USER MOD reduce.3.24.130724 H: found=0, std=0, add=720, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 719 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 72 ASN : amide:sc= -2.26! C(o=-1.2!,f=-14!) USER MOD Set 1.2: A 91 LYS NZ :NH3+ 176:sc= 1.09 (180deg=-0.0547) USER MOD Set 2.1: A 38 HIS : no HE2:sc= -1.9 K(o=-0.76,f=-11!) USER MOD Set 2.2: A 89 THR OG1 : rot -47:sc= 1.14 USER MOD Set 3.1: A 19 GLN : amide:sc= -1.02 K(o=-0.14,f=-1) USER MOD Set 3.2: A 23 ASN : amide:sc= 1.23 K(o=-0.14,f=-1) USER MOD Set 3.3: A 66 MET CE :methyl 171:sc= -0.348 (180deg=-0.76) USER MOD Single : A 9 LYS NZ :NH3+ 179:sc= 1.19 (180deg=1.14) USER MOD Single : A 12 LYS NZ :NH3+ -133:sc= 0.833 (180deg=-3.18!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 ASN : amide:sc=-0.00456 X(o=-0.0046,f=-0.25) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -172:sc=-0.00707 (180deg=-0.086) USER MOD Single : A 27 LYS NZ :NH3+ 173:sc=-0.00817 (180deg=-0.0783) USER MOD Single : A 28 HIS : no HD1:sc= -0.282 X(o=-0.28,f=-0.00059) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -174:sc= -0.727 (180deg=-0.787) USER MOD Single : A 52 THR OG1 : rot 42:sc= 0.198 USER MOD Single : A 62 LYS NZ :NH3+ 165:sc= -0.0732 (180deg=-0.309) USER MOD Single : A 65 THR OG1 : rot 73:sc= 0.832 USER MOD Single : A 69 ASN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 75 LYS NZ :NH3+ 164:sc= -0.0687 (180deg=-0.364) USER MOD Single : A 78 ASN : amide:sc= -0.404 X(o=-0.4,f=-0.58) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -1.66! C(o=-1.7!,f=-11!) USER MOD Single : A 86 MET CE :methyl 135:sc= -0.103 (180deg=-0.39) USER MOD ----------------------------------------------------------------- ATOM 58 N ASP A 7 -12.245 -46.105 21.759 1.00 0.00 N ATOM 59 CA ASP A 7 -12.744 -45.276 22.841 1.00 0.00 C ATOM 60 C ASP A 7 -11.933 -45.501 24.102 1.00 0.00 C ATOM 61 O ASP A 7 -12.009 -46.562 24.726 1.00 0.00 O ATOM 62 CB ASP A 7 -14.221 -45.561 23.104 1.00 0.00 C ATOM 63 CG ASP A 7 -14.831 -44.624 24.137 1.00 0.00 C ATOM 64 OD1 ASP A 7 -14.921 -43.412 23.869 1.00 0.00 O ATOM 65 OD2 ASP A 7 -15.239 -45.101 25.217 1.00 0.00 O ATOM 0 HA ASP A 7 -12.642 -44.232 22.543 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -14.775 -45.473 22.169 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -14.332 -46.591 23.444 1.00 0.00 H new ATOM 70 N ILE A 8 -11.144 -44.513 24.448 1.00 0.00 N ATOM 71 CA ILE A 8 -10.301 -44.567 25.623 1.00 0.00 C ATOM 72 C ILE A 8 -11.055 -44.036 26.828 1.00 0.00 C ATOM 73 O ILE A 8 -11.715 -42.998 26.751 1.00 0.00 O ATOM 74 CB ILE A 8 -8.997 -43.765 25.403 1.00 0.00 C ATOM 75 CG1 ILE A 8 -8.184 -44.411 24.279 1.00 0.00 C ATOM 76 CG2 ILE A 8 -8.177 -43.681 26.690 1.00 0.00 C ATOM 77 CD1 ILE A 8 -6.993 -43.598 23.842 1.00 0.00 C ATOM 0 H ILE A 8 -11.066 -43.643 23.921 1.00 0.00 H new ATOM 0 HA ILE A 8 -10.030 -45.607 25.807 1.00 0.00 H new ATOM 0 HB ILE A 8 -9.256 -42.746 25.116 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -7.841 -45.391 24.609 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -8.835 -44.574 23.420 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -7.266 -43.112 26.505 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -8.764 -43.185 27.464 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -7.915 -44.686 27.021 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -6.468 -44.122 23.043 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.329 -42.626 23.479 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -6.319 -43.457 24.687 1.00 0.00 H new ATOM 89 N LYS A 9 -10.980 -44.755 27.929 1.00 0.00 N ATOM 90 CA LYS A 9 -11.695 -44.365 29.120 1.00 0.00 C ATOM 91 C LYS A 9 -10.832 -43.551 30.024 1.00 0.00 C ATOM 92 O LYS A 9 -9.628 -43.787 30.148 1.00 0.00 O ATOM 93 CB LYS A 9 -12.232 -45.573 29.883 1.00 0.00 C ATOM 94 CG LYS A 9 -13.530 -46.133 29.334 1.00 0.00 C ATOM 95 CD LYS A 9 -13.372 -46.558 27.899 1.00 0.00 C ATOM 96 CE LYS A 9 -14.566 -47.350 27.404 1.00 0.00 C ATOM 97 NZ LYS A 9 -15.793 -46.525 27.339 1.00 0.00 N ATOM 0 H LYS A 9 -10.432 -45.610 28.021 1.00 0.00 H new ATOM 0 HA LYS A 9 -12.541 -43.761 28.792 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -11.477 -46.359 29.872 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -12.384 -45.291 30.925 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -13.846 -46.985 29.936 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -14.315 -45.381 29.409 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -13.238 -45.676 27.273 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -12.470 -47.161 27.797 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -14.348 -47.753 26.415 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -14.736 -48.200 28.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -16.580 -47.102 26.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -16.026 -46.174 28.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -15.636 -45.718 26.702 1.00 0.00 H new ATOM 111 N GLU A 10 -11.439 -42.605 30.651 1.00 0.00 N ATOM 112 CA GLU A 10 -10.745 -41.759 31.584 1.00 0.00 C ATOM 113 C GLU A 10 -11.381 -41.870 32.954 1.00 0.00 C ATOM 114 O GLU A 10 -12.593 -41.702 33.105 1.00 0.00 O ATOM 115 CB GLU A 10 -10.734 -40.290 31.132 1.00 0.00 C ATOM 116 CG GLU A 10 -10.016 -40.030 29.814 1.00 0.00 C ATOM 117 CD GLU A 10 -9.855 -38.551 29.521 1.00 0.00 C ATOM 118 OE1 GLU A 10 -10.379 -37.725 30.298 1.00 0.00 O ATOM 119 OE2 GLU A 10 -9.170 -38.207 28.535 1.00 0.00 O ATOM 0 H GLU A 10 -12.429 -42.388 30.538 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.710 -42.099 31.628 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.764 -39.945 31.042 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -10.263 -39.689 31.910 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -9.033 -40.501 29.841 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -10.572 -40.499 29.002 1.00 0.00 H new ATOM 126 N ILE A 11 -10.582 -42.172 33.940 1.00 0.00 N ATOM 127 CA ILE A 11 -11.062 -42.254 35.293 1.00 0.00 C ATOM 128 C ILE A 11 -10.496 -41.096 36.110 1.00 0.00 C ATOM 129 O ILE A 11 -9.278 -40.954 36.245 1.00 0.00 O ATOM 130 CB ILE A 11 -10.741 -43.638 35.945 1.00 0.00 C ATOM 131 CG1 ILE A 11 -11.589 -44.739 35.287 1.00 0.00 C ATOM 132 CG2 ILE A 11 -10.979 -43.606 37.448 1.00 0.00 C ATOM 133 CD1 ILE A 11 -11.255 -46.140 35.768 1.00 0.00 C ATOM 0 H ILE A 11 -9.587 -42.367 33.831 1.00 0.00 H new ATOM 0 HA ILE A 11 -12.149 -42.171 35.279 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.686 -43.858 35.780 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -12.642 -44.539 35.483 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -11.452 -44.693 34.207 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.747 -44.582 37.874 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.338 -42.851 37.902 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -12.023 -43.362 37.646 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -11.894 -46.861 35.259 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -10.211 -46.361 35.547 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -11.420 -46.204 36.844 1.00 0.00 H new ATOM 145 N LYS A 12 -11.384 -40.242 36.614 1.00 0.00 N ATOM 146 CA LYS A 12 -10.966 -39.071 37.366 1.00 0.00 C ATOM 147 C LYS A 12 -11.021 -39.303 38.862 1.00 0.00 C ATOM 148 O LYS A 12 -11.953 -39.924 39.378 1.00 0.00 O ATOM 149 CB LYS A 12 -11.814 -37.833 37.017 1.00 0.00 C ATOM 150 CG LYS A 12 -11.441 -37.143 35.710 1.00 0.00 C ATOM 151 CD LYS A 12 -12.105 -37.803 34.505 1.00 0.00 C ATOM 152 CE LYS A 12 -11.728 -37.092 33.215 1.00 0.00 C ATOM 153 NZ LYS A 12 -12.402 -37.684 32.028 1.00 0.00 N ATOM 0 H LYS A 12 -12.394 -40.342 36.513 1.00 0.00 H new ATOM 0 HA LYS A 12 -9.931 -38.887 37.078 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -12.861 -38.131 36.967 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -11.727 -37.111 37.829 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -11.735 -36.095 35.757 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -10.358 -37.165 35.585 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -11.805 -38.849 34.448 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -13.188 -37.788 34.629 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -11.993 -36.038 33.293 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -10.648 -37.140 33.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -11.706 -37.827 31.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -12.823 -38.599 32.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -13.149 -37.041 31.696 1.00 0.00 H new ATOM 167 N LEU A 13 -10.022 -38.795 39.547 1.00 0.00 N ATOM 168 CA LEU A 13 -9.956 -38.854 40.988 1.00 0.00 C ATOM 169 C LEU A 13 -9.653 -37.466 41.532 1.00 0.00 C ATOM 170 O LEU A 13 -9.477 -36.515 40.764 1.00 0.00 O ATOM 171 CB LEU A 13 -8.895 -39.857 41.470 1.00 0.00 C ATOM 172 CG LEU A 13 -9.165 -41.336 41.161 1.00 0.00 C ATOM 173 CD1 LEU A 13 -8.622 -41.726 39.792 1.00 0.00 C ATOM 174 CD2 LEU A 13 -8.587 -42.222 42.250 1.00 0.00 C ATOM 0 H LEU A 13 -9.226 -38.325 39.115 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.920 -39.198 41.362 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -7.939 -39.584 41.024 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.786 -39.748 42.549 1.00 0.00 H new ATOM 0 HG LEU A 13 -10.245 -41.483 41.137 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -8.830 -42.779 39.605 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -9.102 -41.119 39.024 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -7.545 -41.559 39.767 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -8.788 -43.267 42.014 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -7.510 -42.065 42.313 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -9.047 -41.971 43.206 1.00 0.00 H new ATOM 186 N SER A 14 -9.616 -37.336 42.837 1.00 0.00 N ATOM 187 CA SER A 14 -9.325 -36.064 43.455 1.00 0.00 C ATOM 188 C SER A 14 -8.329 -36.243 44.584 1.00 0.00 C ATOM 189 O SER A 14 -8.223 -37.317 45.152 1.00 0.00 O ATOM 190 CB SER A 14 -10.615 -35.429 43.969 1.00 0.00 C ATOM 191 OG SER A 14 -11.549 -35.275 42.909 1.00 0.00 O ATOM 0 H SER A 14 -9.784 -38.098 43.493 1.00 0.00 H new ATOM 0 HA SER A 14 -8.882 -35.401 42.712 1.00 0.00 H new ATOM 0 HB2 SER A 14 -11.046 -36.050 44.754 1.00 0.00 H new ATOM 0 HB3 SER A 14 -10.397 -34.458 44.414 1.00 0.00 H new ATOM 0 HG SER A 14 -12.371 -34.868 43.254 1.00 0.00 H new ATOM 197 N VAL A 15 -7.588 -35.194 44.877 1.00 0.00 N ATOM 198 CA VAL A 15 -6.622 -35.208 45.967 1.00 0.00 C ATOM 199 C VAL A 15 -7.342 -35.410 47.305 1.00 0.00 C ATOM 200 O VAL A 15 -6.818 -36.038 48.223 1.00 0.00 O ATOM 201 CB VAL A 15 -5.787 -33.897 45.990 1.00 0.00 C ATOM 202 CG1 VAL A 15 -4.847 -33.856 47.187 1.00 0.00 C ATOM 203 CG2 VAL A 15 -4.994 -33.770 44.707 1.00 0.00 C ATOM 0 H VAL A 15 -7.635 -34.309 44.371 1.00 0.00 H new ATOM 0 HA VAL A 15 -5.935 -36.039 45.806 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.478 -33.059 46.077 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -4.279 -32.926 47.172 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.428 -33.911 48.108 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.161 -34.701 47.140 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.411 -32.849 44.729 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.322 -34.623 44.609 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.677 -33.746 43.858 1.00 0.00 H new ATOM 213 N LYS A 16 -8.554 -34.879 47.397 1.00 0.00 N ATOM 214 CA LYS A 16 -9.361 -35.019 48.597 1.00 0.00 C ATOM 215 C LYS A 16 -10.501 -36.005 48.347 1.00 0.00 C ATOM 216 O LYS A 16 -11.650 -35.609 48.152 1.00 0.00 O ATOM 217 CB LYS A 16 -9.916 -33.663 49.033 1.00 0.00 C ATOM 218 CG LYS A 16 -8.838 -32.656 49.406 1.00 0.00 C ATOM 219 CD LYS A 16 -9.437 -31.331 49.852 1.00 0.00 C ATOM 220 CE LYS A 16 -8.350 -30.326 50.202 1.00 0.00 C ATOM 221 NZ LYS A 16 -8.918 -29.043 50.673 1.00 0.00 N ATOM 0 H LYS A 16 -8.999 -34.346 46.650 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.731 -35.404 49.399 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.523 -33.251 48.226 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.577 -33.808 49.887 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -8.220 -33.064 50.206 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -8.183 -32.490 48.551 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -10.067 -30.928 49.059 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -10.079 -31.492 50.718 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -7.705 -30.743 50.975 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -7.725 -30.147 49.