Browse entries in the PDBbind-CN Database
HEADER 5E1B_COMPLEX COMPND 5E1B_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 227 VAL PRO ARG GLY SER THR SER GLU VAL ILE GLU ASP GLU SEQRES 2 A 227 LYS GLN PHE TYR SER LYS ALA LYS THR TYR TRP LYS GLN SEQRES 3 A 227 ILE PRO PRO THR VAL ASP GLY MET LEU GLY GLY TYR GLY SEQRES 4 A 227 HIS ILE SER SER ILE ASP ILE ASN SER SER ARG LYS PHE SEQRES 5 A 227 LEU GLN ARG PHE LEU ARG GLU GLY PRO ASN LYS THR GLY SEQRES 6 A 227 THR SER CYS ALA LEU ASP CYS GLY ALA GLY ILE GLY ARG SEQRES 7 A 227 ILE THR LYS ARG LEU LEU LEU PRO LEU PHE ARG GLU VAL SEQRES 8 A 227 ASP MET VAL ASP ILE THR GLU ASP PHE LEU VAL GLN ALA SEQRES 9 A 227 LYS THR TYR LEU GLY GLU GLU GLY LYS ARG VAL ARG ASN SEQRES 10 A 227 TYR PHE CYS CYS GLY LEU GLN ASP PHE THR PRO GLU PRO SEQRES 11 A 227 ASP SER TYR ASP VAL ILE TRP ILE GLN TRP VAL ILE GLY SEQRES 12 A 227 HIS LEU THR ASP GLN HIS LEU ALA GLU PHE LEU ARG ARG SEQRES 13 A 227 CYS LYS GLY SER LEU ARG PRO ASN GLY ILE ILE VAL ILE SEQRES 14 A 227 LYS ASP ASN MET ALA GLN GLU GLY VAL ILE LEU ASP ASP SEQRES 15 A 227 VAL ASP SER SER VAL CYS ARG ASP LEU ASP VAL VAL ARG SEQRES 16 A 227 ARG ILE ILE CYS SER ALA GLY LEU SER LEU LEU ALA GLU SEQRES 17 A 227 GLU ARG GLN GLU ASN LEU PRO ASP GLU ILE TYR HIS VAL SEQRES 18 A 227 TYR SER PHE ALA LEU ARG HET SER A 482 103 ATOM 1 N VAL A -3 1.536 19.102 -36.056 1.00 34.98 N ATOM 2 CA VAL A -3 0.537 20.013 -35.427 1.00 34.60 C ATOM 3 C VAL A -3 1.236 20.975 -34.460 1.00 32.74 C ATOM 4 O VAL A -3 1.234 22.209 -34.728 1.00 32.82 O ATOM 5 CB VAL A -3 -0.656 19.277 -34.736 1.00 36.04 C ATOM 6 HN3 VAL A -3 2.017 18.553 -35.315 1.00 0.00 H ATOM 7 HN2 VAL A -3 2.235 19.666 -36.580 1.00 0.00 H ATOM 8 HN1 VAL A -3 1.050 18.455 -36.709 1.00 0.00 H ATOM 9 N PRO A -2 1.769 20.474 -33.294 1.00 30.77 N ATOM 10 CA PRO A -2 2.428 21.412 -32.373 1.00 27.82 C ATOM 11 C PRO A -2 3.733 21.933 -32.908 1.00 24.88 C ATOM 12 O PRO A -2 4.418 21.242 -33.635 1.00 25.09 O ATOM 13 CB PRO A -2 2.777 20.563 -31.107 1.00 28.11 C ATOM 14 CG PRO A -2 1.963 19.309 -31.283 1.00 30.73 C ATOM 15 CD PRO A -2 1.888 19.103 -32.773 1.00 31.86 C ATOM 16 N ARG A -1 4.039 23.165 -32.558 1.00 21.83 N ATOM 17 CA ARG A -1 5.341 23.716 -32.934 1.00 20.03 C ATOM 18 C ARG A -1 6.414 23.157 -32.022 1.00 19.05 C ATOM 19 O ARG A -1 6.166 22.911 -30.842 1.00 18.69 O ATOM 20 CB ARG A -1 5.290 25.221 -32.871 1.00 19.52 C ATOM 21 CG ARG A -1 4.490 25.963 -33.934 1.00 20.48 C ATOM 22 CD ARG A -1 3.002 25.911 -33.843 1.00 21.83 C ATOM 23 NE ARG A -1 2.357 26.644 -34.909 1.00 22.00 N ATOM 24 CZ ARG A -1 1.813 27.862 -34.803 1.00 21.71 C ATOM 25 NH1 ARG A -1 1.814 28.529 -33.652 1.00 20.59 N ATOM 26 NH2 ARG A -1 1.257 28.405 -35.860 1.00 22.43 N ATOM 27 HE ARG A -1 2.312 26.184 -35.841 1.00 0.00 H ATOM 28 HH12 ARG A -1 1.384 29.474 -33.598 1.00 0.00 H ATOM 29 HH11 ARG A -1 2.245 28.105 -32.806 1.00 0.00 H ATOM 30 HH22 ARG A -1 0.830 29.351 -35.795 1.00 0.00 H ATOM 31 HH21 ARG A -1 1.244 27.890 -36.763 1.00 0.00 H ATOM 32 H ARG A -1 3.361 23.741 -32.019 1.00 0.00 H ATOM 33 N GLY A 0 7.624 22.910 -32.541 1.00 17.59 N ATOM 34 CA GLY A 0 8.713 22.420 -31.720 1.00 17.07 C ATOM 35 C GLY A 0 9.892 23.302 -31.616 1.00 16.11 C ATOM 36 O GLY A 0 10.847 23.031 -30.888 1.00 17.12 O ATOM 37 H GLY A 0 7.785 23.073 -33.555 1.00 0.00 H ATOM 38 N SER A 1 9.872 24.444 -32.291 1.00 14.95 N ATOM 39 CA SER A 1 10.952 25.355 -32.123 1.00 14.72 C ATOM 40 C SER A 1 10.538 26.811 -32.231 1.00 13.09 C ATOM 41 O SER A 1 9.533 27.116 -32.847 1.00 12.96 O ATOM 42 CB SER A 1 12.072 25.077 -33.067 1.00 16.60 C ATOM 43 OG SER A 1 11.666 25.318 -34.299 1.00 19.25 O ATOM 44 HG SER A 1 11.392 26.266 -34.375 1.00 0.00 H ATOM 45 H SER A 1 9.083 24.669 -32.930 1.00 0.00 H ATOM 46 N THR A 2 11.342 27.672 -31.637 1.00 11.48 N ATOM 47 CA THR A 2 11.055 29.106 -31.727 1.00 10.57 C ATOM 48 C THR A 2 11.061 29.632 -33.130 1.00 11.17 C ATOM 49 O THR A 2 10.394 30.604 -33.426 1.00 11.11 O ATOM 50 CB THR A 2 11.995 29.924 -30.806 1.00 9.54 C ATOM 51 OG1 THR A 2 13.393 29.633 -31.135 1.00 9.05 O ATOM 52 CG2 THR A 2 11.672 29.708 -29.373 1.00 9.19 C ATOM 53 HG1 THR A 2 13.566 29.877 -32.079 1.00 0.00 H ATOM 54 H THR A 2 12.173 27.336 -31.109 1.00 0.00 H ATOM 55 N SER A 3 11.808 28.968 -34.034 1.00 11.73 N ATOM 56 CA SER A 3 11.805 29.405 -35.417 1.00 12.77 C ATOM 57 C SER A 3 10.481 29.244 -36.110 1.00 13.34 C ATOM 58 O SER A 3 10.290 29.729 -37.222 1.00 14.49 O ATOM 59 CB SER A 3 12.953 28.677 -36.189 1.00 13.48 C ATOM 60 OG SER A 3 12.756 27.256 -36.224 1.00 14.39 O ATOM 61 HG SER A 3 12.732 26.904 -35.299 1.00 0.00 H ATOM 62 H SER A 3 12.381 28.150 -33.743 1.00 0.00 H ATOM 63 N GLU A 4 9.551 28.475 -35.531 1.00 12.91 N ATOM 64 CA GLU A 4 8.199 28.368 -36.046 1.00 13.70 C ATOM 65 C GLU A 4 7.259 29.429 -35.488 1.00 13.36 C ATOM 66 O GLU A 4 6.147 29.611 -36.056 1.00 14.22 O ATOM 67 CB GLU A 4 7.637 27.004 -35.671 1.00 14.34 C ATOM 68 CG GLU A 4 8.352 25.831 -36.293 1.00 15.17 C ATOM 69 CD GLU A 4 7.815 24.465 -35.811 1.00 16.13 C ATOM 70 OE1 GLU A 4 8.498 23.929 -34.950 1.00 17.53 O ATOM 71 OE2 GLU A 4 6.757 24.099 -36.310 1.00 18.28 O ATOM 72 H GLU A 4 9.807 27.934 -34.680 1.00 0.00 H ATOM 73 N VAL A 5 7.663 30.110 -34.429 1.00 12.39 N ATOM 74 CA VAL A 5 6.742 31.056 -33.777 1.00 12.53 C ATOM 75 C VAL A 5 7.199 32.509 -33.745 1.00 12.02 C ATOM 76 O VAL A 5 6.366 33.390 -33.502 1.00 12.37 O ATOM 77 CB VAL A 5 6.233 30.668 -32.378 1.00 12.64 C ATOM 78 CG1 VAL A 5 5.503 29.304 -32.493 1.00 13.66 C ATOM 79 CG2 VAL A 5 7.293 30.717 -31.368 1.00 11.78 C ATOM 80 H VAL A 5 8.626 29.978 -34.059 1.00 0.00 H ATOM 81 N ILE A 6 8.499 32.773 -33.977 1.00 11.36 N ATOM 82 CA ILE A 6 8.989 34.136 -33.906 1.00 11.25 C ATOM 83 C ILE A 6 9.125 34.737 -35.272 1.00 12.18 C ATOM 84 O ILE A 6 9.929 34.270 -36.108 1.00 11.90 O ATOM 85 CB ILE A 6 10.381 34.147 -33.186 1.00 10.43 C ATOM 86 CG1 ILE A 6 10.236 33.685 -31.735 1.00 9.93 C ATOM 87 CG2 ILE A 6 10.934 35.545 -33.237 1.00 10.53 C ATOM 88 CD1 ILE A 6 11.484 33.643 -30.903 1.00 9.26 C ATOM 89 H ILE A 6 9.153 31.998 -34.208 1.00 0.00 H ATOM 90 N GLU A 7 8.330 35.768 -35.570 1.00 13.05 N ATOM 91 CA GLU A 7 8.361 36.351 -36.914 1.00 14.71 C ATOM 92 C GLU A 7 9.671 37.103 -37.189 1.00 14.27 C ATOM 93 O GLU A 7 10.129 37.119 -38.329 1.00 14.09 O ATOM 94 CB GLU A 7 7.170 37.333 -37.043 1.00 16.95 C ATOM 95 CG GLU A 7 7.030 38.042 -38.371 1.00 19.77 C ATOM 96 CD GLU A 7 5.679 38.776 -38.494 1.00 22.94 C ATOM 97 OE1 GLU A 7 5.446 39.341 -39.548 1.00 28.82 O ATOM 98 OE2 GLU A 7 4.870 38.732 -37.548 1.00 25.54 O ATOM 99 H GLU A 7 7.689 36.157 -34.849 1.00 0.00 H ATOM 100 N ASP A 8 10.176 37.810 -36.174 1.00 14.09 N ATOM 101 CA ASP A 8 11.288 38.737 -36.368 1.00 14.87 C ATOM 102 C ASP A 8 12.072 38.758 -35.101 1.00 14.18 C ATOM 103 O ASP A 8 11.587 39.270 -34.056 1.00 14.21 O ATOM 104 CB ASP A 8 10.647 40.124 -36.673 1.00 16.18 C ATOM 105 CG ASP A 8 11.653 41.249 -36.834 1.00 17.12 C ATOM 106 OD1 ASP A 8 12.642 41.324 -36.127 1.00 17.25 O ATOM 107 OD2 ASP A 8 11.259 42.149 -37.624 1.00 20.14 O ATOM 108 H ASP A 8 9.768 37.698 -35.224 1.00 0.00 H ATOM 109 N GLU A 9 13.268 38.220 -35.133 1.00 13.70 N ATOM 110 CA GLU A 9 14.011 38.032 -33.888 1.00 14.19 C ATOM 111 C GLU A 9 14.318 39.377 -33.233 1.00 13.72 C ATOM 112 O GLU A 9 14.251 39.523 -32.003 1.00 12.74 O ATOM 113 CB GLU A 9 15.253 37.288 -34.137 1.00 15.54 C ATOM 114 CG GLU A 9 15.984 36.993 -32.883 1.00 16.91 C ATOM 115 CD GLU A 9 17.217 36.285 -33.148 1.00 18.80 C ATOM 116 OE1 GLU A 9 17.258 35.213 -33.807 1.00 21.11 O ATOM 117 OE2 GLU A 9 18.235 36.951 -32.695 1.00 21.14 O ATOM 118 H GLU A 9 13.686 37.929 -36.040 1.00 0.00 H ATOM 119 N LYS A 10 14.682 40.353 -34.052 1.00 14.47 N ATOM 120 CA LYS A 10 15.042 41.659 -33.417 1.00 15.04 C ATOM 121 C LYS A 10 13.858 42.231 -32.690 1.00 15.33 C ATOM 122 O LYS A 10 14.010 42.757 -31.556 1.00 15.91 O ATOM 123 CB LYS A 10 15.468 42.684 -34.490 1.00 16.36 C ATOM 124 CG LYS A 10 16.766 42.314 -35.054 1.00 17.88 C ATOM 125 H LYS A 10 14.716 40.218 -35.083 1.00 0.00 H ATOM 126 N GLN A 11 12.676 42.106 -33.245 1.00 15.56 N ATOM 127 CA GLN A 11 11.449 42.627 -32.604 1.00 16.39 C ATOM 128 C GLN A 11 11.070 41.792 -31.369 1.00 14.96 C ATOM 129 O GLN A 11 10.539 42.322 -30.389 1.00 14.60 O ATOM 130 CB GLN A 11 10.322 42.696 -33.564 1.00 19.20 C ATOM 131 CG GLN A 11 10.527 43.769 -34.598 1.00 22.78 C ATOM 132 CD GLN A 11 9.291 43.989 -35.408 1.00 27.88 C ATOM 133 OE1 GLN A 11 8.196 43.514 -35.048 1.00 35.03 O ATOM 134 NE2 GLN A 11 9.410 44.767 -36.466 1.00 31.55 N ATOM 135 HE22 GLN A 11 10.342 45.143 -36.733 1.00 0.00 H ATOM 136 HE21 GLN A 11 8.572 45.005 -37.034 1.00 0.00 H ATOM 137 H GLN A 11 12.599 41.626 -34.164 1.00 0.00 H ATOM 138 N PHE A 12 11.338 40.486 -31.426 1.00 13.40 N ATOM 139 CA PHE A 12 11.078 39.588 -30.281 1.00 12.49 C ATOM 140 C PHE A 12 11.842 40.129 -29.075 1.00 12.21 C ATOM 141 O PHE A 12 11.236 40.272 -27.973 1.00 12.35 O ATOM 142 CB PHE A 12 11.448 38.150 -30.626 1.00 11.90 C ATOM 143 CG PHE A 12 11.424 37.182 -29.484 1.00 11.00 C ATOM 144 CD1 PHE A 12 10.222 36.667 -29.043 1.00 11.13 C ATOM 145 CD2 PHE A 12 12.586 36.750 -28.864 1.00 10.48 C ATOM 146 CE1 PHE A 12 10.188 35.724 -28.050 1.00 10.52 C ATOM 147 CE2 PHE A 12 12.563 35.784 -27.879 1.00 9.93 C ATOM 148 CZ PHE A 12 11.329 35.306 -27.457 1.00 9.89 C ATOM 149 H PHE A 12 11.740 40.089 -32.299 1.00 0.00 H ATOM 150 N TYR A 13 13.118 40.480 -29.257 1.00 11.66 N ATOM 151 CA TYR A 13 13.902 40.994 -28.152 1.00 11.53 C ATOM 152 C TYR A 13 13.503 42.433 -27.818 1.00 12.41 C ATOM 153 O TYR A 13 13.373 42.802 -26.623 1.00 12.11 O ATOM 154 CB TYR A 13 15.389 40.886 -28.427 1.00 11.47 C ATOM 155 CG TYR A 13 15.890 39.466 -28.290 1.00 10.71 C ATOM 156 CD1 TYR A 13 15.934 38.832 -27.065 1.00 10.45 C ATOM 157 CD2 TYR A 13 16.336 38.739 -29.433 1.00 10.65 C ATOM 158 CE1 TYR A 13 16.401 37.550 -26.952 1.00 9.96 C ATOM 159 CE2 TYR A 13 16.827 37.434 -29.305 1.00 10.21 C ATOM 160 CZ TYR A 13 16.796 36.833 -28.048 1.00 9.66 C ATOM 161 OH TYR A 13 17.272 35.577 -27.936 1.00 9.69 O ATOM 162 HH TYR A 13 18.224 35.561 -28.206 1.00 0.00 H ATOM 163 H TYR A 13 13.551 40.384 -30.197 1.00 0.00 H ATOM 164 N SER A 14 13.343 43.254 -28.821 1.00 12.97 N ATOM 165 CA SER A 14 13.032 44.686 -28.527 1.00 14.19 C ATOM 166 C SER A 14 11.683 44.882 -27.859 1.00 14.34 C ATOM 167 O SER A 14 11.535 45.735 -26.898 1.00 14.43 O ATOM 168 CB SER A 14 13.194 45.530 -29.767 1.00 15.45 C ATOM 169 OG SER A 14 12.209 45.330 -30.713 1.00 16.52 O ATOM 170 HG SER A 14 11.327 45.551 -30.321 1.00 0.00 H ATOM 171 H SER A 14 13.430 42.919 -29.802 1.00 0.00 H ATOM 172 N LYS A 15 10.680 44.104 -28.242 1.00 14.00 N ATOM 173 CA LYS A 15 9.402 44.215 -27.579 1.00 14.66 C ATOM 174 C LYS A 15 9.485 43.773 -26.109 1.00 13.35 C ATOM 175 O LYS A 15 8.778 44.359 -25.260 1.00 13.50 O ATOM 176 CB LYS A 15 8.317 43.396 -28.289 1.00 15.65 C ATOM 177 CG LYS A 15 8.058 44.062 -29.638 1.00 17.36 C ATOM 178 CD LYS A 15 6.837 43.595 -30.427 1.00 18.82 C ATOM 179 CE LYS A 15 7.038 42.178 -30.866 1.00 18.82 C ATOM 180 NZ LYS A 15 5.973 41.777 -31.845 1.00 19.85 N ATOM 181 HZ1 LYS A 15 5.040 41.863 -31.395 1.00 0.00 H ATOM 182 HZ2 LYS A 15 6.017 42.399 -32.677 1.00 0.00 H ATOM 183 HZ3 LYS A 15 6.128 40.791 -32.139 1.00 0.00 H ATOM 184 H LYS A 15 10.813 43.419 -29.014 1.00 0.00 H ATOM 185 N ALA A 16 10.244 42.701 -25.832 1.00 11.95 N ATOM 186 CA ALA A 16 10.396 42.225 -24.438 1.00 11.36 C ATOM 187 C ALA A 16 11.055 43.307 -23.630 1.00 11.73 C ATOM 188 O ALA A 16 10.656 43.542 -22.478 1.00 11.36 O ATOM 189 CB ALA A 16 11.174 40.922 -24.391 1.00 10.67 C ATOM 190 H ALA A 16 10.730 42.200 -26.603 1.00 0.00 H ATOM 191 N LYS A 17 12.064 43.956 -24.192 1.00 12.24 N ATOM 192 CA LYS A 17 12.788 45.031 -23.397 1.00 13.16 C ATOM 193 C LYS A 17 11.830 46.154 -23.051 1.00 14.05 C ATOM 194 O LYS A 17 11.789 46.661 -21.902 1.00 13.84 O ATOM 195 CB LYS A 17 13.960 45.532 -24.170 1.00 14.68 C ATOM 196 CG LYS A 17 14.897 46.386 -23.353 1.00 16.53 C ATOM 197 CD LYS A 17 16.127 46.784 -24.124 1.00 18.52 C ATOM 198 CE LYS A 17 16.944 47.689 -23.181 1.00 20.76 C ATOM 199 NZ LYS A 17 18.017 48.278 -23.923 1.00 23.08 N ATOM 200 HZ1 LYS A 17 18.625 47.527 -24.306 1.00 0.00 H ATOM 201 HZ2 LYS A 17 17.627 48.843 -24.705 1.00 0.00 H ATOM 202 HZ3 LYS A 17 18.575 48.891 -23.295 1.00 0.00 H ATOM 203 H LYS A 17 12.357 43.733 -25.165 1.00 0.00 H ATOM 204 N THR A 18 11.055 46.579 -24.039 1.00 14.05 N ATOM 205 CA THR A 18 10.034 47.633 -23.807 1.00 15.17 C ATOM 206 C THR A 18 9.025 47.175 -22.752 1.00 14.86 C ATOM 207 O THR A 18 8.586 48.014 -21.898 1.00 15.36 O ATOM 208 CB THR A 18 9.310 47.969 -25.143 1.00 16.19 C ATOM 209 OG1 THR A 18 10.267 48.453 -26.070 1.00 16.67 O ATOM 210 CG2 THR A 18 8.156 48.973 -24.979 1.00 17.47 C ATOM 211 HG1 THR A 18 9.817 48.670 -26.924 1.00 0.00 H ATOM 212 H THR A 18 11.163 46.169 -24.989 1.00 0.00 H ATOM 213 N TYR A 19 8.553 45.934 -22.841 1.00 13.89 N ATOM 214 CA TYR A 19 7.574 45.400 -21.857 1.00 14.17 C ATOM 215 C TYR A 19 8.126 45.522 -20.453 1.00 13.75 C ATOM 216 O TYR A 19 7.492 46.128 -19.574 1.00 14.43 O ATOM 217 CB TYR A 19 7.220 43.977 -22.154 1.00 13.90 C ATOM 218 CG TYR A 19 6.360 43.333 -21.083 1.00 14.54 C ATOM 219 CD1 TYR A 19 4.950 43.470 -21.144 1.00 16.04 C ATOM 220 CD2 TYR A 19 6.899 42.591 -20.079 1.00 14.25 C ATOM 221 CE1 TYR A 19 4.159 42.886 -20.184 1.00 16.81 C ATOM 222 CE2 TYR A 19 6.068 42.019 -19.050 1.00 15.21 C ATOM 223 CZ TYR A 19 4.700 42.215 -19.163 1.00 16.50 C ATOM 224 OH TYR A 19 3.906 41.634 -18.225 1.00 19.62 O ATOM 225 HH TYR A 19 2.959 41.849 -18.417 1.00 0.00 H ATOM 226 H TYR A 19 8.877 45.323 -23.618 1.00 0.00 H ATOM 227 N TRP A 20 9.338 45.069 -20.227 1.00 12.55 N ATOM 228 CA TRP A 20 9.850 45.058 -18.830 1.00 12.49 C ATOM 229 C TRP A 20 10.197 46.444 -18.367 1.00 13.71 C ATOM 230 O TRP A 20 10.081 46.712 -17.161 1.00 13.67 O ATOM 231 CB TRP A 20 11.075 44.124 -18.696 1.00 11.48 C ATOM 232 CG TRP A 20 10.598 42.680 -18.738 1.00 11.01 C ATOM 233 CD1 TRP A 20 10.716 41.783 -19.768 1.00 10.79 C ATOM 234 CD2 TRP A 20 9.868 42.010 -17.712 1.00 11.00 C ATOM 235 NE1 TRP A 20 10.117 40.598 -19.415 1.00 10.58 N ATOM 236 CE2 TRP A 20 9.574 40.710 -18.170 1.00 10.62 C ATOM 237 CE3 TRP A 20 9.412 42.394 -16.454 1.00 11.73 C ATOM 238 CZ2 TRP A 20 8.839 39.796 -17.390 1.00 10.78 C ATOM 239 CZ3 TRP A 20 8.738 41.483 -15.679 1.00 11.56 C ATOM 240 CH2 TRP A 20 8.406 40.233 -16.153 1.00 11.35 C ATOM 241 HE1 TRP A 20 10.083 39.744 -20.008 1.00 0.00 H ATOM 242 H TRP A 20 9.929 44.724 -21.010 1.00 0.00 H ATOM 243 N LYS A 21 10.528 47.355 -19.267 1.00 14.52 N ATOM 244 CA LYS A 21 10.776 48.759 -18.888 1.00 16.32 C ATOM 245 C LYS A 21 9.542 49.416 -18.276 1.00 17.14 C ATOM 246 O LYS A 21 9.709 50.398 -17.516 1.00 19.25 O ATOM 247 CB LYS A 21 11.274 49.551 -20.100 1.00 17.20 C ATOM 248 CG LYS A 21 11.492 51.019 -19.934 1.00 19.05 C ATOM 249 CD LYS A 21 12.573 51.408 -18.952 1.00 19.67 C ATOM 250 CE LYS A 21 12.458 52.914 -18.759 1.00 21.64 C ATOM 251 NZ LYS A 21 13.511 53.362 -17.806 1.00 22.10 N ATOM 252 HZ1 LYS A 21 13.379 52.880 -16.894 1.00 0.00 H ATOM 253 HZ2 LYS A 21 14.448 53.128 -18.191 1.00 0.00 H ATOM 254 HZ3 LYS A 21 13.438 54.390 -17.669 1.00 0.00 H ATOM 255 H LYS A 21 10.615 47.075 -20.265 1.00 0.00 H ATOM 256 N GLN A 22 8.336 48.905 -18.548 1.00 17.07 N ATOM 257 CA GLN A 22 7.086 49.490 -18.038 1.00 18.73 C ATOM 258 C GLN A 22 6.414 48.662 -16.933 1.00 18.05 C ATOM 259 O GLN A 22 5.294 48.982 -16.514 1.00 19.48 O ATOM 260 CB GLN A 22 6.161 49.884 -19.163 1.00 20.27 C ATOM 261 CG GLN A 22 5.710 48.790 -20.110 1.00 20.63 C ATOM 262 CD GLN A 22 4.508 48.020 -19.575 1.00 21.56 C ATOM 263 OE1 GLN A 22 3.393 48.613 -19.424 1.00 24.12 O ATOM 264 NE2 GLN A 22 4.668 46.708 -19.405 1.00 21.36 N ATOM 265 HE22 GLN A 22 5.604 46.276 -19.542 1.00 0.00 H ATOM 266 HE21 GLN A 22 3.857 46.116 -19.135 1.00 0.00 H ATOM 267 H GLN A 22 8.279 48.056 -19.147 1.00 0.00 H ATOM 268 N ILE A 23 7.146 47.681 -16.391 1.00 16.66 N ATOM 269 CA ILE A 23 6.698 46.881 -15.253 1.00 16.25 C ATOM 270 C ILE A 23 7.227 47.532 -13.962 1.00 16.68 C ATOM 271 O ILE A 23 8.380 47.892 -13.869 1.00 16.18 O ATOM 272 CB ILE A 23 7.214 45.418 -15.388 1.00 15.20 C ATOM 273 CG1 ILE A 23 6.483 44.740 -16.572 1.00 15.18 C ATOM 274 CG2 ILE A 23 7.023 44.648 -14.110 1.00 15.04 C ATOM 275 CD1 ILE A 23 5.019 44.644 -16.429 1.00 15.97 C ATOM 276 H ILE A 23 8.080 47.478 -16.800 1.00 0.00 H ATOM 277 N PRO A 24 6.370 47.623 -12.927 1.00 17.27 N ATOM 278 CA PRO A 24 6.903 48.175 -11.682 1.00 17.68 C ATOM 279 C PRO A 24 7.957 47.309 -11.058 1.00 16.52 C ATOM 280 O PRO A 24 7.913 46.075 -11.124 1.00 15.29 O ATOM 281 CB PRO A 24 5.703 48.267 -10.776 1.00 18.88 C ATOM 282 CG PRO A 24 4.702 47.344 -11.324 1.00 18.95 C ATOM 283 CD PRO A 24 4.966 47.233 -12.830 1.00 18.13 C ATOM 284 N PRO A 25 8.940 47.946 -10.410 1.00 16.57 N ATOM 285 CA PRO A 25 10.086 47.244 -9.863 1.00 15.59 C ATOM 286 C PRO A 25 9.764 46.681 -8.476 1.00 15.65 C ATOM 287 O PRO A 25 10.309 47.115 -7.411 1.00 16.28 O ATOM 288 CB PRO A 25 11.138 48.308 -9.821 1.00 16.24 C ATOM 289 CG PRO A 25 10.362 49.497 -9.426 1.00 17.83 C ATOM 290 CD PRO A 25 9.150 49.401 -10.346 1.00 18.01 C ATOM 291 N THR A 26 8.829 45.752 -8.481 1.00 15.08 N ATOM 292 CA THR A 26 8.279 45.178 -7.288 1.00 15.38 C ATOM 293 C THR A 26 8.177 43.686 -7.422 1.00 14.43 C ATOM 294 O THR A 26 8.210 43.145 -8.538 1.00 13.52 O ATOM 295 CB THR A 26 6.868 45.703 -7.018 1.00 16.57 C ATOM 296 OG1 THR A 26 5.976 45.301 -8.078 1.00 16.38 O ATOM 297 CG2 THR A 26 6.811 47.231 -6.888 1.00 17.87 C ATOM 298 HG1 THR A 26 5.067 45.647 -7.892 1.00 0.00 H ATOM 299 H THR A 26 8.471 45.418 -9.399 1.00 0.00 H ATOM 300 N VAL A 27 7.998 42.981 -6.301 1.00 14.52 N ATOM 301 CA VAL A 27 7.789 41.521 -6.408 1.00 13.90 C ATOM 302 C VAL A 27 6.561 41.153 -7.263 1.00 14.00 C ATOM 303 O VAL A 27 6.599 40.216 -8.038 1.00 12.80 O ATOM 304 CB VAL A 27 7.716 40.891 -5.004 1.00 14.49 C ATOM 305 CG1 VAL A 27 7.228 39.466 -5.018 1.00 14.29 C ATOM 306 CG2 VAL A 27 9.114 40.911 -4.404 1.00 14.41 C ATOM 307 H VAL A 27 8.006 43.449 -5.373 1.00 0.00 H ATOM 308 N ASP A 28 5.474 41.878 -7.074 1.00 15.24 N ATOM 309 CA ASP A 28 4.304 41.618 -7.912 1.00 15.88 C ATOM 310 C ASP A 28 4.602 41.879 -9.390 1.00 15.26 C ATOM 311 O ASP A 28 4.059 41.184 -10.258 1.00 15.41 O ATOM 312 CB ASP A 28 3.085 42.395 -7.408 1.00 17.86 C ATOM 313 CG ASP A 28 1.807 41.824 -7.931 1.00 18.96 C ATOM 314 OD1 ASP A 28 1.518 40.629 -7.664 1.00 18.65 O ATOM 315 OD2 ASP A 28 1.077 42.566 -8.636 1.00 20.74 O ATOM 316 H ASP A 28 5.450 42.619 -6.344 1.00 0.00 H ATOM 317 N GLY A 29 5.448 42.857 -9.685 1.00 14.81 N ATOM 318 CA GLY A 29 5.899 43.058 -11.052 1.00 14.27 C ATOM 319 C GLY A 29 6.705 41.919 -11.612 1.00 13.09 C ATOM 320 O GLY A 29 6.447 41.471 -12.746 1.00 12.79 O ATOM 321 H GLY A 29 5.792 43.486 -8.931 1.00 0.00 H ATOM 322 N MET A 30 7.653 41.449 -10.824 1.00 12.47 N ATOM 323 CA MET A 30 8.470 40.300 -11.240 1.00 11.86 C ATOM 324 C MET A 30 7.568 39.096 -11.512 