Browse entries in the PDBbind-CN Database
HEADER 6EQ6_COMPLEX COMPND 6EQ6_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 154 ALA SER ARG LEU TYR THR LEU VAL LEU VAL LEU GLN PRO SEQRES 2 A 154 GLN ARG VAL LEU LEU GLY MET LYS LYS ARG GLY PHE GLY SEQRES 3 A 154 ALA GLY ARG TRP ASN GLY PHE GLY GLY LYS VAL GLN GLU SEQRES 4 A 154 GLY GLU THR ILE GLU ASP GLY ALA ARG ARG GLU LEU GLN SEQRES 5 A 154 GLU GLU SER GLY LEU THR VAL ASP ALA LEU HIS LYS VAL SEQRES 6 A 154 GLY GLN ILE VAL PHE GLU PHE VAL GLY GLU PRO GLU LEU SEQRES 7 A 154 MET ASP VAL HIS VAL PHE CYS THR ASP SER ILE GLN GLY SEQRES 8 A 154 THR PRO VAL GLU SER ASP GLU MET ARG PRO CYS TRP PHE SEQRES 9 A 154 GLN LEU ASP GLN ILE PRO PHE LYS ASP MET TRP PRO ASP SEQRES 10 A 154 ASP SER TYR TRP PHE PRO LEU LEU LEU GLN LYS LYS LYS SEQRES 11 A 154 PHE HIS GLY TYR PHE LYS PHE GLN GLY GLN ASP THR ILE SEQRES 12 A 154 LEU ASP TYR THR LEU ARG GLU VAL ASP THR VAL HET EV A 2 30 ATOM 1 N ALA A 3 -18.794 -6.263 -20.247 1.00 45.77 N ATOM 2 CA ALA A 3 -18.321 -5.495 -19.097 1.00 40.57 C ATOM 3 C ALA A 3 -18.056 -4.026 -19.438 1.00 35.40 C ATOM 4 O ALA A 3 -17.228 -3.379 -18.797 1.00 32.67 O ATOM 5 CB ALA A 3 -17.061 -6.124 -18.531 1.00 42.47 C ATOM 6 HN3 ALA A 3 -18.077 -6.234 -21.000 1.00 0.00 H ATOM 7 HN2 ALA A 3 -19.683 -5.850 -20.596 1.00 0.00 H ATOM 8 HN1 ALA A 3 -18.957 -7.249 -19.960 1.00 0.00 H ATOM 9 N SER A 4 -18.747 -3.496 -20.445 1.00 30.66 N ATOM 10 CA SER A 4 -18.576 -2.094 -20.797 1.00 32.28 C ATOM 11 C SER A 4 -19.939 -1.476 -21.064 1.00 33.49 C ATOM 12 O SER A 4 -20.923 -2.174 -21.342 1.00 33.03 O ATOM 13 CB SER A 4 -17.643 -1.910 -22.002 1.00 31.90 C ATOM 14 OG SER A 4 -18.242 -2.336 -23.213 1.00 40.17 O ATOM 15 HG SER A 4 -17.607 -2.199 -23.960 1.00 0.00 H ATOM 16 H SER A 4 -19.413 -4.087 -20.983 1.00 0.00 H ATOM 17 N ARG A 5 -19.994 -0.154 -20.938 1.00 27.02 N ATOM 18 CA ARG A 5 -21.199 0.604 -21.245 1.00 26.83 C ATOM 19 C ARG A 5 -20.938 1.552 -22.407 1.00 28.65 C ATOM 20 O ARG A 5 -19.900 2.224 -22.456 1.00 23.67 O ATOM 21 CB ARG A 5 -21.692 1.395 -20.037 1.00 33.32 C ATOM 22 CG ARG A 5 -23.149 1.797 -20.185 1.00 41.82 C ATOM 23 CD ARG A 5 -23.719 2.300 -18.890 1.00 42.55 C ATOM 24 NE ARG A 5 -25.172 2.414 -18.969 1.00 49.58 N ATOM 25 CZ ARG A 5 -25.923 2.965 -18.022 1.00 52.76 C ATOM 26 NH1 ARG A 5 -25.345 3.456 -16.934 1.00 44.33 N ATOM 27 HE ARG A 5 -25.647 2.042 -19.816 1.00 0.00 H ATOM 28 HH12 ARG A 5 -25.925 3.889 -16.187 1.00 0.00 H ATOM 29 HH11 ARG A 5 -24.312 3.408 -16.827 1.00 0.00 H ATOM 30 H ARG A 5 -19.149 0.356 -20.609 1.00 0.00 H ATOM 31 N LEU A 6 -21.899 1.617 -23.327 1.00 23.61 N ATOM 32 CA LEU A 6 -21.751 2.406 -24.535 1.00 22.66 C ATOM 33 C LEU A 6 -21.933 3.893 -24.250 1.00 26.20 C ATOM 34 O LEU A 6 -22.830 4.300 -23.502 1.00 27.88 O ATOM 35 CB LEU A 6 -22.766 1.954 -25.581 1.00 25.90 C ATOM 36 CG LEU A 6 -22.555 0.568 -26.178 1.00 28.41 C ATOM 37 CD1 LEU A 6 -23.767 0.167 -27.001 1.00 29.11 C ATOM 38 CD2 LEU A 6 -21.279 0.585 -27.039 1.00 26.42 C ATOM 39 H LEU A 6 -22.781 1.087 -23.175 1.00 0.00 H ATOM 40 N TYR A 7 -21.090 4.703 -24.879 1.00 21.51 N ATOM 41 CA TYR A 7 -21.199 6.152 -24.816 1.00 21.23 C ATOM 42 C TYR A 7 -20.910 6.735 -26.191 1.00 22.41 C ATOM 43 O TYR A 7 -20.188 6.141 -27.000 1.00 19.82 O ATOM 44 CB TYR A 7 -20.227 6.756 -23.798 1.00 24.60 C ATOM 45 CG TYR A 7 -20.641 6.560 -22.376 1.00 30.21 C ATOM 46 CD1 TYR A 7 -20.331 5.387 -21.700 1.00 33.60 C ATOM 47 CD2 TYR A 7 -21.343 7.544 -21.697 1.00 30.66 C ATOM 48 CE1 TYR A 7 -20.719 5.195 -20.385 1.00 36.07 C ATOM 49 CE2 TYR A 7 -21.733 7.361 -20.382 1.00 36.23 C ATOM 50 CZ TYR A 7 -21.420 6.184 -19.732 1.00 40.74 C ATOM 51 OH TYR A 7 -21.806 5.999 -18.423 1.00 50.96 O ATOM 52 HH TYR A 7 -21.503 5.109 -18.114 1.00 0.00 H ATOM 53 H TYR A 7 -20.320 4.284 -25.440 1.00 0.00 H ATOM 54 N THR A 8 -21.476 7.908 -26.450 1.00 17.76 N ATOM 55 CA THR A 8 -21.204 8.629 -27.675 1.00 16.65 C ATOM 56 C THR A 8 -20.529 9.952 -27.352 1.00 19.02 C ATOM 57 O THR A 8 -20.668 10.497 -26.251 1.00 19.05 O ATOM 58 CB THR A 8 -22.476 8.886 -28.498 1.00 25.32 C ATOM 59 OG1 THR A 8 -23.418 9.638 -27.725 1.00 21.56 O ATOM 60 CG2 THR A 8 -23.106 7.566 -28.933 1.00 21.29 C ATOM 61 HG1 THR A 8 -23.655 9.129 -26.910 1.00 0.00 H ATOM 62 H THR A 8 -22.131 8.319 -25.755 1.00 0.00 H ATOM 63 N LEU A 9 -19.802 10.461 -28.338 1.00 18.70 N ATOM 64 CA LEU A 9 -19.098 11.729 -28.215 1.00 19.46 C ATOM 65 C LEU A 9 -19.047 12.328 -29.607 1.00 19.19 C ATOM 66 O LEU A 9 -18.574 11.668 -30.532 1.00 19.94 O ATOM 67 CB LEU A 9 -17.695 11.514 -27.649 1.00 20.65 C ATOM 68 CG LEU A 9 -16.826 12.757 -27.465 1.00 22.19 C ATOM 69 CD1 LEU A 9 -17.498 13.716 -26.503 1.00 21.38 C ATOM 70 CD2 LEU A 9 -15.443 12.379 -26.961 1.00 27.95 C ATOM 71 H LEU A 9 -19.732 9.934 -29.232 1.00 0.00 H ATOM 72 N VAL A 10 -19.566 13.546 -29.766 1.00 18.25 N ATOM 73 CA VAL A 10 -19.723 14.167 -31.077 1.00 20.47 C ATOM 74 C VAL A 10 -18.972 15.483 -31.078 1.00 22.10 C ATOM 75 O VAL A 10 -19.172 16.316 -30.190 1.00 18.77 O ATOM 76 CB VAL A 10 -21.200 14.396 -31.446 1.00 20.50 C ATOM 77 CG1 VAL A 10 -21.287 15.082 -32.785 1.00 19.41 C ATOM 78 CG2 VAL A 10 -21.960 13.078 -31.486 1.00 21.06 C ATOM 79 H VAL A 10 -19.871 14.074 -28.923 1.00 0.00 H ATOM 80 N LEU A 11 -18.101 15.662 -32.063 1.00 18.55 N ATOM 81 CA LEU A 11 -17.353 16.900 -32.221 1.00 18.03 C ATOM 82 C LEU A 11 -17.847 17.601 -33.475 1.00 21.31 C ATOM 83 O LEU A 11 -17.765 17.041 -34.575 1.00 23.59 O ATOM 84 CB LEU A 11 -15.857 16.630 -32.316 1.00 20.17 C ATOM 85 CG LEU A 11 -15.161 16.202 -31.022 1.00 23.00 C ATOM 86 CD1 LEU A 11 -15.506 17.130 -29.858 1.00 21.90 C ATOM 87 CD2 LEU A 11 -15.504 14.771 -30.706 1.00 23.62 C ATOM 88 H LEU A 11 -17.948 14.892 -32.745 1.00 0.00 H ATOM 89 N VAL A 12 -18.358 18.814 -33.310 1.00 21.17 N ATOM 90 CA VAL A 12 -18.711 19.665 -34.440 1.00 17.52 C ATOM 91 C VAL A 12 -17.423 20.346 -34.888 1.00 22.85 C ATOM 92 O VAL A 12 -16.947 21.279 -34.239 1.00 19.37 O ATOM 93 CB VAL A 12 -19.787 20.685 -34.074 1.00 21.12 C ATOM 94 CG1 VAL A 12 -19.986 21.660 -35.217 1.00 25.77 C ATOM 95 CG2 VAL A 12 -21.110 19.959 -33.744 1.00 25.20 C ATOM 96 H VAL A 12 -18.512 19.169 -32.345 1.00 0.00 H ATOM 97 N LEU A 13 -16.873 19.892 -36.007 1.00 23.42 N ATOM 98 CA LEU A 13 -15.574 20.339 -36.501 1.00 27.98 C ATOM 99 C LEU A 13 -15.778 20.999 -37.856 1.00 28.04 C ATOM 100 O LEU A 13 -16.146 20.330 -38.828 1.00 29.27 O ATOM 101 CB LEU A 13 -14.602 19.161 -36.603 1.00 22.71 C ATOM 102 CG LEU A 13 -13.175 19.415 -37.110 1.00 32.75 C ATOM 103 CD1 LEU A 13 -12.500 20.495 -36.291 1.00 28.45 C ATOM 104 CD2 LEU A 13 -12.356 18.120 -37.055 1.00 24.05 C ATOM 105 H LEU A 13 -17.394 19.182 -36.560 1.00 0.00 H ATOM 106 N GLN A 14 -15.539 22.299 -37.919 1.00 27.22 N ATOM 107 CA GLN A 14 -15.524 23.056 -39.160 1.00 29.08 C ATOM 108 C GLN A 14 -14.088 23.364 -39.562 1.00 30.04 C ATOM 109 O GLN A 14 -13.159 23.177 -38.773 1.00 30.87 O ATOM 110 CB GLN A 14 -16.344 24.336 -38.991 1.00 28.86 C ATOM 111 CG GLN A 14 -17.830 24.001 -38.910 1.00 36.94 C ATOM 112 CD GLN A 14 -18.712 25.167 -38.546 1.00 30.14 C ATOM 113 OE1 GLN A 14 -18.248 26.197 -38.085 1.00 35.19 O ATOM 114 NE2 GLN A 14 -20.013 24.991 -38.732 1.00 34.61 N ATOM 115 HE22 GLN A 14 -20.365 24.096 -39.128 1.00 0.00 H ATOM 116 HE21 GLN A 14 -20.681 25.748 -38.482 1.00 0.00 H ATOM 117 H GLN A 14 -15.351 22.807 -37.031 1.00 0.00 H ATOM 118 N PRO A 15 -13.859 23.808 -40.796 1.00 32.44 N ATOM 119 CA PRO A 15 -12.472 23.924 -41.279 1.00 35.38 C ATOM 120 C PRO A 15 -11.566 24.752 -40.375 1.00 33.93 C ATOM 121 O PRO A 15 -10.388 24.407 -40.229 1.00 38.83 O ATOM 122 CB PRO A 15 -12.643 24.558 -42.667 1.00 37.58 C ATOM 123 CG PRO A 15 -14.005 24.092 -43.113 1.00 32.89 C ATOM 124 CD PRO A 15 -14.838 24.138 -41.851 1.00 39.11 C ATOM 125 N GLN A 16 -12.066 25.812 -39.737 1.00 30.21 N ATOM 126 CA GLN A 16 -11.206 26.657 -38.914 1.00 33.17 C ATOM 127 C GLN A 16 -11.513 26.623 -37.420 1.00 32.28 C ATOM 128 O GLN A 16 -10.748 27.208 -36.640 1.00 29.30 O ATOM 129 CB GLN A 16 -11.281 28.116 -39.398 1.00 39.98 C ATOM 130 H GLN A 16 -13.077 26.038 -39.827 1.00 0.00 H ATOM 131 N ARG A 17 -12.588 25.956 -36.993 1.00 24.69 N ATOM 132 CA ARG A 17 -13.003 26.006 -35.598 1.00 25.36 C ATOM 133 C ARG A 17 -13.634 24.676 -35.198 1.00 23.13 C ATOM 134 O ARG A 17 -14.062 23.892 -36.047 1.00 24.45 O ATOM 135 CB ARG A 17 -13.987 27.159 -35.351 1.00 29.42 C ATOM 136 CG ARG A 17 -15.263 27.109 -36.190 1.00 29.78 C ATOM 137 CD ARG A 17 -16.136 28.370 -35.990 1.00 31.20 C ATOM 138 NE ARG A 17 -17.450 28.220 -36.632 1.00 40.38 N ATOM 139 CZ ARG A 17 -18.488 29.039 -36.458 1.00 32.24 C ATOM 140 NH1 ARG A 17 -18.392 30.087 -35.651 1.00 34.72 N ATOM 141 NH2 ARG A 17 -19.629 28.803 -37.092 1.00 38.01 N ATOM 142 HE ARG A 17 -17.580 27.411 -37.273 1.00 0.00 H ATOM 143 HH12 ARG A 17 -19.207 30.720 -35.522 1.00 0.00 H ATOM 144 HH11 ARG A 17 -17.502 30.276 -35.147 1.00 0.00 H ATOM 145 HH22 ARG A 17 -20.440 29.440 -36.958 1.00 0.00 H ATOM 146 HH21 ARG A 17 -19.713 27.981 -37.723 1.00 0.00 H ATOM 147 H ARG A 17 -13.139 25.390 -37.669 1.00 0.00 H ATOM 148 N VAL A 18 -13.678 24.433 -33.885 1.00 21.55 N ATOM 149 CA VAL A 18 -14.368 23.284 -33.301 1.00 21.01 C ATOM 150 C VAL A 18 -15.222 23.759 -32.128 1.00 19.19 C ATOM 151 O VAL A 18 -14.829 24.667 -31.384 1.00 16.68 O ATOM 152 CB VAL A 18 -13.374 22.197 -32.831 1.00 20.06 C ATOM 153 CG1 VAL A 18 -12.443 22.745 -31.778 1.00 19.90 C ATOM 154 CG2 VAL A 18 -14.138 20.984 -32.287 1.00 20.91 C ATOM 155 H VAL A 18 -13.196 25.096 -33.245 1.00 0.00 H ATOM 156 N LEU A 19 -16.374 23.119 -31.944 1.00 18.53 N ATOM 157 CA LEU A 19 -17.299 23.467 -30.866 1.00 17.26 C ATOM 158 C LEU A 19 -17.050 22.563 -29.671 1.00 16.48 C ATOM 159 O LEU A 19 -17.039 21.336 -29.805 1.00 20.82 O ATOM 160 CB LEU A 19 -18.755 23.327 -31.330 1.00 16.13 C ATOM 161 CG LEU A 19 -19.855 23.789 -30.377 1.00 19.51 C ATOM 162 CD1 LEU A 19 -19.793 25.308 -30.185 1.00 17.83 C ATOM 163 CD2 LEU A 19 -21.255 23.346 -30.910 1.00 18.22 C ATOM 164 H LEU A 19 -16.626 22.344 -32.590 1.00 0.00 H ATOM 165 N LEU A 20 -16.855 23.164 -28.508 1.00 15.36 N ATOM 166 CA LEU A 20 -16.762 22.418 -27.264 1.00 17.75 C ATOM 167 C LEU A 20 -17.783 22.993 -26.282 1.00 19.73 C ATOM 168 O LEU A 20 -18.222 24.135 -26.408 1.00 20.87 O ATOM 169 CB LEU A 20 -15.337 22.467 -26.673 1.00 15.15 C ATOM 170 CG LEU A 20 -14.268 21.816 -27.574 1.00 17.20 C ATOM 171 CD1 LEU A 20 -12.811 22.203 -27.186 1.00 15.11 C ATOM 172 CD2 LEU A 20 -14.441 20.293 -27.594 1.00 18.79 C ATOM 173 H LEU A 20 -16.766 24.200 -28.484 1.00 0.00 H ATOM 174 N GLY A 21 -18.148 22.199 -25.293 1.00 18.16 N ATOM 175 CA GLY A 21 -19.041 22.685 -24.253 1.00 21.39 C ATOM 176 C GLY A 21 -18.461 22.503 -22.866 1.00 22.91 C ATOM 177 O GLY A 21 -17.880 21.455 -22.552 1.00 21.35 O ATOM 178 H GLY A 21 -17.795 21.221 -25.257 1.00 0.00 H ATOM 179 N MET A 22 -18.583 23.533 -22.038 1.00 20.30 N ATOM 180 CA MET A 22 -18.135 23.478 -20.651 1.00 25.99 C ATOM 181 C MET A 22 -19.285 22.994 -19.772 1.00 29.90 C ATOM 182 O MET A 22 -20.335 23.641 -19.700 1.00 24.59 O ATOM 183 CB MET A 22 -17.639 24.848 -20.196 1.00 26.42 C ATOM 184 CG MET A 22 -17.479 25.011 -18.678 1.00 33.71 C ATOM 185 SD MET A 22 -16.270 23.883 -17.962 1.00 40.60 S ATOM 186 CE MET A 22 -14.739 24.606 -18.577 1.00 33.34 C ATOM 187 H MET A 22 -19.014 24.411 -22.391 1.00 0.00 H ATOM 188 N LYS A 23 -19.101 21.837 -19.143 1.00 32.38 N ATOM 189 CA LYS A 23 -20.084 21.321 -18.203 1.00 32.13 C ATOM 190 C LYS A 23 -20.106 22.184 -16.944 1.00 38.89 C ATOM 191 O LYS A 23 -19.060 22.458 -16.348 1.00 39.43 O ATOM 192 CB LYS A 23 -19.747 19.874 -17.845 1.00 41.47 C ATOM 193 