Browse entries in the PDBbind-CN Database
HEADER 5VOJ_COMPLEX COMPND 5VOJ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 198 MET ALA SER MET LYS LYS LYS GLY SER VAL VAL ILE VAL SEQRES 2 A 198 GLY ARG ILE ASN LEU SER GLY ASP THR ALA TYR ALA GLN SEQRES 3 A 198 GLN THR ARG GLY GLU GLU GLY CYS GLN GLU THR SER GLN SEQRES 4 A 198 THR GLY ARG ASP LYS ASN GLN VAL GLU GLY GLU VAL GLN SEQRES 5 A 198 ILE VAL SER THR ALA THR GLN THR PHE LEU ALA THR SER SEQRES 6 A 198 ILE ASN GLY VAL LEU TRP THR VAL TYR HIS GLY ALA GLY SEQRES 7 A 198 THR ARG THR ILE ALA SER PRO LYS GLY PRO VAL THR GLN SEQRES 8 A 198 MET TYR THR ASN VAL ASP LYS ASP LEU VAL GLY TRP GLN SEQRES 9 A 198 ALA PRO GLN GLY SER ARG SER LEU THR PRO CYS THR CYS SEQRES 10 A 198 GLY SER SER ASP LEU TYR LEU VAL THR ARG HIS ALA ASP SEQRES 11 A 198 VAL ILE PRO VAL ARG ARG ARG GLY ASP SER ARG GLY SER SEQRES 12 A 198 LEU LEU SER PRO ARG PRO ILE SER TYR LEU LYS GLY SER SEQRES 13 A 198 SER GLY GLY PRO LEU LEU CYS PRO ALA GLY HIS ALA VAL SEQRES 14 A 198 GLY ILE PHE ARG ALA ALA VAL SER THR ARG GLY VAL ALA SEQRES 15 A 198 LYS ALA VAL ASP PHE ILE PRO VAL GLU SER LEU GLU THR SEQRES 16 A 198 THR MET ARG HET ZN A 1 1 HET UNN A 383 103 ATOM 1 N MET A 983 8.138 -3.987 35.830 1.00 31.19 N ATOM 2 CA MET A 983 8.656 -3.857 34.470 1.00 20.93 C ATOM 3 C MET A 983 9.722 -4.904 34.181 1.00 31.79 C ATOM 4 O MET A 983 9.699 -5.560 33.140 1.00 28.55 O ATOM 5 CB MET A 983 9.247 -2.462 34.239 1.00 29.06 C ATOM 6 CG MET A 983 8.246 -1.317 34.281 1.00 29.92 C ATOM 7 SD MET A 983 6.798 -1.564 33.228 1.00 39.82 S ATOM 8 CE MET A 983 7.528 -2.161 31.703 1.00 31.38 C ATOM 9 HN3 MET A 983 8.916 -3.864 36.509 1.00 0.00 H ATOM 10 HN2 MET A 983 7.717 -4.930 35.951 1.00 0.00 H ATOM 11 HN1 MET A 983 7.414 -3.259 35.995 1.00 0.00 H ATOM 12 N ALA A 984 10.668 -5.057 35.108 1.00 32.55 N ATOM 13 CA ALA A 984 11.797 -5.951 34.876 1.00 41.56 C ATOM 14 C ALA A 984 11.375 -7.409 34.772 1.00 34.04 C ATOM 15 O ALA A 984 12.127 -8.221 34.223 1.00 37.71 O ATOM 16 CB ALA A 984 12.828 -5.794 35.994 1.00 35.27 C ATOM 17 H ALA A 984 10.600 -4.534 36.005 1.00 0.00 H ATOM 18 N SER A 985 10.202 -7.761 35.289 1.00 25.41 N ATOM 19 CA SER A 985 9.726 -9.137 35.280 1.00 35.29 C ATOM 20 C SER A 985 8.704 -9.407 34.184 1.00 36.41 C ATOM 21 O SER A 985 8.210 -10.535 34.084 1.00 29.24 O ATOM 22 CB SER A 985 9.111 -9.490 36.638 1.00 30.80 C ATOM 23 OG SER A 985 7.903 -8.780 36.847 1.00 36.63 O ATOM 24 HG SER A 985 7.526 -9.025 37.729 1.00 0.00 H ATOM 25 H SER A 985 9.602 -7.026 35.716 1.00 0.00 H ATOM 26 N MET A 986 8.363 -8.409 33.372 1.00 30.84 N ATOM 27 CA MET A 986 7.362 -8.618 32.336 1.00 36.17 C ATOM 28 C MET A 986 7.861 -9.655 31.338 1.00 26.33 C ATOM 29 O MET A 986 9.015 -9.611 30.896 1.00 21.36 O ATOM 30 CB MET A 986 7.033 -7.298 31.633 1.00 25.02 C ATOM 31 CG MET A 986 6.299 -6.296 32.525 1.00 17.24 C ATOM 32 SD MET A 986 4.585 -6.747 32.890 1.00 37.37 S ATOM 33 CE MET A 986 3.802 -6.373 31.316 1.00 28.74 C ATOM 34 H MET A 986 8.813 -7.477 33.478 1.00 0.00 H ATOM 35 N LYS A 987 6.990 -10.603 31.010 1.00 25.35 N ATOM 36 CA LYS A 987 7.314 -11.688 30.100 1.00 19.95 C ATOM 37 C LYS A 987 7.071 -11.272 28.652 1.00 26.62 C ATOM 38 O LYS A 987 6.365 -10.304 28.360 1.00 18.20 O ATOM 39 CB LYS A 987 6.469 -12.923 30.408 1.00 29.34 C ATOM 40 CG LYS A 987 6.582 -13.481 31.819 1.00 32.01 C ATOM 41 CD LYS A 987 5.384 -14.379 32.090 1.00 37.16 C ATOM 42 CE LYS A 987 5.638 -15.391 33.190 1.00 45.32 C ATOM 43 NZ LYS A 987 4.500 -16.350 33.304 1.00 57.20 N ATOM 44 HZ1 LYS A 987 3.628 -15.827 33.524 1.00 0.00 H ATOM 45 HZ2 LYS A 987 4.383 -16.856 32.403 1.00 0.00 H ATOM 46 HZ3 LYS A 987 4.698 -17.032 34.064 1.00 0.00 H ATOM 47 H LYS A 987 6.036 -10.567 31.422 1.00 0.00 H ATOM 48 N LYS A 988 7.655 -12.040 27.741 1.00 23.75 N ATOM 49 CA LYS A 988 7.402 -11.905 26.316 1.00 24.98 C ATOM 50 C LYS A 988 6.680 -13.153 25.828 1.00 24.63 C ATOM 51 O LYS A 988 7.008 -14.269 26.242 1.00 19.04 O ATOM 52 CB LYS A 988 8.710 -11.714 25.538 1.00 30.13 C ATOM 53 CG LYS A 988 8.520 -11.377 24.065 1.00 32.48 C ATOM 54 CD LYS A 988 7.953 -9.971 23.887 1.00 38.09 C ATOM 55 CE LYS A 988 7.153 -9.819 22.599 1.00 31.34 C ATOM 56 NZ LYS A 988 7.957 -9.257 21.494 1.00 25.82 N ATOM 57 HZ1 LYS A 988 8.308 -8.316 21.766 1.00 0.00 H ATOM 58 HZ2 LYS A 988 8.762 -9.885 21.298 1.00 0.00 H ATOM 59 HZ3 LYS A 988 7.365 -9.175 20.643 1.00 0.00 H ATOM 60 H LYS A 988 8.323 -12.770 28.061 1.00 0.00 H ATOM 61 N LYS A 989 5.688 -12.966 24.965 1.00 18.01 N ATOM 62 CA LYS A 989 5.026 -14.117 24.376 1.00 21.39 C ATOM 63 C LYS A 989 5.967 -14.791 23.390 1.00 18.05 C ATOM 64 O LYS A 989 6.797 -14.145 22.744 1.00 19.83 O ATOM 65 CB LYS A 989 3.723 -13.709 23.685 1.00 28.38 C ATOM 66 CG LYS A 989 2.534 -13.667 24.637 1.00 29.00 C ATOM 67 CD LYS A 989 1.216 -13.485 23.917 1.00 20.22 C ATOM 68 CE LYS A 989 0.055 -13.448 24.900 1.00 24.12 C ATOM 69 NZ LYS A 989 -1.263 -13.325 24.215 1.00 30.80 N ATOM 70 HZ1 LYS A 989 -1.283 -12.446 23.659 1.00 0.00 H ATOM 71 HZ2 LYS A 989 -1.401 -14.139 23.583 1.00 0.00 H ATOM 72 HZ3 LYS A 989 -2.021 -13.304 24.926 1.00 0.00 H ATOM 73 H LYS A 989 5.387 -12.003 24.713 1.00 0.00 H ATOM 74 N GLY A 990 5.850 -16.109 23.297 1.00 17.22 N ATOM 75 CA GLY A 990 6.701 -16.872 22.415 1.00 15.02 C ATOM 76 C GLY A 990 6.262 -16.750 20.973 1.00 14.94 C ATOM 77 O GLY A 990 5.266 -16.106 20.639 1.00 14.50 O ATOM 78 H GLY A 990 5.134 -16.601 23.869 1.00 0.00 H ATOM 79 N SER A 991 7.038 -17.381 20.101 1.00 14.87 N ATOM 80 CA SER A 991 6.701 -17.424 18.689 1.00 9.76 C ATOM 81 C SER A 991 5.736 -18.565 18.395 1.00 13.64 C ATOM 82 O SER A 991 5.711 -19.587 19.087 1.00 11.80 O ATOM 83 CB SER A 991 7.956 -17.610 17.837 1.00 11.22 C ATOM 84 OG SER A 991 8.824 -16.503 17.940 1.00 8.96 O ATOM 85 HG SER A 991 9.623 -16.658 17.377 1.00 0.00 H ATOM 86 H SER A 991 7.903 -17.853 20.435 1.00 0.00 H ATOM 87 N VAL A 992 4.933 -18.372 17.348 1.00 8.95 N ATOM 88 CA VAL A 992 4.298 -19.496 16.674 1.00 7.82 C ATOM 89 C VAL A 992 5.384 -20.426 16.153 1.00 9.21 C ATOM 90 O VAL A 992 6.421 -19.975 15.650 1.00 9.69 O ATOM 91 CB VAL A 992 3.401 -18.982 15.535 1.00 6.28 C ATOM 92 CG1 VAL A 992 2.824 -20.131 14.733 1.00 10.31 C ATOM 93 CG2 VAL A 992 2.293 -18.093 16.079 1.00 7.96 C ATOM 94 H VAL A 992 4.758 -17.405 17.008 1.00 0.00 H ATOM 95 N VAL A 993 5.154 -21.736 16.281 1.00 8.75 N ATOM 96 CA VAL A 993 6.110 -22.764 15.877 1.00 9.12 C ATOM 97 C VAL A 993 5.416 -23.739 14.941 1.00 7.21 C ATOM 98 O VAL A 993 4.315 -24.211 15.240 1.00 7.66 O ATOM 99 CB VAL A 993 6.682 -23.522 17.091 1.00 12.09 C ATOM 100 CG1 VAL A 993 7.713 -24.563 16.642 1.00 10.57 C ATOM 101 CG2 VAL A 993 7.291 -22.542 18.104 1.00 10.64 C ATOM 102 H VAL A 993 4.247 -22.040 16.690 1.00 0.00 H ATOM 103 N ILE A 994 6.069 -24.060 13.828 1.00 6.96 N ATOM 104 CA ILE A 994 5.605 -25.127 12.944 1.00 7.12 C ATOM 105 C ILE A 994 5.937 -26.455 13.612 1.00 11.08 C ATOM 106 O ILE A 994 7.093 -26.710 13.969 1.00 11.54 O ATOM 107 CB ILE A 994 6.247 -25.015 11.552 1.00 11.99 C ATOM 108 CG1 ILE A 994 5.807 -23.714 10.867 1.00 11.80 C ATOM 109 CG2 ILE A 994 5.876 -26.210 10.686 1.00 13.72 C ATOM 110 CD1 ILE A 994 6.549 -23.394 9.566 1.00 14.53 C ATOM 111 H ILE A 994 6.933 -23.538 13.580 1.00 0.00 H ATOM 112 N VAL A 995 4.918 -27.286 13.822 1.00 8.04 N ATOM 113 CA VAL A 995 5.090 -28.573 14.487 1.00 11.92 C ATOM 114 C VAL A 995 4.741 -29.743 13.585 1.00 11.58 C ATOM 115 O VAL A 995 4.878 -30.895 14.003 1.00 12.58 O ATOM 116 CB VAL A 995 4.272 -28.651 15.792 1.00 10.53 C ATOM 117 CG1 VAL A 995 4.783 -27.636 16.797 1.00 12.28 C ATOM 118 CG2 VAL A 995 2.791 -28.448 15.521 1.00 12.70 C ATOM 119 H VAL A 995 3.968 -27.008 13.501 1.00 0.00 H ATOM 120 N GLY A 996 4.288 -29.483 12.367 1.00 10.02 N ATOM 121 CA GLY A 996 3.990 -30.552 11.441 1.00 9.09 C ATOM 122 C GLY A 996 3.425 -29.972 10.168 1.00 10.73 C ATOM 123 O GLY A 996 3.484 -28.759 9.935 1.00 8.63 O ATOM 124 H GLY A 996 4.145 -28.496 12.073 1.00 0.00 H ATOM 125 N ARG A 997 2.863 -30.855 9.348 1.00 10.19 N ATOM 126 CA ARG A 997 2.295 -30.435 8.078 1.00 7.55 C ATOM 127 C ARG A 997 1.216 -31.417 7.660 1.00 9.33 C ATOM 128 O ARG A 997 1.168 -32.562 8.123 1.00 9.34 O ATOM 129 CB ARG A 997 3.366 -30.345 6.988 1.00 13.36 C ATOM 130 CG ARG A 997 3.833 -31.703 6.475 1.00 13.61 C ATOM 131 CD ARG A 997 4.856 -31.540 5.364 1.00 17.62 C ATOM 132 NE ARG A 997 6.121 -31.039 5.883 1.00 18.45 N ATOM 133 CZ ARG A 997 7.106 -31.811 6.331 1.00 17.68 C ATOM 134 NH1 ARG A 997 6.984 -33.134 6.332 1.00 21.98 N ATOM 135 NH2 ARG A 997 8.217 -31.255 6.788 1.00 17.13 N ATOM 136 HE ARG A 997 6.263 -30.009 5.905 1.00 0.00 H ATOM 137 HH12 ARG A 997 7.762 -33.728 6.685 1.00 0.00 H ATOM 138 HH11 ARG A 997 6.111 -33.576 5.980 1.00 0.00 H ATOM 139 HH22 ARG A 997 8.991 -31.853 7.140 1.00 0.00 H ATOM 140 HH21 ARG A 997 8.316 -30.220 6.795 1.00 0.00 H ATOM 141 H ARG A 997 2.829 -31.859 9.619 1.00 0.00 H ATOM 142 N ILE A 998 0.363 -30.963 6.752 1.00 10.22 N ATOM 143 CA ILE A 998 -0.578 -31.841 6.073 1.00 10.94 C ATOM 144 C ILE A 998 0.047 -32.178 4.730 1.00 14.02 C ATOM 145 O ILE A 998 0.238 -31.298 3.884 1.00 16.34 O ATOM 146 CB ILE A 998 -1.960 -31.200 5.910 1.00 12.96 C ATOM 147 CG1 ILE A 998 -2.477 -30.688 7.259 1.00 11.68 C ATOM 148 CG2 ILE A 998 -2.932 -32.215 5.303 1.00 14.65 C ATOM 149 CD1 ILE A 998 -2.583 -31.754 8.336 1.00 11.73 C ATOM 150 H ILE A 998 0.367 -29.950 6.518 1.00 0.00 H ATOM 151 N ASN A 999 0.389 -33.446 4.540 1.00 11.57 N ATOM 152 CA ASN A 999 1.064 -33.869 3.323 1.00 12.69 C ATOM 153 C ASN A 999 0.029 -34.080 2.230 1.00 15.23 C ATOM 154 O ASN A 999 -0.843 -34.949 2.348 1.00 15.43 O ATOM 155 CB ASN A 999 1.872 -35.141 3.574 1.00 11.88 C ATOM 156 CG ASN A 999 2.838 -35.433 2.454 1.00 20.54 C ATOM 157 OD1 ASN A 999 2.438 -35.542 1.297 1.00 19.19 O ATOM 158 ND2 ASN A 999 4.125 -35.525 2.781 1.00 18.45 N ATOM 159 HD22 ASN A 999 4.418 -35.426 3.774 1.00 0.00 H ATOM 160 HD21 ASN A 999 4.838 -35.696 2.043 1.00 0.00 H ATOM 161 H ASN A 999 0.171 -34.150 5.274 1.00 0.00 H ATOM 162 N LEU A1000 0.118 -33.269 1.176 1.00 16.81 N ATOM 163 CA LEU A1000 -0.777 -33.356 0.030 1.00 15.08 C ATOM 164 C LEU A1000 -0.013 -33.674 -1.252 1.00 18.96 C ATOM 165 O LEU A1000 -0.513 -33.417 -2.347 1.00 19.08 O ATOM 166 CB LEU A1000 -1.556 -32.049 -0.129 1.00 13.71 C ATOM 167 CG LEU A1000 -2.421 -31.617 1.057 1.00 16.88 C ATOM 168 CD1 LEU A1000 -2.903 -30.182 0.868 1.00 16.39 C ATOM 169 CD2 LEU A1000 -3.591 -32.566 1.236 1.00 14.76 C ATOM 170 H LEU A1000 0.860 -32.541 1.172 1.00 0.00 H ATOM 171 N SER A1001 1.193 -34.229 -1.134 1.00 21.43 N ATOM 172 CA SER A1001 2.059 -34.382 -2.298 1.00 23.44 C ATOM 173 C SER A1001 1.672 -35.574 -3.162 1.00 27.29 C ATOM 174 O SER A1001 1.950 -35.572 -4.367 1.00 32.41 O ATOM 175 CB SER A1001 3.515 -34.519 -1.853 1.00 26.33 C ATOM 176 OG SER A1001 3.698 -35.678 -1.055 1.00 31.61 O ATOM 177 HG SER A1001 3.125 -35.617 -0.250 1.00 0.00 H ATOM 178 H SER A1001 1.520 -34.556 -0.203 1.00 0.00 H ATOM 179 N GLY A1002 1.039 -36.589 -2.584 1.00 24.85 N ATOM 180 CA GLY A1002 0.762 -37.810 -3.316 1.00 31.67 C ATOM 181 C GLY A1002 -0.714 -38.100 -3.473 1.00 23.49 C ATOM 182 O GLY A1002 -1.525 -37.186 -3.642 1.00 36.12 O ATOM 183 H GLY A1002 0.738 -36.507 -1.592 1.00 0.00 H ATOM 184 N ASP A1003 -1.068 -39.381 -3.416 1.00 23.96 N ATOM 185 CA ASP A1003 -2.446 -39.821 -3.588 1.00 26.08 C ATOM 186 C ASP A1003 -3.231 -39.831 -2.285 1.00 27.89 C ATOM 187 O ASP A1003 -4.468 -39.852 -2.315 1.00 23.89 O ATOM 188 CB ASP A1003 -2.467 -41.229 -4.194 1.00 34.34 C ATOM 189 CG ASP A1003 -1.776 -42.258 -3.307 1.00 54.07 C ATOM 190 OD1 ASP A1003 -0.844 -41.883 -2.558 1.00 43.19 O ATOM 191 OD2 ASP A1003 -2.165 -43.445 -3.359 1.00 58.34 O ATOM 192 H ASP A1003 -0.333 -40.096 -3.242 1.00 0.00 H ATOM 193 N THR A1004 -2.545 -39.814 -1.148 1.00 19.73 N ATOM 194 CA THR A1004 -3.172 -39.904 0.161 1.00 17.86 C ATOM 195 C THR A1004 -2.759 -38.691 0.976 1.00 16.48 C ATOM 196 O THR A1004 -1.572 -38.361 1.041 1.00 22.39 O ATOM 197 CB THR A1004 -2.758 -41.196 0.870 1.00 27.74 C ATOM 198 OG1 THR A1004 -3.047 -42.313 0.020 1.00 22.84 O ATOM 199 CG2 THR A1004 -3.503 -41.365 2.185 1.00 22.08 C ATOM 200 HG1 THR A1004 -2.542 -42.221 -0.827 1.00 0.00 H ATOM 201 H THR A1004 -1.509 -39.732 -1.196 1.00 0.00 H ATOM 202 N ALA A1005 -3.735 -38.012 1.566 1.00 16.27 N ATOM 203 CA ALA A1005 -3.451 -36.889 2.447 1.00 14.00 C ATOM 204 C ALA A1005 -3.240 -37.432 3.849 1.00 13.87 C ATOM 205 O ALA A1005 -4.020 -38.271 4.314 1.00 13.54 O ATOM 206 CB ALA A1005 -4.591 -35.870 2.432 1.00 13.27 C ATOM 207 H ALA A1005 -4.723 -38.288 1.395 1.00 0.00 H ATOM 208 N TYR A1006 -2.174 -36.986 4.512 1.00 12.06 N ATOM 209 CA TYR A1006 -1.938 -37.442 5.872 1.00 10.61 C ATOM 210 C TYR A1006 -1.142 -36.401 6.637 1.00 11.96 C ATOM 211 O TYR A1006 -0.315 -35.678 6.073 1.00 10.03 O ATOM 212 CB TYR A1006 -1.224 -38.801 5.909 1.00 11.08 C ATOM 213 CG TYR A1006 0.161 -38.830 5.297 1.00 13.28 C ATOM 214 CD1 TYR A1006 0.338 -38.840 3.922 1.00 12.44 C ATOM 215 CD2 TYR A1006 1.289 -38.880 6.102 1.00 15.60 C ATOM 216 CE1 TYR A1006 1.606 -38.884 3.362 1.00 14.97 C ATOM 217 CE2 TYR A1006 2.559 -38.919 5.554 1.00 17.61 C ATOM 218 CZ TYR A1006 2.710 -38.927 4.181 1.00 18.72 C ATOM 219 OH TYR A1006 3.968 -38.967 3.625 1.00 19.99 O ATOM 220 HH TYR A1006 3.891 -38.967 2.638 1.00 0.00 H ATOM 221 H TYR A1006 -1.517 -36.318 4.061 1.00 0.00 H ATOM 222 N ALA A1007 -1.419 -36.327 7.933 1.00 6.67 N ATOM 223 CA ALA A1007 -0.707 -35.415 8.810 1.00 11.77 C ATOM 224 C ALA A1007 0.645 -36.004 9.191 1.00 10.74 C ATOM 225 O ALA A1007 0.783 -37.217 9.382 1.00 8.72 O ATOM 226 CB ALA A1007 -1.533 -35.133 10.063 1.00 11.03 C ATOM 227 H ALA A1007 -2.163 -36.936 8.329 1.00 0.00 H ATOM 228 N GLN A1008 1.648 -35.134 9.286 1.00 9.02 N ATOM 229 CA GLN A1008 2.974 -35.496 9.765 1.00 9.98 C ATOM 230 C GLN A1008 3.344 -34.555 10.895 1.00 10.92 C ATOM 231 O GLN A1008 3.150 -33.342 10.779 1.00 10.92 O ATOM 232 CB GLN A1008 4.030 -35.386 8.666 1.00 10.61 C ATOM 233 CG GLN A1008 3.766 -36.218 7.439 1.00 11.54 C ATOM 234 CD GLN A1008 4.740 -35.897 6.329 1.00 17.22 C ATOM 235 OE1 GLN A1008 4.641 -34.850 5.692 1.00 17.51 O ATOM 236 NE2 GLN A1008 5.699 -36.788 6.102 1.00 15.99 N ATOM 237 HE22 GLN A1008 5.743 -37.660 6.667 1.00 0.00 H ATOM 238 HE21 GLN A1008 6.406 -36.613 5.360 1.00 0.00 H ATOM 239 H GLN A1008 1.476 -34.148 9.004 1.00 0.00 H ATOM 240 N GLN A1009 3.879 -35.098 11.981 1.00 7.19 N ATOM 241 CA GLN A1009 4.460 -34.256 13.008 1.00 6.83 C ATOM 242 C GLN A1009 5.958 -34.143 12.766 1.00 8.22 C ATOM 243 O GLN A1009 6.628 -35.142 12.469 1.00 8.70 O ATOM 244 CB GLN A1009 4.183 -34.797 14.407 1.00 8.31 C ATOM 245 CG GLN A1009 4.449 -33.741 15.450 1.00 12.30 C ATOM 246 CD GLN A1009 4.203 -34.219 16.853 1.00 12.31 C ATOM 247 OE1 GLN A1009 3.184 -33.915 17.476 1.00 12.59 O ATOM 248 NE2 GLN A1009 5.154 -34.949 17.370 1.00 9.08 N ATOM 249 HE22 GLN A1009 5.997 -35.181 16.806 1.00 0.00 H ATOM 250 HE21 GLN A1009 5.069 -35.299 18.346 1.00 0.00 H ATOM 251 H GLN A1009 3.882 -36.132 12.096 1.00 0.00 H ATOM 252 N THR A1010 6.475 -32.922 12.875 1.00 10.69 N ATOM 253 CA THR A1010 7.892 -32.664 12.688 1.00 11.30 C ATOM 254 C THR A1010 8.588 -32.179 13.950 1.00 12.86 C ATOM 255 O THR A1010 9.822 -32.114 13.963 1.00 15.19 O ATOM 256 CB THR A1010 8.109 -31.632 11.569 1.00 11.51 C ATOM 257 OG1 THR A1010 7.387 -30.431 11.864 1.00 9.62 O ATOM 258 CG2 THR A1010 7.635 -32.186 10.240 1.00 12.97 C ATOM 259 HG1 THR A1010 7.533 -29.773 11.139 1.00 0.00 H ATOM 260 H THR A1010 5.844 -32.127 13.101 1.00 0.00 H ATOM 261 N ARG A1011 7.846 -31.842 15.002 1.00 11.84 N ATOM 262 CA ARG A1011 8.447 -31.401 16.251 1.00 11.98 C ATOM 263 C ARG A1011 7.534 -31.772 17.410 1.00 13.19 C ATOM 264 O ARG A1011 