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -8.146 -28.385 50.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -9.514 -28.632 49.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -9.494 -29.209 51.523 1.00 0.00 H new ATOM 235 N ILE A 17 -10.161 -37.278 48.306 1.00 0.00 N ATOM 236 CA ILE A 17 -11.135 -38.339 48.070 1.00 0.00 C ATOM 237 C ILE A 17 -10.978 -39.441 49.130 1.00 0.00 C ATOM 238 O ILE A 17 -9.945 -39.522 49.803 1.00 0.00 O ATOM 239 CB ILE A 17 -10.945 -38.943 46.646 1.00 0.00 C ATOM 240 CG1 ILE A 17 -12.061 -39.937 46.297 1.00 0.00 C ATOM 241 CG2 ILE A 17 -9.584 -39.617 46.531 1.00 0.00 C ATOM 242 CD1 ILE A 17 -12.044 -40.377 44.853 1.00 0.00 C ATOM 0 H ILE A 17 -9.206 -37.611 48.434 1.00 0.00 H new ATOM 0 HA ILE A 17 -12.137 -37.915 48.140 1.00 0.00 H new ATOM 0 HB ILE A 17 -10.997 -38.121 45.932 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -11.969 -40.814 46.937 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -13.026 -39.481 46.518 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -9.468 -40.033 45.530 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.798 -38.884 46.712 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -9.511 -40.417 47.268 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -12.859 -41.079 44.677 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -12.167 -39.508 44.206 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -11.094 -40.862 44.632 1.00 0.00 H new ATOM 254 N ALA A 18 -12.008 -40.260 49.298 1.00 0.00 N ATOM 255 CA ALA A 18 -11.955 -41.361 50.239 1.00 0.00 C ATOM 256 C ALA A 18 -11.075 -42.478 49.696 1.00 0.00 C ATOM 257 O ALA A 18 -11.085 -42.757 48.496 1.00 0.00 O ATOM 258 CB ALA A 18 -13.356 -41.880 50.528 1.00 0.00 C ATOM 0 H ALA A 18 -12.890 -40.179 48.792 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.522 -41.001 51.172 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -13.299 -42.707 51.236 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -13.960 -41.079 50.953 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.814 -42.227 49.602 1.00 0.00 H new ATOM 264 N GLN A 19 -10.325 -43.120 50.579 1.00 0.00 N ATOM 265 CA GLN A 19 -9.436 -44.211 50.191 1.00 0.00 C ATOM 266 C GLN A 19 -10.252 -45.377 49.635 1.00 0.00 C ATOM 267 O GLN A 19 -9.859 -46.020 48.662 1.00 0.00 O ATOM 268 CB GLN A 19 -8.598 -44.673 51.391 1.00 0.00 C ATOM 269 CG GLN A 19 -7.157 -45.053 51.048 1.00 0.00 C ATOM 270 CD GLN A 19 -7.052 -46.241 50.112 1.00 0.00 C ATOM 271 OE1 GLN A 19 -7.012 -47.390 50.546 1.00 0.00 O ATOM 272 NE2 GLN A 19 -7.001 -45.973 48.821 1.00 0.00 N ATOM 0 H GLN A 19 -10.313 -42.904 51.576 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.759 -43.852 49.416 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -8.583 -43.877 52.136 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -9.087 -45.531 51.851 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -6.662 -44.196 50.591 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -6.620 -45.278 51.969 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -7.037 -45.006 48.499 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -6.926 -46.733 48.145 1.00 0.00 H new ATOM 281 N ASN A 20 -11.400 -45.622 50.243 1.00 0.00 N ATOM 282 CA ASN A 20 -12.292 -46.702 49.808 1.00 0.00 C ATOM 283 C ASN A 20 -12.751 -46.441 48.388 1.00 0.00 C ATOM 284 O ASN A 20 -12.801 -47.349 47.558 1.00 0.00 O ATOM 285 CB ASN A 20 -13.530 -46.767 50.706 1.00 0.00 C ATOM 286 CG ASN A 20 -13.219 -46.988 52.167 1.00 0.00 C ATOM 287 OD1 ASN A 20 -12.273 -47.690 52.520 1.00 0.00 O ATOM 288 ND2 ASN A 20 -14.002 -46.368 53.025 1.00 0.00 N ATOM 0 H ASN A 20 -11.744 -45.090 51.043 1.00 0.00 H new ATOM 0 HA ASN A 20 -11.745 -47.643 49.867 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -14.091 -45.838 50.601 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -14.177 -47.572 50.357 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -13.835 -46.460 54.027 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -14.776 -45.795 52.688 1.00 0.00 H new ATOM 295 N ASP A 21 -13.059 -45.183 48.115 1.00 0.00 N ATOM 296 CA ASP A 21 -13.549 -44.768 46.814 1.00 0.00 C ATOM 297 C ASP A 21 -12.469 -44.958 45.743 1.00 0.00 C ATOM 298 O ASP A 21 -12.767 -45.337 44.612 1.00 0.00 O ATOM 299 CB ASP A 21 -14.024 -43.317 46.861 1.00 0.00 C ATOM 300 CG ASP A 21 -14.989 -42.988 45.746 1.00 0.00 C ATOM 301 OD1 ASP A 21 -16.192 -43.308 45.888 1.00 0.00 O ATOM 302 OD2 ASP A 21 -14.571 -42.407 44.744 1.00 0.00 O ATOM 0 H ASP A 21 -12.976 -44.423 48.790 1.00 0.00 H new ATOM 0 HA ASP A 21 -14.399 -45.396 46.548 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.504 -43.126 47.821 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -13.162 -42.653 46.798 1.00 0.00 H new ATOM 307 N ILE A 22 -11.205 -44.710 46.118 1.00 0.00 N ATOM 308 CA ILE A 22 -10.082 -44.909 45.197 1.00 0.00 C ATOM 309 C ILE A 22 -10.013 -46.368 44.774 1.00 0.00 C ATOM 310 O ILE A 22 -9.910 -46.674 43.593 1.00 0.00 O ATOM 311 CB ILE A 22 -8.715 -44.522 45.835 1.00 0.00 C ATOM 312 CG1 ILE A 22 -8.731 -43.078 46.326 1.00 0.00 C ATOM 313 CG2 ILE A 22 -7.574 -44.733 44.840 1.00 0.00 C ATOM 314 CD1 ILE A 22 -7.469 -42.674 47.068 1.00 0.00 C ATOM 0 H ILE A 22 -10.939 -44.375 47.044 1.00 0.00 H new ATOM 0 HA ILE A 22 -10.259 -44.260 44.340 1.00 0.00 H new ATOM 0 HB ILE A 22 -8.550 -45.173 46.694 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.869 -42.414 45.472 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.590 -42.936 46.982 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.629 -44.456 45.307 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.539 -45.781 44.543 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.739 -44.112 43.960 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.551 -41.635 47.387 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.340 -43.313 47.942 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.608 -42.784 46.408 1.00 0.00 H new ATOM 326 N ASN A 23 -10.120 -47.261 45.752 1.00 0.00 N ATOM 327 CA ASN A 23 -10.045 -48.708 45.510 1.00 0.00 C ATOM 328 C ASN A 23 -11.129 -49.143 44.549 1.00 0.00 C ATOM 329 O ASN A 23 -10.896 -49.927 43.627 1.00 0.00 O ATOM 330 CB ASN A 23 -10.243 -49.462 46.825 1.00 0.00 C ATOM 331 CG ASN A 23 -8.998 -49.524 47.690 1.00 0.00 C ATOM 332 OD1 ASN A 23 -8.163 -50.408 47.537 1.00 0.00 O ATOM 333 ND2 ASN A 23 -8.874 -48.590 48.614 1.00 0.00 N ATOM 0 H ASN A 23 -10.260 -47.010 46.731 1.00 0.00 H new ATOM 0 HA ASN A 23 -9.066 -48.931 45.085 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -11.043 -48.984 47.390 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -10.572 -50.478 46.605 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -8.062 -48.588 49.231 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -9.590 -47.870 48.711 1.00 0.00 H new ATOM 340 N TYR A 24 -12.298 -48.615 44.773 1.00 0.00 N ATOM 341 CA TYR A 24 -13.456 -48.900 43.973 1.00 0.00 C ATOM 342 C TYR A 24 -13.239 -48.462 42.509 1.00 0.00 C ATOM 343 O TYR A 24 -13.535 -49.219 41.578 1.00 0.00 O ATOM 344 CB TYR A 24 -14.643 -48.195 44.620 1.00 0.00 C ATOM 345 CG TYR A 24 -15.958 -48.289 43.893 1.00 0.00 C ATOM 346 CD1 TYR A 24 -16.732 -49.424 43.989 1.00 0.00 C ATOM 347 CD2 TYR A 24 -16.434 -47.229 43.139 1.00 0.00 C ATOM 348 CE1 TYR A 24 -17.957 -49.514 43.352 1.00 0.00 C ATOM 349 CE2 TYR A 24 -17.651 -47.305 42.492 1.00 0.00 C ATOM 350 CZ TYR A 24 -18.411 -48.449 42.604 1.00 0.00 C ATOM 351 OH TYR A 24 -19.636 -48.528 41.969 1.00 0.00 O ATOM 0 H TYR A 24 -12.477 -47.960 45.534 1.00 0.00 H new ATOM 0 HA TYR A 24 -13.647 -49.972 43.936 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -14.777 -48.603 45.622 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -14.392 -47.141 44.736 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -16.376 -50.260 44.573 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -15.843 -46.329 43.056 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -18.552 -50.411 43.440 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -18.005 -46.473 41.902 1.00 0.00 H new ATOM 0 HH TYR A 24 -19.808 -47.693 41.485 1.00 0.00 H new ATOM 361 N LYS A 25 -12.714 -47.248 42.312 1.00 0.00 N ATOM 362 CA LYS A 25 -12.441 -46.734 40.970 1.00 0.00 C ATOM 363 C LYS A 25 -11.348 -47.547 40.260 1.00 0.00 C ATOM 364 O LYS A 25 -11.453 -47.837 39.066 1.00 0.00 O ATOM 365 CB LYS A 25 -12.049 -45.257 41.008 1.00 0.00 C ATOM 366 CG LYS A 25 -13.158 -44.335 41.477 1.00 0.00 C ATOM 367 CD LYS A 25 -12.720 -42.880 41.414 1.00 0.00 C ATOM 368 CE LYS A 25 -13.775 -41.945 41.987 1.00 0.00 C ATOM 369 NZ LYS A 25 -15.085 -42.067 41.296 1.00 0.00 N ATOM 0 H LYS A 25 -12.471 -46.605 43.066 1.00 0.00 H new ATOM 0 HA LYS A 25 -13.366 -46.835 40.402 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -11.188 -45.137 41.666 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.733 -44.950 40.011 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -14.043 -44.479 40.857 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -13.440 -44.590 42.499 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.788 -42.757 41.966 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.516 -42.607 40.379 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -13.907 -42.159 43.048 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -13.423 -40.916 41.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -15.725 -41.319 41.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -14.947 -41.970 40.