Browse entries in the PDBbind-CN Database
HEADER 4TK5_COMPLEX COMPND 4TK5_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 201 PRO ASP ASP LYS GLU PHE GLN SER VAL GLU GLU GLU MET SEQRES 2 A 201 GLN SER THR VAL ARG GLU HIS ARG ASP GLY GLY HIS ALA SEQRES 3 A 201 GLY GLY ILE PHE ASN ARG TYR ASN ILE LEU LYS ILE GLN SEQRES 4 A 201 LYS VAL CYS ASN LYS LYS LEU TRP GLU ARG TYR THR HIS SEQRES 5 A 201 ARG ARG LYS GLU VAL SER GLU GLU ASN HIS ASN HIS ALA SEQRES 6 A 201 ASN GLU ARG MET LEU PHE HIS GLY SER PRO PHE VAL ASN SEQRES 7 A 201 ALA ILE ILE HIS LYS GLY PHE ASP GLU ARG HIS ALA TYR SEQRES 8 A 201 ILE GLY GLY MET PHE GLY ALA GLY ILE TYR PHE ALA GLU SEQRES 9 A 201 ASN SER SER LYS SER ASN GLN TYR VAL TYR GLY ILE GLY SEQRES 10 A 201 GLY GLY THR GLY CYS PRO VAL HIS LYS ASP ARG SER CYS SEQRES 11 A 201 TYR ILE CYS HIS ARG GLN LEU LEU PHE CYS ARG VAL THR SEQRES 12 A 201 LEU GLY LYS SER PHE LEU GLN PHE SER ALA MET LYS MET SEQRES 13 A 201 ALA HIS SER PRO PRO GLY HIS HIS SER VAL THR GLY ARG SEQRES 14 A 201 PRO SER VAL ASN GLY LEU ALA LEU ALA GLU TYR VAL ILE SEQRES 15 A 201 TYR ARG GLY GLU GLN ALA TYR PRO GLU TYR LEU ILE THR SEQRES 16 A 201 TYR GLN ILE MET ARG PRO HET ZN A 1 1 HET UHB A 409 67 ATOM 1 N PRO A 960 -2.080 48.531 -11.653 1.00 85.44 N ATOM 2 CA PRO A 960 -1.196 49.558 -11.082 1.00 84.04 C ATOM 3 C PRO A 960 -0.999 50.759 -12.008 1.00 86.49 C ATOM 4 O PRO A 960 -0.663 50.588 -13.184 1.00 86.38 O ATOM 5 CB PRO A 960 0.103 48.795 -10.800 1.00 84.76 C ATOM 6 CG PRO A 960 0.071 47.595 -11.716 1.00 89.74 C ATOM 7 CD PRO A 960 -1.320 47.431 -12.277 1.00 86.75 C ATOM 8 HN2 PRO A 960 -2.686 48.972 -12.374 1.00 0.00 H ATOM 9 HN1 PRO A 960 -2.675 48.140 -10.895 1.00 0.00 H ATOM 10 N ASP A 961 -1.231 51.976 -11.474 1.00 81.61 N ATOM 11 CA ASP A 961 -1.127 53.236 -12.217 1.00 80.92 C ATOM 12 C ASP A 961 0.250 53.523 -12.810 1.00 81.20 C ATOM 13 O ASP A 961 1.279 53.234 -12.191 1.00 79.41 O ATOM 14 CB ASP A 961 -1.618 54.429 -11.381 1.00 83.18 C ATOM 15 CG ASP A 961 -3.005 54.910 -11.762 1.00 94.59 C ATOM 16 OD1 ASP A 961 -3.168 55.422 -12.896 1.00 95.21 O ATOM 17 OD2 ASP A 961 -3.924 54.798 -10.920 1.00101.24 O ATOM 18 H ASP A 961 -1.501 52.024 -10.471 1.00 0.00 H ATOM 19 N ASP A 962 0.246 54.100 -14.023 1.00 75.88 N ATOM 20 CA ASP A 962 1.439 54.495 -14.767 1.00 73.72 C ATOM 21 C ASP A 962 2.150 55.664 -14.074 1.00 72.13 C ATOM 22 O ASP A 962 3.364 55.788 -14.201 1.00 70.92 O ATOM 23 CB ASP A 962 1.064 54.878 -16.211 1.00 76.95 C ATOM 24 CG ASP A 962 0.444 53.765 -17.044 1.00 92.00 C ATOM 25 OD1 ASP A 962 0.679 52.573 -16.724 1.00 98.59 O ATOM 26 OD2 ASP A 962 -0.256 54.083 -18.032 1.00 94.29 O ATOM 27 H ASP A 962 -0.678 54.279 -14.466 1.00 0.00 H ATOM 28 N LYS A 963 1.390 56.513 -13.344 1.00 65.22 N ATOM 29 CA LYS A 963 1.908 57.673 -12.611 1.00 62.88 C ATOM 30 C LYS A 963 2.693 57.274 -11.367 1.00 60.98 C ATOM 31 O LYS A 963 3.605 57.993 -10.954 1.00 59.64 O ATOM 32 CB LYS A 963 0.780 58.648 -12.263 1.00 66.57 C ATOM 33 CG LYS A 963 0.232 59.366 -13.498 1.00 80.59 C ATOM 34 CD LYS A 963 -0.334 60.747 -13.190 1.00 88.41 C ATOM 35 CE LYS A 963 0.708 61.803 -12.879 1.00 95.16 C ATOM 36 NZ LYS A 963 1.560 62.122 -14.056 1.00102.92 N ATOM 37 HZ1 LYS A 963 2.056 61.262 -14.367 1.00 0.00 H ATOM 38 HZ2 LYS A 963 0.962 62.478 -14.829 1.00 0.00 H ATOM 39 HZ3 LYS A 963 2.256 62.849 -13.792 1.00 0.00 H ATOM 40 H LYS A 963 0.367 56.330 -13.300 1.00 0.00 H ATOM 41 N GLU A 964 2.329 56.129 -10.768 1.00 54.28 N ATOM 42 CA GLU A 964 3.003 55.550 -9.609 1.00 51.28 C ATOM 43 C GLU A 964 4.371 55.032 -10.089 1.00 50.31 C ATOM 44 O GLU A 964 5.382 55.233 -9.411 1.00 49.27 O ATOM 45 CB GLU A 964 2.145 54.414 -9.034 1.00 52.36 C ATOM 46 CG GLU A 964 2.816 53.612 -7.934 1.00 57.04 C ATOM 47 CD GLU A 964 2.007 52.466 -7.358 1.00 60.51 C ATOM 48 OE1 GLU A 964 2.565 51.740 -6.509 1.00 41.01 O ATOM 49 OE2 GLU A 964 0.810 52.322 -7.704 1.00 52.16 O ATOM 50 H GLU A 964 1.510 55.619 -11.156 1.00 0.00 H ATOM 51 N PHE A 965 4.387 54.409 -11.284 1.00 43.69 N ATOM 52 CA PHE A 965 5.575 53.885 -11.924 1.00 42.53 C ATOM 53 C PHE A 965 6.458 54.999 -12.505 1.00 43.62 C ATOM 54 O PHE A 965 7.680 54.837 -12.510 1.00 41.17 O ATOM 55 CB PHE A 965 5.224 52.805 -12.963 1.00 45.33 C ATOM 56 CG PHE A 965 4.634 51.514 -12.412 1.00 48.11 C ATOM 57 CD1 PHE A 965 4.896 51.106 -11.107 1.00 50.29 C ATOM 58 CD2 PHE A 965 3.833 50.700 -13.206 1.00 52.90 C ATOM 59 CE1 PHE A 965 4.367 49.911 -10.605 1.00 53.78 C ATOM 60 CE2 PHE A 965 3.301 49.505 -12.702 1.00 54.38 C ATOM 61 CZ PHE A 965 3.574 49.119 -11.404 1.00 52.92 C ATOM 62 H PHE A 965 3.481 54.297 -11.782 1.00 0.00 H ATOM 63 N GLN A 966 5.851 56.136 -12.964 1.00 39.07 N ATOM 64 CA GLN A 966 6.587 57.309 -13.477 1.00 38.11 C ATOM 65 C GLN A 966 7.439 57.926 -12.338 1.00 37.36 C ATOM 66 O GLN A 966 8.579 58.331 -12.558 1.00 36.54 O ATOM 67 CB GLN A 966 5.610 58.364 -14.033 1.00 41.22 C ATOM 68 CG GLN A 966 5.733 58.667 -15.538 1.00 65.83 C ATOM 69 CD GLN A 966 4.678 58.001 -16.403 1.00 93.28 C ATOM 70 OE1 GLN A 966 4.714 56.785 -16.633 1.00 90.88 O ATOM 71 NE2 GLN A 966 3.737 58.786 -16.921 1.00 84.01 N ATOM 72 HE22 GLN A 966 3.734 59.804 -16.709 1.00 0.00 H ATOM 73 HE21 GLN A 966 3.004 58.382 -17.538 1.00 0.00 H ATOM 74 H GLN A 966 4.812 56.177 -12.951 1.00 0.00 H ATOM 75 N SER A 967 6.879 57.950 -11.132 1.00 32.49 N ATOM 76 CA SER A 967 7.491 58.446 -9.904 1.00 31.94 C ATOM 77 C SER A 967 8.726 57.604 -9.513 1.00 33.39 C ATOM 78 O SER A 967 9.750 58.160 -9.087 1.00 32.22 O ATOM 79 CB SER A 967 6.449 58.449 -8.788 1.00 36.64 C ATOM 80 OG SER A 967 7.017 58.384 -7.492 1.00 48.31 O ATOM 81 HG SER A 967 6.294 58.389 -6.816 1.00 0.00 H ATOM 82 H SER A 967 5.910 57.579 -11.057 1.00 0.00 H ATOM 83 N VAL A 968 8.622 56.270 -9.670 1.00 27.15 N ATOM 84 CA VAL A 968 9.699 55.320 -9.376 1.00 24.87 C ATOM 85 C VAL A 968 10.789 55.499 -10.431 1.00 26.80 C ATOM 86 O VAL A 968 11.969 55.577 -10.103 1.00 25.40 O ATOM 87 CB VAL A 968 9.169 53.854 -9.314 1.00 27.55 C ATOM 88 CG1 VAL A 968 10.318 52.846 -9.250 1.00 26.06 C ATOM 89 CG2 VAL A 968 8.213 53.662 -8.132 1.00 26.87 C ATOM 90 H VAL A 968 7.720 55.890 -10.022 1.00 0.00 H ATOM 91 N GLU A 969 10.380 55.593 -11.696 1.00 24.47 N ATOM 92 CA GLU A 969 11.281 55.796 -12.818 1.00 25.61 C ATOM 93 C GLU A 969 12.079 57.108 -12.629 1.00 29.75 C ATOM 94 O GLU A 969 13.291 57.106 -12.791 1.00 28.76 O ATOM 95 CB GLU A 969 10.460 55.813 -14.112 1.00 27.50 C ATOM 96 CG GLU A 969 11.254 56.104 -15.355 1.00 40.39 C ATOM 97 CD GLU A 969 10.448 55.940 -16.630 1.00 68.42 C ATOM 98 OE1 GLU A 969 9.410 56.623 -16.786 1.00 65.82 O ATOM 99 OE2 GLU A 969 10.887 55.161 -17.501 1.00 55.71 O ATOM 100 H GLU A 969 9.361 55.517 -11.891 1.00 0.00 H ATOM 101 N GLU A 970 11.404 58.190 -12.221 1.00 27.35 N ATOM 102 CA GLU A 970 12.030 59.486 -11.954 1.00 27.78 C ATOM 103 C GLU A 970 13.056 59.388 -10.809 1.00 27.92 C ATOM 104 O GLU A 970 14.143 59.954 -10.931 1.00 26.92 O ATOM 105 CB GLU A 970 10.941 60.556 -11.673 1.00 30.50 C ATOM 106 CG GLU A 970 11.422 61.944 -11.250 1.00 45.20 C ATOM 107 CD GLU A 970 12.380 62.725 -12.138 1.00 75.63 C ATOM 108 OE1 GLU A 970 13.015 63.669 -11.613 1.00 73.96 O ATOM 109 OE2 GLU A 970 12.508 62.400 -13.342 1.00 75.40 O ATOM 110 H GLU A 970 10.376 58.105 -12.086 1.00 0.00 H ATOM 111 N GLU A 971 12.731 58.654 -9.731 1.00 24.60 N ATOM 112 CA GLU A 971 13.643 58.461 -8.591 1.00 24.95 C ATOM 113 C GLU A 971 14.880 57.673 -9.025 1.00 27.70 C ATOM 114 O GLU A 971 16.004 57.997 -8.639 1.00 27.26 O ATOM 115 CB GLU A 971 12.932 57.743 -7.432 1.00 26.14 C ATOM 116 CG GLU A 971 13.595 57.994 -6.086 1.00 42.28 C ATOM 117 CD GLU A 971 13.605 59.427 -5.588 1.00 63.10 C ATOM 118 OE1 GLU A 971 14.553 59.774 -4.849 1.00 55.06 O ATOM 119 OE2 GLU A 971 12.685 60.205 -5.936 1.00 60.62 O ATOM 120 H GLU A 971 11.795 58.203 -9.701 1.00 0.00 H ATOM 121 N MET A 972 14.658 56.655 -9.842 1.00 25.18 N ATOM 122 CA MET A 972 15.711 55.822 -10.408 1.00 25.47 C ATOM 123 C MET A 972 16.692 56.704 -11.241 1.00 28.94 C ATOM 124 O MET A 972 17.894 56.695 -10.972 1.00 28.15 O ATOM 125 CB MET A 972 15.037 54.720 -11.248 1.00 27.58 C ATOM 126 CG MET A 972 15.968 53.748 -11.837 1.00 30.40 C ATOM 127 SD MET A 972 16.603 52.489 -10.714 1.00 31.41 S ATOM 128 CE MET A 972 17.469 51.519 -11.925 1.00 27.78 C ATOM 129 H MET A 972 13.673 56.437 -10.095 1.00 0.00 H ATOM 130 N GLN A 973 16.166 57.515 -12.184 1.00 24.68 N ATOM 131 CA GLN A 973 16.978 58.366 -13.060 1.00 24.35 C ATOM 132 C GLN A 973 17.654 59.550 -12.364 1.00 27.43 C ATOM 133 O GLN A 973 18.840 59.782 -12.586 1.00 24.81 O ATOM 134 CB GLN A 973 16.173 58.875 -14.285 1.00 25.77 C ATOM 135 CG GLN A 973 15.515 57.788 -15.149 1.00 31.29 C ATOM 136 CD GLN A 973 16.422 57.024 -16.083 1.00 36.86 C ATOM 137 OE1 GLN A 973 17.647 57.028 -15.959 1.00 27.14 O ATOM 138 NE2 GLN A 973 15.822 56.315 -17.040 1.00 24.09 N ATOM 139 HE22 GLN A 973 14.786 56.328 -17.124 1.00 0.00 H ATOM 140 HE21 GLN A 973 16.391 55.749 -17.702 1.00 0.00 H ATOM 141 H GLN A 973 15.132 57.537 -12.295 1.00 0.00 H ATOM 142 N SER A 974 16.905 60.305 -11.545 1.00 24.03 N ATOM 143 CA SER A 974 17.411 61.533 -10.914 1.00 24.72 C ATOM 144 C SER A 974 18.447 61.333 -9.809 1.00 28.69 C ATOM 145 O SER A 974 19.135 62.288 -9.455 1.00 29.33 O ATOM 146 CB SER A 974 16.257 62.388 -10.395 1.00 25.87 C ATOM 147 OG SER A 974 15.642 61.760 -9.283 1.00 28.10 O ATOM 148 HG SER A 974 15.292 60.875 -9.557 1.00 0.00 H ATOM 149 H SER A 974 15.927 60.010 -11.349 1.00 0.00 H ATOM 150 N THR A 975 18.532 60.125 -9.236 1.00 25.08 N ATOM 151 CA THR A 975 19.461 59.852 -8.131 1.00 24.44 C ATOM 152 C THR A 975 20.806 59.280 -8.592 1.00 28.23 C ATOM 153 O THR A 975 21.658 58.968 -7.757 1.00 27.56 O ATOM 154 CB THR A 975 18.797 59.061 -6.998 1.00 27.77 C ATOM 155 OG1 THR A 975 18.475 57.760 -7.480 1.00 26.19 O ATOM 156 CG2 THR A 975 17.560 59.760 -6.414 1.00 26.58 C ATOM 157 HG1 THR A 975 17.853 57.838 -8.247 1.00 0.00 H ATOM 158 H THR A 975 17.922 59.358 -9.584 1.00 0.00 H ATOM 159 N VAL A 976 21.013 59.174 -9.917 1.00 25.93 N ATOM 160 CA VAL A 976 22.283 58.719 -10.497 1.00 25.74 C ATOM 161 C VAL A 976 23.347 59.758 -10.140 1.00 31.74 C ATOM 162 O VAL A 976 23.085 60.962 -10.209 1.00 32.79 O ATOM 163 CB VAL A 976 22.183 58.507 -12.049 1.00 29.05 C ATOM 164 CG1 VAL A 976 23.551 58.223 -12.681 1.00 29.19 C ATOM 165 CG2 VAL A 976 21.215 57.387 -12.381 1.00 27.48 C ATOM 166 H VAL A 976 20.237 59.426 -10.561 1.00 0.00 H ATOM 167 N ARG A 977 24.525 59.299 -9.732 1.00 28.46 N ATOM 168 CA ARG A 977 25.652 60.180 -9.424 1.00 29.56 C ATOM 169 C ARG A 977 26.896 59.637 -10.122 1.00 35.78 C ATOM 170 O ARG A 977 26.918 58.470 -10.533 1.00 34.15 O ATOM 171 CB ARG A 977 25.882 60.272 -7.890 1.00 28.88 C ATOM 172 CG ARG A 977 24.757 60.942 -7.090 1.00 34.03 C ATOM 173 CD ARG A 977 24.563 62.425 -7.424 1.00 37.99 C ATOM 174 NE ARG A 977 23.413 62.994 -6.712 1.00 46.98 N ATOM 175 CZ ARG A 977 22.175 63.085 -7.201 1.00 60.90 C ATOM 176 NH1 ARG A 977 21.904 62.667 -8.435 1.00 38.88 N ATOM 177 NH2 ARG A 977 21.200 63.603 -6.463 1.00 52.23 N ATOM 178 HE ARG A 977 23.576 63.355 -5.750 1.00 0.00 H ATOM 179 HH12 ARG A 977 20.936 62.742 -8.808 1.00 0.00 H ATOM 180 HH11 ARG A 977 22.660 62.266 -9.026 1.00 0.00 H ATOM 181 HH22 ARG A 977 20.237 63.672 -6.848 1.00 0.00 H ATOM 182 HH21 ARG A 977 21.400 63.940 -5.500 1.00 0.00 H ATOM 183 H ARG A 977 24.651 58.272 -9.627 1.00 0.00 H ATOM 184 N GLU A 978 27.913 60.489 -10.292 1.00 35.06 N ATOM 185 CA GLU A 978 29.207 60.104 -10.854 1.00 35.93 C ATOM 186 C GLU A 978 29.941 59.410 -9.714 1.00 39.11 C ATOM 187 O GLU A 978 30.019 59.969 -8.610 1.00 40.85 O ATOM 188 CB GLU A 978 30.015 61.347 -11.270 1.00 39.18 C ATOM 189 CG GLU A 978 29.574 62.052 -12.537 1.00 52.91 C ATOM 190 CD GLU A 978 30.469 63.234 -12.876 1.00 78.16 C ATOM 191 OE1 GLU A 978 31.627 62.995 -13.290 1.00 78.17 O ATOM 192 OE2 GLU A 978 30.043 64.394 -12.663 1.00 69.90 O ATOM 193 H GLU A 978 27.776 61.480 -10.009 1.00 0.00 H ATOM 194 N HIS A 979 30.414 58.174 -9.942 1.00 32.39 N ATOM 195 CA HIS A 979 31.096 57.433 -8.887 1.00 30.67 C ATOM 196 C HIS A 979 32.605 57.607 -8.886 1.00 35.54 C ATOM 197 O HIS A 979 33.218 57.694 -9.955 1.00 33.53 O ATOM 198 CB HIS A 979 30.668 55.965 -8.863 1.00 29.13 C ATOM 199 CG HIS A 979 29.250 55.817 -8.408 1.00 29.98 C ATOM 200 ND1 HIS A 979 28.920 55.789 -7.061 1.00 30.88 N ATOM 201 CD2 HIS A 979 28.108 55.825 -9.136 1.00 29.88 C ATOM 202 CE1 HIS A 979 27.599 55.711 -7.018 1.00 28.71 C ATOM 203 NE2 HIS A 979 27.066 55.758 -8.235 1.00 28.59 N ATOM 204 H HIS A 979 30.293 57.741 -10.880 1.00 0.00 H ATOM 205 N ARG A 980 33.193 57.664 -7.675 1.00 34.22 N ATOM 206 CA ARG A 980 34.642 57.835 -7.424 1.00 35.82 C ATOM 207 C ARG A 980 35.485 56.773 -8.138 1.00 38.91 C ATOM 208 O ARG A 980 36.589 57.072 -8.575 1.00 41.23 O ATOM 209 CB ARG A 980 34.956 57.802 -5.912 1.00 36.46 C ATOM 210 CG ARG A 980 34.294 58.907 -5.081 1.00 51.69 C ATOM 211 CD ARG A 980 35.252 59.612 -4.125 1.00 65.32 C ATOM 212 NE ARG A 980 34.598 60.258 -2.980 1.00 78.61 N ATOM 213 CZ ARG A 980 34.310 61.559 -2.896 1.00 97.62 C ATOM 214 NH1 ARG A 980 34.581 62.375 -3.907 1.00 93.54 N ATOM 215 NH2 ARG A 980 33.756 62.053 -1.795 1.00 80.69 N ATOM 216 HE ARG A 980 34.339 59.656 -2.172 1.00 0.00 H ATOM 217 HH12 ARG A 980 34.354 63.387 -3.834 1.00 0.00 H ATOM 218 HH11 ARG A 980 35.021 62.002 -4.773 1.00 0.00 H ATOM 219 HH22 ARG A 980 33.534 63.067 -1.735 1.00 0.00 H ATOM 220 HH21 ARG A 980 33.544 61.426 -0.993 1.00 0.00 H ATOM 221 H ARG A 980 32.574 57.581 -6.843 1.00 0.00 H ATOM 222 N ASP A 981 34.964 55.542 -8.270 1.00 32.52 N ATOM 223 CA ASP A 981 35.655 54.426 -8.924 1.00 31.55 C ATOM 224 C ASP A 981 35.685 54.504 -10.484 1.00 36.11 C ATOM 225 O ASP A 981 36.164 53.567 -11.136 1.00 35.88 O ATOM 226 CB ASP A 981 35.071 53.084 -8.427 1.00 31.06 C ATOM 227 CG ASP A 981 33.732 52.638 -9.022 1.00 27.13 C ATOM 228 OD1 ASP A 981 33.052 53.467 -9.686 1.00 25.38 O ATOM 229 OD2 ASP A 981 33.370 51.474 -8.838 1.00 30.33 O ATOM 230 H ASP A 981 34.013 55.370 -7.885 1.00 0.00 H ATOM 231 N GLY A 982 35.148 55.594 -11.049 1.00 32.30 N ATOM 232 CA GLY A 982 35.075 55.828 -12.493 1.00 31.98 C ATOM 233 C GLY A 982 34.235 54.823 -13.266 1.00 34.11 C ATOM 234 O GLY A 982 34.428 54.651 -14.474 1.00 34.90 O ATOM 235 H GLY A 982 34.756 56.323 -10.419 1.00 0.00 H ATOM 236 N GLY A 983 33.309 54.167 -12.567 1.00 28.91 N ATOM 237 CA GLY A 983 32.405 53.165 -13.129 1.00 27.72 C ATOM 238 C GLY A 983 32.903 51.731 -13.007 1.00 32.50 C ATOM 239 O GLY A 983 32.296 50.821 -13.569 1.00 31.27 O ATOM 240 H GLY A 983 33.224 54.383 -11.553 1.00 0.00 H ATOM 241 N HIS A 984 34.009 51.506 -12.278 1.00 30.21 N ATOM 242 CA HIS A 984 34.587 50.171 -12.115 1.00 31.35 C ATOM 243 C HIS A 984 33.569 49.117 -11.640 1.00 30.03 C ATOM 244 O HIS A 984 33.426 48.077 -12.281 1.00 28.03 O ATOM 245 CB HIS A 984 35.826 50.210 -11.195 1.00 34.25 C ATOM 246 CG HIS A 984 36.436 48.859 -10.954 1.00 39.11 C ATOM 247 ND1 HIS A 984 37.311 48.288 -11.864 1.00 42.60 N ATOM 248 CD2 HIS A 984 36.273 48.008 -9.910 1.00 41.16 C ATOM 249 CE1 HIS A 984 37.626 47.104 -11.365 1.00 42.27 C ATOM 250 NE2 HIS A 984 37.043 46.894 -10.185 1.00 41.81 N ATOM 251 H HIS A 984 34.472 52.312 -11.811 1.00 0.00 H ATOM 252 N ALA A 985 32.859 49.396 -10.540 1.00 24.75 N ATOM 253 CA ALA A 985 31.891 48.455 -9.958 1.00 23.64 C ATOM 254 C ALA A 985 30.571 48.314 -10.733 1.00 25.90 C ATOM 255 O ALA A 985 30.136 47.190 -10.996 1.00 25.97 O ATOM 256 CB ALA A 985 31.616 48.816 -8.500 1.00 23.64 C ATOM 257 H ALA A 985 32.998 50.317 -10.078 1.00 0.00 H ATOM 258 N GLY A 986 29.941 49.432 -11.081 1.00 21.03 N ATOM 259 CA GLY A 986 28.623 49.401 -11.706 1.00 19.78 C ATOM 260 C GLY A 986 28.514 49.686 -13.186 1.00 25.80 C ATOM 261 O GLY A 986 27.424 49.560 -13.750 1.00 24.45 O ATOM 262 H GLY A 986 30.398 50.349 -10.904 1.00 0.00 H ATOM 263 N GLY A 987 29.622 50.075 -13.809 1.00 24.60 N ATOM 264 CA GLY A 987 29.621 50.420 -15.218 1.00 25.55 C ATOM 265 C GLY A 987 29.618 51.911 -15.476 1.00 29.01 C ATOM 266 O GLY A 987 29.457 52.710 -14.550 1.00 28.12 O ATOM 267 H GLY A 987 30.511 50.133 -13.273 1.00 0.00 H ATOM 268 N ILE A 988 29.790 52.289 -16.753 1.00 26.41 N ATOM 269 CA ILE A 988 29.856 53.684 -17.194 1.00 26.81 C ATOM 270 C ILE A 988 28.526 54.071 -17.824 1.00 29.54 C ATOM 271 O ILE A 988 28.125 53.477 -18.817 1.00 30.17 O ATOM 272 CB ILE A 988 31.074 53.901 -18.137 1.00 31.15 C ATOM 273 CG1 ILE A 988 32.399 53.554 -17.420 1.00 31.86 C ATOM 274 CG2 ILE A 988 31.098 55.337 -18.728 1.00 32.72 C ATOM 275 CD1 ILE A 988 33.542 53.170 -18.368 1.00 38.91 C ATOM 276 H ILE A 988 29.882 51.545 -17.474 1.00 0.00 H ATOM 277 N PHE A 989 27.834 55.047 -17.228 1.00 26.88 N ATOM 278 CA PHE A 989 26.514 55.499 -17.673 1.00 26.80 C ATOM 279 C PHE A 989 26.105 56.778 -16.941 1.00 32.99 C ATOM 280 O PHE A 989 26.570 57.033 -15.834 1.00 32.94 O ATOM 281 CB PHE A 989 25.456 54.394 -17.380 1.00 26.12 C ATOM 282 CG PHE A 989 25.232 54.102 -15.909 1.00 25.97 C ATOM 283 CD1 PHE A 989 26.095 53.267 -15.209 1.00 25.36 C ATOM 284 CD2 PHE A 989 24.164 54.676 -15.221 1.00 26.10 C ATOM 285 CE1 PHE A 989 25.903 53.026 -13.852 1.00 