Browse entries in the PDBbind-CN Database
HEADER 5LNE_COMPLEX COMPND 5LNE_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 65 PHE SER CYS ASN VAL ASP GLY GLY SER SER ILE GLY ALA SEQRES 2 A 65 GLY THR THR SER VAL TYR VAL ASN LEU ASP PRO VAL ILE SEQRES 3 A 65 GLN PRO GLY GLN ASN LEU VAL VAL ASP LEU SER GLN HIS SEQRES 4 A 65 ILE SER CYS TRP ASN ASP TYR GLY GLY TRP TYR ASP THR SEQRES 5 A 65 ASP HIS ILE ASN LEU VAL GLN GLY SER ALA PHE ALA GLY SEQRES 1 A 45 LEU GLN SER TYR LYS GLY SER LEU TYR TRP ASN ASN VAL SEQRES 2 A 45 THR TYR PRO PHE PRO LEU THR THR ASN THR ASN VAL LEU SEQRES 3 A 45 ASP ILE GLY ASP LYS THR PRO MET PRO LEU PRO LEU LYS SEQRES 4 A 45 LEU TYR ILE THR PRO VAL SEQRES 1 A 42 GLY VAL VAL ILE LYS ALA GLY GLU VAL ILE ALA ARG ILE SEQRES 2 A 42 HIS MET TYR LYS ILE ALA THR LEU GLY SER GLY ASN PRO SEQRES 3 A 42 ARG ASN PHE THR TRP ASN ILE ILE SER ASN ASN SER VAL SEQRES 4 A 42 VAL MET PRO HET A A 2G 51 SSBOND 1 CYS A 3 CYS A 42 ATOM 1 N PHE A 1 -13.341 -18.882 32.435 1.00 29.79 N ATOM 2 CA PHE A 1 -13.180 -18.486 30.998 1.00 26.73 C ATOM 3 C PHE A 1 -14.588 -18.324 30.401 1.00 27.19 C ATOM 4 O PHE A 1 -15.463 -19.186 30.652 1.00 24.75 O ATOM 5 CB PHE A 1 -12.422 -19.596 30.261 1.00 27.24 C ATOM 6 CG PHE A 1 -12.287 -19.367 28.775 1.00 25.58 C ATOM 7 CD1 PHE A 1 -11.410 -18.385 28.276 1.00 24.17 C ATOM 8 CD2 PHE A 1 -12.988 -20.157 27.900 1.00 25.16 C ATOM 9 CE1 PHE A 1 -11.281 -18.202 26.931 1.00 22.80 C ATOM 10 CE2 PHE A 1 -12.848 -19.989 26.550 1.00 25.96 C ATOM 11 CZ PHE A 1 -12.011 -18.993 26.065 1.00 24.24 C ATOM 12 HN3 PHE A 1 -13.864 -19.779 32.490 1.00 0.00 H ATOM 13 HN2 PHE A 1 -13.867 -18.141 32.941 1.00 0.00 H ATOM 14 HN1 PHE A 1 -12.403 -19.000 32.868 1.00 0.00 H ATOM 15 N SER A 2 -14.820 -17.256 29.618 1.00 26.32 N ATOM 16 CA SER A 2 -16.113 -17.032 29.010 1.00 27.49 C ATOM 17 C SER A 2 -15.933 -16.694 27.532 1.00 27.94 C ATOM 18 O SER A 2 -14.906 -16.178 27.171 1.00 29.01 O ATOM 19 CB SER A 2 -16.792 -15.865 29.686 1.00 28.77 C ATOM 20 OG SER A 2 -16.888 -16.120 31.065 1.00 32.74 O ATOM 21 HG SER A 2 -15.980 -16.240 31.441 1.00 0.00 H ATOM 22 H SER A 2 -14.052 -16.576 29.446 1.00 0.00 H ATOM 23 N CYS A 3 -16.941 -16.967 26.735 1.00 26.86 N ATOM 24 CA CYS A 3 -17.060 -16.484 25.366 1.00 27.66 C ATOM 25 C CYS A 3 -18.430 -15.953 25.126 1.00 27.89 C ATOM 26 O CYS A 3 -19.324 -16.154 25.953 1.00 25.68 O ATOM 27 CB CYS A 3 -16.912 -17.613 24.377 1.00 30.26 C ATOM 28 SG CYS A 3 -15.358 -18.433 24.538 1.00 32.91 S ATOM 29 H CYS A 3 -17.705 -17.568 27.106 1.00 0.00 H ATOM 30 N ASN A 4 -18.598 -15.232 24.006 1.00 26.76 N ATOM 31 CA ASN A 4 -19.892 -14.852 23.524 1.00 27.18 C ATOM 32 C ASN A 4 -19.906 -14.709 21.989 1.00 28.45 C ATOM 33 O ASN A 4 -18.877 -14.800 21.345 1.00 27.75 O ATOM 34 CB ASN A 4 -20.484 -13.608 24.250 1.00 27.80 C ATOM 35 CG ASN A 4 -19.746 -12.303 23.932 1.00 29.76 C ATOM 36 OD1 ASN A 4 -18.745 -12.274 23.215 1.00 31.92 O ATOM 37 ND2 ASN A 4 -20.211 -11.234 24.512 1.00 29.31 N ATOM 38 HD22 ASN A 4 -21.059 -11.295 25.111 1.00 0.00 H ATOM 39 HD21 ASN A 4 -19.734 -10.320 24.376 1.00 0.00 H ATOM 40 H ASN A 4 -17.757 -14.939 23.469 1.00 0.00 H ATOM 41 N VAL A 5 -21.115 -14.589 21.420 1.00 29.06 N ATOM 42 CA VAL A 5 -21.343 -14.570 19.984 1.00 29.05 C ATOM 43 C VAL A 5 -22.181 -13.322 19.746 1.00 29.98 C ATOM 44 O VAL A 5 -23.226 -13.175 20.357 1.00 27.81 O ATOM 45 CB VAL A 5 -22.064 -15.867 19.506 1.00 30.64 C ATOM 46 CG1 VAL A 5 -22.471 -15.778 18.026 1.00 30.35 C ATOM 47 CG2 VAL A 5 -21.171 -17.089 19.693 1.00 32.30 C ATOM 48 H VAL A 5 -21.941 -14.504 22.046 1.00 0.00 H ATOM 49 N ASP A 6 -21.695 -12.437 18.893 1.00 32.29 N ATOM 50 CA ASP A 6 -22.337 -11.145 18.549 1.00 37.87 C ATOM 51 C ASP A 6 -22.789 -10.379 19.753 1.00 36.22 C ATOM 52 O ASP A 6 -23.847 -9.880 19.775 1.00 38.45 O ATOM 53 CB ASP A 6 -23.479 -11.399 17.583 1.00 40.72 C ATOM 54 CG ASP A 6 -22.970 -12.032 16.262 1.00 46.73 C ATOM 55 OD1 ASP A 6 -21.872 -11.644 15.779 1.00 45.47 O ATOM 56 OD2 ASP A 6 -23.618 -12.978 15.705 1.00 57.21 O ATOM 57 H ASP A 6 -20.793 -12.664 18.427 1.00 0.00 H ATOM 58 N GLY A 7 -21.978 -10.319 20.781 1.00 36.51 N ATOM 59 CA GLY A 7 -22.347 -9.600 21.990 1.00 36.78 C ATOM 60 C GLY A 7 -23.508 -10.205 22.774 1.00 37.99 C ATOM 61 O GLY A 7 -24.143 -9.501 23.480 1.00 36.51 O ATOM 62 H GLY A 7 -21.054 -10.794 20.731 1.00 0.00 H ATOM 63 N GLY A 8 -23.812 -11.508 22.638 1.00 37.04 N ATOM 64 CA GLY A 8 -24.879 -12.144 23.427 1.00 33.94 C ATOM 65 C GLY A 8 -24.352 -12.490 24.803 1.00 33.58 C ATOM 66 O GLY A 8 -23.259 -12.040 25.227 1.00 30.30 O ATOM 67 H GLY A 8 -23.278 -12.083 21.956 1.00 0.00 H ATOM 68 N SER A 9 -25.137 -13.264 25.527 1.00 35.61 N ATOM 69 CA SER A 9 -24.769 -13.582 26.905 1.00 37.45 C ATOM 70 C SER A 9 -23.625 -14.615 26.944 1.00 35.37 C ATOM 71 O SER A 9 -23.281 -15.277 25.925 1.00 32.46 O ATOM 72 CB SER A 9 -25.990 -14.000 27.753 1.00 42.06 C ATOM 73 OG SER A 9 -26.780 -14.960 27.099 1.00 47.97 O ATOM 74 HG SER A 9 -27.110 -14.587 26.243 1.00 0.00 H ATOM 75 H SER A 9 -26.014 -13.646 25.119 1.00 0.00 H ATOM 76 N SER A 10 -22.987 -14.687 28.109 1.00 31.96 N ATOM 77 CA SER A 10 -21.703 -15.309 28.220 1.00 31.41 C ATOM 78 C SER A 10 -21.898 -16.860 28.206 1.00 31.18 C ATOM 79 O SER A 10 -22.947 -17.373 28.537 1.00 29.16 O ATOM 80 CB SER A 10 -21.012 -14.794 29.468 1.00 32.85 C ATOM 81 OG SER A 10 -21.589 -15.451 30.550 1.00 37.06 O ATOM 82 HG SER A 10 -21.163 -15.141 31.388 1.00 0.00 H ATOM 83 H SER A 10 -23.431 -14.282 28.958 1.00 0.00 H ATOM 84 N ILE A 11 -20.873 -17.594 27.790 1.00 30.34 N ATOM 85 CA ILE A 11 -20.971 -19.025 27.490 1.00 28.18 C ATOM 86 C ILE A 11 -19.785 -19.630 28.185 1.00 26.88 C ATOM 87 O ILE A 11 -18.670 -19.153 28.021 1.00 28.78 O ATOM 88 CB ILE A 11 -20.853 -19.338 25.938 1.00 28.46 C ATOM 89 CG1 ILE A 11 -21.900 -18.601 25.115 1.00 30.34 C ATOM 90 CG2 ILE A 11 -20.948 -20.850 25.644 1.00 28.31 C ATOM 91 CD1 ILE A 11 -21.566 -18.486 23.595 1.00 31.69 C ATOM 92 H ILE A 11 -19.951 -17.128 27.671 1.00 0.00 H ATOM 93 N GLY A 12 -19.992 -20.718 28.890 1.00 25.99 N ATOM 94 CA GLY A 12 -18.944 -21.364 29.663 1.00 25.57 C ATOM 95 C GLY A 12 -18.521 -22.708 29.067 1.00 25.44 C ATOM 96 O GLY A 12 -17.485 -23.214 29.444 1.00 27.90 O ATOM 97 H GLY A 12 -20.945 -21.135 28.896 1.00 0.00 H ATOM 98 N ALA A 13 -19.320 -23.273 28.187 1.00 25.01 N ATOM 99 CA ALA A 13 -19.170 -24.613 27.588 1.00 27.30 C ATOM 100 C ALA A 13 -20.364 -24.898 26.627 1.00 27.96 C ATOM 101 O ALA A 13 -21.336 -24.169 26.620 1.00 26.71 O ATOM 102 CB ALA A 13 -19.156 -25.706 28.677 1.00 26.65 C ATOM 103 H ALA A 13 -20.144 -22.716 27.882 1.00 0.00 H ATOM 104 N GLY A 14 -20.308 -26.014 25.887 1.00 27.97 N ATOM 105 CA GLY A 14 -21.460 -26.491 25.186 1.00 26.79 C ATOM 106 C GLY A 14 -21.436 -26.049 23.740 1.00 27.64 C ATOM 107 O GLY A 14 -20.477 -25.437 23.294 1.00 25.85 O ATOM 108 H GLY A 14 -19.414 -26.541 25.821 1.00 0.00 H ATOM 109 N THR A 15 -22.530 -26.352 23.037 1.00 28.52 N ATOM 110 CA THR A 15 -22.720 -26.039 21.617 1.00 30.19 C ATOM 111 C THR A 15 -23.457 -24.745 21.441 1.00 30.33 C ATOM 112 O THR A 15 -24.431 -24.511 22.131 1.00 30.28 O ATOM 113 CB THR A 15 -23.507 -27.129 20.939 1.00 32.31 C ATOM 114 OG1 THR A 15 -22.839 -28.369 21.174 1.00 32.94 O ATOM 115 CG2 THR A 15 -23.598 -26.916 19.432 1.00 33.59 C ATOM 116 HG1 THR A 15 -23.341 -29.101 20.736 1.00 0.00 H ATOM 117 H THR A 15 -23.301 -26.844 23.531 1.00 0.00 H ATOM 118 N THR A 16 -22.982 -23.915 20.520 1.00 30.32 N ATOM 119 CA THR A 16 -23.601 -22.630 20.200 1.00 31.20 C ATOM 120 C THR A 16 -23.642 -22.488 18.663 1.00 28.85 C ATOM 121 O THR A 16 -22.653 -22.765 17.977 1.00 28.45 O ATOM 122 CB THR A 16 -22.814 -21.414 20.808 1.00 31.74 C ATOM 123 OG1 THR A 16 -22.488 -21.637 22.185 1.00 31.38 O ATOM 124 CG2 THR A 16 -23.586 -20.135 20.703 1.00 33.88 C ATOM 125 HG1 THR A 16 -21.924 -22.447 22.262 1.00 0.00 H ATOM 126 H THR A 16 -22.126 -24.193 20.000 1.00 0.00 H ATOM 127 N SER A 17 -24.764 -22.010 18.130 1.00 26.79 N ATOM 128 CA SER A 17 -24.933 -21.750 16.689 1.00 28.73 C ATOM 129 C SER A 17 -24.346 -20.358 16.364 1.00 27.96 C ATOM 130 O SER A 17 -24.481 -19.462 17.164 1.00 29.62 O ATOM 131 CB SER A 17 -26.402 -21.721 16.348 1.00 30.88 C ATOM 132 OG SER A 17 -26.977 -23.017 16.460 1.00 30.91 O ATOM 133 HG SER A 17 -27.939 -22.971 16.232 1.00 0.00 H ATOM 134 H SER A 17 -25.564 -21.809 18.764 1.00 0.00 H ATOM 135 N VAL A 18 -23.610 -20.231 15.270 1.00 27.85 N ATOM 136 CA VAL A 18 -22.941 -18.945 14.881 1.00 27.20 C ATOM 137 C VAL A 18 -23.385 -18.659 13.453 1.00 29.14 C ATOM 138 O VAL A 18 -23.023 -19.369 12.523 1.00 26.27 O ATOM 139 CB VAL A 18 -21.392 -19.017 14.944 1.00 26.95 C ATOM 140 CG1 VAL A 18 -20.766 -17.656 14.600 1.00 26.81 C ATOM 141 CG2 VAL A 18 -20.895 -19.484 16.335 1.00 27.01 C ATOM 142 H VAL A 18 -23.490 -21.060 14.653 1.00 0.00 H ATOM 143 N TYR A 19 -24.213 -17.619 13.325 1.00 30.87 N ATOM 144 CA TYR A 19 -24.839 -17.208 12.045 1.00 31.17 C ATOM 145 C TYR A 19 -23.945 -16.222 11.270 1.00 31.63 C ATOM 146 O TYR A 19 -23.465 -15.296 11.836 1.00 33.27 O ATOM 147 CB TYR A 19 -26.257 -16.682 12.305 1.00 29.65 C ATOM 148 CG TYR A 19 -27.241 -17.848 12.655 1.00 29.46 C ATOM 149 CD1 TYR A 19 -27.396 -18.302 14.013 1.00 28.96 C ATOM 150 CD2 TYR A 19 -27.983 -18.494 11.675 1.00 29.44 C ATOM 151 CE1 TYR A 19 -28.235 -19.367 14.338 1.00 30.05 C ATOM 152 CE2 TYR A 19 -28.851 -19.567 11.998 1.00 30.38 C ATOM 153 CZ TYR A 19 -28.963 -20.007 13.331 1.00 30.84 C ATOM 154 OH TYR A 19 -29.829 -21.023 13.703 1.00 34.39 O ATOM 155 HH TYR A 19 -29.755 -21.178 14.678 1.00 0.00 H ATOM 156 H TYR A 19 -24.432 -17.063 14.176 1.00 0.00 H ATOM 157 N VAL A 20 -23.618 -16.537 10.023 1.00 33.63 N ATOM 158 CA VAL A 20 -22.713 -15.733 9.193 1.00 31.85 C ATOM 159 C VAL A 20 -23.468 -15.362 7.911 1.00 35.15 C ATOM 160 O VAL A 20 -24.274 -16.157 7.412 1.00 31.88 O ATOM 161 CB VAL A 20 -21.386 -16.496 8.863 1.00 32.53 C ATOM 162 CG1 VAL A 20 -20.656 -16.837 10.137 1.00 34.08 C ATOM 163 CG2 VAL A 20 -21.565 -17.818 8.046 1.00 33.07 C ATOM 164 H VAL A 20 -24.025 -17.401 9.611 1.00 0.00 H ATOM 165 N ASN A 21 -23.220 -14.178 7.351 1.00 35.65 N ATOM 166 CA ASN A 21 -23.691 -13.862 5.989 1.00 38.01 C ATOM 167 C ASN A 21 -22.606 -14.173 5.013 1.00 38.53 C ATOM 168 O ASN A 21 -21.465 -13.847 5.258 1.00 41.47 O ATOM 169 CB ASN A 21 -24.054 -12.383 5.884 1.00 40.11 C ATOM 170 CG ASN A 21 -25.163 -12.023 6.822 1.00 40.84 C ATOM 171 OD1 ASN A 21 -26.260 -12.559 6.715 1.00 45.49 O ATOM 172 ND2 ASN A 21 -24.873 -11.201 7.792 1.00 43.61 N ATOM 173 HD22 ASN A 21 -23.928 -10.769 7.843 1.00 0.00 H ATOM 174 HD21 ASN A 21 -25.587 -10.977 8.515 1.00 0.00 H ATOM 175 H ASN A 21 -22.684 -13.464 7.884 1.00 0.00 H ATOM 176 N LEU A 22 -22.927 -14.846 3.929 1.00 39.60 N ATOM 177 CA LEU A 22 -21.919 -15.243 2.963 1.00 39.80 C ATOM 178 C LEU A 22 -22.267 -14.637 1.624 1.00 42.94 C ATOM 179 O LEU A 22 -23.412 -14.263 1.386 1.00 44.21 O ATOM 180 CB LEU A 22 -21.921 -16.746 2.866 1.00 40.59 C ATOM 181 CG LEU A 22 -21.571 -17.488 4.136 1.00 43.80 C ATOM 182 CD1 LEU A 22 -21.658 -18.985 3.891 1.00 44.41 C ATOM 183 CD2 LEU A 22 -20.164 -17.147 4.564 1.00 46.20 C ATOM 184 H LEU A 22 -23.922 -15.098 3.761 1.00 0.00 H ATOM 185 N ASP A 23 -21.294 -14.606 0.729 1.00 51.73 N ATOM 186 CA ASP A 23 -21.513 -14.151 -0.690 1.00 55.69 C ATOM 187 