 13.168 4.805 -4.451 1.00 0.00 H new ATOM 0 HG12 ILE A 94 11.903 4.671 -6.325 1.00 0.00 H new ATOM 0 HG13 ILE A 94 12.531 3.034 -6.338 1.00 0.00 H new ATOM 0 HG21 ILE A 94 14.066 2.513 -4.704 1.00 0.00 H new ATOM 0 HG22 ILE A 94 13.779 2.929 -2.997 1.00 0.00 H new ATOM 0 HG23 ILE A 94 12.638 1.870 -3.860 1.00 0.00 H new ATOM 0 HD11 ILE A 94 10.133 3.056 -6.807 1.00 0.00 H new ATOM 0 HD12 ILE A 94 10.460 2.217 -5.273 1.00 0.00 H new ATOM 0 HD13 ILE A 94 9.822 3.878 -5.260 1.00 0.00 H new ATOM 1438 N ASP A 95 12.254 6.077 -1.971 1.00 0.00 N ATOM 1439 CA ASP A 95 12.862 6.681 -0.794 1.00 0.00 C ATOM 1440 C ASP A 95 11.887 6.675 0.381 1.00 0.00 C ATOM 1441 O ASP A 95 12.298 6.661 1.540 1.00 0.00 O ATOM 1442 CB ASP A 95 13.307 8.114 -1.101 1.00 0.00 C ATOM 1443 CG ASP A 95 14.739 8.377 -0.681 1.00 0.00 C ATOM 1444 OD1 ASP A 95 15.633 7.618 -1.112 1.00 0.00 O ATOM 1445 OD2 ASP A 95 14.967 9.341 0.078 1.00 0.00 O ATOM 0 H ASP A 95 11.990 6.742 -2.698 1.00 0.00 H new ATOM 0 HA ASP A 95 13.737 6.091 -0.521 1.00 0.00 H new ATOM 0 HB2 ASP A 95 13.204 8.302 -2.170 1.00 0.00 H new ATOM 0 HB3 ASP A 95 12.647 8.814 -0.589 1.00 0.00 H new ATOM 1450 N ARG A 96 10.591 6.684 0.073 1.00 0.00 N ATOM 1451 CA ARG A 96 9.563 6.677 1.108 1.00 0.00 C ATOM 1452 C ARG A 96 9.385 5.279 1.693 1.00 0.00 C ATOM 1453 O ARG A 96 8.980 5.130 2.847 1.00 0.00 O ATOM 1454 CB ARG A 96 8.231 7.196 0.554 1.00 0.00 C ATOM 1455 CG ARG A 96 7.873 8.585 1.061 1.00 0.00 C ATOM 1456 CD ARG A 96 8.079 9.647 -0.008 1.00 0.00 C ATOM 1457 NE ARG A 96 6.827 10.010 -0.668 1.00 0.00 N ATOM 1458 CZ ARG A 96 6.761 10.600 -1.860 1.00 0.00 C ATOM 1459 NH1 ARG A 96 7.871 10.899 -2.524 1.00 0.00 N ATOM 1460 NH2 ARG A 96 5.581 10.895 -2.389 1.00 0.00 N ATOM 0 H ARG A 96 10.231 6.696 -0.881 1.00 0.00 H new ATOM 0 HA ARG A 96 9.889 7.343 1.907 1.00 0.00 H new ATOM 0 HB2 ARG A 96 8.280 7.215 -0.535 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.436 6.501 0.825 1.00 0.00 H new ATOM 0 HG2 ARG A 96 6.833 8.596 1.388 1.00 0.00 H new ATOM 0 HG3 ARG A 96 8.484 8.823 1.932 1.00 0.00 H new ATOM 0 HD2 ARG A 96 8.521 10.535 0.444 1.00 0.00 H new ATOM 0 HD3 ARG A 96 8.787 9.281 -0.751 1.00 0.00 H new ATOM 0 HE ARG A 96 5.952 9.799 -0.188 1.00 0.00 H new ATOM 0 HH11 ARG A 96 8.782 10.677 -2.122 1.00 0.00 H new ATOM 0 HH12 ARG A 96 7.813 11.351 -3.437 1.00 0.00 H new ATOM 0 HH21 ARG A 96 4.725 10.670 -1.883 1.00 0.00 H new ATOM 0 HH22 ARG A 96 5.530 11.347 -3.302 1.00 0.00 H new ATOM 1474 N LEU A 97 9.708 4.256 0.906 1.00 0.00 N ATOM 1475 CA LEU A 97 9.597 2.880 1.372 1.00 0.00 C ATOM 1476 C LEU A 97 10.692 2.599 2.387 1.00 0.00 C ATOM 1477 O LEU A 97 10.469 1.931 3.396 1.00 0.00 O ATOM 1478 CB LEU A 97 9.701 1.899 0.202 1.00 0.00 C ATOM 1479 CG LEU A 97 8.439 1.753 -0.660 1.00 0.00 C ATOM 1480 CD1 LEU A 97 7.189 1.695 0.207 1.00 0.00 C ATOM 1481 CD2 LEU A 97 8.346 2.894 -1.661 1.00 0.00 C ATOM 0 H LEU A 97 10.046 4.354 -0.051 1.00 0.00 H new ATOM 0 HA LEU A 97 8.622 2.747 1.841 1.00 0.00 H new ATOM 0 HB2 LEU A 97 10.523 2.215 -0.441 1.00 0.00 H new ATOM 0 HB3 LEU A 97 9.964 0.918 0.597 1.00 0.00 H new ATOM 0 HG LEU A 97 8.509 0.814 -1.210 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.310 1.592 -0.429 1.00 0.00 H new ATOM 0 HD12 LEU A 97 7.253 0.840 0.880 1.00 0.00 H new ATOM 0 HD13 LEU A 97 7.108 2.612 0.791 1.00 0.00 H new ATOM 0 HD21 LEU A 97 7.446 2.776 -2.265 1.00 0.00 H new ATOM 0 HD22 LEU A 97 8.303 3.844 -1.127 1.00 0.00 H new ATOM 0 HD23 LEU A 97 9.222 2.881 -2.310 1.00 0.00 H new ATOM 1493 N CYS A 98 11.875 3.133 2.112 1.00 0.00 N ATOM 1494 CA CYS A 98 13.016 2.965 2.997 1.00 0.00 C ATOM 1495 C CYS A 98 12.845 3.811 4.255 1.00 0.00 C ATOM 1496 O CYS A 98 13.436 3.522 5.296 1.00 0.00 O ATOM 1497 CB CYS A 98 14.300 3.357 2.267 1.00 0.00 C ATOM 1498 SG CYS A 98 15.808 2.697 3.015 1.00 0.00 S ATOM 0 H CYS A 98 12.068 3.688 1.279 1.00 0.00 H new ATOM 0 HA CYS A 98 13.080 1.918 3.293 1.00 0.00 H new ATOM 0 HB2 CYS A 98 14.238 3.011 1.235 1.00 0.00 H new ATOM 0 HB3 CYS A 98 14.369 4.444 2.235 1.00 0.00 H new ATOM 0 HG CYS A 98 16.840 3.082 2.324 1.00 0.00 H new ATOM 1504 N GLN A 99 12.027 4.855 4.152 1.00 0.00 N ATOM 1505 CA GLN A 99 11.771 5.742 5.278 1.00 0.00 C ATOM 1506 C GLN A 99 10.721 5.145 6.210 1.00 0.00 C ATOM 1507 O GLN A 99 10.910 5.104 7.424 1.00 0.00 O ATOM 1508 CB GLN A 99 11.309 7.112 4.781 1.00 0.00 C ATOM 1509 CG GLN A 99 12.444 7.992 4.282 1.00 0.00 C ATOM 1510 CD GLN A 99 13.077 8.812 5.388 1.00 0.00 C ATOM 1511 OE1 GLN A 99 12.468 9.747 5.909 1.00 0.00 O ATOM 1512 NE2 GLN A 99 14.306 8.467 5.753 1.00 0.00 N ATOM 0 H GLN A 99 11.530 5.106 3.297 1.00 0.00 H new ATOM 0 HA GLN A 99 12.701 5.861 5.834 1.00 0.00 H new ATOM 0 HB2 GLN A 99 10.587 6.973 3.976 1.00 0.00 H new ATOM 0 HB3 GLN A 99 10.790 7.627 5.590 1.00 0.00 H new ATOM 0 HG2 GLN A 99 13.206 7.366 3.817 1.00 0.00 H new ATOM 0 HG3 GLN A 99 12.066 8.662 3.509 1.00 0.00 H new ATOM 0 HE21 GLN A 99 14.774 7.685 5.294 1.00 0.00 H new ATOM 0 HE22 GLN A 99 14.782 8.984 6.492 1.00 0.00 H new ATOM 1521 N ASP A 100 9.613 4.683 5.635 1.00 0.00 N ATOM 1522 CA ASP A 100 8.540 4.091 6.426 1.00 0.00 C ATOM 1523 C ASP A 100 8.945 2.719 6.951 1.00 0.00 C ATOM 1524 O ASP A 100 8.498 2.294 8.016 1.00 0.00 O ATOM 1525 CB ASP A 100 7.262 3.981 5.591 1.00 0.00 C ATOM 1526 CG ASP A 100 7.401 3.009 4.436 1.00 0.00 C ATOM 1527 OD1 ASP A 100 7.697 1.823 4.690 1.00 0.00 O ATOM 1528 OD2 ASP A 100 7.211 3.435 3.278 1.00 0.00 O ATOM 0 H ASP A 100 9.436 4.707 4.631 1.00 0.00 H new ATOM 0 HA ASP A 100 8.349 4.741 7.280 1.00 0.00 H new ATOM 0 HB2 ASP A 100 6.440 3.662 6.232 1.00 0.00 H new ATOM 0 HB3 ASP A 100 7.000 4.965 5.203 1.00 0.00 H new ATOM 1533 N LEU A 101 9.795 2.031 6.197 1.00 0.00 N ATOM 1534 CA LEU A 101 10.261 0.708 6.589 1.00 0.00 C ATOM 1535 C LEU A 101 11.241 0.803 7.756 1.00 0.00 C ATOM 1536 O LEU A 101 11.274 -0.070 8.623 1.00 0.00 O ATOM 1537 CB LEU A 101 10.924 0.005 5.403 1.00 0.00 C ATOM 1538 CG LEU A 101 9.954 -0.576 4.373 1.00 0.00 C ATOM 1539 CD1 LEU A 101 10.702 -1.035 3.127 1.00 0.00 C ATOM 1540 CD2 LEU A 101 9.167 -1.726 