Browse entries in the PDBbind-CN Database
HEADER 5D7C_COMPLEX COMPND 5D7C_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 192 ALA GLY GLN ILE GLN VAL LEU GLU GLY LEU GLU ALA VAL SEQRES 2 A 192 ARG LYS ARG PRO GLY MET TYR ILE GLY SER THR SER GLU SEQRES 3 A 192 ARG GLY LEU HIS HIS LEU VAL TRP GLU ILE VAL ASP ASN SEQRES 4 A 192 SER ILE ASP GLU ALA LEU ALA GLY TYR ALA ASN GLN ILE SEQRES 5 A 192 GLU VAL VAL ILE GLU LYS ASP ASN TRP ILE LYS VAL THR SEQRES 6 A 192 ASP ASN GLY ARG GLY ILE PRO VAL ASP ILE GLN GLU LYS SEQRES 7 A 192 MET GLY ARG PRO ALA VAL GLU VAL ILE LEU THR SER SER SEQRES 8 A 192 VAL VAL ASN ALA LEU SER GLN ASP LEU GLU VAL TYR VAL SEQRES 9 A 192 HIS ARG ASN GLU THR ILE TYR HIS GLN ALA TYR LYS LYS SEQRES 10 A 192 GLY VAL PRO GLN PHE ASP LEU LYS GLU VAL GLY THR THR SEQRES 11 A 192 ASP LYS THR GLY THR VAL ILE ARG PHE LYS ALA ASP GLY SEQRES 12 A 192 GLU ILE PHE THR GLU THR THR VAL TYR ASN TYR GLU THR SEQRES 13 A 192 LEU GLN GLN ARG ILE ARG GLU LEU ALA PHE LEU ASN LYS SEQRES 14 A 192 GLY ILE GLN ILE THR LEU ARG ASP GLU ARG ASP GLU GLU SEQRES 15 A 192 ASN VAL ARG GLU ASP SER TYR HIS TYR GLU HET MG A 1 1 HET UNN A 362 45 ATOM 1 N ALA A 16 -5.183 1.209 -23.243 1.00 56.62 N ATOM 2 CA ALA A 16 -5.776 2.535 -22.881 1.00 54.69 C ATOM 3 C ALA A 16 -5.053 3.134 -21.688 1.00 53.21 C ATOM 4 O ALA A 16 -4.978 4.371 -21.554 1.00 47.72 O ATOM 5 CB ALA A 16 -7.263 2.413 -22.575 1.00 54.15 C ATOM 6 HN3 ALA A 16 -5.269 0.560 -22.435 1.00 0.00 H ATOM 7 HN2 ALA A 16 -4.179 1.334 -23.484 1.00 0.00 H ATOM 8 HN1 ALA A 16 -5.691 0.815 -24.061 1.00 0.00 H ATOM 9 N GLY A 17 -4.603 2.257 -20.790 1.00 48.40 N ATOM 10 CA GLY A 17 -3.808 2.678 -19.657 1.00 47.25 C ATOM 11 C GLY A 17 -2.499 3.379 -20.041 1.00 43.02 C ATOM 12 O GLY A 17 -2.236 4.464 -19.511 1.00 45.22 O ATOM 13 H GLY A 17 -4.828 1.248 -20.907 1.00 0.00 H ATOM 14 N GLN A 18 -1.654 2.774 -20.889 1.00 43.95 N ATOM 15 CA GLN A 18 -0.382 3.395 -21.347 1.00 45.38 C ATOM 16 C GLN A 18 -0.607 4.739 -22.125 1.00 44.29 C ATOM 17 O GLN A 18 0.107 5.777 -21.989 1.00 38.65 O ATOM 18 CB GLN A 18 0.488 2.443 -22.189 1.00 49.20 C ATOM 19 CG GLN A 18 1.549 1.629 -21.410 1.00 58.16 C ATOM 20 CD GLN A 18 2.637 2.486 -20.694 1.00 65.76 C ATOM 21 OE1 GLN A 18 3.069 2.147 -19.588 1.00 74.16 O ATOM 22 NE2 GLN A 18 3.063 3.592 -21.320 1.00 70.90 N ATOM 23 HE22 GLN A 18 2.675 3.844 -22.251 1.00 0.00 H ATOM 24 HE21 GLN A 18 3.781 4.198 -20.874 1.00 0.00 H ATOM 25 H GLN A 18 -1.899 1.827 -21.243 1.00 0.00 H ATOM 26 N ILE A 19 -1.621 4.721 -22.968 1.00 38.64 N ATOM 27 CA ILE A 19 -2.067 5.961 -23.610 1.00 32.74 C ATOM 28 C ILE A 19 -2.471 7.029 -22.625 1.00 31.56 C ATOM 29 O ILE A 19 -2.214 8.231 -22.856 1.00 31.79 O ATOM 30 CB ILE A 19 -3.281 5.680 -24.531 1.00 33.47 C ATOM 31 CG1 ILE A 19 -2.846 4.833 -25.722 1.00 34.05 C ATOM 32 CG2 ILE A 19 -3.887 6.958 -25.085 1.00 34.69 C ATOM 33 CD1 ILE A 19 -3.953 3.974 -26.129 1.00 36.07 C ATOM 34 H ILE A 19 -2.105 3.825 -23.178 1.00 0.00 H ATOM 35 N GLN A 20 -3.250 6.675 -21.617 1.00 32.74 N ATOM 36 CA GLN A 20 -3.699 7.678 -20.684 1.00 33.46 C ATOM 37 C GLN A 20 -2.443 8.223 -19.890 1.00 32.15 C ATOM 38 O GLN A 20 -2.428 9.431 -19.576 1.00 32.92 O ATOM 39 CB GLN A 20 -4.842 7.137 -19.795 1.00 35.33 C ATOM 40 CG GLN A 20 -6.262 6.959 -20.414 1.00 35.98 C ATOM 41 CD GLN A 20 -6.480 7.106 -21.937 1.00 37.92 C ATOM 42 OE1 GLN A 20 -6.612 6.103 -22.667 1.00 37.33 O ATOM 43 NE2 GLN A 20 -6.658 8.355 -22.412 1.00 40.66 N ATOM 44 HE22 GLN A 20 -6.541 9.173 -21.780 1.00 0.00 H ATOM 45 HE21 GLN A 20 -6.912 8.501 -23.410 1.00 0.00 H ATOM 46 H GLN A 20 -3.536 5.682 -21.498 1.00 0.00 H ATOM 47 N VAL A 21 -1.413 7.368 -19.692 1.00 31.19 N ATOM 48 CA VAL A 21 -0.057 7.825 -19.109 1.00 33.61 C ATOM 49 C VAL A 21 0.552 8.948 -19.947 1.00 31.08 C ATOM 50 O VAL A 21 0.981 10.062 -19.461 1.00 28.21 O ATOM 51 CB VAL A 21 0.987 6.646 -19.013 1.00 38.25 C ATOM 52 CG1 VAL A 21 2.421 7.106 -18.859 1.00 39.22 C ATOM 53 CG2 VAL A 21 0.594 5.700 -17.927 1.00 42.40 C ATOM 54 H VAL A 21 -1.539 6.366 -19.941 1.00 0.00 H ATOM 55 N LEU A 22 0.734 8.671 -21.226 1.00 30.16 N ATOM 56 CA LEU A 22 1.331 9.621 -22.096 1.00 31.58 C ATOM 57 C LEU A 22 0.604 10.941 -22.164 1.00 31.79 C ATOM 58 O LEU A 22 1.205 12.034 -22.180 1.00 30.50 O ATOM 59 CB LEU A 22 1.503 9.020 -23.483 1.00 36.29 C ATOM 60 CG LEU A 22 2.873 8.562 -23.897 1.00 39.06 C ATOM 61 CD1 LEU A 22 3.906 8.204 -22.813 1.00 39.86 C ATOM 62 CD2 LEU A 22 2.685 7.512 -25.011 1.00 36.37 C ATOM 63 H LEU A 22 0.437 7.747 -21.600 1.00 0.00 H ATOM 64 N GLU A 23 -0.721 10.890 -22.115 1.00 26.60 N ATOM 65 CA GLU A 23 -1.464 12.158 -22.201 1.00 27.69 C ATOM 66 C GLU A 23 -1.286 12.976 -20.918 1.00 26.13 C ATOM 67 O GLU A 23 -1.282 14.214 -20.894 1.00 28.03 O ATOM 68 CB GLU A 23 -2.970 11.850 -22.383 1.00 28.71 C ATOM 69 CG GLU A 23 -3.287 11.224 -23.725 1.00 32.35 C ATOM 70 CD GLU A 23 -4.737 10.697 -23.900 1.00 38.41 C ATOM 71 OE1 GLU A 23 -5.519 10.490 -22.893 1.00 35.59 O ATOM 72 OE2 GLU A 23 -5.105 10.430 -25.100 1.00 33.22 O ATOM 73 H GLU A 23 -1.219 9.982 -22.019 1.00 0.00 H ATOM 74 N GLY A 24 -1.159 12.257 -19.816 1.00 28.91 N ATOM 75 CA GLY A 24 -0.978 12.897 -18.506 1.00 27.66 C ATOM 76 C GLY A 24 0.364 13.584 -18.503 1.00 26.45 C ATOM 77 O GLY A 24 0.458 14.652 -17.930 1.00 26.91 O ATOM 78 H GLY A 24 -1.188 11.219 -19.877 1.00 0.00 H ATOM 79 N LEU A 25 1.400 12.955 -19.024 1.00 26.92 N ATOM 80 CA LEU A 25 2.742 13.587 -19.056 1.00 24.88 C ATOM 81 C LEU A 25 2.671 14.835 -19.886 1.00 27.16 C ATOM 82 O LEU A 25 3.203 15.865 -19.412 1.00 25.28 O ATOM 83 CB LEU A 25 3.841 12.605 -19.593 1.00 24.95 C ATOM 84 CG LEU A 25 4.093 11.368 -18.709 1.00 26.85 C ATOM 85 CD1 LEU A 25 5.139 10.498 -19.511 1.00 25.62 C ATOM 86 CD2 LEU A 25 4.571 11.746 -17.314 1.00 26.59 C ATOM 87 H LEU A 25 1.274 12.001 -19.419 1.00 0.00 H ATOM 88 N GLU A 26 2.019 14.797 -21.066 1.00 24.86 N ATOM 89 CA GLU A 26 1.873 15.931 -21.942 1.00 24.39 C ATOM 90 C GLU A 26 1.138 17.073 -21.183 1.00 25.80 C ATOM 91 O GLU A 26 1.599 18.200 -21.228 1.00 24.95 O ATOM 92 CB GLU A 26 1.118 15.496 -23.221 1.00 30.43 C ATOM 93 CG GLU A 26 0.922 16.575 -24.254 1.00 32.77 C ATOM 94 CD GLU A 26 -0.295 16.356 -25.177 1.00 40.31 C ATOM 95 OE1 GLU A 26 -1.168 15.452 -24.879 1.00 42.60 O ATOM 96 OE2 GLU A 26 -0.409 17.274 -26.083 1.00 45.78 O ATOM 97 H GLU A 26 1.596 13.894 -21.361 1.00 0.00 H ATOM 98 N ALA A 27 0.113 16.748 -20.417 1.00 25.97 N ATOM 99 CA ALA A 27 -0.755 17.742 -19.734 1.00 26.61 C ATOM 100 C ALA A 27 0.141 18.460 -18.724 1.00 23.69 C ATOM 101 O ALA A 27 0.086 19.676 -18.585 1.00 26.77 O ATOM 102 CB ALA A 27 -1.940 17.089 -19.025 1.00 28.63 C ATOM 103 H ALA A 27 -0.099 15.739 -20.284 1.00 0.00 H ATOM 104 N VAL A 28 0.917 17.697 -17.985 1.00 22.93 N ATOM 105 CA VAL A 28 1.766 18.317 -16.891 1.00 20.42 C ATOM 106 C VAL A 28 2.818 19.226 -17.515 1.00 19.73 C ATOM 107 O VAL A 28 3.119 20.313 -16.915 1.00 21.15 O ATOM 108 CB VAL A 28 2.351 17.237 -16.017 1.00 22.26 C ATOM 109 CG1 VAL A 28 3.338 17.785 -14.998 1.00 23.27 C ATOM 110 CG2 VAL A 28 1.304 16.456 -15.176 1.00 26.01 C ATOM 111 H VAL A 28 0.948 16.671 -18.150 1.00 0.00 H ATOM 112 N ARG A 29 3.494 18.763 -18.540 1.00 21.02 N ATOM 113 CA ARG A 29 4.590 19.563 -19.127 1.00 22.18 C ATOM 114 C ARG A 29 4.109 20.784 -19.888 1.00 24.25 C ATOM 115 O ARG A 29 4.825 21.766 -20.004 1.00 25.51 O ATOM 116 CB ARG A 29 5.450 18.684 -19.978 1.00 20.95 C ATOM 117 CG ARG A 29 6.243 17.591 -19.178 1.00 19.72 C ATOM 118 CD ARG A 29 7.109 16.750 -20.002 1.00 19.75 C ATOM 119 NE ARG A 29 8.056 17.579 -20.718 1.00 21.17 N ATOM 120 CZ ARG A 29 9.173 18.138 -20.195 1.00 23.11 C ATOM 121 NH1 ARG A 29 9.545 17.849 -18.936 1.00 20.45 N ATOM 122 NH2 ARG A 29 9.954 18.856 -20.946 1.00 24.53 N ATOM 123 HE ARG A 29 7.861 17.761 -21.723 1.00 0.00 H ATOM 124 HH12 ARG A 29 10.403 18.279 -18.536 1.00 0.00 H ATOM 125 HH11 ARG A 29 8.975 17.195 -18.362 1.00 0.00 H ATOM 126 HH22 ARG A 29 10.812 19.285 -20.544 1.00 0.00 H ATOM 127 HH21 ARG A 29 9.721 19.001 -21.949 1.00 0.00 H ATOM 128 H ARG A 29 3.259 17.832 -18.940 1.00 0.00 H ATOM 129 N LYS A 30 2.834 20.723 -20.316 1.00 25.02 N ATOM 130 CA LYS A 30 2.310 21.880 -21.011 1.00 28.18 C ATOM 131 C LYS A 30 1.924 23.003 -20.063 1.00 27.73 C ATOM 132 O LYS A 30 2.019 24.178 -20.448 1.00 29.55 O ATOM 133 CB LYS A 30 1.093 21.367 -21.896 1.00 30.24 C ATOM 134 CG LYS A 30 0.525 22.432 -22.819 1.00 37.66 C ATOM 135 CD LYS A 30 -0.801 21.879 -23.415 1.00 39.89 C ATOM 136 CE LYS A 30 -0.680 21.417 -24.835 1.00 48.69 C ATOM 137 NZ LYS A 30 -0.224 19.996 -24.919 1.00 51.04 N ATOM 138 HZ1 LYS A 30 0.707 19.905 -24.465 1.00 0.00 H ATOM 139 HZ2 LYS A 30 -0.910 19.384 -24.433 1.00 0.00 H ATOM 140 HZ3 LYS A 30 -0.153 19.714 -25.918 1.00 0.00 H ATOM 141 H LYS A 30 2.249 19.879 -20.154 1.00 0.00 H ATOM 142 N ARG A 31 1.412 22.724 -18.872 1.00 25.80 N ATOM 143 CA ARG A 31 0.970 23.717 -17.947 1.00 26.31 C ATOM 144 C ARG A 31 1.452 23.412 -16.589 1.00 22.68 C ATOM 145 O ARG A 31 0.777 23.218 -15.577 1.00 24.38 O ATOM 146 CB ARG A 31 -0.602 23.907 -18.045 1.00 29.03 C ATOM 147 CG ARG A 31 -1.032 24.234 -19.464 1.00 31.86 C ATOM 148 CD ARG A 31 -2.530 24.579 -19.349 1.00 35.81 C ATOM 149 NE ARG A 31 -3.169 24.660 -20.643 1.00 35.95 N ATOM 150 CZ ARG A 31 -3.658 23.638 -21.299 1.00 36.56 C ATOM 151 NH1 ARG A 31 -4.207 23.899 -22.504 1.00 40.37 N ATOM 152 NH2 ARG A 31 -3.592 22.376 -20.835 1.00 37.18 N ATOM 153 HE ARG A 31 -3.246 25.598 -21.085 1.00 0.00 H ATOM 154 HH12 ARG A 31 -4.611 23.126 -23.070 1.00 0.00 H ATOM 155 HH11 ARG A 31 -4.226 24.874 -22.867 1.00 0.00 H ATOM 156 HH22 ARG A 31 -3.995 21.595 -21.392 1.00 0.00 H ATOM 157 HH21 ARG A 31 -3.138 22.182 -19.920 1.00 0.00 H ATOM 158 H ARG A 31 1.328 21.725 -18.596 1.00 0.00 H ATOM 159 N PRO A 32 2.829 23.424 -16.440 1.00 22.22 N ATOM 160 CA PRO A 32 3.324 22.935 -15.152 1.00 22.89 C ATOM 161 C PRO A 32 2.939 23.697 -13.888 1.00 21.15 C ATOM 162 O PRO A 32 2.719 23.151 -12.803 1.00 21.58 O ATOM 163 CB PRO A 32 4.883 23.009 -15.399 1.00 22.60 C ATOM 164 CG PRO A 32 5.034 23.977 -16.505 1.00 24.72 C ATOM 165 CD PRO A 32 3.872 23.748 -17.387 1.00 22.97 C ATOM 166 N GLY A 33 2.790 25.022 -14.000 1.00 20.81 N ATOM 167 CA GLY A 33 2.370 25.802 -12.889 1.00 23.12 C ATOM 168 C GLY A 33 1.016 25.494 -12.396 1.00 23.74 C ATOM 169 O GLY A 33 0.748 25.763 -11.261 1.00 25.84 O ATOM 170 H GLY A 33 2.984 25.486 -14.910 1.00 0.00 H ATOM 171 N MET A 34 0.149 24.914 -13.270 1.00 26.76 N ATOM 172 CA MET A 34 -1.126 24.520 -12.762 1.00 25.69 C ATOM 173 C MET A 34 -1.017 23.307 -11.831 1.00 26.87 C ATOM 174 O MET A 34 -1.833 23.173 -10.943 1.00 25.95 O ATOM 175 CB MET A 34 -2.129 24.198 -13.805 1.00 28.54 C ATOM 176 CG MET A 34 -2.387 25.323 -14.829 1.00 28.27 C ATOM 177 SD MET A 34 -3.776 24.900 -16.001 1.00 31.83 S ATOM 178 CE MET A 34 -5.151 24.685 -14.821 1.00 33.91 C ATOM 179 H MET A 34 0.405 24.764 -14.267 1.00 0.00 H ATOM 180 N TYR A 35 0.093 22.549 -11.931 1.00 24.54 N ATOM 181 CA TYR A 35 0.305 21.447 -11.115 1.00 27.25 C ATOM 182 C TYR A 35 1.115 21.680 -9.889 1.00 31.13 C ATOM 183 O TYR A 35 0.857 21.142 -8.830 1.00 31.48 O ATOM 184 CB TYR A 35 0.943 20.379 -11.964 1.00 28.70 C ATOM 185 CG TYR A 35 0.065 19.702 -12.892 1.00 26.97 C ATOM 186 CD1 TYR A 35 -0.161 20.197 -14.146 1.00 27.03 C ATOM 187 CD2 TYR A 35 -0.600 18.580 -12.453 1.00 29.19 C ATOM 188 CE1 TYR A 35 -1.051 19.605 -15.003 1.00 30.88 C ATOM 189 CE2 TYR A 35 -1.396 17.945 -13.263 1.00 30.12 C ATOM 190 CZ TYR A 35 -1.633 18.423 -14.477 1.00 27.20 C ATOM 191 OH TYR A 35 -2.542 17.679 -15.151 1.00 35.46 O ATOM 192 HH TYR A 35 -2.687 18.071 -16.048 1.00 0.00 H ATOM 193 H TYR A 35 0.812 22.797 -12.641 1.00 0.00 H ATOM 194 N ILE A 36 2.137 22.569 -9.983 1.00 27.31 N ATOM 195 CA ILE A 36 3.032 22.825 -8.830 1.00 28.06 C ATOM 196 C ILE A 36 3.097 24.234 -8.293 1.00 28.88 C ATOM 197 O ILE A 36 3.987 24.525 -7.478 1.00 29.71 O ATOM 198 CB ILE A 36 4.446 22.338 -9.172 1.00 28.07 C ATOM 199 CG1 ILE A 36 5.027 22.998 -10.394 1.00 25.49 C ATOM 200 CG2 ILE A 36 4.359 20.815 -9.401 1.00 28.92 C ATOM 201 CD1 ILE A 36 6.482 22.852 -10.483 1.00 29.09 C ATOM 202 H ILE A 36 2.294 23.077 -10.877 1.00 0.00 H ATOM 203 N GLY A 37 2.201 25.064 -8.791 1.00 27.97 N ATOM 204 CA GLY A 37 2.037 26.394 -8.350 1.00 29.44 C ATOM 205 C GLY A 37 2.773 27.400 -9.181 1.00 26.98 C ATOM 206 O GLY A 37 2.291 28.428 -9.413 1.00 29.43 O ATOM 207 H GLY A 37 1.581 24.719 -9.551 1.00 0.00 H ATOM 208 N SER A 38 4.009 27.041 -9.569 1.00 23.21 N ATOM 209 CA SER A 38 4.864 27.934 -10.346 1.00 25.57 C ATOM 210 C SER A 38 6.044 27.192 -10.835 1.00 23.22 C ATOM 211 O SER A 38 6.314 26.097 -10.332 1.00 23.05 O ATOM 212 CB SER A 38 5.395 29.095 -9.469 1.00 30.24 C ATOM 213 OG SER A 38 6.412 28.697 -8.611 1.00 35.38 O ATOM 214 HG SER A 38 6.714 29.474 -8.076 1.00 0.00 H ATOM 215 H SER A 38 4.367 26.100 -9.308 1.00 0.00 H ATOM 216 N THR A 39 6.745 27.759 -11.776 1.00 22.04 N ATOM 217 CA THR A 39 7.956 27.153 -12.249 1.00 20.18 C ATOM 218 C THR A 39 9.232 28.010 -11.772 1.00 20.42 C ATOM 219 O THR A 39 10.319 27.786 -12.314 1.00 20.45 O ATOM 220 CB THR A 39 8.012 27.015 -13.737 1.00 22.09 C ATOM 221 OG1 THR A 39 7.843 28.259 -14.328 1.00 25.27 O ATOM 222 CG2 THR A 39 6.950 26.005 -14.204 1.00 25.63 C ATOM 223 HG1 THR A 39 8.564 28.867 -14.027 1.00 0.00 H ATOM 224 H THR A 39 6.424 28.658 -12.187 1.00 0.00 H ATOM 225 N SER A 40 9.023 28.863 -10.813 1.00 19.82 N ATOM 226 CA SER A 40 10.047 29.614 -10.169 1.00 20.74 C ATOM 227 C SER A 40 10.784 28.769 -9.128 1.00 19.74 C ATOM 228 O SER A 40 10.626 27.580 -9.076 1.00 19.10 O ATOM 229 CB SER A 40 9.414 30.784 -9.430 1.00 22.66 C ATOM 230 OG SER A 40 8.733 30.231 -8.270 1.00 26.15 O ATOM 231 HG SER A 40 8.042 29.589 -8.570 1.00 0.00 H ATOM 232 H SER A 40 8.043 29.006 -10.495 1.00 0.00 H ATOM 233 N GLU A 41 11.691 29.393 -8.423 1.00 20.09 N ATOM 234 CA GLU A 41 12.342 28.722 -7.321 1.00 20.79 C ATOM 235 C GLU A 41 11.387 28.037 -6.384 1.00 19.40 C ATOM 236 O GLU A 41 11.706 26.911 -5.897 1.00 18.84 O ATOM 237 CB GLU A 41 13.288 29.707 -6.600 1.00 22.62 C ATOM 238 CG GLU A 41 14.192 29.009 -5.645 1.00 26.15 C ATOM 239 CD GLU A 41 15.412 29.789 -5.116 1.00 28.18 C ATOM 240 OE1 GLU A 41 15.882 29.483 -4.020 1.00 29.96 O ATOM 241 OE2 GLU A 41 16.124 30.570 -5.830 1.00 32.56 O ATOM 242 H GLU A 41 11.945 30.374 -8.656 1.00 0.00 H ATOM 243 N ARG A 42 10.234 28.599 -6.128 1.00 19.74 N ATOM 244 CA ARG A 42 9.275 27.957 -5.241 1.00 20.76 C ATOM 245 C ARG A 42 8.797 26.653 -5.810 1.00 20.15 C ATOM 246 O ARG A 42 8.654 25.584 -5.073 1.00 20.22 O ATOM 247 CB ARG A 42 8.097 28.942 -5.002 1.00 22.26 C ATOM 248 CG ARG A 42 8.530 30.071 -4.121 1.00 25.02 C ATOM 249 CD ARG A 42 7.835 30.008 -2.784 1.00 27.38 C ATOM 250 NE ARG A 42 6.511 30.645 -2.798 1.00 30.97 N ATOM 251 CZ ARG A 42 6.285 31.955 -2.623 1.00 33.15 C ATOM 252 NH1 ARG A 42 5.040 32.396 -2.680 1.00 35.84 N ATOM 253 NH2 ARG A 42 7.242 32.831 -2.369 1.00 35.37 N ATOM 254 HE ARG A 42 5.685 30.033 -2.956 1.00 0.00 H ATOM 255 HH12 ARG A 42 4.840 33.408 -2.547 1.00 0.00 H ATOM 256 HH11 ARG A 42 4.260 31.731 -2.858 1.00 0.00 H ATOM 257 