6.333 -31.494 17.370 1.00 13.80 O ATOM 265 CB ARG A1011 8.701 -29.888 16.238 1.00 15.94 C ATOM 266 CG ARG A1011 9.546 -29.421 17.405 1.00 22.44 C ATOM 267 CD ARG A1011 9.808 -27.929 17.353 1.00 26.44 C ATOM 268 NE ARG A1011 10.818 -27.530 16.371 1.00 23.78 N ATOM 269 CZ ARG A1011 12.130 -27.677 16.533 1.00 24.10 C ATOM 270 NH1 ARG A1011 12.613 -28.255 17.626 1.00 23.96 N ATOM 271 NH2 ARG A1011 12.963 -27.244 15.597 1.00 19.08 N ATOM 272 HE ARG A1011 10.486 -27.101 15.484 1.00 0.00 H ATOM 273 HH12 ARG A1011 13.640 -28.366 17.745 1.00 0.00 H ATOM 274 HH11 ARG A1011 11.964 -28.597 18.363 1.00 0.00 H ATOM 275 HH22 ARG A1011 13.989 -27.358 15.721 1.00 0.00 H ATOM 276 HH21 ARG A1011 12.590 -26.791 14.738 1.00 0.00 H ATOM 277 H ARG A1011 6.810 -31.895 14.929 1.00 0.00 H ATOM 278 N GLY A1012 8.114 -32.401 18.439 1.00 12.46 N ATOM 279 CA GLY A1012 7.376 -32.749 19.632 1.00 14.21 C ATOM 280 C GLY A1012 7.198 -31.572 20.589 1.00 31.25 C ATOM 281 O GLY A1012 7.839 -30.527 20.466 1.00 25.60 O ATOM 282 H GLY A1012 9.123 -32.646 18.379 1.00 0.00 H ATOM 283 N GLU A1013 6.310 -31.778 21.569 1.00 29.17 N ATOM 284 CA GLU A1013 5.863 -30.689 22.440 1.00 38.10 C ATOM 285 C GLU A1013 7.033 -30.002 23.139 1.00 36.33 C ATOM 286 O GLU A1013 7.044 -28.772 23.284 1.00 32.79 O ATOM 287 CB GLU A1013 4.862 -31.228 23.468 1.00 36.44 C ATOM 288 CG GLU A1013 4.223 -30.167 24.360 1.00 45.06 C ATOM 289 CD GLU A1013 3.112 -30.726 25.247 1.00 68.06 C ATOM 290 OE1 GLU A1013 2.723 -31.900 25.057 1.00 48.45 O ATOM 291 OE2 GLU A1013 2.627 -29.990 26.136 1.00 54.32 O ATOM 292 H GLU A1013 5.928 -32.734 21.715 1.00 0.00 H ATOM 293 N GLU A1014 8.027 -30.776 23.580 1.00 35.01 N ATOM 294 CA GLU A1014 9.152 -30.198 24.310 1.00 39.43 C ATOM 295 C GLU A1014 9.978 -29.281 23.417 1.00 38.96 C ATOM 296 O GLU A1014 10.253 -28.128 23.778 1.00 29.98 O ATOM 297 CB GLU A1014 10.024 -31.311 24.891 1.00 56.61 C ATOM 298 CG GLU A1014 9.437 -31.967 26.133 1.00 57.92 C ATOM 299 CD GLU A1014 10.048 -33.325 26.422 1.00 73.11 C ATOM 300 OE1 GLU A1014 11.240 -33.522 26.104 1.00 69.56 O ATOM 301 OE2 GLU A1014 9.332 -34.199 26.959 1.00 68.60 O ATOM 302 H GLU A1014 8.000 -31.800 23.402 1.00 0.00 H ATOM 303 N GLY A1015 10.397 -29.781 22.250 1.00 24.29 N ATOM 304 CA GLY A1015 11.128 -28.946 21.313 1.00 22.70 C ATOM 305 C GLY A1015 10.313 -27.765 20.824 1.00 19.22 C ATOM 306 O GLY A1015 10.870 -26.722 20.469 1.00 23.45 O ATOM 307 H GLY A1015 10.198 -30.774 22.012 1.00 0.00 H ATOM 308 N CYS A1016 8.989 -27.908 20.801 1.00 20.92 N ATOM 309 CA CYS A1016 8.130 -26.787 20.442 1.00 20.61 C ATOM 310 C CYS A1016 8.233 -25.675 21.477 1.00 25.28 C ATOM 311 O CYS A1016 8.436 -24.507 21.130 1.00 15.92 O ATOM 312 CB CYS A1016 6.687 -27.265 20.300 1.00 15.53 C ATOM 313 SG CYS A1016 5.493 -25.992 19.863 1.00 19.57 S ATOM 314 H CYS A1016 8.565 -28.827 21.041 1.00 0.00 H ATOM 315 N GLN A1017 8.113 -26.020 22.762 1.00 25.27 N ATOM 316 CA GLN A1017 8.203 -25.001 23.804 1.00 21.59 C ATOM 317 C GLN A1017 9.539 -24.269 23.746 1.00 20.98 C ATOM 318 O GLN A1017 9.586 -23.040 23.874 1.00 24.19 O ATOM 319 CB GLN A1017 7.994 -25.633 25.181 1.00 31.65 C ATOM 320 CG GLN A1017 7.787 -24.621 26.310 1.00 41.16 C ATOM 321 CD GLN A1017 9.087 -24.050 26.857 1.00 61.49 C ATOM 322 OE1 GLN A1017 10.087 -24.758 26.990 1.00 58.40 O ATOM 323 NE2 GLN A1017 9.075 -22.759 27.181 1.00 53.67 N ATOM 324 HE22 GLN A1017 8.208 -22.199 27.052 1.00 0.00 H ATOM 325 HE21 GLN A1017 9.932 -22.311 27.563 1.00 0.00 H ATOM 326 H GLN A1017 7.955 -27.015 23.020 1.00 0.00 H ATOM 327 N GLU A1018 10.636 -25.005 23.557 1.00 19.23 N ATOM 328 CA GLU A1018 11.947 -24.373 23.469 1.00 23.31 C ATOM 329 C GLU A1018 12.042 -23.476 22.242 1.00 25.31 C ATOM 330 O GLU A1018 12.565 -22.358 22.316 1.00 19.16 O ATOM 331 CB GLU A1018 13.036 -25.445 23.437 1.00 30.65 C ATOM 332 CG GLU A1018 14.446 -24.916 23.214 1.00 33.89 C ATOM 333 CD GLU A1018 14.955 -24.087 24.380 1.00 44.33 C ATOM 334 OE1 GLU A1018 15.384 -24.685 25.390 1.00 62.94 O ATOM 335 OE2 GLU A1018 14.922 -22.841 24.294 1.00 57.16 O ATOM 336 H GLU A1018 10.555 -26.038 23.472 1.00 0.00 H ATOM 337 N THR A1019 11.546 -23.955 21.098 1.00 18.70 N ATOM 338 CA THR A1019 11.598 -23.170 19.870 1.00 14.36 C ATOM 339 C THR A1019 10.716 -21.933 19.970 1.00 14.30 C ATOM 340 O THR A1019 11.050 -20.886 19.404 1.00 14.29 O ATOM 341 CB THR A1019 11.180 -24.050 18.683 1.00 17.64 C ATOM 342 OG1 THR A1019 12.115 -25.124 18.533 1.00 19.99 O ATOM 343 CG2 THR A1019 11.136 -23.267 17.385 1.00 13.12 C ATOM 344 HG1 THR A1019 13.018 -24.753 18.368 1.00 0.00 H ATOM 345 H THR A1019 11.116 -24.902 21.083 1.00 0.00 H ATOM 346 N SER A1020 9.597 -22.029 20.691 1.00 13.65 N ATOM 347 CA SER A1020 8.733 -20.868 20.872 1.00 14.27 C ATOM 348 C SER A1020 9.447 -19.771 21.653 1.00 18.55 C ATOM 349 O SER A1020 9.289 -18.582 21.354 1.00 14.63 O ATOM 350 CB SER A1020 7.451 -21.284 21.594 1.00 15.28 C ATOM 351 OG SER A1020 6.541 -20.205 21.685 1.00 22.20 O ATOM 352 HG SER A1020 6.305 -19.896 20.774 1.00 0.00 H ATOM 353 H SER A1020 9.339 -22.938 21.127 1.00 0.00 H ATOM 354 N GLN A1021 10.231 -20.155 22.664 1.00 14.94 N ATOM 355 CA GLN A1021 10.937 -19.175 23.485 1.00 20.47 C ATOM 356 C GLN A1021 12.071 -18.514 22.712 1.00 18.42 C ATOM 357 O GLN A1021 12.244 -17.292 22.779 1.00 18.28 O ATOM 358 CB GLN A1021 11.473 -19.850 24.750 1.00 21.22 C ATOM 359 H GLN A1021 10.340 -21.169 22.870 1.00 0.00 H ATOM 360 N THR A1022 12.861 -19.299 21.977 1.00 17.53 N ATOM 361 CA THR A1022 14.004 -18.737 21.268 1.00 14.17 C ATOM 362 C THR A1022 13.614 -18.133 19.931 1.00 19.61 C ATOM 363 O THR A1022 14.325 -17.261 19.421 1.00 16.24 O ATOM 364 CB THR A1022 15.069 -19.804 21.021 1.00 22.56 C ATOM 365 OG1 THR A1022 14.581 -20.748 20.054 1.00 20.89 O ATOM 366 CG2 THR A1022 15.435 -20.522 22.315 1.00 31.18 C ATOM 367 HG1 THR A1022 15.270 -21.440 19.893 1.00 0.00 H ATOM 368 H THR A1022 12.660 -20.317 21.910 1.00 0.00 H ATOM 369 N GLY A1023 12.513 -18.592 19.342 1.00 15.96 N ATOM 370 CA GLY A1023 12.187 -18.210 17.987 1.00 12.36 C ATOM 371 C GLY A1023 13.111 -18.775 16.935 1.00 12.98 C ATOM 372 O GLY A1023 13.019 -18.372 15.772 1.00 13.26 O ATOM 373 H GLY A1023 11.880 -19.233 19.862 1.00 0.00 H ATOM 374 N ARG A1024 13.989 -19.712 17.299 1.00 16.24 N ATOM 375 CA ARG A1024 14.956 -20.293 16.376 1.00 14.48 C ATOM 376 C ARG A1024 14.511 -21.705 16.025 1.00 15.85 C ATOM 377 O ARG A1024 14.587 -22.612 16.859 1.00 14.84 O ATOM 378 CB ARG A1024 16.361 -20.298 16.980 1.00 18.75 C ATOM 379 CG ARG A1024 17.005 -18.921 17.038 1.00 35.65 C ATOM 380 CD ARG A1024 18.454 -18.972 17.524 1.00 45.29 C ATOM 381 NE ARG A1024 19.334 -19.679 16.593 1.00 55.72 N ATOM 382 CZ ARG A1024 19.707 -20.953 16.711 1.00 64.27 C ATOM 383 NH1 ARG A1024 19.285 -21.697 17.727 1.00 59.27 N ATOM 384 NH2 ARG A1024 20.514 -21.489 15.804 1.00 60.30 N ATOM 385 HE ARG A1024 19.696 -19.146 15.776 1.00 0.00 H ATOM 386 HH12 ARG A1024 19.585 -22.690 17.805 1.00 0.00 H ATOM 387 HH11 ARG A1024 18.654 -21.287 18.445 1.00 0.00 H ATOM 388 HH22 ARG A1024 20.808 -22.483 15.892 1.00 0.00 H ATOM 389 HH21 ARG A1024 20.853 -20.915 15.005 1.00 0.00 H ATOM 390 H ARG A1024 13.983 -20.042 18.285 1.00 0.00 H ATOM 391 N ASP A1025 14.059 -21.884 14.787 1.00 15.54 N ATOM 392 CA ASP A1025 13.577 -23.168 14.288 1.00 15.48 C ATOM 393 C ASP A1025 14.434 -23.559 13.092 1.00 17.91 C ATOM 394 O ASP A1025 14.309 -22.970 12.012 1.00 17.85 O ATOM 395 CB ASP A1025 12.100 -23.083 13.906 1.00 16.53 C ATOM 396 CG ASP A1025 11.548 -24.406 13.397 1.00 20.41 C ATOM 397 OD1 ASP A1025 12.288 -25.411 13.408 1.00 16.84 O ATOM 398 OD2 ASP A1025 10.368 -24.436 12.984 1.00 19.81 O ATOM 399 H ASP A1025 14.049 -21.068 14.142 1.00 0.00 H ATOM 400 N LYS A1026 15.296 -24.553 13.283 1.00 20.40 N ATOM 401 CA LYS A1026 16.187 -25.026 12.234 1.00 24.53 C ATOM 402 C LYS A1026 15.597 -26.175 11.426 1.00 22.73 C ATOM 403 O LYS A1026 16.267 -26.683 10.524 1.00 19.46 O ATOM 404 CB LYS A1026 17.525 -25.466 12.844 1.00 25.24 C ATOM 405 CG LYS A1026 18.401 -24.323 13.356 1.00 42.52 C ATOM 406 CD LYS A1026 18.934 -23.466 12.216 1.00 51.28 C ATOM 407 CE LYS A1026 19.971 -22.460 12.700 1.00 62.67 C ATOM 408 NZ LYS A1026 20.375 -21.509 11.621 1.00 48.22 N ATOM 409 HZ1 LYS A1026 20.784 -22.041 10.827 1.00 0.00 H ATOM 410 HZ2 LYS A1026 19.540 -20.983 11.294 1.00 0.00 H ATOM 411 HZ3 LYS A1026 21.081 -20.843 11.994 1.00 0.00 H ATOM 412 H LYS A1026 15.335 -25.009 14.217 1.00 0.00 H ATOM 413 N ASN A1027 14.372 -26.600 11.717 1.00 16.30 N ATOM 414 CA ASN A1027 13.792 -27.713 10.981 1.00 15.47 C ATOM 415 C ASN A1027 13.494 -27.306 9.549 1.00 19.46 C ATOM 416 O ASN A1027 13.096 -26.170 9.277 1.00 22.44 O ATOM 417 CB ASN A1027 12.514 -28.201 11.657 1.00 23.83 C ATOM 418 CG ASN A1027 12.786 -29.185 12.773 1.00 26.77 C ATOM 419 OD1 ASN A1027 13.939 -29.477 13.090 1.00 28.89 O ATOM 420 ND2 ASN A1027 11.722 -29.697 13.383 1.00 25.92 N ATOM 421 HD22 ASN A1027 10.766 -29.421 13.081 1.00 0.00 H ATOM 422 HD21 ASN A1027 11.845 -30.374 14.163 1.00 0.00 H ATOM 423 H ASN A1027 13.827 -26.136 12.472 1.00 0.00 H ATOM 424 N GLN A1028 13.699 -28.241 8.626 1.00 20.43 N ATOM 425 CA GLN A1028 13.323 -28.004 7.243 1.00 26.01 C ATOM 426 C GLN A1028 11.806 -27.998 7.118 1.00 23.28 C ATOM 427 O GLN A1028 11.113 -28.834 7.709 1.00 24.83 O ATOM 428 CB GLN A1028 13.930 -29.069 6.331 1.00 31.40 C ATOM 429 CG GLN A1028 15.397 -28.828 6.009 1.00 51.68 C ATOM 430 CD GLN A1028 15.611 -27.565 5.195 1.00 70.06 C ATOM 431 OE1 GLN A1028 15.003 -27.382 4.139 1.00 69.87 O ATOM 432 NE2 GLN A1028 16.469 -26.678 5.690 1.00 65.73 N ATOM 433 HE22 GLN A1028 16.961 -26.874 6.585 1.00 0.00 H ATOM 434 HE21 GLN A1028 16.648 -25.789 5.182 1.00 0.00 H ATOM 435 H GLN A1028 14.131 -29.148 8.896 1.00 0.00 H ATOM 436 N VAL A1029 11.296 -27.022 6.377 1.00 18.18 N ATOM 437 CA VAL A1029 9.868 -26.873 6.126 1.00 18.23 C ATOM 438 C VAL A1029 9.576 -27.390 4.730 1.00 14.36 C ATOM 439 O VAL A1029 10.362 -27.175 3.802 1.00 13.73 O ATOM 440 CB VAL A1029 9.431 -25.403 6.268 1.00 18.46 C ATOM 441 CG1 VAL A1029 7.966 -25.226 5.857 1.00 15.90 C ATOM 442 CG2 VAL A1029 9.649 -24.937 7.694 1.00 20.72 C ATOM 443 H VAL A1029 11.947 -26.330 5.955 1.00 0.00 H ATOM 444 N GLU A1030 8.446 -28.076 4.581 1.00 13.07 N ATOM 445 CA GLU A1030 7.984 -28.557 3.288 1.00 12.15 C ATOM 446 C GLU A1030 6.476 -28.388 3.207 1.00 12.78 C ATOM 447 O GLU A1030 5.790 -28.353 4.230 1.00 10.93 O ATOM 448 CB GLU A1030 8.342 -30.036 3.066 1.00 17.52 C ATOM 449 CG GLU A1030 9.829 -30.318 2.948 1.00 23.17 C ATOM 450 CD GLU A1030 10.118 -31.773 2.608 1.00 28.32 C ATOM 451 OE1 GLU A1030 9.814 -32.657 3.433 1.00 34.37 O ATOM 452 OE2 GLU A1030 10.640 -32.032 1.504 1.00 46.03 O ATOM 453 H GLU A1030 7.869 -28.277 5.423 1.00 0.00 H ATOM 454 N GLY A1031 5.967 -28.267 1.984 1.00 12.79 N ATOM 455 CA GLY A1031 4.538 -28.342 1.751 1.00 13.82 C ATOM 456 C GLY A1031 3.820 -27.012 1.894 1.00 15.96 C ATOM 457 O GLY A1031 4.391 -25.972 2.238 1.00 12.90 O ATOM 458 H GLY A1031 6.607 -28.116 1.179 1.00 0.00 H ATOM 459 N GLU A1032 2.513 -27.073 1.637 1.00 12.50 N ATOM 460 CA GLU A1032 1.644 -25.899 1.596 1.00 9.62 C ATOM 461 C GLU A1032 0.920 -25.634 2.907 1.00 10.06 C ATOM 462 O GLU A1032 0.697 -24.472 3.256 1.00 12.00 O ATOM 463 CB GLU A1032 0.591 -26.054 0.492 1.00 13.40 C ATOM 464 CG GLU A1032 1.155 -26.339 -0.891 1.00 18.11 C ATOM 465 CD GLU A1032 1.480 -27.807 -1.112 1.00 23.15 C ATOM 466 OE1 GLU A1032 1.297 -28.628 -0.185 1.00 16.37 O ATOM 467 OE2 GLU A1032 1.922 -28.139 -2.229 1.00 36.66 O ATOM 468 H GLU A1032 2.090 -28.006 1.456 1.00 0.00 H ATOM 469 N VAL A1033 0.512 -26.681 3.623 1.00 7.71 N ATOM 470 CA VAL A1033 -0.284 -26.546 4.839 1.00 11.59 C ATOM 471 C VAL A1033 0.575 -26.974 6.015 1.00 10.27 C ATOM 472 O VAL A1033 0.974 -28.140 6.105 1.00 8.00 O ATOM 473 CB VAL A1033 -1.567 -27.389 4.778 1.00 9.79 C ATOM 474 CG1 VAL A1033 -2.399 -27.173 6.044 1.00 9.41 C ATOM 475 CG2 VAL A1033 -2.369 -27.058 3.523 1.00 10.39 C ATOM 476 H VAL A1033 0.772 -27.635 3.302 1.00 0.00 H ATOM 477 N GLN A1034 0.840 -26.042 6.922 1.00 7.05 N ATOM 478 CA GLN A1034 1.599 -26.320 8.132 1.00 10.09 C ATOM 479 C GLN A1034 0.663 -26.450 9.321 1.00 8.82 C ATOM 480 O GLN A1034 -0.383 -25.800 9.387 1.00 7.94 O ATOM 481 CB GLN A1034 2.608 -25.211 8.431 1.00 9.82 C ATOM 482 CG GLN A1034 3.483 -24.825 7.269 1.00 10.63 C ATOM 483 CD GLN A1034 4.315 -25.975 6.769 1.00 12.74 C ATOM 484 OE1 GLN A1034 4.864 -26.752 7.557 1.00 9.75 O ATOM 485 NE2 GLN A1034 4.404 -26.107 5.453 1.00 10.26 N ATOM 486 HE22 GLN A1034 3.924 -25.428 4.829 1.00 0.00 H ATOM 487 HE21 GLN A1034 4.954 -26.890 5.045 1.00 0.00 H ATOM 488 H GLN A1034 0.492 -25.075 6.762 1.00 0.00 H ATOM 489 N ILE A1035 1.052 -27.307 10.260 1.00 7.29 N ATOM 490 CA ILE A1035 0.447 -27.359 11.581 1.00 7.68 C ATOM 491 C ILE A1035 1.305 -26.503 12.500 1.00 9.99 C ATOM 492 O ILE A1035 2.527 -26.687 12.566 1.00 7.98 O ATOM 493 CB ILE A1035 0.350 -28.802 12.104 1.00 4.71 C ATOM 494 CG1 ILE A1035 -0.324 -29.714 11.075 1.00 8.82 C ATOM 495 CG2 ILE A1035 -0.426 -28.831 13.411 1.00 8.06 C ATOM 496 CD1 ILE A1035 -0.243 -31.195 11.445 1.00 11.38 C ATOM 497 H ILE A1035 1.823 -27.969 10.040 1.00 0.00 H ATOM 498 N VAL A1036 0.679 -25.556 13.200 1.00 8.01 N ATOM 499 CA VAL A1036 1.420 -24.602 14.012 1.00 6.79 C ATOM 500 C VAL A1036 0.882 -24.619 15.435 1.00 8.91 C ATOM 501 O VAL A1036 -0.261 -25.008 15.693 1.00 9.73 O ATOM 502 CB VAL A1036 1.356 -23.178 13.421 1.00 6.71 C ATOM 503 CG1 VAL A1036 1.972 -23.167 12.034 1.00 10.38 C ATOM 504 CG2 VAL A1036 -0.076 -22.685 13.367 1.00 8.96 C ATOM 505 H VAL A1036 -0.359 -25.498 13.165 1.00 0.00 H ATOM 506 N SER A1037 1.733 -24.198 16.368 1.00 8.94 N ATOM 507 CA SER A1037 1.361 -24.195 17.773 1.00 9.27 C ATOM 508 C SER A1037 1.955 -22.998 18.494 1.00 11.07 C ATOM 509 O SER A1037 3.033 -22.502 18.155 1.00 11.07 O ATOM 510 CB SER A1037 1.815 -25.482 18.477 1.00 12.31 C ATOM 511 OG SER A1037 1.210 -26.620 17.878 1.00 22.00 O ATOM 512 HG SER A1037 1.514 -27.438 18.345 1.00 0.00 H ATOM 513 H SER A1037 2.678 -23.866 16.087 1.00 0.00 H ATOM 514 N THR A1038 1.228 -22.546 19.495 1.00 7.11 N ATOM 515 CA THR A1038 1.754 -21.687 20.537 1.00 14.63 C ATOM 516 C THR A1038 1.813 -22.521 21.809 1.00 14.10 C ATOM 517 O THR A1038 1.589 -23.733 21.786 1.00 14.42 O ATOM 518 CB THR A1038 0.878 -20.447 20.708 1.00 13.37 C ATOM 519 OG1 THR A1038 -0.408 -20.849 21.186 1.00 13.73 O ATOM 520 CG2 THR A1038 0.711 -19.691 19.385 1.00 12.70 C ATOM 521 HG1 THR A1038 -0.981 -20.050 21.299 1.00 0.00 H ATOM 522 H THR A1038 0.226 -22.819 19.540 1.00 0.00 H ATOM 523 N ALA A1039 2.097 -21.872 22.936 1.00 16.97 N ATOM 524 CA ALA A1039 2.080 -22.596 24.201 1.00 19.41 C ATOM 525 C ALA A1039 0.683 -23.083 24.567 1.00 13.65 C ATOM 526 O ALA A1039 0.554 -24.025 25.357 1.00 19.96 O ATOM 527 CB ALA A1039 2.628 -21.705 25.318 1.00 23.21 C ATOM 528 H ALA A1039 2.329 -20.858 22.914 1.00 0.00 H ATOM 529 N THR A1040 -0.369 -22.477 24.000 1.00 12.05 N ATOM 530 CA THR A1040 -1.732 -22.720 24.439 1.00 14.42 C ATOM 531 C THR A1040 -2.688 -23.176 23.345 1.00 16.70 C ATOM 532 O THR A1040 -3.788 -23.631 23.676 1.00 14.17 O ATOM 533 CB THR A1040 -2.308 -21.448 25.083 1.00 19.17 C ATOM 534 OG1 THR A1040 -2.146 -20.341 24.186 1.00 19.55 O ATOM 535 CG2 THR A1040 -1.596 -21.151 26.380 1.00 20.33 C ATOM 536 HG1 THR A1040 -2.517 -19.523 24.602 1.00 0.00 H ATOM 537 H THR A1040 -0.204 -21.810 23.219 1.00 0.00 H ATOM 538 N GLN A1041 -2.316 -23.078 22.067 1.00 11.90 N ATOM 539 CA GLN A1041 -3.238 -23.388 20.983 1.00 11.47 C ATOM 540 C GLN A1041 -2.494 -24.084 19.853 1.00 12.44 C ATOM 541 O GLN A1041 -1.282 -23.924 19.690 1.00 10.73 O ATOM 542 CB GLN A1041 -3.923 -22.114 20.463 1.00 12.47 C ATOM 543 CG GLN A1041 -4.867 -21.474 21.464 1.00 15.70 C ATOM 