26.93 C ATOM 286 CE2 PHE A 989 23.990 54.448 -13.855 1.00 25.95 C ATOM 287 CZ PHE A 989 24.845 53.606 -13.186 1.00 24.37 C ATOM 288 H PHE A 989 28.258 55.512 -16.400 1.00 0.00 H ATOM 289 N ASN A 990 25.148 57.515 -17.519 1.00 30.64 N ATOM 290 CA ASN A 990 24.563 58.722 -16.914 1.00 30.69 C ATOM 291 C ASN A 990 23.070 58.469 -16.666 1.00 31.35 C ATOM 292 O ASN A 990 22.438 59.190 -15.900 1.00 31.07 O ATOM 293 CB ASN A 990 24.718 59.912 -17.887 1.00 32.72 C ATOM 294 CG ASN A 990 26.132 60.199 -18.307 1.00 52.58 C ATOM 295 OD1 ASN A 990 26.419 60.381 -19.490 1.00 48.08 O ATOM 296 ND2 ASN A 990 27.047 60.244 -17.350 1.00 45.67 N ATOM 297 HD22 ASN A 990 26.772 60.086 -16.360 1.00 0.00 H ATOM 298 HD21 ASN A 990 28.040 60.438 -17.589 1.00 0.00 H ATOM 299 H ASN A 990 24.797 57.216 -18.451 1.00 0.00 H ATOM 300 N ARG A 991 22.503 57.477 -17.381 1.00 26.38 N ATOM 301 CA ARG A 991 21.092 57.144 -17.321 1.00 25.29 C ATOM 302 C ARG A 991 20.841 55.654 -17.577 1.00 27.29 C ATOM 303 O ARG A 991 21.737 54.924 -18.006 1.00 25.46 O ATOM 304 CB ARG A 991 20.262 58.048 -18.268 1.00 26.42 C ATOM 305 CG ARG A 991 20.402 57.786 -19.772 1.00 35.89 C ATOM 306 CD ARG A 991 19.176 58.284 -20.500 1.00 37.42 C ATOM 307 NE ARG A 991 18.045 57.368 -20.328 1.00 37.51 N ATOM 308 CZ ARG A 991 16.874 57.502 -20.939 1.00 50.56 C ATOM 309 NH1 ARG A 991 16.666 58.513 -21.775 1.00 41.92 N ATOM 310 NH2 ARG A 991 15.911 56.615 -20.742 1.00 30.07 N ATOM 311 HE ARG A 991 18.168 56.560 -19.685 1.00 0.00 H ATOM 312 HH12 ARG A 991 15.747 58.613 -22.251 1.00 0.00 H ATOM 313 HH11 ARG A 991 17.422 59.204 -21.953 1.00 0.00 H ATOM 314 HH22 ARG A 991 14.996 56.725 -21.224 1.00 0.00 H ATOM 315 HH21 ARG A 991 16.070 55.808 -20.106 1.00 0.00 H ATOM 316 H ARG A 991 23.112 56.918 -18.012 1.00 0.00 H ATOM 317 N TYR A 992 19.604 55.222 -17.327 1.00 23.18 N ATOM 318 CA TYR A 992 19.188 53.848 -17.551 1.00 22.39 C ATOM 319 C TYR A 992 18.143 53.780 -18.640 1.00 24.52 C ATOM 320 O TYR A 992 17.461 54.768 -18.926 1.00 22.12 O ATOM 321 CB TYR A 992 18.522 53.261 -16.296 1.00 21.78 C ATOM 322 CG TYR A 992 19.281 53.435 -14.995 1.00 22.15 C ATOM 323 CD1 TYR A 992 20.354 52.612 -14.678 1.00 22.74 C ATOM 324 CD2 TYR A 992 18.881 54.381 -14.052 1.00 21.94 C ATOM 325 CE1 TYR A 992 21.016 52.726 -13.453 1.00 22.14 C ATOM 326 CE2 TYR A 992 19.550 54.517 -12.833 1.00 21.79 C ATOM 327 CZ TYR A 992 20.632 53.702 -12.550 1.00 26.11 C ATOM 328 OH TYR A 992 21.296 53.835 -11.360 1.00 27.80 O ATOM 329 HH TYR A 992 20.668 53.669 -10.613 1.00 0.00 H ATOM 330 H TYR A 992 18.907 55.898 -16.955 1.00 0.00 H ATOM 331 N ASN A 993 17.961 52.569 -19.175 1.00 21.35 N ATOM 332 CA ASN A 993 16.858 52.228 -20.031 1.00 22.13 C ATOM 333 C ASN A 993 15.970 51.388 -19.090 1.00 25.94 C ATOM 334 O ASN A 993 16.315 50.250 -18.794 1.00 25.11 O ATOM 335 CB ASN A 993 17.286 51.419 -21.281 1.00 24.30 C ATOM 336 CG ASN A 993 16.101 51.151 -22.185 1.00 33.96 C ATOM 337 OD1 ASN A 993 15.119 51.877 -22.152 1.00 25.78 O ATOM 338 ND2 ASN A 993 16.135 50.081 -22.966 1.00 23.81 N ATOM 339 HD22 ASN A 993 16.980 49.475 -22.981 1.00 0.00 H ATOM 340 HD21 ASN A 993 15.317 49.848 -23.564 1.00 0.00 H ATOM 341 H ASN A 993 18.659 51.829 -18.959 1.00 0.00 H ATOM 342 N ILE A 994 14.879 51.979 -18.558 1.00 22.83 N ATOM 343 CA ILE A 994 13.960 51.271 -17.647 1.00 23.32 C ATOM 344 C ILE A 994 13.047 50.378 -18.484 1.00 27.58 C ATOM 345 O ILE A 994 12.298 50.868 -19.325 1.00 25.82 O ATOM 346 CB ILE A 994 13.169 52.234 -16.709 1.00 26.51 C ATOM 347 CG1 ILE A 994 14.113 53.167 -15.876 1.00 27.59 C ATOM 348 CG2 ILE A 994 12.156 51.463 -15.804 1.00 24.99 C ATOM 349 CD1 ILE A 994 15.063 52.489 -14.925 1.00 39.55 C ATOM 350 H ILE A 994 14.679 52.971 -18.800 1.00 0.00 H ATOM 351 N LEU A 995 13.129 49.061 -18.265 1.00 23.96 N ATOM 352 CA LEU A 995 12.350 48.125 -19.063 1.00 24.37 C ATOM 353 C LEU A 995 11.013 47.785 -18.451 1.00 29.26 C ATOM 354 O LEU A 995 10.014 47.714 -19.156 1.00 28.24 O ATOM 355 CB LEU A 995 13.159 46.854 -19.323 1.00 23.96 C ATOM 356 CG LEU A 995 14.506 47.072 -20.010 1.00 27.49 C ATOM 357 CD1 LEU A 995 15.342 45.841 -19.944 1.00 27.23 C ATOM 358 CD2 LEU A 995 14.323 47.528 -21.428 1.00 30.04 C ATOM 359 H LEU A 995 13.756 48.702 -17.517 1.00 0.00 H ATOM 360 N LYS A 996 11.001 47.563 -17.140 1.00 26.15 N ATOM 361 CA LYS A 996 9.803 47.149 -16.431 1.00 25.94 C ATOM 362 C LYS A 996 9.880 47.570 -14.980 1.00 24.75 C ATOM 363 O LYS A 996 10.966 47.603 -14.389 1.00 21.98 O ATOM 364 CB LYS A 996 9.711 45.607 -16.504 1.00 29.08 C ATOM 365 CG LYS A 996 8.291 45.067 -16.462 1.00 53.84 C ATOM 366 CD LYS A 996 8.263 43.573 -16.172 1.00 67.49 C ATOM 367 CE LYS A 996 8.720 42.693 -17.308 1.00 86.59 C ATOM 368 NZ LYS A 996 9.182 41.369 -16.815 1.00 99.88 N ATOM 369 HZ1 LYS A 996 9.978 41.503 -16.159 1.00 0.00 H ATOM 370 HZ2 LYS A 996 8.401 40.893 -16.321 1.00 0.00 H ATOM 371 HZ3 LYS A 996 9.489 40.788 -17.621 1.00 0.00 H ATOM 372 H LYS A 996 11.882 47.691 -16.602 1.00 0.00 H ATOM 373 N ILE A 997 8.724 47.899 -14.405 1.00 22.26 N ATOM 374 CA ILE A 997 8.584 48.220 -12.989 1.00 21.18 C ATOM 375 C ILE A 997 7.405 47.384 -12.512 1.00 27.48 C ATOM 376 O ILE A 997 6.282 47.538 -13.005 1.00 28.34 O ATOM 377 CB ILE A 997 8.439 49.734 -12.636 1.00 23.83 C ATOM 378 CG1 ILE A 997 9.669 50.544 -13.099 1.00 23.48 C ATOM 379 CG2 ILE A 997 8.199 49.908 -11.101 1.00 23.77 C ATOM 380 CD1 ILE A 997 9.536 52.094 -13.007 1.00 31.57 C ATOM 381 H ILE A 997 7.872 47.929 -15.000 1.00 0.00 H ATOM 382 N GLN A 998 7.679 46.468 -11.587 1.00 24.52 N ATOM 383 CA GLN A 998 6.662 45.584 -11.051 1.00 25.12 C ATOM 384 C GLN A 998 6.478 45.877 -9.583 1.00 29.12 C ATOM 385 O GLN A 998 7.459 46.001 -8.848 1.00 28.00 O ATOM 386 CB GLN A 998 7.062 44.119 -11.243 1.00 26.23 C ATOM 387 CG GLN A 998 7.020 43.686 -12.709 1.00 38.51 C ATOM 388 CD GLN A 998 7.782 42.408 -12.922 1.00 50.27 C ATOM 389 OE1 GLN A 998 9.021 42.364 -12.848 1.00 37.83 O ATOM 390 NE2 GLN A 998 7.057 41.345 -13.228 1.00 49.12 N ATOM 391 HE22 GLN A 998 6.021 41.420 -13.281 1.00 0.00 H ATOM 392 HE21 GLN A 998 7.523 40.434 -13.416 1.00 0.00 H ATOM 393 H GLN A 998 8.655 46.383 -11.237 1.00 0.00 H ATOM 394 N LYS A 999 5.226 45.985 -9.156 1.00 26.84 N ATOM 395 CA LYS A 999 4.906 46.185 -7.748 1.00 26.85 C ATOM 396 C LYS A 999 4.846 44.786 -7.153 1.00 30.86 C ATOM 397 O LYS A 999 4.220 43.892 -7.735 1.00 31.13 O ATOM 398 CB LYS A 999 3.585 46.943 -7.578 1.00 30.36 C ATOM 399 CG LYS A 999 3.437 47.578 -6.193 1.00 43.92 C ATOM 400 CD LYS A 999 2.162 48.389 -6.074 1.00 59.19 C ATOM 401 CE LYS A 999 1.915 48.879 -4.666 1.00 75.77 C ATOM 402 NZ LYS A 999 2.804 50.017 -4.301 1.00 85.52 N ATOM 403 HZ1 LYS A 999 3.797 49.715 -4.369 1.00 0.00 H ATOM 404 HZ2 LYS A 999 2.636 50.810 -4.953 1.00 0.00 H ATOM 405 HZ3 LYS A 999 2.598 50.318 -3.327 1.00 0.00 H ATOM 406 H LYS A 999 4.450 45.925 -9.846 1.00 0.00 H ATOM 407 N VAL A1000 5.580 44.564 -6.054 1.00 26.11 N ATOM 408 CA VAL A1000 5.650 43.270 -5.393 1.00 26.81 C ATOM 409 C VAL A1000 4.523 43.226 -4.367 1.00 34.79 C ATOM 410 O VAL A1000 4.426 44.109 -3.500 1.00 33.80 O ATOM 411 CB VAL A1000 7.045 43.048 -4.750 1.00 30.63 C ATOM 412 CG1 VAL A1000 7.070 41.818 -3.858 1.00 31.19 C ATOM 413 CG2 VAL A1000 8.119 42.948 -5.805 1.00 30.24 C ATOM 414 H VAL A1000 6.125 45.354 -5.655 1.00 0.00 H ATOM 415 N CYS A1001 3.671 42.199 -4.482 1.00 34.90 N ATOM 416 CA CYS A1001 2.530 42.014 -3.600 1.00 37.36 C ATOM 417 C CYS A1001 2.666 40.676 -2.913 1.00 39.73 C ATOM 418 O CYS A1001 2.244 39.634 -3.428 1.00 39.79 O ATOM 419 CB CYS A1001 1.213 42.145 -4.366 1.00 40.97 C ATOM 420 SG CYS A1001 0.973 43.768 -5.145 1.00 46.21 S ATOM 421 H CYS A1001 3.833 41.502 -5.237 1.00 0.00 H ATOM 422 N ASN A1002 3.342 40.706 -1.763 1.00 33.18 N ATOM 423 CA ASN A1002 3.558 39.533 -0.940 1.00 31.81 C ATOM 424 C ASN A1002 2.934 39.864 0.420 1.00 31.43 C ATOM 425 O ASN A1002 3.553 40.556 1.235 1.00 26.70 O ATOM 426 CB ASN A1002 5.066 39.233 -0.845 1.00 28.96 C ATOM 427 CG ASN A1002 5.392 37.945 -0.132 1.00 45.72 C ATOM 428 OD1 ASN A1002 4.727 37.539 0.830 1.00 30.88 O ATOM 429 ND2 ASN A1002 6.485 37.316 -0.545 1.00 42.15 N ATOM 430 HD22 ASN A1002 7.021 37.684 -1.357 1.00 0.00 H ATOM 431 HD21 ASN A1002 6.806 36.455 -0.057 1.00 0.00 H ATOM 432 H ASN A1002 3.733 41.615 -1.442 1.00 0.00 H ATOM 433 N LYS A1003 1.697 39.389 0.641 1.00 29.10 N ATOM 434 CA LYS A1003 0.924 39.646 1.857 1.00 29.51 C ATOM 435 C LYS A1003 1.618 39.262 3.157 1.00 32.19 C ATOM 436 O LYS A1003 1.640 40.066 4.087 1.00 32.16 O ATOM 437 CB LYS A1003 -0.487 39.060 1.764 1.00 34.12 C ATOM 438 CG LYS A1003 -1.428 39.591 2.848 1.00 51.80 C ATOM 439 CD LYS A1003 -2.849 39.142 2.616 1.00 61.35 C ATOM 440 CE LYS A1003 -3.791 40.303 2.429 1.00 72.49 C ATOM 441 NZ LYS A1003 -3.702 40.866 1.054 1.00 81.17 N ATOM 442 HZ1 LYS A1003 -2.732 41.198 0.879 1.00 0.00 H ATOM 443 HZ2 LYS A1003 -3.947 40.129 0.362 1.00 0.00 H ATOM 444 HZ3 LYS A1003 -4.364 41.663 0.963 1.00 0.00 H ATOM 445 H LYS A1003 1.261 38.802 -0.098 1.00 0.00 H ATOM 446 N LYS A1004 2.194 38.066 3.226 1.00 29.14 N ATOM 447 CA LYS A1004 2.926 37.613 4.414 1.00 28.97 C ATOM 448 C LYS A1004 4.109 38.555 4.754 1.00 28.60 C ATOM 449 O LYS A1004 4.284 38.912 5.933 1.00 25.29 O ATOM 450 CB LYS A1004 3.417 36.174 4.226 1.00 33.44 C ATOM 451 CG LYS A1004 3.924 35.525 5.505 1.00 57.15 C ATOM 452 CD LYS A1004 4.234 34.037 5.314 1.00 70.61 C ATOM 453 CE LYS A1004 3.017 33.131 5.354 1.00 83.59 C ATOM 454 NZ LYS A1004 2.425 33.055 6.715 1.00 96.77 N ATOM 455 HZ1 LYS A1004 3.132 32.680 7.379 1.00 0.00 H ATOM 456 HZ2 LYS A1004 2.133 34.006 7.018 1.00 0.00 H ATOM 457 HZ3 LYS A1004 1.597 32.426 6.697 1.00 0.00 H ATOM 458 H LYS A1004 2.123 37.428 2.408 1.00 0.00 H ATOM 459 N LEU A1005 4.888 38.984 3.725 1.00 25.49 N ATOM 460 CA LEU A1005 6.008 39.910 3.940 1.00 25.42 C ATOM 461 C LEU A1005 5.518 41.290 4.327 1.00 25.89 C ATOM 462 O LEU A1005 6.152 41.938 5.160 1.00 24.94 O ATOM 463 CB LEU A1005 6.903 40.059 2.699 1.00 26.54 C ATOM 464 CG LEU A1005 7.798 38.900 2.298 1.00 34.23 C ATOM 465 CD1 LEU A1005 8.705 39.333 1.098 1.00 34.83 C ATOM 466 CD2 LEU A1005 8.614 38.383 3.489 1.00 36.76 C ATOM 467 H LEU A1005 4.686 38.648 2.762 1.00 0.00 H ATOM 468 N TRP A1006 4.405 41.752 3.719 1.00 22.05 N ATOM 469 CA TRP A1006 3.832 43.058 4.026 1.00 23.21 C ATOM 470 C TRP A1006 3.357 43.122 5.481 1.00 27.27 C ATOM 471 O TRP A1006 3.614 44.113 6.154 1.00 26.65 O ATOM 472 CB TRP A1006 2.700 43.434 3.047 1.00 23.56 C ATOM 473 CG TRP A1006 2.118 44.798 3.318 1.00 25.22 C ATOM 474 CD1 TRP A1006 0.876 45.069 3.803 1.00 29.06 C ATOM 475 CD2 TRP A1006 2.791 46.064 3.205 1.00 24.63 C ATOM 476 NE1 TRP A1006 0.719 46.423 3.973 1.00 28.76 N ATOM 477 CE2 TRP A1006 1.861 47.063 3.566 1.00 29.35 C ATOM 478 CE3 TRP A1006 4.073 46.457 2.782 1.00 24.96 C ATOM 479 CZ2 TRP A1006 2.189 48.424 3.585 1.00 28.48 C ATOM 480 CZ3 TRP A1006 4.392 47.810 2.780 1.00 26.57 C ATOM 481 CH2 TRP A1006 3.461 48.774 3.199 1.00 27.98 C ATOM 482 HE1 TRP A1006 -0.131 46.889 4.350 1.00 0.00 H ATOM 483 H TRP A1006 3.939 41.155 3.006 1.00 0.00 H ATOM 484 N GLU A1007 2.741 42.047 5.974 1.00 24.28 N ATOM 485 CA GLU A1007 2.252 41.962 7.363 1.00 24.86 C ATOM 486 C GLU A1007 3.409 41.948 8.349 1.00 26.94 C ATOM 487 O GLU A1007 3.333 42.606 9.382 1.00 26.15 O ATOM 488 CB GLU A1007 1.334 40.752 7.561 1.00 27.24 C ATOM 489 CG GLU A1007 0.041 40.936 6.785 1.00 46.45 C ATOM 490 CD GLU A1007 -1.250 40.276 7.201 1.00 81.50 C ATOM 491 OE1 GLU A1007 -2.298 40.817 6.786 1.00 89.36 O ATOM 492 OE2 GLU A1007 -1.247 39.251 7.925 1.00 79.10 O ATOM 493 H GLU A1007 2.598 41.228 5.349 1.00 0.00 H ATOM 494 N ARG A1008 4.500 41.247 8.008 1.00 23.26 N ATOM 495 CA ARG A1008 5.723 41.174 8.818 1.00 23.06 C ATOM 496 C ARG A1008 6.331 42.591 8.899 1.00 25.23 C ATOM 497 O ARG A1008 6.751 43.033 9.982 1.00 25.02 O ATOM 498 CB ARG A1008 6.704 40.215 8.137 1.00 26.44 C ATOM 499 CG ARG A1008 7.717 39.555 9.040 1.00 46.93 C ATOM 500 CD ARG A1008 8.628 38.630 8.247 1.00 62.72 C ATOM 501 NE ARG A1008 9.708 39.373 7.586 1.00 75.33 N ATOM 502 CZ ARG A1008 10.666 38.815 6.852 1.00 83.42 C ATOM 503 NH1 ARG A1008 10.683 37.500 6.657 1.00 69.06 N ATOM 504 NH2 ARG A1008 11.608 39.567 6.297 1.00 61.41 N ATOM 505 HE ARG A1008 9.725 40.407 7.700 1.00 0.00 H ATOM 506 HH12 ARG A1008 11.435 37.069 6.082 1.00 0.00 H ATOM 507 HH11 ARG A1008 9.944 36.902 7.080 1.00 0.00 H ATOM 508 HH22 ARG A1008 12.355 39.126 5.724 1.00 0.00 H ATOM 509 HH21 ARG A1008 11.599 40.598 6.435 1.00 0.00 H ATOM 510 H ARG A1008 4.479 40.721 7.111 1.00 0.00 H ATOM 511 N TYR A1009 6.376 43.296 7.746 1.00 20.54 N ATOM 512 CA TYR A1009 6.885 44.661 7.653 1.00 19.77 C ATOM 513 C TYR A1009 6.043 45.646 8.483 1.00 22.56 C ATOM 514 O TYR A1009 6.606 46.388 9.280 1.00 22.68 O ATOM 515 CB TYR A1009 7.009 45.136 6.183 1.00 20.36 C ATOM 516 CG TYR A1009 7.479 46.574 6.093 1.00 21.27 C ATOM 517 CD1 TYR A1009 8.798 46.916 6.381 1.00 21.63 C ATOM 518 CD2 TYR A1009 6.583 47.608 5.815 1.00 23.06 C ATOM 519 CE1 TYR A1009 9.222 48.247 6.369 1.00 23.76 C ATOM 520 CE2 TYR A1009 7.001 48.941 5.780 1.00 23.61 C ATOM 521 CZ TYR A1009 8.320 49.256 6.074 1.00 25.35 C ATOM 522 OH TYR A1009 8.748 50.563 6.095 1.00 20.93 O ATOM 523 HH TYR A1009 8.233 51.067 6.774 1.00 0.00 H ATOM 524 H TYR A1009 6.029 42.841 6.878 1.00 0.00 H ATOM 525 N THR A1010 4.714 45.675 8.276 1.00 19.78 N ATOM 526 CA THR A1010 3.818 46.597 8.999 1.00 20.54 C ATOM 527 C THR A1010 3.750 46.316 10.490 1.00 23.06 C ATOM 528 O THR A1010 3.599 47.261 11.264 1.00 21.87 O ATOM 529 CB THR A1010 2.422 46.702 8.365 1.00 23.90 C ATOM 530 OG1 THR A1010 1.815 45.431 8.392 1.00 25.89 O ATOM 531 CG2 THR A1010 2.468 47.211 6.944 1.00 25.19 C ATOM 532 HG1 THR A1010 1.736 45.124 9.330 1.00 0.00 H ATOM 533 H THR A1010 4.302 45.022 7.579 1.00 0.00 H ATOM 534 N HIS A1011 3.888 45.041 10.902 1.00 20.29 N ATOM 535 CA HIS A1011 3.897 44.685 12.325 1.00 20.62 C ATOM 536 C HIS A1011 5.134 45.294 13.001 1.00 24.24 C ATOM 537 O HIS A1011 5.023 45.897 14.067 1.00 23.53 O ATOM 538 CB HIS A1011 3.861 43.160 12.538 1.00 21.71 C ATOM 539 CG HIS A1011 3.707 42.786 13.974 1.00 25.42 C ATOM 540 ND1 HIS A1011 4.810 42.641 14.801 1.00 26.88 N ATOM 541 CD2 HIS A1011 2.584 42.608 14.703 1.00 27.64 C ATOM 542 CE1 HIS A1011 4.326 42.364 16.000 1.00 26.63 C ATOM 543 NE2 HIS A1011 2.990 42.327 15.989 1.00 28.11 N ATOM 544 H HIS A1011 3.991 44.288 10.192 1.00 0.00 H ATOM 545 N ARG A1012 6.299 45.163 12.365 1.00 21.50 N ATOM 546 CA ARG A1012 7.545 45.730 12.877 1.00 21.03 C ATOM 547 C ARG A1012 7.517 47.269 12.808 1.00 24.73 C ATOM 548 O ARG A1012 7.998 47.919 13.728 1.00 23.87 O ATOM 549 CB ARG A1012 8.757 45.176 12.102 1.00 20.37 C ATOM 550 CG ARG A1012 10.114 45.739 12.550 1.00 17.32 C ATOM 551 CD ARG A1012 10.418 45.444 14.022 1.00 19.88 C ATOM 552 NE ARG A1012 11.694 46.050 14.406 1.00 24.45 N ATOM 553 CZ ARG A1012 12.052 46.318 15.655 1.00 28.24 C ATOM 554 NH1 ARG A1012 11.233 46.047 16.661 1.00 26.26 N ATOM 555 NH2 ARG A1012 13.217 46.887 15.906 1.00 22.98 N ATOM 556 HE ARG A1012 12.366 46.287 13.648 1.00 0.00 H ATOM 557 HH12 ARG A1012 11.521 46.260 17.638 1.00 0.00 H ATOM 558 HH11 ARG A1012 10.303 45.621 16.474 1.00 0.00 H ATOM 559 HH22 ARG A1012 13.493 47.095 16.887 1.00 0.00 H ATOM 560 HH21 ARG A1012 13.858 47.127 15.123 1.00 0.00 H ATOM 561 H ARG A1012 6.322 44.636 11.469 1.00 0.00 H ATOM 562 N ARG A1013 6.951 47.839 11.731 1.00 22.35 N ATOM 563 CA ARG A1013 6.861 49.295 11.557 1.00 22.54 C ATOM 564 C ARG A1013 6.070 49.943 12.696 1.00 25.76 C ATOM 565 O ARG A1013 6.474 50.994 13.202 1.00 24.50 O ATOM 566 CB ARG A1013 6.262 49.637 10.186 1.00 20.54 C ATOM 567 CG ARG A1013 6.183 51.134 9.888 1.00 21.90 C ATOM 568 CD ARG A1013 5.650 51.387 8.486 1.00 24.59 C ATOM 569 NE ARG A1013 4.236 51.021 8.372 1.00 22.86 N ATOM 570 CZ ARG A1013 3.519 51.132 7.260 1.00 37.08 C ATOM 571 NH1 ARG A1013 4.074 51.585 6.148 1.00 26.19 N ATOM 572 NH2 ARG A1013 2.239 50.787 7.253 1.00 24.20 N ATOM 573 HE ARG A1013 3.762 50.649 9.220 1.00 0.00 H ATOM 574 HH12 ARG A1013 3.507 51.669 5.281 1.00 0.00 H ATOM 575 HH11 ARG A1013 5.078 51.857 6.141 1.00 0.00 H ATOM 576 HH22 ARG A1013 1.681 50.876 6.380 1.00 0.00 H ATOM 577 HH21 ARG A1013 1.793 50.428 8.121 1.00 0.00 H ATOM 578 H ARG A1013 6.560 47.224 10.989 1.00 0.00 H ATOM 579 N LYS A1014 4.963 49.299 13.117 1.00 23.54 N ATOM 580 CA LYS A1014 4.137 49.765 14.231 1.00 24.72 C ATOM 581 C LYS A1014 4.942 49.704 15.554 1.00 27.80 C ATOM 582 O LYS A1014 4.877 50.653 16.336 1.00 27.57 O ATOM 583 CB LYS A1014 2.832 48.960 14.315 1.00 28.49 C ATOM 584 CG LYS A1014 1.883 49.409 15.431 1.00 38.21 C ATOM 585 CD LYS A1014 0.545 48.687 15.351 1.00 46.02 C ATOM 586 CE LYS A1014 -0.439 49.155 16.401 1.00 56.60 C ATOM 587 NZ LYS A1014 -0.133 48.584 17.741 1.00 66.05 N ATOM 588 HZ1 LYS A1014 -0.176 47.546 17.692 1.00 0.00 H ATOM 589 HZ2 LYS A1014 0.821 48.879 18.033 1.00 0.00 H ATOM 590 HZ3 LYS A1014 -0.830 48.929 18.431 1.00 0.00 H ATOM 591 H LYS A1014 4.682 48.427 12.625 1.00 0.00 H ATOM 592 N GLU A1015 5.713 48.619 15.787 1.00 24.90 N ATOM 593 CA GLU A1015 6.567 48.476 16.987 1.00 25.50 C ATOM 594 C GLU A1015 7.624 49.577 17.020 1.00 25.74 C ATOM 595 O GLU A1015 