Browse entries in the PDBbind-CN Database
HEADER 2JQL_COMPLEX COMPND 2JQL_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 141 LYS ARG GLN GLN ARG SER ASN LYS PRO SER SER GLU TYR SEQRES 2 A 141 THR CYS LEU GLY HIS LEU VAL ASN LEU ILE PRO GLY LYS SEQRES 3 A 141 GLU GLN LYS VAL GLU ILE THR ASN ARG ASN VAL THR THR SEQRES 4 A 141 ILE GLY ARG SER ARG SER CYS ASP VAL ILE LEU SER GLU SEQRES 5 A 141 PRO ASP ILE SER THR PHE HIS ALA GLU PHE HIS LEU LEU SEQRES 6 A 141 GLN MET ASP VAL ASP ASN PHE GLN ARG ASN LEU ILE ASN SEQRES 7 A 141 VAL ILE ASP LYS SER ARG ASN GLY THR PHE ILE ASN GLY SEQRES 8 A 141 ASN ARG LEU VAL LYS LYS ASP TYR ILE LEU LYS ASN GLY SEQRES 9 A 141 ASP ARG ILE VAL PHE GLY LYS SER CYS SER PHE LEU PHE SEQRES 10 A 141 LYS TYR ALA SER SER SER SER THR ASP ILE GLU ASN ASP SEQRES 11 A 141 ASP GLU LYS VAL SER SER GLU SER ARG SER TYR HET ASN A 142 160 ATOM 1 N LYS A 19 38.037 -19.607 1.934 1.00 0.00 N ATOM 2 CA LYS A 19 37.378 -18.658 0.998 1.00 0.00 C ATOM 3 C LYS A 19 35.872 -18.611 1.233 1.00 0.00 C ATOM 4 O LYS A 19 35.266 -19.601 1.643 1.00 0.00 O ATOM 5 CB LYS A 19 37.678 -19.101 -0.435 1.00 0.00 C ATOM 6 CG LYS A 19 38.804 -18.316 -1.090 1.00 0.00 C ATOM 7 CD LYS A 19 39.873 -19.237 -1.658 1.00 0.00 C ATOM 8 CE LYS A 19 39.684 -19.454 -3.151 1.00 0.00 C ATOM 9 NZ LYS A 19 38.319 -19.957 -3.471 1.00 0.00 N ATOM 10 HA LYS A 19 37.768 -17.655 1.169 1.00 0.00 H ATOM 11 HB2 LYS A 19 37.955 -20.155 -0.420 1.00 0.00 H ATOM 12 HB3 LYS A 19 36.775 -18.973 -1.032 1.00 0.00 H ATOM 13 HG2 LYS A 19 38.391 -17.712 -1.898 1.00 0.00 H ATOM 14 HG3 LYS A 19 39.259 -17.662 -0.346 1.00 0.00 H ATOM 15 HD2 LYS A 19 40.853 -18.792 -1.486 1.00 0.00 H ATOM 16 HD3 LYS A 19 39.818 -20.200 -1.150 1.00 0.00 H ATOM 17 HE2 LYS A 19 40.418 -20.182 -3.497 1.00 0.00 H ATOM 18 HE3 LYS A 19 39.841 -18.507 -3.668 1.00 0.00 H ATOM 19 HZ1 LYS A 19 38.163 -20.864 -2.987 1.00 0.00 H ATOM 20 HZ2 LYS A 19 37.612 -19.265 -3.150 1.00 0.00 H ATOM 21 HZ3 LYS A 19 38.232 -20.091 -4.499 1.00 0.00 H ATOM 22 HN3 LYS A 19 37.648 -20.561 1.790 1.00 0.00 H ATOM 23 HN2 LYS A 19 37.862 -19.304 2.913 1.00 0.00 H ATOM 24 HN1 LYS A 19 39.061 -19.618 1.751 1.00 0.00 H ATOM 25 N ARG A 20 35.273 -17.455 0.969 1.00 0.00 N ATOM 26 CA ARG A 20 33.837 -17.280 1.151 1.00 0.00 C ATOM 27 C ARG A 20 33.060 -17.939 0.015 1.00 0.00 C ATOM 28 O ARG A 20 33.636 -18.332 -0.999 1.00 0.00 O ATOM 29 CB ARG A 20 33.489 -15.791 1.227 1.00 0.00 C ATOM 30 CG ARG A 20 33.403 -15.258 2.648 1.00 0.00 C ATOM 31 CD ARG A 20 34.669 -14.514 3.043 1.00 0.00 C ATOM 32 NE ARG A 20 35.600 -15.367 3.778 1.00 0.00 N ATOM 33 CZ ARG A 20 36.591 -14.903 4.536 1.00 0.00 C ATOM 34 NH1 ARG A 20 36.782 -13.595 4.660 1.00 0.00 N ATOM 35 NH2 ARG A 20 37.391 -15.747 5.171 1.00 0.00 N ATOM 36 HA ARG A 20 33.553 -17.761 2.087 1.00 0.00 H ATOM 37 HB2 ARG A 20 34.256 -15.230 0.694 1.00 0.00 H ATOM 38 HB3 ARG A 20 32.525 -15.637 0.742 1.00 0.00 H ATOM 39 HG2 ARG A 20 32.555 -14.577 2.720 1.00 0.00 H ATOM 40 HG3 ARG A 20 33.256 -16.094 3.332 1.00 0.00 H ATOM 41 HD2 ARG A 20 34.397 -13.666 3.672 1.00 0.00 H ATOM 42 HD3 ARG A 20 35.161 -14.152 2.140 1.00 0.00 H ATOM 43 HE ARG A 20 35.481 -16.398 3.705 1.00 0.00 H ATOM 44 HH12 ARG A 20 37.557 -13.237 5.253 1.00 0.00 H ATOM 45 HH11 ARG A 20 36.156 -12.929 4.164 1.00 0.00 H ATOM 46 HH22 ARG A 20 38.165 -15.384 5.763 1.00 0.00 H ATOM 47 HH21 ARG A 20 37.245 -16.772 5.077 1.00 0.00 H ATOM 48 H ARG A 20 35.842 -16.656 0.624 1.00 0.00 H ATOM 49 N GLN A 21 31.748 -18.056 0.193 1.00 0.00 N ATOM 50 CA GLN A 21 30.891 -18.668 -0.816 1.00 0.00 C ATOM 51 C GLN A 21 29.616 -17.854 -1.012 1.00 0.00 C ATOM 52 O GLN A 21 28.556 -18.405 -1.307 1.00 0.00 O ATOM 53 CB GLN A 21 30.539 -20.101 -0.416 1.00 0.00 C ATOM 54 CG GLN A 21 30.434 -21.054 -1.594 1.00 0.00 C ATOM 55 CD GLN A 21 30.119 -22.475 -1.169 1.00 0.00 C ATOM 56 OE1 GLN A 21 30.865 -23.406 -1.472 1.00 0.00 O ATOM 57 NE2 GLN A 21 29.008 -22.649 -0.463 1.00 0.00 N ATOM 58 HA GLN A 21 31.438 -18.686 -1.759 1.00 0.00 H ATOM 59 HB2 GLN A 21 31.312 -20.470 0.258 1.00 0.00 H ATOM 60 HB3 GLN A 21 29.581 -20.088 0.104 1.00 0.00 H ATOM 61 HG2 GLN A 21 29.643 -20.704 -2.257 1.00 0.00 H ATOM 62 HG3 GLN A 21 31.383 -21.052 -2.130 1.00 0.00 H ATOM 63 HE22 GLN A 21 28.407 -21.833 -0.230 1.00 0.00 H ATOM 64 HE21 GLN A 21 28.739 -23.601 -0.143 1.00 0.00 H ATOM 65 H GLN A 21 31.322 -17.702 1.073 1.00 0.00 H ATOM 66 N GLN A 22 29.728 -16.540 -0.848 1.00 0.00 N ATOM 67 CA GLN A 22 28.584 -15.650 -1.007 1.00 0.00 C ATOM 68 C GLN A 22 29.030 -14.269 -1.477 1.00 0.00 C ATOM 69 O GLN A 22 29.925 -13.661 -0.892 1.00 0.00 O ATOM 70 CB GLN A 22 27.816 -15.533 0.313 1.00 0.00 C ATOM 71 CG GLN A 22 26.330 -15.827 0.180 1.00 0.00 C ATOM 72 CD GLN A 22 25.670 -16.104 1.516 1.00 0.00 C ATOM 73 OE1 GLN A 22 26.188 -15.729 2.568 1.00 0.00 O ATOM 74 NE2 GLN A 22 24.518 -16.764 1.482 1.00 0.00 N ATOM 75 HA GLN A 22 27.926 -16.075 -1.765 1.00 0.00 H ATOM 76 HB2 GLN A 22 28.245 -16.238 1.025 1.00 0.00 H ATOM 77 HB3 GLN A 22 27.934 -14.518 0.692 1.00 0.00 H ATOM 78 HG2 GLN A 22 25.843 -14.966 -0.279 1.00 0.00 H ATOM 79 HG3 GLN A 22 26.202 -16.700 -0.461 1.00 0.00 H ATOM 80 HE22 GLN A 22 24.116 -17.062 0.570 1.00 0.00 H ATOM 81 HE21 GLN A 22 24.018 -16.983 2.367 1.00 0.00 H ATOM 82 H GLN A 22 30.654 -16.137 -0.600 1.00 0.00 H ATOM 83 N ARG A 23 28.398 -13.779 -2.540 1.00 0.00 N ATOM 84 CA ARG A 23 28.730 -12.470 -3.089 1.00 0.00 C ATOM 85 C ARG A 23 27.479 -11.766 -3.610 1.00 0.00 C ATOM 86 O ARG A 23 26.500 -12.413 -3.979 1.00 0.00 O ATOM 87 CB ARG A 23 29.758 -12.612 -4.214 1.00 0.00 C ATOM 88 CG ARG A 23 30.935 -11.657 -4.087 1.00 0.00 C ATOM 89 CD ARG A 23 30.620 -10.298 -4.695 1.00 0.00 C ATOM 90 NE ARG A 23 31.651 -9.869 -5.637 1.00 0.00 N ATOM 91 CZ ARG A 23 31.817 -8.608 -6.031 1.00 0.00 C ATOM 92 NH1 ARG A 23 31.023 -7.651 -5.568 1.00 0.00 N ATOM 93 NH2 ARG A 23 32.780 -8.303 -6.890 1.00 0.00 N ATOM 94 HA ARG A 23 29.159 -11.865 -2.290 1.00 0.00 H ATOM 95 HB2 ARG A 23 30.140 -13.633 -4.206 1.00 0.00 H ATOM 96 HB3 ARG A 23 29.259 -12.420 -5.164 1.00 0.00 H ATOM 97 HG2 ARG A 23 31.173 -11.526 -3.031 1.00 0.00 H ATOM 98 HG3 ARG A 23 31.795 -12.085 -4.602 1.00 0.00 H ATOM 99 HD2 ARG A 23 30.546 -9.562 -3.894 1.00 0.00 H ATOM 100 HD3 ARG A 23 29.667 -10.359 -5.220 1.00 0.00 H ATOM 101 HE ARG A 23 32.293 -10.591 -6.022 1.00 0.00 H ATOM 102 HH12 ARG A 23 31.157 -6.668 -5.879 1.00 0.00 H ATOM 103 HH11 ARG A 23 30.266 -7.884 -4.894 1.00 0.00 H ATOM 104 HH22 ARG A 23 32.910 -7.318 -7.198 1.00 0.00 H ATOM 105 HH21 ARG A 23 33.406 -9.049 -7.256 1.00 0.00 H ATOM 106 H ARG A 23 27.649 -14.343 -2.990 1.00 0.00 H ATOM 107 N SER A 24 27.521 -10.437 -3.635 1.00 0.00 N ATOM 108 CA SER A 24 26.393 -9.645 -4.110 1.00 0.00 C ATOM 109 C SER A 24 25.142 -9.924 -3.281 1.00 0.00 C ATOM 110 O SER A 24 25.175 -10.715 -2.338 1.00 0.00 O ATOM 111 CB SER A 24 26.120 -9.940 -5.586 1.00 0.00 C ATOM 112 OG SER A 24 25.327 -11.105 -5.738 1.00 0.00 O ATOM 113 HA SER A 24 26.650 -8.591 -4.000 1.00 0.00 H ATOM 114 HB2 SER A 24 27.069 -10.086 -6.101 1.00 0.00 H ATOM 115 HB3 SER A 24 25.595 -9.092 -6.027 1.00 0.00 H ATOM 116 HG SER A 24 25.801 -11.879 -5.343 1.00 0.00 H ATOM 117 H SER A 24 28.380 -9.951 -3.308 1.00 0.00 H ATOM 118 N ASN A 25 24.042 -9.269 -3.638 1.00 0.00 N ATOM 119 CA ASN A 25 22.781 -9.447 -2.927 1.00 0.00 C ATOM 120 C ASN A 25 21.702 -9.996 -3.856 1.00 0.00 C ATOM 121 O ASN A 25 21.306 -9.340 -4.820 1.00 0.00 O ATOM 122 CB ASN A 25 22.322 -8.117 -2.323 1.00 0.00 C ATOM 123 CG ASN A 25 22.685 -7.992 -0.856 1.00 0.00 C ATOM 124 OD1 ASN A 25 21.860 -7.602 -0.031 1.00 0.00 O ATOM 125 ND2 ASN A 25 23.928 -8.324 -0.525 1.00 0.00 N ATOM 126 HA ASN A 25 22.944 -10.168 -2.125 1.00 0.00 H ATOM 127 HB2 ASN A 25 22.794 -7.302 -2.871 1.00 0.00 H ATOM 128 HB3 ASN A 25 21.239 -8.042 -2.424 1.00 0.00 H ATOM 129 HD22 ASN A 25 24.592 -8.649 -1.257 1.00 0.00 H ATOM 130 HD21 ASN A 25 24.237 -8.259 0.466 1.00 0.00 H ATOM 131 H ASN A 25 24.081 -8.613 -4.444 1.00 0.00 H ATOM 132 N LYS A 26 21.232 -11.203 -3.561 1.00 0.00 N ATOM 133 CA LYS A 26 20.200 -11.841 -4.371 1.00 0.00 C ATOM 134 C LYS A 26 18.808 -11.584 -3.791 1.00 0.00 C ATOM 135 O LYS A 26 17.918 -11.101 -4.491 1.00 0.00 O ATOM 136 CB LYS A 26 20.460 -13.345 -4.476 1.00 0.00 C ATOM 137 CG LYS A 26 20.541 -13.851 -5.908 1.00 0.00 C ATOM 138 CD LYS A 26 20.895 -15.328 -5.961 1.00 0.00 C ATOM 139 CE LYS A 26 19.945 -16.100 -6.864 1.00 0.00 C ATOM 140 NZ LYS A 26 20.661 -17.112 -7.688 1.00 0.00 N ATOM 141 HA LYS A 26 20.238 -11.405 -5.369 1.00 0.00 H ATOM 142 HB2 LYS A 26 21.404 -13.567 -3.978 1.00 0.00 H ATOM 143 HB3 LYS A 26 19.651 -13.871 -3.970 1.00 0.00 H ATOM 144 HG2 LYS A 26 19.576 -13.701 -6.392 1.00 0.00 H ATOM 145 HG3 LYS A 26 21.305 -13.285 -6.441 1.00 0.00 H ATOM 146 HD2 LYS A 26 21.911 -15.435 -6.342 1.00 0.00 H ATOM 147 HD3 LYS A 26 20.840 -15.741 -4.954 1.00 0.00 H ATOM 148 HE2 LYS A 26 19.441 -15.398 -7.528 1.00 0.00 H ATOM 149 HE3 LYS A 26 19.205 -16.608 -6.245 1.00 0.00 H ATOM 150 HZ1 LYS A 26 21.365 -16.635 -8.287 1.00 0.00 H ATOM 151 HZ2 LYS A 26 21.140 -17.791 -7.062 1.00 0.00 H ATOM 152 HZ3 LYS A 26 19.977 -17.615 -8.288 1.00 0.00 H ATOM 153 H LYS A 26 21.609 -11.705 -2.732 1.00 0.00 H ATOM 154 N PRO A 27 18.598 -11.906 -2.501 1.00 0.00 N ATOM 155 CA PRO A 27 17.302 -11.706 -1.840 1.00 0.00 C ATOM 156 C PRO A 27 16.846 -10.253 -1.888 1.00 0.00 C ATOM 157 O PRO A 27 17.654 -9.343 -2.072 1.00 0.00 O ATOM 158 CB PRO A 27 17.562 -12.134 -0.392 1.00 0.00 C ATOM 159 CG PRO A 27 18.761 -13.015 -0.457 1.00 0.00 C ATOM 160 CD PRO A 27 19.597 -12.489 -1.588 1.00 0.00 C ATOM 161 HA PRO A 27 16.509 -12.273 -2.328 1.00 0.00 H ATOM 162 HD3 PRO A 27 20.297 -11.730 -1.238 1.00 0.00 H ATOM 163 HD2 PRO A 27 20.149 -13.294 -2.074 1.00 0.00 H ATOM 164 HG3 PRO A 27 18.465 -14.046 -0.652 1.00 0.00 H ATOM 165 HG2 PRO A 27 19.317 -12.969 0.479 1.00 0.00 H ATOM 166 HB2 PRO A 27 17.759 -11.264 0.235 1.00 0.00 H ATOM 167 HB3 PRO A 27 16.707 -12.680 0.005 1.00 0.00 H ATOM 168 N SER A 28 15.544 -10.040 -1.720 1.00 0.00 N ATOM 169 CA SER A 28 14.979 -8.697 -1.743 1.00 0.00 C ATOM 170 C SER A 28 13.633 -8.660 -1.026 1.00 0.00 C ATOM 171 O SER A 28 12.668 -9.288 -1.462 1.00 0.00 O ATOM 172 CB SER A 28 14.814 -8.215 -3.186 1.00 0.00 C ATOM 173 OG SER A 28 15.816 -8.762 -4.024 1.00 0.00 O ATOM 174 HA SER A 28 15.667 -8.032 -1.221 1.00 0.00 H ATOM 175 HB2 SER A 28 14.885 -7.128 -3.209 1.00 0.00 H ATOM 176 HB3 SER A 28 13.835 -8.522 -3.554 1.00 0.00 H ATOM 177 HG SER A 28 16.707 -8.483 -3.696 1.00 0.00 H ATOM 178 H SER A 28 14.913 -10.853 -1.568 1.00 0.00 H ATOM 179 N SER A 29 13.575 -7.920 0.078 1.00 0.00 N ATOM 180 CA SER A 29 12.348 -7.802 0.855 1.00 0.00 C ATOM 181 C SER A 29 12.371 -6.546 1.720 1.00 0.00 C ATOM 182 O SER A 29 13.383 -5.849 1.794 1.00 0.00 O ATOM 183 CB SER A 29 12.154 -9.038 1.736 1.00 0.00 C ATOM 184 OG SER A 29 11.651 -10.127 0.983 1.00 0.00 O ATOM 185 HA SER A 29 11.513 -7.727 0.158 1.00 0.00 H ATOM 186 HB2 SER A 29 11.450 -8.800 2.533 1.00 0.00 H ATOM 187 HB3 SER A 29 13.113 -9.319 2.172 1.00 0.00 H ATOM 188 HG SER A 29 12.290 -10.350 0.260 1.00 0.00 H ATOM 189 H SER A 29 14.426 -7.413 0.394 1.00 0.00 H ATOM 190 N GLU A 30 11.248 -6.262 2.374 1.00 0.00 N ATOM 191 CA GLU A 30 11.139 -5.089 3.234 1.00 0.00 C ATOM 192 C GLU A 30 11.368 -3.807 2.437 1.00 0.00 C ATOM 193 O GLU A 30 12.096 -2.914 2.870 1.00 0.00 O ATOM 194 CB GLU A 30 12.145 -5.180 4.383 1.00 0.00 C ATOM 195 CG GLU A 30 11.614 -5.927 5.596 1.00 0.00 C ATOM 196 CD GLU A 30 12.514 -7.073 6.015 1.00 0.00 C ATOM 197 OE1 GLU A 30 12.652 -8.037 5.232 1.00 0.00 O ATOM 198 OE2 GLU A 30 13.083 -7.007 7.125 1.00 0.00 O ATOM 199 HA GLU A 30 10.130 -5.062 3.646 1.00 0.00 H ATOM 200 HB2 GLU A 30 13.035 -5.695 4.023 1.00 0.00 H ATOM 201 HB3 GLU A 30 12.411 -4.169 4.690 1.00 0.00 H ATOM 202 HG2 GLU A 30 11.529 -5.227 6.428 1.00 0.00 H ATOM 203 HG3 GLU A 30 10.628 -6.326 5.357 1.00 0.00 H ATOM 204 H GLU A 30 10.427 -6.892 2.269 1.00 0.00 H ATOM 205 N TYR A 31 10.740 -3.726 1.269 1.00 0.00 N ATOM 206 CA TYR A 31 10.870 -2.557 0.407 1.00 0.00 C ATOM 207 C TYR A 31 10.430 -1.283 1.137 1.00 0.00 C ATOM 208 O TYR A 31 11.226 -0.665 1.845 1.00 0.00 O ATOM 209 CB TYR A 31 10.052 -2.758 -0.874 1.00 0.00 C ATOM 210 CG TYR A 31 10.879 -3.191 -2.063 1.00 0.00 C ATOM 211 CD1 TYR A 31 12.097 -2.585 -2.345 1.00 0.00 C ATOM 212 CD2 TYR A 31 10.443 -4.208 -2.901 1.00 0.00 C ATOM 213 CE1 TYR A 31 12.856 -2.981 -3.430 1.00 0.00 C ATOM 214 CE2 TYR A 31 11.196 -4.610 -3.987 1.00 0.00 C ATOM 215 CZ TYR A 31 12.401 -3.993 -4.248 1.00 0.00 C ATOM 216 OH TYR A 31 13.153 -4.390 -5.329 1.00 0.00 O ATOM 217 HA TYR A 31 11.920 -2.440 0.139 1.00 0.00 H ATOM 218 HB3 TYR A 31 9.562 -1.816 -1.120 1.00 0.00 H ATOM 219 HB2 TYR A 31 9.297 -3.521 -0.684 1.00 0.00 H ATOM 220 HD2 TYR A 31 9.490 -4.698 -2.699 1.00 0.00 H ATOM 221 HE2 TYR A 31 10.839 -5.411 -4.634 1.00 0.00 H ATOM 222 HE1 TYR A 31 13.810 -2.496 -3.638 1.00 0.00 H ATOM 223 HD1 TYR A 31 12.460 -1.784 -1.700 1.00 0.00 H ATOM 224 HH TYR A 31 13.981 -3.849 -5.370 1.00 0.00 H ATOM 225 H TYR A 31 10.140 -4.517 0.961 1.00 0.00 H ATOM 226 N THR A 32 9.167 -0.894 0.968 1.00 0.00 N ATOM 227 CA THR A 32 8.641 0.302 1.617 1.00 0.00 C ATOM 228 C THR A 32 7.218 0.063 2.110 1.00 0.00 C ATOM 229 O THR A 32 6.365 -0.408 1.362 1.00 0.00 O ATOM 230 CB THR A 32 8.669 1.488 0.651 1.00 0.00 C ATOM 231 OG1 THR A 32 8.531 1.047 -0.688 1.00 0.00 O ATOM 232 CG2 THR A 32 9.942 2.300 0.739 1.00 0.00 C ATOM 233 HA THR A 32 9.273 0.531 2.475 1.00 0.00 H ATOM 234 HB THR A 32 7.832 2.122 0.946 1.00 0.00 H ATOM 235 HG1 THR A 32 8.552 1.829 -1.295 1.00 0.00 H ATOM 236 HG23 THR A 32 10.076 2.654 1.761 1.00 0.00 H ATOM 237 HG21 THR A 32 10.790 1.676 0.456 1.00 0.00 H ATOM 238 HG22 THR A 32 9.875 3.153 0.063 1.00 0.00 H ATOM 239 H THR A 32 8.540 -1.457 0.358 1.00 0.00 H ATOM 240 N CYS A 33 6.970 0.392 3.373 1.00 0.00 N ATOM 241 CA CYS A 33 5.648 0.208 3.964 1.00 0.00 C ATOM 242 C CYS A 33 4.593 1.007 3.205 1.00 0.00 C ATOM 243 O CYS A 33 4.865 2.103 2.713 1.00 0.00 O ATOM 244 CB CYS A 33 5.669 0.631 5.432 1.00 0.00 C ATOM 245 SG CYS A 33 4.069 0.503 6.266 1.00 0.00 S ATOM 246 HA CYS A 33 5.388 -0.848 3.897 1.00 0.00 H ATOM 247 HB2 CYS A 33 5.999 1.668 5.484 1.00 0.00 H ATOM 248 HB3 CYS A 33 6.381 -0.003 5.960 1.00 0.00 H ATOM 249 HG CYS A 33 4.203 0.907 7.579 1.00 0.00 H ATOM 250 H CYS A 33 7.735 0.790 3.954 1.00 0.00 H ATOM 251 N LEU A 34 3.389 0.450 3.113 1.00 0.00 N ATOM 252 CA LEU A 34 2.294 1.113 2.413 1.00 0.00 C ATOM 253 C LEU A 34 0.941 0.567 2.863 1.00 0.00 C ATOM 254 O LEU A 34 0.092 1.314 3.349 1.00 0.00 O ATOM 255 CB LEU A 34 2.449 0.940 0.901 1.00 0.00 C ATOM 256 CG LEU A 34 1.806 2.040 0.055 1.00 0.00 C ATOM 257 CD1 LEU A 34 0.292 1.991 0.177 1.00 0.00 C ATOM 258 CD2 LEU A 34 2.333 3.406 0.470 1.00 0.00 C ATOM 259 HA LEU A 34 2.333 2.174 2.658 1.00 0.00 H ATOM 260 HB2 LEU A 34 3.514 0.915 0.671 1.00 0.00 H ATOM 261 HB3 LEU A 34 1.996 -0.011 0.621 1.00 0.00 H ATOM 262 HG LEU A 34 2.070 1.872 -0.989 1.00 0.00 H ATOM 263 HD21 LEU A 34 2.097 3.581 1.520 1.00 0.00 H ATOM 264 HD22 LEU A 34 3.413 3.435 0.329 1.00 0.00 H ATOM 265 HD23 LEU A 34 1.864 4.176 -0.143 1.00 0.00 H ATOM 266 HD11 LEU A 34 -0.068 1.022 -0.169 1.00 0.00 H ATOM 267 HD12 LEU A 34 0.008 2.134 1.220 1.00 0.00 H ATOM 268 HD13 LEU A 34 -0.146 2.782 -0.432 1.00 0.00 H ATOM 269 H LEU A 34 3.224 -0.479 3.550 1.00 0.00 H ATOM 270 N GLY A 35 0.744 -0.738 2.696 1.00 0.00 N ATOM 271 CA GLY A 35 -0.512 -1.354 3.089 1.00 0.00 C ATOM 272 C GLY A 35 -0.317 -2.643 3.863 1.00 0.00 C ATOM 273 O GLY A 35 0.799 -3.151 3.967 1.00 0.00 O ATOM 274 HA3 GLY A 35 -1.090 -1.571 2.191 1.00 0.00 H ATOM 275 HA2 GLY A 35 -1.064 -0.652 3.714 1.00 0.00 H ATOM 276 H GLY A 35 1.496 -1.323 2.280 1.00 0.00 H ATOM 277 N HIS A 36 -1.409 -3.174 4.408 1.00 0.00 N ATOM 278 CA HIS A 36 -1.358 -4.412 5.178 1.00 0.00 C ATOM 279 C HIS A 36 -2.570 -5.288 4.881 1.00 0.00 C ATOM 280 O HIS A 36 -3.562 -4.825 4.319 1.00 0.00 O ATOM 281 CB HIS A 36 -1.299 -4.107 6.676 1.00 0.00 C ATOM 