544 CD GLN A1041 -5.638 -20.296 20.885 1.00 31.00 C ATOM 545 OE1 GLN A1041 -5.058 -19.396 20.278 1.00 35.52 O ATOM 546 NE2 GLN A1041 -6.953 -20.296 21.077 1.00 37.09 N ATOM 547 HE22 GLN A1041 -7.403 -21.077 21.596 1.00 0.00 H ATOM 548 HE21 GLN A1041 -7.532 -19.515 20.708 1.00 0.00 H ATOM 549 H GLN A1041 -1.348 -22.774 21.840 1.00 0.00 H ATOM 550 N THR A1042 -3.229 -24.879 19.081 1.00 9.95 N ATOM 551 CA THR A1042 -2.678 -25.458 17.863 1.00 9.47 C ATOM 552 C THR A1042 -3.707 -25.294 16.752 1.00 10.21 C ATOM 553 O THR A1042 -4.914 -25.396 16.988 1.00 9.33 O ATOM 554 CB THR A1042 -2.280 -26.937 18.043 1.00 10.77 C ATOM 555 OG1 THR A1042 -1.685 -27.428 16.833 1.00 9.59 O ATOM 556 CG2 THR A1042 -3.483 -27.798 18.406 1.00 15.66 C ATOM 557 HG1 THR A1042 -0.879 -26.894 16.623 1.00 0.00 H ATOM 558 H THR A1042 -4.211 -25.090 19.351 1.00 0.00 H ATOM 559 N PHE A1043 -3.221 -24.986 15.557 1.00 9.92 N ATOM 560 CA PHE A1043 -4.082 -24.680 14.424 1.00 8.76 C ATOM 561 C PHE A1043 -3.248 -24.868 13.160 1.00 9.53 C ATOM 562 O PHE A1043 -2.189 -25.506 13.191 1.00 8.69 O ATOM 563 CB PHE A1043 -4.701 -23.278 14.571 1.00 8.73 C ATOM 564 CG PHE A1043 -3.725 -22.197 14.988 1.00 8.97 C ATOM 565 CD1 PHE A1043 -3.312 -22.077 16.301 1.00 9.59 C ATOM 566 CD2 PHE A1043 -3.255 -21.278 14.061 1.00 7.23 C ATOM 567 CE1 PHE A1043 -2.427 -21.088 16.677 1.00 9.16 C ATOM 568 CE2 PHE A1043 -2.360 -20.286 14.425 1.00 9.66 C ATOM 569 CZ PHE A1043 -1.948 -20.186 15.732 1.00 8.51 C ATOM 570 H PHE A1043 -2.190 -24.962 15.425 1.00 0.00 H ATOM 571 N LEU A1044 -3.735 -24.346 12.038 1.00 6.89 N ATOM 572 CA LEU A1044 -3.069 -24.525 10.755 1.00 7.48 C ATOM 573 C LEU A1044 -2.632 -23.189 10.175 1.00 7.05 C ATOM 574 O LEU A1044 -3.115 -22.122 10.560 1.00 7.29 O ATOM 575 CB LEU A1044 -3.976 -25.224 9.737 1.00 8.72 C ATOM 576 CG LEU A1044 -4.488 -26.599 10.142 1.00 5.82 C ATOM 577 CD1 LEU A1044 -5.476 -27.121 9.126 1.00 7.58 C ATOM 578 CD2 LEU A1044 -3.314 -27.558 10.312 1.00 8.10 C ATOM 579 H LEU A1044 -4.616 -23.795 12.078 1.00 0.00 H ATOM 580 N ALA A1045 -1.720 -23.278 9.214 1.00 7.32 N ATOM 581 CA ALA A1045 -1.251 -22.129 8.458 1.00 10.04 C ATOM 582 C ALA A1045 -0.988 -22.581 7.028 1.00 8.05 C ATOM 583 O ALA A1045 -0.480 -23.682 6.805 1.00 8.71 O ATOM 584 CB ALA A1045 0.005 -21.531 9.093 1.00 10.11 C ATOM 585 H ALA A1045 -1.323 -24.213 8.992 1.00 0.00 H ATOM 586 N THR A1046 -1.340 -21.730 6.063 1.00 7.83 N ATOM 587 CA THR A1046 -1.381 -22.094 4.649 1.00 6.76 C ATOM 588 C THR A1046 -0.598 -21.083 3.824 1.00 8.56 C ATOM 589 O THR A1046 -0.818 -19.876 3.953 1.00 7.89 O ATOM 590 CB THR A1046 -2.832 -22.146 4.150 1.00 8.80 C ATOM 591 OG1 THR A1046 -3.552 -23.142 4.884 1.00 8.65 O ATOM 592 CG2 THR A1046 -2.900 -22.478 2.653 1.00 8.69 C ATOM 593 HG1 THR A1046 -3.541 -22.913 5.847 1.00 0.00 H ATOM 594 H THR A1046 -1.598 -20.759 6.331 1.00 0.00 H ATOM 595 N SER A1047 0.304 -21.572 2.973 1.00 8.25 N ATOM 596 CA SER A1047 1.094 -20.699 2.111 1.00 8.47 C ATOM 597 C SER A1047 0.347 -20.443 0.806 1.00 8.71 C ATOM 598 O SER A1047 -0.008 -21.385 0.090 1.00 9.23 O ATOM 599 CB SER A1047 2.471 -21.298 1.837 1.00 10.34 C ATOM 600 OG SER A1047 3.311 -21.159 2.974 1.00 9.61 O ATOM 601 HG SER A1047 2.903 -21.629 3.744 1.00 0.00 H ATOM 602 H SER A1047 0.448 -22.601 2.922 1.00 0.00 H ATOM 603 N ILE A1048 0.109 -19.166 0.507 1.00 7.79 N ATOM 604 CA ILE A1048 -0.492 -18.727 -0.749 1.00 6.24 C ATOM 605 C ILE A1048 0.293 -17.507 -1.223 1.00 8.68 C ATOM 606 O ILE A1048 0.464 -16.546 -0.468 1.00 9.83 O ATOM 607 CB ILE A1048 -1.990 -18.371 -0.596 1.00 6.00 C ATOM 608 CG1 ILE A1048 -2.788 -19.524 0.022 1.00 10.53 C ATOM 609 CG2 ILE A1048 -2.589 -17.974 -1.948 1.00 11.89 C ATOM 610 CD1 ILE A1048 -4.190 -19.131 0.483 1.00 9.49 C ATOM 611 H ILE A1048 0.366 -18.442 1.208 1.00 0.00 H ATOM 612 N ASN A1049 0.776 -17.541 -2.465 1.00 11.32 N ATOM 613 CA ASN A1049 1.490 -16.397 -3.054 1.00 12.83 C ATOM 614 C ASN A1049 2.698 -15.974 -2.216 1.00 12.78 C ATOM 615 O ASN A1049 2.967 -14.784 -2.057 1.00 15.99 O ATOM 616 CB ASN A1049 0.565 -15.191 -3.236 1.00 16.80 C ATOM 617 CG ASN A1049 -0.377 -15.334 -4.403 1.00 29.66 C ATOM 618 OD1 ASN A1049 -0.230 -16.219 -5.246 1.00 25.59 O ATOM 619 ND2 ASN A1049 -1.353 -14.438 -4.467 1.00 36.52 N ATOM 620 HD22 ASN A1049 -1.438 -13.708 -3.731 1.00 0.00 H ATOM 621 HD21 ASN A1049 -2.033 -14.466 -5.253 1.00 0.00 H ATOM 622 H ASN A1049 0.644 -18.401 -3.034 1.00 0.00 H ATOM 623 N GLY A1050 3.440 -16.940 -1.678 1.00 9.82 N ATOM 624 CA GLY A1050 4.642 -16.607 -0.926 1.00 8.36 C ATOM 625 C GLY A1050 4.407 -16.041 0.456 1.00 8.98 C ATOM 626 O GLY A1050 5.339 -15.485 1.051 1.00 10.09 O ATOM 627 H GLY A1050 3.160 -17.935 -1.795 1.00 0.00 H ATOM 628 N VAL A1051 3.189 -16.153 0.978 1.00 8.45 N ATOM 629 CA VAL A1051 2.848 -15.711 2.325 1.00 7.03 C ATOM 630 C VAL A1051 2.254 -16.897 3.061 1.00 7.04 C ATOM 631 O VAL A1051 1.398 -17.598 2.515 1.00 8.14 O ATOM 632 CB VAL A1051 1.849 -14.541 2.309 1.00 5.68 C ATOM 633 CG1 VAL A1051 1.503 -14.109 3.730 1.00 7.54 C ATOM 634 CG2 VAL A1051 2.410 -13.382 1.502 1.00 12.39 C ATOM 635 H VAL A1051 2.440 -16.578 0.395 1.00 0.00 H ATOM 636 N LEU A1052 2.713 -17.123 4.288 1.00 6.55 N ATOM 637 CA LEU A1052 2.108 -18.110 5.172 1.00 6.50 C ATOM 638 C LEU A1052 1.006 -17.416 5.966 1.00 6.89 C ATOM 639 O LEU A1052 1.286 -16.543 6.796 1.00 7.30 O ATOM 640 CB LEU A1052 3.161 -18.721 6.089 1.00 6.77 C ATOM 641 CG LEU A1052 2.686 -19.861 6.992 1.00 5.61 C ATOM 642 CD1 LEU A1052 2.345 -21.092 6.168 1.00 7.66 C ATOM 643 CD2 LEU A1052 3.759 -20.179 8.022 1.00 9.34 C ATOM 644 H LEU A1052 3.531 -16.577 4.628 1.00 0.00 H ATOM 645 N TRP A1053 -0.242 -17.800 5.704 1.00 7.00 N ATOM 646 CA TRP A1053 -1.421 -17.161 6.278 1.00 6.22 C ATOM 647 C TRP A1053 -2.018 -18.001 7.402 1.00 6.74 C ATOM 648 O TRP A1053 -2.022 -19.233 7.331 1.00 8.36 O ATOM 649 CB TRP A1053 -2.499 -16.970 5.216 1.00 9.71 C ATOM 650 CG TRP A1053 -2.096 -16.179 4.023 1.00 9.48 C ATOM 651 CD1 TRP A1053 -1.690 -16.669 2.821 1.00 8.05 C ATOM 652 CD2 TRP A1053 -2.091 -14.755 3.901 1.00 7.04 C ATOM 653 NE1 TRP A1053 -1.436 -15.639 1.949 1.00 8.15 N ATOM 654 CE2 TRP A1053 -1.669 -14.450 2.592 1.00 8.11 C ATOM 655 CE3 TRP A1053 -2.396 -13.704 4.774 1.00 7.03 C ATOM 656 CZ2 TRP A1053 -1.546 -13.140 2.133 1.00 11.71 C ATOM 657 CZ3 TRP A1053 -2.272 -12.407 4.319 1.00 9.32 C ATOM 658 CH2 TRP A1053 -1.854 -12.133 3.011 1.00 8.54 C ATOM 659 HE1 TRP A1053 -1.119 -15.743 0.964 1.00 0.00 H ATOM 660 H TRP A1053 -0.384 -18.600 5.054 1.00 0.00 H ATOM 661 N THR A1054 -2.558 -17.333 8.422 1.00 6.31 N ATOM 662 CA THR A1054 -3.326 -18.030 9.452 1.00 7.17 C ATOM 663 C THR A1054 -4.305 -17.042 10.079 1.00 8.39 C ATOM 664 O THR A1054 -4.477 -15.919 9.594 1.00 7.15 O ATOM 665 CB THR A1054 -2.394 -18.685 10.483 1.00 8.07 C ATOM 666 OG1 THR A1054 -3.143 -19.575 11.319 1.00 8.61 O ATOM 667 CG2 THR A1054 -1.706 -17.651 11.361 1.00 8.54 C ATOM 668 HG1 THR A1054 -3.560 -20.278 10.761 1.00 0.00 H ATOM 669 H THR A1054 -2.431 -16.303 8.485 1.00 0.00 H ATOM 670 N VAL A1055 -4.949 -17.463 11.164 1.00 7.40 N ATOM 671 CA VAL A1055 -6.004 -16.681 11.805 1.00 4.13 C ATOM 672 C VAL A1055 -5.434 -15.891 12.976 1.00 6.70 C ATOM 673 O VAL A1055 -4.562 -16.370 13.714 1.00 6.65 O ATOM 674 CB VAL A1055 -7.173 -17.575 12.265 1.00 8.75 C ATOM 675 CG1 VAL A1055 -8.018 -17.995 11.068 1.00 7.09 C ATOM 676 CG2 VAL A1055 -6.674 -18.787 13.037 1.00 8.70 C ATOM 677 H VAL A1055 -4.692 -18.384 11.572 1.00 0.00 H ATOM 678 N TYR A1056 -5.944 -14.673 13.149 1.00 6.88 N ATOM 679 CA TYR A1056 -5.541 -13.839 14.276 1.00 4.81 C ATOM 680 C TYR A1056 -5.951 -14.454 15.610 1.00 9.02 C ATOM 681 O TYR A1056 -5.231 -14.303 16.606 1.00 8.30 O ATOM 682 CB TYR A1056 -6.139 -12.434 14.111 1.00 7.50 C ATOM 683 CG TYR A1056 -5.685 -11.448 15.159 1.00 7.41 C ATOM 684 CD1 TYR A1056 -6.350 -11.340 16.374 1.00 9.38 C ATOM 685 CD2 TYR A1056 -4.580 -10.632 14.943 1.00 9.45 C ATOM 686 CE1 TYR A1056 -5.929 -10.446 17.339 1.00 10.19 C ATOM 687 CE2 TYR A1056 -4.154 -9.736 15.911 1.00 9.79 C ATOM 688 CZ TYR A1056 -4.838 -9.648 17.099 1.00 11.59 C ATOM 689 OH TYR A1056 -4.418 -8.767 18.063 1.00 9.65 O ATOM 690 HH TYR A1056 -5.016 -8.830 18.849 1.00 0.00 H ATOM 691 H TYR A1056 -6.642 -14.310 12.469 1.00 0.00 H ATOM 692 N HIS A1057 -7.095 -15.151 15.661 1.00 8.74 N ATOM 693 CA HIS A1057 -7.525 -15.726 16.930 1.00 9.26 C ATOM 694 C HIS A1057 -6.652 -16.897 17.361 1.00 11.09 C ATOM 695 O HIS A1057 -6.731 -17.315 18.523 1.00 9.02 O ATOM 696 CB HIS A1057 -9.016 -16.113 16.870 1.00 10.09 C ATOM 697 CG HIS A1057 -9.318 -17.399 16.158 1.00 9.18 C ATOM 698 ND1 HIS A1057 -9.755 -17.435 14.851 1.00 6.86 N ATOM 699 CD2 HIS A1057 -9.332 -18.682 16.593 1.00 8.33 C ATOM 700 CE1 HIS A1057 -9.983 -18.688 14.498 1.00 10.80 C ATOM 701 NE2 HIS A1057 -9.738 -19.466 15.537 1.00 9.44 N ATOM 702 H HIS A1057 -7.670 -15.280 14.804 1.00 0.00 H ATOM 703 N GLY A1058 -5.801 -17.407 16.475 1.00 8.09 N ATOM 704 CA GLY A1058 -4.775 -18.354 16.860 1.00 9.06 C ATOM 705 C GLY A1058 -3.444 -17.686 17.154 1.00 11.08 C ATOM 706 O GLY A1058 -2.838 -17.922 18.202 1.00 7.40 O ATOM 707 H GLY A1058 -5.874 -17.118 15.479 1.00 0.00 H ATOM 708 N ALA A1059 -2.983 -16.832 16.244 1.00 7.64 N ATOM 709 CA ALA A1059 -1.622 -16.309 16.316 1.00 7.94 C ATOM 710 C ALA A1059 -1.501 -14.980 17.052 1.00 10.56 C ATOM 711 O ALA A1059 -0.393 -14.632 17.492 1.00 8.93 O ATOM 712 CB ALA A1059 -1.058 -16.130 14.903 1.00 7.92 C ATOM 713 H ALA A1059 -3.604 -16.531 15.466 1.00 0.00 H ATOM 714 N GLY A1060 -2.588 -14.227 17.188 1.00 8.40 N ATOM 715 CA GLY A1060 -2.452 -12.865 17.665 1.00 9.43 C ATOM 716 C GLY A1060 -1.443 -12.128 16.819 1.00 7.50 C ATOM 717 O GLY A1060 -1.363 -12.326 15.607 1.00 8.00 O ATOM 718 H GLY A1060 -3.526 -14.611 16.955 1.00 0.00 H ATOM 719 N THR A1061 -0.644 -11.281 17.470 1.00 9.07 N ATOM 720 CA THR A1061 0.423 -10.522 16.830 1.00 7.37 C ATOM 721 C THR A1061 1.781 -11.225 16.902 1.00 10.67 C ATOM 722 O THR A1061 2.818 -10.575 16.704 1.00 7.94 O ATOM 723 CB THR A1061 0.536 -9.145 17.485 1.00 10.72 C ATOM 724 OG1 THR A1061 0.799 -9.322 18.882 1.00 9.45 O ATOM 725 CG2 THR A1061 -0.750 -8.351 17.322 1.00 6.83 C ATOM 726 HG1 THR A1061 1.647 -9.820 18.996 1.00 0.00 H ATOM 727 H THR A1061 -0.791 -11.155 18.492 1.00 0.00 H ATOM 728 N ARG A1062 1.797 -12.528 17.163 1.00 8.03 N ATOM 729 CA ARG A1062 3.042 -13.231 17.437 1.00 9.35 C ATOM 730 C ARG A1062 3.947 -13.311 16.212 1.00 10.32 C ATOM 731 O ARG A1062 3.494 -13.387 15.067 1.00 8.50 O ATOM 732 CB ARG A1062 2.760 -14.649 17.926 1.00 8.93 C ATOM 733 CG ARG A1062 2.245 -14.767 19.340 1.00 11.55 C ATOM 734 CD ARG A1062 1.899 -16.222 19.603 1.00 12.85 C ATOM 735 NE ARG A1062 1.446 -16.488 20.965 1.00 16.30 N ATOM 736 CZ ARG A1062 0.205 -16.311 21.396 1.00 22.72 C ATOM 737 NH1 ARG A1062 -0.731 -15.830 20.582 1.00 29.08 N ATOM 738 NH2 ARG A1062 -0.097 -16.604 22.656 1.00 31.79 N ATOM 739 HE ARG A1062 2.148 -16.842 21.646 1.00 0.00 H ATOM 740 HH12 ARG A1062 -1.702 -15.694 20.929 1.00 0.00 H ATOM 741 HH11 ARG A1062 -0.492 -15.590 19.599 1.00 0.00 H ATOM 742 HH22 ARG A1062 -1.068 -16.468 23.003 1.00 0.00 H ATOM 743 HH21 ARG A1062 0.638 -16.969 23.295 1.00 0.00 H ATOM 744 H ARG A1062 0.901 -13.057 17.172 1.00 0.00 H ATOM 745 N THR A1063 5.250 -13.302 16.478 1.00 8.92 N ATOM 746 CA THR A1063 6.237 -13.720 15.505 1.00 10.22 C ATOM 747 C THR A1063 6.110 -15.219 15.242 1.00 7.80 C ATOM 748 O THR A1063 5.479 -15.960 16.002 1.00 8.02 O ATOM 749 CB THR A1063 7.646 -13.422 16.015 1.00 7.90 C ATOM 750 OG1 THR A1063 7.826 -14.062 17.290 1.00 10.11 O ATOM 751 CG2 THR A1063 7.878 -11.932 16.161 1.00 12.39 C ATOM 752 HG1 THR A1063 7.707 -15.039 17.187 1.00 0.00 H ATOM 753 H THR A1063 5.570 -12.984 17.415 1.00 0.00 H ATOM 754 N ILE A1064 6.743 -15.667 14.161 1.00 7.95 N ATOM 755 CA ILE A1064 6.904 -17.088 13.871 1.00 8.30 C ATOM 756 C ILE A1064 8.388 -17.433 13.945 1.00 10.85 C ATOM 757 O ILE A1064 9.247 -16.619 13.583 1.00 10.25 O ATOM 758 CB ILE A1064 6.305 -17.469 12.499 1.00 7.30 C ATOM 759 CG1 ILE A1064 6.273 -18.998 12.354 1.00 10.40 C ATOM 760 CG2 ILE A1064 7.061 -16.821 11.353 1.00 9.68 C ATOM 761 CD1 ILE A1064 5.421 -19.482 11.200 1.00 10.45 C ATOM 762 H ILE A1064 7.140 -14.975 13.494 1.00 0.00 H ATOM 763 N ALA A1065 8.685 -18.632 14.441 1.00 8.66 N ATOM 764 CA ALA A1065 10.065 -19.089 14.549 1.00 10.35 C ATOM 765 C ALA A1065 10.631 -19.429 13.176 1.00 10.71 C ATOM 766 O ALA A1065 9.922 -19.915 12.292 1.00 10.93 O ATOM 767 CB ALA A1065 10.147 -20.314 15.458 1.00 10.78 C ATOM 768 H ALA A1065 7.916 -19.256 14.758 1.00 0.00 H ATOM 769 N SER A1066 11.925 -19.173 13.004 1.00 11.26 N ATOM 770 CA SER A1066 12.609 -19.430 11.748 1.00 12.58 C ATOM 771 C SER A1066 14.061 -19.761 12.054 1.00 13.34 C ATOM 772 O SER A1066 14.529 -19.561 13.181 1.00 14.42 O ATOM 773 CB SER A1066 12.523 -18.228 10.798 1.00 14.25 C ATOM 774 OG SER A1066 13.535 -17.282 11.098 1.00 15.97 O ATOM 775 HG SER A1066 13.423 -16.965 12.029 1.00 0.00 H ATOM 776 H SER A1066 12.467 -18.774 13.797 1.00 0.00 H ATOM 777 N PRO A1067 14.807 -20.264 11.071 1.00 13.58 N ATOM 778 CA PRO A1067 16.193 -20.673 11.347 1.00 13.88 C ATOM 779 C PRO A1067 17.054 -19.583 11.953 1.00 16.25 C ATOM 780 O PRO A1067 17.962 -19.893 12.737 1.00 24.31 O ATOM 781 CB PRO A1067 16.705 -21.096 9.966 1.00 19.44 C ATOM 782 CG PRO A1067 15.491 -21.579 9.265 1.00 15.66 C ATOM 783 CD PRO A1067 14.384 -20.655 9.713 1.00 15.31 C ATOM 784 N LYS A1068 16.800 -18.318 11.624 1.00 16.75 N ATOM 785 CA LYS A1068 17.622 -17.213 12.096 1.00 14.78 C ATOM 786 C LYS A1068 16.916 -16.357 13.145 1.00 19.58 C ATOM 787 O LYS A1068 17.401 -15.269 13.469 1.00 20.74 O ATOM 788 CB LYS A1068 18.056 -16.351 10.907 1.00 17.80 C ATOM 789 H LYS A1068 15.987 -18.112 11.009 1.00 0.00 H ATOM 790 N GLY A1069 15.794 -16.825 13.694 1.00 12.94 N ATOM 791 CA GLY A1069 15.135 -16.142 14.782 1.00 14.92 C ATOM 792 C GLY A1069 13.713 -15.726 14.463 1.00 15.25 C ATOM 793 O GLY A1069 13.176 -16.022 13.393 1.00 16.16 O ATOM 794 H GLY A1069 15.382 -17.707 13.328 1.00 0.00 H ATOM 795 N PRO A1070 13.080 -15.016 15.396 1.00 13.54 N ATOM 796 CA PRO A1070 11.672 -14.638 15.212 1.00 13.17 C ATOM 797 C PRO A1070 11.473 -13.746 13.997 1.00 15.27 C ATOM 798 O PRO A1070 12.241 -12.810 13.760 1.00 13.22 O ATOM 799 CB PRO A1070 11.328 -13.889 16.507 1.00 17.53 C ATOM 800 CG PRO A1070 12.398 -14.235 17.479 1.00 20.64 C ATOM 801 CD PRO A1070 13.623 -14.551 16.683 1.00 15.84 C ATOM 802 N VAL A1071 10.405 -14.024 13.251 1.00 10.35 N ATOM 803 CA VAL A1071 10.024 -13.254 12.069 1.00 9.31 C ATOM 804 C VAL A1071 8.721 -12.531 12.372 1.00 9.62 C ATOM 805 O VAL A1071 7.728 -13.165 12.745 1.00 8.84 O ATOM 806 CB VAL A1071 9.872 -14.157 10.832 1.00 14.46 C ATOM 807 CG1 VAL A1071 9.269 -13.382 9.643 1.00 13.05 C ATOM 808 CG2 VAL A1071 11.218 -14.750 10.443 1.00 14.87 C ATOM 809 H VAL A1071 9.811 -14.832 13.524 1.00 0.00 H ATOM 810 N THR A1072 8.724 -11.213 12.184 1.00 11.67 N ATOM 811 CA THR A1072 7.559 -10.382 12.462 1.00 10.36 C ATOM 812 C THR A1072 6.513 -10.525 11.364 1.00 9.39 C ATOM 813 O THR A1072 6.845 -10.666 10.182 1.00 9.52 O ATOM 814 CB THR A1072 7.992 -8.921 12.596 1.00 11.01 C ATOM 815 OG1 THR A1072 8.845 -8.799 13.740 1.00 11.23 O ATOM 816 CG2 THR A1072 6.796 -7.989 12.763 1.00 14.20 C ATOM 817 HG1 THR A1072 8.350 -9.080 14.550 1.00 0.00 H ATOM 818 H THR A1072 9.589 -10.760 11.826 1.00 0.00 H ATOM 819 N GLN A1073 5.243 -10.491 11.762 1.00 6.98 N ATOM 820 CA GLN A1073 4.162 -10.530 10.792 1.00 7.58 C ATOM 821 C GLN A1073 4.330 -9.442 9.751 1.00 9.24 C ATOM 822 O GLN A1073 4.720 -8.313 10.053 1.00 9.39 O ATOM 823 CB GLN A1073 2.811 -10.369 11.479 1.00 7.34 C ATOM 824 CG GLN A1073 2.426 -11.599 12.263 1.00 5.55 C ATOM 825 CD GLN A1073 1.139 -11.449 13.029 