C ASP A 23 -22.511 -15.094 -1.356 1.00 53.65 C ATOM 188 O ASP A 23 -22.289 -16.290 -1.345 1.00 49.55 O ATOM 189 CB ASP A 23 -20.229 -14.177 -1.540 1.00 61.21 C ATOM 190 CG ASP A 23 -19.617 -12.784 -1.765 1.00 67.47 C ATOM 191 OD1 ASP A 23 -20.340 -11.766 -1.885 1.00 77.32 O ATOM 192 OD2 ASP A 23 -18.373 -12.703 -1.844 1.00 72.03 O ATOM 193 H ASP A 23 -20.341 -14.907 1.016 1.00 0.00 H ATOM 194 N PRO A 24 -23.612 -14.567 -1.907 1.00 50.42 N ATOM 195 CA PRO A 24 -24.639 -15.489 -2.406 1.00 49.15 C ATOM 196 C PRO A 24 -24.318 -16.260 -3.704 1.00 49.31 C ATOM 197 O PRO A 24 -24.980 -17.280 -3.973 1.00 44.59 O ATOM 198 CB PRO A 24 -25.847 -14.588 -2.583 1.00 50.00 C ATOM 199 CG PRO A 24 -25.290 -13.223 -2.666 1.00 49.71 C ATOM 200 CD PRO A 24 -24.144 -13.214 -1.720 1.00 50.46 C ATOM 201 N VAL A 25 -23.276 -15.832 -4.430 1.00 51.89 N ATOM 202 CA VAL A 25 -22.813 -16.468 -5.685 1.00 52.66 C ATOM 203 C VAL A 25 -21.304 -16.714 -5.575 1.00 54.91 C ATOM 204 O VAL A 25 -20.602 -15.789 -5.239 1.00 58.59 O ATOM 205 CB VAL A 25 -23.090 -15.515 -6.854 1.00 53.49 C ATOM 206 CG1 VAL A 25 -22.621 -16.105 -8.188 1.00 54.26 C ATOM 207 CG2 VAL A 25 -24.573 -15.155 -6.879 1.00 52.50 C ATOM 208 H VAL A 25 -22.758 -14.997 -4.089 1.00 0.00 H ATOM 209 N ILE A 26 -20.843 -17.944 -5.819 1.00 58.45 N ATOM 210 CA ILE A 26 -19.414 -18.330 -5.984 1.00 63.09 C ATOM 211 C ILE A 26 -19.147 -19.035 -7.379 1.00 69.03 C ATOM 212 O ILE A 26 -20.088 -19.610 -7.941 1.00 73.29 O ATOM 213 CB ILE A 26 -18.966 -19.281 -4.815 1.00 64.44 C ATOM 214 CG1 ILE A 26 -17.454 -19.467 -4.801 1.00 68.73 C ATOM 215 CG2 ILE A 26 -19.579 -20.679 -4.867 1.00 62.85 C ATOM 216 CD1 ILE A 26 -16.924 -20.059 -3.525 1.00 73.05 C ATOM 217 H ILE A 26 -21.549 -18.704 -5.902 1.00 0.00 H ATOM 218 N GLN A 27 -17.900 -19.028 -7.921 1.00 67.35 N ATOM 219 CA GLN A 27 -17.513 -19.699 -9.211 1.00 64.36 C ATOM 220 C GLN A 27 -16.651 -20.943 -8.936 1.00 67.15 C ATOM 221 O GLN A 27 -16.038 -21.043 -7.873 1.00 71.08 O ATOM 222 CB GLN A 27 -16.680 -18.755 -10.070 1.00 62.53 C ATOM 223 CG GLN A 27 -17.270 -17.370 -10.313 1.00 62.81 C ATOM 224 CD GLN A 27 -18.538 -17.425 -11.108 1.00 59.21 C ATOM 225 OE1 GLN A 27 -19.415 -16.554 -11.006 1.00 56.56 O ATOM 226 NE2 GLN A 27 -18.696 -18.520 -11.829 1.00 59.48 N ATOM 227 HE22 GLN A 27 -17.930 -19.222 -11.883 1.00 0.00 H ATOM 228 HE21 GLN A 27 -19.586 -18.681 -12.342 1.00 0.00 H ATOM 229 H GLN A 27 -17.155 -18.519 -7.403 1.00 0.00 H ATOM 230 N PRO A 28 -16.577 -21.901 -9.886 1.00 68.17 N ATOM 231 CA PRO A 28 -15.708 -23.096 -9.678 1.00 67.41 C ATOM 232 C PRO A 28 -14.246 -22.728 -9.350 1.00 70.45 C ATOM 233 O PRO A 28 -13.726 -21.706 -9.864 1.00 69.24 O ATOM 234 CB PRO A 28 -15.813 -23.869 -11.012 1.00 69.06 C ATOM 235 CG PRO A 28 -16.991 -23.292 -11.745 1.00 68.15 C ATOM 236 CD PRO A 28 -17.245 -21.907 -11.206 1.00 68.36 C ATOM 237 N GLY A 29 -13.617 -23.497 -8.447 1.00 68.94 N ATOM 238 CA GLY A 29 -12.274 -23.172 -7.945 1.00 65.02 C ATOM 239 C GLY A 29 -12.130 -21.913 -7.081 1.00 64.80 C ATOM 240 O GLY A 29 -11.079 -21.682 -6.518 1.00 61.88 O ATOM 241 H GLY A 29 -14.095 -24.350 -8.091 1.00 0.00 H ATOM 242 N GLN A 30 -13.158 -21.079 -6.963 1.00 66.15 N ATOM 243 CA GLN A 30 -13.083 -19.861 -6.148 1.00 65.68 C ATOM 244 C GLN A 30 -13.269 -20.229 -4.673 1.00 66.52 C ATOM 245 O GLN A 30 -13.937 -21.197 -4.291 1.00 63.98 O ATOM 246 CB GLN A 30 -14.146 -18.858 -6.595 1.00 66.75 C ATOM 247 CG GLN A 30 -14.122 -17.478 -5.961 1.00 68.26 C ATOM 248 CD GLN A 30 -15.432 -16.742 -6.195 1.00 71.35 C ATOM 249 OE1 GLN A 30 -16.013 -16.790 -7.268 1.00 74.91 O ATOM 250 NE2 GLN A 30 -15.922 -16.083 -5.167 1.00 78.28 N ATOM 251 HE22 GLN A 30 -15.402 -16.062 -4.267 1.00 0.00 H ATOM 252 HE21 GLN A 30 -16.830 -15.583 -5.255 1.00 0.00 H ATOM 253 H GLN A 30 -14.043 -21.296 -7.464 1.00 0.00 H ATOM 254 N ASN A 31 -12.649 -19.445 -3.829 1.00 70.88 N ATOM 255 CA ASN A 31 -12.625 -19.793 -2.458 1.00 72.45 C ATOM 256 C ASN A 31 -13.547 -18.948 -1.586 1.00 66.67 C ATOM 257 O ASN A 31 -13.473 -17.719 -1.591 1.00 64.75 O ATOM 258 CB ASN A 31 -11.200 -19.747 -1.992 1.00 77.34 C ATOM 259 CG ASN A 31 -11.061 -20.415 -0.716 1.00 84.93 C ATOM 260 OD1 ASN A 31 -10.841 -21.621 -0.667 1.00 92.42 O ATOM 261 ND2 ASN A 31 -11.354 -19.679 0.343 1.00 92.10 N ATOM 262 HD22 ASN A 31 -11.530 -18.660 0.235 1.00 0.00 H ATOM 263 HD21 ASN A 31 -11.408 -20.119 1.284 1.00 0.00 H ATOM 264 H ASN A 31 -12.180 -18.578 -4.161 1.00 0.00 H ATOM 265 N LEU A 32 -14.405 -19.625 -0.829 1.00 56.85 N ATOM 266 CA LEU A 32 -15.339 -18.972 0.071 1.00 51.65 C ATOM 267 C LEU A 32 -14.724 -18.779 1.482 1.00 49.64 C ATOM 268 O LEU A 32 -14.207 -19.755 2.060 1.00 43.47 O ATOM 269 CB LEU A 32 -16.560 -19.861 0.116 1.00 54.48 C ATOM 270 CG LEU A 32 -17.760 -19.566 0.977 1.00 54.43 C ATOM 271 CD1 LEU A 32 -17.996 -18.087 1.022 1.00 55.47 C ATOM 272 CD2 LEU A 32 -18.917 -20.299 0.332 1.00 55.91 C ATOM 273 H LEU A 32 -14.407 -20.664 -0.884 1.00 0.00 H ATOM 274 N VAL A 33 -14.776 -17.554 2.033 1.00 46.54 N ATOM 275 CA VAL A 33 -14.165 -17.238 3.354 1.00 44.34 C ATOM 276 C VAL A 33 -15.210 -16.956 4.402 1.00 43.35 C ATOM 277 O VAL A 33 -16.105 -16.156 4.198 1.00 45.17 O ATOM 278 CB VAL A 33 -13.233 -16.014 3.338 1.00 45.86 C ATOM 279 CG1 VAL A 33 -12.297 -16.023 4.549 1.00 45.14 C ATOM 280 CG2 VAL A 33 -12.394 -15.987 2.051 1.00 50.28 C ATOM 281 H VAL A 33 -15.263 -16.795 1.515 1.00 0.00 H ATOM 282 N VAL A 34 -15.074 -17.614 5.545 1.00 37.70 N ATOM 283 CA VAL A 34 -15.895 -17.350 6.657 1.00 39.37 C ATOM 284 C VAL A 34 -15.014 -16.790 7.799 1.00 39.29 C ATOM 285 O VAL A 34 -14.258 -17.548 8.402 1.00 36.67 O ATOM 286 CB VAL A 34 -16.627 -18.623 7.142 1.00 40.39 C ATOM 287 CG1 VAL A 34 -17.722 -18.204 8.093 1.00 39.10 C ATOM 288 CG2 VAL A 34 -17.224 -19.431 6.007 1.00 41.68 C ATOM 289 H VAL A 34 -14.339 -18.346 5.622 1.00 0.00 H ATOM 290 N ASP A 35 -15.148 -15.499 8.128 1.00 39.51 N ATOM 291 CA ASP A 35 -14.334 -14.882 9.175 1.00 41.51 C ATOM 292 C ASP A 35 -15.073 -14.908 10.518 1.00 40.34 C ATOM 293 O ASP A 35 -15.899 -14.029 10.825 1.00 41.87 O ATOM 294 CB ASP A 35 -13.880 -13.432 8.845 1.00 43.41 C ATOM 295 CG ASP A 35 -12.847 -12.850 9.918 1.00 48.78 C ATOM 296 OD1 ASP A 35 -12.731 -13.417 11.050 1.00 45.19 O ATOM 297 OD2 ASP A 35 -12.161 -11.811 9.648 1.00 48.03 O ATOM 298 H ASP A 35 -15.850 -14.919 7.625 1.00 0.00 H ATOM 299 N LEU A 36 -14.669 -15.855 11.353 1.00 36.23 N ATOM 300 CA LEU A 36 -15.323 -16.006 12.654 1.00 35.64 C ATOM 301 C LEU A 36 -14.837 -15.042 13.693 1.00 31.90 C ATOM 302 O LEU A 36 -15.482 -14.894 14.703 1.00 33.64 O ATOM 303 CB LEU A 36 -15.267 -17.459 13.178 1.00 34.86 C ATOM 304 CG LEU A 36 -16.129 -18.549 12.514 1.00 37.94 C ATOM 305 CD1 LEU A 36 -17.557 -18.223 12.069 1.00 37.97 C ATOM 306 CD2 LEU A 36 -15.370 -18.965 11.295 1.00 41.44 C ATOM 307 H LEU A 36 -13.890 -16.489 11.085 1.00 0.00 H ATOM 308 N SER A 37 -13.706 -14.398 13.480 1.00 33.13 N ATOM 309 CA SER A 37 -13.211 -13.328 14.385 1.00 34.65 C ATOM 310 C SER A 37 -14.166 -12.117 14.546 1.00 36.07 C ATOM 311 O SER A 37 -14.177 -11.474 15.599 1.00 37.83 O ATOM 312 CB SER A 37 -11.833 -12.871 13.973 1.00 34.84 C ATOM 313 OG SER A 37 -11.902 -11.913 12.970 1.00 39.40 O ATOM 314 HG SER A 37 -12.358 -12.297 12.180 1.00 0.00 H ATOM 315 H SER A 37 -13.138 -14.649 12.646 1.00 0.00 H ATOM 316 N GLN A 38 -15.091 -11.937 13.598 1.00 34.42 N ATOM 317 CA GLN A 38 -16.128 -10.916 13.737 1.00 35.57 C ATOM 318 C GLN A 38 -17.225 -11.297 14.699 1.00 34.71 C ATOM 319 O GLN A 38 -17.982 -10.458 15.042 1.00 30.77 O ATOM 320 CB GLN A 38 -16.808 -10.565 12.372 1.00 40.02 C ATOM 321 CG GLN A 38 -15.826 -10.323 11.217 1.00 45.67 C ATOM 322 CD GLN A 38 -14.785 -9.198 11.449 1.00 52.99 C ATOM 323 OE1 GLN A 38 -15.102 -8.120 11.974 1.00 56.83 O ATOM 324 NE2 GLN A 38 -13.539 -9.432 10.997 1.00 56.88 N ATOM 325 HE22 GLN A 38 -13.307 -10.348 10.562 1.00 0.00 H ATOM 326 HE21 GLN A 38 -12.808 -8.697 11.083 1.00 0.00 H ATOM 327 H GLN A 38 -15.073 -12.534 12.746 1.00 0.00 H ATOM 328 N HIS A 39 -17.396 -12.590 15.009 1.00 34.73 N ATOM 329 CA HIS A 39 -18.544 -13.095 15.732 1.00 35.52 C ATOM 330 C HIS A 39 -18.283 -13.602 17.121 1.00 31.22 C ATOM 331 O HIS A 39 -19.085 -13.369 17.996 1.00 31.44 O ATOM 332 CB HIS A 39 -19.240 -14.180 14.894 1.00 36.69 C ATOM 333 CG HIS A 39 -19.730 -13.668 13.571 1.00 41.21 C ATOM 334 ND1 HIS A 39 -20.863 -12.885 13.444 1.00 43.23 N ATOM 335 CD2 HIS A 39 -19.214 -13.792 12.321 1.00 39.17 C ATOM 336 CE1 HIS A 39 -21.049 -12.602 12.164 1.00 43.02 C ATOM 337 NE2 HIS A 39 -20.071 -13.148 11.465 1.00 39.46 N ATOM 338 H HIS A 39 -16.664 -13.267 14.714 1.00 0.00 H ATOM 339 N ILE A 40 -17.187 -14.304 17.319 1.00 29.30 N ATOM 340 CA ILE A 40 -16.944 -14.951 18.562 1.00 28.88 C ATOM 341 C ILE A 40 -15.787 -14.213 19.271 1.00 26.92 C ATOM 342 O ILE A 40 -14.745 -13.998 18.664 1.00 25.09 O ATOM 343 CB ILE A 40 -16.565 -16.411 18.353 1.00 29.71 C ATOM 344 CG1 ILE A 40 -17.435 -17.143 17.312 1.00 28.98 C ATOM 345 CG2 ILE A 40 -16.633 -17.141 19.697 1.00 30.82 C ATOM 346 CD1 ILE A 40 -16.853 -18.532 16.946 1.00 29.27 C ATOM 347 H ILE A 40 -16.487 -14.387 16.554 1.00 0.00 H ATOM 348 N SER A 41 -15.958 -13.925 20.552 1.00 25.51 N ATOM 349 CA SER A 41 -14.953 -13.332 21.417 1.00 27.83 C ATOM 350 C SER A 41 -14.866 -14.133 22.741 1.00 26.43 C ATOM 351 O SER A 41 -15.877 -14.565 23.154 1.00 28.53 O ATOM 352 CB SER A 41 -15.380 -11.898 21.755 1.00 28.19 C ATOM 353 OG SER A 41 -15.320 -11.173 20.541 1.00 30.68 O ATOM 354 HG SER A 41 -15.935 -11.583 19.882 1.00 0.00 H ATOM 355 H SER A 41 -16.885 -14.140 20.972 1.00 0.00 H ATOM 356 N CYS A 42 -13.710 -14.146 23.426 1.00 26.58 N ATOM 357 CA CYS A 42 -13.510 -14.829 24.676 1.00 28.27 C ATOM 358 C CYS A 42 -12.651 -14.023 25.598 1.00 28.15 C ATOM 359 O CYS A 42 -11.878 -13.158 25.132 1.00 29.25 O ATOM 360 CB CYS A 42 -12.857 -16.228 24.408 1.00 31.38 C ATOM 361 SG CYS A 42 -13.934 -17.311 23.369 1.00 40.07 S ATOM 362 H CYS A 42 -12.904 -13.626 23.024 1.00 0.00 H ATOM 363 N TRP A 43 -12.771 -14.252 26.913 1.00 25.67 N ATOM 364 CA TRP A 43 -11.949 -13.540 27.842 1.00 25.73 C ATOM 365 C TRP A 43 -11.686 -14.353 29.134 1.00 24.60 C ATOM 366 O TRP A 43 -12.383 -15.309 29.443 1.00 24.89 O ATOM 367 CB TRP A 43 -12.615 -12.160 28.160 1.00 27.43 C ATOM 368 CG TRP A 43 -14.027 -12.241 28.788 1.00 26.82 C ATOM 369 CD1 TRP A 43 -14.303 -12.304 30.097 1.00 27.34 C ATOM 370 CD2 TRP A 43 -15.307 -12.347 28.092 1.00 26.81 C ATOM 371 NE1 TRP A 43 -15.657 -12.447 30.277 1.00 27.72 N ATOM 372 CE2 TRP A 43 -16.301 -12.452 29.080 1.00 27.86 C ATOM 373 CE3 TRP A 43 -15.685 -12.416 26.731 1.00 24.77 C ATOM 374 CZ2 TRP A 43 -17.674 -12.568 28.759 1.00 30.32 C ATOM 375 CZ3 TRP A 43 -16.987 -12.527 26.409 1.00 25.93 C ATOM 376 CH2 TRP A 43 -17.993 -12.621 27.386 1.00 28.39 C ATOM 377 HE1 TRP A 43 -16.125 -12.539 31.201 1.00 0.00 H ATOM 378 H TRP A 43 -13.462 -14.948 27.258 1.00 0.00 H ATOM 379 N ASN A 44 -10.653 -13.949 29.856 1.00 24.40 N ATOM 380 CA ASN A 44 -10.315 -14.484 31.165 1.00 23.96 C ATOM 381 C ASN A 44 -11.257 -13.860 32.138 1.00 25.56 C ATOM 382 O ASN A 44 -11.482 -12.648 32.102 1.00 26.68 O ATOM 383 CB ASN A 44 -8.877 -14.159 31.499 1.00 24.47 C ATOM 384 CG ASN A 44 -8.348 -14.910 32.725 1.00 25.00 C ATOM 385 OD1 ASN A 44 -8.704 -14.592 33.879 1.00 24.05 O ATOM 386 ND2 ASN