1.00 11.75 C ATOM 325 O MET A 30 7.802 38.294 -12.449 1.00 11.28 O ATOM 326 CB MET A 30 9.471 39.932 -10.117 1.00 11.83 C ATOM 327 CG MET A 30 10.414 41.018 -9.687 1.00 12.42 C ATOM 328 SD MET A 30 11.459 41.698 -10.977 1.00 12.35 S ATOM 329 CE MET A 30 10.520 43.087 -11.500 1.00 13.45 C ATOM 330 H MET A 30 7.824 41.895 -9.900 1.00 0.00 H ATOM 331 N LEU A 31 6.527 38.946 -10.672 1.00 12.16 N ATOM 332 CA LEU A 31 5.708 37.751 -10.744 1.00 12.01 C ATOM 333 C LEU A 31 4.400 37.972 -11.461 1.00 12.56 C ATOM 334 O LEU A 31 3.473 37.177 -11.341 1.00 12.79 O ATOM 335 CB LEU A 31 5.532 37.121 -9.356 1.00 12.55 C ATOM 336 CG LEU A 31 6.822 36.734 -8.684 1.00 12.32 C ATOM 337 CD1 LEU A 31 6.531 35.976 -7.373 1.00 12.88 C ATOM 338 CD2 LEU A 31 7.663 35.897 -9.592 1.00 11.74 C ATOM 339 H LEU A 31 6.310 39.685 -9.973 1.00 0.00 H ATOM 340 N GLY A 32 4.281 39.022 -12.254 1.00 12.51 N ATOM 341 CA GLY A 32 3.120 39.111 -13.146 1.00 13.29 C ATOM 342 C GLY A 32 1.761 39.129 -12.495 1.00 14.12 C ATOM 343 O GLY A 32 0.785 38.650 -13.042 1.00 14.85 O ATOM 344 H GLY A 32 4.999 39.774 -12.246 1.00 0.00 H ATOM 345 N GLY A 33 1.682 39.760 -11.330 1.00 14.33 N ATOM 346 CA GLY A 33 0.469 39.775 -10.547 1.00 15.35 C ATOM 347 C GLY A 33 0.314 38.629 -9.559 1.00 15.35 C ATOM 348 O GLY A 33 -0.758 38.606 -8.827 1.00 16.72 O ATOM 349 H GLY A 33 2.520 40.259 -10.970 1.00 0.00 H ATOM 350 N TYR A 34 1.276 37.742 -9.544 1.00 14.16 N ATOM 351 CA TYR A 34 1.293 36.614 -8.631 1.00 14.23 C ATOM 352 C TYR A 34 2.330 36.809 -7.545 1.00 13.77 C ATOM 353 O TYR A 34 2.881 35.820 -7.017 1.00 13.21 O ATOM 354 CB TYR A 34 1.498 35.290 -9.389 1.00 13.64 C ATOM 355 CG TYR A 34 0.310 34.931 -10.266 1.00 14.38 C ATOM 356 CD1 TYR A 34 -0.758 34.157 -9.805 1.00 15.45 C ATOM 357 CD2 TYR A 34 0.274 35.365 -11.602 1.00 14.50 C ATOM 358 CE1 TYR A 34 -1.843 33.855 -10.580 1.00 16.24 C ATOM 359 CE2 TYR A 34 -0.796 35.033 -12.404 1.00 15.25 C ATOM 360 CZ TYR A 34 -1.867 34.307 -11.898 1.00 16.11 C ATOM 361 OH TYR A 34 -2.957 33.982 -12.693 1.00 17.26 O ATOM 362 HH TYR A 34 -3.612 33.467 -12.158 1.00 0.00 H ATOM 363 H TYR A 34 2.063 37.850 -10.216 1.00 0.00 H ATOM 364 N GLY A 35 2.582 38.046 -7.110 1.00 14.28 N ATOM 365 CA GLY A 35 3.563 38.251 -6.060 1.00 14.12 C ATOM 366 C GLY A 35 3.304 37.404 -4.804 1.00 14.84 C ATOM 367 O GLY A 35 4.236 36.972 -4.145 1.00 14.34 O ATOM 368 H GLY A 35 2.078 38.858 -7.521 1.00 0.00 H ATOM 369 N HIS A 36 2.041 37.211 -4.524 1.00 15.82 N ATOM 370 CA HIS A 36 1.638 36.374 -3.377 1.00 16.71 C ATOM 371 C HIS A 36 2.179 34.941 -3.350 1.00 15.91 C ATOM 372 O HIS A 36 2.189 34.336 -2.254 1.00 16.29 O ATOM 373 CB HIS A 36 0.133 36.390 -3.208 1.00 18.62 C ATOM 374 CG HIS A 36 -0.610 35.727 -4.324 1.00 19.44 C ATOM 375 ND1 HIS A 36 -0.990 34.401 -4.293 1.00 20.21 N ATOM 376 CD2 HIS A 36 -1.039 36.219 -5.515 1.00 20.16 C ATOM 377 CE1 HIS A 36 -1.650 34.108 -5.399 1.00 20.53 C ATOM 378 NE2 HIS A 36 -1.664 35.181 -6.171 1.00 20.76 N ATOM 379 H HIS A 36 1.311 37.653 -5.118 1.00 0.00 H ATOM 380 N ILE A 37 2.542 34.358 -4.494 1.00 14.84 N ATOM 381 CA ILE A 37 3.117 33.002 -4.498 1.00 14.35 C ATOM 382 C ILE A 37 4.607 32.959 -4.193 1.00 13.28 C ATOM 383 O ILE A 37 5.213 31.874 -4.237 1.00 12.84 O ATOM 384 CB ILE A 37 2.884 32.246 -5.829 1.00 14.29 C ATOM 385 CG1 ILE A 37 3.802 32.729 -6.981 1.00 13.62 C ATOM 386 CG2 ILE A 37 1.424 32.322 -6.181 1.00 15.35 C ATOM 387 CD1 ILE A 37 3.798 31.855 -8.220 1.00 13.40 C ATOM 388 H ILE A 37 2.418 34.867 -5.393 1.00 0.00 H ATOM 389 N SER A 38 5.246 34.103 -3.878 1.00 12.79 N ATOM 390 CA SER A 38 6.687 34.130 -3.823 1.00 11.78 C ATOM 391 C SER A 38 7.235 33.171 -2.749 1.00 11.66 C ATOM 392 O SER A 38 8.273 32.556 -2.953 1.00 11.08 O ATOM 393 CB SER A 38 7.191 35.552 -3.526 1.00 12.09 C ATOM 394 OG SER A 38 8.608 35.604 -3.655 1.00 11.41 O ATOM 395 HG SER A 38 9.020 34.972 -3.014 1.00 0.00 H ATOM 396 H SER A 38 4.701 34.965 -3.675 1.00 0.00 H ATOM 397 N SER A 39 6.552 33.096 -1.593 1.00 12.35 N ATOM 398 CA SER A 39 7.073 32.301 -0.474 1.00 12.43 C ATOM 399 C SER A 39 6.988 30.796 -0.796 1.00 12.43 C ATOM 400 O SER A 39 7.938 29.999 -0.507 1.00 12.04 O ATOM 401 CB SER A 39 6.393 32.677 0.816 1.00 13.51 C ATOM 402 OG SER A 39 7.034 32.057 1.874 1.00 13.42 O ATOM 403 HG SER A 39 6.586 32.305 2.721 1.00 0.00 H ATOM 404 H SER A 39 5.650 33.604 -1.491 1.00 0.00 H ATOM 405 N ILE A 40 5.878 30.375 -1.409 1.00 12.74 N ATOM 406 CA ILE A 40 5.749 29.007 -1.882 1.00 12.90 C ATOM 407 C ILE A 40 6.906 28.656 -2.820 1.00 11.92 C ATOM 408 O ILE A 40 7.564 27.613 -2.694 1.00 11.82 O ATOM 409 CB ILE A 40 4.382 28.854 -2.604 1.00 13.63 C ATOM 410 CG1 ILE A 40 3.260 28.928 -1.633 1.00 14.90 C ATOM 411 CG2 ILE A 40 4.350 27.552 -3.427 1.00 13.51 C ATOM 412 CD1 ILE A 40 1.906 29.151 -2.249 1.00 15.61 C ATOM 413 H ILE A 40 5.091 31.040 -1.550 1.00 0.00 H ATOM 414 N ASP A 41 7.204 29.550 -3.776 1.00 11.22 N ATOM 415 CA ASP A 41 8.254 29.356 -4.737 1.00 10.53 C ATOM 416 C ASP A 41 9.593 29.244 -4.040 1.00 10.35 C ATOM 417 O ASP A 41 10.365 28.318 -4.308 1.00 10.12 O ATOM 418 CB ASP A 41 8.242 30.552 -5.713 1.00 10.24 C ATOM 419 CG ASP A 41 9.465 30.575 -6.576 1.00 9.51 C ATOM 420 OD1 ASP A 41 9.668 29.554 -7.339 1.00 9.56 O ATOM 421 OD2 ASP A 41 10.285 31.530 -6.459 1.00 9.48 O ATOM 422 H ASP A 41 6.647 30.427 -3.823 1.00 0.00 H ATOM 423 N ILE A 42 9.902 30.205 -3.177 1.00 10.45 N ATOM 424 CA ILE A 42 11.233 30.235 -2.552 1.00 10.41 C ATOM 425 C ILE A 42 11.440 28.986 -1.677 1.00 10.73 C ATOM 426 O ILE A 42 12.537 28.401 -1.675 1.00 10.68 O ATOM 427 CB ILE A 42 11.423 31.522 -1.728 1.00 10.97 C ATOM 428 CG1 ILE A 42 11.523 32.727 -2.665 1.00 11.01 C ATOM 429 CG2 ILE A 42 12.661 31.441 -0.832 1.00 11.06 C ATOM 430 CD1 ILE A 42 12.742 32.897 -3.472 1.00 10.67 C ATOM 431 H ILE A 42 9.202 30.937 -2.943 1.00 0.00 H ATOM 432 N ASN A 43 10.438 28.597 -0.900 1.00 11.29 N ATOM 433 CA ASN A 43 10.547 27.406 -0.020 1.00 11.93 C ATOM 434 C ASN A 43 10.874 26.179 -0.871 1.00 11.61 C ATOM 435 O ASN A 43 11.711 25.348 -0.478 1.00 11.74 O ATOM 436 CB ASN A 43 9.315 27.173 0.816 1.00 12.92 C ATOM 437 CG ASN A 43 9.270 28.085 2.042 1.00 13.67 C ATOM 438 OD1 ASN A 43 10.264 28.623 2.460 1.00 13.32 O ATOM 439 ND2 ASN A 43 8.118 28.181 2.649 1.00 14.79 N ATOM 440 HD22 ASN A 43 7.282 27.702 2.257 1.00 0.00 H ATOM 441 HD21 ASN A 43 8.036 28.736 3.524 1.00 0.00 H ATOM 442 H ASN A 43 9.552 29.141 -0.907 1.00 0.00 H ATOM 443 N SER A 44 10.189 26.046 -1.977 1.00 11.54 N ATOM 444 CA SER A 44 10.437 24.879 -2.845 1.00 11.49 C ATOM 445 C SER A 44 11.815 24.928 -3.500 1.00 10.80 C ATOM 446 O SER A 44 12.519 23.879 -3.550 1.00 10.89 O ATOM 447 CB SER A 44 9.376 24.722 -3.903 1.00 11.69 C ATOM 448 OG SER A 44 8.129 24.348 -3.343 1.00 12.84 O ATOM 449 HG SER A 44 7.833 25.045 -2.705 1.00 0.00 H ATOM 450 H SER A 44 9.477 26.756 -2.242 1.00 0.00 H ATOM 451 N SER A 45 12.225 26.074 -3.936 1.00 10.05 N ATOM 452 CA SER A 45 13.538 26.248 -4.541 1.00 9.54 C ATOM 453 C SER A 45 14.603 25.923 -3.522 1.00 9.79 C ATOM 454 O SER A 45 15.624 25.290 -3.840 1.00 9.86 O ATOM 455 CB SER A 45 13.721 27.698 -4.975 1.00 9.23 C ATOM 456 OG SER A 45 12.919 27.910 -6.147 1.00 9.19 O ATOM 457 HG SER A 45 13.021 28.847 -6.450 1.00 0.00 H ATOM 458 H SER A 45 11.597 26.898 -3.852 1.00 0.00 H ATOM 459 N ARG A 46 14.387 26.370 -2.278 1.00 10.13 N ATOM 460 CA ARG A 46 15.384 26.071 -1.256 1.00 10.78 C ATOM 461 C ARG A 46 15.565 24.556 -1.024 1.00 11.53 C ATOM 462 O ARG A 46 16.678 24.032 -0.885 1.00 11.30 O ATOM 463 CB ARG A 46 15.027 26.763 0.074 1.00 11.54 C ATOM 464 CG ARG A 46 16.061 26.584 1.180 1.00 12.13 C ATOM 465 CD ARG A 46 15.656 27.308 2.444 1.00 13.05 C ATOM 466 NE ARG A 46 15.636 28.744 2.205 1.00 12.79 N ATOM 467 CZ ARG A 46 14.593 29.574 2.292 1.00 13.13 C ATOM 468 NH1 ARG A 46 13.404 29.152 2.684 1.00 13.63 N ATOM 469 NH2 ARG A 46 14.799 30.841 1.967 1.00 12.68 N ATOM 470 HE ARG A 46 16.543 29.175 1.934 1.00 0.00 H ATOM 471 HH12 ARG A 46 12.609 29.820 2.743 1.00 0.00 H ATOM 472 HH11 ARG A 46 13.263 28.152 2.934 1.00 0.00 H ATOM 473 HH22 ARG A 46 14.017 31.525 2.019 1.00 0.00 H ATOM 474 HH21 ARG A 46 15.743 31.152 1.660 1.00 0.00 H ATOM 475 H ARG A 46 13.532 26.915 -2.047 1.00 0.00 H ATOM 476 N LYS A 47 14.456 23.864 -0.903 1.00 12.26 N ATOM 477 CA LYS A 47 14.542 22.434 -0.658 1.00 13.51 C ATOM 478 C LYS A 47 15.218 21.761 -1.875 1.00 13.02 C ATOM 479 O LYS A 47 15.978 20.759 -1.682 1.00 13.29 O ATOM 480 CB LYS A 47 13.134 21.866 -0.433 1.00 15.19 C ATOM 481 CG LYS A 47 13.030 20.374 -0.147 1.00 16.90 C ATOM 482 CD LYS A 47 11.591 19.894 0.183 1.00 19.02 C ATOM 483 H LYS A 47 13.530 24.332 -0.981 1.00 0.00 H ATOM 484 N PHE A 48 14.846 22.211 -3.056 1.00 12.12 N ATOM 485 CA PHE A 48 15.426 21.643 -4.289 1.00 12.00 C ATOM 486 C PHE A 48 16.955 21.821 -4.288 1.00 12.10 C ATOM 487 O PHE A 48 17.726 20.860 -4.543 1.00 12.23 O ATOM 488 CB PHE A 48 14.796 22.303 -5.499 1.00 11.44 C ATOM 489 CG PHE A 48 15.204 21.687 -6.854 1.00 11.18 C ATOM 490 CD1 PHE A 48 14.658 20.469 -7.252 1.00 12.09 C ATOM 491 CD2 PHE A 48 16.039 22.334 -7.710 1.00 10.68 C ATOM 492 CE1 PHE A 48 15.016 19.902 -8.486 1.00 11.86 C ATOM 493 CE2 PHE A 48 16.381 21.786 -8.928 1.00 10.47 C ATOM 494 CZ PHE A 48 15.854 20.584 -9.308 1.00 10.94 C ATOM 495 H PHE A 48 14.139 22.971 -3.120 1.00 0.00 H ATOM 496 N LEU A 49 17.410 23.019 -3.993 1.00 12.10 N ATOM 497 CA LEU A 49 18.841 23.334 -3.966 1.00 12.23 C ATOM 498 C LEU A 49 19.579 22.622 -2.889 1.00 13.51 C ATOM 499 O LEU A 49 20.720 22.133 -3.100 1.00 12.69 O ATOM 500 CB LEU A 49 19.001 24.831 -3.814 1.00 12.36 C ATOM 501 CG LEU A 49 20.408 25.359 -3.839 1.00 12.92 C ATOM 502 CD1 LEU A 49 21.113 24.911 -5.106 1.00 13.23 C ATOM 503 CD2 LEU A 49 20.309 26.874 -3.740 1.00 13.49 C ATOM 504 H LEU A 49 16.728 23.772 -3.770 1.00 0.00 H ATOM 505 N GLN A 50 18.960 22.461 -1.738 1.00 14.59 N ATOM 506 CA GLN A 50 19.673 21.826 -0.618 1.00 17.27 C ATOM 507 C GLN A 50 20.082 20.383 -0.856 1.00 18.14 C ATOM 508 O GLN A 50 21.063 19.936 -0.247 1.00 19.41 O ATOM 509 CB GLN A 50 18.798 21.914 0.648 1.00 19.76 C ATOM 510 CG GLN A 50 18.937 23.298 1.227 1.00 21.42 C ATOM 511 CD GLN A 50 17.939 23.536 2.299 1.00 24.99 C ATOM 512 OE1 GLN A 50 16.900 22.849 2.382 1.00 28.57 O ATOM 513 NE2 GLN A 50 18.276 24.415 3.198 1.00 27.96 N ATOM 514 HE22 GLN A 50 19.152 24.964 3.086 1.00 0.00 H ATOM 515 HE21 GLN A 50 17.669 24.568 4.029 1.00 0.00 H ATOM 516 H GLN A 50 17.977 22.779 -1.622 1.00 0.00 H ATOM 517 N ARG A 51 19.392 19.708 -1.735 1.00 19.29 N ATOM 518 CA ARG A 51 19.709 18.363 -2.225 1.00 19.77 C ATOM 519 C ARG A 51 21.260 18.343 -2.613 1.00 19.35 C ATOM 520 O ARG A 51 22.049 17.374 -2.335 1.00 21.27 O ATOM 521 CB ARG A 51 18.844 18.055 -3.489 1.00 20.71 C ATOM 522 CG ARG A 51 17.265 17.980 -3.436 1.00 21.65 C ATOM 523 CD ARG A 51 16.838 17.702 -4.861 1.00 22.30 C ATOM 524 NE ARG A 51 15.448 17.606 -5.206 1.00 23.74 N ATOM 525 CZ ARG A 51 14.990 16.691 -6.065 1.00 25.30 C ATOM 526 NH1 ARG A 51 13.735 16.654 -6.422 1.00 26.61 N ATOM 527 NH2 ARG A 51 15.794 15.783 -6.552 1.00 26.09 N ATOM 528 HE ARG A 51 14.775 18.271 -4.773 1.00 0.00 H ATOM 529 HH12 ARG A 51 13.406 15.930 -7.093 1.00 0.00 H ATOM 530 HH11 ARG A 51 13.064 17.348 -6.036 1.00 0.00 H ATOM 531 HH22 ARG A 51 15.433 15.073 -7.220 1.00 0.00 H ATOM 532 HH21 ARG A 51 16.795 15.771 -6.271 1.00 0.00 H ATOM 533 H ARG A 51 18.542 20.165 -2.122 1.00 0.00 H ATOM 534 N PHE A 52 21.673 19.380 -3.288 1.00 15.51 N ATOM 535 CA PHE A 52 23.022 19.448 -3.869 1.00 14.68 C ATOM 536 C PHE A 52 24.090 19.975 -2.979 1.00 15.44 C ATOM 537 O PHE A 52 25.248 19.927 -3.318 1.00 14.27 O ATOM 538 CB PHE A 52 22.957 20.253 -5.175 1.00 13.26 C ATOM 539 CG PHE A 52 21.957 19.657 -6.124 1.00 12.95 C ATOM 540 CD1 PHE A 52 22.257 18.511 -6.800 1.00 13.55 C ATOM 541 CD2 PHE A 52 20.709 20.211 -6.261 1.00 12.80 C ATOM 542 CE1 PHE A 52 21.273 17.896 -7.574 1.00 14.02 C ATOM 543 CE2 PHE A 52 19.755 19.648 -7.043 1.00 13.22 C ATOM 544 CZ PHE A 52 20.049 18.506 -7.699 1.00 13.70 C ATOM 545 H PHE A 52 21.027 20.185 -3.419 1.00 0.00 H ATOM 546 N LEU A 53 23.674 20.498 -1.810 1.00 17.10 N ATOM 547 CA LEU A 53 24.598 21.004 -0.806 1.00 18.96 C ATOM 548 C LEU A 53 25.044 20.045 0.246 1.00 19.87 C ATOM 549 O LEU A 53 25.845 20.468 1.156 1.00 22.33 O ATOM 550 CB LEU A 53 24.017 22.300 -0.179 1.00 19.30 C ATOM 551 CG LEU A 53 23.654 23.351 -1.196 1.00 18.38 C ATOM 552 CD1 LEU A 53 23.016 24.603 -0.564 1.00 19.09 C ATOM 553 CD2 LEU A 53 24.792 23.894 -2.027 1.00 19.14 C ATOM 554 H LEU A 53 22.653 20.542 -1.617 1.00 0.00 H ATOM 555 N ARG A 54 24.589 18.766 0.249 1.00 19.20 N ATOM 556 CA ARG A 54 24.985 17.752 1.192 1.00 19.99 C ATOM 557 C ARG A 54 26.478 17.463 1.086 1.00 18.84 C ATOM 558 O ARG A 54 27.034 17.517 -0.022 1.00 17.55 O ATOM 559 CB ARG A 54 24.203 16.426 0.995 1.00 22.46 C ATOM 560 CG ARG A 54 22.669 16.589 1.160 1.00 24.59 C ATOM 561 CD ARG A 54 21.998 15.232 1.072 1.00 26.82 C ATOM 562 NE ARG A 54 21.930 14.888 -0.346 1.00 27.05 N ATOM 563 CZ ARG A 54 21.551 13.688 -0.836 1.00 29.04 C ATOM 564 NH1 ARG A 54 21.106 12.742 -0.055 1.00 29.77 N ATOM 565 NH2 ARG A 54 21.551 13.489 -2.175 1.00 31.33 N ATOM 566 HE ARG A 54 22.194 15.624 -1.031 1.00 0.00 H ATOM 567 HH12 ARG A 54 20.820 11.827 -0.458 1.00 0.00 H ATOM 568 HH11 ARG A 54 21.037 12.903 0.970 1.00 0.00 H ATOM 569 HH22 ARG A 54 21.261 12.569 -2.564 1.00 0.00 H ATOM 570 HH21 ARG A 54 21.841 14.256 -2.815 1.00 0.00 H ATOM 571 H ARG A 54 23.903 18.498 -0.485 1.00 0.00 H ATOM 572 N GLU A 55 27.105 17.099 2.194 1.00 18.71 N ATOM 573 CA GLU A 55 28.519 16.708 2.145 1.00 18.88 C ATOM 574 C GLU A 55 28.652 15.464 1.281 1.00 18.63 C ATOM 575 O GLU A 55 27.806 14.563 1.365 1.00 19.31 O ATOM 576 CB GLU A 55 29.062 16.402 3.524 1.00 20.60 C ATOM 577 CG GLU A 55 28.945 17.580 4.482 1.00 21.24 C ATOM 578 CD GLU A 55 29.834 18.745 4.088 1.00 21.98 C ATOM 579 OE1 GLU A 55 29.327 19.893 4.172 1.00 24.43 O ATOM 580 OE2 GLU A 55 30.963 18.580 3.646 1.00 22.05 O ATOM 581 H GLU A 55 26.595 17.090 3.100 1.00 0.00 H ATOM 582 N GLY A 56 29.782 15.348 0.626 1.00 17.85 N ATOM 583 CA GLY A 56 30.082 14.170 -0.196 1.00 17.96 C ATOM 584 C GLY A 56 30.876 14.623 -1.395 1.00 17.20 C ATOM 585 O GLY A 56 31.164 15.784 -1.567 1.00 16.35 O ATOM 586 H GLY A 56 30.485 16.112 0.691 1.00 0.00 H ATOM 587 N PRO A 57 31.214 13.681 -2.280 1.00 17.41 N ATOM 588 CA PRO A 57 32.145 13.963 -3.382 1.00 17.37 C ATOM 589 C PRO A 57 31.691 14.933 -4.325 1.00 15.98 C ATOM 590 O PRO A 57 32.535 15.614 -4.986 1.00 16.40 O ATOM 591 CB PRO A 57 32.298 12.612 -4.135 1.00 18.26 C ATOM 592 CG PRO A 57 31.382 11.692 -3.467 1.00 19.06 C ATOM 593 CD PRO A 57 30.798 12.277 -2.192 1.00 18.61 C ATOM 594 N ASN A 58 30.381 15.094 -4.491 1.00 14.75 N ATOM 595 CA ASN A 58 29.856 15.997 -5.454 1.00 13.62 C ATOM 596 C ASN A 58 29.248 17.261 -4.924 1.00 12.56 C ATOM 597 O ASN A 58 28.509 17.981 -5.610 1.00 11.52 O ATOM 598 CB ASN A 58 28.819 15.259 -6.316 1.00 13.55 C ATOM 599 CG ASN A 58 29.446 14.034 -6.962 1.00 14.59 C ATOM 600 OD1 ASN A 58 30.437 14.158 -7.639 1.00 14.65 O ATOM 601 ND2 ASN A 58 28.963 12.894 -6.623 1.00 15.79 N ATOM 602 HD22 ASN A 58 28.105 12.846 -6.037 1.00 0.00 H ATOM 603 HD21 ASN A 58 29.430 12.018 -6.934 1.00 0.00 H ATOM 604 H ASN A 58 29.724 14.545 -3.901 1.00 0.00 H ATOM 605 N LYS A 59 29.523 17.516 -3.633 1.00 12.85 N ATOM 606 CA LYS A 59 28.891 18.689 -2.984 1.00 12.75 C ATOM 607 C LYS A 59 29.137 19.966 -3.763 1.00 11.71 C ATOM 608 O LYS A 59 30.262 20.317 -4.033 1.00 11.70 O ATOM 609 CB LYS A 59 29.467 18.828 -1.561 1.00 14.12 C ATOM 610 CG LYS A 59 28.919 20.066 -0.850 1.00 14.59 C ATOM 611 CD LYS A 59 29.557 20.275 0.506 1.00 16.31 C ATOM 612 CE LYS A 59 28.769 21.334 1.217 1.00 17.71 C ATOM 613 H LYS A 59 30.169 16.900 -3.098 1.00 0.00 H ATOM 614 N THR A 60 28.050 20.671 -4.044 1.00 10.89 N ATOM 615 CA THR A 60 28.110 21.998 -4.704 1.00 10.42 C ATOM 616 C THR A 60 28.595 22.986 -3.637 1.00 10.80 C ATOM 617 O THR A 60 28.152 22.959 -2.464 1.00 11.47 O ATOM 618 CB THR A 60 26.752 22.348 -5.270 1.00 9.87 C ATOM 619 OG1 THR A 60 26.462 21.409 -6.333 1.00 9.76 O ATOM 620 CG2 THR A 60 26.717 23.716 -5.848 1.00 9.35 C ATOM 621 HG1 THR A 60 27.157 21.482 -7.035 1.00 0.00 H ATOM 622 H THR A 60 27.120 20.279 -3.792 1.00 0.00 H ATOM 623 N GLY A 61 29.492 23.864 -4.066 1.00 11.01 N ATOM 624 CA GLY A 61 30.027 24.883 -3.154 1.00 11.75 C ATOM 625 C GLY A 61 29.058 26.001 -2.878 1.00 11.56 C ATOM 626 O GLY A 61 27.970 26.121 -3.444 1.00 11.12 O ATOM 627 H GLY A 61 29.818 23.831 -5.053 1.00 0.00 H ATOM 628 N THR A 62 29.547 26.878 -1.977 1.00 12.48 N ATOM 629 CA THR A 62 28.711 27.950 -1.484 1.00 12.73 C ATOM 630 C THR A 62 29.433 29.302 -1.544 1.00 12.71 C ATOM 631 O THR A 62 29.075 30.243 -0.759 1.00 12.82 O ATOM 632 CB THR A 62 28.219 27.670 -0.046 1.00 13.98 C ATOM 633 OG1 THR A 62 29.276 27.311 0.795 1.00 15.15 O ATOM 634 CG2 THR A 62 27.194 26.584 -0.032 1.00 14.76 C ATOM 635 HG1 THR A 62 29.936 28.048 0.827 1.00 0.00 H ATOM 636 H THR A 62 30.525 26.783 -1.637 1.00 0.00 H ATOM 637 N SER A 63 30.387 29.433 -2.446 1.00 12.36 N ATOM 638 CA SER A 63 31.174 30.667 -2.573 1.00 12.87 C ATOM 639 C SER A 63 30.465 31.734 -3.414 1.00 12.30 C ATOM 640 O SER A 63 30.520 32.909 -3.089 1.00 12.58 O ATOM 641 CB SER A 63 32.554 30.389 -3.165 1.00 13.31 C ATOM 642 OG SER A 63 33.370 29.802 -2.174 1.00 14.19 O ATOM 643 HG SER A 63 32.960 28.954 -1.870 1.00 0.00 H ATOM 644 H SER A 63 30.588 28.639 -3.086 1.00 0.00 H ATOM 645 N CYS A 64 29.836 31.352 -4.504 1.00 11.54 N ATOM 646 CA CYS A 64 29.288 32.347 -5.438 1.00 11.43 C ATOM 647 C CYS A 64 28.172 31.754 -6.287 1.00 10.18 C ATOM 648 O CYS A 64 28.281 30.645 -6.805 1.00 9.71 O ATOM 649 CB CYS A 64 30.361 32.896 -6.321 1.00 12.71 C ATOM 650 SG CYS A 64 29.928 34.492 -7.071 1.00 15.27 S ATOM 651 H CYS A 64 29.725 30.338 -4.707 1.00 0.00 H ATOM 652 N ALA A 65 27.079 32.501 -6.382 1.00 9.34 N ATOM 653 CA ALA A 65 26.003 32.147 -7.288 1.00 8.73 C ATOM 654 C ALA A 65 25.800 33.285 -8.290 1.00 8.63 C ATOM 655 O ALA A 65 26.056 34.464 -7.975 1.00 9.24 O ATOM 656 CB ALA A 65 24.738 31.922 -6.506 1.00 8.84 C ATOM 657 H ALA A 65 26.992 33.356 -5.796 1.00 0.00 H ATOM 658 N LEU A 66 25.166 32.945 -9.397 1.00 8.20 N ATOM 659 CA LEU A 66 24.770 33.909 -10.444 1.00 8.31 C ATOM 660 C LEU A 66 23.253 33.817 -10.600 1.00 7.92 C ATOM 661 O LEU A 66 22.741 32.704 -10.814 1.00 8.00 O ATOM 662 CB LEU A 66 25.399 33.589 -11.777 1.00 8.33 C ATOM 663 CG LEU A 66 24.936 34.418 -12.997 1.00 8.50 C ATOM 664 CD1 LEU A 66 25.348 35.860 -12.834 1.00 9.17 C ATOM 665 CD2 LEU A 66 25.520 33.792 -14.272 1.00 8.68 C ATOM 666 H LEU A 66 24.932 31.942 -9.540 1.00 0.00 H ATOM 667 N ASP A 67 22.557 34.935 -10.405 1.00 8.05 N ATOM 668 CA ASP A 67 21.087 35.024 -10.607 1.00 8.12 C ATOM 669 C ASP A 67 20.818 35.630 -11.945 1.00 7.81 C ATOM 670 O ASP A 67 21.100 36.810 -12.152 1.00 8.04 O ATOM 671 CB ASP A 67 20.508 35.821 -9.449 1.00 8.86 C ATOM 672 CG ASP A 67 19.004 35.809 -9.385 1.00 9.35 C ATOM 673 OD1 ASP A 67 18.369 35.245 -10.260 1.00 9.69 O ATOM 674 OD2 ASP A 67 18.423 36.413 -8.426 1.00 9.49 O ATOM 675 H ASP A 67 23.066 35.787 -10.096 1.00 0.00 H ATOM 676 N CYS A 68 20.226 34.832 -12.858 1.00 7.47 N ATOM 677 CA CYS A 68 20.041 35.247 -14.250 1.00 7.34 C ATOM 678 C CYS A 68 18.611 35.683 -14.488 1.00 7.40 C ATOM 679 O CYS A 68 17.655 34.995 -14.124 1.00 7.89 O ATOM 680 CB CYS A 68 20.334 34.094 -15.201 1.00 7.02 C ATOM 681 SG CYS A 68 22.032 33.484 -15.115 1.00 8.31 S ATOM 682 H CYS A 68 19.891 33.893 -12.564 1.00 0.00 H ATOM 683 N GLY A 69 18.440 36.807 -15.174 1.00 7.46 N ATOM 684 CA GLY A 69 17.135 37.482 -15.183 1.00 7.72 C ATOM 685 C GLY A 69 16.662 37.812 -13.797 1.00 8.06 C ATOM 686 O GLY A 69 15.496 37.618 -13.482 1.00 8.24 O ATOM 687 H GLY A 69 19.235 37.212 -15.708 1.00 0.00 H ATOM 688 N ALA A 70 17.578 38.312 -13.014 1.00 8.20 N ATOM 689 CA ALA A 70 17.341 38.489 -11.569 1.00 8.41 C ATOM 690 C ALA A 70 16.300 39.514 -11.206 1.00 8.80 C ATOM 691 O ALA A 70 15.788 39.483 -10.067 1.00 8.91 O ATOM 692 CB ALA A 70 18.638 38.847 -10.885 1.00 8.68 C ATOM 693 H ALA A 70 18.495 38.592 -13.417 1.00 0.00 H ATOM 694 N GLY A 71 16.001 40.426 -12.114 1.00 9.05 N ATOM 695 CA GLY A 71 15.099 41.523 -11.787 1.00 9.81 C ATOM 696 C GLY A 71 15.574 42.311 -10.591 1.00 10.38 C ATOM 697 O GLY A 71 16.766 42.627 -10.467 1.00 10.68 O ATOM 698 H GLY A 71 16.412 40.361 -13.067 1.00 0.00 H ATOM 699 N ILE A 72 14.648 42.607 -9.668 1.00 10.68 N ATOM 700 CA ILE A 72 15.016 43.364 -8.465 1.00 11.65 C ATOM 701 C ILE A 72 15.725 42.537 -7.408 1.00 11.25 C ATOM 702 O ILE A 72 16.129 43.097 -6.382 1.00 12.30 O ATOM 703 CB ILE A 72 13.757 44.056 -7.832 1.00 12.58 C ATOM 704 CG1 ILE A 72 12.732 43.019 -7.300 1.00 12.76 C ATOM 705 CG2 ILE A 72 13.073 45.003 -8.795 1.00 13.03 C ATOM 706 CD1 ILE A 72 11.665 43.649 -6.452 1.00 14.03 C ATOM 707 H ILE A 72 13.664 42.299 -9.805 1.00 0.00 H ATOM 708 N GLY A 73 15.854 41.257 -7.630 1.00 10.55 N ATOM 709 CA GLY A 73 16.584 40.380 -6.720 1.00 10.52 C ATOM 710 C GLY A 73 15.715 39.615 -5.732 1.00 10.62 C ATOM 711 O GLY A 73 16.180 39.267 -4.644 1.00 11.12 O ATOM 712 H GLY A 73 15.422 40.849 -8.484 1.00 0.00 H ATOM 713 N ARG A 74 14.481 39.310 -6.090 1.00 10.45 N ATOM 714 CA ARG A 74 13.604 38.493 -5.254 1.00 10.56 C ATOM 715 C ARG A 74 14.292 37.174 -4.814 1.00 10.31 C ATOM 716 O ARG A 74 14.241 36.789 -3.586 1.00 10.88 O ATOM 717 CB ARG A 74 12.307 38.205 -6.013 1.00 10.32 C ATOM 718 CG ARG A 74 11.230 37.425 -5.276 1.00 10.65 C ATOM 719 CD ARG A 74 10.095 37.121 -6.180 1.00 10.58 C ATOM 720 NE ARG A 74 10.463 36.107 -7.165 1.00 9.89 N ATOM 721 CZ ARG A 74 10.429 34.782 -6.985 1.00 9.75 C ATOM 722 NH1 ARG A 74 9.941 34.250 -5.870 1.00 10.23 N ATOM 723 NH2 ARG A 74 10.847 33.978 -7.968 1.00 9.01 N ATOM 724 HE ARG A 74 10.782 36.448 -8.095 1.00 0.00 H ATOM 725 HH12 ARG A 74 9.924 33.217 -5.751 1.00 0.00 H ATOM 726 HH11 ARG A 74 9.576 34.866 -5.116 1.00 0.00 H ATOM 727 HH22 ARG A 74 10.826 32.946 -7.840 1.00 0.00 H ATOM 728 HH21 ARG A 74 11.194 34.384 -8.860 1.00 0.00 H ATOM 729 H ARG A 74 14.121 39.664 -6.999 1.00 0.00 H ATOM 730 N ILE A 75 14.927 36.502 -5.783 1.00 9.72 N ATOM 731 CA ILE A 75 15.517 35.193 -5.496 1.00 9.40 C ATOM 732 C ILE A 75 16.858 35.430 -4.802 1.00 9.44 C ATOM 733 O ILE A 75 17.233 34.731 -3.863 1.00 9.78 O ATOM 734 CB ILE A 75 15.666 34.390 -6.806 1.00 9.20 C ATOM 735 CG1 ILE A 75 14.319 34.166 -7.440 1.00 9.28 C ATOM 736 CG2 ILE A 75 16.326 33.046 -6.522 1.00 9.17 C ATOM 737 CD1 ILE A 75 14.388 33.642 -8.831 1.00 9.08 C ATOM 738 H ILE A 75 15.001 36.909 -6.737 1.00 0.00 H ATOM 739 N THR A 76 17.612 36.444 -5.273 1.00 9.41 N ATOM 740 CA THR A 76 18.880 36.798 -4.629 1.00 9.98 C ATOM 741 C THR A 76 18.651 37.086 -3.155 1.00 10.76 C ATOM 742 O THR A 76 19.424 36.616 -2.306 1.00 10.58 O ATOM 743 CB THR A 76 19.578 37.963 -5.389 1.00 10.09 C ATOM 744 OG1 THR A 76 20.101 37.428 -6.615 1.00 10.59 O ATOM 745 CG2 THR A 76 20.718 38.576 -4.621 1.00 10.76 C ATOM 746 HG1 THR A 76 19.359 37.058 -7.155 1.00 0.00 H ATOM 747 H THR A 76 17.290 36.981 -6.103 1.00 0.00 H ATOM 748 N LYS A 77 17.583 37.813 -2.811 1.00 11.57 N ATOM 749 CA LYS A 77 17.373 38.182 -1.416 1.00 12.94 C ATOM 750 C LYS A 77 17.052 36.976 -0.534 1.00 13.24 C ATOM 751 O LYS A 77 17.624 36.839 0.566 1.00 13.18 O ATOM 752 CB LYS A 77 16.227 39.212 -1.296 1.00 13.93 C ATOM 753 CG LYS A 77 16.097 39.834 0.107 1.00 15.61 C ATOM 754 CD LYS A 77 14.978 40.839 0.148 1.00 16.87 C ATOM 755 CE LYS A 77 14.907 41.502 1.475 1.00 18.74 C ATOM 756 NZ LYS A 77 16.034 42.416 1.789 1.00 19.77 N ATOM 757 HZ1 LYS A 77 16.926 41.882 1.772 1.00 0.00 H ATOM 758 HZ2 LYS A 77 16.070 43.176 1.080 1.00 0.00 H ATOM 759 HZ3 LYS A 77 15.892 42.827 2.734 1.00 0.00 H ATOM 760 H LYS A 77 16.903 38.115 -3.537 1.00 0.00 H ATOM 761 N ARG A 78 16.081 36.202 -0.985 1.00 13.30 N ATOM 762 CA ARG A 78 15.456 35.242 -0.065 1.00 14.97 C ATOM 763 C ARG A 78 16.068 33.840 -0.176 1.00 13.57 C ATOM 764 O ARG A 78 16.030 33.120 0.826 1.00 14.45 O ATOM 765 CB ARG A 78 13.973 35.105 -0.350 1.00 17.35 C ATOM 766 CG ARG A 78 13.154 36.361 -0.387 1.00 20.40 C ATOM 767 CD ARG A 78 13.182 36.930 0.899 1.00 23.01 C ATOM 768 NE ARG A 78 12.384 38.165 0.970 1.00 28.02 N ATOM 769 CZ ARG A 78 12.429 38.956 2.032 1.00 30.48 C ATOM 770 NH1 ARG A 78 13.204 38.693 3.094 1.00 29.87 N ATOM 771 NH2 ARG A 78 11.678 40.079 2.006 1.00 33.99 N ATOM 772 HE ARG A 78 11.772 38.422 0.170 1.00 0.00 H ATOM 773 HH12 ARG A 78 13.209 39.341 3.907 1.00 0.00 H ATOM 774 HH11 ARG A 78 13.800 37.841 3.104 1.00 0.00 H ATOM 775 HH22 ARG A 78 11.684 40.728 2.819 1.00 0.00 H ATOM 776 HH21 ARG A 78 11.094 40.295 1.173 1.00 0.00 H ATOM 777 H ARG A 78 15.765 36.271 -1.973 1.00 0.00 H ATOM 778 N LEU A 79 16.612 33.483 -1.335 1.00 12.16 N ATOM 779 CA LEU A 79 17.193 32.165 -1.541 1.00 11.27 C ATOM 780 C LEU A 79 18.703 32.191 -1.524 1.00 10.94 C ATOM 781 O LEU A 79 19.339 31.435 -0.802 1.00 11.54 O ATOM 782 CB LEU A 79 16.743 31.570 -2.897 1.00 10.72 C ATOM 783 CG LEU A 79 17.306 30.185 -3.198 1.00 10.51 C ATOM 784 CD1 LEU A 79 16.795 29.130 -2.264 1.00 11.34 C ATOM 785 CD2 LEU A 79 16.966 29.873 -4.658 1.00 10.16 C ATOM 786 H LEU A 79 16.623 34.167 -2.119 1.00 0.00 H ATOM 787 N LEU A 80 19.281 33.050 -2.355 1.00 10.30 N ATOM 788 CA LEU A 80 20.737 32.916 -2.642 1.00 9.88 C ATOM 789 C LEU A 80 21.683 33.602 -1.649 1.00 10.38 C ATOM 790 O LEU A 80 22.649 33.000 -1.181 1.00 10.43 O ATOM 791 CB LEU A 80 21.019 33.396 -4.043 1.00 9.72 C ATOM 792 CG LEU A 80 20.333 32.654 -5.207 1.00 9.20 C ATOM 793 CD1 LEU A 80 20.549 33.329 -6.537 1.00 9.25 C ATOM 794 CD2 LEU A 80 20.716 31.220 -5.309 1.00 9.20 C ATOM 795 H LEU A 80 18.724 33.807 -2.800 1.00 0.00 H ATOM 796 N LEU A 81 21.412 34.843 -1.301 1.00 10.55 N ATOM 797 CA LEU A 81 22.301 35.532 -0.330 1.00 11.35 C ATOM 798 C LEU A 81 22.447 34.794 0.955 1.00 12.23 C ATOM 799 O LEU A 81 23.553 34.796 1.553 1.00 12.37 O ATOM 800 CB LEU A 81 21.874 37.008 -0.121 1.00 11.95 C ATOM 801 CG LEU A 81 22.303 37.968 -1.248 1.00 11.81 C ATOM 802 CD1 LEU A 81 21.570 39.274 -1.085 1.00 12.39 C ATOM 803 CD2 LEU A 81 23.778 38.158 -1.253 1.00 12.15 C ATOM 804 H LEU A 81 20.587 35.334 -1.700 1.00 0.00 H ATOM 805 N PRO A 82 21.362 34.147 1.463 1.00 12.51 N ATOM 806 CA PRO A 82 21.573 33.410 2.689 1.00 13.48 C ATOM 807 C PRO A 82 22.504 32.211 2.620 1.00 13.51 C ATOM 808 O PRO A 82 23.014 31.752 3.676 1.00 14.42 O ATOM 809 CB PRO A 82 20.130 32.973 3.102 1.00 13.60 C ATOM 810 CG PRO A 82 19.280 34.005 2.470 1.00 13.42 C ATOM 811 CD PRO A 82 19.928 34.330 1.163 1.00 12.49 C ATOM 812 N LEU A 83 22.687 31.666 1.433 1.00 13.03 N ATOM 813 CA LEU A 83 23.398 30.434 1.231 1.00 13.29 C ATOM 814 C LEU A 83 24.773 30.602 0.597 1.00 12.91 C ATOM 815 O LEU A 83 25.596 29.670 0.695 1.00 13.77 O ATOM 816 CB LEU A 83 22.543 29.518 0.339 1.00 13.50 C ATOM 817 CG LEU A 83 21.293 28.912 0.982 1.00 14.44 C ATOM 818 CD1 LEU A 83 20.444 28.204 -0.045 1.00 14.30 C ATOM 819 CD2 LEU A 83 21.696 27.988 2.119 1.00 16.38 C ATOM 820 H LEU A 83 22.297 32.153 0.601 1.00 0.00 H ATOM 821 N PHE A 84 24.987 31.710 -0.118 1.00 11.68 N ATOM 822 CA PHE A 84 26.238 31.919 -0.890 1.00 11.38 C ATOM 823 C PHE A 84 26.971 33.156 -0.412 1.00 11.67 C ATOM 824 O PHE A 84 26.342 34.142 -0.067 1.00 12.00 O ATOM 825 CB PHE A 84 25.935 32.065 -2.386 1.00 10.65 C ATOM 826 CG PHE A 84 25.414 30.780 -2.952 1.00 10.28 C ATOM 827 CD1 PHE A 84 26.238 29.827 -3.441 1.00 10.32 C ATOM 828 CD2 PHE A 84 24.050 30.512 -2.893 1.00 10.34 C ATOM 829 CE1 PHE A 84 25.714 28.592 -3.827 1.00 10.28 C ATOM 830 CE2 PHE A 84 23.515 29.336 -3.355 1.00 10.18 C ATOM 831 CZ PHE A 84 24.356 28.360 -3.766 1.00 10.10 C ATOM 832 H PHE A 84 24.255 32.449 -0.134 1.00 0.00 H ATOM 833 N ARG A 85 28.284 33.070 -0.298 1.00 11.70 N ATOM 834 CA ARG A 85 29.057 34.173 0.254 1.00 12.41 C ATOM 835 C ARG A 85 28.864 35.440 -0.572 1.00 12.25 C ATOM 836 O ARG A 85 28.794 36.552 -0.013 1.00 12.64 O ATOM 837 CB ARG A 85 30.556 33.815 0.326 1.00 13.00 C ATOM 838 CG ARG A 85 31.450 34.911 0.894 1.00 13.93 C ATOM 839 H ARG A 85 28.771 32.204 -0.606 1.00 0.00 H ATOM 840 N GLU A 86 28.862 35.263 -1.884 1.00 11.64 N ATOM 841 CA GLU A 86 28.620 36.377 -2.812 1.00 11.79 C ATOM 842 C GLU A 86 27.634 35.948 -3.873 1.00 10.87 C ATOM 843 O GLU A 86 27.532 34.761 -4.200 1.00 10.36 O ATOM 844 CB GLU A 86 29.912 36.841 -3.505 1.00 12.77 C ATOM 845 CG GLU A 86 30.956 37.310 -2.528 1.00 14.44 C ATOM 846 CD GLU A 86 32.200 37.798 -3.258 1.00 15.72 C ATOM 847 OE1 GLU A 86 33.102 36.976 -3.515 1.00 17.13 O ATOM 848 OE2 GLU A 86 32.296 39.004 -3.522 1.00 16.43 O ATOM 849 H GLU A 86 29.036 34.312 -2.268 1.00 0.00 H ATOM 850 N VAL A 87 26.979 36.900 -4.479 1.00 10.39 N ATOM 851 CA VAL A 87 26.056 36.649 -5.600 1.00 9.60 C ATOM 852 C VAL A 87 26.268 37.696 -6.664 1.00 9.66 C ATOM 853 O VAL A 87 26.426 38.868 -6.322 1.00 10.10 O ATOM 854 CB VAL A 87 24.551 36.694 -5.140 1.00 9.52 C ATOM 855 CG1 VAL A 87 23.594 36.496 -6.278 1.00 9.12 C ATOM 856 CG2 VAL A 87 24.307 35.653 -4.047 1.00 9.70 C ATOM 857 H VAL A 87 27.114 37.879 -4.157 1.00 0.00 H ATOM 858 N ASP A 88 26.259 37.275 -7.906 1.00 8.99 N ATOM 859 CA ASP A 88 26.191 38.218 -9.029 1.00 9.17 C ATOM 860 C ASP A 88 24.789 38.203 -9.606 1.00 8.96 C ATOM 861 O ASP A 88 24.155 37.117 -9.600 1.00 8.69 O ATOM 862 CB ASP A 88 27.216 37.826 -10.127 1.00 9.14 C ATOM 863 CG ASP A 88 28.637 38.112 -9.773 1.00 10.02 C ATOM 864 OD1 ASP A 88 28.940 38.796 -8.796 1.00 10.62 O ATOM 865 OD2 ASP A 88 29.485 37.665 -10.621 1.00 10.32 O ATOM 866 H ASP A 88 26.301 36.254 -8.099 1.00 0.00 H ATOM 867 N MET A 89 24.334 39.327 -10.144 1.00 9.31 N ATOM 868 CA MET A 89 23.021 39.444 -10.775 1.00 9.33 C ATOM 869 C MET A 89 23.217 39.868 -12.220 1.00 9.43 C ATOM 870 O MET A 89 24.055 40.721 -12.480 1.00 9.84 O ATOM 871 CB MET A 89 22.095 40.451 -10.043 1.00 10.34 C ATOM 872 CG MET A 89 21.754 39.992 -8.646 1.00 10.99 C ATOM 873 SD MET A 89 21.018 41.338 -7.661 1.00 13.09 S ATOM 874 CE MET A 89 19.433 41.550 -8.487 1.00 13.10 C ATOM 875 H MET A 89 24.944 40.169 -10.115 1.00 0.00 H ATOM 876 N VAL A 90 22.375 39.321 -13.121 1.00 8.66 N ATOM 877 CA VAL A 90 22.341 39.793 -14.487 1.00 8.68 C ATOM 878 C VAL A 90 20.907 39.977 -14.919 1.00 8.34 C ATOM 879 O VAL A 90 20.062 39.097 -14.696 1.00 8.05 O ATOM 880 CB VAL A 90 23.159 38.898 -15.465 1.00 8.66 C ATOM 881 CG1 VAL A 90 22.784 37.455 -15.477 1.00 8.41 C ATOM 882 CG2 VAL A 90 23.152 39.498 -16.885 1.00 8.92 C ATOM 883 H VAL A 90 21.742 38.549 -12.829 1.00 0.00 H ATOM 884 N ASP A 91 20.613 41.120 -15.526 1.00 8.78 N ATOM 885 CA ASP A 91 19.268 41.420 -15.999 1.00 8.69 C ATOM 886 C ASP A 91 19.349 42.467 -17.070 1.00 9.17 C ATOM 887 O ASP A 91 20.200 43.395 -17.035 1.00 9.51 O ATOM 888 CB ASP A 91 18.386 41.958 -14.835 1.00 9.01 C ATOM 889 CG ASP A 91 16.891 41.824 -15.136 1.00 9.09 C ATOM 890 OD1 ASP A 91 16.321 42.783 -15.738 1.00 9.50 O ATOM 891 OD2 ASP A 91 16.364 40.740 -14.805 1.00 8.79 O ATOM 892 H ASP A 91 21.366 41.823 -15.668 1.00 0.00 H ATOM 893 N ILE A 92 18.400 42.434 -18.001 1.00 9.36 N ATOM 894 CA ILE A 92 18.365 43.411 -19.050 1.00 10.44 C ATOM 895 C ILE A 92 17.840 44.794 -18.643 1.00 10.84 C ATOM 896 O ILE A 92 18.103 45.764 -19.338 1.00 11.13 O ATOM 897 CB ILE A 92 17.573 42.878 -20.281 1.00 11.10 C ATOM 898 CG1 ILE A 92 18.060 43.530 -21.553 1.00 12.78 C ATOM 899 CG2 ILE A 92 16.085 42.977 -20.048 1.00 11.11 C ATOM 900 CD1 ILE A 92 17.518 42.809 -22.796 1.00 13.60 C ATOM 901 H ILE A 92 17.674 41.690 -17.968 1.00 0.00 H ATOM 902 N THR A 93 17.103 44.882 -17.522 1.00 10.69 N ATOM 903 CA THR A 93 16.358 46.080 -17.187 1.00 11.54 C ATOM 904 C THR A 93 17.079 46.867 -16.115 1.00 12.56 C ATOM 905 O THR A 93 17.090 46.486 -14.940 1.00 12.18 O ATOM 906 CB THR A 93 14.923 45.710 -16.759 1.00 11.42 C ATOM 907 OG1 THR A 93 14.267 45.009 -17.837 1.00 10.76 O ATOM 908 CG2 THR A 93 14.151 46.958 -16.457 1.00 12.40 C ATOM 909 HG1 THR A 93 14.234 45.592 -18.637 1.00 0.00 H ATOM 910 H THR A 93 17.066 44.067 -16.877 1.00 0.00 H ATOM 911 N GLU A 94 17.731 47.932 -16.514 1.00 13.95 N ATOM 912 CA GLU A 94 18.560 48.731 -15.603 1.00 15.44 C ATOM 913 C GLU A 94 17.759 49.178 -14.386 1.00 15.73 C ATOM 914 O GLU A 94 18.310 49.091 -13.275 1.00 14.93 O ATOM 915 CB GLU A 94 19.119 49.955 -16.352 1.00 18.48 C ATOM 916 CG GLU A 94 20.114 50.775 -15.518 1.00 22.48 C ATOM 917 CD GLU A 94 20.573 52.006 -16.314 1.00 27.32 C ATOM 918 OE1 GLU A 94 20.357 52.120 -17.555 1.00 32.02 O ATOM 919 OE2 GLU A 94 21.116 52.932 -15.726 1.00 33.59 O ATOM 920 H GLU A 94 17.659 48.221 -17.510 1.00 0.00 H ATOM 921 N ASP A 95 16.519 49.606 -14.590 1.00 15.75 N ATOM 922 CA ASP A 95 15.703 50.087 -13.447 1.00 17.03 C ATOM 923 C ASP A 95 15.531 49.050 -12.348 1.00 15.43 C ATOM 924 O ASP A 95 15.439 49.391 -11.149 1.00 15.60 O ATOM 925 CB ASP A 95 14.327 50.587 -13.911 1.00 18.63 C ATOM 926 CG ASP A 95 14.373 51.895 -14.667 1.00 21.69 C ATOM 927 OD1 ASP A 95 15.412 52.632 -14.673 1.00 23.88 O ATOM 928 OD2 ASP A 95 13.295 52.282 -15.215 1.00 23.54 O ATOM 929 H ASP A 95 16.119 49.604 -15.550 1.00 0.00 H ATOM 930 N PHE A 96 15.516 47.769 -12.724 1.00 13.90 N ATOM 931 CA PHE A 96 15.363 46.705 -11.716 1.00 12.99 C ATOM 932 C PHE A 96 16.646 46.545 -10.900 1.00 13.07 C ATOM 933 O PHE A 96 16.605 46.312 -9.695 1.00 13.06 O ATOM 934 CB PHE A 96 14.933 45.382 -12.336 1.00 11.88 C ATOM 935 CG PHE A 96 13.599 45.405 -13.024 1.00 11.81 C ATOM 936 CD1 PHE A 96 12.616 46.353 -12.754 1.00 12.59 C ATOM 937 CD2 PHE A 96 13.287 44.395 -13.939 1.00 10.96 C ATOM 938 CE1 PHE A 96 11.379 46.316 -13.401 1.00 12.81 C ATOM 939 CE2 PHE A 96 12.050 44.386 -14.592 1.00 11.34 C ATOM 940 CZ PHE A 96 11.102 45.294 -14.297 1.00 12.10 C ATOM 941 H PHE A 96 15.612 47.522 -13.730 1.00 0.00 H ATOM 942 N LEU A 97 17.798 46.613 -11.578 1.00 13.21 N ATOM 943 CA LEU A 97 19.080 46.507 -10.888 1.00 13.65 C ATOM 944 C LEU A 97 19.281 47.721 -9.950 1.00 14.66 C ATOM 945 O LEU A 97 19.885 47.557 -8.869 1.00 14.81 O ATOM 946 CB LEU A 97 20.280 46.321 -11.835 1.00 13.99 C ATOM 947 CG LEU A 97 20.141 45.050 -12.663 1.00 13.65 C ATOM 948 CD1 LEU A 97 21.213 45.036 -13.744 1.00 14.48 C ATOM 949 CD2 LEU A 97 20.190 43.772 -11.888 1.00 13.34 C ATOM 950 H LEU A 97 17.780 46.743 -12.610 1.00 0.00 H ATOM 951 N VAL A 98 18.840 48.897 -10.352 1.00 15.29 N ATOM 952 CA VAL A 98 18.899 50.067 -9.459 1.00 16.68 C ATOM 953 C VAL A 98 17.990 49.800 -8.245 1.00 16.91 C ATOM 954 O VAL A 98 18.396 50.026 -7.103 1.00 17.46 O ATOM 955 CB VAL A 98 18.465 51.306 -10.190 1.00 17.73 C ATOM 956 CG1 VAL A 98 18.340 52.494 -9.236 1.00 19.14 C ATOM 957 CG2 VAL A 98 19.464 51.642 -11.295 1.00 18.00 C ATOM 958 H VAL A 98 18.447 48.999 -11.309 1.00 0.00 H ATOM 959 N GLN A 99 16.758 49.339 -8.496 1.00 16.29 N ATOM 960 CA GLN A 99 15.867 49.093 -7.369 1.00 17.01 C ATOM 961 C GLN A 99 16.455 48.027 -6.438 1.00 16.03 C ATOM 962 O GLN A 99 16.282 48.107 -5.219 1.00 16.57 O ATOM 963 CB GLN A 99 14.491 48.672 -7.802 1.00 17.43 C ATOM 964 CG GLN A 99 13.487 48.631 -6.652 1.00 18.96 C ATOM 965 CD GLN A 99 13.204 49.991 -6.096 1.00 21.58 C ATOM 966 OE1 GLN A 99 13.152 51.008 -6.831 1.00 24.70 O ATOM 967 NE2 GLN A 99 12.962 50.050 -4.840 1.00 23.25 N ATOM 968 HE22 GLN A 99 13.014 49.189 -4.259 1.00 0.00 H ATOM 969 HE21 GLN A 99 12.714 50.959 -4.400 1.00 0.00 H ATOM 970 H GLN A 99 16.445 49.161 -9.471 1.00 0.00 H ATOM 971 N ALA A 100 17.145 47.030 -6.999 1.00 14.81 N ATOM 972 CA ALA A 100 17.749 45.953 -6.197 1.00 14.51 C ATOM 973 C ALA A 100 18.621 46.468 -5.076 1.00 15.56 C ATOM 974 O ALA A 100 18.677 45.908 -3.999 1.00 15.36 O ATOM 975 CB ALA A 100 18.572 45.003 -7.061 1.00 13.33 C ATOM 976 H ALA A 100 17.259 47.014 -8.033 1.00 0.00 H ATOM 977 N LYS A 101 19.285 47.580 -5.316 1.00 16.92 N ATOM 978 CA LYS A 101 20.197 48.076 -4.305 1.00 18.53 C ATOM 979 C LYS A 101 19.387 48.458 -3.045 1.00 19.36 C ATOM 980 O LYS A 101 19.859 48.238 -1.880 1.00 20.49 O ATOM 981 CB LYS A 101 21.053 49.242 -4.851 1.00 20.33 C ATOM 982 CG LYS A 101 21.901 48.837 -6.090 1.00 21.04 C ATOM 983 H LYS A 101 19.157 48.091 -6.213 1.00 0.00 H ATOM 984 N THR A 102 18.168 48.954 -3.243 1.00 18.94 N ATOM 985 CA THR A 102 17.274 49.265 -2.146 1.00 20.08 C ATOM 986 C THR A 102 16.617 47.966 -1.596 1.00 19.18 C ATOM 987 O THR A 102 16.615 47.716 -0.362 1.00 19.48 O ATOM 988 CB THR A 102 16.245 50.329 -2.581 1.00 21.11 C ATOM 989 OG1 THR A 102 16.928 51.571 -2.776 1.00 21.96 O ATOM 990 CG2 THR A 102 15.217 50.571 -1.457 1.00 22.43 C ATOM 991 HG1 THR A 102 17.617 51.461 -3.478 1.00 0.00 H ATOM 992 H THR A 102 17.846 49.124 -4.217 1.00 0.00 H ATOM 993 N TYR A 103 16.044 47.188 -2.489 1.00 17.95 N ATOM 994 CA TYR A 103 15.294 45.988 -2.131 1.00 17.74 C ATOM 995 C TYR A 103 16.133 45.045 -1.287 1.00 17.73 C ATOM 996 O TYR A 103 15.639 44.411 -0.307 1.00 17.33 O ATOM 997 CB TYR A 103 14.785 45.294 -3.397 1.00 17.36 C ATOM 998 CG TYR A 103 14.053 44.012 -3.177 1.00 17.05 C ATOM 999 CD1 TYR A 103 12.789 44.018 -2.563 1.00 18.47 C ATOM 1000 CD2 TYR A 103 14.592 42.829 -3.472 1.00 16.63 C ATOM 1001 CE1 TYR A 103 12.128 42.843 -2.302 1.00 18.53 C ATOM 1002 CE2 TYR A 103 13.905 41.652 -3.248 1.00 16.69 C ATOM 1003 CZ TYR A 103 12.678 41.692 -2.622 1.00 17.96 C ATOM 1004 OH TYR A 103 12.051 40.486 -2.368 1.00 19.88 O ATOM 1005 HH TYR A 103 11.185 40.654 -1.919 1.00 0.00 H ATOM 1006 H TYR A 103 16.129 47.439 -3.495 1.00 0.00 H ATOM 1007 N LEU A 104 17.407 44.898 -1.671 1.00 17.14 N ATOM 1008 CA LEU A 104 18.257 43.910 -1.012 1.00 17.06 C ATOM 1009 C LEU A 104 18.741 44.353 0.369 1.00 18.57 C ATOM 1010 O LEU A 104 19.241 43.490 1.125 1.00 18.79 O ATOM 1011 CB LEU A 104 19.453 43.531 -1.870 1.00 16.50 C ATOM 1012 CG LEU A 104 19.079 42.904 -3.164 1.00 16.20 C ATOM 1013 CD1 LEU A 104 20.336 42.693 -3.983 1.00 16.18 C ATOM 1014 CD2 LEU A 104 18.406 41.588 -2.915 1.00 15.97 C ATOM 1015 H LEU A 104 17.791 45.487 -2.438 1.00 0.00 H ATOM 1016 N GLY A 105 18.705 45.646 0.665 1.00 19.50 N ATOM 1017 CA GLY A 105 19.143 46.130 1.995 1.00 21.32 C ATOM 1018 C GLY A 105 20.595 45.812 2.298 1.00 