1.00 7.37 C ATOM 826 OE1 GLN A1073 0.337 -10.548 12.769 1.00 7.46 O ATOM 827 NE2 GLN A1073 0.922 -12.354 13.978 1.00 8.69 N ATOM 828 HE22 GLN A1073 1.628 -13.095 14.161 1.00 0.00 H ATOM 829 HE21 GLN A1073 0.046 -12.321 14.538 1.00 0.00 H ATOM 830 H GLN A1073 5.023 -10.436 12.777 1.00 0.00 H ATOM 831 N MET A1074 4.018 -9.813 8.516 1.00 8.03 N ATOM 832 CA MET A1074 3.977 -8.924 7.374 1.00 8.83 C ATOM 833 C MET A1074 2.569 -8.404 7.106 1.00 12.13 C ATOM 834 O MET A1074 2.415 -7.317 6.537 1.00 9.90 O ATOM 835 CB MET A1074 4.535 -9.712 6.181 1.00 16.74 C ATOM 836 CG MET A1074 4.314 -9.231 4.791 1.00 31.78 C ATOM 837 SD MET A1074 4.906 -10.606 3.768 1.00 12.56 S ATOM 838 CE MET A1074 6.671 -10.418 3.988 1.00 10.21 C ATOM 839 H MET A1074 3.786 -10.814 8.357 1.00 0.00 H ATOM 840 N TYR A1075 1.550 -9.139 7.540 1.00 8.38 N ATOM 841 CA TYR A1075 0.160 -8.710 7.472 1.00 7.71 C ATOM 842 C TYR A1075 -0.535 -9.006 8.792 1.00 10.33 C ATOM 843 O TYR A1075 -0.357 -10.083 9.364 1.00 9.62 O ATOM 844 CB TYR A1075 -0.592 -9.430 6.364 1.00 6.78 C ATOM 845 CG TYR A1075 0.057 -9.301 5.010 1.00 9.76 C ATOM 846 CD1 TYR A1075 -0.043 -8.124 4.284 1.00 12.25 C ATOM 847 CD2 TYR A1075 0.764 -10.360 4.458 1.00 9.15 C ATOM 848 CE1 TYR A1075 0.544 -8.001 3.039 1.00 9.76 C ATOM 849 CE2 TYR A1075 1.353 -10.250 3.222 1.00 8.29 C ATOM 850 CZ TYR A1075 1.244 -9.066 2.515 1.00 9.26 C ATOM 851 OH TYR A1075 1.829 -8.961 1.279 1.00 11.05 O ATOM 852 HH TYR A1075 1.659 -8.058 0.911 1.00 0.00 H ATOM 853 H TYR A1075 1.757 -10.072 7.951 1.00 0.00 H ATOM 854 N THR A1076 -1.362 -8.064 9.245 1.00 7.13 N ATOM 855 CA THR A1076 -2.183 -8.257 10.438 1.00 8.25 C ATOM 856 C THR A1076 -3.505 -7.547 10.205 1.00 13.68 C ATOM 857 O THR A1076 -3.507 -6.338 9.944 1.00 9.80 O ATOM 858 CB THR A1076 -1.495 -7.697 11.687 1.00 11.03 C ATOM 859 OG1 THR A1076 -0.128 -8.123 11.725 1.00 9.91 O ATOM 860 CG2 THR A1076 -2.210 -8.162 12.944 1.00 8.86 C ATOM 861 HG1 THR A1076 0.342 -7.794 10.918 1.00 0.00 H ATOM 862 H THR A1076 -1.425 -7.161 8.732 1.00 0.00 H ATOM 863 N ASN A1077 -4.620 -8.282 10.278 1.00 9.66 N ATOM 864 CA ASN A1077 -5.937 -7.658 10.126 1.00 8.77 C ATOM 865 C ASN A1077 -6.927 -8.366 11.046 1.00 7.14 C ATOM 866 O ASN A1077 -7.517 -9.383 10.674 1.00 10.76 O ATOM 867 CB ASN A1077 -6.419 -7.676 8.686 1.00 11.47 C ATOM 868 CG ASN A1077 -7.664 -6.841 8.504 1.00 13.95 C ATOM 869 OD1 ASN A1077 -8.481 -6.735 9.416 1.00 10.26 O ATOM 870 ND2 ASN A1077 -7.812 -6.227 7.337 1.00 17.06 N ATOM 871 HD22 ASN A1077 -7.095 -6.345 6.593 1.00 0.00 H ATOM 872 HD21 ASN A1077 -8.645 -5.628 7.167 1.00 0.00 H ATOM 873 H ASN A1077 -4.552 -9.306 10.444 1.00 0.00 H ATOM 874 N VAL A1078 -7.163 -7.764 12.212 1.00 7.22 N ATOM 875 CA VAL A1078 -8.049 -8.342 13.205 1.00 6.80 C ATOM 876 C VAL A1078 -9.483 -8.323 12.708 1.00 9.57 C ATOM 877 O VAL A1078 -10.285 -9.183 13.083 1.00 9.30 O ATOM 878 CB VAL A1078 -7.888 -7.585 14.540 1.00 9.18 C ATOM 879 CG1 VAL A1078 -8.359 -6.140 14.401 1.00 12.00 C ATOM 880 CG2 VAL A1078 -8.635 -8.294 15.665 1.00 12.34 C ATOM 881 H VAL A1078 -6.699 -6.855 12.415 1.00 0.00 H ATOM 882 N ASP A1079 -9.826 -7.359 11.847 1.00 10.90 N ATOM 883 CA ASP A1079 -11.190 -7.276 11.333 1.00 11.16 C ATOM 884 C ASP A1079 -11.526 -8.458 10.436 1.00 11.61 C ATOM 885 O ASP A1079 -12.699 -8.819 10.305 1.00 12.15 O ATOM 886 CB ASP A1079 -11.390 -5.971 10.568 1.00 13.08 C ATOM 887 CG ASP A1079 -11.314 -4.756 11.468 1.00 15.24 C ATOM 888 OD1 ASP A1079 -11.777 -4.852 12.622 1.00 15.49 O ATOM 889 OD2 ASP A1079 -10.804 -3.712 11.022 1.00 17.39 O ATOM 890 H ASP A1079 -9.116 -6.663 11.541 1.00 0.00 H ATOM 891 N LYS A1080 -10.521 -9.059 9.806 1.00 9.02 N ATOM 892 CA LYS A1080 -10.702 -10.247 8.987 1.00 10.24 C ATOM 893 C LYS A1080 -10.266 -11.523 9.694 1.00 8.72 C ATOM 894 O LYS A1080 -10.369 -12.601 9.107 1.00 9.33 O ATOM 895 CB LYS A1080 -9.910 -10.116 7.684 1.00 12.07 C ATOM 896 CG LYS A1080 -10.282 -8.932 6.803 1.00 15.48 C ATOM 897 CD LYS A1080 -9.425 -8.955 5.540 1.00 20.70 C ATOM 898 CE LYS A1080 -9.629 -7.729 4.664 1.00 35.18 C ATOM 899 NZ LYS A1080 -8.733 -7.752 3.466 1.00 21.39 N ATOM 900 HZ1 LYS A1080 -7.741 -7.772 3.777 1.00 0.00 H ATOM 901 HZ2 LYS A1080 -8.937 -8.599 2.898 1.00 0.00 H ATOM 902 HZ3 LYS A1080 -8.901 -6.901 2.893 1.00 0.00 H ATOM 903 H LYS A1080 -9.564 -8.662 9.903 1.00 0.00 H ATOM 904 N ASP A1081 -9.765 -11.424 10.926 1.00 9.86 N ATOM 905 CA ASP A1081 -9.202 -12.566 11.641 1.00 8.90 C ATOM 906 C ASP A1081 -8.023 -13.170 10.882 1.00 8.83 C ATOM 907 O ASP A1081 -7.882 -14.393 10.804 1.00 8.12 O ATOM 908 CB ASP A1081 -10.271 -13.631 11.896 1.00 6.66 C ATOM 909 CG ASP A1081 -9.860 -14.621 12.959 1.00 10.33 C ATOM 910 OD1 ASP A1081 -8.891 -14.331 13.693 1.00 9.32 O ATOM 911 OD2 ASP A1081 -10.511 -15.689 13.070 1.00 8.07 O ATOM 912 H ASP A1081 -9.776 -10.496 11.396 1.00 0.00 H ATOM 913 N LEU A1082 -7.155 -12.309 10.339 1.00 6.18 N ATOM 914 CA LEU A1082 -6.135 -12.719 9.379 1.00 8.11 C ATOM 915 C LEU A1082 -4.763 -12.196 9.778 1.00 9.32 C ATOM 916 O LEU A1082 -4.619 -11.022 10.130 1.00 10.57 O ATOM 917 CB LEU A1082 -6.485 -12.197 7.977 1.00 9.83 C ATOM 918 CG LEU A1082 -5.554 -12.547 6.812 1.00 7.37 C ATOM 919 CD1 LEU A1082 -5.609 -14.035 6.474 1.00 9.25 C ATOM 920 CD2 LEU A1082 -5.919 -11.713 5.585 1.00 13.33 C ATOM 921 H LEU A1082 -7.209 -11.307 10.612 1.00 0.00 H ATOM 922 N VAL A1083 -3.745 -13.058 9.692 1.00 8.48 N ATOM 923 CA VAL A1083 -2.357 -12.618 9.782 1.00 9.07 C ATOM 924 C VAL A1083 -1.539 -13.369 8.736 1.00 9.43 C ATOM 925 O VAL A1083 -1.944 -14.418 8.231 1.00 6.50 O ATOM 926 CB VAL A1083 -1.738 -12.820 11.187 1.00 10.93 C ATOM 927 CG1 VAL A1083 -2.675 -12.315 12.275 1.00 11.92 C ATOM 928 CG2 VAL A1083 -1.364 -14.270 11.434 1.00 12.68 C ATOM 929 H VAL A1083 -3.948 -14.069 9.557 1.00 0.00 H ATOM 930 N GLY A1084 -0.368 -12.827 8.433 1.00 7.91 N ATOM 931 CA GLY A1084 0.527 -13.460 7.479 1.00 9.62 C ATOM 932 C GLY A1084 1.972 -13.135 7.779 1.00 8.94 C ATOM 933 O GLY A1084 2.304 -12.033 8.225 1.00 8.77 O ATOM 934 H GLY A1084 -0.085 -11.934 8.885 1.00 0.00 H ATOM 935 N TRP A1085 2.836 -14.116 7.533 1.00 7.82 N ATOM 936 CA TRP A1085 4.280 -13.958 7.544 1.00 9.03 C ATOM 937 C TRP A1085 4.823 -14.365 6.182 1.00 8.79 C ATOM 938 O TRP A1085 4.196 -15.133 5.449 1.00 7.45 O ATOM 939 CB TRP A1085 4.969 -14.843 8.597 1.00 7.88 C ATOM 940 CG TRP A1085 4.466 -14.801 10.014 1.00 8.03 C ATOM 941 CD1 TRP A1085 4.910 -13.997 11.026 1.00 7.89 C ATOM 942 CD2 TRP A1085 3.485 -15.666 10.593 1.00 8.95 C ATOM 943 NE1 TRP A1085 4.239 -14.288 12.192 1.00 8.11 N ATOM 944 CE2 TRP A1085 3.362 -15.313 11.953 1.00 8.01 C ATOM 945 CE3 TRP A1085 2.690 -16.701 10.091 1.00 9.35 C ATOM 946 CZ2 TRP A1085 2.470 -15.949 12.811 1.00 9.43 C ATOM 947 CZ3 TRP A1085 1.802 -17.330 10.946 1.00 10.75 C ATOM 948 CH2 TRP A1085 1.706 -16.958 12.291 1.00 9.45 C ATOM 949 HE1 TRP A1085 4.375 -13.808 13.105 1.00 0.00 H ATOM 950 H TRP A1085 2.452 -15.059 7.319 1.00 0.00 H ATOM 951 N GLN A1086 6.016 -13.880 5.854 1.00 8.91 N ATOM 952 CA GLN A1086 6.704 -14.380 4.673 1.00 9.69 C ATOM 953 C GLN A1086 6.791 -15.900 4.737 1.00 10.38 C ATOM 954 O GLN A1086 7.087 -16.474 5.787 1.00 9.55 O ATOM 955 CB GLN A1086 8.106 -13.773 4.571 1.00 12.24 C ATOM 956 CG GLN A1086 9.025 -14.141 5.724 1.00 9.36 C ATOM 957 CD GLN A1086 10.034 -13.058 6.037 1.00 14.72 C ATOM 958 OE1 GLN A1086 9.668 -11.925 6.356 1.00 13.77 O ATOM 959 NE2 GLN A1086 11.315 -13.396 5.937 1.00 16.00 N ATOM 960 HE22 GLN A1086 11.577 -14.365 5.664 1.00 0.00 H ATOM 961 HE21 GLN A1086 12.055 -12.692 6.131 1.00 0.00 H ATOM 962 H GLN A1086 6.458 -13.144 6.441 1.00 0.00 H ATOM 963 N ALA A1087 6.536 -16.549 3.605 1.00 10.24 N ATOM 964 CA ALA A1087 6.497 -18.003 3.587 1.00 9.75 C ATOM 965 C ALA A1087 7.879 -18.571 3.911 1.00 13.01 C ATOM 966 O ALA A1087 8.888 -18.063 3.416 1.00 13.02 O ATOM 967 CB ALA A1087 6.024 -18.504 2.230 1.00 9.00 C ATOM 968 H ALA A1087 6.364 -16.015 2.729 1.00 0.00 H ATOM 969 N PRO A1088 7.963 -19.607 4.750 1.00 11.01 N ATOM 970 CA PRO A1088 9.282 -20.148 5.110 1.00 11.37 C ATOM 971 C PRO A1088 10.004 -20.729 3.906 1.00 16.69 C ATOM 972 O PRO A1088 9.392 -21.278 2.990 1.00 16.71 O ATOM 973 CB PRO A1088 8.958 -21.247 6.135 1.00 15.70 C ATOM 974 CG PRO A1088 7.569 -20.999 6.577 1.00 16.94 C ATOM 975 CD PRO A1088 6.868 -20.282 5.474 1.00 12.83 C ATOM 976 N GLN A1089 11.332 -20.606 3.920 1.00 15.33 N ATOM 977 CA GLN A1089 12.156 -21.295 2.934 1.00 17.82 C ATOM 978 C GLN A1089 11.826 -22.781 2.923 1.00 15.53 C ATOM 979 O GLN A1089 11.789 -23.429 3.971 1.00 16.94 O ATOM 980 CB GLN A1089 13.639 -21.094 3.251 1.00 24.10 C ATOM 981 CG GLN A1089 14.189 -19.753 2.823 1.00 32.28 C ATOM 982 CD GLN A1089 14.329 -19.642 1.317 1.00 37.57 C ATOM 983 OE1 GLN A1089 15.017 -20.446 0.685 1.00 48.14 O ATOM 984 NE2 GLN A1089 13.666 -18.651 0.731 1.00 36.64 N ATOM 985 HE22 GLN A1089 13.097 -17.996 1.304 1.00 0.00 H ATOM 986 HE21 GLN A1089 13.716 -18.531 -0.301 1.00 0.00 H ATOM 987 H GLN A1089 11.785 -20.011 4.643 1.00 0.00 H ATOM 988 N GLY A1090 11.580 -23.319 1.733 1.00 19.78 N ATOM 989 CA GLY A1090 11.263 -24.717 1.570 1.00 23.70 C ATOM 990 C GLY A1090 9.782 -25.013 1.462 1.00 17.10 C ATOM 991 O GLY A1090 9.413 -26.079 0.959 1.00 17.29 O ATOM 992 H GLY A1090 11.617 -22.711 0.890 1.00 0.00 H ATOM 993 N SER A1091 8.928 -24.107 1.922 1.00 13.69 N ATOM 994 CA SER A1091 7.502 -24.271 1.709 1.00 11.35 C ATOM 995 C SER A1091 7.176 -24.180 0.219 1.00 14.55 C ATOM 996 O SER A1091 7.966 -23.687 -0.594 1.00 16.76 O ATOM 997 CB SER A1091 6.723 -23.207 2.485 1.00 15.15 C ATOM 998 OG SER A1091 7.079 -21.908 2.050 1.00 14.63 O ATOM 999 HG SER A1091 8.048 -21.766 2.197 1.00 0.00 H ATOM 1000 H SER A1091 9.282 -23.276 2.437 1.00 0.00 H ATOM 1001 N ARG A1092 5.995 -24.679 -0.135 1.00 14.86 N ATOM 1002 CA ARG A1092 5.411 -24.475 -1.451 1.00 15.55 C ATOM 1003 C ARG A1092 4.116 -23.694 -1.275 1.00 15.28 C ATOM 1004 O ARG A1092 3.412 -23.877 -0.279 1.00 15.89 O ATOM 1005 CB ARG A1092 5.144 -25.815 -2.162 1.00 16.88 C ATOM 1006 H ARG A1092 5.465 -25.241 0.561 1.00 0.00 H ATOM 1007 N SER A1093 3.811 -22.805 -2.219 1.00 9.88 N ATOM 1008 CA SER A1093 2.625 -21.967 -2.118 1.00 9.53 C ATOM 1009 C SER A1093 1.515 -22.487 -3.017 1.00 12.12 C ATOM 1010 O SER A1093 1.760 -22.915 -4.152 1.00 10.54 O ATOM 1011 CB SER A1093 2.907 -20.509 -2.505 1.00 12.27 C ATOM 1012 OG SER A1093 3.330 -19.731 -1.408 1.00 14.25 O ATOM 1013 HG SER A1093 4.163 -20.114 -1.035 1.00 0.00 H ATOM 1014 H SER A1093 4.434 -22.708 -3.046 1.00 0.00 H ATOM 1015 N LEU A1094 0.292 -22.416 -2.510 1.00 9.12 N ATOM 1016 CA LEU A1094 -0.880 -22.609 -3.343 1.00 8.80 C ATOM 1017 C LEU A1094 -1.077 -21.395 -4.242 1.00 10.98 C ATOM 1018 O LEU A1094 -0.685 -20.272 -3.907 1.00 10.91 O ATOM 1019 CB LEU A1094 -2.122 -22.827 -2.478 1.00 10.90 C ATOM 1020 CG LEU A1094 -2.091 -24.085 -1.610 1.00 13.12 C ATOM 1021 CD1 LEU A1094 -3.203 -24.018 -0.588 1.00 12.52 C ATOM 1022 CD2 LEU A1094 -2.218 -25.344 -2.456 1.00 13.73 C ATOM 1023 H LEU A1094 0.171 -22.218 -1.496 1.00 0.00 H ATOM 1024 N THR A1095 -1.675 -21.635 -5.393 1.00 12.93 N ATOM 1025 CA THR A1095 -2.017 -20.579 -6.338 1.00 13.35 C ATOM 1026 C THR A1095 -3.430 -20.077 -6.066 1.00 10.51 C ATOM 1027 O THR A1095 -4.340 -20.893 -5.877 1.00 14.41 O ATOM 1028 CB THR A1095 -1.924 -21.089 -7.768 1.00 19.46 C ATOM 1029 OG1 THR A1095 -0.592 -21.551 -8.021 1.00 19.29 O ATOM 1030 CG2 THR A1095 -2.259 -19.977 -8.758 1.00 17.53 C ATOM 1031 HG1 THR A1095 -0.373 -22.284 -7.393 1.00 0.00 H ATOM 1032 H THR A1095 -1.912 -22.618 -5.636 1.00 0.00 H ATOM 1033 N PRO A1096 -3.659 -18.764 -6.034 1.00 11.08 N ATOM 1034 CA PRO A1096 -5.026 -18.269 -5.835 1.00 10.74 C ATOM 1035 C PRO A1096 -5.942 -18.720 -6.963 1.00 13.15 C ATOM 1036 O PRO A1096 -5.592 -18.650 -8.144 1.00 11.96 O ATOM 1037 CB PRO A1096 -4.860 -16.747 -5.814 1.00 13.80 C ATOM 1038 CG PRO A1096 -3.435 -16.514 -5.484 1.00 22.19 C ATOM 1039 CD PRO A1096 -2.673 -17.671 -6.051 1.00 17.85 C ATOM 1040 N CYS A1097 -7.131 -19.178 -6.583 1.00 11.45 N ATOM 1041 CA CYS A1097 -8.085 -19.719 -7.540 1.00 10.54 C ATOM 1042 C CYS A1097 -8.743 -18.600 -8.336 1.00 12.22 C ATOM 1043 O CYS A1097 -9.176 -17.592 -7.767 1.00 12.35 O ATOM 1044 CB CYS A1097 -9.162 -20.533 -6.822 1.00 12.07 C ATOM 1045 SG CYS A1097 -10.355 -21.287 -7.955 1.00 9.47 S ATOM 1046 H CYS A1097 -7.386 -19.149 -5.575 1.00 0.00 H ATOM 1047 N THR A1098 -8.821 -18.787 -9.656 1.00 10.83 N ATOM 1048 CA THR A1098 -9.609 -17.916 -10.523 1.00 13.43 C ATOM 1049 C THR A1098 -10.669 -18.699 -11.294 1.00 13.48 C ATOM 1050 O THR A1098 -11.189 -18.203 -12.298 1.00 11.27 O ATOM 1051 CB THR A1098 -8.706 -17.167 -11.504 1.00 14.66 C ATOM 1052 OG1 THR A1098 -8.039 -18.108 -12.352 1.00 14.44 O ATOM 1053 CG2 THR A1098 -7.675 -16.342 -10.767 1.00 13.74 C ATOM 1054 HG1 THR A1098 -8.712 -18.631 -12.855 1.00 0.00 H ATOM 1055 H THR A1098 -8.302 -19.581 -10.081 1.00 0.00 H ATOM 1056 N CYS A1099 -11.004 -19.910 -10.834 1.00 10.75 N ATOM 1057 CA CYS A1099 -11.924 -20.779 -11.562 1.00 11.21 C ATOM 1058 C CYS A1099 -13.370 -20.320 -11.442 1.00 12.14 C ATOM 1059 O CYS A1099 -14.194 -20.650 -12.305 1.00 12.38 O ATOM 1060 CB CYS A1099 -11.818 -22.223 -11.042 1.00 12.71 C ATOM 1061 SG CYS A1099 -10.220 -23.006 -11.319 1.00 12.37 S ATOM 1062 H CYS A1099 -10.599 -20.241 -9.935 1.00 0.00 H ATOM 1063 N GLY A1100 -13.712 -19.609 -10.372 1.00 11.93 N ATOM 1064 CA GLY A1100 -15.104 -19.272 -10.136 1.00 12.53 C ATOM 1065 C GLY A1100 -15.986 -20.469 -9.862 1.00 13.95 C ATOM 1066 O GLY A1100 -17.190 -20.413 -10.136 1.00 16.33 O ATOM 1067 H GLY A1100 -12.981 -19.294 -9.703 1.00 0.00 H ATOM 1068 N SER A1101 -15.422 -21.552 -9.323 1.00 9.89 N ATOM 1069 CA SER A1101 -16.167 -22.769 -9.032 1.00 12.92 C ATOM 1070 C SER A1101 -16.685 -22.746 -7.599 1.00 12.40 C ATOM 1071 O SER A1101 -16.080 -22.140 -6.714 1.00 12.25 O ATOM 1072 CB SER A1101 -15.285 -24.002 -9.242 1.00 17.52 C ATOM 1073 OG SER A1101 -15.899 -25.180 -8.722 1.00 16.23 O ATOM 1074 HG SER A1101 -15.303 -25.956 -8.874 1.00 0.00 H ATOM 1075 H SER A1101 -14.406 -21.526 -9.101 1.00 0.00 H ATOM 1076 N SER A1102 -17.824 -23.408 -7.380 1.00 10.96 N ATOM 1077 CA SER A1102 -18.429 -23.494 -6.054 1.00 9.13 C ATOM 1078 C SER A1102 -18.323 -24.884 -5.438 1.00 10.43 C ATOM 1079 O SER A1102 -18.920 -25.128 -4.382 1.00 9.68 O ATOM 1080 CB SER A1102 -19.898 -23.071 -6.111 1.00 12.89 C ATOM 1081 OG SER A1102 -20.019 -21.666 -6.262 1.00 12.03 O ATOM 1082 HG SER A1102 -19.575 -21.386 -7.102 1.00 0.00 H ATOM 1083 H SER A1102 -18.295 -23.877 -8.180 1.00 0.00 H ATOM 1084 N ASP A1103 -17.581 -25.798 -6.057 1.00 10.11 N ATOM 1085 CA ASP A1103 -17.377 -27.136 -5.504 1.00 8.12 C ATOM 1086 C ASP A1103 -15.999 -27.138 -4.856 1.00 10.97 C ATOM 1087 O ASP A1103 -14.978 -27.246 -5.539 1.00 12.38 O ATOM 1088 CB ASP A1103 -17.515 -28.203 -6.584 1.00 9.62 C ATOM 1089 CG ASP A1103 -18.936 -28.325 -7.106 1.00 13.53 C ATOM 1090 OD1 ASP A1103 -19.886 -28.076 -6.329 1.00 10.86 O ATOM 1091 OD2 ASP A1103 -19.104 -28.678 -8.292 1.00 13.28 O ATOM 1092 H ASP A1103 -17.132 -25.553 -6.963 1.00 0.00 H ATOM 1093 N LEU A1104 -15.975 -26.993 -3.538 1.00 8.34 N ATOM 1094 CA LEU A1104 -14.750 -26.768 -2.790 1.00 6.93 C ATOM 1095 C LEU A1104 -14.412 -27.974 -1.929 1.00 11.54 C ATOM 1096 O LEU A1104 -15.198 -28.914 -1.781 1.00 10.18 O ATOM 1097 CB LEU A1104 -14.877 -25.521 -1.911 1.00 10.93 C ATOM 1098 CG LEU A1104 -15.445 -24.283 -2.621 1.00 8.96 C ATOM 1099 CD1 LEU A1104 -15.543 -23.113 -1.658 1.00 11.74 C ATOM 1100 CD2 LEU A1104 -14.587 -23.926 -3.809 1.00 8.33 C ATOM 1101 H LEU A1104 -16.873 -27.043 -3.016 1.00 0.00 H ATOM 1102 N TYR A1105 -13.209 -27.922 -1.361 1.00 7.76 N ATOM 1103 CA TYR A1105 -12.680 -28.976 -0.508 1.00 7.73 C ATOM 1104 C TYR A1105 -11.910 -28.342 0.638 1.00 