282 CG HIS A 36 0.014 -3.554 7.129 1.00 0.00 C ATOM 283 ND1 HIS A 36 0.489 -2.320 6.736 1.00 0.00 N ATOM 284 CD2 HIS A 36 0.954 -4.071 7.952 1.00 0.00 C ATOM 285 CE1 HIS A 36 1.665 -2.105 7.298 1.00 0.00 C ATOM 286 NE2 HIS A 36 1.969 -3.152 8.042 1.00 0.00 N ATOM 287 HA HIS A 36 -0.457 -4.951 4.886 1.00 0.00 H ATOM 288 HB2 HIS A 36 -2.077 -3.380 6.910 1.00 0.00 H ATOM 289 HB3 HIS A 36 -1.490 -5.030 7.223 1.00 0.00 H ATOM 290 HD2 HIS A 36 0.913 -5.039 8.452 1.00 0.00 H ATOM 291 HE1 HIS A 36 2.280 -1.214 7.169 1.00 0.00 H ATOM 292 H HIS A 36 -2.323 -2.694 4.282 1.00 0.00 H ATOM 293 N LEU A 37 -2.487 -6.557 5.272 1.00 0.00 N ATOM 294 CA LEU A 37 -3.580 -7.500 5.056 1.00 0.00 C ATOM 295 C LEU A 37 -3.985 -8.162 6.368 1.00 0.00 C ATOM 296 O LEU A 37 -3.160 -8.781 7.042 1.00 0.00 O ATOM 297 CB LEU A 37 -3.175 -8.570 4.040 1.00 0.00 C ATOM 298 CG LEU A 37 -2.388 -8.060 2.833 1.00 0.00 C ATOM 299 CD1 LEU A 37 -1.458 -9.144 2.310 1.00 0.00 C ATOM 300 CD2 LEU A 37 -3.338 -7.595 1.739 1.00 0.00 C ATOM 301 HA LEU A 37 -4.432 -6.945 4.663 1.00 0.00 H ATOM 302 HB2 LEU A 37 -2.561 -9.309 4.555 1.00 0.00 H ATOM 303 HB3 LEU A 37 -4.084 -9.047 3.673 1.00 0.00 H ATOM 304 HG LEU A 37 -1.782 -7.210 3.146 1.00 0.00 H ATOM 305 HD21 LEU A 37 -3.967 -8.429 1.427 1.00 0.00 H ATOM 306 HD22 LEU A 37 -3.964 -6.789 2.122 1.00 0.00 H ATOM 307 HD23 LEU A 37 -2.761 -7.235 0.887 1.00 0.00 H ATOM 308 HD11 LEU A 37 -0.759 -9.431 3.095 1.00 0.00 H ATOM 309 HD12 LEU A 37 -2.046 -10.012 2.010 1.00 0.00 H ATOM 310 HD13 LEU A 37 -0.906 -8.764 1.451 1.00 0.00 H ATOM 311 H LEU A 37 -1.621 -6.886 5.744 1.00 0.00 H ATOM 312 N VAL A 38 -5.257 -8.030 6.726 1.00 0.00 N ATOM 313 CA VAL A 38 -5.765 -8.619 7.958 1.00 0.00 C ATOM 314 C VAL A 38 -6.616 -9.850 7.670 1.00 0.00 C ATOM 315 O VAL A 38 -7.613 -9.774 6.952 1.00 0.00 O ATOM 316 CB VAL A 38 -6.603 -7.606 8.761 1.00 0.00 C ATOM 317 CG1 VAL A 38 -6.955 -8.170 10.129 1.00 0.00 C ATOM 318 CG2 VAL A 38 -5.862 -6.285 8.894 1.00 0.00 C ATOM 319 HA VAL A 38 -4.897 -8.912 8.549 1.00 0.00 H ATOM 320 HB VAL A 38 -7.531 -7.421 8.221 1.00 0.00 H ATOM 321 HG11 VAL A 38 -7.531 -9.087 10.005 1.00 0.00 H ATOM 322 HG12 VAL A 38 -6.039 -8.386 10.678 1.00 0.00 H ATOM 323 HG13 VAL A 38 -7.547 -7.439 10.680 1.00 0.00 H ATOM 324 HG21 VAL A 38 -4.917 -6.451 9.411 1.00 0.00 H ATOM 325 HG22 VAL A 38 -5.669 -5.877 7.902 1.00 0.00 H ATOM 326 HG23 VAL A 38 -6.471 -5.584 9.464 1.00 0.00 H ATOM 327 H VAL A 38 -5.905 -7.494 6.113 1.00 0.00 H ATOM 328 N ASN A 39 -6.217 -10.984 8.237 1.00 0.00 N ATOM 329 CA ASN A 39 -6.945 -12.232 8.046 1.00 0.00 C ATOM 330 C ASN A 39 -8.014 -12.404 9.118 1.00 0.00 C ATOM 331 O ASN A 39 -7.704 -12.497 10.307 1.00 0.00 O ATOM 332 CB ASN A 39 -5.981 -13.419 8.075 1.00 0.00 C ATOM 333 CG ASN A 39 -5.223 -13.581 6.772 1.00 0.00 C ATOM 334 OD1 ASN A 39 -4.007 -13.394 6.720 1.00 0.00 O ATOM 335 ND2 ASN A 39 -5.940 -13.932 5.710 1.00 0.00 N ATOM 336 HA ASN A 39 -7.433 -12.195 7.072 1.00 0.00 H ATOM 337 HB2 ASN A 39 -5.263 -13.268 8.881 1.00 0.00 H ATOM 338 HB3 ASN A 39 -6.551 -14.329 8.264 1.00 0.00 H ATOM 339 HD22 ASN A 39 -6.966 -14.079 5.801 1.00 0.00 H ATOM 340 HD21 ASN A 39 -5.476 -14.059 4.788 1.00 0.00 H ATOM 341 H ASN A 39 -5.364 -10.981 8.832 1.00 0.00 H ATOM 342 N LEU A 40 -9.273 -12.445 8.694 1.00 0.00 N ATOM 343 CA LEU A 40 -10.385 -12.605 9.622 1.00 0.00 C ATOM 344 C LEU A 40 -10.635 -14.078 9.923 1.00 0.00 C ATOM 345 O LEU A 40 -11.154 -14.815 9.085 1.00 0.00 O ATOM 346 CB LEU A 40 -11.651 -11.966 9.047 1.00 0.00 C ATOM 347 CG LEU A 40 -11.634 -10.437 8.986 1.00 0.00 C ATOM 348 CD1 LEU A 40 -11.082 -9.963 7.651 1.00 0.00 C ATOM 349 CD2 LEU A 40 -13.030 -9.879 9.216 1.00 0.00 C ATOM 350 HA LEU A 40 -10.124 -12.103 10.554 1.00 0.00 H ATOM 351 HB2 LEU A 40 -11.790 -12.343 8.034 1.00 0.00 H ATOM 352 HB3 LEU A 40 -12.495 -12.271 9.666 1.00 0.00 H ATOM 353 HG LEU A 40 -10.982 -10.068 9.778 1.00 0.00 H ATOM 354 HD21 LEU A 40 -13.702 -10.257 8.446 1.00 0.00 H ATOM 355 HD22 LEU A 40 -13.387 -10.191 10.197 1.00 0.00 H ATOM 356 HD23 LEU A 40 -12.997 -8.791 9.169 1.00 0.00 H ATOM 357 HD11 LEU A 40 -10.065 -10.334 7.528 1.00 0.00 H ATOM 358 HD12 LEU A 40 -11.709 -10.343 6.844 1.00 0.00 H ATOM 359 HD13 LEU A 40 -11.078 -8.873 7.627 1.00 0.00 H ATOM 360 H LEU A 40 -9.469 -12.361 7.676 1.00 0.00 H ATOM 361 N ILE A 41 -10.261 -14.499 11.126 1.00 0.00 N ATOM 362 CA ILE A 41 -10.443 -15.885 11.546 1.00 0.00 C ATOM 363 C ILE A 41 -11.252 -15.953 12.841 1.00 0.00 C ATOM 364 O ILE A 41 -11.074 -15.121 13.731 1.00 0.00 O ATOM 365 CB ILE A 41 -9.088 -16.597 11.757 1.00 0.00 C ATOM 366 CG1 ILE A 41 -8.019 -16.013 10.830 1.00 0.00 C ATOM 367 CG2 ILE A 41 -9.232 -18.093 11.520 1.00 0.00 C ATOM 368 CD1 ILE A 41 -6.654 -16.642 11.008 1.00 0.00 C ATOM 369 HA ILE A 41 -10.984 -16.394 10.748 1.00 0.00 H ATOM 370 HB ILE A 41 -8.774 -16.435 12.788 1.00 0.00 H ATOM 371 HG12 ILE A 41 -8.337 -16.165 9.798 1.00 0.00 H ATOM 372 HG13 ILE A 41 -7.935 -14.945 11.030 1.00 0.00 H ATOM 373 HD11 ILE A 41 -6.316 -16.489 12.033 1.00 0.00 H ATOM 374 HD12 ILE A 41 -6.718 -17.710 10.800 1.00 0.00 H ATOM 375 HD13 ILE A 41 -5.949 -16.178 10.318 1.00 0.00 H ATOM 376 HG21 ILE A 41 -9.961 -18.502 12.219 1.00 0.00 H ATOM 377 HG22 ILE A 41 -9.570 -18.267 10.498 1.00 0.00 H ATOM 378 HG23 ILE A 41 -8.268 -18.578 11.673 1.00 0.00 H ATOM 379 H ILE A 41 -9.827 -13.823 11.786 1.00 0.00 H ATOM 380 N PRO A 42 -12.155 -16.942 12.968 1.00 0.00 N ATOM 381 CA PRO A 42 -12.982 -17.095 14.166 1.00 0.00 C ATOM 382 C PRO A 42 -12.201 -17.652 15.356 1.00 0.00 C ATOM 383 O PRO A 42 -12.744 -17.797 16.451 1.00 0.00 O ATOM 384 CB PRO A 42 -14.065 -18.079 13.724 1.00 0.00 C ATOM 385 CG PRO A 42 -13.430 -18.887 12.646 1.00 0.00 C ATOM 386 CD PRO A 42 -12.442 -17.982 11.959 1.00 0.00 C ATOM 387 HA PRO A 42 -13.371 -16.138 14.514 1.00 0.00 H ATOM 388 HD3 PRO A 42 -11.536 -18.526 11.694 1.00 0.00 H ATOM 389 HD2 PRO A 42 -12.877 -17.543 11.061 1.00 0.00 H ATOM 390 HG3 PRO A 42 -14.184 -19.229 11.937 1.00 0.00 H ATOM 391 HG2 PRO A 42 -12.918 -19.749 13.073 1.00 0.00 H ATOM 392 HB2 PRO A 42 -14.367 -18.717 14.555 1.00 0.00 H ATOM 393 HB3 PRO A 42 -14.936 -17.546 13.342 1.00 0.00 H ATOM 394 N GLY A 43 -10.924 -17.960 15.138 1.00 0.00 N ATOM 395 CA GLY A 43 -10.097 -18.491 16.205 1.00 0.00 C ATOM 396 C GLY A 43 -8.799 -17.719 16.380 1.00 0.00 C ATOM 397 O GLY A 43 -7.970 -18.073 17.219 1.00 0.00 O ATOM 398 HA3 GLY A 43 -9.857 -19.530 15.977 1.00 0.00 H ATOM 399 HA2 GLY A 43 -10.659 -18.445 17.138 1.00 0.00 H ATOM 400 H GLY A 43 -10.515 -17.818 14.192 1.00 0.00 H ATOM 401 N LYS A 44 -8.621 -16.661 15.589 1.00 0.00 N ATOM 402 CA LYS A 44 -7.420 -15.836 15.660 1.00 0.00 C ATOM 403 C LYS A 44 -7.408 -14.808 14.530 1.00 0.00 C ATOM 404 O LYS A 44 -8.432 -14.560 13.894 1.00 0.00 O ATOM 405 CB LYS A 44 -6.160 -16.708 15.593 1.00 0.00 C ATOM 406 CG LYS A 44 -5.191 -16.465 16.739 1.00 0.00 C ATOM 407 CD LYS A 44 -3.960 -17.352 16.625 1.00 0.00 C ATOM 408 CE LYS A 44 -2.770 -16.591 16.060 1.00 0.00 C ATOM 409 NZ LYS A 44 -1.656 -16.489 17.044 1.00 0.00 N ATOM 410 HA LYS A 44 -7.427 -15.308 16.613 1.00 0.00 H ATOM 411 HB2 LYS A 44 -6.463 -17.755 15.614 1.00 0.00 H ATOM 412 HB3 LYS A 44 -5.645 -16.499 14.655 1.00 0.00 H ATOM 413 HG2 LYS A 44 -4.878 -15.421 16.724 1.00 0.00 H ATOM 414 HG3 LYS A 44 -5.696 -16.678 17.681 1.00 0.00 H ATOM 415 HD2 LYS A 44 -3.702 -17.728 17.615 1.00 0.00 H ATOM 416 HD3 LYS A 44 -4.188 -18.191 15.967 1.00 0.00 H ATOM 417 HE2 LYS A 44 -3.092 -15.586 15.787 1.00 0.00 H ATOM 418 HE3 LYS A 44 -2.409 -17.110 15.172 1.00 0.00 H ATOM 419 HZ1 LYS A 44 -1.989 -15.989 17.893 1.00 0.00 H ATOM 420 HZ2 LYS A 44 -1.338 -17.444 17.306 1.00 0.00 H ATOM 421 HZ3 LYS A 44 -0.866 -15.963 16.618 1.00 0.00 H ATOM 422 H LYS A 44 -9.361 -16.416 14.900 1.00 0.00 H ATOM 423 N GLU A 45 -6.244 -14.213 14.284 1.00 0.00 N ATOM 424 CA GLU A 45 -6.105 -13.215 13.228 1.00 0.00 C ATOM 425 C GLU A 45 -4.669 -13.166 12.715 1.00 0.00 C ATOM 426 O GLU A 45 -3.735 -13.547 13.420 1.00 0.00 O ATOM 427 CB GLU A 45 -6.527 -11.837 13.740 1.00 0.00 C ATOM 428 CG GLU A 45 -8.025 -11.595 13.664 1.00 0.00 C ATOM 429 CD GLU A 45 -8.410 -10.185 14.064 1.00 0.00 C ATOM 430 OE1 GLU A 45 -8.031 -9.238 13.343 1.00 0.00 O ATOM 431 OE2 GLU A 45 -9.091 -10.026 15.099 1.00 0.00 O ATOM 432 HA GLU A 45 -6.757 -13.500 12.402 1.00 0.00 H ATOM 433 HB2 GLU A 45 -6.215 -11.745 14.780 1.00 0.00 H ATOM 434 HB3 GLU A 45 -6.024 -11.077 13.142 1.00 0.00 H ATOM 435 HG2 GLU A 45 -8.355 -11.770 12.640 1.00 0.00 H ATOM 436 HG3 GLU A 45 -8.526 -12.296 14.331 1.00 0.00 H ATOM 437 H GLU A 45 -5.414 -14.465 14.857 1.00 0.00 H ATOM 438 N GLN A 46 -4.501 -12.697 11.482 1.00 0.00 N ATOM 439 CA GLN A 46 -3.176 -12.604 10.877 1.00 0.00 C ATOM 440 C GLN A 46 -3.003 -11.284 10.132 1.00 0.00 C ATOM 441 O GLN A 46 -3.849 -10.900 9.323 1.00 0.00 O ATOM 442 CB GLN A 46 -2.947 -13.777 9.922 1.00 0.00 C ATOM 443 CG GLN A 46 -1.523 -14.307 9.942 1.00 0.00 C ATOM 444 CD GLN A 46 -1.462 -15.819 9.842 1.00 0.00 C ATOM 445 OE1 GLN A 46 -2.418 -16.462 9.409 1.00 0.00 O ATOM 446 NE2 GLN A 46 -0.335 -16.394 10.245 1.00 0.00 N ATOM 447 HA GLN A 46 -2.437 -12.644 11.677 1.00 0.00 H ATOM 448 HB2 GLN A 46 -3.621 -14.587 10.202 1.00 0.00 H ATOM 449 HB3 GLN A 46 -3.178 -13.448 8.909 1.00 0.00 H ATOM 450 HG2 GLN A 46 -0.979 -13.879 9.100 1.00 0.00 H ATOM 451 HG3 GLN A 46 -1.049 -13.999 10.874 1.00 0.00 H ATOM 452 HE22 GLN A 46 0.447 -15.810 10.604 1.00 0.00 H ATOM 453 HE21 GLN A 46 -0.235 -17.428 10.202 1.00 0.00 H ATOM 454 H GLN A 46 -5.332 -12.390 10.937 1.00 0.00 H ATOM 455 N LYS A 47 -1.900 -10.598 10.407 1.00 0.00 N ATOM 456 CA LYS A 47 -1.611 -9.322 9.763 1.00 0.00 C ATOM 457 C LYS A 47 -0.393 -9.437 8.851 1.00 0.00 C ATOM 458 O LYS A 47 0.668 -9.897 9.272 1.00 0.00 O ATOM 459 CB LYS A 47 -1.370 -8.238 10.815 1.00 0.00 C ATOM 460 CG LYS A 47 -0.182 -8.524 11.719 1.00 0.00 C ATOM 461 CD LYS A 47 -0.196 -7.639 12.955 1.00 0.00 C ATOM 462 CE LYS A 47 0.751 -6.459 12.804 1.00 0.00 C ATOM 463 NZ LYS A 47 0.610 -5.488 13.924 1.00 0.00 N ATOM 464 HA LYS A 47 -2.474 -9.047 9.157 1.00 0.00 H ATOM 465 HB2 LYS A 47 -1.194 -7.292 10.302 1.00 0.00 H ATOM 466 HB3 LYS A 47 -2.263 -8.153 11.434 1.00 0.00 H ATOM 467 HG2 LYS A 47 -0.217 -9.568 12.030 1.00 0.00 H ATOM 468 HG3 LYS A 47 0.738 -8.342 11.163 1.00 0.00 H ATOM 469 HD2 LYS A 47 -1.208 -7.264 13.112 1.00 0.00 H ATOM 470 HD3 LYS A 47 0.109 -8.230 13.818 1.00 0.00 H ATOM 471 HE2 LYS A 47 0.533 -5.949 11.866 1.00 0.00 H ATOM 472 HE3 LYS A 47 1.776 -6.829 12.785 1.00 0.00 H ATOM 473 HZ1 LYS A 47 -0.364 -5.124 13.945 1.00 0.00 H ATOM 474 HZ2 LYS A 47 0.823 -5.965 14.823 1.00 0.00 H ATOM 475 HZ3 LYS A 47 1.273 -4.699 13.783 1.00 0.00 H ATOM 476 H LYS A 47 -1.225 -10.980 11.099 1.00 0.00 H ATOM 477 N VAL A 48 -0.552 -9.015 7.601 1.00 0.00 N ATOM 478 CA VAL A 48 0.536 -9.069 6.632 1.00 0.00 C ATOM 479 C VAL A 48 0.967 -7.667 6.215 1.00 0.00 C ATOM 480 O VAL A 48 0.165 -6.733 6.221 1.00 0.00 O ATOM 481 CB VAL A 48 0.136 -9.866 5.376 1.00 0.00 C ATOM 482 CG1 VAL A 48 1.339 -10.068 4.466 1.00 0.00 C ATOM 483 CG2 VAL A 48 -0.478 -11.204 5.762 1.00 0.00 C ATOM 484 HA VAL A 48 1.369 -9.575 7.121 1.00 0.00 H ATOM 485 HB VAL A 48 -0.613 -9.293 4.830 1.00 0.00 H ATOM 486 HG11 VAL A 48 1.729 -9.097 4.160 1.00 0.00 H ATOM 487 HG12 VAL A 48 2.111 -10.618 5.004 1.00 0.00 H ATOM 488 HG13 VAL A 48 1.035 -10.633 3.585 1.00 0.00 H ATOM 489 HG21 VAL A 48 0.247 -11.784 6.332 1.00 0.00 H ATOM 490 HG22 VAL A 48 -1.367 -11.033 6.370 1.00 0.00 H ATOM 491 HG23 VAL A 48 -0.753 -11.750 4.860 1.00 0.00 H ATOM 492 H VAL A 48 -1.475 -8.637 7.307 1.00 0.00 H ATOM 493 N GLU A 49 2.238 -7.526 5.855 1.00 0.00 N ATOM 494 CA GLU A 49 2.774 -6.235 5.436 1.00 0.00 C ATOM 495 C GLU A 49 2.906 -6.164 3.918 1.00 0.00 C ATOM 496 O GLU A 49 3.452 -7.070 3.289 1.00 0.00 O ATOM 497 CB GLU A 49 4.135 -5.989 6.095 1.00 0.00 C ATOM 498 CG GLU A 49 4.156 -4.774 7.007 1.00 0.00 C ATOM 499 CD GLU A 49 5.533 -4.499 7.580 1.00 0.00 C ATOM 500 OE1 GLU A 49 5.887 -5.124 8.601 1.00 0.00 O ATOM 501 OE2 GLU A 49 6.257 -3.659 7.006 1.00 0.00 O ATOM 502 HA GLU A 49 2.078 -5.459 5.754 1.00 0.00 H ATOM 503 HB2 GLU A 49 4.397 -6.868 6.684 1.00 0.00 H ATOM 504 HB3 GLU A 49 4.878 -5.845 5.310 1.00 0.00 H ATOM 505 HG2 GLU A 49 3.835 -3.903 6.436 1.00 0.00 H ATOM 506 HG3 GLU A 49 3.462 -4.943 7.831 1.00 0.00 H ATOM 507 H GLU A 49 2.866 -8.355 5.872 1.00 0.00 H ATOM 508 N ILE A 50 2.404 -5.078 3.337 1.00 0.00 N ATOM 509 CA ILE A 50 2.465 -4.885 1.892 1.00 0.00 C ATOM 510 C ILE A 50 3.426 -3.755 1.535 1.00 0.00 C ATOM 511 O ILE A 50 3.277 -2.628 2.004 1.00 0.00 O ATOM 512 CB ILE A 50 1.073 -4.575 1.308 1.00 0.00 C ATOM 513 CG1 ILE A 50 0.084 -5.678 1.685 1.00 0.00 C ATOM 514 CG2 ILE A 50 1.149 -4.422 -0.206 1.00 0.00 C ATOM 515 CD1 ILE A 50 0.511 -7.053 1.221 1.00 0.00 C ATOM 516 HA ILE A 50 2.828 -5.817 1.458 1.00 0.00 H ATOM 517 HB ILE A 50 0.722 -3.633 1.730 1.00 0.00 H ATOM 518 HG12 ILE A 50 -0.017 -5.695 2.770 1.00 0.00 H ATOM 519 HG13 ILE A 50 -0.881 -5.446 1.235 1.00 0.00 H ATOM 520 HD11 ILE A 50 0.606 -7.055 0.135 1.00 0.00 H ATOM 521 HD12 ILE A 50 1.471 -7.305 1.672 1.00 0.00 H ATOM 522 HD13 ILE A 50 -0.237 -7.786 1.523 1.00 0.00 H ATOM 523 HG21 ILE A 50 1.827 -3.605 -0.454 1.00 0.00 H ATOM 524 HG22 ILE A 50 1.519 -5.348 -0.645 1.00 0.00 H ATOM 525 HG23 ILE A 50 0.156 -4.203 -0.598 1.00 0.00 H ATOM 526 H ILE A 50 1.957 -4.348 3.927 1.00 0.00 H ATOM 527 N THR A 51 4.414 -4.069 0.704 1.00 0.00 N ATOM 528 CA THR A 51 5.405 -3.086 0.285 1.00 0.00 C ATOM 529 C THR A 51 5.143 -2.610 -1.141 1.00 0.00 C ATOM 530 O THR A 51 4.340 -3.197 -1.865 1.00 0.00 O ATOM 531 CB THR A 51 6.809 -3.681 0.380 1.00 0.00 C ATOM 532 OG1 THR A 51 6.760 -5.096 0.320 1.00 0.00 O ATOM 533 CG2 THR A 51 7.534 -3.301 1.649 1.00 0.00 C ATOM 534 HA THR A 51 5.328 -2.228 0.952 1.00 0.00 H ATOM 535 HB THR A 51 7.355 -3.269 -0.469 1.00 0.00 H ATOM 536 HG1 THR A 51 7.679 -5.460 0.383 1.00 0.00 H ATOM 537 HG23 THR A 51 7.588 -2.215 1.724 1.00 0.00 H ATOM 538 HG21 THR A 51 6.994 -3.699 2.508 1.00 0.00 H ATOM 539 HG22 THR A 51 8.542 -3.716 1.628 1.00 0.00 H ATOM 540 H THR A 51 4.482 -5.042 0.343 1.00 0.00 H ATOM 541 N ASN A 52 5.835 -1.546 -1.538 1.00 0.00 N ATOM 542 CA ASN A 52 5.687 -0.992 -2.880 1.00 0.00 C ATOM 543 C ASN A 52 6.505 -1.801 -3.881 1.00 0.00 C ATOM 544 O ASN A 52 7.415 -1.280 -4.528 1.00 0.00 O ATOM 545 CB ASN A 52 6.125 0.473 -2.901 1.00 0.00 C ATOM 546 CG ASN A 52 5.026 1.411 -2.443 1.00 0.00 C ATOM 547 OD1 ASN A 52 4.087 1.696 -3.186 1.00 0.00 O ATOM 548 ND2 ASN A 52 5.139 1.898 -1.213 1.00 0.00 N ATOM 549 HA ASN A 52 4.636 -1.046 -3.164 1.00 0.00 H ATOM 550 HB2 ASN A 52 6.984 0.591 -2.241 1.00 0.00 H ATOM 551 HB3 ASN A 52 6.411 0.739 -3.919 1.00 0.00 H ATOM 552 HD22 ASN A 52 5.950 1.630 -0.620 1.00 0.00 H ATOM 553 HD21 ASN A 52 4.416 2.548 -0.843 1.00 0.00 H ATOM 554 H ASN A 52 6.499 -1.097 -0.875 1.00 0.00 H ATOM 555 N ARG A 53 6.176 -3.083 -3.996 1.00 0.00 N ATOM 556 CA ARG A 53 6.874 -3.983 -4.906 1.00 0.00 C ATOM 557 C ARG A 53 6.285 -3.940 -6.306 1.00 0.00 C ATOM 558 O ARG A 53 6.750 -4.651 -7.197 1.00 0.00 O ATOM 559 CB ARG A 53 6.813 -5.413 -4.364 1.00 0.00 C ATOM 560 CG ARG A 53 7.778 -6.373 -5.042 1.00 0.00 C ATOM 561 CD ARG A 53 7.585 -7.798 -4.546 1.00 0.00 C ATOM 562 NE ARG A 53 8.855 -8.441 -4.217 1.00 0.00 N ATOM 563 CZ ARG A 53 8.965 -9.502 -3.420 1.00 0.00 C ATOM 564 NH1 ARG A 53 7.885 -10.047 -2.875 1.00 0.00 N ATOM 565 NH2 ARG A 53 10.159 -10.022 -3.170 1.00 0.00 N ATOM 566 HA ARG A 53 7.911 -3.653 -4.971 1.00 0.00 H ATOM 567 HB2 ARG A 53 7.046 -5.387 -3.300 1.00 0.00 H ATOM 568 HB3 ARG A 53 5.800 -5.790 -4.503 1.00 0.00 H ATOM 569 HG2 ARG A 53 7.608 -6.346 -6.118 1.00 0.00 H ATOM 570 HG3 ARG A 53 8.800 -6.058 -4.829 1.00 0.00 H ATOM 571 HD2 ARG A 53 7.088 -8.377 -5.324 1.00 0.00 H ATOM 572 HD3 ARG A 53 6.959 -7.778 -3.654 1.00 0.00 H ATOM 573 HE ARG A 53 9.724 -8.047 -4.630 1.00 0.00 H ATOM 574 HH12 ARG A 53 7.978 -10.876 -2.253 1.00 0.00 H ATOM 575 HH11 ARG A 53 6.945 -9.646 -3.069 1.00 0.00 H ATOM 576 HH22 