CG LYS A 23 -20.885 19.101 -17.208 1.00 43.25 C ATOM 194 CD LYS A 23 -21.911 18.666 -18.249 1.00 43.55 C ATOM 195 CE LYS A 23 -22.949 17.749 -17.619 1.00 44.02 C ATOM 196 NZ LYS A 23 -22.303 16.680 -16.797 1.00 38.66 N ATOM 197 HZ1 LYS A 23 -21.680 16.108 -17.402 1.00 0.00 H ATOM 198 HZ2 LYS A 23 -21.744 17.119 -16.038 1.00 0.00 H ATOM 199 HZ3 LYS A 23 -23.038 16.072 -16.382 1.00 0.00 H ATOM 200 H LYS A 23 -18.236 21.289 -19.327 1.00 0.00 H ATOM 201 N LYS A 24 -21.294 22.622 -16.536 1.00 38.12 N ATOM 202 CA LYS A 24 -21.419 23.432 -15.329 1.00 33.62 C ATOM 203 C LYS A 24 -21.632 22.591 -14.073 1.00 38.56 C ATOM 204 O LYS A 24 -21.734 23.152 -12.980 1.00 43.77 O ATOM 205 CB LYS A 24 -22.556 24.446 -15.485 1.00 37.58 C ATOM 206 CG LYS A 24 -22.339 25.467 -16.611 1.00 38.10 C ATOM 207 CD LYS A 24 -23.554 26.385 -16.753 1.00 40.70 C ATOM 208 CE LYS A 24 -23.617 27.033 -18.131 1.00 33.50 C ATOM 209 H LYS A 24 -22.145 22.384 -17.085 1.00 0.00 H ATOM 210 N ARG A 25 -21.687 21.269 -14.194 1.00 39.05 N ATOM 211 CA ARG A 25 -21.831 20.399 -13.033 1.00 41.63 C ATOM 212 C ARG A 25 -22.017 18.975 -13.535 1.00 45.60 C ATOM 213 O ARG A 25 -22.225 18.743 -14.730 1.00 41.09 O ATOM 214 H ARG A 25 -21.626 20.844 -15.141 1.00 0.00 H ATOM 215 N GLY A 26 -21.942 18.019 -12.598 1.00 47.70 N ATOM 216 CA GLY A 26 -22.027 16.611 -12.936 1.00 45.29 C ATOM 217 C GLY A 26 -20.795 16.143 -13.694 1.00 50.65 C ATOM 218 O GLY A 26 -19.744 16.789 -13.694 1.00 55.66 O ATOM 219 H GLY A 26 -21.820 18.294 -11.603 1.00 0.00 H ATOM 220 N PHE A 27 -20.938 14.991 -14.348 1.00 50.39 N ATOM 221 CA PHE A 27 -19.872 14.413 -15.162 1.00 51.53 C ATOM 222 C PHE A 27 -19.208 15.470 -16.037 1.00 48.43 C ATOM 223 O PHE A 27 -19.849 16.055 -16.915 1.00 45.71 O ATOM 224 CB PHE A 27 -20.444 13.295 -16.042 1.00 50.55 C ATOM 225 CG PHE A 27 -19.394 12.454 -16.721 1.00 52.58 C ATOM 226 CD1 PHE A 27 -18.130 12.321 -16.174 1.00 54.72 C ATOM 227 CD2 PHE A 27 -19.675 11.799 -17.912 1.00 54.31 C ATOM 228 CE1 PHE A 27 -17.163 11.545 -16.798 1.00 53.03 C ATOM 229 CE2 PHE A 27 -18.712 11.019 -18.545 1.00 46.88 C ATOM 230 CZ PHE A 27 -17.456 10.891 -17.986 1.00 50.15 C ATOM 231 H PHE A 27 -21.843 14.484 -14.276 1.00 0.00 H ATOM 232 N GLY A 28 -17.922 15.725 -15.791 1.00 48.47 N ATOM 233 CA GLY A 28 -17.167 16.640 -16.624 1.00 38.97 C ATOM 234 C GLY A 28 -17.273 18.109 -16.275 1.00 43.73 C ATOM 235 O GLY A 28 -16.935 18.955 -17.106 1.00 47.52 O ATOM 236 H GLY A 28 -17.453 15.259 -14.988 1.00 0.00 H ATOM 237 N ALA A 29 -17.727 18.453 -15.076 1.00 43.68 N ATOM 238 CA ALA A 29 -17.822 19.862 -14.725 1.00 46.04 C ATOM 239 C ALA A 29 -16.443 20.513 -14.741 1.00 43.47 C ATOM 240 O ALA A 29 -15.455 19.925 -14.294 1.00 45.49 O ATOM 241 CB ALA A 29 -18.469 20.032 -13.348 1.00 44.45 C ATOM 242 H ALA A 29 -18.012 17.722 -14.394 1.00 0.00 H ATOM 243 N GLY A 30 -16.377 21.737 -15.257 1.00 38.22 N ATOM 244 CA GLY A 30 -15.136 22.484 -15.269 1.00 44.30 C ATOM 245 C GLY A 30 -14.131 22.098 -16.340 1.00 40.54 C ATOM 246 O GLY A 30 -13.032 22.670 -16.360 1.00 44.86 O ATOM 247 H GLY A 30 -17.234 22.167 -15.660 1.00 0.00 H ATOM 248 N ARG A 31 -14.458 21.154 -17.223 1.00 36.04 N ATOM 249 CA ARG A 31 -13.640 20.834 -18.384 1.00 30.46 C ATOM 250 C ARG A 31 -14.428 21.060 -19.669 1.00 30.91 C ATOM 251 O ARG A 31 -15.655 20.989 -19.680 1.00 29.69 O ATOM 252 CB ARG A 31 -13.158 19.385 -18.342 1.00 30.78 C ATOM 253 CG ARG A 31 -12.299 19.044 -17.132 1.00 35.05 C ATOM 254 CD ARG A 31 -12.314 17.544 -16.926 1.00 39.85 C ATOM 255 NE ARG A 31 -11.741 17.139 -15.647 1.00 49.93 N ATOM 256 CZ ARG A 31 -10.439 16.978 -15.430 1.00 47.55 C ATOM 257 NH1 ARG A 31 -9.567 17.196 -16.405 1.00 39.14 N ATOM 258 NH2 ARG A 31 -10.011 16.597 -14.233 1.00 54.10 N ATOM 259 HE ARG A 31 -12.392 16.965 -14.855 1.00 0.00 H ATOM 260 HH12 ARG A 31 -8.550 17.069 -16.231 1.00 0.00 H ATOM 261 HH11 ARG A 31 -9.901 17.494 -17.344 1.00 0.00 H ATOM 262 HH22 ARG A 31 -8.993 16.470 -14.061 1.00 0.00 H ATOM 263 HH21 ARG A 31 -10.693 16.425 -13.467 1.00 0.00 H ATOM 264 H ARG A 31 -15.339 20.621 -17.075 1.00 0.00 H ATOM 265 N TRP A 32 -13.714 21.336 -20.762 1.00 20.72 N ATOM 266 CA TRP A 32 -14.339 21.440 -22.076 1.00 20.63 C ATOM 267 C TRP A 32 -14.475 20.046 -22.668 1.00 22.45 C ATOM 268 O TRP A 32 -13.522 19.263 -22.638 1.00 25.06 O ATOM 269 CB TRP A 32 -13.535 22.355 -23.003 1.00 22.04 C ATOM 270 CG TRP A 32 -13.492 23.777 -22.505 1.00 21.75 C ATOM 271 CD1 TRP A 32 -12.514 24.356 -21.734 1.00 22.30 C ATOM 272 CD2 TRP A 32 -14.490 24.785 -22.719 1.00 18.96 C ATOM 273 NE1 TRP A 32 -12.844 25.679 -21.470 1.00 22.82 N ATOM 274 CE2 TRP A 32 -14.054 25.958 -22.060 1.00 21.17 C ATOM 275 CE3 TRP A 32 -15.719 24.806 -23.404 1.00 19.54 C ATOM 276 CZ2 TRP A 32 -14.795 27.145 -22.076 1.00 22.16 C ATOM 277 CZ3 TRP A 32 -16.463 25.989 -23.410 1.00 20.41 C ATOM 278 CH2 TRP A 32 -15.996 27.138 -22.748 1.00 25.24 C ATOM 279 HE1 TRP A 32 -12.271 26.348 -20.917 1.00 0.00 H ATOM 280 H TRP A 32 -12.688 21.480 -20.675 1.00 0.00 H ATOM 281 N ASN A 33 -15.675 19.739 -23.174 1.00 24.32 N ATOM 282 CA ASN A 33 -16.096 18.404 -23.592 1.00 24.98 C ATOM 283 C ASN A 33 -16.737 18.467 -24.973 1.00 24.38 C ATOM 284 O ASN A 33 -17.335 19.476 -25.346 1.00 18.61 O ATOM 285 CB ASN A 33 -17.158 17.805 -22.631 1.00 29.03 C ATOM 286 CG ASN A 33 -16.625 17.526 -21.235 1.00 31.22 C ATOM 287 OD1 ASN A 33 -16.117 16.449 -20.968 1.00 39.37 O ATOM 288 ND2 ASN A 33 -16.789 18.485 -20.327 1.00 38.90 N ATOM 289 HD22 ASN A 33 -17.227 19.388 -20.598 1.00 0.00 H ATOM 290 HD21 ASN A 33 -16.479 18.331 -19.346 1.00 0.00 H ATOM 291 H ASN A 33 -16.363 20.512 -23.278 1.00 0.00 H ATOM 292 N GLY A 34 -16.649 17.366 -25.715 1.00 22.86 N ATOM 293 CA GLY A 34 -17.579 17.143 -26.802 1.00 19.11 C ATOM 294 C GLY A 34 -18.964 16.840 -26.236 1.00 20.73 C ATOM 295 O GLY A 34 -19.172 16.758 -25.027 1.00 21.19 O ATOM 296 H GLY A 34 -15.909 16.663 -25.513 1.00 0.00 H ATOM 297 N PHE A 35 -19.926 16.653 -27.133 1.00 16.75 N ATOM 298 CA PHE A 35 -21.312 16.406 -26.746 1.00 15.13 C ATOM 299 C PHE A 35 -21.655 14.926 -26.854 1.00 21.09 C ATOM 300 O PHE A 35 -21.368 14.295 -27.872 1.00 22.70 O ATOM 301 CB PHE A 35 -22.248 17.227 -27.625 1.00 16.11 C ATOM 302 CG PHE A 35 -21.971 18.686 -27.553 1.00 20.10 C ATOM 303 CD1 PHE A 35 -22.439 19.437 -26.482 1.00 20.44 C ATOM 304 CD2 PHE A 35 -21.216 19.301 -28.530 1.00 19.65 C ATOM 305 CE1 PHE A 35 -22.173 20.786 -26.411 1.00 23.06 C ATOM 306 CE2 PHE A 35 -20.942 20.651 -28.466 1.00 22.93 C ATOM 307 CZ PHE A 35 -21.413 21.394 -27.408 1.00 18.83 C ATOM 308 H PHE A 35 -19.684 16.684 -28.144 1.00 0.00 H ATOM 309 N GLY A 36 -22.287 14.380 -25.829 1.00 23.57 N ATOM 310 CA GLY A 36 -22.621 12.968 -25.878 1.00 26.39 C ATOM 311 C GLY A 36 -23.182 12.484 -24.563 1.00 26.40 C ATOM 312 O GLY A 36 -23.527 13.268 -23.674 1.00 25.24 O ATOM 313 H GLY A 36 -22.541 14.954 -25.000 1.00 0.00 H ATOM 314 N GLY A 37 -23.250 11.159 -24.449 1.00 24.08 N ATOM 315 CA GLY A 37 -23.909 10.525 -23.336 1.00 25.63 C ATOM 316 C GLY A 37 -24.213 9.071 -23.673 1.00 27.00 C ATOM 317 O GLY A 37 -23.744 8.535 -24.679 1.00 20.24 O ATOM 318 H GLY A 37 -22.815 10.565 -25.184 1.00 0.00 H ATOM 319 N LYS A 38 -25.009 8.461 -22.805 1.00 24.44 N ATOM 320 CA LYS A 38 -25.296 7.041 -22.919 1.00 24.95 C ATOM 321 C LYS A 38 -26.259 6.775 -24.072 1.00 23.28 C ATOM 322 O LYS A 38 -27.023 7.642 -24.495 1.00 28.54 O ATOM 323 CB LYS A 38 -25.889 6.510 -21.614 1.00 31.77 C ATOM 324 CG LYS A 38 -24.917 6.472 -20.439 1.00 34.18 C ATOM 325 H LYS A 38 -25.435 9.008 -22.030 1.00 0.00 H ATOM 326 N VAL A 39 -26.223 5.550 -24.564 1.00 29.32 N ATOM 327 CA VAL A 39 -27.104 5.079 -25.627 1.00 22.56 C ATOM 328 C VAL A 39 -28.277 4.335 -24.999 1.00 29.49 C ATOM 329 O VAL A 39 -28.104 3.574 -24.031 1.00 26.11 O ATOM 330 CB VAL A 39 -26.337 4.158 -26.600 1.00 27.77 C ATOM 331 CG1 VAL A 39 -27.228 3.753 -27.774 1.00 23.48 C ATOM 332 CG2 VAL A 39 -25.061 4.826 -27.095 1.00 26.85 C ATOM 333 H VAL A 39 -25.528 4.884 -24.172 1.00 0.00 H ATOM 334 N GLN A 40 -29.463 4.521 -25.569 1.00 26.91 N ATOM 335 CA GLN A 40 -30.690 3.929 -25.053 1.00 28.56 C ATOM 336 C GLN A 40 -30.897 2.514 -25.597 1.00 26.13 C ATOM 337 O GLN A 40 -30.398 2.146 -26.664 1.00 23.74 O ATOM 338 CB GLN A 40 -31.895 4.811 -25.419 1.00 33.57 C ATOM 339 CG GLN A 40 -31.820 6.230 -24.831 1.00 35.38 C ATOM 340 CD GLN A 40 -32.962 7.145 -25.261 1.00 41.34 C ATOM 341 OE1 GLN A 40 -33.948 6.713 -25.865 1.00 44.26 O ATOM 342 NE2 GLN A 40 -32.824 8.429 -24.947 1.00 46.89 N ATOM 343 HE22 GLN A 40 -31.977 8.752 -24.437 1.00 0.00 H ATOM 344 HE21 GLN A 40 -33.563 9.111 -25.211 1.00 0.00 H ATOM 345 H GLN A 40 -29.518 5.115 -26.421 1.00 0.00 H ATOM 346 N GLU A 41 -31.659 1.719 -24.846 1.00 29.97 N ATOM 347 CA GLU A 41 -32.091 0.420 -25.345 1.00 26.89 C ATOM 348 C GLU A 41 -32.883 0.600 -26.636 1.00 24.20 C ATOM 349 O GLU A 41 -33.690 1.528 -26.768 1.00 25.87 O ATOM 350 CB GLU A 41 -32.928 -0.307 -24.275 1.00 27.56 C ATOM 351 CG GLU A 41 -32.130 -0.652 -23.016 1.00 29.38 C ATOM 352 CD GLU A 41 -32.952 -1.284 -21.891 1.00 43.05 C ATOM 353 OE1 GLU A 41 -34.200 -1.317 -21.987 1.00 36.16 O ATOM 354 OE2 GLU A 41 -32.337 -1.749 -20.898 1.00 40.61 O ATOM 355 H GLU A 41 -31.948 2.028 -23.896 1.00 0.00 H ATOM 356 N GLY A 42 -32.619 -0.271 -27.609 1.00 22.06 N ATOM 357 CA GLY A 42 -33.310 -0.211 -28.882 1.00 27.26 C ATOM 358 C GLY A 42 -32.885 0.917 -29.793 1.00 29.11 C ATOM 359 O GLY A 42 -33.536 1.143 -30.816 1.00 27.58 O ATOM 360 H GLY A 42 -31.903 -1.009 -27.452 1.00 0.00 H ATOM 361 N GLU A 43 -31.811 1.627 -29.454 1.00 25.01 N ATOM 362 CA GLU A 43 -31.336 2.781 -30.205 1.00 26.52 C ATOM 363 C GLU A 43 -29.960 2.447 -30.770 1.00 26.37 C ATOM 364 O GLU A 43 -29.105 1.933 -30.043 1.00 26.08 O ATOM 365 CB GLU A 43 -31.285 4.012 -29.285 1.00 27.26 C ATOM 366 CG GLU A 43 -30.337 5.145 -29.697 1.00 31.55 C ATOM 367 CD GLU A 43 -30.416 6.363 -28.763 1.00 28.37 C ATOM 368 OE1 GLU A 43 -31.111 7.341 -29.097 1.00 31.62 O ATOM 369 OE2 GLU A 43 -29.798 6.335 -27.680 1.00 28.12 O ATOM 370 H GLU A 43 -31.282 1.342 -28.606 1.00 0.00 H ATOM 371 N THR A 44 -29.752 2.691 -32.063 1.00 26.13 N ATOM 372 CA THR A 44 -28.416 2.459 -32.599 1.00 26.03 C ATOM 373 C THR A 44 -27.458 3.525 -32.074 1.00 26.03 C ATOM 374 O THR A 44 -27.866 4.566 -31.547 1.00 22.76 O ATOM 375 CB THR A 44 -28.397 2.453 -34.132 1.00 28.05 C ATOM 376 OG1 THR A 44 -28.733 3.750 -34.643 1.00 31.68 O ATOM 377 CG2 THR A 44 -29.367 1.408 -34.693 1.00 31.55 C ATOM 378 HG1 THR A 44 -28.716 3.728 -35.633 1.00 0.00 H ATOM 379 H THR A 44 -30.520 3.037 -32.673 1.00 0.00 H ATOM 380 N ILE A 45 -26.163 3.244 -32.205 1.00 25.83 N ATOM 381 CA ILE A 45 -25.159 4.162 -31.679 1.00 26.76 C ATOM 382 C ILE A 45 -25.227 5.502 -32.416 1.00 24.28 C ATOM 383 O ILE A 45 -25.191 6.574 -31.802 1.00 26.05 O ATOM 384 CB ILE A 45 -23.763 3.521 -31.758 1.00 25.77 C ATOM 385 CG1 ILE A 45 -23.731 2.248 -30.909 1.00 32.87 C ATOM 386 CG2 ILE A 45 -22.685 4.492 -31.265 1.00 28.92 C ATOM 387 CD1 ILE A 45 -22.407 1.541 -30.899 1.00 31.41 C ATOM 388 H ILE A 45 -25.867 2.369 -32.683 1.00 0.00 H ATOM 389 N GLU A 46 -25.343 5.456 -33.745 1.00 29.10 N ATOM 390 CA GLU A 46 -25.428 6.686 -34.532 1.00 26.80 C ATOM 391 C GLU A 46 -26.654 7.503 -34.154 1.00 27.42 C ATOM 392 O GLU A 46 -26.603 8.744 -34.126 1.00 22.90 O ATOM 393 CB GLU A 46 -25.457 6.345 -36.023 1.00 32.66 C ATOM 394 H GLU A 46 -25.373 4.535 -34.227 1.00 0.00 H ATOM 395 N ASP A 47 -27.779 6.828 -33.892 1.00 24.91 N ATOM 396 CA ASP A 47 -28.971 7.541 -33.451 1.00 26.09 C ATOM 397 C ASP A 47 -28.763 8.154 -32.069 1.00 23.41 C ATOM 398 O ASP A 47 -29.171 9.296 -31.820 1.00 24.15 O ATOM 399 CB ASP