12.43 C ATOM 1105 O TYR A1105 -10.997 -27.546 0.403 1.00 12.52 O ATOM 1106 CB TYR A1105 -11.771 -29.908 -1.315 1.00 7.33 C ATOM 1107 CG TYR A1105 -12.497 -30.514 -2.486 1.00 8.88 C ATOM 1108 CD1 TYR A1105 -12.572 -29.844 -3.703 1.00 11.73 C ATOM 1109 CD2 TYR A1105 -13.156 -31.728 -2.361 1.00 14.08 C ATOM 1110 CE1 TYR A1105 -13.268 -30.382 -4.772 1.00 18.17 C ATOM 1111 CE2 TYR A1105 -13.849 -32.274 -3.425 1.00 18.91 C ATOM 1112 CZ TYR A1105 -13.901 -31.595 -4.627 1.00 23.40 C ATOM 1113 OH TYR A1105 -14.592 -32.133 -5.686 1.00 21.13 O ATOM 1114 HH TYR A1105 -14.529 -31.523 -6.464 1.00 0.00 H ATOM 1115 H TYR A1105 -12.617 -27.085 -1.536 1.00 0.00 H ATOM 1116 N LEU A1106 -12.289 -28.692 1.866 1.00 8.37 N ATOM 1117 CA LEU A1106 -11.653 -28.187 3.075 1.00 6.59 C ATOM 1118 C LEU A1106 -10.671 -29.224 3.600 1.00 8.98 C ATOM 1119 O LEU A1106 -11.030 -30.394 3.757 1.00 10.92 O ATOM 1120 CB LEU A1106 -12.704 -27.881 4.144 1.00 8.00 C ATOM 1121 CG LEU A1106 -12.210 -27.487 5.536 1.00 10.73 C ATOM 1122 CD1 LEU A1106 -11.529 -26.142 5.483 1.00 12.63 C ATOM 1123 CD2 LEU A1106 -13.363 -27.472 6.528 1.00 15.47 C ATOM 1124 H LEU A1106 -13.080 -29.360 1.967 1.00 0.00 H ATOM 1125 N VAL A1107 -9.447 -28.794 3.896 1.00 9.16 N ATOM 1126 CA VAL A1107 -8.414 -29.680 4.427 1.00 8.90 C ATOM 1127 C VAL A1107 -8.257 -29.415 5.921 1.00 11.17 C ATOM 1128 O VAL A1107 -7.942 -28.291 6.328 1.00 10.53 O ATOM 1129 CB VAL A1107 -7.079 -29.482 3.690 1.00 10.14 C ATOM 1130 CG1 VAL A1107 -6.038 -30.468 4.205 1.00 12.23 C ATOM 1131 CG2 VAL A1107 -7.268 -29.647 2.195 1.00 12.87 C ATOM 1132 H VAL A1107 -9.218 -27.791 3.744 1.00 0.00 H ATOM 1133 N THR A1108 -8.449 -30.452 6.739 1.00 10.27 N ATOM 1134 CA THR A1108 -8.364 -30.329 8.188 1.00 8.08 C ATOM 1135 C THR A1108 -6.988 -30.747 8.705 1.00 10.04 C ATOM 1136 O THR A1108 -6.160 -31.328 7.993 1.00 7.64 O ATOM 1137 CB THR A1108 -9.425 -31.184 8.885 1.00 8.79 C ATOM 1138 OG1 THR A1108 -9.034 -32.555 8.798 1.00 9.80 O ATOM 1139 CG2 THR A1108 -10.811 -31.002 8.266 1.00 9.74 C ATOM 1140 HG1 THR A1108 -9.713 -33.120 9.246 1.00 0.00 H ATOM 1141 H THR A1108 -8.667 -31.382 6.327 1.00 0.00 H ATOM 1142 N ARG A1109 -6.766 -30.456 9.991 1.00 8.30 N ATOM 1143 CA ARG A1109 -5.503 -30.791 10.641 1.00 9.72 C ATOM 1144 C ARG A1109 -5.295 -32.291 10.762 1.00 10.37 C ATOM 1145 O ARG A1109 -4.171 -32.727 11.037 1.00 9.97 O ATOM 1146 CB ARG A1109 -5.437 -30.162 12.034 1.00 10.31 C ATOM 1147 CG ARG A1109 -6.376 -30.804 13.055 1.00 8.96 C ATOM 1148 CD ARG A1109 -6.225 -30.176 14.438 1.00 11.19 C ATOM 1149 NE ARG A1109 -4.937 -30.471 15.073 1.00 12.18 N ATOM 1150 CZ ARG A1109 -3.953 -29.598 15.277 1.00 17.81 C ATOM 1151 NH1 ARG A1109 -4.064 -28.330 14.893 1.00 13.50 N ATOM 1152 NH2 ARG A1109 -2.839 -30.000 15.884 1.00 14.89 N ATOM 1153 HE ARG A1109 -4.778 -31.448 15.392 1.00 0.00 H ATOM 1154 HH12 ARG A1109 -3.283 -27.665 15.062 1.00 0.00 H ATOM 1155 HH11 ARG A1109 -4.932 -28.003 14.423 1.00 0.00 H ATOM 1156 HH22 ARG A1109 -2.064 -29.326 16.048 1.00 0.00 H ATOM 1157 HH21 ARG A1109 -2.743 -30.988 16.194 1.00 0.00 H ATOM 1158 H ARG A1109 -7.510 -29.980 10.540 1.00 0.00 H ATOM 1159 N HIS A1110 -6.351 -33.084 10.591 1.00 9.23 N ATOM 1160 CA HIS A1110 -6.247 -34.534 10.569 1.00 10.79 C ATOM 1161 C HIS A1110 -6.139 -35.074 9.152 1.00 13.10 C ATOM 1162 O HIS A1110 -6.231 -36.286 8.951 1.00 12.58 O ATOM 1163 CB HIS A1110 -7.451 -35.148 11.285 1.00 14.15 C ATOM 1164 CG HIS A1110 -7.692 -34.567 12.643 1.00 12.38 C ATOM 1165 ND1 HIS A1110 -6.809 -34.732 13.688 1.00 15.64 N ATOM 1166 CD2 HIS A1110 -8.703 -33.802 13.121 1.00 13.92 C ATOM 1167 CE1 HIS A1110 -7.270 -34.098 14.754 1.00 14.42 C ATOM 1168 NE2 HIS A1110 -8.420 -33.531 14.438 1.00 14.76 N ATOM 1169 H HIS A1110 -7.288 -32.649 10.468 1.00 0.00 H ATOM 1170 N ALA A1111 -5.946 -34.192 8.169 1.00 11.54 N ATOM 1171 CA ALA A1111 -5.819 -34.542 6.759 1.00 10.93 C ATOM 1172 C ALA A1111 -7.097 -35.135 6.188 1.00 10.99 C ATOM 1173 O ALA A1111 -7.052 -35.877 5.201 1.00 14.76 O ATOM 1174 CB ALA A1111 -4.650 -35.501 6.516 1.00 11.64 C ATOM 1175 H ALA A1111 -5.882 -33.186 8.426 1.00 0.00 H ATOM 1176 N ASP A1112 -8.239 -34.836 6.794 1.00 11.95 N ATOM 1177 CA ASP A1112 -9.510 -35.091 6.135 1.00 11.89 C ATOM 1178 C ASP A1112 -9.721 -34.048 5.045 1.00 11.90 C ATOM 1179 O ASP A1112 -9.398 -32.868 5.221 1.00 12.46 O ATOM 1180 CB ASP A1112 -10.662 -35.051 7.144 1.00 12.83 C ATOM 1181 CG ASP A1112 -10.568 -36.152 8.190 1.00 17.48 C ATOM 1182 OD1 ASP A1112 -10.330 -37.318 7.814 1.00 20.98 O ATOM 1183 OD2 ASP A1112 -10.722 -35.845 9.392 1.00 24.22 O ATOM 1184 H ASP A1112 -8.225 -34.417 7.746 1.00 0.00 H ATOM 1185 N VAL A1113 -10.232 -34.493 3.902 1.00 13.10 N ATOM 1186 CA VAL A1113 -10.590 -33.615 2.795 1.00 12.55 C ATOM 1187 C VAL A1113 -12.106 -33.625 2.720 1.00 16.24 C ATOM 1188 O VAL A1113 -12.709 -34.635 2.337 1.00 18.80 O ATOM 1189 CB VAL A1113 -9.959 -34.064 1.471 1.00 12.31 C ATOM 1190 CG1 VAL A1113 -10.422 -33.172 0.330 1.00 18.97 C ATOM 1191 CG2 VAL A1113 -8.436 -34.041 1.576 1.00 13.69 C ATOM 1192 H VAL A1113 -10.384 -35.516 3.792 1.00 0.00 H ATOM 1193 N ILE A1114 -12.718 -32.507 3.086 1.00 12.69 N ATOM 1194 CA ILE A1114 -14.153 -32.411 3.331 1.00 10.10 C ATOM 1195 C ILE A1114 -14.785 -31.650 2.173 1.00 12.31 C ATOM 1196 O ILE A1114 -14.496 -30.459 1.993 1.00 11.71 O ATOM 1197 CB ILE A1114 -14.444 -31.711 4.668 1.00 11.74 C ATOM 1198 CG1 ILE A1114 -13.924 -32.569 5.829 1.00 19.48 C ATOM 1199 CG2 ILE A1114 -15.949 -31.450 4.819 1.00 17.28 C ATOM 1200 CD1 ILE A1114 -14.038 -31.909 7.190 1.00 15.39 C ATOM 1201 H ILE A1114 -12.142 -31.649 3.205 1.00 0.00 H ATOM 1202 N PRO A1115 -15.663 -32.267 1.386 1.00 8.52 N ATOM 1203 CA PRO A1115 -16.361 -31.506 0.344 1.00 9.58 C ATOM 1204 C PRO A1115 -17.271 -30.440 0.939 1.00 7.91 C ATOM 1205 O PRO A1115 -18.026 -30.691 1.884 1.00 7.56 O ATOM 1206 CB PRO A1115 -17.156 -32.580 -0.407 1.00 12.06 C ATOM 1207 CG PRO A1115 -16.405 -33.858 -0.135 1.00 14.44 C ATOM 1208 CD PRO A1115 -15.896 -33.715 1.263 1.00 15.03 C ATOM 1209 N VAL A1116 -17.206 -29.252 0.338 1.00 9.57 N ATOM 1210 CA VAL A1116 -17.917 -28.054 0.780 1.00 8.59 C ATOM 1211 C VAL A1116 -18.487 -27.370 -0.452 1.00 8.80 C ATOM 1212 O VAL A1116 -17.753 -27.101 -1.410 1.00 10.28 O ATOM 1213 CB VAL A1116 -16.990 -27.076 1.536 1.00 9.78 C ATOM 1214 CG1 VAL A1116 -17.681 -25.734 1.794 1.00 11.31 C ATOM 1215 CG2 VAL A1116 -16.530 -27.676 2.845 1.00 9.50 C ATOM 1216 H VAL A1116 -16.605 -29.172 -0.507 1.00 0.00 H ATOM 1217 N ARG A1117 -19.785 -27.083 -0.431 1.00 9.08 N ATOM 1218 CA ARG A1117 -20.423 -26.330 -1.504 1.00 8.31 C ATOM 1219 C ARG A1117 -20.392 -24.852 -1.137 1.00 9.86 C ATOM 1220 O ARG A1117 -20.873 -24.463 -0.069 1.00 8.06 O ATOM 1221 CB ARG A1117 -21.862 -26.803 -1.732 1.00 8.54 C ATOM 1222 CG ARG A1117 -22.648 -25.971 -2.736 1.00 9.46 C ATOM 1223 CD ARG A1117 -22.140 -26.144 -4.174 1.00 12.33 C ATOM 1224 NE ARG A1117 -22.800 -25.211 -5.086 1.00 11.16 N ATOM 1225 CZ ARG A1117 -22.648 -25.200 -6.408 1.00 11.45 C ATOM 1226 NH1 ARG A1117 -21.860 -26.091 -7.009 1.00 12.77 N ATOM 1227 NH2 ARG A1117 -23.295 -24.297 -7.133 1.00 11.31 N ATOM 1228 HE ARG A1117 -23.437 -24.502 -4.670 1.00 0.00 H ATOM 1229 HH12 ARG A1117 -21.749 -26.073 -8.043 1.00 0.00 H ATOM 1230 HH11 ARG A1117 -21.356 -26.804 -6.444 1.00 0.00 H ATOM 1231 HH22 ARG A1117 -23.182 -24.282 -8.167 1.00 0.00 H ATOM 1232 HH21 ARG A1117 -23.916 -23.604 -6.668 1.00 0.00 H ATOM 1233 H ARG A1117 -20.361 -27.405 0.373 1.00 0.00 H ATOM 1234 N ARG A1118 -19.813 -24.034 -2.009 1.00 8.22 N ATOM 1235 CA ARG A1118 -19.763 -22.604 -1.749 1.00 8.09 C ATOM 1236 C ARG A1118 -21.178 -22.041 -1.775 1.00 9.44 C ATOM 1237 O ARG A1118 -21.957 -22.342 -2.684 1.00 8.61 O ATOM 1238 CB ARG A1118 -18.883 -21.894 -2.776 1.00 7.29 C ATOM 1239 CG ARG A1118 -18.454 -20.509 -2.293 1.00 8.56 C ATOM 1240 CD ARG A1118 -17.586 -19.760 -3.272 1.00 7.71 C ATOM 1241 NE ARG A1118 -17.082 -18.545 -2.639 1.00 9.66 N ATOM 1242 CZ ARG A1118 -15.979 -17.901 -2.993 1.00 10.46 C ATOM 1243 NH1 ARG A1118 -15.237 -18.335 -4.001 1.00 13.72 N ATOM 1244 NH2 ARG A1118 -15.619 -16.807 -2.325 1.00 10.62 N ATOM 1245 HE ARG A1118 -17.632 -18.154 -1.848 1.00 0.00 H ATOM 1246 HH12 ARG A1118 -14.373 -17.822 -4.270 1.00 0.00 H ATOM 1247 HH11 ARG A1118 -15.518 -19.189 -4.523 1.00 0.00 H ATOM 1248 HH22 ARG A1118 -14.755 -16.294 -2.594 1.00 0.00 H ATOM 1249 HH21 ARG A1118 -16.201 -16.466 -1.534 1.00 0.00 H ATOM 1250 H ARG A1118 -19.394 -24.417 -2.880 1.00 0.00 H ATOM 1251 N ARG A1119 -21.511 -21.235 -0.766 1.00 7.80 N ATOM 1252 CA ARG A1119 -22.853 -20.700 -0.590 1.00 8.37 C ATOM 1253 C ARG A1119 -22.889 -19.183 -0.550 1.00 10.06 C ATOM 1254 O ARG A1119 -23.980 -18.609 -0.496 1.00 9.64 O ATOM 1255 CB ARG A1119 -23.485 -21.239 0.701 1.00 8.46 C ATOM 1256 CG ARG A1119 -23.702 -22.728 0.718 1.00 12.78 C ATOM 1257 CD ARG A1119 -24.683 -23.157 -0.355 1.00 12.87 C ATOM 1258 NE ARG A1119 -25.106 -24.536 -0.145 1.00 14.08 N ATOM 1259 CZ ARG A1119 -25.859 -25.230 -0.985 1.00 16.90 C ATOM 1260 NH1 ARG A1119 -26.264 -24.687 -2.129 1.00 15.66 N ATOM 1261 NH2 ARG A1119 -26.198 -26.477 -0.681 1.00 16.87 N ATOM 1262 HE ARG A1119 -24.794 -25.009 0.727 1.00 0.00 H ATOM 1263 HH12 ARG A1119 -26.855 -25.237 -2.785 1.00 0.00 H ATOM 1264 HH11 ARG A1119 -25.990 -23.713 -2.368 1.00 0.00 H ATOM 1265 HH22 ARG A1119 -26.789 -27.029 -1.335 1.00 0.00 H ATOM 1266 HH21 ARG A1119 -25.873 -26.902 0.211 1.00 0.00 H ATOM 1267 H ARG A1119 -20.779 -20.977 -0.074 1.00 0.00 H ATOM 1268 N GLY A1120 -21.735 -18.530 -0.572 1.00 9.48 N ATOM 1269 CA GLY A1120 -21.666 -17.083 -0.592 1.00 11.91 C ATOM 1270 C GLY A1120 -20.219 -16.666 -0.721 1.00 9.50 C ATOM 1271 O GLY A1120 -19.341 -17.490 -0.991 1.00 9.79 O ATOM 1272 H GLY A1120 -20.849 -19.075 -0.575 1.00 0.00 H ATOM 1273 N ASP A1121 -19.965 -15.377 -0.506 1.00 11.76 N ATOM 1274 CA ASP A1121 -18.593 -14.894 -0.616 1.00 11.23 C ATOM 1275 C ASP A1121 -17.690 -15.532 0.433 1.00 10.18 C ATOM 1276 O ASP A1121 -16.515 -15.806 0.156 1.00 12.02 O ATOM 1277 CB ASP A1121 -18.544 -13.362 -0.514 1.00 10.28 C ATOM 1278 CG ASP A1121 -19.328 -12.793 0.677 1.00 14.86 C ATOM 1279 OD1 ASP A1121 -19.900 -13.550 1.493 1.00 15.35 O ATOM 1280 OD2 ASP A1121 -19.371 -11.544 0.786 1.00 19.20 O ATOM 1281 H ASP A1121 -20.735 -14.722 -0.263 1.00 0.00 H ATOM 1282 N SER A1122 -18.218 -15.811 1.626 1.00 9.65 N ATOM 1283 CA SER A1122 -17.385 -16.294 2.724 1.00 7.62 C ATOM 1284 C SER A1122 -17.994 -17.491 3.444 1.00 11.50 C ATOM 1285 O SER A1122 -17.596 -17.785 4.579 1.00 11.22 O ATOM 1286 CB SER A1122 -17.127 -15.164 3.724 1.00 13.31 C ATOM 1287 OG SER A1122 -18.349 -14.665 4.241 1.00 14.48 O ATOM 1288 HG SER A1122 -18.834 -15.395 4.700 1.00 0.00 H ATOM 1289 H SER A1122 -19.239 -15.682 1.776 1.00 0.00 H ATOM 1290 N ARG A1123 -18.934 -18.197 2.812 1.00 10.58 N ATOM 1291 CA ARG A1123 -19.620 -19.318 3.436 1.00 7.72 C ATOM 1292 C ARG A1123 -19.654 -20.514 2.495 1.00 8.41 C ATOM 1293 O ARG A1123 -19.749 -20.370 1.274 1.00 9.07 O ATOM 1294 CB ARG A1123 -21.062 -18.963 3.829 1.00 11.09 C ATOM 1295 CG ARG A1123 -21.193 -17.910 4.914 1.00 17.01 C ATOM 1296 CD ARG A1123 -20.656 -18.404 6.252 1.00 15.69 C ATOM 1297 NE ARG A1123 -20.813 -17.399 7.300 1.00 15.11 N ATOM 1298 CZ ARG A1123 -21.857 -17.313 8.122 1.00 20.15 C ATOM 1299 NH1 ARG A1123 -22.860 -18.180 8.043 1.00 26.11 N ATOM 1300 NH2 ARG A1123 -21.893 -16.350 9.035 1.00 24.25 N ATOM 1301 HE ARG A1123 -20.053 -16.698 7.413 1.00 0.00 H ATOM 1302 HH12 ARG A1123 -23.669 -18.100 8.692 1.00 0.00 H ATOM 1303 HH11 ARG A1123 -22.837 -18.939 7.332 1.00 0.00 H ATOM 1304 HH22 ARG A1123 -22.705 -16.276 9.681 1.00 0.00 H ATOM 1305 HH21 ARG A1123 -21.109 -15.670 9.104 1.00 0.00 H ATOM 1306 H ARG A1123 -19.185 -17.936 1.837 1.00 0.00 H ATOM 1307 N GLY A1124 -19.585 -21.696 3.086 1.00 8.87 N ATOM 1308 CA GLY A1124 -19.787 -22.935 2.354 1.00 7.21 C ATOM 1309 C GLY A1124 -20.398 -23.968 3.270 1.00 11.22 C ATOM 1310 O GLY A1124 -20.133 -23.984 4.476 1.00 10.61 O ATOM 1311 H GLY A1124 -19.380 -21.740 4.105 1.00 0.00 H ATOM 1312 N SER A1125 -21.228 -24.837 2.697 1.00 10.40 N ATOM 1313 CA SER A1125 -21.914 -25.866 3.464 1.00 9.99 C ATOM 1314 C SER A1125 -21.187 -27.198 3.324 1.00 10.08 C ATOM 1315 O SER A1125 -20.701 -27.544 2.244 1.00 7.99 O ATOM 1316 CB SER A1125 -23.371 -26.004 3.009 1.00 12.61 C ATOM 1317 OG SER A1125 -23.453 -26.248 1.614 1.00 13.49 O ATOM 1318 HG SER A1125 -22.974 -27.087 1.398 1.00 0.00 H ATOM 1319 H SER A1125 -21.391 -24.779 1.671 1.00 0.00 H ATOM 1320 N LEU A1126 -21.095 -27.936 4.428 1.00 8.59 N ATOM 1321 CA LEU A1126 -20.549 -29.285 4.374 1.00 9.65 C ATOM 1322 C LEU A1126 -21.552 -30.210 3.710 1.00 9.95 C ATOM 1323 O LEU A1126 -22.727 -30.232 4.084 1.00 13.74 O ATOM 1324 CB LEU A1126 -20.235 -29.810 5.777 1.00 10.81 C ATOM 1325 CG LEU A1126 -19.234 -29.071 6.675 1.00 20.74 C ATOM 1326 CD1 LEU A1126 -18.779 -30.018 7.776 1.00 16.26 C ATOM 1327 CD2 LEU A1126 -18.054 -28.543 5.915 1.00 29.62 C ATOM 1328 H LEU A1126 -21.416 -27.546 5.337 1.00 0.00 H ATOM 1329 N LEU A1127 -21.095 -30.978 2.720 1.00 9.84 N ATOM 1330 CA LEU A1127 -21.979 -31.971 2.121 1.00 14.73 C ATOM 1331 C LEU A1127 -22.380 -33.015 3.152 1.00 15.47 C ATOM 1332 O LEU A1127 -23.518 -33.499 3.152 1.00 14.72 O ATOM 1333 CB LEU A1127 -21.298 -32.620 0.916 1.00 11.77 C ATOM 1334 CG LEU A1127 -21.477 -31.880 -0.419 1.00 16.12 C ATOM 1335 CD1 LEU A1127 -21.002 -30.454 -0.329 1.00 17.46 C ATOM 1336 CD2 LEU A1127 -20.760 -32.610 -1.565 1.00 17.12 C ATOM 1337 H LEU A1127 -20.119 -30.870 2.379 1.00 0.00 H ATOM 1338 N SER A1128 -21.463 -33.355 4.053 1.00 14.37 N ATOM 1339 CA SER A1128 -21.731 -34.273 5.161 1.00 15.52 C ATOM 1340 C SER A1128 -21.405 -33.565 6.467 1.00 13.56 C ATOM 1341 O SER A1128 -20.231 -33.536 6.878 1.00 15.44 O ATOM 1342 CB SER A1128 -20.900 -35.549 5.026 1.00 18.83 C ATOM 1343 OG SER A1128 -21.136 -36.186 3.784 1.00 22.40 O ATOM 1344 HG SER A1128 -20.892 -35.571 3.047 1.00 0.00 H ATOM 1345 H SER A1128 -20.509 -32.949 3.966 1.00 0.00 H ATOM 1346 N PRO A1129 -22.390 -32.984 7.151 1.00 16.49 N ATOM 1347 CA PRO A1129 -22.106 -32.303 8.420 1.00 15.51 C ATOM 1348 C PRO A1129 -21.413 -33.211 9.424 1.00 19.19 C ATOM 1349 O PRO A1129 -21.580 -34.432 9.415 1.00 14.65 O ATOM 1350 CB PRO A1129 -23.494 -31.888 8.916 1.00 16.39 C ATOM 1351 CG PRO A1129 -24.310 -31.771 7.669 1.00 21.30 C ATOM 1352 CD PRO A1129 -23.805 -32.850 6.762 1.00 17.92 C ATOM 1353 N ARG A1130 -20.647 -32.587 10.314 1.00 17.95 N ATOM 1354 CA ARG A1130 -19.843 -33.287 11.302 1.00 17.72 C ATOM 1355 C ARG A1130 -19.876 -32.506 12.607 1.00 12.35 C ATOM 1356 O ARG A1130 -20.054 -31.282 12.593 1.00 13.98 O ATOM 1357 CB ARG A1130 -18.389 -33.440 10.815 1.00 19.65 C ATOM 1358 CG ARG A1130 -18.231 -34.342 9.585 1.00 37.53 C ATOM 1359 CD ARG A1130 -17.000 -33.962 8.771 1.00 30.56 C ATOM 1360 NE ARG A1130 -16.638 -34.969 7.768 1.00 39.94 N ATOM 1361 CZ ARG A1130 -17.052 -34.971 6.500 1.00 39.53 C ATOM 1362 NH1 ARG A1130 -17.858 -34.022 6.044 1.00 31.90 N ATOM 1363 NH2 ARG A1130 -16.654 -35.933 5.678 1.00 58.12 N ATOM 1364 HE ARG A1130 -16.010 -35.741 8.069 1.00 0.00 H ATOM 1365 HH12 ARG A1130 -18.172 -34.038 5.053 1.00 0.00 H ATOM 1366 HH11 ARG A1130 -18.177 -33.261 6.678 1.00 0.00 H ATOM 1367 HH22 ARG A1130 -16.975 -35.938 4.689 1.00 0.00 H ATOM 1368 HH21 ARG A1130 -16.021 -36.683 6.023 1.00 0.00 H ATOM 1369 H ARG A1130 -20.622 -31.547 10.303 1.00 0.00 H ATOM 1370 N PRO A1131 -19.732 -33.179 13.751 1.00 12.23 N ATOM 1371 CA PRO A1131 -19.604 -32.437 15.011 1.00 10.51 C ATOM 1372 C PRO A1131 -18.433 -31.470 14.938 1.00 9.49 C ATOM 1373 O PRO A1131 -17.437 -31.724 14.261 1.00 10.92 O ATOM 1374 CB PRO A1131 -19.362 -33.532 16.054 1.00 13.34 C ATOM 1375 CG PRO A1131 -19.966 -34.758 