ARG A 53 10.245 -10.851 -2.548 1.00 0.00 H ATOM 577 HH21 ARG A 53 11.009 -9.601 -3.596 1.00 0.00 H ATOM 578 H ARG A 53 5.396 -3.456 -3.419 1.00 0.00 H ATOM 579 N ASN A 54 5.251 -3.129 -6.506 1.00 0.00 N ATOM 580 CA ASN A 54 4.606 -3.046 -7.810 1.00 0.00 C ATOM 581 C ASN A 54 3.808 -4.319 -8.066 1.00 0.00 C ATOM 582 O ASN A 54 2.740 -4.283 -8.674 1.00 0.00 O ATOM 583 CB ASN A 54 5.641 -2.837 -8.921 1.00 0.00 C ATOM 584 CG ASN A 54 5.028 -2.254 -10.179 1.00 0.00 C ATOM 585 OD1 ASN A 54 5.134 -1.055 -10.437 1.00 0.00 O ATOM 586 ND2 ASN A 54 4.381 -3.103 -10.970 1.00 0.00 N ATOM 587 HA ASN A 54 3.932 -2.189 -7.812 1.00 0.00 H ATOM 588 HB2 ASN A 54 6.411 -2.156 -8.559 1.00 0.00 H ATOM 589 HB3 ASN A 54 6.093 -3.799 -9.164 1.00 0.00 H ATOM 590 HD22 ASN A 54 4.317 -4.108 -10.712 1.00 0.00 H ATOM 591 HD21 ASN A 54 3.939 -2.762 -11.847 1.00 0.00 H ATOM 592 H ASN A 54 4.897 -2.546 -5.721 1.00 0.00 H ATOM 593 N VAL A 55 4.336 -5.445 -7.584 1.00 0.00 N ATOM 594 CA VAL A 55 3.677 -6.730 -7.738 1.00 0.00 C ATOM 595 C VAL A 55 3.750 -7.529 -6.439 1.00 0.00 C ATOM 596 O VAL A 55 4.805 -7.617 -5.811 1.00 0.00 O ATOM 597 CB VAL A 55 4.311 -7.553 -8.869 1.00 0.00 C ATOM 598 CG1 VAL A 55 3.614 -8.903 -9.009 1.00 0.00 C ATOM 599 CG2 VAL A 55 4.266 -6.781 -10.180 1.00 0.00 C ATOM 600 HA VAL A 55 2.635 -6.531 -7.989 1.00 0.00 H ATOM 601 HB VAL A 55 5.356 -7.737 -8.617 1.00 0.00 H ATOM 602 HG11 VAL A 55 3.706 -9.457 -8.075 1.00 0.00 H ATOM 603 HG12 VAL A 55 2.560 -8.744 -9.236 1.00 0.00 H ATOM 604 HG13 VAL A 55 4.080 -9.469 -9.816 1.00 0.00 H ATOM 605 HG21 VAL A 55 3.229 -6.564 -10.437 1.00 0.00 H ATOM 606 HG22 VAL A 55 4.817 -5.847 -10.069 1.00 0.00 H ATOM 607 HG23 VAL A 55 4.720 -7.381 -10.969 1.00 0.00 H ATOM 608 H VAL A 55 5.246 -5.402 -7.083 1.00 0.00 H ATOM 609 N THR A 56 2.623 -8.104 -6.048 1.00 0.00 N ATOM 610 CA THR A 56 2.546 -8.894 -4.826 1.00 0.00 C ATOM 611 C THR A 56 1.999 -10.285 -5.133 1.00 0.00 C ATOM 612 O THR A 56 0.986 -10.419 -5.817 1.00 0.00 O ATOM 613 CB THR A 56 1.655 -8.179 -3.805 1.00 0.00 C ATOM 614 OG1 THR A 56 2.230 -6.942 -3.423 1.00 0.00 O ATOM 615 CG2 THR A 56 1.408 -8.974 -2.540 1.00 0.00 C ATOM 616 HA THR A 56 3.546 -9.004 -4.405 1.00 0.00 H ATOM 617 HB THR A 56 0.700 -8.042 -4.313 1.00 0.00 H ATOM 618 HG1 THR A 56 3.118 -7.104 -3.017 1.00 0.00 H ATOM 619 HG23 THR A 56 0.964 -9.936 -2.798 1.00 0.00 H ATOM 620 HG21 THR A 56 2.354 -9.136 -2.023 1.00 0.00 H ATOM 621 HG22 THR A 56 0.729 -8.421 -1.892 1.00 0.00 H ATOM 622 H THR A 56 1.769 -7.988 -6.630 1.00 0.00 H ATOM 623 N THR A 57 2.672 -11.320 -4.635 1.00 0.00 N ATOM 624 CA THR A 57 2.235 -12.691 -4.880 1.00 0.00 C ATOM 625 C THR A 57 1.554 -13.284 -3.649 1.00 0.00 C ATOM 626 O THR A 57 2.004 -13.087 -2.521 1.00 0.00 O ATOM 627 CB THR A 57 3.423 -13.559 -5.301 1.00 0.00 C ATOM 628 OG1 THR A 57 4.648 -12.913 -5.001 1.00 0.00 O ATOM 629 CG2 THR A 57 3.425 -13.886 -6.779 1.00 0.00 C ATOM 630 HA THR A 57 1.506 -12.672 -5.690 1.00 0.00 H ATOM 631 HB THR A 57 3.320 -14.487 -4.738 1.00 0.00 H ATOM 632 HG1 THR A 57 5.402 -13.491 -5.281 1.00 0.00 H ATOM 633 HG23 THR A 57 2.492 -14.385 -7.041 1.00 0.00 H ATOM 634 HG21 THR A 57 3.519 -12.965 -7.354 1.00 0.00 H ATOM 635 HG22 THR A 57 4.265 -14.543 -7.003 1.00 0.00 H ATOM 636 H THR A 57 3.523 -11.149 -4.062 1.00 0.00 H ATOM 637 N ILE A 58 0.465 -14.011 -3.876 1.00 0.00 N ATOM 638 CA ILE A 58 -0.280 -14.633 -2.787 1.00 0.00 C ATOM 639 C ILE A 58 -0.524 -16.112 -3.065 1.00 0.00 C ATOM 640 O ILE A 58 -1.044 -16.478 -4.122 1.00 0.00 O ATOM 641 CB ILE A 58 -1.633 -13.932 -2.559 1.00 0.00 C ATOM 642 CG1 ILE A 58 -1.428 -12.427 -2.379 1.00 0.00 C ATOM 643 CG2 ILE A 58 -2.344 -14.523 -1.350 1.00 0.00 C ATOM 644 CD1 ILE A 58 -1.361 -11.666 -3.684 1.00 0.00 C ATOM 645 HA ILE A 58 0.327 -14.531 -1.888 1.00 0.00 H ATOM 646 HB ILE A 58 -2.259 -14.094 -3.437 1.00 0.00 H ATOM 647 HG12 ILE A 58 -2.258 -12.033 -1.792 1.00 0.00 H ATOM 648 HG13 ILE A 58 -0.495 -12.268 -1.838 1.00 0.00 H ATOM 649 HD11 ILE A 58 -0.528 -12.040 -4.279 1.00 0.00 H ATOM 650 HD12 ILE A 58 -2.292 -11.805 -4.233 1.00 0.00 H ATOM 651 HD13 ILE A 58 -1.214 -10.606 -3.478 1.00 0.00 H ATOM 652 HG21 ILE A 58 -2.519 -15.586 -1.517 1.00 0.00 H ATOM 653 HG22 ILE A 58 -1.723 -14.391 -0.464 1.00 0.00 H ATOM 654 HG23 ILE A 58 -3.297 -14.014 -1.206 1.00 0.00 H ATOM 655 H ILE A 58 0.136 -14.140 -4.854 1.00 0.00 H ATOM 656 N GLY A 59 -0.148 -16.957 -2.110 1.00 0.00 N ATOM 657 CA GLY A 59 -0.332 -18.387 -2.266 1.00 0.00 C ATOM 658 C GLY A 59 0.411 -19.187 -1.214 1.00 0.00 C ATOM 659 O GLY A 59 0.468 -18.791 -0.049 1.00 0.00 O ATOM 660 HA3 GLY A 59 0.032 -18.681 -3.251 1.00 0.00 H ATOM 661 HA2 GLY A 59 -1.396 -18.613 -2.191 1.00 0.00 H ATOM 662 H GLY A 59 0.284 -16.587 -1.239 1.00 0.00 H ATOM 663 N ARG A 60 0.982 -20.314 -1.624 1.00 0.00 N ATOM 664 CA ARG A 60 1.726 -21.174 -0.711 1.00 0.00 C ATOM 665 C ARG A 60 3.230 -20.980 -0.879 1.00 0.00 C ATOM 666 O ARG A 60 3.999 -21.157 0.067 1.00 0.00 O ATOM 667 CB ARG A 60 1.362 -22.641 -0.950 1.00 0.00 C ATOM 668 CG ARG A 60 1.207 -23.447 0.330 1.00 0.00 C ATOM 669 CD ARG A 60 1.143 -24.939 0.043 1.00 0.00 C ATOM 670 NE ARG A 60 1.932 -25.714 0.998 1.00 0.00 N ATOM 671 CZ ARG A 60 1.781 -27.021 1.196 1.00 0.00 C ATOM 672 NH1 ARG A 60 0.874 -27.703 0.508 1.00 0.00 N ATOM 673 NH2 ARG A 60 2.540 -27.649 2.084 1.00 0.00 N ATOM 674 HA ARG A 60 1.455 -20.898 0.308 1.00 0.00 H ATOM 675 HB2 ARG A 60 0.420 -22.678 -1.497 1.00 0.00 H ATOM 676 HB3 ARG A 60 2.148 -23.098 -1.552 1.00 0.00 H ATOM 677 HG2 ARG A 60 2.058 -23.247 0.980 1.00 0.00 H ATOM 678 HG3 ARG A 60 0.289 -23.143 0.832 1.00 0.00 H ATOM 679 HD2 ARG A 60 1.526 -25.121 -0.961 1.00 0.00 H ATOM 680 HD3 ARG A 60 0.104 -25.264 0.098 1.00 0.00 H ATOM 681 HE ARG A 60 2.654 -25.215 1.556 1.00 0.00 H ATOM 682 HH12 ARG A 60 0.761 -28.724 0.667 1.00 0.00 H ATOM 683 HH11 ARG A 60 0.277 -27.216 -0.190 1.00 0.00 H ATOM 684 HH22 ARG A 60 2.422 -28.671 2.239 1.00 0.00 H ATOM 685 HH21 ARG A 60 3.253 -27.120 2.625 1.00 0.00 H ATOM 686 H ARG A 60 0.896 -20.591 -2.623 1.00 0.00 H ATOM 687 N SER A 61 3.644 -20.617 -2.090 1.00 0.00 N ATOM 688 CA SER A 61 5.057 -20.402 -2.385 1.00 0.00 C ATOM 689 C SER A 61 5.675 -19.400 -1.413 1.00 0.00 C ATOM 690 O SER A 61 5.203 -18.270 -1.286 1.00 0.00 O ATOM 691 CB SER A 61 5.226 -19.908 -3.824 1.00 0.00 C ATOM 692 OG SER A 61 5.949 -20.845 -4.604 1.00 0.00 O ATOM 693 HA SER A 61 5.575 -21.354 -2.269 1.00 0.00 H ATOM 694 HB2 SER A 61 5.765 -18.961 -3.814 1.00 0.00 H ATOM 695 HB3 SER A 61 4.241 -19.760 -4.268 1.00 0.00 H ATOM 696 HG SER A 61 6.043 -20.501 -5.527 1.00 0.00 H ATOM 697 H SER A 61 2.943 -20.483 -2.846 1.00 0.00 H ATOM 698 N ARG A 62 6.734 -19.824 -0.729 1.00 0.00 N ATOM 699 CA ARG A 62 7.417 -18.966 0.231 1.00 0.00 C ATOM 700 C ARG A 62 7.948 -17.706 -0.447 1.00 0.00 C ATOM 701 O ARG A 62 8.088 -16.660 0.187 1.00 0.00 O ATOM 702 CB ARG A 62 8.567 -19.726 0.898 1.00 0.00 C ATOM 703 CG ARG A 62 8.312 -20.051 2.362 1.00 0.00 C ATOM 704 CD ARG A 62 9.431 -19.540 3.256 1.00 0.00 C ATOM 705 NE ARG A 62 9.887 -20.559 4.200 1.00 0.00 N ATOM 706 CZ ARG A 62 9.142 -21.034 5.196 1.00 0.00 C ATOM 707 NH1 ARG A 62 7.906 -20.587 5.380 1.00 0.00 N ATOM 708 NH2 ARG A 62 9.634 -21.958 6.008 1.00 0.00 N ATOM 709 HA ARG A 62 6.697 -18.670 0.994 1.00 0.00 H ATOM 710 HB2 ARG A 62 8.722 -20.661 0.359 1.00 0.00 H ATOM 711 HB3 ARG A 62 9.468 -19.116 0.832 1.00 0.00 H ATOM 712 HG2 ARG A 62 7.375 -19.587 2.669 1.00 0.00 H ATOM 713 HG3 ARG A 62 8.235 -21.132 2.476 1.00 0.00 H ATOM 714 HD2 ARG A 62 9.068 -18.678 3.816 1.00 0.00 H ATOM 715 HD3 ARG A 62 10.271 -19.238 2.631 1.00 0.00 H ATOM 716 HE ARG A 62 10.850 -20.935 4.087 1.00 0.00 H ATOM 717 HH12 ARG A 62 7.328 -20.961 6.160 1.00 0.00 H ATOM 718 HH11 ARG A 62 7.515 -19.862 4.745 1.00 0.00 H ATOM 719 HH22 ARG A 62 9.052 -22.329 6.786 1.00 0.00 H ATOM 720 HH21 ARG A 62 10.602 -22.312 5.867 1.00 0.00 H ATOM 721 H ARG A 62 7.083 -20.791 -0.883 1.00 0.00 H ATOM 722 N SER A 63 8.239 -17.811 -1.740 1.00 0.00 N ATOM 723 CA SER A 63 8.752 -16.679 -2.503 1.00 0.00 C ATOM 724 C SER A 63 7.670 -15.621 -2.695 1.00 0.00 C ATOM 725 O SER A 63 7.966 -14.432 -2.814 1.00 0.00 O ATOM 726 CB SER A 63 9.274 -17.146 -3.862 1.00 0.00 C ATOM 727 OG SER A 63 10.498 -17.845 -3.726 1.00 0.00 O ATOM 728 HA SER A 63 9.574 -16.236 -1.941 1.00 0.00 H ATOM 729 HB2 SER A 63 9.429 -16.277 -4.502 1.00 0.00 H ATOM 730 HB3 SER A 63 8.536 -17.805 -4.319 1.00 0.00 H ATOM 731 HG SER A 63 10.812 -18.135 -4.619 1.00 0.00 H ATOM 732 H SER A 63 8.097 -18.723 -2.219 1.00 0.00 H ATOM 733 N CYS A 64 6.415 -16.059 -2.721 1.00 0.00 N ATOM 734 CA CYS A 64 5.288 -15.150 -2.896 1.00 0.00 C ATOM 735 C CYS A 64 5.309 -14.054 -1.834 1.00 0.00 C ATOM 736 O CYS A 64 6.051 -14.143 -0.855 1.00 0.00 O ATOM 737 CB CYS A 64 3.969 -15.920 -2.823 1.00 0.00 C ATOM 738 SG CYS A 64 3.730 -17.100 -4.173 1.00 0.00 S ATOM 739 HA CYS A 64 5.375 -14.685 -3.878 1.00 0.00 H ATOM 740 HB2 CYS A 64 3.150 -15.201 -2.847 1.00 0.00 H ATOM 741 HB3 CYS A 64 3.943 -16.467 -1.881 1.00 0.00 H ATOM 742 HG CYS A 64 2.517 -17.738 -4.014 1.00 0.00 H ATOM 743 H CYS A 64 6.232 -17.077 -2.614 1.00 0.00 H ATOM 744 N ASP A 65 4.492 -13.024 -2.028 1.00 0.00 N ATOM 745 CA ASP A 65 4.426 -11.922 -1.076 1.00 0.00 C ATOM 746 C ASP A 65 3.752 -12.366 0.215 1.00 0.00 C ATOM 747 O ASP A 65 4.333 -12.277 1.297 1.00 0.00 O ATOM 748 CB ASP A 65 3.668 -10.736 -1.665 1.00 0.00 C ATOM 749 CG ASP A 65 4.586 -9.765 -2.380 1.00 0.00 C ATOM 750 OD1 ASP A 65 5.225 -10.172 -3.373 1.00 0.00 O ATOM 751 OD2 ASP A 65 4.666 -8.596 -1.947 1.00 0.00 O ATOM 752 HA ASP A 65 5.448 -11.613 -0.857 1.00 0.00 H ATOM 753 HB2 ASP A 65 2.930 -11.109 -2.375 1.00 0.00 H ATOM 754 HB3 ASP A 65 3.160 -10.209 -0.858 1.00 0.00 H ATOM 755 H ASP A 65 3.888 -13.004 -2.875 1.00 0.00 H ATOM 756 N VAL A 66 2.519 -12.845 0.089 1.00 0.00 N ATOM 757 CA VAL A 66 1.752 -13.304 1.239 1.00 0.00 C ATOM 758 C VAL A 66 1.537 -14.813 1.188 1.00 0.00 C ATOM 759 O VAL A 66 0.948 -15.335 0.242 1.00 0.00 O ATOM 760 CB VAL A 66 0.382 -12.604 1.318 1.00 0.00 C ATOM 761 CG1 VAL A 66 -0.334 -12.970 2.609 1.00 0.00 C ATOM 762 CG2 VAL A 66 0.543 -11.096 1.200 1.00 0.00 C ATOM 763 HA VAL A 66 2.332 -13.051 2.127 1.00 0.00 H ATOM 764 HB VAL A 66 -0.227 -12.948 0.482 1.00 0.00 H ATOM 765 HG11 VAL A 66 -0.486 -14.049 2.645 1.00 0.00 H ATOM 766 HG12 VAL A 66 0.272 -12.658 3.460 1.00 0.00 H ATOM 767 HG13 VAL A 66 -1.299 -12.465 2.644 1.00 0.00 H ATOM 768 HG21 VAL A 66 1.172 -10.734 2.013 1.00 0.00 H ATOM 769 HG22 VAL A 66 1.008 -10.855 0.244 1.00 0.00 H ATOM 770 HG23 VAL A 66 -0.437 -10.622 1.258 1.00 0.00 H ATOM 771 H VAL A 66 2.090 -12.894 -0.857 1.00 0.00 H ATOM 772 N ILE A 67 2.017 -15.508 2.214 1.00 0.00 N ATOM 773 CA ILE A 67 1.875 -16.957 2.287 1.00 0.00 C ATOM 774 C ILE A 67 0.759 -17.350 3.248 1.00 0.00 C ATOM 775 O ILE A 67 0.921 -17.276 4.467 1.00 0.00 O ATOM 776 CB ILE A 67 3.186 -17.630 2.735 1.00 0.00 C ATOM 777 CG1 ILE A 67 3.769 -16.910 3.953 1.00 0.00 C ATOM 778 CG2 ILE A 67 4.191 -17.648 1.594 1.00 0.00 C ATOM 779 CD1 ILE A 67 4.432 -17.840 4.945 1.00 0.00 C ATOM 780 HA ILE A 67 1.626 -17.302 1.283 1.00 0.00 H ATOM 781 HB ILE A 67 2.967 -18.660 3.017 1.00 0.00 H ATOM 782 HG12 ILE A 67 4.510 -16.190 3.606 1.00 0.00 H ATOM 783 HG13 ILE A 67 2.962 -16.382 4.461 1.00 0.00 H ATOM 784 HD11 ILE A 67 3.700 -18.560 5.311 1.00 0.00 H ATOM 785 HD12 ILE A 67 5.250 -18.368 4.455 1.00 0.00 H ATOM 786 HD13 ILE A 67 4.822 -17.259 5.781 1.00 0.00 H ATOM 787 HG21 ILE A 67 3.775 -18.204 0.754 1.00 0.00 H ATOM 788 HG22 ILE A 67 4.405 -16.625 1.284 1.00 0.00 H ATOM 789 HG23 ILE A 67 5.111 -18.127 1.929 1.00 0.00 H ATOM 790 H ILE A 67 2.505 -15.006 2.983 1.00 0.00 H ATOM 791 N LEU A 68 -0.374 -17.768 2.692 1.00 0.00 N ATOM 792 CA LEU A 68 -1.518 -18.172 3.501 1.00 0.00 C ATOM 793 C LEU A 68 -1.215 -19.454 4.270 1.00 0.00 C ATOM 794 O LEU A 68 -0.106 -19.983 4.198 1.00 0.00 O ATOM 795 CB LEU A 68 -2.749 -18.370 2.613 1.00 0.00 C ATOM 796 CG LEU A 68 -3.331 -17.086 2.020 1.00 0.00 C ATOM 797 CD1 LEU A 68 -4.397 -17.410 0.986 1.00 0.00 C ATOM 798 CD2 LEU A 68 -3.904 -16.205 3.121 1.00 0.00 C ATOM 799 HA LEU A 68 -1.723 -17.380 4.222 1.00 0.00 H ATOM 800 HB2 LEU A 68 -2.470 -19.027 1.789 1.00 0.00 H ATOM 801 HB3 LEU A 68 -3.524 -18.848 3.211 1.00 0.00 H ATOM 802 HG LEU A 68 -2.528 -16.540 1.524 1.00 0.00 H ATOM 803 HD21 LEU A 68 -4.694 -16.745 3.643 1.00 0.00 H ATOM 804 HD22 LEU A 68 -3.113 -15.945 3.825 1.00 0.00 H ATOM 805 HD23 LEU A 68 -4.314 -15.296 2.681 1.00 0.00 H ATOM 806 HD11 LEU A 68 -3.956 -18.002 0.184 1.00 0.00 H ATOM 807 HD12 LEU A 68 -5.199 -17.977 1.458 1.00 0.00 H ATOM 808 HD13 LEU A 68 -4.798 -16.483 0.577 1.00 0.00 H ATOM 809 H LEU A 68 -0.446 -17.808 1.655 1.00 0.00 H ATOM 810 N SER A 69 -2.205 -19.946 5.008 1.00 0.00 N ATOM 811 CA SER A 69 -2.039 -21.164 5.793 1.00 0.00 C ATOM 812 C SER A 69 -3.011 -22.250 5.338 1.00 0.00 C ATOM 813 O SER A 69 -3.586 -22.964 6.159 1.00 0.00 O ATOM 814 CB SER A 69 -2.246 -20.868 7.279 1.00 0.00 C ATOM 815 OG SER A 69 -1.259 -19.974 7.764 1.00 0.00 O ATOM 816 HA SER A 69 -1.023 -21.528 5.638 1.00 0.00 H ATOM 817 HB2 SER A 69 -2.188 -21.801 7.840 1.00 0.00 H ATOM 818 HB3 SER A 69 -3.231 -20.422 7.420 1.00 0.00 H ATOM 819 HG SER A 69 -1.417 -19.800 8.726 1.00 0.00 H ATOM 820 H SER A 69 -3.119 -19.451 5.026 1.00 0.00 H ATOM 821 N GLU A 70 -3.185 -22.373 4.026 1.00 0.00 N ATOM 822 CA GLU A 70 -4.085 -23.377 3.469 1.00 0.00 C ATOM 823 C GLU A 70 -3.291 -24.540 2.873 1.00 0.00 C ATOM 824 O GLU A 70 -2.318 -24.330 2.149 1.00 0.00 O ATOM 825 CB GLU A 70 -4.986 -22.751 2.400 1.00 0.00 C ATOM 826 CG GLU A 70 -6.469 -22.855 2.719 1.00 0.00 C ATOM 827 CD GLU A 70 -7.325 -22.971 1.474 1.00 0.00 C ATOM 828 OE1 GLU A 70 -7.400 -21.986 0.710 1.00 0.00 O ATOM 829 OE2 GLU A 70 -7.922 -24.048 1.262 1.00 0.00 O ATOM 830 HA GLU A 70 -4.711 -23.761 4.275 1.00 0.00 H ATOM 831 HB2 GLU A 70 -4.727 -21.697 2.304 1.00 0.00 H ATOM 832 HB3 GLU A 70 -4.800 -23.257 1.453 1.00 0.00 H ATOM 833 HG2 GLU A 70 -6.632 -23.737 3.339 1.00 0.00 H ATOM 834 HG3 GLU A 70 -6.772 -21.964 3.270 1.00 0.00 H ATOM 835 H GLU A 70 -2.668 -21.740 3.383 1.00 0.00 H ATOM 836 N PRO A 71 -3.696 -25.788 3.171 1.00 0.00 N ATOM 837 CA PRO A 71 -3.012 -26.982 2.660 1.00 0.00 C ATOM 838 C PRO A 71 -3.153 -27.141 1.148 1.00 0.00 C ATOM 839 O PRO A 71 -2.442 -27.936 0.533 1.00 0.00 O ATOM 840 CB PRO A 71 -3.712 -28.135 3.385 1.00 0.00 C ATOM 841 CG PRO A 71 -5.051 -27.598 3.753 1.00 0.00 C ATOM 842 CD PRO A 71 -4.846 -26.135 4.025 1.00 0.00 C ATOM 843 HA PRO A 71 -1.938 -26.936 2.838 1.00 0.00 H ATOM 844 HD3 PRO A 71 -5.728 -25.558 3.746 1.00 0.00 H ATOM 845 HD2 PRO A 71 -4.618 -25.961 5.077 1.00 0.00 H ATOM 846 HG3 PRO A 71 -5.430 -28.100 4.643 1.00 0.00 H ATOM 847 HG2 PRO A 71 -5.754 -27.737 2.932 1.00 0.00 H ATOM 848 HB2 PRO A 71 -3.812 -28.998 2.727 1.00 0.00 H ATOM 849 HB3 PRO A 71 -3.155 -28.422 4.277 1.00 0.00 H ATOM 850 N ASP A 72 -4.075 -26.389 0.553 1.00 0.00 N ATOM 851 CA ASP A 72 -4.302 -26.463 -0.886 1.00 0.00 C ATOM 852 C ASP A 72 -4.377 -25.070 -1.505 1.00 0.00 C ATOM 853 O ASP A 72 -5.116 -24.848 -2.465 1.00 0.00 O ATOM 854 CB ASP A 72 -5.591 -27.232 -1.181 1.00 0.00 C ATOM 855 CG ASP A 72 -5.669 -28.542 -0.423 1.00 0.00 C ATOM 856 OD1 ASP A 72 -4.790 -29.403 -0.632 1.00 0.00 O ATOM 857 OD2 ASP A 72 -6.611 -28.707 0.382 1.00 0.00 O ATOM 858 HA ASP A 72 -3.458 -26.991 -1.331 1.00 0.00 H ATOM 859 HB2 ASP A 72 -6.441 -26.612 -0.897 1.00 0.00 H ATOM 860 HB3 ASP A 72 -5.637 -27.442 -2.250 1.00 0.00 H ATOM 861 H ASP A 72 -4.646 -25.735 1.126 1.00 0.00 H ATOM 862 N ILE A 73 -3.610 -24.135 -0.954 1.00 0.00 N ATOM 863 CA ILE A 73 -3.597 -22.769 -1.460 1.00 0.00 C ATOM 864 C ILE A 73 -2.761 -22.665 -2.733 1.00 0.00 C ATOM 865 O ILE A 73 -1.589 -23.040 -2.754 1.00 0.00 O ATOM 866 CB ILE A 73 -3.064 -21.780 -0.399 1.00 0.00 C ATOM 867 CG1 ILE A 73 -3.494 -20.354 -0.742 1.00 0.00 C ATOM 868 CG2 ILE A 73 -1.549 -21.873 -0.274 1.00 0.00 C ATOM 869 CD1 ILE A 73 -4.920 -20.045 -0.343 1.00 0.00 C ATOM 870 HA ILE A 73 -4.628 -22.501 -1.693 