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -15.501 -42.997 41.503 1.00 0.00 H new ATOM 383 N VAL A 26 -10.306 -47.915 41.009 1.00 0.00 N ATOM 384 CA VAL A 26 -9.178 -48.689 40.464 1.00 0.00 C ATOM 385 C VAL A 26 -9.657 -50.050 39.948 1.00 0.00 C ATOM 386 O VAL A 26 -9.209 -50.521 38.903 1.00 0.00 O ATOM 387 CB VAL A 26 -8.039 -48.879 41.507 1.00 0.00 C ATOM 388 CG1 VAL A 26 -6.881 -49.635 40.895 1.00 0.00 C ATOM 389 CG2 VAL A 26 -7.552 -47.531 42.013 1.00 0.00 C ATOM 0 H VAL A 26 -10.216 -47.690 42.000 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.768 -48.116 39.632 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.438 -49.453 42.343 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.094 -49.759 41.639 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -7.222 -50.615 40.561 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.491 -49.077 40.044 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.756 -47.682 42.742 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.172 -46.944 41.177 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.379 -46.999 42.484 1.00 0.00 H new ATOM 399 N LYS A 27 -10.581 -50.670 40.689 1.00 0.00 N ATOM 400 CA LYS A 27 -11.166 -51.951 40.280 1.00 0.00 C ATOM 401 C LYS A 27 -11.787 -51.837 38.882 1.00 0.00 C ATOM 402 O LYS A 27 -11.664 -52.750 38.061 1.00 0.00 O ATOM 403 CB LYS A 27 -12.227 -52.408 41.293 1.00 0.00 C ATOM 404 CG LYS A 27 -12.899 -53.733 40.934 1.00 0.00 C ATOM 405 CD LYS A 27 -13.939 -54.137 41.969 1.00 0.00 C ATOM 406 CE LYS A 27 -14.666 -55.424 41.569 1.00 0.00 C ATOM 407 NZ LYS A 27 -13.748 -56.588 41.461 1.00 0.00 N ATOM 0 H LYS A 27 -10.939 -50.307 41.572 1.00 0.00 H new ATOM 0 HA LYS A 27 -10.370 -52.695 40.249 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -11.761 -52.503 42.274 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -12.991 -51.636 41.376 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -13.373 -53.647 39.956 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -12.143 -54.514 40.854 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -13.455 -54.278 42.935 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -14.664 -53.332 42.090 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -15.440 -55.643 42.304 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -15.168 -55.272 40.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -14.302 -57.454 41.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -13.098 -56.445 40.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.200 -56.681 42.340 1.00 0.00 H new ATOM 421 N HIS A 28 -12.438 -50.710 38.612 1.00 0.00 N ATOM 422 CA HIS A 28 -13.047 -50.472 37.308 1.00 0.00 C ATOM 423 C HIS A 28 -11.992 -50.403 36.220 1.00 0.00 C ATOM 424 O HIS A 28 -12.203 -50.891 35.116 1.00 0.00 O ATOM 425 CB HIS A 28 -13.866 -49.183 37.306 1.00 0.00 C ATOM 426 CG HIS A 28 -15.198 -49.317 37.952 1.00 0.00 C ATOM 427 ND1 HIS A 28 -15.604 -48.545 39.019 1.00 0.00 N ATOM 428 CD2 HIS A 28 -16.234 -50.134 37.665 1.00 0.00 C ATOM 429 CE1 HIS A 28 -16.832 -48.885 39.357 1.00 0.00 C ATOM 430 NE2 HIS A 28 -17.235 -49.847 38.551 1.00 0.00 N ATOM 0 H HIS A 28 -12.557 -49.947 39.279 1.00 0.00 H new ATOM 0 HA HIS A 28 -13.713 -51.311 37.105 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -13.301 -48.404 37.818 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -14.004 -48.853 36.276 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -16.266 -50.876 36.881 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -17.410 -48.449 40.159 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -18.147 -50.304 38.583 1.00 0.00 H new ATOM 438 N ALA A 29 -10.860 -49.799 36.539 1.00 0.00 N ATOM 439 CA ALA A 29 -9.774 -49.664 35.582 1.00 0.00 C ATOM 440 C ALA A 29 -9.281 -51.025 35.135 1.00 0.00 C ATOM 441 O ALA A 29 -8.996 -51.232 33.961 1.00 0.00 O ATOM 442 CB ALA A 29 -8.636 -48.866 36.184 1.00 0.00 C ATOM 0 H ALA A 29 -10.668 -49.393 37.455 1.00 0.00 H new ATOM 0 HA ALA A 29 -10.152 -49.131 34.709 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -7.831 -48.774 35.455 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -8.993 -47.873 36.458 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.264 -49.376 37.073 1.00 0.00 H new ATOM 448 N LEU A 30 -9.231 -51.959 36.076 1.00 0.00 N ATOM 449 CA LEU A 30 -8.772 -53.311 35.799 1.00 0.00 C ATOM 450 C LEU A 30 -9.686 -53.972 34.769 1.00 0.00 C ATOM 451 O LEU A 30 -9.226 -54.688 33.881 1.00 0.00 O ATOM 452 CB LEU A 30 -8.748 -54.134 37.092 1.00 0.00 C ATOM 453 CG LEU A 30 -7.780 -53.642 38.186 1.00 0.00 C ATOM 454 CD1 LEU A 30 -7.892 -54.511 39.428 1.00 0.00 C ATOM 455 CD2 LEU A 30 -6.342 -53.615 37.679 1.00 0.00 C ATOM 0 H LEU A 30 -9.506 -51.801 37.046 1.00 0.00 H new ATOM 0 HA LEU A 30 -7.761 -53.266 35.394 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.756 -54.152 37.507 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -8.489 -55.162 36.840 1.00 0.00 H new ATOM 0 HG LEU A 30 -8.062 -52.622 38.449 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -7.201 -54.148 40.189 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.911 -54.467 39.812 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -7.644 -55.542 39.174 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -5.683 -53.264 38.473 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -6.044 -54.619 37.377 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -6.270 -52.943 36.824 1.00 0.00 H new ATOM 467 N GLU A 31 -10.981 -53.708 34.902 1.00 0.00 N ATOM 468 CA GLU A 31 -11.988 -54.235 33.992 1.00 0.00 C ATOM 469 C GLU A 31 -11.723 -53.780 32.556 1.00 0.00 C ATOM 470 O GLU A 31 -11.658 -54.595 31.637 1.00 0.00 O ATOM 471 CB GLU A 31 -13.370 -53.744 34.429 1.00 0.00 C ATOM 472 CG GLU A 31 -13.825 -54.266 35.779 1.00 0.00 C ATOM 473 CD GLU A 31 -14.262 -55.707 35.719 1.00 0.00 C ATOM 474 OE1 GLU A 31 -13.416 -56.585 35.465 1.00 0.00 O ATOM 475 OE2 GLU A 31 -15.467 -55.968 35.911 1.00 0.00 O ATOM 0 H GLU A 31 -11.361 -53.122 35.645 1.00 0.00 H new ATOM 0 HA GLU A 31 -11.946 -55.324 34.023 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -13.362 -52.654 34.459 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -14.101 -54.037 33.675 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -13.012 -54.165 36.498 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -14.650 -53.654 36.143 1.00 0.00 H new ATOM 482 N PHE A 32 -11.530 -52.477 32.381 1.00 0.00 N ATOM 483 CA PHE A 32 -11.308 -51.903 31.056 1.00 0.00 C ATOM 484 C PHE A 32 -10.007 -52.402 30.442 1.00 0.00 C ATOM 485 O PHE A 32 -9.918 -52.594 29.226 1.00 0.00 O ATOM 486 CB PHE A 32 -11.321 -50.371 31.096 1.00 0.00 C ATOM 487 CG PHE A 32 -12.668 -49.776 31.427 1.00 0.00 C ATOM 488 CD1 PHE A 32 -13.659 -49.691 30.459 1.00 0.00 C ATOM 489 CD2 PHE A 32 -12.943 -49.315 32.703 1.00 0.00 C ATOM 490 CE1 PHE A 32 -14.897 -49.153 30.761 1.00 0.00 C ATOM 491 CE2 PHE A 32 -14.178 -48.777 33.012 1.00 0.00 C ATOM 492 CZ PHE A 32 -15.157 -48.695 32.041 1.00 0.00 C ATOM 0 H PHE A 32 -11.523 -51.796 33.141 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.133 -52.235 30.426 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -10.594 -50.031 31.834 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -10.995 -49.990 30.128 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -13.461 -50.049 29.459 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -12.182 -49.377 33.467 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -15.660 -49.090 29.999 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -14.377 -48.421 34.012 1.00 0.00 H new ATOM 0 HZ PHE A 32 -16.123 -48.275 32.280 1.00 0.00 H new ATOM 502 N LEU A 33 -9.006 -52.611 31.281 1.00 0.00 N ATOM 503 CA LEU A 33 -7.700 -53.061 30.825 1.00 0.00 C ATOM 504 C LEU A 33 -7.806 -54.438 30.179 1.00 0.00 C ATOM 505 O LEU A 33 -7.236 -54.692 29.119 1.00 0.00 O ATOM 506 CB LEU A 33 -6.741 -53.112 32.010 1.00 0.00 C ATOM 507 CG LEU A 33 -6.413 -51.763 32.649 1.00 0.00 C ATOM 508 CD1 LEU A 33 -5.567 -51.952 33.887 1.00 0.00 C ATOM 509 CD2 LEU A 33 -5.716 -50.843 31.656 1.00 0.00 C ATOM 0 H LEU A 33 -9.074 -52.475 32.290 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.322 -52.360 30.080 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.169 -53.762 32.774 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.810 -53.575 31.682 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.351 -51.292 32.942 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.344 -50.980 34.327 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.110 -52.562 34.609 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.636 -52.451 33.619 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.494 -49.890 32.137 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.787 -51.306 31.321 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.367 -50.674 30.798 1.00 0.00 H new ATOM 521 N GLU A 34 -8.556 -55.305 30.820 1.00 0.00 N ATOM 522 CA GLU A 34 -8.796 -56.647 30.325 1.00 0.00 C ATOM 523 C GLU A 34 -9.626 -56.615 29.042 1.00 0.00 C ATOM 524 O GLU A 34 -9.541 -57.518 28.214 1.00 0.00 O ATOM 525 CB GLU A 34 -9.483 -57.479 31.399 1.00 0.00 C ATOM 526 CG GLU A 34 -8.623 -57.690 32.638 1.00 0.00 C ATOM 527 CD GLU A 34 -7.381 -58.518 32.357 1.00 0.00 C ATOM 528 OE1 GLU A 34 -7.474 -59.765 32.405 1.00 0.00 O ATOM 529 OE2 GLU A 34 -6.319 -57.930 32.069 1.00 0.00 O ATOM 0 H GLU A 34 -9.021 -55.101 31.705 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.838 -57.109 30.085 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.413 -56.989 31.689 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -9.751 -58.450 30.981 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.325 -56.721 33.038 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.217 -58.183 33.407 1.00 0.00 H new ATOM 536 N GLN A 35 -10.424 -55.569 28.889 1.00 0.00 N ATOM 537 CA GLN A 35 -11.255 -55.387 27.709 1.00 0.00 C ATOM 538 C GLN A 35 -10.421 -54.879 26.525 1.00 0.00 C ATOM 539 O GLN A 35 -10.913 -54.787 25.393 1.00 0.00 O ATOM 540 CB GLN A 35 -12.371 -54.395 28.012 1.00 0.00 C ATOM 541 CG GLN A 35 -13.339 -54.877 29.075 1.00 0.00 C ATOM 542 CD GLN A 35 -14.380 -53.836 29.436 1.00 0.00 C ATOM 543 OE1 GLN A 35 -14.721 -52.968 28.628 1.00 0.00 O ATOM 544 NE2 GLN A 35 -14.881 -53.904 30.654 1.00 0.00 N ATOM 0 H GLN A 35 -10.514 -54.823 29.579 1.00 0.00 H new ATOM 0 HA GLN A 35 -11.685 -56.352 27.440 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -11.930 -53.452 28.335 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -12.924 -54.191 27.095 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -13.840 -55.778 28.722 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -12.781 -55.152 29.970 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -14.572 -54.637 31.292 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -15.577 -53.223 30.958 1.00 0.00 H new ATOM 553 N GLY A 36 -9.160 -54.542 26.790 1.00 0.00 N ATOM 554 CA GLY A 36 -8.296 -54.035 25.748 1.00 0.00 C ATOM 555 C GLY A 36 -8.449 -52.541 25.565 1.00 0.00 C ATOM 556 O GLY A 36 -8.166 -52.004 24.495 1.00 0.00 O ATOM 0 H GLY A 36 -8.726 -54.613 27.710 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.259 -54.267 25.992 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.524 -54.541 24.810 1.00 0.00 H new ATOM 560 N LYS A 37 -8.930 -51.875 26.598 1.00 0.00 N ATOM 561 CA LYS A 37 -9.109 -50.438 26.570 1.00 0.00 C ATOM 562 C LYS A 37 -8.015 -49.758 27.360 1.00 0.00 C ATOM 563 O LYS A 37 -7.372 -50.373 28.213 1.00 0.00 O ATOM 564 CB LYS A 37 -10.479 -50.039 27.144 1.00 0.00 C ATOM 565 CG LYS A 37 -11.678 -50.516 26.336 1.00 0.00 C ATOM 566 CD LYS A 37 -11.771 -49.818 24.980 1.00 0.00 C ATOM 567 CE LYS A 37 -12.984 -50.320 24.205 1.00 0.00 C ATOM 568 NZ LYS A 37 -13.128 -49.667 22.880 1.00 0.00 N ATOM 0 H LYS A 37 -9.206 -52.314 27.476 1.00 0.00 H new ATOM 0 HA LYS A 37 -9.060 -50.117 25.530 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.561 -50.435 28.156 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.521 -48.953 27.222 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.607 -51.593 26.185 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -12.592 -50.333 26.901 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -11.844 -48.740 25.123 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -10.863 -50.003 24.406 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -12.901 -51.398 24.067 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -13.885 -50.142 24.