A 44 -7.602 -15.989 32.459 1.00 23.32 N ATOM 387 HD22 ASN A 44 -7.334 -16.207 31.478 1.00 0.00 H ATOM 388 HD21 ASN A 44 -7.290 -16.609 33.233 1.00 0.00 H ATOM 389 H ASN A 44 -10.045 -13.202 29.463 1.00 0.00 H ATOM 390 N ASP A 45 -11.852 -14.664 33.002 1.00 27.35 N ATOM 391 CA ASP A 45 -12.816 -14.136 33.983 1.00 28.28 C ATOM 392 C ASP A 45 -12.174 -13.408 35.164 1.00 27.45 C ATOM 393 O ASP A 45 -12.877 -12.737 35.852 1.00 26.21 O ATOM 394 CB ASP A 45 -13.800 -15.225 34.482 1.00 29.48 C ATOM 395 CG ASP A 45 -14.771 -15.683 33.388 1.00 32.31 C ATOM 396 OD1 ASP A 45 -15.251 -14.855 32.610 1.00 36.82 O ATOM 397 OD2 ASP A 45 -15.030 -16.880 33.233 1.00 33.93 O ATOM 398 H ASP A 45 -11.637 -15.681 32.989 1.00 0.00 H ATOM 399 N TYR A 46 -10.876 -13.537 35.432 1.00 29.06 N ATOM 400 CA TYR A 46 -10.263 -12.750 36.524 1.00 29.34 C ATOM 401 C TYR A 46 -9.359 -11.582 36.047 1.00 31.54 C ATOM 402 O TYR A 46 -9.271 -10.571 36.723 1.00 28.05 O ATOM 403 CB TYR A 46 -9.386 -13.625 37.386 1.00 30.87 C ATOM 404 CG TYR A 46 -10.019 -14.877 37.960 1.00 31.61 C ATOM 405 CD1 TYR A 46 -11.321 -14.903 38.426 1.00 32.14 C ATOM 406 CD2 TYR A 46 -9.257 -16.024 38.090 1.00 33.57 C ATOM 407 CE1 TYR A 46 -11.861 -16.064 38.953 1.00 34.62 C ATOM 408 CE2 TYR A 46 -9.766 -17.182 38.613 1.00 33.26 C ATOM 409 CZ TYR A 46 -11.073 -17.208 39.048 1.00 34.76 C ATOM 410 OH TYR A 46 -11.585 -18.373 39.602 1.00 38.55 O ATOM 411 HH TYR A 46 -12.529 -18.227 39.861 1.00 0.00 H ATOM 412 H TYR A 46 -10.293 -14.192 34.873 1.00 0.00 H ATOM 413 N GLY A 47 -8.643 -11.756 34.914 1.00 29.54 N ATOM 414 CA GLY A 47 -7.675 -10.757 34.484 1.00 29.29 C ATOM 415 C GLY A 47 -6.319 -10.892 35.185 1.00 29.20 C ATOM 416 O GLY A 47 -6.121 -11.747 36.076 1.00 28.35 O ATOM 417 H GLY A 47 -8.785 -12.613 34.343 1.00 0.00 H ATOM 418 N GLY A 48 -5.381 -10.062 34.726 1.00 27.82 N ATOM 419 CA GLY A 48 -4.048 -10.037 35.232 1.00 27.54 C ATOM 420 C GLY A 48 -3.216 -11.304 35.067 1.00 27.74 C ATOM 421 O GLY A 48 -2.210 -11.438 35.731 1.00 27.01 O ATOM 422 H GLY A 48 -5.634 -9.402 33.963 1.00 0.00 H ATOM 423 N TRP A 49 -3.596 -12.242 34.222 1.00 28.18 N ATOM 424 CA TRP A 49 -2.764 -13.464 33.966 1.00 28.80 C ATOM 425 C TRP A 49 -2.580 -14.282 35.249 1.00 30.88 C ATOM 426 O TRP A 49 -1.651 -14.965 35.410 1.00 30.84 O ATOM 427 CB TRP A 49 -1.428 -13.047 33.289 1.00 30.20 C ATOM 428 CG TRP A 49 -1.642 -12.576 31.895 1.00 29.02 C ATOM 429 CD1 TRP A 49 -2.235 -11.441 31.530 1.00 28.72 C ATOM 430 CD2 TRP A 49 -1.417 -13.341 30.677 1.00 28.69 C ATOM 431 NE1 TRP A 49 -2.376 -11.398 30.156 1.00 29.06 N ATOM 432 CE2 TRP A 49 -1.881 -12.550 29.610 1.00 28.58 C ATOM 433 CE3 TRP A 49 -0.854 -14.597 30.399 1.00 28.67 C ATOM 434 CZ2 TRP A 49 -1.786 -12.952 28.268 1.00 30.99 C ATOM 435 CZ3 TRP A 49 -0.745 -15.008 29.065 1.00 31.86 C ATOM 436 CH2 TRP A 49 -1.191 -14.165 28.000 1.00 31.09 C ATOM 437 HE1 TRP A 49 -2.794 -10.611 29.620 1.00 0.00 H ATOM 438 H TRP A 49 -4.499 -12.132 33.718 1.00 0.00 H ATOM 439 N TYR A 50 -3.539 -14.196 36.161 1.00 32.42 N ATOM 440 CA TYR A 50 -3.474 -14.852 37.433 1.00 34.42 C ATOM 441 C TYR A 50 -3.783 -16.353 37.224 1.00 34.57 C ATOM 442 O TYR A 50 -3.097 -17.230 37.741 1.00 32.65 O ATOM 443 CB TYR A 50 -4.506 -14.190 38.407 1.00 38.10 C ATOM 444 CG TYR A 50 -4.539 -14.885 39.693 1.00 44.30 C ATOM 445 CD1 TYR A 50 -3.461 -14.802 40.575 1.00 49.48 C ATOM 446 CD2 TYR A 50 -5.619 -15.688 40.043 1.00 49.65 C ATOM 447 CE1 TYR A 50 -3.481 -15.474 41.800 1.00 51.96 C ATOM 448 CE2 TYR A 50 -5.640 -16.391 41.249 1.00 49.64 C ATOM 449 CZ TYR A 50 -4.574 -16.266 42.116 1.00 52.99 C ATOM 450 OH TYR A 50 -4.612 -16.971 43.267 1.00 59.95 O ATOM 451 HH TYR A 50 -3.792 -16.790 43.791 1.00 0.00 H ATOM 452 H TYR A 50 -4.380 -13.624 35.942 1.00 0.00 H ATOM 453 N ASP A 51 -4.879 -16.644 36.532 1.00 32.29 N ATOM 454 CA ASP A 51 -5.239 -18.024 36.203 1.00 29.02 C ATOM 455 C ASP A 51 -5.419 -18.072 34.696 1.00 27.50 C ATOM 456 O ASP A 51 -6.510 -17.927 34.235 1.00 25.42 O ATOM 457 CB ASP A 51 -6.532 -18.475 36.906 1.00 28.57 C ATOM 458 CG ASP A 51 -6.747 -19.990 36.789 1.00 28.26 C ATOM 459 OD1 ASP A 51 -5.855 -20.603 36.196 1.00 32.04 O ATOM 460 OD2 ASP A 51 -7.770 -20.553 37.279 1.00 26.58 O ATOM 461 H ASP A 51 -5.498 -15.870 36.216 1.00 0.00 H ATOM 462 N THR A 52 -4.333 -18.255 33.949 1.00 25.83 N ATOM 463 CA THR A 52 -4.349 -18.006 32.509 1.00 25.74 C ATOM 464 C THR A 52 -5.090 -19.184 31.790 1.00 26.41 C ATOM 465 O THR A 52 -4.896 -20.309 32.136 1.00 25.04 O ATOM 466 CB THR A 52 -2.935 -17.787 31.993 1.00 26.33 C ATOM 467 OG1 THR A 52 -2.305 -16.659 32.619 1.00 30.58 O ATOM 468 CG2 THR A 52 -2.893 -17.596 30.472 1.00 27.17 C ATOM 469 HG1 THR A 52 -1.390 -16.551 32.257 1.00 0.00 H ATOM 470 H THR A 52 -3.454 -18.582 34.399 1.00 0.00 H ATOM 471 N ASP A 53 -5.909 -18.849 30.798 1.00 28.35 N ATOM 472 CA ASP A 53 -6.642 -19.791 29.995 1.00 27.70 C ATOM 473 C ASP A 53 -5.883 -20.129 28.751 1.00 28.48 C ATOM 474 O ASP A 53 -5.295 -19.276 28.134 1.00 27.87 O ATOM 475 CB ASP A 53 -8.005 -19.206 29.649 1.00 29.15 C ATOM 476 CG ASP A 53 -8.899 -19.003 30.892 1.00 29.64 C ATOM 477 OD1 ASP A 53 -9.097 -20.043 31.608 1.00 31.08 O ATOM 478 OD2 ASP A 53 -9.430 -17.857 31.119 1.00 28.73 O ATOM 479 H ASP A 53 -6.028 -17.837 30.588 1.00 0.00 H ATOM 480 N HIS A 54 -5.888 -21.404 28.402 1.00 28.02 N ATOM 481 CA HIS A 54 -5.195 -21.929 27.239 1.00 28.03 C ATOM 482 C HIS A 54 -6.245 -22.609 26.331 1.00 27.36 C ATOM 483 O HIS A 54 -6.903 -23.537 26.772 1.00 27.37 O ATOM 484 CB HIS A 54 -4.138 -22.973 27.642 1.00 27.51 C ATOM 485 CG HIS A 54 -3.247 -22.520 28.764 1.00 30.40 C ATOM 486 ND1 HIS A 54 -2.263 -21.584 28.587 1.00 31.15 N ATOM 487 CD2 HIS A 54 -3.234 -22.828 30.083 1.00 31.38 C ATOM 488 CE1 HIS A 54 -1.707 -21.311 29.756 1.00 32.15 C ATOM 489 NE2 HIS A 54 -2.230 -22.104 30.665 1.00 31.07 N ATOM 490 H HIS A 54 -6.420 -22.071 28.996 1.00 0.00 H ATOM 491 N ILE A 55 -6.410 -22.104 25.110 1.00 25.98 N ATOM 492 CA ILE A 55 -7.383 -22.614 24.214 1.00 26.99 C ATOM 493 C ILE A 55 -6.800 -23.098 22.885 1.00 25.93 C ATOM 494 O ILE A 55 -5.866 -22.517 22.349 1.00 23.60 O ATOM 495 CB ILE A 55 -8.612 -21.676 24.064 1.00 30.58 C ATOM 496 CG1 ILE A 55 -8.324 -20.644 23.097 1.00 33.59 C ATOM 497 CG2 ILE A 55 -9.065 -21.051 25.458 1.00 30.75 C ATOM 498 CD1 ILE A 55 -9.501 -19.719 22.893 1.00 40.91 C ATOM 499 H ILE A 55 -5.808 -21.313 24.805 1.00 0.00 H ATOM 500 N ASN A 56 -7.328 -24.204 22.367 1.00 24.56 N ATOM 501 CA ASN A 56 -6.953 -24.673 21.033 1.00 24.05 C ATOM 502 C ASN A 56 -8.181 -25.300 20.369 1.00 24.35 C ATOM 503 O ASN A 56 -9.234 -25.564 21.049 1.00 24.21 O ATOM 504 CB ASN A 56 -5.755 -25.610 21.124 1.00 25.52 C ATOM 505 CG ASN A 56 -6.104 -26.951 21.844 1.00 28.08 C ATOM 506 OD1 ASN A 56 -6.010 -27.058 23.082 1.00 26.92 O ATOM 507 ND2 ASN A 56 -6.638 -27.913 21.078 1.00 28.93 N ATOM 508 HD22 ASN A 56 -6.698 -27.784 20.048 1.00 0.00 H ATOM 509 HD21 ASN A 56 -6.992 -28.788 21.514 1.00 0.00 H ATOM 510 H ASN A 56 -8.021 -24.746 22.922 1.00 0.00 H ATOM 511 N LEU A 57 -8.076 -25.505 19.057 1.00 23.28 N ATOM 512 CA LEU A 57 -9.095 -26.246 18.314 1.00 23.42 C ATOM 513 C LEU A 57 -8.670 -27.746 18.226 1.00 23.06 C ATOM 514 O LEU A 57 -7.481 -28.085 18.421 1.00 22.08 O ATOM 515 CB LEU A 57 -9.363 -25.620 16.941 1.00 24.55 C ATOM 516 CG LEU A 57 -9.572 -24.097 16.920 1.00 25.01 C ATOM 517 CD1 LEU A 57 -9.946 -23.670 15.522 1.00 27.60 C ATOM 518 CD2 LEU A 57 -10.691 -23.699 17.911 1.00 24.73 C ATOM 519 H LEU A 57 -7.250 -25.129 18.549 1.00 0.00 H ATOM 520 N VAL A 58 -9.690 -28.604 18.058 1.00 22.06 N ATOM 521 CA VAL A 58 -9.567 -30.000 18.306 1.00 23.20 C ATOM 522 C VAL A 58 -9.771 -30.852 17.011 1.00 23.44 C ATOM 523 O VAL A 58 -10.654 -30.617 16.196 1.00 22.96 O ATOM 524 CB VAL A 58 -10.482 -30.480 19.463 1.00 22.82 C ATOM 525 CG1 VAL A 58 -10.166 -31.913 19.875 1.00 24.09 C ATOM 526 CG2 VAL A 58 -10.331 -29.624 20.679 1.00 22.40 C ATOM 527 H VAL A 58 -10.606 -28.233 17.734 1.00 0.00 H ATOM 528 N GLN A 59 -8.867 -31.808 16.891 1.00 25.45 N ATOM 529 CA GLN A 59 -8.942 -33.014 16.028 1.00 26.75 C ATOM 530 C GLN A 59 -10.331 -33.565 15.877 1.00 25.68 C ATOM 531 O GLN A 59 -11.069 -33.738 16.861 1.00 26.76 O ATOM 532 CB GLN A 59 -8.033 -34.112 16.588 1.00 27.12 C ATOM 533 CG GLN A 59 -7.956 -35.357 15.754 1.00 27.89 C ATOM 534 CD GLN A 59 -7.097 -36.404 16.450 1.00 29.88 C ATOM 535 OE1 GLN A 59 -7.408 -36.884 17.518 1.00 29.35 O ATOM 536 NE2 GLN A 59 -6.011 -36.756 15.822 1.00 31.58 N ATOM 537 HE22 GLN A 59 -5.776 -36.322 14.906 1.00 0.00 H ATOM 538 HE21 GLN A 59 -5.379 -37.471 16.236 1.00 0.00 H ATOM 539 H GLN A 59 -8.006 -31.704 17.465 1.00 0.00 H ATOM 540 N GLY A 60 -10.719 -33.685 14.629 1.00 26.79 N ATOM 541 CA GLY A 60 -12.052 -34.104 14.279 1.00 26.50 C ATOM 542 C GLY A 60 -13.037 -33.025 13.939 1.00 27.60 C ATOM 543 O GLY A 60 -14.092 -33.373 13.457 1.00 30.03 O ATOM 544 H GLY A 60 -10.043 -33.471 13.869 1.00 0.00 H ATOM 545 N SER A 61 -12.740 -31.726 14.193 1.00 25.47 N ATOM 546 CA SER A 61 -13.576 -30.625 13.734 1.00 23.98 C ATOM 547 C SER A 61 -13.673 -30.794 12.225 1.00 24.54 C ATOM 548 O SER A 61 -12.689 -30.955 11.534 1.00 24.53 O ATOM 549 CB SER A 61 -12.939 -29.299 14.099 1.00 23.74 C ATOM 550 OG SER A 61 -12.721 -29.180 15.504 1.00 23.56 O ATOM 551 HG SER A 61 -12.120 -29.906 15.806 1.00 0.00 H ATOM 552 H SER A 61 -11.881 -31.507 14.737 1.00 0.00 H ATOM 553 N ALA A 62 -14.868 -30.687 11.719 1.00 25.79 N ATOM 554 CA ALA A 62 -15.152 -31.065 10.341 1.00 27.82 C ATOM 555 C ALA A 62 -16.346 -30.281 9.746 1.00 28.05 C ATOM 556 O ALA A 62 -17.092 -29.603 10.456 1.00 27.55 O ATOM 557 CB ALA A 62 -15.369 -32.605 10.260 1.00 28.81 C ATOM 558 H ALA A 62 -15.639 -30.322 12.314 1.00 0.00 H ATOM 559 N PHE A 63 -16.438 -30.338 8.427 1.00 28.72 N ATOM 560 CA PHE A 63 -17.664 -30.026 7.668 1.00 32.47 C ATOM 561 C PHE A 63 -18.810 -30.949 8.083 1.00 35.55 C ATOM 562 O PHE A 63 -18.586 -32.070 8.513 1.00 36.35 O ATOM 563 CB PHE A 63 -17.437 -30.149 6.157 1.00 30.33 C ATOM 564 CG PHE A 63 -16.495 -29.140 5.598 1.00 30.09 C ATOM 565 CD1 PHE A 63 -16.778 -27.775 5.674 1.00 31.91 C ATOM 566 CD2 PHE A 63 -15.333 -29.521 4.960 1.00 31.37 C ATOM 567 CE1 PHE A 63 -15.920 -26.810 5.150 1.00 31.28 C ATOM 568 CE2 PHE A 63 -14.484 -28.577 4.411 1.00 30.57 C ATOM 569 CZ PHE A 63 -14.767 -27.214 4.514 1.00 32.60 C ATOM 570 H PHE A 63 -15.592 -30.621 7.892 1.00 0.00 H ATOM 571 N ALA A 64 -20.034 -30.445 7.989 1.00 40.62 N ATOM 572 CA ALA A 64 -21.197 -31.208 8.370 1.00 47.12 C ATOM 573 C ALA A 64 -21.996 -31.507 7.143 1.00 54.61 C ATOM 574 O ALA A 64 -22.066 -30.643 6.268 1.00 55.38 O ATOM 575 CB ALA A 64 -22.035 -30.387 9.312 1.00 48.81 C ATOM 576 H ALA A 64 -20.158 -29.476 7.632 1.00 0.00 H ATOM 577 N GLY A 65 -22.623 -32.694 7.107 1.00 63.21 N ATOM 578 CA GLY A 65 -23.728 -33.023 6.125 1.00 67.00 C ATOM 579 C GLY A 65 -23.398 -33.342 4.657 1.00 63.62 C ATOM 580 O GLY A 65 -22.572 -34.221 4.383 1.00 58.25 O ATOM 581 H GLY A 65 -22.335 -33.425 7.788 1.00 0.00 H TER 582 GLY A 65 ATOM 583 N LEU A 67 -21.570 -31.473 3.399 1.00 60.66 N ATOM 584 CA LEU A 67 -20.390 -30.845 2.816 1.00 56.88 C ATOM 585 C LEU A 67 -19.087 -31.548 3.109 1.00 55.17 C ATOM 586 O LEU A 67 -18.010 -30.957 2.957 1.00 51.74 O ATOM 587 CB LEU A 67 -20.260 -29.404 3.253 1.00 57.47 C ATOM 588 CG LEU A 67 -21.533 -28.607 3.403 1.00 59.34 C ATOM 589 CD1 LEU A 67 -21.056 -27.156 3.482 1.00 64.21 C ATOM 590 CD2 LEU A 67 -22.554 -28.861 2.282 1.00 62.01 C ATOM 591 HN3 LEU A 67 -21.471 -31.501 4.434 1.00 0.00 H ATOM 592 HN2 LEU A 67 -21.663 -32.442 3.032 1.00 0.00 H ATOM 593 HN1 LEU A 67 -22.415 -30.922 3.146 1.00 0.00 H ATOM 594 N GLN A 68 -19.165 -32.835 3.428 1.00 59.14 N ATOM 595 CA GLN A 68 -17.964 -33.664 3.763 1.00 64.15 C ATOM 596 C GLN A 68 -17.000 -33.862 2.582 1.00 62.79 C ATOM 597 O GLN A 68 -15.806 -34.027 2.789 1.00 66.45 O ATOM 598 CB GLN A 68 -18.386 -34.997 4.401 1.00 69.87 C ATOM 599 CG GLN A 68 -19.158 -34.771 5.712 1.00 75.90 C ATOM 600 CD GLN A 68 -18.987 -35.900 6.735 1.00 78.25 C ATOM 601 OE1 GLN A 68 -17.959 -35.973 7.380 1.00 80.43 O ATOM 602 NE2 GLN A 68 -19.990 -36.771 6.892 1.00 78.16 N ATOM 603 HE22 GLN A 68 -20.855 -36.677 6.322 1.00 0.00 H ATOM 604 HE21 GLN A 68 -19.905 -37.543 7.584 1.00 0.00 H ATOM 605 H GLN A 68 -20.102 -33.287 3.446 1.00 0.00 H ATOM 606 N SER A 69 -17.496 -33.767 1.354 1.00 59.69 N ATOM 607 CA SER A 69 -16.631 -33.847 0.181 1.00 60.98 C ATOM 608 C SER A 69 -15.888 -32.555 -0.058 1.00 62.71 C ATOM 609 O SER A 69 -15.140 -32.486 -1.059 1.00 63.05 O ATOM 610 CB SER A 69 -17.407 -34.090 -1.120 1.00 61.56 C ATOM 611 OG SER A 69 -18.450 -34.988 -0.919 1.00 66.39 O ATOM 612 HG SER A 69 -18.933 -35.127 -1.772 1.00 0.00 H ATOM 613 H SER A 69 -18.519 -33.633 1.226 1.00 0.00 H ATOM 614 N TYR A 70 -16.105 -31.518 0.764 1.00 57.95 N ATOM 615 CA TYR A 70 -15.501 -30.236 0.437 1.00 56.27 C ATOM 616 C TYR A 70 -14.065 -30.164 0.952 1.00 53.44 C ATOM 617 O TYR A 70 -13.711 -30.783 1.953 1.00 47.26 O ATOM 618 CB TYR A 70 -16.349 -29.088 0.960 1.00 59.78 C ATOM 619 CG TYR A 70 -17.641 -28.778 0.207 1.00 61.53 C ATOM 620 CD1 TYR A 70 -18.223 -29.673 -0.704 1.00 64.14 C ATOM 621 CD2 TYR A 70 -18.322 -27.582 0.469 1.00 67.45 C ATOM 622 CE1 TYR A 70 -19.403 -29.373 -1.372 1.00 62.22 C ATOM 623 CE2 TYR A 70 -19.521 -27.274 -0.166 1.00 64.46 C ATOM 624 CZ TYR A 70 -20.065 -28.174 -1.105 1.00 67.45 C ATOM 625 OH TYR A 70 -21.270 -27.883 -1.756 1.00 63.84 O ATOM 626 HH TYR A 70 -21.990 -27.781 -1.084 1.00 0.00 H ATOM 627 H TYR A 70 -16.692 -31.628 1.616 1.00 0.00 H ATOM 628 N LYS A 71 -13.245 -29.390 0.236 1.00 56.02 N ATOM 629 CA LYS A 71 -11.858 -29.102 0.653 1.00 55.71 C ATOM 630 C LYS A 71 -11.888 -27.864 1.537 1.00 45.06 C ATOM 631 O LYS A 71 -12.718 -26.938 1.364 1.00 44.37 O ATOM 632 CB LYS A 71 -10.898 -28.779 -0.532 1.00 63.25 C ATOM 633 CG LYS A 71 -11.175 -29.425 -1.896 1.00 71.51 C ATOM 634 CD LYS A 71 -10.145 -29.001 -2.946 1.00 76.20 C ATOM 635 CE LYS A 71 -8.853 -29.805 -2.842 1.00 78.34 C ATOM 636 NZ LYS A 71 -9.067 -31.197 -3.340 1.00 79.80 N ATOM 637 HZ1 LYS A 71 -9.802 -31.659 -2.768 1.00 0.00 H ATOM 638 HZ2 LYS A 71 -9.369 -31.165 -4.335 1.00 0.00 H ATOM 639 HZ3 LYS A 71 -8.178 -31.732 -3.263 1.00 0.00 H ATOM 640 H LYS A 71 -13.597 -28.974 -0.650 1.00 0.00 H ATOM 641 N GLY A 72 -10.958 -27.801 2.449 1.00 36.00 N ATOM 642 CA GLY A 72 -10.852 -26.624 3.220 1.00 36.27 C ATOM 643 C GLY A 72 -9.614 -26.468 4.012 1.00 33.04 C ATOM 644 O GLY A 72 -8.794 -27.393 4.122 1.00 32.98 O ATOM 645 H GLY A 72 -10.310 -28.599 2.604 1.00 0.00 H ATOM 646 N SER A 73 -9.492 -25.246 4.493 1.00 31.57 N ATOM 647 CA SER A 73 -8.433 -24.809 5.332 1.00 33.07 C ATOM 648 C SER A 73 -9.026 -24.054 6.482 1.00 32.59 C ATOM 649 O SER A 73 -10.058 -23.413 6.362 1.00 36.16 O ATOM 650 CB SER A 73 -7.546 -23.842 4.606 1.00 32.99 C ATOM 651 OG SER A 73 -6.801 -24.562 3.702 1.00 37.51 O ATOM 652 HG SER A 73 -6.203 -23.948 3.206 1.00 0.00 H ATOM 653 H SER A 73 -10.224 -24.552 4.239 1.00 0.00 H ATOM 654 N LEU A 74 -8.307 -24.061 7.578 1.00 31.67 N ATOM 655 CA LEU A 74 -8.718 -23.307 8.741 1.00 32.02 C ATOM 656 C LEU A 74 -7.533 -22.477 9.192 1.00 31.69 C ATOM 657 O LEU A 74 -6.478 -23.031 9.426 1.00 31.74 O ATOM 658 CB LEU A 74 -9.175 -24.313 9.772 1.00 33.01 C ATOM 659 CG LEU A 74 -9.658 -23.713 11.064 1.00 34.02 C ATOM 660 CD1 LEU A 74 -10.761 -24.565 11.623 1.00 35.58 C ATOM 661 CD2 LEU A 74 -8.501 -23.742 12.017 1.00 34.79 C ATOM 662 H LEU A 74 -7.429 -24.617 7.611 1.00 0.00 H ATOM 663 N TYR A 75 -7.702 -21.168 9.260 1.00 32.40 N ATOM 664 CA TYR A 75 -6.678 -20.250 9.799 1.00 35.02 C ATOM 665 C TYR A 75 -6.942 -20.123 11.307 1.00 32.19 C ATOM 666 O TYR A 75 -8.034 -19.829 11.711 1.00 35.18 O ATOM 667 CB TYR A 75 -6.749 -18.892 9.097 1.00 38.95 C ATOM 668 CG TYR A 75 -5.976 -17.796 9.763 1.00 48.46 C ATOM 669 CD1 TYR A 75 -6.505 -17.200 10.932 1.00 52.73 C ATOM 670 CD2 TYR A 75 -4.734 -17.333 9.273 1.00 53.20 C ATOM 671 CE1 TYR A 75 -5.827 -16.216 11.644 1.00 56.90 C ATOM 672 CE2 TYR A 75 -4.042 -16.332 9.972 1.00 58.99 C ATOM 673 CZ TYR A 75 -4.607 -15.782 11.159 1.00 64.51 C ATOM 674 OH TYR A 75 -3.994 -14.808 11.924 1.00 74.19 O ATOM 675 HH TYR A 75 -3.122 -15.146 12.250 1.00 0.00 H ATOM 676 H TYR A 75 -8.598 -20.765 8.918 1.00 0.00 H ATOM 677 N TRP A 76 -5.975 -20.431 12.130 1.00 29.63 N ATOM 678 CA TRP A 76 -6.126 -20.330 13.569 1.00 30.44 C ATOM 679 C TRP A 76 -4.816 -19.769 14.116 1.00 31.96 C ATOM 680 O TRP A 76 -3.741 -20.421 13.991 1.00 32.29 O ATOM 681 CB TRP A 76 -6.439 -21.659 14.262 1.00 28.86 C ATOM 682 CG TRP A 76 -6.287 -21.602 15.818 1.00 28.15 C ATOM 683 CD1 TRP A 76 -5.259 -22.086 16.557 1.00 27.74 C ATOM 684 CD2 TRP A 76 -7.225 -21.071 16.772 1.00 26.67 C ATOM 685 NE1 TRP A 76 -5.469 -21.870 17.887 1.00 28.31 N ATOM 686 CE2 TRP A 76 -6.671 -21.250 18.048 1.00 28.20 C ATOM 687 CE3 TRP A 76 -8.474 -20.508 16.666 1.00 28.50 C ATOM 688 CZ2 TRP A 76 -7.316 -20.866 19.205 1.00 29.47 C ATOM 689 CZ3 TRP A 76 -9.127 -20.109 17.798 1.00 28.95 C ATOM 690 CH2 TRP A 76 -8.545 -20.317 19.076 1.00 29.76 C ATOM 691 HE1 TRP A 76 -4.818 -22.135 18.653 1.00 0.00 H ATOM 692 H TRP A 76 -5.068 -20.759 11.741 1.00 0.00 H ATOM 693 N ASN A 77 -4.917 -18.564 14.697 1.00 31.38 N ATOM 694 CA ASN A 77 -3.864 -17.932 15.454 1.00 33.05 C ATOM 695 C ASN A 77 -2.619 -17.863 14.664 1.00 33.26 C ATOM 696 O ASN A 77 -1.633 -18.401 15.101 1.00 36.28 O ATOM 697 CB ASN A 77 -3.729 -18.693 16.805 1.00 33.74 C ATOM 698 CG ASN A 77 -2.856 -17.977 17.805 1.00 34.17 C ATOM 699 OD1 ASN A 77 -2.716 -16.754 17.779 1.00 33.75 O ATOM 700 ND2 ASN A 77 -2.305 -18.741 18.725 1.00 35.25 N ATOM 701 HD22 ASN A 77 -2.453 -19.770 18.704 1.00 0.00 H ATOM 702 HD21 ASN A 77 -1.721 -18.315 19.473 1.00 0.00 H ATOM 703 H ASN A 77 -5.816 -18.050 14.595 1.00 0.00 H ATOM 704 N ASN A 78 -2.753 -17.392 13.418 1.00 36.53 N ATOM 705 CA ASN A 78 -1.668 -17.203 12.451 1.00 38.74 C ATOM 706 C ASN A 78 -1.195 -18.429 11.734 1.00 39.80 C ATOM 707 O ASN A 78 -0.211 -18.312 11.097 1.00 41.52 O ATOM 708 CB ASN A 78 -0.431 -16.553 13.107 1.00 45.46 C ATOM 709 CG ASN A 78 -0.749 -15.207 13.701 1.00 49.99 C ATOM 710 OD1 ASN A 78 -0.985 -14.219 12.964 1.00 55.31 O ATOM 711 ND2 ASN A 78 -0.807 -15.154 15.022 1.00 52.21 N ATOM 712 HD22 ASN A 78 -0.602 -16.003 15.586 1.00 0.00 H ATOM 713 HD21 ASN A 78 -1.058 -14.263 15.496 1.00 0.00 H ATOM 714 H ASN A 78 -3.713 -17.137 13.109 1.00 0.00 H ATOM 715 N VAL A 79 -1.845 -19.598 11.817 1.00 38.53 N ATOM 716 CA VAL A 79 -1.379 -20.797 11.115 1.00 35.24 C ATOM 717 C VAL A 79 -2.564 -21.367 10.321 1.00 33.11 C ATOM 718 O VAL A 79 -3.699 -21.272 10.778 1.00 33.34 O ATOM 719 CB VAL A 79 -0.904 -21.839 12.140 1.00 36.93 C ATOM 720 CG1 VAL A 79 -0.388 -23.127 11.489 1.00 39.57 C ATOM 721 CG2 VAL A 79 0.181 -21.282 13.039 1.00 35.75 C ATOM 722 H VAL A 79 -2.706 -19.656 12.397 1.00 0.00 H ATOM 723 N THR A 80 -2.280 -21.935 9.161 1.00 29.60 N ATOM 724 CA THR A 80 -3.223 -22.573 8.291 1.00 30.48 C ATOM 725 C THR A 80 -3.136 -24.078 8.464 1.00 29.08 C ATOM 726 O THR A 80 -2.077 -24.597 8.431 1.00 27.14 O ATOM 727 CB THR A 80 -2.884 -22.250 6.845 1.00 33.04 C ATOM 728 OG1 THR A 80 -3.131 -20.866 6.721 1.00 35.63 O ATOM 729 CG2 THR A 80 -3.839 -22.973 5.860 1.00 33.53 C ATOM 730 HG1 THR A 80 -2.931 -20.578 5.795 1.00 0.00 H ATOM 731 H THR A 80 -1.287 -21.917 8.854 1.00 0.00 H ATOM 732 N TYR A 81 -4.256 -24.740 8.751 1.00 27.32 N ATOM 733 CA TYR A 81 -4.294 -26.145 8.897 1.00 27.92 C ATOM 734 C TYR A 81 -5.252 -26.683 7.863 1.00 28.03 C ATOM 735 O TYR A 81 -6.269 -26.064 7.580 1.00 27.32 O ATOM 736 CB TYR A 81 -4.841 -26.486 10.263 1.00 27.56 C ATOM 737 CG TYR A 81 -3.999 -26.010 11.440 1.00 27.83 C ATOM 738 CD1 TYR A 81 -4.197 -24.731 12.015 1.00 26.98 C ATOM 739 CD2 TYR A 81 -3.045 -26.847 12.032 1.00 28.33 C ATOM 740 CE1 TYR A 81 -3.477 -24.336 13.120 1.00 25.87 C ATOM 741 CE2 TYR A 81 -2.256 -26.389 13.118 1.00 25.90 C ATOM 742 CZ TYR A 81 -2.505 -25.144 13.612 1.00 25.92 C ATOM 743 OH TYR A 81 -1.808 -24.663 14.644 1.00 29.58 O ATOM 744 HH TYR A 81 -2.128 -23.751 14.860 1.00 0.00 H ATOM 745 H TYR A 81 -5.137 -24.201 8.872 1.00 0.00 H ATOM 746 N PRO A 82 -4.956 -27.859 7.290 1.00 29.48 N ATOM 747 CA PRO A 82 -6.000 -28.495 6.458 1.00 28.65 C ATOM 748 C PRO A 82 -7.248 -28.697 7.317 1.00 29.51 C ATOM 749 O PRO A 82 -7.139 -28.916 8.562 1.00 28.72 O ATOM 750 CB PRO A 82 -5.404 -29.879 6.089 1.00 30.12 C ATOM 751 CG PRO A 82 -3.917 -29.716 6.332 1.00 30.43 C ATOM 752 CD PRO A 82 -3.795 -28.744 7.493 1.00 29.28 C ATOM 753 N PHE A 83 -8.406 -28.577 6.680 1.00 28.73 N ATOM 754 CA PHE A 83 -9.700 -28.796 7.314 1.00 30.52 C ATOM 755 C PHE A 83 -10.469 -29.829 6.425 1.00 33.15 C ATOM 756 O PHE A 83 -10.473 -29.643 5.196 1.00 31.33 O ATOM 757 CB PHE A 83 -10.486 -27.508 7.403 1.00 30.66 C ATOM 758 CG PHE A 83 -11.638 -27.593 8.371 1.00 30.78 C ATOM 759 CD1 PHE A 83 -11.427 -27.556 9.751 1.00 31.48 C ATOM 760 CD2 PHE A 83 -12.921 -27.727 7.904 1.00 32.29 C ATOM 761 CE1 PHE A 83 -12.493 -27.620 10.634 1.00 30.56 C ATOM 762 CE2 PHE A 83 -13.989 -27.766 8.767 1.00 31.42 C ATOM 763 CZ PHE A 83 -13.773 -27.754 10.137 1.00 32.11 C ATOM 764 H PHE A 83 -8.389 -28.312 5.674 1.00 0.00 H ATOM 765 N PRO A 84 -11.030 -30.896 7.019 1.00 32.67 N ATOM 766 CA PRO A 84 -11.132 -31.138 8.524 1.00 32.36 C ATOM 767 C PRO A 84 -9.868 -31.410 9.329 1.00 29.83 C ATOM 768 O PRO A 84 -8.850 -31.891 8.816 1.00 29.54 O ATOM 769 CB PRO A 84 -12.003 -32.385 8.621 1.00 32.71 C ATOM 770 CG PRO A 84 -11.960 -32.990 7.266 1.00 34.51 C ATOM 771 CD PRO A 84 -11.835 -31.856 6.275 1.00 33.62 C ATOM 772 N LEU A 85 -9.908 -31.013 10.604 1.00 29.06 N ATOM 773 CA LEU A 85 -8.674 -31.031 11.434 1.00 27.12 C ATOM 774 C LEU A 85 -8.332 -32.449 11.740 1.00 26.89 C ATOM 775 O LEU A 85 -9.169 -33.167 12.308 1.00 28.16 O ATOM 776 CB LEU A 85 -8.863 -30.307 12.735 1.00 26.87 C ATOM 777 CG LEU A 85 -8.966 -28.788 12.618 1.00 28.15 C ATOM 778 CD1 LEU A 85 -9.093 -28.204 14.006 1.00 26.92 C ATOM 779 CD2 LEU A 85 -7.783 -28.152 11.899 1.00 27.23 C ATOM 780 H LEU A 85 -10.806 -30.690 11.018 1.00 0.00 H ATOM 781 N THR A 86 -7.139 -32.892 11.351 1.00 27.85 N ATOM 782 CA THR A 86 -6.696 -34.265 11.645 1.00 27.44 C ATOM 783 C THR A 86 -5.753 -34.257 12.869 1.00 27.64 C ATOM 784 O THR A 86 -5.136 -35.265 13.130 1.00 26.36 O ATOM 785 CB THR A 86 -5.998 -34.902 10.458 1.00 27.59 C ATOM 786 OG1 THR A 86 -4.761 -34.263 10.321 1.00 28.25 O ATOM 787 CG2 THR A 86 -6.768 -34.689 9.129 1.00 29.22 C ATOM 788 HG1 THR A 86 -4.232 -34.390 11.148 1.00 0.00 H ATOM 789 H THR A 86 -6.506 -32.254 10.828 1.00 0.00 H ATOM 790 N THR A 87 -5.524 -33.078 13.465 1.00 27.35 N ATOM 