1.00 0.00 H ATOM 871 HB ILE A 73 -3.493 -22.050 0.566 1.00 0.00 H ATOM 872 HG12 ILE A 73 -2.832 -19.659 -0.225 1.00 0.00 H ATOM 873 HG13 ILE A 73 -3.398 -20.213 -1.819 1.00 0.00 H ATOM 874 HD11 ILE A 73 -5.596 -20.725 -0.861 1.00 0.00 H ATOM 875 HD12 ILE A 73 -5.030 -20.171 0.734 1.00 0.00 H ATOM 876 HD13 ILE A 73 -5.158 -19.017 -0.616 1.00 0.00 H ATOM 877 HG21 ILE A 73 -1.272 -22.885 0.021 1.00 0.00 H ATOM 878 HG22 ILE A 73 -1.091 -21.635 -1.234 1.00 0.00 H ATOM 879 HG23 ILE A 73 -1.204 -21.165 0.480 1.00 0.00 H ATOM 880 H ILE A 73 -3.006 -24.384 -0.144 1.00 0.00 H ATOM 881 N SER A 74 -3.378 -22.159 -3.796 1.00 0.00 N ATOM 882 CA SER A 74 -2.701 -22.010 -5.079 1.00 0.00 C ATOM 883 C SER A 74 -1.426 -21.185 -4.942 1.00 0.00 C ATOM 884 O SER A 74 -1.421 -20.127 -4.314 1.00 0.00 O ATOM 885 CB SER A 74 -3.637 -21.355 -6.097 1.00 0.00 C ATOM 886 OG SER A 74 -4.607 -22.277 -6.565 1.00 0.00 O ATOM 887 HA SER A 74 -2.426 -23.005 -5.428 1.00 0.00 H ATOM 888 HB2 SER A 74 -3.049 -20.996 -6.942 1.00 0.00 H ATOM 889 HB3 SER A 74 -4.144 -20.513 -5.625 1.00 0.00 H ATOM 890 HG SER A 74 -4.152 -23.042 -6.999 1.00 0.00 H ATOM 891 H SER A 74 -4.371 -21.861 -3.710 1.00 0.00 H ATOM 892 N THR A 75 -0.346 -21.678 -5.537 1.00 0.00 N ATOM 893 CA THR A 75 0.938 -20.988 -5.490 1.00 0.00 C ATOM 894 C THR A 75 0.842 -19.623 -6.164 1.00 0.00 C ATOM 895 O THR A 75 1.350 -18.627 -5.651 1.00 0.00 O ATOM 896 CB THR A 75 2.018 -21.831 -6.171 1.00 0.00 C ATOM 897 OG1 THR A 75 2.115 -23.108 -5.564 1.00 0.00 O ATOM 898 CG2 THR A 75 3.391 -21.197 -6.124 1.00 0.00 C ATOM 899 HA THR A 75 1.208 -20.841 -4.444 1.00 0.00 H ATOM 900 HB THR A 75 1.707 -21.910 -7.213 1.00 0.00 H ATOM 901 HG1 THR A 75 2.818 -23.636 -6.019 1.00 0.00 H ATOM 902 HG23 THR A 75 3.350 -20.210 -6.585 1.00 0.00 H ATOM 903 HG21 THR A 75 3.711 -21.102 -5.086 1.00 0.00 H ATOM 904 HG22 THR A 75 4.098 -21.824 -6.667 1.00 0.00 H ATOM 905 H THR A 75 -0.418 -22.580 -6.050 1.00 0.00 H ATOM 906 N PHE A 76 0.182 -19.589 -7.317 1.00 0.00 N ATOM 907 CA PHE A 76 0.009 -18.350 -8.071 1.00 0.00 C ATOM 908 C PHE A 76 -1.381 -17.771 -7.874 1.00 0.00 C ATOM 909 O PHE A 76 -1.813 -16.887 -8.614 1.00 0.00 O ATOM 910 CB PHE A 76 0.297 -18.569 -9.557 1.00 0.00 C ATOM 911 CG PHE A 76 1.720 -18.282 -9.943 1.00 0.00 C ATOM 912 CD1 PHE A 76 2.766 -18.961 -9.336 1.00 0.00 C ATOM 913 CD2 PHE A 76 2.012 -17.335 -10.911 1.00 0.00 C ATOM 914 CE1 PHE A 76 4.076 -18.700 -9.689 1.00 0.00 C ATOM 915 CE2 PHE A 76 3.321 -17.070 -11.268 1.00 0.00 C ATOM 916 CZ PHE A 76 4.353 -17.753 -10.656 1.00 0.00 C ATOM 917 HA PHE A 76 0.729 -17.628 -7.686 1.00 0.00 H ATOM 918 HB2 PHE A 76 0.076 -19.608 -9.802 1.00 0.00 H ATOM 919 HB3 PHE A 76 -0.356 -17.915 -10.135 1.00 0.00 H ATOM 920 HD2 PHE A 76 1.201 -16.793 -11.397 1.00 0.00 H ATOM 921 HE2 PHE A 76 3.538 -16.323 -12.032 1.00 0.00 H ATOM 922 HZ PHE A 76 5.386 -17.545 -10.936 1.00 0.00 H ATOM 923 HE1 PHE A 76 4.890 -19.240 -9.205 1.00 0.00 H ATOM 924 HD1 PHE A 76 2.552 -19.709 -8.572 1.00 0.00 H ATOM 925 H PHE A 76 -0.223 -20.470 -7.693 1.00 0.00 H ATOM 926 N HIS A 77 -2.061 -18.298 -6.872 1.00 0.00 N ATOM 927 CA HIS A 77 -3.426 -17.891 -6.511 1.00 0.00 C ATOM 928 C HIS A 77 -3.821 -16.546 -7.120 1.00 0.00 C ATOM 929 O HIS A 77 -4.728 -16.475 -7.949 1.00 0.00 O ATOM 930 CB HIS A 77 -3.576 -17.827 -4.991 1.00 0.00 C ATOM 931 CG HIS A 77 -4.996 -17.915 -4.526 1.00 0.00 C ATOM 932 ND1 HIS A 77 -5.427 -18.836 -3.595 1.00 0.00 N ATOM 933 CD2 HIS A 77 -6.087 -17.191 -4.870 1.00 0.00 C ATOM 934 CE1 HIS A 77 -6.722 -18.675 -3.386 1.00 0.00 C ATOM 935 NE2 HIS A 77 -7.146 -17.682 -4.147 1.00 0.00 N ATOM 936 HA HIS A 77 -4.096 -18.646 -6.921 1.00 0.00 H ATOM 937 HB2 HIS A 77 -3.018 -18.655 -4.554 1.00 0.00 H ATOM 938 HB3 HIS A 77 -3.156 -16.883 -4.642 1.00 0.00 H ATOM 939 HD2 HIS A 77 -6.119 -16.371 -5.587 1.00 0.00 H ATOM 940 HE1 HIS A 77 -7.336 -19.262 -2.702 1.00 0.00 H ATOM 941 H HIS A 77 -1.605 -19.043 -6.307 1.00 0.00 H ATOM 942 N ALA A 78 -3.142 -15.482 -6.703 1.00 0.00 N ATOM 943 CA ALA A 78 -3.443 -14.149 -7.216 1.00 0.00 C ATOM 944 C ALA A 78 -2.248 -13.210 -7.094 1.00 0.00 C ATOM 945 O ALA A 78 -1.300 -13.479 -6.357 1.00 0.00 O ATOM 946 CB ALA A 78 -4.641 -13.566 -6.481 1.00 0.00 C ATOM 947 HA ALA A 78 -3.678 -14.248 -8.276 1.00 0.00 H ATOM 948 HB1 ALA A 78 -5.506 -14.212 -6.630 1.00 0.00 H ATOM 949 HB2 ALA A 78 -4.415 -13.499 -5.417 1.00 0.00 H ATOM 950 HB3 ALA A 78 -4.857 -12.572 -6.872 1.00 0.00 H ATOM 951 H ALA A 78 -2.385 -15.601 -6.000 1.00 0.00 H ATOM 952 N GLU A 79 -2.313 -12.099 -7.822 1.00 0.00 N ATOM 953 CA GLU A 79 -1.251 -11.101 -7.803 1.00 0.00 C ATOM 954 C GLU A 79 -1.826 -9.723 -7.485 1.00 0.00 C ATOM 955 O GLU A 79 -2.898 -9.363 -7.973 1.00 0.00 O ATOM 956 CB GLU A 79 -0.519 -11.071 -9.147 1.00 0.00 C ATOM 957 CG GLU A 79 0.823 -11.786 -9.124 1.00 0.00 C ATOM 958 CD GLU A 79 1.282 -12.209 -10.504 1.00 0.00 C ATOM 959 OE1 GLU A 79 1.118 -11.415 -11.454 1.00 0.00 O ATOM 960 OE2 GLU A 79 1.806 -13.336 -10.637 1.00 0.00 O ATOM 961 HA GLU A 79 -0.537 -11.371 -7.025 1.00 0.00 H ATOM 962 HB2 GLU A 79 -1.152 -11.548 -9.895 1.00 0.00 H ATOM 963 HB3 GLU A 79 -0.351 -10.031 -9.425 1.00 0.00 H ATOM 964 HG2 GLU A 79 1.569 -11.115 -8.698 1.00 0.00 H ATOM 965 HG3 GLU A 79 0.735 -12.674 -8.498 1.00 0.00 H ATOM 966 H GLU A 79 -3.146 -11.937 -8.423 1.00 0.00 H ATOM 967 N PHE A 80 -1.116 -8.958 -6.662 1.00 0.00 N ATOM 968 CA PHE A 80 -1.571 -7.624 -6.281 1.00 0.00 C ATOM 969 C PHE A 80 -0.567 -6.560 -6.711 1.00 0.00 C ATOM 970 O PHE A 80 0.626 -6.678 -6.443 1.00 0.00 O ATOM 971 CB PHE A 80 -1.796 -7.554 -4.769 1.00 0.00 C ATOM 972 CG PHE A 80 -3.234 -7.725 -4.369 1.00 0.00 C ATOM 973 CD1 PHE A 80 -3.946 -8.848 -4.759 1.00 0.00 C ATOM 974 CD2 PHE A 80 -3.873 -6.764 -3.603 1.00 0.00 C ATOM 975 CE1 PHE A 80 -5.268 -9.009 -4.394 1.00 0.00 C ATOM 976 CE2 PHE A 80 -5.197 -6.919 -3.234 1.00 0.00 C ATOM 977 CZ PHE A 80 -5.894 -8.043 -3.630 1.00 0.00 C ATOM 978 HA PHE A 80 -2.514 -7.429 -6.791 1.00 0.00 H ATOM 979 HB2 PHE A 80 -1.210 -8.342 -4.296 1.00 0.00 H ATOM 980 HB3 PHE A 80 -1.452 -6.583 -4.413 1.00 0.00 H ATOM 981 HD2 PHE A 80 -3.326 -5.875 -3.287 1.00 0.00 H ATOM 982 HE2 PHE A 80 -5.689 -6.155 -2.632 1.00 0.00 H ATOM 983 HZ PHE A 80 -6.937 -8.168 -3.340 1.00 0.00 H ATOM 984 HE1 PHE A 80 -5.817 -9.897 -4.708 1.00 0.00 H ATOM 985 HD1 PHE A 80 -3.457 -9.614 -5.361 1.00 0.00 H ATOM 986 H PHE A 80 -0.217 -9.317 -6.281 1.00 0.00 H ATOM 987 N HIS A 81 -1.054 -5.519 -7.374 1.00 0.00 N ATOM 988 CA HIS A 81 -0.182 -4.444 -7.831 1.00 0.00 C ATOM 989 C HIS A 81 -0.155 -3.294 -6.829 1.00 0.00 C ATOM 990 O HIS A 81 -1.174 -2.651 -6.578 1.00 0.00 O ATOM 991 CB HIS A 81 -0.636 -3.932 -9.198 1.00 0.00 C ATOM 992 CG HIS A 81 -0.326 -4.870 -10.322 1.00 0.00 C ATOM 993 ND1 HIS A 81 0.201 -4.453 -11.527 1.00 0.00 N ATOM 994 CD2 HIS A 81 -0.467 -6.213 -10.421 1.00 0.00 C ATOM 995 CE1 HIS A 81 0.368 -5.498 -12.318 1.00 0.00 C ATOM 996 NE2 HIS A 81 -0.028 -6.578 -11.670 1.00 0.00 N ATOM 997 HA HIS A 81 0.827 -4.848 -7.918 1.00 0.00 H ATOM 998 HB2 HIS A 81 -1.714 -3.775 -9.167 1.00 0.00 H ATOM 999 HB3 HIS A 81 -0.138 -2.983 -9.394 1.00 0.00 H ATOM 1000 HD2 HIS A 81 -0.857 -6.880 -9.652 1.00 0.00 H ATOM 1001 HE1 HIS A 81 0.765 -5.473 -13.333 1.00 0.00 H ATOM 1002 H HIS A 81 -2.074 -5.469 -7.571 1.00 0.00 H ATOM 1003 N LEU A 82 1.021 -3.038 -6.266 1.00 0.00 N ATOM 1004 CA LEU A 82 1.189 -1.960 -5.297 1.00 0.00 C ATOM 1005 C LEU A 82 1.917 -0.782 -5.933 1.00 0.00 C ATOM 1006 O LEU A 82 3.112 -0.861 -6.222 1.00 0.00 O ATOM 1007 CB LEU A 82 1.969 -2.461 -4.079 1.00 0.00 C ATOM 1008 CG LEU A 82 1.759 -1.656 -2.793 1.00 0.00 C ATOM 1009 CD1 LEU A 82 2.101 -0.190 -3.017 1.00 0.00 C ATOM 1010 CD2 LEU A 82 0.328 -1.805 -2.297 1.00 0.00 C ATOM 1011 HA LEU A 82 0.202 -1.628 -4.974 1.00 0.00 H ATOM 1012 HB2 LEU A 82 1.668 -3.491 -3.886 1.00 0.00 H ATOM 1013 HB3 LEU A 82 3.031 -2.434 -4.324 1.00 0.00 H ATOM 1014 HG LEU A 82 2.429 -2.049 -2.028 1.00 0.00 H ATOM 1015 HD21 LEU A 82 -0.359 -1.440 -3.060 1.00 0.00 H ATOM 1016 HD22 LEU A 82 0.123 -2.856 -2.094 1.00 0.00 H ATOM 1017 HD23 LEU A 82 0.200 -1.226 -1.383 1.00 0.00 H ATOM 1018 HD11 LEU A 82 3.144 -0.104 -3.322 1.00 0.00 H ATOM 1019 HD12 LEU A 82 1.458 0.217 -3.798 1.00 0.00 H ATOM 1020 HD13 LEU A 82 1.945 0.364 -2.091 1.00 0.00 H ATOM 1021 H LEU A 82 1.843 -3.621 -6.523 1.00 0.00 H ATOM 1022 N LEU A 83 1.188 0.310 -6.152 1.00 0.00 N ATOM 1023 CA LEU A 83 1.763 1.505 -6.758 1.00 0.00 C ATOM 1024 C LEU A 83 1.600 2.720 -5.849 1.00 0.00 C ATOM 1025 O LEU A 83 0.559 2.900 -5.218 1.00 0.00 O ATOM 1026 CB LEU A 83 1.106 1.780 -8.113 1.00 0.00 C ATOM 1027 CG LEU A 83 1.971 2.558 -9.107 1.00 0.00 C ATOM 1028 CD1 LEU A 83 1.653 2.139 -10.534 1.00 0.00 C ATOM 1029 CD2 LEU A 83 1.767 4.055 -8.929 1.00 0.00 C ATOM 1030 HA LEU A 83 2.828 1.326 -6.902 1.00 0.00 H ATOM 1031 HB2 LEU A 83 0.850 0.822 -8.565 1.00 0.00 H ATOM 1032 HB3 LEU A 83 0.195 2.352 -7.937 1.00 0.00 H ATOM 1033 HG LEU A 83 3.018 2.327 -8.909 1.00 0.00 H ATOM 1034 HD21 LEU A 83 0.719 4.301 -9.101 1.00 0.00 H ATOM 1035 HD22 LEU A 83 2.047 4.340 -7.915 1.00 0.00 H ATOM 1036 HD23 LEU A 83 2.390 4.593 -9.644 1.00 0.00 H ATOM 1037 HD11 LEU A 83 1.850 1.073 -10.651 1.00 0.00 H ATOM 1038 HD12 LEU A 83 0.603 2.341 -10.745 1.00 0.00 H ATOM 1039 HD13 LEU A 83 2.279 2.704 -11.225 1.00 0.00 H ATOM 1040 H LEU A 83 0.183 0.311 -5.884 1.00 0.00 H ATOM 1041 N GLN A 84 2.635 3.551 -5.791 1.00 0.00 N ATOM 1042 CA GLN A 84 2.608 4.752 -4.964 1.00 0.00 C ATOM 1043 C GLN A 84 3.012 5.977 -5.779 1.00 0.00 C ATOM 1044 O GLN A 84 4.111 6.033 -6.331 1.00 0.00 O ATOM 1045 CB GLN A 84 3.543 4.592 -3.763 1.00 0.00 C ATOM 1046 CG GLN A 84 3.590 5.813 -2.859 1.00 0.00 C ATOM 1047 CD GLN A 84 4.997 6.350 -2.675 1.00 0.00 C ATOM 1048 OE1 GLN A 84 5.613 6.845 -3.617 1.00 0.00 O ATOM 1049 NE2 GLN A 84 5.512 6.252 -1.454 1.00 0.00 N ATOM 1050 HA GLN A 84 1.589 4.895 -4.604 1.00 0.00 H ATOM 1051 HB2 GLN A 84 3.204 3.740 -3.174 1.00 0.00 H ATOM 1052 HB3 GLN A 84 4.550 4.399 -4.133 1.00 0.00 H ATOM 1053 HG2 GLN A 84 2.972 6.596 -3.298 1.00 0.00 H ATOM 1054 HG3 GLN A 84 3.190 5.540 -1.883 1.00 0.00 H ATOM 1055 HE22 GLN A 84 4.954 5.826 -0.687 1.00 0.00 H ATOM 1056 HE21 GLN A 84 6.473 6.602 -1.265 1.00 0.00 H ATOM 1057 H GLN A 84 3.486 3.340 -6.350 1.00 0.00 H ATOM 1058 N MET A 85 2.115 6.957 -5.852 1.00 0.00 N ATOM 1059 CA MET A 85 2.380 8.180 -6.603 1.00 0.00 C ATOM 1060 C MET A 85 2.084 9.414 -5.756 1.00 0.00 C ATOM 1061 O MET A 85 1.176 9.406 -4.924 1.00 0.00 O ATOM 1062 CB MET A 85 1.539 8.210 -7.880 1.00 0.00 C ATOM 1063 CG MET A 85 1.983 9.272 -8.874 1.00 0.00 C ATOM 1064 SD MET A 85 1.908 8.699 -10.582 1.00 0.00 S ATOM 1065 CE MET A 85 1.496 10.220 -11.433 1.00 0.00 C ATOM 1066 HA MET A 85 3.436 8.191 -6.871 1.00 0.00 H ATOM 1067 HB2 MET A 85 1.609 7.235 -8.362 1.00 0.00 H ATOM 1068 HB3 MET A 85 0.502 8.405 -7.606 1.00 0.00 H ATOM 1069 HG2 MET A 85 3.010 9.556 -8.646 1.00 0.00 H ATOM 1070 HG3 MET A 85 1.335 10.142 -8.769 1.00 0.00 H ATOM 1071 HE1 MET A 85 0.545 10.599 -11.058 1.00 0.00 H ATOM 1072 HE2 MET A 85 2.278 10.958 -11.255 1.00 0.00 H ATOM 1073 HE3 MET A 85 1.415 10.026 -12.503 1.00 0.00 H ATOM 1074 H MET A 85 1.204 6.849 -5.362 1.00 0.00 H ATOM 1075 N ASP A 86 2.855 10.474 -5.976 1.00 0.00 N ATOM 1076 CA ASP A 86 2.676 11.716 -5.235 1.00 0.00 C ATOM 1077 C ASP A 86 2.052 12.793 -6.118 1.00 0.00 C ATOM 1078 O ASP A 86 2.571 13.111 -7.188 1.00 0.00 O ATOM 1079 CB ASP A 86 4.018 12.206 -4.688 1.00 0.00 C ATOM 1080 CG ASP A 86 5.018 12.502 -5.788 1.00 0.00 C ATOM 1081 OD1 ASP A 86 5.546 11.540 -6.385 1.00 0.00 O ATOM 1082 OD2 ASP A 86 5.273 13.696 -6.053 1.00 0.00 O ATOM 1083 HA ASP A 86 2.001 11.518 -4.402 1.00 0.00 H ATOM 1084 HB2 ASP A 86 3.850 13.117 -4.113 1.00 0.00 H ATOM 1085 HB3 ASP A 86 4.432 11.437 -4.036 1.00 0.00 H ATOM 1086 H ASP A 86 3.604 10.416 -6.695 1.00 0.00 H ATOM 1087 N VAL A 87 0.935 13.350 -5.660 1.00 0.00 N ATOM 1088 CA VAL A 87 0.238 14.392 -6.407 1.00 0.00 C ATOM 1089 C VAL A 87 -0.241 15.503 -5.477 1.00 0.00 C ATOM 1090 O VAL A 87 -0.802 15.236 -4.414 1.00 0.00 O ATOM 1091 CB VAL A 87 -0.969 13.819 -7.177 1.00 0.00 C ATOM 1092 CG1 VAL A 87 -1.981 13.212 -6.217 1.00 0.00 C ATOM 1093 CG2 VAL A 87 -1.615 14.895 -8.037 1.00 0.00 C ATOM 1094 HA VAL A 87 0.950 14.803 -7.123 1.00 0.00 H ATOM 1095 HB VAL A 87 -0.611 13.027 -7.835 1.00 0.00 H ATOM 1096 HG11 VAL A 87 -1.508 12.408 -5.653 1.00 0.00 H ATOM 1097 HG12 VAL A 87 -2.334 13.981 -5.529 1.00 0.00 H ATOM 1098 HG13 VAL A 87 -2.823 12.814 -6.783 1.00 0.00 H ATOM 1099 HG21 VAL A 87 -1.957 15.711 -7.400 1.00 0.00 H ATOM 1100 HG22 VAL A 87 -0.885 15.273 -8.753 1.00 0.00 H ATOM 1101 HG23 VAL A 87 -2.464 14.470 -8.572 1.00 0.00 H ATOM 1102 H VAL A 87 0.549 13.035 -4.747 1.00 0.00 H ATOM 1103 N ASP A 88 -0.015 16.750 -5.882 1.00 0.00 N ATOM 1104 CA ASP A 88 -0.422 17.907 -5.086 1.00 0.00 C ATOM 1105 C ASP A 88 0.501 18.096 -3.884 1.00 0.00 C ATOM 1106 O ASP A 88 1.124 19.146 -3.729 1.00 0.00 O ATOM 1107 CB ASP A 88 -1.871 17.755 -4.615 1.00 0.00 C ATOM 1108 CG ASP A 88 -2.663 19.041 -4.756 1.00 0.00 C ATOM 1109 OD1 ASP A 88 -2.552 19.908 -3.863 1.00 0.00 O ATOM 1110 OD2 ASP A 88 -3.393 19.181 -5.759 1.00 0.00 O ATOM 1111 HA ASP A 88 -0.349 18.791 -5.720 1.00 0.00 H ATOM 1112 HB2 ASP A 88 -2.353 16.980 -5.210 1.00 0.00 H ATOM 1113 HB3 ASP A 88 -1.869 17.458 -3.566 1.00 0.00 H ATOM 1114 H ASP A 88 0.465 16.906 -6.791 1.00 0.00 H ATOM 1115 N ASN A 89 0.585 17.073 -3.038 1.00 0.00 N ATOM 1116 CA ASN A 89 1.430 17.124 -1.858 1.00 0.00 C ATOM 1117 C ASN A 89 1.438 15.779 -1.140 1.00 0.00 C ATOM 1118 O ASN A 89 2.479 15.323 -0.667 1.00 0.00 O ATOM 1119 CB ASN A 89 0.959 18.225 -0.907 1.00 0.00 C ATOM 1120 CG ASN A 89 2.041 18.649 0.067 1.00 0.00 C ATOM 1121 OD1 ASN A 89 3.227 18.423 -0.168 1.00 0.00 O ATOM 1122 ND2 ASN A 89 1.635 19.268 1.170 1.00 0.00 N ATOM 1123 HA ASN A 89 2.446 17.351 -2.180 1.00 0.00 H ATOM 1124 HB2 ASN A 89 0.658 19.092 -1.496 1.00 0.00 H ATOM 1125 HB3 ASN A 89 0.103 17.857 -0.341 1.00 0.00 H ATOM 1126 HD22 ASN A 89 0.621 19.438 1.328 1.00 0.00 H ATOM 1127 HD21 ASN A 89 2.331 19.582 1.876 1.00 0.00 H ATOM 1128 H ASN A 89 0.031 16.214 -3.227 1.00 0.00 H ATOM 1129 N PHE A 90 0.272 15.145 -1.069 1.00 0.00 N ATOM 1130 CA PHE A 90 0.146 13.848 -0.415 1.00 0.00 C ATOM 1131 C PHE A 90 0.477 12.719 -1.386 1.00 0.00 C ATOM 1132 O PHE A 90 0.862 12.965 -2.529 1.00 0.00 O ATOM 1133 CB PHE A 90 -1.268 13.665 0.136 1.00 0.00 C ATOM 1134 CG PHE A 90 -1.434 14.166 1.543 1.00 0.00 C ATOM 1135 CD1 PHE A 90 -0.555 13.776 2.540 1.00 0.00 C ATOM 1136 CD2 PHE A 90 -2.468 15.030 1.867 1.00 0.00 C ATOM 1137 CE1 PHE A 90 -0.704 14.235 3.834 1.00 0.00 C ATOM 1138 CE2 PHE A 90 -2.623 15.494 3.160 1.00 0.00 C ATOM 1139 CZ PHE A 90 -1.738 15.095 4.144 1.00 0.00 C ATOM 1140 HA PHE A 90 0.855 13.814 0.412 1.00 0.00 H ATOM 1141 HB2 PHE A 90 -1.962 14.206 -0.507 1.00 0.00 H ATOM 1142 HB3 PHE A 90 -1.511 12.603 0.117 1.00 0.00 H ATOM 1143 HD2 PHE A 90 -3.167 15.347 1.093 1.00 0.00 H ATOM 1144 HE2 PHE A 90 -3.441 16.173 3.403 1.00 0.00 H ATOM 1145 HZ PHE A 90 -1.857 15.459 5.164 1.00 0.00 H ATOM 1146 HE1 PHE A 90 -0.006 13.919 4.609 1.00 0.00 H ATOM 1147 HD1 PHE A 90 0.264 13.098 2.300 1.00 0.00 H ATOM 1148 H PHE A 90 -0.571 15.585 -1.490 1.00 0.00 H ATOM 1149 N GLN A 91 0.326 11.481 -0.926 1.00 0.00 N ATOM 1150 CA GLN A 91 0.612 10.318 -1.758 1.00 0.00 C ATOM 1151 C GLN A 91 -0.640 9.469 -1.957 1.00 0.00 C ATOM 1152 O GLN A 91 -1.305 9.090 -0.994 1.00 0.00 O ATOM 1153 CB GLN A 91 1.721 9.474 -1.128 1.00 0.00 C ATOM 1154 CG GLN A 91 1.458 9.108 0.323 1.00 0.00 C ATOM 1155 CD GLN A 91 2.122 7.805 0.725 1.00 0.00 C ATOM 1156 OE1 GLN A 91 2.027 6.803 0.018 1.00 0.00 O ATOM 1157 NE2 GLN A 91 2.802 7.815 1.866 1.00 0.00 N ATOM 1158 HA GLN A 91 0.946 10.674 -2.733 1.00 0.00 H ATOM 1159 HB2 GLN A 91 1.822 8.553 -1.703 1.00 0.00 H ATOM 1160 HB3 GLN A 91 2.653 10.037 -1.178 1.00 0.00 H ATOM 1161 HG2 GLN A 91 1.840 9.906 0.960 1.00 0.00 H ATOM 1162 HG3 GLN A 91 0.382 9.012 0.470 1.00 0.00 H ATOM 1163 HE22 GLN A 91 