A 47 -30.191 6.598 -33.458 1.00 28.50 C ATOM 400 CG ASP A 47 -30.627 6.188 -34.878 1.00 35.62 C ATOM 401 OD1 ASP A 47 -30.542 7.020 -35.803 1.00 39.29 O ATOM 402 OD2 ASP A 47 -31.073 5.030 -35.073 1.00 41.43 O ATOM 403 H ASP A 47 -27.803 5.794 -34.003 1.00 0.00 H ATOM 404 N GLY A 48 -28.124 7.422 -31.154 1.00 22.91 N ATOM 405 CA GLY A 48 -27.827 8.007 -29.853 1.00 23.83 C ATOM 406 C GLY A 48 -26.959 9.249 -29.961 1.00 22.75 C ATOM 407 O GLY A 48 -27.161 10.235 -29.244 1.00 24.15 O ATOM 408 H GLY A 48 -27.841 6.444 -31.367 1.00 0.00 H ATOM 409 N ALA A 49 -25.985 9.224 -30.864 1.00 20.24 N ATOM 410 CA ALA A 49 -25.099 10.374 -31.032 1.00 23.73 C ATOM 411 C ALA A 49 -25.850 11.580 -31.589 1.00 24.06 C ATOM 412 O ALA A 49 -25.657 12.714 -31.127 1.00 24.29 O ATOM 413 CB ALA A 49 -23.931 9.989 -31.944 1.00 22.31 C ATOM 414 H ALA A 49 -25.852 8.379 -31.456 1.00 0.00 H ATOM 415 N ARG A 50 -26.718 11.361 -32.578 1.00 23.39 N ATOM 416 CA ARG A 50 -27.484 12.473 -33.127 1.00 23.47 C ATOM 417 C ARG A 50 -28.348 13.107 -32.045 1.00 25.34 C ATOM 418 O ARG A 50 -28.363 14.335 -31.877 1.00 22.42 O ATOM 419 CB ARG A 50 -28.330 11.983 -34.305 1.00 25.95 C ATOM 420 CG ARG A 50 -29.086 13.077 -35.051 1.00 35.44 C ATOM 421 CD ARG A 50 -29.819 12.501 -36.267 1.00 40.98 C ATOM 422 NE ARG A 50 -29.129 11.321 -36.801 1.00 44.96 N ATOM 423 CZ ARG A 50 -28.250 11.345 -37.796 1.00 40.00 C ATOM 424 NH1 ARG A 50 -27.936 12.487 -38.391 1.00 45.28 N ATOM 425 NH2 ARG A 50 -27.681 10.221 -38.200 1.00 46.26 N ATOM 426 HE ARG A 50 -29.344 10.400 -36.369 1.00 0.00 H ATOM 427 HH12 ARG A 50 -27.246 12.495 -39.169 1.00 0.00 H ATOM 428 HH11 ARG A 50 -28.379 13.375 -38.079 1.00 0.00 H ATOM 429 HH22 ARG A 50 -26.992 10.238 -38.979 1.00 0.00 H ATOM 430 HH21 ARG A 50 -27.922 9.321 -37.738 1.00 0.00 H ATOM 431 H ARG A 50 -26.848 10.401 -32.956 1.00 0.00 H ATOM 432 N ARG A 51 -29.059 12.270 -31.280 1.00 23.34 N ATOM 433 CA ARG A 51 -29.913 12.762 -30.203 1.00 29.18 C ATOM 434 C ARG A 51 -29.102 13.516 -29.154 1.00 25.58 C ATOM 435 O ARG A 51 -29.474 14.618 -28.743 1.00 26.74 O ATOM 436 CB ARG A 51 -30.675 11.592 -29.563 1.00 29.44 C ATOM 437 CG ARG A 51 -31.433 11.948 -28.274 1.00 32.44 C ATOM 438 CD ARG A 51 -32.114 10.717 -27.652 1.00 33.53 C ATOM 439 NE ARG A 51 -31.149 9.656 -27.359 1.00 33.08 N ATOM 440 CZ ARG A 51 -30.330 9.671 -26.310 1.00 33.69 C ATOM 441 NH1 ARG A 51 -30.372 10.683 -25.452 1.00 33.35 N ATOM 442 NH2 ARG A 51 -29.468 8.679 -26.114 1.00 32.08 N ATOM 443 HE ARG A 51 -31.101 8.844 -28.007 1.00 0.00 H ATOM 444 HH12 ARG A 51 -29.733 10.696 -24.632 1.00 0.00 H ATOM 445 HH11 ARG A 51 -31.044 11.463 -25.600 1.00 0.00 H ATOM 446 HH22 ARG A 51 -28.831 8.698 -25.292 1.00 0.00 H ATOM 447 HH21 ARG A 51 -29.430 7.883 -26.783 1.00 0.00 H ATOM 448 H ARG A 51 -29.002 11.247 -31.457 1.00 0.00 H ATOM 449 N GLU A 52 -27.983 12.935 -28.709 1.00 23.53 N ATOM 450 CA GLU A 52 -27.164 13.591 -27.690 1.00 25.77 C ATOM 451 C GLU A 52 -26.648 14.945 -28.165 1.00 25.51 C ATOM 452 O GLU A 52 -26.657 15.918 -27.401 1.00 25.33 O ATOM 453 CB GLU A 52 -25.985 12.695 -27.284 1.00 24.25 C ATOM 454 CG GLU A 52 -26.356 11.610 -26.286 1.00 32.89 C ATOM 455 CD GLU A 52 -27.079 12.167 -25.076 1.00 37.35 C ATOM 456 OE1 GLU A 52 -26.480 12.227 -23.980 1.00 44.63 O ATOM 457 OE2 GLU A 52 -28.251 12.568 -25.225 1.00 45.99 O ATOM 458 H GLU A 52 -27.693 12.011 -29.090 1.00 0.00 H ATOM 459 N LEU A 53 -26.167 15.030 -29.405 1.00 21.18 N ATOM 460 CA LEU A 53 -25.715 16.325 -29.907 1.00 21.99 C ATOM 461 C LEU A 53 -26.855 17.336 -29.897 1.00 28.38 C ATOM 462 O LEU A 53 -26.700 18.465 -29.421 1.00 25.42 O ATOM 463 CB LEU A 53 -25.143 16.189 -31.315 1.00 26.84 C ATOM 464 CG LEU A 53 -24.739 17.543 -31.908 1.00 27.52 C ATOM 465 CD1 LEU A 53 -23.403 18.016 -31.327 1.00 21.84 C ATOM 466 CD2 LEU A 53 -24.689 17.481 -33.414 1.00 28.85 C ATOM 467 H LEU A 53 -26.114 14.184 -30.008 1.00 0.00 H ATOM 468 N GLN A 54 -28.024 16.936 -30.406 1.00 26.94 N ATOM 469 CA GLN A 54 -29.126 17.880 -30.522 1.00 27.06 C ATOM 470 C GLN A 54 -29.622 18.318 -29.152 1.00 27.84 C ATOM 471 O GLN A 54 -29.871 19.507 -28.932 1.00 28.96 O ATOM 472 CB GLN A 54 -30.253 17.271 -31.358 1.00 29.61 C ATOM 473 CG GLN A 54 -29.807 16.911 -32.785 1.00 31.65 C ATOM 474 CD GLN A 54 -30.891 16.209 -33.587 1.00 38.54 C ATOM 475 OE1 GLN A 54 -31.840 15.653 -33.027 1.00 42.66 O ATOM 476 NE2 GLN A 54 -30.750 16.227 -34.909 1.00 40.94 N ATOM 477 HE22 GLN A 54 -29.934 16.708 -35.338 1.00 0.00 H ATOM 478 HE21 GLN A 54 -31.456 15.760 -35.514 1.00 0.00 H ATOM 479 H GLN A 54 -28.146 15.952 -30.719 1.00 0.00 H ATOM 480 N GLU A 55 -29.725 17.379 -28.203 1.00 29.93 N ATOM 481 CA GLU A 55 -30.256 17.701 -26.878 1.00 30.91 C ATOM 482 C GLU A 55 -29.326 18.617 -26.093 1.00 30.91 C ATOM 483 O GLU A 55 -29.793 19.489 -25.346 1.00 29.71 O ATOM 484 CB GLU A 55 -30.507 16.415 -26.085 1.00 30.52 C ATOM 485 CG GLU A 55 -31.415 15.422 -26.792 1.00 36.12 C ATOM 486 CD GLU A 55 -32.675 16.071 -27.338 1.00 45.33 C ATOM 487 OE1 GLU A 55 -33.143 17.070 -26.737 1.00 46.75 O ATOM 488 OE2 GLU A 55 -33.188 15.588 -28.378 1.00 48.84 O ATOM 489 H GLU A 55 -29.423 16.406 -28.411 1.00 0.00 H ATOM 490 N GLU A 56 -28.012 18.410 -26.214 1.00 24.44 N ATOM 491 CA GLU A 56 -27.038 19.119 -25.388 1.00 24.24 C ATOM 492 C GLU A 56 -26.570 20.431 -25.995 1.00 27.48 C ATOM 493 O GLU A 56 -26.238 21.358 -25.251 1.00 31.48 O ATOM 494 CB GLU A 56 -25.808 18.240 -25.136 1.00 26.23 C ATOM 495 CG GLU A 56 -26.132 17.005 -24.301 1.00 29.55 C ATOM 496 CD GLU A 56 -24.916 16.173 -23.969 1.00 32.55 C ATOM 497 OE1 GLU A 56 -23.794 16.552 -24.372 1.00 27.97 O ATOM 498 OE2 GLU A 56 -25.090 15.128 -23.306 1.00 38.39 O ATOM 499 H GLU A 56 -27.672 17.723 -26.917 1.00 0.00 H ATOM 500 N SER A 57 -26.489 20.523 -27.318 1.00 23.60 N ATOM 501 CA SER A 57 -26.004 21.730 -27.961 1.00 24.86 C ATOM 502 C SER A 57 -27.101 22.546 -28.623 1.00 28.54 C ATOM 503 O SER A 57 -26.856 23.703 -28.975 1.00 29.95 O ATOM 504 CB SER A 57 -24.956 21.385 -29.019 1.00 21.10 C ATOM 505 OG SER A 57 -25.586 20.898 -30.181 1.00 21.79 O ATOM 506 HG SER A 57 -26.104 20.084 -29.958 1.00 0.00 H ATOM 507 H SER A 57 -26.779 19.714 -27.904 1.00 0.00 H ATOM 508 N GLY A 58 -28.282 21.974 -28.837 1.00 25.11 N ATOM 509 CA GLY A 58 -29.315 22.648 -29.596 1.00 32.06 C ATOM 510 C GLY A 58 -29.155 22.607 -31.105 1.00 31.49 C ATOM 511 O GLY A 58 -30.044 23.086 -31.816 1.00 29.33 O ATOM 512 H GLY A 58 -28.467 21.026 -28.452 1.00 0.00 H ATOM 513 N LEU A 59 -28.059 22.055 -31.618 1.00 30.03 N ATOM 514 CA LEU A 59 -27.846 21.986 -33.056 1.00 30.10 C ATOM 515 C LEU A 59 -28.585 20.803 -33.676 1.00 30.81 C ATOM 516 O LEU A 59 -28.807 19.769 -33.038 1.00 32.55 O ATOM 517 CB LEU A 59 -26.359 21.861 -33.373 1.00 31.96 C ATOM 518 CG LEU A 59 -25.418 22.917 -32.800 1.00 24.73 C ATOM 519 CD1 LEU A 59 -23.969 22.481 -33.017 1.00 23.97 C ATOM 520 CD2 LEU A 59 -25.683 24.267 -33.442 1.00 26.89 C ATOM 521 H LEU A 59 -27.339 21.664 -30.978 1.00 0.00 H ATOM 522 N THR A 60 -28.949 20.967 -34.945 1.00 31.15 N ATOM 523 CA THR A 60 -29.473 19.890 -35.774 1.00 32.78 C ATOM 524 C THR A 60 -28.384 19.429 -36.727 1.00 32.84 C ATOM 525 O THR A 60 -27.766 20.253 -37.408 1.00 33.94 O ATOM 526 CB THR A 60 -30.686 20.360 -36.581 1.00 35.54 C ATOM 527 OG1 THR A 60 -31.712 20.808 -35.689 1.00 35.35 O ATOM 528 CG2 THR A 60 -31.213 19.224 -37.441 1.00 34.11 C ATOM 529 HG1 THR A 60 -31.368 21.559 -35.143 1.00 0.00 H ATOM 530 H THR A 60 -28.855 21.913 -35.367 1.00 0.00 H ATOM 531 N VAL A 61 -28.159 18.125 -36.804 1.00 37.08 N ATOM 532 CA VAL A 61 -27.085 17.594 -37.638 1.00 36.37 C ATOM 533 C VAL A 61 -27.672 16.744 -38.755 1.00 42.49 C ATOM 534 O VAL A 61 -28.564 15.916 -38.526 1.00 41.77 O ATOM 535 CB VAL A 61 -26.058 16.791 -36.816 1.00 38.18 C ATOM 536 CG1 VAL A 61 -26.711 15.603 -36.128 1.00 37.67 C ATOM 537 CG2 VAL A 61 -24.911 16.337 -37.703 1.00 43.21 C ATOM 538 H VAL A 61 -28.757 17.470 -36.262 1.00 0.00 H ATOM 539 N ASP A 62 -27.170 16.962 -39.970 1.00 39.75 N ATOM 540 CA ASP A 62 -27.422 16.034 -41.061 1.00 45.64 C ATOM 541 C ASP A 62 -26.533 14.809 -40.894 1.00 44.60 C ATOM 542 O ASP A 62 -26.865 13.885 -40.146 1.00 45.53 O ATOM 543 CB ASP A 62 -27.172 16.704 -42.414 1.00 44.69 C ATOM 544 H ASP A 62 -26.590 17.808 -40.141 1.00 0.00 H ATOM 545 N ALA A 63 -25.382 14.816 -41.556 1.00 42.05 N ATOM 546 CA ALA A 63 -24.534 13.640 -41.654 1.00 41.41 C ATOM 547 C ALA A 63 -23.536 13.594 -40.502 1.00 35.53 C ATOM 548 O ALA A 63 -22.869 14.593 -40.212 1.00 34.12 O ATOM 549 CB ALA A 63 -23.797 13.641 -42.993 1.00 41.33 C ATOM 550 H ALA A 63 -25.076 15.695 -42.021 1.00 0.00 H ATOM 551 N LEU A 64 -23.452 12.439 -39.843 1.00 32.28 N ATOM 552 CA LEU A 64 -22.430 12.161 -38.844 1.00 32.30 C ATOM 553 C LEU A 64 -21.473 11.118 -39.388 1.00 35.57 C ATOM 554 O LEU A 64 -21.898 10.142 -40.015 1.00 35.56 O ATOM 555 CB LEU A 64 -23.023 11.637 -37.535 1.00 32.44 C ATOM 556 CG LEU A 64 -23.650 12.609 -36.544 1.00 31.16 C ATOM 557 CD1 LEU A 64 -24.281 11.822 -35.423 1.00 31.89 C ATOM 558 CD2 LEU A 64 -22.620 13.570 -35.995 1.00 30.13 C ATOM 559 H LEU A 64 -24.152 11.699 -40.053 1.00 0.00 H ATOM 560 N HIS A 65 -20.188 11.312 -39.123 1.00 26.05 N ATOM 561 CA HIS A 65 -19.146 10.397 -39.560 1.00 33.28 C ATOM 562 C HIS A 65 -18.509 9.768 -38.333 1.00 28.01 C ATOM 563 O HIS A 65 -18.119 10.478 -37.404 1.00 24.81 O ATOM 564 CB HIS A 65 -18.092 11.124 -40.398 1.00 30.47 C ATOM 565 CG HIS A 65 -18.659 11.803 -41.603 1.00 37.72 C ATOM 566 ND1 HIS A 65 -19.103 11.107 -42.707 1.00 46.26 N ATOM 567 CD2 HIS A 65 -18.886 13.112 -41.867 1.00 42.16 C ATOM 568 CE1 HIS A 65 -19.567 11.958 -43.605 1.00 46.89 C ATOM 569 NE2 HIS A 65 -19.449 13.181 -43.120 1.00 48.82 N ATOM 570 H HIS A 65 -19.914 12.155 -38.579 1.00 0.00 H ATOM 571 N LYS A 66 -18.414 8.441 -38.328 1.00 26.49 N ATOM 572 CA LYS A 66 -17.768 7.733 -37.232 1.00 25.75 C ATOM 573 C LYS A 66 -16.264 7.875 -37.407 1.00 20.75 C ATOM 574 O LYS A 66 -15.727 7.512 -38.456 1.00 31.02 O ATOM 575 CB LYS A 66 -18.183 6.262 -37.225 1.00 27.14 C ATOM 576 H LYS A 66 -18.809 7.899 -39.123 1.00 0.00 H ATOM 577 N VAL A 67 -15.578 8.426 -36.412 1.00 23.28 N ATOM 578 CA VAL A 67 -14.147 8.665 -36.547 1.00 20.01 C ATOM 579 C VAL A 67 -13.307 7.854 -35.562 1.00 25.66 C ATOM 580 O VAL A 67 -12.112 7.639 -35.829 1.00 24.84 O ATOM 581 CB VAL A 67 -13.796 10.168 -36.448 1.00 26.27 C ATOM 582 CG1 VAL A 67 -14.347 10.926 -37.647 1.00 29.72 C ATOM 583 CG2 VAL A 67 -14.298 10.783 -35.168 1.00 21.95 C ATOM 584 H VAL A 67 -16.065 8.688 -35.531 1.00 0.00 H ATOM 585 N GLY A 68 -13.878 7.377 -34.460 1.00 19.26 N ATOM 586 CA GLY A 68 -13.056 6.618 -33.536 1.00 20.34 C ATOM 587 C GLY A 68 -13.856 5.864 -32.499 1.00 21.54 C ATOM 588 O GLY A 68 -15.071 6.039 -32.349 1.00 19.84 O ATOM 589 H GLY A 68 -14.886 7.543 -34.266 1.00 0.00 H ATOM 590 N GLN A 69 -13.142 4.997 -31.788 1.00 19.93 N ATOM 591 CA GLN A 69 -13.697 4.258 -30.664 1.00 25.31 C ATOM 592 C GLN A 69 -12.634 4.217 -29.582 1.00 23.71 C ATOM 593 O GLN A 69 -11.510 3.773 -29.844 1.00 21.53 O ATOM 594 CB GLN A 69 -14.120 2.836 -31.061 1.00 26.05 C ATOM 595 CG GLN A 69 -14.843 2.085 -29.937 1.00 29.80 C ATOM 596 CD GLN A 69 -15.379 0.730 -30.368 1.00 30.41 C ATOM 597 OE1 GLN A 69 -15.564 0.470 -31.556 1.00 35.51 O ATOM 598 NE2 GLN A 69 -15.628 -0.142 -29.400 1.00 30.91 N ATOM 599 HE22 GLN A 69 -15.457 0.119 -28.408 1.00 0.00 H ATOM 600 HE21 GLN A 69 -15.994 -1.087 -29.633 1.00 0.00 H ATOM 601 H GLN A 69 -12.147 4.841 -32.045 1.00 0.00 H ATOM 602 N ILE A 70 -12.991 4.668 -28.378 1.00 18.34 N ATOM 603 CA ILE A 70 -12.071 4.763 -27.249 1.00 22.48 C ATOM 604 C ILE A 70 -12.683 4.054 -26.046 