791 CA THR A 87 -4.696 -32.862 14.672 1.00 28.27 C ATOM 792 C THR A 87 -5.284 -31.668 15.459 1.00 27.31 C ATOM 793 O THR A 87 -6.109 -30.937 14.966 1.00 24.23 O ATOM 794 CB THR A 87 -3.267 -32.404 14.355 1.00 33.61 C ATOM 795 OG1 THR A 87 -3.301 -31.089 13.760 1.00 38.25 O ATOM 796 CG2 THR A 87 -2.556 -33.373 13.427 1.00 35.20 C ATOM 797 HG1 THR A 87 -3.718 -30.452 14.393 1.00 0.00 H ATOM 798 H THR A 87 -5.969 -32.239 13.040 1.00 0.00 H ATOM 799 N ASN A 88 -4.847 -31.476 16.682 1.00 27.23 N ATOM 800 CA ASN A 88 -5.142 -30.279 17.420 1.00 28.14 C ATOM 801 C ASN A 88 -4.335 -29.105 16.881 1.00 30.95 C ATOM 802 O ASN A 88 -3.240 -29.297 16.376 1.00 31.80 O ATOM 803 CB ASN A 88 -4.858 -30.502 18.926 1.00 27.78 C ATOM 804 CG ASN A 88 -5.757 -31.568 19.511 1.00 27.56 C ATOM 805 OD1 ASN A 88 -6.683 -32.032 18.877 1.00 28.59 O ATOM 806 ND2 ASN A 88 -5.501 -31.954 20.718 1.00 29.21 N ATOM 807 HD22 ASN A 88 -4.701 -31.540 21.238 1.00 0.00 H ATOM 808 HD21 ASN A 88 -6.095 -32.679 21.169 1.00 0.00 H ATOM 809 H ASN A 88 -4.268 -32.214 17.131 1.00 0.00 H ATOM 810 N THR A 89 -4.839 -27.875 17.058 1.00 31.11 N ATOM 811 CA THR A 89 -4.085 -26.659 16.665 1.00 30.98 C ATOM 812 C THR A 89 -3.163 -26.141 17.771 1.00 31.28 C ATOM 813 O THR A 89 -3.142 -26.648 18.868 1.00 31.75 O ATOM 814 CB THR A 89 -5.051 -25.513 16.301 1.00 31.87 C ATOM 815 OG1 THR A 89 -5.682 -25.009 17.523 1.00 30.86 O ATOM 816 CG2 THR A 89 -6.050 -26.014 15.304 1.00 30.81 C ATOM 817 HG1 THR A 89 -4.984 -24.673 18.139 1.00 0.00 H ATOM 818 H THR A 89 -5.783 -27.771 17.482 1.00 0.00 H ATOM 819 N ASN A 90 -2.354 -25.135 17.448 1.00 30.88 N ATOM 820 CA ASN A 90 -1.529 -24.459 18.420 1.00 30.58 C ATOM 821 C ASN A 90 -2.466 -23.753 19.513 1.00 30.91 C ATOM 822 O ASN A 90 -3.674 -23.564 19.329 1.00 27.62 O ATOM 823 CB ASN A 90 -0.612 -23.438 17.693 1.00 33.11 C ATOM 824 CG ASN A 90 -1.381 -22.238 17.210 1.00 36.70 C ATOM 825 OD1 ASN A 90 -1.726 -21.391 18.025 1.00 41.80 O ATOM 826 ND2 ASN A 90 -1.764 -22.192 15.888 1.00 41.67 N ATOM 827 HD22 ASN A 90 -1.448 -22.932 15.229 1.00 0.00 H ATOM 828 HD21 ASN A 90 -2.369 -21.417 15.549 1.00 0.00 H ATOM 829 H ASN A 90 -2.315 -24.824 16.456 1.00 0.00 H ATOM 830 N VAL A 91 -1.881 -23.403 20.639 1.00 31.55 N ATOM 831 CA VAL A 91 -2.616 -22.943 21.810 1.00 30.18 C ATOM 832 C VAL A 91 -2.572 -21.414 21.852 1.00 27.83 C ATOM 833 O VAL A 91 -1.558 -20.819 21.600 1.00 29.05 O ATOM 834 CB VAL A 91 -1.977 -23.531 23.101 1.00 30.83 C ATOM 835 CG1 VAL A 91 -2.461 -22.792 24.333 1.00 28.84 C ATOM 836 CG2 VAL A 91 -2.247 -25.059 23.172 1.00 30.25 C ATOM 837 H VAL A 91 -0.844 -23.457 20.696 1.00 0.00 H ATOM 838 N LEU A 92 -3.693 -20.807 22.143 1.00 26.37 N ATOM 839 CA LEU A 92 -3.801 -19.363 22.365 1.00 29.20 C ATOM 840 C LEU A 92 -3.979 -19.148 23.859 1.00 27.34 C ATOM 841 O LEU A 92 -4.822 -19.774 24.503 1.00 26.06 O ATOM 842 CB LEU A 92 -5.011 -18.845 21.575 1.00 30.46 C ATOM 843 CG LEU A 92 -5.356 -17.369 21.758 1.00 34.55 C ATOM 844 CD1 LEU A 92 -4.205 -16.486 21.258 1.00 36.36 C ATOM 845 CD2 LEU A 92 -6.657 -17.131 20.990 1.00 36.07 C ATOM 846 H LEU A 92 -4.556 -21.382 22.221 1.00 0.00 H ATOM 847 N ASP A 93 -3.190 -18.263 24.421 1.00 26.65 N ATOM 848 CA ASP A 93 -3.233 -17.981 25.868 1.00 28.75 C ATOM 849 C ASP A 93 -4.074 -16.725 26.122 1.00 28.69 C ATOM 850 O ASP A 93 -3.819 -15.694 25.461 1.00 29.25 O ATOM 851 CB ASP A 93 -1.857 -17.726 26.437 1.00 31.97 C ATOM 852 CG ASP A 93 -1.060 -18.988 26.744 1.00 40.22 C ATOM 853 OD1 ASP A 93 -1.399 -20.152 26.359 1.00 40.08 O ATOM 854 OD2 ASP A 93 -0.071 -18.800 27.505 1.00 49.25 O ATOM 855 H ASP A 93 -2.512 -17.744 23.827 1.00 0.00 H ATOM 856 N ILE A 94 -5.043 -16.781 27.045 1.00 26.43 N ATOM 857 CA ILE A 94 -5.917 -15.657 27.340 1.00 28.37 C ATOM 858 C ILE A 94 -5.867 -15.386 28.844 1.00 27.54 C ATOM 859 O ILE A 94 -6.357 -16.212 29.660 1.00 24.54 O ATOM 860 CB ILE A 94 -7.337 -15.945 26.806 1.00 32.29 C ATOM 861 CG1 ILE A 94 -7.348 -15.892 25.249 1.00 34.00 C ATOM 862 CG2 ILE A 94 -8.356 -14.932 27.306 1.00 32.31 C ATOM 863 CD1 ILE A 94 -8.497 -16.607 24.626 1.00 34.70 C ATOM 864 H ILE A 94 -5.176 -17.667 27.574 1.00 0.00 H ATOM 865 N GLY A 95 -5.335 -14.201 29.187 1.00 26.24 N ATOM 866 CA GLY A 95 -5.139 -13.823 30.576 1.00 27.47 C ATOM 867 C GLY A 95 -5.787 -12.555 30.986 1.00 27.72 C ATOM 868 O GLY A 95 -5.882 -12.279 32.201 1.00 27.69 O ATOM 869 H GLY A 95 -5.056 -13.536 28.438 1.00 0.00 H ATOM 870 N ASP A 96 -6.346 -11.831 30.033 1.00 26.72 N ATOM 871 CA ASP A 96 -6.995 -10.539 30.352 1.00 30.43 C ATOM 872 C ASP A 96 -8.526 -10.671 30.369 1.00 30.20 C ATOM 873 O ASP A 96 -9.073 -11.434 29.625 1.00 25.16 O ATOM 874 CB ASP A 96 -6.525 -9.429 29.374 1.00 30.48 C ATOM 875 CG ASP A 96 -5.003 -9.186 29.436 1.00 32.82 C ATOM 876 OD1 ASP A 96 -4.463 -8.803 30.509 1.00 33.37 O ATOM 877 OD2 ASP A 96 -4.304 -9.408 28.416 1.00 35.26 O ATOM 878 H ASP A 96 -6.330 -12.171 29.050 1.00 0.00 H ATOM 879 N LYS A 97 -9.189 -9.788 31.136 1.00 32.92 N ATOM 880 CA LYS A 97 -10.613 -9.661 31.208 1.00 34.98 C ATOM 881 C LYS A 97 -11.097 -8.659 30.159 1.00 36.42 C ATOM 882 O LYS A 97 -11.709 -7.654 30.503 1.00 43.28 O ATOM 883 CB LYS A 97 -10.939 -9.154 32.582 1.00 38.19 C ATOM 884 CG LYS A 97 -12.307 -9.412 33.082 1.00 41.38 C ATOM 885 CD LYS A 97 -12.320 -8.984 34.537 1.00 49.51 C ATOM 886 CE LYS A 97 -13.662 -8.589 35.104 1.00 55.36 C ATOM 887 NZ LYS A 97 -14.416 -9.846 35.174 1.00 56.29 N ATOM 888 HZ1 LYS A 97 -14.502 -10.251 34.220 1.00 0.00 H ATOM 889 HZ2 LYS A 97 -13.915 -10.515 35.792 1.00 0.00 H ATOM 890 HZ3 LYS A 97 -15.364 -9.659 35.559 1.00 0.00 H ATOM 891 H LYS A 97 -8.621 -9.145 31.725 1.00 0.00 H ATOM 892 N THR A 98 -10.755 -8.902 28.917 1.00 35.04 N ATOM 893 CA THR A 98 -10.949 -8.041 27.762 1.00 36.11 C ATOM 894 C THR A 98 -11.383 -9.022 26.674 1.00 34.50 C ATOM 895 O THR A 98 -10.723 -9.992 26.432 1.00 33.31 O ATOM 896 CB THR A 98 -9.667 -7.377 27.235 1.00 35.20 C ATOM 897 OG1 THR A 98 -9.204 -6.406 28.153 1.00 34.63 O ATOM 898 CG2 THR A 98 -9.961 -6.603 25.924 1.00 36.95 C ATOM 899 HG1 THR A 98 -8.379 -5.987 27.801 1.00 0.00 H ATOM 900 H THR A 98 -10.292 -9.816 28.737 1.00 0.00 H ATOM 901 N PRO A 99 -12.494 -8.761 26.021 1.00 38.61 N ATOM 902 CA PRO A 99 -12.848 -9.809 25.056 1.00 40.80 C ATOM 903 C PRO A 99 -11.938 -9.857 23.816 1.00 38.90 C ATOM 904 O PRO A 99 -11.738 -8.864 23.174 1.00 39.19 O ATOM 905 CB PRO A 99 -14.266 -9.440 24.658 1.00 42.45 C ATOM 906 CG PRO A 99 -14.793 -8.656 25.830 1.00 44.84 C ATOM 907 CD PRO A 99 -13.607 -7.822 26.266 1.00 40.33 C ATOM 908 N MET A 100 -11.323 -11.006 23.564 1.00 39.42 N ATOM 909 CA MET A 100 -10.418 -11.146 22.463 1.00 38.46 C ATOM 910 C MET A 100 -11.193 -11.849 21.369 1.00 34.44 C ATOM 911 O MET A 100 -11.657 -12.987 21.572 1.00 32.09 O ATOM 912 CB MET A 100 -9.229 -11.975 22.872 1.00 45.50 C ATOM 913 CG MET A 100 -8.178 -11.962 21.753 1.00 57.51 C ATOM 914 SD MET A 100 -6.879 -13.205 21.776 1.00 66.65 S ATOM 915 CE MET A 100 -6.120 -12.919 20.103 1.00 61.23 C ATOM 916 H MET A 100 -11.503 -11.824 24.181 1.00 0.00 H ATOM 917 N PRO A 101 -11.331 -11.214 20.187 1.00 32.50 N ATOM 918 CA PRO A 101 -11.885 -11.972 19.015 1.00 30.20 C ATOM 919 C PRO A 101 -11.123 -13.267 18.777 1.00 29.82 C ATOM 920 O PRO A 101 -9.906 -13.247 18.808 1.00 30.33 O ATOM 921 CB PRO A 101 -11.691 -11.009 17.843 1.00 32.41 C ATOM 922 CG PRO A 101 -11.615 -9.647 18.469 1.00 32.38 C ATOM 923 CD PRO A 101 -10.933 -9.856 19.804 1.00 33.01 C ATOM 924 N LEU A 102 -11.800 -14.401 18.570 1.00 30.21 N ATOM 925 CA LEU A 102 -11.060 -15.607 18.244 1.00 32.75 C ATOM 926 C LEU A 102 -10.465 -15.462 16.832 1.00 31.68 C ATOM 927 O LEU A 102 -11.176 -15.096 15.919 1.00 29.53 O ATOM 928 CB LEU A 102 -11.945 -16.814 18.232 1.00 35.60 C ATOM 929 CG LEU A 102 -12.365 -17.360 19.582 1.00 40.84 C ATOM 930 CD1 LEU A 102 -12.877 -18.757 19.268 1.00 40.23 C ATOM 931 CD2 LEU A 102 -11.252 -17.373 20.653 1.00 42.96 C ATOM 932 H LEU A 102 -12.837 -14.419 18.641 1.00 0.00 H ATOM 933 N PRO A 103 -9.163 -15.753 16.676 1.00 31.96 N ATOM 934 CA PRO A 103 -8.465 -15.472 15.406 1.00 31.61 C ATOM 935 C PRO A 103 -8.625 -16.693 14.531 1.00 30.96 C ATOM 936 O PRO A 103 -7.743 -17.560 14.416 1.00 27.66 O ATOM 937 CB PRO A 103 -7.026 -15.215 15.861 1.00 33.12 C ATOM 938 CG PRO A 103 -6.866 -16.118 17.076 1.00 33.42 C ATOM 939 CD PRO A 103 -8.223 -16.122 17.759 1.00 33.76 C ATOM 940 N LEU A 104 -9.801 -16.770 13.937 1.00 30.52 N ATOM 941 CA LEU A 104 -10.270 -17.988 13.313 1.00 31.79 C ATOM 942 C LEU A 104 -10.989 -17.664 11.989 1.00 31.51 C ATOM 943 O LEU A 104 -11.900 -16.876 12.018 1.00 28.78 O ATOM 944 CB LEU A 104 -11.238 -18.637 14.275 1.00 33.67 C ATOM 945 CG LEU A 104 -11.995 -19.874 13.791 1.00 35.66 C ATOM 946 CD1 LEU A 104 -11.062 -20.992 13.329 1.00 38.91 C ATOM 947 CD2 LEU A 104 -12.848 -20.322 14.936 1.00 37.79 C ATOM 948 H LEU A 104 -10.410 -15.928 13.917 1.00 0.00 H ATOM 949 N LYS A 105 -10.527 -18.219 10.873 1.00 31.11 N ATOM 950 CA LYS A 105 -11.205 -18.095 9.584 1.00 34.43 C ATOM 951 C LYS A 105 -11.284 -19.471 8.957 1.00 32.20 C ATOM 952 O LYS A 105 -10.383 -20.249 9.090 1.00 35.36 O ATOM 953 CB LYS A 105 -10.439 -17.190 8.628 1.00 39.60 C ATOM 954 CG LYS A 105 -10.345 -15.720 8.994 1.00 45.19 C ATOM 955 CD LYS A 105 -9.418 -15.028 7.983 1.00 52.85 C ATOM 956 CE LYS A 105 -8.729 -13.817 8.660 1.00 61.66 C ATOM 957 NZ LYS A 105 -8.207 -12.743 7.752 1.00 67.23 N ATOM 958 HZ1 LYS A 105 -7.497 -13.149 7.109 1.00 0.00 H ATOM 959 HZ2 LYS A 105 -8.993 -12.347 7.197 1.00 0.00 H ATOM 960 HZ3 LYS A 105 -7.770 -11.991 8.322 1.00 0.00 H ATOM 961 H LYS A 105 -9.644 -18.766 10.919 1.00 0.00 H ATOM 962 N LEU A 106 -12.313 -19.720 8.197 1.00 34.43 N ATOM 963 CA LEU A 106 -12.536 -21.015 7.516 1.00 37.09 C ATOM 964 C LEU A 106 -12.611 -20.757 6.014 1.00 34.96 C ATOM 965 O LEU A 106 -13.316 -19.875 5.586 1.00 35.00 O ATOM 966 CB LEU A 106 -13.774 -21.651 8.128 1.00 39.93 C ATOM 967 CG LEU A 106 -14.329 -22.911 7.489 1.00 46.73 C ATOM 968 CD1 LEU A 106 -13.389 -24.106 7.527 1.00 49.13 C ATOM 969 CD2 LEU A 106 -15.602 -23.260 8.224 1.00 50.35 C ATOM 970 H LEU A 106 -13.017 -18.967 8.061 1.00 0.00 H ATOM 971 N TYR A 107 -11.762 -21.427 5.251 1.00 34.55 N ATOM 972 CA TYR A 107 -11.719 -21.345 3.788 1.00 37.43 C ATOM 973 C TYR A 107 -12.304 -22.574 3.178 1.00 38.99 C ATOM 974 O TYR A 107 -11.875 -23.681 3.518 1.00 40.68 O ATOM 975 CB TYR A 107 -10.291 -21.294 3.341 1.00 39.16 C ATOM 976 CG TYR A 107 -9.651 -20.025 3.787 1.00 40.73 C ATOM 977 CD1 TYR A 107 -9.776 -18.868 3.017 1.00 42.89 C ATOM 978 CD2 TYR A 107 -8.996 -19.933 5.013 1.00 43.31 C ATOM 979 CE1 TYR A 107 -9.247 -17.654 3.417 1.00 44.44 C ATOM 980 CE2 TYR A 107 -8.444 -18.727 5.426 1.00 46.03 C ATOM 981 CZ TYR A 107 -8.584 -17.579 4.618 1.00 46.98 C ATOM 982 OH TYR A 107 -8.056 -16.360 4.941 1.00 51.51 O ATOM 983 HH TYR A 107 -8.279 -15.707 4.231 1.00 0.00 H ATOM 984 H TYR A 107 -11.079 -22.054 5.721 1.00 0.00 H ATOM 985 N ILE A 108 -13.281 -22.403 2.309 1.00 40.27 N ATOM 986 CA ILE A 108 -14.041 -23.539 1.755 1.00 44.10 C ATOM 987 C ILE A 108 -13.967 -23.541 0.253 1.00 45.18 C ATOM 988 O ILE A 108 -14.325 -22.561 -0.365 1.00 42.39 O ATOM 989 CB ILE A 108 -15.548 -23.473 2.146 1.00 47.23 C ATOM 990 CG1 ILE A 108 -15.699 -23.234 3.669 1.00 49.56 C ATOM 991 CG2 ILE A 108 -16.299 -24.746 1.717 