15.467 1.00 16.69 C ATOM 1376 CD PRO A1131 -19.743 -34.636 13.971 1.00 14.87 C ATOM 1377 N ILE A1132 -18.554 -30.350 15.655 1.00 11.64 N ATOM 1378 CA ILE A1132 -17.516 -29.323 15.576 1.00 10.21 C ATOM 1379 C ILE A1132 -16.179 -29.837 16.096 1.00 12.37 C ATOM 1380 O ILE A1132 -15.127 -29.280 15.757 1.00 10.66 O ATOM 1381 CB ILE A1132 -17.943 -28.040 16.325 1.00 12.17 C ATOM 1382 CG1 ILE A1132 -18.396 -28.352 17.755 1.00 15.55 C ATOM 1383 CG2 ILE A1132 -19.043 -27.322 15.540 1.00 16.45 C ATOM 1384 CD1 ILE A1132 -18.641 -27.120 18.598 1.00 16.56 C ATOM 1385 H ILE A1132 -19.383 -30.209 16.267 1.00 0.00 H ATOM 1386 N SER A1133 -16.198 -30.899 16.906 1.00 11.63 N ATOM 1387 CA SER A1133 -14.971 -31.534 17.378 1.00 12.26 C ATOM 1388 C SER A1133 -14.037 -31.906 16.236 1.00 14.42 C ATOM 1389 O SER A1133 -12.812 -31.922 16.411 1.00 11.20 O ATOM 1390 CB SER A1133 -15.324 -32.798 18.166 1.00 10.89 C ATOM 1391 OG SER A1133 -16.332 -32.531 19.122 1.00 12.40 O ATOM 1392 HG SER A1133 -16.543 -33.361 19.618 1.00 0.00 H ATOM 1393 H SER A1133 -17.115 -31.285 17.210 1.00 0.00 H ATOM 1394 N TYR A1134 -14.593 -32.254 15.075 1.00 9.79 N ATOM 1395 CA TYR A1134 -13.773 -32.711 13.960 1.00 12.54 C ATOM 1396 C TYR A1134 -13.122 -31.561 13.216 1.00 10.25 C ATOM 1397 O TYR A1134 -12.165 -31.787 12.471 1.00 10.52 O ATOM 1398 CB TYR A1134 -14.614 -33.546 12.992 1.00 17.35 C ATOM 1399 CG TYR A1134 -14.943 -34.920 13.532 1.00 22.10 C ATOM 1400 CD1 TYR A1134 -14.039 -35.971 13.412 1.00 26.38 C ATOM 1401 CD2 TYR A1134 -16.151 -35.165 14.174 1.00 24.51 C ATOM 1402 CE1 TYR A1134 -14.333 -37.232 13.915 1.00 22.22 C ATOM 1403 CE2 TYR A1134 -16.456 -36.424 14.675 1.00 18.36 C ATOM 1404 CZ TYR A1134 -15.544 -37.450 14.540 1.00 25.05 C ATOM 1405 OH TYR A1134 -15.844 -38.697 15.040 1.00 25.76 O ATOM 1406 HH TYR A1134 -15.090 -39.313 14.862 1.00 0.00 H ATOM 1407 H TYR A1134 -15.626 -32.199 14.964 1.00 0.00 H ATOM 1408 N LEU A1135 -13.619 -30.342 13.408 1.00 8.11 N ATOM 1409 CA LEU A1135 -13.064 -29.156 12.775 1.00 6.60 C ATOM 1410 C LEU A1135 -12.194 -28.337 13.712 1.00 8.42 C ATOM 1411 O LEU A1135 -11.420 -27.501 13.236 1.00 8.71 O ATOM 1412 CB LEU A1135 -14.194 -28.272 12.231 1.00 8.60 C ATOM 1413 CG LEU A1135 -15.123 -28.953 11.226 1.00 9.23 C ATOM 1414 CD1 LEU A1135 -16.183 -27.989 10.713 1.00 11.69 C ATOM 1415 CD2 LEU A1135 -14.337 -29.538 10.060 1.00 12.49 C ATOM 1416 H LEU A1135 -14.439 -30.232 14.038 1.00 0.00 H ATOM 1417 N LYS A1136 -12.289 -28.563 15.021 1.00 8.30 N ATOM 1418 CA LYS A1136 -11.500 -27.796 15.972 1.00 8.60 C ATOM 1419 C LYS A1136 -10.017 -27.994 15.695 1.00 8.32 C ATOM 1420 O LYS A1136 -9.552 -29.121 15.527 1.00 9.29 O ATOM 1421 CB LYS A1136 -11.835 -28.225 17.400 1.00 9.87 C ATOM 1422 CG LYS A1136 -11.068 -27.483 18.477 1.00 10.56 C ATOM 1423 CD LYS A1136 -11.541 -27.876 19.868 1.00 10.37 C ATOM 1424 CE LYS A1136 -10.879 -27.041 20.954 1.00 11.83 C ATOM 1425 NZ LYS A1136 -9.413 -27.285 21.080 1.00 16.08 N ATOM 1426 HZ1 LYS A1136 -9.248 -28.285 21.311 1.00 0.00 H ATOM 1427 HZ2 LYS A1136 -8.946 -27.054 20.180 1.00 0.00 H ATOM 1428 HZ3 LYS A1136 -9.027 -26.685 21.837 1.00 0.00 H ATOM 1429 H LYS A1136 -12.937 -29.299 15.368 1.00 0.00 H ATOM 1430 N GLY A1137 -9.272 -26.894 15.658 1.00 7.51 N ATOM 1431 CA GLY A1137 -7.853 -26.943 15.375 1.00 10.70 C ATOM 1432 C GLY A1137 -7.489 -26.813 13.911 1.00 10.43 C ATOM 1433 O GLY A1137 -6.303 -26.915 13.572 1.00 7.30 O ATOM 1434 H GLY A1137 -9.721 -25.973 15.837 1.00 0.00 H ATOM 1435 N SER A1138 -8.462 -26.586 13.033 1.00 7.91 N ATOM 1436 CA SER A1138 -8.209 -26.521 11.602 1.00 7.08 C ATOM 1437 C SER A1138 -8.319 -25.109 11.044 1.00 7.83 C ATOM 1438 O SER A1138 -8.093 -24.915 9.845 1.00 7.91 O ATOM 1439 CB SER A1138 -9.167 -27.454 10.854 1.00 9.85 C ATOM 1440 OG SER A1138 -8.826 -28.820 11.069 1.00 10.60 O ATOM 1441 HG SER A1138 -8.877 -29.023 12.037 1.00 0.00 H ATOM 1442 H SER A1138 -9.433 -26.451 13.380 1.00 0.00 H ATOM 1443 N SER A1139 -8.648 -24.115 11.869 1.00 7.73 N ATOM 1444 CA SER A1139 -8.589 -22.740 11.397 1.00 7.37 C ATOM 1445 C SER A1139 -7.204 -22.474 10.834 1.00 8.91 C ATOM 1446 O SER A1139 -6.204 -22.994 11.335 1.00 6.74 O ATOM 1447 CB SER A1139 -8.910 -21.749 12.516 1.00 7.01 C ATOM 1448 OG SER A1139 -7.883 -21.682 13.489 1.00 8.09 O ATOM 1449 HG SER A1139 -7.758 -22.575 13.897 1.00 0.00 H ATOM 1450 H SER A1139 -8.945 -24.321 12.844 1.00 0.00 H ATOM 1451 N GLY A1140 -7.150 -21.669 9.778 1.00 8.06 N ATOM 1452 CA GLY A1140 -5.925 -21.460 9.051 1.00 7.27 C ATOM 1453 C GLY A1140 -5.708 -22.416 7.903 1.00 7.42 C ATOM 1454 O GLY A1140 -4.800 -22.186 7.096 1.00 11.41 O ATOM 1455 H GLY A1140 -8.013 -21.178 9.469 1.00 0.00 H ATOM 1456 N GLY A1141 -6.505 -23.481 7.808 1.00 7.67 N ATOM 1457 CA GLY A1141 -6.414 -24.418 6.711 1.00 6.91 C ATOM 1458 C GLY A1141 -7.098 -23.902 5.467 1.00 8.50 C ATOM 1459 O GLY A1141 -7.874 -22.940 5.486 1.00 9.34 O ATOM 1460 H GLY A1141 -7.217 -23.643 8.549 1.00 0.00 H ATOM 1461 N PRO A1142 -6.810 -24.551 4.343 1.00 6.82 N ATOM 1462 CA PRO A1142 -7.332 -24.082 3.061 1.00 8.80 C ATOM 1463 C PRO A1142 -8.674 -24.687 2.689 1.00 9.33 C ATOM 1464 O PRO A1142 -9.001 -25.827 3.033 1.00 8.46 O ATOM 1465 CB PRO A1142 -6.256 -24.558 2.075 1.00 9.89 C ATOM 1466 CG PRO A1142 -5.828 -25.857 2.656 1.00 10.24 C ATOM 1467 CD PRO A1142 -5.880 -25.681 4.166 1.00 8.68 C ATOM 1468 N LEU A1143 -9.457 -23.885 1.974 1.00 7.16 N ATOM 1469 CA LEU A1143 -10.485 -24.396 1.085 1.00 9.45 C ATOM 1470 C LEU A1143 -9.926 -24.346 -0.328 1.00 9.76 C ATOM 1471 O LEU A1143 -9.369 -23.322 -0.742 1.00 10.12 O ATOM 1472 CB LEU A1143 -11.781 -23.592 1.182 1.00 11.28 C ATOM 1473 CG LEU A1143 -12.597 -23.839 2.447 1.00 11.84 C ATOM 1474 CD1 LEU A1143 -12.064 -23.004 3.602 1.00 12.68 C ATOM 1475 CD2 LEU A1143 -14.062 -23.546 2.201 1.00 18.25 C ATOM 1476 H LEU A1143 -9.329 -22.856 2.054 1.00 0.00 H ATOM 1477 N LEU A1144 -10.048 -25.458 -1.044 1.00 8.69 N ATOM 1478 CA LEU A1144 -9.469 -25.624 -2.365 1.00 11.00 C ATOM 1479 C LEU A1144 -10.567 -25.874 -3.390 1.00 9.43 C ATOM 1480 O LEU A1144 -11.634 -26.402 -3.062 1.00 10.79 O ATOM 1481 CB LEU A1144 -8.488 -26.791 -2.383 1.00 9.80 C ATOM 1482 CG LEU A1144 -7.364 -26.753 -1.344 1.00 10.31 C ATOM 1483 CD1 LEU A1144 -6.570 -28.048 -1.369 1.00 27.15 C ATOM 1484 CD2 LEU A1144 -6.460 -25.568 -1.594 1.00 12.98 C ATOM 1485 H LEU A1144 -10.586 -26.250 -0.638 1.00 0.00 H ATOM 1486 N CYS A1145 -10.294 -25.494 -4.628 1.00 9.53 N ATOM 1487 CA CYS A1145 -11.167 -25.807 -5.752 1.00 8.90 C ATOM 1488 C CYS A1145 -10.836 -27.190 -6.288 1.00 10.33 C ATOM 1489 O CYS A1145 -9.882 -27.837 -5.843 1.00 9.31 O ATOM 1490 CB CYS A1145 -11.010 -24.741 -6.833 1.00 11.69 C ATOM 1491 SG CYS A1145 -9.524 -24.946 -7.845 1.00 8.64 S ATOM 1492 H CYS A1145 -9.424 -24.952 -4.805 1.00 0.00 H ATOM 1493 N PRO A1146 -11.615 -27.691 -7.250 1.00 9.31 N ATOM 1494 CA PRO A1146 -11.320 -29.029 -7.789 1.00 10.98 C ATOM 1495 C PRO A1146 -9.917 -29.154 -8.351 1.00 10.73 C ATOM 1496 O PRO A1146 -9.353 -30.257 -8.339 1.00 15.98 O ATOM 1497 CB PRO A1146 -12.387 -29.209 -8.879 1.00 11.62 C ATOM 1498 CG PRO A1146 -13.501 -28.304 -8.472 1.00 10.82 C ATOM 1499 CD PRO A1146 -12.818 -27.109 -7.869 1.00 8.86 C ATOM 1500 N ALA A1147 -9.334 -28.056 -8.834 1.00 9.05 N ATOM 1501 CA ALA A1147 -7.999 -28.061 -9.412 1.00 11.18 C ATOM 1502 C ALA A1147 -6.897 -27.829 -8.386 1.00 11.95 C ATOM 1503 O ALA A1147 -5.727 -27.722 -8.769 1.00 11.70 O ATOM 1504 CB ALA A1147 -7.902 -27.000 -10.507 1.00 10.65 C ATOM 1505 H ALA A1147 -9.856 -27.157 -8.796 1.00 0.00 H ATOM 1506 N GLY A1148 -7.232 -27.731 -7.103 1.00 11.29 N ATOM 1507 CA GLY A1148 -6.218 -27.575 -6.080 1.00 13.39 C ATOM 1508 C GLY A1148 -5.737 -26.161 -5.853 1.00 14.19 C ATOM 1509 O GLY A1148 -4.706 -25.977 -5.194 1.00 13.45 O ATOM 1510 H GLY A1148 -8.235 -27.767 -6.830 1.00 0.00 H ATOM 1511 N HIS A1149 -6.440 -25.157 -6.375 1.00 11.24 N ATOM 1512 CA HIS A1149 -6.111 -23.769 -6.089 1.00 9.95 C ATOM 1513 C HIS A1149 -6.711 -23.351 -4.756 1.00 7.92 C ATOM 1514 O HIS A1149 -7.718 -23.898 -4.305 1.00 8.42 O ATOM 1515 CB HIS A1149 -6.659 -22.832 -7.162 1.00 11.13 C ATOM 1516 CG HIS A1149 -6.286 -23.208 -8.556 1.00 15.74 C ATOM 1517 ND1 HIS A1149 -7.181 -23.140 -9.603 1.00 17.05 N ATOM 1518 CD2 HIS A1149 -5.111 -23.619 -9.087 1.00 18.32 C ATOM 1519 CE1 HIS A1149 -6.576 -23.513 -10.716 1.00 15.97 C ATOM 1520 NE2 HIS A1149 -5.320 -23.805 -10.431 1.00 16.96 N ATOM 1521 H HIS A1149 -7.242 -25.370 -7.001 1.00 0.00 H ATOM 1522 N ALA A1150 -6.111 -22.327 -4.148 1.00 8.68 N ATOM 1523 CA ALA A1150 -6.633 -21.794 -2.896 1.00 6.77 C ATOM 1524 C ALA A1150 -7.832 -20.892 -3.151 1.00 7.14 C ATOM 1525 O ALA A1150 -7.746 -19.924 -3.916 1.00 8.02 O ATOM 1526 CB ALA A1150 -5.555 -21.014 -2.146 1.00 8.56 C ATOM 1527 H ALA A1150 -5.261 -21.904 -4.572 1.00 0.00 H ATOM 1528 N VAL A1151 -8.949 -21.220 -2.508 1.00 6.80 N ATOM 1529 CA VAL A1151 -10.145 -20.403 -2.563 1.00 5.72 C ATOM 1530 C VAL A1151 -10.352 -19.591 -1.288 1.00 8.08 C ATOM 1531 O VAL A1151 -10.940 -18.504 -1.350 1.00 7.22 O ATOM 1532 CB VAL A1151 -11.370 -21.294 -2.856 1.00 8.57 C ATOM 1533 CG1 VAL A1151 -12.672 -20.495 -2.805 1.00 11.72 C ATOM 1534 CG2 VAL A1151 -11.190 -21.980 -4.214 1.00 11.25 C ATOM 1535 H VAL A1151 -8.965 -22.094 -1.945 1.00 0.00 H ATOM 1536 N GLY A1152 -9.879 -20.069 -0.144 1.00 9.83 N ATOM 1537 CA GLY A1152 -10.009 -19.289 1.075 1.00 9.14 C ATOM 1538 C GLY A1152 -9.295 -19.961 2.223 1.00 8.58 C ATOM 1539 O GLY A1152 -8.717 -21.041 2.076 1.00 7.04 O ATOM 1540 H GLY A1152 -9.416 -21.000 -0.120 1.00 0.00 H ATOM 1541 N ILE A1153 -9.349 -19.292 3.376 1.00 10.24 N ATOM 1542 CA ILE A1153 -8.731 -19.747 4.621 1.00 11.50 C ATOM 1543 C ILE A1153 -9.846 -19.989 5.635 1.00 9.76 C ATOM 1544 O ILE A1153 -10.623 -19.075 5.936 1.00 6.79 O ATOM 1545 CB ILE A1153 -7.727 -18.711 5.159 1.00 7.76 C ATOM 1546 CG1 ILE A1153 -6.539 -18.527 4.206 1.00 9.31 C ATOM 1547 CG2 ILE A1153 -7.241 -19.081 6.566 1.00 11.20 C ATOM 1548 CD1 ILE A1153 -5.626 -19.719 4.087 1.00 10.92 C ATOM 1549 H ILE A1153 -9.864 -18.388 3.390 1.00 0.00 H ATOM 1550 N PHE A1154 -9.912 -21.209 6.169 1.00 8.05 N ATOM 1551 CA PHE A1154 -10.939 -21.586 7.139 1.00 9.38 C ATOM 1552 C PHE A1154 -10.838 -20.719 8.391 1.00 9.02 C ATOM 1553 O PHE A1154 -9.779 -20.641 9.022 1.00 7.00 O ATOM 1554 CB PHE A1154 -10.761 -23.073 7.474 1.00 7.92 C ATOM 1555 CG PHE A1154 -11.762 -23.643 8.438 1.00 6.68 C ATOM 1556 CD1 PHE A1154 -13.046 -23.132 8.567 1.00 7.88 C ATOM 1557 CD2 PHE A1154 -11.412 -24.745 9.194 1.00 7.59 C ATOM 1558 CE1 PHE A1154 -13.954 -23.708 9.455 1.00 7.33 C ATOM 1559 CE2 PHE A1154 -12.305 -25.323 10.080 1.00 7.45 C ATOM 1560 CZ PHE A1154 -13.580 -24.799 10.217 1.00 7.93 C ATOM 1561 H PHE A1154 -9.207 -21.919 5.885 1.00 0.00 H ATOM 1562 N ARG A1155 -11.945 -20.063 8.752 1.00 6.98 N ATOM 1563 CA ARG A1155 -11.971 -19.105 9.850 1.00 6.73 C ATOM 1564 C ARG A1155 -12.832 -19.550 11.025 1.00 9.25 C ATOM 1565 O ARG A1155 -12.377 -19.493 12.169 1.00 7.18 O ATOM 1566 CB ARG A1155 -12.465 -17.746 9.340 1.00 7.99 C ATOM 1567 CG ARG A1155 -12.622 -16.695 10.427 1.00 8.98 C ATOM 1568 CD ARG A1155 -12.747 -15.294 9.828 1.00 10.17 C ATOM 1569 NE ARG A1155 -13.852 -15.198 8.877 1.00 12.42 N ATOM 1570 CZ ARG A1155 -13.996 -14.218 7.990 1.00 11.65 C ATOM 1571 NH1 ARG A1155 -13.108 -13.238 7.922 1.00 8.57 N ATOM 1572 NH2 ARG A1155 -15.031 -14.217 7.163 1.00 13.41 N ATOM 1573 HE ARG A1155 -14.574 -15.946 8.895 1.00 0.00 H ATOM 1574 HH12 ARG A1155 -13.228 -12.475 7.225 1.00 0.00 H ATOM 1575 HH11 ARG A1155 -12.291 -13.231 8.565 1.00 0.00 H ATOM 1576 HH22 ARG A1155 -15.142 -13.450 6.470 1.00 0.00 H ATOM 1577 HH21 ARG A1155 -15.732 -14.984 7.207 1.00 0.00 H ATOM 1578 H ARG A1155 -12.825 -20.244 8.227 1.00 0.00 H ATOM 1579 N ALA A1156 -14.066 -19.988 10.777 1.00 8.64 N ATOM 1580 CA ALA A1156 -14.995 -20.302 11.856 1.00 9.17 C ATOM 1581 C ALA A1156 -16.016 -21.328 11.379 1.00 10.49 C ATOM 1582 O ALA A1156 -16.302 -21.429 10.183 1.00 8.76 O ATOM 1583 CB ALA A1156 -15.708 -19.036 12.352 1.00 9.05 C ATOM 1584 H ALA A1156 -14.373 -20.109 9.791 1.00 0.00 H ATOM 1585 N ALA A1157 -16.561 -22.094 12.325 1.00 9.59 N ATOM 1586 CA ALA A1157 -17.570 -23.101 12.021 1.00 9.69 C ATOM 1587 C ALA A1157 -18.962 -22.587 12.362 1.00 12.41 C ATOM 1588 O ALA A1157 -19.166 -21.956 13.402 1.00 11.23 O ATOM 1589 CB ALA A1157 -17.309 -24.396 12.791 1.00 11.10 C ATOM 1590 H ALA A1157 -16.256 -21.969 13.311 1.00 0.00 H ATOM 1591 N VAL A1158 -19.920 -22.882 11.489 1.00 11.91 N ATOM 1592 CA VAL A1158 -21.322 -22.545 11.700 1.00 13.15 C ATOM 1593 C VAL A1158 -22.000 -23.807 12.196 1.00 15.36 C ATOM 1594 O VAL A1158 -22.115 -24.785 11.450 1.00 14.60 O ATOM 1595 CB VAL A1158 -21.980 -22.037 10.410 1.00 12.13 C ATOM 1596 CG1 VAL A1158 -23.434 -21.658 10.665 1.00 17.39 C ATOM 1597 CG2 VAL A1158 -21.202 -20.860 9.838 1.00 16.83 C ATOM 1598 H VAL A1158 -19.656 -23.377 10.613 1.00 0.00 H ATOM 1599 N SER A1159 -22.439 -23.812 13.453 1.00 17.68 N ATOM 1600 CA SER A1159 -22.960 -25.031 14.048 1.00 26.02 C ATOM 1601 C SER A1159 -24.294 -24.788 14.735 1.00 21.46 C ATOM 1602 O SER A1159 -24.574 -23.697 15.240 1.00 26.84 O ATOM 1603 CB SER A1159 -21.971 -25.636 15.059 1.00 22.70 C ATOM 1604 OG SER A1159 -21.915 -24.878 16.251 1.00 26.69 O ATOM 1605 HG SER A1159 -22.813 -24.854 16.668 1.00 0.00 H ATOM 1606 H SER A1159 -22.409 -22.936 14.013 1.00 0.00 H ATOM 1607 N THR A1160 -25.109 -25.836 14.745 1.00 20.66 N ATOM 1608 CA THR A1160 -26.340 -25.877 15.516 1.00 29.62 C ATOM 1609 C THR A1160 -26.324 -27.160 16.330 1.00 19.48 C ATOM 1610 O THR A1160 -26.098 -28.247 15.784 1.00 17.21 O ATOM 1611 CB THR A1160 -27.574 -25.815 14.612 1.00 31.93 C ATOM 1612 OG1 THR A1160 -27.638 -26.994 13.804 1.00 47.23 O ATOM 1613 CG2 THR A1160 -27.507 -24.593 13.713 1.00 34.63 C ATOM 1614 HG1 THR A1160 -27.698 -27.791 14.389 1.00 0.00 H ATOM 1615 H THR A1160 -24.854 -26.667 14.174 1.00 0.00 H ATOM 1616 N ARG A1161 -26.521 -27.027 17.637 1.00 26.04 N ATOM 1617 CA ARG A1161 -26.450 -28.166 18.547 1.00 22.00 C ATOM 1618 C ARG A1161 -25.153 -28.945 18.338 1.00 16.31 C ATOM 1619 O ARG A1161 -25.134 -30.177 18.307 1.00 19.92 O ATOM 1620 CB ARG A1161 -27.674 -29.065 18.384 1.00 29.13 C ATOM 1621 CG ARG A1161 -28.983 -28.310 18.597 1.00 45.63 C ATOM 1622 CD ARG A1161 -30.146 -29.240 18.899 1.00 65.31 C ATOM 1623 NE ARG A1161 -30.382 -30.203 17.827 1.00 63.42 N ATOM 1624 CZ ARG A1161 -30.975 -29.911 16.673 1.00 75.53 C ATOM 1625 NH1 ARG A1161 -31.390 -28.675 16.424 1.00 80.58 N ATOM 1626 NH2 ARG A1161 -31.147 -30.857 15.761 1.00 57.85 N ATOM 1627 HE ARG A1161 -30.065 -31.182 17.976 1.00 0.00 H ATOM 1628 HH12 ARG A1161 -31.853 -28.454 15.519 1.00 0.00 H ATOM 1629 HH11 ARG A1161 -31.252 -27.927 17.134 1.00 0.00 H ATOM 1630 HH22 ARG A1161 -31.611 -30.631 14.858 1.00 0.00 H ATOM 1631 HH21 ARG A1161 -30.818 -31.826 15.948 1.00 0.00 H ATOM 1632 H ARG A1161 -26.732 -26.084 18.023 1.00 0.00 H ATOM 1633 N GLY A1162 -24.058 -28.210 18.173 1.00 20.05 N ATOM 1634 CA GLY A1162 -22.740 -28.801 18.098 1.00 19.85 C ATOM 1635 C GLY A1162 -22.377 -29.447 16.781 1.00 17.72 C ATOM 1636 O GLY A1162 -21.285 -30.015 16.682 1.00 14.86 O ATOM 1637 H GLY A1162 -24.152 -27.177 18.095 1.00 0.00 H ATOM 1638 N VAL A1163 -23.242 -29.388 15.766 1.00 17.07 N ATOM 1639 CA VAL A1163 -22.960 -29.987 14.465 1.00 15.62 C ATOM 1640 C VAL A1163 -22.570 -28.879 13.500 1.00 16.57 C ATOM 1641 O VAL A1163 -23.298 -27.892 13.350 1.00 16.29 O ATOM 1642 CB VAL A1163 -24.165 -30.781 13.932 1.00 14.33 C ATOM 1643 CG1 VAL A1163 -23.867 -31.357 12.550 1.00 19.48 C ATOM 1644 CG2 VAL A1163 -24.520 -31.898 14.900 1.00 17.93 C ATOM 1645 H VAL A1163 -24.149 -28.898 15.907 1.00 0.00 H ATOM 1646 N ALA A1164 -21.429 -29.046 12.842 1.00 14.81 N