21.78 C ATOM 1019 O GLY A 105 21.453 45.726 1.417 1.00 20.81 O ATOM 1020 H GLY A 105 18.366 46.327 -0.044 1.00 0.00 H ATOM 1021 N GLU A 106 20.892 45.646 3.587 1.00 22.98 N ATOM 1022 CA GLU A 106 22.234 45.453 4.038 1.00 24.41 C ATOM 1023 C GLU A 106 22.901 44.191 3.469 1.00 22.01 C ATOM 1024 O GLU A 106 24.071 44.213 3.127 1.00 21.19 O ATOM 1025 CB GLU A 106 22.215 45.323 5.579 1.00 27.25 C ATOM 1026 CG GLU A 106 23.604 45.206 6.211 1.00 30.82 C ATOM 1027 CD GLU A 106 24.426 46.508 6.150 1.00 34.47 C ATOM 1028 OE1 GLU A 106 23.927 47.606 5.710 1.00 37.72 O ATOM 1029 OE2 GLU A 106 25.616 46.439 6.580 1.00 40.41 O ATOM 1030 H GLU A 106 20.122 45.657 4.287 1.00 0.00 H ATOM 1031 N GLU A 107 22.146 43.107 3.374 1.00 20.64 N ATOM 1032 CA GLU A 107 22.710 41.875 2.831 1.00 19.73 C ATOM 1033 C GLU A 107 23.123 42.077 1.360 1.00 17.75 C ATOM 1034 O GLU A 107 23.986 41.352 0.844 1.00 16.61 O ATOM 1035 CB GLU A 107 21.742 40.696 2.945 1.00 19.91 C ATOM 1036 CG GLU A 107 21.476 40.334 4.401 1.00 22.30 C ATOM 1037 CD GLU A 107 22.698 39.746 5.087 1.00 23.21 C ATOM 1038 OE1 GLU A 107 23.053 38.565 4.806 1.00 23.40 O ATOM 1039 OE2 GLU A 107 23.289 40.458 5.957 1.00 26.35 O ATOM 1040 H GLU A 107 21.154 43.133 3.685 1.00 0.00 H ATOM 1041 N GLY A 108 22.458 42.995 0.654 1.00 17.21 N ATOM 1042 CA GLY A 108 22.852 43.330 -0.702 1.00 16.33 C ATOM 1043 C GLY A 108 24.288 43.837 -0.891 1.00 16.39 C ATOM 1044 O GLY A 108 24.783 43.819 -2.035 1.00 15.68 O ATOM 1045 H GLY A 108 21.643 43.478 1.083 1.00 0.00 H ATOM 1046 N LYS A 109 24.953 44.190 0.200 1.00 16.97 N ATOM 1047 CA LYS A 109 26.343 44.565 0.119 1.00 17.44 C ATOM 1048 C LYS A 109 27.184 43.342 -0.328 1.00 16.71 C ATOM 1049 O LYS A 109 28.309 43.522 -0.825 1.00 17.53 O ATOM 1050 CB LYS A 109 26.793 45.196 1.413 1.00 18.75 C ATOM 1051 CG LYS A 109 26.147 46.562 1.648 1.00 19.55 C ATOM 1052 H LYS A 109 24.469 44.197 1.120 1.00 0.00 H ATOM 1053 N ARG A 110 26.631 42.125 -0.238 1.00 15.26 N ATOM 1054 CA ARG A 110 27.367 40.917 -0.736 1.00 14.35 C ATOM 1055 C ARG A 110 27.044 40.575 -2.205 1.00 13.42 C ATOM 1056 O ARG A 110 27.581 39.589 -2.744 1.00 12.93 O ATOM 1057 CB ARG A 110 27.167 39.708 0.194 1.00 14.23 C ATOM 1058 CG ARG A 110 27.827 39.958 1.533 1.00 15.23 C ATOM 1059 CD ARG A 110 27.751 38.754 2.479 1.00 15.32 C ATOM 1060 NE ARG A 110 26.389 38.419 2.890 1.00 15.05 N ATOM 1061 CZ ARG A 110 25.669 37.414 2.376 1.00 14.34 C ATOM 1062 NH1 ARG A 110 26.131 36.608 1.420 1.00 13.43 N ATOM 1063 NH2 ARG A 110 24.434 37.208 2.850 1.00 14.40 N ATOM 1064 HE ARG A 110 25.949 39.001 3.632 1.00 0.00 H ATOM 1065 HH12 ARG A 110 25.533 35.841 1.053 1.00 0.00 H ATOM 1066 HH11 ARG A 110 27.090 36.747 1.041 1.00 0.00 H ATOM 1067 HH22 ARG A 110 23.853 36.434 2.469 1.00 0.00 H ATOM 1068 HH21 ARG A 110 24.056 37.822 3.600 1.00 0.00 H ATOM 1069 H ARG A 110 25.685 42.017 0.180 1.00 0.00 H ATOM 1070 N VAL A 111 26.191 41.358 -2.835 1.00 13.17 N ATOM 1071 CA VAL A 111 26.074 41.287 -4.319 1.00 12.70 C ATOM 1072 C VAL A 111 27.319 41.943 -4.900 1.00 13.18 C ATOM 1073 O VAL A 111 27.682 43.086 -4.495 1.00 14.46 O ATOM 1074 CB VAL A 111 24.796 41.910 -4.872 1.00 12.77 C ATOM 1075 CG1 VAL A 111 24.849 41.939 -6.394 1.00 12.54 C ATOM 1076 CG2 VAL A 111 23.584 41.132 -4.358 1.00 12.61 C ATOM 1077 H VAL A 111 25.601 42.024 -2.297 1.00 0.00 H ATOM 1078 N ARG A 112 28.036 41.219 -5.729 1.00 12.57 N ATOM 1079 CA ARG A 112 29.319 41.644 -6.209 1.00 13.54 C ATOM 1080 C ARG A 112 29.033 42.403 -7.528 1.00 13.19 C ATOM 1081 O ARG A 112 29.043 43.663 -7.528 1.00 14.38 O ATOM 1082 CB ARG A 112 30.219 40.440 -6.364 1.00 13.56 C ATOM 1083 CG ARG A 112 31.562 40.735 -6.954 1.00 14.56 C ATOM 1084 CD ARG A 112 32.351 39.442 -7.111 1.00 14.65 C ATOM 1085 NE ARG A 112 31.782 38.474 -7.989 1.00 14.08 N ATOM 1086 CZ ARG A 112 32.383 37.356 -8.367 1.00 14.67 C ATOM 1087 NH1 ARG A 112 33.538 37.018 -7.744 1.00 16.69 N ATOM 1088 NH2 ARG A 112 31.878 36.611 -9.295 1.00 14.38 N ATOM 1089 HE ARG A 112 30.828 38.659 -8.359 1.00 0.00 H ATOM 1090 HH12 ARG A 112 34.039 36.147 -8.014 1.00 0.00 H ATOM 1091 HH11 ARG A 112 33.924 37.629 -6.996 1.00 0.00 H ATOM 1092 HH22 ARG A 112 32.362 35.736 -9.580 1.00 0.00 H ATOM 1093 HH21 ARG A 112 30.987 36.887 -9.756 1.00 0.00 H ATOM 1094 H ARG A 112 27.659 40.304 -6.049 1.00 0.00 H ATOM 1095 N ASN A 113 28.782 41.683 -8.608 1.00 12.34 N ATOM 1096 CA ASN A 113 28.533 42.307 -9.909 1.00 12.22 C ATOM 1097 C ASN A 113 27.024 42.421 -10.168 1.00 11.74 C ATOM 1098 O ASN A 113 26.303 41.420 -10.067 1.00 10.72 O ATOM 1099 CB ASN A 113 29.166 41.468 -11.019 1.00 11.99 C ATOM 1100 CG ASN A 113 30.678 41.246 -10.834 1.00 12.90 C ATOM 1101 OD1 ASN A 113 31.229 40.085 -10.856 1.00 14.24 O ATOM 1102 ND2 ASN A 113 31.360 42.305 -10.784 1.00 13.35 N ATOM 1103 HD22 ASN A 113 30.884 43.230 -10.767 1.00 0.00 H ATOM 1104 HD21 ASN A 113 32.398 42.254 -10.759 1.00 0.00 H ATOM 1105 H ASN A 113 28.761 40.646 -8.532 1.00 0.00 H ATOM 1106 N TYR A 114 26.646 43.623 -10.629 1.00 12.52 N ATOM 1107 CA TYR A 114 25.330 43.846 -11.213 1.00 12.55 C ATOM 1108 C TYR A 114 25.538 44.061 -12.715 1.00 12.26 C ATOM 1109 O TYR A 114 26.044 45.115 -13.135 1.00 13.85 O ATOM 1110 CB TYR A 114 24.675 45.103 -10.610 1.00 13.81 C ATOM 1111 CG TYR A 114 24.314 45.082 -9.158 1.00 14.88 C ATOM 1112 CD1 TYR A 114 25.220 45.510 -8.187 1.00 16.35 C ATOM 1113 CD2 TYR A 114 23.050 44.733 -8.748 1.00 15.37 C ATOM 1114 CE1 TYR A 114 24.826 45.563 -6.827 1.00 17.56 C ATOM 1115 CE2 TYR A 114 22.682 44.782 -7.428 1.00 16.58 C ATOM 1116 CZ TYR A 114 23.523 45.223 -6.505 1.00 17.26 C ATOM 1117 OH TYR A 114 23.123 45.219 -5.172 1.00 20.42 O ATOM 1118 HH TYR A 114 23.855 45.575 -4.608 1.00 0.00 H ATOM 1119 H TYR A 114 27.312 44.419 -10.568 1.00 0.00 H ATOM 1120 N PHE A 115 25.249 43.058 -13.493 1.00 11.37 N ATOM 1121 CA PHE A 115 25.451 43.106 -14.934 1.00 11.01 C ATOM 1122 C PHE A 115 24.136 43.486 -15.603 1.00 11.01 C ATOM 1123 O PHE A 115 23.132 42.782 -15.447 1.00 10.49 O ATOM 1124 CB PHE A 115 25.859 41.741 -15.439 1.00 10.31 C ATOM 1125 CG PHE A 115 27.218 41.244 -14.968 1.00 10.35 C ATOM 1126 CD1 PHE A 115 28.378 41.804 -15.466 1.00 11.19 C ATOM 1127 CD2 PHE A 115 27.314 40.130 -14.150 1.00 9.99 C ATOM 1128 CE1 PHE A 115 29.628 41.345 -15.094 1.00 11.46 C ATOM 1129 CE2 PHE A 115 28.559 39.656 -13.794 1.00 10.41 C ATOM 1130 CZ PHE A 115 29.704 40.235 -14.280 1.00 11.11 C ATOM 1131 H PHE A 115 24.860 42.191 -13.070 1.00 0.00 H ATOM 1132 N CYS A 116 24.169 44.560 -16.359 1.00 11.80 N ATOM 1133 CA CYS A 116 22.980 45.003 -17.084 1.00 12.47 C ATOM 1134 C CYS A 116 23.198 44.618 -18.561 1.00 12.48 C ATOM 1135 O CYS A 116 23.834 45.364 -19.306 1.00 13.45 O ATOM 1136 CB CYS A 116 22.689 46.422 -16.885 1.00 13.72 C ATOM 1137 SG CYS A 116 21.127 46.935 -17.711 1.00 14.85 S ATOM 1138 H CYS A 116 25.053 45.102 -16.443 1.00 0.00 H ATOM 1139 N CYS A 117 22.612 43.523 -18.986 1.00 12.12 N ATOM 1140 CA CYS A 117 22.990 42.847 -20.269 1.00 12.79 C ATOM 1141 C CYS A 117 21.791 41.877 -20.532 1.00 11.27 C ATOM 1142 O CYS A 117 21.250 41.295 -19.576 1.00 11.11 O ATOM 1143 CB CYS A 117 24.266 41.819 -20.022 1.00 13.55 C ATOM 1144 SG CYS A 117 25.003 41.525 -21.512 1.00 18.29 S ATOM 1145 H CYS A 117 21.854 43.107 -18.408 1.00 0.00 H ATOM 1146 N GLY A 118 21.445 41.667 -21.791 1.00 10.73 N ATOM 1147 CA GLY A 118 20.648 40.505 -22.106 1.00 9.73 C ATOM 1148 C GLY A 118 21.418 39.228 -21.969 1.00 9.13 C ATOM 1149 O GLY A 118 22.619 39.207 -22.221 1.00 9.33 O ATOM 1150 H GLY A 118 21.741 42.326 -22.539 1.00 0.00 H ATOM 1151 N LEU A 119 20.781 38.126 -21.588 1.00 8.33 N ATOM 1152 CA LEU A 119 21.483 36.843 -21.439 1.00 8.00 C ATOM 1153 C LEU A 119 22.129 36.439 -22.742 1.00 8.24 C ATOM 1154 O LEU A 119 23.224 35.881 -22.781 1.00 7.90 O ATOM 1155 CB LEU A 119 20.607 35.733 -20.955 1.00 7.68 C ATOM 1156 CG LEU A 119 19.892 35.928 -19.605 1.00 7.89 C ATOM 1157 CD1 LEU A 119 19.122 34.731 -19.200 1.00 7.86 C ATOM 1158 CD2 LEU A 119 20.841 36.362 -18.510 1.00 8.01 C ATOM 1159 H LEU A 119 19.761 38.172 -21.390 1.00 0.00 H ATOM 1160 N GLN A 120 21.439 36.790 -23.838 1.00 8.56 N ATOM 1161 CA GLN A 120 21.963 36.476 -25.167 1.00 9.41 C ATOM 1162 C GLN A 120 23.271 37.130 -25.498 1.00 10.04 C ATOM 1163 O GLN A 120 23.974 36.671 -26.437 1.00 10.53 O ATOM 1164 CB GLN A 120 20.888 36.764 -26.235 1.00 9.60 C ATOM 1165 CG GLN A 120 20.562 38.180 -26.530 1.00 10.40 C ATOM 1166 CD GLN A 120 19.602 38.833 -25.577 1.00 10.45 C ATOM 1167 OE1 GLN A 120 19.286 38.322 -24.510 1.00 9.53 O ATOM 1168 NE2 GLN A 120 19.079 39.991 -26.021 1.00 12.23 N ATOM 1169 HE22 GLN A 120 19.383 40.382 -26.936 1.00 0.00 H ATOM 1170 HE21 GLN A 120 18.371 40.495 -25.449 1.00 0.00 H ATOM 1171 H GLN A 120 20.530 37.286 -23.742 1.00 0.00 H ATOM 1172 N ASP A 121 23.617 38.192 -24.775 1.00 9.79 N ATOM 1173 CA ASP A 121 24.849 38.924 -24.910 1.00 10.70 C ATOM 1174 C ASP A 121 25.840 38.740 -23.739 1.00 9.95 C ATOM 1175 O ASP A 121 26.876 39.424 -23.720 1.00 10.05 O ATOM 1176 CB ASP A 121 24.542 40.399 -25.100 1.00 12.06 C ATOM 1177 CG ASP A 121 23.831 40.679 -26.387 1.00 13.39 C ATOM 1178 OD1 ASP A 121 24.227 40.130 -27.445 1.00 14.94 O ATOM 1179 OD2 ASP A 121 22.869 41.464 -26.366 1.00 15.13 O ATOM 1180 H ASP A 121 22.943 38.520 -24.054 1.00 0.00 H ATOM 1181 N PHE A 122 25.546 37.854 -22.827 1.00 8.87 N ATOM 1182 CA PHE A 122 26.330 37.739 -21.571 1.00 9.00 C ATOM 1183 C PHE A 122 27.187 36.480 -21.567 1.00 8.81 C ATOM 1184 O PHE A 122 26.679 35.391 -21.895 1.00 8.54 O ATOM 1185 CB PHE A 122 25.351 37.660 -20.384 1.00 9.03 C ATOM 1186 CG PHE A 122 26.033 37.620 -19.013 1.00 9.49 C ATOM 1187 CD1 PHE A 122 26.866 38.641 -18.640 1.00 11.05 C ATOM 1188 CD2 PHE A 122 25.787 36.626 -18.137 1.00 9.75 C ATOM 1189 CE1 PHE A 122 27.462 38.625 -17.413 1.00 11.16 C ATOM 1190 CE2 PHE A 122 26.434 36.584 -16.906 1.00 10.30 C ATOM 1191 CZ PHE A 122 27.236 37.593 -16.592 1.00 10.92 C ATOM 1192 H PHE A 122 24.743 37.212 -22.984 1.00 0.00 H ATOM 1193 N THR A 123 28.477 36.675 -21.295 1.00 9.00 N ATOM 1194 CA THR A 123 29.433 35.548 -21.160 1.00 9.05 C ATOM 1195 C THR A 123 30.013 35.529 -19.740 1.00 9.35 C ATOM 1196 O THR A 123 30.951 36.260 -19.500 1.00 9.81 O ATOM 1197 CB THR A 123 30.530 35.663 -22.177 1.00 9.68 C ATOM 1198 OG1 THR A 123 29.955 35.751 -23.518 1.00 9.67 O ATOM 1199 CG2 THR A 123 31.423 34.439 -22.102 1.00 10.10 C ATOM 1200 HG1 THR A 123 29.371 36.549 -23.574 1.00 0.00 H ATOM 1201 H THR A 123 28.825 37.648 -21.174 1.00 0.00 H ATOM 1202 N PRO A 124 29.422 34.675 -18.904 1.00 9.35 N ATOM 1203 CA PRO A 124 29.912 34.654 -17.490 1.00 10.11 C ATOM 1204 C PRO A 124 31.351 34.166 -17.450 1.00 10.64 C ATOM 1205 O PRO A 124 31.844 33.405 -18.315 1.00 11.15 O ATOM 1206 CB PRO A 124 28.952 33.726 -16.815 1.00 9.63 C ATOM 1207 CG PRO A 124 28.345 32.922 -17.830 1.00 9.67 C ATOM 1208 CD PRO A 124 28.279 33.762 -19.073 1.00 9.36 C ATOM 1209 N GLU A 125 32.067 34.693 -16.447 1.00 10.84 N ATOM 1210 CA GLU A 125 33.488 34.373 -16.272 1.00 11.47 C ATOM 1211 C GLU A 125 33.692 32.857 -16.091 1.00 11.31 C ATOM 1212 O GLU A 125 33.021 32.275 -15.255 1.00 10.58 O ATOM 1213 CB GLU A 125 34.044 35.139 -15.053 1.00 12.11 C ATOM 1214 CG GLU A 125 35.508 34.918 -14.871 1.00 12.93 C ATOM 1215 CD GLU A 125 36.123 35.590 -13.664 1.00 13.92 C ATOM 1216 OE1 GLU A 125 37.219 35.182 -13.194 1.00 14.80 O ATOM 1217 OE2 GLU A 125 35.449 36.483 -13.079 1.00 14.66 O ATOM 1218 H GLU A 125 31.605 35.343 -15.779 1.00 0.00 H ATOM 1219 N PRO A 126 34.642 32.261 -16.783 1.00 12.03 N ATOM 1220 CA PRO A 126 34.940 30.855 -16.553 1.00 12.31 C ATOM 1221 C PRO A 126 35.216 30.542 -15.098 1.00 12.50 C ATOM 1222 O PRO A 126 35.859 31.349 -14.400 1.00 12.76 O ATOM 1223 CB PRO A 126 36.152 30.626 -17.382 1.00 13.36 C ATOM 1224 CG PRO A 126 35.932 31.490 -18.579 1.00 13.39 C ATOM 1225 CD PRO A 126 35.390 32.757 -17.945 1.00 13.11 C ATOM 1226 N ASP A 127 34.821 29.322 -14.628 1.00 12.52 N ATOM 1227 CA ASP A 127 35.223 28.792 -13.329 1.00 13.65 C ATOM 1228 C ASP A 127 34.897 29.756 -12.197 1.00 12.91 C ATOM 1229 O ASP A 127 35.758 30.056 -11.354 1.00 13.19 O ATOM 1230 CB ASP A 127 36.723 28.445 -13.349 1.00 16.25 C ATOM 1231 CG ASP A 127 37.194 27.703 -12.118 1.00 18.67 C ATOM 1232 OD1 ASP A 127 36.390 26.918 -11.559 1.00 18.63 O ATOM 1233 OD2 ASP A 127 38.326 27.985 -11.607 1.00 22.35 O ATOM 1234 H ASP A 127 34.201 28.740 -15.227 1.00 0.00 H ATOM 1235 N SER A 128 33.713 30.313 -12.220 1.00 11.62 N ATOM 1236 CA SER A 128 33.303 31.366 -11.271 1.00 11.54 C ATOM 1237 C SER A 128 32.133 31.047 -10.358 1.00 10.91 C ATOM 1238 O SER A 128 32.053 31.662 -9.273 1.00 11.73 O ATOM 1239 CB SER A 128 32.969 32.661 -12.077 1.00 11.87 C ATOM 1240 OG SER A 128 34.187 33.121 -12.520 1.00 13.29 O ATOM 1241 HG SER A 128 34.611 32.432 -13.090 1.00 0.00 H ATOM 1242 H SER A 128 33.030 29.999 -12.939 1.00 0.00 H ATOM 1243 N TYR A 129 31.193 30.208 -10.756 1.00 9.84 N ATOM 1244 CA TYR A 129 29.926 30.074 -10.017 1.00 9.30 C ATOM 1245 C TYR A 129 29.709 28.617 -9.567 1.00 9.32 C ATOM 1246 O TYR A 129 29.880 27.665 -10.341 1.00 9.38 O ATOM 1247 CB TYR A 129 28.729 30.552 -10.855 1.00 8.85 C ATOM 1248 CG TYR A 129 28.889 31.984 -11.278 1.00 8.76 C ATOM 1249 CD1 TYR A 129 28.816 32.996 -10.343 1.00 9.05 C ATOM 1250 CD2 TYR A 129 29.080 32.316 -12.624 1.00 8.72 C ATOM 1251 CE1 TYR A 129 28.911 34.335 -10.732 1.00 9.18 C ATOM 1252 CE2 TYR A 129 29.186 33.614 -13.000 1.00 8.81 C ATOM 1253 CZ TYR A 129 29.084 34.625 -12.078 1.00 9.15 C ATOM 1254 OH TYR A 129 29.163 35.909 -12.522 1.00 9.35 O ATOM 1255 HH TYR A 129 29.074 36.528 -11.755 1.00 0.00 H ATOM 1256 H TYR A 129 31.351 29.631 -11.607 1.00 0.00 H ATOM 1257 N ASP A 130 29.292 28.498 -8.323 1.00 9.06 N ATOM 1258 CA ASP A 130 28.826 27.219 -7.794 1.00 9.20 C ATOM 1259 C ASP A 130 27.418 26.896 -8.271 1.00 8.46 C ATOM 1260 O ASP A 130 27.081 25.732 -8.511 1.00 8.58 O ATOM 1261 CB ASP A 130 28.865 27.262 -6.254 1.00 9.70 C ATOM 1262 CG ASP A 130 30.274 27.462 -5.759 1.00 10.59 C ATOM 1263 OD1 ASP A 130 31.190 26.650 -6.097 1.00 10.83 O ATOM 1264 OD2 ASP A 130 30.563 28.522 -5.094 1.00 11.28 O ATOM 1265 H ASP A 130 29.295 29.334 -7.704 1.00 0.00 H ATOM 1266 N VAL A 131 26.558 27.911 -8.312 1.00 8.14 N ATOM 1267 CA VAL A 131 25.187 27.759 -8.773 1.00 8.04 C ATOM 1268 C VAL A 131 24.875 28.893 -9.724 1.00 7.82 C ATOM 1269 O VAL A 131 25.159 30.055 -9.418 1.00 8.36 O ATOM 1270 CB VAL A 131 24.196 27.732 -7.617 1.00 8.15 C ATOM 1271 CG1 VAL A 131 22.753 27.827 -8.099 1.00 8.04 C ATOM 1272 CG2 VAL A 131 24.459 26.467 -6.767 1.00 8.59 C ATOM 1273 H VAL A 131 26.879 28.850 -8.002 1.00 0.00 H ATOM 1274 N ILE A 132 24.286 28.552 -10.871 1.00 7.34 N ATOM 1275 CA ILE A 132 23.770 29.510 -11.820 1.00 7.44 C ATOM 1276 C ILE A 132 22.260 29.289 -11.857 1.00 7.39 C ATOM 1277 O ILE A 132 21.797 28.189 -12.224 1.00 7.27 O ATOM 1278 CB ILE A 132 24.372 29.336 -13.208 1.00 7.54 C ATOM 1279 CG1 ILE A 132 25.881 29.563 -13.129 1.00 7.88 C ATOM 1280 CG2 ILE A 132 23.667 30.276 -14.187 1.00 7.44 C ATOM 1281 CD1 ILE A 132 26.640 29.330 -14.433 1.00 8.13 C ATOM 1282 H ILE A 132 24.193 27.540 -11.094 1.00 0.00 H ATOM 1283 N TRP A 133 21.504 30.276 -11.396 1.00 7.04 N ATOM 1284 CA TRP A 133 20.069 30.139 -11.185 1.00 7.29 C ATOM 1285 C TRP A 133 19.354 30.925 -12.281 1.00 7.14 C ATOM 1286 O TRP A 133 19.593 32.143 -12.439 1.00 7.67 O ATOM 1287 CB TRP A 133 19.665 30.699 -9.804 1.00 7.63 C ATOM 1288 CG TRP A 133 18.299 30.242 -9.391 1.00 7.85 C ATOM 1289 CD1 TRP A 133 17.117 30.810 -9.698 1.00 8.07 C ATOM 1290 CD2 TRP A 133 17.986 29.093 -8.613 1.00 8.15 C ATOM 1291 NE1 TRP A 133 16.090 30.097 -9.184 1.00 8.27 N ATOM 1292 CE2 TRP A 133 16.580 29.018 -8.515 1.00 8.36 C ATOM 1293 CE3 TRP A 133 18.737 28.133 -7.977 1.00 8.56 C ATOM 1294 CZ2 TRP A 133 15.928 28.011 -7.791 1.00 8.67 C ATOM 1295 CZ3 TRP A 133 18.123 27.109 -7.310 1.00 9.25 C ATOM 1296 CH2 TRP A 133 16.712 27.066 -7.186 1.00 9.19 C ATOM 1297 HE1 TRP A 133 15.083 30.336 -9.284 1.00 0.00 H ATOM 1298 H TRP A 133 21.955 31.187 -11.176 1.00 0.00 H ATOM 1299 N ILE A 134 18.539 30.247 -13.050 1.00 6.82 N ATOM 1300 CA ILE A 134 17.867 30.852 -14.210 1.00 6.74 C ATOM 1301 C ILE A 134 16.377 30.642 -14.081 1.00 7.09 C ATOM 1302 O ILE A 134 15.860 29.547 -14.351 1.00 7.51 O ATOM 1303 CB ILE A 134 18.352 30.211 -15.553 1.00 6.68 C ATOM 1304 CG1 ILE A 134 19.887 30.115 -15.648 1.00 6.71 C ATOM 1305 CG2 ILE A 134 17.768 30.999 -16.736 1.00 6.82 C ATOM 1306 CD1 ILE A 134 20.364 29.328 -16.838 1.00 6.63 C ATOM 1307 H ILE A 134 18.361 29.246 -12.833 1.00 0.00 H ATOM 1308 N GLN A 135 15.653 31.684 -13.649 1.00 6.99 N ATOM 1309 CA GLN A 135 14.233 31.514 -13.264 1.00 7.25 C ATOM 1310 C GLN A 135 13.360 32.545 -13.978 1.00 7.66 C ATOM 1311 O GLN A 135 13.615 33.777 -13.900 1.00 7.64 O ATOM 1312 CB GLN A 135 14.032 31.525 -11.767 1.00 7.57 C ATOM 1313 CG GLN A 135 12.558 31.363 -11.407 1.00 8.12 C ATOM 1314 CD GLN A 135 12.321 30.815 -10.015 1.00 8.58 C ATOM 1315 OE1 GLN A 135 13.255 30.444 -9.281 1.00 8.63 O ATOM 1316 NE2 GLN A 135 11.023 30.694 -9.651 1.00 8.82 N ATOM 1317 HE22 GLN A 135 10.271 31.016 -10.293 1.00 0.00 H ATOM 1318 HE21 GLN A 135 10.778 30.279 -8.729 1.00 0.00 H ATOM 1319 H GLN A 135 16.094 32.624 -13.583 1.00 0.00 H ATOM 1320 N TRP A 136 12.322 32.033 -14.625 1.00 7.78 N ATOM 1321 CA TRP A 136 11.286 32.887 -15.262 1.00 7.98 C ATOM 1322 C TRP A 136 11.921 33.860 -16.274 1.00 8.00 C ATOM 1323 O TRP A 136 11.564 35.044 -16.344 1.00 8.27 O ATOM 1324 CB TRP A 136 10.374 33.503 -14.204 1.00 8.44 C ATOM 1325 CG TRP A 136 9.289 32.572 -13.783 1.00 8.90 C ATOM 1326 CD1 TRP A 136 8.592 31.722 -14.571 1.00 9.04 C ATOM 1327 CD2 TRP A 136 8.832 32.355 -12.455 1.00 9.22 C ATOM 1328 NE1 TRP A 136 7.713 30.974 -13.826 1.00 9.49 N ATOM 1329 CE2 TRP A 136 7.811 31.384 -12.523 1.00 9.85 C ATOM 1330 CE3 TRP A 136 9.122 32.932 -11.214 1.00 9.65 C ATOM 1331 CZ2 TRP A 136 7.138 30.928 -11.383 1.00 10.35 C ATOM 1332 CZ3 TRP A 136 8.376 32.517 -10.104 1.00 10.13 C ATOM 1333 CH2 TRP A 136 7.438 31.519 -10.198 1.00 10.69 C ATOM 1334 HE1 TRP A 136 7.084 30.228 -14.187 1.00 0.00 H ATOM 1335 H TRP A 136 12.230 30.999 -14.689 1.00 0.00 H ATOM 1336 N VAL A 137 12.840 33.326 -17.075 1.00 7.30 N ATOM 1337 CA VAL A 137 13.468 34.096 -18.140 1.00 7.44 C ATOM 1338 C VAL A 137 13.840 33.306 -19.371 1.00 7.29 C ATOM 1339 O VAL A 137 14.051 33.915 -20.422 1.00 7.00 O ATOM 1340 CB VAL A 137 14.710 34.874 -17.582 1.00 7.50 C ATOM 1341 CG1 VAL A 137 15.827 33.929 -17.180 1.00 7.52 C ATOM 1342 CG2 VAL A 137 15.182 35.952 -18.554 1.00 7.90 C ATOM 1343 H VAL A 137 13.117 32.333 -16.937 1.00 0.00 H ATOM 1344 N ILE A 138 13.855 31.957 -19.330 1.00 7.35 N ATOM 1345 CA ILE A 138 14.297 31.265 -20.540 1.00 7.31 C ATOM 1346 C ILE A 138 13.369 31.481 -21.724 1.00 7.47 C ATOM 1347 O ILE A 138 13.841 31.317 -22.896 1.00 7.28 O ATOM 1348 CB ILE A 138 14.508 29.748 -20.376 1.00 7.99 C ATOM 1349 CG1 ILE A 138 13.203 28.968 -20.162 1.00 8.36 C ATOM 1350 CG2 ILE A 138 15.537 29.462 -19.258 1.00 8.17 C ATOM 1351 CD1 ILE A 138 13.336 27.464 -20.348 