1.00 46.01 C ATOM 992 CD1 ILE A 108 -17.107 -22.946 4.138 1.00 48.96 C ATOM 993 H ILE A 108 -13.523 -21.438 2.005 1.00 0.00 H ATOM 994 N THR A 109 -13.550 -24.665 -0.313 1.00 53.53 N ATOM 995 CA THR A 109 -13.674 -24.898 -1.751 1.00 65.69 C ATOM 996 C THR A 109 -14.687 -26.009 -2.001 1.00 69.08 C ATOM 997 O THR A 109 -14.508 -27.158 -1.567 1.00 66.94 O ATOM 998 CB THR A 109 -12.390 -25.332 -2.429 1.00 68.68 C ATOM 999 OG1 THR A 109 -11.292 -24.650 -1.852 1.00 70.25 O ATOM 1000 CG2 THR A 109 -12.481 -25.017 -3.946 1.00 69.28 C ATOM 1001 HG1 THR A 109 -11.412 -23.674 -1.969 1.00 0.00 H ATOM 1002 H THR A 109 -13.122 -25.402 0.283 1.00 0.00 H ATOM 1003 N PRO A 110 -15.758 -25.682 -2.720 1.00 73.68 N ATOM 1004 CA PRO A 110 -16.767 -26.726 -2.958 1.00 75.77 C ATOM 1005 C PRO A 110 -16.327 -27.734 -4.043 1.00 75.11 C ATOM 1006 O PRO A 110 -15.632 -27.348 -4.975 1.00 67.02 O ATOM 1007 CB PRO A 110 -17.981 -25.913 -3.414 1.00 78.42 C ATOM 1008 CG PRO A 110 -17.692 -24.513 -2.943 1.00 79.87 C ATOM 1009 CD PRO A 110 -16.232 -24.357 -3.150 1.00 75.80 C ATOM 1010 N VAL A 111 -16.696 -29.007 -3.894 1.00 81.12 N ATOM 1011 CA VAL A 111 -16.520 -29.991 -4.996 1.00 85.72 C ATOM 1012 C VAL A 111 -17.376 -31.259 -4.789 1.00 86.13 C ATOM 1013 O VAL A 111 -18.257 -31.559 -5.606 1.00 84.85 O ATOM 1014 CB VAL A 111 -15.023 -30.291 -5.303 1.00 85.35 C ATOM 1015 CG1 VAL A 111 -14.421 -31.186 -4.225 1.00 83.43 C ATOM 1016 CG2 VAL A 111 -14.844 -30.803 -6.750 1.00 84.78 C ATOM 1017 H VAL A 111 -17.113 -29.317 -2.993 1.00 0.00 H TER 1018 VAL A 111 ATOM 1019 N GLY A 116 -24.954 -25.464 -8.937 1.00 53.05 N ATOM 1020 CA GLY A 116 -26.245 -25.244 -8.208 1.00 55.62 C ATOM 1021 C GLY A 116 -26.034 -24.791 -6.758 1.00 51.43 C ATOM 1022 O GLY A 116 -25.074 -24.102 -6.449 1.00 50.21 O ATOM 1023 HN3 GLY A 116 -24.403 -26.199 -8.449 1.00 0.00 H ATOM 1024 HN2 GLY A 116 -24.412 -24.577 -8.955 1.00 0.00 H ATOM 1025 HN1 GLY A 116 -25.155 -25.769 -9.911 1.00 0.00 H ATOM 1026 N VAL A 117 -26.957 -25.104 -5.860 1.00 51.65 N ATOM 1027 CA VAL A 117 -26.797 -24.693 -4.438 1.00 52.40 C ATOM 1028 C VAL A 117 -25.640 -25.424 -3.812 1.00 51.33 C ATOM 1029 O VAL A 117 -25.616 -26.645 -3.788 1.00 50.78 O ATOM 1030 CB VAL A 117 -28.065 -24.899 -3.575 1.00 53.56 C ATOM 1031 CG1 VAL A 117 -27.762 -24.771 -2.063 1.00 54.03 C ATOM 1032 CG2 VAL A 117 -29.126 -23.864 -3.967 1.00 53.48 C ATOM 1033 H VAL A 117 -27.799 -25.641 -6.151 1.00 0.00 H ATOM 1034 N VAL A 118 -24.707 -24.656 -3.275 1.00 47.92 N ATOM 1035 CA VAL A 118 -23.522 -25.208 -2.619 1.00 48.08 C ATOM 1036 C VAL A 118 -23.654 -25.225 -1.074 1.00 43.85 C ATOM 1037 O VAL A 118 -23.272 -26.187 -0.447 1.00 42.81 O ATOM 1038 CB VAL A 118 -22.330 -24.400 -3.108 1.00 52.71 C ATOM 1039 CG1 VAL A 118 -21.124 -24.583 -2.219 1.00 55.93 C ATOM 1040 CG2 VAL A 118 -22.015 -24.794 -4.549 1.00 52.11 C ATOM 1041 H VAL A 118 -24.820 -23.623 -3.321 1.00 0.00 H ATOM 1042 N ILE A 119 -24.251 -24.179 -0.512 1.00 42.57 N ATOM 1043 CA ILE A 119 -24.564 -24.056 0.914 1.00 42.19 C ATOM 1044 C ILE A 119 -26.022 -23.646 1.033 1.00 40.12 C ATOM 1045 O ILE A 119 -26.410 -22.621 0.448 1.00 37.52 O ATOM 1046 CB ILE A 119 -23.640 -22.986 1.598 1.00 43.12 C ATOM 1047 CG1 ILE A 119 -22.224 -23.520 1.694 1.00 43.62 C ATOM 1048 CG2 ILE A 119 -24.119 -22.606 3.001 1.00 42.50 C ATOM 1049 CD1 ILE A 119 -21.172 -22.446 1.720 1.00 50.47 C ATOM 1050 H ILE A 119 -24.516 -23.387 -1.132 1.00 0.00 H ATOM 1051 N LYS A 120 -26.812 -24.411 1.787 1.00 37.09 N ATOM 1052 CA LYS A 120 -28.216 -24.041 2.113 1.00 38.96 C ATOM 1053 C LYS A 120 -28.342 -23.159 3.361 1.00 34.23 C ATOM 1054 O LYS A 120 -27.737 -23.426 4.374 1.00 33.01 O ATOM 1055 CB LYS A 120 -29.070 -25.284 2.411 1.00 44.03 C ATOM 1056 CG LYS A 120 -29.245 -26.231 1.253 1.00 51.49 C ATOM 1057 CD LYS A 120 -29.935 -27.533 1.640 1.00 59.33 C ATOM 1058 CE LYS A 120 -29.031 -28.748 1.363 1.00 65.92 C ATOM 1059 NZ LYS A 120 -29.866 -29.972 1.202 1.00 68.81 N ATOM 1060 HZ1 LYS A 120 -30.408 -30.138 2.074 1.00 0.00 H ATOM 1061 HZ2 LYS A 120 -30.521 -29.841 0.405 1.00 0.00 H ATOM 1062 HZ3 LYS A 120 -29.250 -30.789 1.015 1.00 0.00 H ATOM 1063 H LYS A 120 -26.431 -25.303 2.163 1.00 0.00 H ATOM 1064 N ALA A 121 -29.174 -22.148 3.294 1.00 31.82 N ATOM 1065 CA ALA A 121 -29.404 -21.250 4.421 1.00 31.23 C ATOM 1066 C ALA A 121 -29.879 -22.133 5.594 1.00 31.05 C ATOM 1067 O ALA A 121 -30.738 -22.944 5.404 1.00 29.09 O ATOM 1068 CB ALA A 121 -30.500 -20.232 4.078 1.00 30.89 C ATOM 1069 H ALA A 121 -29.688 -21.980 2.406 1.00 0.00 H ATOM 1070 N GLY A 122 -29.307 -21.950 6.779 1.00 28.89 N ATOM 1071 CA GLY A 122 -29.843 -22.549 7.950 1.00 31.32 C ATOM 1072 C GLY A 122 -29.330 -23.927 8.274 1.00 32.61 C ATOM 1073 O GLY A 122 -29.616 -24.389 9.347 1.00 30.96 O ATOM 1074 H GLY A 122 -28.454 -21.359 6.850 1.00 0.00 H ATOM 1075 N GLU A 123 -28.524 -24.525 7.377 1.00 34.59 N ATOM 1076 CA GLU A 123 -27.941 -25.838 7.625 1.00 36.56 C ATOM 1077 C GLU A 123 -26.566 -25.596 8.295 1.00 34.91 C ATOM 1078 O GLU A 123 -25.802 -24.634 7.986 1.00 31.20 O ATOM 1079 CB GLU A 123 -27.785 -26.745 6.339 1.00 40.88 C ATOM 1080 CG GLU A 123 -26.596 -26.304 5.448 1.00 48.27 C ATOM 1081 CD GLU A 123 -26.236 -27.215 4.242 1.00 55.63 C ATOM 1082 OE1 GLU A 123 -26.568 -28.451 4.264 1.00 61.30 O ATOM 1083 OE2 GLU A 123 -25.595 -26.669 3.280 1.00 52.82 O ATOM 1084 H GLU A 123 -28.312 -24.037 6.483 1.00 0.00 H ATOM 1085 N VAL A 124 -26.217 -26.502 9.177 1.00 32.36 N ATOM 1086 CA VAL A 124 -24.896 -26.462 9.760 1.00 33.19 C ATOM 1087 C VAL A 124 -23.882 -26.786 8.687 1.00 33.71 C ATOM 1088 O VAL A 124 -23.967 -27.803 8.039 1.00 34.17 O ATOM 1089 CB VAL A 124 -24.815 -27.446 10.925 1.00 34.95 C ATOM 1090 CG1 VAL A 124 -23.374 -27.626 11.368 1.00 34.44 C ATOM 1091 CG2 VAL A 124 -25.689 -26.922 12.090 1.00 33.57 C ATOM 1092 H VAL A 124 -26.888 -27.246 9.455 1.00 0.00 H ATOM 1093 N ILE A 125 -22.898 -25.930 8.515 1.00 34.05 N ATOM 1094 CA ILE A 125 -21.851 -26.113 7.506 1.00 35.68 C ATOM 1095 C ILE A 125 -20.588 -26.766 8.093 1.00 34.68 C ATOM 1096 O ILE A 125 -19.875 -27.517 7.384 1.00 34.71 O ATOM 1097 CB ILE A 125 -21.370 -24.723 7.072 1.00 37.58 C ATOM 1098 CG1 ILE A 125 -22.437 -23.906 6.391 1.00 38.90 C ATOM 1099 CG2 ILE A 125 -20.105 -24.774 6.223 1.00 41.46 C ATOM 1100 CD1 ILE A 125 -21.973 -22.451 6.274 1.00 39.74 C ATOM 1101 H ILE A 125 -22.861 -25.086 9.122 1.00 0.00 H ATOM 1102 N ALA A 126 -20.264 -26.408 9.332 1.00 30.99 N ATOM 1103 CA ALA A 126 -19.065 -26.922 10.004 1.00 29.70 C ATOM 1104 C ALA A 126 -19.308 -26.996 11.515 1.00 29.32 C ATOM 1105 O ALA A 126 -20.091 -26.206 12.035 1.00 25.89 O ATOM 1106 CB ALA A 126 -17.920 -26.019 9.743 1.00 29.38 C ATOM 1107 H ALA A 126 -20.880 -25.742 9.841 1.00 0.00 H ATOM 1108 N ARG A 127 -18.631 -27.940 12.172 1.00 28.13 N ATOM 1109 CA ARG A 127 -18.684 -28.072 13.618 1.00 30.07 C ATOM 1110 C ARG A 127 -17.277 -27.965 14.134 1.00 28.94 C ATOM 1111 O ARG A 127 -16.432 -28.831 13.832 1.00 29.66 O ATOM 1112 CB ARG A 127 -19.346 -29.403 14.049 1.00 31.36 C ATOM 1113 CG ARG A 127 -20.782 -29.550 13.674 1.00 33.38 C ATOM 1114 CD ARG A 127 -21.320 -30.921 14.102 1.00 36.25 C ATOM 1115 NE ARG A 127 -22.334 -31.363 13.154 1.00 40.37 N ATOM 1116 CZ ARG A 127 -23.632 -31.114 13.236 1.00 40.56 C ATOM 1117 NH1 ARG A 127 -24.175 -30.489 14.276 1.00 41.66 N ATOM 1118 NH2 ARG A 127 -24.401 -31.513 12.244 1.00 44.62 N ATOM 1119 HE ARG A 127 -22.010 -31.924 12.341 1.00 0.00 H ATOM 1120 HH12 ARG A 127 -25.200 -30.313 14.300 1.00 0.00 H ATOM 1121 HH11 ARG A 127 -23.575 -30.176 15.066 1.00 0.00 H ATOM 1122 HH22 ARG A 127 -25.425 -31.334 12.275 1.00 0.00 H ATOM 1123 HH21 ARG A 127 -23.984 -32.007 11.429 1.00 0.00 H ATOM 1124 H ARG A 127 -18.044 -28.605 11.629 1.00 0.00 H ATOM 1125 N ILE A 128 -17.016 -26.876 14.839 1.00 27.46 N ATOM 1126 CA ILE A 128 -15.690 -26.604 15.298 1.00 26.59 C ATOM 1127 C ILE A 128 -15.553 -26.807 16.791 1.00 26.80 C ATOM 1128 O ILE A 128 -16.157 -26.038 17.612 1.00 26.14 O ATOM 1129 CB ILE A 128 -15.281 -25.184 14.829 1.00 28.78 C ATOM 1130 CG1 ILE A 128 -15.128 -25.218 13.299 1.00 29.61 C ATOM 1131 CG2 ILE A 128 -13.957 -24.775 15.437 1.00 27.59 C ATOM 1132 CD1 ILE A 128 -15.074 -23.849 12.741 1.00 32.24 C ATOM 1133 H ILE A 128 -17.784 -26.211 15.061 1.00 0.00 H ATOM 1134 N HIS A 129 -14.770 -27.822 17.154 1.00 26.98 N ATOM 1135 CA HIS A 129 -14.512 -28.153 18.572 1.00 27.64 C ATOM 1136 C HIS A 129 -13.323 -27.335 19.123 1.00 24.67 C ATOM 1137 O HIS A 129 -12.239 -27.309 18.578 1.00 23.39 O ATOM 1138 CB HIS A 129 -14.441 -29.687 18.790 1.00 29.95 C ATOM 1139 CG HIS A 129 -14.238 -30.117 20.218 1.00 35.86 C ATOM 1140 ND1 HIS A 129 -13.821 -31.402 20.561 1.00 38.96 N ATOM 1141 CD2 HIS A 129 -14.387 -29.455 21.395 1.00 37.20 C ATOM 1142 CE1 HIS A 129 -13.671 -31.482 21.880 1.00 37.70 C ATOM 1143 NE2 HIS A 129 -14.014 -30.324 22.408 1.00 36.68 N ATOM 1144 H HIS A 129 -14.325 -28.402 16.414 1.00 0.00 H ATOM 1145 N MET A 130 -13.584 -26.609 20.200 1.00 22.37 N ATOM 1146 CA MET A 130 -12.583 -25.827 20.887 1.00 22.54 C ATOM 1147 C MET A 130 -12.427 -26.330 22.347 1.00 21.11 C ATOM 1148 O MET A 130 -13.369 -26.654 22.974 1.00 21.19 O ATOM 1149 CB MET A 130 -12.980 -24.327 20.801 1.00 23.77 C ATOM 1150 CG MET A 130 -12.055 -23.367 21.550 1.00 25.61 C ATOM 1151 SD MET A 130 -12.550 -21.608 21.390 1.00 31.91 S ATOM 1152 CE MET A 130 -13.284 -21.454 23.037 1.00 31.15 C ATOM 1153 H MET A 130 -14.557 -26.602 20.568 1.00 0.00 H ATOM 1154 N TYR A 131 -11.218 -26.390 22.843 1.00 21.58 N ATOM 1155 CA TYR A 131 -10.940 -26.861 24.187 1.00 22.44 C ATOM 1156 C TYR A 131 -10.245 -25.753 24.977 1.00 22.01 C ATOM 1157 O TYR A 131 -9.380 -25.067 24.420 1.00 21.06 O ATOM 1158 CB TYR A 131 -9.961 -28.039 24.103 1.00 23.33 C ATOM 1159 CG TYR A 131 -9.511 -28.616 25.427 1.00 23.06 C ATOM 1160 CD1 TYR A 131 -10.361 -29.384 26.192 1.00 24.34 C ATOM 1161 CD2 TYR A 131 -8.230 -28.397 25.891 1.00 24.21 C ATOM 1162 CE1 TYR A 131 -9.937 -29.974 27.389 1.00 23.88 C ATOM 1163 CE2 TYR A 131 -7.773 -28.966 27.056 1.00 23.97 C ATOM 1164 CZ TYR A 131 -8.654 -29.772 27.778 1.00 24.41 C ATOM 1165 OH TYR A 131 -8.205 -30.312 28.910 1.00 29.00 O ATOM 1166 HH TYR A 131 -8.922 -30.856 29.322 1.00 0.00 H ATOM 1167 H TYR A 131 -10.421 -26.087 22.248 1.00 0.00 H ATOM 1168 N LYS A 132 -10.617 -25.643 26.264 1.00 21.41 N ATOM 1169 CA LYS A 132 -10.059 -24.747 27.184 1.00 22.65 C ATOM 1170 C LYS A 132 -9.609 -25.511 28.391 1.00 23.71 C ATOM 1171 O LYS A 132 -10.331 -26.361 28.869 1.00 24.76 O ATOM 1172 CB LYS A 132 -11.159 -23.726 27.645 1.00 22.27 C ATOM 1173 CG LYS A 132 -10.777 -22.922 28.913 1.00 21.76 C ATOM 1174 CD LYS A 132 -11.541 -23.389 30.206 1.00 22.24 C ATOM 1175 CE LYS A 132 -10.830 -22.862 31.423 1.00 21.72 C ATOM 1176 NZ LYS A 132 -11.503 -23.103 32.722 1.00 22.82 N ATOM 1177 HZ1 LYS A 132 -12.440 -22.651 32.715 1.00 0.00 H ATOM 1178 HZ2 LYS A 132 -11.612 -24.127 32.870 1.00 0.00 H ATOM 1179 HZ3 LYS A 132 -10.928 -22.700 33.489 1.00 0.00 H ATOM 1180 H LYS A 132 -11.375 -26.270 26.601 1.00 0.00 H ATOM 1181 N ILE A 133 -8.428 -25.175 28.909 1.00 24.41 N ATOM 1182 CA ILE A 133 -8.017 -25.535 30.240 1.00 25.23 C ATOM 1183 C ILE A 133 -7.178 -24.325 30.785 1.00 26.24 C ATOM 1184 O ILE A 133 -6.510 -23.614 30.027 1.00 25.71 O ATOM 1185 CB ILE A 133 -7.203 -26.808 30.199 1.00 26.76 