HH22 ARG A 42 7.007 33.836 -2.242 1.00 0.00 H ATOM 258 HH21 ARG A 42 8.230 32.515 -2.296 1.00 0.00 H ATOM 259 H ARG A 42 10.000 29.514 -6.563 1.00 0.00 H ATOM 260 N GLY A 43 8.480 26.580 -7.101 1.00 18.08 N ATOM 261 CA GLY A 43 8.086 25.342 -7.719 1.00 18.77 C ATOM 262 C GLY A 43 9.157 24.296 -7.767 1.00 17.08 C ATOM 263 O GLY A 43 8.886 23.106 -7.568 1.00 18.05 O ATOM 264 H GLY A 43 8.518 27.443 -7.680 1.00 0.00 H ATOM 265 N LEU A 44 10.439 24.727 -7.975 1.00 16.57 N ATOM 266 CA LEU A 44 11.555 23.782 -7.933 1.00 15.96 C ATOM 267 C LEU A 44 11.604 23.076 -6.605 1.00 15.99 C ATOM 268 O LEU A 44 11.765 21.850 -6.535 1.00 15.85 O ATOM 269 CB LEU A 44 12.898 24.544 -8.148 1.00 16.74 C ATOM 270 CG LEU A 44 14.170 23.683 -8.095 1.00 16.81 C ATOM 271 CD1 LEU A 44 14.236 22.894 -9.397 1.00 18.44 C ATOM 272 CD2 LEU A 44 15.404 24.620 -7.848 1.00 17.60 C ATOM 273 H LEU A 44 10.621 25.733 -8.164 1.00 0.00 H ATOM 274 N HIS A 45 11.474 23.836 -5.531 1.00 15.34 N ATOM 275 CA HIS A 45 11.560 23.200 -4.188 1.00 15.52 C ATOM 276 C HIS A 45 10.315 22.359 -3.915 1.00 16.62 C ATOM 277 O HIS A 45 10.351 21.356 -3.190 1.00 16.48 O ATOM 278 CB HIS A 45 11.764 24.220 -3.080 1.00 16.55 C ATOM 279 CG HIS A 45 13.150 24.833 -3.070 1.00 16.20 C ATOM 280 ND1 HIS A 45 13.502 25.841 -3.915 1.00 18.95 N ATOM 281 CD2 HIS A 45 14.287 24.519 -2.383 1.00 18.41 C ATOM 282 CE1 HIS A 45 14.770 26.169 -3.715 1.00 20.28 C ATOM 283 NE2 HIS A 45 15.259 25.362 -2.810 1.00 17.84 N ATOM 284 H HIS A 45 11.315 24.860 -5.623 1.00 0.00 H ATOM 285 N HIS A 46 9.180 22.720 -4.482 1.00 16.45 N ATOM 286 CA HIS A 46 7.980 21.900 -4.347 1.00 18.45 C ATOM 287 C HIS A 46 8.168 20.493 -4.831 1.00 15.92 C ATOM 288 O HIS A 46 7.517 19.501 -4.262 1.00 17.24 O ATOM 289 CB HIS A 46 6.836 22.563 -5.125 1.00 20.17 C ATOM 290 CG HIS A 46 5.524 21.914 -4.881 1.00 25.48 C ATOM 291 ND1 HIS A 46 4.720 22.182 -3.787 1.00 31.17 N ATOM 292 CD2 HIS A 46 4.871 20.994 -5.627 1.00 27.86 C ATOM 293 CE1 HIS A 46 3.611 21.446 -3.872 1.00 28.13 C ATOM 294 NE2 HIS A 46 3.678 20.733 -4.987 1.00 29.31 N ATOM 295 H HIS A 46 9.140 23.601 -5.033 1.00 0.00 H ATOM 296 N LEU A 47 9.021 20.243 -5.834 1.00 15.30 N ATOM 297 CA LEU A 47 9.371 18.897 -6.287 1.00 16.13 C ATOM 298 C LEU A 47 9.785 18.049 -5.081 1.00 16.66 C ATOM 299 O LEU A 47 9.397 16.865 -4.949 1.00 16.85 O ATOM 300 CB LEU A 47 10.448 18.852 -7.338 1.00 15.99 C ATOM 301 CG LEU A 47 10.162 19.621 -8.688 1.00 17.26 C ATOM 302 CD1 LEU A 47 11.387 19.561 -9.580 1.00 18.00 C ATOM 303 CD2 LEU A 47 8.924 19.078 -9.307 1.00 20.33 C ATOM 304 H LEU A 47 9.459 21.052 -6.318 1.00 0.00 H ATOM 305 N VAL A 48 10.675 18.602 -4.276 1.00 15.59 N ATOM 306 CA VAL A 48 11.224 17.871 -3.121 1.00 16.50 C ATOM 307 C VAL A 48 10.093 17.546 -2.212 1.00 17.32 C ATOM 308 O VAL A 48 10.034 16.375 -1.722 1.00 17.45 O ATOM 309 CB VAL A 48 12.336 18.679 -2.424 1.00 16.37 C ATOM 310 CG1 VAL A 48 12.883 17.888 -1.258 1.00 16.47 C ATOM 311 CG2 VAL A 48 13.481 18.943 -3.428 1.00 16.91 C ATOM 312 H VAL A 48 10.995 19.574 -4.462 1.00 0.00 H ATOM 313 N TRP A 49 9.249 18.517 -1.916 1.00 16.41 N ATOM 314 CA TRP A 49 8.147 18.299 -0.972 1.00 18.59 C ATOM 315 C TRP A 49 7.169 17.224 -1.374 1.00 18.06 C ATOM 316 O TRP A 49 6.700 16.455 -0.567 1.00 17.89 O ATOM 317 CB TRP A 49 7.420 19.578 -0.666 1.00 17.96 C ATOM 318 CG TRP A 49 8.407 20.623 -0.172 1.00 21.71 C ATOM 319 CD1 TRP A 49 8.442 21.789 -0.576 1.00 23.57 C ATOM 320 CD2 TRP A 49 9.634 20.418 0.672 1.00 21.81 C ATOM 321 NE1 TRP A 49 9.519 22.474 -0.021 1.00 23.31 N ATOM 322 CE2 TRP A 49 10.303 21.575 0.640 1.00 23.70 C ATOM 323 CE3 TRP A 49 10.132 19.354 1.393 1.00 24.91 C ATOM 324 CZ2 TRP A 49 11.460 21.818 1.348 1.00 23.45 C ATOM 325 CZ3 TRP A 49 11.308 19.524 2.065 1.00 25.95 C ATOM 326 CH2 TRP A 49 11.906 20.813 2.096 1.00 23.21 C ATOM 327 HE1 TRP A 49 9.696 23.496 -0.097 1.00 0.00 H ATOM 328 H TRP A 49 9.367 19.451 -2.359 1.00 0.00 H ATOM 329 N GLU A 50 6.955 17.126 -2.620 1.00 15.99 N ATOM 330 CA GLU A 50 6.025 16.102 -3.151 1.00 16.76 C ATOM 331 C GLU A 50 6.598 14.694 -2.874 1.00 17.94 C ATOM 332 O GLU A 50 5.858 13.750 -2.479 1.00 20.05 O ATOM 333 CB GLU A 50 5.784 16.247 -4.652 1.00 18.96 C ATOM 334 CG GLU A 50 4.782 17.433 -4.831 1.00 21.47 C ATOM 335 CD GLU A 50 3.350 17.215 -4.241 1.00 29.25 C ATOM 336 OE1 GLU A 50 2.831 16.146 -4.458 1.00 27.38 O ATOM 337 OE2 GLU A 50 2.781 18.104 -3.602 1.00 45.81 O ATOM 338 H GLU A 50 7.438 17.772 -3.277 1.00 0.00 H ATOM 339 N ILE A 51 7.907 14.527 -3.091 1.00 15.81 N ATOM 340 CA ILE A 51 8.523 13.212 -2.857 1.00 15.80 C ATOM 341 C ILE A 51 8.528 12.902 -1.399 1.00 17.80 C ATOM 342 O ILE A 51 8.167 11.835 -0.939 1.00 19.26 O ATOM 343 CB ILE A 51 9.937 13.152 -3.524 1.00 17.69 C ATOM 344 CG1 ILE A 51 9.949 13.367 -5.046 1.00 17.90 C ATOM 345 CG2 ILE A 51 10.616 11.901 -3.076 1.00 17.45 C ATOM 346 CD1 ILE A 51 9.020 12.544 -5.832 1.00 20.86 C ATOM 347 H ILE A 51 8.487 15.324 -3.424 1.00 0.00 H ATOM 348 N VAL A 52 8.963 13.869 -0.556 1.00 15.32 N ATOM 349 CA VAL A 52 9.123 13.674 0.880 1.00 15.26 C ATOM 350 C VAL A 52 7.764 13.358 1.468 1.00 16.33 C ATOM 351 O VAL A 52 7.635 12.537 2.392 1.00 16.83 O ATOM 352 CB VAL A 52 9.785 14.895 1.520 1.00 15.89 C ATOM 353 CG1 VAL A 52 9.647 14.855 3.014 1.00 18.34 C ATOM 354 CG2 VAL A 52 11.240 14.921 1.108 1.00 17.14 C ATOM 355 H VAL A 52 9.195 14.801 -0.955 1.00 0.00 H ATOM 356 N ASP A 53 6.681 14.027 0.969 1.00 17.24 N ATOM 357 CA ASP A 53 5.298 13.753 1.554 1.00 17.87 C ATOM 358 C ASP A 53 4.941 12.295 1.411 1.00 18.92 C ATOM 359 O ASP A 53 4.307 11.775 2.337 1.00 18.89 O ATOM 360 CB ASP A 53 4.288 14.629 0.751 1.00 20.06 C ATOM 361 CG ASP A 53 2.848 14.568 1.400 1.00 23.58 C ATOM 362 OD1 ASP A 53 1.953 14.138 0.692 1.00 29.15 O ATOM 363 OD2 ASP A 53 2.786 14.911 2.623 1.00 27.36 O ATOM 364 H ASP A 53 6.798 14.716 0.199 1.00 0.00 H ATOM 365 N ASN A 54 5.286 11.639 0.357 1.00 17.85 N ATOM 366 CA ASN A 54 4.926 10.198 0.208 1.00 18.65 C ATOM 367 C ASN A 54 5.738 9.365 1.183 1.00 18.25 C ATOM 368 O ASN A 54 5.269 8.338 1.697 1.00 19.19 O ATOM 369 CB ASN A 54 5.131 9.733 -1.166 1.00 22.05 C ATOM 370 CG ASN A 54 3.987 10.135 -2.120 1.00 27.28 C ATOM 371 OD1 ASN A 54 2.846 10.318 -1.737 1.00 33.80 O ATOM 372 ND2 ASN A 54 4.315 10.155 -3.328 1.00 31.62 N ATOM 373 HD22 ASN A 54 5.305 9.992 -3.601 1.00 0.00 H ATOM 374 HD21 ASN A 54 3.597 10.334 -4.059 1.00 0.00 H ATOM 375 H ASN A 54 5.820 12.118 -0.396 1.00 0.00 H ATOM 376 N SER A 55 7.024 9.732 1.431 1.00 17.06 N ATOM 377 CA SER A 55 7.789 9.005 2.436 1.00 16.60 C ATOM 378 C SER A 55 7.154 9.207 3.819 1.00 17.00 C ATOM 379 O SER A 55 7.138 8.291 4.666 1.00 16.59 O ATOM 380 CB SER A 55 9.270 9.389 2.476 1.00 17.07 C ATOM 381 OG SER A 55 9.908 9.063 1.279 1.00 17.30 O ATOM 382 HG SER A 55 9.838 8.088 1.124 1.00 0.00 H ATOM 383 H SER A 55 7.456 10.522 0.910 1.00 0.00 H ATOM 384 N ILE A 56 6.733 10.460 4.110 1.00 15.82 N ATOM 385 CA ILE A 56 6.045 10.741 5.379 1.00 16.82 C ATOM 386 C ILE A 56 4.780 9.856 5.533 1.00 17.31 C ATOM 387 O ILE A 56 4.575 9.322 6.593 1.00 17.61 O ATOM 388 CB ILE A 56 5.792 12.237 5.573 1.00 17.66 C ATOM 389 CG1 ILE A 56 7.139 12.958 5.752 1.00 20.13 C ATOM 390 CG2 ILE A 56 4.870 12.415 6.844 1.00 19.15 C ATOM 391 CD1 ILE A 56 7.030 14.450 5.815 1.00 21.84 C ATOM 392 H ILE A 56 6.897 11.230 3.431 1.00 0.00 H ATOM 393 N ASP A 57 4.058 9.664 4.427 1.00 18.68 N ATOM 394 CA ASP A 57 2.856 8.745 4.540 1.00 18.56 C ATOM 395 C ASP A 57 3.241 7.351 4.910 1.00 18.69 C ATOM 396 O ASP A 57 2.514 6.711 5.626 1.00 20.04 O ATOM 397 CB ASP A 57 2.083 8.816 3.235 1.00 20.09 C ATOM 398 CG ASP A 57 1.294 10.063 3.093 1.00 27.31 C ATOM 399 OD1 ASP A 57 0.993 10.321 1.944 1.00 32.03 O ATOM 400 OD2 ASP A 57 0.966 10.731 4.049 1.00 29.20 O ATOM 401 H ASP A 57 4.308 10.124 3.528 1.00 0.00 H ATOM 402 N GLU A 58 4.316 6.877 4.338 1.00 17.31 N ATOM 403 CA GLU A 58 4.844 5.570 4.689 1.00 18.14 C ATOM 404 C GLU A 58 5.218 5.464 6.121 1.00 18.29 C ATOM 405 O GLU A 58 5.122 4.377 6.719 1.00 19.92 O ATOM 406 CB GLU A 58 5.903 5.181 3.639 1.00 18.26 C ATOM 407 CG GLU A 58 6.491 3.847 3.757 1.00 18.28 C ATOM 408 CD GLU A 58 5.513 2.669 3.386 1.00 17.19 C ATOM 409 OE1 GLU A 58 4.332 2.947 3.082 1.00 21.87 O ATOM 410 OE2 GLU A 58 6.100 1.590 3.551 1.00 19.53 O ATOM 411 H GLU A 58 4.803 7.447 3.617 1.00 0.00 H ATOM 412 N ALA A 59 5.740 6.510 6.730 1.00 16.80 N ATOM 413 CA ALA A 59 6.004 6.538 8.189 1.00 16.53 C ATOM 414 C ALA A 59 4.773 6.630 8.955 1.00 18.03 C ATOM 415 O ALA A 59 4.651 5.905 9.980 1.00 19.42 O ATOM 416 CB ALA A 59 6.971 7.666 8.535 1.00 17.47 C ATOM 417 H ALA A 59 5.976 7.350 6.164 1.00 0.00 H ATOM 418 N LEU A 60 3.785 7.443 8.577 1.00 19.28 N ATOM 419 CA LEU A 60 2.523 7.466 9.305 1.00 22.19 C ATOM 420 C LEU A 60 1.799 6.203 9.235 1.00 22.01 C ATOM 421 O LEU A 60 1.136 5.871 10.224 1.00 24.30 O ATOM 422 CB LEU A 60 1.649 8.612 8.699 1.00 24.90 C ATOM 423 CG LEU A 60 2.222 9.983 8.871 1.00 27.65 C ATOM 424 CD1 LEU A 60 1.389 10.822 7.924 1.00 30.07 C ATOM 425 CD2 LEU A 60 2.253 10.512 10.240 1.00 29.20 C ATOM 426 H LEU A 60 3.917 8.066 7.755 1.00 0.00 H ATOM 427 N ALA A 61 1.972 5.448 8.181 1.00 20.32 N ATOM 428 CA ALA A 61 1.411 4.050 8.068 1.00 19.97 C ATOM 429 C ALA A 61 2.080 3.070 8.972 1.00 23.01 C ATOM 430 O ALA A 61 1.491 1.959 9.145 1.00 23.93 O ATOM 431 CB ALA A 61 1.449 3.610 6.661 1.00 21.76 C ATOM 432 H ALA A 61 2.521 5.828 7.384 1.00 0.00 H ATOM 433 N GLY A 62 3.244 3.410 9.632 1.00 19.12 N ATOM 434 CA GLY A 62 3.834 2.604 10.584 1.00 20.41 C ATOM 435 C GLY A 62 5.084 1.882 10.110 1.00 20.51 C ATOM 436 O GLY A 62 5.567 1.007 10.803 1.00 21.64 O ATOM 437 H GLY A 62 3.698 4.317 9.401 1.00 0.00 H ATOM 438 N TYR A 63 5.554 2.182 8.888 1.00 19.22 N ATOM 439 CA TYR A 63 6.606 1.350 8.291 1.00 21.91 C ATOM 440 C TYR A 63 7.987 2.050 8.241 1.00 24.42 C ATOM 441 O TYR A 63 8.962 1.569 8.814 1.00 34.31 O ATOM 442 CB TYR A 63 6.181 0.799 6.961 1.00 23.06 C ATOM 443 CG TYR A 63 5.017 -0.210 7.160 1.00 24.31 C ATOM 444 CD1 TYR A 63 3.877 0.219 6.880 1.00 27.32 C ATOM 445 CD2 TYR A 63 5.256 -1.502 7.599 1.00 30.79 C ATOM 446 CE1 TYR A 63 2.791 -0.627 6.975 1.00 36.79 C ATOM 447 CE2 TYR A 63 4.195 -2.345 7.797 1.00 33.46 C ATOM 448 CZ TYR A 63 2.982 -1.854 7.460 1.00 33.54 C ATOM 449 OH TYR A 63 1.780 -2.525 7.484 1.00 45.73 O ATOM 450 HH TYR A 63 1.058 -1.917 7.186 1.00 0.00 H ATOM 451 H TYR A 63 5.175 2.999 8.368 1.00 0.00 H ATOM 452 N ALA A 64 8.060 3.289 7.876 1.00 20.50 N ATOM 453 CA ALA A 64 9.309 4.038 7.785 1.00 18.06 C ATOM 454 C ALA A 64 9.554 4.863 9.003 1.00 18.28 C ATOM 455 O ALA A 64 8.594 5.288 9.682 1.00 21.08 O ATOM 456 CB ALA A 64 9.252 4.919 6.620 1.00 17.92 C ATOM 457 H ALA A 64 7.176 3.780 7.633 1.00 0.00 H ATOM 458 N ASN A 65 10.816 5.088 9.389 1.00 17.60 N ATOM 459 CA ASN A 65 11.187 6.056 10.356 1.00 18.08 C ATOM 460 C ASN A 65 12.390 6.864 10.052 1.00 16.75 C ATOM 461 O ASN A 65 12.778 7.685 10.913 1.00 16.91 O ATOM 462 CB ASN A 65 11.289 5.448 11.735 1.00 19.24 C ATOM 463 CG ASN A 65 12.516 4.531 11.896 1.00 22.70 C ATOM 464 OD1 ASN A 65 13.256 4.240 11.000 1.00 21.78 O ATOM 465 ND2 ASN A 65 12.789 4.125 13.148 1.00 32.39 N ATOM 466 HD22 ASN A 65 12.148 4.376 13.928 1.00 0.00 H ATOM 467 HD21 ASN A 65 13.641 3.560 13.337 1.00 0.00 H ATOM 468 H ASN A 65 11.569 4.519 8.953 1.00 0.00 H ATOM 469 N GLN A 66 12.939 6.767 8.846 1.00 16.16 N ATOM 470 CA GLN A 66 14.113 7.537 8.493 1.00 16.72 C ATOM 471 C GLN A 66 13.860 8.034 7.064 1.00 15.41 C ATOM 472 O GLN A 66 13.511 7.189 6.178 1.00 16.97 O ATOM 473 CB GLN A 66 15.360 6.713 8.547 1.00 18.39 C ATOM 474 CG GLN A 66 15.790 6.361 9.930 1.00 22.94 C ATOM 475 CD GLN A 66 17.008 5.416 9.861 1.00 29.86 C ATOM 476 OE1 GLN A 66 16.911 4.283 10.200 1.00 42.55 O ATOM 477 NE2 GLN A 66 18.037 5.854 9.323 1.00 35.59 N ATOM 478 HE22 GLN A 66 18.090 6.853 9.038 1.00 0.00 H ATOM 479 HE21 GLN A 66 18.846 5.222 9.158 1.00 0.00 H ATOM 480 H GLN A 66 12.518 6.127 8.143 1.00 0.00 H ATOM 481 N ILE A 67 14.130 9.310 6.867 1.00 14.14 N ATOM 482 CA ILE A 67 14.043 9.925 5.510 1.00 14.63 C ATOM 483 C ILE A 67 15.294 10.724 5.342 1.00 14.50 C ATOM 484 O ILE A 67 15.701 11.448 6.254 1.00 15.80 O ATOM 485 CB ILE A 67 12.848 10.825 5.360 1.00 14.73 C ATOM 486 CG1 ILE A 67 11.563 10.019 5.617 1.00 15.53 C ATOM 487 CG2 ILE A 67 12.860 11.529 4.038 1.00 15.76 C ATOM 488 CD1 ILE A 67 10.344 10.947 5.641 1.00 17.03 C ATOM 489 H ILE A 67 14.410 9.901 7.676 1.00 0.00 H ATOM 490 N GLU A 68 15.950 10.617 4.200 1.00 15.59 N ATOM 491 CA GLU A 68 17.212 11.385 3.892 1.00 15.63 C ATOM 492 C GLU A 68 17.048 12.166 2.607 1.00 16.26 C ATOM 493 O GLU A 68 16.557 11.550 1.637 1.00 17.36 O ATOM 494 CB GLU A 68 18.403 10.497 3.799 1.00 17.35 C ATOM 495 CG GLU A 68 19.710 11.236 3.615 1.00 20.80 C ATOM 496 CD GLU A 68 20.749 10.186 3.156 1.00 21.87 C ATOM 497 OE1 GLU A 68 21.762 10.000 3.964 1.00 24.82 O ATOM 498 OE2 GLU A 68 20.684 9.475 2.072 1.00 22.56 O ATOM 499 H GLU A 68 15.577 9.970 3.476 1.00 0.00 H ATOM 500 N VAL A 69 17.310 13.448 2.617 1.00 14.41 N ATOM 501 CA VAL A 69 17.258 14.279 1.430 1.00 14.51 C ATOM 502 C VAL A 69 18.689 14.735 1.164 1.00 14.19 C ATOM 503 O VAL A 69 19.305 15.373 2.079 1.00 14.71 O ATOM 504 CB VAL A 69 16.347 15.465 1.582 1.00 15.60 C ATOM 505 CG1 VAL A 69 16.434 16.469 0.409 1.00 16.41 C ATOM 506 CG2 VAL A 69 14.930 15.014 1.957 1.00 16.08 C ATOM 507 H VAL A 69 17.568 13.893 3.521 1.00 0.00 H ATOM 508 N VAL A 70 19.244 14.432 -0.003 1.00 14.91 N ATOM 509 CA VAL A 70 20.643 14.779 -0.397 1.00 14.76 C ATOM 510 C VAL A 70 20.565 15.726 -1.619 1.00 16.09 C ATOM 511 O VAL A 70 19.973 15.346 -2.634 1.00 15.43 O ATOM 512 CB VAL A 70 21.494 13.581 -0.652 1.00 15.69 C ATOM 513 CG1 VAL A 70 22.938 14.070 -0.869 1.00 16.63 C ATOM 514 CG2 VAL A 70 21.401 12.559 0.461 1.00 16.66 C ATOM 515 H VAL A 70 18.663 13.915 -0.694 1.00 0.00 H ATOM 516 N ILE A 71 21.238 16.878 -1.515 1.00 15.80 N ATOM 517 CA ILE A 71 21.476 17.738 -2.697 1.00 14.99 C ATOM 518 C ILE A 71 22.791 17.220 -3.281 1.00 15.48 C ATOM 519 O ILE A 71 23.862 17.419 -2.607 1.00 17.59 O ATOM 520 CB ILE A 71 21.444 19.223 -2.406 1.00 15.08 C ATOM 521 CG1 ILE A 71 20.514 19.668 -1.307 1.00 16.29 C ATOM 522 CG2 ILE A 71 21.314 19.958 -3.739 1.00 15.97 C ATOM 523 CD1 ILE A 71 20.702 21.177 -0.892 1.00 16.00 C ATOM 524 H ILE A 71 21.601 17.175 -0.587 1.00 0.00 H ATOM 525 N GLU A 72 22.738 16.565 -4.425 1.00 15.06 N ATOM 526 CA GLU A 72 23.903 15.938 -5.072 1.00 16.49 C ATOM 527 C GLU A 72 24.511 16.987 -6.009 1.00 17.80 C ATOM 528 O GLU A 72 23.908 17.986 -6.488 1.00 19.20 O ATOM 529 CB GLU A 72 23.562 14.604 -5.717 1.00 17.98 C ATOM 530 CG GLU A 72 23.059 13.597 -4.675 1.00 19.97 C ATOM 531 CD GLU A 72 22.792 12.238 -5.287 1.00 23.37 C ATOM 532 OE1 GLU A 72 21.947 12.190 -6.207 1.00 30.69 O ATOM 533 OE2 GLU A 72 23.263 11.236 -4.757 1.00 30.26 O ATOM 534 H GLU A 72 21.816 16.487 -4.900 1.00 0.00 H ATOM 535 N LYS A 73 25.747 16.617 -6.463 1.00 21.76 N ATOM 536 CA LYS A 73 26.328 17.381 -7.568 1.00 22.13 C ATOM 537 C LYS A 73 25.384 17.612 -8.737 1.00 20.74 C ATOM 538 O LYS A 73 24.573 16.719 -9.109 1.00 20.88 O ATOM 539 CB LYS A 73 