ATOM 1647 CA ALA A1164 -20.966 -28.085 11.847 1.00 14.29 C ATOM 1648 C ALA A1164 -21.698 -28.354 10.539 1.00 14.23 C ATOM 1649 O ALA A1164 -21.434 -29.356 9.870 1.00 16.74 O ATOM 1650 CB ALA A1164 -19.456 -28.198 11.662 1.00 13.93 C ATOM 1651 H ALA A1164 -20.849 -29.886 13.042 1.00 0.00 H ATOM 1652 N LYS A1165 -22.630 -27.467 10.176 1.00 13.52 N ATOM 1653 CA LYS A1165 -23.311 -27.574 8.894 1.00 13.98 C ATOM 1654 C LYS A1165 -22.674 -26.715 7.813 1.00 11.55 C ATOM 1655 O LYS A1165 -22.900 -26.969 6.626 1.00 12.26 O ATOM 1656 CB LYS A1165 -24.787 -27.183 9.038 1.00 19.22 C ATOM 1657 CG LYS A1165 -25.570 -28.096 9.970 1.00 26.82 C ATOM 1658 CD LYS A1165 -26.990 -28.318 9.470 1.00 40.87 C ATOM 1659 CE LYS A1165 -27.794 -29.180 10.428 1.00 51.97 C ATOM 1660 NZ LYS A1165 -28.638 -28.365 11.347 1.00 54.93 N ATOM 1661 HZ1 LYS A1165 -28.029 -27.738 11.910 1.00 0.00 H ATOM 1662 HZ2 LYS A1165 -29.304 -27.794 10.789 1.00 0.00 H ATOM 1663 HZ3 LYS A1165 -29.168 -28.997 11.981 1.00 0.00 H ATOM 1664 H LYS A1165 -22.873 -26.688 10.820 1.00 0.00 H ATOM 1665 N ALA A1166 -21.874 -25.727 8.195 1.00 10.54 N ATOM 1666 CA ALA A1166 -21.290 -24.793 7.244 1.00 10.68 C ATOM 1667 C ALA A1166 -20.024 -24.224 7.859 1.00 11.42 C ATOM 1668 O ALA A1166 -19.797 -24.332 9.068 1.00 10.66 O ATOM 1669 CB ALA A1166 -22.270 -23.673 6.882 1.00 12.34 C ATOM 1670 H ALA A1166 -21.658 -25.617 9.206 1.00 0.00 H ATOM 1671 N VAL A1167 -19.197 -23.628 7.009 1.00 8.18 N ATOM 1672 CA VAL A1167 -17.966 -22.993 7.452 1.00 8.52 C ATOM 1673 C VAL A1167 -17.935 -21.564 6.945 1.00 9.45 C ATOM 1674 O VAL A1167 -18.483 -21.239 5.887 1.00 10.16 O ATOM 1675 CB VAL A1167 -16.708 -23.749 6.983 1.00 7.93 C ATOM 1676 CG1 VAL A1167 -16.634 -25.110 7.656 1.00 10.89 C ATOM 1677 CG2 VAL A1167 -16.677 -23.876 5.462 1.00 10.76 C ATOM 1678 H VAL A1167 -19.436 -23.615 5.997 1.00 0.00 H ATOM 1679 N ASP A1168 -17.293 -20.713 7.732 1.00 9.45 N ATOM 1680 CA ASP A1168 -16.983 -19.339 7.377 1.00 6.49 C ATOM 1681 C ASP A1168 -15.501 -19.280 7.023 1.00 10.85 C ATOM 1682 O ASP A1168 -14.674 -19.867 7.726 1.00 7.40 O ATOM 1683 CB ASP A1168 -17.329 -18.432 8.567 1.00 12.63 C ATOM 1684 CG ASP A1168 -16.642 -17.090 8.526 1.00 14.76 C ATOM 1685 OD1 ASP A1168 -16.734 -16.394 7.497 1.00 13.42 O ATOM 1686 OD2 ASP A1168 -16.042 -16.710 9.561 1.00 17.24 O ATOM 1687 H ASP A1168 -16.990 -21.052 8.668 1.00 0.00 H ATOM 1688 N PHE A1169 -15.165 -18.622 5.916 1.00 10.98 N ATOM 1689 CA PHE A1169 -13.775 -18.588 5.485 1.00 8.98 C ATOM 1690 C PHE A1169 -13.423 -17.215 4.941 1.00 10.28 C ATOM 1691 O PHE A1169 -14.289 -16.441 4.527 1.00 9.34 O ATOM 1692 CB PHE A1169 -13.455 -19.677 4.438 1.00 9.51 C ATOM 1693 CG PHE A1169 -14.214 -19.543 3.142 1.00 9.07 C ATOM 1694 CD1 PHE A1169 -13.719 -18.766 2.106 1.00 7.94 C ATOM 1695 CD2 PHE A1169 -15.415 -20.209 2.956 1.00 10.52 C ATOM 1696 CE1 PHE A1169 -14.417 -18.643 0.908 1.00 10.20 C ATOM 1697 CE2 PHE A1169 -16.112 -20.090 1.763 1.00 10.39 C ATOM 1698 CZ PHE A1169 -15.610 -19.304 0.739 1.00 9.64 C ATOM 1699 H PHE A1169 -15.895 -18.133 5.360 1.00 0.00 H ATOM 1700 N ILE A1170 -12.124 -16.922 4.978 1.00 7.93 N ATOM 1701 CA ILE A1170 -11.559 -15.696 4.421 1.00 6.53 C ATOM 1702 C ILE A1170 -11.312 -15.930 2.936 1.00 10.88 C ATOM 1703 O ILE A1170 -10.454 -16.749 2.577 1.00 7.48 O ATOM 1704 CB ILE A1170 -10.259 -15.296 5.136 1.00 9.33 C ATOM 1705 CG1 ILE A1170 -10.469 -15.261 6.655 1.00 11.28 C ATOM 1706 CG2 ILE A1170 -9.778 -13.937 4.632 1.00 10.63 C ATOM 1707 CD1 ILE A1170 -9.186 -15.341 7.453 1.00 11.56 C ATOM 1708 H ILE A1170 -11.478 -17.602 5.427 1.00 0.00 H ATOM 1709 N PRO A1171 -12.019 -15.243 2.042 1.00 7.65 N ATOM 1710 CA PRO A1171 -11.813 -15.483 0.608 1.00 12.33 C ATOM 1711 C PRO A1171 -10.409 -15.085 0.179 1.00 9.98 C ATOM 1712 O PRO A1171 -9.823 -14.129 0.693 1.00 9.34 O ATOM 1713 CB PRO A1171 -12.871 -14.596 -0.065 1.00 11.81 C ATOM 1714 CG PRO A1171 -13.787 -14.152 1.015 1.00 12.55 C ATOM 1715 CD PRO A1171 -13.050 -14.224 2.300 1.00 10.63 C ATOM 1716 N VAL A1172 -9.876 -15.819 -0.798 1.00 8.33 N ATOM 1717 CA VAL A1172 -8.523 -15.537 -1.267 1.00 9.34 C ATOM 1718 C VAL A1172 -8.435 -14.126 -1.836 1.00 13.52 C ATOM 1719 O VAL A1172 -7.384 -13.473 -1.746 1.00 11.60 O ATOM 1720 CB VAL A1172 -8.093 -16.613 -2.286 1.00 11.08 C ATOM 1721 CG1 VAL A1172 -8.887 -16.491 -3.578 1.00 12.31 C ATOM 1722 CG2 VAL A1172 -6.585 -16.551 -2.542 1.00 13.16 C ATOM 1723 H VAL A1172 -10.424 -16.592 -1.226 1.00 0.00 H ATOM 1724 N GLU A1173 -9.537 -13.609 -2.386 1.00 10.72 N ATOM 1725 CA GLU A1173 -9.524 -12.233 -2.879 1.00 14.42 C ATOM 1726 C GLU A1173 -9.275 -11.243 -1.750 1.00 17.71 C ATOM 1727 O GLU A1173 -8.668 -10.185 -1.967 1.00 16.30 O ATOM 1728 CB GLU A1173 -10.839 -11.908 -3.586 1.00 15.01 C ATOM 1729 CG GLU A1173 -11.079 -12.725 -4.857 1.00 15.42 C ATOM 1730 CD GLU A1173 -11.862 -13.995 -4.596 1.00 20.48 C ATOM 1731 OE1 GLU A1173 -12.401 -14.572 -5.563 1.00 17.98 O ATOM 1732 OE2 GLU A1173 -11.949 -14.413 -3.424 1.00 11.73 O ATOM 1733 H GLU A1173 -10.401 -14.183 -2.463 1.00 0.00 H ATOM 1734 N SER A1174 -9.736 -11.562 -0.542 1.00 11.06 N ATOM 1735 CA SER A1174 -9.474 -10.698 0.599 1.00 15.37 C ATOM 1736 C SER A1174 -8.003 -10.753 0.997 1.00 16.25 C ATOM 1737 O SER A1174 -7.425 -9.738 1.407 1.00 19.45 O ATOM 1738 CB SER A1174 -10.382 -11.097 1.762 1.00 14.11 C ATOM 1739 OG SER A1174 -10.135 -10.290 2.888 1.00 21.29 O ATOM 1740 HG SER A1174 -9.191 -10.396 3.168 1.00 0.00 H ATOM 1741 H SER A1174 -10.287 -12.435 -0.413 1.00 0.00 H ATOM 1742 N LEU A1175 -7.376 -11.924 0.863 1.00 13.02 N ATOM 1743 CA LEU A1175 -5.930 -12.020 1.034 1.00 14.25 C ATOM 1744 C LEU A1175 -5.209 -11.158 0.011 1.00 16.76 C ATOM 1745 O LEU A1175 -4.285 -10.411 0.351 1.00 16.55 O ATOM 1746 CB LEU A1175 -5.474 -13.473 0.901 1.00 13.84 C ATOM 1747 CG LEU A1175 -5.469 -14.362 2.140 1.00 17.77 C ATOM 1748 CD1 LEU A1175 -6.826 -14.389 2.798 1.00 18.46 C ATOM 1749 CD2 LEU A1175 -5.017 -15.757 1.734 1.00 13.50 C ATOM 1750 H LEU A1175 -7.924 -12.778 0.634 1.00 0.00 H ATOM 1751 N GLU A1176 -5.625 -11.246 -1.257 1.00 18.37 N ATOM 1752 CA GLU A1176 -4.957 -10.497 -2.316 1.00 18.14 C ATOM 1753 C GLU A1176 -5.130 -8.994 -2.136 1.00 22.93 C ATOM 1754 O GLU A1176 -4.222 -8.225 -2.474 1.00 30.26 O ATOM 1755 CB GLU A1176 -5.478 -10.960 -3.685 1.00 22.87 C ATOM 1756 CG GLU A1176 -5.179 -12.439 -3.978 1.00 25.56 C ATOM 1757 CD GLU A1176 -5.769 -12.932 -5.292 1.00 30.03 C ATOM 1758 OE1 GLU A1176 -5.061 -12.878 -6.317 1.00 38.80 O ATOM 1759 OE2 GLU A1176 -6.942 -13.374 -5.303 1.00 31.58 O ATOM 1760 H GLU A1176 -6.434 -11.856 -1.491 1.00 0.00 H ATOM 1761 N THR A1177 -6.269 -8.553 -1.595 1.00 19.68 N ATOM 1762 CA THR A1177 -6.440 -7.137 -1.280 1.00 22.20 C ATOM 1763 C THR A1177 -5.561 -6.728 -0.104 1.00 31.48 C ATOM 1764 O THR A1177 -4.945 -5.655 -0.124 1.00 24.51 O ATOM 1765 CB THR A1177 -7.910 -6.835 -0.977 1.00 26.62 C ATOM 1766 OG1 THR A1177 -8.692 -7.012 -2.165 1.00 33.26 O ATOM 1767 CG2 THR A1177 -8.088 -5.403 -0.476 1.00 29.22 C ATOM 1768 HG1 THR A1177 -8.606 -7.947 -2.479 1.00 0.00 H ATOM 1769 H THR A1177 -7.040 -9.223 -1.397 1.00 0.00 H ATOM 1770 N THR A1178 -5.504 -7.560 0.938 1.00 23.10 N ATOM 1771 CA THR A1178 -4.592 -7.292 2.044 1.00 23.59 C ATOM 1772 C THR A1178 -3.160 -7.151 1.542 1.00 22.43 C ATOM 1773 O THR A1178 -2.388 -6.343 2.071 1.00 26.35 O ATOM 1774 CB THR A1178 -4.696 -8.403 3.093 1.00 22.67 C ATOM 1775 OG1 THR A1178 -5.908 -8.243 3.845 1.00 25.25 O ATOM 1776 CG2 THR A1178 -3.509 -8.377 4.062 1.00 23.06 C ATOM 1777 HG1 THR A1178 -5.901 -7.362 4.297 1.00 0.00 H ATOM 1778 H THR A1178 -6.113 -8.403 0.961 1.00 0.00 H ATOM 1779 N MET A1179 -2.785 -7.927 0.520 1.00 19.91 N ATOM 1780 CA MET A1179 -1.422 -7.857 0.009 1.00 15.81 C ATOM 1781 C MET A1179 -1.116 -6.526 -0.667 1.00 34.06 C ATOM 1782 O MET A1179 0.046 -6.281 -1.006 1.00 23.25 O ATOM 1783 CB MET A1179 -1.155 -9.010 -0.963 1.00 19.90 C ATOM 1784 CG MET A1179 -1.131 -10.384 -0.279 1.00 18.38 C ATOM 1785 SD MET A1179 -0.826 -11.786 -1.373 1.00 22.83 S ATOM 1786 CE MET A1179 0.959 -11.790 -1.466 1.00 27.65 C ATOM 1787 H MET A1179 -3.468 -8.582 0.089 1.00 0.00 H ATOM 1788 N ARG A1180 -2.115 -5.665 -0.853 1.00 34.43 N ATOM 1789 CA ARG A1180 -1.916 -4.361 -1.485 1.00 37.80 C ATOM 1790 C ARG A1180 -1.951 -3.234 -0.454 1.00 34.16 C ATOM 1791 O ARG A1180 -2.458 -3.407 0.657 1.00 38.51 O ATOM 1792 CB ARG A1180 -2.985 -4.119 -2.550 1.00 45.90 C ATOM 1793 CG ARG A1180 -3.026 -5.171 -3.645 1.00 43.43 C ATOM 1794 CD ARG A1180 -4.399 -5.209 -4.305 1.00 58.20 C ATOM 1795 NE ARG A1180 -4.354 -5.771 -5.654 1.00 70.91 N ATOM 1796 CZ ARG A1180 -4.400 -5.059 -6.779 1.00 89.06 C ATOM 1797 NH1 ARG A1180 -4.503 -3.736 -6.748 1.00 72.59 N ATOM 1798 NH2 ARG A1180 -4.350 -5.679 -7.950 1.00 79.85 N ATOM 1799 HE ARG A1180 -4.281 -6.805 -5.742 1.00 0.00 H ATOM 1800 HH12 ARG A1180 -4.538 -3.196 -7.636 1.00 0.00 H ATOM 1801 HH11 ARG A1180 -4.549 -3.239 -5.835 1.00 0.00 H ATOM 1802 HH22 ARG A1180 -4.386 -5.129 -8.832 1.00 0.00 H ATOM 1803 HH21 ARG A1180 -4.275 -6.716 -7.987 1.00 0.00 H ATOM 1804 H ARG A1180 -3.070 -5.929 -0.538 1.00 0.00 H TER 1805 ARG A1180 HETATM 1806 ZN ZN A 1 -9.385 -23.006 -9.125 1.00 13.47 ZN HETATM 1807 O HOH 2 5.694 -40.191 5.239 1.00 30.35 O HETATM 1808 O HOH 3 -13.591 -16.681 -5.935 1.00 19.77 O HETATM 1809 O HOH 4 9.697 -26.796 14.300 1.00 18.81 O HETATM 1810 O HOH 5 -5.812 -6.039 5.063 1.00 25.35 O HETATM 1811 O HOH 6 9.127 -14.379 21.803 1.00 32.12 O HETATM 1812 O HOH 7 0.392 -29.230 2.425 1.00 22.19 O HETATM 1813 O HOH 8 -12.995 -36.223 0.325 1.00 27.25 O HETATM 1814 O HOH 9 -24.421 -28.838 5.698 1.00 22.41 O HETATM 1815 O HOH 10 -10.840 -33.608 10.677 1.00 18.52 O HETATM 1816 O HOH 11 -7.699 -37.584 3.374 1.00 22.43 O HETATM 1817 O HOH 12 0.740 -23.212 -6.546 1.00 32.84 O HETATM 1818 O HOH 13 1.906 -28.703 19.257 1.00 27.09 O HETATM 1819 O HOH 14 -10.320 -37.735 11.127 1.00 27.61 O HETATM 1820 O HOH 15 9.494 -28.956 12.250 1.00 30.73 O HETATM 1821 O HOH 16 -12.473 -1.714 10.873 1.00 23.73 O HETATM 1822 O HOH 17 0.541 -37.045 0.262 1.00 19.46 O HETATM 1823 O HOH 18 -19.078 -15.514 6.600 1.00 21.26 O HETATM 1824 O HOH 19 -18.373 -27.500 -10.522 1.00 26.45 O HETATM 1825 O HOH 20 -24.069 -28.763 1.163 1.00 22.09 O HETATM 1826 O HOH 21 6.916 -28.412 7.409 1.00 14.15 O HETATM 1827 O HOH 22 -13.548 -32.306 -8.116 1.00 19.21 O HETATM 1828 O HOH 23 -5.215 -23.931 25.890 1.00 22.45 O HETATM 1829 O HOH 24 4.394 -38.704 1.021 1.00 31.65 O HETATM 1830 O HOH 25 -14.398 -40.921 14.847 1.00 25.47 O HETATM 1831 O HOH 26 15.736 -23.146 19.979 1.00 28.68 O HETATM 1832 O HOH 27 10.290 -16.072 20.122 1.00 17.81 O HETATM 1833 O HOH 28 1.612 -6.741 10.255 1.00 20.37 O HETATM 1834 O HOH 29 -13.431 -21.863 -7.576 1.00 19.27 O HETATM 1835 O HOH 30 -17.860 -10.029 -0.810 1.00 17.66 O HETATM 1836 O HOH 31 14.799 -25.143 18.618 1.00 26.64 O HETATM 1837 O HOH 32 -12.695 -16.968 -3.032 1.00 16.48 O HETATM 1838 O HOH 33 -15.990 -19.449 -6.520 1.00 15.28 O HETATM 1839 O HOH 34 1.964 -39.788 9.799 1.00 10.07 O HETATM 1840 O HOH 35 -5.940 -14.255 -8.471 1.00 22.10 O HETATM 1841 O HOH 36 -21.054 -9.673 1.778 1.00 25.14 O HETATM 1842 O HOH 37 -9.782 -30.340 13.103 1.00 7.84 O HETATM 1843 O HOH 38 -9.068 -19.687 -14.304 1.00 27.96 O HETATM 1844 O HOH 39 -19.987 -28.976 -3.768 1.00 11.18 O HETATM 1845 O HOH 40 3.463 -23.791 3.646 1.00 13.06 O HETATM 1846 O HOH 41 8.435 -22.540 13.260 1.00 11.95 O HETATM 1847 O HOH 42 -15.932 -26.971 -10.780 1.00 16.08 O HETATM 1848 O HOH 43 13.209 -25.381 5.318 1.00 30.42 O HETATM 1849 O HOH 44 -19.591 -20.865 -8.909 1.00 11.78 O HETATM 1850 O HOH 45 2.141 -31.505 0.566 1.00 22.31 O HETATM 1851 O HOH 46 -10.045 -32.004 16.063 1.00 20.65 O HETATM 1852 O HOH 47 -10.704 -32.632 -7.952 1.00 20.52 O HETATM 1853 O HOH 48 -4.291 -35.805 13.273 1.00 14.77 O HETATM 1854 O HOH 49 -2.754 -33.443 13.309 1.00 15.82 O HETATM 1855 O HOH 50 -3.656 -12.892 22.884 1.00 23.55 O HETATM 1856 O HOH 51 3.825 -12.147 -2.094 1.00 19.39 O HETATM 1857 O HOH 52 1.821 -11.334 20.495 1.00 15.11 O HETATM 1858 O HOH 53 -24.329 -23.069 -3.932 1.00 10.94 O HETATM 1859 O HOH 54 7.123 -11.739 7.457 1.00 10.25 O HETATM 1860 O HOH 55 5.800 -20.931 -0.225 1.00 18.02 O HETATM 1861 O HOH 56 7.339 -8.518 16.068 1.00 25.31 O HETATM 1862 O HOH 57 11.379 -33.800 12.381 1.00 32.38 O HETATM 1863 O HOH 58 -4.064 -16.737 -9.486 1.00 22.25 O HETATM 1864 O HOH 59 -2.349 -18.823 20.801 1.00 14.87 O HETATM 1865 O HOH 60 16.009 -25.597 15.776 1.00 28.57 O HETATM 1866 O HOH 61 7.581 -36.596 10.280 1.00 17.03 O HETATM 1867 O HOH 62 11.910 -31.772 15.795 1.00 21.74 O HETATM 1868 O HOH 63 16.964 -12.878 14.861 1.00 30.35 O HETATM 1869 O HOH 64 4.125 -8.675 18.295 1.00 16.09 O HETATM 1870 O HOH 65 -23.841 -25.422 18.354 1.00 24.74 O HETATM 1871 O HOH 66 -7.899 -26.104 18.952 1.00 8.85 O HETATM 1872 O HOH 67 -23.694 -35.985 8.424 1.00 30.46 O HETATM 1873 O HOH 68 12.238 -23.612 10.044 1.00 22.01 O HETATM 1874 O HOH 69 -12.689 -8.730 14.458 1.00 24.90 O HETATM 1875 O HOH 70 -13.456 -20.720 19.360 1.00 14.68 O HETATM 1876 O HOH 71 5.742 -22.357 -4.215 1.00 24.56 O HETATM 1877 O HOH 72 -11.739 -38.225 5.551 1.00 30.29 O HETATM 1878 O HOH 73 10.104 -21.885 -0.238 1.00 25.50 O HETATM 1879 O HOH 74 -2.741 -13.448 -7.820 1.00 38.03 O HETATM 1880 O HOH 75 5.670 -5.681 9.652 1.00 23.94 O HETATM 1881 O HOH 76 8.980 -17.323 7.712 1.00 18.44 O HETATM 1882 O HOH 77 -8.416 -26.127 23.463 1.00 20.68 O HETATM 1883 O HOH 78 -1.411 -5.702 7.685 1.00 14.24 O HETATM 1884 O HOH 79 -21.678 -29.290 -9.303 1.00 20.42 O HETATM 1885 O HOH 80 12.353 -19.815 6.441 1.00 19.22 O HETATM 1886 O HOH 81 -16.317 -19.184 -13.477 1.00 14.32 O HETATM 1887 O HOH 82 -18.641 -32.979 3.447 1.00 11.23 O HETATM 1888 O HOH 83 -17.647 -15.126 16.508 1.00 27.18 O HETATM 1889 O HOH 84 7.800 -28.122 -0.192 1.00 21.32 O HETATM 1890 O HOH 85 14.273 -13.100 11.786 1.00 25.71 O HETATM 1891 O HOH 86 4.179 -30.731 19.085 1.00 23.46 O HETATM 1892 O HOH 87 -5.365 -13.711 19.399 1.00 12.54 O HETATM 1893 O HOH 88 4.608 -10.082 14.519 1.00 9.10 O HETATM 1894 O HOH 89 0.892 -4.907 6.300 1.00 21.71 O HETATM 1895 O HOH 90 -2.383 -24.329 -6.068 1.00 12.69 O HETATM 1896 O HOH 91 -19.986 -14.246 9.521 1.00 30.51 O HETATM 1897 O HOH 92 -16.998 -14.110 10.419 1.00 18.98 O HETATM 1898 O HOH 93 -2.819 -16.850 23.636 1.00 30.34 O HETATM 1899 O HOH 94 9.941 -24.805 -2.408 1.00 34.98 O HETATM 1900 O HOH 95 -19.116 -35.370 1.842 1.00 19.33 O HETATM 1901 O HOH 96 7.500 -35.957 3.959 1.00 27.98 O HETATM 1902 O HOH 97 -12.129 -23.877 18.056 1.00 11.38 O HETATM 1903 O HOH 98 0.976 -7.381 14.344 1.00 19.64 O HETATM 1904 O HOH 99 11.051 -16.123 3.854 1.00 26.08 O HETATM 1905 O HOH 100 10.412 -33.106 7.436 1.00 33.67 O HETATM 1906 O HOH 101 -3.592 -37.977 9.045 1.00 16.09 O HETATM 1907 O HOH 102 -5.884 -25.229 20.320 1.00 11.50 O HETATM 1908 O HOH 103 14.622 -30.907 9.501 1.00 31.53 O HETATM 1909 O HOH 104 9.299 -19.755 9.408 1.00 25.77 O HETATM 1910 O HOH 105 -17.432 -30.190 -3.235 1.00 12.84 O HETATM 1911 O HOH 106 8.424 -35.225 7.855 1.00 23.00 O HETATM 1912 O HOH 107 -10.396 -37.417 3.397 1.00 19.70 O HETATM 1913 O HOH 108 -6.584 -30.941 -7.419 1.00 27.61 O HETATM 1914 O HOH 109 -23.585 -20.263 6.007 1.00 24.57 O HETATM 1915 O HOH 110 -8.552 -9.038 -4.745 1.00 26.92 O HETATM 1916 O HOH 111 -12.405 -18.208 -8.050 1.00 20.00 O HETATM 1917 O HOH 112 -3.679 -15.248 20.851 1.00 20.36 O HETATM 1918 O HOH 113 7.025 -33.646 2.781 1.00 32.51 O HETATM 1919 O HOH 114 -19.491 -24.395 -9.724 1.00 13.36 O HETATM 1920 O HOH 115 -21.445 -13.385 4.108 1.00 31.92 O HETATM 1921 O HOH 116 6.048 -36.676 0.702 1.00 30.75 O HETATM 1922 O HOH 117 -2.848 -28.370 -4.698 1.00 28.15 O HETATM 1923 O HOH 118 5.636 -13.121 19.536 1.00 19.74 O