2.855 8.686 2.432 1.00 0.00 H ATOM 1164 HE21 GLN A 91 3.281 6.952 2.193 1.00 0.00 H ATOM 1165 H GLN A 91 -0.004 11.339 0.050 1.00 0.00 H ATOM 1166 N ARG A 92 -0.950 9.170 -3.214 1.00 0.00 N ATOM 1167 CA ARG A 92 -2.118 8.362 -3.543 1.00 0.00 C ATOM 1168 C ARG A 92 -1.697 6.982 -4.036 1.00 0.00 C ATOM 1169 O ARG A 92 -1.015 6.858 -5.054 1.00 0.00 O ATOM 1170 CB ARG A 92 -2.968 9.061 -4.607 1.00 0.00 C ATOM 1171 CG ARG A 92 -3.518 10.405 -4.158 1.00 0.00 C ATOM 1172 CD ARG A 92 -4.977 10.571 -4.551 1.00 0.00 C ATOM 1173 NE ARG A 92 -5.266 11.921 -5.029 1.00 0.00 N ATOM 1174 CZ ARG A 92 -6.491 12.437 -5.096 1.00 0.00 C ATOM 1175 NH1 ARG A 92 -7.544 11.721 -4.719 1.00 0.00 N ATOM 1176 NH2 ARG A 92 -6.667 13.674 -5.544 1.00 0.00 N ATOM 1177 HA ARG A 92 -2.714 8.241 -2.638 1.00 0.00 H ATOM 1178 HB2 ARG A 92 -2.352 9.218 -5.492 1.00 0.00 H ATOM 1179 HB3 ARG A 92 -3.806 8.412 -4.860 1.00 0.00 H ATOM 1180 HG2 ARG A 92 -3.433 10.478 -3.074 1.00 0.00 H ATOM 1181 HG3 ARG A 92 -2.934 11.200 -4.622 1.00 0.00 H ATOM 1182 HD2 ARG A 92 -5.601 10.364 -3.682 1.00 0.00 H ATOM 1183 HD3 ARG A 92 -5.211 9.860 -5.343 1.00 0.00 H ATOM 1184 HE ARG A 92 -4.468 12.513 -5.335 1.00 0.00 H ATOM 1185 HH12 ARG A 92 -8.498 12.131 -4.774 1.00 0.00 H ATOM 1186 HH11 ARG A 92 -7.414 10.750 -4.369 1.00 0.00 H ATOM 1187 HH22 ARG A 92 -7.624 14.077 -5.596 1.00 0.00 H ATOM 1188 HH21 ARG A 92 -5.848 14.240 -5.843 1.00 0.00 H ATOM 1189 H ARG A 92 -0.344 9.521 -3.983 1.00 0.00 H ATOM 1190 N ASN A 93 -2.102 5.947 -3.308 1.00 0.00 N ATOM 1191 CA ASN A 93 -1.761 4.577 -3.672 1.00 0.00 C ATOM 1192 C ASN A 93 -2.978 3.829 -4.205 1.00 0.00 C ATOM 1193 O ASN A 93 -4.096 4.018 -3.725 1.00 0.00 O ATOM 1194 CB ASN A 93 -1.184 3.838 -2.463 1.00 0.00 C ATOM 1195 CG ASN A 93 0.226 4.287 -2.130 1.00 0.00 C ATOM 1196 OD1 ASN A 93 1.180 3.518 -2.249 1.00 0.00 O ATOM 1197 ND2 ASN A 93 0.363 5.539 -1.710 1.00 0.00 N ATOM 1198 HA ASN A 93 -1.011 4.616 -4.462 1.00 0.00 H ATOM 1199 HB2 ASN A 93 -1.824 4.024 -1.600 1.00 0.00 H ATOM 1200 HB3 ASN A 93 -1.170 2.770 -2.679 1.00 0.00 H ATOM 1201 HD22 ASN A 93 -0.472 6.153 -1.625 1.00 0.00 H ATOM 1202 HD21 ASN A 93 1.305 5.906 -1.466 1.00 0.00 H ATOM 1203 H ASN A 93 -2.676 6.118 -2.458 1.00 0.00 H ATOM 1204 N LEU A 94 -2.751 2.976 -5.198 1.00 0.00 N ATOM 1205 CA LEU A 94 -3.823 2.191 -5.798 1.00 0.00 C ATOM 1206 C LEU A 94 -3.436 0.716 -5.862 1.00 0.00 C ATOM 1207 O LEU A 94 -2.271 0.380 -6.079 1.00 0.00 O ATOM 1208 CB LEU A 94 -4.143 2.714 -7.201 1.00 0.00 C ATOM 1209 CG LEU A 94 -5.417 3.554 -7.303 1.00 0.00 C ATOM 1210 CD1 LEU A 94 -5.150 4.985 -6.861 1.00 0.00 C ATOM 1211 CD2 LEU A 94 -5.960 3.527 -8.724 1.00 0.00 C ATOM 1212 HA LEU A 94 -4.712 2.289 -5.175 1.00 0.00 H ATOM 1213 HB2 LEU A 94 -3.306 3.328 -7.532 1.00 0.00 H ATOM 1214 HB3 LEU A 94 -4.249 1.857 -7.866 1.00 0.00 H ATOM 1215 HG LEU A 94 -6.167 3.124 -6.639 1.00 0.00 H ATOM 1216 HD21 LEU A 94 -5.212 3.933 -9.405 1.00 0.00 H ATOM 1217 HD22 LEU A 94 -6.189 2.499 -9.005 1.00 0.00 H ATOM 1218 HD23 LEU A 94 -6.866 4.130 -8.777 1.00 0.00 H ATOM 1219 HD11 LEU A 94 -4.807 4.986 -5.826 1.00 0.00 H ATOM 1220 HD12 LEU A 94 -4.384 5.424 -7.500 1.00 0.00 H ATOM 1221 HD13 LEU A 94 -6.069 5.566 -6.941 1.00 0.00 H ATOM 1222 H LEU A 94 -1.781 2.865 -5.557 1.00 0.00 H ATOM 1223 N ILE A 95 -4.418 -0.161 -5.669 1.00 0.00 N ATOM 1224 CA ILE A 95 -4.170 -1.598 -5.702 1.00 0.00 C ATOM 1225 C ILE A 95 -5.010 -2.279 -6.777 1.00 0.00 C ATOM 1226 O ILE A 95 -6.192 -1.978 -6.940 1.00 0.00 O ATOM 1227 CB ILE A 95 -4.473 -2.253 -4.342 1.00 0.00 C ATOM 1228 CG1 ILE A 95 -3.962 -1.376 -3.197 1.00 0.00 C ATOM 1229 CG2 ILE A 95 -3.851 -3.640 -4.271 1.00 0.00 C ATOM 1230 CD1 ILE A 95 -2.460 -1.198 -3.195 1.00 0.00 C ATOM 1231 HA ILE A 95 -3.113 -1.728 -5.933 1.00 0.00 H ATOM 1232 HB ILE A 95 -5.554 -2.353 -4.240 1.00 0.00 H ATOM 1233 HG12 ILE A 95 -4.426 -0.393 -3.282 1.00 0.00 H ATOM 1234 HG13 ILE A 95 -4.256 -1.835 -2.253 1.00 0.00 H ATOM 1235 HD11 ILE A 95 -1.980 -2.172 -3.099 1.00 0.00 H ATOM 1236 HD12 ILE A 95 -2.150 -0.729 -4.129 1.00 0.00 H ATOM 1237 HD13 ILE A 95 -2.172 -0.565 -2.356 1.00 0.00 H ATOM 1238 HG21 ILE A 95 -4.263 -4.263 -5.065 1.00 0.00 H ATOM 1239 HG22 ILE A 95 -2.771 -3.559 -4.394 1.00 0.00 H ATOM 1240 HG23 ILE A 95 -4.075 -4.088 -3.303 1.00 0.00 H ATOM 1241 H ILE A 95 -5.382 0.185 -5.491 1.00 0.00 H ATOM 1242 N ASN A 96 -4.392 -3.205 -7.506 1.00 0.00 N ATOM 1243 CA ASN A 96 -5.084 -3.936 -8.562 1.00 0.00 C ATOM 1244 C ASN A 96 -5.056 -5.437 -8.287 1.00 0.00 C ATOM 1245 O ASN A 96 -4.017 -5.991 -7.927 1.00 0.00 O ATOM 1246 CB ASN A 96 -4.444 -3.643 -9.920 1.00 0.00 C ATOM 1247 CG ASN A 96 -5.175 -4.320 -11.062 1.00 0.00 C ATOM 1248 OD1 ASN A 96 -4.708 -5.319 -11.608 1.00 0.00 O ATOM 1249 ND2 ASN A 96 -6.330 -3.777 -11.431 1.00 0.00 N ATOM 1250 HA ASN A 96 -6.122 -3.605 -8.580 1.00 0.00 H ATOM 1251 HB2 ASN A 96 -4.454 -2.566 -10.087 1.00 0.00 H ATOM 1252 HB3 ASN A 96 -3.413 -3.997 -9.905 1.00 0.00 H ATOM 1253 HD22 ASN A 96 -6.687 -2.932 -10.941 1.00 0.00 H ATOM 1254 HD21 ASN A 96 -6.877 -4.197 -12.210 1.00 0.00 H ATOM 1255 H ASN A 96 -3.390 -3.413 -7.318 1.00 0.00 H ATOM 1256 N VAL A 97 -6.202 -6.088 -8.458 1.00 0.00 N ATOM 1257 CA VAL A 97 -6.304 -7.523 -8.224 1.00 0.00 C ATOM 1258 C VAL A 97 -6.299 -8.297 -9.538 1.00 0.00 C ATOM 1259 O VAL A 97 -7.028 -7.961 -10.472 1.00 0.00 O ATOM 1260 CB VAL A 97 -7.581 -7.878 -7.439 1.00 0.00 C ATOM 1261 CG1 VAL A 97 -7.535 -9.325 -6.971 1.00 0.00 C ATOM 1262 CG2 VAL A 97 -7.766 -6.935 -6.259 1.00 0.00 C ATOM 1263 HA VAL A 97 -5.433 -7.807 -7.633 1.00 0.00 H ATOM 1264 HB VAL A 97 -8.437 -7.761 -8.104 1.00 0.00 H ATOM 1265 HG11 VAL A 97 -7.457 -9.983 -7.836 1.00 0.00 H ATOM 1266 HG12 VAL A 97 -6.670 -9.469 -6.324 1.00 0.00 H ATOM 1267 HG13 VAL A 97 -8.446 -9.556 -6.419 1.00 0.00 H ATOM 1268 HG21 VAL A 97 -6.908 -7.017 -5.592 1.00 0.00 H ATOM 1269 HG22 VAL A 97 -7.849 -5.911 -6.623 1.00 0.00 H ATOM 1270 HG23 VAL A 97 -8.674 -7.204 -5.719 1.00 0.00 H ATOM 1271 H VAL A 97 -7.045 -5.562 -8.766 1.00 0.00 H ATOM 1272 N ILE A 98 -5.472 -9.336 -9.600 1.00 0.00 N ATOM 1273 CA ILE A 98 -5.369 -10.164 -10.796 1.00 0.00 C ATOM 1274 C ILE A 98 -5.497 -11.643 -10.449 1.00 0.00 C ATOM 1275 O ILE A 98 -4.713 -12.176 -9.666 1.00 0.00 O ATOM 1276 CB ILE A 98 -4.032 -9.934 -11.527 1.00 0.00 C ATOM 1277 CG1 ILE A 98 -3.777 -8.437 -11.710 1.00 0.00 C ATOM 1278 CG2 ILE A 98 -4.031 -10.647 -12.870 1.00 0.00 C ATOM 1279 CD1 ILE A 98 -2.372 -8.116 -12.173 1.00 0.00 C ATOM 1280 HA ILE A 98 -6.188 -9.873 -11.454 1.00 0.00 H ATOM 1281 HB ILE A 98 -3.227 -10.348 -10.920 1.00 0.00 H ATOM 1282 HG12 ILE A 98 -4.480 -8.055 -12.450 1.00 0.00 H ATOM 1283 HG13 ILE A 98 -3.949 -7.938 -10.756 1.00 0.00 H ATOM 1284 HD11 ILE A 98 -1.656 -8.482 -11.437 1.00 0.00 H ATOM 1285 HD12 ILE A 98 -2.188 -8.599 -13.133 1.00 0.00 H ATOM 1286 HD13 ILE A 98 -2.264 -7.037 -12.281 1.00 0.00 H ATOM 1287 HG21 ILE A 98 -4.170 -11.717 -12.712 1.00 0.00 H ATOM 1288 HG22 ILE A 98 -4.843 -10.261 -13.486 1.00 0.00 H ATOM 1289 HG23 ILE A 98 -3.079 -10.473 -13.372 1.00 0.00 H ATOM 1290 H ILE A 98 -4.883 -9.564 -8.774 1.00 0.00 H ATOM 1291 N ASP A 99 -6.493 -12.299 -11.036 1.00 0.00 N ATOM 1292 CA ASP A 99 -6.724 -13.718 -10.784 1.00 0.00 C ATOM 1293 C ASP A 99 -6.361 -14.555 -12.007 1.00 0.00 C ATOM 1294 O ASP A 99 -6.874 -14.329 -13.102 1.00 0.00 O ATOM 1295 CB ASP A 99 -8.185 -13.957 -10.403 1.00 0.00 C ATOM 1296 CG ASP A 99 -8.522 -13.411 -9.029 1.00 0.00 C ATOM 1297 OD1 ASP A 99 -7.584 -13.179 -8.237 1.00 0.00 O ATOM 1298 OD2 ASP A 99 -9.721 -13.214 -8.745 1.00 0.00 O ATOM 1299 HA ASP A 99 -6.085 -14.023 -9.956 1.00 0.00 H ATOM 1300 HB2 ASP A 99 -8.823 -13.469 -11.140 1.00 0.00 H ATOM 1301 HB3 ASP A 99 -8.378 -15.030 -10.410 1.00 0.00 H ATOM 1302 H ASP A 99 -7.122 -11.790 -11.689 1.00 0.00 H ATOM 1303 N LYS A 100 -5.477 -15.527 -11.809 1.00 0.00 N ATOM 1304 CA LYS A 100 -5.046 -16.403 -12.893 1.00 0.00 C ATOM 1305 C LYS A 100 -6.179 -17.324 -13.340 1.00 0.00 C ATOM 1306 O LYS A 100 -6.119 -17.915 -14.419 1.00 0.00 O ATOM 1307 CB LYS A 100 -3.840 -17.236 -12.454 1.00 0.00 C ATOM 1308 CG LYS A 100 -2.728 -16.412 -11.824 1.00 0.00 C ATOM 1309 CD LYS A 100 -1.429 -16.534 -12.605 1.00 0.00 C ATOM 1310 CE LYS A 100 -1.543 -15.901 -13.983 1.00 0.00 C ATOM 1311 NZ LYS A 100 -1.604 -16.925 -15.062 1.00 0.00 N ATOM 1312 HA LYS A 100 -4.760 -15.776 -13.738 1.00 0.00 H ATOM 1313 HB2 LYS A 100 -4.177 -17.974 -11.726 1.00 0.00 H ATOM 1314 HB3 LYS A 100 -3.437 -17.747 -13.328 1.00 0.00 H ATOM 1315 HG2 LYS A 100 -3.031 -15.365 -11.803 1.00 0.00 H ATOM 1316 HG3 LYS A 100 -2.562 -16.761 -10.805 1.00 0.00 H ATOM 1317 HD2 LYS A 100 -0.634 -16.035 -12.051 1.00 0.00 H ATOM 1318 HD3 LYS A 100 -1.183 -17.590 -12.720 1.00 0.00 H ATOM 1319 HE2 LYS A 100 -0.675 -15.263 -14.151 1.00 0.00 H ATOM 1320 HE3 LYS A 100 -2.449 -15.296 -14.019 1.00 0.00 H ATOM 1321 HZ1 LYS A 100 -0.740 -17.503 -15.039 1.00 0.00 H ATOM 1322 HZ2 LYS A 100 -2.434 -17.534 -14.914 1.00 0.00 H ATOM 1323 HZ3 LYS A 100 -1.681 -16.451 -15.984 1.00 0.00 H ATOM 1324 H LYS A 100 -5.082 -15.667 -10.857 1.00 0.00 H ATOM 1325 N SER A 101 -7.210 -17.446 -12.506 1.00 0.00 N ATOM 1326 CA SER A 101 -8.353 -18.299 -12.819 1.00 0.00 C ATOM 1327 C SER A 101 -7.956 -19.770 -12.797 1.00 0.00 C ATOM 1328 O SER A 101 -7.384 -20.284 -13.759 1.00 0.00 O ATOM 1329 CB SER A 101 -8.934 -17.936 -14.188 1.00 0.00 C ATOM 1330 OG SER A 101 -9.005 -16.530 -14.356 1.00 0.00 O ATOM 1331 HA SER A 101 -9.114 -18.134 -12.056 1.00 0.00 H ATOM 1332 HB2 SER A 101 -9.936 -18.356 -14.272 1.00 0.00 H ATOM 1333 HB3 SER A 101 -8.299 -18.356 -14.968 1.00 0.00 H ATOM 1334 HG SER A 101 -8.096 -16.144 -14.285 1.00 0.00 H ATOM 1335 H SER A 101 -7.201 -16.920 -11.609 1.00 0.00 H ATOM 1336 N ARG A 102 -8.261 -20.444 -11.693 1.00 0.00 N ATOM 1337 CA ARG A 102 -7.936 -21.858 -11.545 1.00 0.00 C ATOM 1338 C ARG A 102 -8.626 -22.450 -10.319 1.00 0.00 C ATOM 1339 O ARG A 102 -9.460 -23.347 -10.436 1.00 0.00 O ATOM 1340 CB ARG A 102 -6.420 -22.045 -11.437 1.00 0.00 C ATOM 1341 CG ARG A 102 -5.818 -22.820 -12.598 1.00 0.00 C ATOM 1342 CD ARG A 102 -4.497 -23.463 -12.212 1.00 0.00 C ATOM 1343 NE ARG A 102 -4.135 -24.554 -13.113 1.00 0.00 N ATOM 1344 CZ ARG A 102 -3.631 -24.373 -14.332 1.00 0.00 C ATOM 1345 NH1 ARG A 102 -3.428 -23.147 -14.798 1.00 0.00 N ATOM 1346 NH2 ARG A 102 -3.330 -25.421 -15.086 1.00 0.00 N ATOM 1347 HA ARG A 102 -8.297 -22.384 -12.429 1.00 0.00 H ATOM 1348 HB2 ARG A 102 -5.953 -21.061 -11.400 1.00 0.00 H ATOM 1349 HB3 ARG A 102 -6.204 -22.583 -10.514 1.00 0.00 H ATOM 1350 HG2 ARG A 102 -6.516 -23.599 -12.904 1.00 0.00 H ATOM 1351 HG3 ARG A 102 -5.650 -22.137 -13.431 1.00 0.00 H ATOM 1352 HD2 ARG A 102 -4.579 -23.856 -11.199 1.00 0.00 H ATOM 1353 HD3 ARG A 102 -3.714 -22.705 -12.244 1.00 0.00 H ATOM 1354 HE ARG A 102 -4.279 -25.530 -12.783 1.00 0.00 H ATOM 1355 HH12 ARG A 102 -3.034 -23.012 -15.751 1.00 0.00 H ATOM 1356 HH11 ARG A 102 -3.663 -22.322 -14.210 1.00 0.00 H ATOM 1357 HH22 ARG A 102 -2.936 -25.281 -16.038 1.00 0.00 H ATOM 1358 HH21 ARG A 102 -3.488 -26.384 -14.725 1.00 0.00 H ATOM 1359 H ARG A 102 -8.744 -19.951 -10.915 1.00 0.00 H ATOM 1360 N ASN A 103 -8.271 -21.940 -9.144 1.00 0.00 N ATOM 1361 CA ASN A 103 -8.855 -22.418 -7.897 1.00 0.00 C ATOM 1362 C ASN A 103 -10.166 -21.703 -7.591 1.00 0.00 C ATOM 1363 O ASN A 103 -11.241 -22.300 -7.656 1.00 0.00 O ATOM 1364 CB ASN A 103 -7.877 -22.233 -6.752 1.00 0.00 C ATOM 1365 CG ASN A 103 -7.299 -23.546 -6.262 1.00 0.00 C ATOM 1366 OD1 ASN A 103 -7.104 -24.481 -7.039 1.00 0.00 O ATOM 1367 ND2 ASN A 103 -7.021 -23.623 -4.966 1.00 0.00 N ATOM 1368 HA ASN A 103 -9.069 -23.480 -8.013 1.00 0.00 H ATOM 1369 HB2 ASN A 103 -7.060 -21.596 -7.090 1.00 0.00 H ATOM 1370 HB3 ASN A 103 -8.395 -21.749 -5.924 1.00 0.00 H ATOM 1371 HD22 ASN A 103 -7.202 -22.808 -4.346 1.00 0.00 H ATOM 1372 HD21 ASN A 103 -6.622 -24.498 -4.571 1.00 0.00 H ATOM 1373 H ASN A 103 -7.560 -21.182 -9.114 1.00 0.00 H ATOM 1374 N GLY A 104 -10.072 -20.419 -7.257 1.00 0.00 N ATOM 1375 CA GLY A 104 -11.259 -19.645 -6.947 1.00 0.00 C ATOM 1376 C GLY A 104 -10.964 -18.474 -6.029 1.00 0.00 C ATOM 1377 O GLY A 104 -10.678 -18.661 -4.846 1.00 0.00 O ATOM 1378 HA3 GLY A 104 -11.985 -20.297 -6.461 1.00 0.00 H ATOM 1379 HA2 GLY A 104 -11.681 -19.263 -7.877 1.00 0.00 H ATOM 1380 H GLY A 104 -9.137 -19.965 -7.218 1.00 0.00 H ATOM 1381 N THR A 105 -11.035 -17.264 -6.575 1.00 0.00 N ATOM 1382 CA THR A 105 -10.775 -16.058 -5.798 1.00 0.00 C ATOM 1383 C THR A 105 -11.981 -15.124 -5.823 1.00 0.00 C ATOM 1384 O THR A 105 -12.484 -14.774 -6.890 1.00 0.00 O ATOM 1385 CB THR A 105 -9.543 -15.332 -6.341 1.00 0.00 C ATOM 1386 OG1 THR A 105 -8.423 -16.200 -6.372 1.00 0.00 O ATOM 1387 CG2 THR A 105 -9.159 -14.115 -5.528 1.00 0.00 C ATOM 1388 HA THR A 105 -10.588 -16.354 -4.766 1.00 0.00 H ATOM 1389 HB THR A 105 -9.818 -15.006 -7.344 1.00 0.00 H ATOM 1390 HG1 THR A 105 -8.229 -16.519 -5.455 1.00 0.00 H ATOM 1391 HG23 THR A 105 -10.003 -13.427 -5.486 1.00 0.00 H ATOM 1392 HG21 THR A 105 -8.890 -14.424 -4.518 1.00 0.00 H ATOM 1393 HG22 THR A 105 -8.308 -13.620 -5.996 1.00 0.00 H ATOM 1394 H THR A 105 -11.282 -17.175 -7.581 1.00 0.00 H ATOM 1395 N PHE A 106 -12.441 -14.727 -4.640 1.00 0.00 N ATOM 1396 CA PHE A 106 -13.589 -13.835 -4.527 1.00 0.00 C ATOM 1397 C PHE A 106 -13.201 -12.529 -3.842 1.00 0.00 C ATOM 1398 O PHE A 106 -12.581 -12.535 -2.778 1.00 0.00 O ATOM 1399 CB PHE A 106 -14.716 -14.516 -3.748 1.00 0.00 C ATOM 1400 CG PHE A 106 -14.969 -15.935 -4.171 1.00 0.00 C ATOM 1401 CD1 PHE A 106 -15.403 -16.221 -5.455 1.00 0.00 C ATOM 1402 CD2 PHE A 106 -14.771 -16.982 -3.284 1.00 0.00 C ATOM 1403 CE1 PHE A 106 -15.637 -17.525 -5.846 1.00 0.00 C ATOM 1404 CE2 PHE A 106 -15.003 -18.287 -3.671 1.00 0.00 C ATOM 1405 CZ PHE A 106 -15.437 -18.560 -4.954 1.00 0.00 C ATOM 1406 HA PHE A 106 -13.938 -13.606 -5.534 1.00 0.00 H ATOM 1407 HB2 PHE A 106 -14.454 -14.513 -2.690 1.00 0.00 H ATOM 1408 HB3 PHE A 106 -15.632 -13.944 -3.896 1.00 0.00 H ATOM 1409 HD2 PHE A 106 -14.429 -16.773 -2.271 1.00 0.00 H ATOM 1410 HE2 PHE A 106 -14.844 -19.102 -2.964 1.00 0.00 H ATOM 1411 HZ PHE A 106 -15.621 -19.589 -5.261 1.00 0.00 H ATOM 1412 HE1 PHE A 106 -15.980 -17.737 -6.859 1.00 0.00 H ATOM 1413 HD1 PHE A 106 -15.562 -15.409 -6.164 1.00 0.00 H ATOM 1414 H PHE A 106 -11.971 -15.061 -3.775 1.00 0.00 H ATOM 1415 N ILE A 107 -13.570 -11.410 -4.457 1.00 0.00 N ATOM 1416 CA ILE A 107 -13.261 -10.096 -3.905 1.00 0.00 C ATOM 1417 C ILE A 107 -14.524 -9.284 -3.679 1.00 0.00 C ATOM 1418 O ILE A 107 -15.432 -9.263 -4.510 1.00 0.00 O ATOM 1419 CB ILE A 107 -12.288 -9.305 -4.797 1.00 0.00 C ATOM 1420 CG1 ILE A 107 -12.161 -7.848 -4.334 1.00 0.00 C ATOM 1421 CG2 ILE A 107 -12.721 -9.369 -6.252 1.00 0.00 C ATOM 1422 CD1 ILE A 107 -11.439 -7.696 -3.014 1.00 0.00 C ATOM 1423 HA ILE A 107 -12.774 -10.271 -2.946 1.00 0.00 H ATOM 1424 HB ILE A 107 -11.306 -9.768 -4.707 1.00 0.00 H ATOM 1425 HG12 ILE A 107 -11.613 -7.291 -5.094 1.00 0.00 H ATOM 1426 HG13 ILE A 107 -13.162 -7.430 -4.230 1.00 0.00 H ATOM 1427 HD11 ILE A 107 -11.981 -8.239 -2.240 1.00 0.00 H ATOM 1428 HD12 ILE A 107 -10.431 -8.100 -3.104 1.00 0.00 H ATOM 1429 HD13 ILE A 107 -11.387 -6.640 -2.750 1.00 0.00 H ATOM 1430 HG21 ILE A 107 -12.735 -10.408 -6.580 1.00 0.00 H ATOM 1431 HG22 ILE A 107 -13.719 -8.941 -6.352 1.00 0.00 H ATOM 1432 HG23 ILE A 107 -12.019 -8.803 -6.864 1.00 0.00 H ATOM 1433 H ILE A 107 -14.092 -11.473 -5.354 1.00 0.00 H ATOM 1434 N ASN A 108 -14.561 -8.620 -2.540 1.00 0.00 N ATOM 1435 CA ASN A 108 -15.702 -7.792 -2.165 1.00 0.00 C ATOM 1436 C ASN A 108 -16.965 -8.638 -2.033 1.00 0.00 C ATOM 1437 O ASN A 108 -18.074 -8.153 -2.254 1.00 0.00 O ATOM 1438 CB ASN A 108 -15.923 -6.689 -3.203 1.00 0.00 C ATOM 1439 CG ASN A 108 -15.103 -5.447 -2.915 1.00 0.00 C ATOM 1440 OD1 ASN A 108 -15.584 -4.323 -3.062 1.00 0.00 O ATOM 1441 ND2 ASN A 108 -13.855 -5.643 -2.504 1.00 0.00 N ATOM 1442 HA ASN A 108 -15.486 -7.335 -1.199 1.00 0.00 H ATOM 1443 HB2 ASN A 108 -15.645 -7.072 -4.185 1.00 0.00 H ATOM 1444 HB3 