27.506 16.612 -8.088 1.00 28.66 C ATOM 540 CG LYS A 73 28.328 17.293 -9.136 1.00 36.32 C ATOM 541 CD LYS A 73 29.443 16.339 -9.567 1.00 46.15 C ATOM 542 CE LYS A 73 29.044 15.622 -10.841 1.00 50.69 C ATOM 543 NZ LYS A 73 29.152 16.520 -12.073 1.00 57.48 N ATOM 544 HZ1 LYS A 73 28.526 17.342 -11.957 1.00 0.00 H ATOM 545 HZ2 LYS A 73 30.135 16.843 -12.180 1.00 0.00 H ATOM 546 HZ3 LYS A 73 28.868 15.983 -12.918 1.00 0.00 H ATOM 547 H LYS A 73 26.258 15.818 -6.036 1.00 0.00 H ATOM 548 N ASP A 74 25.517 18.810 -9.211 1.00 21.78 N ATOM 549 CA ASP A 74 24.760 19.358 -10.335 1.00 22.56 C ATOM 550 C ASP A 74 23.264 19.472 -9.976 1.00 21.47 C ATOM 551 O ASP A 74 22.412 19.489 -10.830 1.00 22.48 O ATOM 552 CB ASP A 74 24.945 18.562 -11.626 1.00 23.91 C ATOM 553 CG ASP A 74 26.419 18.441 -12.007 1.00 25.16 C ATOM 554 OD1 ASP A 74 27.115 19.409 -11.777 1.00 25.87 O ATOM 555 OD2 ASP A 74 26.803 17.387 -12.506 1.00 29.70 O ATOM 556 H ASP A 74 26.217 19.430 -8.756 1.00 0.00 H ATOM 557 N ASN A 75 22.974 19.618 -8.712 1.00 18.36 N ATOM 558 CA ASN A 75 21.574 19.817 -8.271 1.00 17.23 C ATOM 559 C ASN A 75 20.653 18.670 -8.664 1.00 16.88 C ATOM 560 O ASN A 75 19.468 18.892 -8.935 1.00 16.70 O ATOM 561 CB ASN A 75 21.052 21.238 -8.609 1.00 15.96 C ATOM 562 CG ASN A 75 21.735 22.277 -7.779 1.00 15.94 C ATOM 563 OD1 ASN A 75 21.362 22.571 -6.641 1.00 16.33 O ATOM 564 ND2 ASN A 75 22.780 22.872 -8.388 1.00 20.18 N ATOM 565 HD22 ASN A 75 23.053 22.586 -9.350 1.00 0.00 H ATOM 566 HD21 ASN A 75 23.313 23.617 -7.896 1.00 0.00 H ATOM 567 H ASN A 75 23.736 19.594 -8.005 1.00 0.00 H ATOM 568 N TRP A 76 21.144 17.459 -8.588 1.00 17.24 N ATOM 569 CA TRP A 76 20.279 16.296 -8.468 1.00 17.32 C ATOM 570 C TRP A 76 19.804 16.314 -7.000 1.00 17.31 C ATOM 571 O TRP A 76 20.488 16.818 -6.100 1.00 16.59 O ATOM 572 CB TRP A 76 20.994 14.971 -8.686 1.00 17.44 C ATOM 573 CG TRP A 76 21.248 14.633 -10.109 1.00 18.54 C ATOM 574 CD1 TRP A 76 22.089 15.223 -10.926 1.00 19.87 C ATOM 575 CD2 TRP A 76 20.544 13.639 -10.848 1.00 17.46 C ATOM 576 NE1 TRP A 76 22.028 14.598 -12.190 1.00 21.71 N ATOM 577 CE2 TRP A 76 21.087 13.627 -12.143 1.00 20.24 C ATOM 578 CE3 TRP A 76 19.477 12.827 -10.528 1.00 18.49 C ATOM 579 CZ2 TRP A 76 20.605 12.714 -13.107 1.00 19.37 C ATOM 580 CZ3 TRP A 76 19.051 11.879 -11.451 1.00 22.76 C ATOM 581 CH2 TRP A 76 19.624 11.877 -12.694 1.00 20.64 C ATOM 582 HE1 TRP A 76 22.608 14.843 -13.018 1.00 0.00 H ATOM 583 H TRP A 76 22.175 17.326 -8.614 1.00 0.00 H ATOM 584 N ILE A 77 18.633 15.779 -6.784 1.00 15.21 N ATOM 585 CA ILE A 77 18.110 15.494 -5.445 1.00 14.52 C ATOM 586 C ILE A 77 17.998 13.989 -5.295 1.00 14.78 C ATOM 587 O ILE A 77 17.420 13.359 -6.194 1.00 15.29 O ATOM 588 CB ILE A 77 16.744 16.146 -5.184 1.00 14.98 C ATOM 589 CG1 ILE A 77 16.866 17.694 -5.220 1.00 15.07 C ATOM 590 CG2 ILE A 77 16.047 15.625 -3.965 1.00 15.66 C ATOM 591 CD1 ILE A 77 17.431 18.262 -3.902 1.00 16.70 C ATOM 592 H ILE A 77 18.040 15.543 -7.605 1.00 0.00 H ATOM 593 N LYS A 78 18.389 13.452 -4.147 1.00 13.91 N ATOM 594 CA LYS A 78 18.144 12.046 -3.759 1.00 15.05 C ATOM 595 C LYS A 78 17.320 12.022 -2.527 1.00 14.75 C ATOM 596 O LYS A 78 17.729 12.616 -1.504 1.00 15.71 O ATOM 597 CB LYS A 78 19.403 11.295 -3.631 1.00 16.16 C ATOM 598 CG LYS A 78 19.231 9.817 -3.249 1.00 16.99 C ATOM 599 CD LYS A 78 20.522 9.071 -3.213 1.00 21.48 C ATOM 600 CE LYS A 78 21.402 9.580 -2.090 1.00 24.16 C ATOM 601 NZ LYS A 78 22.706 8.821 -1.928 1.00 29.97 N ATOM 602 HZ1 LYS A 78 22.501 7.821 -1.727 1.00 0.00 H ATOM 603 HZ2 LYS A 78 23.259 8.893 -2.806 1.00 0.00 H ATOM 604 HZ3 LYS A 78 23.248 9.230 -1.141 1.00 0.00 H ATOM 605 H LYS A 78 18.901 14.059 -3.476 1.00 0.00 H ATOM 606 N VAL A 79 16.189 11.301 -2.531 1.00 13.47 N ATOM 607 CA VAL A 79 15.305 11.145 -1.342 1.00 13.31 C ATOM 608 C VAL A 79 15.323 9.625 -1.115 1.00 14.75 C ATOM 609 O VAL A 79 15.018 8.835 -2.011 1.00 14.88 O ATOM 610 CB VAL A 79 13.919 11.693 -1.488 1.00 14.22 C ATOM 611 CG1 VAL A 79 13.181 11.555 -0.165 1.00 14.49 C ATOM 612 CG2 VAL A 79 13.961 13.133 -1.967 1.00 15.91 C ATOM 613 H VAL A 79 15.914 10.824 -3.413 1.00 0.00 H ATOM 614 N THR A 80 15.493 9.219 0.123 1.00 14.89 N ATOM 615 CA THR A 80 15.562 7.786 0.566 1.00 15.25 C ATOM 616 C THR A 80 14.624 7.665 1.709 1.00 15.47 C ATOM 617 O THR A 80 14.631 8.518 2.654 1.00 16.60 O ATOM 618 CB THR A 80 16.897 7.321 0.945 1.00 17.05 C ATOM 619 OG1 THR A 80 17.829 7.555 -0.169 1.00 18.05 O ATOM 620 CG2 THR A 80 16.857 5.812 1.229 1.00 18.44 C ATOM 621 HG1 THR A 80 17.861 8.523 -0.373 1.00 0.00 H ATOM 622 H THR A 80 15.588 9.950 0.856 1.00 0.00 H ATOM 623 N ASP A 81 13.815 6.624 1.795 1.00 14.64 N ATOM 624 CA ASP A 81 13.103 6.229 3.032 1.00 14.74 C ATOM 625 C ASP A 81 13.392 4.783 3.316 1.00 16.78 C ATOM 626 O ASP A 81 13.821 4.057 2.415 1.00 17.00 O ATOM 627 CB ASP A 81 11.635 6.566 3.027 1.00 14.70 C ATOM 628 CG ASP A 81 10.766 5.703 2.097 1.00 16.81 C ATOM 629 OD1 ASP A 81 10.022 6.277 1.310 1.00 17.35 O ATOM 630 OD2 ASP A 81 10.858 4.472 2.170 1.00 17.22 O ATOM 631 H ASP A 81 13.669 6.047 0.942 1.00 0.00 H ATOM 632 N ASN A 82 13.185 4.368 4.539 1.00 15.78 N ATOM 633 CA ASN A 82 13.358 2.981 4.956 1.00 15.25 C ATOM 634 C ASN A 82 11.997 2.278 5.149 1.00 15.80 C ATOM 635 O ASN A 82 11.845 1.429 6.101 1.00 17.63 O ATOM 636 CB ASN A 82 14.178 2.837 6.145 1.00 15.11 C ATOM 637 CG ASN A 82 13.570 3.399 7.380 1.00 15.81 C ATOM 638 OD1 ASN A 82 12.650 4.189 7.380 1.00 14.32 O ATOM 639 ND2 ASN A 82 14.082 2.981 8.541 1.00 18.70 N ATOM 640 HD22 ASN A 82 14.871 2.304 8.547 1.00 0.00 H ATOM 641 HD21 ASN A 82 13.692 3.333 9.438 1.00 0.00 H ATOM 642 H ASN A 82 12.881 5.063 5.251 1.00 0.00 H ATOM 643 N GLY A 83 11.030 2.639 4.357 1.00 15.14 N ATOM 644 CA GLY A 83 9.703 1.969 4.340 1.00 16.22 C ATOM 645 C GLY A 83 9.701 0.625 3.673 1.00 16.72 C ATOM 646 O GLY A 83 10.772 -0.041 3.610 1.00 17.63 O ATOM 647 H GLY A 83 11.193 3.433 3.706 1.00 0.00 H ATOM 648 N ARG A 84 8.495 0.213 3.217 1.00 16.40 N ATOM 649 CA ARG A 84 8.366 -1.106 2.669 1.00 18.09 C ATOM 650 C ARG A 84 8.943 -1.227 1.280 1.00 18.49 C ATOM 651 O ARG A 84 9.092 -2.395 0.834 1.00 18.40 O ATOM 652 CB ARG A 84 6.897 -1.501 2.626 1.00 20.85 C ATOM 653 CG ARG A 84 6.365 -1.851 3.998 1.00 21.42 C ATOM 654 CD ARG A 84 4.900 -1.892 4.002 1.00 24.51 C ATOM 655 NE ARG A 84 4.281 -0.676 3.738 1.00 26.29 N ATOM 656 CZ ARG A 84 2.959 -0.458 3.717 1.00 30.80 C ATOM 657 NH1 ARG A 84 2.519 0.719 3.541 1.00 28.50 N ATOM 658 NH2 ARG A 84 2.095 -1.486 3.780 1.00 34.52 N ATOM 659 HE ARG A 84 4.899 0.137 3.539 1.00 0.00 H ATOM 660 HH12 ARG A 84 1.494 0.894 3.524 1.00 0.00 H ATOM 661 HH11 ARG A 84 3.183 1.509 3.414 1.00 0.00 H ATOM 662 HH22 ARG A 84 1.071 -1.306 3.763 1.00 0.00 H ATOM 663 HH21 ARG A 84 2.451 -2.461 3.846 1.00 0.00 H ATOM 664 H ARG A 84 7.671 0.846 3.264 1.00 0.00 H ATOM 665 N GLY A 85 9.309 -0.131 0.605 1.00 16.89 N ATOM 666 CA GLY A 85 9.620 -0.239 -0.823 1.00 17.25 C ATOM 667 C GLY A 85 8.382 -0.126 -1.666 1.00 17.11 C ATOM 668 O GLY A 85 7.356 -0.835 -1.442 1.00 18.21 O ATOM 669 H GLY A 85 9.372 0.788 1.089 1.00 0.00 H ATOM 670 N ILE A 86 8.342 0.789 -2.660 1.00 16.69 N ATOM 671 CA ILE A 86 7.197 0.859 -3.514 1.00 17.35 C ATOM 672 C ILE A 86 7.031 -0.478 -4.211 1.00 17.36 C ATOM 673 O ILE A 86 7.969 -1.136 -4.647 1.00 17.54 O ATOM 674 CB ILE A 86 7.349 1.948 -4.607 1.00 17.59 C ATOM 675 CG1 ILE A 86 7.650 3.330 -4.014 1.00 18.70 C ATOM 676 CG2 ILE A 86 6.079 1.966 -5.524 1.00 18.99 C ATOM 677 CD1 ILE A 86 7.961 4.369 -5.026 1.00 20.06 C ATOM 678 H ILE A 86 9.141 1.440 -2.803 1.00 0.00 H ATOM 679 N PRO A 87 5.743 -0.992 -4.227 1.00 17.83 N ATOM 680 CA PRO A 87 5.601 -2.356 -4.750 1.00 18.39 C ATOM 681 C PRO A 87 6.012 -2.509 -6.189 1.00 17.26 C ATOM 682 O PRO A 87 5.891 -1.593 -6.983 1.00 16.93 O ATOM 683 CB PRO A 87 4.055 -2.573 -4.621 1.00 19.59 C ATOM 684 CG PRO A 87 3.740 -1.821 -3.359 1.00 19.91 C ATOM 685 CD PRO A 87 4.499 -0.522 -3.573 1.00 18.41 C ATOM 686 N VAL A 88 6.415 -3.737 -6.545 1.00 18.21 N ATOM 687 CA VAL A 88 6.908 -4.050 -7.917 1.00 18.36 C ATOM 688 C VAL A 88 6.039 -5.133 -8.624 1.00 22.01 C ATOM 689 O VAL A 88 6.325 -5.412 -9.801 1.00 22.09 O ATOM 690 CB VAL A 88 8.391 -4.502 -7.851 1.00 20.51 C ATOM 691 CG1 VAL A 88 9.284 -3.328 -7.303 1.00 20.44 C ATOM 692 CG2 VAL A 88 8.560 -5.744 -7.008 1.00 23.50 C ATOM 693 H VAL A 88 6.383 -4.499 -5.838 1.00 0.00 H ATOM 694 N ASP A 89 4.978 -5.589 -7.974 1.00 22.60 N ATOM 695 CA ASP A 89 4.136 -6.630 -8.566 1.00 23.67 C ATOM 696 C ASP A 89 3.461 -6.044 -9.768 1.00 24.85 C ATOM 697 O ASP A 89 3.157 -4.851 -9.910 1.00 22.07 O ATOM 698 CB ASP A 89 3.071 -7.046 -7.551 1.00 28.54 C ATOM 699 CG ASP A 89 2.080 -5.888 -7.178 1.00 37.89 C ATOM 700 OD1 ASP A 89 2.523 -4.950 -6.407 1.00 38.54 O ATOM 701 OD2 ASP A 89 0.804 -5.832 -7.592 1.00 39.58 O ATOM 702 H ASP A 89 4.742 -5.205 -7.037 1.00 0.00 H ATOM 703 N ILE A 90 3.105 -6.912 -10.705 1.00 25.95 N ATOM 704 CA ILE A 90 2.450 -6.549 -11.928 1.00 28.57 C ATOM 705 C ILE A 90 1.012 -6.211 -11.599 1.00 33.69 C ATOM 706 O ILE A 90 0.335 -6.909 -10.853 1.00 36.08 O ATOM 707 CB ILE A 90 2.509 -7.720 -12.964 1.00 33.92 C ATOM 708 CG1 ILE A 90 3.975 -7.979 -13.372 1.00 34.69 C ATOM 709 CG2 ILE A 90 1.596 -7.430 -14.134 1.00 34.30 C ATOM 710 CD1 ILE A 90 4.857 -6.865 -13.924 1.00 36.97 C ATOM 711 H ILE A 90 3.314 -7.918 -10.543 1.00 0.00 H ATOM 712 N GLN A 91 0.588 -5.068 -12.077 1.00 34.71 N ATOM 713 CA GLN A 91 -0.828 -4.688 -11.962 1.00 46.87 C ATOM 714 C GLN A 91 -1.854 -5.330 -12.856 1.00 54.09 C ATOM 715 O GLN A 91 -1.612 -5.638 -14.012 1.00 56.71 O ATOM 716 CB GLN A 91 -0.939 -3.265 -12.300 1.00 45.06 C ATOM 717 CG GLN A 91 -0.261 -2.444 -11.261 1.00 40.96 C ATOM 718 CD GLN A 91 -1.119 -1.303 -10.947 1.00 39.96 C ATOM 719 OE1 GLN A 91 -2.076 -0.914 -11.706 1.00 40.88 O ATOM 720 NE2 GLN A 91 -0.826 -0.733 -9.858 1.00 40.36 N ATOM 721 HE22 GLN A 91 -0.039 -1.090 -9.280 1.00 0.00 H ATOM 722 HE21 GLN A 91 -1.372 0.093 -9.540 1.00 0.00 H ATOM 723 H GLN A 91 1.259 -4.423 -12.542 1.00 0.00 H ATOM 724 N GLU A 92 -3.049 -5.423 -12.291 1.00 65.90 N ATOM 725 CA GLU A 92 -4.181 -5.890 -13.034 1.00 70.56 C ATOM 726 C GLU A 92 -4.484 -4.843 -14.087 1.00 61.79 C ATOM 727 O GLU A 92 -4.442 -5.152 -15.258 1.00 65.23 O ATOM 728 CB GLU A 92 -5.374 -6.177 -12.125 1.00 76.25 C ATOM 729 CG GLU A 92 -6.084 -7.479 -12.508 1.00 80.32 C ATOM 730 CD GLU A 92 -5.336 -8.741 -12.047 1.00 80.96 C ATOM 731 OE1 GLU A 92 -5.462 -9.101 -10.862 1.00 76.55 O ATOM 732 OE2 GLU A 92 -4.628 -9.384 -12.857 1.00 82.05 O ATOM 733 H GLU A 92 -3.167 -5.153 -11.294 1.00 0.00 H ATOM 734 N LYS A 93 -4.644 -3.592 -13.670 1.00 60.71 N ATOM 735 CA LYS A 93 -5.148 -2.555 -14.590 1.00 61.61 C ATOM 736 C LYS A 93 -4.149 -2.115 -15.699 1.00 54.87 C ATOM 737 O LYS A 93 -4.585 -1.859 -16.815 1.00 43.19 O ATOM 738 CB LYS A 93 -5.707 -1.346 -13.830 1.00 61.85 C ATOM 739 CG LYS A 93 -7.108 -0.933 -14.295 1.00 64.53 C ATOM 740 CD LYS A 93 -8.241 -1.560 -13.471 1.00 58.83 C ATOM 741 CE LYS A 93 -8.553 -0.797 -12.193 1.00 57.63 C ATOM 742 NZ LYS A 93 -7.577 -1.066 -11.075 1.00 49.78 N ATOM 743 HZ1 LYS A 93 -7.589 -2.080 -10.843 1.00 0.00 H ATOM 744 HZ2 LYS A 93 -6.621 -0.789 -11.377 1.00 0.00 H ATOM 745 HZ3 LYS A 93 -7.851 -0.514 -10.237 1.00 0.00 H ATOM 746 H LYS A 93 -4.412 -3.342 -12.688 1.00 0.00 H ATOM 747 N MET A 94 -2.845 -2.030 -15.379 1.00 53.93 N ATOM 748 CA MET A 94 -1.792 -1.596 -16.340 1.00 50.80 C ATOM 749 C MET A 94 -0.963 -2.703 -16.995 1.00 45.02 C ATOM 750 O MET A 94 -0.375 -2.461 -18.044 1.00 41.78 O ATOM 751 CB MET A 94 -0.822 -0.623 -15.673 1.00 53.24 C ATOM 752 CG MET A 94 -1.505 0.654 -15.198 1.00 55.98 C ATOM 753 SD MET A 94 -2.046 1.708 -16.581 1.00 55.85 S ATOM 754 CE MET A 94 -1.202 3.258 -16.204 1.00 58.55 C ATOM 755 H MET A 94 -2.557 -2.280 -14.411 1.00 0.00 H ATOM 756 N GLY A 95 -0.879 -3.897 -16.410 1.00 40.47 N ATOM 757 CA GLY A 95 -0.022 -4.910 -16.973 1.00 37.67 C ATOM 758 C GLY A 95 1.494 -4.571 -16.759 1.00 33.39 C ATOM 759 O GLY A 95 2.345 -5.120 -17.350 1.00 34.00 O ATOM 760 H GLY A 95 -1.429 -4.097 -15.551 1.00 0.00 H ATOM 761 N ARG A 96 1.753 -3.635 -15.866 1.00 30.16 N ATOM 762 CA ARG A 96 3.053 -3.003 -15.659 1.00 26.09 C ATOM 763 C ARG A 96 3.319 -3.095 -14.179 1.00 22.20 C ATOM 764 O ARG A 96 2.406 -3.166 -13.369 1.00 22.01 O ATOM 765 CB ARG A 96 3.181 -1.542 -16.092 1.00 26.32 C ATOM 766 CG ARG A 96 2.741 -1.247 -17.564 1.00 28.79 C ATOM 767 CD ARG A 96 3.577 -2.105 -18.449 1.00 29.49 C ATOM 768 NE ARG A 96 5.012 -1.655 -18.399 1.00 31.34 N ATOM 769 CZ ARG A 96 5.980 -2.199 -19.047 1.00 31.71 C ATOM 770 NH1 ARG A 96 7.177 -1.666 -19.048 1.00 28.94 N ATOM 771 NH2 ARG A 96 5.739 -3.318 -19.765 1.00 37.42 N ATOM 772 HE ARG A 96 5.238 -0.841 -17.793 1.00 0.00 H ATOM 773 HH12 ARG A 96 7.948 -2.120 -19.578 1.00 0.00 H ATOM 774 HH11 ARG A 96 7.356 -0.789 -18.519 1.00 0.00 H ATOM 775 HH22 ARG A 96 6.510 -3.772 -20.295 1.00 0.00 H ATOM 776 HH21 ARG A 96 4.782 -3.726 -19.787 1.00 0.00 H ATOM 777 H ARG A 96 0.968 -3.322 -15.260 1.00 0.00 H ATOM 778 N PRO A 97 4.644 -3.082 -13.833 1.00 20.12 N ATOM 779 CA PRO A 97 4.894 -3.063 -12.416 1.00 18.42 C ATOM 780 C PRO A 97 4.305 -1.866 -11.662 1.00 16.45 C ATOM 781 O PRO A 97 4.302 -0.774 -12.231 1.00 17.40 O ATOM 782 CB PRO A 97 6.442 -2.996 -12.339 1.00 20.18 C ATOM 783 CG PRO A 97 6.881 -3.600 -13.632 1.00 21.41 C ATOM 784 CD PRO A 97 5.883 -3.123 -14.603 1.00 21.73 C ATOM 785 N ALA A 98 3.870 -2.128 -10.430 1.00 17.32 N ATOM 786 CA ALA A 98 3.186 -1.068 -9.642 1.00 17.76 C ATOM 787 C ALA A 98 4.066 0.176 -9.542 1.00 17.61 C ATOM 788 O ALA A 98 3.512 1.301 -9.735 1.00 18.55 O ATOM 789 CB ALA A 98 2.796 -1.588 -8.324 1.00 18.61 C ATOM 790 H ALA A 98 4.009 -3.073 -10.020 1.00 0.00 H ATOM 791 N VAL A 99 5.331 0.008 -9.299 1.00 16.43 N ATOM 792 CA VAL A 99 6.236 1.208 -9.181 1.00 17.17 C ATOM 793 C VAL A 99 6.216 1.968 -10.432 1.00 16.44 C ATOM 794 O VAL A 99 6.358 3.235 -10.411 1.00 16.90 O ATOM 795 CB VAL A 99 7.620 0.803 -8.733 1.00 16.40 C ATOM 796 CG1 VAL A 99 8.279 -0.209 -9.700 1.00 19.37 C ATOM 797 CG2 VAL A 99 8.488 2.025 -8.520 1.00 17.95 C ATOM 798 H VAL A 99 5.718 -0.951 -9.186 1.00 0.00 H ATOM 799 N GLU A 100 6.265 1.328 -11.590 1.00 17.05 N ATOM 800 CA GLU A 100 6.141 2.021 -12.873 1.00 18.30 C ATOM 801 C GLU A 100 4.873 2.849 -13.019 1.00 19.64 C ATOM 802 O GLU A 100 4.913 3.986 -13.435 1.00 19.06 O ATOM 803 CB GLU A 100 6.406 1.117 -14.098 1.00 18.16 C ATOM 804 CG GLU A 100 6.501 1.845 -15.374 1.00 19.42 C ATOM 805 CD GLU A 100 6.565 0.914 -16.548 1.00 21.12 C ATOM 806 OE1 GLU A 100 5.584 0.942 -17.380 1.00 28.17 O ATOM 807 OE2 GLU A 100 7.486 0.167 -16.746 1.00 21.32 O ATOM 808 H GLU A 100 6.396 0.296 -11.588 1.00 0.00 H ATOM 809 N VAL A 101 3.744 2.263 -12.630 1.00 17.76 N ATOM 810 CA VAL A 101 2.494 2.953 -12.685 1.00 18.79 C ATOM 811 C VAL A 101 2.473 4.231 -11.846 1.00 18.49 C ATOM 812 O VAL A 101 2.076 5.288 -12.376 1.00 19.77 O ATOM 813 CB VAL A 101 1.296 2.001 -12.322 1.00 18.34 C ATOM 814 CG1 VAL A 101 -0.019 2.756 -12.309 1.00 19.57 C ATOM 815 CG2 VAL A 101 1.284 0.814 -13.240 1.00 18.93 C ATOM 816 H VAL A 101 3.772 