1.00 23.12 C ATOM 605 O ILE A 70 -13.819 4.351 -25.659 1.00 20.74 O ATOM 606 CB ILE A 70 -11.766 6.229 -26.885 1.00 25.13 C ATOM 607 CG1 ILE A 70 -11.127 6.964 -28.063 1.00 31.63 C ATOM 608 CG2 ILE A 70 -10.845 6.299 -25.667 1.00 23.57 C ATOM 609 CD1 ILE A 70 -10.790 8.393 -27.746 1.00 29.26 C ATOM 610 H ILE A 70 -13.977 4.968 -28.237 1.00 0.00 H ATOM 611 N VAL A 71 -11.926 3.144 -25.434 1.00 19.33 N ATOM 612 CA VAL A 71 -12.360 2.431 -24.231 1.00 22.71 C ATOM 613 C VAL A 71 -11.659 3.036 -23.022 1.00 23.55 C ATOM 614 O VAL A 71 -10.431 3.185 -23.021 1.00 26.50 O ATOM 615 CB VAL A 71 -12.068 0.922 -24.329 1.00 29.10 C ATOM 616 CG1 VAL A 71 -12.423 0.215 -23.007 1.00 23.93 C ATOM 617 CG2 VAL A 71 -12.831 0.300 -25.490 1.00 26.06 C ATOM 618 H VAL A 71 -10.987 2.931 -25.828 1.00 0.00 H ATOM 619 N PHE A 72 -12.425 3.400 -21.996 1.00 19.69 N ATOM 620 CA PHE A 72 -11.846 3.953 -20.776 1.00 20.91 C ATOM 621 C PHE A 72 -11.979 2.946 -19.646 1.00 22.27 C ATOM 622 O PHE A 72 -13.060 2.388 -19.431 1.00 20.73 O ATOM 623 CB PHE A 72 -12.509 5.278 -20.381 1.00 21.78 C ATOM 624 CG PHE A 72 -12.268 6.390 -21.358 1.00 23.02 C ATOM 625 CD1 PHE A 72 -11.161 7.216 -21.232 1.00 26.30 C ATOM 626 CD2 PHE A 72 -13.146 6.611 -22.401 1.00 22.86 C ATOM 627 CE1 PHE A 72 -10.935 8.248 -22.126 1.00 23.61 C ATOM 628 CE2 PHE A 72 -12.928 7.644 -23.307 1.00 27.69 C ATOM 629 CZ PHE A 72 -11.822 8.464 -23.172 1.00 23.13 C ATOM 630 H PHE A 72 -13.457 3.288 -22.065 1.00 0.00 H ATOM 631 N GLU A 73 -10.879 2.710 -18.938 1.00 17.39 N ATOM 632 CA GLU A 73 -10.872 1.894 -17.731 1.00 21.08 C ATOM 633 C GLU A 73 -10.451 2.750 -16.549 1.00 23.30 C ATOM 634 O GLU A 73 -9.435 3.451 -16.617 1.00 25.04 O ATOM 635 CB GLU A 73 -9.915 0.708 -17.835 1.00 23.94 C ATOM 636 CG GLU A 73 -9.715 0.065 -16.457 1.00 24.82 C ATOM 637 CD GLU A 73 -8.647 -0.996 -16.424 1.00 29.25 C ATOM 638 OE1 GLU A 73 -8.365 -1.604 -17.478 1.00 29.55 O ATOM 639 OE2 GLU A 73 -8.095 -1.214 -15.323 1.00 32.01 O ATOM 640 H GLU A 73 -9.982 3.127 -19.260 1.00 0.00 H ATOM 641 N PHE A 74 -11.210 2.669 -15.463 1.00 22.04 N ATOM 642 CA PHE A 74 -10.907 3.377 -14.224 1.00 22.43 C ATOM 643 C PHE A 74 -10.555 2.326 -13.180 1.00 27.30 C ATOM 644 O PHE A 74 -11.422 1.553 -12.755 1.00 23.78 O ATOM 645 CB PHE A 74 -12.086 4.257 -13.800 1.00 29.58 C ATOM 646 CG PHE A 74 -12.377 5.362 -14.781 1.00 27.96 C ATOM 647 CD1 PHE A 74 -11.699 6.555 -14.705 1.00 30.76 C ATOM 648 CD2 PHE A 74 -13.283 5.176 -15.814 1.00 30.43 C ATOM 649 CE1 PHE A 74 -11.936 7.563 -15.622 1.00 31.78 C ATOM 650 CE2 PHE A 74 -13.531 6.177 -16.730 1.00 32.30 C ATOM 651 CZ PHE A 74 -12.851 7.374 -16.636 1.00 29.87 C ATOM 652 H PHE A 74 -12.061 2.072 -15.497 1.00 0.00 H ATOM 653 N VAL A 75 -9.274 2.281 -12.794 1.00 23.86 N ATOM 654 CA VAL A 75 -8.804 1.251 -11.875 1.00 29.23 C ATOM 655 C VAL A 75 -9.756 1.154 -10.695 1.00 29.62 C ATOM 656 O VAL A 75 -10.125 2.165 -10.091 1.00 33.23 O ATOM 657 CB VAL A 75 -7.362 1.553 -11.422 1.00 38.97 C ATOM 658 H VAL A 75 -8.605 2.991 -13.155 1.00 0.00 H ATOM 659 N GLY A 76 -10.196 -0.064 -10.390 1.00 36.20 N ATOM 660 CA GLY A 76 -11.120 -0.288 -9.303 1.00 36.09 C ATOM 661 C GLY A 76 -12.585 -0.270 -9.695 1.00 37.63 C ATOM 662 O GLY A 76 -13.411 -0.829 -8.969 1.00 40.92 O ATOM 663 H GLY A 76 -9.866 -0.876 -10.949 1.00 0.00 H ATOM 664 N GLU A 77 -12.933 0.360 -10.833 1.00 30.60 N ATOM 665 CA GLU A 77 -14.329 0.411 -11.232 1.00 29.86 C ATOM 666 C GLU A 77 -14.617 -0.684 -12.239 1.00 27.94 C ATOM 667 O GLU A 77 -13.945 -0.752 -13.278 1.00 27.30 O ATOM 668 CB GLU A 77 -14.673 1.771 -11.828 1.00 33.63 C ATOM 669 CG GLU A 77 -14.432 2.901 -10.857 1.00 40.13 C ATOM 670 CD GLU A 77 -14.841 4.250 -11.399 1.00 45.80 C ATOM 671 OE1 GLU A 77 -15.646 4.300 -12.356 1.00 48.78 O ATOM 672 OE2 GLU A 77 -14.344 5.265 -10.864 1.00 49.77 O ATOM 673 H GLU A 77 -12.205 0.809 -11.424 1.00 0.00 H ATOM 674 N PRO A 78 -15.598 -1.548 -11.963 1.00 27.71 N ATOM 675 CA PRO A 78 -15.822 -2.708 -12.840 1.00 25.90 C ATOM 676 C PRO A 78 -16.232 -2.336 -14.244 1.00 25.05 C ATOM 677 O PRO A 78 -15.889 -3.059 -15.180 1.00 23.91 O ATOM 678 CB PRO A 78 -16.946 -3.478 -12.125 1.00 25.81 C ATOM 679 CG PRO A 78 -17.625 -2.444 -11.266 1.00 32.05 C ATOM 680 CD PRO A 78 -16.502 -1.554 -10.801 1.00 29.13 C ATOM 681 N GLU A 79 -16.980 -1.252 -14.421 1.00 21.55 N ATOM 682 CA GLU A 79 -17.580 -0.929 -15.710 1.00 21.07 C ATOM 683 C GLU A 79 -16.587 -0.138 -16.568 1.00 22.87 C ATOM 684 O GLU A 79 -16.112 0.922 -16.153 1.00 22.59 O ATOM 685 CB GLU A 79 -18.862 -0.135 -15.474 1.00 32.22 C ATOM 686 CG GLU A 79 -19.834 -0.057 -16.626 1.00 33.64 C ATOM 687 CD GLU A 79 -21.147 0.575 -16.179 1.00 41.40 C ATOM 688 OE1 GLU A 79 -21.906 -0.092 -15.443 1.00 49.48 O ATOM 689 OE2 GLU A 79 -21.402 1.747 -16.526 1.00 42.88 O ATOM 690 H GLU A 79 -17.142 -0.615 -13.615 1.00 0.00 H ATOM 691 N LEU A 80 -16.273 -0.658 -17.753 1.00 25.42 N ATOM 692 CA LEU A 80 -15.517 0.094 -18.756 1.00 23.27 C ATOM 693 C LEU A 80 -16.453 1.041 -19.509 1.00 26.90 C ATOM 694 O LEU A 80 -17.656 0.791 -19.609 1.00 23.84 O ATOM 695 CB LEU A 80 -14.845 -0.858 -19.749 1.00 23.93 C ATOM 696 CG LEU A 80 -13.890 -1.926 -19.198 1.00 27.09 C ATOM 697 CD1 LEU A 80 -13.543 -2.951 -20.269 1.00 30.12 C ATOM 698 CD2 LEU A 80 -12.632 -1.266 -18.671 1.00 24.43 C ATOM 699 H LEU A 80 -16.574 -1.629 -17.973 1.00 0.00 H ATOM 700 N MET A 81 -15.901 2.145 -20.021 1.00 20.33 N ATOM 701 CA MET A 81 -16.656 3.080 -20.860 1.00 22.58 C ATOM 702 C MET A 81 -16.204 2.906 -22.301 1.00 24.29 C ATOM 703 O MET A 81 -15.050 3.195 -22.627 1.00 22.68 O ATOM 704 CB MET A 81 -16.452 4.543 -20.444 1.00 25.01 C ATOM 705 CG MET A 81 -16.766 4.906 -19.022 1.00 26.41 C ATOM 706 SD MET A 81 -16.511 6.682 -18.762 1.00 48.01 S ATOM 707 CE MET A 81 -17.529 7.411 -20.045 1.00 35.13 C ATOM 708 H MET A 81 -14.902 2.348 -19.817 1.00 0.00 H ATOM 709 N ASP A 82 -17.114 2.468 -23.167 1.00 23.45 N ATOM 710 CA ASP A 82 -16.811 2.245 -24.580 1.00 22.83 C ATOM 711 C ASP A 82 -17.351 3.446 -25.361 1.00 23.71 C ATOM 712 O ASP A 82 -18.549 3.521 -25.653 1.00 20.45 O ATOM 713 CB ASP A 82 -17.431 0.928 -25.038 1.00 25.92 C ATOM 714 CG ASP A 82 -17.259 0.681 -26.514 1.00 33.20 C ATOM 715 OD1 ASP A 82 -16.346 1.286 -27.120 1.00 31.81 O ATOM 716 OD2 ASP A 82 -18.059 -0.107 -27.076 1.00 34.57 O ATOM 717 H ASP A 82 -18.078 2.277 -22.826 1.00 0.00 H ATOM 718 N VAL A 83 -16.475 4.396 -25.690 1.00 20.40 N ATOM 719 CA VAL A 83 -16.905 5.679 -26.253 1.00 20.42 C ATOM 720 C VAL A 83 -16.761 5.648 -27.767 1.00 20.15 C ATOM 721 O VAL A 83 -15.661 5.452 -28.295 1.00 21.98 O ATOM 722 CB VAL A 83 -16.111 6.848 -25.650 1.00 21.27 C ATOM 723 CG1 VAL A 83 -16.559 8.172 -26.279 1.00 19.13 C ATOM 724 CG2 VAL A 83 -16.272 6.876 -24.133 1.00 23.76 C ATOM 725 H VAL A 83 -15.460 4.222 -25.543 1.00 0.00 H ATOM 726 N HIS A 84 -17.864 5.875 -28.466 1.00 20.51 N ATOM 727 CA HIS A 84 -17.889 5.921 -29.919 1.00 17.53 C ATOM 728 C HIS A 84 -17.909 7.389 -30.336 1.00 22.07 C ATOM 729 O HIS A 84 -18.820 8.140 -29.945 1.00 17.23 O ATOM 730 CB HIS A 84 -19.093 5.144 -30.460 1.00 19.70 C ATOM 731 CG HIS A 84 -18.987 3.666 -30.226 1.00 24.80 C ATOM 732 ND1 HIS A 84 -18.763 2.760 -31.242 1.00 23.25 N ATOM 733 CD2 HIS A 84 -19.004 2.948 -29.078 1.00 21.72 C ATOM 734 CE1 HIS A 84 -18.667 1.544 -30.729 1.00 25.58 C ATOM 735 NE2 HIS A 84 -18.812 1.630 -29.418 1.00 20.11 N ATOM 736 H HIS A 84 -18.754 6.028 -27.950 1.00 0.00 H ATOM 737 N VAL A 85 -16.869 7.799 -31.067 1.00 17.84 N ATOM 738 CA VAL A 85 -16.600 9.197 -31.389 1.00 19.16 C ATOM 739 C VAL A 85 -17.045 9.468 -32.813 1.00 18.13 C ATOM 740 O VAL A 85 -16.732 8.697 -33.733 1.00 19.35 O ATOM 741 CB VAL A 85 -15.108 9.541 -31.214 1.00 17.76 C ATOM 742 CG1 VAL A 85 -14.867 11.020 -31.450 1.00 17.75 C ATOM 743 CG2 VAL A 85 -14.608 9.117 -29.830 1.00 17.78 C ATOM 744 H VAL A 85 -16.211 7.079 -31.428 1.00 0.00 H ATOM 745 N PHE A 86 -17.742 10.588 -32.999 1.00 17.58 N ATOM 746 CA PHE A 86 -18.302 10.993 -34.278 1.00 18.88 C ATOM 747 C PHE A 86 -17.880 12.419 -34.592 1.00 21.81 C ATOM 748 O PHE A 86 -17.670 13.227 -33.684 1.00 21.32 O ATOM 749 CB PHE A 86 -19.831 10.922 -34.263 1.00 19.92 C ATOM 750 CG PHE A 86 -20.373 9.540 -34.157 1.00 22.21 C ATOM 751 CD1 PHE A 86 -20.542 8.946 -32.918 1.00 21.54 C ATOM 752 CD2 PHE A 86 -20.740 8.838 -35.294 1.00 22.52 C ATOM 753 CE1 PHE A 86 -21.050 7.662 -32.815 1.00 21.88 C ATOM 754 CE2 PHE A 86 -21.259 7.564 -35.195 1.00 25.28 C ATOM 755 CZ PHE A 86 -21.416 6.974 -33.956 1.00 21.94 C ATOM 756 H PHE A 86 -17.895 11.210 -32.180 1.00 0.00 H ATOM 757 N CYS A 87 -17.762 12.722 -35.888 1.00 18.53 N ATOM 758 CA CYS A 87 -17.493 14.069 -36.365 1.00 26.60 C ATOM 759 C CYS A 87 -18.594 14.539 -37.305 1.00 28.96 C ATOM 760 O CYS A 87 -19.206 13.737 -38.022 1.00 25.74 O ATOM 761 CB CYS A 87 -16.157 14.128 -37.097 1.00 33.00 C ATOM 762 SG CYS A 87 -15.247 15.565 -36.678 1.00 53.36 S ATOM 763 H CYS A 87 -17.867 11.960 -36.587 1.00 0.00 H ATOM 764 N THR A 88 -18.826 15.854 -37.320 1.00 26.65 N ATOM 765 CA THR A 88 -19.731 16.435 -38.296 1.00 30.97 C ATOM 766 C THR A 88 -19.326 17.867 -38.612 1.00 37.50 C ATOM 767 O THR A 88 -18.851 18.607 -37.743 1.00 34.98 O ATOM 768 CB THR A 88 -21.180 16.428 -37.811 1.00 34.12 C ATOM 769 OG1 THR A 88 -22.004 17.012 -38.825 1.00 37.73 O ATOM 770 CG2 THR A 88 -21.309 17.243 -36.534 1.00 28.92 C ATOM 771 HG1 THR A 88 -21.924 16.483 -39.658 1.00 0.00 H ATOM 772 H THR A 88 -18.354 16.468 -36.626 1.00 0.00 H ATOM 773 N ASP A 89 -19.535 18.253 -39.872 1.00 38.95 N ATOM 774 CA ASP A 89 -19.380 19.635 -40.309 1.00 37.59 C ATOM 775 C ASP A 89 -20.664 20.200 -40.886 1.00 43.12 C ATOM 776 O ASP A 89 -20.669 21.346 -41.348 1.00 51.21 O ATOM 777 CB ASP A 89 -18.262 19.750 -41.354 1.00 42.50 C ATOM 778 H ASP A 89 -19.820 17.538 -40.571 1.00 0.00 H ATOM 779 N SER A 90 -21.745 19.434 -40.873 1.00 40.66 N ATOM 780 CA SER A 90 -23.010 19.799 -41.497 1.00 40.52 C ATOM 781 C SER A 90 -24.045 19.934 -40.385 1.00 37.84 C ATOM 782 O SER A 90 -24.678 18.956 -39.986 1.00 39.72 O ATOM 783 CB SER A 90 -23.425 18.745 -42.510 1.00 47.16 C ATOM 784 OG SER A 90 -23.764 17.533 -41.845 1.00 46.53 O ATOM 785 HG SER A 90 -24.515 17.699 -41.222 1.00 0.00 H ATOM 786 H SER A 90 -21.687 18.516 -40.388 1.00 0.00 H ATOM 787 N ILE A 91 -24.212 21.154 -39.887 1.00 33.00 N ATOM 788 CA ILE A 91 -25.124 21.436 -38.788 1.00 34.08 C ATOM 789 C ILE A 91 -26.063 22.563 -39.196 1.00 36.43 C ATOM 790 O ILE A 91 -25.769 23.361 -40.089 1.00 37.05 O ATOM 791 CB ILE A 91 -24.369 21.825 -37.503 1.00 35.35 C ATOM 792 CG1 ILE A 91 -23.396 22.970 -37.809 1.00 32.92 C ATOM 793 CG2 ILE A 91 -23.641 20.617 -36.904 1.00 36.10 C ATOM 794 CD1 ILE A 91 -23.132 23.864 -36.646 1.00 30.78 C ATOM 795 H ILE A 91 -23.669 21.940 -40.299 1.00 0.00 H ATOM 796 N GLN A 92 -27.198 22.635 -38.509 1.00 32.94 N ATOM 797 CA GLN A 92 -28.122 23.753 -38.643 1.00 36.16 C ATOM 798 C GLN A 92 -28.413 24.314 -37.260 1.00 31.53 C ATOM 799 O GLN A 92 -28.609 23.554 -36.309 1.00 31.69 O ATOM 800 CB GLN A 92 -29.427 23.328 -39.323 1.00 33.01 C ATOM 801 CG GLN A 92 -29.234 22.639 -40.660 1.00 37.66 C ATOM 802 CD GLN A 92 -30.514 21.984 -41.164 1.00 42.30 C ATOM 803 OE1 GLN A 92 -30.597 20.757 -41.296 1.00 46.94 O ATOM 804 NE2 GLN A 92 -31.519 22.803 -41.442 1.00 33.85 N ATOM 805 HE22 GLN A 92 -31.404 23.829 -41.316 1.00 0.00 H ATOM 806 HE21 GLN A 92 -32.422 22.420 -41.786 1.00 0.00 H ATOM 807 H GLN A 92 -27.435 21.865 -37.852 1.00 0.00 H ATOM 808 N GLY A 93 -28.433 25.631 -37.148 1.00 31.86 N ATOM 809 CA GLY A 93 -28.790 26.284 -35.910 1.00 28.98 C ATOM 810 C GLY A 93 -27.586 26.923 -35.237 1.00 29.95 C ATOM 811 O GLY A 93 -26.467 26.944 -35.762 