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -13.968 -50.045 22.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -13.235 -48.641 23.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -12.282 -49.857 22.305 1.00 0.00 H new ATOM 582 N HIS A 38 -7.802 -48.502 27.073 1.00 0.00 N ATOM 583 CA HIS A 38 -6.844 -47.708 27.782 1.00 0.00 C ATOM 584 C HIS A 38 -7.525 -46.878 28.839 1.00 0.00 C ATOM 585 O HIS A 38 -8.602 -46.327 28.605 1.00 0.00 O ATOM 586 CB HIS A 38 -6.099 -46.788 26.820 1.00 0.00 C ATOM 587 CG HIS A 38 -4.796 -47.321 26.363 1.00 0.00 C ATOM 588 ND1 HIS A 38 -4.576 -47.881 25.120 1.00 0.00 N ATOM 589 CD2 HIS A 38 -3.623 -47.342 26.991 1.00 0.00 C ATOM 590 CE1 HIS A 38 -3.299 -48.223 25.027 1.00 0.00 C ATOM 591 NE2 HIS A 38 -2.712 -47.899 26.149 1.00 0.00 N ATOM 0 H HIS A 38 -8.294 -48.000 26.334 1.00 0.00 H new ATOM 0 HA HIS A 38 -6.133 -48.382 28.259 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -6.729 -46.602 25.950 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -5.936 -45.826 27.306 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -5.280 -48.010 24.393 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -3.429 -46.981 27.990 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -2.827 -48.688 24.174 1.00 0.00 H new ATOM 599 N VAL A 39 -6.904 -46.795 29.999 1.00 0.00 N ATOM 600 CA VAL A 39 -7.416 -45.980 31.067 1.00 0.00 C ATOM 601 C VAL A 39 -6.486 -44.826 31.297 1.00 0.00 C ATOM 602 O VAL A 39 -5.272 -45.003 31.449 1.00 0.00 O ATOM 603 CB VAL A 39 -7.578 -46.755 32.406 1.00 0.00 C ATOM 604 CG1 VAL A 39 -7.878 -45.794 33.550 1.00 0.00 C ATOM 605 CG2 VAL A 39 -8.686 -47.768 32.311 1.00 0.00 C ATOM 0 H VAL A 39 -6.039 -47.288 30.220 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.406 -45.644 30.759 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.638 -47.271 32.602 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.988 -46.356 34.478 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.059 -45.082 33.652 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.802 -45.256 33.340 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -8.779 -48.296 33.260 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.624 -47.261 32.085 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.459 -48.482 31.519 1.00 0.00 H new ATOM 615 N ARG A 40 -7.037 -43.659 31.304 1.00 0.00 N ATOM 616 CA ARG A 40 -6.285 -42.489 31.575 1.00 0.00 C ATOM 617 C ARG A 40 -6.685 -41.987 32.945 1.00 0.00 C ATOM 618 O ARG A 40 -7.829 -41.568 33.148 1.00 0.00 O ATOM 619 CB ARG A 40 -6.586 -41.437 30.522 1.00 0.00 C ATOM 620 CG ARG A 40 -5.746 -40.186 30.617 1.00 0.00 C ATOM 621 CD ARG A 40 -6.181 -39.168 29.583 1.00 0.00 C ATOM 622 NE ARG A 40 -5.297 -38.012 29.545 1.00 0.00 N ATOM 623 CZ ARG A 40 -5.631 -36.823 29.039 1.00 0.00 C ATOM 624 NH1 ARG A 40 -6.860 -36.616 28.545 1.00 0.00 N ATOM 625 NH2 ARG A 40 -4.739 -35.836 29.024 1.00 0.00 N ATOM 0 H ARG A 40 -8.027 -43.493 31.121 1.00 0.00 H new ATOM 0 HA ARG A 40 -5.216 -42.703 31.553 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -6.443 -41.879 29.536 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -7.637 -41.158 30.597 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -5.834 -39.758 31.615 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -4.695 -40.436 30.469 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -6.204 -39.638 28.600 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -7.197 -38.840 29.803 1.00 0.00 H new ATOM 0 HE ARG A 40 -4.359 -38.118 29.931 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -7.547 -37.370 28.554 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -7.108 -35.705 28.160 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -3.803 -35.989 29.399 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -4.991 -34.926 28.638 1.00 0.00 H new ATOM 639 N PHE A 41 -5.773 -42.049 33.887 1.00 0.00 N ATOM 640 CA PHE A 41 -6.068 -41.599 35.224 1.00 0.00 C ATOM 641 C PHE A 41 -5.799 -40.126 35.316 1.00 0.00 C ATOM 642 O PHE A 41 -4.670 -39.678 35.107 1.00 0.00 O ATOM 643 CB PHE A 41 -5.234 -42.361 36.260 1.00 0.00 C ATOM 644 CG PHE A 41 -5.627 -43.807 36.416 1.00 0.00 C ATOM 645 CD1 PHE A 41 -6.639 -44.180 37.290 1.00 0.00 C ATOM 646 CD2 PHE A 41 -4.979 -44.792 35.693 1.00 0.00 C ATOM 647 CE1 PHE A 41 -6.996 -45.504 37.433 1.00 0.00 C ATOM 648 CE2 PHE A 41 -5.333 -46.117 35.836 1.00 0.00 C ATOM 649 CZ PHE A 41 -6.341 -46.473 36.704 1.00 0.00 C ATOM 0 H PHE A 41 -4.827 -42.405 33.752 1.00 0.00 H new ATOM 0 HA PHE A 41 -7.118 -41.794 35.440 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -4.183 -42.309 35.975 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -5.328 -41.863 37.225 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -7.153 -43.424 37.865 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -4.188 -44.521 35.010 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -7.787 -45.781 38.114 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -4.819 -46.877 35.266 1.00 0.00 H new ATOM 0 HZ PHE A 41 -6.618 -47.511 36.813 1.00 0.00 H new ATOM 659 N ARG A 42 -6.832 -39.371 35.599 1.00 0.00 N ATOM 660 CA ARG A 42 -6.720 -37.936 35.668 1.00 0.00 C ATOM 661 C ARG A 42 -7.233 -37.452 37.004 1.00 0.00 C ATOM 662 O ARG A 42 -8.249 -37.936 37.497 1.00 0.00 O ATOM 663 CB ARG A 42 -7.515 -37.285 34.525 1.00 0.00 C ATOM 664 CG ARG A 42 -7.067 -37.731 33.137 1.00 0.00 C ATOM 665 CD ARG A 42 -7.877 -37.062 32.035 1.00 0.00 C ATOM 666 NE ARG A 42 -7.624 -35.623 31.953 1.00 0.00 N ATOM 667 CZ ARG A 42 -8.333 -34.770 31.204 1.00 0.00 C ATOM 668 NH1 ARG A 42 -9.379 -35.202 30.501 1.00 0.00 N ATOM 669 NH2 ARG A 42 -7.983 -33.486 31.153 1.00 0.00 N ATOM 0 H ARG A 42 -7.768 -39.731 35.787 1.00 0.00 H new ATOM 0 HA ARG A 42 -5.672 -37.654 35.564 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -8.572 -37.520 34.649 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.419 -36.202 34.598 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.011 -37.497 33.004 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -7.166 -38.813 33.054 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -7.636 -37.526 31.078 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -8.939 -37.232 32.214 1.00 0.00 H new ATOM 0 HE ARG A 42 -6.854 -35.244 32.505 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -9.643 -36.187 30.532 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -9.916 -34.548 29.932 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.177 -33.156 31.684 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -8.521 -32.833 30.583 1.00 0.00 H new ATOM 683 N VAL A 43 -6.549 -36.508 37.586 1.00 0.00 N ATOM 684 CA VAL A 43 -6.942 -35.989 38.875 1.00 0.00 C ATOM 685 C VAL A 43 -7.080 -34.475 38.836 1.00 0.00 C ATOM 686 O VAL A 43 -6.246 -33.775 38.254 1.00 0.00 O ATOM 687 CB VAL A 43 -5.940 -36.403 39.989 1.00 0.00 C ATOM 688 CG1 VAL A 43 -4.523 -36.068 39.585 1.00 0.00 C ATOM 689 CG2 VAL A 43 -6.285 -35.740 41.314 1.00 0.00 C ATOM 0 H VAL A 43 -5.713 -36.078 37.191 1.00 0.00 H new ATOM 0 HA VAL A 43 -7.913 -36.424 39.112 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.018 -37.482 40.121 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -3.838 -36.366 40.379 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.270 -36.601 38.669 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.437 -34.995 39.416 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.567 -36.049 42.073 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.248 -34.657 41.199 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.288 -36.039 41.620 1.00 0.00 H new ATOM 699 N PHE A 44 -8.149 -33.989 39.431 1.00 0.00 N ATOM 700 CA PHE A 44 -8.410 -32.568 39.515 1.00 0.00 C ATOM 701 C PHE A 44 -8.034 -32.058 40.899 1.00 0.00 C ATOM 702 O PHE A 44 -8.388 -32.669 41.916 1.00 0.00 O ATOM 703 CB PHE A 44 -9.889 -32.280 39.211 1.00 0.00 C ATOM 704 CG PHE A 44 -10.278 -30.834 39.353 1.00 0.00 C ATOM 705 CD1 PHE A 44 -9.987 -29.924 38.351 1.00 0.00 C ATOM 706 CD2 PHE A 44 -10.938 -30.386 40.488 1.00 0.00 C ATOM 707 CE1 PHE A 44 -10.344 -28.596 38.474 1.00 0.00 C ATOM 708 CE2 PHE A 44 -11.299 -29.060 40.618 1.00 0.00 C ATOM 709 CZ PHE A 44 -11.002 -28.164 39.611 1.00 0.00 C ATOM 0 H PHE A 44 -8.863 -34.570 39.871 1.00 0.00 H new ATOM 0 HA PHE A 44 -7.804 -32.047 38.774 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.109 -32.606 38.194 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -10.509 -32.878 39.879 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -9.474 -30.257 37.461 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -11.172 -31.083 41.279 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -10.110 -27.897 37.685 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -11.813 -28.724 41.506 1.00 0.00 H new ATOM 0 HZ PHE A 44 -11.283 -27.126 39.711 1.00 0.00 H new ATOM 719 N LEU A 45 -7.301 -30.960 40.942 1.00 0.00 N ATOM 720 CA LEU A 45 -6.878 -30.398 42.207 1.00 0.00 C ATOM 721 C LEU A 45 -7.917 -29.395 42.702 1.00 0.00 C ATOM 722 O LEU A 45 -8.110 -28.332 42.105 1.00 0.00 O ATOM 723 CB LEU A 45 -5.517 -29.703 42.064 1.00 0.00 C ATOM 724 CG LEU A 45 -4.402 -30.504 41.373 1.00 0.00 C ATOM 725 CD1 LEU A 45 -3.095 -29.738 41.416 1.00 0.00 C ATOM 726 CD2 LEU A 45 -4.232 -31.869 42.006 1.00 0.00 C ATOM 0 H LEU A 45 -6.989 -30.444 40.119 1.00 0.00 H new ATOM 0 HA LEU A 45 -6.781 -31.209 42.929 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.665 -28.777 41.509 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -5.170 -29.426 43.060 1.00 0.00 H new ATOM 0 HG LEU A 45 -4.691 -30.649 40.332 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -2.316 -30.319 40.922 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -3.216 -28.784 40.903 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -2.812 -29.559 42.453 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.436 -32.411 41.495 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.974 -31.752 43.058 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -5.164 -32.428 41.921 1.00 0.00 H new ATOM 738 N LYS A 46 -8.591 -29.740 43.785 1.00 0.00 N ATOM 739 CA LYS A 46 -9.614 -28.878 44.350 1.00 0.00 C ATOM 740 C LYS A 46 -9.097 -28.183 45.599 1.00 0.00 C ATOM 741 O LYS A 46 -8.676 -28.840 46.554 1.00 0.00 O ATOM 742 CB LYS A 46 -10.866 -29.686 44.710 1.00 0.00 C ATOM 743 CG LYS A 46 -12.008 -28.828 45.227 1.00 0.00 C ATOM 744 CD LYS A 46 -13.210 -29.666 45.630 1.00 0.00 C ATOM 745 CE LYS A 46 -14.347 -28.789 46.121 1.00 0.00 C ATOM 746 NZ LYS A 46 -15.509 -29.590 46.590 1.00 0.00 N ATOM 0 H LYS A 46 -8.448 -30.613 44.292 1.00 0.00 H new ATOM 0 HA LYS A 46 -9.871 -28.131 43.599 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -11.202 -30.233 43.829 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -10.607 -30.427 45.466 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -11.667 -28.248 46.084 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -12.304 -28.116 44.457 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -13.545 -30.259 44.779 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -12.922 -30.367 46.414 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -13.991 -28.157 46.934 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -14.666 -28.125 45.