C ATOM 1186 CG1 ILE A 133 -6.855 -27.275 31.597 1.00 28.15 C ATOM 1187 CG2 ILE A 133 -5.921 -26.660 29.374 1.00 27.51 C ATOM 1188 CD1 ILE A 133 -6.401 -28.707 31.694 1.00 29.74 C ATOM 1189 H ILE A 133 -7.770 -24.625 28.321 1.00 0.00 H ATOM 1190 N ALA A 134 -7.236 -24.089 32.073 1.00 26.98 N ATOM 1191 CA ALA A 134 -6.534 -22.970 32.669 1.00 28.53 C ATOM 1192 C ALA A 134 -5.283 -23.500 33.378 1.00 32.11 C ATOM 1193 O ALA A 134 -4.782 -24.542 33.031 1.00 34.37 O ATOM 1194 CB ALA A 134 -7.468 -22.235 33.629 1.00 28.00 C ATOM 1195 H ALA A 134 -7.798 -24.719 32.681 1.00 0.00 H ATOM 1196 N THR A 135 -4.810 -22.791 34.397 1.00 35.08 N ATOM 1197 CA THR A 135 -3.490 -22.983 34.967 1.00 37.11 C ATOM 1198 C THR A 135 -3.558 -23.544 36.437 1.00 38.24 C ATOM 1199 O THR A 135 -2.794 -24.440 36.773 1.00 38.36 O ATOM 1200 CB THR A 135 -2.780 -21.594 34.882 1.00 39.99 C ATOM 1201 OG1 THR A 135 -2.622 -21.168 33.485 1.00 38.93 O ATOM 1202 CG2 THR A 135 -1.464 -21.610 35.577 1.00 39.12 C ATOM 1203 HG1 THR A 135 -3.513 -21.096 33.060 1.00 0.00 H ATOM 1204 H THR A 135 -5.420 -22.057 34.809 1.00 0.00 H ATOM 1205 N LEU A 136 -4.481 -23.028 37.270 1.00 35.24 N ATOM 1206 CA LEU A 136 -4.580 -23.395 38.694 1.00 36.59 C ATOM 1207 C LEU A 136 -5.476 -24.599 38.923 1.00 35.03 C ATOM 1208 O LEU A 136 -6.382 -24.847 38.149 1.00 33.69 O ATOM 1209 CB LEU A 136 -5.090 -22.195 39.533 1.00 38.92 C ATOM 1210 CG LEU A 136 -4.326 -20.834 39.407 1.00 39.27 C ATOM 1211 CD1 LEU A 136 -4.926 -19.693 40.211 1.00 40.19 C ATOM 1212 CD2 LEU A 136 -2.855 -20.973 39.795 1.00 39.85 C ATOM 1213 H LEU A 136 -5.158 -22.336 36.890 1.00 0.00 H ATOM 1214 N GLY A 137 -5.217 -25.330 39.987 1.00 34.91 N ATOM 1215 CA GLY A 137 -6.001 -26.548 40.344 1.00 35.30 C ATOM 1216 C GLY A 137 -5.976 -27.563 39.212 1.00 33.15 C ATOM 1217 O GLY A 137 -4.983 -27.816 38.613 1.00 33.96 O ATOM 1218 H GLY A 137 -4.431 -25.046 40.606 1.00 0.00 H ATOM 1219 N SER A 138 -7.109 -28.111 38.893 1.00 34.84 N ATOM 1220 CA SER A 138 -7.247 -29.031 37.761 1.00 38.78 C ATOM 1221 C SER A 138 -7.301 -28.289 36.424 1.00 36.13 C ATOM 1222 O SER A 138 -7.423 -28.910 35.398 1.00 36.73 O ATOM 1223 CB SER A 138 -8.586 -29.749 37.900 1.00 41.10 C ATOM 1224 OG SER A 138 -9.695 -28.835 37.576 1.00 41.85 O ATOM 1225 HG SER A 138 -9.596 -28.514 36.645 1.00 0.00 H ATOM 1226 H SER A 138 -7.950 -27.889 39.462 1.00 0.00 H ATOM 1227 N GLY A 139 -7.365 -26.966 36.433 1.00 33.18 N ATOM 1228 CA GLY A 139 -7.548 -26.187 35.208 1.00 31.17 C ATOM 1229 C GLY A 139 -8.977 -26.060 34.723 1.00 31.18 C ATOM 1230 O GLY A 139 -9.196 -25.322 33.727 1.00 32.12 O ATOM 1231 H GLY A 139 -7.282 -26.465 37.340 1.00 0.00 H ATOM 1232 N ASN A 140 -9.953 -26.729 35.379 1.00 30.22 N ATOM 1233 CA ASN A 140 -11.374 -26.768 34.981 1.00 31.01 C ATOM 1234 C ASN A 140 -11.607 -26.803 33.435 1.00 28.60 C ATOM 1235 O ASN A 140 -12.174 -25.865 32.852 1.00 28.42 O ATOM 1236 CB ASN A 140 -12.182 -25.663 35.680 1.00 34.13 C ATOM 1237 CG ASN A 140 -12.086 -25.780 37.217 1.00 38.42 C ATOM 1238 OD1 ASN A 140 -11.922 -24.797 37.928 1.00 42.97 O ATOM 1239 ND2 ASN A 140 -12.118 -26.979 37.708 1.00 40.36 N ATOM 1240 HD22 ASN A 140 -12.259 -27.795 37.079 1.00 0.00 H ATOM 1241 HD21 ASN A 140 -12.003 -27.125 38.731 1.00 0.00 H ATOM 1242 H ASN A 140 -9.680 -27.258 36.232 1.00 0.00 H ATOM 1243 N PRO A 141 -11.174 -27.887 32.799 1.00 26.65 N ATOM 1244 CA PRO A 141 -11.340 -27.986 31.370 1.00 27.06 C ATOM 1245 C PRO A 141 -12.769 -27.891 30.891 1.00 26.27 C ATOM 1246 O PRO A 141 -13.672 -28.355 31.549 1.00 25.29 O ATOM 1247 CB PRO A 141 -10.724 -29.381 31.009 1.00 29.35 C ATOM 1248 CG PRO A 141 -10.629 -30.145 32.309 1.00 28.72 C ATOM 1249 CD PRO A 141 -10.734 -29.173 33.431 1.00 27.87 C ATOM 1250 N ARG A 142 -12.989 -27.225 29.751 1.00 26.13 N ATOM 1251 CA ARG A 142 -14.318 -27.074 29.163 1.00 25.15 C ATOM 1252 C ARG A 142 -14.272 -27.327 27.692 1.00 25.19 C ATOM 1253 O ARG A 142 -13.281 -27.044 27.078 1.00 24.85 O ATOM 1254 CB ARG A 142 -14.786 -25.637 29.408 1.00 25.99 C ATOM 1255 CG ARG A 142 -14.982 -25.261 30.845 1.00 28.02 C ATOM 1256 CD ARG A 142 -16.103 -26.116 31.418 1.00 32.14 C ATOM 1257 NE ARG A 142 -16.693 -25.589 32.641 1.00 36.77 N ATOM 1258 CZ ARG A 142 -16.283 -25.896 33.871 1.00 44.01 C ATOM 1259 NH1 ARG A 142 -15.267 -26.756 34.078 1.00 43.69 N ATOM 1260 NH2 ARG A 142 -16.901 -25.324 34.923 1.00 47.14 N ATOM 1261 HE ARG A 142 -17.490 -24.927 32.548 1.00 0.00 H ATOM 1262 HH12 ARG A 142 -14.965 -26.980 35.048 1.00 0.00 H ATOM 1263 HH11 ARG A 142 -14.785 -27.196 33.268 1.00 0.00 H ATOM 1264 HH22 ARG A 142 -16.596 -25.550 35.891 1.00 0.00 H ATOM 1265 HH21 ARG A 142 -17.683 -24.656 34.767 1.00 0.00 H ATOM 1266 H ARG A 142 -12.178 -26.796 29.262 1.00 0.00 H ATOM 1267 N ASN A 143 -15.343 -27.833 27.099 1.00 26.28 N ATOM 1268 CA ASN A 143 -15.380 -28.073 25.681 1.00 26.95 C ATOM 1269 C ASN A 143 -16.498 -27.150 25.137 1.00 26.78 C ATOM 1270 O ASN A 143 -17.549 -27.040 25.743 1.00 26.50 O ATOM 1271 CB ASN A 143 -15.741 -29.553 25.364 1.00 27.65 C ATOM 1272 CG ASN A 143 -14.623 -30.561 25.733 1.00 28.51 C ATOM 1273 OD1 ASN A 143 -13.627 -30.614 25.089 1.00 29.35 O ATOM 1274 ND2 ASN A 143 -14.803 -31.314 26.780 1.00 29.84 N ATOM 1275 HD22 ASN A 143 -15.686 -31.245 27.324 1.00 0.00 H ATOM 1276 HD21 ASN A 143 -14.063 -31.984 27.072 1.00 0.00 H ATOM 1277 H ASN A 143 -16.179 -28.063 27.674 1.00 0.00 H ATOM 1278 N PHE A 144 -16.226 -26.518 23.996 1.00 26.27 N ATOM 1279 CA PHE A 144 -17.134 -25.671 23.233 1.00 26.38 C ATOM 1280 C PHE A 144 -17.273 -26.251 21.841 1.00 26.92 C ATOM 1281 O PHE A 144 -16.270 -26.684 21.296 1.00 26.79 O ATOM 1282 CB PHE A 144 -16.535 -24.279 23.038 1.00 25.08 C ATOM 1283 CG PHE A 144 -16.391 -23.477 24.326 1.00 25.29 C ATOM 1284 CD1 PHE A 144 -15.294 -23.657 25.157 1.00 25.06 C ATOM 1285 CD2 PHE A 144 -17.354 -22.509 24.685 1.00 23.48 C ATOM 1286 CE1 PHE A 144 -15.191 -22.954 26.406 1.00 27.08 C ATOM 1287 CE2 PHE A 144 -17.246 -21.813 25.893 1.00 25.51 C ATOM 1288 CZ PHE A 144 -16.167 -22.010 26.753 1.00 24.98 C ATOM 1289 H PHE A 144 -15.268 -26.642 23.611 1.00 0.00 H ATOM 1290 N THR A 145 -18.476 -26.204 21.249 1.00 28.85 N ATOM 1291 CA THR A 145 -18.658 -26.536 19.827 1.00 29.72 C ATOM 1292 C THR A 145 -19.369 -25.377 19.203 1.00 28.41 C ATOM 1293 O THR A 145 -20.362 -24.874 19.763 1.00 27.46 O ATOM 1294 CB THR A 145 -19.424 -27.857 19.625 1.00 32.60 C ATOM 1295 OG1 THR A 145 -18.644 -28.909 20.171 1.00 34.92 O ATOM 1296 CG2 THR A 145 -19.606 -28.170 18.131 1.00 35.43 C ATOM 1297 HG1 THR A 145 -18.498 -28.744 21.136 1.00 0.00 H ATOM 1298 H THR A 145 -19.305 -25.925 21.812 1.00 0.00 H ATOM 1299 N TRP A 146 -18.767 -24.847 18.131 1.00 27.20 N ATOM 1300 CA TRP A 146 -19.305 -23.770 17.390 1.00 25.98 C ATOM 1301 C TRP A 146 -19.889 -24.391 16.142 1.00 25.21 C ATOM 1302 O TRP A 146 -19.170 -24.844 15.276 1.00 24.54 O ATOM 1303 CB TRP A 146 -18.209 -22.759 17.036 1.00 28.45 C ATOM 1304 CG TRP A 146 -17.440 -22.237 18.235 1.00 30.36 C ATOM 1305 CD1 TRP A 146 -16.153 -22.488 18.523 1.00 31.74 C ATOM 1306 CD2 TRP A 146 -17.930 -21.404 19.297 1.00 30.49 C ATOM 1307 NE1 TRP A 146 -15.784 -21.881 19.695 1.00 31.47 N ATOM 1308 CE2 TRP A 146 -16.841 -21.198 20.200 1.00 30.02 C ATOM 1309 CE3 TRP A 146 -19.167 -20.806 19.575 1.00 29.18 C ATOM 1310 CZ2 TRP A 146 -16.944 -20.423 21.355 1.00 29.65 C ATOM 1311 CZ3 TRP A 146 -19.303 -20.072 20.772 1.00 29.13 C ATOM 1312 CH2 TRP A 146 -18.182 -19.874 21.650 1.00 29.67 C ATOM 1313 HE1 TRP A 146 -14.841 -21.936 20.129 1.00 0.00 H ATOM 1314 H TRP A 146 -17.857 -25.248 17.828 1.00 0.00 H ATOM 1315 N ASN A 147 -21.197 -24.348 16.022 1.00 27.20 N ATOM 1316 CA ASN A 147 -21.921 -24.765 14.791 1.00 26.92 C ATOM 1317 C ASN A 147 -22.055 -23.598 13.866 1.00 29.72 C ATOM 1318 O ASN A 147 -22.789 -22.659 14.169 1.00 31.52 O ATOM 1319 CB ASN A 147 -23.287 -25.319 15.154 1.00 27.09 C ATOM 1320 CG ASN A 147 -23.196 -26.708 15.782 1.00 28.57 C ATOM 1321 OD1 ASN A 147 -22.154 -27.303 15.871 1.00 32.83 O ATOM 1322 ND2 ASN A 147 -24.282 -27.221 16.178 1.00 31.92 N ATOM 1323 HD22 ASN A 147 -25.171 -26.688 16.091 1.00 0.00 H ATOM 1324 HD21 ASN A 147 -24.286 -28.176 16.590 1.00 0.00 H ATOM 1325 H ASN A 147 -21.755 -24.005 16.830 1.00 0.00 H ATOM 1326 N ILE A 148 -21.310 -23.631 12.764 1.00 27.91 N ATOM 1327 CA ILE A 148 -21.305 -22.535 11.855 1.00 30.73 C ATOM 1328 C ILE A 148 -22.486 -22.684 10.856 1.00 29.78 C ATOM 1329 O ILE A 148 -22.663 -23.762 10.292 1.00 29.64 O ATOM 1330 CB ILE A 148 -19.954 -22.465 11.124 1.00 31.47 C ATOM 1331 CG1 ILE A 148 -18.797 -22.525 12.110 1.00 34.79 C ATOM 1332 CG2 ILE A 148 -19.892 -21.181 10.340 1.00 35.62 C ATOM 1333 CD1 ILE A 148 -18.964 -21.678 13.377 1.00 35.48 C ATOM 1334 H ILE A 148 -20.725 -24.467 12.564 1.00 0.00 H ATOM 1335 N ILE A 149 -23.279 -21.635 10.688 1.00 27.44 N ATOM 1336 CA ILE A 149 -24.525 -21.697 9.917 1.00 29.72 C ATOM 1337 C ILE A 149 -24.643 -20.443 9.068 1.00 30.20 C ATOM 1338 O ILE A 149 -24.462 -19.345 9.560 1.00 32.08 O ATOM 1339 CB ILE A 149 -25.776 -21.784 10.841 1.00 29.23 C ATOM 1340 CG1 ILE A 149 -25.688 -22.993 11.794 1.00 30.21 C ATOM 1341 CG2 ILE A 149 -27.042 -21.910 10.028 1.00 29.85 C ATOM 1342 CD1 ILE A 149 -26.687 -23.007 12.915 1.00 32.54 C ATOM 1343 H ILE A 149 -23.006 -20.730 11.121 1.00 0.00 H ATOM 1344 N SER A 150 -24.986 -20.589 7.794 1.00 30.93 N ATOM 1345 CA SER A 150 -25.179 -19.409 6.897 1.00 31.38 C ATOM 1346 C SER A 150 -26.586 -18.914 6.987 1.00 30.92 C ATOM 1347 O SER A 150 -27.511 -19.722 7.010 1.00 31.44 O ATOM 1348 CB SER A 150 -24.895 -19.745 5.432 1.00 34.49 C ATOM 1349 OG SER A 150 -25.079 -18.532 4.660 1.00 36.26 O ATOM 1350 HG SER A 150 -24.901 -18.720 3.704 1.00 0.00 H ATOM 1351 H SER A 150 -25.124 -21.546 7.411 1.00 0.00 H ATOM 1352 N ASN A 151 -26.757 -17.599 7.084 1.00 30.32 N ATOM 1353 CA ASN A 151 -28.081 -16.925 6.943 1.00 30.74 C ATOM 1354 C ASN A 151 -28.711 -16.987 5.508 1.00 31.83 C ATOM 1355 O ASN A 151 -29.914 -16.913 5.384 1.00 29.82 O ATOM 1356 CB ASN A 151 -27.984 -15.423 7.352 1.00 30.74 C ATOM 1357 CG ASN A 151 -27.885 -15.226 8.877 1.00 30.81 C ATOM 1358 OD1 ASN A 151 -28.513 -15.907 9.684 1.00 31.28 O ATOM 1359 ND2 ASN A 151 -27.119 -14.293 9.248 1.00 31.31 N ATOM 1360 HD22 ASN A 151 -26.600 -13.734 8.541 1.00 0.00 H ATOM 1361 HD21 ASN A 151 -27.007 -14.084 10.261 1.00 0.00 H ATOM 1362 H ASN A 151 -25.922 -17.007 7.268 1.00 0.00 H ATOM 1363 N ASN A 152 -27.914 -17.244 4.479 1.00 32.90 N ATOM 1364 CA ASN A 152 -28.392 -17.297 3.107 1.00 37.79 C ATOM 1365 C ASN A 152 -27.778 -18.464 2.301 1.00 37.67 C ATOM 1366 O ASN A 152 -26.725 -18.983 2.631 1.00 36.16 O ATOM 1367 CB ASN A 152 -28.047 -15.977 2.425 1.00 42.90 C ATOM 1368 CG ASN A 152 -26.530 -15.697 2.455 1.00 50.07 C ATOM 1369 OD1 ASN A 152 -25.967 -15.245 3.515 1.00 52.48 O ATOM 1370 ND2 ASN A 152 -25.850 -15.964 1.314 1.00 49.73 N ATOM 1371 HD22 ASN A 152 -26.355 -16.330 0.481 1.00 0.00 H ATOM 1372 HD21 ASN A 152 -24.823 -15.803 1.271 1.00 0.00 H ATOM 1373 H ASN A 152 -26.904 -17.415 4.662 1.00 0.00 H ATOM 1374 N SER A 153 -28.482 -18.933 1.281 1.00 37.95 N ATOM 1375 CA SER A 153 -27.884 -19.908 0.411 1.00 40.75 C ATOM 1376 C SER A 153 -26.793 -19.265 -0.459 1.00 40.93 C ATOM 1377 O SER A 153 -26.728 -18.052 -0.676 1.00 44.70 O ATOM 1378 CB SER A 153 -28.948 -20.687 -0.395 1.00 41.11 C ATOM 