4.980 1.00 0.00 C ATOM 0 H LEU A 101 10.174 2.368 5.312 1.00 0.00 H new ATOM 0 HA LEU A 101 9.398 0.124 6.909 1.00 0.00 H new ATOM 0 HB2 LEU A 101 11.582 0.714 4.901 1.00 0.00 H new ATOM 0 HB3 LEU A 101 11.553 -0.800 5.782 1.00 0.00 H new ATOM 0 HG LEU A 101 9.254 0.206 4.079 1.00 0.00 H new ATOM 0 HD11 LEU A 101 9.993 -1.445 2.407 1.00 0.00 H new ATOM 0 HD12 LEU A 101 11.222 -0.187 2.682 1.00 0.00 H new ATOM 0 HD13 LEU A 101 11.427 -1.802 3.400 1.00 0.00 H new ATOM 0 HD21 LEU A 101 8.481 -2.130 4.236 1.00 0.00 H new ATOM 0 HD22 LEU A 101 9.855 -2.508 5.301 1.00 0.00 H new ATOM 0 HD23 LEU A 101 8.600 -1.366 5.839 1.00 0.00 H new ATOM 1552 N ARG A 102 12.031 1.870 7.772 1.00 0.00 N ATOM 1553 CA ARG A 102 13.007 2.082 8.834 1.00 0.00 C ATOM 1554 C ARG A 102 12.347 2.724 10.051 1.00 0.00 C ATOM 1555 O ARG A 102 12.746 2.477 11.189 1.00 0.00 O ATOM 1556 CB ARG A 102 14.152 2.967 8.336 1.00 0.00 C ATOM 1557 CG ARG A 102 15.297 2.187 7.711 1.00 0.00 C ATOM 1558 CD ARG A 102 16.157 3.075 6.825 1.00 0.00 C ATOM 1559 NE ARG A 102 16.578 4.293 7.513 1.00 0.00 N ATOM 1560 CZ ARG A 102 17.570 5.076 7.096 1.00 0.00 C ATOM 1561 NH1 ARG A 102 18.246 4.772 5.994 1.00 0.00 N ATOM 1562 NH2 ARG A 102 17.887 6.166 7.781 1.00 0.00 N ATOM 0 H ARG A 102 12.015 2.602 7.062 1.00 0.00 H new ATOM 0 HA ARG A 102 13.409 1.112 9.125 1.00 0.00 H new ATOM 0 HB2 ARG A 102 13.762 3.673 7.603 1.00 0.00 H new ATOM 0 HB3 ARG A 102 14.536 3.554 9.171 1.00 0.00 H new ATOM 0 HG2 ARG A 102 15.913 1.750 8.497 1.00 0.00 H new ATOM 0 HG3 ARG A 102 14.898 1.361 7.122 1.00 0.00 H new ATOM 0 HD2 ARG A 102 17.037 2.520 6.501 1.00 0.00 H new ATOM 0 HD3 ARG A 102 15.599 3.341 5.927 1.00 0.00 H new ATOM 0 HE ARG A 102 16.082 4.559 8.364 1.00 0.00 H new ATOM 0 HH11 ARG A 102 18.006 3.935 5.463 1.00 0.00 H new ATOM 0 HH12 ARG A 102 19.005 5.376 5.679 1.00 0.00 H new ATOM 0 HH21 ARG A 102 17.371 6.404 8.628 1.00 0.00 H new ATOM 0 HH22 ARG A 102 18.647 6.766 7.461 1.00 0.00 H new ATOM 1576 N ASN A 103 11.333 3.547 9.800 1.00 0.00 N ATOM 1577 CA ASN A 103 10.613 4.226 10.873 1.00 0.00 C ATOM 1578 C ASN A 103 9.764 3.243 11.672 1.00 0.00 C ATOM 1579 O ASN A 103 9.445 3.488 12.836 1.00 0.00 O ATOM 1580 CB ASN A 103 9.722 5.330 10.298 1.00 0.00 C ATOM 1581 CG ASN A 103 10.524 6.489 9.739 1.00 0.00 C ATOM 1582 OD1 ASN A 103 11.613 6.797 10.224 1.00 0.00 O ATOM 1583 ND2 ASN A 103 9.986 7.140 8.713 1.00 0.00 N ATOM 0 H ASN A 103 10.991 3.760 8.863 1.00 0.00 H new ATOM 0 HA ASN A 103 11.350 4.670 11.543 1.00 0.00 H new ATOM 0 HB2 ASN A 103 9.094 4.913 9.510 1.00 0.00 H new ATOM 0 HB3 ASN A 103 9.054 5.697 11.077 1.00 0.00 H new ATOM 0 HD21 ASN A 103 10.478 7.930 8.295 1.00 0.00 H new ATOM 0 HD22 ASN A 103 9.081 6.850 8.343 1.00 0.00 H new ATOM 1590 N GLN A 104 9.395 2.131 11.043 1.00 0.00 N ATOM 1591 CA GLN A 104 8.578 1.117 11.700 1.00 0.00 C ATOM 1592 C GLN A 104 7.212 1.689 12.068 1.00 0.00 C ATOM 1593 O GLN A 104 6.687 1.428 13.150 1.00 0.00 O ATOM 1594 CB GLN A 104 9.283 0.594 12.955 1.00 0.00 C ATOM 1595 CG GLN A 104 10.733 0.205 12.719 1.00 0.00 C ATOM 1596 CD GLN A 104 11.600 0.414 13.945 1.00 0.00 C ATOM 1597 OE1 GLN A 104 11.553 -0.369 14.894 1.00 0.00 O ATOM 1598 NE2 GLN A 104 12.397 1.476 13.932 1.00 0.00 N ATOM 0 H GLN A 104 9.649 1.910 10.080 1.00 0.00 H new ATOM 0 HA GLN A 104 8.436 0.289 11.006 1.00 0.00 H new ATOM 0 HB2 GLN A 104 9.242 1.359 13.730 1.00 0.00 H new ATOM 0 HB3 GLN A 104 8.740 -0.272 13.333 1.00 0.00 H new ATOM 0 HG2 GLN A 104 10.780 -0.842 12.419 1.00 0.00 H new ATOM 0 HG3 GLN A 104 11.133 0.792 11.892 1.00 0.00 H new ATOM 0 HE21 GLN A 104 12.404 2.099 13.124 1.00 0.00 H new ATOM 0 HE22 GLN A 104 13.002 1.669 14.730 1.00 0.00 H new ATOM 1607 N LEU A 105 6.646 2.474 11.157 1.00 0.00 N ATOM 1608 CA LEU A 105 5.345 3.092 11.378 1.00 0.00 C ATOM 1609 C LEU A 105 4.231 2.050 11.378 1.00 0.00 C ATOM 1610 O LEU A 105 3.197 2.238 12.011 1.00 0.00 O ATOM 1611 CB LEU A 105 5.074 4.150 10.305 1.00 0.00 C ATOM 1612 CG LEU A 105 6.099 5.283 10.246 1.00 0.00 C ATOM 1613 CD1 LEU A 105 6.000 6.021 8.921 1.00 0.00 C ATOM 1614 CD2 LEU A 105 5.900 6.240 11.411 1.00 0.00 C ATOM 0 H LEU A 105 7.070 2.697 10.257 1.00 0.00 H new ATOM 0 HA LEU A 105 5.362 3.570 12.357 1.00 0.00 H new ATOM 0 HB2 LEU A 105 5.040 3.660 9.332 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.088 4.580 10.480 1.00 0.00 H new ATOM 0 HG LEU A 105 7.097 4.852 10.323 1.00 0.00 H new ATOM 0 HD11 LEU A 105 6.737 6.824 8.896 1.00 0.00 H new ATOM 0 HD12 LEU A 105 6.192 5.327 8.103 1.00 0.00 H new ATOM 0 HD13 LEU A 105 5.000 6.442 8.813 1.00 0.00 H new ATOM 0 HD21 LEU A 105 6.638 7.041 11.354 1.00 0.00 H new ATOM 0 HD22 LEU A 105 4.898 6.666 11.365 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.022 5.700 12.350 1.00 0.00 H new ATOM 1626 N TYR A 106 4.442 0.954 10.662 1.00 0.00 N ATOM 1627 CA TYR A 106 3.441 -0.105 10.589 1.00 0.00 C ATOM 1628 C TYR A 106 4.095 -1.485 10.588 1.00 0.00 C ATOM 1629 O TYR A 106 5.223 -1.649 10.124 1.00 0.00 O ATOM 1630 CB TYR A 106 2.577 0.086 9.342 1.00 0.00 C ATOM 1631 CG TYR A 106 2.134 1.520 9.146 1.00 0.00 C ATOM 1632 CD1 TYR A 106 3.021 2.481 8.678 1.00 0.00 C ATOM 1633 CD2 TYR A 106 0.837 1.916 9.439 1.00 0.00 C ATOM 1634 CE1 TYR A 106 2.629 3.793 8.508 1.00 0.00 C ATOM 1635 CE2 TYR A 106 0.436 3.230 9.270 1.00 0.00 C ATOM 1636 CZ TYR A 106 1.337 4.164 8.804 1.00 0.00 C ATOM 1637 OH TYR A 106 0.943 5.473 8.631 1.00 0.00 O ATOM 0 H TYR A 106 5.291 0.774 10.126 1.00 0.00 H new ATOM 0 HA TYR A 106 2.807 -0.044 11.473 1.00 0.00 H new ATOM 0 HB2 TYR A 106 3.137 -0.239 8.465 1.00 0.00 H new ATOM 0 HB3 TYR A 106 1.698 -0.554 9.414 1.00 0.00 H new ATOM 0 HD1 TYR A 106 4.036 2.196 8.443 1.00 0.00 H new ATOM 0 HD2 TYR A 106 0.129 1.187 9.805 1.00 0.00 H new ATOM 0 HE1 TYR A 106 3.333 4.526 8.144 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -0.578 3.522 9.502 1.00 0.00 H new ATOM 0 HH TYR A 106 1.140 5.984 9.444 1.00 0.00 H new ATOM 1647 N GLU A 107 3.384 -2.473 11.130 1.00 0.00 N ATOM 1648 CA GLU A 107 3.897 -3.838 11.210 1.00 0.00 C ATOM 1649 C GLU A 107 4.127 -4.436 