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -16.262 -28.951 46.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -15.866 -30.175 45.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -15.213 -30.205 47.375 1.00 0.00 H new ATOM 760 N GLY A 47 -9.141 -26.868 45.594 1.00 0.00 N ATOM 761 CA GLY A 47 -8.702 -26.115 46.739 1.00 0.00 C ATOM 762 C GLY A 47 -7.390 -25.423 46.495 1.00 0.00 C ATOM 763 O GLY A 47 -7.083 -25.039 45.367 1.00 0.00 O ATOM 0 H GLY A 47 -9.475 -26.305 44.812 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.459 -25.374 46.997 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.605 -26.783 47.595 1.00 0.00 H new ATOM 767 N ARG A 48 -6.600 -25.292 47.542 1.00 0.00 N ATOM 768 CA ARG A 48 -5.305 -24.625 47.453 1.00 0.00 C ATOM 769 C ARG A 48 -4.219 -25.637 47.084 1.00 0.00 C ATOM 770 O ARG A 48 -3.024 -25.365 47.208 1.00 0.00 O ATOM 771 CB ARG A 48 -4.973 -23.928 48.780 1.00 0.00 C ATOM 772 CG ARG A 48 -5.983 -22.850 49.163 1.00 0.00 C ATOM 773 CD ARG A 48 -5.611 -22.150 50.462 1.00 0.00 C ATOM 774 NE ARG A 48 -6.623 -21.163 50.858 1.00 0.00 N ATOM 775 CZ ARG A 48 -6.404 -20.144 51.706 1.00 0.00 C ATOM 776 NH1 ARG A 48 -5.196 -19.945 52.221 1.00 0.00 N ATOM 777 NH2 ARG A 48 -7.397 -19.320 52.027 1.00 0.00 N ATOM 0 H ARG A 48 -6.830 -25.640 48.473 1.00 0.00 H new ATOM 0 HA ARG A 48 -5.349 -23.866 46.672 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -4.929 -24.674 49.574 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -3.982 -23.479 48.709 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -6.048 -22.114 48.361 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -6.971 -23.299 49.264 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -5.496 -22.890 51.254 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -4.647 -21.655 50.345 1.00 0.00 H new ATOM 0 HE ARG A 48 -7.558 -21.257 50.462 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -4.427 -20.568 51.973 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -5.037 -19.169 52.864 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -8.326 -19.461 51.629 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -7.230 -18.547 52.671 1.00 0.00 H new ATOM 791 N GLU A 49 -4.661 -26.799 46.613 1.00 0.00 N ATOM 792 CA GLU A 49 -3.775 -27.890 46.223 1.00 0.00 C ATOM 793 C GLU A 49 -3.083 -27.561 44.891 1.00 0.00 C ATOM 794 O GLU A 49 -2.124 -28.223 44.502 1.00 0.00 O ATOM 795 CB GLU A 49 -4.587 -29.186 46.057 1.00 0.00 C ATOM 796 CG GLU A 49 -5.635 -29.437 47.144 1.00 0.00 C ATOM 797 CD GLU A 49 -5.060 -29.537 48.538 1.00 0.00 C ATOM 798 OE1 GLU A 49 -4.292 -30.477 48.802 1.00 0.00 O ATOM 799 OE2 GLU A 49 -5.394 -28.676 49.383 1.00 0.00 O ATOM 0 H GLU A 49 -5.651 -27.011 46.490 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.022 -28.021 47.000 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.088 -29.162 45.089 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -3.897 -30.029 46.037 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -6.368 -28.631 47.121 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -6.168 -30.360 46.915 1.00 0.00 H new ATOM 806 N MET A 50 -3.570 -26.513 44.224 1.00 0.00 N ATOM 807 CA MET A 50 -3.082 -26.107 42.900 1.00 0.00 C ATOM 808 C MET A 50 -1.612 -25.732 42.919 1.00 0.00 C ATOM 809 O MET A 50 -0.889 -25.984 41.958 1.00 0.00 O ATOM 810 CB MET A 50 -3.901 -24.931 42.371 1.00 0.00 C ATOM 811 CG MET A 50 -5.337 -25.277 42.011 1.00 0.00 C ATOM 812 SD MET A 50 -5.446 -26.521 40.707 1.00 0.00 S ATOM 813 CE MET A 50 -4.651 -25.665 39.347 1.00 0.00 C ATOM 0 H MET A 50 -4.316 -25.919 44.586 1.00 0.00 H new ATOM 0 HA MET A 50 -3.199 -26.967 42.240 1.00 0.00 H new ATOM 0 HB2 MET A 50 -3.908 -24.142 43.123 1.00 0.00 H new ATOM 0 HB3 MET A 50 -3.405 -24.527 41.488 1.00 0.00 H new ATOM 0 HG2 MET A 50 -5.853 -25.641 42.900 1.00 0.00 H new ATOM 0 HG3 MET A 50 -5.855 -24.373 41.690 1.00 0.00 H new ATOM 0 HE1 MET A 50 -4.736 -26.264 38.440 1.00 0.00 H new ATOM 0 HE2 MET A 50 -5.135 -24.701 39.192 1.00 0.00 H new ATOM 0 HE3 MET A 50 -3.598 -25.509 39.581 1.00 0.00 H new ATOM 823 N ALA A 51 -1.177 -25.117 44.006 1.00 0.00 N ATOM 824 CA ALA A 51 0.214 -24.702 44.157 1.00 0.00 C ATOM 825 C ALA A 51 1.162 -25.904 44.147 1.00 0.00 C ATOM 826 O ALA A 51 2.354 -25.760 43.886 1.00 0.00 O ATOM 827 CB ALA A 51 0.393 -23.895 45.436 1.00 0.00 C ATOM 0 H ALA A 51 -1.770 -24.891 44.805 1.00 0.00 H new ATOM 0 HA ALA A 51 0.467 -24.072 43.304 1.00 0.00 H new ATOM 0 HB1 ALA A 51 1.436 -23.594 45.533 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.239 -23.008 45.398 1.00 0.00 H new ATOM 0 HB3 ALA A 51 0.110 -24.505 46.294 1.00 0.00 H new ATOM 833 N THR A 52 0.632 -27.079 44.443 1.00 0.00 N ATOM 834 CA THR A 52 1.436 -28.280 44.495 1.00 0.00 C ATOM 835 C THR A 52 0.957 -29.332 43.485 1.00 0.00 C ATOM 836 O THR A 52 0.046 -30.112 43.762 1.00 0.00 O ATOM 837 CB THR A 52 1.434 -28.876 45.913 1.00 0.00 C ATOM 838 OG1 THR A 52 0.093 -28.876 46.425 1.00 0.00 O ATOM 839 CG2 THR A 52 2.326 -28.070 46.839 1.00 0.00 C ATOM 0 H THR A 52 -0.356 -27.223 44.651 1.00 0.00 H new ATOM 0 HA THR A 52 2.454 -27.996 44.228 1.00 0.00 H new ATOM 0 HB THR A 52 1.817 -29.895 45.863 1.00 0.00 H new ATOM 0 HG1 THR A 52 -0.527 -29.149 45.717 1.00 0.00 H new ATOM 0 HG21 THR A 52 2.308 -28.511 47.836 1.00 0.00 H new ATOM 0 HG22 THR A 52 3.347 -28.076 46.457 1.00 0.00 H new ATOM 0 HG23 THR A 52 1.964 -27.043 46.890 1.00 0.00 H new ATOM 847 N PRO A 53 1.577 -29.355 42.295 1.00 0.00 N ATOM 848 CA PRO A 53 1.240 -30.313 41.222 1.00 0.00 C ATOM 849 C PRO A 53 1.545 -31.745 41.644 1.00 0.00 C ATOM 850 O PRO A 53 0.959 -32.706 41.132 1.00 0.00 O ATOM 851 CB PRO A 53 2.166 -29.885 40.071 1.00 0.00 C ATOM 852 CG PRO A 53 2.548 -28.482 40.407 1.00 0.00 C ATOM 853 CD PRO A 53 2.658 -28.447 41.886 1.00 0.00 C ATOM 0 HA PRO A 53 0.182 -30.300 40.960 1.00 0.00 H new ATOM 0 HB2 PRO A 53 3.042 -30.530 40.004 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.656 -29.939 39.109 1.00 0.00 H new ATOM 0 HG2 PRO A 53 3.492 -28.208 39.936 1.00 0.00 H new ATOM 0 HG3 PRO A 53 1.798 -27.775 40.052 1.00 0.00 H new ATOM 0 HD2 PRO A 53 3.633 -28.792 42.231 1.00 0.00 H new ATOM 0 HD3 PRO A 53 2.518 -27.441 42.282 1.00 0.00 H new ATOM 861 N GLU A 54 2.454 -31.865 42.594 1.00 0.00 N ATOM 862 CA GLU A 54 2.885 -33.146 43.131 1.00 0.00 C ATOM 863 C GLU A 54 1.736 -33.888 43.819 1.00 0.00 C ATOM 864 O GLU A 54 1.782 -35.108 43.962 1.00 0.00 O ATOM 865 CB GLU A 54 4.022 -32.928 44.118 1.00 0.00 C ATOM 866 CG GLU A 54 3.698 -31.898 45.185 1.00 0.00 C ATOM 867 CD GLU A 54 4.827 -31.696 46.151 1.00 0.00 C ATOM 868 OE1 GLU A 54 5.774 -30.975 45.815 1.00 0.00 O ATOM 869 OE2 GLU A 54 4.769 -32.265 47.260 1.00 0.00 O ATOM 0 H GLU A 54 2.921 -31.065 43.021 1.00 0.00 H new ATOM 0 HA GLU A 54 3.227 -33.762 42.299 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.264 -33.876 44.599 1.00 0.00 H new ATOM 0 HB3 GLU A 54 4.911 -32.610 43.574 1.00 0.00 H new ATOM 0 HG2 GLU A 54 3.459 -30.948 44.707 1.00 0.00 H new ATOM 0 HG3 GLU A 54 2.809 -32.213 45.731 1.00 0.00 H new ATOM 876 N ALA A 55 0.708 -33.150 44.237 1.00 0.00 N ATOM 877 CA ALA A 55 -0.439 -33.751 44.910 1.00 0.00 C ATOM 878 C ALA A 55 -1.128 -34.756 43.996 1.00 0.00 C ATOM 879 O ALA A 55 -1.519 -35.842 44.429 1.00 0.00 O ATOM 880 CB ALA A 55 -1.418 -32.671 45.348 1.00 0.00 C ATOM 0 H ALA A 55 0.647 -32.138 44.121 1.00 0.00 H new ATOM 0 HA ALA A 55 -0.085 -34.279 45.795 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -2.269 -33.133 45.849 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -0.921 -31.986 46.035 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.766 -32.120 44.475 1.00 0.00 H new ATOM 886 N GLY A 56 -1.264 -34.390 42.730 1.00 0.00 N ATOM 887 CA GLY A 56 -1.852 -35.285 41.759 1.00 0.00 C ATOM 888 C GLY A 56 -0.968 -36.473 41.482 1.00 0.00 C ATOM 889 O GLY A 56 -1.445 -37.597 41.336 1.00 0.00 O ATOM 0 H GLY A 56 -0.976 -33.485 42.358 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.820 -35.630 42.123 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.035 -34.744 40.830 1.00 0.00 H new ATOM 893 N VAL A 57 0.328 -36.222 41.419 1.00 0.00 N ATOM 894 CA VAL A 57 1.305 -37.257 41.138 1.00 0.00 C ATOM 895 C VAL A 57 1.312 -38.318 42.239 1.00 0.00 C ATOM 896 O VAL A 57 1.303 -39.512 41.957 1.00 0.00 O ATOM 897 CB VAL A 57 2.723 -36.651 40.987 1.00 0.00 C ATOM 898 CG1 VAL A 57 3.754 -37.737 40.727 1.00 0.00 C ATOM 899 CG2 VAL A 57 2.742 -35.621 39.868 1.00 0.00 C ATOM 0 H VAL A 57 0.731 -35.296 41.561 1.00 0.00 H new ATOM 0 HA VAL A 57 1.021 -37.730 40.198 1.00 0.00 H new ATOM 0 HB VAL A 57 2.982 -36.156 41.923 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.741 -37.285 40.625 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.761 -38.439 41.561 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.501 -38.267 39.809 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.745 -35.204 39.774 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.458 -36.098 38.930 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.037 -34.822 40.097 1.00 0.00 H new ATOM 909 N ALA A 58 1.293 -37.871 43.490 1.00 0.00 N ATOM 910 CA ALA A 58 1.316 -38.785 44.631 1.00 0.00 C ATOM 911 C ALA A 58 0.097 -39.707 44.624 1.00 0.00 C ATOM 912 O ALA A 58 0.211 -40.904 44.911 1.00 0.00 O ATOM 913 CB ALA A 58 1.384 -38.001 45.931 1.00 0.00 C ATOM 0 H ALA A 58 1.262 -36.883 43.742 1.00 0.00 H new ATOM 0 HA ALA A 58 2.207 -39.408 44.549 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.401 -38.693 46.773 1.00 0.00 H new ATOM 0 HB2 ALA A 58 2.289 -37.394 45.943 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.511 -37.353 46.011 1.00 0.00 H new ATOM 919 N LEU A 59 -1.062 -39.148 44.292 1.00 0.00 N ATOM 920 CA LEU A 59 -2.299 -39.922 44.210 1.00 0.00 C ATOM 921 C LEU A 59 -2.182 -40.978 43.116 1.00 0.00 C ATOM 922 O LEU A 59 -2.537 -42.143 43.312 1.00 0.00 