1379 OG SER A 153 -30.006 -21.048 0.489 1.00 44.58 O ATOM 1380 HG SER A 153 -30.406 -20.229 0.876 1.00 0.00 H ATOM 1381 H SER A 153 -29.453 -18.600 1.113 1.00 0.00 H ATOM 1382 N VAL A 154 -25.892 -20.127 -0.883 1.00 43.07 N ATOM 1383 CA VAL A 154 -24.752 -19.794 -1.703 1.00 43.44 C ATOM 1384 C VAL A 154 -24.879 -20.765 -2.876 1.00 45.67 C ATOM 1385 O VAL A 154 -25.052 -21.966 -2.686 1.00 42.55 O ATOM 1386 CB VAL A 154 -23.438 -20.041 -0.977 1.00 42.67 C ATOM 1387 CG1 VAL A 154 -22.269 -19.615 -1.848 1.00 42.68 C ATOM 1388 CG2 VAL A 154 -23.412 -19.319 0.390 1.00 43.75 C ATOM 1389 H VAL A 154 -26.011 -21.122 -0.606 1.00 0.00 H ATOM 1390 N VAL A 155 -24.792 -20.200 -4.068 1.00 48.26 N ATOM 1391 CA VAL A 155 -25.061 -20.861 -5.356 1.00 53.21 C ATOM 1392 C VAL A 155 -23.821 -20.739 -6.237 1.00 53.25 C ATOM 1393 O VAL A 155 -23.085 -19.774 -6.152 1.00 49.42 O ATOM 1394 CB VAL A 155 -26.223 -20.129 -6.067 1.00 55.49 C ATOM 1395 CG1 VAL A 155 -26.234 -20.377 -7.569 1.00 60.84 C ATOM 1396 CG2 VAL A 155 -27.546 -20.539 -5.465 1.00 52.10 C ATOM 1397 H VAL A 155 -24.508 -19.200 -4.099 1.00 0.00 H ATOM 1398 N MET A 156 -23.585 -21.751 -7.051 1.00 57.76 N ATOM 1399 CA MET A 156 -22.583 -21.717 -8.101 1.00 63.88 C ATOM 1400 C MET A 156 -23.223 -22.007 -9.465 1.00 67.86 C ATOM 1401 O MET A 156 -23.699 -23.130 -9.666 1.00 70.04 O ATOM 1402 CB MET A 156 -21.579 -22.806 -7.808 1.00 64.69 C ATOM 1403 CG MET A 156 -20.549 -23.022 -8.900 1.00 67.49 C ATOM 1404 SD MET A 156 -19.461 -24.377 -8.421 1.00 73.76 S ATOM 1405 CE MET A 156 -18.576 -23.636 -7.025 1.00 71.61 C ATOM 1406 H MET A 156 -24.147 -22.619 -6.934 1.00 0.00 H ATOM 1407 N PRO A 157 -23.227 -21.032 -10.412 1.00 71.74 N ATOM 1408 CA PRO A 157 -23.738 -21.234 -11.818 1.00 70.73 C ATOM 1409 C PRO A 157 -23.497 -22.595 -12.530 1.00 62.37 C ATOM 1410 O PRO A 157 -22.462 -23.236 -12.312 1.00 52.29 O ATOM 1411 CB PRO A 157 -23.034 -20.103 -12.583 1.00 73.61 C ATOM 1412 CG PRO A 157 -22.941 -18.968 -11.571 1.00 77.55 C ATOM 1413 CD PRO A 157 -22.958 -19.593 -10.168 1.00 77.29 C TER 1414 PRO A 157 HETATM 1415 O HOH 1 1.642 -20.023 28.676 1.00 39.46 O HETATM 1416 O HOH 2 -8.337 -23.012 37.042 1.00 27.77 O HETATM 1417 O HOH 3 -9.607 -32.211 29.921 1.00 39.06 O HETATM 1418 O HOH 4 -5.624 -8.167 32.722 1.00 42.07 O HETATM 1419 O HOH 5 -25.798 -22.664 6.321 1.00 31.72 O HETATM 1420 O HOH 6 -23.383 -15.364 23.328 1.00 26.92 O HETATM 1421 O HOH 7 -20.153 -22.802 22.340 1.00 37.17 O HETATM 1422 O HOH 8 -26.168 -30.480 15.997 1.00 43.12 O HETATM 1423 O HOH 9 -15.267 -21.826 30.092 1.00 27.60 O HETATM 1424 O HOH 10 -6.598 -14.679 35.577 1.00 25.15 O HETATM 1425 O HOH 11 -15.704 -10.880 17.784 1.00 45.68 O HETATM 1426 O HOH 12 -5.352 -25.498 25.226 1.00 23.16 O HETATM 1427 O HOH 13 -5.306 -12.218 27.306 1.00 31.58 O HETATM 1428 O HOH 14 -1.280 -27.467 20.696 1.00 30.46 O HETATM 1429 O HOH 15 -13.356 -32.714 18.032 1.00 30.48 O HETATM 1430 O HOH 16 -8.112 -32.734 6.272 1.00 29.36 O HETATM 1431 O HOH 17 -2.245 -7.381 31.438 1.00 35.76 O HETATM 1432 O HOH 18 -5.587 -30.968 9.746 1.00 26.10 O HETATM 1433 O HOH 19 -7.804 -7.637 32.538 1.00 28.37 O HETATM 1434 O HOH 20 -26.843 -21.235 20.059 1.00 26.80 O HETATM 1435 O HOH 21 -24.831 -16.006 15.732 1.00 38.36 O HETATM 1436 O HOH 22 -14.167 -21.807 32.666 1.00 29.71 O HETATM 1437 O HOH 23 -18.734 -29.098 23.149 1.00 36.23 O HETATM 1438 O HOH 24 -20.999 -12.551 8.675 1.00 41.58 O HETATM 1439 O HOH 25 -16.015 -21.625 34.706 1.00 26.74 O HETATM 1440 O HOH 26 -24.106 -33.330 9.786 1.00 36.54 O HETATM 1441 O HOH 27 -17.277 -29.097 29.153 1.00 30.21 O HETATM 1442 O HOH 28 -13.101 -35.196 11.162 1.00 30.99 O HETATM 1443 O HOH 29 -24.230 -12.809 30.388 1.00 47.77 O HETATM 1444 O HOH 30 -2.518 -33.278 18.002 1.00 37.06 O HETATM 1445 O HOH 31 -31.555 -17.980 0.760 1.00 39.93 O HETATM 1446 O HOH 32 -24.862 -27.525 24.993 1.00 38.60 O HETATM 1447 O HOH 33 -18.215 -14.274 7.025 1.00 45.93 O HETATM 1448 O HOH 34 -28.131 -14.343 23.940 1.00 36.30 O HETATM 1449 O HOH 35 -18.693 -18.868 32.443 1.00 43.08 O HETATM 1450 O HOH 36 -3.330 -27.622 35.085 1.00 44.88 O HETATM 1451 O HOH 37 -7.844 -9.700 24.109 1.00 38.24 O HETATM 1452 O HOH 38 -19.535 -20.210 37.406 1.00 43.35 O HETATM 1453 O HOH 39 -26.992 -9.862 10.661 1.00 50.33 O HETATM 1454 O HOH 40 -23.601 -22.275 29.241 1.00 40.69 O HETATM 1455 O HOH 41 -20.057 -22.582 33.814 1.00 35.35 O HETATM 1456 O HOH 42 -3.250 -27.015 26.468 1.00 50.56 O HETATM 1457 O HOH 43 -24.220 -18.986 32.482 1.00 41.12 O HETATM 1458 O HOH 44 -21.144 -18.263 34.916 1.00 44.64 O HETATM 1459 O A A 2 -17.205 -17.254 38.073 1.00 -0.34 O HETATM 1460 C1 A A 2 -16.291 -17.850 38.997 1.00 0.18 C HETATM 1461 O1 A A 2 -15.362 -16.841 39.360 1.00 -0.37 O HETATM 1462 H2 A A 2 -15.825 -16.116 39.762 1.00 0.21 H HETATM 1463 C2 A A 2 -15.490 -18.998 38.355 1.00 0.12 C HETATM 1464 N2 A A 2 -14.497 -19.538 39.251 1.00 -0.28 N HETATM 1465 C7 A A 2 -14.490 -20.781 39.696 1.00 0.17 C HETATM 1466 O7 A A 2 -15.351 -21.574 39.323 1.00 -0.40 O HETATM 1467 C8 A A 2 -13.343 -21.110 40.637 1.00 0.03 C HETATM 1468 H12 A A 2 -13.419 -22.160 40.954 1.00 0.05 H HETATM 1469 H13 A A 2 -13.394 -20.456 41.520 1.00 0.05 H HETATM 1470 H14 A A 2 -12.386 -20.952 40.118 1.00 0.05 H HETATM 1471 H4 A A 2 -13.764 -18.930 39.556 1.00 0.19 H HETATM 1472 C3 A A 2 -14.723 -18.520 37.094 1.00 0.12 C HETATM 1473 O3 A A 2 -14.060 -19.613 36.362 1.00 -0.34 O HETATM 1474 C1 A A 2 -12.738 -19.676 36.210 1.00 0.19 C HETATM 1475 C2 A A 2 -12.258 -21.100 35.877 1.00 0.13 C HETATM 1476 C3 A A 2 -10.759 -21.121 35.749 1.00 0.11 C HETATM 1477 C4 A A 2 -10.218 -20.038 34.817 1.00 0.11 C HETATM 1478 C5 A A 2 -10.652 -18.664 35.373 1.00 0.11 C HETATM 1479 C6 A A 2 -10.199 -17.498 34.465 1.00 0.07 C HETATM 1480 O6 A A 2 -10.953 -17.447 33.273 1.00 -0.39 O HETATM 1481 H25 A A 2 -10.843 -18.261 32.795 1.00 0.21 H HETATM 1482 H20 A A 2 -9.137 -17.635 34.211 1.00 0.06 H HETATM 1483 H21 A A 2 -10.327 -16.551 35.009 1.00 0.06 H HETATM 1484 O5 A A 2 -12.073 -18.602 35.488 1.00 -0.34 O HETATM 1485 H19 A A 2 -10.202 -18.535 36.368 1.00 0.06 H HETATM 1486 O4 A A 2 -10.713 -20.235 33.485 1.00 -0.39 O HETATM 1487 H24 A A 2 -10.371 -19.555 32.917 1.00 0.21 H HETATM 1488 H18 A A 2 -9.119 -20.090 34.797 1.00 0.06 H HETATM 1489 O3 A A 2 -10.405 -22.411 35.323 1.00 -0.39 O HETATM 1490 H23 A A 2 -9.458 -22.487 35.299 1.00 0.21 H HETATM 1491 H17 A A 2 -10.323 -20.947 36.744 1.00 0.06 H HETATM 1492 O2 A A 2 -12.681 -21.916 36.991 1.00 -0.38 O HETATM 1493 H22 A A 2 -12.395 -22.811 36.853 1.00 0.21 H HETATM 1494 H16 A A 2 -12.715 -21.455 34.941 1.00 0.07 H HETATM 1495 H15 A A 2 -12.371 -19.522 37.236 1.00 0.09 H HETATM 1496 C4 A A 2 -15.703 -17.802 36.193 1.00 0.11 C HETATM 1497 O4 A A 2 -16.551 -18.813 35.628 1.00 -0.39 O HETATM 1498 H7 A A 2 -16.022 -19.428 35.134 1.00 0.21 H HETATM 1499 C5 A A 2 -16.517 -16.721 36.912 1.00 0.11 C HETATM 1500 C6 A A 2 -17.495 -16.038 35.956 1.00 0.07 C HETATM 1501 O6 A A 2 -17.997 -14.885 36.652 1.00 -0.39 O HETATM 1502 H11 A A 2 -18.434 -15.163 37.448 1.00 0.21 H HETATM 1503 H9 A A 2 -18.320 -16.720 35.703 1.00 0.06 H HETATM 1504 H10 A A 2 -16.977 -15.732 35.035 1.00 0.06 H HETATM 1505 H8 A A 2 -15.811 -15.956 37.268 1.00 0.06 H HETATM 1506 H6 A A 2 -15.142 -17.312 35.384 1.00 0.06 H HETATM 1507 H5 A A 2 -13.946 -17.809 37.412 1.00 0.06 H HETATM 1508 H3 A A 2 -16.195 -19.794 38.074 1.00 0.06 H HETATM 1509 H1 A A 2 -16.835 -18.220 39.879 1.00 0.09 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 28 27 361 CONECT 361 28 360 CONECT 583 584 591 592 593 CONECT 591 583 CONECT 592 583 CONECT 593 583 CONECT 1019 1020 1023 1024 1025 CONECT 1023 1019 CONECT 1024 1019 CONECT 1025 1019 CONECT 1459 1460 1499 CONECT 1460 1459 1461 1463 1509 CONECT 1461 1460 1462 CONECT 1462 1461 CONECT 1463 1460 1464 1472 1508 CONECT 1464 1463 1465 1471 CONECT 1465 1464 1466 1467 CONECT 1466 1465 CONECT 1467 1465 1468 1469 1470 CONECT 1468 1467 CONECT 1469 1467 CONECT 1470 1467 CONECT 1471 1464 CONECT 1472 1463 1473 1496 1507 CONECT 1473 1472 1474 CONECT 1474 1473 1475 1484 1495 CONECT 1475 1474 1476 1492 1494 CONECT 1476 1475 1477 1489 1491 CONECT 1477 1476 1478 1486 1488 CONECT 1478 1477 1479 1484 1485 CONECT 1479 1478 1480 1482 1483 CONECT 1480 1479 1481 CONECT 1481 1480 CONECT 1482 1479 CONECT 1483 1479 CONECT 1484 1474 1478 CONECT 1485 1478 CONECT 1486 1477 1487 CONECT 1487 1486 CONECT 1488 1477 CONECT 1489 1476 1490 CONECT 1490 1489 CONECT 1491 1476 CONECT 1492 1475 1493 CONECT 1493 1492 CONECT 1494 1475 CONECT 1495 1474 CONECT 1496 1472 1497 1499 1506 CONECT 1497 1496 1498 CONECT 1498 1497 CONECT 1499 1459 1496 1500 1505 CONECT 1500 1499 1501 1503 1504 CONECT 1501 1500 1502 CONECT 1502 1501 CONECT 1503 1500 CONECT 1504 1500 CONECT 1505 1499 CONECT 1506 1496 CONECT 1507 1472 CONECT 1508 1463 CONECT 1509 1460 MASTER 0 0 0 0 0 0 0 0 1506 3 65 13 END
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2-mer
4cd6
RCSB PDB
PDBbind
2-mer
4cd8
RCSB PDB
PDBbind
2-mer
4gzx
RCSB PDB
PDBbind
2-mer
4jjf
RCSB PDB
PDBbind
2-mer
4jjg
RCSB PDB
PDBbind
2-mer
4k3l
RCSB PDB
PDBbind
2-mer
4lk7
RCSB PDB
PDBbind
2-mer
4lkk
RCSB PDB
PDBbind
2-mer
4nku
RCSB PDB
PDBbind
2-mer
4oak
RCSB PDB
PDBbind
2-mer
4oel
RCSB PDB
PDBbind
2-mer
4oem
RCSB PDB
PDBbind
2-mer
4qfl
RCSB PDB
PDBbind
2-mer
4qfn
RCSB PDB
PDBbind
2-mer
4qfo
RCSB PDB
PDBbind
2-mer
4qfp
RCSB PDB
PDBbind
2-mer
4v27
RCSB PDB
PDBbind
2-mer
4x6h
RCSB PDB
PDBbind
2-mer
4yw2
RCSB PDB
PDBbind
2-mer
5ggo
RCSB PDB
PDBbind
2-mer
5gub
RCSB PDB
PDBbind
2-mer
5gx6
RCSB PDB
PDBbind
2-mer
5gx7
RCSB PDB
PDBbind
2-mer
5j41
RCSB PDB
PDBbind
2-mer
5l7f
RCSB PDB
PDBbind
2-mer
5lyr
RCSB PDB
PDBbind
2-mer
5m17
RCSB PDB
PDBbind
2-mer
5m1z
RCSB PDB
PDBbind
2-mer
5m5d
RCSB PDB
PDBbind
2-mer
5m77
RCSB PDB
PDBbind
2-mer
5o58
RCSB PDB
PDBbind
2-mer
5oxk
RCSB PDB
PDBbind
2-mer
5oxl
RCSB PDB
PDBbind
2-mer
5oxm
RCSB PDB
PDBbind
2-mer
5oxn
RCSB PDB
PDBbind
2-mer
5vkm
RCSB PDB
PDBbind
2-mer
5xs8
RCSB PDB
PDBbind
2-mer
6fam
RCSB PDB
PDBbind
2-mer
6hmg
RCSB PDB
PDBbind
2-mer
6p7q
RCSB PDB
PDBbind
2-mer
6kdi
RCSB PDB
PDBbind
2-mer
6idg
RCSB PDB
PDBbind
2-mer
6a87
RCSB PDB
PDBbind
2-mer
6inz
RCSB PDB
PDBbind
2-mer
Entry Information
PDB ID
5lne
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
E. coli F9 pilus adhesin FmlH N-terminal adhesin domain
Ligand Name
2-mer
EC.Number
E.C.-.-.-.-
Resolution
2.2(Å)
Affinity (Kd/Ki/IC50)
Kd=17.43uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Cell Host Microbe Vol. 20: pp. 482-492
Ligand Properties
Formula
C
1
4
H
2
5
NO
1
1
Molecular Weight
383.348
Exact Mass
383.143
No. of atoms
51
No. of bonds
52
Polar Surface Area
198.4
LOGP Value
-4.18 (
Computed with XLOGP3
)
-4.86 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 8
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 13
No. of Nitrogen and Oxygen Atoms: 12
No. of Rings: 2
Canonical SMILES
OC[C@H]1O[C@H](O)[C@@H]([C@H]([C@H]1O)O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O)NC(=O)C
InChI String
InChI=1S/C14H25NO11/c1-4(18)15-7-12(9(20)6(3-17)24-13(7)23)26-14-11(22)10(21)8(19)5(2-16)25-14/h5-14,16-17,19-23H,2-3H2,1H3,(H,15,18)/t5-,6-,7-,8+,9+,10+,11-,12-,13+,14+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
A0A0H2V7F6
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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