1.00 8.89 C ATOM 1352 H ILE A 138 13.566 31.435 -18.478 1.00 0.00 H ATOM 1353 N GLY A 139 12.132 31.814 -21.472 1.00 7.51 N ATOM 1354 CA GLY A 139 11.190 32.080 -22.551 1.00 7.83 C ATOM 1355 C GLY A 139 11.493 33.335 -23.331 1.00 7.83 C ATOM 1356 O GLY A 139 10.897 33.566 -24.356 1.00 8.19 O ATOM 1357 H GLY A 139 11.814 31.891 -20.485 1.00 0.00 H ATOM 1358 N HIS A 140 12.397 34.161 -22.802 1.00 7.72 N ATOM 1359 CA HIS A 140 12.822 35.341 -23.524 1.00 7.69 C ATOM 1360 C HIS A 140 13.964 35.140 -24.472 1.00 7.59 C ATOM 1361 O HIS A 140 14.336 36.088 -25.145 1.00 8.15 O ATOM 1362 CB HIS A 140 13.145 36.454 -22.515 1.00 7.77 C ATOM 1363 CG HIS A 140 11.920 37.134 -21.998 1.00 8.13 C ATOM 1364 ND1 HIS A 140 11.047 37.780 -22.822 1.00 8.86 N ATOM 1365 CD2 HIS A 140 11.369 37.170 -20.765 1.00 8.24 C ATOM 1366 CE1 HIS A 140 10.054 38.297 -22.108 1.00 9.15 C ATOM 1367 NE2 HIS A 140 10.210 37.904 -20.857 1.00 8.99 N ATOM 1368 H HIS A 140 12.799 33.956 -21.865 1.00 0.00 H ATOM 1369 N LEU A 141 14.523 33.922 -24.572 1.00 7.12 N ATOM 1370 CA LEU A 141 15.593 33.653 -25.502 1.00 7.06 C ATOM 1371 C LEU A 141 15.073 32.736 -26.597 1.00 7.43 C ATOM 1372 O LEU A 141 14.288 31.832 -26.347 1.00 7.59 O ATOM 1373 CB LEU A 141 16.789 32.968 -24.797 1.00 6.78 C ATOM 1374 CG LEU A 141 17.383 33.730 -23.615 1.00 6.57 C ATOM 1375 CD1 LEU A 141 18.577 32.995 -23.082 1.00 6.38 C ATOM 1376 CD2 LEU A 141 17.854 35.144 -24.021 1.00 6.87 C ATOM 1377 H LEU A 141 14.175 33.154 -23.963 1.00 0.00 H ATOM 1378 N THR A 142 15.611 32.918 -27.793 1.00 7.35 N ATOM 1379 CA THR A 142 15.374 31.966 -28.912 1.00 8.08 C ATOM 1380 C THR A 142 16.030 30.652 -28.558 1.00 7.61 C ATOM 1381 O THR A 142 16.893 30.572 -27.667 1.00 7.12 O ATOM 1382 CB THR A 142 15.971 32.463 -30.218 1.00 8.85 C ATOM 1383 OG1 THR A 142 17.407 32.518 -30.072 1.00 9.31 O ATOM 1384 CG2 THR A 142 15.430 33.812 -30.673 1.00 9.27 C ATOM 1385 HG1 THR A 142 17.751 31.613 -29.864 1.00 0.00 H ATOM 1386 H THR A 142 16.216 33.749 -27.955 1.00 0.00 H ATOM 1387 N ASP A 143 15.644 29.591 -29.231 1.00 8.24 N ATOM 1388 CA ASP A 143 16.299 28.277 -28.951 1.00 8.34 C ATOM 1389 C ASP A 143 17.801 28.306 -29.201 1.00 8.24 C ATOM 1390 O ASP A 143 18.547 27.828 -28.318 1.00 8.04 O ATOM 1391 CB ASP A 143 15.724 27.132 -29.817 1.00 9.01 C ATOM 1392 CG ASP A 143 14.255 26.818 -29.570 1.00 9.24 C ATOM 1393 OD1 ASP A 143 13.708 27.202 -28.549 1.00 9.31 O ATOM 1394 OD2 ASP A 143 13.669 26.255 -30.545 1.00 10.11 O ATOM 1395 H ASP A 143 14.894 29.665 -29.948 1.00 0.00 H ATOM 1396 N GLN A 144 18.226 28.976 -30.243 1.00 8.81 N ATOM 1397 CA GLN A 144 19.681 29.036 -30.505 1.00 9.02 C ATOM 1398 C GLN A 144 20.358 29.819 -29.383 1.00 9.07 C ATOM 1399 O GLN A 144 21.420 29.376 -28.896 1.00 8.79 O ATOM 1400 CB GLN A 144 19.940 29.675 -31.852 1.00 9.56 C ATOM 1401 CG GLN A 144 21.396 29.810 -32.236 1.00 9.75 C ATOM 1402 CD GLN A 144 22.027 28.471 -32.542 1.00 9.93 C ATOM 1403 OE1 GLN A 144 21.383 27.549 -33.078 1.00 10.15 O ATOM 1404 NE2 GLN A 144 23.313 28.326 -32.168 1.00 9.82 N ATOM 1405 HE22 GLN A 144 23.818 29.119 -31.723 1.00 0.00 H ATOM 1406 HE21 GLN A 144 23.801 27.421 -32.324 1.00 0.00 H ATOM 1407 H GLN A 144 17.554 29.457 -30.874 1.00 0.00 H ATOM 1408 N HIS A 145 19.794 30.931 -28.967 1.00 8.88 N ATOM 1409 CA HIS A 145 20.430 31.768 -27.948 1.00 9.30 C ATOM 1410 C HIS A 145 20.373 31.078 -26.608 1.00 8.07 C ATOM 1411 O HIS A 145 21.313 31.245 -25.828 1.00 7.93 O ATOM 1412 CB HIS A 145 19.785 33.092 -27.844 1.00 10.72 C ATOM 1413 CG HIS A 145 20.095 33.953 -29.011 1.00 13.48 C ATOM 1414 ND1 HIS A 145 19.354 35.095 -29.298 1.00 15.03 N ATOM 1415 CD2 HIS A 145 20.979 33.783 -30.027 1.00 17.14 C ATOM 1416 CE1 HIS A 145 19.895 35.685 -30.350 1.00 17.83 C ATOM 1417 NE2 HIS A 145 20.825 34.879 -30.877 1.00 20.02 N ATOM 1418 H HIS A 145 18.880 31.221 -29.369 1.00 0.00 H ATOM 1419 N LEU A 146 19.305 30.340 -26.316 1.00 7.36 N ATOM 1420 CA LEU A 146 19.206 29.624 -25.039 1.00 7.08 C ATOM 1421 C LEU A 146 20.252 28.507 -25.003 1.00 6.97 C ATOM 1422 O LEU A 146 20.959 28.340 -23.974 1.00 6.81 O ATOM 1423 CB LEU A 146 17.817 29.096 -24.826 1.00 7.41 C ATOM 1424 CG LEU A 146 17.595 28.310 -23.521 1.00 7.55 C ATOM 1425 CD1 LEU A 146 17.958 29.137 -22.294 1.00 7.57 C ATOM 1426 CD2 LEU A 146 16.162 27.785 -23.487 1.00 8.17 C ATOM 1427 H LEU A 146 18.528 30.270 -27.004 1.00 0.00 H ATOM 1428 N ALA A 147 20.356 27.747 -26.075 1.00 7.06 N ATOM 1429 CA ALA A 147 21.389 26.687 -26.113 1.00 7.32 C ATOM 1430 C ALA A 147 22.792 27.302 -25.933 1.00 7.27 C ATOM 1431 O ALA A 147 23.598 26.785 -25.139 1.00 7.25 O ATOM 1432 CB ALA A 147 21.345 25.898 -27.415 1.00 7.94 C ATOM 1433 H ALA A 147 19.720 27.890 -26.885 1.00 0.00 H ATOM 1434 N GLU A 148 23.088 28.359 -26.640 1.00 7.34 N ATOM 1435 CA GLU A 148 24.421 28.992 -26.518 1.00 7.62 C ATOM 1436 C GLU A 148 24.638 29.562 -25.111 1.00 7.16 C ATOM 1437 O GLU A 148 25.739 29.400 -24.554 1.00 6.95 O ATOM 1438 CB GLU A 148 24.587 30.113 -27.541 1.00 8.29 C ATOM 1439 CG GLU A 148 24.651 29.626 -28.951 1.00 9.35 C ATOM 1440 CD GLU A 148 25.093 30.633 -29.945 1.00 10.77 C ATOM 1441 OE1 GLU A 148 25.958 31.503 -29.602 1.00 12.48 O ATOM 1442 OE2 GLU A 148 24.770 30.525 -31.162 1.00 10.60 O ATOM 1443 H GLU A 148 22.384 28.759 -27.292 1.00 0.00 H ATOM 1444 N PHE A 149 23.635 30.203 -24.524 1.00 6.84 N ATOM 1445 CA PHE A 149 23.760 30.743 -23.148 1.00 6.88 C ATOM 1446 C PHE A 149 24.058 29.601 -22.173 1.00 6.69 C ATOM 1447 O PHE A 149 24.974 29.735 -21.362 1.00 6.82 O ATOM 1448 CB PHE A 149 22.535 31.512 -22.741 1.00 6.97 C ATOM 1449 CG PHE A 149 22.646 32.077 -21.364 1.00 7.28 C ATOM 1450 CD1 PHE A 149 23.667 32.993 -21.092 1.00 7.70 C ATOM 1451 CD2 PHE A 149 21.837 31.632 -20.359 1.00 7.50 C ATOM 1452 CE1 PHE A 149 23.806 33.479 -19.784 1.00 8.15 C ATOM 1453 CE2 PHE A 149 22.001 32.123 -19.071 1.00 7.84 C ATOM 1454 CZ PHE A 149 22.932 33.078 -18.839 1.00 7.99 C ATOM 1455 H PHE A 149 22.741 30.330 -25.040 1.00 0.00 H ATOM 1456 N LEU A 150 23.373 28.467 -22.315 1.00 6.56 N ATOM 1457 CA LEU A 150 23.618 27.327 -21.438 1.00 6.94 C ATOM 1458 C LEU A 150 25.040 26.787 -21.614 1.00 7.18 C ATOM 1459 O LEU A 150 25.700 26.384 -20.646 1.00 7.10 O ATOM 1460 CB LEU A 150 22.594 26.232 -21.650 1.00 7.22 C ATOM 1461 CG LEU A 150 21.228 26.628 -21.141 1.00 7.29 C ATOM 1462 CD1 LEU A 150 20.228 25.602 -21.537 1.00 7.98 C ATOM 1463 CD2 LEU A 150 21.145 26.857 -19.628 1.00 7.55 C ATOM 1464 H LEU A 150 22.653 28.393 -23.062 1.00 0.00 H ATOM 1465 N ARG A 151 25.567 26.762 -22.863 1.00 7.37 N ATOM 1466 CA ARG A 151 26.950 26.351 -23.097 1.00 7.98 C ATOM 1467 C ARG A 151 27.939 27.301 -22.352 1.00 8.11 C ATOM 1468 O ARG A 151 28.949 26.852 -21.773 1.00 8.61 O ATOM 1469 CB ARG A 151 27.304 26.309 -24.577 1.00 8.96 C ATOM 1470 CG ARG A 151 26.578 25.304 -25.422 1.00 9.51 C ATOM 1471 CD ARG A 151 27.084 25.271 -26.863 1.00 10.49 C ATOM 1472 NE ARG A 151 26.216 24.349 -27.594 1.00 11.06 N ATOM 1473 CZ ARG A 151 25.142 24.667 -28.272 1.00 10.83 C ATOM 1474 NH1 ARG A 151 24.914 25.906 -28.742 1.00 10.75 N ATOM 1475 NH2 ARG A 151 24.369 23.694 -28.685 1.00 11.09 N ATOM 1476 HE ARG A 151 26.477 23.343 -27.573 1.00 0.00 H ATOM 1477 HH12 ARG A 151 24.044 26.108 -29.276 1.00 0.00 H ATOM 1478 HH11 ARG A 151 25.607 26.662 -28.572 1.00 0.00 H ATOM 1479 HH22 ARG A 151 23.507 23.909 -29.226 1.00 0.00 H ATOM 1480 HH21 ARG A 151 24.617 22.707 -28.472 1.00 0.00 H ATOM 1481 H ARG A 151 24.975 27.041 -23.671 1.00 0.00 H ATOM 1482 N ARG A 152 27.667 28.599 -22.437 1.00 7.81 N ATOM 1483 CA ARG A 152 28.518 29.575 -21.758 1.00 7.99 C ATOM 1484 C ARG A 152 28.412 29.388 -20.250 1.00 8.22 C ATOM 1485 O ARG A 152 29.437 29.464 -19.558 1.00 8.86 O ATOM 1486 CB ARG A 152 28.200 31.011 -22.234 1.00 7.99 C ATOM 1487 CG ARG A 152 28.445 31.195 -23.716 1.00 8.16 C ATOM 1488 CD ARG A 152 28.511 32.634 -24.180 1.00 8.47 C ATOM 1489 NE ARG A 152 27.326 33.403 -23.829 1.00 8.05 N ATOM 1490 CZ ARG A 152 26.198 33.451 -24.536 1.00 8.12 C ATOM 1491 NH1 ARG A 152 26.096 32.766 -25.673 1.00 8.22 N ATOM 1492 NH2 ARG A 152 25.210 34.210 -24.186 1.00 7.91 N ATOM 1493 HE ARG A 152 27.363 33.962 -22.953 1.00 0.00 H ATOM 1494 HH12 ARG A 152 25.216 32.803 -26.225 1.00 0.00 H ATOM 1495 HH11 ARG A 152 26.897 32.194 -26.009 1.00 0.00 H ATOM 1496 HH22 ARG A 152 24.341 34.228 -24.757 1.00 0.00 H ATOM 1497 HH21 ARG A 152 25.285 34.802 -23.334 1.00 0.00 H ATOM 1498 H ARG A 152 26.846 28.922 -22.988 1.00 0.00 H ATOM 1499 N CYS A 153 27.220 29.160 -19.752 1.00 8.05 N ATOM 1500 CA CYS A 153 27.025 28.874 -18.309 1.00 8.15 C ATOM 1501 C CYS A 153 27.807 27.641 -17.920 1.00 8.63 C ATOM 1502 O CYS A 153 28.469 27.655 -16.854 1.00 8.64 O ATOM 1503 CB CYS A 153 25.560 28.703 -17.989 1.00 8.02 C ATOM 1504 SG CYS A 153 24.625 30.230 -17.992 1.00 8.70 S ATOM 1505 H CYS A 153 26.393 29.180 -20.383 1.00 0.00 H ATOM 1506 N LYS A 154 27.775 26.556 -18.689 1.00 8.68 N ATOM 1507 CA LYS A 154 28.571 25.365 -18.356 1.00 9.54 C ATOM 1508 C LYS A 154 30.041 25.703 -18.128 1.00 10.09 C ATOM 1509 O LYS A 154 30.649 25.187 -17.176 1.00 10.24 O ATOM 1510 CB LYS A 154 28.385 24.291 -19.436 1.00 10.16 C ATOM 1511 CG LYS A 154 29.025 22.962 -19.110 1.00 11.27 C ATOM 1512 CD LYS A 154 28.834 21.974 -20.257 1.00 12.44 C ATOM 1513 CE LYS A 154 29.657 20.696 -19.971 1.00 15.03 C ATOM 1514 NZ LYS A 154 29.512 19.726 -21.108 1.00 16.47 N ATOM 1515 HZ1 LYS A 154 28.510 19.471 -21.219 1.00 0.00 H ATOM 1516 HZ2 LYS A 154 29.857 20.167 -21.984 1.00 0.00 H ATOM 1517 HZ3 LYS A 154 30.069 18.871 -20.906 1.00 0.00 H ATOM 1518 H LYS A 154 27.177 26.550 -19.540 1.00 0.00 H ATOM 1519 N GLY A 155 30.604 26.581 -18.988 1.00 10.14 N ATOM 1520 CA GLY A 155 31.947 26.962 -18.904 1.00 11.22 C ATOM 1521 C GLY A 155 32.268 27.860 -17.707 1.00 11.43 C ATOM 1522 O GLY A 155 33.474 27.949 -17.346 1.00 14.27 O ATOM 1523 H GLY A 155 30.015 26.989 -19.742 1.00 0.00 H ATOM 1524 N SER A 156 31.265 28.369 -17.050 1.00 10.23 N ATOM 1525 CA SER A 156 31.382 29.280 -15.912 1.00 10.16 C ATOM 1526 C SER A 156 31.306 28.513 -14.574 1.00 10.02 C ATOM 1527 O SER A 156 31.481 29.122 -13.512 1.00 10.07 O ATOM 1528 CB SER A 156 30.209 30.237 -16.011 1.00 10.00 C ATOM 1529 OG SER A 156 30.225 31.302 -15.114 1.00 10.87 O ATOM 1530 HG SER A 156 31.041 31.844 -15.261 1.00 0.00 H ATOM 1531 H SER A 156 30.307 28.107 -17.359 1.00 0.00 H ATOM 1532 N LEU A 157 30.918 27.247 -14.597 1.00 9.54 N ATOM 1533 CA LEU A 157 30.757 26.522 -13.333 1.00 9.37 C ATOM 1534 C LEU A 157 32.080 26.149 -12.697 1.00 10.25 C ATOM 1535 O LEU A 157 33.032 25.656 -13.360 1.00 10.68 O ATOM 1536 CB LEU A 157 29.966 25.222 -13.542 1.00 9.29 C ATOM 1537 CG LEU A 157 28.524 25.442 -13.957 1.00 8.82 C ATOM 1538 CD1 LEU A 157 27.945 24.094 -14.355 1.00 9.14 C ATOM 1539 CD2 LEU A 157 27.711 26.127 -12.946 1.00 8.78 C ATOM 1540 H LEU A 157 30.729 26.772 -15.503 1.00 0.00 H ATOM 1541 N ARG A 158 32.126 26.319 -11.357 1.00 10.79 N ATOM 1542 CA ARG A 158 33.179 25.757 -10.517 1.00 12.17 C ATOM 1543 C ARG A 158 33.040 24.220 -10.488 1.00 12.01 C ATOM 1544 O ARG A 158 32.035 23.683 -10.871 1.00 11.03 O ATOM 1545 CB ARG A 158 33.007 26.315 -9.078 1.00 12.50 C ATOM 1546 CG ARG A 158 33.278 27.815 -8.913 1.00 12.98 C ATOM 1547 CD ARG A 158 34.761 28.115 -8.867 1.00 14.34 C ATOM 1548 NE ARG A 158 35.372 27.622 -7.687 1.00 15.79 N ATOM 1549 CZ ARG A 158 36.599 27.098 -7.637 1.00 17.61 C ATOM 1550 NH1 ARG A 158 37.066 26.636 -6.504 1.00 19.36 N ATOM 1551 NH2 ARG A 158 37.352 26.983 -8.710 1.00 17.96 N ATOM 1552 HE ARG A 158 34.829 27.672 -6.802 1.00 0.00 H ATOM 1553 HH12 ARG A 158 38.022 26.228 -6.463 1.00 0.00 H ATOM 1554 HH11 ARG A 158 36.481 26.678 -5.645 1.00 0.00 H ATOM 1555 HH22 ARG A 158 38.304 26.570 -8.636 1.00 0.00 H ATOM 1556 HH21 ARG A 158 36.996 27.305 -9.632 1.00 0.00 H ATOM 1557 H ARG A 158 31.375 26.877 -10.903 1.00 0.00 H ATOM 1558 N PRO A 159 34.080 23.536 -10.029 1.00 12.70 N ATOM 1559 CA PRO A 159 33.925 22.090 -9.771 1.00 13.09 C ATOM 1560 C PRO A 159 32.711 21.841 -8.890 1.00 12.41 C ATOM 1561 O PRO A 159 32.463 22.521 -7.862 1.00 12.09 O ATOM 1562 CB PRO A 159 35.206 21.722 -9.056 1.00 14.20 C ATOM 1563 CG PRO A 159 36.213 22.734 -9.538 1.00 14.61 C ATOM 1564 CD PRO A 159 35.413 24.014 -9.603 1.00 13.72 C ATOM 1565 N ASN A 160 31.941 20.833 -9.310 1.00 12.11 N ATOM 1566 CA ASN A 160 30.710 20.436 -8.643 1.00 11.64 C ATOM 1567 C ASN A 160 29.592 21.434 -8.775 1.00 10.49 C ATOM 1568 O ASN A 160 28.538 21.274 -8.167 1.00 10.29 O ATOM 1569 CB ASN A 160 30.857 20.034 -7.158 1.00 12.47 C ATOM 1570 CG ASN A 160 31.758 18.900 -6.922 1.00 13.90 C ATOM 1571 OD1 ASN A 160 32.084 18.147 -7.802 1.00 14.71 O ATOM 1572 ND2 ASN A 160 32.049 18.694 -5.678 1.00 14.83 N ATOM 1573 HD22 ASN A 160 31.745 19.375 -4.953 1.00 0.00 H ATOM 1574 HD21 ASN A 160 32.587 17.848 -5.403 1.00 0.00 H ATOM 1575 H ASN A 160 32.236 20.306 -10.156 1.00 0.00 H ATOM 1576 N GLY A 161 29.754 22.433 -9.625 1.00 9.65 N ATOM 1577 CA GLY A 161 28.708 23.430 -9.835 1.00 8.91 C ATOM 1578 C GLY A 161 27.515 22.915 -10.612 1.00 8.60 C ATOM 1579 O GLY A 161 27.621 21.904 -11.288 1.00 9.09 O ATOM 1580 H GLY A 161 30.645 22.511 -10.155 1.00 0.00 H ATOM 1581 N ILE A 162 26.395 23.585 -10.461 1.00 8.16 N ATOM 1582 CA ILE A 162 25.167 23.233 -11.159 1.00 7.97 C ATOM 1583 C ILE A 162 24.510 24.476 -11.742 1.00 7.61 C ATOM 1584 O ILE A 162 24.695 25.622 -11.247 1.00 7.13 O ATOM 1585 CB ILE A 162 24.178 22.503 -10.257 1.00 8.38 C ATOM 1586 CG1 ILE A 162 23.707 23.398 -9.078 1.00 8.34 C ATOM 1587 CG2 ILE A 162 24.744 21.189 -9.754 1.00 8.99 C ATOM 1588 CD1 ILE A 162 22.572 22.741 -8.261 1.00 9.01 C ATOM 1589 H ILE A 162 26.385 24.401 -9.816 1.00 0.00 H ATOM 1590 N ILE A 163 23.715 24.249 -12.789 1.00 7.46 N ATOM 1591 CA ILE A 163 22.791 25.228 -13.345 1.00 7.35 C ATOM 1592 C ILE A 163 21.402 24.763 -12.938 1.00 7.58 C ATOM 1593 O ILE A 163 21.086 23.593 -13.063 1.00 7.77 O ATOM 1594 CB ILE A 163 22.901 25.288 -14.860 1.00 7.31 C ATOM 1595 CG1 ILE A 163 24.292 25.791 -15.267 1.00 7.51 C ATOM 1596 CG2 ILE A 163 21.829 26.149 -15.465 1.00 7.19 C ATOM 1597 CD1 ILE A 163 24.739 25.323 -16.664 1.00 7.94 C ATOM 1598 H ILE A 163 23.758 23.312 -13.238 1.00 0.00 H ATOM 1599 N VAL A 164 20.574 25.716 -12.487 1.00 7.60 N ATOM 1600 CA VAL A 164 19.190 25.405 -12.214 1.00 7.99 C ATOM 1601 C VAL A 164 18.341 26.263 -13.161 1.00 7.98 C ATOM 1602 O VAL A 164 18.530 27.475 -13.250 1.00 8.39 O ATOM 1603 CB VAL A 164 18.835 25.677 -10.746 1.00 8.32 C ATOM 1604 CG1 VAL A 164 17.333 25.492 -10.538 1.00 8.91 C ATOM 1605 CG2 VAL A 164 19.583 24.751 -9.814 1.00 8.97 C ATOM 1606 H VAL A 164 20.929 26.681 -12.333 1.00 0.00 H ATOM 1607 N ILE A 165 17.392 25.616 -13.856 1.00 7.86 N ATOM 1608 CA ILE A 165 16.389 26.294 -14.616 1.00 7.61 C ATOM 1609 C ILE A 165 15.075 26.068 -13.876 1.00 7.81 C ATOM 1610 O ILE A 165 14.731 24.934 -13.560 1.00 8.04 O ATOM 1611 CB ILE A 165 16.276 25.746 -16.048 1.00 7.80 C ATOM 1612 CG1 ILE A 165 17.535 26.078 -16.840 1.00 7.70 C ATOM 1613 CG2 ILE A 165 15.066 26.336 -16.779 1.00 8.19 C ATOM 1614 CD1 ILE A 165 17.580 25.404 -18.207 1.00 8.07 C ATOM 1615 H ILE A 165 17.386 24.576 -13.841 1.00 0.00 H ATOM 1616 N LYS A 166 14.338 27.150 -13.644 1.00 7.76 N ATOM 1617 CA LYS A 166 12.974 27.039 -13.076 1.00 7.94 C ATOM 1618 C LYS A 166 12.072 27.914 -13.899 1.00 8.32 C ATOM 1619 O LYS A 166 12.299 29.161 -13.946 1.00 8.26 O ATOM 1620 CB LYS A 166 12.977 27.424 -11.604 1.00 8.20 C ATOM 1621 CG LYS A 166 11.646 27.115 -10.917 1.00 8.49 C ATOM 1622 CD LYS A 166 11.728 27.187 -9.402 1.00 8.74 C ATOM 1623 CE LYS A 166 10.409 26.812 -8.743 1.00 9.23 C ATOM 1624 NZ LYS A 166 10.467 26.860 -7.225 1.00 9.51 N ATOM 1625 HZ1 LYS A 166 11.190 26.194 -6.886 1.00 0.00 H ATOM 1626 HZ2 LYS A 166 10.710 27.824 -6.919 1.00 0.00 H ATOM 1627 HZ3 LYS A 166 9.540 26.595 -6.835 1.00 0.00 H ATOM 1628 H LYS A 166 14.725 28.090 -13.865 1.00 0.00 H ATOM 1629 N ASP A 167 11.044 27.349 -14.506 1.00 8.70 N ATOM 1630 CA ASP A 167 10.262 28.160 -15.457 1.00 9.05 C ATOM 1631 C ASP A 167 8.964 27.534 -15.776 1.00 9.48 C ATOM 1632 O ASP A 167 8.694 26.393 -15.473 1.00 9.45 O ATOM 1633 CB ASP A 167 11.135 28.416 -16.731 1.00 9.10 C ATOM 1634 CG ASP A 167 11.112 29.897 -17.196 1.00 9.63 C ATOM 1635 OD1 ASP A 167 9.976 30.375 -17.386 1.00 10.95 O ATOM 1636 OD2 ASP A 167 12.188 30.501 -17.310 1.00 10.57 O ATOM 1637 H ASP A 167 10.793 26.358 -14.318 1.00 0.00 H ATOM 1638 N ASN A 168 8.141 28.308 -16.486 1.00 10.01 N ATOM 1639 CA ASN A 168 6.894 27.873 -17.026 1.00 11.00 C ATOM 1640 C ASN A 168 7.127 26.821 -18.106 1.00 11.04 C ATOM 1641 O ASN A 168 8.076 27.001 -18.920 1.00 11.19 O ATOM 1642 CB ASN A 168 6.169 29.021 -17.720 1.00 11.25 C ATOM 1643 CG ASN A 168 5.835 30.164 -16.763 1.00 11.30 C ATOM 1644 OD1 ASN A 168 5.637 29.936 -15.556 1.00 10.95 O ATOM 1645 ND2 ASN A 168 5.667 31.364 -17.298 1.00 11.38 N ATOM 1646 HD22 ASN A 168 5.844 31.511 -18.312 1.00 0.00 H ATOM 1647 HD21 ASN A 168 5.358 32.160 -16.704 1.00 0.00 H ATOM 1648 H ASN A 168 8.427 29.293 -16.657 1.00 0.00 H ATOM 1649 N MET A 169 6.280 25.842 -18.127 1.00 11.84 N ATOM 1650 CA MET A 169 6.316 24.777 -19.140 1.00 12.59 C ATOM 1651 C MET A 169 4.942 24.659 -19.783 1.00 13.83 C ATOM 1652 O MET A 169 3.923 24.676 -19.117 1.00 14.66 O ATOM 1653 CB MET A 169 6.739 23.453 -18.520 1.00 13.25 C ATOM 1654 CG MET A 169 8.090 23.451 -17.873 1.00 13.46 C ATOM 1655 SD MET A 169 9.468 23.607 -18.974 1.00 14.09 S ATOM 1656 CE MET A 169 10.512 24.710 -18.101 1.00 14.44 C ATOM 1657 H MET A 169 5.542 25.807 -17.395 1.00 0.00 H ATOM 1658 N ALA A 170 4.913 24.501 -21.113 1.00 13.58 N ATOM 1659 CA ALA A 170 3.708 24.253 -21.867 1.00 14.28 C ATOM 1660 C ALA A 170 3.339 22.785 -21.831 1.00 15.28 C ATOM 1661 O ALA A 170 4.204 21.940 -21.753 1.00 15.07 O ATOM 1662 CB ALA A 170 3.875 24.697 -23.309 1.00 14.22 C ATOM 1663 H ALA A 170 5.812 24.561 -21.633 1.00 0.00 H ATOM 1664 N GLN A 171 2.044 22.477 -21.884 1.00 16.67 N ATOM 1665 CA GLN A 171 1.615 21.118 -21.982 1.00 18.26 C ATOM 1666 C GLN A 171 2.179 20.482 -23.262 1.00 18.14 C ATOM 1667 O GLN A 171 2.639 19.369 -23.222 1.00 18.40 O ATOM 1668 CB GLN A 171 0.066 21.016 -21.987 1.00 20.41 C ATOM 1669 CG GLN A 171 -0.505 19.621 -22.231 1.00 22.66 C ATOM 1670 CD GLN A 171 -2.044 19.528 -22.000 1.00 24.87 C ATOM 1671 H GLN A 171 1.335 23.237 -21.854 1.00 0.00 H ATOM 1672 N GLU A 172 2.162 21.234 -24.364 1.00 17.84 N ATOM 1673 CA GLU A 172 2.616 20.699 -25.647 1.00 18.44 C ATOM 1674 C GLU A 172 3.046 21.837 -26.541 1.00 17.29 C ATOM 1675 O GLU A 172 2.348 22.802 -26.665 1.00 18.05 O ATOM 1676 CB GLU A 172 1.491 19.893 -26.350 1.00 21.37 C ATOM 1677 CG GLU A 172 2.010 19.131 -27.550 1.00 23.51 C ATOM 1678 CD GLU A 172 1.061 18.143 -28.113 1.00 26.74 C ATOM 1679 OE1 GLU A 172 1.520 17.025 -28.433 1.00 30.55 O ATOM 1680 OE2 GLU A 172 -0.102 18.470 -28.313 1.00 28.66 O ATOM 1681 H GLU A 172 1.821 22.215 -24.310 1.00 0.00 H ATOM 1682 N GLY A 173 4.172 21.675 -27.168 1.00 15.98 N ATOM 1683 CA GLY A 173 4.680 22.603 -28.172 1.00 15.47 C ATOM 1684 C GLY