O ATOM 923 CB LEU A 59 -3.474 -38.993 43.886 1.00 0.00 C ATOM 924 CG LEU A 59 -4.846 -39.662 43.734 1.00 0.00 C ATOM 925 CD1 LEU A 59 -5.360 -40.160 45.075 1.00 0.00 C ATOM 926 CD2 LEU A 59 -5.838 -38.710 43.102 1.00 0.00 C ATOM 0 H LEU A 59 -1.172 -38.158 44.074 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.471 -40.409 45.170 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.544 -38.243 44.673 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -3.247 -38.464 42.961 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.730 -40.523 43.076 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -6.334 -40.630 44.940 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.660 -40.888 45.486 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.455 -39.320 45.763 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -6.804 -39.204 43.003 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.945 -37.826 43.731 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.480 -38.413 42.116 1.00 0.00 H new ATOM 938 N LEU A 60 -1.663 -40.560 41.971 1.00 0.00 N ATOM 939 CA LEU A 60 -1.501 -41.437 40.832 1.00 0.00 C ATOM 940 C LEU A 60 -0.486 -42.543 41.109 1.00 0.00 C ATOM 941 O LEU A 60 -0.668 -43.677 40.662 1.00 0.00 O ATOM 942 CB LEU A 60 -1.136 -40.646 39.579 1.00 0.00 C ATOM 943 CG LEU A 60 -2.205 -39.648 39.090 1.00 0.00 C ATOM 944 CD1 LEU A 60 -1.797 -39.009 37.790 1.00 0.00 C ATOM 945 CD2 LEU A 60 -3.562 -40.313 38.941 1.00 0.00 C ATOM 0 H LEU A 60 -1.344 -39.604 41.810 1.00 0.00 H new ATOM 0 HA LEU A 60 -2.461 -41.922 40.653 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.214 -40.098 39.772 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.926 -41.350 38.774 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.288 -38.870 39.849 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.570 -38.310 37.470 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.858 -38.473 37.927 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.668 -39.780 37.030 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.290 -39.580 38.595 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.492 -41.125 38.217 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.879 -40.713 39.904 1.00 0.00 H new ATOM 957 N GLU A 61 0.592 -42.207 41.837 1.00 0.00 N ATOM 958 CA GLU A 61 1.607 -43.203 42.209 1.00 0.00 C ATOM 959 C GLU A 61 0.968 -44.367 42.945 1.00 0.00 C ATOM 960 O GLU A 61 1.295 -45.533 42.686 1.00 0.00 O ATOM 961 CB GLU A 61 2.704 -42.598 43.093 1.00 0.00 C ATOM 962 CG GLU A 61 3.612 -41.607 42.396 1.00 0.00 C ATOM 963 CD GLU A 61 4.704 -41.093 43.308 1.00 0.00 C ATOM 964 OE1 GLU A 61 4.385 -40.508 44.371 1.00 0.00 O ATOM 965 OE2 GLU A 61 5.895 -41.281 42.971 1.00 0.00 O ATOM 0 H GLU A 61 0.781 -41.264 42.176 1.00 0.00 H new ATOM 0 HA GLU A 61 2.061 -43.553 41.282 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.234 -42.102 43.942 1.00 0.00 H new ATOM 0 HB3 GLU A 61 3.314 -43.407 43.494 1.00 0.00 H new ATOM 0 HG2 GLU A 61 4.062 -42.081 41.524 1.00 0.00 H new ATOM 0 HG3 GLU A 61 3.020 -40.767 42.032 1.00 0.00 H new ATOM 972 N LYS A 62 0.045 -44.050 43.849 1.00 0.00 N ATOM 973 CA LYS A 62 -0.657 -45.066 44.611 1.00 0.00 C ATOM 974 C LYS A 62 -1.452 -45.964 43.675 1.00 0.00 C ATOM 975 O LYS A 62 -1.447 -47.190 43.812 1.00 0.00 O ATOM 976 CB LYS A 62 -1.598 -44.434 45.636 1.00 0.00 C ATOM 977 CG LYS A 62 -2.286 -45.454 46.507 1.00 0.00 C ATOM 978 CD LYS A 62 -3.174 -44.809 47.544 1.00 0.00 C ATOM 979 CE LYS A 62 -3.854 -45.868 48.395 1.00 0.00 C ATOM 980 NZ LYS A 62 -2.870 -46.711 49.126 1.00 0.00 N ATOM 0 H LYS A 62 -0.231 -43.093 44.069 1.00 0.00 H new ATOM 0 HA LYS A 62 0.086 -45.660 45.144 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -1.033 -43.748 46.266 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.350 -43.842 45.115 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -2.882 -46.120 45.883 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -1.537 -46.070 47.004 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -2.582 -44.149 48.178 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -3.926 -44.190 47.054 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -4.520 -45.386 49.110 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -4.473 -46.501 47.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -3.357 -47.241 49.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -2.425 -47.378 48.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -2.140 -46.104 49.550 1.00 0.00 H new ATOM 994 N ILE A 63 -2.118 -45.342 42.716 1.00 0.00 N ATOM 995 CA ILE A 63 -2.915 -46.063 41.743 1.00 0.00 C ATOM 996 C ILE A 63 -2.045 -46.990 40.913 1.00 0.00 C ATOM 997 O ILE A 63 -2.395 -48.151 40.707 1.00 0.00 O ATOM 998 CB ILE A 63 -3.681 -45.106 40.807 1.00 0.00 C ATOM 999 CG1 ILE A 63 -4.538 -44.139 41.624 1.00 0.00 C ATOM 1000 CG2 ILE A 63 -4.534 -45.889 39.826 1.00 0.00 C ATOM 1001 CD1 ILE A 63 -5.217 -43.077 40.792 1.00 0.00 C ATOM 0 H ILE A 63 -2.120 -44.330 42.592 1.00 0.00 H new ATOM 0 HA ILE A 63 -3.642 -46.652 42.303 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.958 -44.524 40.235 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.297 -44.706 42.162 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.911 -43.655 42.373 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -5.067 -45.197 39.174 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -3.896 -46.536 39.224 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.253 -46.498 40.374 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.807 -42.429 41.440 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.464 -42.484 40.274 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.871 -43.551 40.061 1.00 0.00 H new ATOM 1013 N TRP A 64 -0.904 -46.483 40.452 1.00 0.00 N ATOM 1014 CA TRP A 64 0.017 -47.290 39.663 1.00 0.00 C ATOM 1015 C TRP A 64 0.451 -48.534 40.430 1.00 0.00 C ATOM 1016 O TRP A 64 0.502 -49.624 39.874 1.00 0.00 O ATOM 1017 CB TRP A 64 1.249 -46.477 39.218 1.00 0.00 C ATOM 1018 CG TRP A 64 2.340 -47.340 38.647 1.00 0.00 C ATOM 1019 CD1 TRP A 64 3.606 -47.481 39.131 1.00 0.00 C ATOM 1020 CD2 TRP A 64 2.250 -48.215 37.513 1.00 0.00 C ATOM 1021 NE1 TRP A 64 4.302 -48.378 38.360 1.00 0.00 N ATOM 1022 CE2 TRP A 64 3.499 -48.839 37.374 1.00 0.00 C ATOM 1023 CE3 TRP A 64 1.238 -48.532 36.603 1.00 0.00 C ATOM 1024 CZ2 TRP A 64 3.766 -49.758 36.373 1.00 0.00 C ATOM 1025 CZ3 TRP A 64 1.512 -49.447 35.605 1.00 0.00 C ATOM 1026 CH2 TRP A 64 2.768 -50.049 35.505 1.00 0.00 C ATOM 0 H TRP A 64 -0.598 -45.523 40.611 1.00 0.00 H new ATOM 0 HA TRP A 64 -0.518 -47.604 38.767 1.00 0.00 H new ATOM 0 HB2 TRP A 64 0.944 -45.743 38.472 1.00 0.00 H new ATOM 0 HB3 TRP A 64 1.640 -45.922 40.071 1.00 0.00 H new ATOM 0 HD1 TRP A 64 4.002 -46.964 39.992 1.00 0.00 H new ATOM 0 HE1 TRP A 64 5.273 -48.654 38.507 1.00 0.00 H new ATOM 0 HE3 TRP A 64 0.264 -48.072 36.678 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 4.736 -50.226 36.288 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 0.743 -49.701 34.891 1.00 0.00 H new ATOM 0 HH2 TRP A 64 2.948 -50.764 34.716 1.00 0.00 H new ATOM 1037 N THR A 65 0.710 -48.371 41.716 1.00 0.00 N ATOM 1038 CA THR A 65 1.150 -49.479 42.549 1.00 0.00 C ATOM 1039 C THR A 65 0.054 -50.569 42.628 1.00 0.00 C ATOM 1040 O THR A 65 0.342 -51.748 42.848 1.00 0.00 O ATOM 1041 CB THR A 65 1.508 -48.982 43.969 1.00 0.00 C ATOM 1042 OG1 THR A 65 2.418 -47.868 43.871 1.00 0.00 O ATOM 1043 CG2 THR A 65 2.164 -50.088 44.789 1.00 0.00 C ATOM 0 H THR A 65 0.623 -47.481 42.207 1.00 0.00 H new ATOM 0 HA THR A 65 2.041 -49.913 42.095 1.00 0.00 H new ATOM 0 HB THR A 65 0.587 -48.678 44.467 1.00 0.00 H new ATOM 0 HG1 THR A 65 1.933 -47.076 43.558 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.405 -49.710 45.783 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.478 -50.931 44.878 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.078 -50.415 44.294 1.00 0.00 H new ATOM 1051 N MET A 66 -1.192 -50.165 42.438 1.00 0.00 N ATOM 1052 CA MET A 66 -2.312 -51.087 42.476 1.00 0.00 C ATOM 1053 C MET A 66 -2.605 -51.689 41.088 1.00 0.00 C ATOM 1054 O MET A 66 -2.832 -52.891 40.956 1.00 0.00 O ATOM 1055 CB MET A 66 -3.561 -50.372 42.997 1.00 0.00 C ATOM 1056 CG MET A 66 -3.477 -49.960 44.456 1.00 0.00 C ATOM 1057 SD MET A 66 -4.945 -49.063 45.010 1.00 0.00 S ATOM 1058 CE MET A 66 -6.197 -50.338 44.861 1.00 0.00 C ATOM 0 H MET A 66 -1.453 -49.196 42.255 1.00 0.00 H new ATOM 0 HA MET A 66 -2.044 -51.902 43.148 1.00 0.00 H new ATOM 0 HB2 MET A 66 -3.738 -49.484 42.390 1.00 0.00 H new ATOM 0 HB3 MET A 66 -4.423 -51.026 42.864 1.00 0.00 H new ATOM 0 HG2 MET A 66 -3.344 -50.848 45.074 1.00 0.00 H new ATOM 0 HG3 MET A 66 -2.596 -49.335 44.603 1.00 0.00 H new ATOM 0 HE1 MET A 66 -7.125 -49.991 45.315 1.00 0.00 H new ATOM 0 HE2 MET A 66 -6.368 -50.558 43.807 1.00 0.00 H new ATOM 0 HE3 MET A 66 -5.859 -51.241 45.370 1.00 0.00 H new ATOM 1068 N ILE A 67 -2.576 -50.850 40.060 1.00 0.00 N ATOM 1069 CA ILE A 67 -2.961 -51.268 38.707 1.00 0.00 C ATOM 1070 C ILE A 67 -1.842 -51.997 37.965 1.00 0.00 C ATOM 1071 O ILE A 67 -2.111 -52.706 36.996 1.00 0.00 O ATOM 1072 CB ILE A 67 -3.426 -50.065 37.853 1.00 0.00 C ATOM 1073 CG1 ILE A 67 -2.297 -49.055 37.719 1.00 0.00 C ATOM 1074 CG2 ILE A 67 -4.652 -49.419 38.462 1.00 0.00 C ATOM 1075 CD1 ILE A 67 -2.621 -47.892 36.820 1.00 0.00 C ATOM 0 H ILE A 67 -2.290 -49.874 40.132 1.00 0.00 H new ATOM 0 HA ILE A 67 -3.788 -51.965 38.845 1.00 0.00 H new ATOM 0 HB ILE A 67 -3.693 -50.424 36.859 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -2.042 -48.676 38.709 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -1.412 -49.563 37.335 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -4.963 -48.575 37.846 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.460 -50.148 38.513 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -4.417 -49.068 39.467 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -1.766 -47.217 36.776 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -2.846 -48.258 35.818 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -3.486 -47.358 37.214 1.00 0.00 H new ATOM 1087 N GLU A 68 -0.596 -51.846 38.425 1.00 0.00 N ATOM 1088 CA GLU A 68 0.558 -52.463 37.758 1.00 0.00 C ATOM 1089 C GLU A 68 0.424 -53.989 37.680 1.00 0.00 C ATOM 1090 O GLU A 68 1.143 -54.657 36.923 1.00 0.00 O ATOM 1091 CB GLU A 68 1.866 -52.076 38.449 1.00 0.00 C ATOM 1092 CG GLU A 68 2.017 -52.608 39.861 1.00 0.00 C ATOM 1093 CD GLU A 68 3.360 -52.259 40.469 1.00 0.00 C ATOM 1094 OE1 GLU A 68 4.381 -52.815 40.006 1.00 0.00 O ATOM 1095 OE2 GLU A 68 3.407 -51.449 41.416 1.00 0.00 O ATOM 0 H GLU A 68 -0.359 -51.303 39.255 1.00 0.00 H new ATOM 0 HA GLU A 68 0.579 -52.079 36.738 1.00 0.00 H new ATOM 0 HB2 GLU A 68 2.700 -52.438 37.848 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.940 -50.989 38.475 1.00 0.00 H new ATOM 0 HG2 GLU A 68 1.222 -52.202 40.486 1.00 0.00 H new ATOM 0 HG3 GLU A 68 1.895 -53.691 39.853 1.00 0.00 H new ATOM 1102 N ASN A 69 -0.490 -54.533 38.466 1.00 0.00 N ATOM 1103 CA ASN A 69 -0.757 -55.960 38.477 1.00 0.00 C ATOM 1104 C ASN A 69 -1.280 -56.420 37.121 1.00 0.00 C ATOM 