1.00 33.40 O ATOM 812 H GLY A 93 -28.185 26.213 -37.974 1.00 0.00 H ATOM 813 N THR A 94 -27.850 27.466 -34.051 1.00 29.81 N ATOM 814 CA THR A 94 -26.875 28.114 -33.196 1.00 32.49 C ATOM 815 C THR A 94 -26.809 27.393 -31.854 1.00 29.14 C ATOM 816 O THR A 94 -27.856 27.107 -31.263 1.00 27.55 O ATOM 817 CB THR A 94 -27.244 29.580 -32.968 1.00 36.61 C ATOM 818 OG1 THR A 94 -26.912 30.340 -34.137 1.00 41.64 O ATOM 819 CG2 THR A 94 -26.508 30.136 -31.741 1.00 32.43 C ATOM 820 HG1 THR A 94 -27.151 31.290 -33.991 1.00 0.00 H ATOM 821 H THR A 94 -28.832 27.422 -33.711 1.00 0.00 H ATOM 822 N PRO A 95 -25.621 27.100 -31.340 1.00 27.28 N ATOM 823 CA PRO A 95 -25.546 26.381 -30.063 1.00 24.35 C ATOM 824 C PRO A 95 -26.210 27.195 -28.966 1.00 30.24 C ATOM 825 O PRO A 95 -26.167 28.426 -28.971 1.00 29.80 O ATOM 826 CB PRO A 95 -24.038 26.229 -29.818 1.00 28.07 C ATOM 827 CG PRO A 95 -23.363 26.694 -31.090 1.00 28.96 C ATOM 828 CD PRO A 95 -24.315 27.609 -31.773 1.00 25.20 C ATOM 829 N VAL A 96 -26.838 26.489 -28.031 1.00 29.76 N ATOM 830 CA VAL A 96 -27.630 27.076 -26.955 1.00 27.07 C ATOM 831 C VAL A 96 -26.898 26.878 -25.636 1.00 27.02 C ATOM 832 O VAL A 96 -26.449 25.771 -25.335 1.00 26.63 O ATOM 833 CB VAL A 96 -29.021 26.408 -26.883 1.00 27.78 C ATOM 834 CG1 VAL A 96 -29.826 26.998 -25.749 1.00 33.56 C ATOM 835 CG2 VAL A 96 -29.750 26.522 -28.217 1.00 34.33 C ATOM 836 H VAL A 96 -26.760 25.453 -28.069 1.00 0.00 H ATOM 837 N GLU A 97 -26.799 27.926 -24.831 1.00 24.39 N ATOM 838 CA GLU A 97 -26.282 27.744 -23.479 1.00 25.41 C ATOM 839 C GLU A 97 -27.436 27.440 -22.533 1.00 28.72 C ATOM 840 O GLU A 97 -28.455 28.132 -22.553 1.00 28.76 O ATOM 841 CB GLU A 97 -25.525 28.973 -22.997 1.00 26.63 C ATOM 842 CG GLU A 97 -25.130 28.894 -21.532 1.00 30.45 C ATOM 843 CD GLU A 97 -24.109 29.945 -21.179 1.00 32.56 C ATOM 844 OE1 GLU A 97 -23.637 30.608 -22.125 1.00 37.77 O ATOM 845 OE2 GLU A 97 -23.778 30.106 -19.977 1.00 34.04 O ATOM 846 H GLU A 97 -27.087 28.870 -25.160 1.00 0.00 H ATOM 847 N SER A 98 -27.278 26.405 -21.718 1.00 28.01 N ATOM 848 CA SER A 98 -28.304 25.964 -20.785 1.00 28.54 C ATOM 849 C SER A 98 -27.744 25.986 -19.370 1.00 31.47 C ATOM 850 O SER A 98 -26.604 26.400 -19.132 1.00 29.20 O ATOM 851 CB SER A 98 -28.799 24.561 -21.147 1.00 31.79 C ATOM 852 OG SER A 98 -27.700 23.657 -21.205 1.00 28.54 O ATOM 853 HG SER A 98 -28.030 22.753 -21.439 1.00 0.00 H ATOM 854 H SER A 98 -26.378 25.884 -21.747 1.00 0.00 H ATOM 855 N ASP A 99 -28.565 25.528 -18.421 1.00 31.38 N ATOM 856 CA ASP A 99 -28.111 25.395 -17.042 1.00 32.71 C ATOM 857 C ASP A 99 -26.990 24.375 -16.903 1.00 32.27 C ATOM 858 O ASP A 99 -26.202 24.462 -15.957 1.00 31.24 O ATOM 859 CB ASP A 99 -29.280 25.000 -16.131 1.00 30.48 C ATOM 860 CG ASP A 99 -29.838 23.616 -16.455 1.00 34.51 C ATOM 861 OD1 ASP A 99 -29.922 23.266 -17.656 1.00 32.45 O ATOM 862 OD2 ASP A 99 -30.194 22.873 -15.509 1.00 37.61 O ATOM 863 H ASP A 99 -29.540 25.263 -18.669 1.00 0.00 H ATOM 864 N GLU A 100 -26.901 23.411 -17.819 1.00 29.22 N ATOM 865 CA GLU A 100 -25.925 22.336 -17.719 1.00 29.68 C ATOM 866 C GLU A 100 -24.676 22.540 -18.568 1.00 32.36 C ATOM 867 O GLU A 100 -23.618 22.007 -18.217 1.00 28.55 O ATOM 868 CB GLU A 100 -26.562 21.001 -18.124 1.00 31.67 C ATOM 869 H GLU A 100 -27.550 23.427 -18.632 1.00 0.00 H ATOM 870 N MET A 101 -24.759 23.272 -19.674 1.00 28.38 N ATOM 871 CA MET A 101 -23.676 23.282 -20.650 1.00 30.42 C ATOM 872 C MET A 101 -23.466 24.687 -21.205 1.00 27.81 C ATOM 873 O MET A 101 -24.430 25.402 -21.495 1.00 28.89 O ATOM 874 CB MET A 101 -23.986 22.291 -21.794 1.00 31.88 C ATOM 875 CG MET A 101 -22.813 21.978 -22.725 1.00 33.73 C ATOM 876 SD MET A 101 -21.858 20.549 -22.184 1.00 51.20 S ATOM 877 CE MET A 101 -22.989 19.217 -22.584 1.00 39.58 C ATOM 878 H MET A 101 -25.609 23.846 -19.846 1.00 0.00 H ATOM 879 N ARG A 102 -22.204 25.077 -21.360 1.00 24.58 N ATOM 880 CA ARG A 102 -21.847 26.372 -21.940 1.00 26.91 C ATOM 881 C ARG A 102 -21.011 26.165 -23.205 1.00 23.24 C ATOM 882 O ARG A 102 -19.789 25.952 -23.119 1.00 23.76 O ATOM 883 CB ARG A 102 -21.094 27.214 -20.906 1.00 29.22 C ATOM 884 CG ARG A 102 -20.445 28.489 -21.432 1.00 30.79 C ATOM 885 CD ARG A 102 -19.979 29.396 -20.271 1.00 31.25 C ATOM 886 NE ARG A 102 -18.810 28.886 -19.545 1.00 29.89 N ATOM 887 CZ ARG A 102 -17.553 29.236 -19.817 1.00 29.92 C ATOM 888 NH1 ARG A 102 -17.299 30.090 -20.806 1.00 27.25 N ATOM 889 NH2 ARG A 102 -16.548 28.737 -19.102 1.00 31.08 N ATOM 890 HE ARG A 102 -18.972 28.210 -18.771 1.00 0.00 H ATOM 891 HH12 ARG A 102 -16.318 30.363 -21.018 1.00 0.00 H ATOM 892 HH11 ARG A 102 -18.081 30.484 -21.366 1.00 0.00 H ATOM 893 HH22 ARG A 102 -15.569 29.013 -19.318 1.00 0.00 H ATOM 894 HH21 ARG A 102 -16.742 28.071 -18.327 1.00 0.00 H ATOM 895 H ARG A 102 -21.442 24.437 -21.057 1.00 0.00 H ATOM 896 N PRO A 103 -21.615 26.235 -24.393 1.00 25.28 N ATOM 897 CA PRO A 103 -20.863 25.993 -25.633 1.00 23.44 C ATOM 898 C PRO A 103 -20.027 27.189 -26.065 1.00 25.95 C ATOM 899 O PRO A 103 -20.391 28.344 -25.839 1.00 26.08 O ATOM 900 CB PRO A 103 -21.976 25.718 -26.653 1.00 24.27 C ATOM 901 CG PRO A 103 -23.091 26.602 -26.158 1.00 30.56 C ATOM 902 CD PRO A 103 -23.051 26.419 -24.658 1.00 27.93 C ATOM 903 N CYS A 104 -18.924 26.887 -26.749 1.00 20.73 N ATOM 904 CA CYS A 104 -18.029 27.928 -27.225 1.00 22.73 C ATOM 905 C CYS A 104 -17.190 27.386 -28.374 1.00 21.74 C ATOM 906 O CYS A 104 -16.692 26.261 -28.303 1.00 18.56 O ATOM 907 CB CYS A 104 -17.132 28.422 -26.087 1.00 24.78 C ATOM 908 SG CYS A 104 -16.067 29.762 -26.543 1.00 26.98 S ATOM 909 H CYS A 104 -18.700 25.890 -26.945 1.00 0.00 H ATOM 910 N TRP A 105 -17.053 28.186 -29.432 1.00 21.54 N ATOM 911 CA TRP A 105 -16.211 27.827 -30.568 1.00 20.50 C ATOM 912 C TRP A 105 -14.745 28.112 -30.246 1.00 25.50 C ATOM 913 O TRP A 105 -14.423 29.092 -29.570 1.00 25.34 O ATOM 914 CB TRP A 105 -16.620 28.615 -31.819 1.00 25.48 C ATOM 915 CG TRP A 105 -17.980 28.258 -32.383 1.00 22.16 C ATOM 916 CD1 TRP A 105 -19.143 28.940 -32.211 1.00 25.50 C ATOM 917 CD2 TRP A 105 -18.292 27.138 -33.218 1.00 22.07 C ATOM 918 NE1 TRP A 105 -20.160 28.321 -32.885 1.00 28.48 N ATOM 919 CE2 TRP A 105 -19.665 27.208 -33.511 1.00 26.97 C ATOM 920 CE3 TRP A 105 -17.539 26.086 -33.751 1.00 22.44 C ATOM 921 CZ2 TRP A 105 -20.307 26.263 -34.299 1.00 24.03 C ATOM 922 CZ3 TRP A 105 -18.172 25.146 -34.534 1.00 24.44 C ATOM 923 CH2 TRP A 105 -19.548 25.244 -34.807 1.00 26.50 C ATOM 924 HE1 TRP A 105 -21.148 28.643 -32.917 1.00 0.00 H ATOM 925 H TRP A 105 -17.562 29.093 -29.448 1.00 0.00 H ATOM 926 N PHE A 106 -13.850 27.247 -30.736 1.00 22.27 N ATOM 927 CA PHE A 106 -12.410 27.414 -30.538 1.00 21.88 C ATOM 928 C PHE A 106 -11.708 27.295 -31.887 1.00 24.72 C ATOM 929 O PHE A 106 -11.863 26.288 -32.581 1.00 23.09 O ATOM 930 CB PHE A 106 -11.842 26.372 -29.555 1.00 21.08 C ATOM 931 CG PHE A 106 -12.369 26.498 -28.147 1.00 23.60 C ATOM 932 CD1 PHE A 106 -13.574 25.912 -27.788 1.00 22.52 C ATOM 933 CD2 PHE A 106 -11.668 27.221 -27.192 1.00 24.02 C ATOM 934 CE1 PHE A 106 -14.068 26.035 -26.492 1.00 23.07 C ATOM 935 CE2 PHE A 106 -12.153 27.346 -25.904 1.00 25.89 C ATOM 936 CZ PHE A 106 -13.354 26.751 -25.554 1.00 22.61 C ATOM 937 H PHE A 106 -14.190 26.426 -31.277 1.00 0.00 H ATOM 938 N GLN A 107 -10.942 28.320 -32.258 1.00 28.56 N ATOM 939 CA GLN A 107 -10.009 28.190 -33.373 1.00 32.30 C ATOM 940 C GLN A 107 -9.085 27.003 -33.144 1.00 27.02 C ATOM 941 O GLN A 107 -8.722 26.683 -32.012 1.00 22.15 O ATOM 942 CB GLN A 107 -9.171 29.464 -33.527 1.00 31.26 C ATOM 943 CG GLN A 107 -9.980 30.731 -33.497 1.00 38.31 C ATOM 944 CD GLN A 107 -10.928 30.824 -34.667 1.00 43.83 C ATOM 945 OE1 GLN A 107 -10.500 30.816 -35.820 1.00 53.12 O ATOM 946 NE2 GLN A 107 -12.228 30.892 -34.383 1.00 43.58 N ATOM 947 HE22 GLN A 107 -12.544 30.896 -33.392 1.00 0.00 H ATOM 948 HE21 GLN A 107 -12.926 30.941 -35.152 1.00 0.00 H ATOM 949 H GLN A 107 -11.010 29.223 -31.747 1.00 0.00 H ATOM 950 N LEU A 108 -8.676 26.364 -34.238 1.00 27.97 N ATOM 951 CA LEU A 108 -7.989 25.084 -34.108 1.00 34.55 C ATOM 952 C LEU A 108 -6.678 25.220 -33.345 1.00 34.33 C ATOM 953 O LEU A 108 -6.294 24.300 -32.613 1.00 37.67 O ATOM 954 CB LEU A 108 -7.780 24.460 -35.493 1.00 33.03 C ATOM 955 CG LEU A 108 -9.133 24.200 -36.163 1.00 31.68 C ATOM 956 CD1 LEU A 108 -8.996 23.542 -37.522 1.00 41.06 C ATOM 957 CD2 LEU A 108 -10.005 23.358 -35.245 1.00 31.64 C ATOM 958 H LEU A 108 -8.845 26.775 -35.178 1.00 0.00 H ATOM 959 N ASP A 109 -6.002 26.365 -33.457 1.00 33.75 N ATOM 960 CA ASP A 109 -4.765 26.571 -32.709 1.00 35.55 C ATOM 961 C ASP A 109 -4.990 26.872 -31.233 1.00 37.49 C ATOM 962 O ASP A 109 -4.024 26.864 -30.461 1.00 39.64 O ATOM 963 CB ASP A 109 -3.947 27.709 -33.322 1.00 41.87 C ATOM 964 CG ASP A 109 -3.259 27.303 -34.599 1.00 44.42 C ATOM 965 OD1 ASP A 109 -3.150 26.084 -34.850 1.00 44.06 O ATOM 966 OD2 ASP A 109 -2.815 28.201 -35.343 1.00 47.42 O ATOM 967 H ASP A 109 -6.359 27.116 -34.082 1.00 0.00 H ATOM 968 N GLN A 110 -6.220 27.148 -30.822 1.00 31.62 N ATOM 969 CA GLN A 110 -6.508 27.577 -29.462 1.00 30.75 C ATOM 970 C GLN A 110 -7.354 26.545 -28.715 1.00 30.95 C ATOM 971 O GLN A 110 -8.108 26.892 -27.806 1.00 27.86 O ATOM 972 CB GLN A 110 -7.186 28.948 -29.484 1.00 38.25 C ATOM 973 CG GLN A 110 -6.242 30.071 -29.966 1.00 43.54 C ATOM 974 CD GLN A 110 -6.956 31.390 -30.232 1.00 54.19 C ATOM 975 OE1 GLN A 110 -7.843 31.799 -29.480 1.00 53.59 O ATOM 976 NE2 GLN A 110 -6.575 32.059 -31.319 1.00 50.90 N ATOM 977 HE22 GLN A 110 -5.822 31.678 -31.927 1.00 0.00 H ATOM 978 HE21 GLN A 110 -7.031 32.962 -31.560 1.00 0.00 H ATOM 979 H GLN A 110 -7.007 27.055 -31.496 1.00 0.00 H ATOM 980 N ILE A 111 -7.237 25.276 -29.093 1.00 29.01 N ATOM 981 CA ILE A 111 -7.910 24.209 -28.335 1.00 28.03 C ATOM 982 C ILE A 111 -7.429 24.252 -26.893 1.00 29.70 C ATOM 983 O ILE A 111 -6.203 24.218 -26.647 1.00 26.33 O ATOM 984 CB ILE A 111 -7.621 22.830 -28.951 1.00 29.64 C ATOM 985 CG1 ILE A 111 -7.915 22.814 -30.449 1.00 37.08 C ATOM 986 CG2 ILE A 111 -8.392 21.752 -28.216 1.00 25.65 C ATOM 987 CD1 ILE A 111 -9.269 23.358 -30.797 1.00 32.17 C ATOM 988 H ILE A 111 -6.667 25.036 -29.929 1.00 0.00 H ATOM 989 N PRO A 112 -8.327 24.309 -25.903 1.00 23.08 N ATOM 990 CA PRO A 112 -7.920 24.504 -24.492 1.00 25.62 C ATOM 991 C PRO A 112 -7.517 23.204 -23.804 1.00 23.06 C ATOM 992 O PRO A 112 -8.152 22.717 -22.858 1.00 22.31 O ATOM 993 CB PRO A 112 -9.176 25.129 -23.879 1.00 27.75 C ATOM 994 CG PRO A 112 -10.305 24.474 -24.648 1.00 24.88 C ATOM 995 CD PRO A 112 -9.792 24.276 -26.063 1.00 24.97 C ATOM 996 N PHE A 113 -6.403 22.627 -24.256 1.00 24.81 N ATOM 997 CA PHE A 113 -6.041 21.289 -23.805 1.00 26.30 C ATOM 998 C PHE A 113 -5.792 21.229 -22.304 1.00 23.84 C ATOM 999 O PHE A 113 -5.972 20.170 -21.691 1.00 25.89 O ATOM 1000 CB PHE A 113 -4.805 20.790 -24.563 1.00 26.81 C ATOM 1001 CG PHE A 113 -5.087 20.359 -25.975 1.00 26.09 C ATOM 1002 CD1 PHE A 113 -5.771 19.187 -26.227 1.00 28.11 C ATOM 1003 CD2 PHE A 113 -4.663 21.129 -27.050 1.00 29.23 C ATOM 1004 CE1 PHE A 113 -6.026 18.780 -27.525 1.00 29.68 C ATOM 1005 CE2 PHE A 113 -4.918 20.733 -28.354 1.00 30.11 C ATOM 1006 CZ PHE A 113 -5.595 19.557 -28.593 1.00 30.30 C ATOM 1007 H PHE A 113 -5.793 23.132 -24.930 1.00 0.00 H ATOM 1008 N LYS A 114 -5.370 22.336 -21.688 1.00 23.43 N ATOM 1009 CA LYS A 114 -5.125 22.317 -20.250 1.00 26.87 C ATOM 1010 C LYS A 114 -6.413 22.231 -19.453 1.00 25.55 C ATOM 1011 O LYS A 114 -6.377 21.864 -18.271 1.00 25.45 O ATOM 1012 CB LYS A 114 -4.341 23.554 -19.807 1.00 31.34 C ATOM 1013 H LYS A 114 -5.216 23.209 -22.232 1.00 0.00 H ATOM 1014 N ASP A 115 -7.553 22.535 -20.069 1.00 24.94 N ATOM 1015 CA ASP A 115 -8.837 22.472 -19.381 1.00 22.57 C ATOM 1016 C ASP A 115 -9.748 21.412 -19.992 1.00 24.03 C ATOM 1017 O ASP A 115 -10.978 21.526 -19.935 1.00 22.79 O ATOM 1018 CB ASP A 115 -9.517 23.840 -19.396 1.00 24.45 C ATOM 1019 CG ASP A 115 -10.645 23.938 -18.388 1.00 32.08 C ATOM 1020 OD1 ASP A 115 -10.671 23.136 -17.418 1.00 39.12 O ATOM 1021 OD2 ASP A 115 -11.510 24.819 -18.561 1.00 39.78 O ATOM 1022 H ASP A 115 -7.527 22.825 -21.067 1.00 0.00 H ATOM 1023 N MET A 116 -9.150 20.381 -20.582 1.00 24.53 N ATOM 1024 CA MET A 116 -9.849 19.234 -21.136 1.00 27.55 C ATOM 1025 C MET A 116 -9.335 17.975 -20.432 1.00 28.35 C ATOM 1026 O MET A 116 -8.494 18.037 -19.531 1.00 31.40 O ATOM 1027 CB MET A 116 -9.654 19.170 -22.656 1.00 23.36 C ATOM 1028 CG MET A 116 -10.311 20.308 -23.441 1.00 20.17 C ATOM 1029 SD MET A 116 -9.614 20.540 -25.091 1.00 22.23 S ATOM 1030 CE MET A 116 -10.266 19.117 -25.976 1.00 27.08 C ATOM 1031 H MET A 116 -8.112 20.397 -20.652 1.00 0.00 H ATOM 1032 N TRP A 117 -9.822 16.843 -20.853 1.00 24.78 N ATOM 1033 CA TRP A 117 -9.383 15.614 -20.214 1.00 25.15 C ATOM 1034 C TRP A 117 -7.987 15.227 -20.712 1.00 21.30 C ATOM 1035 O TRP A 117 -7.616 15.541 -21.842 1.00 21.30 O ATOM 1036 CB TRP A 117 -10.371 14.494 -20.506 1.00 25.86 C ATOM 1037 CG TRP A 117 -11.772 14.828 -20.097 1.00 29.66 C ATOM 1038 CD1 TRP A 117 -12.765 15.314 -20.894 1.00 32.16 C ATOM 1039 CD2 TRP A 117 -12.327 14.716 -18.786 1.00 34.48 C ATOM 1040 NE1 TRP A 117 -13.913 15.508 -20.162 1.00 34.16 N ATOM 1041 CE2 TRP A 117 -13.670 15.143 -18.863 1.00 39.00 C ATOM 1042 CE3 TRP A 117 -11.824 14.294 -17.554 1.00 38.05 C ATOM 1043 CZ2 TRP A 117 -14.512 15.157 -17.755 1.00 42.44 C ATOM 1044 CZ3 TRP A 117 -12.665 14.310 -16.454 1.00 45.17 C ATOM 1045 CH2 TRP A 117 -13.993 14.739 -16.563 1.00 43.62 C ATOM 1046 HE1 TRP A 117 -14.815 15.871 -20.532 1.00 0.00 H ATOM 1047 H TRP A 117 -10.512 16.819 -21.631 1.00 0.00 H ATOM 1048 N PRO A 118 -7.184 14.547 -19.891 1.00 24.73 N ATOM 1049 CA PRO A 118 -5.796 14.282 -20.317 1.00 23.01 C ATOM 1050 C PRO A 118 -5.696 13.433 -21.588 1.00 21.52 C ATOM 1051 O PRO A 118 -4.746 13.613 -22.368 1.00 22.86 O ATOM 1052 CB PRO A 118 -5.175 13.580 -19.098 1.00 24.77 C ATOM 1053 CG PRO A 118 -6.294 13.269 -18.179 1.00 26.86 C ATOM 1054 CD PRO A 118 -7.425 14.179 -18.489 1.00 25.44 C ATOM 1055 N ASP A 119 -6.651 12.531 -21.835 1.00 16.52 N ATOM 1056 CA ASP A 119 -6.610 11.734 -23.065 1.00 18.97 C ATOM 1057 C ASP A 119 -6.787 12.584 -24.321 1.00 19.58 C ATOM 1058 O ASP A 119 -6.298 12.200 -25.391 1.00 20.97 O ATOM 1059 CB ASP A 119 -7.692 10.642 -23.043 1.00 19.11 C ATOM 1060 CG ASP A 119 -9.081 11.190 -22.675 1.00 19.23 C ATOM 1061 OD1 ASP A 119 -9.252 11.603 -21.523 1.00 22.06 O ATOM 1062 OD2 ASP A 119 -10.000 11.195 -23.523 1.00 22.66 O ATOM 1063 H ASP A 119 -7.425 12.394 -21.153 1.00 0.00 H ATOM 1064 N ASP A 120 -7.498 13.719 -24.226 1.00 18.81 N ATOM 1065 CA ASP A 120 -7.786 14.526 -25.417 1.00 19.09 C ATOM 1066 C ASP A 120 -6.500 14.963 -26.115 1.00 21.22 C ATOM 1067 O ASP A 120 -6.457 15.072 -27.350 1.00 18.71 O ATOM 1068 CB ASP A 120 -8.606 15.762 -25.047 1.00 19.00 C ATOM 1069 CG ASP A 120 -10.054 15.441 -24.683 1.00 24.23 C ATOM 1070 OD1 ASP A 120 -10.684 14.586 -25.328 1.00 24.98 O ATOM 1071 OD2 ASP A 120 -10.574 16.088 -23.760 1.00 25.12 O ATOM 1072 H ASP A 120 -7.849 14.030 -23.297 1.00 0.00 H ATOM 1073 N SER A 121 -5.449 15.232 -25.336 1.00 20.93 N ATOM 1074 CA SER A 121 -4.178 15.666 -25.907 1.00 23.27 C ATOM 1075 C SER A 121 -3.588 14.617 -26.836 1.00 26.59 C ATOM 1076 O SER A 121 -2.745 14.951 -27.677 1.00 29.05 O ATOM 1077 CB SER A 121 -3.175 15.996 -24.791 1.00 23.60 C ATOM 1078 OG SER A 121 -3.535 17.189 -24.102 1.00 29.41 O ATOM 1079 HG SER A 121 -4.431 17.077 -23.696 1.00 0.00 H ATOM 1080 H SER A 121 -5.538 15.130 -24.305 1.00 0.00 H ATOM 1081 N TYR A 122 -4.019 13.360 -26.715 1.00 24.92 N ATOM 1082 CA TYR A 122 -3.466 12.267 -27.504 1.00 22.80 C ATOM 1083 C TYR A 122 -4.253 12.003 -28.781 1.00 23.20 C ATOM 1084 O TYR A 122 -3.658 11.858 -29.852 1.00 23.62 O ATOM 1085 CB TYR A 122 -3.408 10.985 -26.671 1.00 20.49 C ATOM 1086 CG TYR A 122 -2.339 10.989 -25.600 1.00 27.24 C ATOM 1087 CD1 TYR A 122 -1.021 10.649 -25.905 1.00 31.70 C ATOM 1088 CD2 TYR A 122 -2.650 11.316 -24.283 1.00 25.10 C ATOM 1089 CE1 TYR A 122 -0.031 10.651 -24.925 1.00 33.83 C ATOM 1090 CE2 TYR A 122 -1.676 11.315 -23.294 1.00 29.18 C ATOM 1091 CZ TYR A 122 -0.368 10.980 -23.622 1.00 37.43 C ATOM 1092 OH TYR A 122 0.608 10.980 -22.650 1.00 36.13 O ATOM 1093 HH TYR A 122 1.474 10.720 -23.053 1.00 0.00 H ATOM 1094 H TYR A 122 -4.777 13.153 -26.033 1.00 0.00 H ATOM 1095 N TRP A 123 -5.581 11.895 -28.684 1.00 17.86 N ATOM 1096 CA TRP A 123 -6.382 11.524 -29.838 1.00 20.47 C ATOM 1097 C TRP A 123 -7.006 12.710 -30.562 1.00 23.85 C ATOM 1098 O TRP A 123 -7.267 12.618 -31.769 1.00 23.83 O ATOM 1099 CB TRP A 123 -7.474 10.527 -29.421 1.00 19.55 C ATOM 1100 CG TRP A 123 -8.480 10.997 -28.396 1.00 21.94 C ATOM 1101 CD1 TRP A 123 -8.441 10.781 -27.037 1.00 19.13 C ATOM 1102 CD2 TRP A 123 -9.704 11.706 -28.652 1.00 21.03 C ATOM 1103 NE1 TRP A 123 -9.553 11.332 -26.439 1.00 19.19 N ATOM 1104 CE2 TRP A 123 -10.345 11.899 -27.404 1.00 20.04 C ATOM 1105 CE3 TRP A 123 -10.313 12.201 -29.808 1.00 19.89 C ATOM 1106 CZ2 TRP A 123 -11.566 12.562 -27.284 1.00 21.06 C ATOM 1107 CZ3 TRP A 123 -11.526 12.868 -29.688 1.00 23.81 C ATOM 1108 CH2 TRP A 123 -12.139 13.043 -28.429 1.00 21.69 C ATOM 1109 HE1 TRP A 123 -9.759 11.320 -25.420 1.00 0.00 H ATOM 1110 H TRP A 123 -6.047 12.079 -27.772 1.00 0.00 H ATOM 1111 N PHE A 124 -7.246 13.817 -29.872 1.00 22.06 N ATOM 1112 CA PHE A 124 -7.790 14.992 -30.540 1.00 24.07 C ATOM 1113 C PHE A 124 -6.979 15.406 -31.760 1.00 24.79 C ATOM 1114 O PHE A 124 -7.589 15.705 -32.799 1.00 28.33 O ATOM 1115 CB PHE A 124 -7.908 16.138 -29.525 1.00 25.99 C ATOM 1116 CG PHE A 124 -9.143 16.975 -29.684 1.00 27.89 C ATOM 1117 CD1 PHE A 124 -10.343 16.581 -29.115 1.00 33.86 C ATOM 1118 CD2 PHE A 124 -9.099 18.169 -30.381 1.00 30.95 C ATOM 1119 CE1 PHE A 124 -11.479 17.356 -29.257 1.00 31.83 C ATOM 1120 CE2 PHE A 124 -10.230 18.946 -30.525 1.00 36.30 C ATOM 1121 CZ PHE A 124 -11.416 18.539 -29.966 1.00 29.64 C ATOM 1122 H PHE A 124 -7.045 13.846 -28.852 1.00 0.00 H ATOM 1123 N PRO A 125 -5.641 15.431 -31.723 1.00 26.08 N ATOM 1124 CA PRO A 125 -4.896 15.774 -32.940 1.00 25.60 C ATOM 1125 C PRO A 125 -5.170 14.833 -34.100 1.00 28.72 C ATOM 1126 O PRO A 125 -5.146 15.273 -35.256 1.00 31.72 O ATOM 1127 CB PRO A 125 -3.427 15.700 -32.486 1.00 29.01 C ATOM 1128 CG PRO A 125 -3.472 15.906 -31.026 1.00 25.81 C ATOM 1129 CD PRO A 125 -4.747 15.257 -30.563 1.00 25.99 C ATOM 1130 N LEU A 126 -5.408 13.544 -33.843 1.00 23.23 N ATOM 1131 CA LEU A 126 -5.759 12.641 -34.936 1.00 23.40 C ATOM 1132 C LEU A 126 -7.090 13.045 -35.552 1.00 27.64 C ATOM 1133 O LEU A 126 -7.238 13.090 -36.779 1.00 25.84 O ATOM 1134 CB LEU A 126 -5.827 11.195 -34.438 1.00 23.67 C ATOM 1135 CG LEU A 126 -4.563 10.605 -33.813 1.00 26.03 C ATOM 1136 CD1 LEU A 126 -4.801 9.173 -33.372 1.00 24.52 C ATOM 1137 CD2 LEU A 126 -3.432 10.657 -34.802 1.00 32.37 C ATOM 1138 H LEU A 126 -5.344 13.185 -32.869 1.00 0.00 H ATOM 1139 N LEU A 127 -8.074 13.336 -34.708 1.00 25.10 N ATOM 1140 CA LEU A 127 -9.366 13.769 -35.219 1.00 27.40 C ATOM 1141 C LEU A 127 -9.209 15.000 -36.094 1.00 27.38 C ATOM 1142 O LEU A 127 -9.808 15.085 -37.169 1.00 31.32 O ATOM 1143 CB LEU A 127 -10.322 14.055 -34.065 1.00 24.58 C ATOM 1144 CG LEU A 127 -11.682 14.554 -34.561 1.00 37.17 C ATOM 1145 CD1 LEU A 127 -12.347 13.459 -35.379 1.00 30.84 C ATOM 1146 CD2 LEU A 127 -12.573 14.989 -33.415 1.00 36.94 C ATOM 1147 H LEU A 127 -7.921 13.254 -33.683 1.00 0.00 H ATOM 1148 N LEU A 128 -8.380 15.951 -35.664 1.00 25.34 N ATOM 1149 CA LEU A 128 -8.289 17.220 -36.382 1.00 30.56 C ATOM 1150 C LEU A 128 -7.687 17.056 -37.769 1.00 33.53 C ATOM 1151 O LEU A 128 -7.962 17.877 -38.651 1.00 38.50 O ATOM 1152 CB LEU A 128 -7.487 18.239 -35.573 1.00 27.37 C ATOM 1153 CG LEU A 128 -8.194 18.775 -34.324 1.00 25.99 C ATOM 1154 CD1 LEU A 128 -7.380 19.875 -33.661 1.00 32.61 C ATOM 1155 CD2 LEU A 128 -9.606 19.263 -34.647 1.00 33.84 C ATOM 1156 H LEU A 128 -7.798 15.790 -34.817 1.00 0.00 H ATOM 1157 N GLN A 129 -6.867 16.025 -38.000 1.00 29.52 N ATOM 1158 CA GLN A 129 -6.366 15.777 -39.348 1.00 35.41 C ATOM 1159 C GLN A 129 -7.083 14.616 -40.031 1.00 32.88 C ATOM 1160 O GLN A 129 -6.492 13.926 -40.864 1.00 41.04 O ATOM 1161 CB GLN A 129 -4.848 15.569 -39.355 1.00 39.23 C ATOM 1162 CG GLN A 129 -4.261 14.581 -38.365 1.00 38.09 C ATOM 1163 CD GLN A 129 -2.733 14.522 -38.472 1.00 41.63 C ATOM 1164 OE1 GLN A 129 -2.016 14.865 -37.527 1.00 42.13 O ATOM 1165 NE2 GLN A 129 -2.232 14.093 -39.630 1.00 40.35 N ATOM 1166 HE22 GLN A 129 -2.871 13.813 -40.401 1.00 0.00 H ATOM 1167 HE21 GLN A 129 -1.202 14.038 -39.762 1.00 0.00 H ATOM 1168 H GLN A 129 -6.586 15.399 -37.218 1.00 0.00 H ATOM 1169 N LYS A 130 -8.357 14.405 -39.706 1.00 31.06 N ATOM 1170 CA LYS A 130 -9.238 13.497 -40.442 1.00 35.90 C ATOM 1171 C LYS A 130 -8.767 12.043 -40.390 1.00 34.89 C ATOM 1172 O LYS A 130 -9.040 11.253 -41.303 1.00 33.06 O ATOM 1173 CB LYS A 130 -9.403 13.953 -41.897 1.00 38.42 C ATOM 1174 CG LYS A 130 -9.941 15.379 -42.065 1.00 36.50 C ATOM 1175 H LYS A 130 -8.747 14.912 -38.886 1.00 0.00 H ATOM 1176 N LYS A 131 -8.068 11.660 -39.333 1.00 28.74 N ATOM 1177 CA LYS A 131 -7.639 10.281 -39.165 1.00 28.67 C ATOM 1178 C LYS A 131 -8.635 9.560 -38.267 1.00 36.25 C ATOM 1179 O LYS A 131 -9.269 10.176 -37.403 1.00 36.90 O ATOM 1180 CB LYS A 131 -6.228 10.208 -38.574 1.00 34.11 C ATOM 1181 CG LYS A 131 -5.162 10.841 -39.467 1.00 34.78 C ATOM 1182 CD LYS A 131 -3.755 10.563 -38.934 1.00 39.77 C ATOM 1183 H LYS A 131 -7.820 12.361 -38.606 1.00 0.00 H ATOM 1184 N LYS A 132 -8.803 8.270 -38.503 1.00 27.68 N ATOM 1185 CA LYS A 132 -9.630 7.433 -37.649 1.00 26.11 C ATOM 1186 C LYS A 132 -8.722 6.650 -36.714 1.00 27.73 C ATOM 1187 O LYS A 132 -7.556 6.390 -37.036 1.00 28.45 O ATOM 1188 CB LYS A 132 -10.487 6.491 -38.485 1.00 28.22 C ATOM 1189 CG LYS A 132 -11.468 7.213 -39.402 1.00 33.74 C ATOM 1190 CD LYS A 132 -12.289 6.207 -40.206 1.00 38.71 C ATOM 1191 CE LYS A 132 -13.164 6.891 -41.253 1.00 44.11 C ATOM 1192 NZ LYS A 132 -14.195 7.783 -40.643 1.00 44.52 N ATOM 1193 HZ1 LYS A 132 -14.815 7.222 -40.024 1.00 0.00 H ATOM 1194 HZ2 LYS A 132 -13.724 8.524 -40.085 1.00 0.00 H ATOM 1195 HZ3 LYS A 132 -14.761 8.222 -41.397 1.00 0.00 H ATOM 1196 H LYS A 132 -8.330 7.841 -39.324 1.00 0.00 H ATOM 1197 N PHE A 133 -9.250 6.285 -35.547 1.00 21.73 N ATOM 1198 CA PHE A 133 -8.407 5.722 -34.504 1.00 22.52 C ATOM 1199 C PHE A 133 -9.198 4.777 -33.609 1.00 23.75 C ATOM 1200 O PHE A 133 -10.414 4.914 -33.439 1.00 20.60 O ATOM 1201 CB PHE A 133 -7.788 6.834 -33.644 1.00 19.83 C ATOM 1202 CG PHE A 133 -8.813 7.808 -33.099 1.00 23.94 C ATOM 1203 CD1 PHE A 133 -9.212 8.901 -33.844 1.00 23.24 C ATOM 1204 CD2 PHE A 133 -9.379 7.613 -31.848 1.00 23.50 C ATOM 1205 CE1 PHE A 133 -10.151 9.800 -33.354 1.00 24.59 C ATOM 1206 CE2 PHE A 133 -10.302 8.500 -31.347 1.00 23.95 C ATOM 1207 CZ PHE A 133 -10.700 9.601 -32.113 1.00 20.31 C ATOM 1208 H PHE A 133 -10.270 6.403 -35.381 1.00 0.00 H ATOM 1209 N HIS A 134 -8.469 3.838 -33.009 1.00 22.38 N ATOM 1210 CA HIS A 134 -8.936 3.003 -31.915 1.00 23.67 C ATOM 1211 C HIS A 134 -7.998 3.210 -30.737 1.00 26.55 C ATOM 1212 O HIS A 134 -6.775 3.232 -30.905 1.00 23.28 O ATOM 1213 CB HIS A 134 -8.957 1.523 -32.290 1.00 22.78 C ATOM 1214 CG HIS A 134 -10.154 1.118 -33.090 1.00 