1.284 -12.279 1.00 0.00 H ATOM 817 N ILE A 102 2.972 4.126 -10.593 1.00 19.94 N ATOM 818 CA ILE A 102 3.031 5.251 -9.706 1.00 19.29 C ATOM 819 C ILE A 102 4.013 6.340 -10.231 1.00 21.55 C ATOM 820 O ILE A 102 3.651 7.526 -10.303 1.00 19.81 O ATOM 821 CB ILE A 102 3.433 4.795 -8.374 1.00 22.05 C ATOM 822 CG1 ILE A 102 2.284 4.037 -7.718 1.00 22.23 C ATOM 823 CG2 ILE A 102 3.956 5.950 -7.508 1.00 24.85 C ATOM 824 CD1 ILE A 102 2.836 3.117 -6.608 1.00 25.42 C ATOM 825 H ILE A 102 3.323 3.204 -10.264 1.00 0.00 H ATOM 826 N LEU A 103 5.144 5.930 -10.758 1.00 18.90 N ATOM 827 CA LEU A 103 6.117 6.939 -11.207 1.00 18.73 C ATOM 828 C LEU A 103 5.742 7.545 -12.558 1.00 18.88 C ATOM 829 O LEU A 103 6.037 8.742 -12.795 1.00 20.43 O ATOM 830 CB LEU A 103 7.551 6.375 -11.195 1.00 18.21 C ATOM 831 CG LEU A 103 8.022 6.182 -9.738 1.00 18.47 C ATOM 832 CD1 LEU A 103 9.434 5.789 -9.789 1.00 18.05 C ATOM 833 CD2 LEU A 103 7.763 7.390 -8.747 1.00 19.51 C ATOM 834 H LEU A 103 5.348 4.915 -10.856 1.00 0.00 H ATOM 835 N THR A 104 5.075 6.813 -13.448 1.00 18.54 N ATOM 836 CA THR A 104 4.621 7.415 -14.709 1.00 19.26 C ATOM 837 C THR A 104 3.432 8.332 -14.474 1.00 20.73 C ATOM 838 O THR A 104 3.131 9.134 -15.387 1.00 24.16 O ATOM 839 CB THR A 104 4.435 6.420 -15.889 1.00 19.93 C ATOM 840 OG1 THR A 104 3.534 5.438 -15.518 1.00 20.64 O ATOM 841 CG2 THR A 104 5.786 5.678 -16.153 1.00 21.51 C ATOM 842 HG1 THR A 104 3.881 4.955 -14.727 1.00 0.00 H ATOM 843 H THR A 104 4.875 5.812 -13.250 1.00 0.00 H ATOM 844 N SER A 128 2.759 8.305 -13.338 1.00 19.27 N ATOM 845 CA SER A 128 1.685 9.179 -12.971 1.00 19.73 C ATOM 846 C SER A 128 2.146 10.374 -12.120 1.00 19.47 C ATOM 847 O SER A 128 1.344 11.135 -11.603 1.00 22.39 O ATOM 848 CB SER A 128 0.434 8.455 -12.448 1.00 21.25 C ATOM 849 OG SER A 128 0.682 8.026 -11.121 1.00 19.63 O ATOM 850 HG SER A 128 0.879 8.812 -10.553 1.00 0.00 H ATOM 851 H SER A 128 3.035 7.581 -12.644 1.00 0.00 H ATOM 852 N SER A 129 3.469 10.493 -11.913 1.00 19.06 N ATOM 853 CA SER A 129 4.040 11.469 -11.028 1.00 17.80 C ATOM 854 C SER A 129 4.407 12.804 -11.680 1.00 19.00 C ATOM 855 O SER A 129 5.151 12.890 -12.665 1.00 18.69 O ATOM 856 CB SER A 129 5.396 10.910 -10.502 1.00 20.96 C ATOM 857 OG SER A 129 6.223 11.876 -9.861 1.00 22.94 O ATOM 858 HG SER A 129 5.744 12.253 -9.081 1.00 0.00 H ATOM 859 H SER A 129 4.109 9.847 -12.418 1.00 0.00 H ATOM 860 N VAL A 130 3.930 13.875 -11.073 1.00 17.89 N ATOM 861 CA VAL A 130 4.274 15.266 -11.545 1.00 17.58 C ATOM 862 C VAL A 130 5.787 15.506 -11.487 1.00 17.10 C ATOM 863 O VAL A 130 6.366 16.042 -12.382 1.00 18.36 O ATOM 864 CB VAL A 130 3.483 16.278 -10.770 1.00 19.85 C ATOM 865 CG1 VAL A 130 3.921 17.708 -10.966 1.00 21.99 C ATOM 866 CG2 VAL A 130 2.003 16.240 -11.221 1.00 21.66 C ATOM 867 H VAL A 130 3.303 13.757 -10.251 1.00 0.00 H ATOM 868 N VAL A 131 6.454 15.006 -10.458 1.00 16.21 N ATOM 869 CA VAL A 131 7.876 15.303 -10.283 1.00 15.86 C ATOM 870 C VAL A 131 8.586 14.615 -11.424 1.00 15.69 C ATOM 871 O VAL A 131 9.482 15.145 -12.024 1.00 17.45 O ATOM 872 CB VAL A 131 8.421 14.759 -8.964 1.00 16.80 C ATOM 873 CG1 VAL A 131 9.917 14.838 -8.882 1.00 18.39 C ATOM 874 CG2 VAL A 131 7.754 15.560 -7.854 1.00 18.99 C ATOM 875 H VAL A 131 5.964 14.399 -9.770 1.00 0.00 H ATOM 876 N ASN A 132 8.207 13.375 -11.773 1.00 15.34 N ATOM 877 CA ASN A 132 8.836 12.636 -12.856 1.00 14.21 C ATOM 878 C ASN A 132 8.628 13.339 -14.138 1.00 14.51 C ATOM 879 O ASN A 132 9.545 13.557 -14.933 1.00 14.99 O ATOM 880 CB ASN A 132 8.349 11.185 -12.846 1.00 16.89 C ATOM 881 CG ASN A 132 9.202 10.266 -13.631 1.00 17.49 C ATOM 882 OD1 ASN A 132 10.317 10.540 -14.038 1.00 17.96 O ATOM 883 ND2 ASN A 132 8.657 9.129 -13.899 1.00 17.85 N ATOM 884 HD22 ASN A 132 7.704 8.912 -13.543 1.00 0.00 H ATOM 885 HD21 ASN A 132 9.170 8.428 -14.471 1.00 0.00 H ATOM 886 H ASN A 132 7.431 12.924 -11.247 1.00 0.00 H ATOM 887 N ALA A 133 7.394 13.801 -14.435 1.00 15.21 N ATOM 888 CA ALA A 133 7.134 14.546 -15.735 1.00 15.61 C ATOM 889 C ALA A 133 7.975 15.800 -15.894 1.00 15.87 C ATOM 890 O ALA A 133 8.362 16.176 -16.979 1.00 17.68 O ATOM 891 CB ALA A 133 5.644 14.996 -15.734 1.00 16.93 C ATOM 892 H ALA A 133 6.612 13.645 -13.767 1.00 0.00 H ATOM 893 N LEU A 134 8.272 16.400 -14.757 1.00 14.00 N ATOM 894 CA LEU A 134 8.995 17.688 -14.691 1.00 15.27 C ATOM 895 C LEU A 134 10.505 17.480 -14.437 1.00 15.77 C ATOM 896 O LEU A 134 11.165 18.536 -14.184 1.00 16.39 O ATOM 897 CB LEU A 134 8.386 18.676 -13.736 1.00 15.89 C ATOM 898 CG LEU A 134 6.844 18.960 -13.999 1.00 17.34 C ATOM 899 CD1 LEU A 134 6.306 19.914 -13.005 1.00 17.85 C ATOM 900 CD2 LEU A 134 6.649 19.470 -15.417 1.00 18.39 C ATOM 901 H LEU A 134 7.984 15.946 -13.867 1.00 0.00 H ATOM 902 N SER A 135 10.962 16.278 -14.495 1.00 14.57 N ATOM 903 CA SER A 135 12.386 15.962 -14.372 1.00 14.32 C ATOM 904 C SER A 135 12.994 15.583 -15.670 1.00 14.19 C ATOM 905 O SER A 135 12.436 14.731 -16.401 1.00 16.88 O ATOM 906 CB SER A 135 12.614 14.892 -13.348 1.00 15.00 C ATOM 907 OG SER A 135 12.252 15.314 -12.044 1.00 15.81 O ATOM 908 HG SER A 135 11.292 15.554 -12.031 1.00 0.00 H ATOM 909 H SER A 135 10.290 15.497 -14.635 1.00 0.00 H ATOM 910 N GLN A 136 14.160 16.155 -16.032 1.00 15.47 N ATOM 911 CA GLN A 136 14.863 15.621 -17.192 1.00 17.21 C ATOM 912 C GLN A 136 15.271 14.218 -17.096 1.00 17.85 C ATOM 913 O GLN A 136 15.300 13.510 -18.048 1.00 18.28 O ATOM 914 CB GLN A 136 16.040 16.460 -17.645 1.00 24.52 C ATOM 915 CG GLN A 136 17.114 16.629 -16.623 1.00 26.28 C ATOM 916 CD GLN A 136 18.548 17.010 -17.204 1.00 33.76 C ATOM 917 OE1 GLN A 136 18.742 18.124 -17.390 1.00 27.58 O ATOM 918 NE2 GLN A 136 19.551 16.081 -17.198 1.00 35.80 N ATOM 919 HE22 GLN A 136 19.331 15.079 -17.025 1.00 0.00 H ATOM 920 HE21 GLN A 136 20.534 16.376 -17.367 1.00 0.00 H ATOM 921 H GLN A 136 14.548 16.958 -15.497 1.00 0.00 H ATOM 922 N ASP A 137 15.622 13.807 -15.879 1.00 15.94 N ATOM 923 CA ASP A 137 15.933 12.456 -15.576 1.00 16.16 C ATOM 924 C ASP A 137 15.455 12.127 -14.130 1.00 14.97 C ATOM 925 O ASP A 137 15.588 13.004 -13.270 1.00 15.71 O ATOM 926 CB ASP A 137 17.443 12.252 -15.590 1.00 18.74 C ATOM 927 CG ASP A 137 18.066 12.335 -16.985 1.00 21.02 C ATOM 928 OD1 ASP A 137 18.051 11.288 -17.662 1.00 21.43 O ATOM 929 OD2 ASP A 137 18.698 13.403 -17.248 1.00 23.75 O ATOM 930 H ASP A 137 15.671 14.510 -15.114 1.00 0.00 H ATOM 931 N LEU A 138 15.032 10.883 -13.949 1.00 14.66 N ATOM 932 CA LEU A 138 14.676 10.373 -12.635 1.00 14.94 C ATOM 933 C LEU A 138 15.014 8.954 -12.561 1.00 16.18 C ATOM 934 O LEU A 138 14.853 8.196 -13.574 1.00 15.90 O ATOM 935 CB LEU A 138 13.195 10.645 -12.398 1.00 14.84 C ATOM 936 CG LEU A 138 12.708 10.249 -10.956 1.00 16.15 C ATOM 937 CD1 LEU A 138 11.567 11.184 -10.581 1.00 15.10 C ATOM 938 CD2 LEU A 138 12.242 8.824 -10.936 1.00 16.68 C ATOM 939 H LEU A 138 14.953 10.253 -14.773 1.00 0.00 H ATOM 940 N GLU A 139 15.569 8.505 -11.415 1.00 15.84 N ATOM 941 CA GLU A 139 15.858 7.112 -11.193 1.00 17.01 C ATOM 942 C GLU A 139 15.130 6.652 -9.914 1.00 16.97 C ATOM 943 O GLU A 139 15.085 7.400 -8.930 1.00 15.53 O ATOM 944 CB GLU A 139 17.384 6.970 -10.921 1.00 18.88 C ATOM 945 CG GLU A 139 18.171 7.275 -12.121 1.00 22.21 C ATOM 946 CD GLU A 139 19.673 7.398 -11.838 1.00 25.92 C ATOM 947 OE1 GLU A 139 20.350 7.561 -12.920 1.00 31.59 O ATOM 948 OE2 GLU A 139 20.192 7.317 -10.635 1.00 24.59 O ATOM 949 H GLU A 139 15.796 9.190 -10.666 1.00 0.00 H ATOM 950 N VAL A 140 14.665 5.382 -9.871 1.00 14.62 N ATOM 951 CA VAL A 140 14.122 4.776 -8.691 1.00 15.07 C ATOM 952 C VAL A 140 14.894 3.519 -8.369 1.00 14.61 C ATOM 953 O VAL A 140 15.289 2.813 -9.322 1.00 16.14 O ATOM 954 CB VAL A 140 12.638 4.513 -8.721 1.00 14.89 C ATOM 955 CG1 VAL A 140 12.307 3.475 -9.799 1.00 14.66 C ATOM 956 CG2 VAL A 140 12.003 4.070 -7.401 1.00 15.84 C ATOM 957 H VAL A 140 14.704 4.815 -10.742 1.00 0.00 H ATOM 958 N TYR A 141 15.231 3.302 -7.081 1.00 14.87 N ATOM 959 CA TYR A 141 15.732 2.001 -6.638 1.00 15.15 C ATOM 960 C TYR A 141 14.800 1.569 -5.548 1.00 17.63 C ATOM 961 O TYR A 141 14.560 2.328 -4.560 1.00 17.64 O ATOM 962 CB TYR A 141 17.117 2.073 -6.118 1.00 16.06 C ATOM 963 CG TYR A 141 18.160 2.475 -7.126 1.00 18.82 C ATOM 964 CD1 TYR A 141 18.450 3.786 -7.389 1.00 20.19 C ATOM 965 CD2 TYR A 141 18.893 1.454 -7.695 1.00 20.50 C ATOM 966 CE1 TYR A 141 19.418 4.118 -8.354 1.00 21.91 C ATOM 967 CE2 TYR A 141 19.876 1.760 -8.580 1.00 21.51 C ATOM 968 CZ TYR A 141 20.079 3.051 -8.920 1.00 23.43 C ATOM 969 OH TYR A 141 21.147 3.298 -9.725 1.00 31.98 O ATOM 970 HH TYR A 141 21.202 4.269 -9.910 1.00 0.00 H ATOM 971 H TYR A 141 15.133 4.074 -6.391 1.00 0.00 H ATOM 972 N VAL A 142 14.221 0.361 -5.667 1.00 14.76 N ATOM 973 CA VAL A 142 13.362 -0.199 -4.596 1.00 15.29 C ATOM 974 C VAL A 142 14.088 -1.347 -3.915 1.00 14.49 C ATOM 975 O VAL A 142 14.578 -2.251 -4.683 1.00 16.04 O ATOM 976 CB VAL A 142 12.027 -0.697 -5.169 1.00 15.77 C ATOM 977 CG1 VAL A 142 11.210 -1.359 -4.089 1.00 16.18 C ATOM 978 CG2 VAL A 142 11.229 0.494 -5.717 1.00 16.94 C ATOM 979 H VAL A 142 14.380 -0.194 -6.532 1.00 0.00 H ATOM 980 N HIS A 143 14.193 -1.375 -2.599 1.00 14.56 N ATOM 981 CA HIS A 143 14.703 -2.480 -1.868 1.00 15.23 C ATOM 982 C HIS A 143 13.468 -3.233 -1.251 1.00 15.94 C ATOM 983 O HIS A 143 12.759 -2.672 -0.449 1.00 15.99 O ATOM 984 CB HIS A 143 15.582 -1.991 -0.740 1.00 15.56 C ATOM 985 CG HIS A 143 16.900 -1.412 -1.187 1.00 16.75 C ATOM 986 ND1 HIS A 143 18.098 -1.954 -0.793 1.00 18.62 N ATOM 987 CD2 HIS A 143 17.205 -0.419 -2.039 1.00 17.11 C ATOM 988 CE1 HIS A 143 19.087 -1.264 -1.325 1.00 18.20 C ATOM 989 NE2 HIS A 143 18.589 -0.313 -2.049 1.00 18.00 N ATOM 990 H HIS A 143 13.884 -0.537 -2.066 1.00 0.00 H ATOM 991 N ARG A 144 13.147 -4.420 -1.780 1.00 16.81 N ATOM 992 CA ARG A 144 11.960 -5.117 -1.344 1.00 17.51 C ATOM 993 C ARG A 144 12.145 -6.610 -1.725 1.00 19.20 C ATOM 994 O ARG A 144 12.822 -6.899 -2.726 1.00 18.06 O ATOM 995 CB ARG A 144 10.774 -4.508 -2.061 1.00 20.33 C ATOM 996 CG ARG A 144 9.423 -4.992 -1.700 1.00 21.68 C ATOM 997 CD ARG A 144 8.397 -4.187 -2.405 1.00 21.59 C ATOM 998 NE ARG A 144 7.087 -4.791 -2.212 1.00 23.69 N ATOM 999 CZ ARG A 144 6.142 -4.415 -1.402 1.00 24.72 C ATOM 1000 NH1 ARG A 144 6.310 -3.380 -0.585 1.00 24.01 N ATOM 1001 NH2 ARG A 144 4.983 -5.101 -1.313 1.00 26.21 N ATOM 1002 HE ARG A 144 6.881 -5.628 -2.795 1.00 0.00 H ATOM 1003 HH12 ARG A 144 5.543 -3.094 0.056 1.00 0.00 H ATOM 1004 HH11 ARG A 144 7.209 -2.857 -0.587 1.00 0.00 H ATOM 1005 HH22 ARG A 144 4.240 -4.783 -0.659 1.00 0.00 H ATOM 1006 HH21 ARG A 144 4.833 -5.947 -1.899 1.00 0.00 H ATOM 1007 H ARG A 144 13.756 -4.843 -2.509 1.00 0.00 H ATOM 1008 N ASN A 145 11.564 -7.498 -0.947 1.00 20.09 N ATOM 1009 CA ASN A 145 11.679 -8.918 -1.293 1.00 20.23 C ATOM 1010 C ASN A 145 13.171 -9.367 -1.467 1.00 19.43 C ATOM 1011 O ASN A 145 13.483 -10.225 -2.327 1.00 20.72 O ATOM 1012 CB ASN A 145 10.967 -9.219 -2.656 1.00 21.91 C ATOM 1013 CG ASN A 145 9.619 -8.655 -2.832 1.00 24.37 C ATOM 1014 OD1 ASN A 145 8.800 -8.825 -1.961 1.00 24.64 O ATOM 1015 ND2 ASN A 145 9.311 -8.126 -4.024 1.00 23.80 N ATOM 1016 HD22 ASN A 145 10.051 -7.999 -4.743 1.00 0.00 H ATOM 1017 HD21 ASN A 145 8.332 -7.843 -4.230 1.00 0.00 H ATOM 1018 H ASN A 145 11.034 -7.199 -0.104 1.00 0.00 H ATOM 1019 N GLU A 146 14.094 -8.790 -0.649 1.00 18.50 N ATOM 1020 CA GLU A 146 15.528 -9.106 -0.635 1.00 19.56 C ATOM 1021 C GLU A 146 16.201 -8.811 -1.958 1.00 18.50 C ATOM 1022 O GLU A 146 17.271 -9.288 -2.220 1.00 18.10 O ATOM 1023 CB GLU A 146 15.769 -10.565 -0.180 1.00 22.32 C ATOM 1024 CG GLU A 146 15.371 -10.738 1.267 1.00 25.95 C ATOM 1025 CD GLU A 146 13.883 -10.828 1.504 1.00 31.75 C ATOM 1026 OE1 GLU A 146 13.212 -11.642 0.840 1.00 35.49 O ATOM 1027 OE2 GLU A 146 13.419 -10.134 2.500 1.00 40.63 O ATOM 1028 H GLU A 146 13.757 -8.068 0.019 1.00 0.00 H ATOM 1029 N THR A 147 15.598 -7.954 -2.781 1.00 16.04 N ATOM 1030 CA THR A 147 15.969 -7.657 -4.065 1.00 16.37 C ATOM 1031 C THR A 147 16.044 -6.092 -4.294 1.00 16.09 C ATOM 1032 O THR A 147 15.293 -5.375 -3.661 1.00 16.83 O ATOM 1033 CB THR A 147 15.050 -8.242 -5.089 1.00 16.64 C ATOM 1034 OG1 THR A 147 14.948 -9.674 -4.890 1.00 20.15 O ATOM 1035 CG2 THR A 147 15.441 -8.020 -6.578 1.00 17.63 C ATOM 1036 HG1 THR A 147 14.591 -9.856 -3.985 1.00 0.00 H ATOM 1037 H THR A 147 14.761 -7.461 -2.411 1.00 0.00 H ATOM 1038 N ILE A 148 16.985 -5.631 -5.108 1.00 15.42 N ATOM 1039 CA ILE A 148 17.037 -4.235 -5.460 1.00 15.86 C ATOM 1040 C ILE A 148 16.514 -4.162 -6.876 1.00 16.89 C ATOM 1041 O ILE A 148 17.076 -4.817 -7.788 1.00 15.97 O ATOM 1042 CB ILE A 148 18.487 -3.708 -5.417 1.00 16.65 C ATOM 1043 CG1 ILE A 148 19.053 -3.891 -4.019 1.00 17.62 C ATOM 1044 CG2 ILE A 148 18.515 -2.263 -5.880 1.00 16.20 C ATOM 1045 CD1 ILE A 148 20.530 -3.456 -3.841 1.00 18.02 C ATOM 1046 H ILE A 148 17.694 -6.285 -5.497 1.00 0.00 H ATOM 1047 N TYR A 149 15.494 -3.304 -7.118 1.00 15.13 N ATOM 1048 CA TYR A 149 14.913 -3.107 -8.442 1.00 15.31 C ATOM 1049 C TYR A 149 15.201 -1.708 -8.892 1.00 17.57 C ATOM 1050 O TYR A 149 15.286 -0.790 -8.050 1.00 17.83 O ATOM 1051 CB TYR A 149 13.396 -3.293 -8.406 1.00 16.41 C ATOM 1052 CG TYR A 149 12.878 -4.599 -7.808 1.00 16.76 C ATOM 1053 CD1 TYR A 149 12.751 -4.783 -6.480 1.00 18.05 C ATOM 1054 CD2 TYR A 149 12.606 -5.655 -8.636 1.00 17.41 C ATOM 1055 CE1 TYR A 149 12.355 -5.964 -5.938 1.00 19.67 C ATOM 1056 CE2 TYR A 149 12.126 -6.841 -8.094 1.00 17.21 C ATOM 1057 CZ TYR A 149 11.963 -6.989 -6.775 1.00 18.74 C ATOM 1058 OH TYR A 149 11.535 -8.212 -6.278 1.00 21.62 O ATOM 1059 HH TYR A 149 12.187 -8.914 -6.526 1.00 0.00 H ATOM 1060 H TYR A 149 15.106 -2.759 -6.321 1.00 0.00 H ATOM 1061 N HIS A 150 15.457 -1.481 -10.155 1.00 15.34 N ATOM 1062 CA HIS A 150 15.799 -0.168 -10.693 1.00 15.33 C ATOM 1063 C HIS A 150 15.068 0.162 -11.968 1.00 15.88 C ATOM 1064 O HIS A 150 14.881 -0.728 -12.839 1.00 16.36 O ATOM 1065 CB HIS A 150 17.268 -0.150 -10.943 1.00 17.93 C ATOM 1066 CG HIS A 150 17.802 1.053 -11.590 1.00 18.00 C ATOM 1067 ND1 HIS A 150 17.654 2.333 -11.080 1.00 20.40 N ATOM 1068 CD2 HIS A 150 18.478 1.196 -12.760 1.00 19.70 C ATOM 1069 CE1 HIS A 150 18.268 3.204 -11.870 1.00 22.73 C ATOM 1070 NE2 HIS A 150 18.744 2.556 -12.915 1.00 21.56 N ATOM 1071 H HIS A 150 15.414 -2.284 -10.815 1.00 0.00 H ATOM 1072 N GLN A 151 14.614 1.382 -12.100 1.00 16.41 N ATOM 1073 CA GLN A 151 14.099 1.956 -13.330 1.00 15.31 C ATOM 1074 C GLN A 151 14.514 3.366 -13.480 1.00 16.73 C ATOM 1075 O GLN A 151 14.627 4.053 -12.464 1.00 17.05 O ATOM 1076 CB GLN A 151 12.574 1.839 -13.428 1.00 15.66 C ATOM 1077 CG GLN A 151 11.937 2.056 -14.816 1.00 16.99 C ATOM 1078 CD GLN A 151 10.507 1.640 -14.913 1.00 17.80 C ATOM 1079 OE1 GLN A 151 9.690 1.835 -14.020 1.00 18.45 O ATOM 1080 NE2 GLN A 151 10.189 0.963 -16.059 1.00 18.13 N ATOM 1081 HE22 GLN A 151 10.910 0.818 -16.794 1.00 0.00 H ATOM 1082 HE21 GLN A 151 9.226 0.594 -16.195 1.00 0.00 H ATOM 1083 H GLN A 151 14.623 1.989 -11.256 1.00 0.00 H ATOM 1084 N ALA A 152 14.699 3.794 -14.693 1.00 14.94 N ATOM 1085 CA ALA A 152 15.064 5.220 -14.994 