9.826 1.00 0.00 C ATOM 1650 O GLU A 107 5.189 -4.996 9.550 1.00 0.00 O ATOM 1651 CB GLU A 107 2.929 -4.721 12.001 1.00 0.00 C ATOM 1652 CG GLU A 107 3.587 -5.470 13.148 1.00 0.00 C ATOM 1653 CD GLU A 107 3.644 -6.967 12.913 1.00 0.00 C ATOM 1654 OE1 GLU A 107 3.660 -7.383 11.735 1.00 0.00 O ATOM 1655 OE2 GLU A 107 3.670 -7.725 13.906 1.00 0.00 O ATOM 0 H GLU A 107 2.450 -2.352 11.521 1.00 0.00 H new ATOM 0 HA GLU A 107 4.858 -3.798 11.724 1.00 0.00 H new ATOM 0 HB2 GLU A 107 2.125 -4.100 12.397 1.00 0.00 H new ATOM 0 HB3 GLU A 107 2.471 -5.441 11.323 1.00 0.00 H new ATOM 0 HG2 GLU A 107 4.599 -5.090 13.292 1.00 0.00 H new ATOM 0 HG3 GLU A 107 3.038 -5.271 14.069 1.00 0.00 H new ATOM 1662 N SER A 108 3.129 -4.317 8.958 1.00 0.00 N ATOM 1663 CA SER A 108 3.227 -4.852 7.606 1.00 0.00 C ATOM 1664 C SER A 108 3.426 -3.730 6.596 1.00 0.00 C ATOM 1665 O SER A 108 3.348 -2.552 6.943 1.00 0.00 O ATOM 1666 CB SER A 108 1.974 -5.656 7.257 1.00 0.00 C ATOM 1667 OG SER A 108 1.442 -6.295 8.404 1.00 0.00 O ATOM 0 H SER A 108 2.244 -3.855 9.166 1.00 0.00 H new ATOM 0 HA SER A 108 4.092 -5.514 7.565 1.00 0.00 H new ATOM 0 HB2 SER A 108 1.223 -4.995 6.824 1.00 0.00 H new ATOM 0 HB3 SER A 108 2.216 -6.402 6.500 1.00 0.00 H new ATOM 0 HG SER A 108 1.020 -7.140 8.142 1.00 0.00 H new ATOM 1673 N TYR A 109 3.687 -4.100 5.348 1.00 0.00 N ATOM 1674 CA TYR A 109 3.902 -3.116 4.296 1.00 0.00 C ATOM 1675 C TYR A 109 3.450 -3.642 2.934 1.00 0.00 C ATOM 1676 O TYR A 109 4.259 -3.799 2.020 1.00 0.00 O ATOM 1677 CB TYR A 109 5.379 -2.718 4.240 1.00 0.00 C ATOM 1678 CG TYR A 109 5.845 -1.957 5.461 1.00 0.00 C ATOM 1679 CD1 TYR A 109 5.666 -0.583 5.556 1.00 0.00 C ATOM 1680 CD2 TYR A 109 6.465 -2.613 6.517 1.00 0.00 C ATOM 1681 CE1 TYR A 109 6.092 0.117 6.669 1.00 0.00 C ATOM 1682 CE2 TYR A 109 6.894 -1.921 7.634 1.00 0.00 C ATOM 1683 CZ TYR A 109 6.705 -0.556 7.705 1.00 0.00 C ATOM 1684 OH TYR A 109 7.130 0.137 8.815 1.00 0.00 O ATOM 0 H TYR A 109 3.755 -5.070 5.041 1.00 0.00 H new ATOM 0 HA TYR A 109 3.300 -2.239 4.533 1.00 0.00 H new ATOM 0 HB2 TYR A 109 5.985 -3.617 4.128 1.00 0.00 H new ATOM 0 HB3 TYR A 109 5.549 -2.107 3.354 1.00 0.00 H new ATOM 0 HD1 TYR A 109 5.186 -0.053 4.747 1.00 0.00 H new ATOM 0 HD2 TYR A 109 6.614 -3.681 6.464 1.00 0.00 H new ATOM 0 HE1 TYR A 109 5.946 1.185 6.727 1.00 0.00 H new ATOM 0 HE2 TYR A 109 7.374 -2.446 8.447 1.00 0.00 H new ATOM 0 HH TYR A 109 7.375 1.050 8.557 1.00 0.00 H new ATOM 1694 N TYR A 110 2.152 -3.895 2.800 1.00 0.00 N ATOM 1695 CA TYR A 110 1.594 -4.382 1.543 1.00 0.00 C ATOM 1696 C TYR A 110 1.836 -3.355 0.440 1.00 0.00 C ATOM 1697 O TYR A 110 1.025 -2.457 0.229 1.00 0.00 O ATOM 1698 CB TYR A 110 0.094 -4.648 1.703 1.00 0.00 C ATOM 1699 CG TYR A 110 -0.519 -5.452 0.577 1.00 0.00 C ATOM 1700 CD1 TYR A 110 -0.465 -5.005 -0.737 1.00 0.00 C ATOM 1701 CD2 TYR A 110 -1.159 -6.658 0.833 1.00 0.00 C ATOM 1702 CE1 TYR A 110 -1.028 -5.737 -1.764 1.00 0.00 C ATOM 1703 CE2 TYR A 110 -1.724 -7.397 -0.189 1.00 0.00 C ATOM 1704 CZ TYR A 110 -1.657 -6.932 -1.485 1.00 0.00 C ATOM 1705 OH TYR A 110 -2.219 -7.665 -2.505 1.00 0.00 O ATOM 0 H TYR A 110 1.467 -3.771 3.546 1.00 0.00 H new ATOM 0 HA TYR A 110 2.085 -5.316 1.270 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -0.071 -5.175 2.642 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -0.427 -3.693 1.777 1.00 0.00 H new ATOM 0 HD1 TYR A 110 0.026 -4.069 -0.959 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -1.216 -7.024 1.847 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -0.976 -5.375 -2.780 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -2.216 -8.334 0.027 1.00 0.00 H new ATOM 0 HH TYR A 110 -2.621 -8.480 -2.139 1.00 0.00 H new ATOM 1715 N LEU A 111 2.968 -3.480 -0.245 1.00 0.00 N ATOM 1716 CA LEU A 111 3.329 -2.543 -1.305 1.00 0.00 C ATOM 1717 C LEU A 111 2.605 -2.850 -2.611 1.00 0.00 C ATOM 1718 O LEU A 111 2.273 -3.999 -2.903 1.00 0.00 O ATOM 1719 CB LEU A 111 4.841 -2.555 -1.536 1.00 0.00 C ATOM 1720 CG LEU A 111 5.695 -2.571 -0.267 1.00 0.00 C ATOM 1721 CD1 LEU A 111 7.169 -2.422 -0.613 1.00 0.00 C ATOM 1722 CD2 LEU A 111 5.262 -1.467 0.681 1.00 0.00 C ATOM 0 H LEU A 111 3.651 -4.220 -0.086 1.00 0.00 H new ATOM 0 HA LEU A 111 3.019 -1.551 -0.977 1.00 0.00 H new ATOM 0 HB2 LEU A 111 5.094 -3.430 -2.135 1.00 0.00 H new ATOM 0 HB3 LEU A 111 5.109 -1.677 -2.124 1.00 0.00 H new ATOM 0 HG LEU A 111 5.551 -3.530 0.230 1.00 0.00 H new ATOM 0 HD11 LEU A 111 7.761 -2.436 0.302 1.00 0.00 H new ATOM 0 HD12 LEU A 111 7.477 -3.246 -1.256 1.00 0.00 H new ATOM 0 HD13 LEU A 111 7.327 -1.477 -1.133 1.00 0.00 H new ATOM 0 HD21 LEU A 111 5.881 -1.494 1.578 1.00 0.00 H new ATOM 0 HD22 LEU A 111 5.376 -0.500 0.190 1.00 0.00 H new ATOM 0 HD23 LEU A 111 4.217 -1.613 0.956 1.00 0.00 H new ATOM 1734 N ASN A 112 2.378 -1.802 -3.396 1.00 0.00 N ATOM 1735 CA ASN A 112 1.710 -1.922 -4.687 1.00 0.00 C ATOM 1736 C ASN A 112 2.158 -0.801 -5.612 1.00 0.00 C ATOM 1737 O ASN A 112 1.908 0.374 -5.348 1.00 0.00 O ATOM 1738 CB ASN A 112 0.191 -1.891 -4.513 1.00 0.00 C ATOM 1739 CG ASN A 112 -0.510 -2.850 -5.452 1.00 0.00 C ATOM 1740 OD1 ASN A 112 -0.231 -2.874 -6.649 1.00 0.00 O ATOM 1741 ND2 ASN A 112 -1.423 -3.650 -4.913 1.00 0.00 N ATOM 0 H ASN A 112 2.651 -0.849 -3.156 1.00 0.00 H new ATOM 0 HA ASN A 112 1.984 -2.878 -5.132 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -0.061 -2.144 -3.483 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -0.173 -0.879 -4.691 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -1.924 -4.319 -5.498 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -1.623 -3.596 -3.914 1.00 0.00 H new ATOM 1748 N PHE A 113 2.847 -1.171 -6.685 1.00 0.00 N ATOM 1749 CA PHE A 113 3.360 -0.194 -7.636 1.00 0.00 C ATOM 1750 C PHE A 113 2.410 0.025 -8.810 1.00 0.00 C ATOM 1751 O PHE A 113 1.886 -0.927 -9.387 1.00 0.00 O ATOM 1752 CB PHE A 113 4.737 -0.634 -8.140 1.00 0.00 C ATOM 1753 CG PHE A 113 5.809 -0.563 -7.087 1.00 0.00 C ATOM 1754 CD1 PHE A 113 5.860 0.502 -6.200 1.00 0.00 C ATOM 1755 CD2 PHE A 113 6.764 -1.562 -6.980 1.00 0.00 C ATOM 1756 CE1 PHE A 113 