7.842 50.179 18.061 1.00 24.87 O ATOM 596 CB GLU A1015 7.336 47.138 16.976 1.00 26.67 C ATOM 597 CG GLU A1015 6.582 45.907 17.400 1.00 41.07 C ATOM 598 CD GLU A1015 7.530 44.754 17.691 1.00 58.06 C ATOM 599 OE1 GLU A1015 8.454 44.496 16.881 1.00 33.11 O ATOM 600 OE2 GLU A1015 7.369 44.135 18.765 1.00 53.20 O ATOM 601 H GLU A1015 5.706 47.848 15.090 1.00 0.00 H ATOM 602 N VAL A1016 8.307 49.806 15.875 1.00 21.62 N ATOM 603 CA VAL A1016 9.343 50.835 15.759 1.00 20.81 C ATOM 604 C VAL A1016 8.742 52.239 16.018 1.00 26.15 C ATOM 605 O VAL A1016 9.312 52.995 16.806 1.00 24.54 O ATOM 606 CB VAL A1016 10.110 50.749 14.419 1.00 22.76 C ATOM 607 CG1 VAL A1016 11.018 51.943 14.239 1.00 22.16 C ATOM 608 CG2 VAL A1016 10.912 49.454 14.314 1.00 21.79 C ATOM 609 H VAL A1016 8.087 49.226 15.040 1.00 0.00 H ATOM 610 N SER A1017 7.587 52.576 15.372 1.00 24.50 N ATOM 611 CA SER A1017 6.897 53.860 15.550 1.00 25.31 C ATOM 612 C SER A1017 6.620 54.089 17.048 1.00 30.65 C ATOM 613 O SER A1017 6.898 55.168 17.544 1.00 30.39 O ATOM 614 CB SER A1017 5.565 53.888 14.801 1.00 27.91 C ATOM 615 OG SER A1017 5.721 53.643 13.414 1.00 40.71 O ATOM 616 HG SER A1017 6.129 52.751 13.282 1.00 0.00 H ATOM 617 H SER A1017 7.172 51.883 14.716 1.00 0.00 H ATOM 618 N GLU A1018 6.117 53.062 17.763 1.00 28.20 N ATOM 619 CA GLU A1018 5.812 53.153 19.195 1.00 29.90 C ATOM 620 C GLU A1018 7.054 53.426 20.061 1.00 34.34 C ATOM 621 O GLU A1018 6.952 54.071 21.094 1.00 36.60 O ATOM 622 CB GLU A1018 5.058 51.909 19.674 1.00 31.82 C ATOM 623 CG GLU A1018 3.619 51.880 19.191 1.00 45.60 C ATOM 624 CD GLU A1018 2.850 50.577 19.324 1.00 66.30 C ATOM 625 OE1 GLU A1018 1.722 50.521 18.785 1.00 64.25 O ATOM 626 OE2 GLU A1018 3.359 49.617 19.950 1.00 57.09 O ATOM 627 H GLU A1018 5.937 52.161 17.275 1.00 0.00 H ATOM 628 N GLU A1019 8.219 52.962 19.617 1.00 28.68 N ATOM 629 CA GLU A1019 9.500 53.175 20.296 1.00 28.04 C ATOM 630 C GLU A1019 10.207 54.438 19.782 1.00 31.29 C ATOM 631 O GLU A1019 11.319 54.740 20.219 1.00 30.05 O ATOM 632 CB GLU A1019 10.420 51.973 20.055 1.00 27.92 C ATOM 633 CG GLU A1019 9.942 50.696 20.722 1.00 34.11 C ATOM 634 CD GLU A1019 10.758 49.470 20.390 1.00 41.42 C ATOM 635 OE1 GLU A1019 11.861 49.613 19.811 1.00 31.00 O ATOM 636 OE2 GLU A1019 10.293 48.360 20.732 1.00 33.38 O ATOM 637 H GLU A1019 8.221 52.414 18.733 1.00 0.00 H ATOM 638 N ASN A1020 9.600 55.138 18.819 1.00 28.38 N ATOM 639 CA ASN A1020 10.208 56.336 18.251 1.00 29.00 C ATOM 640 C ASN A1020 9.223 57.520 18.162 1.00 34.75 C ATOM 641 O ASN A1020 9.055 58.101 17.089 1.00 34.47 O ATOM 642 CB ASN A1020 10.838 56.020 16.882 1.00 23.64 C ATOM 643 CG ASN A1020 11.772 57.103 16.385 1.00 38.55 C ATOM 644 OD1 ASN A1020 12.580 57.651 17.122 1.00 33.32 O ATOM 645 ND2 ASN A1020 11.657 57.470 15.133 1.00 26.81 N ATOM 646 HD22 ASN A1020 10.967 56.998 14.514 1.00 0.00 H ATOM 647 HD21 ASN A1020 12.256 58.233 14.758 1.00 0.00 H ATOM 648 H ASN A1020 8.674 54.822 18.467 1.00 0.00 H ATOM 649 N HIS A1021 8.602 57.896 19.275 1.00 33.14 N ATOM 650 CA HIS A1021 7.647 59.016 19.368 1.00 34.50 C ATOM 651 C HIS A1021 6.603 58.980 18.236 1.00 36.69 C ATOM 652 O HIS A1021 6.413 59.981 17.537 1.00 35.45 O ATOM 653 CB HIS A1021 8.367 60.386 19.387 1.00 36.38 C ATOM 654 CG HIS A1021 9.605 60.450 20.230 1.00 39.88 C ATOM 655 ND1 HIS A1021 9.537 60.506 21.615 1.00 42.05 N ATOM 656 CD2 HIS A1021 10.905 60.526 19.849 1.00 41.11 C ATOM 657 CE1 HIS A1021 10.792 60.599 22.031 1.00 41.79 C ATOM 658 NE2 HIS A1021 11.651 60.610 21.004 1.00 41.48 N ATOM 659 H HIS A1021 8.804 57.361 20.144 1.00 0.00 H ATOM 660 N ASN A1022 5.973 57.802 18.032 1.00 32.22 N ATOM 661 CA ASN A1022 4.936 57.574 17.007 1.00 32.51 C ATOM 662 C ASN A1022 5.364 57.914 15.567 1.00 33.27 C ATOM 663 O ASN A1022 4.547 58.311 14.740 1.00 31.70 O ATOM 664 CB ASN A1022 3.584 58.206 17.405 1.00 39.53 C ATOM 665 CG ASN A1022 2.833 57.485 18.518 1.00 81.71 C ATOM 666 OD1 ASN A1022 3.346 56.601 19.218 1.00 73.78 O ATOM 667 ND2 ASN A1022 1.590 57.896 18.747 1.00 80.31 N ATOM 668 HD22 ASN A1022 1.170 58.639 18.153 1.00 0.00 H ATOM 669 HD21 ASN A1022 1.037 57.475 19.521 1.00 0.00 H ATOM 670 H ASN A1022 6.237 57.000 18.640 1.00 0.00 H ATOM 671 N HIS A1023 6.656 57.711 15.276 1.00 28.82 N ATOM 672 CA HIS A1023 7.248 57.998 13.987 1.00 27.89 C ATOM 673 C HIS A1023 8.099 56.829 13.517 1.00 28.74 C ATOM 674 O HIS A1023 9.131 56.522 14.118 1.00 27.45 O ATOM 675 CB HIS A1023 8.081 59.287 14.050 1.00 29.52 C ATOM 676 CG HIS A1023 8.597 59.734 12.716 1.00 32.45 C ATOM 677 ND1 HIS A1023 7.752 59.859 11.613 1.00 34.28 N ATOM 678 CD2 HIS A1023 9.842 60.129 12.360 1.00 33.60 C ATOM 679 CE1 HIS A1023 8.516 60.291 10.620 1.00 33.32 C ATOM 680 NE2 HIS A1023 9.781 60.471 11.020 1.00 33.47 N ATOM 681 H HIS A1023 7.270 57.324 16.021 1.00 0.00 H ATOM 682 N ALA A1024 7.674 56.203 12.412 1.00 23.90 N ATOM 683 CA ALA A1024 8.368 55.051 11.845 1.00 23.29 C ATOM 684 C ALA A1024 9.684 55.446 11.172 1.00 25.42 C ATOM 685 O ALA A1024 10.582 54.612 11.070 1.00 23.63 O ATOM 686 CB ALA A1024 7.462 54.368 10.823 1.00 23.73 C ATOM 687 H ALA A1024 6.816 56.551 11.939 1.00 0.00 H ATOM 688 N ASN A1025 9.790 56.717 10.720 1.00 23.43 N ATOM 689 CA ASN A1025 10.921 57.262 9.955 1.00 23.55 C ATOM 690 C ASN A1025 11.150 56.343 8.719 1.00 25.94 C ATOM 691 O ASN A1025 12.223 55.763 8.509 1.00 23.55 O ATOM 692 CB ASN A1025 12.192 57.429 10.826 1.00 23.04 C ATOM 693 CG ASN A1025 13.318 58.158 10.124 1.00 34.61 C ATOM 694 OD1 ASN A1025 13.106 58.872 9.148 1.00 30.42 O ATOM 695 ND2 ASN A1025 14.531 58.020 10.625 1.00 25.32 N ATOM 696 HD22 ASN A1025 14.685 57.409 11.453 1.00 0.00 H ATOM 697 HD21 ASN A1025 15.333 58.522 10.192 1.00 0.00 H ATOM 698 H ASN A1025 9.004 57.364 10.932 1.00 0.00 H ATOM 699 N GLU A1026 10.081 56.162 7.953 1.00 22.45 N ATOM 700 CA GLU A1026 10.106 55.321 6.761 1.00 21.40 C ATOM 701 C GLU A1026 10.677 56.075 5.564 1.00 24.81 C ATOM 702 O GLU A1026 10.374 57.240 5.383 1.00 24.78 O ATOM 703 CB GLU A1026 8.693 54.818 6.468 1.00 22.89 C ATOM 704 CG GLU A1026 8.585 53.852 5.313 1.00 28.13 C ATOM 705 CD GLU A1026 7.157 53.392 5.130 1.00 39.32 C ATOM 706 OE1 GLU A1026 6.797 52.312 5.651 1.00 28.64 O ATOM 707 OE2 GLU A1026 6.395 54.108 4.449 1.00 28.77 O ATOM 708 H GLU A1026 9.193 56.637 8.212 1.00 0.00 H ATOM 709 N ARG A1027 11.513 55.403 4.752 1.00 20.74 N ATOM 710 CA ARG A1027 12.085 55.991 3.543 1.00 20.92 C ATOM 711 C ARG A1027 11.994 55.007 2.390 1.00 23.76 C ATOM 712 O ARG A1027 12.036 53.802 2.626 1.00 20.91 O ATOM 713 CB ARG A1027 13.563 56.365 3.794 1.00 21.23 C ATOM 714 CG ARG A1027 13.703 57.714 4.514 1.00 29.53 C ATOM 715 CD ARG A1027 14.088 58.798 3.540 1.00 40.79 C ATOM 716 NE ARG A1027 15.512 59.069 3.673 1.00 44.53 N ATOM 717 CZ ARG A1027 16.352 59.278 2.674 1.00 47.32 C ATOM 718 NH1 ARG A1027 17.626 59.510 2.918 1.00 46.15 N ATOM 719 NH2 ARG A1027 15.921 59.279 1.420 1.00 33.97 N ATOM 720 HE ARG A1027 15.902 59.101 4.637 1.00 0.00 H ATOM 721 HH12 ARG A1027 18.285 59.674 2.130 1.00 0.00 H ATOM 722 HH11 ARG A1027 17.973 59.529 3.898 1.00 0.00 H ATOM 723 HH22 ARG A1027 16.589 59.444 0.641 1.00 0.00 H ATOM 724 HH21 ARG A1027 14.915 59.114 1.216 1.00 0.00 H ATOM 725 H ARG A1027 11.763 54.423 4.995 1.00 0.00 H ATOM 726 N MET A1028 11.850 55.508 1.149 1.00 21.12 N ATOM 727 CA MET A1028 11.907 54.646 -0.040 1.00 19.98 C ATOM 728 C MET A1028 13.382 54.643 -0.462 1.00 23.67 C ATOM 729 O MET A1028 13.942 55.706 -0.713 1.00 23.73 O ATOM 730 CB MET A1028 10.999 55.171 -1.171 1.00 22.19 C ATOM 731 CG MET A1028 9.503 55.050 -0.863 1.00 25.26 C ATOM 732 SD MET A1028 8.911 53.371 -0.490 1.00 26.93 S ATOM 733 CE MET A1028 9.383 52.467 -2.027 1.00 23.68 C ATOM 734 H MET A1028 11.695 56.529 1.029 1.00 0.00 H ATOM 735 N LEU A1029 14.037 53.486 -0.420 1.00 19.49 N ATOM 736 CA LEU A1029 15.471 53.382 -0.723 1.00 18.60 C ATOM 737 C LEU A1029 15.765 52.191 -1.653 1.00 22.23 C ATOM 738 O LEU A1029 15.020 51.207 -1.659 1.00 20.62 O ATOM 739 CB LEU A1029 16.285 53.231 0.595 1.00 17.97 C ATOM 740 CG LEU A1029 16.110 54.310 1.688 1.00 21.57 C ATOM 741 CD1 LEU A1029 16.686 53.841 3.018 1.00 20.72 C ATOM 742 CD2 LEU A1029 16.766 55.644 1.280 1.00 24.23 C ATOM 743 H LEU A1029 13.515 52.624 -0.163 1.00 0.00 H ATOM 744 N PHE A1030 16.881 52.262 -2.392 1.00 18.99 N ATOM 745 CA PHE A1030 17.296 51.211 -3.326 1.00 18.12 C ATOM 746 C PHE A1030 18.118 50.111 -2.691 1.00 21.27 C ATOM 747 O PHE A1030 18.881 50.358 -1.743 1.00 19.93 O ATOM 748 CB PHE A1030 18.068 51.799 -4.530 1.00 19.35 C ATOM 749 CG PHE A1030 17.282 52.812 -5.329 1.00 20.09 C ATOM 750 CD1 PHE A1030 16.414 52.405 -6.334 1.00 21.33 C ATOM 751 CD2 PHE A1030 17.412 54.176 -5.076 1.00 20.43 C ATOM 752 CE1 PHE A1030 15.688 53.347 -7.079 1.00 22.74 C ATOM 753 CE2 PHE A1030 16.679 55.114 -5.817 1.00 23.15 C ATOM 754 CZ PHE A1030 15.804 54.690 -6.797 1.00 21.15 C ATOM 755 H PHE A1030 17.483 53.105 -2.298 1.00 0.00 H ATOM 756 N HIS A1031 17.990 48.899 -3.246 1.00 17.93 N ATOM 757 CA HIS A1031 18.806 47.762 -2.833 1.00 17.06 C ATOM 758 C HIS A1031 19.201 46.954 -4.062 1.00 19.16 C ATOM 759 O HIS A1031 18.335 46.479 -4.795 1.00 17.92 O ATOM 760 CB HIS A1031 18.087 46.868 -1.811 1.00 17.60 C ATOM 761 CG HIS A1031 18.951 45.753 -1.297 1.00 20.09 C ATOM 762 ND1 HIS A1031 19.886 45.965 -0.287 1.00 21.79 N ATOM 763 CD2 HIS A1031 19.002 44.450 -1.675 1.00 21.11 C ATOM 764 CE1 HIS A1031 20.450 44.779 -0.062 1.00 20.55 C ATOM 765 NE2 HIS A1031 19.947 43.836 -0.869 1.00 20.93 N ATOM 766 H HIS A1031 17.284 48.763 -3.998 1.00 0.00 H ATOM 767 N GLY A1032 20.505 46.817 -4.275 1.00 16.67 N ATOM 768 CA GLY A1032 21.061 46.010 -5.354 1.00 17.15 C ATOM 769 C GLY A1032 21.590 44.722 -4.771 1.00 22.13 C ATOM 770 O GLY A1032 22.228 44.739 -3.712 1.00 23.57 O ATOM 771 H GLY A1032 21.163 47.311 -3.639 1.00 0.00 H ATOM 772 N SER A1033 21.312 43.594 -5.433 1.00 18.20 N ATOM 773 CA SER A1033 21.726 42.287 -4.971 1.00 17.94 C ATOM 774 C SER A1033 21.586 41.201 -6.023 1.00 24.16 C ATOM 775 O SER A1033 20.556 41.145 -6.687 1.00 23.84 O ATOM 776 CB SER A1033 20.869 41.881 -3.769 1.00 19.17 C ATOM 777 OG SER A1033 21.190 40.575 -3.326 1.00 25.60 O ATOM 778 HG SER A1033 20.621 40.342 -2.550 1.00 0.00 H ATOM 779 H SER A1033 20.774 43.659 -6.320 1.00 0.00 H ATOM 780 N PRO A1034 22.499 40.201 -6.067 1.00 23.80 N ATOM 781 CA PRO A1034 22.259 39.035 -6.951 1.00 24.45 C ATOM 782 C PRO A1034 21.111 38.151 -6.421 1.00 26.93 C ATOM 783 O PRO A1034 20.643 37.268 -7.137 1.00 24.80 O ATOM 784 CB PRO A1034 23.589 38.259 -6.895 1.00 26.94 C ATOM 785 CG PRO A1034 24.579 39.186 -6.231 1.00 30.69 C ATOM 786 CD PRO A1034 23.775 40.063 -5.335 1.00 25.57 C ATOM 787 N PHE A1035 20.637 38.409 -5.175 1.00 23.39 N ATOM 788 CA PHE A1035 19.599 37.601 -4.516 1.00 24.60 C ATOM 789 C PHE A1035 18.195 38.208 -4.498 1.00 27.34 C ATOM 790 O PHE A1035 17.383 37.844 -3.653 1.00 23.54 O ATOM 791 CB PHE A1035 20.072 37.190 -3.102 1.00 27.47 C ATOM 792 CG PHE A1035 21.459 36.590 -3.111 1.00 30.63 C ATOM 793 CD1 PHE A1035 21.672 35.295 -3.572 1.00 36.44 C ATOM 794 CD2 PHE A1035 22.557 37.335 -2.704 1.00 33.35 C ATOM 795 CE1 PHE A1035 22.965 34.755 -3.620 1.00 38.42 C ATOM 796 CE2 PHE A1035 23.845 36.792 -2.745 1.00 37.30 C ATOM 797 CZ PHE A1035 24.038 35.504 -3.197 1.00 36.85 C ATOM 798 H PHE A1035 21.029 39.222 -4.658 1.00 0.00 H ATOM 799 N VAL A1036 17.890 39.079 -5.455 1.00 26.54 N ATOM 800 CA VAL A1036 16.589 39.730 -5.564 1.00 28.15 C ATOM 801 C VAL A1036 15.398 38.794 -5.553 1.00 29.52 C ATOM 802 O VAL A1036 14.441 39.052 -4.922 1.00 26.73 O ATOM 803 CB VAL A1036 16.445 40.658 -6.790 1.00 34.98 C ATOM 804 CG1 VAL A1036 17.224 41.856 -6.652 1.00 34.57 C ATOM 805 CG2 VAL A1036 16.748 39.969 -8.003 1.00 36.31 C ATOM 806 H VAL A1036 18.617 39.308 -6.163 1.00 0.00 H ATOM 807 N ASN A1037 15.493 37.714 -6.283 1.00 27.75 N ATOM 808 CA ASN A1037 14.421 36.727 -6.347 1.00 29.12 C ATOM 809 C ASN A1037 14.124 36.036 -5.022 1.00 31.59 C ATOM 810 O ASN A1037 12.953 35.885 -4.675 1.00 32.00 O ATOM 811 CB ASN A1037 14.581 35.776 -7.540 1.00 36.86 C ATOM 812 CG ASN A1037 14.064 36.402 -8.818 1.00 70.03 C ATOM 813 OD1 ASN A1037 14.801 37.063 -9.564 1.00 63.77 O ATOM 814 ND2 ASN A1037 12.756 36.280 -9.062 1.00 65.74 N ATOM 815 HD22 ASN A1037 12.158 35.720 -8.422 1.00 0.00 H ATOM 816 HD21 ASN A1037 12.336 36.745 -9.892 1.00 0.00 H ATOM 817 H ASN A1037 16.360 37.553 -6.835 1.00 0.00 H ATOM 818 N ALA A1038 15.167 35.695 -4.242 1.00 27.38 N ATOM 819 CA ALA A1038 14.969 35.133 -2.911 1.00 27.65 C ATOM 820 C ALA A1038 14.357 36.210 -1.986 1.00 26.21 C ATOM 821 O ALA A1038 13.507 35.885 -1.162 1.00 26.07 O ATOM 822 CB ALA A1038 16.294 34.639 -2.332 1.00 29.03 C ATOM 823 H ALA A1038 16.135 35.835 -4.596 1.00 0.00 H ATOM 824 N ILE A1039 14.770 37.478 -2.142 1.00 20.59 N ATOM 825 CA ILE A1039 14.248 38.598 -1.329 1.00 20.16 C ATOM 826 C ILE A1039 12.736 38.815 -1.573 1.00 24.42 C ATOM 827 O ILE A1039 11.972 38.942 -0.618 1.00 21.87 O ATOM 828 CB ILE A1039 15.077 39.904 -1.504 1.00 21.71 C ATOM 829 CG1 ILE A1039 16.542 39.719 -1.019 1.00 21.70 C ATOM 830 CG2 ILE A1039 14.410 41.078 -0.762 1.00 20.87 C ATOM 831 CD1 ILE A1039 17.543 40.780 -1.500 1.00 24.53 C ATOM 832 H ILE A1039 15.488 37.682 -2.866 1.00 0.00 H ATOM 833 N ILE A1040 12.309 38.825 -2.843 1.00 22.54 N ATOM 834 CA ILE A1040 10.893 39.010 -3.185 1.00 24.06 C ATOM 835 C ILE A1040 9.983 37.912 -2.629 1.00 29.76 C ATOM 836 O ILE A1040 8.846 38.178 -2.242 1.00 30.77 O ATOM 837 CB ILE A1040 10.689 39.266 -4.701 1.00 28.32 C ATOM 838 CG1 ILE A1040 11.125 38.148 -5.608 1.00 31.03 C ATOM 839 CG2 ILE A1040 11.292 40.642 -5.093 1.00 27.77 C ATOM 840 CD1 ILE A1040 10.409 38.175 -6.990 1.00 42.51 C ATOM 841 H ILE A1040 13.001 38.698 -3.609 1.00 0.00 H ATOM 842 N HIS A1041 10.495 36.684 -2.585 1.00 27.69 N ATOM 843 CA HIS A1041 9.735 35.546 -2.093 1.00 29.73 C ATOM 844 C HIS A1041 9.837 35.345 -0.583 1.00 31.84 C ATOM 845 O HIS A1041 8.825 35.076 0.056 1.00 31.33 O ATOM 846 CB HIS A1041 10.135 34.275 -2.845 1.00 32.54 C ATOM 847 CG HIS A1041 9.719 34.297 -4.282 1.00 38.08 C ATOM 848 ND1 HIS A1041 10.552 34.804 -5.270 1.00 40.29 N ATOM 849 CD2 HIS A1041 8.564 33.878 -4.854 1.00 41.69 C ATOM 850 CE1 HIS A1041 9.878 34.678 -6.402 1.00 40.81 C ATOM 851 NE2 HIS A1041 8.678 34.119 -6.201 1.00 41.89 N ATOM 852 H HIS A1041 11.470 36.534 -2.913 1.00 0.00 H ATOM 853 N LYS A1042 11.039 35.490 -0.012 1.00 27.01 N ATOM 854 CA LYS A1042 11.264 35.219 1.408 1.00 26.49 C ATOM 855 C LYS A1042 11.486 36.445 2.288 1.00 27.00 C ATOM 856 O LYS A1042 11.480 36.307 3.498 1.00 25.49 O ATOM 857 CB LYS A1042 12.427 34.235 1.583 1.00 30.52 C ATOM 858 CG LYS A1042 12.291 32.931 0.792 1.00 40.63 C ATOM 859 CD LYS A1042 13.418 32.008 1.165 1.00 53.38 C ATOM 860 CE LYS A1042 13.794 31.056 0.057 1.00 60.11 C ATOM 861 NZ LYS A1042 15.217 31.225 -0.335 1.00 60.97 N ATOM 862 HZ1 LYS A1042 15.371 32.199 -0.666 1.00 0.00 H ATOM 863 HZ2 LYS A1042 15.826 31.037 0.487 1.00 0.00 H ATOM 864 HZ3 LYS A1042 15.447 30.557 -1.099 1.00 0.00 H ATOM 865 H LYS A1042 11.839 35.806 -0.597 1.00 0.00 H ATOM 866 N GLY A1043 11.700 37.611 1.684 1.00 22.50 N ATOM 867 CA GLY A1043 11.978 38.857 2.390 1.00 20.46 C ATOM 868 C GLY A1043 13.452 39.051 2.661 1.00 21.92 C ATOM 869 O GLY A1043 14.242 38.136 2.434 1.00 20.78 O ATOM 870 H GLY A1043 11.667 37.636 0.645 1.00 0.00 H ATOM 871 N PHE A1044 13.832 40.227 3.182 1.00 17.82 N ATOM 872 CA PHE A1044 15.222 40.506 3.560 1.00 17.16 C ATOM 873 C PHE A1044 15.546 39.650 4.758 1.00 22.57 C ATOM 874 O PHE A1044 14.669 39.386 5.583 1.00 23.23 O ATOM 875 CB PHE A1044 15.410 41.995 3.890 1.00 17.85 C ATOM 876 CG PHE A1044 15.416 42.853 2.648 1.00 18.01 C ATOM 877 CD1 PHE A1044 16.563 42.978 1.877 1.00 19.50 C ATOM 878 CD2 PHE A1044 14.263 43.483 2.217 1.00 18.82 C ATOM 879 CE1 PHE A1044 16.578 43.783 0.743 1.00 19.21 C ATOM 880 CE2 PHE A1044 14.284 44.312 1.092 1.00 20.36 C ATOM 881 CZ PHE A1044 15.441 44.447 0.361 1.00 17.87 C ATOM 882 H PHE A1044 13.116 40.968 3.323 1.00 0.00 H ATOM 883 N ASP A1045 16.767 39.140 4.807 1.00 19.38 N ATOM 884 CA ASP A1045 17.144 38.219 5.858 1.00 19.49 C ATOM 885 C ASP A1045 18.522 38.562 6.384 1.00 22.29 C ATOM 886 O ASP A1045 19.513 38.314 5.700 1.00 21.20 O ATOM 887 CB ASP A1045 17.067 36.767 5.312 1.00 21.57 C ATOM 888 CG ASP A1045 17.216 35.671 6.350 1.00 23.95 C ATOM 889 OD1 ASP A1045 17.507 35.998 7.520 1.00 23.62 O ATOM 890 OD2 ASP A1045 17.042 34.490 5.988 1.00 25.76 O ATOM 891 H ASP A1045 17.464 39.404 4.081 1.00 0.00 H ATOM 892 N GLU A1046 18.579 39.105 7.617 1.00 19.22 N ATOM 893 CA GLU A1046 19.832 39.490 8.294 1.00 19.18 C ATOM 894 C GLU A1046 20.775 38.312 8.545 1.00 22.10 C ATOM 895 O GLU A1046 21.974 38.528 8.746 1.00 20.67 O ATOM 896 CB GLU A1046 19.563 40.286 9.597 1.00 20.28 C ATOM 897 CG GLU A1046 19.058 39.465 10.776 1.00 23.25 C ATOM 898 CD GLU A1046 17.639 38.937 10.688 1.00 33.39 C ATOM 899 OE1 GLU A1046 17.327 37.936 11.374 1.00 29.83 O ATOM 900 OE2 GLU A1046 16.858 39.486 9.880 1.00 24.04 O ATOM 901 H GLU A1046 17.684 39.262 8.122 1.00 0.00 H ATOM 902 N ARG A1047 20.245 37.070 8.514 1.00 17.80 N ATOM 903 CA ARG A1047 21.065 35.872 8.704 1.00 18.83 C ATOM 904 C ARG A1047 22.073 35.691 7.569 1.00 