A 173 5.411 23.799 -27.648 1.00 13.83 C ATOM 1685 O GLY A 173 6.009 23.758 -26.621 1.00 13.12 O ATOM 1686 H GLY A 173 4.744 20.836 -26.941 1.00 0.00 H ATOM 1687 N VAL A 174 5.359 24.871 -28.453 1.00 13.28 N ATOM 1688 CA VAL A 174 6.052 26.120 -28.165 1.00 12.39 C ATOM 1689 C VAL A 174 5.069 27.199 -28.433 1.00 12.56 C ATOM 1690 O VAL A 174 4.516 27.267 -29.563 1.00 13.44 O ATOM 1691 CB VAL A 174 7.303 26.321 -29.050 1.00 12.08 C ATOM 1692 CG1 VAL A 174 7.954 27.657 -28.726 1.00 11.67 C ATOM 1693 CG2 VAL A 174 8.275 25.170 -28.872 1.00 12.03 C ATOM 1694 H VAL A 174 4.796 24.807 -29.325 1.00 0.00 H ATOM 1695 N ILE A 175 4.719 27.958 -27.396 1.00 11.91 N ATOM 1696 CA ILE A 175 3.584 28.894 -27.452 1.00 12.43 C ATOM 1697 C ILE A 175 4.098 30.307 -27.272 1.00 11.82 C ATOM 1698 O ILE A 175 4.743 30.592 -26.284 1.00 11.19 O ATOM 1699 CB ILE A 175 2.570 28.596 -26.325 1.00 12.88 C ATOM 1700 CG1 ILE A 175 1.987 27.189 -26.503 1.00 13.68 C ATOM 1701 CG2 ILE A 175 1.407 29.576 -26.360 1.00 13.67 C ATOM 1702 CD1 ILE A 175 1.209 26.743 -25.276 1.00 14.02 C ATOM 1703 H ILE A 175 5.267 27.887 -26.515 1.00 0.00 H ATOM 1704 N LEU A 176 3.777 31.187 -28.243 1.00 12.18 N ATOM 1705 CA LEU A 176 4.173 32.620 -28.155 1.00 12.04 C ATOM 1706 C LEU A 176 3.174 33.436 -27.333 1.00 12.48 C ATOM 1707 O LEU A 176 1.972 33.338 -27.564 1.00 12.84 O ATOM 1708 CB LEU A 176 4.193 33.226 -29.559 1.00 12.65 C ATOM 1709 CG LEU A 176 4.576 34.702 -29.666 1.00 12.71 C ATOM 1710 CD1 LEU A 176 6.016 34.867 -29.236 1.00 12.22 C ATOM 1711 CD2 LEU A 176 4.339 35.174 -31.102 1.00 13.44 C ATOM 1712 H LEU A 176 3.241 30.857 -29.071 1.00 0.00 H ATOM 1713 N ASP A 177 3.717 34.230 -26.409 1.00 12.15 N ATOM 1714 CA ASP A 177 2.996 35.327 -25.762 1.00 13.26 C ATOM 1715 C ASP A 177 3.494 36.638 -26.409 1.00 13.67 C ATOM 1716 O ASP A 177 4.600 37.084 -26.157 1.00 12.64 O ATOM 1717 CB ASP A 177 3.240 35.283 -24.268 1.00 12.94 C ATOM 1718 CG ASP A 177 2.479 36.387 -23.472 1.00 14.01 C ATOM 1719 OD1 ASP A 177 2.171 37.412 -24.052 1.00 15.15 O ATOM 1720 OD2 ASP A 177 2.243 36.147 -22.250 1.00 14.26 O ATOM 1721 H ASP A 177 4.705 34.061 -26.134 1.00 0.00 H ATOM 1722 N ASP A 178 2.656 37.230 -27.233 1.00 15.67 N ATOM 1723 CA ASP A 178 3.085 38.400 -27.959 1.00 16.82 C ATOM 1724 C ASP A 178 2.911 39.700 -27.196 1.00 17.17 C ATOM 1725 O ASP A 178 3.203 40.789 -27.748 1.00 19.17 O ATOM 1726 CB ASP A 178 2.388 38.415 -29.304 1.00 18.68 C ATOM 1727 CG ASP A 178 2.973 39.428 -30.295 1.00 19.98 C ATOM 1728 OD1 ASP A 178 4.238 39.563 -30.468 1.00 20.71 O ATOM 1729 OD2 ASP A 178 2.087 40.090 -30.897 1.00 22.25 O ATOM 1730 H ASP A 178 1.693 36.858 -27.360 1.00 0.00 H ATOM 1731 N VAL A 179 2.413 39.613 -25.972 1.00 16.39 N ATOM 1732 CA VAL A 179 2.282 40.805 -25.128 1.00 16.63 C ATOM 1733 C VAL A 179 3.577 41.047 -24.376 1.00 15.21 C ATOM 1734 O VAL A 179 4.117 42.158 -24.471 1.00 16.07 O ATOM 1735 CB VAL A 179 1.120 40.640 -24.187 1.00 17.49 C ATOM 1736 CG1 VAL A 179 1.029 41.786 -23.193 1.00 18.27 C ATOM 1737 CG2 VAL A 179 -0.156 40.476 -24.990 1.00 19.00 C ATOM 1738 H VAL A 179 2.111 38.688 -25.605 1.00 0.00 H ATOM 1739 N ASP A 180 4.102 40.045 -23.688 1.00 13.69 N ATOM 1740 CA ASP A 180 5.418 40.188 -23.044 1.00 12.70 C ATOM 1741 C ASP A 180 6.593 39.789 -23.963 1.00 11.93 C ATOM 1742 O ASP A 180 7.756 40.021 -23.607 1.00 11.20 O ATOM 1743 CB ASP A 180 5.512 39.553 -21.641 1.00 12.41 C ATOM 1744 CG ASP A 180 5.530 38.048 -21.612 1.00 12.12 C ATOM 1745 OD1 ASP A 180 5.436 37.461 -22.708 1.00 11.94 O ATOM 1746 OD2 ASP A 180 5.576 37.482 -20.450 1.00 12.43 O ATOM 1747 H ASP A 180 3.580 39.149 -23.602 1.00 0.00 H ATOM 1748 N SER A 181 6.274 39.187 -25.107 1.00 11.77 N ATOM 1749 CA SER A 181 7.281 38.805 -26.106 1.00 11.20 C ATOM 1750 C SER A 181 8.200 37.733 -25.515 1.00 10.35 C ATOM 1751 O SER A 181 9.416 37.879 -25.364 1.00 9.56 O ATOM 1752 CB SER A 181 8.035 40.010 -26.650 1.00 11.49 C ATOM 1753 OG SER A 181 8.623 39.692 -27.911 1.00 12.02 O ATOM 1754 HG SER A 181 7.912 39.437 -28.551 1.00 0.00 H ATOM 1755 H SER A 181 5.274 38.979 -25.301 1.00 0.00 H ATOM 1756 N SER A 182 7.577 36.577 -25.309 1.00 10.29 N ATOM 1757 CA SER A 182 8.239 35.391 -24.761 1.00 9.90 C ATOM 1758 C SER A 182 7.587 34.124 -25.291 1.00 10.09 C ATOM 1759 O SER A 182 6.468 34.180 -25.824 1.00 11.11 O ATOM 1760 CB SER A 182 8.164 35.329 -23.220 1.00 9.80 C ATOM 1761 OG SER A 182 6.814 35.186 -22.758 1.00 10.56 O ATOM 1762 HG SER A 182 6.278 35.959 -23.065 1.00 0.00 H ATOM 1763 H SER A 182 6.567 36.511 -25.549 1.00 0.00 H ATOM 1764 N VAL A 183 8.260 32.983 -25.095 1.00 9.74 N ATOM 1765 CA VAL A 183 7.645 31.703 -25.421 1.00 10.10 C ATOM 1766 C VAL A 183 7.595 30.783 -24.194 1.00 10.31 C ATOM 1767 O VAL A 183 8.373 30.967 -23.285 1.00 10.07 O ATOM 1768 CB VAL A 183 8.396 30.968 -26.558 1.00 9.98 C ATOM 1769 CG1 VAL A 183 8.344 31.799 -27.816 1.00 10.61 C ATOM 1770 CG2 VAL A 183 9.825 30.606 -26.131 1.00 9.40 C ATOM 1771 H VAL A 183 9.225 33.011 -24.709 1.00 0.00 H ATOM 1772 N CYS A 184 6.666 29.862 -24.210 1.00 11.21 N ATOM 1773 CA CYS A 184 6.491 28.830 -23.183 1.00 12.39 C ATOM 1774 C CYS A 184 6.757 27.519 -23.983 1.00 12.07 C ATOM 1775 O CYS A 184 6.066 27.317 -24.949 1.00 13.50 O ATOM 1776 CB CYS A 184 4.981 28.879 -22.585 1.00 14.37 C ATOM 1777 SG CYS A 184 5.024 27.810 -21.205 1.00 18.81 S ATOM 1778 H CYS A 184 6.002 29.862 -25.011 1.00 0.00 H ATOM 1779 N ARG A 185 7.678 26.640 -23.579 1.00 10.73 N ATOM 1780 CA ARG A 185 8.012 25.402 -24.282 1.00 10.64 C ATOM 1781 C ARG A 185 7.631 24.203 -23.445 1.00 11.00 C ATOM 1782 O ARG A 185 7.688 24.260 -22.208 1.00 10.89 O ATOM 1783 CB ARG A 185 9.515 25.318 -24.451 1.00 9.94 C ATOM 1784 CG ARG A 185 10.124 26.465 -25.282 1.00 9.40 C ATOM 1785 CD ARG A 185 11.597 26.455 -25.060 1.00 8.76 C ATOM 1786 NE ARG A 185 12.388 27.336 -25.927 1.00 8.33 N ATOM 1787 CZ ARG A 185 12.928 28.495 -25.591 1.00 7.92 C ATOM 1788 NH1 ARG A 185 12.698 29.058 -24.445 1.00 7.59 N ATOM 1789 NH2 ARG A 185 13.791 29.083 -26.429 1.00 8.01 N ATOM 1790 HE ARG A 185 12.539 27.016 -26.905 1.00 0.00 H ATOM 1791 HH12 ARG A 185 13.141 29.971 -24.216 1.00 0.00 H ATOM 1792 HH11 ARG A 185 12.071 28.597 -23.756 1.00 0.00 H ATOM 1793 HH22 ARG A 185 14.222 29.995 -26.176 1.00 0.00 H ATOM 1794 HH21 ARG A 185 14.030 28.628 -27.333 1.00 0.00 H ATOM 1795 H ARG A 185 8.195 26.851 -22.701 1.00 0.00 H ATOM 1796 N ASP A 186 7.285 23.129 -24.115 1.00 11.68 N ATOM 1797 CA ASP A 186 7.005 21.856 -23.405 1.00 12.64 C ATOM 1798 C ASP A 186 8.277 21.204 -22.862 1.00 12.50 C ATOM 1799 O ASP A 186 9.395 21.621 -23.172 1.00 11.32 O ATOM 1800 CB ASP A 186 6.104 20.966 -24.177 1.00 13.90 C ATOM 1801 CG ASP A 186 6.763 20.184 -25.292 1.00 14.47 C ATOM 1802 OD1 ASP A 186 7.954 19.879 -25.263 1.00 14.52 O ATOM 1803 OD2 ASP A 186 6.048 19.779 -26.259 1.00 15.82 O ATOM 1804 H ASP A 186 7.206 23.170 -25.151 1.00 0.00 H ATOM 1805 N LEU A 187 8.063 20.228 -21.972 1.00 13.37 N ATOM 1806 CA LEU A 187 9.209 19.601 -21.313 1.00 13.67 C ATOM 1807 C LEU A 187 10.163 18.915 -22.325 1.00 13.59 C ATOM 1808 O LEU A 187 11.389 18.985 -22.130 1.00 13.44 O ATOM 1809 CB LEU A 187 8.754 18.535 -20.326 1.00 14.99 C ATOM 1810 CG LEU A 187 8.075 19.050 -19.061 1.00 15.67 C ATOM 1811 CD1 LEU A 187 7.292 17.938 -18.380 1.00 17.06 C ATOM 1812 CD2 LEU A 187 9.026 19.750 -18.139 1.00 15.24 C ATOM 1813 H LEU A 187 7.095 19.919 -21.752 1.00 0.00 H ATOM 1814 N ASP A 188 9.617 18.302 -23.361 1.00 14.50 N ATOM 1815 CA ASP A 188 10.448 17.642 -24.393 1.00 15.22 C ATOM 1816 C ASP A 188 11.365 18.672 -25.089 1.00 13.39 C ATOM 1817 O ASP A 188 12.564 18.399 -25.320 1.00 12.73 O ATOM 1818 CB ASP A 188 9.636 16.880 -25.391 1.00 17.78 C ATOM 1819 CG ASP A 188 8.992 15.649 -24.769 1.00 21.10 C ATOM 1820 OD1 ASP A 188 9.542 15.030 -23.848 1.00 22.88 O ATOM 1821 OD2 ASP A 188 7.916 15.273 -25.194 1.00 26.21 O ATOM 1822 H ASP A 188 8.581 18.283 -23.453 1.00 0.00 H ATOM 1823 N VAL A 189 10.809 19.834 -25.379 1.00 12.21 N ATOM 1824 CA VAL A 189 11.596 20.883 -26.049 1.00 11.26 C ATOM 1825 C VAL A 189 12.716 21.359 -25.143 1.00 10.44 C ATOM 1826 O VAL A 189 13.885 21.536 -25.547 1.00 10.08 O ATOM 1827 CB VAL A 189 10.694 22.054 -26.528 1.00 11.38 C ATOM 1828 CG1 VAL A 189 11.537 23.197 -27.108 1.00 10.94 C ATOM 1829 CG2 VAL A 189 9.736 21.555 -27.568 1.00 12.44 C ATOM 1830 H VAL A 189 9.814 20.009 -25.134 1.00 0.00 H ATOM 1831 N VAL A 190 12.389 21.648 -23.871 1.00 10.06 N ATOM 1832 CA VAL A 190 13.378 22.147 -22.954 1.00 9.77 C ATOM 1833 C VAL A 190 14.483 21.066 -22.778 1.00 9.82 C ATOM 1834 O VAL A 190 15.687 21.371 -22.799 1.00 9.31 O ATOM 1835 CB VAL A 190 12.732 22.543 -21.630 1.00 9.89 C ATOM 1836 CG1 VAL A 190 13.801 22.890 -20.611 1.00 10.18 C ATOM 1837 CG2 VAL A 190 11.795 23.766 -21.822 1.00 9.82 C ATOM 1838 H VAL A 190 11.411 21.509 -23.547 1.00 0.00 H ATOM 1839 N ARG A 191 14.074 19.823 -22.575 1.00 10.59 N ATOM 1840 CA ARG A 191 15.097 18.757 -22.451 1.00 11.51 C ATOM 1841 C ARG A 191 16.009 18.665 -23.702 1.00 11.45 C ATOM 1842 O ARG A 191 17.204 18.366 -23.603 1.00 11.05 O ATOM 1843 CB ARG A 191 14.467 17.427 -22.144 1.00 13.80 C ATOM 1844 CG ARG A 191 13.873 17.367 -20.763 1.00 15.64 C ATOM 1845 CD ARG A 191 13.326 15.969 -20.506 1.00 19.27 C ATOM 1846 NE ARG A 191 12.292 15.893 -19.463 1.00 22.45 N ATOM 1847 CZ ARG A 191 11.017 15.593 -19.646 1.00 23.32 C ATOM 1848 NH1 ARG A 191 10.232 15.559 -18.574 1.00 24.36 N ATOM 1849 NH2 ARG A 191 10.507 15.220 -20.851 1.00 24.84 N ATOM 1850 HE ARG A 191 12.592 16.095 -18.488 1.00 0.00 H ATOM 1851 HH12 ARG A 191 9.223 15.327 -18.675 1.00 0.00 H ATOM 1852 HH11 ARG A 191 10.627 15.764 -17.634 1.00 0.00 H ATOM 1853 HH22 ARG A 191 9.496 14.995 -20.940 1.00 0.00 H ATOM 1854 HH21 ARG A 191 11.128 15.160 -21.683 1.00 0.00 H ATOM 1855 H ARG A 191 13.061 19.600 -22.504 1.00 0.00 H ATOM 1856 N ARG A 192 15.418 18.832 -24.895 1.00 10.99 N ATOM 1857 CA ARG A 192 16.204 18.828 -26.120 1.00 11.36 C ATOM 1858 C ARG A 192 17.276 19.929 -26.096 1.00 10.27 C ATOM 1859 O ARG A 192 18.442 19.701 -26.519 1.00 10.18 O ATOM 1860 CB ARG A 192 15.260 18.988 -27.338 1.00 12.48 C ATOM 1861 CG ARG A 192 15.981 18.946 -28.692 1.00 13.95 C ATOM 1862 CD ARG A 192 14.998 19.418 -29.752 1.00 15.47 C ATOM 1863 NE ARG A 192 14.934 20.857 -29.768 1.00 16.37 N ATOM 1864 CZ ARG A 192 13.843 21.616 -30.039 1.00 18.27 C ATOM 1865 NH1 ARG A 192 12.634 21.094 -30.168 1.00 19.57 N ATOM 1866 NH2 ARG A 192 13.980 22.941 -30.079 1.00 18.88 N ATOM 1867 HE ARG A 192 15.814 21.366 -29.549 1.00 0.00 H ATOM 1868 HH12 ARG A 192 11.822 21.709 -30.376 1.00 0.00 H ATOM 1869 HH11 ARG A 192 12.496 20.069 -30.061 1.00 0.00 H ATOM 1870 HH22 ARG A 192 13.157 23.543 -30.285 1.00 0.00 H ATOM 1871 HH21 ARG A 192 14.910 23.373 -29.904 1.00 0.00 H ATOM 1872 H ARG A 192 14.388 18.966 -24.945 1.00 0.00 H ATOM 1873 N ILE A 193 16.864 21.119 -25.695 1.00 9.38 N ATOM 1874 CA ILE A 193 17.743 22.256 -25.662 1.00 8.79 C ATOM 1875 C ILE A 193 18.876 22.015 -24.679 1.00 8.63 C ATOM 1876 O ILE A 193 20.071 22.281 -24.938 1.00 8.53 O ATOM 1877 CB ILE A 193 16.997 23.579 -25.428 1.00 8.48 C ATOM 1878 CG1 ILE A 193 16.048 23.853 -26.583 1.00 9.02 C ATOM 1879 CG2 ILE A 193 17.984 24.705 -25.185 1.00 8.15 C ATOM 1880 CD1 ILE A 193 15.076 24.970 -26.323 1.00 9.26 C ATOM 1881 H ILE A 193 15.875 21.236 -25.395 1.00 0.00 H ATOM 1882 N ILE A 194 18.516 21.494 -23.505 1.00 8.75 N ATOM 1883 CA ILE A 194 19.534 21.209 -22.490 1.00 8.96 C ATOM 1884 C ILE A 194 20.556 20.223 -23.020 1.00 9.67 C ATOM 1885 O ILE A 194 21.784 20.371 -22.825 1.00 9.77 O ATOM 1886 CB ILE A 194 18.811 20.614 -21.267 1.00 9.28 C ATOM 1887 CG1 ILE A 194 18.089 21.698 -20.518 1.00 8.89 C ATOM 1888 CG2 ILE A 194 19.811 19.946 -20.309 1.00 9.47 C ATOM 1889 CD1 ILE A 194 17.051 21.179 -19.523 1.00 9.46 C ATOM 1890 H ILE A 194 17.515 21.290 -23.310 1.00 0.00 H ATOM 1891 N CYS A 195 20.079 19.166 -23.650 1.00 10.20 N ATOM 1892 CA CYS A 195 20.949 18.135 -24.257 1.00 10.97 C ATOM 1893 C CYS A 195 21.870 18.762 -25.300 1.00 10.90 C ATOM 1894 O CYS A 195 23.085 18.493 -25.351 1.00 11.07 O ATOM 1895 CB CYS A 195 20.116 16.966 -24.838 1.00 11.95 C ATOM 1896 SG CYS A 195 21.038 15.698 -25.733 1.00 13.70 S ATOM 1897 H CYS A 195 19.048 19.053 -23.723 1.00 0.00 H ATOM 1898 N SER A 196 21.304 19.630 -26.129 1.00 10.17 N ATOM 1899 CA SER A 196 22.056 20.314 -27.184 1.00 10.21 C ATOM 1900 C SER A 196 23.197 21.146 -26.624 1.00 9.80 C ATOM 1901 O SER A 196 24.232 21.302 -27.295 1.00 9.85 O ATOM 1902 CB SER A 196 21.127 21.205 -28.043 1.00 10.03 C ATOM 1903 OG SER A 196 20.168 20.434 -28.770 1.00 10.49 O ATOM 1904 HG SER A 196 19.606 19.923 -28.134 1.00 0.00 H ATOM 1905 H SER A 196 20.289 19.832 -26.026 1.00 0.00 H ATOM 1906 N ALA A 197 22.995 21.684 -25.428 1.00 9.35 N ATOM 1907 CA ALA A 197 24.033 22.486 -24.741 1.00 9.20 C ATOM 1908 C ALA A 197 25.114 21.650 -24.067 1.00 9.77 C ATOM 1909 O ALA A 197 26.002 22.210 -23.407 1.00 10.34 O ATOM 1910 CB ALA A 197 23.429 23.447 -23.777 1.00 8.68 C ATOM 1911 H ALA A 197 22.079 21.538 -24.958 1.00 0.00 H ATOM 1912 N GLY A 198 25.060 20.330 -24.200 1.00 10.09 N ATOM 1913 CA GLY A 198 26.070 19.490 -23.560 1.00 10.53 C ATOM 1914 C GLY A 198 25.855 19.308 -22.077 1.00 10.22 C ATOM 1915 O GLY A 198 26.812 18.955 -21.387 1.00 10.80 O ATOM 1916 H GLY A 198 24.299 19.894 -24.759 1.00 0.00 H ATOM 1917 N LEU A 199 24.631 19.458 -21.604 1.00 9.62 N ATOM 1918 CA LEU A 199 24.271 19.323 -20.208 1.00 9.50 C ATOM 1919 C LEU A 199 23.404 18.097 -19.978 1.00 9.71 C ATOM 1920 O LEU A 199 22.815 17.529 -20.911 1.00 9.91 O ATOM 1921 CB LEU A 199 23.541 20.542 -19.743 1.00 9.15 C ATOM 1922 CG LEU A 199 24.387 21.787 -19.707 1.00 9.16 C ATOM 1923 CD1 LEU A 199 23.508 23.031 -19.541 1.00 9.14 C ATOM 1924 CD2 LEU A 199 25.417 21.737 -18.561 1.00 9.56 C ATOM 1925 H LEU A 199 23.875 19.689 -22.280 1.00 0.00 H ATOM 1926 N SER A 200 23.419 17.631 -18.729 1.00 9.45 N ATOM 1927 CA SER A 200 22.656 16.459 -18.321 1.00 9.96 C ATOM 1928 C SER A 200 21.815 16.808 -17.105 1.00 9.96 C ATOM 1929 O SER A 200 22.178 17.665 -16.314 1.00 9.31 O ATOM 1930 CB SER A 200 23.542 15.319 -17.924 1.00 10.65 C ATOM 1931 OG SER A 200 24.347 14.861 -19.032 1.00 10.77 O ATOM 1932 HG SER A 200 23.755 14.557 -19.765 1.00 0.00 H ATOM 1933 H SER A 200 23.998 18.123 -18.019 1.00 0.00 H ATOM 1934 N LEU A 201 20.686 16.134 -16.987 1.00 11.01 N ATOM 1935 CA LEU A 201 19.820 16.362 -15.838 1.00 11.41 C ATOM 1936 C LEU A 201 20.260 15.608 -14.598 1.00 11.95 C ATOM 1937 O LEU A 201 20.447 14.376 -14.620 1.00 12.42 O ATOM 1938 CB LEU A 201 18.404 15.977 -16.193 1.00 12.41 C ATOM 1939 CG LEU A 201 17.697 16.971 -17.084 1.00 12.52 C ATOM 1940 CD1 LEU A 201 16.668 16.144 -17.796 1.00 13.54 C ATOM 1941 CD2 LEU A 201 17.106 17.968 -16.063 1.00 12.44 C ATOM 1942 H LEU A 201 20.415 15.441 -17.714 1.00 0.00 H ATOM 1943 N LEU A 202 20.375 16.326 -13.492 1.00 11.42 N ATOM 1944 CA LEU A 202 20.544 15.726 -12.190 1.00 12.32 C ATOM 1945 C LEU A 202 19.207 15.487 -11.480 1.00 12.84 C ATOM 1946 O LEU A 202 19.088 14.522 -10.700 1.00 14.06 O ATOM 1947 CB LEU A 202 21.377 16.618 -11.262 1.00 12.19 C ATOM 1948 CG LEU A 202 22.829 16.891 -11.694 1.00 12.55 C ATOM 1949 CD1 LEU A 202 23.416 17.971 -10.822 1.00 13.31 C ATOM 1950 CD2 LEU A 202 23.635 15.667 -11.553 1.00 13.64 C ATOM 1951 H LEU A 202 20.342 17.363 -13.564 1.00 0.00 H ATOM 1952 N ALA A 203 18.246 16.360 -11.733 1.00 12.19 N ATOM 1953 CA ALA A 203 16.934 16.274 -11.099 1.00 12.95 C ATOM 1954 C ALA A 203 15.934 17.163 -11.844 1.00 12.55 C ATOM 1955 O ALA A 203 16.310 18.093 -12.483 1.00 11.69 O ATOM 1956 CB ALA A 203 17.049 16.713 -9.650 1.00 13.34 C ATOM 1957 H ALA A 203 18.431 17.132 -12.405 1.00 0.00 H ATOM 1958 N GLU A 204 14.650 16.779 -11.772 1.00 13.86 N ATOM 1959 CA GLU A 204 13.561 17.520 -12.414 1.00 14.34 C ATOM 1960 C GLU A 204 12.393 17.445 -11.435 1.00 14.36 C ATOM 1961 O GLU A 204 12.111 16.346 -10.913 1.00 15.61 O ATOM 1962 CB GLU A 204 13.198 16.858 -13.730 1.00 16.69 C ATOM 1963 CG GLU A 204 12.117 17.475 -14.546 1.00 19.34 C ATOM 1964 CD GLU A 204 11.822 16.639 -15.807 1.00 22.65 C ATOM 1965 OE1 GLU A 204 12.700 16.332 -16.652 1.00 24.01 O ATOM 1966 OE2 GLU A 204 10.648 16.230 -15.939 1.00 28.73 O ATOM 1967 H GLU A 204 14.418 15.918 -11.237 1.00 0.00 H ATOM 1968 N GLU A 205 11.748 18.554 -11.156 1.00 13.34 N ATOM 1969 CA GLU A 205 10.675 18.549 -10.163 1.00 14.41 C ATOM 1970 C GLU A 205 9.589 19.544 -10.586 1.00 13.13 C ATOM 1971 O GLU A 205 9.901 20.685 -10.859 1.00 12.09 O ATOM 1972 CB GLU A 205 11.252 18.944 -8.820 1.00 15.70 C ATOM 1973 CG GLU A 205 10.286 18.904 -7.688 1.00 17.96 C ATOM 1974 CD GLU A 205 11.068 19.235 -6.416 1.00 20.11 C ATOM 1975 OE1 GLU A 205 11.811 18.329 -5.946 1.00 23.36 O ATOM 1976 OE2 GLU A 205 11.004 20.396 -5.991 1.00 19.48 O ATOM 1977 H GLU A 205 12.001 19.438 -11.642 1.00 0.00 H ATOM 1978 N ARG A 206 8.325 19.108 -10.536 1.00 13.59 N ATOM 1979 CA ARG A 206 7.192 20.048 -10.729 1.00 13.98 C ATOM 1980 C ARG A 206 6.948 20.868 -9.447 1.00 13.68 C ATOM 1981 O ARG A 206 6.929 20.283 -8.324 1.00 14.17 O ATOM 1982 CB ARG A 206 5.921 19.293 -11.056 1.00 15.94 C ATOM 1983 CG ARG A 206 4.789 20.226 -11.511 1.00 16.92 C ATOM 1984 CD ARG A 206 3.614 19.513 -12.031 1.00 19.42 C ATOM 1985 NE ARG A 206 2.505 20.458 -12.044 1.00 20.40 N ATOM 1986 CZ ARG A 206 1.257 20.095 -12.230 1.00 22.83 C ATOM 1987 NH1 ARG A 206 0.937 18.820 -12.458 1.00 24.95 N ATOM 1988 NH2 ARG A 206 0.284 20.988 -12.136 1.00 23.01 N ATOM 1989 HE ARG A 206 2.712 21.467 -11.899 1.00 0.00 H ATOM 1990 HH12 ARG A 206 -0.057 18.551 -12.603 1.00 0.00 H ATOM 1991 HH11 ARG A 206 1.682 18.095 -12.491 1.00 0.00 H ATOM 1992 HH22 ARG A 206 -0.704 20.698 -12.284 1.00 0.00 H ATOM 1993 HH21 ARG A 206 0.508 21.979 -11.914 1.00 0.00 H ATOM 1994 H ARG A 206 8.134 18.101 -10.360 1.00 0.00 H ATOM 1995 N GLN A 207 6.709 22.158 -9.620 1.00 13.06 N ATOM 1996 CA GLN A 207 6.339 23.028 -8.478 1.00 13.23 C ATOM 1997 C GLN A 207 4.929 22.753 -8.071 1.00 14.39 C ATOM 1998 O GLN A 207 3.976 22.846 -8.874 1.00 14.66 O ATOM 1999 CB GLN A 207 6.433 24.479 -8.926 1.00 12.60 C ATOM 2000 CG GLN A 207 6.013 25.485 -7.845 1.00 12.77 C ATOM 2001 CD GLN A 207 6.858 25.439 -6.620 1.00 12.70 C ATOM 2002 OE1 GLN A 207 8.082 25.584 -6.692 1.00 12.64 O ATOM 2003 NE2 GLN A 207 6.211 25.293 -5.463 1.00 13.38 N ATOM 2004 HE22 GLN A 207 5.178 25.174 -5.456 1.00 0.00 H ATOM 2005 HE21 GLN A 207 6.740 25.298 -4.567 1.00 0.00 H ATOM 2006 H GLN A 207 6.782 22.568 -10.573 1.00 0.00 H ATOM 2007 N GLU A 208 4.739 22.435 -6.784 1.00 15.29 N ATOM 2008 CA GLU A 208 3.412 22.215 -6.244 1.00 16.92 C ATOM 2009 C GLU A 208 2.781 23.482 -5.665 1.00 16.67 C ATOM 2010 O GLU A 208 3.433 24.473 -5.510 1.00 15.28 O ATOM 2011 CB GLU A 208 3.493 21.182 -5.111 1.00 18.85 C ATOM 2012 CG GLU A 208 3.955 19.811 -5.590 1.00 20.42 C ATOM 2013 CD GLU A 208 4.078 18.816 -4.460 1.00 22.74 C ATOM 2014 OE1 GLU A 208 4.935 18.966 -3.549 1.00 24.99 O ATOM 2015 OE2 GLU A 208 3.285 17.895 -4.442 1.00 26.03 O ATOM 2016 H GLU A 208 5.564 22.344 -6.157 1.00 