ASN A 108 -16.979 -6.418 -3.206 1.00 0.00 H ATOM 1445 HD22 ASN A 108 -13.490 -6.610 -2.394 1.00 0.00 H ATOM 1446 HD21 ASN A 108 -13.243 -4.829 -2.293 1.00 0.00 H ATOM 1447 H ASN A 108 -13.752 -8.689 -1.890 1.00 0.00 H ATOM 1448 N GLY A 109 -16.789 -9.904 -1.669 1.00 0.00 N ATOM 1449 CA GLY A 109 -17.914 -10.793 -1.510 1.00 0.00 C ATOM 1450 C GLY A 109 -18.547 -11.185 -2.833 1.00 0.00 C ATOM 1451 O GLY A 109 -19.648 -11.734 -2.862 1.00 0.00 O ATOM 1452 HA3 GLY A 109 -18.666 -10.296 -0.897 1.00 0.00 H ATOM 1453 HA2 GLY A 109 -17.575 -11.697 -1.005 1.00 0.00 H ATOM 1454 H GLY A 109 -15.827 -10.259 -1.496 1.00 0.00 H ATOM 1455 N ASN A 110 -17.853 -10.902 -3.932 1.00 0.00 N ATOM 1456 CA ASN A 110 -18.358 -11.231 -5.260 1.00 0.00 C ATOM 1457 C ASN A 110 -17.275 -11.895 -6.106 1.00 0.00 C ATOM 1458 O ASN A 110 -16.084 -11.656 -5.907 1.00 0.00 O ATOM 1459 CB ASN A 110 -18.869 -9.969 -5.961 1.00 0.00 C ATOM 1460 CG ASN A 110 -20.376 -9.827 -5.868 1.00 0.00 C ATOM 1461 OD1 ASN A 110 -21.075 -9.828 -6.883 1.00 0.00 O ATOM 1462 ND2 ASN A 110 -20.885 -9.704 -4.648 1.00 0.00 N ATOM 1463 HA ASN A 110 -19.183 -11.933 -5.144 1.00 0.00 H ATOM 1464 HB2 ASN A 110 -18.406 -9.098 -5.497 1.00 0.00 H ATOM 1465 HB3 ASN A 110 -18.585 -10.013 -7.013 1.00 0.00 H ATOM 1466 HD22 ASN A 110 -20.256 -9.708 -3.819 1.00 0.00 H ATOM 1467 HD21 ASN A 110 -21.912 -9.603 -4.521 1.00 0.00 H ATOM 1468 H ASN A 110 -16.928 -10.435 -3.842 1.00 0.00 H ATOM 1469 N ARG A 111 -17.699 -12.729 -7.049 1.00 0.00 N ATOM 1470 CA ARG A 111 -16.767 -13.430 -7.926 1.00 0.00 C ATOM 1471 C ARG A 111 -16.122 -12.466 -8.916 1.00 0.00 C ATOM 1472 O ARG A 111 -16.783 -11.578 -9.455 1.00 0.00 O ATOM 1473 CB ARG A 111 -17.490 -14.548 -8.679 1.00 0.00 C ATOM 1474 CG ARG A 111 -16.557 -15.613 -9.233 1.00 0.00 C ATOM 1475 CD ARG A 111 -17.321 -16.677 -10.004 1.00 0.00 C ATOM 1476 NE ARG A 111 -17.384 -17.943 -9.277 1.00 0.00 N ATOM 1477 CZ ARG A 111 -18.347 -18.848 -9.438 1.00 0.00 C ATOM 1478 NH1 ARG A 111 -19.328 -18.639 -10.308 1.00 0.00 N ATOM 1479 NH2 ARG A 111 -18.329 -19.968 -8.728 1.00 0.00 N ATOM 1480 HA ARG A 111 -15.981 -13.866 -7.309 1.00 0.00 H ATOM 1481 HB2 ARG A 111 -18.192 -15.026 -7.995 1.00 0.00 H ATOM 1482 HB3 ARG A 111 -18.039 -14.105 -9.510 1.00 0.00 H ATOM 1483 HG2 ARG A 111 -15.836 -15.140 -9.900 1.00 0.00 H ATOM 1484 HG3 ARG A 111 -16.028 -16.086 -8.406 1.00 0.00 H ATOM 1485 HD2 ARG A 111 -16.824 -16.844 -10.959 1.00 0.00 H ATOM 1486 HD3 ARG A 111 -18.336 -16.322 -10.181 1.00 0.00 H ATOM 1487 HE ARG A 111 -16.630 -18.150 -8.591 1.00 0.00 H ATOM 1488 HH12 ARG A 111 -20.077 -19.351 -10.428 1.00 0.00 H ATOM 1489 HH11 ARG A 111 -19.348 -17.764 -10.869 1.00 0.00 H ATOM 1490 HH22 ARG A 111 -19.081 -20.675 -8.853 1.00 0.00 H ATOM 1491 HH21 ARG A 111 -17.563 -20.139 -8.046 1.00 0.00 H ATOM 1492 H ARG A 111 -18.720 -12.886 -7.165 1.00 0.00 H ATOM 1493 N LEU A 112 -14.827 -12.649 -9.154 1.00 0.00 N ATOM 1494 CA LEU A 112 -14.093 -11.796 -10.081 1.00 0.00 C ATOM 1495 C LEU A 112 -14.191 -12.331 -11.506 1.00 0.00 C ATOM 1496 O LEU A 112 -14.052 -13.531 -11.740 1.00 0.00 O ATOM 1497 CB LEU A 112 -12.624 -11.696 -9.662 1.00 0.00 C ATOM 1498 CG LEU A 112 -11.784 -10.708 -10.476 1.00 0.00 C ATOM 1499 CD1 LEU A 112 -11.736 -9.354 -9.785 1.00 0.00 C ATOM 1500 CD2 LEU A 112 -10.379 -11.251 -10.688 1.00 0.00 C ATOM 1501 HA LEU A 112 -14.540 -10.802 -10.053 1.00 0.00 H ATOM 1502 HB2 LEU A 112 -12.591 -11.388 -8.617 1.00 0.00 H ATOM 1503 HB3 LEU A 112 -12.176 -12.684 -9.763 1.00 0.00 H ATOM 1504 HG LEU A 112 -12.253 -10.579 -11.452 1.00 0.00 H ATOM 1505 HD21 LEU A 112 -9.902 -11.409 -9.721 1.00 0.00 H ATOM 1506 HD22 LEU A 112 -10.434 -12.197 -11.226 1.00 0.00 H ATOM 1507 HD23 LEU A 112 -9.798 -10.535 -11.268 1.00 0.00 H ATOM 1508 HD11 LEU A 112 -12.748 -8.962 -9.686 1.00 0.00 H ATOM 1509 HD12 LEU A 112 -11.291 -9.468 -8.796 1.00 0.00 H ATOM 1510 HD13 LEU A 112 -11.135 -8.666 -10.379 1.00 0.00 H ATOM 1511 H LEU A 112 -14.325 -13.419 -8.667 1.00 0.00 H ATOM 1512 N VAL A 113 -14.431 -11.431 -12.455 1.00 0.00 N ATOM 1513 CA VAL A 113 -14.548 -11.813 -13.857 1.00 0.00 C ATOM 1514 C VAL A 113 -13.520 -11.078 -14.712 1.00 0.00 C ATOM 1515 O VAL A 113 -12.897 -11.667 -15.595 1.00 0.00 O ATOM 1516 CB VAL A 113 -15.961 -11.523 -14.402 1.00 0.00 C ATOM 1517 CG1 VAL A 113 -16.269 -10.035 -14.336 1.00 0.00 C ATOM 1518 CG2 VAL A 113 -16.105 -12.044 -15.824 1.00 0.00 C ATOM 1519 HA VAL A 113 -14.361 -12.885 -13.912 1.00 0.00 H ATOM 1520 HB VAL A 113 -16.683 -12.045 -13.775 1.00 0.00 H ATOM 1521 HG11 VAL A 113 -16.215 -9.700 -13.300 1.00 0.00 H ATOM 1522 HG12 VAL A 113 -15.541 -9.488 -14.935 1.00 0.00 H ATOM 1523 HG13 VAL A 113 -17.271 -9.855 -14.726 1.00 0.00 H ATOM 1524 HG21 VAL A 113 -15.372 -11.554 -16.465 1.00 0.00 H ATOM 1525 HG22 VAL A 113 -15.937 -13.121 -15.834 1.00 0.00 H ATOM 1526 HG23 VAL A 113 -17.109 -11.829 -16.189 1.00 0.00 H ATOM 1527 H VAL A 113 -14.538 -10.431 -12.191 1.00 0.00 H ATOM 1528 N LYS A 114 -13.349 -9.788 -14.444 1.00 0.00 N ATOM 1529 CA LYS A 114 -12.396 -8.972 -15.189 1.00 0.00 C ATOM 1530 C LYS A 114 -10.967 -9.256 -14.738 1.00 0.00 C ATOM 1531 O LYS A 114 -10.744 -9.825 -13.669 1.00 0.00 O ATOM 1532 CB LYS A 114 -12.718 -7.486 -15.011 1.00 0.00 C ATOM 1533 CG LYS A 114 -13.190 -6.808 -16.287 1.00 0.00 C ATOM 1534 CD LYS A 114 -13.406 -5.318 -16.080 1.00 0.00 C ATOM 1535 CE LYS A 114 -12.219 -4.509 -16.579 1.00 0.00 C ATOM 1536 NZ LYS A 114 -12.356 -3.063 -16.252 1.00 0.00 N ATOM 1537 HA LYS A 114 -12.480 -9.230 -16.245 1.00 0.00 H ATOM 1538 HB2 LYS A 114 -13.502 -7.391 -14.260 1.00 0.00 H ATOM 1539 HB3 LYS A 114 -11.819 -6.978 -14.663 1.00 0.00 H ATOM 1540 HG2 LYS A 114 -12.439 -6.953 -17.064 1.00 0.00 H ATOM 1541 HG3 LYS A 114 -14.129 -7.262 -16.603 1.00 0.00 H ATOM 1542 HD2 LYS A 114 -14.299 -5.010 -16.624 1.00 0.00 H ATOM 1543 HD3 LYS A 114 -13.545 -5.124 -15.016 1.00 0.00 H ATOM 1544 HE2 LYS A 114 -12.146 -4.621 -17.661 1.00 0.00 H ATOM 1545 HE3 LYS A 114 -11.311 -4.891 -16.113 1.00 0.00 H ATOM 1546 HZ1 LYS A 114 -13.217 -2.688 -16.698 1.00 0.00 H ATOM 1547 HZ2 LYS A 114 -12.420 -2.947 -15.221 1.00 0.00 H ATOM 1548 HZ3 LYS A 114 -11.526 -2.548 -16.610 1.00 0.00 H ATOM 1549 H LYS A 114 -13.908 -9.349 -13.685 1.00 0.00 H ATOM 1550 N LYS A 115 -10.003 -8.856 -15.559 1.00 0.00 N ATOM 1551 CA LYS A 115 -8.594 -9.066 -15.246 1.00 0.00 C ATOM 1552 C LYS A 115 -7.925 -7.754 -14.847 1.00 0.00 C ATOM 1553 O LYS A 115 -6.731 -7.558 -15.076 1.00 0.00 O ATOM 1554 CB LYS A 115 -7.871 -9.682 -16.447 1.00 0.00 C ATOM 1555 CG LYS A 115 -7.629 -11.177 -16.310 1.00 0.00 C ATOM 1556 CD LYS A 115 -6.295 -11.469 -15.640 1.00 0.00 C ATOM 1557 CE LYS A 115 -5.415 -12.357 -16.505 1.00 0.00 C ATOM 1558 NZ LYS A 115 -4.820 -11.608 -17.646 1.00 0.00 N ATOM 1559 HA LYS A 115 -8.531 -9.754 -14.403 1.00 0.00 H ATOM 1560 HB2 LYS A 115 -8.475 -9.510 -17.338 1.00 0.00 H ATOM 1561 HB3 LYS A 115 -6.907 -9.186 -16.561 1.00 0.00 H ATOM 1562 HG2 LYS A 115 -8.429 -11.612 -15.711 1.00 0.00 H ATOM 1563 HG3 LYS A 115 -7.633 -11.629 -17.302 1.00 0.00 H ATOM 1564 HD2 LYS A 115 -5.777 -10.527 -15.458 1.00 0.00 H ATOM 1565 HD3 LYS A 115 -6.479 -11.971 -14.690 1.00 0.00 H ATOM 1566 HE2 LYS A 115 -6.018 -13.176 -16.897 1.00 0.00 H ATOM 1567 HE3 LYS A 115 -4.610 -12.761 -15.891 1.00 0.00 H ATOM 1568 HZ1 LYS A 115 -5.581 -11.224 -18.242 1.00 0.00 H ATOM 1569 HZ2 LYS A 115 -4.237 -10.828 -17.281 1.00 0.00 H ATOM 1570 HZ3 LYS A 115 -4.228 -12.251 -18.210 1.00 0.00 H ATOM 1571 H LYS A 115 -10.259 -8.381 -16.448 1.00 0.00 H ATOM 1572 N ASP A 116 -8.703 -6.855 -14.250 1.00 0.00 N ATOM 1573 CA ASP A 116 -8.185 -5.561 -13.821 1.00 0.00 C ATOM 1574 C ASP A 116 -9.096 -4.929 -12.772 1.00 0.00 C ATOM 1575 O ASP A 116 -9.672 -3.864 -12.995 1.00 0.00 O ATOM 1576 CB ASP A 116 -8.041 -4.625 -15.023 1.00 0.00 C ATOM 1577 CG ASP A 116 -7.303 -3.347 -14.676 1.00 0.00 C ATOM 1578 OD1 ASP A 116 -6.144 -3.436 -14.217 1.00 0.00 O ATOM 1579 OD2 ASP A 116 -7.883 -2.257 -14.864 1.00 0.00 O ATOM 1580 HA ASP A 116 -7.204 -5.719 -13.372 1.00 0.00 H ATOM 1581 HB2 ASP A 116 -7.491 -5.145 -15.808 1.00 0.00 H ATOM 1582 HB3 ASP A 116 -9.035 -4.367 -15.387 1.00 0.00 H ATOM 1583 H ASP A 116 -9.705 -7.080 -14.085 1.00 0.00 H ATOM 1584 N TYR A 117 -9.215 -5.588 -11.624 1.00 0.00 N ATOM 1585 CA TYR A 117 -10.049 -5.085 -10.540 1.00 0.00 C ATOM 1586 C TYR A 117 -9.283 -4.070 -9.696 1.00 0.00 C ATOM 1587 O TYR A 117 -8.107 -4.266 -9.392 1.00 0.00 O ATOM 1588 CB TYR A 117 -10.532 -6.239 -9.660 1.00 0.00 C ATOM 1589 CG TYR A 117 -11.441 -5.803 -8.533 1.00 0.00 C ATOM 1590 CD1 TYR A 117 -10.936 -5.129 -7.428 1.00 0.00 C ATOM 1591 CD2 TYR A 117 -12.804 -6.066 -8.574 1.00 0.00 C ATOM 1592 CE1 TYR A 117 -11.764 -4.729 -6.397 1.00 0.00 C ATOM 1593 CE2 TYR A 117 -13.639 -5.668 -7.546 1.00 0.00 C ATOM 1594 CZ TYR A 117 -13.113 -5.000 -6.461 1.00 0.00 C ATOM 1595 OH TYR A 117 -13.941 -4.604 -5.434 1.00 0.00 O ATOM 1596 HA TYR A 117 -10.915 -4.589 -10.979 1.00 0.00 H ATOM 1597 HB3 TYR A 117 -9.661 -6.732 -9.229 1.00 0.00 H ATOM 1598 HB2 TYR A 117 -11.075 -6.946 -10.287 1.00 0.00 H ATOM 1599 HD2 TYR A 117 -13.222 -6.595 -9.430 1.00 0.00 H ATOM 1600 HE2 TYR A 117 -14.707 -5.881 -7.593 1.00 0.00 H ATOM 1601 HE1 TYR A 117 -11.352 -4.201 -5.537 1.00 0.00 H ATOM 1602 HD1 TYR A 117 -9.869 -4.912 -7.374 1.00 0.00 H ATOM 1603 HH TYR A 117 -14.379 -5.399 -5.039 1.00 0.00 H ATOM 1604 H TYR A 117 -8.701 -6.483 -11.496 1.00 0.00 H ATOM 1605 N ILE A 118 -9.954 -2.985 -9.327 1.00 0.00 N ATOM 1606 CA ILE A 118 -9.335 -1.942 -8.529 1.00 0.00 C ATOM 1607 C ILE A 118 -9.692 -2.084 -7.050 1.00 0.00 C ATOM 1608 O ILE A 118 -10.860 -2.004 -6.670 1.00 0.00 O ATOM 1609 CB ILE A 118 -9.751 -0.542 -9.032 1.00 0.00 C ATOM 1610 CG1 ILE A 118 -8.814 0.519 -8.462 1.00 0.00 C ATOM 1611 CG2 ILE A 118 -11.198 -0.236 -8.671 1.00 0.00 C ATOM 1612 CD1 ILE A 118 -7.361 0.257 -8.780 1.00 0.00 C ATOM 1613 HA ILE A 118 -8.256 -2.052 -8.637 1.00 0.00 H ATOM 1614 HB ILE A 118 -9.673 -0.530 -10.119 1.00 0.00 H ATOM 1615 HG12 ILE A 118 -9.092 1.487 -8.878 1.00 0.00 H ATOM 1616 HG13 ILE A 118 -8.934 0.543 -7.379 1.00 0.00 H ATOM 1617 HD11 ILE A 118 -7.066 -0.705 -8.361 1.00 0.00 H ATOM 1618 HD12 ILE A 118 -7.224 0.241 -9.861 1.00 0.00 H ATOM 1619 HD13 ILE A 118 -6.747 1.047 -8.347 1.00 0.00 H ATOM 1620 HG21 ILE A 118 -11.850 -0.979 -9.129 1.00 0.00 H ATOM 1621 HG22 ILE A 118 -11.315 -0.266 -7.588 1.00 0.00 H ATOM 1622 HG23 ILE A 118 -11.461 0.756 -9.038 1.00 0.00 H ATOM 1623 H ILE A 118 -10.947 -2.880 -9.617 1.00 0.00 H ATOM 1624 N LEU A 119 -8.675 -2.297 -6.221 1.00 0.00 N ATOM 1625 CA LEU A 119 -8.878 -2.450 -4.786 1.00 0.00 C ATOM 1626 C LEU A 119 -8.484 -1.178 -4.040 1.00 0.00 C ATOM 1627 O LEU A 119 -7.460 -0.560 -4.339 1.00 0.00 O ATOM 1628 CB LEU A 119 -8.072 -3.643 -4.259 1.00 0.00 C ATOM 1629 CG LEU A 119 -8.062 -3.799 -2.733 1.00 0.00 C ATOM 1630 CD1 LEU A 119 -8.503 -5.198 -2.332 1.00 0.00 C ATOM 1631 CD2 LEU A 119 -6.680 -3.497 -2.174 1.00 0.00 C ATOM 1632 HA LEU A 119 -9.938 -2.634 -4.611 1.00 0.00 H ATOM 1633 HB2 LEU A 119 -8.493 -4.552 -4.689 1.00 0.00 H ATOM 1634 HB3 LEU A 119 -7.041 -3.529 -4.594 1.00 0.00 H ATOM 1635 HG LEU A 119 -8.769 -3.083 -2.313 1.00 0.00 H ATOM 1636 HD21 LEU A 119 -5.956 -4.188 -2.605 1.00 0.00 H ATOM 1637 HD22 LEU A 119 -6.403 -2.474 -2.427 1.00 0.00 H ATOM 1638 HD23 LEU A 119 -6.694 -3.613 -1.090 1.00 0.00 H ATOM 1639 HD11 LEU A 119 -9.514 -5.378 -2.698 1.00 0.00 H ATOM 1640 HD12 LEU A 119 -7.822 -5.930 -2.766 1.00 0.00 H ATOM 1641 HD13 LEU A 119 -8.488 -5.285 -1.246 1.00 0.00 H ATOM 1642 H LEU A 119 -7.711 -2.356 -6.606 1.00 0.00 H ATOM 1643 N LYS A 120 -9.306 -0.796 -3.067 1.00 0.00 N ATOM 1644 CA LYS A 120 -9.054 0.401 -2.271 1.00 0.00 C ATOM 1645 C LYS A 120 -9.166 0.092 -0.781 1.00 0.00 C ATOM 1646 O LYS A 120 -9.470 -1.036 -0.393 1.00 0.00 O ATOM 1647 CB LYS A 120 -10.038 1.510 -2.655 1.00 0.00 C ATOM 1648 CG LYS A 120 -9.362 2.768 -3.178 1.00 0.00 C ATOM 1649 CD LYS A 120 -9.553 2.923 -4.680 1.00 0.00 C ATOM 1650 CE LYS A 120 -8.308 3.489 -5.345 1.00 0.00 C ATOM 1651 NZ LYS A 120 -8.461 4.934 -5.674 1.00 0.00 N ATOM 1652 HA LYS A 120 -8.039 0.742 -2.477 1.00 0.00 H ATOM 1653 HB2 LYS A 120 -10.703 1.128 -3.430 1.00 0.00 H ATOM 1654 HB3 LYS A 120 -10.622 1.773 -1.773 1.00 0.00 H ATOM 1655 HG2 LYS A 120 -9.790 3.635 -2.675 1.00 0.00 H ATOM 1656 HG3 LYS A 120 -8.295 2.713 -2.960 1.00 0.00 H ATOM 1657 HD2 LYS A 120 -9.773 1.947 -5.112 1.00 0.00 H ATOM 1658 HD3 LYS A 120 -10.390 3.597 -4.863 1.00 0.00 H ATOM 1659 HE2 LYS A 120 -8.117 2.936 -6.265 1.00 0.00 H ATOM 1660 HE3 LYS A 120 -7.462 3.369 -4.669 1.00 0.00 H ATOM 1661 HZ1 LYS A 120 -9.263 5.057 -6.325 1.00 0.00 H ATOM 1662 HZ2 LYS A 120 -8.636 5.470 -4.801 1.00 0.00 H ATOM 1663 HZ3 LYS A 120 -7.590 5.280 -6.125 1.00 0.00 H ATOM 1664 H LYS A 120 -10.152 -1.366 -2.868 1.00 0.00 H ATOM 1665 N ASN A 121 -8.917 1.099 0.051 1.00 0.00 N ATOM 1666 CA ASN A 121 -8.990 0.931 1.500 1.00 0.00 C ATOM 1667 C ASN A 121 -10.358 0.407 1.926 1.00 0.00 C ATOM 1668 O ASN A 121 -11.385 0.807 1.380 1.00 0.00 O ATOM 1669 CB ASN A 121 -8.699 2.257 2.210 1.00 0.00 C ATOM 1670 CG ASN A 121 -9.411 3.431 1.564 1.00 0.00 C ATOM 1671 OD1 ASN A 121 -10.523 3.293 1.055 1.00 0.00 O ATOM 1672 ND2 ASN A 121 -8.770 4.594 1.583 1.00 0.00 N ATOM 1673 HA ASN A 121 -8.235 0.199 1.787 1.00 0.00 H ATOM 1674 HB2 ASN A 121 -9.025 2.178 3.247 1.00 0.00 H ATOM 1675 HB3 ASN A 121 -7.625 2.441 2.182 1.00 0.00 H ATOM 1676 HD22 ASN A 121 -7.831 4.663 2.025 1.00 0.00 H ATOM 1677 HD21 ASN A 121 -9.207 5.436 1.156 1.00 0.00 H ATOM 1678 H ASN A 121 -8.664 2.029 -0.340 1.00 0.00 H ATOM 1679 N GLY A 122 -10.360 -0.490 2.907 1.00 0.00 N ATOM 1680 CA GLY A 122 -11.604 -1.055 3.393 1.00 0.00 C ATOM 1681 C GLY A 122 -12.251 -1.982 2.385 1.00 0.00 C ATOM 1682 O GLY A 122 -13.431 -1.839 2.067 1.00 0.00 O ATOM 1683 HA3 GLY A 122 -12.295 -0.242 3.615 1.00 0.00 H ATOM 1684 HA2 GLY A 122 -11.401 -1.616 4.305 1.00 0.00 H ATOM 1685 H GLY A 122 -9.459 -0.790 3.331 1.00 0.00 H ATOM 1686 N ASP A 123 -11.476 -2.936 1.880 1.00 0.00 N ATOM 1687 CA ASP A 123 -11.982 -3.889 0.899 1.00 0.00 C ATOM 1688 C ASP A 123 -11.751 -5.325 1.360 1.00 0.00 C ATOM 1689 O ASP A 123 -10.616 -5.734 1.603 1.00 0.00 O ATOM 1690 CB ASP A 123 -11.310 -3.663 -0.457 1.00 0.00 C ATOM 1691 CG ASP A 123 -11.809 -2.409 -1.147 1.00 0.00 C ATOM 1692 OD1 ASP A 123 -11.938 -1.369 -0.469 1.00 0.00 O ATOM 1693 OD2 ASP A 123 -12.070 -2.467 -2.368 1.00 0.00 O ATOM 1694 HA ASP A 123 -13.055 -3.729 0.797 1.00 0.00 H ATOM 1695 HB2 ASP A 123 -10.234 -3.575 -0.305 1.00 0.00 H ATOM 1696 HB3 ASP A 123 -11.516 -4.521 -1.097 1.00 0.00 H ATOM 1697 H ASP A 123 -10.486 -3.005 2.191 1.00 0.00 H ATOM 1698 N ARG A 124 -12.835 -6.086 1.476 1.00 0.00 N ATOM 1699 CA ARG A 124 -12.751 -7.477 1.903 1.00 0.00 C ATOM 1700 C ARG A 124 -12.367 -8.378 0.734 1.00 0.00 C ATOM 1701 O ARG A 124 -12.936 -8.275 -0.352 1.00 0.00 O ATOM 1702 CB ARG A 124 -14.084 -7.933 2.498 1.00 0.00 C ATOM 1703 CG ARG A 124 -14.473 -7.187 3.766 1.00 0.00 C ATOM 1704 CD ARG A 124 -15.009 -8.134 4.828 1.00 0.00 C ATOM 1705 NE ARG A 124 -15.786 -7.429 5.845 1.00 0.00 N ATOM 1706 CZ ARG A 124 -17.014 -6.956 5.646 1.00 0.00 C ATOM 1707 NH1 ARG A 124 -17.608 -7.108 4.469 1.00 0.00 N ATOM 1708 NH2 ARG A 124 -17.649 -6.329 6.627 1.00 0.00 N ATOM 1709 HA ARG A 124 -11.978 -7.552 2.668 1.00 0.00 H ATOM 1710 HB2 ARG A 124 -14.865 -7.778 1.753 1.00 0.00 H ATOM 1711 HB3 ARG A 124 -14.012 -8.995 2.731 1.00 0.00 H ATOM 1712 HG2 ARG A 124 -13.595 -6.674 4.159 1.00 0.00 H ATOM 1713 HG3 ARG A 124 -15.242 -6.454 3.524 1.00 0.00 H ATOM 1714 HD2 ARG A 124 -14.169 -8.635 5.310 1.00 0.00 H ATOM 1715 HD3 ARG A 124 -15.647 -8.877 4.349 1.00 0.00 H ATOM 1716 HE ARG A 124 -15.354 -7.288 6.780 1.00 0.00 H ATOM 1717 HH12 ARG A 124 -18.568 -6.736 4.319 1.00 0.00 H ATOM 1718 HH11 ARG A 124 -17.114 -7.599 3.697 1.00 0.00 H ATOM 1719 HH22 ARG A 124 -18.609 -5.959 6.472 1.00 0.00 H ATOM 1720 HH21 ARG A 124 -17.187 -6.207 7.551 1.00 0.00 H ATOM 1721 H ARG A 124 -13.766 -5.678 1.257 1.00 0.00 H ATOM 1722 N