25.11 C ATOM 905 O ARG A1047 23.081 35.015 7.763 1.00 25.20 O ATOM 906 CB ARG A1047 20.193 34.621 8.880 1.00 19.49 C ATOM 907 CG ARG A1047 19.289 34.675 10.139 1.00 20.84 C ATOM 908 CD ARG A1047 18.402 33.452 10.174 1.00 20.59 C ATOM 909 NE ARG A1047 17.344 33.559 9.156 1.00 23.46 N ATOM 910 CZ ARG A1047 16.318 32.720 9.022 1.00 33.96 C ATOM 911 NH1 ARG A1047 16.192 31.675 9.832 1.00 19.55 N ATOM 912 NH2 ARG A1047 15.411 32.920 8.078 1.00 27.85 N ATOM 913 HE ARG A1047 17.402 34.354 8.488 1.00 0.00 H ATOM 914 HH12 ARG A1047 15.388 31.025 9.721 1.00 0.00 H ATOM 915 HH11 ARG A1047 16.897 31.507 10.578 1.00 0.00 H ATOM 916 HH22 ARG A1047 14.612 32.262 7.977 1.00 0.00 H ATOM 917 HH21 ARG A1047 15.498 33.735 7.438 1.00 0.00 H ATOM 918 H ARG A1047 19.224 36.961 8.350 1.00 0.00 H ATOM 919 N HIS A1048 21.827 36.348 6.408 1.00 22.43 N ATOM 920 CA HIS A1048 22.729 36.350 5.254 1.00 24.07 C ATOM 921 C HIS A1048 23.733 37.490 5.323 1.00 32.98 C ATOM 922 O HIS A1048 24.602 37.592 4.457 1.00 34.70 O ATOM 923 CB HIS A1048 21.943 36.404 3.936 1.00 23.86 C ATOM 924 CG HIS A1048 21.190 35.154 3.668 1.00 26.72 C ATOM 925 ND1 HIS A1048 21.842 33.966 3.355 1.00 29.84 N ATOM 926 CD2 HIS A1048 19.860 34.935 3.693 1.00 28.25 C ATOM 927 CE1 HIS A1048 20.882 33.072 3.178 1.00 29.48 C ATOM 928 NE2 HIS A1048 19.674 33.605 3.396 1.00 29.36 N ATOM 929 H HIS A1048 20.940 36.885 6.332 1.00 0.00 H ATOM 930 N ALA A1049 23.629 38.332 6.363 1.00 32.04 N ATOM 931 CA ALA A1049 24.556 39.431 6.605 1.00 33.62 C ATOM 932 C ALA A1049 25.631 38.991 7.598 1.00 44.19 C ATOM 933 O ALA A1049 25.323 38.484 8.689 1.00 44.51 O ATOM 934 CB ALA A1049 23.808 40.645 7.138 1.00 33.47 C ATOM 935 H ALA A1049 22.845 38.193 7.032 1.00 0.00 H ATOM 936 N TYR A1050 26.887 39.194 7.224 1.00 45.89 N ATOM 937 CA TYR A1050 28.034 38.885 8.085 1.00 49.47 C ATOM 938 C TYR A1050 28.892 40.126 8.261 1.00 57.94 C ATOM 939 O TYR A1050 28.860 41.012 7.392 1.00 58.13 O ATOM 940 CB TYR A1050 28.866 37.722 7.520 1.00 51.99 C ATOM 941 CG TYR A1050 28.076 36.443 7.330 1.00 55.10 C ATOM 942 CD1 TYR A1050 27.874 35.558 8.388 1.00 56.27 C ATOM 943 CD2 TYR A1050 27.560 36.098 6.084 1.00 57.64 C ATOM 944 CE1 TYR A1050 27.151 34.379 8.215 1.00 57.59 C ATOM 945 CE2 TYR A1050 26.852 34.915 5.895 1.00 59.17 C ATOM 946 CZ TYR A1050 26.638 34.067 6.966 1.00 66.56 C ATOM 947 OH TYR A1050 25.950 32.902 6.762 1.00 70.45 O ATOM 948 HH TYR A1050 25.879 32.408 7.617 1.00 0.00 H ATOM 949 H TYR A1050 27.067 39.590 6.279 1.00 0.00 H ATOM 950 N ILE A1051 29.618 40.221 9.407 1.00 56.87 N ATOM 951 CA ILE A1051 30.493 41.369 9.682 1.00 58.13 C ATOM 952 C ILE A1051 31.394 41.546 8.468 1.00 63.37 C ATOM 953 O ILE A1051 32.214 40.683 8.142 1.00 65.25 O ATOM 954 CB ILE A1051 31.278 41.316 11.026 1.00 62.41 C ATOM 955 CG1 ILE A1051 30.381 40.926 12.244 1.00 62.39 C ATOM 956 CG2 ILE A1051 32.058 42.628 11.260 1.00 64.65 C ATOM 957 CD1 ILE A1051 29.489 42.049 12.913 1.00 66.14 C ATOM 958 H ILE A1051 29.552 39.458 10.110 1.00 0.00 H ATOM 959 N GLY A1052 31.104 42.613 7.754 1.00 57.99 N ATOM 960 CA GLY A1052 31.706 43.003 6.493 1.00 57.34 C ATOM 961 C GLY A1052 30.852 44.140 5.989 1.00 58.36 C ATOM 962 O GLY A1052 29.613 44.076 6.040 1.00 57.77 O ATOM 963 H GLY A1052 30.367 43.241 8.133 1.00 0.00 H ATOM 964 N GLY A1053 31.517 45.189 5.555 1.00 51.93 N ATOM 965 CA GLY A1053 30.862 46.424 5.167 1.00 49.19 C ATOM 966 C GLY A1053 31.130 47.395 6.292 1.00 46.33 C ATOM 967 O GLY A1053 31.368 46.974 7.429 1.00 45.38 O ATOM 968 H GLY A1053 32.553 45.131 5.487 1.00 0.00 H ATOM 969 N MET A1054 31.109 48.685 5.976 1.00 39.72 N ATOM 970 CA MET A1054 31.390 49.790 6.882 1.00 38.76 C ATOM 971 C MET A1054 30.672 49.708 8.220 1.00 33.62 C ATOM 972 O MET A1054 31.283 50.031 9.238 1.00 30.68 O ATOM 973 CB MET A1054 31.043 51.115 6.199 1.00 42.39 C ATOM 974 CG MET A1054 32.200 52.039 6.101 1.00 49.30 C ATOM 975 SD MET A1054 31.605 53.715 5.855 1.00 55.73 S ATOM 976 CE MET A1054 32.916 54.633 6.629 1.00 53.80 C ATOM 977 H MET A1054 30.870 48.928 4.993 1.00 0.00 H ATOM 978 N PHE A1055 29.375 49.324 8.221 1.00 26.56 N ATOM 979 CA PHE A1055 28.574 49.293 9.451 1.00 26.11 C ATOM 980 C PHE A1055 28.212 47.909 9.989 1.00 27.37 C ATOM 981 O PHE A1055 27.184 47.754 10.659 1.00 25.87 O ATOM 982 CB PHE A1055 27.363 50.237 9.356 1.00 27.60 C ATOM 983 CG PHE A1055 27.763 51.610 8.876 1.00 30.20 C ATOM 984 CD1 PHE A1055 28.435 52.493 9.722 1.00 33.90 C ATOM 985 CD2 PHE A1055 27.540 51.994 7.555 1.00 30.59 C ATOM 986 CE1 PHE A1055 28.851 53.750 9.261 1.00 35.55 C ATOM 987 CE2 PHE A1055 27.952 53.255 7.097 1.00 34.52 C ATOM 988 CZ PHE A1055 28.622 54.112 7.946 1.00 33.82 C ATOM 989 H PHE A1055 28.932 49.042 7.323 1.00 0.00 H ATOM 990 N GLY A1056 29.074 46.934 9.714 1.00 22.05 N ATOM 991 CA GLY A1056 28.907 45.568 10.192 1.00 21.12 C ATOM 992 C GLY A1056 27.831 44.743 9.507 1.00 24.68 C ATOM 993 O GLY A1056 27.498 44.971 8.342 1.00 22.51 O ATOM 994 H GLY A1056 29.906 47.157 9.131 1.00 0.00 H ATOM 995 N ALA A1057 27.270 43.784 10.256 1.00 23.06 N ATOM 996 CA ALA A1057 26.318 42.785 9.769 1.00 21.84 C ATOM 997 C ALA A1057 24.875 43.234 9.604 1.00 24.64 C ATOM 998 O ALA A1057 23.966 42.697 10.221 1.00 24.18 O ATOM 999 CB ALA A1057 26.404 41.537 10.631 1.00 22.49 C ATOM 1000 H ALA A1057 27.532 43.747 11.262 1.00 0.00 H ATOM 1001 N GLY A1058 24.670 44.191 8.718 1.00 20.83 N ATOM 1002 CA GLY A1058 23.337 44.683 8.418 1.00 19.66 C ATOM 1003 C GLY A1058 22.947 44.503 6.967 1.00 21.94 C ATOM 1004 O GLY A1058 23.666 43.874 6.179 1.00 20.65 O ATOM 1005 H GLY A1058 25.485 44.604 8.221 1.00 0.00 H ATOM 1006 N ILE A1059 21.780 45.019 6.632 1.00 19.09 N ATOM 1007 CA ILE A1059 21.186 45.022 5.287 1.00 18.40 C ATOM 1008 C ILE A1059 21.281 46.492 4.885 1.00 22.07 C ATOM 1009 O ILE A1059 20.810 47.374 5.612 1.00 20.67 O ATOM 1010 CB ILE A1059 19.734 44.472 5.268 1.00 20.72 C ATOM 1011 CG1 ILE A1059 19.668 43.076 5.966 1.00 21.59 C ATOM 1012 CG2 ILE A1059 19.209 44.406 3.818 1.00 20.93 C ATOM 1013 CD1 ILE A1059 18.326 42.644 6.451 1.00 25.69 C ATOM 1014 H ILE A1059 21.228 45.466 7.391 1.00 0.00 H ATOM 1015 N TYR A1060 21.979 46.742 3.781 1.00 18.38 N ATOM 1016 CA TYR A1060 22.324 48.066 3.312 1.00 18.48 C ATOM 1017 C TYR A1060 21.444 48.561 2.204 1.00 20.23 C ATOM 1018 O TYR A1060 21.130 47.819 1.279 1.00 19.50 O ATOM 1019 CB TYR A1060 23.793 48.089 2.844 1.00 19.31 C ATOM 1020 CG TYR A1060 24.819 47.893 3.935 1.00 20.81 C ATOM 1021 CD1 TYR A1060 24.948 46.669 4.588 1.00 20.87 C ATOM 1022 CD2 TYR A1060 25.725 48.899 4.252 1.00 22.43 C ATOM 1023 CE1 TYR A1060 25.910 46.476 5.578 1.00 21.68 C ATOM 1024 CE2 TYR A1060 26.712 48.709 5.218 1.00 23.48 C ATOM 1025 CZ TYR A1060 26.795 47.499 5.884 1.00 27.17 C ATOM 1026 OH TYR A1060 27.761 47.319 6.840 1.00 26.04 O ATOM 1027 HH TYR A1060 27.685 46.407 7.217 1.00 0.00 H ATOM 1028 H TYR A1060 22.299 45.930 3.216 1.00 0.00 H ATOM 1029 N PHE A1061 21.114 49.861 2.262 1.00 16.73 N ATOM 1030 CA PHE A1061 20.290 50.529 1.256 1.00 16.07 C ATOM 1031 C PHE A1061 20.933 51.856 0.864 1.00 22.21 C ATOM 1032 O PHE A1061 21.717 52.419 1.626 1.00 22.91 O ATOM 1033 CB PHE A1061 18.861 50.764 1.790 1.00 17.03 C ATOM 1034 CG PHE A1061 18.122 49.486 2.132 1.00 17.37 C ATOM 1035 CD1 PHE A1061 18.282 48.884 3.373 1.00 17.33 C ATOM 1036 CD2 PHE A1061 17.289 48.876 1.202 1.00 18.37 C ATOM 1037 CE1 PHE A1061 17.655 47.668 3.669 1.00 19.67 C ATOM 1038 CE2 PHE A1061 16.628 47.681 1.514 1.00 18.19 C ATOM 1039 CZ PHE A1061 16.822 47.081 2.747 1.00 16.74 C ATOM 1040 H PHE A1061 21.463 50.422 3.065 1.00 0.00 H ATOM 1041 N ALA A1062 20.597 52.355 -0.319 1.00 19.29 N ATOM 1042 CA ALA A1062 21.119 53.621 -0.799 1.00 19.46 C ATOM 1043 C ALA A1062 19.976 54.536 -1.238 1.00 21.59 C ATOM 1044 O ALA A1062 18.943 54.056 -1.694 1.00 19.47 O ATOM 1045 CB ALA A1062 22.062 53.367 -1.976 1.00 20.17 C ATOM 1046 H ALA A1062 19.938 51.821 -0.921 1.00 0.00 H ATOM 1047 N GLU A1063 20.174 55.856 -1.148 1.00 18.58 N ATOM 1048 CA GLU A1063 19.179 56.780 -1.678 1.00 19.50 C ATOM 1049 C GLU A1063 19.545 57.115 -3.149 1.00 23.88 C ATOM 1050 O GLU A1063 18.773 57.770 -3.831 1.00 24.94 O ATOM 1051 CB GLU A1063 19.061 58.054 -0.812 1.00 21.58 C ATOM 1052 CG GLU A1063 20.318 58.905 -0.759 1.00 26.66 C ATOM 1053 CD GLU A1063 20.228 60.130 0.133 1.00 45.47 C ATOM 1054 OE1 GLU A1063 19.180 60.326 0.792 1.00 38.64 O ATOM 1055 OE2 GLU A1063 21.215 60.897 0.177 1.00 29.25 O ATOM 1056 H GLU A1063 21.038 56.223 -0.700 1.00 0.00 H ATOM 1057 N ASN A1064 20.733 56.673 -3.613 1.00 19.49 N ATOM 1058 CA ASN A1064 21.206 56.873 -4.988 1.00 19.98 C ATOM 1059 C ASN A1064 21.137 55.538 -5.720 1.00 23.90 C ATOM 1060 O ASN A1064 21.822 54.594 -5.326 1.00 22.11 O ATOM 1061 CB ASN A1064 22.645 57.424 -4.994 1.00 20.81 C ATOM 1062 CG ASN A1064 22.749 58.750 -4.295 1.00 32.19 C ATOM 1063 OD1 ASN A1064 23.134 58.824 -3.124 1.00 22.45 O ATOM 1064 ND2 ASN A1064 22.325 59.819 -4.973 1.00 24.50 N ATOM 1065 HD22 ASN A1064 22.008 59.718 -5.958 1.00 0.00 H ATOM 1066 HD21 ASN A1064 22.312 60.753 -4.516 1.00 0.00 H ATOM 1067 H ASN A1064 21.352 56.158 -2.955 1.00 0.00 H ATOM 1068 N SER A1065 20.289 55.445 -6.773 1.00 21.83 N ATOM 1069 CA SER A1065 20.108 54.200 -7.547 1.00 20.11 C ATOM 1070 C SER A1065 21.450 53.677 -8.092 1.00 20.62 C ATOM 1071 O SER A1065 21.671 52.475 -8.101 1.00 18.47 O ATOM 1072 CB SER A1065 19.123 54.423 -8.699 1.00 22.43 C ATOM 1073 OG SER A1065 19.697 55.311 -9.645 1.00 22.81 O ATOM 1074 HG SER A1065 19.060 55.455 -10.389 1.00 0.00 H ATOM 1075 H SER A1065 19.742 56.286 -7.048 1.00 0.00 H ATOM 1076 N SER A1066 22.326 54.589 -8.547 1.00 18.38 N ATOM 1077 CA SER A1066 23.643 54.232 -9.099 1.00 19.18 C ATOM 1078 C SER A1066 24.587 53.578 -8.070 1.00 22.59 C ATOM 1079 O SER A1066 25.413 52.744 -8.451 1.00 22.49 O ATOM 1080 CB SER A1066 24.282 55.418 -9.819 1.00 20.79 C ATOM 1081 OG SER A1066 24.429 56.515 -8.933 1.00 25.01 O ATOM 1082 HG SER A1066 25.006 56.249 -8.174 1.00 0.00 H ATOM 1083 H SER A1066 22.061 55.594 -8.507 1.00 0.00 H ATOM 1084 N LYS A1067 24.433 53.901 -6.805 1.00 19.06 N ATOM 1085 CA LYS A1067 25.154 53.229 -5.748 1.00 17.55 C ATOM 1086 C LYS A1067 24.705 51.780 -5.618 1.00 20.99 C ATOM 1087 O LYS A1067 25.524 50.915 -5.609 1.00 20.12 O ATOM 1088 CB LYS A1067 24.997 53.958 -4.428 1.00 20.18 C ATOM 1089 CG LYS A1067 25.858 53.449 -3.338 1.00 20.73 C ATOM 1090 CD LYS A1067 25.880 54.307 -2.136 1.00 23.23 C ATOM 1091 CE LYS A1067 26.768 53.659 -1.139 1.00 35.08 C ATOM 1092 NZ LYS A1067 27.112 54.471 -0.003 1.00 57.62 N ATOM 1093 HZ1 LYS A1067 27.606 55.327 -0.327 1.00 0.00 H ATOM 1094 HZ2 LYS A1067 26.245 54.741 0.504 1.00 0.00 H ATOM 1095 HZ3 LYS A1067 27.733 53.931 0.633 1.00 0.00 H ATOM 1096 H LYS A1067 23.771 54.664 -6.557 1.00 0.00 H ATOM 1097 N SER A1068 23.395 51.552 -5.521 1.00 18.05 N ATOM 1098 CA SER A1068 22.816 50.197 -5.456 1.00 17.03 C ATOM 1099 C SER A1068 23.149 49.378 -6.690 1.00 20.92 C ATOM 1100 O SER A1068 23.340 48.162 -6.584 1.00 19.04 O ATOM 1101 CB SER A1068 21.309 50.265 -5.249 1.00 18.04 C ATOM 1102 OG SER A1068 21.083 50.644 -3.893 1.00 22.47 O ATOM 1103 HG SER A1068 21.487 49.969 -3.291 1.00 0.00 H ATOM 1104 H SER A1068 22.751 52.368 -5.490 1.00 0.00 H ATOM 1105 N ASN A1069 23.256 50.052 -7.863 1.00 17.90 N ATOM 1106 CA ASN A1069 23.633 49.406 -9.128 1.00 17.39 C ATOM 1107 C ASN A1069 25.033 48.748 -9.047 1.00 21.98 C ATOM 1108 O ASN A1069 25.274 47.726 -9.697 1.00 22.21 O ATOM 1109 CB ASN A1069 23.557 50.413 -10.269 1.00 16.93 C ATOM 1110 CG ASN A1069 24.013 49.855 -11.588 1.00 27.41 C ATOM 1111 OD1 ASN A1069 23.397 48.954 -12.159 1.00 23.72 O ATOM 1112 ND2 ASN A1069 25.178 50.286 -12.015 1.00 20.73 N ATOM 1113 HD22 ASN A1069 25.668 51.049 -11.506 1.00 0.00 H ATOM 1114 HD21 ASN A1069 25.610 49.864 -12.862 1.00 0.00 H ATOM 1115 H ASN A1069 23.062 51.074 -7.867 1.00 0.00 H ATOM 1116 N GLN A1070 25.929 49.301 -8.212 1.00 19.34 N ATOM 1117 CA GLN A1070 27.289 48.773 -7.988 1.00 19.73 C ATOM 1118 C GLN A1070 27.278 47.401 -7.271 1.00 23.99 C ATOM 1119 O GLN A1070 28.311 46.748 -7.215 1.00 24.99 O ATOM 1120 CB GLN A1070 28.115 49.745 -7.130 1.00 20.11 C ATOM 1121 CG GLN A1070 28.407 51.096 -7.786 1.00 21.29 C ATOM 1122 CD GLN A1070 29.243 51.954 -6.874 1.00 31.76 C ATOM 1123 OE1 GLN A1070 28.941 52.124 -5.686 1.00 31.90 O ATOM 1124 NE2 GLN A1070 30.319 52.511 -7.405 1.00 27.96 N ATOM 1125 HE22 GLN A1070 30.547 52.350 -8.407 1.00 0.00 H ATOM 1126 HE21 GLN A1070 30.937 53.110 -6.821 1.00 0.00 H ATOM 1127 H GLN A1070 25.646 50.155 -7.691 1.00 0.00 H ATOM 1128 N TYR A1071 26.122 46.983 -6.716 1.00 20.21 N ATOM 1129 CA TYR A1071 25.981 45.730 -5.968 1.00 19.26 C ATOM 1130 C TYR A1071 25.142 44.658 -6.637 1.00 23.04 C ATOM 1131 O TYR A1071 25.047 43.550 -6.096 1.00 22.48 O ATOM 1132 CB TYR A1071 25.439 46.026 -4.562 1.00 19.55 C ATOM 1133 CG TYR A1071 26.431 46.771 -3.702 1.00 20.67 C ATOM 1134 CD1 TYR A1071 27.369 46.087 -2.935 1.00 23.05 C ATOM 1135 CD2 TYR A1071 26.456 48.164 -3.677 1.00 21.13 C ATOM 1136 CE1 TYR A1071 28.293 46.767 -2.147 1.00 25.11 C ATOM 1137 CE2 TYR A1071 27.397 48.855 -2.910 1.00 23.13 C ATOM 1138 CZ TYR A1071 28.300 48.149 -2.132 1.00 28.84 C ATOM 1139 OH TYR A1071 29.232 48.799 -1.358 1.00 29.27 O ATOM 1140 HH TYR A1071 29.812 49.353 -1.938 1.00 0.00 H ATOM 1141 H TYR A1071 25.281 47.585 -6.825 1.00 0.00 H ATOM 1142 N VAL A1072 24.514 44.974 -7.786 1.00 20.56 N ATOM 1143 CA VAL A1072 23.639 44.023 -8.488 1.00 21.07 C ATOM 1144 C VAL A1072 24.331 42.706 -8.842 1.00 23.08 C ATOM 1145 O VAL A1072 23.725 41.652 -8.699 1.00 20.22 O ATOM 1146 CB VAL A1072 22.804 44.608 -9.672 1.00 26.18 C ATOM 1147 CG1 VAL A1072 22.008 45.822 -9.237 1.00 24.73 C ATOM 1148 CG2 VAL A1072 23.647 44.911 -10.879 1.00 27.37 C ATOM 1149 H VAL A1072 24.653 45.922 -8.190 1.00 0.00 H ATOM 1150 N TYR A1073 25.593 42.770 -9.290 1.00 21.10 N ATOM 1151 CA TYR A1073 26.325 41.561 -9.665 1.00 21.04 C ATOM 1152 C TYR A1073 27.305 41.053 -8.575 1.00 24.85 C ATOM 1153 O TYR A1073 28.076 40.129 -8.821 1.00 24.04 O ATOM 1154 CB TYR A1073 27.023 41.781 -11.021 1.00 22.47 C ATOM 1155 CG TYR A1073 26.068 41.927 -12.192 1.00 21.68 C ATOM 1156 CD1 TYR A1073 25.063 40.987 -12.425 1.00 23.88 C ATOM 1157 CD2 TYR A1073 26.218 42.959 -13.113 1.00 21.86 C ATOM 1158 CE1 TYR A1073 24.193 41.108 -13.519 1.00 24.28 C ATOM 1159 CE2 TYR A1073 25.375 43.074 -14.223 1.00 22.17 C ATOM 1160 CZ TYR A1073 24.360 42.149 -14.418 1.00 27.87 C ATOM 1161 OH TYR A1073 23.549 42.247 -15.523 1.00 30.32 O ATOM 1162 HH TYR A1073 22.883 41.514 -15.508 1.00 0.00 H ATOM 1163 H TYR A1073 26.060 43.696 -9.372 1.00 0.00 H ATOM 1164 N GLY A1074 27.214 41.624 -7.378 1.00 22.09 N ATOM 1165 CA GLY A1074 28.063 41.267 -6.250 1.00 23.22 C ATOM 1166 C GLY A1074 28.780 42.461 -5.662 1.00 28.03 C ATOM 1167 O GLY A1074 28.574 43.591 -6.113 1.00 26.25 O ATOM 1168 H GLY A1074 26.498 42.366 -7.240 1.00 0.00 H ATOM 1169 N ILE A1075 29.608 42.225 -4.638 1.00 28.56 N ATOM 1170 CA ILE A1075 30.379 43.282 -3.966 1.00 29.53 C ATOM 1171 C ILE A1075 31.394 43.828 -4.965 1.00 32.28 C ATOM 1172 O ILE A1075 32.111 43.050 -5.615 1.00 32.50 O ATOM 1173 CB ILE A1075 31.033 42.790 -2.638 1.00 33.99 C ATOM 1174 CG1 ILE A1075 29.964 42.369 -1.613 1.00 34.69 C ATOM 1175 CG2 ILE A1075 31.982 43.842 -2.024 1.00 34.46 C ATOM 1176 CD1 ILE A1075 29.946 40.979 -1.390 1.00 49.69 C ATOM 1177 H ILE A1075 29.712 41.247 -4.301 1.00 0.00 H ATOM 1178 N GLY A1076 31.387 45.153 -5.137 1.00 26.86 N ATOM 1179 CA GLY A1076 32.250 45.826 -6.110 1.00 26.22 C ATOM 1180 C GLY A1076 31.897 45.431 -7.535 1.00 27.34 C ATOM 1181 O GLY A1076 32.726 45.547 -8.438 1.00 27.49 O ATOM 1182 H GLY A1076 30.744 45.729 -4.557 1.00 0.00 H ATOM 1183 N GLY A1077 30.663 44.958 -7.725 1.00 22.29 N ATOM 1184 CA GLY A1077 30.149 44.517 -9.021 1.00 22.77 C ATOM 1185 C GLY A1077 30.509 43.090 -9.392 1.00 27.55 C ATOM 1186 O GLY A1077 30.173 42.650 -10.491 1.00 27.18 O ATOM 1187 H GLY A1077 30.030 44.900 -6.902 1.00 0.00 H ATOM 1188 N GLY A1078 31.191 42.378 -8.478 1.00 25.19 N ATOM 1189 CA GLY A1078 31.648 41.006 -8.678 1.00 25.71 C ATOM 1190 C GLY A1078 32.433 40.891 -9.964 1.00 30.95 C ATOM 1191 O GLY A1078 33.296 41.731 -10.245 1.00 31.47 O ATOM 1192 H GLY A1078 31.407 42.835 -7.569 1.00 0.00 H ATOM 1193 N THR A1079 32.075 39.910 -10.792 1.00 28.40 N ATOM 1194 CA THR A1079 32.674 39.726 -12.123 1.00 28.99 C ATOM 1195 C THR A1079 31.702 40.191 -13.219 1.00 33.36 C ATOM 1196 O THR A1079 31.836 39.809 -14.373 1.00 33.26 O ATOM 1197 CB THR A1079 33.189 38.288 -12.301 1.00 40.94 C ATOM 1198 OG1 THR A1079 33.768 38.182 -13.591 1.00 55.02 O ATOM 1199 CG2 THR A1079 32.112 37.254 -12.133 1.00 35.51 C ATOM 1200 HG1 THR A1079 33.084 38.386 -14.276 1.00 0.00 H ATOM 1201 H THR A1079 31.338 39.244 -10.483 1.00 0.00 H ATOM 1202 N GLY A1080 30.730 41.012 -12.844 1.00 28.82 N ATOM 1203 CA GLY A1080 29.755 41.535 -13.791 1.00 26.92 C ATOM 1204 C GLY A1080 28.681 40.547 -14.172 1.00 29.40 C ATOM 1205 O GLY A1080 28.406 39.609 -13.423 1.00 28.15 O ATOM 1206 H GLY A1080 30.662 41.290 -11.844 1.00 0.00 H ATOM 1207 N CYS A1081 28.045 40.771 -15.334 1.00 27.06 N ATOM 1208 CA CYS A1081 26.938 39.934 -15.797 1.00 26.91 C ATOM 1209 C CYS A1081 27.333 38.444 -15.985 1.00 34.61 C ATOM 1210 O CYS A1081 28.466 38.166 -16.376 1.00 34.63 O ATOM 1211 CB CYS A1081 26.341 40.511 -17.071 1.00 25.43 C ATOM 1212 SG CYS A1081 27.452 40.409 -18.491 1.00 29.07 S ATOM 1213 H CYS A1081 28.351 41.569 -15.926 1.00 0.00 H ATOM 1214 N PRO A1082 26.419 37.482 -15.726 1.00 33.94 N ATOM 1215 CA PRO A1082 26.776 36.059 -15.913 1.00 35.56 C ATOM 1216 C PRO A1082 27.212 35.674 -17.328 1.00 42.05 C ATOM 1217 O PRO A1082 28.155 34.889 -17.469 1.00 43.38 O ATOM 1218 CB PRO A1082 25.503 35.308 -15.490 1.00 37.16 C ATOM 1219 CG PRO A1082 24.780 36.258 -14.606 1.00 41.00 C ATOM 1220 CD PRO A1082 25.050 37.622 -15.184 1.00 35.79 C ATOM 1221 N VAL A1083 26.560 36.233 -18.369 1.00 40.06 N ATOM 1222 CA VAL A1083 26.863 35.874 -19.752 1.00 41.29 C ATOM 1223 C VAL A1083 28.152 36.443 -20.350 1.00 42.52 C ATOM 1224 O VAL A1083 28.889 35.697 -21.008 1.00 43.05 O ATOM 1225 CB VAL A1083 25.656 35.918 -20.726 1.00 47.42 C ATOM 1226 CG1 VAL A1083 24.556 34.954 -20.289 1.00 47.68 C ATOM 1227 CG2 VAL A1083 25.099 37.300 -20.859 1.00 46.76 C ATOM 1228 H VAL A1083 25.821 36.940 -18.181 1.00 0.00 H ATOM 1229 N HIS A1084 28.432 37.745 -20.139 1.00 34.42 N ATOM 1230 CA HIS A1084 29.625 38.371 -20.721 1.00 33.40 C ATOM 1231 C HIS A1084 30.744 38.674 -19.725 1.00 35.80 C ATOM 1232 O HIS A1084 31.808 39.125 -20.147 1.00 36.97 O ATOM 1233 CB HIS A1084 29.242 39.666 -21.462 1.00 33.18 C ATOM 1234 CG HIS A1084 28.078 39.511 -22.388 1.00 35.61 C ATOM 1235 ND1 HIS A1084 26.802 39.830 -21.986 1.00 35.46 N ATOM 1236 CD2 HIS A1084 28.043 39.073 -23.668 1.00 37.56 C ATOM 1237 CE1 HIS A1084 26.025 39.577 -23.028 1.00 35.51 C ATOM 1238 NE2 HIS A1084 26.723 39.114 -24.060 1.00 36.91 N ATOM 1239 H HIS A1084 27.790 38.316 -19.553 1.00 0.00 H ATOM 1240 N LYS A1085 30.497 38.484 -18.417 1.00 31.64 N ATOM 1241 CA LYS A1085 31.454 38.788 -17.338 1.00 31.14 C ATOM 1242 C LYS A1085 31.919 40.255 -17.448 1.00 32.78 C ATOM 1243 O LYS A1085 33.103 40.574 -17.352 1.00 32.87 O ATOM 1244 CB LYS A1085 32.606 37.758 -17.283 1.00 34.56 C ATOM 1245 CG LYS A1085 32.103 36.357 -16.960 1.00 53.50 C ATOM 1246 CD LYS A1085 33.208 35.330 -16.842 1.00 67.40 C ATOM 1247 CE LYS A1085 32.688 33.921 -16.629 1.00 84.24 C ATOM 1248 NZ LYS A1085 31.842 33.805 -15.403 1.00 95.26 N ATOM 1249 HZ1 LYS A1085 32.404 34.070 -14.569 1.00 0.00 H ATOM 1250 HZ2 LYS A1085 31.023 34.441 -15.487 1.00 0.00 H ATOM 1251 HZ3 LYS A1085 31.512 32.824 -15.303 1.00 0.00 H ATOM 1252 H LYS A1085 29.570 38.097 -18.149 1.00 0.00 H ATOM 1253 N ASP A1086 30.948 41.141 -17.678 1.00 26.76 N ATOM 1254 CA ASP A1086 31.193 42.559 -17.883 1.00 25.36 C ATOM 1255 C ASP A1086 30.409 43.374 -16.852 1.00 27.70 C ATOM 1256 O ASP A1086 29.176 43.362 -16.849 1.00 25.12 O ATOM 1257 CB ASP A1086 30.826 42.930 -19.342 1.00 26.31 C ATOM 1258 CG ASP A1086 31.082 44.363 -19.778 1.00 32.01 C ATOM 1259 OD1 ASP A1086 31.569 45.167 -18.951 1.00 33.76 O ATOM 1260 OD2 ASP A1086 30.796 44.680 -20.937 1.00 35.80 O ATOM 1261 H ASP A1086 29.966 40.800 -17.712 1.00 0.00 H ATOM 1262 N ARG A1087 31.135 44.085 -15.970 1.00 25.42 N ATOM 1263 CA ARG A1087 30.522 44.958 -14.952 1.00 24.74 C ATOM 1264 C ARG A1087 29.827 46.145 -15.606 1.00 26.33 C ATOM 1265 O ARG A1087 28.893 46.702 -15.032 1.00 24.62 O ATOM 1266 CB ARG A1087 31.559 45.430 -13.925 1.00 25.03 C ATOM 1267 CG ARG A1087 31.881 44.378 -12.881 1.00 28.56 C ATOM 1268 CD ARG A1087 32.901 44.853 -11.841 1.00 31.21 C ATOM 1269 NE ARG A1087 34.152 45.234 -12.495 1.00 27.80 N ATOM 1270 CZ ARG A1087 35.158 44.401 -12.736 1.00 43.71 C ATOM 1271 NH1 ARG A1087 35.101 43.141 -12.316 1.00 31.88 N ATOM 1272 NH2 ARG A1087 36.224 44.817 -13.410 1.00 32.63 N ATOM 1273 HE ARG A1087 34.262 46.225 -12.792 1.00 0.00 H ATOM 1274 HH12 ARG A1087 35.891 42.493 -12.507 1.00 0.00 H ATOM 1275 HH11 ARG A1087 34.266 42.803 -11.796 1.00 0.00 H ATOM 1276 HH22 ARG A1087 37.010 44.162 -13.597 1.00 0.00 H ATOM 1277 HH21 ARG A1087 36.273 45.798 -13.751 1.00 0.00 H ATOM 1278 H ARG A1087 32.172 44.016 -16.008 1.00 0.00 H ATOM 1279 N SER A1088 30.249 46.489 -16.829 1.00 23.67 N ATOM 1280 CA SER A1088 29.649 47.582 -17.587 1.00 24.17 C ATOM 1281 C SER A1088 28.788 47.072 -18.738 1.00 26.87 C ATOM 1282 O SER A1088 28.636 47.785 -19.718 1.00 25.47 O ATOM 1283 CB SER A1088 30.718 48.540 -18.116 1.00 28.86 C ATOM 1284 OG SER A1088 30.070 49.742 -18.511 1.00 29.94 O ATOM 1285 HG SER A1088 29.408 49.541 -19.219 1.00 0.00 H ATOM 1286 H SER A1088 31.034 45.957 -17.255 1.00 0.00 H ATOM 1287 N CYS A1089 28.203 45.865 -18.619 1.00 24.43 N ATOM 1288 CA CYS A1089 27.364 45.318 -19.689 1.00 25.79 C ATOM 1289 C CYS A1089 26.177 46.211 -20.002 1.00 28.18 C ATOM 1290 O CYS A1089 25.460 46.596 -19.083 1.00 24.85 O ATOM 1291 CB CYS A1089 26.911 43.901 -19.365 1.00 25.90 C ATOM 1292 SG CYS A1089 26.264 43.010 -20.796 1.00 29.72 S ATOM 1293 H CYS A1089 28.349 45.310 -17.751 1.00 0.00 H ATOM 1294 N TYR A1090 25.990 46.555 -21.298 1.00 27.22 N ATOM 1295 CA TYR A1090 24.868 47.385 -21.749 1.00 27.35 C ATOM 1296 C TYR A1090 23.756 46.525 -22.341 1.00 31.58 C ATOM 1297 O TYR A1090 22.694 47.042 -22.686 1.00 32.48 O ATOM 1298 CB TYR A1090 25.345 48.409 -22.802 1.00 28.82 C ATOM 1299 CG TYR A1090 26.367 49.376 -22.257 1.00 29.44 C ATOM 1300 CD1 TYR A1090 26.026 50.298 -21.271 1.00 29.70 C ATOM 1301 CD2 TYR A1090 27.680 49.367 -22.721 1.00 31.21 C ATOM 1302 CE1 TYR A1090 26.965 51.182 -20.755 1.00 29.41 C ATOM 1303 CE2 TYR A1090 28.633 50.248 -22.208 1.00 32.21 C ATOM 1304 CZ TYR A1090 28.266 51.152 -21.223 1.00 31.97 C ATOM 1305 OH TYR A1090 29.171 52.038 -20.711 1.00 28.21 O ATOM 1306 HH TYR A1090 28.730 52.598 -20.024 1.00 0.00 H ATOM 1307 H TYR A1090 26.673 46.216 -22.005 1.00 0.00 H ATOM 1308 N ILE A1091 24.021 45.218 -22.475 1.00 27.64 N ATOM 1309 CA ILE A1091 23.134 44.234 -23.082 1.00 27.25 C ATOM 1310 C ILE A1091 22.255 43.542 -22.056 1.00 30.98 C ATOM 1311 O ILE A1091 21.035 43.552 -22.204 1.00 30.76 O ATOM 1312 CB ILE A1091 23.963 43.230 -23.946 1.00 29.99 C ATOM 1313 CG1 ILE A1091 24.729 43.974 -25.059 1.00 30.60 C ATOM 1314 CG2 ILE A1091 23.083 42.122 -24.536 1.00 30.27 C ATOM 1315 CD1 ILE A1091 26.055 43.286 -25.498 1.00 36.75 C ATOM 1316 H ILE A1091 24.936 44.878 -22.116 1.00 0.00 H ATOM 1317 N CYS A1092 22.868 42.941 -21.022 1.00 27.04 N ATOM 1318 CA CYS A1092 22.131 42.205 -20.004 1.00 26.85 C ATOM 1319 C CYS A1092 21.232 43.082 -19.158 1.00 29.96 C ATOM 1320 O CYS A1092 21.584 44.219 -18.821 1.00 28.62 O ATOM 1321 CB CYS A1092 23.056 41.336 -19.155 1.00 27.27 C ATOM 1322 SG CYS A1092 23.910 40.047 -20.110 1.00 32.05 S ATOM 1323 H CYS A1092 23.903 43.004 -20.946 1.00 0.00 H ATOM 1324 N HIS A1093 20.034 42.556 -18.883 1.00 25.79 N ATOM 1325 CA HIS A1093 19.023 43.236 -18.098 1.00 24.21 C ATOM 1326 C HIS A1093 19.343 43.049 -16.622 1.00 27.19 C ATOM 1327 O HIS A1093 19.606 41.930 -16.177 1.00 26.58 O ATOM 1328 CB HIS A1093 17.617 42.727 -18.457 1.00 24.61 C ATOM 1329 CG HIS A1093 17.260 42.894 -19.917 1.00 28.83 C ATOM 1330 ND1 HIS A1093 16.042 42.459 -20.413 1.00 30.45 N ATOM 1331 CD2 HIS A1093 17.963 43.461 -20.931 1.00 31.47 C ATOM 1332 CE1 HIS A1093 16.050 42.753 -21.706 1.00 30.90 C ATOM 1333 NE2 HIS A1093 17.190 43.347 -22.067 1.00 31.60 N ATOM 1334 H HIS A1093 19.816 41.608 -19.252 1.00 0.00 H ATOM 1335 N ARG A1094 19.367 44.161 -15.888 1.00 22.72 N ATOM 1336 CA ARG A1094 19.650 44.179 -14.449 1.00 20.99 C ATOM 1337 C ARG A1094 18.370 44.376 -13.679 1.00 23.51 C ATOM 1338 O ARG A1094 17.366 44.810 -14.243 1.00 23.74 O ATOM 1339 CB ARG A1094 20.650 45.297 -14.114 1.00 20.33 C ATOM 1340 CG ARG A1094 21.940 45.215 -14.907 1.00 25.55 C ATOM 1341 CD ARG A1094 22.806 46.448 -14.726 1.00 28.24 C ATOM 1342 NE ARG A1094 24.015 46.336 -15.544 1.00 24.13 N ATOM 1343 CZ ARG A1094 25.218 46.773 -15.179 1.00 28.87 C ATOM 1344 NH1 ARG A1094 25.383 47.385 -14.014 1.00 20.12 N ATOM 1345 NH2 ARG A1094 26.263 46.608 -15.980 1.00 21.46 N ATOM 1346 HE ARG A1094 23.928 45.883 -16.476 1.00 0.00 H ATOM 1347 HH12 ARG A1094 26.325 47.724 -13.734 1.00 0.00 H ATOM 1348 HH11 ARG A1094 24.570 47.525 -13.381 1.00 0.00 H ATOM 1349 HH22 ARG A1094 27.201 46.952 -15.689 1.00 0.00 H ATOM 1350 HH21 ARG A1094 26.145 46.135 -16.899 1.00 0.00 H ATOM 1351 H ARG A1094 19.174 45.066 -16.362 1.00 0.00 H ATOM 1352 N GLN A1095 18.392 44.030 -12.394 1.00 20.98 N ATOM 1353 CA GLN A1095 17.245 44.211 -11.524 1.00 21.31 C ATOM 1354 C GLN A1095 17.703 44.862 -10.231 1.00 25.77 C ATOM 1355 O GLN A1095 18.767 44.519 -9.704 1.00 24.09 O ATOM 1356 CB GLN A1095 16.519 42.881 -11.255 1.00 23.04 C ATOM 1357 CG GLN A1095 15.861 42.307 -12.516 1.00 33.23 C ATOM 1358 CD GLN A1095 14.918 41.173 -12.252 1.00 41.63 C ATOM 1359 OE1 GLN A1095 15.241 40.234 -11.542 1.00 31.89 O ATOM 1360 NE2 GLN A1095 13.748 41.214 -12.868 1.00 38.27 N ATOM 1361 HE22 GLN A1095 13.503 42.029 -13.466 1.00 0.00 H ATOM 1362 HE21 GLN A1095 13.073 40.431 -12.754 1.00 0.00 H ATOM 1363 H GLN A1095 19.261 43.616 -12.000 1.00 0.00 H ATOM 1364 N LEU A1096 16.919 45.825 -9.758 1.00 22.17 N ATOM 1365 CA LEU A1096 17.150 46.587 -8.528 1.00 22.03 C ATOM 1366 C LEU A1096 15.841 46.568 -7.766 1.00 21.77 C ATOM 1367 O LEU A1096 14.759 46.561 -8.381 1.00 19.50 O ATOM 1368 CB LEU A1096 17.451 48.077 -8.922 1.00 23.29 C ATOM 1369 CG LEU A1096 18.564 48.839 -8.200 1.00 30.95 C ATOM 1370 CD1 LEU A1096 19.779 48.017 -8.029 1.00 32.05 C ATOM 1371 CD2 LEU A1096 18.967 50.085 -8.949 1.00 33.96 C ATOM 1372 H LEU A1096 16.068 46.058 -10.308 1.00 0.00 H ATOM 1373 N LEU A1097 15.917 46.645 -6.437 1.00 18.12 N ATOM 1374 CA LEU A1097 14.699 46.771 -5.639 1.00 17.44 C ATOM 1375 C LEU A1097 14.568 48.203 -5.164 1.00 20.54 C ATOM 1376 O LEU A1097 15.573 48.825 -4.830 1.00 21.00 O ATOM 1377 CB LEU A1097 14.730 45.825 -4.428 1.00 17.06 C ATOM 1378 CG LEU A1097 14.676 44.310 -4.749 1.00 21.89 C ATOM 1379 CD1 LEU A1097 14.958 43.492 -3.508 1.00 22.52 C ATOM 1380 CD2 LEU A1097 13.346 43.917 -5.373 1.00 22.95 C ATOM 1381 H LEU A1097 16.845 46.615 -5.967 1.00 0.00 H ATOM 1382 N PHE A1098 13.345 48.729 -5.118 1.00 17.35 N ATOM 1383 CA PHE A1098 13.067 50.055 -4.578 1.00 17.53 C ATOM 1384 C PHE A1098 12.161 49.730 -3.418 1.00 22.49 C ATOM 1385 O PHE A1098 11.053 49.231 -3.618 1.00 21.60 O ATOM 1386 CB PHE A1098 12.441 51.011 -5.613 1.00 19.25 C ATOM 1387 CG PHE A1098 12.326 52.451 -5.146 1.00 20.86 C ATOM 1388 CD1 PHE A1098 13.392 53.081 -4.498 1.00 21.68 C ATOM 1389 CD2 PHE A1098 11.182 53.202 -5.423 1.00 23.70 C ATOM 1390 CE1 PHE A1098 13.310 54.429 -4.127 1.00 24.00 C ATOM 1391 CE2 PHE A1098 11.095 54.550 -5.034 1.00 26.27 C ATOM 1392 CZ PHE A1098 12.161 55.155 -4.401 1.00 23.42 C ATOM 1393 H PHE A1098 12.550 48.167 -5.485 1.00 0.00 H ATOM 1394 N CYS A1099 12.703 49.891 -2.202 1.00 20.36 N ATOM 1395 CA CYS A1099 12.132 49.401 -0.954 1.00 19.96 C ATOM 1396 C CYS A1099 11.582 50.400 0.010 1.00 22.15 C ATOM 1397 O CYS A1099 12.122 51.486 0.180 1.00 21.61 O ATOM 1398 CB CYS A1099 13.131 48.488 -0.244 1.00 19.74 C ATOM 1399 SG CYS A1099 13.965 47.301 -1.320 1.00 23.05 S ATOM 1400 H CYS A1099 13.604 50.407 -2.145 1.00 0.00 H ATOM 1401 N ARG A1100 10.607 49.933 0.775 1.00 18.89 N ATOM 1402 CA ARG A1100 10.064 50.677 1.893 1.00 19.73 C ATOM 1403 C ARG A1100 10.952 50.268 3.083 1.00 21.29 C ATOM 1404 O ARG A1100 11.094 49.077 3.357 1.00 19.38 O ATOM 1405 CB ARG A1100 8.612 50.259 2.108 1.00 21.84 C ATOM 1406 CG ARG A1100 7.750 51.421 2.465 1.00 34.14 C ATOM 1407 CD ARG A1100 6.324 50.985 2.522 1.00 39.09 C ATOM 1408 NE ARG A1100 5.612 51.381 1.310 1.00 41.46 N ATOM 1409 CZ ARG A1100 4.718 52.356 1.256 1.00 52.92 C ATOM 1410 NH1 ARG A1100 4.426 53.057 2.343 1.00 39.84 N ATOM 1411 NH2 ARG A1100 4.111 52.642 0.113 1.00 42.81 N ATOM 1412 HE ARG A1100 5.821 50.864 0.432 1.00 0.00 H ATOM 1413 HH12 ARG A1100 3.723 53.822 2.295 1.00 0.00 H ATOM 1414 HH11 ARG A1100 4.900 52.842 3.243 1.00 0.00 H ATOM 1415 HH22 ARG A1100 3.409 53.409 0.074 1.00 0.00 H ATOM 1416 HH21 ARG A1100 4.336 52.100 -0.745 1.00 0.00 H ATOM 1417 H ARG A1100 10.215 48.993 0.564 1.00 0.00 H ATOM 1418 N VAL A1101 11.660 51.224 3.693 1.00 18.14 N ATOM 1419 CA VAL A1101 12.586 50.890 4.799 1.00 17.40 C ATOM 1420 C VAL A1101 12.215 51.662 6.070 1.00 22.12 C ATOM 1421 O VAL A1101 12.113 52.883 6.020 1.00 22.61 O ATOM 1422 CB VAL A1101 14.080 51.136 4.400 1.00 19.62 C ATOM 1423 CG1 VAL A1101 15.032 50.707 5.522 1.00 18.64 C ATOM 1424 CG2 VAL A1101 14.433 50.428 3.072 1.00 18.83 C ATOM 1425 H VAL A1101 11.559 52.213 3.387 1.00 0.00 H ATOM 1426 N THR A1102 12.029 50.960 7.191 1.00 19.39 N ATOM 1427 CA THR A1102 11.734 51.596 8.482 1.00 19.83 C ATOM 1428 C THR A1102 13.070 51.884 9.162 1.00 22.77 C ATOM 1429 O THR A1102 13.782 50.960 9.527 1.00 21.01 O ATOM 1430 CB THR A1102 10.813 50.698 9.331 1.00 24.27 C ATOM 1431 OG1 THR A1102 9.533 50.663 8.717 1.00 21.88 O ATOM 1432 CG2 THR A1102 10.646 51.200 10.775 1.00 19.76 C ATOM 1433 HG1 THR A1102 9.617 50.295 7.802 1.00 0.00 H ATOM 1434 H THR A1102 12.096 49.923 7.148 1.00 0.00 H ATOM 1435 N LEU A1103 13.437 53.163 9.279 1.00 21.15 N ATOM 1436 CA LEU A1103 14.694 53.533 9.929 1.00 20.36 C ATOM 1437 C LEU A1103 14.546 53.745 11.435 1.00 23.07 C ATOM 1438 O LEU A1103 15.549 53.658 12.144 1.00 21.74 O ATOM 1439 CB LEU A1103 15.324 54.798 9.302 1.00 20.52 C ATOM 1440 CG LEU A1103 15.702 54.728 7.800 1.00 25.11 C ATOM 1441 CD1 LEU A1103 16.085 56.119 7.287 1.00 24.27 C ATOM 1442 CD2 LEU A1103 16.801 53.673 7.536 1.00 24.64 C ATOM 1443 H LEU A1103 12.818 53.909 8.901 1.00 0.00 H ATOM 1444 N GLY A1104 13.342 54.106 11.897 1.00 20.69 N ATOM 1445 CA GLY A1104 13.087 54.453 13.292 1.00 20.76 C ATOM 1446 C GLY A1104 14.058 55.496 13.785 1.00 24.83 C ATOM 1447 O GLY A1104 14.381 56.443 13.056 1.00 25.69 O ATOM 1448 H GLY A1104 12.547 54.141 11.227 1.00 0.00 H ATOM 1449 N LYS A1105 14.591 55.295 15.003 1.00 20.63 N ATOM 1450 CA LYS A1105 15.600 56.204 15.548 1.00 20.89 C ATOM 1451 C LYS A1105 16.918 55.735 14.944 1.00 23.49 C ATOM 1452 O LYS A1105 17.407 54.653 15.278 1.00 21.55 O ATOM 1453 CB LYS A1105 15.620 56.165 17.089 1.00 23.54 C ATOM 1454 CG LYS A1105 16.485 57.268 17.670 1.00 31.06 C ATOM 1455 CD LYS A1105 16.494 57.224 19.197 1.00 38.51 C ATOM 1456 CE LYS A1105 15.437 58.161 19.746 1.00 46.99 C ATOM 1457 NZ LYS A1105 15.621 59.591 19.259 1.00 39.40 N ATOM 1458 HZ1 LYS A1105 16.552 59.942 19.562 1.00 0.00 H ATOM 1459 HZ2 LYS A1105 15.563 59.613 18.221 1.00 0.00 H ATOM 1460 HZ3 LYS A1105 14.874 60.192 19.662 1.00 0.00 H ATOM 1461 H LYS A1105 14.281 54.479 15.568 1.00 0.00 H ATOM 1462 N SER A1106 17.401 56.475 13.949 1.00 21.17 N ATOM 1463 CA SER A1106 18.585 56.111 13.180 1.00 20.93 C ATOM 1464 C SER A1106 19.818 56.718 13.766 1.00 25.49 C ATOM 1465 O SER A1106 19.852 57.919 13.969 1.00 26.70 O ATOM 1466 CB SER A1106 18.430 56.537 11.719 1.00 22.86 C ATOM 1467 OG SER A1106 19.352 55.783 10.960 1.00 26.76 O ATOM 1468 HG SER A1106 19.153 54.819 11.064 1.00 0.00 H ATOM 1469 H SER A1106 16.908 57.359 13.707 1.00 0.00 H ATOM 1470 N PHE A1107 20.836 55.890 14.017 1.00 23.56 N ATOM 1471 CA PHE A1107 22.116 56.298 14.596 1.00 24.90 C ATOM 1472 C PHE A1107 22.986 56.873 13.492 1.00 28.26 C ATOM 1473 O PHE A1107 23.352 56.158 12.559 1.00 26.69 O ATOM 1474 CB PHE A1107 22.806 55.092 15.258 1.00 27.15 C ATOM 1475 CG PHE A1107 24.007 55.442 16.119 1.00 31.36 C ATOM 1476 CD1 PHE A1107 25.277 55.551 15.562 1.00 34.50 C ATOM 1477 CD2 PHE A1107 23.866 55.651 17.483 1.00 36.56 C ATOM 1478 CE1 PHE A1107 26.378 55.897 16.354 1.00 39.64 C ATOM 1479 CE2 PHE A1107 24.971 55.978 18.277 1.00 39.81 C ATOM 1480 CZ PHE A1107 26.219 56.109 17.706 1.00 39.06 C ATOM 1481 H PHE A1107 20.710 54.884 13.784 1.00 0.00 H ATOM 1482 N LEU A1108 23.284 58.174 13.566 1.00 26.51 N ATOM 1483 CA LEU A1108 24.089 58.873 12.555 1.00 27.81 C ATOM 1484 C LEU A1108 25.585 58.553 12.756 1.00 33.22 C ATOM 1485 O LEU A1108 26.110 58.751 13.850 1.00 34.37 O ATOM 1486 CB LEU A1108 23.826 60.380 12.702 1.00 29.39 C ATOM 1487 CG LEU A1108 22.804 61.081 11.794 1.00 35.78 C ATOM 1488 CD1 LEU A1108 21.518 60.244 11.492 1.00 36.23 C ATOM 1489 CD2 LEU A1108 22.439 62.471 12.371 1.00 37.59 C ATOM 1490 H LEU A1108 22.929 58.718 14.378 1.00 0.00 H ATOM 1491 N GLN A1109 26.252 58.028 11.726 1.00 29.46 N ATOM 1492 CA GLN A1109 27.658 57.635 11.812 1.00 31.12 C ATOM 1493 C GLN A1109 28.410 58.057 10.550 1.00 38.82 C ATOM 1494 O GLN A1109 27.852 58.004 9.450 1.00 37.16 O ATOM 1495 CB GLN A1109 27.749 56.109 12.057 1.00 31.82 C ATOM 1496 CG GLN A1109 29.129 55.554 12.439 1.00 46.29 C ATOM 1497 CD GLN A1109 29.670 55.950 13.802 1.00 65.08 C ATOM 1498 OE1 GLN A1109 28.993 56.548 14.653 1.00 60.35 O ATOM 1499 NE2 GLN A1109 30.935 55.631 14.026 1.00 53.82 N ATOM 1500 HE22 GLN A1109 31.482 55.130 13.297 1.00 0.00 H ATOM 1501 HE21 GLN A1109 31.382 55.882 14.931 1.00 0.00 H ATOM 1502 H GLN A1109 25.751 57.893 10.825 1.00 0.00 H ATOM 1503 N PHE A1110 29.670 58.478 10.709 1.00 39.89 N ATOM 1504 CA PHE A1110 30.498 58.929 9.585 1.00 42.33 C ATOM 1505 C PHE A1110 31.570 57.900 9.256 1.00 47.00 C ATOM 1506 O PHE A1110 31.809 57.614 8.086 1.00 47.26 O ATOM 1507 CB PHE A1110 31.121 60.321 9.876 1.00 46.72 C ATOM 1508 CG PHE A1110 30.097 61.428 9.990 1.00 49.89 C