6.842 0.570 -5.230 1.00 0.00 C ATOM 1757 CE2 PHE A 113 7.749 -1.499 -6.011 1.00 0.00 C ATOM 1758 CZ PHE A 113 7.788 -0.432 -5.135 1.00 0.00 C ATOM 0 H PHE A 113 3.063 -2.140 -6.918 1.00 0.00 H new ATOM 0 HA PHE A 113 3.448 0.759 -7.114 1.00 0.00 H new ATOM 0 HB2 PHE A 113 4.670 -1.657 -8.511 1.00 0.00 H new ATOM 0 HB3 PHE A 113 5.025 -0.007 -8.984 1.00 0.00 H new ATOM 0 HD1 PHE A 113 5.123 1.288 -6.268 1.00 0.00 H new ATOM 0 HD2 PHE A 113 6.739 -2.400 -7.661 1.00 0.00 H new ATOM 0 HE1 PHE A 113 6.870 1.406 -4.547 1.00 0.00 H new ATOM 0 HE2 PHE A 113 8.487 -2.284 -5.939 1.00 0.00 H new ATOM 0 HZ PHE A 113 8.556 -0.381 -4.378 1.00 0.00 H new ATOM 1768 N ILE A 114 2.208 1.295 -9.161 1.00 0.00 N ATOM 1769 CA ILE A 114 1.333 1.658 -10.285 1.00 0.00 C ATOM 1770 C ILE A 114 2.078 1.512 -11.612 1.00 0.00 C ATOM 1771 O ILE A 114 1.476 1.248 -12.651 1.00 0.00 O ATOM 1772 CB ILE A 114 0.774 3.110 -10.202 1.00 0.00 C ATOM 1773 CG1 ILE A 114 1.159 3.805 -8.891 1.00 0.00 C ATOM 1774 CG2 ILE A 114 -0.741 3.112 -10.376 1.00 0.00 C ATOM 1775 CD1 ILE A 114 0.402 3.305 -7.684 1.00 0.00 C ATOM 0 H ILE A 114 2.635 2.091 -8.687 1.00 0.00 H new ATOM 0 HA ILE A 114 0.489 0.971 -10.227 1.00 0.00 H new ATOM 0 HB ILE A 114 1.228 3.675 -11.016 1.00 0.00 H new ATOM 0 HG12 ILE A 114 2.227 3.668 -8.719 1.00 0.00 H new ATOM 0 HG13 ILE A 114 0.988 4.876 -8.996 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -1.113 4.135 -10.315 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -0.996 2.690 -11.348 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -1.198 2.512 -9.589 1.00 0.00 H new ATOM 0 HD11 ILE A 114 0.732 3.846 -6.797 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -0.666 3.467 -7.831 1.00 0.00 H new ATOM 0 HD13 ILE A 114 0.592 2.240 -7.551 1.00 0.00 H new ATOM 1787 N SER A 115 3.393 1.682 -11.568 1.00 0.00 N ATOM 1788 CA SER A 115 4.218 1.568 -12.765 1.00 0.00 C ATOM 1789 C SER A 115 5.044 0.287 -12.736 1.00 0.00 C ATOM 1790 O SER A 115 5.189 -0.348 -11.691 1.00 0.00 O ATOM 1791 CB SER A 115 5.138 2.784 -12.891 1.00 0.00 C ATOM 1792 OG SER A 115 5.489 3.021 -14.243 1.00 0.00 O ATOM 0 H SER A 115 3.912 1.899 -10.717 1.00 0.00 H new ATOM 0 HA SER A 115 3.558 1.531 -13.631 1.00 0.00 H new ATOM 0 HB2 SER A 115 4.641 3.664 -12.482 1.00 0.00 H new ATOM 0 HB3 SER A 115 6.040 2.624 -12.301 1.00 0.00 H new ATOM 0 HG SER A 115 6.076 3.804 -14.296 1.00 0.00 H new ATOM 1798 N ALA A 116 5.582 -0.090 -13.891 1.00 0.00 N ATOM 1799 CA ALA A 116 6.389 -1.297 -14.002 1.00 0.00 C ATOM 1800 C ALA A 116 7.801 -1.070 -13.470 1.00 0.00 C ATOM 1801 O ALA A 116 8.698 -0.672 -14.213 1.00 0.00 O ATOM 1802 CB ALA A 116 6.437 -1.767 -15.448 1.00 0.00 C ATOM 0 H ALA A 116 5.473 0.425 -14.765 1.00 0.00 H new ATOM 0 HA ALA A 116 5.923 -2.071 -13.393 1.00 0.00 H new ATOM 0 HB1 ALA A 116 7.043 -2.670 -15.517 1.00 0.00 H new ATOM 0 HB2 ALA A 116 5.426 -1.981 -15.795 1.00 0.00 H new ATOM 0 HB3 ALA A 116 6.876 -0.987 -16.070 1.00 0.00 H new ATOM 1808 N ILE A 117 7.992 -1.332 -12.181 1.00 0.00 N ATOM 1809 CA ILE A 117 9.295 -1.164 -11.550 1.00 0.00 C ATOM 1810 C ILE A 117 10.259 -2.262 -11.993 1.00 0.00 C ATOM 1811 O ILE A 117 9.836 -3.306 -12.489 1.00 0.00 O ATOM 1812 CB ILE A 117 9.174 -1.170 -10.011 1.00 0.00 C ATOM 1813 CG1 ILE A 117 10.541 -0.927 -9.359 1.00 0.00 C ATOM 1814 CG2 ILE A 117 8.565 -2.479 -9.534 1.00 0.00 C ATOM 1815 CD1 ILE A 117 10.464 -0.598 -7.881 1.00 0.00 C ATOM 0 H ILE A 117 7.259 -1.662 -11.553 1.00 0.00 H new ATOM 0 HA ILE A 117 9.688 -0.198 -11.866 1.00 0.00 H new ATOM 0 HB ILE A 117 8.512 -0.358 -9.711 1.00 0.00 H new ATOM 0 HG12 ILE A 117 11.160 -1.814 -9.492 1.00 0.00 H new ATOM 0 HG13 ILE A 117 11.041 -0.109 -9.878 1.00 0.00 H new ATOM 0 HG21 ILE A 117 8.486 -2.469 -8.447 1.00 0.00 H new ATOM 0 HG22 ILE A 117 7.573 -2.598 -9.969 1.00 0.00 H new ATOM 0 HG23 ILE A 117 9.199 -3.310 -9.844 1.00 0.00 H new ATOM 0 HD11 ILE A 117 11.469 -0.439 -7.491 1.00 0.00 H new ATOM 0 HD12 ILE A 117 9.873 0.307 -7.740 1.00 0.00 H new ATOM 0 HD13 ILE A 117 9.994 -1.425 -7.348 1.00 0.00 H new ATOM 1827 N SER A 118 11.555 -2.017 -11.823 1.00 0.00 N ATOM 1828 CA SER A 118 12.575 -2.985 -12.218 1.00 0.00 C ATOM 1829 C SER A 118 13.177 -3.681 -11.002 1.00 0.00 C ATOM 1830 O SER A 118 13.146 -3.151 -9.891 1.00 0.00 O ATOM 1831 CB SER A 118 13.677 -2.294 -13.022 1.00 0.00 C ATOM 1832 OG SER A 118 13.327 -2.197 -14.392 1.00 0.00 O ATOM 0 H SER A 118 11.924 -1.158 -11.415 1.00 0.00 H new ATOM 0 HA SER A 118 12.096 -3.741 -12.840 1.00 0.00 H new ATOM 0 HB2 SER A 118 13.855 -1.297 -12.618 1.00 0.00 H new ATOM 0 HB3 SER A 118 14.609 -2.851 -12.920 1.00 0.00 H new ATOM 0 HG SER A 118 14.048 -1.750 -14.883 1.00 0.00 H new ATOM 1838 N ARG A 119 13.726 -4.874 -11.222 1.00 0.00 N ATOM 1839 CA ARG A 119 14.337 -5.650 -10.148 1.00 0.00 C ATOM 1840 C ARG A 119 15.309 -4.798 -9.338 1.00 0.00 C ATOM 1841 O ARG A 119 15.468 -4.995 -8.133 1.00 0.00 O ATOM 1842 CB ARG A 119 15.062 -6.869 -10.723 1.00 0.00 C ATOM 1843 CG ARG A 119 14.191 -8.114 -10.798 1.00 0.00 C ATOM 1844 CD ARG A 119 14.264 -8.773 -12.168 1.00 0.00 C ATOM 1845 NE ARG A 119 14.830 -10.118 -12.098 1.00 0.00 N ATOM 1846 CZ ARG A 119 14.677 -11.038 -13.047 1.00 0.00 C ATOM 1847 NH1 ARG A 119 13.974 -10.764 -14.141 1.00 0.00 N ATOM 1848 NH2 ARG A 119 15.226 -12.237 -12.904 1.00 0.00 N ATOM 0 H ARG A 119 13.760 -5.324 -12.137 1.00 0.00 H new ATOM 0 HA ARG A 119 13.543 -5.987 -9.482 1.00 0.00 H new ATOM 0 HB2 ARG A 119 15.424 -6.628 -11.722 1.00 0.00 H new ATOM 0 HB3 ARG A 119 15.937 -7.084 -10.110 1.00 0.00 H new ATOM 0 HG2 ARG A 119 14.507 -8.825 -10.035 1.00 0.00 H new ATOM 0 HG3 ARG A 119 13.157 -7.848 -10.577 1.00 0.00 H new ATOM 0 HD2 ARG A 119 13.265 -8.822 -12.601 1.00 0.00 H new ATOM 0 HD3 ARG A 119 14.870 -8.159 -12.834 1.00 0.00 H new ATOM 0 HE ARG A 119 15.375 -10.367 -11.272 1.00 0.00 H new ATOM 0 HH11 ARG A 119 13.548 -9.844 -14.257 1.00 0.00 H new ATOM 0 HH12 ARG A 119 13.860 -11.473 -14.865 1.00 0.00 H new ATOM 0 HH21 ARG A 119 15.766 -12.454 -12.066 1.00 0.00 H new ATOM 0 HH22 ARG A 119 15.108 -12.942 -13.632 1.00 