0.00 H ATOM 2017 N ASN A 209 1.491 23.385 -5.380 1.00 17.39 N ATOM 2018 CA ASN A 209 0.740 24.417 -4.634 1.00 18.15 C ATOM 2019 C ASN A 209 0.626 25.738 -5.330 1.00 18.06 C ATOM 2020 O ASN A 209 0.442 26.763 -4.682 1.00 18.23 O ATOM 2021 CB ASN A 209 1.367 24.568 -3.222 1.00 18.35 C ATOM 2022 CG ASN A 209 1.274 23.299 -2.467 1.00 19.38 C ATOM 2023 OD1 ASN A 209 0.176 22.797 -2.220 1.00 20.98 O ATOM 2024 ND2 ASN A 209 2.416 22.783 -2.031 1.00 19.41 N ATOM 2025 HD22 ASN A 209 3.318 23.244 -2.266 1.00 0.00 H ATOM 2026 HD21 ASN A 209 2.409 21.918 -1.454 1.00 0.00 H ATOM 2027 H ASN A 209 0.979 22.537 -5.698 1.00 0.00 H ATOM 2028 N LEU A 210 0.667 25.700 -6.652 1.00 17.75 N ATOM 2029 CA LEU A 210 0.403 26.888 -7.481 1.00 17.91 C ATOM 2030 C LEU A 210 -1.084 27.009 -7.830 1.00 18.64 C ATOM 2031 O LEU A 210 -1.814 26.021 -7.841 1.00 19.04 O ATOM 2032 CB LEU A 210 1.173 26.831 -8.795 1.00 17.86 C ATOM 2033 CG LEU A 210 2.684 26.763 -8.659 1.00 17.61 C ATOM 2034 CD1 LEU A 210 3.373 26.829 -10.015 1.00 17.54 C ATOM 2035 CD2 LEU A 210 3.181 27.848 -7.755 1.00 17.70 C ATOM 2036 H LEU A 210 0.893 24.800 -7.122 1.00 0.00 H ATOM 2037 N PRO A 211 -1.533 28.236 -8.153 1.00 18.79 N ATOM 2038 CA PRO A 211 -2.887 28.445 -8.702 1.00 20.13 C ATOM 2039 C PRO A 211 -3.139 27.541 -9.915 1.00 20.46 C ATOM 2040 O PRO A 211 -2.242 27.392 -10.762 1.00 19.20 O ATOM 2041 CB PRO A 211 -2.882 29.913 -9.071 1.00 19.97 C ATOM 2042 CG PRO A 211 -1.842 30.529 -8.171 1.00 19.31 C ATOM 2043 CD PRO A 211 -0.768 29.496 -8.101 1.00 18.31 C ATOM 2044 N ASP A 212 -4.343 26.979 -9.991 1.00 22.32 N ATOM 2045 CA ASP A 212 -4.702 26.028 -11.036 1.00 23.14 C ATOM 2046 C ASP A 212 -4.629 26.635 -12.443 1.00 22.56 C ATOM 2047 O ASP A 212 -4.414 25.897 -13.440 1.00 22.38 O ATOM 2048 CB ASP A 212 -6.124 25.493 -10.833 1.00 25.36 C ATOM 2049 CG ASP A 212 -6.240 24.465 -9.703 1.00 26.60 C ATOM 2050 OD1 ASP A 212 -5.240 24.084 -9.064 1.00 26.49 O ATOM 2051 OD2 ASP A 212 -7.376 24.035 -9.468 1.00 28.40 O ATOM 2052 H ASP A 212 -5.056 27.228 -9.276 1.00 0.00 H ATOM 2053 N GLU A 213 -4.797 27.953 -12.537 1.00 21.71 N ATOM 2054 CA GLU A 213 -4.951 28.583 -13.844 1.00 21.63 C ATOM 2055 C GLU A 213 -3.684 28.877 -14.609 1.00 19.30 C ATOM 2056 O GLU A 213 -3.774 29.228 -15.776 1.00 18.96 O ATOM 2057 CB GLU A 213 -5.806 29.822 -13.752 1.00 23.33 C ATOM 2058 CG GLU A 213 -5.067 31.007 -13.210 1.00 23.49 C ATOM 2059 CD GLU A 213 -5.199 31.175 -11.727 1.00 25.09 C ATOM 2060 OE1 GLU A 213 -4.803 32.336 -11.348 1.00 26.65 O ATOM 2061 OE2 GLU A 213 -5.757 30.267 -10.991 1.00 25.97 O ATOM 2062 H GLU A 213 -4.818 28.535 -11.676 1.00 0.00 H ATOM 2063 N ILE A 214 -2.530 28.773 -13.940 1.00 17.27 N ATOM 2064 CA ILE A 214 -1.278 29.189 -14.534 1.00 15.94 C ATOM 2065 C ILE A 214 -0.537 28.004 -15.124 1.00 15.10 C ATOM 2066 O ILE A 214 -0.805 26.829 -14.825 1.00 15.24 O ATOM 2067 CB ILE A 214 -0.363 29.963 -13.550 1.00 15.26 C ATOM 2068 CG1 ILE A 214 0.148 29.119 -12.381 1.00 15.34 C ATOM 2069 CG2 ILE A 214 -1.029 31.245 -13.032 1.00 15.92 C ATOM 2070 CD1 ILE A 214 1.231 29.846 -11.576 1.00 14.66 C ATOM 2071 H ILE A 214 -2.533 28.386 -12.975 1.00 0.00 H ATOM 2072 N TYR A 215 0.384 28.312 -16.031 1.00 14.39 N ATOM 2073 CA TYR A 215 1.239 27.261 -16.619 1.00 14.17 C ATOM 2074 C TYR A 215 1.952 26.503 -15.529 1.00 13.79 C ATOM 2075 O TYR A 215 2.332 27.056 -14.476 1.00 13.17 O ATOM 2076 CB TYR A 215 2.292 27.788 -17.569 1.00 13.61 C ATOM 2077 CG TYR A 215 1.753 28.278 -18.899 1.00 14.29 C ATOM 2078 CD1 TYR A 215 1.384 27.359 -19.874 1.00 14.93 C ATOM 2079 CD2 TYR A 215 1.598 29.635 -19.157 1.00 14.85 C ATOM 2080 CE1 TYR A 215 0.833 27.790 -21.066 1.00 15.69 C ATOM 2081 CE2 TYR A 215 1.080 30.096 -20.394 1.00 15.26 C ATOM 2082 CZ TYR A 215 0.711 29.163 -21.328 1.00 15.77 C ATOM 2083 OH TYR A 215 0.115 29.583 -22.550 1.00 17.10 O ATOM 2084 HH TYR A 215 -0.088 28.790 -23.106 1.00 0.00 H ATOM 2085 H TYR A 215 0.504 29.301 -16.329 1.00 0.00 H ATOM 2086 N HIS A 216 2.125 25.215 -15.740 1.00 13.94 N ATOM 2087 CA HIS A 216 2.905 24.430 -14.756 1.00 14.05 C ATOM 2088 C HIS A 216 4.349 24.947 -14.764 1.00 12.66 C ATOM 2089 O HIS A 216 4.875 25.509 -15.737 1.00 12.27 O ATOM 2090 CB HIS A 216 2.853 22.936 -15.102 1.00 14.97 C ATOM 2091 CG HIS A 216 1.486 22.372 -15.132 1.00 16.96 C ATOM 2092 ND1 HIS A 216 1.231 21.045 -15.386 1.00 18.34 N ATOM 2093 CD2 HIS A 216 0.292 22.928 -14.858 1.00 17.87 C ATOM 2094 CE1 HIS A 216 -0.067 20.819 -15.327 1.00 19.39 C ATOM 2095 NE2 HIS A 216 -0.670 21.950 -15.007 1.00 19.36 N ATOM 2096 H HIS A 216 1.721 24.757 -16.582 1.00 0.00 H ATOM 2097 N VAL A 217 5.026 24.765 -13.625 1.00 11.97 N ATOM 2098 CA VAL A 217 6.357 25.266 -13.421 1.00 10.72 C ATOM 2099 C VAL A 217 7.230 24.083 -13.011 1.00 10.59 C ATOM 2100 O VAL A 217 6.798 23.272 -12.167 1.00 10.74 O ATOM 2101 CB VAL A 217 6.379 26.362 -12.326 1.00 10.54 C ATOM 2102 CG1 VAL A 217 7.797 26.731 -11.952 1.00 9.83 C ATOM 2103 CG2 VAL A 217 5.620 27.605 -12.837 1.00 10.70 C ATOM 2104 H VAL A 217 4.569 24.238 -12.854 1.00 0.00 H ATOM 2105 N TYR A 218 8.404 23.991 -13.644 1.00 10.04 N ATOM 2106 CA TYR A 218 9.339 22.923 -13.290 1.00 10.29 C ATOM 2107 C TYR A 218 10.680 23.470 -12.990 1.00 9.32 C ATOM 2108 O TYR A 218 11.093 24.499 -13.563 1.00 8.61 O ATOM 2109 CB TYR A 218 9.488 21.926 -14.469 1.00 10.88 C ATOM 2110 CG TYR A 218 8.340 20.950 -14.594 1.00 12.22 C ATOM 2111 CD1 TYR A 218 7.079 21.347 -15.047 1.00 12.91 C ATOM 2112 CD2 TYR A 218 8.518 19.622 -14.290 1.00 13.40 C ATOM 2113 CE1 TYR A 218 6.036 20.445 -15.180 1.00 14.27 C ATOM 2114 CE2 TYR A 218 7.481 18.696 -14.442 1.00 14.42 C ATOM 2115 CZ TYR A 218 6.243 19.116 -14.849 1.00 14.92 C ATOM 2116 OH TYR A 218 5.193 18.239 -14.978 1.00 17.33 O ATOM 2117 HH TYR A 218 4.389 18.731 -15.281 1.00 0.00 H ATOM 2118 H TYR A 218 8.652 24.677 -14.386 1.00 0.00 H ATOM 2119 N SER A 219 11.415 22.718 -12.174 1.00 9.21 N ATOM 2120 CA SER A 219 12.819 22.979 -11.876 1.00 8.85 C ATOM 2121 C SER A 219 13.684 21.853 -12.449 1.00 9.11 C ATOM 2122 O SER A 219 13.310 20.680 -12.319 1.00 10.14 O ATOM 2123 CB SER A 219 13.083 23.002 -10.358 1.00 9.03 C ATOM 2124 OG SER A 219 12.261 24.030 -9.763 1.00 8.98 O ATOM 2125 HG SER A 219 11.307 23.830 -9.937 1.00 0.00 H ATOM 2126 H SER A 219 10.962 21.897 -11.723 1.00 0.00 H ATOM 2127 N PHE A 220 14.810 22.226 -13.020 1.00 9.05 N ATOM 2128 CA PHE A 220 15.791 21.264 -13.525 1.00 9.73 C ATOM 2129 C PHE A 220 17.132 21.615 -12.938 1.00 9.19 C ATOM 2130 O PHE A 220 17.507 22.779 -12.960 1.00 9.86 O ATOM 2131 CB PHE A 220 15.939 21.410 -15.063 1.00 10.31 C ATOM 2132 CG PHE A 220 14.680 21.223 -15.831 1.00 12.38 C ATOM 2133 CD1 PHE A 220 13.853 22.323 -16.042 1.00 13.62 C ATOM 2134 CD2 PHE A 220 14.341 19.996 -16.363 1.00 15.11 C ATOM 2135 CE1 PHE A 220 12.685 22.193 -16.754 1.00 15.09 C ATOM 2136 CE2 PHE A 220 13.162 19.905 -17.157 1.00 16.13 C ATOM 2137 CZ PHE A 220 12.346 21.002 -17.298 1.00 16.02 C ATOM 2138 H PHE A 220 15.010 23.242 -13.116 1.00 0.00 H ATOM 2139 N ALA A 221 17.851 20.639 -12.410 1.00 8.71 N ATOM 2140 CA ALA A 221 19.256 20.852 -11.975 1.00 8.50 C ATOM 2141 C ALA A 221 20.156 20.162 -13.002 1.00 8.57 C ATOM 2142 O ALA A 221 19.891 19.031 -13.310 1.00 8.93 O ATOM 2143 CB ALA A 221 19.520 20.246 -10.609 1.00 9.12 C ATOM 2144 H ALA A 221 17.422 19.698 -12.296 1.00 0.00 H ATOM 2145 N LEU A 222 21.182 20.863 -13.479 1.00 8.61 N ATOM 2146 CA LEU A 222 21.951 20.423 -14.641 1.00 9.33 C ATOM 2147 C LEU A 222 23.434 20.512 -14.333 1.00 9.30 C ATOM 2148 O LEU A 222 23.888 21.415 -13.615 1.00 9.23 O ATOM 2149 CB LEU A 222 21.673 21.390 -15.814 1.00 9.86 C ATOM 2150 CG LEU A 222 20.190 21.668 -16.124 1.00 10.43 C ATOM 2151 CD1 LEU A 222 20.174 22.664 -17.226 1.00 11.01 C ATOM 2152 CD2 LEU A 222 19.523 20.365 -16.485 1.00 11.48 C ATOM 2153 H LEU A 222 21.445 21.753 -13.009 1.00 0.00 H ATOM 2154 N ARG A 223 24.218 19.655 -14.975 1.00 9.69 N ATOM 2155 CA ARG A 223 25.683 19.838 -15.069 1.00 10.19 C ATOM 2156 C ARG A 223 26.212 19.280 -16.340 1.00 10.63 C ATOM 2157 O ARG A 223 25.422 18.571 -17.060 1.00 11.08 O ATOM 2158 CB ARG A 223 26.455 19.289 -13.891 1.00 11.44 C ATOM 2159 CG ARG A 223 25.996 18.010 -13.407 1.00 12.67 C ATOM 2160 CD ARG A 223 26.407 16.854 -14.124 1.00 13.34 C ATOM 2161 NE ARG A 223 27.922 16.716 -14.397 1.00 13.60 N ATOM 2162 CZ ARG A 223 28.445 15.820 -15.207 1.00 13.30 C ATOM 2163 NH1 ARG A 223 29.718 15.923 -15.602 1.00 13.20 N ATOM 2164 NH2 ARG A 223 27.693 14.802 -15.584 1.00 13.06 N ATOM 2165 OXT ARG A 223 27.442 19.437 -16.613 1.00 10.34 O ATOM 2166 HE ARG A 223 28.567 17.371 -13.911 1.00 0.00 H ATOM 2167 HH12 ARG A 223 30.123 15.210 -16.242 1.00 0.00 H ATOM 2168 HH11 ARG A 223 30.303 16.716 -15.269 1.00 0.00 H ATOM 2169 HH22 ARG A 223 28.080 14.079 -16.224 1.00 0.00 H ATOM 2170 HH21 ARG A 223 26.714 14.724 -15.241 1.00 0.00 H ATOM 2171 H ARG A 223 23.787 18.824 -15.429 1.00 0.00 H TER 2172 ARG A 223 HETATM 2173 O HOH 1 6.459 39.362 -41.802 1.00 23.87 O HETATM 2174 O HOH 2 1.228 48.121 -18.291 1.00 37.37 O HETATM 2175 O HOH 3 14.515 23.432 2.890 1.00 29.47 O HETATM 2176 O HOH 4 14.845 52.544 -7.863 1.00 38.39 O HETATM 2177 O HOH 5 9.880 36.107 -1.526 1.00 18.31 O HETATM 2178 O HOH 6 24.206 46.608 -3.326 1.00 26.65 O HETATM 2179 O HOH 7 10.120 46.792 -30.610 1.00 25.51 O HETATM 2180 O HOH 8 30.579 20.677 -23.236 1.00 29.48 O HETATM 2181 O HOH 9 31.017 16.306 -9.245 1.00 20.61 O HETATM 2182 O HOH 10 4.695 37.473 -41.149 1.00 33.65 O HETATM 2183 O HOH 11 33.661 26.670 -5.338 1.00 23.78 O HETATM 2184 O HOH 12 6.218 21.579 -36.058 1.00 28.78 O HETATM 2185 O HOH 13 31.096 31.705 -20.131 1.00 19.06 O HETATM 2186 O HOH 14 32.953 34.376 -3.443 1.00 22.73 O HETATM 2187 O HOH 15 38.958 35.815 -11.350 1.00 20.46 O HETATM 2188 O HOH 16 29.498 20.602 -15.495 1.00 10.36 O HETATM 2189 O HOH 17 17.876 51.872 -5.307 1.00 25.25 O HETATM 2190 O HOH 18 10.450 32.256 -37.924 1.00 15.12 O HETATM 2191 O HOH 19 18.928 38.162 2.435 1.00 24.88 O HETATM 2192 O HOH 20 29.290 38.159 -24.363 1.00 15.38 O HETATM 2193 O HOH 21 16.344 19.172 0.396 1.00 29.36 O HETATM 2194 O HOH 22 9.676 22.553 -6.755 1.00 16.66 O HETATM 2195 O HOH 23 -1.624 27.988 -23.751 1.00 21.31 O HETATM 2196 O HOH 24 21.827 46.644 -1.101 1.00 21.42 O HETATM 2197 O HOH 25 15.938 37.329 -8.297 1.00 10.61 O HETATM 2198 O HOH 26 8.026 36.649 -19.512 1.00 13.50 O HETATM 2199 O HOH 27 11.396 21.252 -3.503 1.00 14.72 O HETATM 2200 O HOH 28 14.236 31.174 -33.135 1.00 13.55 O HETATM 2201 O HOH 29 1.469 24.055 -18.292 1.00 14.78 O HETATM 2202 O HOH 30 9.763 23.187 -9.382 1.00 12.79 O HETATM 2203 O HOH 31 5.073 28.287 -38.111 1.00 19.10 O HETATM 2204 O HOH 32 9.364 26.390 -21.180 1.00 10.87 O HETATM 2205 O HOH 33 -0.185 42.537 -19.618 1.00 40.58 O HETATM 2206 O HOH 34 0.773 23.614 -28.667 1.00 35.43 O HETATM 2207 O HOH 35 26.543 15.815 -2.030 1.00 16.02 O HETATM 2208 O HOH 36 36.333 35.293 -6.044 1.00 34.46 O HETATM 2209 O HOH 37 12.893 30.576 -6.476 1.00 10.48 O HETATM 2210 O HOH 38 28.637 22.502 -23.857 1.00 18.92 O HETATM 2211 O HOH 39 16.271 34.421 -11.736 1.00 10.28 O HETATM 2212 O HOH 40 2.253 27.512 -31.017 1.00 17.80 O HETATM 2213 O HOH 41 9.095 48.003 -28.462 1.00 22.96 O HETATM 2214 O HOH 42 40.010 37.631 -7.495 1.00 21.55 O HETATM 2215 O HOH 43 22.526 13.263 -20.235 1.00 15.80 O HETATM 2216 O HOH 44 5.398 32.881 -22.208 1.00 10.83 O HETATM 2217 O HOH 45 6.616 17.770 -7.370 1.00 22.65 O HETATM 2218 O HOH 46 2.336 39.070 -38.440 1.00 32.06 O HETATM 2219 O HOH 47 0.931 31.948 -23.588 1.00 14.07 O HETATM 2220 O HOH 48 26.633 45.428 -3.621 1.00 22.12 O HETATM 2221 O HOH 49 39.320 34.877 -14.882 1.00 18.18 O HETATM 2222 O HOH 50 -0.156 32.750 -25.984 1.00 14.18 O HETATM 2223 O HOH 51 1.948 44.848 -9.822 1.00 26.21 O HETATM 2224 O HOH 52 5.265 37.723 -17.763 1.00 17.49 O HETATM 2225 O HOH 53 3.482 46.374 -8.012 1.00 17.16 O HETATM 2226 O HOH 54 30.389 24.133 -6.739 1.00 10.99 O HETATM 2227 O HOH 55 25.832 40.236 5.019 1.00 22.91 O HETATM 2228 O HOH 56 2.786 51.152 -20.199 1.00 35.75 O HETATM 2229 O HOH 57 3.614 32.284 -1.167 1.00 11.18 O HETATM 2230 O HOH 58 -1.165 36.665 -18.950 1.00 22.03 O HETATM 2231 O HOH 59 -1.025 25.558 -12.423 1.00 17.57 O HETATM 2232 O HOH 60 8.517 50.740 -21.901 1.00 21.37 O HETATM 2233 O HOH 61 12.313 24.747 2.118 1.00 15.54 O HETATM 2234 O HOH 62 25.447 27.913 2.782 1.00 17.72 O HETATM 2235 O HOH 63 13.923 46.466 -20.124 1.00 16.22 O HETATM 2236 O HOH 64 16.410 43.726 -30.670 1.00 17.10 O HETATM 2237 O HOH 65 30.347 40.727 -2.675 1.00 21.07 O HETATM 2238 O HOH 66 5.329 19.575 -20.955 1.00 20.95 O HETATM 2239 O HOH 67 -3.331 35.897 -8.222 1.00 29.93 O HETATM 2240 O HOH 68 14.610 51.906 -10.448 1.00 27.17 O HETATM 2241 O HOH 69 9.068 42.327 -39.260 1.00 34.36 O HETATM 2242 O HOH 70 33.325 34.011 -8.655 1.00 18.66 O HETATM 2243 O HOH 71 22.092 42.953 -24.198 1.00 15.29 O HETATM 2244 O HOH 72 13.434 15.819 -25.651 1.00 19.29 O HETATM 2245 O HOH 73 31.045 34.722 -25.816 1.00 19.15 O HETATM 2246 O HOH 74 6.826 38.894 -29.849 1.00 17.88 O HETATM 2247 O HOH 75 32.828 12.811 -7.662 1.00 16.04 O HETATM 2248 O HOH 76 10.210 47.040 -4.669 1.00 23.11 O HETATM 2249 O HOH 77 32.106 22.198 -13.180 1.00 20.71 O HETATM 2250 O HOH 78 1.593 42.814 -17.329 1.00 33.45 O HETATM 2251 O HOH 79 6.349 45.529 -25.809 1.00 18.90 O HETATM 2252 O HOH 80 26.847 39.429 -27.946 1.00 28.69 O HETATM 2253 O HOH 81 30.318 24.649 -22.716 1.00 23.63 O HETATM 2254 O HOH 82 13.093 18.950 -3.578 1.00 20.97 O HETATM 2255 O HOH 83 29.724 20.898 -12.778 1.00 11.16 O HETATM 2256 O HOH 84 22.463 40.309 -29.569 1.00 41.64 O HETATM 2257 O HOH 85 21.268 36.856 3.546 1.00 19.17 O HETATM 2258 O HOH 86 -2.505 23.769 -9.436 1.00 36.26 O HETATM 2259 O HOH 87 17.795 16.796 -21.387 1.00 20.79 O HETATM 2260 O HOH 88 17.868 48.533 -19.400 1.00 18.90 O HETATM 2261 O HOH 89 12.561 38.211 -25.411 1.00 9.11 O HETATM 2262 O HOH 90 37.416 32.525 -12.389 1.00 25.13 O HETATM 2263 O HOH 91 6.125 36.151 -33.765 1.00 12.79 O HETATM 2264 O HOH 92 31.190 22.593 -16.304 1.00 14.35 O HETATM 2265 O HOH 93 2.972 29.926 -14.730 1.00 11.62 O HETATM 2266 O HOH 94 31.755 17.290 1.300 1.00 18.46 O HETATM 2267 O HOH 95 30.939 38.020 1.008 1.00 25.07 O HETATM 2268 O HOH 96 32.806 36.858 -12.255 1.00 23.30 O HETATM 2269 O HOH 97 30.961 36.576 -14.555 1.00 11.55 O HETATM 2270 O HOH 98 27.147 33.258 -31.424 1.00 16.51 O HETATM 2271 O HOH 99 2.786 47.808 -16.127 1.00 29.73 O HETATM 2272 O HOH 100 33.703 42.831 -4.488 1.00 19.46 O HETATM 2273 O HOH 101 32.287 21.925 -2.960 1.00 30.17 O HETATM 2274 O HOH 102 15.722 33.999 3.468 1.00 19.93 O HETATM 2275 O HOH 103 7.558 19.687 -4.227 1.00 36.21 O HETATM 2276 O HOH 104 -1.988 38.342 -12.719 1.00 29.32 O HETATM 2277 O HOH 105 28.197 13.973 -3.117 1.00 16.02 O HETATM 2278 O HOH 106 8.824 38.816 -33.775 1.00 14.86 O HETATM 2279 O HOH 107 13.515 45.996 -33.117 1.00 29.06 O HETATM 2280 O HOH 108 22.274 32.681 6.229 1.00 33.17 O HETATM 2281 O HOH 109 -0.958 29.210 -4.727 1.00 30.16 O HETATM 2282 O HOH 110 28.232 45.792 -5.865 1.00 26.31 O HETATM 2283 O HOH 111 7.821 16.408 -9.894 1.00 23.83 O HETATM 2284 O HOH 112 23.078 33.432 -26.078 1.00 10.16 O HETATM 2285 O HOH 113 13.274 44.113 -37.404 1.00 32.04 O HETATM 2286 O HOH 114 26.431 20.401 3.922 1.00 32.65 O HETATM 2287 O HOH 115 33.076 17.718 -2.346 1.00 33.74 O HETATM 2288 O HOH 116 18.853 46.118 5.491 1.00 35.30 O HETATM 2289 O HOH 117 31.676 28.802 0.954 1.00 39.88 O HETATM 2290 O HOH 118 27.910 31.426 -27.553 1.00 11.85 O HETATM 2291 O HOH 119 33.790 42.238 -9.332 1.00 12.61 O HETATM 2292 O HOH 120 13.246 39.469 -8.817 1.00 8.90 O HETATM 2293 O HOH 121 26.819 12.336 -4.857 1.00 25.59 O HETATM 2294 O HOH 122 3.377 23.378 -11.599 1.00 13.80 O HETATM 2295 O HOH 123 2.872 44.628 -23.825 1.00 25.69 O HETATM 2296 O HOH 124 19.973 46.223 -23.749 1.00 32.98 O HETATM 2297 O HOH 125 14.308 39.636 -23.766 1.00 8.61 O HETATM 2298 O HOH 126 32.858 19.128 -11.392 1.00 20.99 O HETATM 2299 O HOH 127 17.919 30.281 1.464 1.00 12.60 O HETATM 2300 O HOH 128 10.789 38.409 -40.786 1.00 18.87 O HETATM 2301 O HOH 129 5.113 23.619 -2.449 1.00 24.27 O HETATM 2302 O HOH 130 0.157 34.199 -22.315 1.00 18.57 O HETATM 2303 O HOH 131 15.435 50.288 -17.142 1.00 15.72 O HETATM 2304 O HOH 132 1.209 23.519 -8.654 1.00 18.05 O HETATM 2305 O HOH 133 14.350 14.091 -10.850 1.00 28.76 O HETATM 2306 O HOH 134 35.732 24.604 -13.110 1.00 36.70 O HETATM 2307 O HOH 135 25.200 45.677 -21.806 1.00 31.56 O HETATM 2308 O HOH 136 20.108 14.139 -18.970 1.00 15.85 O HETATM 2309 O HOH 137 0.040 20.917 -5.650 1.00 26.33 O HETATM 2310 O HOH 138 20.299 46.006 -21.180 1.00 21.64 O HETATM 2311 O HOH 139 3.633 31.720 -23.882 1.00 11.99 O HETATM 2312 O HOH 140 26.376 42.909 4.257 1.00 20.02 O HETATM 2313 O HOH 141 24.354 36.367 -29.275 1.00 33.52 O HETATM 2314 O HOH 142 12.019 24.392 -6.916 1.00 11.86 O HETATM 2315 O HOH 143 12.346 14.447 -23.525 1.00 31.53 O HETATM 2316 O HOH 144 28.524 45.788 -10.935 1.00 19.77 O HETATM 2317 O HOH 145 2.093 45.650 -18.651 1.00 34.09 O HETATM 2318 O HOH 146 27.170 13.454 3.952 1.00 17.91 O HETATM 2319 O HOH 147 7.203 40.879 -34.399 1.00 27.07 O HETATM 2320 O HOH 148 -0.182 36.749 -27.534 1.00 21.16 O HETATM 2321 O HOH 149 12.363 47.706 -3.236 1.00 24.88 O HETATM 2322 O HOH 150 11.620 18.472 -29.434 1.00 35.68 O HETATM 2323 O HOH 151 34.876 17.333 -7.703 1.00 32.51 O HETATM 2324 O HOH 152 34.169 27.057 -2.720 1.00 22.04 O HETATM 2325 O HOH 153 6.476 25.585 -0.910 1.00 16.49 O HETATM 2326 O HOH 154 13.331 48.033 -26.917 1.00 20.52 O HETATM 2327 O HOH 155 12.428 26.708 3.944 1.00 16.54 O HETATM 2328 O HOH 156 24.959 47.807 -13.439 1.00 33.62 O HETATM 2329 O HOH 157 32.254 26.411 -0.958 1.00 25.10 O HETATM 2330 O HOH 158 7.197 22.081 -5.225 1.00 17.73 O HETATM 2331 O HOH 159 0.750 23.769 -11.303 1.00 22.64 O HETATM 2332 O HOH 160 10.433 28.662 -22.608 1.00 10.57 O HETATM 2333 O HOH 161 24.326 29.402 4.872 1.00 24.72 O HETATM 2334 O HOH 162 29.941 18.036 -12.696 1.00 14.25 O HETATM 2335 O HOH 163 4.861 43.543 -4.715 1.00 17.85 O HETATM 2336 O HOH 164 8.635 44.611 -3.917 1.00 24.54 O HETATM 2337 O HOH 165 31.262 18.443 -15.788 1.00 12.77 O HETATM 2338 O HOH 166 12.274 52.379 -3.145 1.00 42.14 O HETATM 2339 O HOH 167 18.242 40.761 2.875 1.00 32.99 O HETATM 2340 O HOH 168 -0.743 37.336 -23.486 1.00 31.07 O HETATM 2341 O HOH 169 24.469 33.716 -28.289 1.00 18.32 O HETATM 2342 O HOH 170 9.020 29.525 -20.182 1.00 25.40 O HETATM 2343 O HOH 171 19.920 41.093 -28.658 1.00 31.24 O HETATM 2344 O HOH 172 25.605 15.983 4.514 1.00 28.20 O HETATM 2345 O HOH 173 21.398 12.920 -9.703 1.00 28.06 O HETATM 2346 O HOH 174 2.625 24.593 -30.352 1.00 23.85 O HETATM 2347 O HOH 175 10.888 48.862 -15.234 1.00 27.14 O HETATM 2348 O HOH 176 -2.569 23.121 -12.445 1.00 35.15 O HETATM 2349 O HOH 177 0.057 23.333 -24.784 1.00 22.49 O HETATM 2350 O HOH 178 30.380 43.384 -3.013 1.00 25.11 O HETATM 2351 O HOH 179 34.163 33.709 -5.895 1.00 25.15 O HETATM 2352 O HOH 180 19.938 50.257 -19.969 1.00 42.14 O HETATM 2353 O HOH 181 27.431 19.019 -10.173 1.00 18.40 O HETATM 2354 