ATOM 1509 CD1 PHE A1110 29.345 61.589 11.151 1.00 53.72 C ATOM 1510 CD2 PHE A1110 29.841 62.273 8.918 1.00 54.75 C ATOM 1511 CE1 PHE A1110 28.367 62.587 11.242 1.00 57.57 C ATOM 1512 CE2 PHE A1110 28.880 63.286 9.017 1.00 56.82 C ATOM 1513 CZ PHE A1110 28.146 63.433 10.177 1.00 56.23 C ATOM 1514 H PHE A1110 30.078 58.486 11.666 1.00 0.00 H ATOM 1515 N SER A1111 32.193 57.330 10.291 1.00 43.43 N ATOM 1516 CA SER A1111 33.275 56.362 10.133 1.00 43.06 C ATOM 1517 C SER A1111 32.817 54.919 10.376 1.00 43.76 C ATOM 1518 O SER A1111 31.744 54.698 10.937 1.00 41.57 O ATOM 1519 CB SER A1111 34.447 56.732 11.037 1.00 47.72 C ATOM 1520 OG SER A1111 34.061 56.749 12.402 1.00 57.82 O ATOM 1521 HG SER A1111 34.841 56.992 12.961 1.00 0.00 H ATOM 1522 H SER A1111 31.894 57.587 11.253 1.00 0.00 H ATOM 1523 N ALA A1112 33.639 53.945 9.935 1.00 39.88 N ATOM 1524 CA ALA A1112 33.388 52.515 10.078 1.00 39.04 C ATOM 1525 C ALA A1112 33.089 52.144 11.536 1.00 43.78 C ATOM 1526 O ALA A1112 33.804 52.565 12.447 1.00 43.56 O ATOM 1527 CB ALA A1112 34.573 51.719 9.559 1.00 40.24 C ATOM 1528 H ALA A1112 34.516 54.235 9.458 1.00 0.00 H ATOM 1529 N MET A1113 31.996 51.402 11.747 1.00 39.78 N ATOM 1530 CA MET A1113 31.544 50.968 13.067 1.00 40.75 C ATOM 1531 C MET A1113 30.921 49.597 12.848 1.00 42.98 C ATOM 1532 O MET A1113 29.753 49.497 12.472 1.00 41.80 O ATOM 1533 CB MET A1113 30.519 51.984 13.620 1.00 44.11 C ATOM 1534 CG MET A1113 30.176 51.807 15.079 1.00 49.40 C ATOM 1535 SD MET A1113 28.948 53.017 15.670 1.00 55.84 S ATOM 1536 CE MET A1113 27.517 52.658 14.577 1.00 51.31 C ATOM 1537 H MET A1113 31.433 51.116 10.920 1.00 0.00 H ATOM 1538 N LYS A1114 31.722 48.544 13.022 1.00 39.88 N ATOM 1539 CA LYS A1114 31.277 47.177 12.780 1.00 39.09 C ATOM 1540 C LYS A1114 30.349 46.621 13.870 1.00 41.21 C ATOM 1541 O LYS A1114 30.790 46.043 14.860 1.00 43.31 O ATOM 1542 CB LYS A1114 32.444 46.253 12.389 1.00 42.93 C ATOM 1543 CG LYS A1114 32.957 46.552 10.980 1.00 63.70 C ATOM 1544 CD LYS A1114 34.163 45.715 10.593 1.00 76.70 C ATOM 1545 CE LYS A1114 34.630 46.048 9.194 1.00 89.71 C ATOM 1546 NZ LYS A1114 35.760 45.185 8.771 1.00100.20 N ATOM 1547 HZ1 LYS A1114 36.559 45.318 9.423 1.00 0.00 H ATOM 1548 HZ2 LYS A1114 35.459 44.190 8.787 1.00 0.00 H ATOM 1549 HZ3 LYS A1114 36.051 45.445 7.807 1.00 0.00 H ATOM 1550 H LYS A1114 32.699 48.704 13.342 1.00 0.00 H ATOM 1551 N MET A1115 29.055 46.849 13.678 1.00 34.43 N ATOM 1552 CA MET A1115 27.980 46.423 14.573 1.00 32.66 C ATOM 1553 C MET A1115 27.433 45.057 14.170 1.00 30.40 C ATOM 1554 O MET A1115 27.391 44.726 12.986 1.00 28.53 O ATOM 1555 CB MET A1115 26.771 47.378 14.449 1.00 35.27 C ATOM 1556 CG MET A1115 27.008 48.842 14.685 1.00 40.82 C ATOM 1557 SD MET A1115 27.685 49.270 16.288 1.00 46.92 S ATOM 1558 CE MET A1115 26.321 48.799 17.424 1.00 42.48 C ATOM 1559 H MET A1115 28.784 47.373 12.822 1.00 0.00 H ATOM 1560 N ALA A1116 26.880 44.334 15.151 1.00 24.52 N ATOM 1561 CA ALA A1116 26.146 43.099 14.900 1.00 22.59 C ATOM 1562 C ALA A1116 24.653 43.472 14.832 1.00 23.22 C ATOM 1563 O ALA A1116 23.889 42.892 14.057 1.00 21.83 O ATOM 1564 CB ALA A1116 26.376 42.126 16.040 1.00 23.24 C ATOM 1565 H ALA A1116 26.978 44.666 16.132 1.00 0.00 H ATOM 1566 N HIS A1117 24.244 44.462 15.643 1.00 18.86 N ATOM 1567 CA HIS A1117 22.855 44.906 15.782 1.00 17.73 C ATOM 1568 C HIS A1117 22.816 46.421 15.823 1.00 21.03 C ATOM 1569 O HIS A1117 23.864 47.050 15.924 1.00 21.10 O ATOM 1570 CB HIS A1117 22.291 44.344 17.117 1.00 17.77 C ATOM 1571 CG HIS A1117 22.450 42.854 17.236 1.00 19.90 C ATOM 1572 ND1 HIS A1117 21.733 41.986 16.429 1.00 20.12 N ATOM 1573 CD2 HIS A1117 23.273 42.132 18.026 1.00 20.61 C ATOM 1574 CE1 HIS A1117 22.135 40.770 16.757 1.00 19.65 C ATOM 1575 NE2 HIS A1117 23.064 40.805 17.705 1.00 20.65 N ATOM 1576 H HIS A1117 24.965 44.948 16.213 1.00 0.00 H ATOM 1577 N SER A1118 21.621 47.006 15.810 1.00 16.69 N ATOM 1578 CA SER A1118 21.473 48.458 15.957 1.00 17.59 C ATOM 1579 C SER A1118 22.111 48.905 17.268 1.00 23.82 C ATOM 1580 O SER A1118 22.057 48.163 18.254 1.00 22.92 O ATOM 1581 CB SER A1118 19.994 48.843 15.997 1.00 19.22 C ATOM 1582 OG SER A1118 19.381 48.622 14.744 1.00 26.40 O ATOM 1583 HG SER A1118 19.454 47.664 14.506 1.00 0.00 H ATOM 1584 H SER A1118 20.771 46.419 15.693 1.00 0.00 H ATOM 1585 N PRO A1119 22.664 50.135 17.350 1.00 22.90 N ATOM 1586 CA PRO A1119 23.150 50.610 18.646 1.00 23.21 C ATOM 1587 C PRO A1119 21.991 50.652 19.664 1.00 25.22 C ATOM 1588 O PRO A1119 20.834 50.761 19.237 1.00 21.47 O ATOM 1589 CB PRO A1119 23.662 52.022 18.327 1.00 25.68 C ATOM 1590 CG PRO A1119 23.975 51.978 16.867 1.00 29.28 C ATOM 1591 CD PRO A1119 22.863 51.161 16.305 1.00 24.75 C ATOM 1592 N PRO A1120 22.274 50.513 20.990 1.00 23.40 N ATOM 1593 CA PRO A1120 21.194 50.552 21.997 1.00 23.51 C ATOM 1594 C PRO A1120 20.240 51.738 21.813 1.00 25.48 C ATOM 1595 O PRO A1120 20.699 52.853 21.521 1.00 22.80 O ATOM 1596 CB PRO A1120 21.968 50.698 23.318 1.00 26.60 C ATOM 1597 CG PRO A1120 23.280 50.066 23.054 1.00 30.72 C ATOM 1598 CD PRO A1120 23.602 50.366 21.634 1.00 26.31 C ATOM 1599 N GLY A1121 18.944 51.488 21.965 1.00 21.75 N ATOM 1600 CA GLY A1121 17.904 52.504 21.797 1.00 22.17 C ATOM 1601 C GLY A1121 17.631 52.939 20.355 1.00 24.66 C ATOM 1602 O GLY A1121 16.815 53.836 20.124 1.00 24.76 O ATOM 1603 H GLY A1121 18.654 50.521 22.216 1.00 0.00 H ATOM 1604 N HIS A1122 18.323 52.338 19.368 1.00 20.76 N ATOM 1605 CA HIS A1122 18.177 52.707 17.958 1.00 19.41 C ATOM 1606 C HIS A1122 17.607 51.561 17.119 1.00 23.70 C ATOM 1607 O HIS A1122 17.553 50.423 17.596 1.00 23.84 O ATOM 1608 CB HIS A1122 19.513 53.247 17.395 1.00 20.17 C ATOM 1609 CG HIS A1122 19.955 54.536 18.029 1.00 24.53 C ATOM 1610 ND1 HIS A1122 20.456 54.569 19.310 1.00 26.06 N ATOM 1611 CD2 HIS A1122 19.962 55.796 17.526 1.00 26.29 C ATOM 1612 CE1 HIS A1122 20.728 55.843 19.560 1.00 26.80 C ATOM 1613 NE2 HIS A1122 20.461 56.613 18.509 1.00 27.04 N ATOM 1614 H HIS A1122 18.989 51.580 19.618 1.00 0.00 H ATOM 1615 N HIS A1123 17.165 51.860 15.883 1.00 19.98 N ATOM 1616 CA HIS A1123 16.529 50.883 14.988 1.00 18.77 C ATOM 1617 C HIS A1123 17.268 50.752 13.678 1.00 21.93 C ATOM 1618 O HIS A1123 16.925 49.907 12.857 1.00 20.99 O ATOM 1619 CB HIS A1123 15.055 51.295 14.731 1.00 19.16 C ATOM 1620 CG HIS A1123 14.299 51.563 15.995 1.00 22.48 C ATOM 1621 ND1 HIS A1123 14.075 52.852 16.438 1.00 25.08 N ATOM 1622 CD2 HIS A1123 13.769 50.695 16.888 1.00 23.73 C ATOM 1623 CE1 HIS A1123 13.407 52.733 17.580 1.00 25.08 C ATOM 1624 NE2 HIS A1123 13.198 51.459 17.892 1.00 24.98 N ATOM 1625 H HIS A1123 17.280 52.836 15.543 1.00 0.00 H ATOM 1626 N SER A1124 18.254 51.632 13.453 1.00 19.22 N ATOM 1627 CA SER A1124 19.063 51.613 12.236 1.00 18.32 C ATOM 1628 C SER A1124 20.285 52.487 12.404 1.00 22.22 C ATOM 1629 O SER A1124 20.459 53.150 13.435 1.00 21.92 O ATOM 1630 CB SER A1124 18.246 52.090 11.031 1.00 19.81 C ATOM 1631 OG SER A1124 17.870 53.448 11.182 1.00 24.20 O ATOM 1632 HG SER A1124 17.321 53.548 12.000 1.00 0.00 H ATOM 1633 H SER A1124 18.451 52.357 14.173 1.00 0.00 H ATOM 1634 N VAL A1125 21.136 52.463 11.382 1.00 19.89 N ATOM 1635 CA VAL A1125 22.340 53.262 11.272 1.00 21.10 C ATOM 1636 C VAL A1125 22.255 54.032 9.961 1.00 25.76 C ATOM 1637 O VAL A1125 21.981 53.435 8.913 1.00 24.58 O ATOM 1638 CB VAL A1125 23.651 52.404 11.356 1.00 25.32 C ATOM 1639 CG1 VAL A1125 24.887 53.230 10.964 1.00 26.13 C ATOM 1640 CG2 VAL A1125 23.845 51.798 12.750 1.00 24.84 C ATOM 1641 H VAL A1125 20.919 51.817 10.596 1.00 0.00 H ATOM 1642 N THR A1126 22.504 55.352 10.010 1.00 24.64 N ATOM 1643 CA THR A1126 22.620 56.165 8.799 1.00 24.00 C ATOM 1644 C THR A1126 24.087 56.531 8.643 1.00 28.93 C ATOM 1645 O THR A1126 24.652 57.208 9.511 1.00 28.60 O ATOM 1646 CB THR A1126 21.742 57.437 8.824 1.00 30.15 C ATOM 1647 OG1 THR A1126 20.358 57.059 8.816 1.00 25.02 O ATOM 1648 CG2 THR A1126 22.019 58.363 7.608 1.00 27.58 C ATOM 1649 HG1 THR A1126 19.795 57.873 8.832 1.00 0.00 H ATOM 1650 H THR A1126 22.618 55.809 10.937 1.00 0.00 H ATOM 1651 N GLY A1127 24.674 56.095 7.528 1.00 25.80 N ATOM 1652 CA GLY A1127 26.045 56.419 7.160 1.00 26.59 C ATOM 1653 C GLY A1127 26.013 57.704 6.363 1.00 32.55 C ATOM 1654 O GLY A1127 25.384 57.754 5.306 1.00 31.53 O ATOM 1655 H GLY A1127 24.122 55.491 6.886 1.00 0.00 H ATOM 1656 N ARG A1128 26.600 58.767 6.917 1.00 30.66 N ATOM 1657 CA ARG A1128 26.632 60.101 6.323 1.00 32.76 C ATOM 1658 C ARG A1128 27.961 60.342 5.561 1.00 36.28 C ATOM 1659 O ARG A1128 29.018 59.921 6.035 1.00 34.23 O ATOM 1660 CB ARG A1128 26.465 61.167 7.423 1.00 36.22 C ATOM 1661 CG ARG A1128 25.098 61.156 8.098 1.00 52.38 C ATOM 1662 CD ARG A1128 24.750 62.516 8.659 1.00 74.28 C ATOM 1663 NE ARG A1128 23.330 62.828 8.474 1.00 86.84 N ATOM 1664 CZ ARG A1128 22.712 63.871 9.022 1.00 99.74 C ATOM 1665 NH1 ARG A1128 23.377 64.708 9.811 1.00 83.48 N ATOM 1666 NH2 ARG A1128 21.419 64.074 8.800 1.00 85.51 N ATOM 1667 HE ARG A1128 22.768 62.191 7.874 1.00 0.00 H ATOM 1668 HH12 ARG A1128 22.888 65.521 10.236 1.00 0.00 H ATOM 1669 HH11 ARG A1128 24.387 64.550 10.003 1.00 0.00 H ATOM 1670 HH22 ARG A1128 20.939 64.890 9.230 1.00 0.00 H ATOM 1671 HH21 ARG A1128 20.886 63.417 8.196 1.00 0.00 H ATOM 1672 H ARG A1128 27.068 58.636 7.837 1.00 0.00 H ATOM 1673 N PRO A1129 27.928 61.030 4.400 1.00 36.29 N ATOM 1674 CA PRO A1129 29.187 61.310 3.672 1.00 37.67 C ATOM 1675 C PRO A1129 30.183 62.149 4.483 1.00 45.93 C ATOM 1676 O PRO A1129 29.764 63.046 5.225 1.00 46.00 O ATOM 1677 CB PRO A1129 28.717 62.026 2.393 1.00 39.50 C ATOM 1678 CG PRO A1129 27.247 61.771 2.308 1.00 42.21 C ATOM 1679 CD PRO A1129 26.760 61.600 3.697 1.00 37.48 C ATOM 1680 N SER A1130 31.492 61.787 4.416 1.00 44.68 N ATOM 1681 CA SER A1130 32.603 62.489 5.093 1.00 47.06 C ATOM 1682 C SER A1130 33.909 62.432 4.266 1.00 55.69 C ATOM 1683 O SER A1130 34.084 61.524 3.447 1.00 55.07 O ATOM 1684 CB SER A1130 32.816 61.979 6.521 1.00 48.95 C ATOM 1685 OG SER A1130 33.685 60.860 6.611 1.00 50.51 O ATOM 1686 HG SER A1130 33.774 60.588 7.559 1.00 0.00 H ATOM 1687 H SER A1130 31.730 60.952 3.844 1.00 0.00 H ATOM 1688 N VAL A1131 34.811 63.417 4.475 1.00 56.24 N ATOM 1689 CA VAL A1131 36.088 63.577 3.758 1.00 58.02 C ATOM 1690 C VAL A1131 36.861 62.267 3.473 1.00 62.62 C ATOM 1691 O VAL A1131 37.050 61.923 2.304 1.00 62.34 O ATOM 1692 CB VAL A1131 36.953 64.725 4.349 1.00 64.23 C ATOM 1693 CG1 VAL A1131 37.034 64.616 5.865 1.00 64.69 C ATOM 1694 CG2 VAL A1131 38.345 64.786 3.720 1.00 65.11 C ATOM 1695 H VAL A1131 34.584 64.122 5.205 1.00 0.00 H ATOM 1696 N ASN A1132 37.257 61.528 4.522 1.00 59.79 N ATOM 1697 CA ASN A1132 37.993 60.271 4.354 1.00 59.59 C ATOM 1698 C ASN A1132 37.090 59.054 4.544 1.00 60.75 C ATOM 1699 O ASN A1132 37.552 57.973 4.931 1.00 60.89 O ATOM 1700 CB ASN A1132 39.235 60.233 5.263 1.00 63.19 C ATOM 1701 CG ASN A1132 40.438 60.923 4.656 1.00 89.62 C ATOM 1702 OD1 ASN A1132 41.025 60.458 3.665 1.00 82.66 O ATOM 1703 ND2 ASN A1132 40.831 62.052 5.237 1.00 81.96 N ATOM 1704 HD22 ASN A1132 40.319 62.416 6.066 1.00 0.00 H ATOM 1705 HD21 ASN A1132 41.651 62.571 4.863 1.00 0.00 H ATOM 1706 H ASN A1132 37.035 61.857 5.483 1.00 0.00 H ATOM 1707 N GLY A1133 35.808 59.240 4.242 1.00 54.46 N ATOM 1708 CA GLY A1133 34.802 58.198 4.386 1.00 51.16 C ATOM 1709 C GLY A1133 33.931 58.037 3.167 1.00 49.84 C ATOM 1710 O GLY A1133 34.428 57.987 2.037 1.00 50.07 O ATOM 1711 H GLY A1133 35.511 60.171 3.887 1.00 0.00 H ATOM 1712 N LEU A1134 32.619 57.959 3.405 1.00 41.94 N ATOM 1713 CA LEU A1134 31.617 57.752 2.366 1.00 38.25 C ATOM 1714 C LEU A1134 31.491 58.934 1.425 1.00 39.13 C ATOM 1715 O LEU A1134 31.541 60.082 1.862 1.00 39.58 O ATOM 1716 CB LEU A1134 30.249 57.458 3.005 1.00 36.69 C ATOM 1717 CG LEU A1134 30.092 56.141 3.739 1.00 39.02 C ATOM 1718 CD1 LEU A1134 28.881 56.170 4.629 1.00 38.73 C ATOM 1719 CD2 LEU A1134 30.052 54.965 2.783 1.00 37.75 C ATOM 1720 H LEU A1134 32.293 58.051 4.388 1.00 0.00 H ATOM 1721 N ALA A1135 31.322 58.652 0.132 1.00 32.87 N ATOM 1722 CA ALA A1135 31.081 59.683 -0.873 1.00 32.16 C ATOM 1723 C ALA A1135 29.568 59.980 -0.851 1.00 33.24 C ATOM 1724 O ALA A1135 29.148 61.121 -1.062 1.00 33.41 O ATOM 1725 CB ALA A1135 31.487 59.171 -2.252 1.00 32.72 C ATOM 1726 H ALA A1135 31.364 57.658 -0.172 1.00 0.00 H ATOM 1727 N LEU A1136 28.757 58.935 -0.601 1.00 26.79 N ATOM 1728 CA LEU A1136 27.291 59.008 -0.597 1.00 25.16 C ATOM 1729 C LEU A1136 26.711 58.330 0.643 1.00 28.57 C ATOM 1730 O LEU A1136 27.352 57.470 1.237 1.00 27.74 O ATOM 1731 CB LEU A1136 26.709 58.341 -1.882 1.00 24.02 C ATOM 1732 CG LEU A1136 27.161 58.903 -3.257 1.00 29.62 C ATOM 1733 CD1 LEU A1136 26.819 57.943 -4.399 1.00 29.46 C ATOM 1734 CD2 LEU A1136 26.604 60.310 -3.518 1.00 30.84 C ATOM 1735 H LEU A1136 29.198 58.016 -0.397 1.00 0.00 H ATOM 1736 N ALA A1137 25.474 58.682 0.998 1.00 25.25 N ATOM 1737 CA ALA A1137 24.784 58.113 2.135 1.00 24.14 C ATOM 1738 C ALA A1137 24.465 56.628 1.925 1.00 26.50 C ATOM 1739 O ALA A1137 24.357 56.135 0.791 1.00 24.04 O ATOM 1740 CB ALA A1137 23.499 58.876 2.393 1.00 25.08 C ATOM 1741 H ALA A1137 24.982 59.401 0.430 1.00 0.00 H ATOM 1742 N GLU A1138 24.352 55.921 3.034 1.00 23.05 N ATOM 1743 CA GLU A1138 23.900 54.541 3.106 1.00 21.45 C ATOM 1744 C GLU A1138 23.134 54.321 4.409 1.00 23.17 C ATOM 1745 O GLU A1138 23.346 55.054 5.387 1.00 22.85 O ATOM 1746 CB GLU A1138 24.967 53.493 2.782 1.00 22.51 C ATOM 1747 CG GLU A1138 26.102 53.361 3.775 1.00 29.92 C ATOM 1748 CD GLU A1138 27.208 52.493 3.208 1.00 31.56 C ATOM 1749 OE1 GLU A1138 27.574 52.677 2.026 1.00 25.78 O ATOM 1750 OE2 GLU A1138 27.667 51.581 3.925 1.00 33.00 O ATOM 1751 H GLU A1138 24.607 56.388 3.927 1.00 0.00 H ATOM 1752 N TYR A1139 22.151 53.419 4.355 1.00 18.20 N ATOM 1753 CA TYR A1139 21.199 53.165 5.436 1.00 18.64 C ATOM 1754 C TYR A1139 21.229 51.703 5.760 1.00 21.99 C ATOM 1755 O TYR A1139 21.195 50.864 4.853 1.00 21.58 O ATOM 1756 CB TYR A1139 19.786 53.646 5.030 1.00 19.91 C ATOM 1757 CG TYR A1139 19.808 55.083 4.529 1.00 23.25 C ATOM 1758 CD1 TYR A1139 19.636 56.152 5.406 1.00 26.47 C ATOM 1759 CD2 TYR A1139 20.074 55.374 3.190 1.00 23.91 C ATOM 1760 CE1 TYR A1139 19.713 57.476 4.959 1.00 28.83 C ATOM 1761 CE2 TYR A1139 20.165 56.690 2.737 1.00 25.00 C ATOM 1762 CZ TYR A1139 19.994 57.737 3.628 1.00 32.79 C ATOM 1763 OH TYR A1139 20.080 59.037 3.175 1.00 36.78 O ATOM 1764 HH TYR A1139 19.935 59.659 3.931 1.00 0.00 H ATOM 1765 H TYR A1139 22.056 52.858 3.484 1.00 0.00 H ATOM 1766 N VAL A1140 21.414 51.399 7.047 1.00 18.08 N ATOM 1767 CA VAL A1140 21.607 50.019 7.477 1.00 17.59 C ATOM 1768 C VAL A1140 20.608 49.615 8.530 1.00 20.09 C ATOM 1769 O VAL A1140 20.488 50.289 9.553 1.00 19.00 O ATOM 1770 CB VAL A1140 23.060 49.770 7.971 1.00 22.22 C ATOM 1771 CG1 VAL A1140 23.349 48.276 8.131 1.00 21.74 C ATOM 1772 CG2 VAL A1140 24.090 50.422 7.045 1.00 22.77 C ATOM 1773 H VAL A1140 21.421 52.160 7.756 1.00 0.00 H ATOM 1774 N ILE A1141 19.926 48.483 8.291 1.00 16.14 N ATOM 1775 CA ILE A1141 19.000 47.861 9.251 1.00 16.80 C ATOM 1776 C ILE A1141 19.620 46.523 9.651 1.00 20.79 C ATOM 1777 O ILE A1141 20.406 45.982 8.888 1.00 19.97 O ATOM 1778 CB ILE A1141 17.534 47.713 8.708 1.00 19.09 C ATOM 1779 CG1 ILE A1141 17.465 46.800 7.450 1.00 19.42 C ATOM 1780 CG2 ILE A1141 16.908 49.103 8.476 1.00 19.42 C ATOM 1781 CD1 ILE A1141 16.000 46.397 6.976 1.00 17.47 C ATOM 1782 H ILE A1141 20.061 48.017 7.371 1.00 0.00 H ATOM 1783 N TYR A1142 19.291 46.008 10.837 1.00 18.84 N ATOM 1784 CA TYR A1142 19.855 44.757 11.368 1.00 18.20 C ATOM 1785 C TYR A1142 18.776 43.683 11.590 1.00 20.78 C ATOM 1786 O TYR A1142 19.050 42.623 12.143 1.00 21.47 O ATOM 1787 CB TYR A1142 20.678 45.053 12.642 1.00 18.35 C ATOM 1788 CG TYR A1142 21.795 46.037 12.355 1.00 18.35 C ATOM 1789 CD1 TYR A1142 21.561 47.414 12.369 1.00 18.37 C ATOM 1790 CD2 TYR A1142 23.073 45.593 12.013 1.00 19.48 C ATOM 1791 CE1 TYR A1142 22.561 48.321 12.028 1.00 19.37 C ATOM 1792 CE2 TYR A1142 24.092 46.498 11.698 1.00 19.90 C ATOM 1793 CZ TYR A1142 23.835 47.861 11.730 1.00 23.14 C ATOM 1794 OH TYR A1142 24.816 48.767 11.407 1.00 21.96 O ATOM 1795 HH TYR A1142 25.118 48.608 10.478 1.00 0.00 H ATOM 1796 H TYR A1142 18.597 46.519 11.419 1.00 0.00 H ATOM 1797 N ARG A1143 17.560 43.962 11.120 1.00 18.17 N ATOM 1798 CA ARG A1143 16.392 43.071 11.182 1.00 18.44 C ATOM 1799 C ARG A1143 15.743 43.100 9.810 1.00 21.95 C ATOM 1800 O ARG A1143 15.352 44.172 9.359 1.00 21.34 O ATOM 1801 CB ARG A1143 15.377 43.584 12.212 1.00 17.93 C ATOM 1802 CG ARG A1143 15.843 43.427 13.636 1.00 26.33 C ATOM 1803 CD ARG A1143 14.925 44.171 14.583 1.00 36.26 C ATOM 1804 NE ARG A1143 15.155 43.693 15.932 1.00 43.98 N ATOM 1805 CZ ARG A1143 14.381 42.819 16.561 1.00 56.86 C ATOM 1806 NH1 ARG A1143 13.263 42.377 15.988 1.00 37.83 N ATOM 1807 NH2 ARG A1143 14.707 42.389 17.769 1.00 43.58 N ATOM 1808 HE ARG A1143 15.984 44.061 16.441 1.00 0.00 H ATOM 1809 HH12 ARG A1143 12.660 41.692 16.486 1.00 0.00 H ATOM 1810 HH11 ARG A1143 12.993 42.717 15.043 1.00 0.00 H ATOM 1811 HH22 ARG A1143 14.097 41.704 18.259 1.00 0.00 H ATOM 1812 HH21 ARG A1143 15.573 42.736 18.229 