ILE A 125 -11.396 -9.256 0.961 1.00 0.00 N ATOM 1723 CA ILE A 125 -10.935 -10.168 -0.078 1.00 0.00 C ATOM 1724 C ILE A 125 -10.947 -11.614 0.405 1.00 0.00 C ATOM 1725 O ILE A 125 -10.553 -11.906 1.533 1.00 0.00 O ATOM 1726 CB ILE A 125 -9.512 -9.812 -0.550 1.00 0.00 C ATOM 1727 CG1 ILE A 125 -9.375 -8.300 -0.756 1.00 0.00 C ATOM 1728 CG2 ILE A 125 -9.178 -10.560 -1.832 1.00 0.00 C ATOM 1729 CD1 ILE A 125 -8.430 -7.642 0.226 1.00 0.00 C ATOM 1730 HA ILE A 125 -11.627 -10.062 -0.913 1.00 0.00 H ATOM 1731 HB ILE A 125 -8.805 -10.116 0.222 1.00 0.00 H ATOM 1732 HG12 ILE A 125 -9.004 -8.121 -1.765 1.00 0.00 H ATOM 1733 HG13 ILE A 125 -10.360 -7.846 -0.646 1.00 0.00 H ATOM 1734 HD11 ILE A 125 -8.793 -7.803 1.241 1.00 0.00 H ATOM 1735 HD12 ILE A 125 -7.437 -8.078 0.121 1.00 0.00 H ATOM 1736 HD13 ILE A 125 -8.382 -6.573 0.021 1.00 0.00 H ATOM 1737 HG21 ILE A 125 -9.235 -11.633 -1.650 1.00 0.00 H ATOM 1738 HG22 ILE A 125 -9.891 -10.283 -2.609 1.00 0.00 H ATOM 1739 HG23 ILE A 125 -8.170 -10.298 -2.152 1.00 0.00 H ATOM 1740 H ILE A 125 -10.955 -9.293 1.902 1.00 0.00 H ATOM 1741 N VAL A 126 -11.397 -12.516 -0.462 1.00 0.00 N ATOM 1742 CA VAL A 126 -11.457 -13.934 -0.130 1.00 0.00 C ATOM 1743 C VAL A 126 -10.678 -14.764 -1.146 1.00 0.00 C ATOM 1744 O VAL A 126 -10.937 -14.693 -2.347 1.00 0.00 O ATOM 1745 CB VAL A 126 -12.911 -14.440 -0.078 1.00 0.00 C ATOM 1746 CG1 VAL A 126 -12.963 -15.865 0.450 1.00 0.00 C ATOM 1747 CG2 VAL A 126 -13.768 -13.515 0.773 1.00 0.00 C ATOM 1748 HA VAL A 126 -11.007 -14.049 0.856 1.00 0.00 H ATOM 1749 HB VAL A 126 -13.313 -14.439 -1.091 1.00 0.00 H ATOM 1750 HG11 VAL A 126 -12.385 -16.516 -0.206 1.00 0.00 H ATOM 1751 HG12 VAL A 126 -12.542 -15.894 1.455 1.00 0.00 H ATOM 1752 HG13 VAL A 126 -13.999 -16.203 0.479 1.00 0.00 H ATOM 1753 HG21 VAL A 126 -13.368 -13.481 1.786 1.00 0.00 H ATOM 1754 HG22 VAL A 126 -13.757 -12.513 0.343 1.00 0.00 H ATOM 1755 HG23 VAL A 126 -14.791 -13.890 0.797 1.00 0.00 H ATOM 1756 H VAL A 126 -11.714 -12.202 -1.401 1.00 0.00 H ATOM 1757 N PHE A 127 -9.720 -15.545 -0.658 1.00 0.00 N ATOM 1758 CA PHE A 127 -8.900 -16.381 -1.527 1.00 0.00 C ATOM 1759 C PHE A 127 -9.194 -17.861 -1.303 1.00 0.00 C ATOM 1760 O PHE A 127 -9.071 -18.367 -0.188 1.00 0.00 O ATOM 1761 CB PHE A 127 -7.415 -16.104 -1.281 1.00 0.00 C ATOM 1762 CG PHE A 127 -6.862 -14.994 -2.130 1.00 0.00 C ATOM 1763 CD1 PHE A 127 -7.575 -13.820 -2.313 1.00 0.00 C ATOM 1764 CD2 PHE A 127 -5.626 -15.125 -2.744 1.00 0.00 C ATOM 1765 CE1 PHE A 127 -7.066 -12.797 -3.092 1.00 0.00 C ATOM 1766 CE2 PHE A 127 -5.113 -14.106 -3.524 1.00 0.00 C ATOM 1767 CZ PHE A 127 -5.835 -12.941 -3.698 1.00 0.00 C ATOM 1768 HA PHE A 127 -9.146 -16.134 -2.560 1.00 0.00 H ATOM 1769 HB2 PHE A 127 -7.283 -15.835 -0.233 1.00 0.00 H ATOM 1770 HB3 PHE A 127 -6.854 -17.014 -1.495 1.00 0.00 H ATOM 1771 HD2 PHE A 127 -5.052 -16.042 -2.610 1.00 0.00 H ATOM 1772 HE2 PHE A 127 -4.140 -14.221 -4.001 1.00 0.00 H ATOM 1773 HZ PHE A 127 -5.432 -12.136 -4.313 1.00 0.00 H ATOM 1774 HE1 PHE A 127 -7.637 -11.878 -3.227 1.00 0.00 H ATOM 1775 HD1 PHE A 127 -8.549 -13.701 -1.837 1.00 0.00 H ATOM 1776 H PHE A 127 -9.551 -15.560 0.368 1.00 0.00 H ATOM 1777 N GLY A 128 -9.578 -18.551 -2.372 1.00 0.00 N ATOM 1778 CA GLY A 128 -9.878 -19.966 -2.273 1.00 0.00 C ATOM 1779 C GLY A 128 -11.347 -20.232 -2.014 1.00 0.00 C ATOM 1780 O GLY A 128 -12.057 -20.733 -2.886 1.00 0.00 O ATOM 1781 HA3 GLY A 128 -9.296 -20.390 -1.455 1.00 0.00 H ATOM 1782 HA2 GLY A 128 -9.595 -20.450 -3.208 1.00 0.00 H ATOM 1783 H GLY A 128 -9.664 -18.070 -3.290 1.00 0.00 H ATOM 1784 N LYS A 129 -11.804 -19.901 -0.810 1.00 0.00 N ATOM 1785 CA LYS A 129 -13.200 -20.109 -0.437 1.00 0.00 C ATOM 1786 C LYS A 129 -13.437 -19.748 1.027 1.00 0.00 C ATOM 1787 O LYS A 129 -14.491 -19.222 1.383 1.00 0.00 O ATOM 1788 CB LYS A 129 -13.605 -21.566 -0.686 1.00 0.00 C ATOM 1789 CG LYS A 129 -14.604 -21.737 -1.819 1.00 0.00 C ATOM 1790 CD LYS A 129 -14.811 -23.204 -2.162 1.00 0.00 C ATOM 1791 CE LYS A 129 -15.111 -23.396 -3.640 1.00 0.00 C ATOM 1792 NZ LYS A 129 -16.513 -23.843 -3.868 1.00 0.00 N ATOM 1793 HA LYS A 129 -13.814 -19.455 -1.056 1.00 0.00 H ATOM 1794 HB2 LYS A 129 -12.708 -22.136 -0.928 1.00 0.00 H ATOM 1795 HB3 LYS A 129 -14.049 -21.961 0.228 1.00 0.00 H ATOM 1796 HG2 LYS A 129 -15.559 -21.305 -1.518 1.00 0.00 H ATOM 1797 HG3 LYS A 129 -14.232 -21.216 -2.701 1.00 0.00 H ATOM 1798 HD2 LYS A 129 -13.907 -23.758 -1.909 1.00 0.00 H ATOM 1799 HD3 LYS A 129 -15.647 -23.590 -1.578 1.00 0.00 H ATOM 1800 HE2 LYS A 129 -14.431 -24.147 -4.043 1.00 0.00 H ATOM 1801 HE3 LYS A 129 -14.954 -22.450 -4.158 1.00 0.00 H ATOM 1802 HZ1 LYS A 129 -16.670 -24.749 -3.383 1.00 0.00 H ATOM 1803 HZ2 LYS A 129 -17.169 -23.129 -3.492 1.00 0.00 H ATOM 1804 HZ3 LYS A 129 -16.676 -23.962 -4.888 1.00 0.00 H ATOM 1805 H LYS A 129 -11.151 -19.484 -0.117 1.00 0.00 H ATOM 1806 N SER A 130 -12.453 -20.041 1.873 1.00 0.00 N ATOM 1807 CA SER A 130 -12.563 -19.753 3.299 1.00 0.00 C ATOM 1808 C SER A 130 -11.657 -18.593 3.703 1.00 0.00 C ATOM 1809 O SER A 130 -12.059 -17.723 4.477 1.00 0.00 O ATOM 1810 CB SER A 130 -12.211 -20.997 4.117 1.00 0.00 C ATOM 1811 OG SER A 130 -10.833 -21.310 4.003 1.00 0.00 O ATOM 1812 HA SER A 130 -13.594 -19.466 3.503 1.00 0.00 H ATOM 1813 HB2 SER A 130 -12.799 -21.840 3.754 1.00 0.00 H ATOM 1814 HB3 SER A 130 -12.449 -20.814 5.165 1.00 0.00 H ATOM 1815 HG SER A 130 -10.633 -22.117 4.541 1.00 0.00 H ATOM 1816 H SER A 130 -11.586 -20.485 1.510 1.00 0.00 H ATOM 1817 N CYS A 131 -10.434 -18.585 3.184 1.00 0.00 N ATOM 1818 CA CYS A 131 -9.476 -17.530 3.501 1.00 0.00 C ATOM 1819 C CYS A 131 -10.045 -16.154 3.167 1.00 0.00 C ATOM 1820 O CYS A 131 -10.160 -15.785 1.998 1.00 0.00 O ATOM 1821 CB CYS A 131 -8.166 -17.747 2.744 1.00 0.00 C ATOM 1822 SG CYS A 131 -7.517 -19.431 2.856 1.00 0.00 S ATOM 1823 HA CYS A 131 -9.278 -17.573 4.572 1.00 0.00 H ATOM 1824 HB2 CYS A 131 -7.419 -17.065 3.150 1.00 0.00 H ATOM 1825 HB3 CYS A 131 -8.336 -17.515 1.693 1.00 0.00 H ATOM 1826 HG CYS A 131 -8.440 -20.314 2.333 1.00 0.00 H ATOM 1827 H CYS A 131 -10.152 -19.349 2.536 1.00 0.00 H ATOM 1828 N SER A 132 -10.397 -15.402 4.204 1.00 0.00 N ATOM 1829 CA SER A 132 -10.951 -14.064 4.026 1.00 0.00 C ATOM 1830 C SER A 132 -10.131 -13.031 4.794 1.00 0.00 C ATOM 1831 O SER A 132 -9.876 -13.191 5.987 1.00 0.00 O ATOM 1832 CB SER A 132 -12.408 -14.027 4.495 1.00 0.00 C ATOM 1833 OG SER A 132 -13.175 -13.134 3.706 1.00 0.00 O ATOM 1834 HA SER A 132 -10.912 -13.818 2.965 1.00 0.00 H ATOM 1835 HB2 SER A 132 -12.440 -13.701 5.535 1.00 0.00 H ATOM 1836 HB3 SER A 132 -12.833 -15.028 4.416 1.00 0.00 H ATOM 1837 HG SER A 132 -14.110 -13.129 4.030 1.00 0.00 H ATOM 1838 H SER A 132 -10.275 -15.776 5.167 1.00 0.00 H ATOM 1839 N PHE A 133 -9.720 -11.973 4.102 1.00 0.00 N ATOM 1840 CA PHE A 133 -8.928 -10.918 4.725 1.00 0.00 C ATOM 1841 C PHE A 133 -9.329 -9.545 4.194 1.00 0.00 C ATOM 1842 O PHE A 133 -9.846 -9.423 3.084 1.00 0.00 O ATOM 1843 CB PHE A 133 -7.437 -11.156 4.476 1.00 0.00 C ATOM 1844 CG PHE A 133 -7.117 -11.545 3.061 1.00 0.00 C ATOM 1845 CD1 PHE A 133 -7.124 -12.877 2.677 1.00 0.00 C ATOM 1846 CD2 PHE A 133 -6.812 -10.580 2.115 1.00 0.00 C ATOM 1847 CE1 PHE A 133 -6.830 -13.237 1.375 1.00 0.00 C ATOM 1848 CE2 PHE A 133 -6.517 -10.934 0.812 1.00 0.00 C ATOM 1849 CZ PHE A 133 -6.526 -12.266 0.442 1.00 0.00 C ATOM 1850 HA PHE A 133 -9.121 -10.942 5.798 1.00 0.00 H ATOM 1851 HB2 PHE A 133 -6.897 -10.239 4.712 1.00 0.00 H ATOM 1852 HB3 PHE A 133 -7.100 -11.954 5.137 1.00 0.00 H ATOM 1853 HD2 PHE A 133 -6.805 -9.528 2.402 1.00 0.00 H ATOM 1854 HE2 PHE A 133 -6.278 -10.165 0.078 1.00 0.00 H ATOM 1855 HZ PHE A 133 -6.293 -12.549 -0.585 1.00 0.00 H ATOM 1856 HE1 PHE A 133 -6.838 -14.288 1.085 1.00 0.00 H ATOM 1857 HD1 PHE A 133 -7.364 -13.648 3.409 1.00 0.00 H ATOM 1858 H PHE A 133 -9.968 -11.896 3.095 1.00 0.00 H ATOM 1859 N LEU A 134 -9.084 -8.515 4.997 1.00 0.00 N ATOM 1860 CA LEU A 134 -9.414 -7.147 4.613 1.00 0.00 C ATOM 1861 C LEU A 134 -8.146 -6.326 4.398 1.00 0.00 C ATOM 1862 O LEU A 134 -7.179 -6.456 5.148 1.00 0.00 O ATOM 1863 CB LEU A 134 -10.286 -6.491 5.686 1.00 0.00 C ATOM 1864 CG LEU A 134 -10.644 -5.026 5.425 1.00 0.00 C ATOM 1865 CD1 LEU A 134 -11.847 -4.927 4.502 1.00 0.00 C ATOM 1866 CD2 LEU A 134 -10.913 -4.303 6.736 1.00 0.00 C ATOM 1867 HA LEU A 134 -9.969 -7.180 3.675 1.00 0.00 H ATOM 1868 HB2 LEU A 134 -11.214 -7.058 5.760 1.00 0.00 H ATOM 1869 HB3 LEU A 134 -9.752 -6.545 6.635 1.00 0.00 H ATOM 1870 HG LEU A 134 -9.797 -4.546 4.935 1.00 0.00 H ATOM 1871 HD21 LEU A 134 -11.744 -4.785 7.252 1.00 0.00 H ATOM 1872 HD22 LEU A 134 -10.022 -4.345 7.362 1.00 0.00 H ATOM 1873 HD23 LEU A 134 -11.166 -3.263 6.531 1.00 0.00 H ATOM 1874 HD11 LEU A 134 -11.616 -5.410 3.552 1.00 0.00 H ATOM 1875 HD12 LEU A 134 -12.700 -5.423 4.965 1.00 0.00 H ATOM 1876 HD13 LEU A 134 -12.085 -3.878 4.329 1.00 0.00 H ATOM 1877 H LEU A 134 -8.645 -8.689 5.924 1.00 0.00 H ATOM 1878 N PHE A 135 -8.155 -5.484 3.369 1.00 0.00 N ATOM 1879 CA PHE A 135 -7.002 -4.648 3.060 1.00 0.00 C ATOM 1880 C PHE A 135 -7.227 -3.205 3.453 1.00 0.00 C ATOM 1881 O PHE A 135 -8.317 -2.651 3.299 1.00 0.00 O ATOM 1882 CB PHE A 135 -6.622 -4.714 1.595 1.00 0.00 C ATOM 1883 CG PHE A 135 -5.407 -3.902 1.248 1.00 0.00 C ATOM 1884 CD1 PHE A 135 -4.143 -4.325 1.627 1.00 0.00 C ATOM 1885 CD2 PHE A 135 -5.529 -2.715 0.545 1.00 0.00 C ATOM 1886 CE1 PHE A 135 -3.024 -3.578 1.310 1.00 0.00 C ATOM 1887 CE2 PHE A 135 -4.415 -1.965 0.224 1.00 0.00 C ATOM 1888 CZ PHE A 135 -3.161 -2.397 0.608 1.00 0.00 C ATOM 1889 HA PHE A 135 -6.179 -5.050 3.651 1.00 0.00 H ATOM 1890 HB2 PHE A 135 -6.426 -5.755 1.337 1.00 0.00 H ATOM 1891 HB3 PHE A 135 -7.462 -4.347 1.005 1.00 0.00 H ATOM 1892 HD2 PHE A 135 -6.517 -2.368 0.241 1.00 0.00 H ATOM 1893 HE2 PHE A 135 -4.525 -1.034 -0.331 1.00 0.00 H ATOM 1894 HZ PHE A 135 -2.280 -1.806 0.357 1.00 0.00 H ATOM 1895 HE1 PHE A 135 -2.035 -3.921 1.614 1.00 0.00 H ATOM 1896 HD1 PHE A 135 -4.030 -5.257 2.181 1.00 0.00 H ATOM 1897 H PHE A 135 -9.004 -5.421 2.771 1.00 0.00 H ATOM 1898 N LYS A 136 -6.165 -2.621 3.956 1.00 0.00 N ATOM 1899 CA LYS A 136 -6.165 -1.229 4.396 1.00 0.00 C ATOM 1900 C LYS A 136 -4.755 -0.643 4.332 1.00 0.00 C ATOM 1901 O LYS A 136 -3.781 -1.315 4.668 1.00 0.00 O ATOM 1902 CB LYS A 136 -6.702 -1.124 5.826 1.00 0.00 C ATOM 1903 CG LYS A 136 -8.204 -0.900 5.901 1.00 0.00 C ATOM 1904 CD LYS A 136 -8.815 -1.621 7.093 1.00 0.00 C ATOM 1905 CE LYS A 136 -10.203 -1.091 7.412 1.00 0.00 C ATOM 1906 NZ LYS A 136 -10.150 0.249 8.059 1.00 0.00 N ATOM 1907 HA LYS A 136 -6.812 -0.661 3.727 1.00 0.00 H ATOM 1908 HB2 LYS A 136 -6.465 -2.049 6.351 1.00 0.00 H ATOM 1909 HB3 LYS A 136 -6.204 -0.290 6.320 1.00 0.00 H ATOM 1910 HG2 LYS A 136 -8.399 0.168 5.994 1.00 0.00 H ATOM 1911 HG3 LYS A 136 -8.664 -1.273 4.986 1.00 0.00 H ATOM 1912 HD2 LYS A 136 -8.885 -2.685 6.866 1.00 0.00 H ATOM 1913 HD3 LYS A 136 -8.172 -1.478 7.962 1.00 0.00 H ATOM 1914 HE2 LYS A 136 -10.701 -1.789 8.086 1.00 0.00 H ATOM 1915 HE3 LYS A 136 -10.772 -1.013 6.486 1.00 0.00 H ATOM 1916 HZ1 LYS A 136 -9.614 0.183 8.948 1.00 0.00 H ATOM 1917 HZ2 LYS A 136 -9.682 0.923 7.420 1.00 0.00 H ATOM 1918 HZ3 LYS A 136 -11.117 0.574 8.260 1.00 0.00 H ATOM 1919 H LYS A 136 -5.288 -3.172 4.045 1.00 0.00 H ATOM 1920 N TYR A 137 -4.652 0.615 3.910 1.00 0.00 N ATOM 1921 CA TYR A 137 -3.354 1.279 3.820 1.00 0.00 C ATOM 1922 C TYR A 137 -2.815 1.594 5.210 1.00 0.00 C ATOM 1923 O TYR A 137 -3.559 1.999 6.103 1.00 0.00 O ATOM 1924 CB TYR A 137 -3.437 2.568 3.008 1.00 0.00 C ATOM 1925 CG TYR A 137 -4.269 2.459 1.750 1.00 0.00 C ATOM 1926 CD1 TYR A 137 -3.945 1.542 0.758 1.00 0.00 C ATOM 1927 CD2 TYR A 137 -5.372 3.280 1.550 1.00 0.00 C ATOM 1928 CE1 TYR A 137 -4.695 1.447 -0.398 1.00 0.00 C ATOM 1929 CE2 TYR A 137 -6.128 3.189 0.397 1.00 0.00 C ATOM 1930 CZ TYR A 137 -5.786 2.272 -0.574 1.00 0.00 C ATOM 1931 OH TYR A 137 -6.535 2.180 -1.723 1.00 0.00 O ATOM 1932 HA TYR A 137 -2.676 0.593 3.312 1.00 0.00 H ATOM 1933 HB3 TYR A 137 -2.426 2.859 2.724 1.00 0.00 H ATOM 1934 HB2 TYR A 137 -3.873 3.342 3.640 1.00 0.00 H ATOM 1935 HD2 TYR A 137 -5.645 4.007 2.315 1.00 0.00 H ATOM 1936 HE2 TYR A 137 -6.991 3.839 0.256 1.00 0.00 H ATOM 1937 HE1 TYR A 137 -4.426 0.723 -1.167 1.00 0.00 H ATOM 1938 HD1 TYR A 137 -3.085 0.887 0.894 1.00 0.00 H ATOM 1939 HH TYR A 137 -6.155 1.478 -2.308 1.00 0.00 H ATOM 1940 H TYR A 137 -5.511 1.135 3.639 1.00 0.00 H ATOM 1941 N ALA A 138 -1.516 1.405 5.379 1.00 0.00 N ATOM 1942 CA ALA A 138 -0.862 1.667 6.655 1.00 0.00 C ATOM 1943 C ALA A 138 -0.334 3.096 6.719 1.00 0.00 C ATOM 1944 O ALA A 138 -0.237 3.685 7.796 1.00 0.00 O ATOM 1945 CB ALA A 138 0.270 0.674 6.880 1.00 0.00 C ATOM 1946 HA ALA A 138 -1.602 1.546 7.446 1.00 0.00 H ATOM 1947 HB1 ALA A 138 -0.133 -0.339 6.886 1.00 0.00 H ATOM 1948 HB2 ALA A 138 1.001 0.771 6.077 1.00 0.00 H ATOM 1949 HB3 ALA A 138 0.749 0.882 7.837 1.00 0.00 H ATOM 1950 H ALA A 138 -0.947 1.060 4.580 1.00 0.00 H ATOM 1951 N SER A 139 0.005 3.650 5.557 1.00 0.00 N ATOM 1952 CA SER A 139 0.524 5.012 5.476 1.00 0.00 C ATOM 1953 C SER A 139 1.852 5.138 6.218 1.00 0.00 C ATOM 1954 O SER A 139 2.919 5.126 5.605 1.00 0.00 O ATOM 1955 CB SER A 139 -0.494 6.005 6.044 1.00 0.00 C ATOM 1956 OG SER A 139 -1.642 6.088 5.218 1.00 0.00 O ATOM 1957 HA SER A 139 0.697 5.245 4.425 1.00 0.00 H ATOM 1958 HB2 SER A 139 -0.032 6.990 6.111 1.00 0.00 H ATOM 1959 HB3 SER A 139 -0.794 5.677 7.039 1.00 0.00 H ATOM 1960 HG SER A 139 -2.282 6.735 5.608 1.00 0.00 H ATOM 1961 H SER A 139 -0.103 3.097 4.683 1.00 0.00 H ATOM 1962 N SER A 140 1.780 5.260 7.539 1.00 0.00 N ATOM 1963 CA SER A 140 2.978 5.388 8.361 1.00 0.00 C ATOM 1964 C SER A 140 2.699 4.969 9.801 1.00 0.00 C ATOM 1965 O SER A 140 3.316 4.036 10.317 1.00 0.00 O ATOM 1966 CB SER A 140 3.493 6.828 8.328 1.00 0.00 C ATOM 1967 OG SER A 140 4.892 6.875 8.545 1.00 0.00 O ATOM 1968 HA SER A 140 3.741 4.726 7.951 1.00 0.00 H ATOM 1969 HB2 SER A 140 2.992 7.403 9.107 1.00 0.00 H ATOM 1970 HB3 SER A 140 3.269 7.264 7.355 1.00 0.00 H ATOM 1971 HG SER A 140 5.197 7.816 8.519 1.00 0.00 H ATOM 1972 H SER A 140 0.847 5.264 7.998 1.00 0.00 H ATOM 1973 N SER A 141 1.765 5.663 10.443 1.00 0.00 N ATOM 1974 CA SER A 141 1.404 5.362 11.824 1.00 0.00 C ATOM 1975 C SER A 141 0.057 5.980 12.183 1.00 0.00 C ATOM 1976 O SER A 141 -0.065 7.199 12.304 1.00 0.00 O ATOM 1977 CB SER A 141 2.484 5.873 12.779 1.00 0.00 C ATOM 1978 OG SER A 141 2.170 5.554 14.124 1.00 0.00 O ATOM 1979 HA SER A 141 1.324 4.280 11.923 1.00 0.00 H ATOM 1980 HB2 SER A 141 2.564 6.955 12.679 1.00 0.00 H ATOM 1981 HB3 SER A 141 3.437 5.414 12.517 1.00 0.00 H ATOM 1982 HG SER A 141 2.884 5.896 14.718 1.00 0.00 H ATOM 1983 H SER A 141 1.280 6.439 9.949 1.00 0.00 H ATOM 1984 N SER A 142 -0.953 5.132 12.350 1.00 0.00 N ATOM 1985 CA SER A 142 -2.291 5.595 12.694 1.00 0.00 C ATOM 1986 C SER A 142 -2.303 6.253 14.070 1.00 0.00 C ATOM 1987 O SER A 142 -1.326 6.172 14.815 1.00 0.00 O ATOM 1988 CB SER A 142 -3.280 4.429 12.665 1.00 0.00 C ATOM 1989 OG SER A 142 -3.369 3.865 11.368 1.00 0.00 O ATOM 1990 HA SER A 142 -2.592 6.337 11.954 1.00 0.00 H ATOM 1991 HB2 SER A 142 -4.264 4.789 12.965 1.00 0.00 H ATOM 1992 HB3 SER A 142 -2.947 3.662 13.364 1.00 0.00 H ATOM 1993 HG SER A 142 -4.015 3.115 11.379 1.00 0.00 H ATOM 1994 H SER A 142 -0.784 4.113 12.232 1.00 0.00 H ATOM 1995 N THR A 143 -3.412 6.904 14.400 1.00 0.00 N ATOM 1996 CA THR A 143 -3.550 7.576 15.687 1.00 0.00 C ATOM 1997 C THR A 143 -4.795 7.091 16.424 1.00 0.00 C ATOM 1998 O THR A 143 -5.693 6.503 15.823 1.00 0.00 O ATOM 1999 CB THR A 143 -3.617 9.091 15.491 1.00 0.00 C ATOM 2000 OG1 THR A 143 -3.006 9.466 14.269 1.00 0.00 O ATOM 2001 CG2 THR A 143 -2.942 9.868 16.600 1.00 0.00 C ATOM 2002 HA THR A 143 -2.675 7.333 16.290 1.00 0.00 H ATOM 2003 HB THR A 143 -4.679 9.336 15.493 1.00 0.00 H ATOM 2004 HG1 THR A 143 -3.060 10.449 14.162 1.00 0.00 H ATOM 2005 HG23 THR A 143 -3.392 9.600 17.556 1.00 0.00 H ATOM 2006 HG21 THR A 143 -1.879 9.626 16.617 1.00 0.00 H ATOM 2007 HG22 