1105 O ASN A 69 -0.893 -57.472 36.626 1.00 0.00 O ATOM 1106 CB ASN A 69 -1.794 -56.297 39.547 1.00 0.00 C ATOM 1107 CG ASN A 69 -1.292 -56.082 40.957 1.00 0.00 C ATOM 1108 OD1 ASN A 69 -0.106 -56.243 41.246 1.00 0.00 O ATOM 1109 ND2 ASN A 69 -2.192 -55.700 41.842 1.00 0.00 N ATOM 0 H ASN A 69 -1.067 -53.997 39.114 1.00 0.00 H new ATOM 0 HA ASN A 69 0.179 -56.474 38.697 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -2.682 -55.685 39.388 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -2.099 -57.337 39.432 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -1.915 -55.526 42.808 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -3.165 -55.578 41.560 1.00 0.00 H new ATOM 1116 N GLU A 70 -2.151 -55.609 36.523 1.00 0.00 N ATOM 1117 CA GLU A 70 -2.769 -55.955 35.244 1.00 0.00 C ATOM 1118 C GLU A 70 -2.370 -54.964 34.138 1.00 0.00 C ATOM 1119 O GLU A 70 -2.642 -55.197 32.954 1.00 0.00 O ATOM 1120 CB GLU A 70 -4.299 -55.970 35.391 1.00 0.00 C ATOM 1121 CG GLU A 70 -4.817 -56.893 36.490 1.00 0.00 C ATOM 1122 CD GLU A 70 -4.607 -58.364 36.195 1.00 0.00 C ATOM 1123 OE1 GLU A 70 -3.465 -58.844 36.300 1.00 0.00 O ATOM 1124 OE2 GLU A 70 -5.594 -59.058 35.896 1.00 0.00 O ATOM 0 H GLU A 70 -2.444 -54.709 36.903 1.00 0.00 H new ATOM 0 HA GLU A 70 -2.413 -56.945 34.959 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -4.642 -54.956 35.593 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -4.740 -56.272 34.441 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -4.319 -56.644 37.427 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -5.881 -56.709 36.636 1.00 0.00 H new ATOM 1131 N ALA A 71 -1.722 -53.871 34.524 1.00 0.00 N ATOM 1132 CA ALA A 71 -1.359 -52.816 33.580 1.00 0.00 C ATOM 1133 C ALA A 71 0.137 -52.552 33.547 1.00 0.00 C ATOM 1134 O ALA A 71 0.872 -52.920 34.465 1.00 0.00 O ATOM 1135 CB ALA A 71 -2.089 -51.527 33.925 1.00 0.00 C ATOM 0 H ALA A 71 -1.436 -53.690 35.486 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.657 -53.164 32.591 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -1.810 -50.749 33.214 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -3.165 -51.694 33.876 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -1.816 -51.213 34.932 1.00 0.00 H new ATOM 1141 N ASN A 72 0.573 -51.932 32.468 1.00 0.00 N ATOM 1142 CA ASN A 72 1.949 -51.524 32.286 1.00 0.00 C ATOM 1143 C ASN A 72 2.028 -50.009 32.202 1.00 0.00 C ATOM 1144 O ASN A 72 1.048 -49.335 31.861 1.00 0.00 O ATOM 1145 CB ASN A 72 2.558 -52.142 31.029 1.00 0.00 C ATOM 1146 CG ASN A 72 2.871 -53.620 31.186 1.00 0.00 C ATOM 1147 OD1 ASN A 72 2.331 -54.292 32.059 1.00 0.00 O ATOM 1148 ND2 ASN A 72 3.735 -54.137 30.335 1.00 0.00 N ATOM 0 H ASN A 72 -0.031 -51.694 31.681 1.00 0.00 H new ATOM 0 HA ASN A 72 2.520 -51.878 33.144 1.00 0.00 H new ATOM 0 HB2 ASN A 72 1.869 -52.009 30.195 1.00 0.00 H new ATOM 0 HB3 ASN A 72 3.473 -51.607 30.775 1.00 0.00 H new ATOM 0 HD21 ASN A 72 3.974 -55.127 30.389 1.00 0.00 H new ATOM 0 HD22 ASN A 72 4.164 -53.547 29.622 1.00 0.00 H new ATOM 1155 N ARG A 73 3.184 -49.494 32.506 1.00 0.00 N ATOM 1156 CA ARG A 73 3.420 -48.081 32.556 1.00 0.00 C ATOM 1157 C ARG A 73 3.766 -47.538 31.181 1.00 0.00 C ATOM 1158 O ARG A 73 4.852 -47.780 30.659 1.00 0.00 O ATOM 1159 CB ARG A 73 4.558 -47.850 33.540 1.00 0.00 C ATOM 1160 CG ARG A 73 4.931 -46.419 33.796 1.00 0.00 C ATOM 1161 CD ARG A 73 5.969 -46.338 34.912 1.00 0.00 C ATOM 1162 NE ARG A 73 6.438 -44.972 35.162 1.00 0.00 N ATOM 1163 CZ ARG A 73 7.086 -44.596 36.276 1.00 0.00 C ATOM 1164 NH1 ARG A 73 7.281 -45.466 37.261 1.00 0.00 N ATOM 1165 NH2 ARG A 73 7.540 -43.354 36.400 1.00 0.00 N ATOM 0 H ARG A 73 4.005 -50.056 32.730 1.00 0.00 H new ATOM 0 HA ARG A 73 2.523 -47.554 32.881 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.288 -48.309 34.491 1.00 0.00 H new ATOM 0 HB3 ARG A 73 5.440 -48.374 33.173 1.00 0.00 H new ATOM 0 HG2 ARG A 73 5.329 -45.971 32.886 1.00 0.00 H new ATOM 0 HG3 ARG A 73 4.044 -45.848 34.071 1.00 0.00 H new ATOM 0 HD2 ARG A 73 5.540 -46.742 35.829 1.00 0.00 H new ATOM 0 HD3 ARG A 73 6.821 -46.967 34.654 1.00 0.00 H new ATOM 0 HE ARG A 73 6.262 -44.266 34.448 1.00 0.00 H new ATOM 0 HH11 ARG A 73 6.938 -46.422 37.172 1.00 0.00 H new ATOM 0 HH12 ARG A 73 7.774 -45.177 38.106 1.00 0.00 H new ATOM 0 HH21 ARG A 73 7.397 -42.681 35.647 1.00 0.00 H new ATOM 0 HH22 ARG A 73 8.032 -43.073 37.248 1.00 0.00 H new ATOM 1179 N ASP A 74 2.822 -46.831 30.589 1.00 0.00 N ATOM 1180 CA ASP A 74 3.030 -46.222 29.283 1.00 0.00 C ATOM 1181 C ASP A 74 3.767 -44.908 29.435 1.00 0.00 C ATOM 1182 O ASP A 74 4.615 -44.548 28.608 1.00 0.00 O ATOM 1183 CB ASP A 74 1.699 -45.992 28.574 1.00 0.00 C ATOM 1184 CG ASP A 74 1.873 -45.604 27.114 1.00 0.00 C ATOM 1185 OD1 ASP A 74 2.058 -46.510 26.274 1.00 0.00 O ATOM 1186 OD2 ASP A 74 1.819 -44.393 26.800 1.00 0.00 O ATOM 0 H ASP A 74 1.900 -46.662 30.991 1.00 0.00 H new ATOM 0 HA ASP A 74 3.630 -46.903 28.679 1.00 0.00 H new ATOM 0 HB2 ASP A 74 1.097 -46.899 28.636 1.00 0.00 H new ATOM 0 HB3 ASP A 74 1.147 -45.207 29.091 1.00 0.00 H new ATOM 1191 N LYS A 75 3.444 -44.191 30.504 1.00 0.00 N ATOM 1192 CA LYS A 75 4.045 -42.902 30.770 1.00 0.00 C ATOM 1193 C LYS A 75 3.879 -42.548 32.241 1.00 0.00 C ATOM 1194 O LYS A 75 3.020 -43.109 32.927 1.00 0.00 O ATOM 1195 CB LYS A 75 3.398 -41.813 29.895 1.00 0.00 C ATOM 1196 CG LYS A 75 4.109 -40.471 29.960 1.00 0.00 C ATOM 1197 CD LYS A 75 3.471 -39.447 29.043 1.00 0.00 C ATOM 1198 CE LYS A 75 4.208 -38.122 29.114 1.00 0.00 C ATOM 1199 NZ LYS A 75 5.628 -38.258 28.682 1.00 0.00 N ATOM 0 H LYS A 75 2.763 -44.489 31.203 1.00 0.00 H new ATOM 0 HA LYS A 75 5.107 -42.957 30.529 1.00 0.00 H new ATOM 0 HB2 LYS A 75 3.380 -42.155 28.860 1.00 0.00 H new ATOM 0 HB3 LYS A 75 2.361 -41.680 30.204 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.092 -40.101 30.985 1.00 0.00 H new ATOM 0 HG3 LYS A 75 5.156 -40.601 29.686 1.00 0.00 H new ATOM 0 HD2 LYS A 75 3.478 -39.817 28.018 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.427 -39.303 29.323 1.00 0.00 H new ATOM 0 HE2 LYS A 75 3.704 -37.391 28.482 1.00 0.00 H new ATOM 0 HE3 LYS A 75 4.173 -37.740 30.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 6.022 -37.316 28.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 6.179 -38.711 29.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 5.675 -38.842 27.823 1.00 0.00 H new ATOM 1213 N GLU A 76 4.698 -41.636 32.720 1.00 0.00 N ATOM 1214 CA GLU A 76 4.620 -41.184 34.087 1.00 0.00 C ATOM 1215 C GLU A 76 3.578 -40.077 34.206 1.00 0.00 C ATOM 1216 O GLU A 76 3.264 -39.415 33.213 1.00 0.00 O ATOM 1217 CB GLU A 76 5.987 -40.678 34.550 1.00 0.00 C ATOM 1218 CG GLU A 76 6.599 -39.635 33.631 1.00 0.00 C ATOM 1219 CD GLU A 76 7.921 -39.122 34.140 1.00 0.00 C ATOM 1220 OE1 GLU A 76 8.924 -39.861 34.049 1.00 0.00 O ATOM 1221 OE2 GLU A 76 7.965 -37.977 34.632 1.00 0.00 O ATOM 0 H GLU A 76 5.434 -41.190 32.172 1.00 0.00 H new ATOM 0 HA GLU A 76 4.323 -42.018 34.723 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.888 -40.254 35.549 1.00 0.00 H new ATOM 0 HB3 GLU A 76 6.669 -41.524 34.629 1.00 0.00 H new ATOM 0 HG2 GLU A 76 6.738 -40.066 32.639 1.00 0.00 H new ATOM 0 HG3 GLU A 76 5.907 -38.800 33.522 1.00 0.00 H new ATOM 1228 N PRO A 77 3.008 -39.877 35.409 1.00 0.00 N ATOM 1229 CA PRO A 77 2.020 -38.820 35.646 1.00 0.00 C ATOM 1230 C PRO A 77 2.569 -37.442 35.291 1.00 0.00 C ATOM 1231 O PRO A 77 3.679 -37.079 35.689 1.00 0.00 O ATOM 1232 CB PRO A 77 1.741 -38.913 37.160 1.00 0.00 C ATOM 1233 CG PRO A 77 2.877 -39.712 37.710 1.00 0.00 C ATOM 1234 CD PRO A 77 3.266 -40.663 36.624 1.00 0.00 C ATOM 0 HA PRO A 77 1.128 -38.948 35.032 1.00 0.00 H new ATOM 0 HB2 PRO A 77 1.696 -37.924 37.615 1.00 0.00 H new ATOM 0 HB3 PRO A 77 0.785 -39.398 37.357 1.00 0.00 H new ATOM 0 HG2 PRO A 77 3.712 -39.068 37.984 1.00 0.00 H new ATOM 0 HG3 PRO A 77 2.579 -40.248 38.611 1.00 0.00 H new ATOM 0 HD2 PRO A 77 4.312 -40.961 36.700 1.00 0.00 H new ATOM 0 HD3 PRO A 77 2.671 -41.576 36.651 1.00 0.00 H new ATOM 1242 N ASN A 78 1.786 -36.679 34.558 1.00 0.00 N ATOM 1243 CA ASN A 78 2.193 -35.356 34.129 1.00 0.00 C ATOM 1244 C ASN A 78 1.138 -34.337 34.495 1.00 0.00 C ATOM 1245 O ASN A 78 -0.054 -34.571 34.287 1.00 0.00 O ATOM 1246 CB ASN A 78 2.413 -35.321 32.614 1.00 0.00 C ATOM 1247 CG ASN A 78 3.021 -34.010 32.148 1.00 0.00 C ATOM 1248 OD1 ASN A 78 3.850 -33.421 32.841 1.00 0.00 O ATOM 1249 ND2 ASN A 78 2.595 -33.526 30.996 1.00 0.00 N ATOM 0 H ASN A 78 0.856 -36.955 34.244 1.00 0.00 H new ATOM 0 HA ASN A 78 3.128 -35.114 34.634 1.00 0.00 H new ATOM 0 HB2 ASN A 78 3.066 -36.144 32.325 1.00 0.00 H new ATOM 0 HB3 ASN A 78 1.461 -35.477 32.107 1.00 0.00 H new ATOM 0 HD21 ASN A 78 2.954 -32.635 30.653 1.00 0.00 H new ATOM 0 HD22 ASN A 78 1.907 -34.043 30.449 1.00 0.00 H new ATOM 1256 N PHE A 79 1.569 -33.225 35.051 1.00 0.00 N ATOM 1257 CA PHE A 79 0.655 -32.151 35.385 1.00 0.00 C ATOM 1258 C PHE A 79 0.388 -31.315 34.144 1.00 0.00 C ATOM 1259 O PHE A 79 1.293 -30.658 33.617 1.00 0.00 O ATOM 1260 CB PHE A 79 1.233 -31.283 36.514 1.00 0.00 C ATOM 1261 CG PHE A 79 0.412 -30.059 36.839 1.00 0.00 C ATOM 1262 CD1 PHE A 79 -0.728 -30.155 37.620 1.00 0.00 C ATOM 1263 CD2 PHE A 79 0.794 -28.810 36.371 1.00 0.00 C ATOM 1264 CE1 PHE A 79 -1.472 -29.034 37.924 1.00 0.00 C ATOM 1265 CE2 PHE A 79 0.051 -27.686 36.673 1.00 0.00 C ATOM 1266 CZ PHE A 79 -1.081 -27.798 37.450 1.00 0.00 C ATOM 0 H PHE A 79 2.545 -33.040 35.282 1.00 0.00 H new ATOM 0 HA PHE A 79 -0.285 -32.574 35.738 1.00 0.00 H new ATOM 0 HB2 PHE A 79 1.327 -31.892 37.413 1.00 0.00 H new ATOM 0 HB3 PHE A 79 2.239 -30.968 36.236 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.038 -31.119 37.995 1.00 0.00 H new ATOM 0 HD2 PHE A 79 1.682 -28.716 35.764 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -2.360 -29.123 38.532 1.00 0.00 H new ATOM 0 HE2 PHE A 79 0.357 -26.720 36.300 1.00 0.00 H new ATOM 0 HZ PHE A 79 -1.662 -26.919 37.688 1.00 0.00 H new ATOM 1276 N GLU A 80 -0.838 -31.356 33.680 1.00 0.00 N ATOM 1277 CA GLU A 80 -1.232 -30.647 32.487 1.00 0.00 C ATOM 1278 C GLU A 80 -2.438 -29.782 32.740 1.00 0.00 C ATOM 1279 O GLU A 80 -3.537 -30.281 33.017 1.00 0.00 O ATOM 1280 CB GLU A 80 -1.504 -31.620 31.358 1.00 0.00 C ATOM 1281 CG GLU A 80 -0.264 -32.290 30.857 1.00 0.00 C ATOM 1282 CD GLU A 80 -0.540 -33.298 29.770 1.00 0.00 C ATOM 1283 OE1 GLU A 80 -1.402 -34.176 29.969 1.00 0.00 O ATOM 1284 OE2 GLU A 80 0.099 -33.216 28.706 1.00 0.00 O ATOM 0 H GLU A 80 -1.592 -31.883 34.120 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.408 -29.996 32.196 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -2.208 -32.379 31.700 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -1.982 -31.089 30.535 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.424 -31.534 30.478 1.00 0.00 H new ATOM 0 HG3 GLU A 80 0.235 -32.787 31.688 1.00 0.00 H new ATOM 1291 N GLY A 81 -2.235 -28.494 32.633 1.00 0.00 N ATOM 1292 CA GLY A 81 -3.290 -27.561 32.867 1.00 0.00 C ATOM 1293 C GLY A 81 -3.667 -27.498 34.334 1.00 0.00 C ATOM 1294 O GLY A 81 -2.945 -26.927 35.145 1.00 0.00 O ATOM 0 H GLY A 81 -1.340 -28.072 32.383 