1.00 0.00 H ATOM 1813 H ARG A1143 17.426 44.890 10.671 1.00 0.00 H ATOM 1814 N GLY A1144 15.639 41.938 9.171 1.00 19.53 N ATOM 1815 CA GLY A1144 15.061 41.836 7.832 1.00 19.75 C ATOM 1816 C GLY A1144 13.644 42.359 7.683 1.00 22.69 C ATOM 1817 O GLY A1144 13.305 42.897 6.630 1.00 21.73 O ATOM 1818 H GLY A1144 15.980 41.074 9.639 1.00 0.00 H ATOM 1819 N GLU A1145 12.811 42.222 8.741 1.00 18.77 N ATOM 1820 CA GLU A1145 11.408 42.695 8.757 1.00 18.35 C ATOM 1821 C GLU A1145 11.256 44.243 8.717 1.00 20.87 C ATOM 1822 O GLU A1145 10.140 44.747 8.588 1.00 20.25 O ATOM 1823 CB GLU A1145 10.643 42.090 9.942 1.00 19.85 C ATOM 1824 CG GLU A1145 11.143 42.561 11.302 1.00 28.41 C ATOM 1825 CD GLU A1145 12.196 41.733 12.019 1.00 39.69 C ATOM 1826 OE1 GLU A1145 12.957 40.993 11.351 1.00 27.04 O ATOM 1827 OE2 GLU A1145 12.283 41.866 13.262 1.00 26.03 O ATOM 1828 H GLU A1145 13.179 41.756 9.595 1.00 0.00 H ATOM 1829 N GLN A1146 12.361 44.987 8.829 1.00 16.74 N ATOM 1830 CA GLN A1146 12.352 46.454 8.749 1.00 16.79 C ATOM 1831 C GLN A1146 12.451 47.005 7.311 1.00 20.05 C ATOM 1832 O GLN A1146 12.603 48.218 7.111 1.00 17.98 O ATOM 1833 CB GLN A1146 13.406 47.059 9.671 1.00 17.86 C ATOM 1834 CG GLN A1146 12.815 47.338 11.024 1.00 18.66 C ATOM 1835 CD GLN A1146 13.814 47.818 12.028 1.00 20.85 C ATOM 1836 OE1 GLN A1146 13.986 47.207 13.081 1.00 23.27 O ATOM 1837 NE2 GLN A1146 14.412 48.964 11.766 1.00 20.47 N ATOM 1838 HE22 GLN A1146 14.237 49.447 10.862 1.00 0.00 H ATOM 1839 HE21 GLN A1146 15.058 49.385 12.464 1.00 0.00 H ATOM 1840 H GLN A1146 13.270 44.505 8.980 1.00 0.00 H ATOM 1841 N ALA A1147 12.307 46.115 6.313 1.00 16.33 N ATOM 1842 CA ALA A1147 12.279 46.518 4.912 1.00 17.58 C ATOM 1843 C ALA A1147 11.307 45.647 4.146 1.00 20.84 C ATOM 1844 O ALA A1147 11.144 44.472 4.469 1.00 21.26 O ATOM 1845 CB ALA A1147 13.663 46.441 4.282 1.00 17.76 C ATOM 1846 H ALA A1147 12.213 45.106 6.548 1.00 0.00 H ATOM 1847 N TYR A1148 10.655 46.232 3.151 1.00 18.20 N ATOM 1848 CA TYR A1148 9.715 45.533 2.280 1.00 18.01 C ATOM 1849 C TYR A1148 10.145 45.836 0.838 1.00 21.93 C ATOM 1850 O TYR A1148 10.250 47.013 0.472 1.00 21.26 O ATOM 1851 CB TYR A1148 8.260 45.978 2.540 1.00 19.13 C ATOM 1852 CG TYR A1148 7.273 45.294 1.614 1.00 21.68 C ATOM 1853 CD1 TYR A1148 6.871 43.975 1.839 1.00 23.45 C ATOM 1854 CD2 TYR A1148 6.787 45.943 0.480 1.00 23.14 C ATOM 1855 CE1 TYR A1148 5.998 43.325 0.964 1.00 26.15 C ATOM 1856 CE2 TYR A1148 5.894 45.310 -0.388 1.00 24.74 C ATOM 1857 CZ TYR A1148 5.512 43.994 -0.147 1.00 30.37 C ATOM 1858 OH TYR A1148 4.655 43.340 -0.995 1.00 30.78 O ATOM 1859 HH TYR A1148 5.053 43.302 -1.900 1.00 0.00 H ATOM 1860 H TYR A1148 10.822 47.244 2.982 1.00 0.00 H ATOM 1861 N PRO A1149 10.390 44.791 0.016 1.00 20.07 N ATOM 1862 CA PRO A1149 10.824 45.033 -1.379 1.00 20.34 C ATOM 1863 C PRO A1149 9.630 45.421 -2.255 1.00 23.87 C ATOM 1864 O PRO A1149 9.049 44.578 -2.917 1.00 25.66 O ATOM 1865 CB PRO A1149 11.459 43.696 -1.763 1.00 21.97 C ATOM 1866 CG PRO A1149 10.688 42.673 -0.987 1.00 26.30 C ATOM 1867 CD PRO A1149 10.282 43.340 0.312 1.00 21.69 C ATOM 1868 N GLU A1150 9.240 46.694 -2.224 1.00 18.75 N ATOM 1869 CA GLU A1150 8.028 47.171 -2.889 1.00 18.46 C ATOM 1870 C GLU A1150 8.012 47.129 -4.405 1.00 22.50 C ATOM 1871 O GLU A1150 6.982 46.772 -4.976 1.00 21.09 O ATOM 1872 CB GLU A1150 7.655 48.573 -2.386 1.00 20.15 C ATOM 1873 CG GLU A1150 6.167 48.855 -2.559 1.00 29.38 C ATOM 1874 CD GLU A1150 5.642 50.101 -1.887 1.00 44.14 C ATOM 1875 OE1 GLU A1150 6.459 50.957 -1.483 1.00 43.93 O ATOM 1876 OE2 GLU A1150 4.402 50.236 -1.792 1.00 43.58 O ATOM 1877 H GLU A1150 9.824 47.380 -1.704 1.00 0.00 H ATOM 1878 N TYR A1151 9.107 47.571 -5.052 1.00 19.94 N ATOM 1879 CA TYR A1151 9.177 47.579 -6.506 1.00 20.37 C ATOM 1880 C TYR A1151 10.381 46.837 -7.014 1.00 23.63 C ATOM 1881 O TYR A1151 11.498 47.040 -6.526 1.00 21.19 O ATOM 1882 CB TYR A1151 9.212 49.007 -7.074 1.00 21.58 C ATOM 1883 CG TYR A1151 8.039 49.865 -6.673 1.00 23.58 C ATOM 1884 CD1 TYR A1151 6.862 49.862 -7.414 1.00 25.72 C ATOM 1885 CD2 TYR A1151 8.115 50.708 -5.566 1.00 23.90 C ATOM 1886 CE1 TYR A1151 5.777 50.659 -7.052 1.00 27.67 C ATOM 1887 CE2 TYR A1151 7.037 51.512 -5.196 1.00 25.87 C ATOM 1888 CZ TYR A1151 5.868 51.474 -5.935 1.00 32.13 C ATOM 1889 OH TYR A1151 4.818 52.273 -5.582 1.00 34.30 O ATOM 1890 HH TYR A1151 4.066 52.124 -6.209 1.00 0.00 H ATOM 1891 H TYR A1151 9.920 47.914 -4.501 1.00 0.00 H ATOM 1892 N LEU A1152 10.157 46.022 -8.046 1.00 21.95 N ATOM 1893 CA LEU A1152 11.223 45.313 -8.737 1.00 21.66 C ATOM 1894 C LEU A1152 11.410 46.053 -10.051 1.00 24.17 C ATOM 1895 O LEU A1152 10.473 46.146 -10.847 1.00 24.45 O ATOM 1896 CB LEU A1152 10.862 43.835 -8.978 1.00 21.81 C ATOM 1897 CG LEU A1152 11.874 43.015 -9.830 1.00 25.05 C ATOM 1898 CD1 LEU A1152 13.230 42.953 -9.152 1.00 22.86 C ATOM 1899 CD2 LEU A1152 11.330 41.611 -10.103 1.00 27.45 C ATOM 1900 H LEU A1152 9.178 45.888 -8.371 1.00 0.00 H ATOM 1901 N ILE A1153 12.596 46.634 -10.242 1.00 20.20 N ATOM 1902 CA ILE A1153 12.910 47.420 -11.444 1.00 19.27 C ATOM 1903 C ILE A1153 13.823 46.624 -12.344 1.00 21.63 C ATOM 1904 O ILE A1153 14.911 46.249 -11.917 1.00 19.75 O ATOM 1905 CB ILE A1153 13.532 48.812 -11.068 1.00 21.68 C ATOM 1906 CG1 ILE A1153 12.642 49.584 -10.053 1.00 21.52 C ATOM 1907 CG2 ILE A1153 13.836 49.658 -12.325 1.00 21.05 C ATOM 1908 CD1 ILE A1153 13.382 50.736 -9.277 1.00 23.44 C ATOM 1909 H ILE A1153 13.328 46.526 -9.511 1.00 0.00 H ATOM 1910 N THR A1154 13.394 46.385 -13.605 1.00 19.17 N ATOM 1911 CA THR A1154 14.214 45.701 -14.599 1.00 18.26 C ATOM 1912 C THR A1154 14.721 46.810 -15.523 1.00 22.67 C ATOM 1913 O THR A1154 13.935 47.628 -16.007 1.00 21.95 O ATOM 1914 CB THR A1154 13.444 44.592 -15.330 1.00 20.37 C ATOM 1915 OG1 THR A1154 12.926 43.689 -14.363 1.00 23.08 O ATOM 1916 CG2 THR A1154 14.331 43.798 -16.294 1.00 18.83 C ATOM 1917 HG1 THR A1154 12.319 44.175 -13.751 1.00 0.00 H ATOM 1918 H THR A1154 12.441 46.702 -13.876 1.00 0.00 H ATOM 1919 N TYR A1155 16.035 46.854 -15.736 1.00 18.42 N ATOM 1920 CA TYR A1155 16.629 47.943 -16.491 1.00 18.64 C ATOM 1921 C TYR A1155 17.969 47.562 -17.094 1.00 21.97 C ATOM 1922 O TYR A1155 18.551 46.532 -16.748 1.00 21.48 O ATOM 1923 CB TYR A1155 16.841 49.155 -15.527 1.00 18.78 C ATOM 1924 CG TYR A1155 17.914 48.915 -14.478 1.00 19.89 C ATOM 1925 CD1 TYR A1155 17.649 48.157 -13.338 1.00 19.36 C ATOM 1926 CD2 TYR A1155 19.219 49.366 -14.672 1.00 22.54 C ATOM 1927 CE1 TYR A1155 18.638 47.911 -12.384 1.00 19.25 C ATOM 1928 CE2 TYR A1155 20.226 49.108 -13.734 1.00 22.51 C ATOM 1929 CZ TYR A1155 19.927 48.381 -12.591 1.00 23.83 C ATOM 1930 OH TYR A1155 20.913 48.112 -11.675 1.00 21.46 O ATOM 1931 HH TYR A1155 21.633 47.591 -12.111 1.00 0.00 H ATOM 1932 H TYR A1155 16.643 46.100 -15.357 1.00 0.00 H ATOM 1933 N GLN A1156 18.486 48.451 -17.936 1.00 18.24 N ATOM 1934 CA GLN A1156 19.840 48.365 -18.462 1.00 18.31 C ATOM 1935 C GLN A1156 20.496 49.700 -18.152 1.00 23.27 C ATOM 1936 O GLN A1156 19.820 50.727 -18.130 1.00 22.96 O ATOM 1937 CB GLN A1156 19.846 48.174 -19.987 1.00 19.73 C ATOM 1938 CG GLN A1156 19.362 46.814 -20.481 1.00 30.27 C ATOM 1939 CD GLN A1156 18.760 46.940 -21.858 1.00 32.18 C ATOM 1940 OE1 GLN A1156 17.787 47.654 -22.067 1.00 34.97 O ATOM 1941 NE2 GLN A1156 19.343 46.284 -22.833 1.00 26.15 N ATOM 1942 HE22 GLN A1156 20.168 45.683 -22.635 1.00 0.00 H ATOM 1943 HE21 GLN A1156 18.980 46.365 -23.804 1.00 0.00 H ATOM 1944 H GLN A1156 17.891 49.250 -18.235 1.00 0.00 H ATOM 1945 N ILE A1157 21.811 49.699 -17.951 1.00 22.37 N ATOM 1946 CA ILE A1157 22.575 50.943 -17.874 1.00 22.35 C ATOM 1947 C ILE A1157 22.764 51.333 -19.344 1.00 25.77 C ATOM 1948 O ILE A1157 22.802 50.444 -20.201 1.00 24.69 O ATOM 1949 CB ILE A1157 23.922 50.811 -17.108 1.00 24.40 C ATOM 1950 CG1 ILE A1157 24.855 49.708 -17.714 1.00 24.10 C ATOM 1951 CG2 ILE A1157 23.648 50.613 -15.606 1.00 23.04 C ATOM 1952 CD1 ILE A1157 26.370 49.853 -17.402 1.00 23.23 C ATOM 1953 H ILE A1157 22.308 48.791 -17.846 1.00 0.00 H ATOM 1954 N MET A1158 22.812 52.632 -19.652 1.00 24.17 N ATOM 1955 CA MET A1158 22.954 53.045 -21.054 1.00 24.59 C ATOM 1956 C MET A1158 24.298 53.643 -21.322 1.00 29.37 C ATOM 1957 O MET A1158 24.779 54.449 -20.528 1.00 27.81 O ATOM 1958 CB MET A1158 21.841 54.029 -21.472 1.00 25.98 C ATOM 1959 CG MET A1158 20.492 53.370 -21.642 1.00 27.66 C ATOM 1960 SD MET A1158 19.180 54.550 -22.016 1.00 31.61 S ATOM 1961 CE MET A1158 19.661 55.078 -23.665 1.00 28.75 C ATOM 1962 H MET A1158 22.749 53.349 -18.901 1.00 0.00 H ATOM 1963 N ARG A1159 24.890 53.277 -22.453 1.00 29.67 N ATOM 1964 CA ARG A1159 26.175 53.805 -22.896 1.00 32.17 C ATOM 1965 C ARG A1159 26.048 55.343 -23.050 1.00 39.24 C ATOM 1966 O ARG A1159 25.090 55.811 -23.682 1.00 41.23 O ATOM 1967 CB ARG A1159 26.569 53.132 -24.223 1.00 34.74 C ATOM 1968 CG ARG A1159 28.004 53.341 -24.642 1.00 43.40 C ATOM 1969 CD ARG A1159 28.240 52.759 -26.013 1.00 53.79 C ATOM 1970 NE ARG A1159 28.762 51.400 -25.903 1.00 66.19 N ATOM 1971 CZ ARG A1159 28.072 50.298 -26.171 1.00 80.58 C ATOM 1972 NH1 ARG A1159 26.797 50.377 -26.540 1.00 66.81 N ATOM 1973 NH2 ARG A1159 28.641 49.106 -26.048 1.00 64.95 N ATOM 1974 HE ARG A1159 29.748 51.287 -25.591 1.00 0.00 H ATOM 1975 HH12 ARG A1159 26.261 49.510 -26.749 1.00 0.00 H ATOM 1976 HH11 ARG A1159 26.335 51.305 -26.620 1.00 0.00 H ATOM 1977 HH22 ARG A1159 28.096 48.246 -26.259 1.00 0.00 H ATOM 1978 HH21 ARG A1159 29.632 49.032 -25.740 1.00 0.00 H ATOM 1979 H ARG A1159 24.412 52.577 -23.055 1.00 0.00 H ATOM 1980 N PRO A1160 26.943 56.139 -22.417 1.00 35.96 N ATOM 1981 CA PRO A1160 26.849 57.611 -22.545 1.00 41.83 C ATOM 1982 C PRO A1160 27.055 58.100 -23.978 1.00 69.53 C ATOM 1983 O PRO A1160 26.281 58.914 -24.455 1.00 48.81 O ATOM 1984 CB PRO A1160 27.990 58.127 -21.661 1.00 43.01 C ATOM 1985 CG PRO A1160 28.364 56.979 -20.794 1.00 44.55 C ATOM 1986 CD PRO A1160 28.116 55.754 -21.612 1.00 38.48 C TER 1987 PRO A1160 HETATM 1988 ZN ZN A 1 26.127 40.845 -20.264 1.00 32.69 ZN HETATM 1989 O HOH 2 30.128 46.938 -21.808 1.00 34.15 O HETATM 1990 O HOH 3 14.008 60.213 21.860 1.00 42.03 O HETATM 1991 O HOH 4 21.935 49.495 -22.743 1.00 28.48 O HETATM 1992 O HOH 5 3.353 37.944 8.124 1.00 33.44 O HETATM 1993 O HOH 6 7.276 60.628 22.947 1.00 50.89 O HETATM 1994 O HOH 7 37.350 49.726 -14.111 1.00 51.01 O HETATM 1995 O HOH 8 31.103 51.236 -24.584 1.00 58.75 O HETATM 1996 O HOH 9 19.840 60.271 15.280 1.00 54.35 O HETATM 1997 O HOH 10 34.284 50.074 -6.721 1.00 43.61 O HETATM 1998 O HOH 11 15.439 54.824 22.225 1.00 32.02 O HETATM 1999 O HOH 12 33.081 40.483 -5.663 1.00 42.08 O HETATM 2000 O HOH 13 27.205 37.374 -12.371 1.00 61.01 O HETATM 2001 O HOH 14 33.888 43.996 -16.027 1.00 32.93 O HETATM 2002 O HOH 15 13.206 59.373 13.834 1.00 34.63 O HETATM 2003 O HOH 16 32.127 32.715 -12.848 1.00 53.42 O HETATM 2004 O HOH 17 29.515 38.683 -10.744 1.00 36.24 O HETATM 2005 O HOH 18 38.537 56.294 -10.516 1.00 50.55 O HETATM 2006 O HOH 19 1.772 36.059 1.216 1.00 39.18 O HETATM 2007 O HOH 20 18.338 59.917 18.362 1.00 32.20 O HETATM 2008 O HOH 21 29.713 37.040 -14.006 1.00 39.77 O HETATM 2009 O HOH 22 10.256 53.220 -19.571 1.00 50.67 O HETATM 2010 O HOH 23 22.429 59.728 15.878 1.00 37.81 O HETATM 2011 O HOH 24 23.610 51.292 -24.164 1.00 28.20 O HETATM 2012 O HOH 25 6.448 48.102 -16.218 1.00 35.17 O HETATM 2013 O HOH 26 32.698 48.406 -15.183 1.00 40.54 O HETATM 2014 O HOH 27 9.587 40.376 -19.573 1.00 57.43 O HETATM 2015 O HOH 28 22.929 54.346 -25.158 1.00 37.93 O HETATM 2016 O HOH 29 27.981 45.797 -23.411 1.00 27.76 O HETATM 2017 O HOH 30 13.207 57.502 -21.833 1.00 53.27 O HETATM 2018 O HOH 31 23.034 57.753 -22.505 1.00 52.85 O HETATM 2019 O HOH 32 4.799 56.577 11.403 1.00 50.62 O HETATM 2020 O HOH 33 11.667 41.819 -18.585 1.00 48.36 O HETATM 2021 O HOH 34 14.533 58.784 -23.986 1.00 47.57 O HETATM 2022 O HOH 35 16.027 59.240 13.774 1.00 34.96 O HETATM 2023 O HOH 36 24.919 60.360 16.264 1.00 45.75 O HETATM 2024 O HOH 37 26.965 36.982 -8.007 1.00 56.66 O HETATM 2025 O HOH 38 3.099 55.914 0.868 1.00 51.66 O HETATM 2026 O HOH 39 33.850 50.232 -16.653 1.00 37.66 O HETATM 2027 O HOH 40 38.612 54.903 -13.268 1.00 47.76 O HETATM 2028 O HOH 41 6.114 55.745 0.072 1.00 50.59 O HETATM 2029 O HOH 42 22.354 65.999 13.131 1.00 54.72 O HETATM 2030 O HOH 43 35.191 45.671 -3.658 1.00 48.14 O HETATM 2031 O HOH 44 44.489 63.783 4.408 1.00 44.92 O HETATM 2032 O HOH 45 21.880 38.875 -22.158 1.00 48.85 O HETATM 2033 O HOH 46 29.675 42.229 -25.210 1.00 50.71 O HETATM 2034 O HOH 47 7.741 51.721 -16.516 1.00 49.52 O HETATM 2035 O HOH 48 30.715 52.276 -10.301 1.00 26.33 O HETATM 2036 O HOH 49 29.925 56.410 -12.330 1.00 43.90 O HETATM 2037 O HOH 50 16.841 59.712 10.409 1.00 29.31 O HETATM 2038 O HOH 51 22.782 44.309 2.361 1.00 19.20 O HETATM 2039 O HOH 52 14.592 36.769 9.100 1.00 56.15 O HETATM 2040 O HOH 53 13.985 54.424 -19.559 1.00 24.75 O HETATM 2041 O HOH 54 20.216 41.609 -11.960 1.00 22.59 O HETATM 2042 O HOH 55 29.538 55.893 -1.120 1.00 26.69 O HETATM 2043 O HOH 56 23.043 56.745 -1.391 1.00 21.28 O HETATM 2044 O HOH 57 20.904 60.935 4.824 1.00 44.86 O HETATM 2045 O HOH 58 28.053 44.967 17.987 1.00 43.40 O HETATM 2046 O HOH 59 30.112 39.108 -4.536 1.00 39.10 O HETATM 2047 O HOH 60 17.363 47.289 12.580 1.00 20.73 O HETATM 2048 O HOH 61 22.764 46.702 -18.636 1.00 24.96 O HETATM 2049 O HOH 62 7.507 41.542 12.122 1.00 26.39 O HETATM 2050 O HOH 63 11.142 59.428 6.873 1.00 32.44 O HETATM 2051 O HOH 64 29.582 47.619 18.252 1.00 55.93 O HETATM 2052 O HOH 65 11.690 41.637 4.422 1.00 26.25 O HETATM 2053 O HOH 66 0.048 50.109 9.155 1.00 64.29 O HETATM 2054 O HOH 67 17.927 34.494 -5.420 1.00 36.45 O HETATM 2055 O HOH 68 26.795 52.228 -10.615 1.00 21.23 O HETATM 2056 O HOH 69 26.216 42.614 -3.726 1.00 19.58 O HETATM 2057 O HOH 70 1.711 41.180 18.922 1.00 46.08 O HETATM 2058 O HOH 71 9.455 47.897 9.683 1.00 22.90 O HETATM 2059 O HOH 72 14.757 58.227 -0.847 1.00 33.80 O HETATM 2060 O HOH 73 11.105 58.253 0.972 1.00 40.52 O HETATM 2061 O HOH 74 26.712 40.025 -3.220 1.00 31.83 O HETATM 2062 O HOH 75 17.981 36.613 -7.961 1.00 39.92 O HETATM 2063 O HOH 76 29.917 47.561 -4.907 1.00 39.53 O HETATM 2064 O HOH 77 27.677 63.400 -9.284 1.00 41.59 O HETATM 2065 O HOH 78 23.868 43.109 -2.126 1.00 22.66 O HETATM 2066 O HOH 79 24.108 44.272 -17.368 1.00 26.98 O HETATM 2067 O HOH 80 16.949 59.615 6.310 1.00 39.03 O HETATM 2068 O HOH 81 18.063 32.078 6.178 1.00 26.54 O HETATM 2069 O HOH 82 17.029 40.327 -15.280 1.00 47.99 O HETATM 2070 O HOH 83 7.569 57.638 8.450 1.00 21.36 O HETATM 2071 O HOH 84 23.454 60.585 -1.057 1.00 29.23 O HETATM 2072 O HOH 85 28.333 45.784 -12.393 1.00 20.28 O HETATM 2073 O HOH 86 24.172 34.616 10.095 1.00 24.16 O HETATM 2074 O HOH 87 3.036 45.701 16.047 1.00 30.03 O HETATM 2075 O HOH 88 25.662 36.576 10.875 1.00 29.62 O HETATM 2076 O HOH 89 21.894 40.298 -10.203 1.00 38.64 O HETATM 2077 O HOH 90 21.939 62.483 -12.216 1.00 47.25 O HETATM 2078 O HOH 91 10.709 44.542 -13.078 1.00 27.97 O HETATM 2079 O HOH 92 13.049 47.421 18.818 1.00 29.96 O HETATM 2080 O HOH 93 14.680 40.114 -16.580 1.00 43.92 O HETATM 2081 O HOH 94 8.740 56.589 21.730 1.00 36.75 O HETATM 2082 O HOH 95 2.731 49.692 10.441 1.00 30.09 O HETATM 2083 O HOH 96 31.029 58.715 13.395 1.00 58.24 O HETATM 2084 O HOH 97 20.010 59.920 -15.133 1.00 43.29 O HETATM 2085 O HOH 98 18.625 62.553 2.065 1.00 46.86 O HETATM 2086 O HOH 99 19.896 61.434 7.666 1.00 55.90 O HETATM 2087 O HOH 100 24.105 56.880 -20.069 1.00 27.82 O HETATM 2088 O HOH 101 26.876 45.325 -10.126 1.00 26.20 O HETATM 2089 O HOH 102 31.434 52.888 -22.202 1.00 49.41 O HETATM 2090 O HOH 103 26.907 59.774 -14.304 1.00 45.08 O HETATM 2091 O HOH 104 28.067 59.827 -26.559 1.00 50.41 O HETATM 2092 O HOH 105 22.938 37.869 -11.368 1.00 48.95 O HETATM 2093 O HOH 106 -1.313 48.304 4.777 1.00 55.18 O HETATM 2094 O HOH 107 18.256 39.807 -11.526 1.00 61.44 O HETATM 2095 O HOH 108 21.974 62.388 -3.386 1.00 53.41 O HETATM 2096 O HOH 109 9.449 59.585 -15.246 1.00 42.39 O HETATM 2097 O HOH 110 23.079 35.876 0.319 1.00 50.78 O HETATM 2098 O HOH 111 13.103 53.568 21.829 1.00 40.74 O HETATM 2099 O HOH 112 10.038 42.428 18.019 1.00 38.77 O HETATM 2100 O HOH 113 10.268 40.217 -13.586 1.00 44.93 O HETATM 2101 O HOH 114 6.126 41.961 18.288 1.00 30.18 O HETATM 2102 O HOH 115 0.698 43.687 10.427 1.00 42.25 O HETATM 2103 O HOH 116 21.766 40.245 -15.930 1.00 45.66 O HETATM 2104 O HOH 117 29.417 51.221 -1.419 1.00 39.48 O HETATM 2105 O HOH 118 15.499 33.795 3.808 1.00 34.90 O HETATM 2106 O HOH 119 10.125 60.704 -7.948 1.00 40.59 O HETATM 2107 O HOH 120 11.225 61.368 8.967 1.00 52.04 O HETATM 2108 O HOH 121 25.470 37.734 -10.337 1.00 51.47 O HETATM 2109 O HOH 122 1.539 52.201 4.325 1.00 35.62 O HETATM 2110 O HOH 123 23.790 37.904 -17.970 1.00 53.41 O HETATM 2111 O HOH 124 17.739 32.416 0.327 1.00 63.76 O HETATM 2112 O HOH 125 15.943 32.253 -5.814 1.00 50.51 O HETATM 2113 O HOH 126 17.728 40.760 14.470 1.00 51.12 O HETATM 2114 O HOH 127 23.358 61.301 -14.600 1.00 38.77 O HETATM 2115 O HOH 128 8.662 42.220 14.641 1.00 45.64 O HETATM 2116 O HOH 129 13.188 56.562 -17.838 1.00 39.40 O HETATM 2117 O HOH 130 