1.00 14.50 C ATOM 1086 C ALA A 152 14.115 5.751 -16.030 1.00 15.31 C ATOM 1087 O ALA A 152 13.491 5.000 -16.811 1.00 16.31 O ATOM 1088 CB ALA A 152 16.472 5.473 -15.425 1.00 16.33 C ATOM 1089 H ALA A 152 14.591 3.126 -15.483 1.00 0.00 H ATOM 1090 N TYR A 153 13.953 7.055 -15.999 1.00 14.91 N ATOM 1091 CA TYR A 153 12.902 7.760 -16.762 1.00 16.01 C ATOM 1092 C TYR A 153 13.574 9.073 -17.255 1.00 16.68 C ATOM 1093 O TYR A 153 14.501 9.681 -16.672 1.00 16.27 O ATOM 1094 CB TYR A 153 11.673 8.103 -15.950 1.00 15.62 C ATOM 1095 CG TYR A 153 11.147 7.033 -15.085 1.00 15.20 C ATOM 1096 CD1 TYR A 153 10.067 6.214 -15.464 1.00 16.40 C ATOM 1097 CD2 TYR A 153 11.755 6.753 -13.859 1.00 16.98 C ATOM 1098 CE1 TYR A 153 9.649 5.213 -14.637 1.00 17.58 C ATOM 1099 CE2 TYR A 153 11.316 5.787 -13.008 1.00 17.46 C ATOM 1100 CZ TYR A 153 10.326 4.949 -13.407 1.00 17.13 C ATOM 1101 OH TYR A 153 9.884 3.914 -12.574 1.00 17.57 O ATOM 1102 HH TYR A 153 9.163 3.411 -13.029 1.00 0.00 H ATOM 1103 H TYR A 153 14.597 7.619 -15.408 1.00 0.00 H ATOM 1104 N LYS A 154 13.012 9.649 -18.354 1.00 16.77 N ATOM 1105 CA LYS A 154 13.337 11.029 -18.804 1.00 17.93 C ATOM 1106 C LYS A 154 12.004 11.686 -19.156 1.00 18.39 C ATOM 1107 O LYS A 154 11.233 11.175 -20.017 1.00 20.61 O ATOM 1108 CB LYS A 154 14.276 11.021 -20.032 1.00 18.55 C ATOM 1109 CG LYS A 154 15.619 10.449 -19.883 1.00 19.41 C ATOM 1110 CD LYS A 154 16.463 10.479 -21.150 1.00 22.61 C ATOM 1111 CE LYS A 154 17.768 9.847 -21.012 1.00 24.81 C ATOM 1112 NZ LYS A 154 18.715 10.702 -20.295 1.00 26.58 N ATOM 1113 HZ1 LYS A 154 18.838 11.594 -20.816 1.00 0.00 H ATOM 1114 HZ2 LYS A 154 18.347 10.903 -19.343 1.00 0.00 H ATOM 1115 HZ3 LYS A 154 19.631 10.215 -20.219 1.00 0.00 H ATOM 1116 H LYS A 154 12.323 9.098 -18.905 1.00 0.00 H ATOM 1117 N LYS A 155 11.689 12.783 -18.532 1.00 17.22 N ATOM 1118 CA LYS A 155 10.462 13.541 -18.714 1.00 20.20 C ATOM 1119 C LYS A 155 9.244 12.613 -18.462 1.00 20.45 C ATOM 1120 O LYS A 155 8.180 12.695 -19.111 1.00 21.13 O ATOM 1121 CB LYS A 155 10.421 14.208 -20.054 1.00 21.23 C ATOM 1122 CG LYS A 155 11.522 15.172 -20.295 1.00 22.48 C ATOM 1123 CD LYS A 155 11.537 15.823 -21.713 1.00 24.64 C ATOM 1124 CE LYS A 155 12.707 16.783 -21.893 1.00 27.85 C ATOM 1125 NZ LYS A 155 12.659 17.242 -23.305 1.00 32.22 N ATOM 1126 HZ1 LYS A 155 12.749 16.422 -23.938 1.00 0.00 H ATOM 1127 HZ2 LYS A 155 11.753 17.721 -23.482 1.00 0.00 H ATOM 1128 HZ3 LYS A 155 13.442 17.904 -23.480 1.00 0.00 H ATOM 1129 H LYS A 155 12.375 13.150 -17.842 1.00 0.00 H ATOM 1130 N GLY A 156 9.422 11.684 -17.541 1.00 18.80 N ATOM 1131 CA GLY A 156 8.385 10.720 -17.201 1.00 17.76 C ATOM 1132 C GLY A 156 8.338 9.388 -17.969 1.00 17.71 C ATOM 1133 O GLY A 156 7.604 8.471 -17.563 1.00 19.88 O ATOM 1134 H GLY A 156 10.333 11.639 -17.042 1.00 0.00 H ATOM 1135 N VAL A 157 9.103 9.350 -19.049 1.00 18.77 N ATOM 1136 CA VAL A 157 9.084 8.193 -19.984 1.00 18.43 C ATOM 1137 C VAL A 157 10.088 7.148 -19.472 1.00 17.29 C ATOM 1138 O VAL A 157 11.274 7.409 -19.426 1.00 17.66 O ATOM 1139 CB VAL A 157 9.437 8.581 -21.400 1.00 19.96 C ATOM 1140 CG1 VAL A 157 9.412 7.352 -22.361 1.00 20.67 C ATOM 1141 CG2 VAL A 157 8.424 9.607 -21.878 1.00 21.64 C ATOM 1142 H VAL A 157 9.735 10.151 -19.249 1.00 0.00 H ATOM 1143 N PRO A 158 9.702 5.929 -19.188 1.00 17.44 N ATOM 1144 CA PRO A 158 10.626 4.886 -18.739 1.00 18.03 C ATOM 1145 C PRO A 158 11.631 4.636 -19.833 1.00 19.54 C ATOM 1146 O PRO A 158 11.205 4.507 -21.048 1.00 19.87 O ATOM 1147 CB PRO A 158 9.719 3.667 -18.526 1.00 18.88 C ATOM 1148 CG PRO A 158 8.367 4.227 -18.449 1.00 19.73 C ATOM 1149 CD PRO A 158 8.300 5.456 -19.184 1.00 18.79 C ATOM 1150 N GLN A 159 12.900 4.502 -19.506 1.00 17.14 N ATOM 1151 CA GLN A 159 13.938 4.217 -20.442 1.00 18.54 C ATOM 1152 C GLN A 159 14.185 2.772 -20.697 1.00 19.50 C ATOM 1153 O GLN A 159 14.939 2.398 -21.640 1.00 21.27 O ATOM 1154 CB GLN A 159 15.248 4.899 -19.994 1.00 20.26 C ATOM 1155 CG GLN A 159 15.126 6.434 -19.827 1.00 19.99 C ATOM 1156 CD GLN A 159 14.827 7.141 -21.188 1.00 21.58 C ATOM 1157 OE1 GLN A 159 15.728 7.194 -22.061 1.00 22.05 O ATOM 1158 NE2 GLN A 159 13.609 7.589 -21.386 1.00 23.71 N ATOM 1159 HE22 GLN A 159 12.900 7.521 -20.628 1.00 0.00 H ATOM 1160 HE21 GLN A 159 13.353 8.012 -22.301 1.00 0.00 H ATOM 1161 H GLN A 159 13.161 4.611 -18.505 1.00 0.00 H ATOM 1162 N PHE A 160 13.690 1.920 -19.823 1.00 18.09 N ATOM 1163 CA PHE A 160 13.809 0.494 -19.861 1.00 18.83 C ATOM 1164 C PHE A 160 12.869 -0.118 -18.846 1.00 17.82 C ATOM 1165 O PHE A 160 12.354 0.600 -17.982 1.00 18.85 O ATOM 1166 CB PHE A 160 15.251 0.002 -19.604 1.00 19.75 C ATOM 1167 CG PHE A 160 15.973 0.639 -18.400 1.00 19.60 C ATOM 1168 CD1 PHE A 160 15.790 0.095 -17.136 1.00 20.95 C ATOM 1169 CD2 PHE A 160 16.829 1.732 -18.548 1.00 21.34 C ATOM 1170 CE1 PHE A 160 16.371 0.660 -16.008 1.00 21.11 C ATOM 1171 CE2 PHE A 160 17.420 2.325 -17.465 1.00 20.90 C ATOM 1172 CZ PHE A 160 17.192 1.741 -16.191 1.00 21.00 C ATOM 1173 H PHE A 160 13.159 2.324 -19.025 1.00 0.00 H ATOM 1174 N ASP A 161 12.541 -1.393 -18.964 1.00 18.19 N ATOM 1175 CA ASP A 161 11.703 -2.058 -18.047 1.00 19.83 C ATOM 1176 C ASP A 161 12.372 -2.147 -16.660 1.00 18.23 C ATOM 1177 O ASP A 161 13.591 -2.285 -16.549 1.00 19.19 O ATOM 1178 CB ASP A 161 11.293 -3.492 -18.472 1.00 21.44 C ATOM 1179 CG ASP A 161 10.444 -3.495 -19.735 1.00 25.31 C ATOM 1180 OD1 ASP A 161 9.683 -2.575 -20.015 1.00 24.86 O ATOM 1181 OD2 ASP A 161 10.573 -4.531 -20.373 1.00 31.68 O ATOM 1182 H ASP A 161 12.919 -1.930 -19.771 1.00 0.00 H ATOM 1183 N LEU A 162 11.566 -2.122 -15.594 1.00 16.77 N ATOM 1184 CA LEU A 162 12.064 -2.318 -14.251 1.00 16.95 C ATOM 1185 C LEU A 162 12.952 -3.594 -14.221 1.00 18.38 C ATOM 1186 O LEU A 162 12.611 -4.675 -14.757 1.00 18.40 O ATOM 1187 CB LEU A 162 10.920 -2.552 -13.319 1.00 17.51 C ATOM 1188 CG LEU A 162 11.265 -2.723 -11.876 1.00 17.93 C ATOM 1189 CD1 LEU A 162 11.695 -1.382 -11.323 1.00 18.20 C ATOM 1190 CD2 LEU A 162 10.060 -3.242 -11.130 1.00 18.69 C ATOM 1191 H LEU A 162 10.549 -1.956 -15.735 1.00 0.00 H ATOM 1192 N LYS A 163 14.116 -3.435 -13.605 1.00 17.40 N ATOM 1193 CA LYS A 163 15.050 -4.554 -13.564 1.00 19.20 C ATOM 1194 C LYS A 163 15.562 -4.853 -12.222 1.00 18.71 C ATOM 1195 O LYS A 163 15.856 -3.941 -11.414 1.00 19.57 O ATOM 1196 CB LYS A 163 16.105 -4.295 -14.470 1.00 25.48 C ATOM 1197 CG LYS A 163 16.952 -3.206 -14.428 1.00 32.58 C ATOM 1198 CD LYS A 163 17.903 -3.379 -15.685 1.00 39.65 C ATOM 1199 CE LYS A 163 19.021 -2.318 -15.724 1.00 46.24 C ATOM 1200 NZ LYS A 163 19.317 -1.753 -17.118 1.00 50.06 N ATOM 1201 HZ1 LYS A 163 19.612 -2.526 -17.748 1.00 0.00 H ATOM 1202 HZ2 LYS A 163 18.460 -1.302 -17.497 1.00 0.00 H ATOM 1203 HZ3 LYS A 163 20.079 -1.049 -17.051 1.00 0.00 H ATOM 1204 H LYS A 163 14.358 -2.527 -13.159 1.00 0.00 H ATOM 1205 N GLU A 164 15.819 -6.122 -12.003 1.00 16.85 N ATOM 1206 CA GLU A 164 16.537 -6.593 -10.829 1.00 17.82 C ATOM 1207 C GLU A 164 17.977 -6.385 -10.992 1.00 17.14 C ATOM 1208 O GLU A 164 18.578 -6.794 -12.017 1.00 18.38 O ATOM 1209 CB GLU A 164 16.269 -8.060 -10.558 1.00 18.79 C ATOM 1210 CG GLU A 164 14.804 -8.448 -10.197 1.00 21.85 C ATOM 1211 CD GLU A 164 14.666 -9.952 -9.971 1.00 28.68 C ATOM 1212 OE1 GLU A 164 15.615 -10.704 -10.163 1.00 33.45 O ATOM 1213 OE2 GLU A 164 13.594 -10.375 -9.528 1.00 34.77 O ATOM 1214 H GLU A 164 15.495 -6.822 -12.700 1.00 0.00 H ATOM 1215 N VAL A 165 18.569 -5.618 -10.045 1.00 15.92 N ATOM 1216 CA VAL A 165 19.967 -5.206 -10.184 1.00 16.33 C ATOM 1217 C VAL A 165 20.846 -5.756 -9.051 1.00 16.20 C ATOM 1218 O VAL A 165 22.126 -5.652 -9.173 1.00 19.69 O ATOM 1219 CB VAL A 165 20.208 -3.692 -10.391 1.00 16.24 C ATOM 1220 CG1 VAL A 165 19.591 -3.219 -11.696 1.00 18.42 C ATOM 1221 CG2 VAL A 165 19.659 -2.915 -9.180 1.00 17.47 C ATOM 1222 H VAL A 165 18.025 -5.319 -9.211 1.00 0.00 H ATOM 1223 N GLY A 166 20.317 -6.230 -7.958 1.00 16.18 N ATOM 1224 CA GLY A 166 21.125 -6.649 -6.861 1.00 15.75 C ATOM 1225 C GLY A 166 20.204 -7.240 -5.794 1.00 14.72 C ATOM 1226 O GLY A 166 19.016 -7.481 -5.987 1.00 16.86 O ATOM 1227 H GLY A 166 19.282 -6.304 -7.885 1.00 0.00 H ATOM 1228 N THR A 167 20.820 -7.534 -4.669 1.00 17.79 N ATOM 1229 CA THR A 167 20.142 -8.045 -3.482 1.00 17.43 C ATOM 1230 C THR A 167 20.350 -7.185 -2.281 1.00 17.09 C ATOM 1231 O THR A 167 21.291 -6.362 -2.197 1.00 17.95 O ATOM 1232 CB THR A 167 20.563 -9.501 -3.164 1.00 19.29 C ATOM 1233 OG1 THR A 167 21.972 -9.503 -2.852 1.00 20.51 O ATOM 1234 CG2 THR A 167 20.343 -10.402 -4.320 1.00 20.81 C ATOM 1235 HG1 THR A 167 22.262 -10.427 -2.645 1.00 0.00 H ATOM 1236 H THR A 167 21.850 -7.394 -4.623 1.00 0.00 H ATOM 1237 N THR A 168 19.509 -7.434 -1.279 1.00 17.50 N ATOM 1238 CA THR A 168 19.503 -6.570 -0.104 1.00 18.53 C ATOM 1239 C THR A 168 18.887 -7.236 1.088 1.00 18.26 C ATOM 1240 O THR A 168 18.138 -8.197 0.921 1.00 20.99 O ATOM 1241 CB THR A 168 18.735 -5.269 -0.457 1.00 17.66 C ATOM 1242 OG1 THR A 168 18.855 -4.340 0.641 1.00 19.58 O ATOM 1243 CG2 THR A 168 17.264 -5.499 -0.802 1.00 17.88 C ATOM 1244 HG1 THR A 168 19.811 -4.133 0.794 1.00 0.00 H ATOM 1245 H THR A 168 18.858 -8.243 -1.334 1.00 0.00 H ATOM 1246 N ASP A 169 19.247 -6.776 2.282 1.00 19.76 N ATOM 1247 CA ASP A 169 18.547 -7.214 3.433 1.00 20.55 C ATOM 1248 C ASP A 169 17.765 -6.073 4.080 1.00 23.32 C ATOM 1249 O ASP A 169 17.311 -6.205 5.166 1.00 26.46 O ATOM 1250 CB ASP A 169 19.565 -7.789 4.479 1.00 23.20 C ATOM 1251 CG ASP A 169 20.602 -6.830 4.878 1.00 26.63 C ATOM 1252 OD1 ASP A 169 20.703 -5.698 4.416 1.00 30.04 O ATOM 1253 OD2 ASP A 169 21.497 -7.181 5.715 1.00 30.69 O ATOM 1254 H ASP A 169 20.034 -6.102 2.370 1.00 0.00 H ATOM 1255 N LYS A 170 17.598 -4.986 3.362 1.00 21.75 N ATOM 1256 CA LYS A 170 16.809 -3.806 3.790 1.00 23.23 C ATOM 1257 C LYS A 170 15.613 -3.648 2.936 1.00 20.00 C ATOM 1258 O LYS A 170 15.527 -4.211 1.839 1.00 19.03 O ATOM 1259 CB LYS A 170 17.749 -2.606 3.676 1.00 26.62 C ATOM 1260 CG LYS A 170 19.068 -2.643 4.503 1.00 33.27 C ATOM 1261 CD LYS A 170 18.810 -2.058 5.864 1.00 39.27 C ATOM 1262 CE LYS A 170 19.888 -2.390 6.905 1.00 43.61 C ATOM 1263 NZ LYS A 170 19.922 -3.867 7.223 1.00 48.70 N ATOM 1264 HZ1 LYS A 170 18.999 -4.160 7.602 1.00 0.00 H ATOM 1265 HZ2 LYS A 170 20.128 -4.402 6.356 1.00 0.00 H ATOM 1266 HZ3 LYS A 170 20.663 -4.051 7.930 1.00 0.00 H ATOM 1267 H LYS A 170 18.051 -4.950 2.427 1.00 0.00 H ATOM 1268 N THR A 171 14.711 -2.753 3.405 1.00 19.61 N ATOM 1269 CA THR A 171 13.600 -2.341 2.585 1.00 18.51 C ATOM 1270 C THR A 171 13.529 -0.845 2.558 1.00 17.09 C ATOM 1271 O THR A 171 13.996 -0.193 3.516 1.00 19.19 O ATOM 1272 CB THR A 171 12.229 -2.861 2.982 1.00 21.14 C ATOM 1273 OG1 THR A 171 11.879 -2.442 4.301 1.00 24.49 O ATOM 1274 CG2 THR A 171 12.248 -4.404 2.908 1.00 22.04 C ATOM 1275 HG1 THR A 171 11.865 -1.453 4.339 1.00 0.00 H ATOM 1276 H THR A 171 14.821 -2.361 4.362 1.00 0.00 H ATOM 1277 N GLY A 172 13.057 -0.346 1.443 1.00 16.48 N ATOM 1278 CA GLY A 172 12.820 1.122 1.279 1.00 16.14 C ATOM 1279 C GLY A 172 12.890 1.543 -0.139 1.00 16.38 C ATOM 1280 O GLY A 172 12.963 0.700 -1.046 1.00 15.42 O ATOM 1281 H GLY A 172 12.842 -0.986 0.652 1.00 0.00 H ATOM 1282 N THR A 173 12.821 2.856 -0.374 1.00 15.09 N ATOM 1283 CA THR A 173 12.737 3.480 -1.700 1.00 15.77 C ATOM 1284 C THR A 173 13.780 4.549 -1.800 1.00 14.83 C ATOM 1285 O THR A 173 13.899 5.388 -0.847 1.00 14.91 O ATOM 1286 CB THR A 173 11.376 3.997 -2.012 1.00 15.57 C ATOM 1287 OG1 THR A 173 10.430 2.856 -1.816 1.00 16.77 O ATOM 1288 CG2 THR A 173 11.238 4.521 -3.404 1.00 16.62 C ATOM 1289 HG1 THR A 173 10.483 2.543 -0.878 1.00 0.00 H ATOM 1290 H THR A 173 12.827 3.489 0.451 1.00 0.00 H ATOM 1291 N VAL A 174 14.466 4.599 -2.941 1.00 15.22 N ATOM 1292 CA VAL A 174 15.324 5.730 -3.246 1.00 15.73 C ATOM 1293 C VAL A 174 14.828 6.339 -4.524 1.00 15.11 C ATOM 1294 O VAL A 174 14.625 5.627 -5.543 1.00 15.17 O ATOM 1295 CB VAL A 174 16.795 5.258 -3.507 1.00 15.42 C ATOM 1296 CG1 VAL A 174 17.706 6.443 -3.854 1.00 17.32 C ATOM 1297 CG2 VAL A 174 17.342 4.527 -2.375 1.00 17.23 C ATOM 1298 H VAL A 174 14.386 3.817 -3.622 1.00 0.00 H ATOM 1299 N ILE A 175 14.617 7.666 -4.563 1.00 14.79 N ATOM 1300 CA ILE A 175 14.270 8.441 -5.784 1.00 15.12 C ATOM 1301 C ILE A 175 15.390 9.474 -5.964 1.00 15.79 C ATOM 1302 O ILE A 175 15.585 10.261 -5.054 1.00 17.30 O ATOM 1303 CB ILE A 175 12.934 9.208 -5.725 1.00 16.99 C ATOM 1304 CG1 ILE A 175 11.775 8.302 -5.432 1.00 18.01 C ATOM 1305 CG2 ILE A 175 12.687 10.044 -6.966 1.00 17.93 C ATOM 1306 CD1 ILE A 175 11.369 7.382 -6.528 1.00 20.05 C ATOM 1307 H ILE A 175 14.703 8.192 -3.670 1.00 0.00 H ATOM 1308 N ARG A 176 15.997 9.552 -7.129 1.00 15.81 N ATOM 1309 CA ARG A 176 16.994 10.585 -7.476 1.00 16.88 C ATOM 1310 C ARG A 176 16.447 11.247 -8.732 1.00 15.02 C ATOM 1311 O ARG A 176 16.065 10.579 -9.694 1.00 16.20 O ATOM 1312 CB ARG A 176 18.371 9.931 -7.904 1.00 21.64 C ATOM 1313 CG ARG A 176 19.165 9.188 -6.922 1.00 27.97 C ATOM 1314 CD ARG A 176 20.481 8.864 -7.597 1.00 25.77 C ATOM 1315 NE ARG A 176 21.303 10.024 -7.855 1.00 23.60 N ATOM 1316 CZ ARG A 176 21.780 10.419 -9.006 1.00 21.67 C ATOM 1317 NH1 ARG A 176 22.591 11.408 -8.989 1.00 25.00 N ATOM 1318 NH2 ARG A 176 21.605 9.721 -10.154 1.00 23.84 N ATOM 1319 HE ARG A 176 21.542 10.612 -7.031 1.00 0.00 H ATOM 1320 HH12 ARG A 176 22.999 11.761 -9.878 1.00 0.00 H ATOM 1321 HH11 ARG A 176 22.842 11.859 -8.086 1.00 0.00 H ATOM 1322 HH22 ARG A 176 22.005 10.078 -11.045 1.00 0.00 H ATOM 1323 HH21 ARG A 176 21.071 8.829 -10.144 1.00 0.00 H ATOM 1324 H ARG A 176 15.760 8.842 -7.851 1.00 0.00 H ATOM 1325 N PHE A 177 16.391 12.588 -8.727 1.00 14.08 N ATOM 1326 CA PHE A 177 15.854 13.303 -9.918 1.00 14.75 C ATOM 1327 C PHE A 177 16.639 14.578 -10.153 1.00 16.11 C ATOM 1328 O PHE A 177 17.146 15.234 -9.242 1.00 14.57 O ATOM 1329 CB PHE A 177 14.381 13.564 -9.752 1.00 15.11 C ATOM 1330 CG PHE A 177 13.989 14.566 -8.749 1.00 15.61 C ATOM 1331 CD1 PHE A 177 13.881 15.947 -9.046 1.00 17.30 C ATOM 1332 CD2 PHE A 177 13.784 14.191 -7.448 1.00 16.92 C ATOM 1333 CE1 PHE A 177 13.517 16.850 -8.031 1.00 18.22 C ATOM 1334 CE2 PHE A 177 13.425 15.094 -6.472 1.00 18.01 C ATOM 1335 CZ PHE A 177 13.342 16.394 -6.803 1.00 17.45 C ATOM 1336 H PHE A 177 16.720 13.123 -7.898 1.00 0.00 H ATOM 1337 N LYS A 178 16.630 14.964 -11.423 1.00 14.83 N ATOM 1338 CA LYS A 178 17.220 16.207 -11.893 1.00 15.31 C ATOM 1339 C LYS A 178 16.065 17.062 -12.536 1.00 14.49 C ATOM 1340 O LYS A 178 15.543 16.613 -13.577 1.00 15.23 O ATOM 1341 CB LYS A 178 18.318 15.928 -12.946 1.00 17.23 C ATOM 1342 CG LYS A 178 19.057 17.232 -13.356 1.00 22.20 C ATOM 1343 CD LYS A 178 20.520 17.096 -13.669 1.00 30.09 C ATOM 1344 CE LYS A 178 21.027 18.391 -14.340 1.00 31.92 C ATOM 1345 NZ LYS A 178 20.895 19.573 -13.492 1.00 28.50 N ATOM 1346 HZ1 LYS A 178 19.893 19.716 -13.252 1.00 0.00 H ATOM 1347 HZ2 LYS A 178 21.445 19.436 -12.620 1.00 0.00 H ATOM 1348 HZ3 LYS A 178 21.253 20.406 -14.002 1.00 0.00 H ATOM 1349 H LYS A 178 16.175 14.342 -12.121 1.00 0.00 H ATOM 1350 N ALA A 179 15.726 18.177 -11.956 1.00 14.61 N ATOM 1351 CA