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -2.983 -26.572 32.527 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.163 -27.844 32.279 1.00 0.00 H new ATOM 1298 N ARG A 82 -4.802 -28.079 34.664 1.00 0.00 N ATOM 1299 CA ARG A 82 -5.273 -28.136 36.039 1.00 0.00 C ATOM 1300 C ARG A 82 -5.463 -29.586 36.478 1.00 0.00 C ATOM 1301 O ARG A 82 -5.988 -29.863 37.560 1.00 0.00 O ATOM 1302 CB ARG A 82 -6.581 -27.361 36.180 1.00 0.00 C ATOM 1303 CG ARG A 82 -6.422 -25.865 35.989 1.00 0.00 C ATOM 1304 CD ARG A 82 -7.760 -25.161 36.033 1.00 0.00 C ATOM 1305 NE ARG A 82 -8.578 -25.474 34.863 1.00 0.00 N ATOM 1306 CZ ARG A 82 -9.895 -25.282 34.787 1.00 0.00 C ATOM 1307 NH1 ARG A 82 -10.571 -24.818 35.835 1.00 0.00 N ATOM 1308 NH2 ARG A 82 -10.535 -25.560 33.659 1.00 0.00 N ATOM 0 H ARG A 82 -5.425 -28.525 33.991 1.00 0.00 H new ATOM 0 HA ARG A 82 -4.524 -27.677 36.684 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -7.298 -27.738 35.451 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -7.002 -27.550 37.168 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.772 -25.464 36.766 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -5.936 -25.668 35.034 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -8.294 -25.452 36.938 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -7.602 -24.084 36.088 1.00 0.00 H new ATOM 0 HE ARG A 82 -8.108 -25.867 34.047 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -10.082 -24.606 36.705 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -11.579 -24.674 35.769 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -10.020 -25.919 32.855 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -11.543 -25.415 33.595 1.00 0.00 H new ATOM 1322 N TYR A 83 -5.029 -30.505 35.629 1.00 0.00 N ATOM 1323 CA TYR A 83 -5.162 -31.930 35.893 1.00 0.00 C ATOM 1324 C TYR A 83 -3.811 -32.620 35.847 1.00 0.00 C ATOM 1325 O TYR A 83 -2.913 -32.199 35.127 1.00 0.00 O ATOM 1326 CB TYR A 83 -6.084 -32.595 34.855 1.00 0.00 C ATOM 1327 CG TYR A 83 -7.535 -32.169 34.904 1.00 0.00 C ATOM 1328 CD1 TYR A 83 -7.958 -30.991 34.306 1.00 0.00 C ATOM 1329 CD2 TYR A 83 -8.485 -32.966 35.528 1.00 0.00 C ATOM 1330 CE1 TYR A 83 -9.288 -30.616 34.332 1.00 0.00 C ATOM 1331 CE2 TYR A 83 -9.815 -32.599 35.561 1.00 0.00 C ATOM 1332 CZ TYR A 83 -10.211 -31.425 34.961 1.00 0.00 C ATOM 1333 OH TYR A 83 -11.539 -31.059 34.984 1.00 0.00 O ATOM 0 H TYR A 83 -4.577 -30.286 34.741 1.00 0.00 H new ATOM 0 HA TYR A 83 -5.592 -32.034 36.889 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.694 -32.382 33.860 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -6.036 -33.675 34.992 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.237 -30.357 33.812 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -8.178 -33.890 35.996 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -9.602 -29.695 33.863 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -10.540 -33.229 36.054 1.00 0.00 H new ATOM 0 HH TYR A 83 -12.057 -31.738 35.465 1.00 0.00 H new ATOM 1343 N VAL A 84 -3.673 -33.666 36.620 1.00 0.00 N ATOM 1344 CA VAL A 84 -2.489 -34.499 36.568 1.00 0.00 C ATOM 1345 C VAL A 84 -2.911 -35.813 35.931 1.00 0.00 C ATOM 1346 O VAL A 84 -3.875 -36.436 36.377 1.00 0.00 O ATOM 1347 CB VAL A 84 -1.903 -34.744 37.985 1.00 0.00 C ATOM 1348 CG1 VAL A 84 -0.766 -35.740 37.948 1.00 0.00 C ATOM 1349 CG2 VAL A 84 -1.436 -33.444 38.602 1.00 0.00 C ATOM 0 H VAL A 84 -4.370 -33.967 37.301 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.705 -34.010 35.990 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.699 -35.161 38.601 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.379 -35.888 38.956 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -1.127 -36.690 37.555 1.00 0.00 H new ATOM 0 HG13 VAL A 84 0.029 -35.361 37.306 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -1.029 -33.638 39.594 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.664 -33.000 37.974 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -2.278 -32.757 38.683 1.00 0.00 H new ATOM 1359 N ASN A 85 -2.218 -36.220 34.884 1.00 0.00 N ATOM 1360 CA ASN A 85 -2.657 -37.373 34.110 1.00 0.00 C ATOM 1361 C ASN A 85 -1.579 -38.444 34.015 1.00 0.00 C ATOM 1362 O ASN A 85 -0.400 -38.137 33.839 1.00 0.00 O ATOM 1363 CB ASN A 85 -3.061 -36.937 32.684 1.00 0.00 C ATOM 1364 CG ASN A 85 -3.859 -35.635 32.650 1.00 0.00 C ATOM 1365 OD1 ASN A 85 -5.048 -35.612 32.941 1.00 0.00 O ATOM 1366 ND2 ASN A 85 -3.216 -34.554 32.257 1.00 0.00 N ATOM 0 H ASN A 85 -1.361 -35.779 34.551 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.515 -37.798 34.631 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -2.161 -36.819 32.080 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -3.652 -37.729 32.224 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -3.709 -33.664 32.188 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -2.225 -34.607 32.022 1.00 0.00 H new ATOM 1373 N MET A 86 -1.997 -39.691 34.137 1.00 0.00 N ATOM 1374 CA MET A 86 -1.116 -40.849 33.967 1.00 0.00 C ATOM 1375 C MET A 86 -1.771 -41.828 33.007 1.00 0.00 C ATOM 1376 O MET A 86 -2.940 -42.190 33.181 1.00 0.00 O ATOM 1377 CB MET A 86 -0.840 -41.547 35.313 1.00 0.00 C ATOM 1378 CG MET A 86 0.128 -42.735 35.220 1.00 0.00 C ATOM 1379 SD MET A 86 0.448 -43.500 36.827 1.00 0.00 S ATOM 1380 CE MET A 86 -1.176 -44.159 37.229 1.00 0.00 C ATOM 0 H MET A 86 -2.962 -39.938 34.358 1.00 0.00 H new ATOM 0 HA MET A 86 -0.162 -40.506 33.567 1.00 0.00 H new ATOM 0 HB2 MET A 86 -0.434 -40.816 36.012 1.00 0.00 H new ATOM 0 HB3 MET A 86 -1.785 -41.895 35.729 1.00 0.00 H new ATOM 0 HG2 MET A 86 -0.284 -43.482 34.542 1.00 0.00 H new ATOM 0 HG3 MET A 86 1.070 -42.398 34.788 1.00 0.00 H new ATOM 0 HE1 MET A 86 -1.073 -45.177 37.605 1.00 0.00 H new ATOM 0 HE2 MET A 86 -1.643 -43.536 37.992 1.00 0.00 H new ATOM 0 HE3 MET A 86 -1.798 -44.165 36.334 1.00 0.00 H new ATOM 1390 N LEU A 87 -1.036 -42.250 31.997 1.00 0.00 N ATOM 1391 CA LEU A 87 -1.582 -43.157 31.010 1.00 0.00 C ATOM 1392 C LEU A 87 -0.974 -44.538 31.180 1.00 0.00 C ATOM 1393 O LEU A 87 0.254 -44.693 31.221 1.00 0.00 O ATOM 1394 CB LEU A 87 -1.335 -42.619 29.585 1.00 0.00 C ATOM 1395 CG LEU A 87 -2.130 -43.281 28.434 1.00 0.00 C ATOM 1396 CD1 LEU A 87 -1.537 -44.616 28.033 1.00 0.00 C ATOM 1397 CD2 LEU A 87 -3.596 -43.443 28.812 1.00 0.00 C ATOM 0 H LEU A 87 -0.065 -41.981 31.840 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.659 -43.233 31.159 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.560 -41.553 29.582 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -0.272 -42.721 29.364 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.062 -42.617 27.572 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.125 -45.047 27.222 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.509 -44.472 27.699 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.549 -45.291 28.889 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.135 -43.910 27.988 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.676 -44.070 29.700 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.029 -42.464 29.020 1.00 0.00 H new ATOM 1409 N VAL A 88 -1.834 -45.530 31.291 1.00 0.00 N ATOM 1410 CA VAL A 88 -1.403 -46.907 31.448 1.00 0.00 C ATOM 1411 C VAL A 88 -1.977 -47.783 30.358 1.00 0.00 C ATOM 1412 O VAL A 88 -3.098 -47.563 29.889 1.00 0.00 O ATOM 1413 CB VAL A 88 -1.788 -47.489 32.825 1.00 0.00 C ATOM 1414 CG1 VAL A 88 -1.011 -46.799 33.927 1.00 0.00 C ATOM 1415 CG2 VAL A 88 -3.298 -47.376 33.067 1.00 0.00 C ATOM 0 H VAL A 88 -2.846 -45.407 31.275 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.316 -46.898 31.374 1.00 0.00 H new ATOM 0 HB VAL A 88 -1.528 -48.548 32.833 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -1.294 -47.221 34.891 1.00 0.00 H new ATOM 0 HG12 VAL A 88 0.057 -46.946 33.766 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -1.236 -45.732 33.918 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -3.542 -47.793 34.044 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -3.594 -46.327 33.036 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -3.833 -47.927 32.293 1.00 0.00 H new ATOM 1425 N THR A 89 -1.208 -48.754 29.952 1.00 0.00 N ATOM 1426 CA THR A 89 -1.616 -49.672 28.929 1.00 0.00 C ATOM 1427 C THR A 89 -1.727 -51.066 29.526 1.00 0.00 C ATOM 1428 O THR A 89 -0.861 -51.477 30.274 1.00 0.00 O ATOM 1429 CB THR A 89 -0.587 -49.692 27.782 1.00 0.00 C ATOM 1430 OG1 THR A 89 -0.355 -48.359 27.298 1.00 0.00 O ATOM 1431 CG2 THR A 89 -1.050 -50.556 26.640 1.00 0.00 C ATOM 0 H THR A 89 -0.275 -48.931 30.325 1.00 0.00 H new ATOM 0 HA THR A 89 -2.580 -49.355 28.532 1.00 0.00 H new ATOM 0 HB THR A 89 0.338 -50.108 28.181 1.00 0.00 H new ATOM 0 HG1 THR A 89 -1.213 -47.905 27.166 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.300 -50.547 25.849 1.00 0.00 H new ATOM 0 HG22 THR A 89 -1.194 -51.578 26.992 1.00 0.00 H new ATOM 0 HG23 THR A 89 -1.992 -50.170 26.251 1.00 0.00 H new ATOM 1439 N PRO A 90 -2.789 -51.803 29.218 1.00 0.00 N ATOM 1440 CA PRO A 90 -2.970 -53.166 29.724 1.00 0.00 C ATOM 1441 C PRO A 90 -1.867 -54.079 29.180 1.00 0.00 C ATOM 1442 O PRO A 90 -1.313 -53.809 28.110 1.00 0.00 O ATOM 1443 CB PRO A 90 -4.357 -53.546 29.186 1.00 0.00 C ATOM 1444 CG PRO A 90 -4.517 -52.692 27.978 1.00 0.00 C ATOM 1445 CD PRO A 90 -3.886 -51.390 28.333 1.00 0.00 C ATOM 0 HA PRO A 90 -2.908 -53.256 30.809 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.413 -54.606 28.937 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.138 -53.350 29.920 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -4.032 -53.141 27.111 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.569 -52.563 27.723 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -3.521 -50.862 27.452 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -4.586 -50.723 28.837 1.00 0.00 H new ATOM 1453 N LYS A 91 -1.531 -55.133 29.917 1.00 0.00 N ATOM 1454 CA LYS A 91 -0.413 -56.000 29.547 1.00 0.00 C ATOM 1455 C LYS A 91 -0.600 -56.670 28.189 1.00 0.00 C ATOM 1456 O LYS A 91 -1.273 -57.693 28.065 1.00 0.00 O ATOM 1457 CB LYS A 91 -0.145 -57.043 30.627 1.00 0.00 C ATOM 1458 CG LYS A 91 0.293 -56.432 31.945 1.00 0.00 C ATOM 1459 CD LYS A 91 0.625 -57.485 32.984 1.00 0.00 C ATOM 1460 CE LYS A 91 0.977 -56.844 34.324 1.00 0.00 C ATOM 1461 NZ LYS A 91 2.142 -55.928 34.227 1.00 0.00 N ATOM 0 H LYS A 91 -2.014 -55.409 30.772 1.00 0.00 H new ATOM 0 HA LYS A 91 0.458 -55.351 29.460 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -1.048 -57.632 30.788 1.00 0.00 H new ATOM 0 HB3 LYS A 91 0.625 -57.730 30.278 1.00 0.00 H new ATOM 0 HG2 LYS A 91 1.166 -55.801 31.778 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -0.499 -55.787 32.325 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -0.225 -58.156 33.110 1.00 0.00 H new ATOM 0 HD3 LYS A 91 1.461 -58.092 32.637 1.00 0.00 H new ATOM 0 HE2 LYS A 91 0.114 -56.292 34.697 1.00 0.00 H new ATOM 0 HE3 LYS A 91 1.193 -57.626 35.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 2.299 -55.467 35.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 2.989 -56.470 33.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 1.955 -55.204 33.504 1.00 0.00 H new