29.888 51.643 1.219 1.00 54.67 O HETATM 2118 O HOH 131 11.749 41.052 -15.823 1.00 47.71 O HETATM 2119 O HOH 132 27.503 64.370 5.838 1.00 52.67 O HETATM 2120 O HOH 133 15.431 62.504 2.986 1.00 61.82 O HETATM 2121 O HOH 134 2.977 52.014 11.768 1.00 41.97 O HETATM 2122 O HOH 135 0.208 45.870 11.854 1.00 59.64 O HETATM 2123 O HOH 136 21.605 36.353 -18.271 1.00 53.76 O HETATM 2124 O HOH 137 27.014 36.935 -4.732 1.00 58.93 O HETATM 2125 O HOH 138 8.481 62.355 -9.344 1.00 54.01 O HETATM 2126 O HOH 139 15.548 65.754 -10.312 1.00 64.37 O HETATM 2127 O HOH 140 33.121 53.201 0.871 1.00 55.67 O HETATM 2128 O HOH 141 22.749 33.163 -0.591 1.00 58.96 O HETATM 2129 O HOH 142 29.342 47.261 1.521 1.00 30.00 O HETATM 2130 O HOH 143 28.856 53.501 -11.996 1.00 22.77 O HETATM 2131 O HOH 144 31.136 56.983 -5.164 1.00 22.66 O HETATM 2132 O HOH 145 19.647 42.597 14.975 1.00 22.22 O HETATM 2133 O HOH 146 32.414 54.586 -6.135 1.00 29.95 O HETATM 2134 O HOH 147 19.502 39.890 -19.909 1.00 33.30 O HETATM 2135 O HOH 148 18.766 36.566 13.601 1.00 37.40 O HETATM 2136 O HOH 149 18.664 59.078 8.502 1.00 30.64 O HETATM 2137 O HOH 150 14.596 60.111 7.407 1.00 38.63 O HETATM 2138 O HOH 151 15.933 47.919 17.025 1.00 26.43 O HETATM 2139 O HOH 152 17.483 46.730 15.230 1.00 28.49 O HETATM 2140 O HOH 153 14.059 40.979 -19.066 1.00 30.93 O HETATM 2141 O HOH 154 29.030 55.144 -3.892 1.00 38.04 O HETATM 2142 O HOH 155 32.008 55.341 -0.329 1.00 41.75 O HETATM 2143 O HOH 156 30.175 56.492 -14.978 1.00 41.89 O HETATM 2144 O HOH 157 15.966 58.045 -3.324 1.00 43.84 O HETATM 2145 O HOH 158 2.728 47.895 -0.995 1.00 51.21 O HETATM 2146 O HOH 159 1.282 45.277 -0.370 1.00 56.13 O HETATM 2147 O HOH 160 12.627 62.039 -7.933 1.00 50.19 O HETATM 2148 O HOH 161 21.331 62.360 2.489 1.00 48.06 O HETATM 2149 O HOH 162 31.678 49.592 -4.681 1.00 43.13 O HETATM 2150 O HOH 163 32.859 62.718 0.741 1.00 53.35 O HETATM 2151 O HOH 164 23.816 60.163 -21.526 1.00 49.11 O HETATM 2152 O HOH 165 10.887 45.854 20.168 1.00 50.11 O HETATM 2153 O HOH 166 21.556 38.160 -14.002 1.00 43.06 O HETATM 2154 O HOH 167 24.381 63.441 -4.169 1.00 53.65 O HETATM 2155 O HOH 168 30.196 60.181 -5.765 1.00 56.16 O HETATM 2156 O HOH 169 15.483 35.569 11.461 1.00 46.13 O HETATM 2157 O HOH 170 9.868 31.093 -1.658 1.00 48.32 O HETATM 2158 O HOH 171 28.733 43.265 -22.841 1.00 39.81 O HETATM 2159 O HOH 172 12.326 60.041 -15.744 1.00 46.59 O HETATM 2160 O HOH 173 3.627 54.095 10.184 1.00 54.11 O HETATM 2161 O HOH 174 25.288 62.462 -0.363 1.00 57.05 O HETATM 2162 O HOH 175 36.011 49.088 11.781 1.00 51.52 O HETATM 2163 O HOH 176 11.686 38.394 10.756 1.00 43.33 O HETATM 2164 O HOH 177 9.010 58.177 2.857 1.00 58.14 O HETATM 2165 O HOH 178 29.538 49.783 3.214 1.00 31.38 O HETATM 2166 O HOH 179 19.725 43.444 -7.592 1.00 31.72 O HETATM 2167 O HOH 180 7.628 55.855 2.526 1.00 46.06 O HETATM 2168 O HOH 181 16.262 63.043 -7.023 1.00 39.41 O HETATM 2169 O HOH 182 12.042 57.125 21.662 1.00 44.40 O HETATM 2170 O HOH 183 12.744 61.676 5.107 1.00 61.12 O HETATM 2171 O HOH 184 11.947 38.554 -12.013 1.00 74.24 O HETATM 2172 O HOH 185 37.364 54.437 -5.591 1.00 59.74 O HETATM 2173 O HOH 186 23.952 62.798 2.710 1.00 57.35 O HETATM 2174 O HOH 187 30.672 63.690 -0.563 1.00 60.94 O HETATM 2175 O HOH 188 19.387 65.450 -9.563 1.00 51.26 O HETATM 2176 O HOH 189 2.925 45.896 -10.850 1.00 33.77 O HETATM 2177 O HOH 190 0.529 37.689 -1.333 1.00 41.37 O HETATM 2178 O HOH 191 27.221 56.672 -12.870 1.00 53.63 O HETATM 2179 O HOH 192 3.795 46.351 -14.000 1.00 52.55 O HETATM 2180 O HOH 193 3.476 40.360 -6.623 1.00 53.22 O HETATM 2181 O HOH 194 5.952 40.794 -9.593 1.00 61.61 O HETATM 2182 O HOH 195 6.147 37.623 -4.075 1.00 56.52 O HETATM 2183 O HOH 196 29.318 58.593 -17.319 1.00 47.70 O HETATM 2184 O HOH 197 27.458 37.808 2.250 1.00 50.46 O HETATM 2185 O HOH 198 8.962 38.266 -10.251 1.00 54.00 O HETATM 2186 O HOH 199 -3.481 53.315 -15.162 1.00 62.56 O HETATM 2187 O HOH 200 24.413 64.982 -10.257 1.00 56.36 O HETATM 2188 O HOH 201 26.899 30.080 9.937 1.00 58.42 O HETATM 2189 O HOH 202 17.800 60.958 -17.168 1.00 50.60 O HETATM 2190 O HOH 203 -1.299 47.949 -7.200 1.00 65.19 O HETATM 2191 O HOH 204 23.444 61.088 5.192 1.00 72.06 O HETATM 2192 O HOH 205 1.221 40.843 11.515 1.00 59.97 O HETATM 2193 O HOH 206 19.144 61.351 -3.324 1.00 52.20 O HETATM 2194 O HOH 207 9.283 64.216 5.759 1.00 55.39 O HETATM 2195 C01 UHB A 208 24.103 49.897 -0.802 1.00 -0.06 C HETATM 2196 C02 UHB A 208 25.200 50.255 0.004 1.00 -0.08 C HETATM 2197 C03 UHB A 208 26.078 49.298 0.513 1.00 -0.04 C HETATM 2198 C04 UHB A 208 25.864 47.907 0.320 1.00 0.08 C HETATM 2199 C05 UHB A 208 24.758 47.548 -0.510 1.00 0.02 C HETATM 2200 C06 UHB A 208 23.955 48.560 -1.058 1.00 0.04 C HETATM 2201 C07 UHB A 208 22.925 47.986 -1.946 1.00 0.20 C HETATM 2202 N09 UHB A 208 23.089 46.603 -1.880 1.00 -0.28 N HETATM 2203 C08 UHB A 208 24.164 46.227 -1.012 1.00 0.06 C HETATM 2204 H UHB A 208 23.788 45.629 -0.169 1.00 0.07 H HETATM 2205 H UHB A 208 24.920 45.649 -1.563 1.00 0.07 H HETATM 2206 H UHB A 208 22.522 45.949 -2.381 1.00 0.19 H HETATM 2207 O10 UHB A 208 22.075 48.551 -2.605 1.00 -0.39 O HETATM 2208 N11 UHB A 208 26.751 46.989 0.919 1.00 -0.23 N HETATM 2209 C12 UHB A 208 26.442 45.754 1.517 1.00 0.25 C HETATM 2210 O13 UHB A 208 25.258 45.355 1.602 1.00 -0.38 O HETATM 2211 C14 UHB A 208 27.514 44.836 2.084 1.00 0.06 C HETATM 2212 N15 UHB A 208 27.206 43.470 2.544 1.00 0.26 N HETATM 2213 C16 UHB A 208 26.806 42.547 1.363 1.00 -0.01 C HETATM 2214 C17 UHB A 208 26.386 41.095 1.825 1.00 0.07 C HETATM 2215 N18 UHB A 208 25.424 41.168 2.891 1.00 -0.26 N HETATM 2216 C19 UHB A 208 25.909 41.859 4.041 1.00 0.07 C HETATM 2217 C20 UHB A 208 26.281 43.316 3.741 1.00 -0.01 C HETATM 2218 H UHB A 208 25.357 43.878 3.542 1.00 0.08 H HETATM 2219 H UHB A 208 26.782 43.737 4.625 1.00 0.08 H HETATM 2220 H UHB A 208 26.802 41.337 4.415 1.00 0.06 H HETATM 2221 H UHB A 208 25.127 41.847 4.815 1.00 0.06 H HETATM 2222 C21 UHB A 208 24.082 40.753 2.748 1.00 0.21 C HETATM 2223 C22 UHB A 208 23.550 40.035 1.492 1.00 0.18 C HETATM 2224 C23 UHB A 208 23.099 41.014 0.298 1.00 0.13 C HETATM 2225 C24 UHB A 208 21.729 40.468 -0.093 1.00 0.14 C HETATM 2226 C25 UHB A 208 21.512 39.216 0.822 1.00 0.20 C HETATM 2227 O26 UHB A 208 22.387 39.346 1.880 1.00 -0.32 O HETATM 2228 N30 UHB A 208 20.214 38.812 1.276 1.00 -0.19 N HETATM 2229 C32 UHB A 208 19.616 37.626 0.949 1.00 0.16 C HETATM 2230 C31 UHB A 208 18.302 37.674 1.503 1.00 0.10 C HETATM 2231 N34 UHB A 208 18.067 38.944 2.086 1.00 -0.30 N HETATM 2232 C33 UHB A 208 19.231 39.605 1.952 1.00 0.11 C HETATM 2233 H UHB A 208 19.404 40.618 2.313 1.00 0.13 H HETATM 2234 C38 UHB A 208 17.485 36.530 1.331 1.00 0.13 C HETATM 2235 N35 UHB A 208 18.006 35.421 0.674 1.00 -0.27 N HETATM 2236 C36 UHB A 208 19.295 35.492 0.239 1.00 0.05 C HETATM 2237 N37 UHB A 208 20.153 36.533 0.291 1.00 -0.27 N HETATM 2238 H UHB A 208 19.686 34.587 -0.211 1.00 0.10 H HETATM 2239 N39 UHB A 208 16.184 36.432 1.731 1.00 -0.32 N HETATM 2240 H UHB A 208 15.659 35.561 1.567 1.00 0.18 H HETATM 2241 H UHB A 208 15.727 37.229 2.197 1.00 0.18 H HETATM 2242 H UHB A 208 21.859 38.364 0.218 1.00 0.10 H HETATM 2243 O29 UHB A 208 20.781 41.435 -0.055 1.00 -0.38 O HETATM 2244 H UHB A 208 21.022 42.137 -0.648 1.00 0.21 H HETATM 2245 H UHB A 208 21.772 40.116 -1.134 1.00 0.07 H HETATM 2246 O28 UHB A 208 23.934 40.802 -0.768 1.00 -0.38 O HETATM 2247 H UHB A 208 23.595 41.258 -1.530 1.00 0.21 H HETATM 2248 H UHB A 208 23.073 42.072 0.599 1.00 0.07 H HETATM 2249 H UHB A 208 24.317 39.338 1.123 1.00 0.09 H HETATM 2250 O27 UHB A 208 23.297 40.948 3.709 1.00 -0.39 O HETATM 2251 H UHB A 208 27.277 40.554 2.177 1.00 0.06 H HETATM 2252 H UHB A 208 25.944 40.557 0.974 1.00 0.06 H HETATM 2253 H UHB A 208 27.663 42.462 0.679 1.00 0.08 H HETATM 2254 H UHB A 208 25.958 43.005 0.833 1.00 0.08 H HETATM 2255 H UHB A 208 28.090 43.114 2.871 1.00 0.21 H HETATM 2256 H UHB A 208 27.945 45.362 2.948 1.00 0.11 H HETATM 2257 H UHB A 208 28.278 44.732 1.299 1.00 0.11 H HETATM 2258 H UHB A 208 27.717 47.247 0.919 1.00 0.22 H HETATM 2259 H UHB A 208 26.948 49.625 1.071 1.00 0.05 H HETATM 2260 H UHB A 208 25.367 51.301 0.235 1.00 0.05 H HETATM 2261 H UHB A 208 23.416 50.636 -1.197 1.00 0.05 H CONECT 1 2 7 8 9 CONECT 8 1 CONECT 9 1 CONECT 1212 1211 1988 CONECT 1235 1234 1237 1988 CONECT 1292 1291 1988 CONECT 1322 1321 1988 CONECT 1988 1212 1235 1292 1322 CONECT 2195 2196 2200 2261 CONECT 2196 2195 2197 2260 CONECT 2197 2196 2198 2259 CONECT 2198 2197 2199 2208 CONECT 2199 2198 2200 2203 CONECT 2200 2195 2199 2201 CONECT 2201 2200 2202 2207 CONECT 2202 2201 2203 2206 CONECT 2203 2199 2202 2204 2205 CONECT 2204 2203 CONECT 2205 2203 CONECT 2206 2202 CONECT 2207 2201 CONECT 2208 2198 2209 2258 CONECT 2209 2208 2210 2211 CONECT 2210 2209 CONECT 2211 2209 2212 2256 2257 CONECT 2212 2211 2213 2217 2255 CONECT 2213 2212 2214 2253 2254 CONECT 2214 2213 2215 2251 2252 CONECT 2215 2214 2216 2222 CONECT 2216 2215 2217 2220 2221 CONECT 2217 2212 2216 2218 2219 CONECT 2218 2217 CONECT 2219 2217 CONECT 2220 2216 CONECT 2221 2216 CONECT 2222 2215 2223 2250 CONECT 2223 2222 2224 2227 2249 CONECT 2224 2223 2225 2246 2248 CONECT 2225 2224 2226 2243 2245 CONECT 2226 2225 2227 2228 2242 CONECT 2227 2223 2226 CONECT 2228 2226 2229 2232 CONECT 2229 2228 2230 2237 CONECT 2230 2229 2231 2234 CONECT 2231 2230 2232 CONECT 2232 2228 2231 2233 CONECT 2233 2232 CONECT 2234 2230 2235 2239 CONECT 2235 2234 2236 CONECT 2236 2235 2237 2238 CONECT 2237 2229 2236 CONECT 2238 2236 CONECT 2239 2234 2240 2241 CONECT 2240 2239 CONECT 2241 2239 CONECT 2242 2226 CONECT 2243 2225 2244 CONECT 2244 2243 CONECT 2245 2225 CONECT 2246 2224 2247 CONECT 2247 2246 CONECT 2248 2224 CONECT 2249 2223 CONECT 2250 2222 CONECT 2251 2214 CONECT 2252 2214 CONECT 2253 2213 CONECT 2254 2213 CONECT 2255 2212 CONECT 2256 2211 CONECT 2257 2211 CONECT 2258 2208 CONECT 2259 2197 CONECT 2260 2196 CONECT 2261 2195 MASTER 0 0 0 0 0 0 0 0 2260 1 75 16 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 4tk5
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3kr8
RCSB PDB
PDBbind
240aa, >3KR8_1|Chains... *
3ua9
RCSB PDB
PDBbind
240aa, >3UA9_1|Chains... at 100%
4avu
RCSB PDB
PDBbind
240aa, >4AVU_1|Chains... at 100%
4avw
RCSB PDB
PDBbind
240aa, >4AVW_1|Chains... at 100%
4bfp
RCSB PDB
PDBbind
240aa, >4BFP_1|Chains... at 100%
4bj9
RCSB PDB
PDBbind
240aa, >4BJ9_1|Chains... at 100%
4bjb
RCSB PDB
PDBbind
240aa, >4BJB_1|Chain... at 100%
4bjc
RCSB PDB
PDBbind
240aa, >4BJC_1|Chain... at 100%
4bs4
RCSB PDB
PDBbind
240aa, >4BS4_1|Chains... at 100%
4hki
RCSB PDB
PDBbind
49aa, >4HKI_2|Chains... at 100%
4hkk
RCSB PDB
PDBbind
49aa, >4HKK_2|Chains... at 100%
4hkn
RCSB PDB
PDBbind
49aa, >4HKN_2|Chain... at 100%
4hl5
RCSB PDB
PDBbind
49aa, >4HL5_2|Chain... at 100%
4hlf
RCSB PDB
PDBbind
49aa, >4HLF_2|Chains... at 100%
4hlg
RCSB PDB
PDBbind
49aa, >4HLG_2|Chains... at 100%
4hlh
RCSB PDB
PDBbind
49aa, >4HLH_2|Chains... at 100%
4hlk
RCSB PDB
PDBbind
49aa, >4HLK_2|Chains... at 100%
4hlm
RCSB PDB
PDBbind
49aa, >4HLM_2|Chains... at 100%
4hmh
RCSB PDB
PDBbind
49aa, >4HMH_2|Chain... at 100%
4hyf
RCSB PDB
PDBbind
240aa, >4HYF_1|Chains... at 100%
4iue
RCSB PDB
PDBbind
210aa, >4IUE_1|Chain... at 100%
4j21
RCSB PDB
PDBbind
210aa, >4J21_1|Chain... at 100%
4j22
RCSB PDB
PDBbind
210aa, >4J22_1|Chains... at 100%
4j3l
RCSB PDB
PDBbind
210aa, >4J3L_1|Chain... at 100%
4j3m
RCSB PDB
PDBbind
210aa, >4J3M_1|Chains... at 100%
4kzl
RCSB PDB
PDBbind
49aa, >4KZL_2|Chains... at 100%
4kzq
RCSB PDB
PDBbind
49aa, >4KZQ_2|Chains... at 100%
4kzu
RCSB PDB
PDBbind
49aa, >4KZU_2|Chains... at 100%
4l09
RCSB PDB
PDBbind
49aa, >4L09_2|Chains... at 100%
4l0b
RCSB PDB
PDBbind
49aa, >4L0B_2|Chains... at 100%
4l0i
RCSB PDB
PDBbind
49aa, >4L0I_2|Chains... at 100%
4l0s
RCSB PDB
PDBbind
49aa, >4L0S_2|Chains... at 100%
4l0t
RCSB PDB
PDBbind
49aa, >4L0T_2|Chains... at 100%
4l0v
RCSB PDB
PDBbind
191aa, >4L0V_1|Chains... at 100%
4l10
RCSB PDB
PDBbind
191aa, >4L10_1|Chains... at 100%
4l2f
RCSB PDB
PDBbind
49aa, >4L2F_2|Chains... at 100%
4l2g
RCSB PDB
PDBbind
49aa, >4L2G_2|Chains... at 100%
4l2k
RCSB PDB
PDBbind
49aa, >4L2K_2|Chains... at 100%
4l31
RCSB PDB
PDBbind
49aa, >4L31_2|Chains... at 100%
4l32
RCSB PDB
PDBbind
49aa, >4L32_2|Chains... at 100%
4l33
RCSB PDB
PDBbind
49aa, >4L33_2|Chains... at 100%
4l34
RCSB PDB
PDBbind
49aa, >4L34_2|Chains... at 100%
4m7b
RCSB PDB
PDBbind
240aa, >4M7B_1|Chains... at 100%
4pml
RCSB PDB
PDBbind
227aa, >4PML_1|Chains... at 96%
4pnl
RCSB PDB
PDBbind
227aa, >4PNL_1|Chains... at 96%
4pnm
RCSB PDB
PDBbind
227aa, >4PNM_1|Chains... at 96%
4pnn
RCSB PDB
PDBbind
227aa, >4PNN_1|Chains... at 96%
4pnq
RCSB PDB
PDBbind
227aa, >4PNQ_1|Chains... at 96%
4pnr
RCSB PDB
PDBbind
227aa, >4PNR_1|Chains... at 96%
4pns
RCSB PDB
PDBbind
227aa, >4PNS_1|Chains... at 96%
4pnt
RCSB PDB
PDBbind
227aa, >4PNT_1|Chains... at 96%
4tju
RCSB PDB
PDBbind
227aa, >4TJU_1|Chains... at 96%
4tjw
RCSB PDB
PDBbind
227aa, >4TJW_1|Chains... at 96%
4tjy
RCSB PDB
PDBbind
227aa, >4TJY_1|Chains... at 96%
4tk0
RCSB PDB
PDBbind
227aa, >4TK0_1|Chains... at 96%
4tkf
RCSB PDB
PDBbind
227aa, >4TKF_1|Chains... at 96%
4tkg
RCSB PDB
PDBbind
227aa, >4TKG_1|Chains... at 96%
4tki
RCSB PDB
PDBbind
227aa, >4TKI_1|Chains... at 96%
4ufu
RCSB PDB
PDBbind
240aa, >4UFU_1|Chains... at 100%
4ufy
RCSB PDB
PDBbind
240aa, >4UFY_1|Chains... at 100%
4uhg
RCSB PDB
PDBbind
240aa, >4UHG_1|Chains... at 100%
4ui3
RCSB PDB
PDBbind
48aa, >4UI3_2|Chains... at 100%
4ui4
RCSB PDB
PDBbind
48aa, >4UI4_2|Chains... at 100%
4ui5
RCSB PDB
PDBbind
48aa, >4UI5_2|Chains... at 100%
4ui6
RCSB PDB
PDBbind
48aa, >4UI6_2|Chains... at 100%
4ui7
RCSB PDB
PDBbind
191aa, >4UI7_1|Chains... at 100%
4ui8
RCSB PDB
PDBbind
48aa, >4UI8_2|Chains... at 100%
4uvu
RCSB PDB
PDBbind
240aa, >4UVU_1|Chains... at 100%
4uvv
RCSB PDB
PDBbind
240aa, >4UVV_1|Chains... at 100%
4uvw
RCSB PDB
PDBbind
240aa, >4UVW_1|Chains... at 100%
4uvx
RCSB PDB
PDBbind
240aa, >4UVX_1|Chains... at 100%
4uvy
RCSB PDB
PDBbind
240aa, >4UVY_1|Chains... at 100%
4ux4
RCSB PDB
PDBbind
240aa, >4UX4_1|Chains... at 100%
5adq
RCSB PDB
PDBbind
48aa, >5ADQ_2|Chain... at 100%
5adr
RCSB PDB
PDBbind
48aa, >5ADR_2|Chain... at 100%
5ads
RCSB PDB
PDBbind
48aa, >5ADS_2|Chain... at 100%
5adt
RCSB PDB
PDBbind
48aa, >5ADT_2|Chain... at 100%
5aeh
RCSB PDB
PDBbind
240aa, >5AEH_1|Chains... at 100%
5aku
RCSB PDB
PDBbind
240aa, >5AKU_1|Chains... at 100%
5akw
RCSB PDB
PDBbind
240aa, >5AKW_1|Chains... at 100%
5al1
RCSB PDB
PDBbind
240aa, >5AL1_1|Chains... at 100%
5al2
RCSB PDB
PDBbind
240aa, >5AL2_1|Chains... at 100%
5al3
RCSB PDB
PDBbind
240aa, >5AL3_1|Chains... at 100%
5al4
RCSB PDB
PDBbind
240aa, >5AL4_1|Chains... at 100%
5al5
RCSB PDB
PDBbind
240aa, >5AL5_1|Chains... at 100%
5dcz
RCSB PDB
PDBbind
231aa, >5DCZ_1|Chain... at 94%
5nob
RCSB PDB
PDBbind
240aa, >5NOB_1|Chains... at 100%
5nsp
RCSB PDB
PDBbind
49aa, >5NSP_2|Chains... at 100%
5nsx
RCSB PDB
PDBbind
49aa, >5NSX_2|Chains... at 100%
5nt0
RCSB PDB
PDBbind
49aa, >5NT0_2|Chains... at 100%
5nt4
RCSB PDB
PDBbind
49aa, >5NT4_2|Chains... at 100%
5nut
RCSB PDB
PDBbind
240aa, >5NUT_1|Chains... at 100%
5nvc
RCSB PDB
PDBbind
49aa, >5NVC_2|Chains... at 100%
5nve
RCSB PDB
PDBbind
49aa, >5NVE_2|Chains... at 100%
5nvf
RCSB PDB
PDBbind
49aa, >5NVF_2|Chains... at 100%
5nvh
RCSB PDB
PDBbind
49aa, >5NVH_2|Chains... at 100%
5nwb
RCSB PDB
PDBbind
49aa, >5NWB_2|Chains... at 100%
5nwc
RCSB PDB
PDBbind
49aa, >5NWC_2|Chains... at 100%
5nwd
RCSB PDB
PDBbind
49aa, >5NWD_2|Chains... at 100%
5nwg
RCSB PDB
PDBbind
191aa, >5NWG_1|Chains... at 100%
5ows
RCSB PDB
PDBbind
240aa, >5OWS_1|Chains... at 100%
5owt
RCSB PDB
PDBbind
240aa, >5OWT_1|Chains... at 100%
6a84
RCSB PDB
PDBbind
48aa, >6A84_2|Chain... at 100%
5zqr
RCSB PDB
PDBbind
48aa, >5ZQR_2|Chain... at 100%
5zqq
RCSB PDB
PDBbind
48aa, >5ZQQ_2|Chain... at 100%
5zqo
RCSB PDB
PDBbind
48aa, >5ZQO_2|Chain... at 100%
5zqp
RCSB PDB
PDBbind
48aa, >5ZQP_2|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
4bj9
RCSB PDB
PDBbind
UHB
Entry Information
PDB ID
4tk5
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Tankyrase-2 TNKS2
Ligand Name
UHB
EC.Number
E.C.2.4.2.30
Resolution
2.02(Å)
Affinity (Kd/Ki/IC50)
IC50=32nM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) Acta Crystallogr.,Sect.D Vol. 70: pp. 2740-2753
Ligand Properties
Formula
C
2
4
H
2
8
N
9
O
6
Molecular Weight
538.536
Exact Mass
538.216
No. of atoms
67
No. of bonds
72
Polar Surface Area
202.26
LOGP Value
-2.16 (
Computed with XLOGP3
)
-0.87 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 6
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 15
No. of Rings: 6
Canonical SMILES
O=C(Nc1cccc2c1CNC2=O)C[N@@H+]1CCN(CC1)C(=O)[C@H]1O[C@H]([C@H]([C@@H]1O)O)n1cnc2c1ncnc2N
InChI String
InChI=1S/C24H27N9O6/c25-20-16-21(28-10-27-20)33(11-29-16)24-18(36)17(35)19(39-24)23(38)32-6-4-31(5-7-32)9-15(34)30-14-3-1-2-12-13(14)8-26-22(12)37/h1-3,10-11,17-19,24,35-36H,4-9H2,(H,26,37)(H,30,34)(H2,25,27,28)/p+1/t17-,18-,19-,24+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9H2K2
Entrez Gene ID
NCBI Entrez Gene ID:
80351
ASD
Information of known allosteric effects of PDB entries
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