0.00 H new ATOM 1862 N SER A 120 15.953 -3.848 -10.006 1.00 0.00 N ATOM 1863 CA SER A 120 16.904 -2.963 -9.344 1.00 0.00 C ATOM 1864 C SER A 120 16.184 -2.036 -8.370 1.00 0.00 C ATOM 1865 O SER A 120 16.493 -2.007 -7.179 1.00 0.00 O ATOM 1866 CB SER A 120 17.673 -2.139 -10.378 1.00 0.00 C ATOM 1867 OG SER A 120 16.843 -1.152 -10.965 1.00 0.00 O ATOM 0 H SER A 120 15.834 -3.671 -11.003 1.00 0.00 H new ATOM 0 HA SER A 120 17.611 -3.576 -8.785 1.00 0.00 H new ATOM 0 HB2 SER A 120 18.530 -1.662 -9.903 1.00 0.00 H new ATOM 0 HB3 SER A 120 18.064 -2.797 -11.154 1.00 0.00 H new ATOM 0 HG SER A 120 16.895 -0.326 -10.440 1.00 0.00 H new ATOM 1873 N LYS A 121 15.216 -1.285 -8.886 1.00 0.00 N ATOM 1874 CA LYS A 121 14.445 -0.362 -8.062 1.00 0.00 C ATOM 1875 C LYS A 121 13.676 -1.117 -6.984 1.00 0.00 C ATOM 1876 O LYS A 121 13.482 -0.616 -5.875 1.00 0.00 O ATOM 1877 CB LYS A 121 13.478 0.443 -8.932 1.00 0.00 C ATOM 1878 CG LYS A 121 14.160 1.517 -9.765 1.00 0.00 C ATOM 1879 CD LYS A 121 13.577 2.894 -9.490 1.00 0.00 C ATOM 1880 CE LYS A 121 12.191 3.043 -10.098 1.00 0.00 C ATOM 1881 NZ LYS A 121 12.227 2.975 -11.584 1.00 0.00 N ATOM 0 H LYS A 121 14.947 -1.298 -9.870 1.00 0.00 H new ATOM 0 HA LYS A 121 15.138 0.325 -7.576 1.00 0.00 H new ATOM 0 HB2 LYS A 121 12.947 -0.238 -9.597 1.00 0.00 H new ATOM 0 HB3 LYS A 121 12.730 0.911 -8.292 1.00 0.00 H new ATOM 0 HG2 LYS A 121 15.228 1.523 -9.547 1.00 0.00 H new ATOM 0 HG3 LYS A 121 14.052 1.280 -10.824 1.00 0.00 H new ATOM 0 HD2 LYS A 121 13.523 3.059 -8.414 1.00 0.00 H new ATOM 0 HD3 LYS A 121 14.239 3.659 -9.897 1.00 0.00 H new ATOM 0 HE2 LYS A 121 11.540 2.258 -9.714 1.00 0.00 H new ATOM 0 HE3 LYS A 121 11.759 3.995 -9.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 11.364 3.406 -11.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 13.059 3.491 -11.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 12.283 1.981 -11.885 1.00 0.00 H new ATOM 1895 N LEU A 122 13.243 -2.330 -7.312 1.00 0.00 N ATOM 1896 CA LEU A 122 12.503 -3.152 -6.365 1.00 0.00 C ATOM 1897 C LEU A 122 13.385 -3.521 -5.181 1.00 0.00 C ATOM 1898 O LEU A 122 12.952 -3.469 -4.030 1.00 0.00 O ATOM 1899 CB LEU A 122 11.979 -4.412 -7.046 1.00 0.00 C ATOM 1900 CG LEU A 122 10.675 -4.216 -7.816 1.00 0.00 C ATOM 1901 CD1 LEU A 122 10.850 -4.604 -9.273 1.00 0.00 C ATOM 1902 CD2 LEU A 122 9.545 -5.009 -7.179 1.00 0.00 C ATOM 0 H LEU A 122 13.392 -2.763 -8.223 1.00 0.00 H new ATOM 0 HA LEU A 122 11.652 -2.576 -6.001 1.00 0.00 H new ATOM 0 HB2 LEU A 122 12.740 -4.783 -7.733 1.00 0.00 H new ATOM 0 HB3 LEU A 122 11.828 -5.183 -6.290 1.00 0.00 H new ATOM 0 HG LEU A 122 10.411 -3.159 -7.773 1.00 0.00 H new ATOM 0 HD11 LEU A 122 9.910 -4.457 -9.804 1.00 0.00 H new ATOM 0 HD12 LEU A 122 11.623 -3.982 -9.725 1.00 0.00 H new ATOM 0 HD13 LEU A 122 11.143 -5.652 -9.338 1.00 0.00 H new ATOM 0 HD21 LEU A 122 8.627 -4.853 -7.745 1.00 0.00 H new ATOM 0 HD22 LEU A 122 9.798 -6.069 -7.182 1.00 0.00 H new ATOM 0 HD23 LEU A 122 9.399 -4.674 -6.152 1.00 0.00 H new ATOM 1914 N GLU A 123 14.631 -3.885 -5.472 1.00 0.00 N ATOM 1915 CA GLU A 123 15.578 -4.251 -4.428 1.00 0.00 C ATOM 1916 C GLU A 123 15.727 -3.113 -3.428 1.00 0.00 C ATOM 1917 O GLU A 123 15.892 -3.343 -2.232 1.00 0.00 O ATOM 1918 CB GLU A 123 16.936 -4.603 -5.035 1.00 0.00 C ATOM 1919 CG GLU A 123 17.235 -6.090 -5.009 1.00 0.00 C ATOM 1920 CD GLU A 123 18.599 -6.424 -5.581 1.00 0.00 C ATOM 1921 OE1 GLU A 123 19.610 -5.964 -5.013 1.00 0.00 O ATOM 1922 OE2 GLU A 123 18.654 -7.145 -6.600 1.00 0.00 O ATOM 0 H GLU A 123 15.006 -3.934 -6.419 1.00 0.00 H new ATOM 0 HA GLU A 123 15.195 -5.128 -3.906 1.00 0.00 H new ATOM 0 HB2 GLU A 123 16.968 -4.250 -6.066 1.00 0.00 H new ATOM 0 HB3 GLU A 123 17.718 -4.072 -4.492 1.00 0.00 H new ATOM 0 HG2 GLU A 123 17.179 -6.450 -3.982 1.00 0.00 H new ATOM 0 HG3 GLU A 123 16.469 -6.620 -5.575 1.00 0.00 H new ATOM 1929 N ASP A 124 15.651 -1.882 -3.925 1.00 0.00 N ATOM 1930 CA ASP A 124 15.761 -0.711 -3.064 1.00 0.00 C ATOM 1931 C ASP A 124 14.668 -0.743 -2.003 1.00 0.00 C ATOM 1932 O ASP A 124 14.941 -0.596 -0.812 1.00 0.00 O ATOM 1933 CB ASP A 124 15.661 0.576 -3.886 1.00 0.00 C ATOM 1934 CG ASP A 124 17.008 1.026 -4.417 1.00 0.00 C ATOM 1935 OD1 ASP A 124 17.985 1.023 -3.639 1.00 0.00 O ATOM 1936 OD2 ASP A 124 17.086 1.382 -5.613 1.00 0.00 O ATOM 0 H ASP A 124 15.515 -1.671 -4.914 1.00 0.00 H new ATOM 0 HA ASP A 124 16.735 -0.730 -2.574 1.00 0.00 H new ATOM 0 HB2 ASP A 124 14.978 0.419 -4.721 1.00 0.00 H new ATOM 0 HB3 ASP A 124 15.234 1.366 -3.269 1.00 0.00 H new ATOM 1941 N ILE A 125 13.429 -0.958 -2.441 1.00 0.00 N ATOM 1942 CA ILE A 125 12.302 -1.033 -1.520 1.00 0.00 C ATOM 1943 C ILE A 125 12.396 -2.296 -0.669 1.00 0.00 C ATOM 1944 O ILE A 125 12.354 -2.237 0.559 1.00 0.00 O ATOM 1945 CB ILE A 125 10.952 -1.023 -2.263 1.00 0.00 C ATOM 1946 CG1 ILE A 125 10.750 0.310 -2.980 1.00 0.00 C ATOM 1947 CG2 ILE A 125 9.811 -1.275 -1.293 1.00 0.00 C ATOM 1948 CD1 ILE A 125 11.155 0.273 -4.433 1.00 0.00 C ATOM 0 H ILE A 125 13.183 -1.082 -3.423 1.00 0.00 H new ATOM 0 HA ILE A 125 12.349 -0.150 -0.882 1.00 0.00 H new ATOM 0 HB ILE A 125 10.961 -1.821 -3.005 1.00 0.00 H new ATOM 0 HG12 ILE A 125 9.701 0.597 -2.910 1.00 0.00 H new ATOM 0 HG13 ILE A 125 11.327 1.081 -2.469 1.00 0.00 H new ATOM 0 HG21 ILE A 125 8.865 -1.265 -1.834 1.00 0.00 H new ATOM 0 HG22 ILE A 125 9.946 -2.246 -0.817 1.00 0.00 H new ATOM 0 HG23 ILE A 125 9.802 -0.495 -0.531 1.00 0.00 H new ATOM 0 HD11 ILE A 125 10.986 1.251 -4.883 1.00 0.00 H new ATOM 0 HD12 ILE A 125 12.211 0.016 -4.510 1.00 0.00 H new ATOM 0 HD13 ILE A 125 10.560 -0.475 -4.957 1.00 0.00 H new ATOM 1960 N ALA A 126 12.532 -3.443 -1.332 1.00 0.00 N ATOM 1961 CA ALA A 126 12.645 -4.715 -0.632 1.00 0.00 C ATOM 1962 C ALA A 126 13.755 -4.643 0.405 1.00 0.00 C ATOM 1963 O ALA A 126 13.572 -5.028 1.560 1.00 0.00 O ATOM 1964 CB ALA A 126 12.906 -5.844 -1.617 1.00 0.00 C ATOM 0 H ALA A 126 12.566 -3.515 -2.349 1.00 0.00 H new ATOM 0 HA ALA A 126 11.704 -4.919 -0.122 1.00 0.00 H new ATOM 0 HB1 ALA A 126 12.988 -6.787 -1.076 1.00 0.00 H new ATOM 0 