27.51 C ATOM 1215 ND1 HIS A 134 -10.298 -0.147 -33.622 1.00 36.09 N ATOM 1216 CD2 HIS A 134 -11.268 1.804 -33.442 1.00 26.47 C ATOM 1217 CE1 HIS A 134 -11.447 -0.218 -34.273 1.00 32.43 C ATOM 1218 NE2 HIS A 134 -12.052 0.953 -34.181 1.00 32.29 N ATOM 1219 H HIS A 134 -7.496 3.692 -33.347 1.00 0.00 H ATOM 1220 N GLY A 135 -8.562 3.364 -29.545 1.00 22.18 N ATOM 1221 CA GLY A 135 -7.746 3.729 -28.403 1.00 27.15 C ATOM 1222 C GLY A 135 -8.229 3.104 -27.118 1.00 25.28 C ATOM 1223 O GLY A 135 -9.392 2.698 -26.978 1.00 21.69 O ATOM 1224 H GLY A 135 -9.586 3.223 -29.431 1.00 0.00 H ATOM 1225 N TYR A 136 -7.317 3.069 -26.155 1.00 21.55 N ATOM 1226 CA TYR A 136 -7.584 2.512 -24.840 1.00 22.33 C ATOM 1227 C TYR A 136 -6.769 3.306 -23.835 1.00 26.84 C ATOM 1228 O TYR A 136 -5.575 3.556 -24.058 1.00 23.02 O ATOM 1229 CB TYR A 136 -7.224 1.021 -24.776 1.00 21.61 C ATOM 1230 CG TYR A 136 -7.108 0.500 -23.357 1.00 25.97 C ATOM 1231 CD1 TYR A 136 -8.214 0.008 -22.683 1.00 33.96 C ATOM 1232 CD2 TYR A 136 -5.886 0.516 -22.688 1.00 36.80 C ATOM 1233 CE1 TYR A 136 -8.110 -0.454 -21.377 1.00 37.65 C ATOM 1234 CE2 TYR A 136 -5.771 0.060 -21.389 1.00 34.44 C ATOM 1235 CZ TYR A 136 -6.888 -0.426 -20.739 1.00 38.93 C ATOM 1236 OH TYR A 136 -6.772 -0.886 -19.439 1.00 45.29 O ATOM 1237 HH TYR A 136 -7.656 -1.198 -19.120 1.00 0.00 H ATOM 1238 H TYR A 136 -6.372 3.456 -26.350 1.00 0.00 H ATOM 1239 N PHE A 137 -7.416 3.699 -22.741 1.00 20.27 N ATOM 1240 CA PHE A 137 -6.813 4.528 -21.706 1.00 21.27 C ATOM 1241 C PHE A 137 -7.173 3.985 -20.332 1.00 27.04 C ATOM 1242 O PHE A 137 -8.360 3.813 -20.018 1.00 22.53 O ATOM 1243 CB PHE A 137 -7.279 5.984 -21.810 1.00 24.44 C ATOM 1244 CG PHE A 137 -6.740 6.707 -23.012 1.00 22.59 C ATOM 1245 CD1 PHE A 137 -7.409 6.650 -24.224 1.00 19.73 C ATOM 1246 CD2 PHE A 137 -5.559 7.437 -22.926 1.00 21.21 C ATOM 1247 CE1 PHE A 137 -6.912 7.299 -25.333 1.00 23.56 C ATOM 1248 CE2 PHE A 137 -5.055 8.086 -24.029 1.00 24.02 C ATOM 1249 CZ PHE A 137 -5.739 8.023 -25.241 1.00 23.37 C ATOM 1250 H PHE A 137 -8.404 3.399 -22.618 1.00 0.00 H ATOM 1251 N LYS A 138 -6.156 3.736 -19.513 1.00 20.64 N ATOM 1252 CA LYS A 138 -6.337 3.301 -18.132 1.00 25.16 C ATOM 1253 C LYS A 138 -6.071 4.489 -17.217 1.00 23.80 C ATOM 1254 O LYS A 138 -4.957 5.039 -17.213 1.00 25.58 O ATOM 1255 CB LYS A 138 -5.402 2.133 -17.788 1.00 25.87 C ATOM 1256 CG LYS A 138 -5.636 1.560 -16.399 1.00 30.88 C ATOM 1257 CD LYS A 138 -4.775 0.326 -16.144 1.00 31.48 C ATOM 1258 H LYS A 138 -5.188 3.857 -19.873 1.00 0.00 H ATOM 1259 N PHE A 139 -7.089 4.880 -16.452 1.00 20.73 N ATOM 1260 CA PHE A 139 -7.040 6.011 -15.541 1.00 24.85 C ATOM 1261 C PHE A 139 -6.992 5.556 -14.089 1.00 30.27 C ATOM 1262 O PHE A 139 -7.592 4.546 -13.711 1.00 28.69 O ATOM 1263 CB PHE A 139 -8.259 6.921 -15.713 1.00 26.55 C ATOM 1264 CG PHE A 139 -8.149 7.859 -16.868 1.00 27.05 C ATOM 1265 CD1 PHE A 139 -8.447 7.438 -18.147 1.00 27.54 C ATOM 1266 CD2 PHE A 139 -7.738 9.161 -16.678 1.00 31.43 C ATOM 1267 CE1 PHE A 139 -8.340 8.302 -19.225 1.00 24.73 C ATOM 1268 CE2 PHE A 139 -7.633 10.025 -17.755 1.00 33.68 C ATOM 1269 CZ PHE A 139 -7.938 9.581 -19.033 1.00 28.09 C ATOM 1270 H PHE A 139 -7.976 4.341 -16.511 1.00 0.00 H ATOM 1271 N GLN A 140 -6.281 6.329 -13.276 1.00 26.78 N ATOM 1272 CA GLN A 140 -6.403 6.279 -11.823 1.00 34.44 C ATOM 1273 C GLN A 140 -6.920 7.643 -11.392 1.00 38.81 C ATOM 1274 O GLN A 140 -6.198 8.641 -11.487 1.00 38.46 O ATOM 1275 CB GLN A 140 -5.071 5.946 -11.153 1.00 40.96 C ATOM 1276 CG GLN A 140 -5.166 5.665 -9.649 1.00 41.05 C ATOM 1277 CD GLN A 140 -3.898 5.016 -9.102 1.00 47.11 C ATOM 1278 OE1 GLN A 140 -3.469 3.966 -9.582 1.00 48.94 O ATOM 1279 NE2 GLN A 140 -3.291 5.647 -8.104 1.00 46.19 N ATOM 1280 HE22 GLN A 140 -3.689 6.532 -7.730 1.00 0.00 H ATOM 1281 HE21 GLN A 140 -2.417 5.256 -7.697 1.00 0.00 H ATOM 1282 H GLN A 140 -5.606 7.001 -13.694 1.00 0.00 H ATOM 1283 N GLY A 141 -8.173 7.691 -10.946 1.00 35.86 N ATOM 1284 CA GLY A 141 -8.839 8.967 -10.774 1.00 37.74 C ATOM 1285 C GLY A 141 -9.347 9.499 -12.107 1.00 40.82 C ATOM 1286 O GLY A 141 -9.649 8.740 -13.026 1.00 42.15 O ATOM 1287 H GLY A 141 -8.676 6.809 -10.720 1.00 0.00 H ATOM 1288 N GLN A 142 -9.424 10.824 -12.216 1.00 32.99 N ATOM 1289 CA GLN A 142 -9.781 11.459 -13.475 1.00 35.54 C ATOM 1290 C GLN A 142 -8.649 12.250 -14.117 1.00 36.95 C ATOM 1291 O GLN A 142 -8.817 12.730 -15.244 1.00 36.62 O ATOM 1292 CB GLN A 142 -10.986 12.387 -13.280 1.00 41.69 C ATOM 1293 H GLN A 142 -9.225 11.416 -11.385 1.00 0.00 H ATOM 1294 N ASP A 143 -7.501 12.405 -13.460 1.00 35.82 N ATOM 1295 CA ASP A 143 -6.446 13.252 -14.012 1.00 34.79 C ATOM 1296 C ASP A 143 -5.140 12.521 -14.302 1.00 34.35 C ATOM 1297 O ASP A 143 -4.162 13.179 -14.678 1.00 29.69 O ATOM 1298 CB ASP A 143 -6.156 14.435 -13.081 1.00 36.06 C ATOM 1299 CG ASP A 143 -6.719 14.241 -11.693 1.00 43.63 C ATOM 1300 OD1 ASP A 143 -7.849 14.719 -11.433 1.00 49.82 O ATOM 1301 OD2 ASP A 143 -6.030 13.611 -10.862 1.00 52.76 O ATOM 1302 H ASP A 143 -7.355 11.922 -12.551 1.00 0.00 H ATOM 1303 N THR A 144 -5.079 11.197 -14.146 1.00 29.61 N ATOM 1304 CA THR A 144 -3.814 10.473 -14.287 1.00 27.35 C ATOM 1305 C THR A 144 -4.009 9.288 -15.225 1.00 27.67 C ATOM 1306 O THR A 144 -4.718 8.331 -14.885 1.00 26.49 O ATOM 1307 CB THR A 144 -3.280 10.002 -12.928 1.00 32.15 C ATOM 1308 OG1 THR A 144 -3.231 11.101 -12.010 1.00 30.33 O ATOM 1309 CG2 THR A 144 -1.866 9.402 -13.074 1.00 27.24 C ATOM 1310 HG1 THR A 144 -4.142 11.471 -11.891 1.00 0.00 H ATOM 1311 H THR A 144 -5.946 10.669 -13.920 1.00 0.00 H ATOM 1312 N ILE A 145 -3.381 9.346 -16.397 1.00 21.37 N ATOM 1313 CA ILE A 145 -3.320 8.189 -17.284 1.00 23.50 C ATOM 1314 C ILE A 145 -2.216 7.251 -16.807 1.00 26.08 C ATOM 1315 O ILE A 145 -1.039 7.631 -16.763 1.00 23.54 O ATOM 1316 CB ILE A 145 -3.085 8.611 -18.739 1.00 24.18 C ATOM 1317 CG1 ILE A 145 -4.269 9.432 -19.270 1.00 24.13 C ATOM 1318 CG2 ILE A 145 -2.856 7.365 -19.609 1.00 23.41 C ATOM 1319 CD1 ILE A 145 -3.981 10.098 -20.568 1.00 21.84 C ATOM 1320 H ILE A 145 -2.924 10.234 -16.687 1.00 0.00 H ATOM 1321 N LEU A 146 -2.595 6.024 -16.448 1.00 23.06 N ATOM 1322 CA LEU A 146 -1.614 5.023 -16.049 1.00 24.27 C ATOM 1323 C LEU A 146 -0.942 4.400 -17.262 1.00 28.43 C ATOM 1324 O LEU A 146 0.275 4.204 -17.266 1.00 24.76 O ATOM 1325 CB LEU A 146 -2.265 3.947 -15.182 1.00 24.15 C ATOM 1326 CG LEU A 146 -2.810 4.428 -13.837 1.00 27.33 C ATOM 1327 CD1 LEU A 146 -3.486 3.279 -13.129 1.00 31.47 C ATOM 1328 CD2 LEU A 146 -1.704 5.012 -12.965 1.00 32.94 C ATOM 1329 H LEU A 146 -3.605 5.778 -16.453 1.00 0.00 H ATOM 1330 N ASP A 147 -1.717 4.060 -18.287 1.00 19.68 N ATOM 1331 CA ASP A 147 -1.161 3.590 -19.547 1.00 25.69 C ATOM 1332 C ASP A 147 -2.234 3.728 -20.617 1.00 27.00 C ATOM 1333 O ASP A 147 -3.405 3.985 -20.322 1.00 24.27 O ATOM 1334 CB ASP A 147 -0.645 2.152 -19.442 1.00 30.18 C ATOM 1335 CG ASP A 147 -1.750 1.123 -19.546 1.00 41.31 C ATOM 1336 OD1 ASP A 147 -2.676 1.146 -18.700 1.00 38.13 O ATOM 1337 OD2 ASP A 147 -1.693 0.293 -20.487 1.00 43.14 O ATOM 1338 H ASP A 147 -2.750 4.132 -18.186 1.00 0.00 H ATOM 1339 N TYR A 148 -1.815 3.586 -21.869 1.00 26.41 N ATOM 1340 CA TYR A 148 -2.755 3.774 -22.961 1.00 26.52 C ATOM 1341 C TYR A 148 -2.223 3.123 -24.226 1.00 29.70 C ATOM 1342 O TYR A 148 -1.025 2.827 -24.355 1.00 24.34 O ATOM 1343 CB TYR A 148 -3.030 5.264 -23.204 1.00 25.53 C ATOM 1344 CG TYR A 148 -1.956 5.952 -24.015 1.00 24.22 C ATOM 1345 CD1 TYR A 148 -0.791 6.411 -23.420 1.00 29.16 C ATOM 1346 CD2 TYR A 148 -2.118 6.148 -25.379 1.00 27.85 C ATOM 1347 CE1 TYR A 148 0.184 7.041 -24.169 1.00 30.99 C ATOM 1348 CE2 TYR A 148 -1.163 6.766 -26.129 1.00 27.95 C ATOM 1349 CZ TYR A 148 -0.011 7.210 -25.525 1.00 32.14 C ATOM 1350 OH TYR A 148 0.939 7.832 -26.290 1.00 34.29 O ATOM 1351 HH TYR A 148 1.704 8.092 -25.718 1.00 0.00 H ATOM 1352 H TYR A 148 -0.823 3.343 -22.066 1.00 0.00 H ATOM 1353 N THR A 149 -3.148 2.903 -25.156 1.00 22.31 N ATOM 1354 CA THR A 149 -2.855 2.476 -26.513 1.00 27.39 C ATOM 1355 C THR A 149 -3.724 3.293 -27.449 1.00 29.12 C ATOM 1356 O THR A 149 -4.853 3.651 -27.109 1.00 24.65 O ATOM 1357 CB THR A 149 -3.139 0.980 -26.745 1.00 28.00 C ATOM 1358 OG1 THR A 149 -2.909 0.667 -28.123 1.00 40.71 O ATOM 1359 CG2 THR A 149 -4.570 0.665 -26.434 1.00 27.07 C ATOM 1360 HG1 THR A 149 -3.090 -0.294 -28.277 1.00 0.00 H ATOM 1361 H THR A 149 -4.145 3.046 -24.895 1.00 0.00 H ATOM 1362 N LEU A 150 -3.194 3.578 -28.633 1.00 24.57 N ATOM 1363 CA LEU A 150 -3.884 4.427 -29.597 1.00 21.74 C ATOM 1364 C LEU A 150 -3.274 4.148 -30.957 1.00 30.21 C ATOM 1365 O LEU A 150 -2.060 4.330 -31.147 1.00 28.19 O ATOM 1366 CB LEU A 150 -3.753 5.899 -29.220 1.00 20.53 C ATOM 1367 CG LEU A 150 -4.475 6.948 -30.085 1.00 26.45 C ATOM 1368 CD1 LEU A 150 -5.973 6.671 -30.137 1.00 24.12 C ATOM 1369 CD2 LEU A 150 -4.208 8.351 -29.557 1.00 26.79 C ATOM 1370 H LEU A 150 -2.263 3.186 -28.879 1.00 0.00 H ATOM 1371 N ARG A 151 -4.091 3.680 -31.892 1.00 23.32 N ATOM 1372 CA ARG A 151 -3.582 3.404 -33.220 1.00 25.88 C ATOM 1373 C ARG A 151 -4.576 3.891 -34.259 1.00 27.78 C ATOM 1374 O ARG A 151 -5.795 3.868 -34.052 1.00 23.14 O ATOM 1375 CB ARG A 151 -3.261 1.912 -33.412 1.00 28.86 C ATOM 1376 CG ARG A 151 -4.450 1.001 -33.600 1.00 33.19 C ATOM 1377 CD ARG A 151 -4.027 -0.469 -33.819 1.00 36.99 C ATOM 1378 NE ARG A 151 -5.197 -1.341 -33.753 1.00 42.34 N ATOM 1379 CZ ARG A 151 -5.849 -1.813 -34.813 1.00 47.47 C ATOM 1380 NH1 ARG A 151 -6.930 -2.578 -34.649 1.00 44.50 N ATOM 1381 NH2 ARG A 151 -5.421 -1.524 -36.037 1.00 45.58 N ATOM 1382 HE ARG A 151 -5.545 -1.612 -32.811 1.00 0.00 H ATOM 1383 HH12 ARG A 151 -7.438 -2.946 -35.479 1.00 0.00 H ATOM 1384 HH11 ARG A 151 -7.265 -2.807 -33.691 1.00 0.00 H ATOM 1385 HH22 ARG A 151 -5.930 -1.892 -36.866 1.00 0.00 H ATOM 1386 HH21 ARG A 151 -4.577 -0.930 -36.166 1.00 0.00 H ATOM 1387 H ARG A 151 -5.094 3.512 -31.672 1.00 0.00 H ATOM 1388 N GLU A 152 -4.028 4.350 -35.375 1.00 21.68 N ATOM 1389 CA GLU A 152 -4.826 4.768 -36.510 1.00 25.31 C ATOM 1390 C GLU A 152 -5.351 3.535 -37.229 1.00 28.08 C ATOM 1391 O GLU A 152 -4.655 2.524 -37.328 1.00 28.62 O ATOM 1392 CB GLU A 152 -3.966 5.620 -37.447 1.00 31.72 C ATOM 1393 CG GLU A 152 -4.733 6.527 -38.370 1.00 36.74 C ATOM 1394 CD GLU A 152 -3.830 7.175 -39.401 1.00 46.89 C ATOM 1395 OE1 GLU A 152 -4.140 7.081 -40.610 1.00 48.82 O ATOM 1396 OE2 GLU A 152 -2.802 7.762 -38.997 1.00 44.84 O ATOM 1397 H GLU A 152 -2.992 4.412 -35.438 1.00 0.00 H ATOM 1398 N VAL A 153 -6.591 3.607 -37.717 1.00 24.32 N ATOM 1399 CA VAL A 153 -7.224 2.473 -38.373 1.00 29.54 C ATOM 1400 C VAL A 153 -7.886 2.955 -39.655 1.00 33.06 C ATOM 1401 O VAL A 153 -8.105 4.151 -39.863 1.00 27.20 O ATOM 1402 CB VAL A 153 -8.259 1.771 -37.466 1.00 31.23 C ATOM 1403 CG1 VAL A 153 -7.571 1.095 -36.286 1.00 29.86 C ATOM 1404 CG2 VAL A 153 -9.290 2.773 -36.989 1.00 29.97 C ATOM 1405 H VAL A 153 -7.119 4.498 -37.626 1.00 0.00 H ATOM 1406 N ASP A 154 -8.198 2.000 -40.528 1.00 35.45 N ATOM 1407 CA ASP A 154 -8.908 2.326 -41.759 1.00 35.44 C ATOM 1408 C ASP A 154 -10.416 2.304 -41.577 1.00 36.09 C ATOM 1409 O ASP A 154 -11.121 3.101 -42.208 1.00 42.38 O ATOM 1410 CB ASP A 154 -8.507 1.364 -42.881 1.00 35.53 C ATOM 1411 CG ASP A 154 -7.052 1.514 -43.287 1.00 41.29 C ATOM 1412 OD1 ASP A 154 -6.618 2.649 -43.586 1.00 38.85 O ATOM 1413 OD2 ASP A 154 -6.341 0.489 -43.303 1.00 41.70 O ATOM 1414 H ASP A 154 -7.933 1.014 -40.331 1.00 0.00 H ATOM 1415 N THR A 155 -10.929 1.420 -40.725 1.00 36.18 N ATOM 1416 CA THR A 155 -12.349 1.382 -40.409 1.00 42.04 C ATOM 1417 C THR A 155 -12.513 1.371 -38.899 1.00 40.26 C ATOM 1418 O THR A 155 -11.787 