ALA A 179 14.665 19.051 -12.444 1.00 15.58 C ATOM 1352 C ALA A 179 14.953 19.441 -13.845 1.00 17.15 C ATOM 1353 O ALA A 179 16.103 19.655 -14.244 1.00 17.09 O ATOM 1354 CB ALA A 179 14.553 20.212 -11.535 1.00 16.04 C ATOM 1355 H ALA A 179 16.240 18.460 -11.097 1.00 0.00 H ATOM 1356 N ASP A 180 13.898 19.467 -14.680 1.00 16.06 N ATOM 1357 CA ASP A 180 14.087 19.868 -16.142 1.00 16.82 C ATOM 1358 C ASP A 180 14.248 21.376 -16.312 1.00 17.55 C ATOM 1359 O ASP A 180 13.342 22.148 -15.983 1.00 17.06 O ATOM 1360 CB ASP A 180 12.879 19.369 -16.857 1.00 18.31 C ATOM 1361 CG ASP A 180 12.981 19.519 -18.389 1.00 19.75 C ATOM 1362 OD1 ASP A 180 13.982 20.106 -18.791 1.00 20.15 O ATOM 1363 OD2 ASP A 180 12.070 18.956 -19.035 1.00 21.59 O ATOM 1364 H ASP A 180 12.952 19.214 -14.329 1.00 0.00 H ATOM 1365 N GLY A 181 15.416 21.787 -16.740 1.00 18.23 N ATOM 1366 CA GLY A 181 15.656 23.204 -16.991 1.00 20.13 C ATOM 1367 C GLY A 181 14.815 23.814 -18.103 1.00 21.25 C ATOM 1368 O GLY A 181 14.648 25.029 -18.120 1.00 22.42 O ATOM 1369 H GLY A 181 16.178 21.098 -16.902 1.00 0.00 H ATOM 1370 N GLU A 182 14.223 22.966 -18.897 1.00 21.23 N ATOM 1371 CA GLU A 182 13.166 23.443 -19.924 1.00 23.50 C ATOM 1372 C GLU A 182 11.926 23.932 -19.243 1.00 22.32 C ATOM 1373 O GLU A 182 11.141 24.748 -19.839 1.00 25.06 O ATOM 1374 CB GLU A 182 12.813 22.400 -20.905 1.00 26.63 C ATOM 1375 CG GLU A 182 13.902 21.917 -21.837 1.00 33.88 C ATOM 1376 CD GLU A 182 13.271 20.845 -22.829 1.00 43.86 C ATOM 1377 OE1 GLU A 182 13.793 19.750 -22.978 1.00 43.78 O ATOM 1378 OE2 GLU A 182 12.142 21.082 -23.393 1.00 48.10 O ATOM 1379 H GLU A 182 14.464 21.956 -18.840 1.00 0.00 H ATOM 1380 N ILE A 183 11.595 23.409 -18.071 1.00 18.93 N ATOM 1381 CA ILE A 183 10.425 23.767 -17.254 1.00 18.89 C ATOM 1382 C ILE A 183 10.824 24.908 -16.260 1.00 18.78 C ATOM 1383 O ILE A 183 10.184 25.963 -16.157 1.00 20.20 O ATOM 1384 CB ILE A 183 9.899 22.546 -16.449 1.00 19.30 C ATOM 1385 CG1 ILE A 183 9.492 21.390 -17.368 1.00 20.18 C ATOM 1386 CG2 ILE A 183 8.734 22.926 -15.510 1.00 20.11 C ATOM 1387 CD1 ILE A 183 8.332 21.613 -18.283 1.00 22.13 C ATOM 1388 H ILE A 183 12.224 22.673 -17.692 1.00 0.00 H ATOM 1389 N PHE A 184 11.870 24.644 -15.481 1.00 18.43 N ATOM 1390 CA PHE A 184 12.334 25.539 -14.433 1.00 17.85 C ATOM 1391 C PHE A 184 13.320 26.521 -14.994 1.00 19.80 C ATOM 1392 O PHE A 184 14.509 26.333 -14.874 1.00 19.26 O ATOM 1393 CB PHE A 184 12.901 24.735 -13.309 1.00 17.52 C ATOM 1394 CG PHE A 184 11.859 23.825 -12.665 1.00 17.16 C ATOM 1395 CD1 PHE A 184 11.687 22.505 -13.065 1.00 17.63 C ATOM 1396 CD2 PHE A 184 10.926 24.402 -11.792 1.00 18.84 C ATOM 1397 CE1 PHE A 184 10.633 21.729 -12.537 1.00 17.96 C ATOM 1398 CE2 PHE A 184 9.817 23.614 -11.280 1.00 17.40 C ATOM 1399 CZ PHE A 184 9.767 22.295 -11.629 1.00 16.91 C ATOM 1400 H PHE A 184 12.382 23.751 -15.629 1.00 0.00 H ATOM 1401 N THR A 185 12.792 27.454 -15.785 1.00 20.51 N ATOM 1402 CA THR A 185 13.640 28.351 -16.616 1.00 21.53 C ATOM 1403 C THR A 185 14.319 29.407 -15.789 1.00 21.29 C ATOM 1404 O THR A 185 15.367 29.859 -16.289 1.00 23.64 O ATOM 1405 CB THR A 185 12.820 29.003 -17.753 1.00 22.71 C ATOM 1406 OG1 THR A 185 11.723 29.681 -17.133 1.00 25.85 O ATOM 1407 CG2 THR A 185 12.411 27.969 -18.673 1.00 25.76 C ATOM 1408 HG1 THR A 185 12.070 30.368 -16.510 1.00 0.00 H ATOM 1409 H THR A 185 11.758 27.558 -15.823 1.00 0.00 H ATOM 1410 N GLU A 186 13.861 29.780 -14.599 1.00 20.27 N ATOM 1411 CA GLU A 186 14.530 30.753 -13.748 1.00 20.15 C ATOM 1412 C GLU A 186 15.816 30.166 -13.100 1.00 19.51 C ATOM 1413 O GLU A 186 16.878 30.710 -13.188 1.00 19.29 O ATOM 1414 CB GLU A 186 13.681 31.377 -12.716 1.00 22.65 C ATOM 1415 CG GLU A 186 12.717 32.382 -13.428 1.00 27.35 C ATOM 1416 CD GLU A 186 13.500 33.512 -14.129 1.00 29.81 C ATOM 1417 OE1 GLU A 186 13.363 33.695 -15.385 1.00 32.79 O ATOM 1418 OE2 GLU A 186 14.251 34.205 -13.437 1.00 31.50 O ATOM 1419 H GLU A 186 12.976 29.354 -14.257 1.00 0.00 H ATOM 1420 N THR A 187 15.611 29.037 -12.451 1.00 18.30 N ATOM 1421 CA THR A 187 16.707 28.425 -11.706 1.00 17.95 C ATOM 1422 C THR A 187 16.443 26.954 -11.435 1.00 18.04 C ATOM 1423 O THR A 187 15.274 26.565 -11.211 1.00 17.64 O ATOM 1424 CB THR A 187 16.964 29.145 -10.377 1.00 18.82 C ATOM 1425 OG1 THR A 187 18.149 28.553 -9.767 1.00 18.98 O ATOM 1426 CG2 THR A 187 15.698 29.126 -9.435 1.00 21.76 C ATOM 1427 HG1 THR A 187 18.335 29.003 -8.905 1.00 0.00 H ATOM 1428 H THR A 187 14.674 28.585 -12.470 1.00 0.00 H ATOM 1429 N THR A 188 17.494 26.133 -11.477 1.00 17.43 N ATOM 1430 CA THR A 188 17.460 24.721 -11.036 1.00 17.82 C ATOM 1431 C THR A 188 18.358 24.489 -9.829 1.00 17.41 C ATOM 1432 O THR A 188 18.693 23.341 -9.536 1.00 18.80 O ATOM 1433 CB THR A 188 17.832 23.814 -12.237 1.00 19.63 C ATOM 1434 OG1 THR A 188 19.093 24.285 -12.722 1.00 23.61 O ATOM 1435 CG2 THR A 188 16.713 23.905 -13.276 1.00 22.36 C ATOM 1436 HG1 THR A 188 19.005 25.230 -13.004 1.00 0.00 H ATOM 1437 H THR A 188 18.392 26.509 -11.842 1.00 0.00 H ATOM 1438 N VAL A 189 18.787 25.578 -9.157 1.00 15.36 N ATOM 1439 CA VAL A 189 19.636 25.495 -8.007 1.00 16.10 C ATOM 1440 C VAL A 189 18.849 25.540 -6.718 1.00 15.76 C ATOM 1441 O VAL A 189 18.140 26.501 -6.451 1.00 17.55 O ATOM 1442 CB VAL A 189 20.729 26.638 -8.049 1.00 17.72 C ATOM 1443 CG1 VAL A 189 21.569 26.546 -6.763 1.00 17.11 C ATOM 1444 CG2 VAL A 189 21.665 26.403 -9.234 1.00 17.31 C ATOM 1445 H VAL A 189 18.488 26.517 -9.489 1.00 0.00 H ATOM 1446 N TYR A 190 19.044 24.503 -5.852 1.00 15.43 N ATOM 1447 CA TYR A 190 18.268 24.522 -4.601 1.00 15.98 C ATOM 1448 C TYR A 190 18.933 25.361 -3.508 1.00 16.22 C ATOM 1449 O TYR A 190 20.135 25.606 -3.612 1.00 17.89 O ATOM 1450 CB TYR A 190 18.255 23.044 -4.129 1.00 15.90 C ATOM 1451 CG TYR A 190 17.438 22.120 -5.029 1.00 15.29 C ATOM 1452 CD1 TYR A 190 18.008 21.427 -6.020 1.00 15.64 C ATOM 1453 CD2 TYR A 190 16.039 22.063 -4.896 1.00 15.57 C ATOM 1454 CE1 TYR A 190 17.254 20.675 -6.910 1.00 15.00 C ATOM 1455 CE2 TYR A 190 15.295 21.264 -5.752 1.00 15.23 C ATOM 1456 CZ TYR A 190 15.914 20.572 -6.772 1.00 15.55 C ATOM 1457 OH TYR A 190 15.171 19.823 -7.608 1.00 16.59 O ATOM 1458 HH TYR A 190 15.761 19.395 -8.278 1.00 0.00 H ATOM 1459 H TYR A 190 19.711 23.734 -6.066 1.00 0.00 H ATOM 1460 N ASN A 191 18.137 25.825 -2.552 1.00 15.43 N ATOM 1461 CA ASN A 191 18.625 26.664 -1.500 1.00 18.44 C ATOM 1462 C ASN A 191 18.635 25.788 -0.243 1.00 17.04 C ATOM 1463 O ASN A 191 17.572 25.349 0.252 1.00 16.70 O ATOM 1464 CB ASN A 191 17.710 27.842 -1.393 1.00 19.46 C ATOM 1465 CG ASN A 191 18.062 28.771 -0.212 1.00 23.91 C ATOM 1466 OD1 ASN A 191 18.140 28.438 0.905 1.00 23.35 O ATOM 1467 ND2 ASN A 191 18.223 29.992 -0.561 1.00 32.58 N ATOM 1468 HD22 ASN A 191 18.148 30.261 -1.563 1.00 0.00 H ATOM 1469 HD21 ASN A 191 18.429 30.715 0.157 1.00 0.00 H ATOM 1470 H ASN A 191 17.129 25.571 -2.568 1.00 0.00 H ATOM 1471 N TYR A 192 19.822 25.544 0.319 1.00 17.57 N ATOM 1472 CA TYR A 192 19.884 24.672 1.503 1.00 17.00 C ATOM 1473 C TYR A 192 19.031 25.158 2.617 1.00 18.06 C ATOM 1474 O TYR A 192 18.385 24.347 3.317 1.00 17.20 O ATOM 1475 CB TYR A 192 21.386 24.655 1.949 1.00 17.94 C ATOM 1476 CG TYR A 192 21.615 23.673 3.080 1.00 18.70 C ATOM 1477 CD1 TYR A 192 21.404 24.059 4.355 1.00 18.79 C ATOM 1478 CD2 TYR A 192 21.928 22.431 2.811 1.00 17.76 C ATOM 1479 CE1 TYR A 192 21.571 23.125 5.379 1.00 19.34 C ATOM 1480 CE2 TYR A 192 22.180 21.455 3.867 1.00 20.08 C ATOM 1481 CZ TYR A 192 21.984 21.882 5.112 1.00 19.04 C ATOM 1482 OH TYR A 192 22.183 20.838 6.055 1.00 21.11 O ATOM 1483 HH TYR A 192 22.030 21.187 6.969 1.00 0.00 H ATOM 1484 H TYR A 192 20.689 25.964 -0.074 1.00 0.00 H ATOM 1485 N GLU A 193 19.075 26.448 2.926 1.00 19.71 N ATOM 1486 CA GLU A 193 18.281 26.986 4.021 1.00 19.36 C ATOM 1487 C GLU A 193 16.766 26.796 3.836 1.00 16.48 C ATOM 1488 O GLU A 193 15.981 26.526 4.813 1.00 17.85 O ATOM 1489 CB GLU A 193 18.644 28.468 4.312 1.00 23.95 C ATOM 1490 CG GLU A 193 20.055 28.623 4.937 1.00 28.65 C ATOM 1491 CD GLU A 193 21.229 28.305 4.000 1.00 37.93 C ATOM 1492 OE1 GLU A 193 21.227 28.425 2.714 1.00 40.33 O ATOM 1493 OE2 GLU A 193 22.201 27.789 4.584 1.00 48.02 O ATOM 1494 H GLU A 193 19.687 27.085 2.377 1.00 0.00 H ATOM 1495 N THR A 194 16.244 26.965 2.608 1.00 17.18 N ATOM 1496 CA THR A 194 14.880 26.616 2.295 1.00 18.54 C ATOM 1497 C THR A 194 14.527 25.182 2.589 1.00 17.64 C ATOM 1498 O THR A 194 13.533 24.901 3.298 1.00 17.53 O ATOM 1499 CB THR A 194 14.544 26.932 0.860 1.00 19.14 C ATOM 1500 OG1 THR A 194 14.816 28.353 0.587 1.00 20.98 O ATOM 1501 CG2 THR A 194 13.100 26.642 0.521 1.00 20.29 C ATOM 1502 HG1 THR A 194 14.594 28.555 -0.356 1.00 0.00 H ATOM 1503 H THR A 194 16.845 27.361 1.858 1.00 0.00 H ATOM 1504 N LEU A 195 15.391 24.330 2.167 1.00 16.83 N ATOM 1505 CA LEU A 195 15.121 22.860 2.380 1.00 15.17 C ATOM 1506 C LEU A 195 15.257 22.589 3.931 1.00 16.53 C ATOM 1507 O LEU A 195 14.436 21.881 4.506 1.00 15.66 O ATOM 1508 CB LEU A 195 16.132 21.980 1.657 1.00 17.20 C ATOM 1509 CG LEU A 195 15.971 22.011 0.202 1.00 18.37 C ATOM 1510 CD1 LEU A 195 17.086 21.302 -0.498 1.00 19.82 C ATOM 1511 CD2 LEU A 195 14.603 21.484 -0.297 1.00 19.46 C ATOM 1512 H LEU A 195 16.259 24.646 1.689 1.00 0.00 H ATOM 1513 N GLN A 196 16.266 23.185 4.563 1.00 16.55 N ATOM 1514 CA GLN A 196 16.491 22.966 6.009 1.00 16.87 C ATOM 1515 C GLN A 196 15.308 23.377 6.818 1.00 17.69 C ATOM 1516 O GLN A 196 14.842 22.642 7.732 1.00 17.34 O ATOM 1517 CB GLN A 196 17.700 23.780 6.433 1.00 18.41 C ATOM 1518 CG GLN A 196 18.219 23.411 7.809 1.00 19.16 C ATOM 1519 CD GLN A 196 19.483 24.139 8.122 1.00 20.80 C ATOM 1520 OE1 GLN A 196 19.821 25.160 7.570 1.00 20.91 O ATOM 1521 NE2 GLN A 196 20.173 23.599 8.994 1.00 21.31 N ATOM 1522 HE22 GLN A 196 19.847 22.721 9.445 1.00 0.00 H ATOM 1523 HE21 GLN A 196 21.080 24.023 9.276 1.00 0.00 H ATOM 1524 H GLN A 196 16.904 23.813 4.033 1.00 0.00 H ATOM 1525 N GLN A 197 14.793 24.551 6.544 1.00 17.79 N ATOM 1526 CA GLN A 197 13.659 25.074 7.349 1.00 18.85 C ATOM 1527 C GLN A 197 12.449 24.173 7.292 1.00 18.27 C ATOM 1528 O GLN A 197 11.796 23.870 8.318 1.00 19.60 O ATOM 1529 CB GLN A 197 13.145 26.393 6.783 1.00 21.88 C ATOM 1530 CG GLN A 197 12.007 27.067 7.540 1.00 24.76 C ATOM 1531 CD GLN A 197 11.548 28.389 6.909 1.00 30.56 C ATOM 1532 OE1 GLN A 197 12.282 29.026 6.146 1.00 37.83 O ATOM 1533 NE2 GLN A 197 10.329 28.814 7.253 1.00 33.09 N ATOM 1534 HE22 GLN A 197 9.743 28.247 7.899 1.00 0.00 H ATOM 1535 HE21 GLN A 197 9.966 29.712 6.875 1.00 0.00 H ATOM 1536 H GLN A 197 15.179 25.117 5.762 1.00 0.00 H ATOM 1537 N ARG A 198 12.156 23.739 6.089 1.00 17.30 N ATOM 1538 CA ARG A 198 10.953 22.910 5.925 1.00 17.72 C ATOM 1539 C ARG A 198 11.200 21.461 6.452 1.00 17.79 C ATOM 1540 O ARG A 198 10.281 20.882 6.986 1.00 18.37 O ATOM 1541 CB ARG A 198 10.414 22.974 4.522 1.00 19.26 C ATOM 1542 CG ARG A 198 9.140 22.177 4.341 1.00 20.55 C ATOM 1543 CD ARG A 198 8.033 22.464 5.357 1.00 23.10 C ATOM 1544 NE ARG A 198 6.842 21.780 4.972 1.00 24.06 N ATOM 1545 CZ ARG A 198 5.736 21.693 5.676 1.00 26.45 C ATOM 1546 NH1 ARG A 198 5.630 22.277 6.839 1.00 28.73 N ATOM 1547 NH2 ARG A 198 4.755 21.009 5.158 1.00 24.91 N ATOM 1548 HE ARG A 198 6.850 21.305 4.047 1.00 0.00 H ATOM 1549 HH12 ARG A 198 4.747 22.197 7.382 1.00 0.00 H ATOM 1550 HH11 ARG A 198 6.429 22.822 7.222 1.00 0.00 H ATOM 1551 HH22 ARG A 198 3.859 20.911 5.676 1.00 0.00 H ATOM 1552 HH21 ARG A 198 4.868 20.561 4.226 1.00 0.00 H ATOM 1553 H ARG A 198 12.758 23.975 5.274 1.00 0.00 H ATOM 1554 N ILE A 199 12.372 20.902 6.275 1.00 16.63 N ATOM 1555 CA ILE A 199 12.692 19.589 6.825 1.00 16.15 C ATOM 1556 C ILE A 199 12.591 19.652 8.332 1.00 16.08 C ATOM 1557 O ILE A 199 12.042 18.685 8.929 1.00 16.61 O ATOM 1558 CB ILE A 199 14.004 19.065 6.308 1.00 18.18 C ATOM 1559 CG1 ILE A 199 13.748 18.649 4.842 1.00 18.82 C ATOM 1560 CG2 ILE A 199 14.702 18.038 7.230 1.00 19.06 C ATOM 1561 CD1 ILE A 199 14.986 18.336 4.088 1.00 20.65 C ATOM 1562 H ILE A 199 13.095 21.409 5.726 1.00 0.00 H ATOM 1563 N ARG A 200 13.109 20.684 8.985 1.00 16.64 N ATOM 1564 CA ARG A 200 13.020 20.805 10.455 1.00 15.10 C ATOM 1565 C ARG A 200 11.555 20.828 10.863 1.00 16.74 C ATOM 1566 O ARG A 200 11.133 20.190 11.834 1.00 17.72 O ATOM 1567 CB ARG A 200 13.686 22.088 10.879 1.00 14.13 C ATOM 1568 CG ARG A 200 13.845 22.150 12.353 1.00 12.94 C ATOM 1569 CD ARG A 200 14.714 23.314 12.754 1.00 14.90 C ATOM 1570 NE ARG A 200 15.085 23.241 14.190 1.00 15.84 N ATOM 1571 CZ ARG A 200 14.696 24.093 15.081 1.00 15.85 C ATOM 1572 NH1 ARG A 200 13.772 25.004 14.726 1.00 16.81 N ATOM 1573 NH2 ARG A 200 15.100 23.924 16.345 1.00 13.73 N ATOM 1574 HE ARG A 200 15.695 22.457 14.498 1.00 0.00 H ATOM 1575 HH12 ARG A 200 13.438 25.703 15.420 1.00 0.00 H ATOM 1576 HH11 ARG A 200 13.392 25.009 13.758 1.00 0.00 H ATOM 1577 HH22 ARG A 200 14.801 24.596 17.081 1.00 0.00 H ATOM 1578 HH21 ARG A 200 15.713 23.121 16.592 1.00 0.00 H ATOM 1579 H ARG A 200 13.592 21.431 8.446 1.00 0.00 H ATOM 1580 N GLU A 201 10.783 21.644 10.122 1.00 17.39 N ATOM 1581 CA GLU A 201 9.312 21.696 10.420 1.00 19.07 C ATOM 1582 C GLU A 201 8.661 20.343 10.309 1.00 18.77 C ATOM 1583 O GLU A 201 7.902 19.969 11.194 1.00 19.22 O ATOM 1584 CB GLU A 201 8.643 22.677 9.479 1.00 22.04 C ATOM 1585 CG GLU A 201 7.224 23.024 9.790 1.00 28.51 C ATOM 1586 CD GLU A 201 6.726 24.137 8.753 1.00 40.25 C ATOM 1587 OE1 GLU A 201 5.481 24.400 8.772 1.00 50.50 O ATOM 1588 OE2 GLU A 201 7.539 24.698 7.871 1.00 43.20 O ATOM 1589 H GLU A 201 11.194 22.224 9.363 1.00 0.00 H ATOM 1590 N LEU A 202 8.923 19.633 9.250 1.00 17.94 N ATOM 1591 CA LEU A 202 8.330 18.329 9.008 1.00 18.24 C ATOM 1592 C LEU A 202 8.704 17.373 10.071 1.00 18.63 C ATOM 1593 O LEU A 202 7.873 16.585 10.529 1.00 20.42 O ATOM 1594 CB LEU A 202 8.706 17.769 7.666 1.00 17.70 C ATOM 1595 CG LEU A 202 8.116 18.465 6.495 1.00 19.76 C ATOM 1596 CD1 LEU A 202 8.749 18.032 5.235 1.00 22.01 C ATOM 1597 CD2 LEU A 202 6.579 18.224 6.371 1.00 22.82 C ATOM 1598 H LEU A 202 9.586 20.016 8.546 1.00 0.00 H ATOM 1599 N ALA A 203 9.943 17.348 10.557 1.00 16.55 N ATOM 1600 CA ALA A 203 10.330 16.458 11.624 1.00 15.66 C ATOM 1601 C ALA A 203 9.623 16.853 12.882 1.00 17.44 C ATOM 1602 O ALA A 203 9.239 16.020 13.708 1.00 19.83 O ATOM 1603 CB ALA A 203 11.864 16.493 11.783 1.00 16.33 C ATOM 1604 H ALA A 203 10.655 17.991 10.154 1.00 0.00 H ATOM 1605 N PHE A 204 9.500 18.170 13.229 1.00 18.18 N ATOM 1606 CA PHE A 204 8.838 18.563 14.448 1.00 19.80 C ATOM 1607 C PHE A 204 7.349 18.205 14.401 1.00 19.43 C ATOM 1608 O PHE A 204 6.768 17.848 15.465 1.00 20.60 O ATOM 1609 CB PHE A 204 8.918 20.118 14.564 1.00 20.71 C ATOM 1610 CG PHE A 204 8.243 20.670 15.759 1.00 23.66 C ATOM 1611 CD1 PHE A 204 6.986 21.210 15.657 1.00 25.53 C ATOM 1612 CD2 PHE A 204 8.843 20.573 16.997 1.00 26.25 C ATOM 1613 CE1 PHE A 204 6.325 21.762 16.766 1.00 26.40 C ATOM 1614 CE2 PHE A 204 8.182 21.137 18.134 1.00 26.70 C ATOM 1615 CZ PHE A 204 6.937 21.641 17.989 1.00 26.99 C ATOM 1616 H PHE A 204 9.891 18.902 12.602 1.00 0.00 H ATOM 1617 N LEU A 205 6.710 