HB2 ALA A 126 12.082 -5.904 -2.329 1.00 0.00 H new ATOM 0 HB3 ALA A 126 13.835 -5.652 -2.153 1.00 0.00 H new ATOM 1970 N ASN A 127 14.902 -4.123 -0.015 1.00 0.00 N ATOM 1971 CA ASN A 127 16.039 -3.975 0.878 1.00 0.00 C ATOM 1972 C ASN A 127 15.775 -2.855 1.870 1.00 0.00 C ATOM 1973 O ASN A 127 16.246 -2.900 3.007 1.00 0.00 O ATOM 1974 CB ASN A 127 17.319 -3.693 0.087 1.00 0.00 C ATOM 1975 CG ASN A 127 17.697 -4.841 -0.828 1.00 0.00 C ATOM 1976 OD1 ASN A 127 17.532 -6.010 -0.479 1.00 0.00 O ATOM 1977 ND2 ASN A 127 18.210 -4.512 -2.008 1.00 0.00 N ATOM 0 H ASN A 127 15.067 -3.798 -0.968 1.00 0.00 H new ATOM 0 HA ASN A 127 16.176 -4.909 1.423 1.00 0.00 H new ATOM 0 HB2 ASN A 127 17.185 -2.788 -0.506 1.00 0.00 H new ATOM 0 HB3 ASN A 127 18.137 -3.501 0.781 1.00 0.00 H new ATOM 0 HD21 ASN A 127 18.485 -5.241 -2.666 1.00 0.00 H new ATOM 0 HD22 ASN A 127 18.329 -3.530 -2.256 1.00 0.00 H new ATOM 1984 N ALA A 128 14.998 -1.860 1.445 1.00 0.00 N ATOM 1985 CA ALA A 128 14.657 -0.748 2.320 1.00 0.00 C ATOM 1986 C ALA A 128 14.145 -1.278 3.655 1.00 0.00 C ATOM 1987 O ALA A 128 14.325 -0.652 4.700 1.00 0.00 O ATOM 1988 CB ALA A 128 13.615 0.142 1.658 1.00 0.00 C ATOM 0 H ALA A 128 14.598 -1.804 0.509 1.00 0.00 H new ATOM 0 HA ALA A 128 15.550 -0.150 2.502 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.369 0.970 2.323 1.00 0.00 H new ATOM 0 HB2 ALA A 128 14.013 0.534 0.722 1.00 0.00 H new ATOM 0 HB3 ALA A 128 12.716 -0.440 1.454 1.00 0.00 H new ATOM 1994 N ALA A 129 13.513 -2.449 3.602 1.00 0.00 N ATOM 1995 CA ALA A 129 12.976 -3.091 4.794 1.00 0.00 C ATOM 1996 C ALA A 129 14.036 -3.945 5.474 1.00 0.00 C ATOM 1997 O ALA A 129 14.092 -4.020 6.698 1.00 0.00 O ATOM 1998 CB ALA A 129 11.765 -3.940 4.438 1.00 0.00 C ATOM 0 H ALA A 129 13.361 -2.973 2.740 1.00 0.00 H new ATOM 0 HA ALA A 129 12.667 -2.311 5.490 1.00 0.00 H new ATOM 0 HB1 ALA A 129 11.375 -4.413 5.339 1.00 0.00 H new ATOM 0 HB2 ALA A 129 10.994 -3.308 3.997 1.00 0.00 H new ATOM 0 HB3 ALA A 129 12.057 -4.708 3.722 1.00 0.00 H new ATOM 2004 N LEU A 130 14.881 -4.587 4.669 1.00 0.00 N ATOM 2005 CA LEU A 130 15.946 -5.439 5.192 1.00 0.00 C ATOM 2006 C LEU A 130 16.698 -4.739 6.321 1.00 0.00 C ATOM 2007 O LEU A 130 17.225 -5.388 7.226 1.00 0.00 O ATOM 2008 CB LEU A 130 16.923 -5.820 4.072 1.00 0.00 C ATOM 2009 CG LEU A 130 16.645 -7.159 3.382 1.00 0.00 C ATOM 2010 CD1 LEU A 130 16.470 -8.267 4.408 1.00 0.00 C ATOM 2011 CD2 LEU A 130 15.417 -7.057 2.489 1.00 0.00 C ATOM 0 H LEU A 130 14.848 -4.533 3.651 1.00 0.00 H new ATOM 0 HA LEU A 130 15.489 -6.345 5.590 1.00 0.00 H new ATOM 0 HB2 LEU A 130 16.909 -5.033 3.318 1.00 0.00 H new ATOM 0 HB3 LEU A 130 17.931 -5.847 4.486 1.00 0.00 H new ATOM 0 HG LEU A 130 17.504 -7.405 2.757 1.00 0.00 H new ATOM 0 HD11 LEU A 130 16.273 -9.209 3.896 1.00 0.00 H new ATOM 0 HD12 LEU A 130 17.379 -8.360 5.002 1.00 0.00 H new ATOM 0 HD13 LEU A 130 15.632 -8.028 5.062 1.00 0.00 H new ATOM 0 HD21 LEU A 130 15.236 -8.018 2.008 1.00 0.00 H new ATOM 0 HD22 LEU A 130 14.551 -6.784 3.092 1.00 0.00 H new ATOM 0 HD23 LEU A 130 15.583 -6.295 1.727 1.00 0.00 H new ATOM 2023 N ALA A 131 16.742 -3.414 6.260 1.00 0.00 N ATOM 2024 CA ALA A 131 17.425 -2.622 7.275 1.00 0.00 C ATOM 2025 C ALA A 131 16.717 -2.724 8.623 1.00 0.00 C ATOM 2026 O ALA A 131 17.361 -2.854 9.665 1.00 0.00 O ATOM 2027 CB ALA A 131 17.520 -1.169 6.834 1.00 0.00 C ATOM 0 H ALA A 131 16.312 -2.864 5.516 1.00 0.00 H new ATOM 0 HA ALA A 131 18.432 -3.021 7.394 1.00 0.00 H new ATOM 0 HB1 ALA A 131 18.032 -0.589 7.601 1.00 0.00 H new ATOM 0 HB2 ALA A 131 18.078 -1.108 5.900 1.00 0.00 H new ATOM 0 HB3 ALA A 131 16.518 -0.768 6.685 1.00 0.00 H new ATOM 2033 N ALA A 132 15.390 -2.660 8.595 1.00 0.00 N ATOM 2034 CA ALA A 132 14.593 -2.742 9.816 1.00 0.00 C ATOM 2035 C ALA A 132 13.948 -4.119 9.977 1.00 0.00 C ATOM 2036 O ALA A 132 13.312 -4.399 10.993 1.00 0.00 O ATOM 2037 CB ALA A 132 13.527 -1.657 9.819 1.00 0.00 C ATOM 0 H ALA A 132 14.843 -2.552 7.741 1.00 0.00 H new ATOM 0 HA ALA A 132 15.263 -2.590 10.662 1.00 0.00 H new ATOM 0 HB1 ALA A 132 12.939 -1.727 10.734 1.00 0.00 H new ATOM 0 HB2 ALA A 132 14.004 -0.678 9.769 1.00 0.00 H new ATOM 0 HB3 ALA A 132 12.873 -1.787 8.956 1.00 0.00 H new ATOM 2043 N ASN A 133 14.112 -4.973 8.970 1.00 0.00 N ATOM 2044 CA ASN A 133 13.544 -6.315 9.002 1.00 0.00 C ATOM 2045 C ASN A 133 12.024 -6.258 9.122 1.00 0.00 C ATOM 2046 O ASN A 133 11.434 -6.883 10.005 1.00 0.00 O ATOM 2047 CB ASN A 133 14.137 -7.112 10.163 1.00 0.00 C ATOM 2048 CG ASN A 133 15.333 -7.944 9.742 1.00 0.00 C ATOM 2049 OD1 ASN A 133 15.188 -8.974 9.085 1.00 0.00 O ATOM 2050 ND2 ASN A 133 16.526 -7.500 10.123 1.00 0.00 N ATOM 0 H ASN A 133 14.635 -4.758 8.121 1.00 0.00 H new ATOM 0 HA ASN A 133 13.794 -6.815 8.066 1.00 0.00 H new ATOM 0 HB2 ASN A 133 14.436 -6.426 10.956 1.00 0.00 H new ATOM 0 HB3 ASN A 133 13.371 -7.766 10.580 1.00 0.00 H new ATOM 0 HD21 ASN A 133 17.367 -8.019 9.871 1.00 0.00 H new ATOM 0 HD22 ASN A 133 16.600 -6.641 10.667 1.00 0.00 H new ATOM 2057 N ALA A 134 11.393 -5.506 8.226 1.00 0.00 N ATOM 2058 CA ALA A 134 9.942 -5.367 8.229 1.00 0.00 C ATOM 2059 C ALA A 134 9.307 -6.231 7.145 1.00 0.00 C ATOM 2060 O ALA A 134 9.807 -6.304 6.023 1.00 0.00 O ATOM 2061 CB ALA A 134 9.551 -3.909 8.041 1.00 0.00 C ATOM 0 H ALA A 134 11.865 -4.983 7.488 1.00 0.00 H new ATOM 0 HA ALA A 134 9.570 -5.709 9.195 1.00 0.00 H new ATOM 0 HB1 ALA A 134 8.465 -3.820 8.045 1.00 0.00 H new ATOM 0 HB2 ALA A 134 9.967 -3.313 8.853 1.00 0.00 H new ATOM 0 HB3 ALA A 134 9.941 -3.548 7.089 1.00 0.00 H new ATOM 2067 N VAL A 135 8.201 -6.885 7.490 1.00 0.00 N ATOM 2068 CA VAL A 135 7.497 -7.744 6.544 1.00 0.00 C ATOM 2069 C VAL A 135 6.839 -6.920 5.444 1.00 0.00 C ATOM 2070 O VAL A 135 5.934 -6.127 5.706 1.00 0.00 O ATOM 2071 CB VAL A 135 6.420 -8.596 7.245 1.00 0.00 C ATOM 2072 CG1 VAL A 135 6.009 -9.766 6.364 1.00 0.00 C ATOM 2073 CG2 VAL A 135 6.915 -9.085 8.599 1.00 0.00 C ATOM 0 H VAL A 135 7.774 -6.836 8.415 1.00 0.00 H new ATOM 0 HA VAL A 135 8.242 -8.408 6.105 1.00 0.00 H new ATOM 0 HB VAL A 135 5.543 -7.970 