0.667 -38.190 1.00 37.33 O ATOM 1419 CB THR A 155 -13.042 0.158 -41.028 1.00 42.41 C ATOM 1420 OG1 THR A 155 -12.308 -1.023 -40.703 1.00 38.81 O ATOM 1421 CG2 THR A 155 -13.109 0.296 -42.537 1.00 45.37 C ATOM 1422 HG1 THR A 155 -12.272 -1.127 -39.719 1.00 0.00 H ATOM 1423 H THR A 155 -10.294 0.733 -40.270 1.00 0.00 H ATOM 1424 N VAL A 156 -13.461 2.160 -38.412 1.00 38.92 N ATOM 1425 CA VAL A 156 -13.657 2.296 -36.978 1.00 38.68 C ATOM 1426 C VAL A 156 -14.537 1.156 -36.463 1.00 46.47 C ATOM 1427 O VAL A 156 -15.531 0.809 -37.102 1.00 44.71 O ATOM 1428 CB VAL A 156 -14.251 3.670 -36.646 1.00 34.33 C ATOM 1429 CG1 VAL A 156 -14.293 3.894 -35.141 1.00 32.38 C ATOM 1430 CG2 VAL A 156 -13.427 4.753 -37.301 1.00 31.05 C ATOM 1431 OXT VAL A 156 -14.278 0.547 -35.412 1.00 44.73 O ATOM 1432 H VAL A 156 -14.073 2.689 -39.065 1.00 0.00 H TER 1433 VAL A 156 HETATM 1434 O HOH 1 -7.959 -2.860 -32.847 1.00 48.18 O HETATM 1435 O HOH 2 -31.392 22.657 -34.756 1.00 34.82 O HETATM 1436 O HOH 3 -32.167 3.986 -33.330 1.00 35.61 O HETATM 1437 O HOH 4 -12.997 14.530 -24.828 1.00 21.95 O HETATM 1438 O HOH 5 -16.980 4.413 -14.313 1.00 48.83 O HETATM 1439 O HOH 6 -6.495 17.806 -18.067 1.00 40.40 O HETATM 1440 O HOH 7 -18.802 31.319 -22.475 1.00 36.53 O HETATM 1441 O HOH 8 -25.453 3.954 -22.716 1.00 32.54 O HETATM 1442 O HOH 9 -5.698 11.004 -10.600 1.00 44.80 O HETATM 1443 O HOH 10 -28.264 4.195 -37.161 1.00 39.50 O HETATM 1444 O HOH 11 -1.159 -0.945 -22.768 1.00 43.73 O HETATM 1445 O HOH 12 -23.054 23.111 -41.262 1.00 43.98 O HETATM 1446 O HOH 13 -18.743 19.385 -30.729 1.00 21.78 O HETATM 1447 O HOH 14 -3.198 17.070 -36.565 1.00 38.21 O HETATM 1448 O HOH 15 -13.518 0.941 -15.431 1.00 23.35 O HETATM 1449 O HOH 16 -10.356 30.897 -29.889 1.00 35.85 O HETATM 1450 O HOH 17 -6.074 17.668 -22.771 1.00 24.51 O HETATM 1451 O HOH 18 -33.337 14.558 -30.909 1.00 46.04 O HETATM 1452 O HOH 19 -31.536 13.121 -24.967 1.00 45.76 O HETATM 1453 O HOH 20 -36.357 0.151 -22.895 1.00 30.24 O HETATM 1454 O HOH 21 -20.187 32.127 -35.021 1.00 35.10 O HETATM 1455 O HOH 22 -12.158 -2.463 -7.083 1.00 34.12 O HETATM 1456 O HOH 23 -25.850 8.485 -26.961 1.00 30.36 O HETATM 1457 O HOH 24 -14.883 15.345 -24.867 1.00 25.78 O HETATM 1458 O HOH 25 -23.743 27.668 -35.647 1.00 41.18 O HETATM 1459 O HOH 26 -35.661 2.247 -24.821 1.00 36.86 O HETATM 1460 O HOH 27 -1.704 11.628 -16.818 1.00 32.41 O HETATM 1461 O HOH 28 -2.204 14.621 -21.509 1.00 35.04 O HETATM 1462 O HOH 29 -24.839 9.934 -40.314 1.00 47.05 O HETATM 1463 O HOH 30 -25.608 0.465 -32.921 1.00 34.03 O HETATM 1464 O HOH 31 -4.003 24.273 -28.627 1.00 40.39 O HETATM 1465 O HOH 32 -30.649 16.038 -40.631 1.00 41.97 O HETATM 1466 O HOH 33 -24.741 3.063 -35.396 1.00 33.37 O HETATM 1467 O HOH 34 -7.133 6.819 -40.747 1.00 39.20 O HETATM 1468 O HOH 35 -28.427 30.156 -25.967 1.00 38.14 O HETATM 1469 O HOH 36 -26.724 24.977 -42.445 1.00 55.13 O HETATM 1470 O HOH 37 -31.601 10.260 -33.357 1.00 33.91 O HETATM 1471 O HOH 38 -32.803 2.878 -22.282 1.00 31.99 O HETATM 1472 O HOH 39 -10.180 5.180 -10.521 1.00 40.78 O HETATM 1473 O HOH 40 -20.527 30.749 -23.972 1.00 33.67 O HETATM 1474 O HOH 41 -4.347 24.791 -23.180 1.00 38.80 O HETATM 1475 O HOH 42 -28.010 4.607 -15.967 1.00 55.71 O HETATM 1476 O HOH 43 -3.855 8.562 -7.228 1.00 45.95 O HETATM 1477 O HOH 44 -30.094 18.875 -22.308 1.00 38.56 O HETATM 1478 O HOH 45 -28.716 9.249 -22.410 1.00 46.37 O HETATM 1479 O HOH 46 -10.317 27.328 -20.612 1.00 40.10 O HETATM 1480 O HOH 47 -15.278 3.468 -40.628 1.00 45.66 O HETATM 1481 O HOH 48 -25.548 6.546 -17.619 1.00 52.84 O HETATM 1482 O HOH 49 -33.380 1.509 -34.001 1.00 38.66 O HETATM 1483 O HOH 50 -20.573 16.724 -42.512 1.00 45.74 O HETATM 1484 O HOH 51 -1.793 11.611 -9.154 1.00 48.67 O HETATM 1485 O HOH 52 -26.576 10.596 -20.925 1.00 42.53 O HETATM 1486 O HOH 53 -0.776 4.292 -35.680 1.00 38.02 O HETATM 1487 O HOH 54 -20.792 10.905 -22.159 1.00 38.07 O HETATM 1488 O HOH 55 3.999 6.755 -27.569 1.00 56.13 O HETATM 1489 O HOH 56 -6.428 28.248 -36.386 1.00 34.66 O HETATM 1490 O HOH 57 -17.777 24.854 -14.113 1.00 44.71 O HETATM 1491 O HOH 58 -7.667 -2.715 -38.478 1.00 38.07 O HETATM 1492 O HOH 59 -29.023 30.565 -28.968 1.00 43.81 O HETATM 1493 O HOH 60 -22.467 15.964 -9.671 1.00 50.22 O HETATM 1494 O HOH 61 -18.452 3.785 -34.728 1.00 40.12 O HETATM 1495 O HOH 62 -2.808 24.225 -25.259 1.00 48.85 O HETATM 1496 O HOH 63 -12.720 11.152 -40.833 1.00 46.80 O HETATM 1497 O HOH 64 0.512 3.545 -28.512 1.00 36.92 O HETATM 1498 O HOH 65 -26.672 -0.898 -18.175 1.00 55.24 O HETATM 1499 O HOH 66 0.741 14.328 -26.487 1.00 43.59 O HETATM 1500 O HOH 67 -15.388 -3.195 -25.490 1.00 52.92 O HETATM 1501 O HOH 68 -33.891 9.032 -21.373 1.00 52.59 O HETATM 1502 O HOH 69 -6.542 23.017 -14.632 1.00 51.96 O HETATM 1503 O HOH 70 -20.780 16.014 -21.637 1.00 46.24 O HETATM 1504 O HOH 71 -2.691 32.025 -34.851 1.00 46.74 O HETATM 1505 O HOH 72 -5.498 34.621 -28.277 1.00 62.57 O HETATM 1506 O HOH 73 -24.548 13.782 -15.003 1.00 46.09 O HETATM 1507 O HOH 74 -11.502 20.077 -13.113 1.00 45.51 O HETATM 1508 O HOH 75 -11.710 22.744 -12.679 1.00 57.01 O HETATM 1509 O HOH 76 -25.955 19.284 -15.939 1.00 46.89 O HETATM 1510 O HOH 77 -20.907 20.115 -45.116 1.00 57.26 O HETATM 1511 O HOH 78 -11.516 -0.171 -29.147 1.00 45.97 O HETATM 1512 O HOH 79 -1.615 18.798 -27.862 1.00 37.75 O HETATM 1513 O HOH 80 -19.741 13.100 -11.007 1.00 49.04 O HETATM 1514 O HOH 81 1.981 4.809 -21.131 1.00 39.83 O HETATM 1515 O HOH 82 -25.843 19.079 -12.113 1.00 39.88 O HETATM 1516 O HOH 83 -21.735 30.108 -29.356 1.00 35.86 O HETATM 1517 O HOH 84 -19.007 6.590 -46.534 1.00 62.52 O HETATM 1518 O HOH 85 -24.470 0.994 -35.325 1.00 40.42 O HETATM 1519 O HOH 86 -8.767 7.290 -42.833 1.00 49.23 O HETATM 1520 O HOH 87 0.810 14.900 -24.480 1.00 42.72 O HETATM 1521 O HOH 88 -20.845 -2.060 -30.791 1.00 43.07 O HETATM 1522 O HOH 89 -5.192 27.172 -23.404 1.00 51.38 O HETATM 1523 O HOH 90 -9.247 29.213 -41.041 1.00 45.62 O HETATM 1524 O HOH 91 -13.516 13.701 -13.085 1.00 52.05 O HETATM 1525 O HOH 92 -14.812 9.144 -13.438 1.00 40.59 O HETATM 1526 O HOH 93 -0.377 26.433 -27.389 1.00 44.34 O HETATM 1527 O HOH 94 -31.017 -6.280 -20.043 1.00 53.72 O HETATM 1528 O HOH 95 -14.147 -6.853 -21.593 1.00 47.53 O HETATM 1529 O HOH 96 -30.233 33.477 -31.988 1.00 50.13 O HETATM 1530 O HOH 97 -23.878 13.520 -10.402 1.00 50.62 O HETATM 1531 O HOH 98 -23.809 11.565 -18.197 1.00 50.67 O HETATM 1532 O HOH 99 -26.327 10.244 -16.264 1.00 51.26 O HETATM 1533 O HOH 100 -0.412 36.569 -27.154 1.00 64.47 O HETATM 1534 N12 EV A 2 -12.431 12.360 -22.970 1.00 -0.31 N HETATM 1535 C10 EV A 2 -12.708 12.092 -21.616 1.00 0.17 C HETATM 1536 N8 EV A 2 -11.678 11.749 -20.810 1.00 -0.27 N HETATM 1537 C6 EV A 2 -11.913 11.473 -19.457 1.00 0.04 C HETATM 1538 C4 EV A 2 -10.812 11.106 -18.573 1.00 -0.05 C HETATM 1539 C2 EV A 2 -11.035 10.841 -17.222 1.00 -0.06 C HETATM 1540 C1 EV A 2 -12.357 10.924 -16.688 1.00 -0.06 C HETATM 1541 C3 EV A 2 -13.422 11.278 -17.514 1.00 -0.05 C HETATM 1542 C5 EV A 2 -13.204 11.563 -18.933 1.00 0.04 C HETATM 1543 N7 EV A 2 -14.275 11.927 -19.787 1.00 -0.27 N HETATM 1544 C9 EV A 2 -14.098 12.196 -21.081 1.00 0.17 C HETATM 1545 N11 EV A 2 -15.160 12.564 -22.039 1.00 -0.28 N HETATM 1546 C16 EV A 2 -15.374 11.844 -23.309 1.00 0.03 C HETATM 1547 C14 EV A 2 -16.913 11.546 -23.427 1.00 -0.03 C HETATM 1548 C13 EV A 2 -17.580 12.647 -22.687 1.00 -0.03 C HETATM 1549 C15 EV A 2 -16.551 13.112 -21.630 1.00 0.03 C HETATM 1550 H13 EV A 2 -16.523 14.211 -21.595 1.00 0.05 H HETATM 1551 H14 EV A 2 -16.830 12.720 -20.641 1.00 0.05 H HETATM 1552 H11 EV A 2 -18.496 12.283 -22.199 1.00 0.03 H HETATM 1553 H12 EV A 2 -17.831 13.473 -23.369 1.00 0.03 H HETATM 1554 H9 EV A 2 -17.154 10.574 -22.972 1.00 0.03 H HETATM 1555 H10 EV A 2 -17.226 11.545 -24.482 1.00 0.03 H HETATM 1556 H7 EV A 2 -14.808 10.901 -23.307 1.00 0.05 H HETATM 1557 H8 EV A 2 -15.046 12.467 -24.154 1.00 0.05 H HETATM 1558 H5 EV A 2 -14.422 11.343 -17.101 1.00 0.06 H HETATM 1559 H6 EV A 2 -12.532 10.711 -15.639 1.00 0.06 H HETATM 1560 H4 EV A 2 -10.206 10.572 -16.578 1.00 0.06 H HETATM 1561 H3 EV A 2 -9.806 11.038 -18.972 1.00 0.06 H HETATM 1562 H1 EV A 2 -13.194 12.624 -23.609 1.00 0.18 H HETATM 1563 H2 EV A 2 -11.465 12.292 -23.321 1.00 0.18 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1534 1535 1562 1563 CONECT 1535 1534 1536 1544 CONECT 1536 1535 1537 CONECT 1537 1536 1538 1542 CONECT 1538 1537 1539 1561 CONECT 1539 1538 1540 1560 CONECT 1540 1539 1541 1559 CONECT 1541 1540 1542 1558 CONECT 1542 1537 1541 1543 CONECT 1543 1542 1544 CONECT 1544 1535 1543 1545 CONECT 1545 1544 1546 1549 CONECT 1546 1545 1547 1556 1557 CONECT 1547 1546 1548 1554 1555 CONECT 1548 1547 1549 1552 1553 CONECT 1549 1545 1548 1550 1551 CONECT 1550 1549 CONECT 1551 1549 CONECT 1552 1548 CONECT 1553 1548 CONECT 1554 1547 CONECT 1555 1547 CONECT 1556 1546 CONECT 1557 1546 CONECT 1558 1541 CONECT 1559 1540 CONECT 1560 1539 CONECT 1561 1538 CONECT 1562 1534 CONECT 1563 1534 MASTER 0 0 0 0 0 0 0 0 1562 1 34 12 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 6eq6
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3whw
RCSB PDB
PDBbind
156aa, >3WHW_1|Chains... at 100%
4c9w
RCSB PDB
PDBbind
158aa, >4C9W_1|Chain... at 100%
4c9x
RCSB PDB
PDBbind
158aa, >4C9X_1|Chain... at 100%
4n1t
RCSB PDB
PDBbind
159aa, >4N1T_1|Chain... at 98%
4n1u
RCSB PDB
PDBbind
158aa, >4N1U_1|Chains... at 98%
5ans
RCSB PDB
PDBbind
175aa, >5ANS_1|Chain... at 93%
5ant
RCSB PDB
PDBbind
175aa, >5ANT_1|Chains... at 93%
5anu
RCSB PDB
PDBbind
158aa, >5ANU_1|Chain... at 100%
5anv
RCSB PDB
PDBbind
158aa, >5ANV_1|Chain... at 100%
5anw
RCSB PDB
PDBbind
158aa, >5ANW_1|Chain... at 100%
5fsl
RCSB PDB
PDBbind
156aa, >5FSL_1|Chain... at 100%
5fsm
RCSB PDB
PDBbind
156aa, >5FSM_1|Chain... at 100%
5fsn
RCSB PDB
PDBbind
156aa, >5FSN_1|Chain... at 100%
5fso
RCSB PDB
PDBbind
156aa, >5FSO_1|Chain... at 100%
5ngr
RCSB PDB
PDBbind
159aa, >5NGR_1|Chains... at 98%
5ngs
RCSB PDB
PDBbind
159aa, >5NGS_1|Chains... at 98%
5ngt
RCSB PDB
PDBbind
159aa, >5NGT_1|Chain... at 98%
5nhy
RCSB PDB
PDBbind
159aa, >5NHY_1|Chains... at 98%
6f1x
RCSB PDB
PDBbind
159aa, >6F1X_1|Chains... at 98%
6f20
RCSB PDB
PDBbind
159aa, >6F20_1|Chains... at 98%
6f22
RCSB PDB
PDBbind
159aa, >6F22_1|Chains... at 98%
6f23
RCSB PDB
PDBbind
159aa, >6F23_1|Chains... at 98%
6eq7
RCSB PDB
PDBbind
182aa, >6EQ7_1|Chain... at 100%
6eq5
RCSB PDB
PDBbind
182aa, >6EQ5_1|Chain... at 100%
6eq4
RCSB PDB
PDBbind
182aa, >6EQ4_1|Chain... at 100%
6eq3
RCSB PDB
PDBbind
182aa, >6EQ3_1|Chain... at 100%
6eq2
RCSB PDB
PDBbind
182aa, >6EQ2_1|Chain... *
6aa5
RCSB PDB
PDBbind
163aa, >6AA5_1|Chain... at 94%
6aa4
RCSB PDB
PDBbind
163aa, >6AA4_1|Chain... at 94%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3hw1
RCSB PDB
PDBbind
EV2
Entry Information
PDB ID
6eq6
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
7,8-dihydro-8-oxoguanine triphosphatase
Ligand Name
EV2
EC.Number
E.C.3.6.1.55;3.6.1.56
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=15uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Eur.J.Med.Chem. Vol. 175: pp. 107-113
Ligand Properties
Formula
C
1
2
H
1
4
N
4
Molecular Weight
214.266
Exact Mass
214.122
No. of atoms
30
No. of bonds
32
Polar Surface Area
55.04
LOGP Value
1.80 (
Computed with XLOGP3
)
2.46 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 3
Canonical SMILES
Nc1nc2ccccc2nc1N1CCCC1
InChI String
InChI=1S/C12H14N4/c13-11-12(16-7-3-4-8-16)15-10-6-2-1-5-9(10)14-11/h1-2,5-6H,3-4,7-8H2,(H2,13,14)
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):
P36639
Entrez Gene ID
NCBI Entrez Gene ID:
4521
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com