18.257 13.269 1.00 17.85 N ATOM 1618 CA LEU A 205 5.309 17.914 13.096 1.00 19.53 C ATOM 1619 C LEU A 205 5.081 16.437 13.183 1.00 22.55 C ATOM 1620 O LEU A 205 4.075 16.010 13.658 1.00 25.14 O ATOM 1621 CB LEU A 205 4.680 18.510 11.860 1.00 21.91 C ATOM 1622 CG LEU A 205 4.780 20.077 11.781 1.00 24.66 C ATOM 1623 CD1 LEU A 205 4.184 20.446 10.416 1.00 27.68 C ATOM 1624 CD2 LEU A 205 4.003 20.746 12.940 1.00 25.96 C ATOM 1625 H LEU A 205 7.239 18.566 12.429 1.00 0.00 H ATOM 1626 N ASN A 206 6.010 15.666 12.664 1.00 19.85 N ATOM 1627 CA ASN A 206 5.866 14.165 12.501 1.00 20.72 C ATOM 1628 C ASN A 206 6.838 13.546 13.484 1.00 21.20 C ATOM 1629 O ASN A 206 7.952 13.065 13.123 1.00 19.02 O ATOM 1630 CB ASN A 206 6.066 13.766 11.034 1.00 20.60 C ATOM 1631 CG ASN A 206 5.052 14.315 10.165 1.00 25.38 C ATOM 1632 OD1 ASN A 206 3.896 13.812 10.103 1.00 26.32 O ATOM 1633 ND2 ASN A 206 5.415 15.408 9.446 1.00 21.40 N ATOM 1634 HD22 ASN A 206 6.379 15.788 9.529 1.00 0.00 H ATOM 1635 HD21 ASN A 206 4.729 15.865 8.812 1.00 0.00 H ATOM 1636 H ASN A 206 6.895 16.111 12.347 1.00 0.00 H ATOM 1637 N LYS A 207 6.572 13.641 14.797 1.00 23.83 N ATOM 1638 CA LYS A 207 7.490 13.195 15.806 1.00 25.85 C ATOM 1639 C LYS A 207 7.847 11.726 15.703 1.00 24.06 C ATOM 1640 O LYS A 207 7.031 10.930 15.325 1.00 24.99 O ATOM 1641 CB LYS A 207 6.918 13.547 17.219 1.00 33.02 C ATOM 1642 CG LYS A 207 6.998 15.098 17.378 1.00 33.78 C ATOM 1643 CD LYS A 207 6.226 15.621 18.538 1.00 39.24 C ATOM 1644 CE LYS A 207 5.878 17.061 18.336 1.00 38.52 C ATOM 1645 NZ LYS A 207 7.093 17.841 18.130 1.00 36.99 N ATOM 1646 HZ1 LYS A 207 7.708 17.750 18.964 1.00 0.00 H ATOM 1647 HZ2 LYS A 207 7.592 17.487 17.289 1.00 0.00 H ATOM 1648 HZ3 LYS A 207 6.842 18.841 17.990 1.00 0.00 H ATOM 1649 H LYS A 207 5.665 14.054 15.094 1.00 0.00 H ATOM 1650 N GLY A 208 9.110 11.463 15.853 1.00 22.47 N ATOM 1651 CA GLY A 208 9.596 10.108 15.711 1.00 22.09 C ATOM 1652 C GLY A 208 10.269 9.793 14.404 1.00 21.72 C ATOM 1653 O GLY A 208 10.912 8.722 14.280 1.00 24.52 O ATOM 1654 H GLY A 208 9.775 12.231 16.076 1.00 0.00 H ATOM 1655 N ILE A 209 10.081 10.611 13.400 1.00 18.05 N ATOM 1656 CA ILE A 209 10.722 10.338 12.143 1.00 17.95 C ATOM 1657 C ILE A 209 12.032 11.078 12.128 1.00 18.57 C ATOM 1658 O ILE A 209 12.079 12.313 12.408 1.00 21.36 O ATOM 1659 CB ILE A 209 9.895 10.877 10.947 1.00 18.30 C ATOM 1660 CG1 ILE A 209 8.478 10.338 10.892 1.00 20.45 C ATOM 1661 CG2 ILE A 209 10.572 10.451 9.677 1.00 21.02 C ATOM 1662 CD1 ILE A 209 7.678 10.871 9.711 1.00 20.81 C ATOM 1663 H ILE A 209 9.475 11.449 13.510 1.00 0.00 H ATOM 1664 N GLN A 210 13.113 10.399 11.830 1.00 16.46 N ATOM 1665 CA GLN A 210 14.414 11.021 11.677 1.00 16.77 C ATOM 1666 C GLN A 210 14.528 11.547 10.238 1.00 17.30 C ATOM 1667 O GLN A 210 14.432 10.749 9.285 1.00 17.77 O ATOM 1668 CB GLN A 210 15.566 10.105 11.964 1.00 21.00 C ATOM 1669 CG GLN A 210 16.923 10.834 11.785 1.00 25.54 C ATOM 1670 CD GLN A 210 18.114 9.856 11.856 1.00 35.76 C ATOM 1671 OE1 GLN A 210 18.345 9.020 10.954 1.00 42.71 O ATOM 1672 NE2 GLN A 210 18.894 10.042 12.848 1.00 40.28 N ATOM 1673 HE22 GLN A 210 18.656 10.750 13.571 1.00 0.00 H ATOM 1674 HE21 GLN A 210 19.768 9.485 12.933 1.00 0.00 H ATOM 1675 H GLN A 210 13.034 9.370 11.698 1.00 0.00 H ATOM 1676 N ILE A 211 14.683 12.839 10.045 1.00 15.57 N ATOM 1677 CA ILE A 211 14.823 13.376 8.680 1.00 16.21 C ATOM 1678 C ILE A 211 16.156 14.113 8.594 1.00 16.52 C ATOM 1679 O ILE A 211 16.436 15.045 9.383 1.00 17.02 O ATOM 1680 CB ILE A 211 13.692 14.331 8.304 1.00 16.26 C ATOM 1681 CG1 ILE A 211 12.335 13.767 8.663 1.00 17.43 C ATOM 1682 CG2 ILE A 211 13.738 14.666 6.836 1.00 16.89 C ATOM 1683 CD1 ILE A 211 11.049 14.552 8.342 1.00 18.48 C ATOM 1684 H ILE A 211 14.707 13.485 10.860 1.00 0.00 H ATOM 1685 N THR A 212 16.949 13.736 7.606 1.00 16.12 N ATOM 1686 CA THR A 212 18.302 14.228 7.446 1.00 15.84 C ATOM 1687 C THR A 212 18.419 15.029 6.160 1.00 16.58 C ATOM 1688 O THR A 212 17.867 14.558 5.138 1.00 17.68 O ATOM 1689 CB THR A 212 19.299 13.125 7.476 1.00 17.60 C ATOM 1690 OG1 THR A 212 19.231 12.447 8.766 1.00 18.05 O ATOM 1691 CG2 THR A 212 20.735 13.599 7.198 1.00 19.14 C ATOM 1692 HG1 THR A 212 19.430 13.094 9.488 1.00 0.00 H ATOM 1693 H THR A 212 16.584 13.054 6.911 1.00 0.00 H ATOM 1694 N LEU A 213 19.082 16.139 6.154 1.00 17.30 N ATOM 1695 CA LEU A 213 19.391 16.887 4.919 1.00 15.72 C ATOM 1696 C LEU A 213 20.873 16.936 4.773 1.00 16.36 C ATOM 1697 O LEU A 213 21.587 17.265 5.772 1.00 16.58 O ATOM 1698 CB LEU A 213 18.884 18.283 5.048 1.00 15.18 C ATOM 1699 CG LEU A 213 19.205 19.262 3.946 1.00 15.39 C ATOM 1700 CD1 LEU A 213 18.672 18.840 2.619 1.00 16.57 C ATOM 1701 CD2 LEU A 213 18.684 20.669 4.326 1.00 16.79 C ATOM 1702 H LEU A 213 19.413 16.523 7.062 1.00 0.00 H ATOM 1703 N ARG A 214 21.390 16.705 3.550 1.00 15.10 N ATOM 1704 CA ARG A 214 22.853 16.742 3.347 1.00 15.31 C ATOM 1705 C ARG A 214 23.108 17.474 2.055 1.00 15.17 C ATOM 1706 O ARG A 214 22.412 17.156 1.048 1.00 16.19 O ATOM 1707 CB ARG A 214 23.447 15.357 3.348 1.00 17.36 C ATOM 1708 CG ARG A 214 24.941 15.381 3.129 1.00 21.33 C ATOM 1709 CD ARG A 214 25.655 14.129 3.628 1.00 25.57 C ATOM 1710 NE ARG A 214 25.307 13.114 2.827 1.00 25.08 N ATOM 1711 CZ ARG A 214 24.390 12.210 3.182 1.00 30.50 C ATOM 1712 NH1 ARG A 214 23.844 12.236 4.382 1.00 29.91 N ATOM 1713 NH2 ARG A 214 24.091 11.273 2.319 1.00 32.31 N ATOM 1714 HE ARG A 214 25.766 13.027 1.898 1.00 0.00 H ATOM 1715 HH12 ARG A 214 23.131 11.526 4.644 1.00 0.00 H ATOM 1716 HH11 ARG A 214 24.126 12.967 5.066 1.00 0.00 H ATOM 1717 HH22 ARG A 214 23.382 10.551 2.560 1.00 0.00 H ATOM 1718 HH21 ARG A 214 24.563 11.250 1.392 1.00 0.00 H ATOM 1719 H ARG A 214 20.759 16.501 2.749 1.00 0.00 H ATOM 1720 N ASP A 215 24.083 18.370 1.990 1.00 14.15 N ATOM 1721 CA ASP A 215 24.499 19.043 0.764 1.00 15.36 C ATOM 1722 C ASP A 215 25.841 18.529 0.337 1.00 16.57 C ATOM 1723 O ASP A 215 26.797 18.879 1.064 1.00 17.64 O ATOM 1724 CB ASP A 215 24.509 20.534 0.991 1.00 16.40 C ATOM 1725 CG ASP A 215 24.752 21.380 -0.291 1.00 17.48 C ATOM 1726 OD1 ASP A 215 24.947 20.745 -1.353 1.00 16.86 O ATOM 1727 OD2 ASP A 215 24.723 22.642 -0.168 1.00 19.66 O ATOM 1728 H ASP A 215 24.584 18.609 2.870 1.00 0.00 H ATOM 1729 N GLU A 216 25.949 17.847 -0.784 1.00 17.49 N ATOM 1730 CA GLU A 216 27.145 17.244 -1.329 1.00 18.92 C ATOM 1731 C GLU A 216 27.533 17.969 -2.591 1.00 20.21 C ATOM 1732 O GLU A 216 28.393 17.492 -3.236 1.00 22.55 O ATOM 1733 CB GLU A 216 26.934 15.737 -1.661 1.00 21.39 C ATOM 1734 CG GLU A 216 26.640 14.854 -0.493 1.00 24.04 C ATOM 1735 CD GLU A 216 26.498 13.416 -1.015 1.00 24.26 C ATOM 1736 OE1 GLU A 216 26.203 13.190 -2.203 1.00 29.45 O ATOM 1737 OE2 GLU A 216 26.400 12.643 -0.137 1.00 30.28 O ATOM 1738 H GLU A 216 25.077 17.729 -1.339 1.00 0.00 H ATOM 1739 N ARG A 217 26.992 19.114 -2.879 1.00 19.12 N ATOM 1740 CA ARG A 217 27.334 19.791 -4.119 1.00 19.00 C ATOM 1741 C ARG A 217 28.777 20.206 -4.164 1.00 23.47 C ATOM 1742 O ARG A 217 29.335 20.110 -5.280 1.00 24.72 O ATOM 1743 CB ARG A 217 26.440 20.982 -4.395 1.00 18.18 C ATOM 1744 CG ARG A 217 25.050 20.559 -4.733 1.00 17.72 C ATOM 1745 CD ARG A 217 24.118 21.707 -4.751 1.00 16.93 C ATOM 1746 NE ARG A 217 23.846 22.351 -3.496 1.00 17.16 N ATOM 1747 CZ ARG A 217 23.066 23.347 -3.263 1.00 17.04 C ATOM 1748 NH1 ARG A 217 22.927 23.918 -2.073 1.00 18.75 N ATOM 1749 NH2 ARG A 217 22.314 23.871 -4.282 1.00 16.36 N ATOM 1750 HE ARG A 217 24.344 21.962 -2.670 1.00 0.00 H ATOM 1751 HH12 ARG A 217 22.277 24.722 -1.954 1.00 0.00 H ATOM 1752 HH11 ARG A 217 23.468 23.562 -1.259 1.00 0.00 H ATOM 1753 HH22 ARG A 217 21.681 24.676 -4.100 1.00 0.00 H ATOM 1754 HH21 ARG A 217 22.376 23.463 -5.237 1.00 0.00 H ATOM 1755 H ARG A 217 26.313 19.547 -2.221 1.00 0.00 H ATOM 1756 N ASP A 218 29.349 20.600 -3.034 1.00 23.16 N ATOM 1757 CA ASP A 218 30.850 20.841 -2.992 1.00 23.62 C ATOM 1758 C ASP A 218 31.460 19.762 -2.130 1.00 24.82 C ATOM 1759 O ASP A 218 31.255 19.779 -0.915 1.00 23.49 O ATOM 1760 CB ASP A 218 30.991 22.178 -2.437 1.00 22.49 C ATOM 1761 CG ASP A 218 32.543 22.556 -2.159 1.00 25.74 C ATOM 1762 OD1 ASP A 218 33.301 21.677 -2.648 1.00 26.95 O ATOM 1763 OD2 ASP A 218 32.699 23.575 -1.565 1.00 31.08 O ATOM 1764 H ASP A 218 28.773 20.744 -2.180 1.00 0.00 H ATOM 1765 N GLU A 219 32.082 18.825 -2.771 1.00 26.97 N ATOM 1766 CA GLU A 219 32.681 17.622 -2.127 1.00 28.59 C ATOM 1767 C GLU A 219 33.697 18.022 -1.089 1.00 28.16 C ATOM 1768 O GLU A 219 33.958 17.245 -0.164 1.00 28.47 O ATOM 1769 CB GLU A 219 33.303 16.677 -3.212 1.00 32.75 C ATOM 1770 CG GLU A 219 34.628 17.150 -3.825 1.00 39.08 C ATOM 1771 CD GLU A 219 34.571 18.339 -4.849 1.00 45.93 C ATOM 1772 OE1 GLU A 219 33.460 18.782 -5.301 1.00 48.38 O ATOM 1773 OE2 GLU A 219 35.692 18.824 -5.263 1.00 50.49 O ATOM 1774 H GLU A 219 32.169 18.918 -3.803 1.00 0.00 H ATOM 1775 N GLU A 220 34.243 19.228 -1.217 1.00 27.20 N ATOM 1776 CA GLU A 220 35.261 19.701 -0.232 1.00 27.05 C ATOM 1777 C GLU A 220 34.587 20.187 1.104 1.00 24.19 C ATOM 1778 O GLU A 220 35.298 20.391 2.109 1.00 22.51 O ATOM 1779 CB GLU A 220 36.170 20.685 -0.897 1.00 30.99 C ATOM 1780 CG GLU A 220 36.927 20.093 -2.086 1.00 30.48 C ATOM 1781 CD GLU A 220 37.966 21.078 -2.686 1.00 34.83 C ATOM 1782 OE1 GLU A 220 37.638 22.346 -2.806 1.00 35.44 O ATOM 1783 OE2 GLU A 220 39.115 20.557 -3.047 1.00 37.11 O ATOM 1784 H GLU A 220 33.960 19.844 -2.006 1.00 0.00 H ATOM 1785 N ASN A 221 33.265 20.560 1.123 1.00 19.47 N ATOM 1786 CA ASN A 221 32.618 21.095 2.300 1.00 19.14 C ATOM 1787 C ASN A 221 31.176 20.591 2.268 1.00 20.20 C ATOM 1788 O ASN A 221 30.338 21.228 1.645 1.00 22.94 O ATOM 1789 CB ASN A 221 32.461 22.579 2.456 1.00 25.90 C ATOM 1790 CG ASN A 221 31.664 22.945 3.755 1.00 26.70 C ATOM 1791 OD1 ASN A 221 31.389 22.181 4.821 1.00 31.37 O ATOM 1792 ND2 ASN A 221 31.062 24.111 3.633 1.00 38.55 N ATOM 1793 HD22 ASN A 221 31.263 24.717 2.812 1.00 0.00 H ATOM 1794 HD21 ASN A 221 30.385 24.425 4.358 1.00 0.00 H ATOM 1795 H ASN A 221 32.705 20.453 0.253 1.00 0.00 H ATOM 1796 N VAL A 222 31.001 19.456 2.945 1.00 18.97 N ATOM 1797 CA VAL A 222 29.673 18.783 3.026 1.00 17.62 C ATOM 1798 C VAL A 222 28.997 19.193 4.311 1.00 18.90 C ATOM 1799 O VAL A 222 29.534 19.035 5.413 1.00 19.53 O ATOM 1800 CB VAL A 222 29.887 17.254 2.848 1.00 19.33 C ATOM 1801 CG1 VAL A 222 28.595 16.491 3.025 1.00 20.20 C ATOM 1802 CG2 VAL A 222 30.515 16.897 1.566 1.00 20.72 C ATOM 1803 H VAL A 222 31.815 19.027 3.431 1.00 0.00 H ATOM 1804 N ARG A 223 27.765 19.611 4.236 1.00 17.75 N ATOM 1805 CA ARG A 223 26.968 20.096 5.306 1.00 18.17 C ATOM 1806 C ARG A 223 25.867 19.151 5.572 1.00 19.57 C ATOM 1807 O ARG A 223 25.166 18.790 4.579 1.00 20.39 O ATOM 1808 CB ARG A 223 26.306 21.376 4.870 1.00 19.56 C ATOM 1809 CG ARG A 223 27.160 22.588 4.838 1.00 21.83 C ATOM 1810 CD ARG A 223 26.164 23.753 4.748 1.00 23.20 C ATOM 1811 NE ARG A 223 25.273 23.713 5.881 1.00 26.48 N ATOM 1812 CZ ARG A 223 24.494 24.692 6.388 1.00 22.00 C ATOM 1813 NH1 ARG A 223 24.168 25.924 5.789 1.00 24.87 N ATOM 1814 NH2 ARG A 223 23.963 24.406 7.509 1.00 25.85 N ATOM 1815 HE ARG A 223 25.224 22.801 6.378 1.00 0.00 H ATOM 1816 HH12 ARG A 223 23.553 26.598 6.288 1.00 0.00 H ATOM 1817 HH11 ARG A 223 24.543 26.160 4.848 1.00 0.00 H ATOM 1818 HH22 ARG A 223 23.345 25.095 7.983 1.00 0.00 H ATOM 1819 HH21 ARG A 223 24.147 23.483 7.951 1.00 0.00 H ATOM 1820 H ARG A 223 27.320 19.587 3.296 1.00 0.00 H ATOM 1821 N GLU A 224 25.544 18.832 6.819 1.00 18.58 N ATOM 1822 CA GLU A 224 24.424 17.904 7.108 1.00 19.81 C ATOM 1823 C GLU A 224 23.648 18.445 8.334 1.00 20.45 C ATOM 1824 O GLU A 224 24.261 19.008 9.317 1.00 21.90 O ATOM 1825 CB GLU A 224 24.880 16.567 7.348 1.00 20.46 C ATOM 1826 CG GLU A 224 23.830 15.475 7.498 1.00 23.93 C ATOM 1827 CD GLU A 224 24.384 14.155 7.699 1.00 26.52 C ATOM 1828 OE1 GLU A 224 24.598 13.885 8.912 1.00 37.43 O ATOM 1829 OE2 GLU A 224 24.553 13.394 6.806 1.00 31.08 O ATOM 1830 H GLU A 224 26.086 19.240 7.607 1.00 0.00 H ATOM 1831 N ASP A 225 22.346 18.395 8.350 1.00 16.81 N ATOM 1832 CA ASP A 225 21.533 18.676 9.503 1.00 17.54 C ATOM 1833 C ASP A 225 20.644 17.458 9.626 1.00 17.56 C ATOM 1834 O ASP A 225 19.970 17.063 8.660 1.00 17.99 O ATOM 1835 CB ASP A 225 20.744 19.899 9.368 1.00 19.58 C ATOM 1836 CG ASP A 225 21.501 21.182 9.642 1.00 26.50 C ATOM 1837 OD1 ASP A 225 21.763 21.594 10.833 1.00 25.30 O ATOM 1838 OD2 ASP A 225 21.819 21.849 8.643 1.00 28.31 O ATOM 1839 H ASP A 225 21.861 18.134 7.468 1.00 0.00 H ATOM 1840 N SER A 226 20.494 16.947 10.848 1.00 17.54 N ATOM 1841 CA SER A 226 19.542 15.828 11.029 1.00 16.80 C ATOM 1842 C SER A 226 18.621 16.033 12.190 1.00 18.47 C ATOM 1843 O SER A 226 19.025 16.439 13.318 1.00 18.52 O ATOM 1844 CB SER A 226 20.309 14.604 11.344 1.00 16.44 C ATOM 1845 OG SER A 226 19.518 13.450 11.341 1.00 16.43 O ATOM 1846 HG SER A 226 19.113 13.331 10.445 1.00 0.00 H ATOM 1847 H SER A 226 21.032 17.325 11.654 1.00 0.00 H ATOM 1848 N TYR A 227 17.352 15.814 11.961 1.00 18.24 N ATOM 1849 CA TYR A 227 16.297 16.190 12.923 1.00 19.10 C ATOM 1850 C TYR A 227 15.538 14.969 13.395 1.00 19.22 C ATOM 1851 O TYR A 227 15.161 14.126 12.561 1.00 19.96 O ATOM 1852 CB TYR A 227 15.368 17.203 12.234 1.00 19.60 C ATOM 1853 CG TYR A 227 16.085 18.497 11.848 1.00 20.30 C ATOM 1854 CD1 TYR A 227 16.442 18.753 10.565 1.00 21.30 C ATOM 1855 CD2 TYR A 227 16.385 19.406 12.726 1.00 20.81 C ATOM 1856 CE1 TYR A 227 17.118 19.911 10.207 1.00 22.81 C ATOM 1857 CE2 TYR A 227 17.094 20.551 12.358 1.00 20.42 C ATOM 1858 CZ TYR A 227 17.432 20.730 11.101 1.00 20.99 C ATOM 1859 OH TYR A 227 18.077 21.913 10.727 1.00 22.60 O ATOM 1860 HH TYR A 227 18.262 21.893 9.755 1.00 0.00 H ATOM 1861 H TYR A 227 17.076 15.358 11.068 1.00 0.00 H ATOM 1862 N HIS A 228 15.202 14.877 14.680 1.00 18.59 N ATOM 1863 CA HIS A 228 14.508 13.702 15.176 1.00 19.67 C ATOM 1864 C HIS A 228 13.904 14.112 16.442 1.00 19.46 C ATOM 1865 O HIS A 228 14.692 14.127 17.473 1.00 20.62 O ATOM 1866 CB HIS A 228 15.463 12.562 15.347 1.00 21.78 C ATOM 1867 CG HIS A 228 14.866 11.301 15.816 1.00 24.59 C ATOM 1868 ND1 HIS A 228 15.674 10.264 16.278 1.00 29.01 N ATOM 1869 CD2 HIS A 228 13.607 10.832 15.776 1.00 27.47 C ATOM 1870 CE1 HIS A 228 14.876 9.246 16.632 1.00 29.68 C ATOM 1871 NE2 HIS A 228 13.623 9.576 16.354 1.00 30.30 N ATOM 1872 H HIS A 228 15.438 15.652 15.333 1.00 0.00 H ATOM 1873 N TYR A 229 12.627 14.418 16.436 1.00 18.36 N ATOM 1874 CA TYR A 229 11.951 14.908 17.671 1.00 19.48 C ATOM 1875 C TYR A 229 11.334 13.716 18.451 1.00 27.48 C ATOM 1876 O TYR A 229 10.779 12.822 17.878 1.00 29.96 O ATOM 1877 CB TYR A 229 10.991 15.967 17.298 1.00 19.69 C ATOM 1878 CG TYR A 229 11.603 17.233 16.901 1.00 23.27 C ATOM 1879 CD1 TYR A 229 12.013 17.479 15.630 1.00 23.07 C ATOM 1880 CD2 TYR A 229 11.865 18.154 17.845 1.00 25.31 C ATOM 1881 CE1 TYR A 229 12.705 18.657 15.289 1.00 24.41 C ATOM 1882 CE2 TYR A 229 12.467 19.357 17.493 1.00 26.82 C ATOM 1883 CZ TYR A 229 12.932 19.591 16.243 1.00 24.71 C ATOM 1884 OH TYR A 229 13.519 20.916 16.078 1.00 27.91 O ATOM 1885 