7.413 1.00 0.00 H new ATOM 0 HG11 VAL A 135 5.248 -10.356 6.875 1.00 0.00 H new ATOM 0 HG12 VAL A 135 5.606 -9.390 5.424 1.00 0.00 H new ATOM 0 HG13 VAL A 135 6.878 -10.392 6.161 1.00 0.00 H new ATOM 0 HG21 VAL A 135 6.139 -9.684 9.076 1.00 0.00 H new ATOM 0 HG22 VAL A 135 7.809 -9.693 8.462 1.00 0.00 H new ATOM 0 HG23 VAL A 135 7.152 -8.229 9.231 1.00 0.00 H new ATOM 2083 N THR A 136 7.303 -7.106 4.214 1.00 0.00 N ATOM 2084 CA THR A 136 6.759 -6.372 3.078 1.00 0.00 C ATOM 2085 C THR A 136 6.438 -7.305 1.917 1.00 0.00 C ATOM 2086 O THR A 136 6.944 -8.425 1.844 1.00 0.00 O ATOM 2087 CB THR A 136 7.746 -5.300 2.617 1.00 0.00 C ATOM 2088 OG1 THR A 136 8.852 -5.888 1.954 1.00 0.00 O ATOM 2089 CG2 THR A 136 8.287 -4.457 3.750 1.00 0.00 C ATOM 0 H THR A 136 8.052 -7.757 3.978 1.00 0.00 H new ATOM 0 HA THR A 136 5.833 -5.897 3.404 1.00 0.00 H new ATOM 0 HB THR A 136 7.179 -4.656 1.945 1.00 0.00 H new ATOM 0 HG1 THR A 136 9.471 -5.186 1.665 1.00 0.00 H new ATOM 0 HG21 THR A 136 8.981 -3.716 3.353 1.00 0.00 H new ATOM 0 HG22 THR A 136 7.463 -3.950 4.252 1.00 0.00 H new ATOM 0 HG23 THR A 136 8.807 -5.097 4.463 1.00 0.00 H new ATOM 2097 N GLN A 137 5.598 -6.825 1.007 1.00 0.00 N ATOM 2098 CA GLN A 137 5.207 -7.599 -0.164 1.00 0.00 C ATOM 2099 C GLN A 137 4.789 -6.669 -1.296 1.00 0.00 C ATOM 2100 O GLN A 137 3.835 -5.903 -1.162 1.00 0.00 O ATOM 2101 CB GLN A 137 4.061 -8.553 0.183 1.00 0.00 C ATOM 2102 CG GLN A 137 2.985 -7.924 1.055 1.00 0.00 C ATOM 2103 CD GLN A 137 2.778 -8.671 2.358 1.00 0.00 C ATOM 2104 OE1 GLN A 137 3.017 -8.135 3.440 1.00 0.00 O ATOM 2105 NE2 GLN A 137 2.330 -9.918 2.260 1.00 0.00 N ATOM 0 H GLN A 137 5.173 -5.899 1.059 1.00 0.00 H new ATOM 0 HA GLN A 137 6.064 -8.188 -0.490 1.00 0.00 H new ATOM 0 HB2 GLN A 137 3.605 -8.910 -0.740 1.00 0.00 H new ATOM 0 HB3 GLN A 137 4.468 -9.425 0.695 1.00 0.00 H new ATOM 0 HG2 GLN A 137 3.257 -6.891 1.272 1.00 0.00 H new ATOM 0 HG3 GLN A 137 2.045 -7.897 0.503 1.00 0.00 H new ATOM 0 HE21 GLN A 137 2.145 -10.323 1.342 1.00 0.00 H new ATOM 0 HE22 GLN A 137 2.171 -10.470 3.103 1.00 0.00 H new ATOM 2114 N VAL A 138 5.513 -6.733 -2.408 1.00 0.00 N ATOM 2115 CA VAL A 138 5.219 -5.888 -3.556 1.00 0.00 C ATOM 2116 C VAL A 138 4.174 -6.530 -4.461 1.00 0.00 C ATOM 2117 O VAL A 138 4.475 -7.441 -5.232 1.00 0.00 O ATOM 2118 CB VAL A 138 6.489 -5.582 -4.370 1.00 0.00 C ATOM 2119 CG1 VAL A 138 6.198 -4.550 -5.449 1.00 0.00 C ATOM 2120 CG2 VAL A 138 7.602 -5.100 -3.450 1.00 0.00 C ATOM 0 H VAL A 138 6.306 -7.361 -2.537 1.00 0.00 H new ATOM 0 HA VAL A 138 4.821 -4.951 -3.167 1.00 0.00 H new ATOM 0 HB VAL A 138 6.818 -6.499 -4.858 1.00 0.00 H new ATOM 0 HG11 VAL A 138 7.108 -4.347 -6.013 1.00 0.00 H new ATOM 0 HG12 VAL A 138 5.431 -4.934 -6.122 1.00 0.00 H new ATOM 0 HG13 VAL A 138 5.846 -3.629 -4.986 1.00 0.00 H new ATOM 0 HG21 VAL A 138 8.494 -4.887 -4.039 1.00 0.00 H new ATOM 0 HG22 VAL A 138 7.282 -4.194 -2.936 1.00 0.00 H new ATOM 0 HG23 VAL A 138 7.828 -5.873 -2.716 1.00 0.00 H new ATOM 2130 N ALA A 139 2.943 -6.047 -4.348 1.00 0.00 N ATOM 2131 CA ALA A 139 1.834 -6.561 -5.140 1.00 0.00 C ATOM 2132 C ALA A 139 2.053 -6.318 -6.629 1.00 0.00 C ATOM 2133 O ALA A 139 3.065 -5.747 -7.035 1.00 0.00 O ATOM 2134 CB ALA A 139 0.534 -5.918 -4.681 1.00 0.00 C ATOM 0 H ALA A 139 2.687 -5.294 -3.710 1.00 0.00 H new ATOM 0 HA ALA A 139 1.776 -7.639 -4.989 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -0.293 -6.305 -5.276 1.00 0.00 H new ATOM 0 HB2 ALA A 139 0.365 -6.150 -3.630 1.00 0.00 H new ATOM 0 HB3 ALA A 139 0.598 -4.837 -4.808 1.00 0.00 H new ATOM 2140 N LYS A 140 1.092 -6.754 -7.440 1.00 0.00 N ATOM 2141 CA LYS A 140 1.173 -6.584 -8.886 1.00 0.00 C ATOM 2142 C LYS A 140 0.829 -5.152 -9.283 1.00 0.00 C ATOM 2143 O LYS A 140 0.286 -4.391 -8.484 1.00 0.00 O ATOM 2144 CB LYS A 140 0.230 -7.563 -9.589 1.00 0.00 C ATOM 2145 CG LYS A 140 0.748 -8.992 -9.617 1.00 0.00 C ATOM 2146 CD LYS A 140 -0.278 -9.945 -10.209 1.00 0.00 C ATOM 2147 CE LYS A 140 0.370 -10.943 -11.155 1.00 0.00 C ATOM 2148 NZ LYS A 140 0.897 -10.284 -12.381 1.00 0.00 N ATOM 0 H LYS A 140 0.248 -7.228 -7.119 1.00 0.00 H new ATOM 0 HA LYS A 140 2.197 -6.792 -9.196 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -0.738 -7.546 -9.088 1.00 0.00 H new ATOM 0 HB3 LYS A 140 0.065 -7.225 -10.612 1.00 0.00 H new ATOM 0 HG2 LYS A 140 1.667 -9.036 -10.202 1.00 0.00 H new ATOM 0 HG3 LYS A 140 0.999 -9.309 -8.605 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -0.785 -10.480 -9.406 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -1.039 -9.376 -10.744 1.00 0.00 H new ATOM 0 HE2 LYS A 140 1.183 -11.456 -10.641 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -0.359 -11.703 -11.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 0.969 -10.983 -13.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 0.253 -9.520 -12.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 1.838 -9.887 -12.185 1.00 0.00 H new ATOM 2162 N VAL A 141 1.150 -4.791 -10.520 1.00 0.00 N ATOM 2163 CA VAL A 141 0.878 -3.449 -11.020 1.00 0.00 C ATOM 2164 C VAL A 141 -0.280 -3.453 -12.015 1.00 0.00 C ATOM 2165 O VAL A 141 -0.409 -4.370 -12.826 1.00 0.00 O ATOM 2166 CB VAL A 141 2.125 -2.845 -11.696 1.00 0.00 C ATOM 2167 CG1 VAL A 141 1.885 -1.394 -12.079 1.00 0.00 C ATOM 2168 CG2 VAL A 141 3.335 -2.958 -10.782 1.00 0.00 C ATOM 0 H VAL A 141 1.599 -5.409 -11.195 1.00 0.00 H new ATOM 0 HA VAL A 141 0.605 -2.837 -10.160 1.00 0.00 H new ATOM 0 HB VAL A 141 2.323 -3.410 -12.607 1.00 0.00 H new ATOM 0 HG11 VAL A 141 2.779 -0.990 -12.554 1.00 0.00 H new ATOM 0 HG12 VAL A 141 1.047 -1.335 -12.773 1.00 0.00 H new ATOM 0 HG13 VAL A 141 1.656 -0.815 -11.184 1.00 0.00 H new ATOM 0 HG21 VAL A 141 4.206 -2.527 -11.276 1.00 0.00 H new ATOM 0 HG22 VAL A 141 3.141 -2.421 -9.854 1.00 0.00 H new ATOM 0 HG23 VAL A 141 3.527 -4.008 -10.560 1.00 0.00 H new ATOM 2178 N PHE A 142 -1.120 -2.422 -11.946 1.00 0.00 N ATOM 2179 CA PHE A 142 -2.267 -2.311 -12.844 1.00 0.00 C ATOM 2180 C PHE A 142 -2.074 -1.172 -13.837 1.00 0.00 C ATOM 2181 O PHE A 142 -2.248 -1.345 -15.042 1.00 0.00 O ATOM 2182 