O HOH 182 6.681 17.338 -23.125 1.00 28.36 O HETATM 2355 O HOH 183 0.372 20.728 -8.355 1.00 33.95 O HETATM 2356 O HOH 184 27.133 36.278 -26.526 1.00 28.49 O HETATM 2357 O HOH 185 16.501 53.871 -11.947 1.00 28.09 O HETATM 2358 O HOH 186 25.436 16.845 -4.285 1.00 22.75 O HETATM 2359 O HOH 187 30.579 42.983 1.424 1.00 35.12 O HETATM 2360 O HOH 188 -3.283 36.682 -14.496 1.00 26.21 O HETATM 2361 O HOH 189 17.496 42.940 -26.242 1.00 21.73 O HETATM 2362 O HOH 190 16.375 44.655 -28.116 1.00 19.99 O HETATM 2363 O HOH 191 -3.481 37.345 -10.588 1.00 30.04 O HETATM 2364 O HOH 192 34.152 15.428 0.232 1.00 28.80 O HETATM 2365 O HOH 193 28.637 34.416 -27.598 1.00 29.23 O HETATM 2366 O HOH 194 13.346 49.725 -24.646 1.00 31.48 O HETATM 2367 O HOH 195 12.298 49.715 -28.809 1.00 22.00 O HETATM 2368 O HOH 196 16.094 15.272 -25.199 1.00 31.85 O HETATM 2369 O HOH 197 5.010 46.495 -23.592 1.00 27.71 O HETATM 2370 O HOH 198 31.184 28.363 -24.257 1.00 32.77 O HETATM 2371 O HOH 199 -0.405 40.831 -15.923 1.00 43.22 O HETATM 2372 O HOH 200 35.795 19.284 -5.998 1.00 40.38 O HETATM 2373 O HOH 201 18.885 29.718 3.934 1.00 26.51 O HETATM 2374 O HOH 202 10.350 26.609 5.693 1.00 18.58 O HETATM 2375 O HOH 203 15.652 42.371 -38.276 1.00 34.73 O HETATM 2376 O HOH 204 32.369 23.706 -20.971 1.00 28.28 O HETATM 2377 O HOH 205 20.341 10.430 -8.937 1.00 24.03 O HETATM 2378 O HOH 206 -1.607 30.793 -2.872 1.00 28.81 O HETATM 2379 O HOH 207 27.187 15.193 -9.624 1.00 22.26 O HETATM 2380 O HOH 208 31.265 40.771 -0.142 1.00 26.23 O HETATM 2381 O HOH 209 18.096 39.278 -35.952 1.00 31.94 O HETATM 2382 O HOH 210 0.233 43.984 -4.985 1.00 20.98 O HETATM 2383 O HOH 211 28.835 16.958 -10.488 1.00 24.96 O HETATM 2384 O HOH 212 13.139 46.026 -35.586 1.00 35.36 O HETATM 2385 O HOH 213 9.066 50.782 -29.192 1.00 45.74 O HETATM 2386 O HOH 214 7.836 37.334 -31.814 1.00 14.67 O HETATM 2387 O HOH 215 16.879 14.327 -22.857 1.00 41.88 O HETATM 2388 O HOH 216 8.963 40.050 -41.590 1.00 29.75 O HETATM 2389 O HOH 217 14.246 27.058 6.157 1.00 40.75 O HETATM 2390 O HOH 218 20.884 35.195 5.869 1.00 43.50 O HETATM 2391 O HOH 219 12.395 47.907 -0.617 1.00 36.72 O HETATM 2392 O HOH 220 -0.260 27.510 -30.141 1.00 31.23 O HETATM 2393 O HOH 221 33.355 31.302 -21.629 1.00 23.12 O HETATM 2394 O HOH 222 32.834 22.033 -18.906 1.00 21.40 O HETATM 2395 O HOH 223 19.782 44.155 -25.347 1.00 26.82 O HETATM 2396 O HOH 224 15.137 48.940 -19.716 1.00 15.53 O HETATM 2397 O HOH 225 16.708 46.035 -31.954 1.00 36.16 O HETATM 2398 O HOH 226 11.923 52.521 -11.166 1.00 39.41 O HETATM 2399 O HOH 227 1.450 45.117 -26.071 1.00 38.32 O HETATM 2400 O HOH 228 33.032 19.493 -0.419 1.00 24.22 O HETATM 2401 O HOH 229 5.983 51.258 -23.108 1.00 30.49 O HETATM 2402 O HOH 230 10.500 51.899 -23.426 1.00 33.23 O HETATM 2403 O HOH 231 -1.442 35.031 -25.466 1.00 30.20 O HETATM 2404 O HOH 232 1.236 45.067 -21.560 1.00 33.27 O HETATM 2405 O HOH 233 8.832 43.340 -1.447 1.00 25.41 O HETATM 2406 O HOH 234 8.537 49.036 -3.815 1.00 33.06 O HETATM 2407 O HOH 235 -1.876 31.077 -27.325 1.00 18.00 O HETATM 2408 O HOH 236 6.315 47.341 -27.884 1.00 23.32 O HETATM 2409 O HOH 237 17.594 15.389 -27.527 1.00 29.61 O HETATM 2410 O HOH 238 18.403 41.733 -30.973 1.00 26.16 O HETATM 2411 O HOH 239 31.055 37.938 3.730 1.00 39.98 O HETATM 2412 O HOH 240 15.814 47.263 -27.860 1.00 23.80 O HETATM 2413 O HOH 241 14.472 50.446 -21.854 1.00 26.43 O HETATM 2414 O HOH 242 22.326 27.802 6.023 1.00 38.82 O HETATM 2415 O HOH 243 3.185 49.036 -8.188 1.00 25.41 O HETATM 2416 O HOH 244 4.648 49.386 -23.988 1.00 33.22 O HETATM 2417 O HOH 245 9.688 24.066 5.102 1.00 39.26 O HETATM 2418 O HOH 246 24.419 25.257 2.870 1.00 34.07 O HETATM 2419 O HOH 247 -1.119 26.226 -28.158 1.00 25.19 O HETATM 2420 O HOH 248 32.077 31.020 -24.072 1.00 35.60 O HETATM 2421 O HOH 249 -1.630 34.354 -20.437 1.00 22.15 O HETATM 2422 O HOH 250 1.101 36.807 -15.101 1.00 13.19 O HETATM 2423 O HOH 251 -1.337 35.973 -16.255 1.00 15.07 O HETATM 2424 O HOH 252 -2.241 28.315 -26.402 1.00 24.26 O HETATM 2425 O HOH 253 -4.303 34.703 -21.208 1.00 37.09 O HETATM 2426 O HOH 254 -4.321 32.055 -27.680 1.00 36.07 O HETATM 2427 N SER A 255 6.922 35.822 -16.454 1.00 0.24 N HETATM 2428 CA SER A 255 6.405 35.596 -15.050 1.00 0.09 C HETATM 2429 C SER A 255 5.550 34.369 -15.036 1.00 0.23 C HETATM 2430 O SER A 255 5.066 33.896 -16.095 1.00 -0.39 O HETATM 2431 N SER A 255 5.224 33.831 -13.833 1.00 -0.25 N HETATM 2432 CA SER A 255 4.091 32.921 -13.803 1.00 0.13 C HETATM 2433 C SER A 255 2.879 33.601 -14.435 1.00 0.20 C HETATM 2434 O SER A 255 2.756 34.830 -14.324 1.00 -0.39 O HETATM 2435 N SER A 255 2.076 32.838 -15.155 1.00 -0.26 N HETATM 2436 CA SER A 255 0.987 33.442 -15.942 1.00 0.13 C HETATM 2437 C SER A 255 -0.103 32.475 -16.298 1.00 0.20 C HETATM 2438 O SER A 255 0.105 31.265 -16.415 1.00 -0.39 O HETATM 2439 N SER A 255 -1.292 33.032 -16.526 1.00 -0.26 N HETATM 2440 CA SER A 255 -2.471 32.262 -16.916 1.00 0.13 C HETATM 2441 C SER A 255 -2.227 31.503 -18.221 1.00 0.20 C HETATM 2442 O SER A 255 -1.649 32.067 -19.164 1.00 -0.39 O HETATM 2443 N SER A 255 -2.660 30.253 -18.269 1.00 -0.26 N HETATM 2444 CA SER A 255 -2.589 29.442 -19.508 1.00 0.13 C HETATM 2445 C SER A 255 -3.426 30.174 -20.556 1.00 0.20 C HETATM 2446 O SER A 255 -4.580 30.505 -20.308 1.00 -0.39 O HETATM 2447 N SER A 255 -2.831 30.496 -21.715 1.00 -0.27 N HETATM 2448 CA SER A 255 -3.577 31.173 -22.776 1.00 0.09 C HETATM 2449 C SER A 255 -4.573 30.220 -23.410 1.00 0.06 C HETATM 2450 O SER A 255 -4.342 29.007 -23.490 1.00 -0.57 O HETATM 2451 OXT SER A 255 -5.632 30.683 -23.860 1.00 -0.57 O HETATM 2452 CB SER A 255 -2.629 31.708 -23.841 1.00 -0.03 C HETATM 2453 H54 SER A 255 -3.209 32.212 -24.628 1.00 0.03 H HETATM 2454 H55 SER A 255 -2.063 30.874 -24.280 1.00 0.03 H HETATM 2455 H56 SER A 255 -1.931 32.425 -23.384 1.00 0.03 H HETATM 2456 H53 SER A 255 -4.126 32.018 -22.335 1.00 0.07 H HETATM 2457 H52 SER A 255 -1.867 30.271 -21.855 1.00 0.19 H HETATM 2458 CB SER A 255 -3.071 27.997 -19.296 1.00 -0.00 C HETATM 2459 CG1 SER A 255 -2.118 27.238 -18.364 1.00 -0.05 C HETATM 2460 CD1 SER A 255 -2.616 25.871 -17.950 1.00 -0.06 C HETATM 2461 H49 SER A 255 -1.878 25.397 -17.286 1.00 0.02 H HETATM 2462 H50 SER A 255 -2.759 25.247 -18.844 1.00 0.02 H HETATM 2463 H51 SER A 255 -3.573 25.975 -17.418 1.00 0.02 H HETATM 2464 H44 SER A 255 -1.970 27.841 -17.456 1.00 0.03 H HETATM 2465 H45 SER A 255 -1.156 27.113 -18.882 1.00 0.03 H HETATM 2466 CG2 SER A 255 -3.214 27.244 -20.615 1.00 -0.06 C HETATM 2467 H46 SER A 255 -3.898 27.793 -21.278 1.00 0.02 H HETATM 2468 H47 SER A 255 -3.618 26.239 -20.422 1.00 0.02 H HETATM 2469 H48 SER A 255 -2.229 27.157 -21.096 1.00 0.02 H HETATM 2470 H43 SER A 255 -4.061 28.038 -18.818 1.00 0.03 H HETATM 2471 H42 SER A 255 -1.544 29.402 -19.848 1.00 0.08 H HETATM 2472 H41 SER A 255 -3.047 29.843 -17.443 1.00 0.19 H HETATM 2473 CB SER A 255 -3.659 33.220 -17.091 1.00 -0.01 C HETATM 2474 CG SER A 255 -4.996 32.567 -17.426 1.00 -0.02 C HETATM 2475 CD SER A 255 -6.075 33.626 -17.672 1.00 0.06 C HETATM 2476 NE SER A 255 -6.357 34.364 -16.439 1.00 -0.27 N HETATM 2477 CZ SER A 255 -7.142 33.917 -15.459 1.00 0.29 C HETATM 2478 NH1 SER A 255 -7.759 32.740 -15.574 1.00 -0.28 N HETATM 2479 H37 SER A 255 -8.364 32.400 -14.813 1.00 0.26 H HETATM 2480 H38 SER A 255 -7.630 32.172 -16.423 1.00 0.26 H HETATM 2481 NH2 SER A 255 -7.320 34.643 -14.368 1.00 -0.28 N HETATM 2482 H39 SER A 255 -6.847 35.553 -14.272 1.00 0.26 H HETATM 2483 H40 SER A 255 -7.932 34.298 -13.614 1.00 0.26 H HETATM 2484 H36 SER A 255 -5.920 35.289 -16.321 1.00 0.26 H HETATM 2485 H34 SER A 255 -6.995 33.132 -18.017 1.00 0.07 H HETATM 2486 H35 SER A 255 -5.724 34.328 -18.442 1.00 0.07 H HETATM 2487 H32 SER A 255 -5.305 31.927 -16.586 1.00 0.03 H HETATM 2488 H33 SER A 255 -4.880 31.954 -18.332 1.00 0.03 H HETATM 2489 H30 SER A 255 -3.412 33.919 -17.904 1.00 0.03 H HETATM 2490 H31 SER A 255 -3.783 33.779 -16.152 1.00 0.03 H HETATM 2491 H29 SER A 255 -2.703 31.537 -16.122 1.00 0.08 H HETATM 2492 H28 SER A 255 -1.381 34.023 -16.425 1.00 0.19 H HETATM 2493 CB SER A 255 1.556 34.115 -17.216 1.00 -0.01 C HETATM 2494 CG SER A 255 2.106 33.101 -18.208 1.00 -0.04 C HETATM 2495 CD SER A 255 2.562 33.738 -19.520 1.00 -0.01 C HETATM 2496 CE SER A 255 3.715 34.686 -19.362 1.00 -0.04 C HETATM 2497 NZ SER A 255 4.297 35.091 -20.667 1.00 0.22 N HETATM 2498 H25 SER A 255 5.065 35.725 -20.510 1.00 0.20 H HETATM 2499 H26 SER A 255 3.591 35.549 -21.222 1.00 0.20 H HETATM 2500 H27 SER A 255 4.630 34.274 -21.154 1.00 0.20 H HETATM 2501 H23 SER A 255 4.497 34.195 -18.764 1.00 0.08 H HETATM 2502 H24 SER A 255 3.363 35.587 -18.837 1.00 0.08 H HETATM 2503 H21 SER A 255 1.714 34.291 -19.951 1.00 0.03 H HETATM 2504 H22 SER A 255 2.864 32.936 -20.209 1.00 0.03 H HETATM 2505 H19 SER A 255 1.319 32.365 -18.430 1.00 0.03 H HETATM 2506 H20 SER A 255 2.966 32.591 -17.748 1.00 0.03 H HETATM 2507 H17 SER A 255 2.366 34.799 -16.923 1.00 0.03 H HETATM 2508 H18 SER A 255 0.752 34.687 -17.703 1.00 0.03 H HETATM 2509 H16 SER A 255 0.533 34.228 -15.320 1.00 0.08 H HETATM 2510 H15 SER A 255 2.208 31.847 -15.166 1.00 0.19 H HETATM 2511 CB SER A 255 3.845 32.687 -12.290 1.00 -0.01 C HETATM 2512 CG SER A 255 4.467 33.850 -11.648 1.00 -0.03 C HETATM 2513 CD SER A 255 5.667 34.222 -12.486 1.00 0.04 C HETATM 2514 H13 SER A 255 5.876 35.300 -12.430 1.00 0.05 H HETATM 2515 H14 SER A 255 6.561 33.659 -12.179 1.00 0.05 H HETATM 2516 H11 SER A 255 4.784 33.594 -10.626 1.00 0.03 H HETATM 2517 H12 SER A 255 3.756 34.688 -11.612 1.00 0.03 H HETATM 2518 H9 SER A 255 4.322 31.754 -11.956 1.00 0.03 H HETATM 2519 H10 SER A 255 2.768 32.648 -12.070 1.00 0.03 H HETATM 2520 H8 SER A 255 4.315 31.978 -14.324 1.00 0.08 H HETATM 2521 CB SER A 255 5.528 36.816 -14.645 1.00 0.10 C HETATM 2522 OG SER A 255 6.267 38.008 -14.672 1.00 -0.39 O HETATM 2523 H7 SER A 255 6.994 37.943 -14.063 1.00 0.21 H HETATM 2524 H5 SER A 255 5.142 36.657 -13.627 1.00 0.06 H HETATM 2525 H6 SER A 255 4.686 36.901 -15.348 1.00 0.06 H HETATM 2526 H4 SER A 255 7.245 35.481 -14.350 1.00 0.11 H HETATM 2527 H1 SER A 255 7.499 36.648 -16.471 1.00 0.20 H HETATM 2528 H2 SER A 255 6.144 35.943 -17.083 1.00 0.20 H HETATM 2529 H3 SER A 255 7.467 35.025 -16.744 1.00 0.20 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 2427 2428 2527 2528 2529 CONECT 2428 2427 2429 2521 2526 CONECT 2429 2428 2430 2431 CONECT 2430 2429 CONECT 2431 2429 2432 2513 CONECT 2432 2431 2433 2511 2520 CONECT 2433 2432 2434 2435 CONECT 2434 2433 CONECT 2435 2433 2436 2510 CONECT 2436 2435 2437 2493 2509 CONECT 2437 2436 2438 2439 CONECT 2438 2437 CONECT 2439 2437 2440 2492 CONECT 2440 2439 2441 2473 2491 CONECT 2441 2440 2442 2443 CONECT 2442 2441 CONECT 2443 2441 2444 2472 CONECT 2444 2443 2445 2458 2471 CONECT 2445 2444 2446 2447 CONECT 2446 2445 CONECT 2447 2445 2448 2457 CONECT 2448 2447 2449 2452 2456 CONECT 2449 2448 2450 2451 CONECT 2450 2449 CONECT 2451 2449 CONECT 2452 2448 2453 2454 2455 CONECT 2453 2452 CONECT 2454 2452 CONECT 2455 2452 CONECT 2456 2448 CONECT 2457 2447 CONECT 2458 2444 2459 2466 2470 CONECT 2459 2458 2460 2464 2465 CONECT 2460 2459 2461 2462 2463 CONECT 2461 2460 CONECT 2462 2460 CONECT 2463 2460 CONECT 2464 2459 CONECT 2465 2459 CONECT 2466 2458 2467 2468 2469 CONECT 2467 2466 CONECT 2468 2466 CONECT 2469 2466 CONECT 2470 2458 CONECT 2471 2444 CONECT 2472 2443 CONECT 2473 2440 2474 2489 2490 CONECT 2474 2473 2475 2487 2488 CONECT 2475 2474 2476 2485 2486 CONECT 2476 2475 2477 2484 CONECT 2477 2476 2478 2481 CONECT 2478 2477 2479 2480 CONECT 2479 2478 CONECT 2480 2478 CONECT 2481 2477 2482 2483 CONECT 2482 2481 CONECT 2483 2481 CONECT 2484 2476 CONECT 2485 2475 CONECT 2486 2475 CONECT 2487 2474 CONECT 2488 2474 CONECT 2489 2473 CONECT 2490 2473 CONECT 2491 2440 CONECT 2492 2439 CONECT 2493 2436 2494 2507 2508 CONECT 2494 2493 2495 2505 2506 CONECT 2495 2494 2496 2503 2504 CONECT 2496 2495 2497 2501 2502 CONECT 2497 2496 2498 2499 2500 CONECT 2498 2497 CONECT 2499 2497 CONECT 2500 2497 CONECT 2501 2496 CONECT 2502 2496 CONECT 2503 2495 CONECT 2504 2495 CONECT 2505 2494 CONECT 2506 2494 CONECT 2507 2493 CONECT 2508 2493 CONECT 2509 2436 CONECT 2510 2435 CONECT 2511 2432 2512 2518 2519 CONECT 2512 2511 2513 2516 2517 CONECT 2513 2431 2512 2514 2515 CONECT 2514 2513 CONECT 2515 2513 CONECT 2516 2512 CONECT 2517 2512 CONECT 2518 2511 CONECT 2519 2511 CONECT 2520 2432 CONECT 2521 2428 2522 2524 2525 CONECT 2522 2521 2523 CONECT 2523 2522 CONECT 2524 2521 CONECT 2525 2521 CONECT 2526 2428 CONECT 2527 2427 CONECT 2528 2427 CONECT 2529 2427 MASTER 0 0 0 0 0 0 0 0 2528 1 107 18 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
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Related entries of code: 5e1b
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5cvd
RCSB PDB
PDBbind
243aa, >5CVD_1|Chains... *
5e1d
RCSB PDB
PDBbind
241aa, >5E1D_1|Chains... at 100%
5e1m
RCSB PDB
PDBbind
241aa, >5E1M_1|Chains... at 100%
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PDBbind
241aa, >5E1O_1|Chains... at 100%
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RCSB PDB
PDBbind
241aa, >6DTN_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1a7c
RCSB PDB
PDBbind
6-mer
1elr
RCSB PDB
PDBbind
6-mer
1gui
RCSB PDB
PDBbind
6-mer
1gvx
RCSB PDB
PDBbind
6-mer
1gwm
RCSB PDB
PDBbind
6-mer
1k9r
RCSB PDB
PDBbind
6-mer
1lyb
RCSB PDB
PDBbind
6-mer
1njt
RCSB PDB
PDBbind
6-mer
1okv
RCSB PDB
PDBbind
6-mer
1ol1
RCSB PDB
PDBbind
6-mer
1ol2
RCSB PDB
PDBbind
6-mer
1q4k
RCSB PDB
PDBbind
6-mer
1rhk
RCSB PDB
PDBbind
6-mer
1sld
RCSB PDB
PDBbind
6-mer
1sme
RCSB PDB
PDBbind
6-mer
1str
RCSB PDB
PDBbind
6-mer
1urc
RCSB PDB
PDBbind
6-mer
1xt3
RCSB PDB
PDBbind
6-mer
1ym2
RCSB PDB
PDBbind
6-mer
1zfp
RCSB PDB
PDBbind
6-mer
2h65
RCSB PDB
PDBbind
6-mer
2h6t
RCSB PDB
PDBbind
6-mer
2hob
RCSB PDB
PDBbind
6-mer
2itk
RCSB PDB
PDBbind
6-mer
2l65
RCSB PDB
PDBbind
6-mer
2oqs
RCSB PDB
PDBbind
6-mer
2q6f
RCSB PDB
PDBbind
6-mer
2qzx
RCSB PDB
PDBbind
6-mer
2r0z
RCSB PDB
PDBbind
6-mer
2w76
RCSB PDB
PDBbind
6-mer
2x6x
RCSB PDB
PDBbind
6-mer
3avz
RCSB PDB
PDBbind
6-mer
3aw0
RCSB PDB
PDBbind
6-mer
3bv9
RCSB PDB
PDBbind
6-mer
3dri
RCSB PDB
PDBbind
6-mer
3eys
RCSB PDB
PDBbind
6-mer
3fv3
RCSB PDB
PDBbind
6-mer
3fwv
RCSB PDB
PDBbind
6-mer
3h6z
RCSB PDB
PDBbind
6-mer
3hik
RCSB PDB
PDBbind
6-mer
3iqu
RCSB PDB
PDBbind
6-mer
3iqv
RCSB PDB
PDBbind
6-mer
3kd7
RCSB PDB
PDBbind
6-mer
3luo
RCSB PDB
PDBbind
6-mer
3nth
RCSB PDB
PDBbind
6-mer
3old
RCSB PDB
PDBbind
6-mer
3psl
RCSB PDB
PDBbind
6-mer
3q4j
RCSB PDB
PDBbind
6-mer
3q4k
RCSB PDB
PDBbind
6-mer
3q4l
RCSB PDB
PDBbind
6-mer
3r5j
RCSB PDB
PDBbind
6-mer
3r6g
RCSB PDB
PDBbind
6-mer
3rjm
RCSB PDB
PDBbind
6-mer
3sm1
RCSB PDB
PDBbind
6-mer
3sna
RCSB PDB
PDBbind
6-mer
3snb
RCSB PDB
PDBbind
6-mer
3snc
RCSB PDB
PDBbind
6-mer
3snd
RCSB PDB
PDBbind
6-mer
3u51
RCSB PDB
PDBbind
6-mer
3ux0
RCSB PDB
PDBbind
6-mer
3wqw
RCSB PDB
PDBbind
6-mer
3zmt
RCSB PDB
PDBbind
6-mer
3zmu
RCSB PDB
PDBbind
6-mer
3zmv
RCSB PDB
PDBbind
6-mer
3zmz
RCSB PDB
PDBbind
6-mer
3zn0
RCSB PDB
PDBbind
6-mer
3zn1
RCSB PDB
PDBbind
6-mer
4a0j
RCSB PDB
PDBbind
6-mer
4apo
RCSB PDB
PDBbind
6-mer
4b3b
RCSB PDB
PDBbind
6-mer
4b4q
RCSB PDB
PDBbind
6-mer
4b8y
RCSB PDB
PDBbind
6-mer
4c4n
RCSB PDB
PDBbind
6-mer
4dgb
RCSB PDB
PDBbind
6-mer
4er2
RCSB PDB
PDBbind
6-mer
4exh
RCSB PDB
PDBbind
6-mer
4fr3
RCSB PDB
PDBbind
6-mer
4fys
RCSB PDB
PDBbind
6-mer
4fz3
RCSB PDB
PDBbind
6-mer
4gye
RCSB PDB
PDBbind
6-mer
4gzf
RCSB PDB
PDBbind
6-mer
4ifi
RCSB PDB
PDBbind
6-mer
4ikn
RCSB PDB
PDBbind
6-mer
4j09
RCSB PDB
PDBbind
6-mer
4j77
RCSB PDB
PDBbind
6-mer
4j79
RCSB PDB
PDBbind
6-mer
4j86
RCSB PDB
PDBbind
6-mer
4j8b
RCSB PDB
PDBbind
6-mer
4jj7
RCSB PDB
PDBbind
6-mer
4jj8
RCSB PDB
PDBbind
6-mer
4jje
RCSB PDB
PDBbind
6-mer
4jr0
RCSB PDB
PDBbind
6-mer
4k3o
RCSB PDB
PDBbind
6-mer
4k3p
RCSB PDB
PDBbind
6-mer
4k3q
RCSB PDB
PDBbind
6-mer
4k3r
RCSB PDB
PDBbind
6-mer
4ny3
RCSB PDB
PDBbind
6-mer
4o9w
RCSB PDB
PDBbind
6-mer
4ou3
RCSB PDB
PDBbind
6-mer
4tsz
RCSB PDB
PDBbind
6-mer
4tt2
RCSB PDB
PDBbind
6-mer
4wk2
RCSB PDB
PDBbind
6-mer
4wvt
RCSB PDB
PDBbind
6-mer
4x9r
RCSB PDB
PDBbind
6-mer
4x9v
RCSB PDB
PDBbind
6-mer
4ynl
RCSB PDB
PDBbind
6-mer
5a2i
RCSB PDB
PDBbind
6-mer
5a2j
RCSB PDB
PDBbind
6-mer
5a2k
RCSB PDB
PDBbind
6-mer
5e1d
RCSB PDB
PDBbind
6-mer
5e1m
RCSB PDB
PDBbind
6-mer
5e1o
RCSB PDB
PDBbind
6-mer
5epk
RCSB PDB
PDBbind
6-mer
5epl
RCSB PDB
PDBbind
6-mer
5eq0
RCSB PDB
PDBbind
6-mer
5fot
RCSB PDB
PDBbind
6-mer
5fou
RCSB PDB
PDBbind
6-mer
5fov
RCSB PDB
PDBbind
6-mer
5fow
RCSB PDB
PDBbind
6-mer
5fox
RCSB PDB
PDBbind
6-mer
5fpk
RCSB PDB
PDBbind
6-mer
5gwz
RCSB PDB
PDBbind
6-mer
5hvp
RCSB PDB
PDBbind
6-mer
5izf
RCSB PDB
PDBbind
6-mer
5l7k
RCSB PDB
PDBbind
6-mer
5lrg
RCSB PDB
PDBbind
6-mer
5lrj
RCSB PDB
PDBbind
6-mer
5lrk
RCSB PDB
PDBbind
6-mer
5lso
RCSB PDB
PDBbind
6-mer
5tpc
RCSB PDB
PDBbind
6-mer
5w94
RCSB PDB
PDBbind
6-mer
5y24
RCSB PDB
PDBbind
6-mer
6apr
RCSB PDB
PDBbind
6-mer
6asz
RCSB PDB
PDBbind
6-mer
6at0
RCSB PDB
PDBbind
6-mer
6cdg
RCSB PDB
PDBbind
6-mer
6cgt
RCSB PDB
PDBbind
6-mer
6do4
RCSB PDB
PDBbind
6-mer
6do5
RCSB PDB
PDBbind
6-mer
6dub
RCSB PDB
PDBbind
6-mer
6eqx
RCSB PDB
PDBbind
6-mer
7hvp
RCSB PDB
PDBbind
6-mer
6rhe
RCSB PDB
PDBbind
6-mer
6nsx
RCSB PDB
PDBbind
6-mer
6nsv
RCSB PDB
PDBbind
6-mer
6jij
RCSB PDB
PDBbind
6-mer
6im4
RCSB PDB
PDBbind
6-mer
6hzd
RCSB PDB
PDBbind
6-mer
6hzc
RCSB PDB
PDBbind
6-mer
6hp5
RCSB PDB
PDBbind
6-mer
6hmy
RCSB PDB
PDBbind
6-mer
6hle
RCSB PDB
PDBbind
6-mer
6fvo
RCSB PDB
PDBbind
6-mer
6fvn
RCSB PDB
PDBbind
6-mer
6fvm
RCSB PDB
PDBbind
6-mer
6fvl
RCSB PDB
PDBbind
6-mer
6efk
RCSB PDB
PDBbind
6-mer
6a30
RCSB PDB
PDBbind
6-mer
5zw6
RCSB PDB
PDBbind
6-mer
5zvw
RCSB PDB
PDBbind
6-mer
Entry Information
PDB ID
5e1b
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
N-terminal Xaa-Pro-Lys N-methyltransferase 1, human NRMT1
Ligand Name
6-mer
EC.Number
E.C.2.1.1.244
Resolution
1.65(Å)
Affinity (Kd/Ki/IC50)
Kd=14.3uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Genes Dev. Vol. 29: pp. 2343-2348
Ligand Properties
Formula
C
2
9
H
5
7
N
1
0
O
8
Molecular Weight
673.825
Exact Mass
673.436
No. of atoms
104
No. of bonds
104
Polar Surface Area
315.53
LOGP Value
-2.14 (
Computed with XLOGP3
)
-3.88 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 7
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 26
No. of Nitrogen and Oxygen Atoms: 18
No. of Rings: 1
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](CC)C)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)[NH3+]
InChI String
InChI=1S/C29H54N10O8/c1-4-16(2)22(26(44)35-17(3)28(46)47)38-24(42)20(10-7-13-34-29(32)33)36-23(41)19(9-5-6-12-30)37-25(43)21-11-8-14-39(21)27(45)18(31)15-40/h16-22,40H,4-15,30-31H2,1-3H3,(H,35,44)(H,36,41)(H,37,43)(H,38,42)(H,46,47)(H4,32,33,34)/p+3/t16-,17-,18-,19-,20-,21-,22-/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):
Q9BV86
P18754
Entrez Gene ID
NCBI Entrez Gene ID:
28989
1104
ASD
Information of known allosteric effects of PDB entries
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