HH TYR A 229 12.836 21.605 16.274 1.00 0.00 H ATOM 1886 H TYR A 229 12.080 14.317 15.557 1.00 0.00 H ATOM 1887 N GLU A 230 11.410 13.786 19.748 1.00 31.00 N ATOM 1888 CA GLU A 230 10.851 12.786 20.690 1.00 42.10 C ATOM 1889 C GLU A 230 11.141 11.361 20.345 1.00 45.74 C ATOM 1890 O GLU A 230 12.315 11.007 20.174 1.00 54.15 O ATOM 1891 CB GLU A 230 9.358 13.068 20.900 1.00 47.77 C ATOM 1892 CG GLU A 230 9.103 13.968 22.107 1.00 53.96 C ATOM 1893 CD GLU A 230 9.125 15.472 21.831 1.00 58.80 C ATOM 1894 OE1 GLU A 230 8.238 16.189 22.404 1.00 63.33 O ATOM 1895 OE2 GLU A 230 10.013 15.962 21.093 1.00 58.25 O ATOM 1896 H GLU A 230 11.901 14.607 20.156 1.00 0.00 H TER 1897 GLU A 230 HETATM 1898 MG MG A 1 1.393 14.442 -3.747 1.00 31.11 MG HETATM 1899 O HOH 2 23.872 23.467 8.638 1.00 20.94 O HETATM 1900 O HOH 3 25.049 25.870 3.284 1.00 27.58 O HETATM 1901 O HOH 4 0.414 10.170 -0.336 1.00 11.15 O HETATM 1902 O HOH 5 12.994 32.219 -17.224 1.00 41.08 O HETATM 1903 O HOH 6 11.027 -10.518 2.504 1.00 51.52 O HETATM 1904 O HOH 7 0.794 5.568 -14.667 1.00 32.54 O HETATM 1905 O HOH 8 17.563 20.275 -17.399 1.00 37.94 O HETATM 1906 O HOH 9 4.474 16.231 3.821 1.00 38.30 O HETATM 1907 O HOH 10 16.212 0.411 5.008 1.00 42.78 O HETATM 1908 O HOH 11 5.378 11.785 -7.528 1.00 42.88 O HETATM 1909 O HOH 12 11.464 26.235 -21.851 1.00 39.19 O HETATM 1910 O HOH 13 24.817 10.932 -2.765 1.00 33.77 O HETATM 1911 O HOH 14 -4.223 11.099 -18.888 1.00 39.72 O HETATM 1912 O HOH 15 6.136 20.134 2.781 1.00 31.45 O HETATM 1913 O HOH 16 11.549 -10.141 -8.017 1.00 31.41 O HETATM 1914 O HOH 17 1.449 15.597 -1.361 1.00 44.69 O HETATM 1915 O HOH 18 1.944 8.959 -8.997 1.00 35.76 O HETATM 1916 O HOH 19 12.293 -7.877 3.100 1.00 37.96 O HETATM 1917 O HOH 20 15.637 -13.121 -9.222 1.00 36.84 O HETATM 1918 O HOH 21 20.554 20.805 12.988 1.00 29.17 O HETATM 1919 O HOH 22 22.229 5.964 -9.752 1.00 32.58 O HETATM 1920 O HOH 23 7.461 9.937 -3.573 1.00 35.51 O HETATM 1921 O HOH 24 17.623 31.188 -3.072 1.00 46.34 O HETATM 1922 O HOH 25 14.329 29.230 -1.924 1.00 28.09 O HETATM 1923 O HOH 26 11.645 25.447 10.417 1.00 38.19 O HETATM 1924 O HOH 27 18.896 25.460 -15.067 1.00 41.63 O HETATM 1925 O HOH 28 15.344 19.180 -20.842 1.00 34.35 O HETATM 1926 O HOH 29 18.457 20.547 -13.255 1.00 23.83 O HETATM 1927 O HOH 30 2.311 13.263 4.627 1.00 34.45 O HETATM 1928 O HOH 31 0.931 10.324 -16.835 1.00 28.80 O HETATM 1929 O HOH 32 6.338 -7.996 -1.476 1.00 42.51 O HETATM 1930 O HOH 33 5.897 24.169 -20.379 1.00 41.76 O HETATM 1931 O HOH 34 19.502 8.922 -15.041 1.00 35.94 O HETATM 1932 O HOH 35 12.842 -12.552 -3.447 1.00 48.24 O HETATM 1933 O HOH 36 8.240 26.870 -17.735 1.00 34.25 O HETATM 1934 O HOH 37 11.231 31.410 -3.457 1.00 45.25 O HETATM 1935 O HOH 38 -2.670 15.646 -22.667 1.00 38.58 O HETATM 1936 O HOH 39 18.450 29.378 -7.246 1.00 29.50 O HETATM 1937 O HOH 40 10.917 13.842 14.269 1.00 17.73 O HETATM 1938 O HOH 41 10.232 -5.679 -15.472 1.00 37.75 O HETATM 1939 O HOH 42 3.366 2.837 -17.015 1.00 39.37 O HETATM 1940 O HOH 43 1.340 14.495 9.627 1.00 44.19 O HETATM 1941 O HOH 44 20.062 28.452 -11.655 1.00 32.44 O HETATM 1942 O HOH 45 19.124 -10.514 1.867 1.00 40.57 O HETATM 1943 O HOH 46 25.392 24.145 1.961 1.00 32.89 O HETATM 1944 O HOH 47 18.862 10.021 0.154 1.00 19.28 O HETATM 1945 O HOH 48 12.962 27.997 -11.842 1.00 20.43 O HETATM 1946 O HOH 49 2.415 4.541 2.055 1.00 28.85 O HETATM 1947 O HOH 50 6.680 4.607 11.457 1.00 33.57 O HETATM 1948 O HOH 51 9.289 2.833 0.704 1.00 17.07 O HETATM 1949 O HOH 52 2.057 5.863 12.765 1.00 37.49 O HETATM 1950 O HOH 53 20.264 3.601 -14.900 1.00 31.43 O HETATM 1951 O HOH 54 8.064 25.352 -2.432 1.00 31.39 O HETATM 1952 O HOH 55 8.672 -4.763 2.101 1.00 22.71 O HETATM 1953 O HOH 56 15.243 -3.647 -18.227 1.00 30.74 O HETATM 1954 O HOH 57 17.235 8.846 -16.768 1.00 20.66 O HETATM 1955 O HOH 58 22.145 7.713 0.590 1.00 51.05 O HETATM 1956 O HOH 59 18.179 20.872 -10.577 1.00 21.38 O HETATM 1957 O HOH 60 15.329 30.234 2.497 1.00 40.19 O HETATM 1958 O HOH 61 21.382 -3.386 1.054 1.00 33.37 O HETATM 1959 O HOH 62 11.972 11.901 -15.735 1.00 19.80 O HETATM 1960 O HOH 63 -6.445 11.536 -20.542 1.00 42.67 O HETATM 1961 O HOH 64 8.242 -2.515 -22.348 1.00 50.30 O HETATM 1962 O HOH 65 23.940 16.001 -14.221 1.00 39.14 O HETATM 1963 O HOH 66 17.477 10.360 8.398 1.00 23.33 O HETATM 1964 O HOH 67 3.312 6.740 0.583 1.00 27.57 O HETATM 1965 O HOH 68 15.552 14.395 -20.657 1.00 26.03 O HETATM 1966 O HOH 69 8.787 -2.193 -16.119 1.00 22.11 O HETATM 1967 O HOH 70 19.269 12.472 14.126 1.00 36.46 O HETATM 1968 O HOH 71 23.565 22.717 -11.042 1.00 31.62 O HETATM 1969 O HOH 72 16.816 18.101 -9.137 1.00 15.69 O HETATM 1970 O HOH 73 23.975 15.663 11.102 1.00 29.17 O HETATM 1971 O HOH 74 2.113 -4.264 3.746 1.00 45.73 O HETATM 1972 O HOH 75 24.830 13.952 -9.170 1.00 28.71 O HETATM 1973 O HOH 76 33.993 17.070 2.611 1.00 25.57 O HETATM 1974 O HOH 77 11.313 26.505 3.784 1.00 25.76 O HETATM 1975 O HOH 78 3.078 13.668 -2.568 1.00 25.93 O HETATM 1976 O HOH 79 28.448 20.718 -0.334 1.00 20.93 O HETATM 1977 O HOH 80 10.942 29.496 -14.466 1.00 34.79 O HETATM 1978 O HOH 81 13.189 14.996 -24.870 1.00 47.18 O HETATM 1979 O HOH 82 23.809 11.029 8.094 1.00 45.18 O HETATM 1980 O HOH 83 11.755 11.882 -22.672 1.00 25.39 O HETATM 1981 O HOH 84 20.249 6.157 -0.416 1.00 26.01 O HETATM 1982 O HOH 85 17.572 -11.981 -2.951 1.00 31.13 O HETATM 1983 O HOH 86 27.211 23.225 -1.354 1.00 30.49 O HETATM 1984 O HOH 87 21.395 12.586 -17.266 1.00 50.50 O HETATM 1985 O HOH 88 0.037 13.273 2.579 1.00 31.12 O HETATM 1986 O HOH 89 1.365 13.058 -9.526 1.00 37.48 O HETATM 1987 O HOH 90 10.122 -6.991 1.451 1.00 24.14 O HETATM 1988 O HOH 91 23.526 8.677 -5.975 1.00 38.60 O HETATM 1989 O HOH 92 14.073 -6.652 1.239 1.00 24.47 O HETATM 1990 O HOH 93 -6.971 8.567 -26.229 1.00 33.13 O HETATM 1991 O HOH 94 38.968 20.141 -5.882 1.00 54.87 O HETATM 1992 O HOH 95 15.476 36.669 -14.271 1.00 40.42 O HETATM 1993 O HOH 96 23.639 10.995 -11.761 1.00 41.69 O HETATM 1994 O HOH 97 3.531 18.967 -23.236 1.00 30.32 O HETATM 1995 O HOH 98 18.171 32.617 -5.813 1.00 45.89 O HETATM 1996 O HOH 99 13.698 -2.867 -21.176 1.00 33.26 O HETATM 1997 O HOH 100 15.210 -8.007 -14.120 1.00 25.57 O HETATM 1998 O HOH 101 3.487 -9.694 -9.919 1.00 36.57 O HETATM 1999 O HOH 102 -1.093 9.207 -25.369 1.00 38.41 O HETATM 2000 O HOH 103 5.995 30.501 -12.445 1.00 44.92 O HETATM 2001 O HOH 104 7.329 13.527 -21.781 1.00 33.38 O HETATM 2002 O HOH 105 21.775 28.013 -3.343 1.00 27.53 O HETATM 2003 O HOH 106 17.581 23.519 17.844 1.00 21.92 O HETATM 2004 O HOH 107 -2.606 20.829 -18.544 1.00 31.86 O HETATM 2005 O HOH 108 22.262 26.608 -0.907 1.00 21.88 O HETATM 2006 O HOH 109 14.315 25.708 18.535 1.00 24.39 O HETATM 2007 O HOH 110 21.941 11.482 9.939 1.00 39.02 O HETATM 2008 O HOH 111 -0.055 13.243 -26.468 1.00 40.82 O HETATM 2009 O HOH 112 3.009 26.959 -16.208 1.00 30.35 O HETATM 2010 O HOH 113 28.313 23.362 1.797 1.00 46.36 O HETATM 2011 O HOH 114 9.816 25.404 -0.121 1.00 40.05 O HETATM 2012 O HOH 115 6.716 17.410 2.223 1.00 26.67 O HETATM 2013 O HOH 116 -1.835 11.226 4.830 1.00 39.08 O HETATM 2014 O HOH 117 24.862 24.676 -7.332 1.00 26.25 O HETATM 2015 O HOH 118 20.813 7.569 10.222 1.00 61.46 O HETATM 2016 O HOH 119 12.491 32.223 -8.778 1.00 30.83 O HETATM 2017 O HOH 120 12.911 9.506 -23.535 1.00 27.53 O HETATM 2018 O HOH 121 3.618 -5.004 1.339 1.00 41.57 O HETATM 2019 O HOH 122 16.328 -11.698 -6.608 1.00 39.18 O HETATM 2020 O HOH 123 16.908 -11.094 -12.859 1.00 27.78 O HETATM 2021 O HOH 124 0.554 -2.780 -5.635 1.00 33.17 O HETATM 2022 O HOH 125 27.721 20.507 -7.827 1.00 34.99 O HETATM 2023 O HOH 126 0.916 1.118 -8.157 1.00 33.92 O HETATM 2024 O HOH 127 27.014 14.156 -5.180 1.00 27.58 O HETATM 2025 O HOH 128 2.995 -5.054 8.709 1.00 46.83 O HETATM 2026 O HOH 129 16.132 0.709 8.246 1.00 39.00 O HETATM 2027 O HOH 130 6.106 -6.346 -4.678 1.00 21.44 O HETATM 2028 O HOH 131 3.795 16.352 6.936 1.00 34.65 O HETATM 2029 O HOH 132 4.721 13.958 -8.002 1.00 30.75 O HETATM 2030 O HOH 133 -0.222 15.698 -3.693 1.00 37.20 O HETATM 2031 O HOH 134 11.591 23.247 17.319 1.00 45.15 O HETATM 2032 O HOH 135 14.636 3.375 15.811 1.00 31.67 O HETATM 2033 O HOH 136 6.534 -8.686 -5.812 1.00 43.02 O HETATM 2034 O HOH 137 5.028 14.751 -22.540 1.00 41.63 O HETATM 2035 O HOH 138 22.678 -5.919 1.708 1.00 42.05 O HETATM 2036 O HOH 139 4.013 20.951 0.689 1.00 48.34 O HETATM 2037 O HOH 140 23.972 27.232 1.066 1.00 35.39 O HETATM 2038 O HOH 141 -7.485 23.767 -23.514 1.00 34.07 O HETATM 2039 O HOH 142 11.082 -2.131 -23.231 1.00 45.09 O HETATM 2040 O HOH 143 19.293 22.129 -15.564 1.00 36.06 O HETATM 2041 O HOH 144 7.995 -4.631 -17.115 1.00 29.25 O HETATM 2042 O HOH 145 11.648 28.714 -2.670 1.00 33.16 O HETATM 2043 O HOH 146 10.525 23.744 13.529 1.00 50.57 O HETATM 2044 O HOH 147 5.987 -5.684 2.273 1.00 41.20 O HETATM 2045 O HOH 148 25.645 25.505 -4.429 1.00 42.98 O HETATM 2046 O HOH 149 17.482 23.925 -20.546 1.00 35.45 O HETATM 2047 O HOH 150 21.384 10.038 -16.268 1.00 40.41 O HETATM 2048 O HOH 151 8.798 -4.648 4.836 1.00 38.13 O HETATM 2049 O HOH 152 25.605 13.189 -11.708 1.00 48.86 O HETATM 2050 O HOH 153 24.223 6.493 -10.951 1.00 43.83 O HETATM 2051 O HOH 154 11.807 22.383 19.573 1.00 42.29 O HETATM 2052 O HOH 155 1.657 14.515 6.610 1.00 43.08 O HETATM 2053 O HOH 156 14.206 13.331 -22.924 1.00 30.53 O HETATM 2054 O HOH 157 16.627 16.959 -21.459 1.00 38.63 O HETATM 2055 O HOH 158 2.387 11.186 -7.461 1.00 35.95 O HETATM 2056 O HOH 159 10.112 27.491 -1.370 1.00 44.70 O HETATM 2057 O HOH 160 26.562 12.539 -7.584 1.00 40.77 O HETATM 2058 O HOH 161 5.090 17.010 -23.790 1.00 40.39 O HETATM 2059 O HOH 162 25.389 26.148 -9.550 1.00 36.78 O HETATM 2060 O HOH 163 18.302 6.740 -18.174 1.00 33.19 O HETATM 2061 O HOH 164 0.867 -0.023 -5.702 1.00 34.72 O HETATM 2062 O HOH 165 29.218 13.081 -8.867 1.00 60.45 O HETATM 2063 O HOH 166 16.185 11.885 -24.420 1.00 43.15 O HETATM 2064 O HOH 167 5.478 -5.429 5.313 1.00 45.85 O HETATM 2065 O HOH 168 -0.209 2.823 -1.357 1.00 35.43 O HETATM 2066 O HOH 169 0.852 1.028 -2.887 1.00 27.71 O HETATM 2067 O UNN A 170 7.886 7.521 -2.673 1.00 -0.39 O HETATM 2068 C3 UNN A 170 8.383 6.903 -1.760 1.00 0.28 C HETATM 2069 N1 UNN A 170 9.627 7.196 -1.337 1.00 -0.27 N HETATM 2070 C2 UNN A 170 10.318 8.390 -1.871 1.00 0.03 C HETATM 2071 C1 UNN A 170 11.771 8.212 -1.560 1.00 -0.05 C HETATM 2072 H1 UNN A 170 12.335 9.077 -1.938 1.00 0.02 H HETATM 2073 H2 UNN A 170 12.140 7.295 -2.043 1.00 0.02 H HETATM 2074 H3 UNN A 170 11.906 8.133 -0.471 1.00 0.02 H HETATM 2075 H6 UNN A 170 10.168 8.462 -2.958 1.00 0.05 H HETATM 2076 H7 UNN A 170 9.934 9.300 -1.387 1.00 0.05 H HETATM 2077 H8 UNN A 170 10.081 6.610 -0.666 1.00 0.18 H HETATM 2078 N2 UNN A 170 7.735 5.911 -1.044 1.00 -0.24 N HETATM 2079 C4 UNN A 170 6.432 5.524 -1.377 1.00 0.09 C HETATM 2080 C7 UNN A 170 5.968 4.181 -0.908 1.00 0.08 C HETATM 2081 C6 UNN A 170 4.623 4.048 -1.489 1.00 0.11 C HETATM 2082 C10 UNN A 170 3.985 2.875 -1.159 1.00 -0.01 C HETATM 2083 C9 UNN A 170 4.584 1.953 -0.415 1.00 0.00 C HETATM 2084 C8 UNN A 170 5.844 2.211 0.106 1.00 0.00 C HETATM 2085 N4 UNN A 170 6.584 3.307 -0.116 1.00 -0.31 N HETATM 2086 H4 UNN A 170 6.271 1.454 0.754 1.00 0.08 H HETATM 2087 C11 UNN A 170 3.885 0.660 -0.042 1.00 0.01 C HETATM 2088 C12 UNN A 170 4.671 -0.440 0.094 1.00 0.02 C HETATM 2089 N5 UNN A 170 4.135 -1.715 0.337 1.00 -0.30 N HETATM 2090 C13 UNN A 170 2.834 -1.771 0.563 1.00 0.01 C HETATM 2091 C14 UNN A 170 2.004 -0.663 0.407 1.00 -0.03 C HETATM 2092 C15 UNN A 170 2.524 0.583 0.105 1.00 -0.04 C HETATM 2093 H14 UNN A 170 1.888 1.454 -0.009 1.00 0.07 H HETATM 2094 H10 UNN A 170 0.933 -0.779 0.524 1.00 0.07 H HETATM 2095 H12 UNN A 170 2.398 -2.711 0.881 1.00 0.08 H HETATM 2096 H13 UNN A 170 5.746 -0.330 0.012 1.00 0.08 H HETATM 2097 H9 UNN A 170 2.975 2.700 -1.513 1.00 0.07 H HETATM 2098 N3 UNN A 170 4.440 5.161 -2.231 1.00 -0.22 N HETATM 2099 C5 UNN A 170 5.480 6.059 -2.176 1.00 0.06 C HETATM 2100 H5 UNN A 170 5.528 7.022 -2.682 1.00 0.07 H HETATM 2101 C16 UNN A 170 3.300 5.434 -2.927 1.00 0.16 C HETATM 2102 N6 UNN A 170 3.091 6.692 -3.442 1.00 -0.27 N HETATM 2103 C20 UNN A 170 1.993 7.129 -4.137 1.00 0.00 C HETATM 2104 C19 UNN A 170 1.018 6.185 -4.291 1.00 -0.04 C HETATM 2105 C18 UNN A 170 1.193 4.878 -3.883 1.00 -0.05 C HETATM 2106 C17 UNN A 170 2.379 4.461 -3.231 1.00 -0.00 C HETATM 2107 H18 UNN A 170 2.552 3.420 -2.983 1.00 0.07 H HETATM 2108 H17 UNN A 170 0.406 4.155 -4.066 1.00 0.07 H HETATM 2109 H16 UNN A 170 0.077 6.471 -4.748 1.00 0.06 H HETATM 2110 H15 UNN A 170 1.906 8.136 -4.530 1.00 0.08 H HETATM 2111 H11 UNN A 170 8.203 5.466 -0.281 1.00 0.21 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 336 335 1898 CONECT 1898 336 CONECT 2067 2068 CONECT 2068 2067 2069 2078 CONECT 2069 2068 2070 2077 CONECT 2070 2069 2071 2075 2076 CONECT 2071 2070 2072 2073 2074 CONECT 2072 2071 CONECT 2073 2071 CONECT 2074 2071 CONECT 2075 2070 CONECT 2076 2070 CONECT 2077 2069 CONECT 2078 2068 2079 2111 CONECT 2079 2078 2080 2099 CONECT 2080 2079 2081 2085 CONECT 2081 2080 2082 2098 CONECT 2082 2081 2083 2097 CONECT 2083 2082 2084 2087 CONECT 2084 2083 2085 2086 CONECT 2085 2080 2084 CONECT 2086 2084 CONECT 2087 2083 2088 2092 CONECT 2088 2087 2089 2096 CONECT 2089 2088 2090 CONECT 2090 2089 2091 2095 CONECT 2091 2090 2092 2094 CONECT 2092 2087 2091 2093 CONECT 2093 2092 CONECT 2094 2091 CONECT 2095 2090 CONECT 2096 2088 CONECT 2097 2082 CONECT 2098 2081 2099 2101 CONECT 2099 2079 2098 2100 CONECT 2100 2099 CONECT 2101 2098 2102 2106 CONECT 2102 2101 2103 CONECT 2103 2102 2104 2110 CONECT 2104 2103 2105 2109 CONECT 2105 2104 2106 2108 CONECT 2106 2101 2105 2107 CONECT 2107 2106 CONECT 2108 2105 CONECT 2109 2104 CONECT 2110 2103 CONECT 2111 2078 MASTER 0 0 0 0 0 0 0 0 2110 1 51 15 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 5d7c
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3ttz
RCSB PDB
PDBbind
198aa, >3TTZ_1|Chains... at 99%
3u2k
RCSB PDB
PDBbind
198aa, >3U2K_1|Chains... at 99%
5d6p
RCSB PDB
PDBbind
212aa, >5D6P_1|Chains... *
5d6q
RCSB PDB
PDBbind
212aa, >5D6Q_1|Chains... at 100%
5d7r
RCSB PDB
PDBbind
212aa, >5D7R_1|Chains... at 100%
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
5d7c
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
ATP binding domain of S. aureus GyrB
Ligand Name
57W
EC.Number
E.C.5.99.1.3
Resolution
1.55(Å)
Affinity (Kd/Ki/IC50)
IC50=0.14uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) J.Med.Chem. Vol. 58: pp. 8503-8512
Ligand Properties
Formula
C
2
0
H
1
8
N
6
O
Molecular Weight
358.397
Exact Mass
358.154
No. of atoms
45
No. of bonds
48
Polar Surface Area
84.73
LOGP Value
1.87 (
Computed with XLOGP3
)
4.09 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 4
Canonical SMILES
CCNC(=O)Nc1cn(c2c1ncc(c2)c1cccnc1)c1ccccn1
InChI String
InChI=1S/C20H18N6O/c1-2-22-20(27)25-16-13-26(18-7-3-4-9-23-18)17-10-15(12-24-19(16)17)14-6-5-8-21-11-14/h3-13H,2H2,1H3,(H2,22,25,27)
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
UniProt accession number (AC):
P0A0K8
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝ｅ湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