HETATM 1924 O HOH 119 -14.917 -12.144 4.830 1.00 22.07 O HETATM 1925 O HOH 120 12.627 -22.668 -1.156 1.00 39.10 O HETATM 1926 O HOH 121 1.743 -32.902 20.094 1.00 31.43 O HETATM 1927 O HOH 122 6.872 -9.544 18.536 1.00 16.78 O HETATM 1928 O HOH 123 14.626 -27.420 19.921 1.00 35.93 O HETATM 1929 O HOH 124 -21.762 -20.763 14.790 1.00 27.70 O HETATM 1930 O HOH 125 -14.776 -13.109 -2.754 1.00 29.73 O HETATM 1931 O HOH 126 -13.946 -11.843 11.419 1.00 24.11 O HETATM 1932 O HOH 127 -18.584 -13.811 7.854 1.00 38.59 O HETATM 1933 O HOH 128 -26.994 -24.126 18.913 1.00 36.05 O HETATM 1934 O HOH 129 -11.779 -18.153 -5.955 1.00 24.61 O HETATM 1935 O HOH 130 1.145 -32.597 15.358 1.00 33.09 O HETATM 1936 O HOH 131 8.577 -28.341 9.719 1.00 22.70 O HETATM 1937 O HOH 132 -17.504 -32.564 -4.330 1.00 18.24 O HETATM 1938 O HOH 133 -5.698 -20.184 -11.003 1.00 27.24 O HETATM 1939 O HOH 134 -13.961 -35.540 9.638 1.00 25.08 O HETATM 1940 O HOH 135 -22.777 -26.921 -10.029 1.00 32.16 O HETATM 1941 O HOH 136 15.139 -14.550 10.200 1.00 35.28 O HETATM 1942 O HOH 137 -0.437 -12.273 21.206 1.00 18.37 O HETATM 1943 O HOH 138 -7.808 -31.119 17.516 1.00 33.44 O HETATM 1944 O HOH 139 15.009 -6.832 33.300 1.00 36.01 O HETATM 1945 O HOH 140 11.208 -9.186 28.358 1.00 31.12 O HETATM 1946 O HOH 141 -25.889 -26.689 -5.029 1.00 39.20 O HETATM 1947 O HOH 142 -4.238 -30.816 -8.263 1.00 30.34 O HETATM 1948 O HOH 143 11.630 -31.769 9.523 1.00 27.76 O HETATM 1949 O HOH 144 3.335 -18.640 23.586 1.00 34.96 O HETATM 1950 O HOH 145 -8.560 -10.490 -6.565 1.00 32.30 O HETATM 1951 O HOH 146 2.398 -39.180 -0.552 1.00 32.73 O HETATM 1952 O HOH 147 -13.246 -11.129 5.040 1.00 20.46 O HETATM 1953 O HOH 148 -6.283 -26.200 24.080 1.00 31.74 O HETATM 1954 O HOH 149 -4.516 -17.647 23.410 1.00 25.38 O HETATM 1955 O HOH 150 -8.676 -23.851 22.041 1.00 24.75 O HETATM 1956 O HOH 151 5.505 -6.118 37.555 1.00 38.43 O HETATM 1957 O HOH 152 -9.952 -34.613 17.576 1.00 22.01 O HETATM 1958 O HOH 153 3.500 -17.848 25.509 1.00 25.19 O HETATM 1959 O HOH 154 5.067 -18.510 -4.573 1.00 36.22 O HETATM 1960 O HOH 155 -7.007 -28.925 18.176 1.00 22.63 O HETATM 1961 O HOH 156 12.803 -36.691 27.143 1.00 42.27 O HETATM 1962 O HOH 157 -3.823 -25.820 26.663 1.00 38.70 O HETATM 1963 O HOH 158 -11.266 -7.963 -4.786 1.00 36.56 O HETATM 1964 O HOH 159 7.797 -19.065 25.410 1.00 34.02 O HETATM 1965 O HOH 160 -4.223 -33.552 17.287 1.00 21.70 O HETATM 1966 O HOH 161 3.529 -7.636 14.292 1.00 14.45 O HETATM 1967 O HOH 162 -4.313 -19.228 -12.309 1.00 41.49 O HETATM 1968 O HOH 163 11.478 -17.172 6.970 1.00 27.56 O HETATM 1969 O HOH 164 -5.595 -26.796 22.129 1.00 29.57 O HETATM 1970 O HOH 165 11.408 -9.466 16.694 1.00 38.22 O HETATM 1971 O HOH 166 -14.105 -40.269 11.824 1.00 29.95 O HETATM 1972 O HOH 167 -22.545 -30.105 -3.913 1.00 19.24 O HETATM 1973 O HOH 168 -21.741 -20.426 17.369 1.00 35.90 O HETATM 1974 O HOH 169 -25.555 -21.298 7.469 1.00 34.25 O HETATM 1975 O HOH 170 -24.074 -22.633 19.245 1.00 43.65 O HETATM 1976 O HOH 171 11.198 -21.655 8.685 1.00 26.14 O HETATM 1977 O HOH 172 9.868 -18.151 26.399 1.00 41.48 O HETATM 1978 O HOH 173 3.923 -11.149 21.177 1.00 26.69 O HETATM 1979 O HOH 174 -16.575 -35.355 -7.780 1.00 22.37 O HETATM 1980 O HOH 175 -14.773 -34.472 -9.354 1.00 15.12 O HETATM 1981 O HOH 176 -24.678 -18.855 3.884 1.00 26.31 O HETATM 1982 O HOH 177 10.979 -10.926 18.658 1.00 32.15 O HETATM 1983 O HOH 178 -24.162 -24.505 20.745 1.00 38.92 O HETATM 1984 O HOH 179 15.193 -19.778 6.215 1.00 30.70 O HETATM 1985 O HOH 180 15.342 -12.763 19.506 1.00 33.95 O HETATM 1986 O HOH 181 -0.146 -34.388 14.125 1.00 26.83 O HETATM 1987 O HOH 182 -19.633 -35.858 -0.760 1.00 28.97 O HETATM 1988 O HOH 183 -17.926 -34.968 -3.319 1.00 30.93 O HETATM 1989 O HOH 184 -18.647 -38.253 -1.188 1.00 47.16 O HETATM 1990 C10 UNN A 185 -13.649 -15.582 15.595 1.00 0.20 C HETATM 1991 C09 UNN A 185 -13.920 -14.841 14.273 1.00 0.09 C HETATM 1992 C08 UNN A 185 -14.943 -15.408 13.289 1.00 -0.01 C HETATM 1993 H17 UNN A 185 -15.006 -14.753 12.407 1.00 0.04 H HETATM 1994 H18 UNN A 185 -15.928 -15.463 13.775 1.00 0.04 H HETATM 1995 H19 UNN A 185 -14.631 -16.415 12.976 1.00 0.04 H HETATM 1996 N52 UNN A 185 -13.213 -13.611 13.973 1.00 -0.28 N HETATM 1997 C51 UNN A 185 -12.239 -13.107 14.955 1.00 0.05 C HETATM 1998 C44 UNN A 185 -11.995 -13.855 16.241 1.00 0.04 C HETATM 1999 C45 UNN A 185 -10.986 -13.344 17.284 1.00 -0.02 C HETATM 2000 C46 UNN A 185 -10.208 -12.059 17.000 1.00 0.10 C HETATM 2001 C49 UNN A 185 -10.451 -11.283 15.698 1.00 -0.02 C HETATM 2002 C50 UNN A 185 -11.460 -11.796 14.666 1.00 -0.04 C HETATM 2003 H44 UNN A 185 -11.628 -11.250 13.745 1.00 0.06 H HETATM 2004 H43 UNN A 185 -9.905 -10.366 15.508 1.00 0.06 H HETATM 2005 O47 UNN A 185 -9.289 -11.585 17.946 1.00 -0.32 O HETATM 2006 C48 UNN A 185 -8.937 -12.433 19.034 1.00 0.06 C HETATM 2007 H40 UNN A 185 -8.212 -11.918 19.681 1.00 0.06 H HETATM 2008 H41 UNN A 185 -8.489 -13.360 18.646 1.00 0.06 H HETATM 2009 H42 UNN A 185 -9.838 -12.677 19.615 1.00 0.06 H HETATM 2010 H39 UNN A 185 -10.829 -13.888 18.208 1.00 0.05 H HETATM 2011 N43 UNN A 185 -12.695 -15.100 16.565 1.00 -0.26 N HETATM 2012 O11 UNN A 185 -14.345 -16.764 15.857 1.00 -0.29 O HETATM 2013 C12 UNN A 185 -13.845 -17.460 17.088 1.00 0.11 C HETATM 2014 C13 UNN A 185 -12.869 -18.230 16.841 1.00 0.02 C HETATM 2015 C14 UNN A 185 -13.578 -19.249 15.770 1.00 0.14 C HETATM 2016 C24 UNN A 185 -13.085 -20.714 15.720 1.00 0.20 C HETATM 2017 N23 UNN A 185 -12.528 -21.192 14.451 1.00 -0.27 N HETATM 2018 C22 UNN A 185 -12.253 -22.619 14.401 1.00 0.15 C HETATM 2019 C26 UNN A 185 -10.971 -23.194 15.012 1.00 0.25 C HETATM 2020 N28 UNN A 185 -10.284 -22.504 15.829 1.00 -0.15 N HETATM 2021 S29 UNN A 185 -8.921 -23.263 16.478 1.00 0.07 S HETATM 2022 C32 UNN A 185 -8.223 -22.109 17.690 1.00 0.11 C HETATM 2023 C33 UNN A 185 -7.111 -21.184 17.195 1.00 -0.02 C HETATM 2024 C34 UNN A 185 -6.771 -22.398 18.071 1.00 -0.02 C HETATM 2025 H28 UNN A 185 -6.249 -23.262 17.635 1.00 0.03 H HETATM 2026 H29 UNN A 185 -6.434 -22.251 19.108 1.00 0.03 H HETATM 2027 H26 UNN A 185 -7.018 -20.167 17.604 1.00 0.03 H HETATM 2028 H27 UNN A 185 -6.833 -21.178 16.131 1.00 0.03 H HETATM 2029 C53 UNN A 185 -9.191 -21.563 18.765 1.00 -0.04 C HETATM 2030 H45 UNN A 185 -8.648 -20.879 19.434 1.00 0.03 H HETATM 2031 H46 UNN A 185 -9.599 -22.400 19.350 1.00 0.03 H HETATM 2032 H47 UNN A 185 -10.014 -21.021 18.276 1.00 0.03 H HETATM 2033 O30 UNN A 185 -7.918 -23.755 15.516 1.00 -0.15 O HETATM 2034 O31 UNN A 185 -9.372 -24.431 17.252 1.00 -0.15 O HETATM 2035 H49 UNN A 185 -10.535 -21.567 16.073 1.00 0.21 H HETATM 2036 O27 UNN A 185 -10.590 -24.483 14.669 1.00 -0.34 O HETATM 2037 C06 UNN A 185 -13.303 -23.690 14.108 1.00 0.01 C HETATM 2038 C05 UNN A 185 -13.490 -25.154 14.553 1.00 -0.09 C HETATM 2039 C21 UNN A 185 -14.494 -25.526 15.389 1.00 -0.10 C HETATM 2040 C20 UNN A 185 -15.570 -24.564 15.964 1.00 -0.04 C HETATM 2041 C04 UNN A 185 -15.524 -24.581 17.518 1.00 -0.05 C HETATM 2042 C19 UNN A 185 -16.744 -23.795 18.091 1.00 -0.05 C HETATM 2043 C03 UNN A 185 -16.543 -22.271 17.845 1.00 -0.05 C HETATM 2044 C18 UNN A 185 -17.513 -21.836 16.699 1.00 -0.01 C HETATM 2045 C02 UNN A 185 -17.215 -20.407 16.271 1.00 0.13 C HETATM 2046 C16 UNN A 185 -15.809 -20.369 15.633 1.00 0.21 C HETATM 2047 N15 UNN A 185 -14.815 -19.406 16.175 1.00 -0.25 N HETATM 2048 C01 UNN A 185 -15.048 -18.422 17.349 1.00 0.07 C HETATM 2049 H6 UNN A 185 -16.016 -17.906 17.271 1.00 0.06 H HETATM 2050 H7 UNN A 185 -14.976 -18.920 18.327 1.00 0.06 H HETATM 2051 O17 UNN A 185 -15.538 -21.095 14.721 1.00 -0.39 O HETATM 2052 N35 UNN A 185 -18.180 -20.073 15.276 1.00 -0.24 N HETATM 2053 C36 UNN A 185 -18.449 -18.686 14.890 1.00 0.32 C HETATM 2054 O37 UNN A 185 -17.979 -17.748 15.457 1.00 -0.38 O HETATM 2055 O38 UNN A 185 -19.323 -18.586 13.794 1.00 -0.26 O HETATM 2056 C39 UNN A 185 -19.745 -17.302 13.327 1.00 0.09 C HETATM 2057 C40 UNN A 185 -20.661 -17.598 12.109 1.00 -0.03 C HETATM 2058 H30 UNN A 185 -21.030 -16.651 11.689 1.00 0.03 H HETATM 2059 H31 UNN A 185 -21.514 -18.213 12.432 1.00 0.03 H HETATM 2060 H32 UNN A 185 -20.088 -18.140 11.342 1.00 0.03 H HETATM 2061 C41 UNN A 185 -18.528 -16.465 12.850 1.00 -0.03 C HETATM 2062 H33 UNN A 185 -17.872 -16.250 13.707 1.00 0.03 H HETATM 2063 H34 UNN A 185 -18.882 -15.520 12.413 1.00 0.03 H HETATM 2064 H35 UNN A 185 -17.967 -17.032 12.092 1.00 0.03 H HETATM 2065 C42 UNN A 185 -20.553 -16.574 14.432 1.00 -0.03 C HETATM 2066 H36 UNN A 185 -21.403 -17.202 14.739 1.00 0.03 H HETATM 2067 H37 UNN A 185 -20.927 -15.616 14.042 1.00 0.03 H HETATM 2068 H38 UNN A 185 -19.903 -16.388 15.300 1.00 0.03 H HETATM 2069 H50 UNN A 185 -18.689 -20.808 14.828 1.00 0.19 H HETATM 2070 H8 UNN A 185 -17.273 -19.717 17.125 1.00 0.08 H HETATM 2071 H22 UNN A 185 -17.382 -22.508 15.838 1.00 0.03 H HETATM 2072 H23 UNN A 185 -18.551 -21.898 17.058 1.00 0.03 H HETATM 2073 H9 UNN A 185 -16.774 -21.711 18.763 1.00 0.03 H HETATM 2074 H10 UNN A 185 -15.502 -22.075 17.548 1.00 0.03 H HETATM 2075 H24 UNN A 185 -17.664 -24.129 17.589 1.00 0.03 H HETATM 2076 H25 UNN A 185 -16.827 -23.984 19.172 1.00 0.03 H HETATM 2077 H11 UNN A 185 -14.592 -24.109 17.861 1.00 0.03 H HETATM 2078 H12 UNN A 185 -15.560 -25.621 17.873 1.00 0.03 H HETATM 2079 H3 UNN A 185 -16.566 -24.887 15.626 1.00 0.04 H HETATM 2080 H4 UNN A 185 -15.374 -23.543 15.605 1.00 0.04 H HETATM 2081 H5 UNN A 185 -14.549 -26.575 15.677 1.00 0.04 H HETATM 2082 H13 UNN A 185 -12.798 -25.911 14.187 1.00 0.05 H HETATM 2083 C07 UNN A 185 -12.485 -23.079 12.953 1.00 -0.01 C HETATM 2084 H15 UNN A 185 -11.723 -23.682 12.438 1.00 0.03 H HETATM 2085 H16 UNN A 185 -12.969 -22.405 12.231 1.00 0.03 H HETATM 2086 H14 UNN A 185 -14.333 -23.309 14.171 1.00 0.04 H HETATM 2087 H48 UNN A 185 -12.351 -20.583 13.678 1.00 0.18 H HETATM 2088 O25 UNN A 185 -13.204 -21.450 16.662 1.00 -0.39 O HETATM 2089 H21 UNN A 185 -13.522 -18.804 14.766 1.00 0.08 H HETATM 2090 H1 UNN A 185 -12.527 -18.759 17.743 1.00 0.03 H HETATM 2091 H2 UNN A 185 -12.024 -17.688 16.391 1.00 0.03 H HETATM 2092 H20 UNN A 185 -13.624 -16.767 17.913 1.00 0.07 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1045 1044 1806 CONECT 1061 1060 1806 CONECT 1491 1490 1806 CONECT 1517 1516 1519 1806 CONECT 1806 1045 1061 1491 1517 CONECT 1990 1991 2011 2012 CONECT 1991 1990 1992 1996 CONECT 1992 1991 1993 1994 1995 CONECT 1993 1992 CONECT 1994 1992 CONECT 1995 1992 CONECT 1996 1991 1997 CONECT 1997 1996 1998 2002 CONECT 1998 1997 1999 2011 CONECT 1999 1998 2000 2010 CONECT 2000 1999 2001 2005 CONECT 2001 2000 2002 2004 CONECT 2002 1997 2001 2003 CONECT 2003 2002 CONECT 2004 2001 CONECT 2005 2000 2006 CONECT 2006 2005 2007 2008 2009 CONECT 2007 2006 CONECT 2008 2006 CONECT 2009 2006 CONECT 2010 1999 CONECT 2011 1990 1998 CONECT 2012 1990 2013 CONECT 2013 2012 2014 2048 2092 CONECT 2014 2013 2015 2090 2091 CONECT 2015 2014 2016 2047 2089 CONECT 2016 2015 2017 2088 CONECT 2017 2016 2018 2087 CONECT 2018 2017 2019 2037 2083 CONECT 2019 2018 2020 2036 CONECT 2020 2019 2021 2035 CONECT 2021 2020 2022 2033 2034 CONECT 2022 2021 2023 2024 2029 CONECT 2023 2022 2024 2027 2028 CONECT 2024 2022 2023 2025 2026 CONECT 2025 2024 CONECT 2026 2024 CONECT 2027 2023 CONECT 2028 2023 CONECT 2029 2022 2030 2031 2032 CONECT 2030 2029 CONECT 2031 2029 CONECT 2032 2029 CONECT 2033 2021 CONECT 2034 2021 CONECT 2035 2020 CONECT 2036 2019 CONECT 2037 2018 2038 2083 2086 CONECT 2038 2037 2039 2082 CONECT 2039 2038 2040 2081 CONECT 2040 2039 2041 2079 2080 CONECT 2041 2040 2042 2077 2078 CONECT 2042 2041 2043 2075 2076 CONECT 2043 2042 2044 2073 2074 CONECT 2044 2043 2045 2071 2072 CONECT 2045 2044 2046 2052 2070 CONECT 2046 2045 2047 2051 CONECT 2047 2015 2046 2048 CONECT 2048 2013 2047 2049 2050 CONECT 2049 2048 CONECT 2050 2048 CONECT 2051 2046 CONECT 2052 2045 2053 2069 CONECT 2053 2052 2054 2055 CONECT 2054 2053 CONECT 2055 2053 2056 CONECT 2056 2055 2057 2061 2065 CONECT 2057 2056 2058 2059 2060 CONECT 2058 2057 CONECT 2059 2057 CONECT 2060 2057 CONECT 2061 2056 2062 2063 2064 CONECT 2062 2061 CONECT 2063 2061 CONECT 2064 2061 CONECT 2065 2056 2066 2067 2068 CONECT 2066 2065 CONECT 2067 2065 CONECT 2068 2065 CONECT 2069 2052 CONECT 2070 2045 CONECT 2071 2044 CONECT 2072 2044 CONECT 2073 2043 CONECT 2074 2043 CONECT 2075 2042 CONECT 2076 2042 CONECT 2077 2041 CONECT 2078 2041 CONECT 2079 2040 CONECT 2080 2040 CONECT 2081 2039 CONECT 2082 2038 CONECT 2083 2018 2037 2084 2085 CONECT 2084 2083 CONECT 2085 2083 CONECT 2086 2037 CONECT 2087 2017 CONECT 2088 2016 CONECT 2089 2015 CONECT 2090 2014 CONECT 2091 2014 CONECT 2092 2013 MASTER 0 0 0 0 0 0 0 0 2091 1 112 16 END
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Related entries of code: 5voj
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3su0
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PDBbind
198aa, >3SU0_1|Chain... at 96%
3su1
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PDBbind
203aa, >3SU1_1|Chain... at 95%
3su2
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PDBbind
203aa, >3SU2_1|Chain... at 95%
3su3
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PDBbind
203aa, >3SU3_1|Chain... at 96%
3su4
RCSB PDB
PDBbind
203aa, >3SU4_1|Chains... at 95%
3su5
RCSB PDB
PDBbind
203aa, >3SU5_1|Chain... at 95%
3su6
RCSB PDB
PDBbind
203aa, >3SU6_1|Chain... at 95%
3sud
RCSB PDB
PDBbind
203aa, >3SUD_1|Chains... at 96%
3sue
RCSB PDB
PDBbind
203aa, >3SUE_1|Chains... at 96%
3suf
RCSB PDB
PDBbind
203aa, >3SUF_1|Chains... at 96%
3sug
RCSB PDB
PDBbind
203aa, >3SUG_1|Chain... at 95%
3sv6
RCSB PDB
PDBbind
203aa, >3SV6_1|Chain... at 96%
3sv7
RCSB PDB
PDBbind
203aa, >3SV7_1|Chain... at 96%
3sv8
RCSB PDB
PDBbind
203aa, >3SV8_1|Chain... at 96%
3sv9
RCSB PDB
PDBbind
203aa, >3SV9_1|Chain... at 96%
4nwk
RCSB PDB
PDBbind
219aa, >4NWK_1|Chain... *
5epn
RCSB PDB
PDBbind
197aa, >5EPN_1|Chain... at 97%
5epy
RCSB PDB
PDBbind
198aa, >5EPY_1|Chain... at 96%
5eqq
RCSB PDB
PDBbind
190aa, >5EQQ_1|Chain... at 99%
5etx
RCSB PDB
PDBbind
194aa, >5ETX_1|Chains... at 98%
5vp9
RCSB PDB
PDBbind
203aa, >5VP9_1|Chain... at 96%
6bqj
RCSB PDB
PDBbind
219aa, >6BQJ_1|Chains... at 100%
6bqk
RCSB PDB
PDBbind
219aa, >6BQK_1|Chains... at 100%
6cvw
RCSB PDB
PDBbind
201aa, >6CVW_1|Chain... at 97%
6cvx
RCSB PDB
PDBbind
201aa, >6CVX_1|Chain... at 97%
6cvy
RCSB PDB
PDBbind
201aa, >6CVY_1|Chain... at 97%
6nzt
RCSB PDB
PDBbind
203aa, >6NZT_1|Chain... at 96%
6nzv
RCSB PDB
PDBbind
203aa, >6NZV_1|Chain... at 96%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5voj
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
NS4A cofactor -- NS3 protein chimera
Ligand Name
9H4
EC.Number
E.C.-.-.-.-
Resolution
1.8(Å)
Affinity (Kd/Ki/IC50)
Ki=3.6nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Med. Chem. Vol. 60: pp. 5699-5716
Ligand Properties
Formula
C
3
7
H
5
0
N
6
O
9
S
Molecular Weight
754.893
Exact Mass
754.336
No. of atoms
103
No. of bonds
108
Polar Surface Area
203.6
LOGP Value
4.11 (
Computed with XLOGP3
)
5.71 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 15
No. of Rings: 6
Canonical SMILES
COc1ccc2c(c1)nc(c(n2)C)O[C@@H]1C[C@@H]2N(C1)C(=O)[C@H](CCCCC/C=C\[C@H]1[C@](NC2=O)(C1)C(=O)NS(=O)(=O)C1(C)CC1)NC(=O)OC(C)(C)C
InChI String
InChI=1S/C37H50N6O9S/c1-22-31(39-28-18-24(50-6)14-15-26(28)38-22)51-25-19-29-30(44)41-37(33(46)42-53(48,49)36(5)16-17-36)20-23(37)12-10-8-7-9-11-13-27(32(45)43(29)21-25)40-34(47)52-35(2,3)4/h10,12,14-15,18,23,25,27,29H,7-9,11,13,16-17,19-21H2,1-6H3,(H,40,47)(H,41,44)(H,42,46)/b12-10-/t23-,25-,27+,29+,37-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
No matched UniProt accession number (AC) found!
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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