CB PHE A 142 -3.574 -2.093 -12.066 1.00 0.00 C ATOM 2183 CG PHE A 142 -3.393 -1.635 -10.647 1.00 0.00 C ATOM 2184 CD1 PHE A 142 -2.749 -2.436 -9.720 1.00 0.00 C ATOM 2185 CD2 PHE A 142 -3.882 -0.404 -10.241 1.00 0.00 C ATOM 2186 CE1 PHE A 142 -2.595 -2.019 -8.414 1.00 0.00 C ATOM 2187 CE2 PHE A 142 -3.731 0.017 -8.935 1.00 0.00 C ATOM 2188 CZ PHE A 142 -3.086 -0.791 -8.020 1.00 0.00 C ATOM 0 H PHE A 142 -1.028 -1.655 -11.280 1.00 0.00 H new ATOM 0 HA PHE A 142 -2.338 -3.253 -13.387 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -4.178 -1.357 -12.596 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -4.138 -3.025 -12.063 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -2.363 -3.398 -10.022 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -4.386 0.232 -10.953 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -2.090 -2.653 -7.700 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -4.117 0.978 -8.629 1.00 0.00 H new ATOM 0 HZ PHE A 142 -2.966 -0.463 -6.998 1.00 0.00 H new ATOM 2198 N ASP A 143 -1.718 -0.008 -13.310 1.00 0.00 N ATOM 2199 CA ASP A 143 -1.505 1.189 -14.119 1.00 0.00 C ATOM 2200 C ASP A 143 -0.477 0.966 -15.233 1.00 0.00 C ATOM 2201 O ASP A 143 -0.356 1.788 -16.140 1.00 0.00 O ATOM 2202 CB ASP A 143 -1.061 2.341 -13.210 1.00 0.00 C ATOM 2203 CG ASP A 143 -0.408 3.487 -13.964 1.00 0.00 C ATOM 2204 OD1 ASP A 143 0.714 3.296 -14.482 1.00 0.00 O ATOM 2205 OD2 ASP A 143 -1.017 4.574 -14.033 1.00 0.00 O ATOM 0 H ASP A 143 -1.568 0.135 -12.311 1.00 0.00 H new ATOM 0 HA ASP A 143 -2.449 1.437 -14.605 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -1.927 2.720 -12.667 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -0.361 1.959 -12.467 1.00 0.00 H new ATOM 2210 N GLN A 144 0.270 -0.129 -15.165 1.00 0.00 N ATOM 2211 CA GLN A 144 1.284 -0.408 -16.179 1.00 0.00 C ATOM 2212 C GLN A 144 0.682 -0.443 -17.586 1.00 0.00 C ATOM 2213 O GLN A 144 1.390 -0.214 -18.567 1.00 0.00 O ATOM 2214 CB GLN A 144 2.010 -1.728 -15.888 1.00 0.00 C ATOM 2215 CG GLN A 144 1.177 -2.749 -15.130 1.00 0.00 C ATOM 2216 CD GLN A 144 1.508 -4.177 -15.518 1.00 0.00 C ATOM 2217 OE1 GLN A 144 0.746 -4.833 -16.228 1.00 0.00 O ATOM 2218 NE2 GLN A 144 2.652 -4.667 -15.054 1.00 0.00 N ATOM 0 H GLN A 144 0.196 -0.831 -14.429 1.00 0.00 H new ATOM 0 HA GLN A 144 2.007 0.407 -16.137 1.00 0.00 H new ATOM 0 HB2 GLN A 144 2.331 -2.168 -16.832 1.00 0.00 H new ATOM 0 HB3 GLN A 144 2.911 -1.514 -15.314 1.00 0.00 H new ATOM 0 HG2 GLN A 144 1.338 -2.621 -14.060 1.00 0.00 H new ATOM 0 HG3 GLN A 144 0.120 -2.561 -15.318 1.00 0.00 H new ATOM 0 HE21 GLN A 144 3.254 -4.089 -14.468 1.00 0.00 H new ATOM 0 HE22 GLN A 144 2.928 -5.622 -15.283 1.00 0.00 H new ATOM 2227 N TYR A 145 -0.615 -0.735 -17.692 1.00 0.00 N ATOM 2228 CA TYR A 145 -1.265 -0.796 -18.992 1.00 0.00 C ATOM 2229 C TYR A 145 -2.276 0.336 -19.200 1.00 0.00 C ATOM 2230 O TYR A 145 -2.769 0.530 -20.312 1.00 0.00 O ATOM 2231 CB TYR A 145 -1.953 -2.146 -19.190 1.00 0.00 C ATOM 2232 CG TYR A 145 -2.407 -2.808 -17.917 1.00 0.00 C ATOM 2233 CD1 TYR A 145 -1.486 -3.321 -17.022 1.00 0.00 C ATOM 2234 CD2 TYR A 145 -3.756 -2.928 -17.618 1.00 0.00 C ATOM 2235 CE1 TYR A 145 -1.891 -3.933 -15.858 1.00 0.00 C ATOM 2236 CE2 TYR A 145 -4.172 -3.540 -16.454 1.00 0.00 C ATOM 2237 CZ TYR A 145 -3.237 -4.042 -15.575 1.00 0.00 C ATOM 2238 OH TYR A 145 -3.647 -4.657 -14.415 1.00 0.00 O ATOM 0 H TYR A 145 -1.227 -0.930 -16.900 1.00 0.00 H new ATOM 0 HA TYR A 145 -0.479 -0.674 -19.737 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -2.817 -2.007 -19.840 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -1.268 -2.816 -19.709 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -0.431 -3.240 -17.240 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -4.491 -2.537 -18.306 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -1.158 -4.326 -15.169 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -5.226 -3.625 -16.233 1.00 0.00 H new ATOM 0 HH TYR A 145 -4.290 -4.082 -13.950 1.00 0.00 H new ATOM 2248 N LEU A 146 -2.590 1.082 -18.141 1.00 0.00 N ATOM 2249 CA LEU A 146 -3.550 2.182 -18.251 1.00 0.00 C ATOM 2250 C LEU A 146 -3.195 3.333 -17.315 1.00 0.00 C ATOM 2251 O LEU A 146 -2.189 3.288 -16.608 1.00 0.00 O ATOM 2252 CB LEU A 146 -4.981 1.697 -17.966 1.00 0.00 C ATOM 2253 CG LEU A 146 -5.223 1.058 -16.589 1.00 0.00 C ATOM 2254 CD1 LEU A 146 -4.276 -0.104 -16.358 1.00 0.00 C ATOM 2255 CD2 LEU A 146 -5.085 2.084 -15.472 1.00 0.00 C ATOM 0 H LEU A 146 -2.200 0.948 -17.208 1.00 0.00 H new ATOM 0 HA LEU A 146 -3.500 2.548 -19.276 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -5.657 2.545 -18.073 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -5.255 0.972 -18.732 1.00 0.00 H new ATOM 0 HG LEU A 146 -6.245 0.679 -16.577 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -4.467 -0.539 -15.377 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -4.433 -0.860 -17.127 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -3.246 0.251 -16.403 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -5.262 1.601 -14.511 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -4.080 2.505 -15.487 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -5.814 2.881 -15.618 1.00 0.00 H new ATOM 2267 N ASN A 147 -4.036 4.363 -17.317 1.00 0.00 N ATOM 2268 CA ASN A 147 -3.823 5.531 -16.468 1.00 0.00 C ATOM 2269 C ASN A 147 -2.460 6.163 -16.736 1.00 0.00 C ATOM 2270 O ASN A 147 -1.450 5.624 -16.238 1.00 0.00 O ATOM 2271 CB ASN A 147 -3.941 5.143 -14.993 1.00 0.00 C ATOM 2272 CG ASN A 147 -3.921 6.349 -14.076 1.00 0.00 C ATOM 2273 OD1 ASN A 147 -4.319 7.447 -14.466 1.00 0.00 O ATOM 2274 ND2 ASN A 147 -3.454 6.151 -12.849 1.00 0.00 N ATOM 2275 OXT ASN A 147 -2.415 7.192 -17.443 1.00 0.00 O ATOM 0 H ASN A 147 -4.873 4.413 -17.898 1.00 0.00 H new ATOM 0 HA ASN A 147 -4.592 6.266 -16.706 1.00 0.00 H new ATOM 0 HB2 ASN A 147 -4.866 4.588 -14.839 1.00 0.00 H new ATOM 0 HB3 ASN A 147 -3.121 4.475 -14.729 1.00 0.00 H new ATOM 0 HD21 ASN A 147 -3.415 6.926 -12.187 1.00 0.00 H new ATOM 0 HD22 ASN A 147 -3.135 5.224 -12.568 1.00 0.00 H new