THR A 143 -3.070 10.936 16.424 1.00 0.00 H ATOM 2008 H THR A 143 -4.202 6.936 13.724 1.00 0.00 H ATOM 2009 N ASP A 144 -4.840 7.343 17.728 1.00 0.00 N ATOM 2010 CA ASP A 144 -5.974 6.932 18.547 1.00 0.00 C ATOM 2011 C ASP A 144 -7.127 7.921 18.417 1.00 0.00 C ATOM 2012 O ASP A 144 -6.952 9.034 17.919 1.00 0.00 O ATOM 2013 CB ASP A 144 -5.553 6.812 20.013 1.00 0.00 C ATOM 2014 CG ASP A 144 -4.652 5.618 20.261 1.00 0.00 C ATOM 2015 OD1 ASP A 144 -3.708 5.413 19.471 1.00 0.00 O ATOM 2016 OD2 ASP A 144 -4.892 4.887 21.246 1.00 0.00 O ATOM 2017 HA ASP A 144 -6.313 5.959 18.192 1.00 0.00 H ATOM 2018 HB2 ASP A 144 -5.020 7.718 20.299 1.00 0.00 H ATOM 2019 HB3 ASP A 144 -6.448 6.709 20.627 1.00 0.00 H ATOM 2020 H ASP A 144 -4.047 7.846 18.175 1.00 0.00 H ATOM 2021 N ILE A 145 -8.307 7.510 18.869 1.00 0.00 N ATOM 2022 CA ILE A 145 -9.492 8.361 18.802 1.00 0.00 C ATOM 2023 C ILE A 145 -9.808 8.971 20.154 1.00 0.00 C ATOM 2024 O ILE A 145 -10.947 9.327 20.451 1.00 0.00 O ATOM 2025 CB ILE A 145 -10.715 7.575 18.334 1.00 0.00 C ATOM 2026 CG1 ILE A 145 -10.366 6.696 17.131 1.00 0.00 C ATOM 2027 CG2 ILE A 145 -11.867 8.515 18.005 1.00 0.00 C ATOM 2028 CD1 ILE A 145 -9.874 5.317 17.511 1.00 0.00 C ATOM 2029 HA ILE A 145 -9.267 9.151 18.085 1.00 0.00 H ATOM 2030 HB ILE A 145 -11.033 6.923 19.148 1.00 0.00 H ATOM 2031 HG12 ILE A 145 -11.258 6.586 16.514 1.00 0.00 H ATOM 2032 HG13 ILE A 145 -9.586 7.194 16.555 1.00 0.00 H ATOM 2033 HD11 ILE A 145 -8.975 5.409 18.120 1.00 0.00 H ATOM 2034 HD12 ILE A 145 -10.648 4.800 18.079 1.00 0.00 H ATOM 2035 HD13 ILE A 145 -9.646 4.752 16.607 1.00 0.00 H ATOM 2036 HG21 ILE A 145 -12.134 9.086 18.894 1.00 0.00 H ATOM 2037 HG22 ILE A 145 -11.562 9.198 17.212 1.00 0.00 H ATOM 2038 HG23 ILE A 145 -12.727 7.932 17.674 1.00 0.00 H ATOM 2039 H ILE A 145 -8.389 6.559 19.281 1.00 0.00 H ATOM 2040 N GLU A 146 -8.780 9.079 20.955 1.00 0.00 N ATOM 2041 CA GLU A 146 -8.891 9.641 22.296 1.00 0.00 C ATOM 2042 C GLU A 146 -8.748 11.160 22.263 1.00 0.00 C ATOM 2043 O GLU A 146 -9.412 11.872 23.017 1.00 0.00 O ATOM 2044 CB GLU A 146 -7.828 9.037 23.215 1.00 0.00 C ATOM 2045 CG GLU A 146 -6.404 9.285 22.745 1.00 0.00 C ATOM 2046 CD GLU A 146 -5.369 8.712 23.693 1.00 0.00 C ATOM 2047 OE1 GLU A 146 -5.349 9.126 24.871 1.00 0.00 O ATOM 2048 OE2 GLU A 146 -4.578 7.849 23.257 1.00 0.00 O ATOM 2049 HA GLU A 146 -9.879 9.395 22.685 1.00 0.00 H ATOM 2050 HB2 GLU A 146 -7.944 9.471 24.208 1.00 0.00 H ATOM 2051 HB3 GLU A 146 -7.991 7.961 23.269 1.00 0.00 H ATOM 2052 HG2 GLU A 146 -6.274 8.824 21.766 1.00 0.00 H ATOM 2053 HG3 GLU A 146 -6.245 10.360 22.663 1.00 0.00 H ATOM 2054 H GLU A 146 -7.850 8.752 20.624 1.00 0.00 H ATOM 2055 N ASN A 147 -7.878 11.648 21.386 1.00 0.00 N ATOM 2056 CA ASN A 147 -7.648 13.082 21.254 1.00 0.00 C ATOM 2057 C ASN A 147 -7.731 13.515 19.795 1.00 0.00 C ATOM 2058 O ASN A 147 -7.043 14.443 19.372 1.00 0.00 O ATOM 2059 CB ASN A 147 -6.281 13.456 21.831 1.00 0.00 C ATOM 2060 CG ASN A 147 -6.284 13.498 23.346 1.00 0.00 C ATOM 2061 OD1 ASN A 147 -7.341 13.551 23.976 1.00 0.00 O ATOM 2062 ND2 ASN A 147 -5.097 13.475 23.941 1.00 0.00 N ATOM 2063 HA ASN A 147 -8.426 13.602 21.813 1.00 0.00 H ATOM 2064 HB2 ASN A 147 -5.549 12.718 21.503 1.00 0.00 H ATOM 2065 HB3 ASN A 147 -5.999 14.439 21.454 1.00 0.00 H ATOM 2066 HD22 ASN A 147 -4.229 13.430 23.369 1.00 0.00 H ATOM 2067 HD21 ASN A 147 -5.035 13.502 24.979 1.00 0.00 H ATOM 2068 H ASN A 147 -7.348 10.991 20.778 1.00 0.00 H ATOM 2069 N ASP A 148 -8.579 12.834 19.029 1.00 0.00 N ATOM 2070 CA ASP A 148 -8.752 13.148 17.614 1.00 0.00 C ATOM 2071 C ASP A 148 -10.224 13.372 17.284 1.00 0.00 C ATOM 2072 O ASP A 148 -10.937 12.439 16.916 1.00 0.00 O ATOM 2073 CB ASP A 148 -8.188 12.019 16.749 1.00 0.00 C ATOM 2074 CG ASP A 148 -6.700 12.170 16.499 1.00 0.00 C ATOM 2075 OD1 ASP A 148 -6.262 13.298 16.189 1.00 0.00 O ATOM 2076 OD2 ASP A 148 -5.974 11.162 16.612 1.00 0.00 O ATOM 2077 HA ASP A 148 -8.207 14.067 17.400 1.00 0.00 H ATOM 2078 HB2 ASP A 148 -8.364 11.069 17.254 1.00 0.00 H ATOM 2079 HB3 ASP A 148 -8.706 12.020 15.790 1.00 0.00 H ATOM 2080 H ASP A 148 -9.132 12.059 19.448 1.00 0.00 H ATOM 2081 N ASP A 149 -10.671 14.617 17.417 1.00 0.00 N ATOM 2082 CA ASP A 149 -12.058 14.964 17.132 1.00 0.00 C ATOM 2083 C ASP A 149 -12.292 15.083 15.629 1.00 0.00 C ATOM 2084 O ASP A 149 -11.386 15.442 14.876 1.00 0.00 O ATOM 2085 CB ASP A 149 -12.430 16.278 17.827 1.00 0.00 C ATOM 2086 CG ASP A 149 -13.548 16.102 18.835 1.00 0.00 C ATOM 2087 OD1 ASP A 149 -13.435 15.208 19.699 1.00 0.00 O ATOM 2088 OD2 ASP A 149 -14.538 16.860 18.761 1.00 0.00 O ATOM 2089 HA ASP A 149 -12.693 14.166 17.516 1.00 0.00 H ATOM 2090 HB2 ASP A 149 -11.550 16.663 18.343 1.00 0.00 H ATOM 2091 HB3 ASP A 149 -12.749 16.996 17.071 1.00 0.00 H ATOM 2092 H ASP A 149 -10.016 15.361 17.732 1.00 0.00 H ATOM 2093 N GLU A 150 -13.513 14.780 15.199 1.00 0.00 N ATOM 2094 CA GLU A 150 -13.868 14.852 13.786 1.00 0.00 C ATOM 2095 C GLU A 150 -14.893 15.953 13.537 1.00 0.00 C ATOM 2096 O GLU A 150 -16.074 15.795 13.844 1.00 0.00 O ATOM 2097 CB GLU A 150 -14.420 13.508 13.309 1.00 0.00 C ATOM 2098 CG GLU A 150 -14.625 13.433 11.806 1.00 0.00 C ATOM 2099 CD GLU A 150 -13.334 13.177 11.053 1.00 0.00 C ATOM 2100 OE1 GLU A 150 -12.398 13.992 11.187 1.00 0.00 O ATOM 2101 OE2 GLU A 150 -13.259 12.161 10.331 1.00 0.00 O ATOM 2102 HA GLU A 150 -12.965 15.088 13.222 1.00 0.00 H ATOM 2103 HB2 GLU A 150 -13.720 12.725 13.601 1.00 0.00 H ATOM 2104 HB3 GLU A 150 -15.380 13.337 13.797 1.00 0.00 H ATOM 2105 HG2 GLU A 150 -15.323 12.624 11.589 1.00 0.00 H ATOM 2106 HG3 GLU A 150 -15.048 14.378 11.464 1.00 0.00 H ATOM 2107 H GLU A 150 -14.234 14.484 15.888 1.00 0.00 H ATOM 2108 N LYS A 151 -14.434 17.069 12.979 1.00 0.00 N ATOM 2109 CA LYS A 151 -15.313 18.196 12.689 1.00 0.00 C ATOM 2110 C LYS A 151 -15.888 18.089 11.280 1.00 0.00 C ATOM 2111 O LYS A 151 -15.219 17.617 10.361 1.00 0.00 O ATOM 2112 CB LYS A 151 -14.554 19.515 12.844 1.00 0.00 C ATOM 2113 CG LYS A 151 -14.191 19.843 14.283 1.00 0.00 C ATOM 2114 CD LYS A 151 -13.082 18.941 14.798 1.00 0.00 C ATOM 2115 CE LYS A 151 -12.504 19.459 16.105 1.00 0.00 C ATOM 2116 NZ LYS A 151 -11.083 19.052 16.283 1.00 0.00 N ATOM 2117 HA LYS A 151 -16.138 18.174 13.401 1.00 0.00 H ATOM 2118 HB2 LYS A 151 -13.635 19.454 12.262 1.00 0.00 H ATOM 2119 HB3 LYS A 151 -15.177 20.319 12.454 1.00 0.00 H ATOM 2120 HG2 LYS A 151 -13.858 20.880 14.337 1.00 0.00 H ATOM 2121 HG3 LYS A 151 -15.073 19.713 14.910 1.00 0.00 H ATOM 2122 HD2 LYS A 151 -13.485 17.941 14.960 1.00 0.00 H ATOM 2123 HD3 LYS A 151 -12.288 18.895 14.053 1.00 0.00 H ATOM 2124 HE2 LYS A 151 -13.091 19.061 16.933 1.00 0.00 H ATOM 2125 HE3 LYS A 151 -12.562 20.547 16.110 1.00 0.00 H ATOM 2126 HZ1 LYS A 151 -11.019 18.014 16.286 1.00 0.00 H ATOM 2127 HZ2 LYS A 151 -10.514 19.433 15.501 1.00 0.00 H ATOM 2128 HZ3 LYS A 151 -10.727 19.425 17.186 1.00 0.00 H ATOM 2129 H LYS A 151 -13.423 17.140 12.744 1.00 0.00 H ATOM 2130 N VAL A 152 -17.131 18.531 11.119 1.00 0.00 N ATOM 2131 CA VAL A 152 -17.795 18.485 9.821 1.00 0.00 C ATOM 2132 C VAL A 152 -17.385 19.669 8.952 1.00 0.00 C ATOM 2133 O VAL A 152 -17.587 20.825 9.323 1.00 0.00 O ATOM 2134 CB VAL A 152 -19.327 18.481 9.973 1.00 0.00 C ATOM 2135 CG1 VAL A 152 -19.811 17.134 10.488 1.00 0.00 C ATOM 2136 CG2 VAL A 152 -19.779 19.605 10.894 1.00 0.00 C ATOM 2137 HA VAL A 152 -17.483 17.558 9.339 1.00 0.00 H ATOM 2138 HB VAL A 152 -19.769 18.649 8.991 1.00 0.00 H ATOM 2139 HG11 VAL A 152 -19.524 16.353 9.784 1.00 0.00 H ATOM 2140 HG12 VAL A 152 -19.359 16.934 11.459 1.00 0.00 H ATOM 2141 HG13 VAL A 152 -20.896 17.153 10.588 1.00 0.00 H ATOM 2142 HG21 VAL A 152 -19.326 19.472 11.877 1.00 0.00 H ATOM 2143 HG22 VAL A 152 -19.468 20.563 10.476 1.00 0.00 H ATOM 2144 HG23 VAL A 152 -20.865 19.583 10.987 1.00 0.00 H ATOM 2145 H VAL A 152 -17.642 18.919 11.938 1.00 0.00 H ATOM 2146 N SER A 153 -16.808 19.372 7.792 1.00 0.00 N ATOM 2147 CA SER A 153 -16.370 20.412 6.869 1.00 0.00 C ATOM 2148 C SER A 153 -15.937 19.811 5.536 1.00 0.00 C ATOM 2149 O SER A 153 -16.315 20.300 4.472 1.00 0.00 O ATOM 2150 CB SER A 153 -15.218 21.212 7.480 1.00 0.00 C ATOM 2151 OG SER A 153 -14.931 22.364 6.706 1.00 0.00 O ATOM 2152 HA SER A 153 -17.212 21.080 6.688 1.00 0.00 H ATOM 2153 HB2 SER A 153 -14.330 20.582 7.524 1.00 0.00 H ATOM 2154 HB3 SER A 153 -15.493 21.520 8.489 1.00 0.00 H ATOM 2155 HG SER A 153 -14.184 22.862 7.122 1.00 0.00 H ATOM 2156 H SER A 153 -16.666 18.374 7.537 1.00 0.00 H ATOM 2157 N SER A 154 -15.142 18.748 5.602 1.00 0.00 N ATOM 2158 CA SER A 154 -14.657 18.081 4.399 1.00 0.00 C ATOM 2159 C SER A 154 -15.376 16.752 4.184 1.00 0.00 C ATOM 2160 O SER A 154 -14.830 15.835 3.570 1.00 0.00 O ATOM 2161 CB SER A 154 -13.149 17.849 4.493 1.00 0.00 C ATOM 2162 OG SER A 154 -12.452 19.074 4.647 1.00 0.00 O ATOM 2163 HA SER A 154 -14.866 18.727 3.547 1.00 0.00 H ATOM 2164 HB2 SER A 154 -12.807 17.357 3.583 1.00 0.00 H ATOM 2165 HB3 SER A 154 -12.940 17.210 5.351 1.00 0.00 H ATOM 2166 HG SER A 154 -11.480 18.894 4.705 1.00 0.00 H ATOM 2167 H SER A 154 -14.859 18.383 6.534 1.00 0.00 H ATOM 2168 N GLU A 155 -16.601 16.655 4.690 1.00 0.00 N ATOM 2169 CA GLU A 155 -17.393 15.437 4.550 1.00 0.00 C ATOM 2170 C GLU A 155 -16.646 14.231 5.114 1.00 0.00 C ATOM 2171 O GLU A 155 -16.080 13.434 4.366 1.00 0.00 O ATOM 2172 CB GLU A 155 -17.740 15.195 3.080 1.00 0.00 C ATOM 2173 CG GLU A 155 -18.833 16.112 2.555 1.00 0.00 C ATOM 2174 CD GLU A 155 -20.221 15.538 2.756 1.00 0.00 C ATOM 2175 OE1 GLU A 155 -20.645 14.703 1.930 1.00 0.00 O ATOM 2176 OE2 GLU A 155 -20.885 15.924 3.741 1.00 0.00 O ATOM 2177 HA GLU A 155 -18.315 15.567 5.117 1.00 0.00 H ATOM 2178 HB2 GLU A 155 -16.842 15.352 2.483 1.00 0.00 H ATOM 2179 HB3 GLU A 155 -18.073 14.163 2.969 1.00 0.00 H ATOM 2180 HG2 GLU A 155 -18.770 17.066 3.078 1.00 0.00 H ATOM 2181 HG3 GLU A 155 -18.672 16.273 1.489 1.00 0.00 H ATOM 2182 H GLU A 155 -17.005 17.467 5.198 1.00 0.00 H ATOM 2183 N SER A 156 -16.649 14.104 6.437 1.00 0.00 N ATOM 2184 CA SER A 156 -15.972 12.996 7.100 1.00 0.00 C ATOM 2185 C SER A 156 -16.983 11.995 7.652 1.00 0.00 C ATOM 2186 O SER A 156 -16.823 10.785 7.495 1.00 0.00 O ATOM 2187 CB SER A 156 -15.080 13.517 8.228 1.00 0.00 C ATOM 2188 OG SER A 156 -13.710 13.427 7.879 1.00 0.00 O ATOM 2189 HA SER A 156 -15.350 12.488 6.363 1.00 0.00 H ATOM 2190 HB2 SER A 156 -15.258 12.925 9.126 1.00 0.00 H ATOM 2191 HB3 SER A 156 -15.329 14.559 8.426 1.00 0.00 H ATOM 2192 HG SER A 156 -13.157 13.770 8.625 1.00 0.00 H ATOM 2193 H SER A 156 -17.146 14.812 7.013 1.00 0.00 H ATOM 2194 N ARG A 157 -18.024 12.508 8.300 1.00 0.00 N ATOM 2195 CA ARG A 157 -19.060 11.660 8.875 1.00 0.00 C ATOM 2196 C ARG A 157 -20.449 12.204 8.552 1.00 0.00 C ATOM 2197 O ARG A 157 -20.588 13.176 7.809 1.00 0.00 O ATOM 2198 CB ARG A 157 -18.879 11.554 10.391 1.00 0.00 C ATOM 2199 CG ARG A 157 -18.188 10.274 10.833 1.00 0.00 C ATOM 2200 CD ARG A 157 -16.714 10.507 11.124 1.00 0.00 C ATOM 2201 NE ARG A 157 -15.918 9.299 10.924 1.00 0.00 N ATOM 2202 CZ ARG A 157 -14.703 9.118 11.437 1.00 0.00 C ATOM 2203 NH1 ARG A 157 -14.141 10.063 12.181 1.00 0.00 N ATOM 2204 NH2 ARG A 157 -14.048 7.988 11.206 1.00 0.00 N ATOM 2205 HA ARG A 157 -18.968 10.667 8.436 1.00 0.00 H ATOM 2206 HB2 ARG A 157 -18.282 12.402 10.727 1.00 0.00 H ATOM 2207 HB3 ARG A 157 -19.862 11.595 10.860 1.00 0.00 H ATOM 2208 HG2 ARG A 157 -18.673 9.903 11.736 1.00 0.00 H ATOM 2209 HG3 ARG A 157 -18.280 9.530 10.041 1.00 0.00 H ATOM 2210 HD2 ARG A 157 -16.607 10.832 12.159 1.00 0.00 H ATOM 2211 HD3 ARG A 157 -16.343 11.287 10.459 1.00 0.00 H ATOM 2212 HE ARG A 157 -16.324 8.535 10.347 1.00 0.00 H ATOM 2213 HH12 ARG A 157 -13.192 9.916 12.579 1.00 0.00 H ATOM 2214 HH11 ARG A 157 -14.650 10.951 12.366 1.00 0.00 H ATOM 2215 HH22 ARG A 157 -13.099 7.846 11.606 1.00 0.00 H ATOM 2216 HH21 ARG A 157 -14.484 7.244 10.624 1.00 0.00 H ATOM 2217 H ARG A 157 -18.101 13.540 8.399 1.00 0.00 H ATOM 2218 N SER A 158 -21.473 11.571 9.114 1.00 0.00 N ATOM 2219 CA SER A 158 -22.850 11.991 8.885 1.00 0.00 C ATOM 2220 C SER A 158 -23.738 11.613 10.066 1.00 0.00 C ATOM 2221 O SER A 158 -24.919 11.309 9.896 1.00 0.00 O ATOM 2222 CB SER A 158 -23.392 11.359 7.602 1.00 0.00 C ATOM 2223 OG SER A 158 -22.670 11.808 6.467 1.00 0.00 O ATOM 2224 HA SER A 158 -22.859 13.076 8.779 1.00 0.00 H ATOM 2225 HB2 SER A 158 -24.441 11.630 7.487 1.00 0.00 H ATOM 2226 HB3 SER A 158 -23.304 10.275 7.674 1.00 0.00 H ATOM 2227 HG SER A 158 -21.717 11.560 6.564 1.00 0.00 H ATOM 2228 H SER A 158 -21.288 10.756 9.733 1.00 0.00 H ATOM 2229 N TYR A 159 -23.162 11.633 11.264 1.00 0.00 N ATOM 2230 CA TYR A 159 -23.901 11.292 12.474 1.00 0.00 C ATOM 2231 C TYR A 159 -23.352 12.050 13.679 1.00 0.00 C ATOM 2232 O TYR A 159 -24.074 12.151 14.692 1.00 0.00 O ATOM 2233 CB TYR A 159 -23.837 9.784 12.727 1.00 0.00 C ATOM 2234 CG TYR A 159 -25.196 9.123 12.797 1.00 0.00 C ATOM 2235 CD1 TYR A 159 -26.065 9.389 13.848 1.00 0.00 C ATOM 2236 CD2 TYR A 159 -25.609 8.234 11.812 1.00 0.00 C ATOM 2237 CE1 TYR A 159 -27.308 8.787 13.915 1.00 0.00 C ATOM 2238 CE2 TYR A 159 -26.849 7.628 11.873 1.00 0.00 C ATOM 2239 CZ TYR A 159 -27.695 7.907 12.927 1.00 0.00 C ATOM 2240 OH TYR A 159 -28.931 7.306 12.990 1.00 0.00 O ATOM 2241 HA TYR A 159 -24.941 11.584 12.330 1.00 0.00 H ATOM 2242 HB3 TYR A 159 -23.322 9.615 13.673 1.00 0.00 H ATOM 2243 HB2 TYR A 159 -23.270 9.322 11.918 1.00 0.00 H ATOM 2244 HD2 TYR A 159 -24.944 8.011 10.978 1.00 0.00 H ATOM 2245 HE2 TYR A 159 -27.158 6.933 11.092 1.00 0.00 H ATOM 2246 HE1 TYR A 159 -27.979 9.007 14.745 1.00 0.00 H ATOM 2247 HD1 TYR A 159 -25.762 10.083 14.632 1.00 0.00 H ATOM 2248 HH TYR A 159 -29.405 7.614 13.803 1.00 0.00 H ATOM 2249 H TYR A 159 -22.159 11.898 11.340 1.00 0.00 H TER 2250 TYR A 159 HETATM 2251 N ASN A 1 13.413 -22.819 -0.603 1.00 0.24 N HETATM 2252 CA ASN A 1 12.017 -22.984 -0.121 1.00 0.08 C HETATM 2253 C ASN A 1 11.147 -23.662 -1.176 1.00 0.23 C HETATM 2254 O ASN A 1 10.719 -23.030 -2.141 1.00 -0.39 O HETATM 2255 N ASN A 1 10.889 -24.951 -0.984 1.00 -0.26 N HETATM 2256 CA ASN A 1 10.071 -25.714 -1.918 1.00 0.13 C HETATM 2257 C ASN A 1 8.683 -25.979 -1.343 1.00 0.20 C HETATM 2258 O ASN A 1 8.536 -26.698 -0.356 1.00 -0.39 O HETATM 2259 N ASN A 1 7.667 -25.391 -1.968 1.00 -0.26 N HETATM 2260 CA ASN A 1 6.290 -25.564 -1.519 1.00 0.16 C HETATM 2261 CB ASN A 1 5.605 -24.202 -1.280 1.00 0.13 C HETATM 2262 CG2 ASN A 1 4.156 -24.385 -0.847 1.00 -0.03 C HETATM 2263 H23 ASN A 1 3.695 -23.400 -0.684 1.00 0.03 H HETATM 2264 H24 ASN A 1 4.123 -24.964 0.088 1.00 0.03 H HETATM 2265 H25 ASN A 1 3.604 -24.923 -1.632 1.00 0.03 H HETATM 2266 OG1 ASN A 1 6.300 -23.476 -0.300 1.00 -0.27 O HETATM 2267 P ASN A 1 6.547 -24.147 1.089 1.00 0.20 P HETATM 2268 O1P ASN A 1 6.458 -22.982 2.108 1.00 -0.55 O HETATM 2269 O2P ASN A 1 8.011 -24.651 1.025 1.00 -0.55 O HETATM 2270 O3P ASN A 1 5.571 -25.246 1.385 1.00 -0.55 O HETATM 2271 H22 ASN A 1 5.621 -23.633 -2.221 1.00 0.07 H HETATM 2272 C ASN A 1 5.481 -26.363 -2.537 1.00 0.21 C HETATM 2273 O ASN A 1 5.762 -26.324 -3.735 1.00 -0.39 O HETATM 2274 N ASN A 1 4.477 -27.085 -2.052 1.00 -0.26 N HETATM 2275 CA ASN A 1 3.627 -27.893 -2.920 1.00 0.13 C HETATM 2276 C ASN A 1 2.811 -27.008 -3.862 1.00 0.21 C HETATM 2277 O ASN A 1 2.204 -26.028 -3.431 1.00 -0.39 O HETATM 2278 N ASN A 1 2.782 -27.341 -5.167 1.00 -0.25 N HETATM 2279 CA ASN A 1 2.031 -26.565 -6.162 1.00 0.13 C HETATM 2280 C ASN A 1 0.557 -26.432 -5.797 1.00 0.20 C HETATM 2281 O ASN A 1 0.159 -26.707 -4.664 1.00 -0.39 O HETATM 2282 N ASN A 1 -0.250 -26.011 -6.765 1.00 -0.26 N HETATM 2283 CA ASN A 1 -1.682 -25.842 -6.549 1.00 0.16 C HETATM 2284 CB ASN A 1 -2.332 -25.045 -7.697 1.00 0.13 C HETATM 2285 CG2 ASN A 1 -3.832 -24.895 -7.484 1.00 -0.03 C HETATM 2286 H44 ASN A 1 -4.265 -24.323 -8.318 1.00 0.03 H HETATM 2287 H45 ASN A 1 -4.017 -24.363 -6.539 1.00 0.03 H HETATM 2288 H46 ASN A 1 -4.298 -25.891 -7.441 1.00 0.03 H HETATM 2289 OG1 ASN A 1 -1.744 -23.776 -7.789 1.00 -0.27 O HETATM 2290 P ASN A 1 -2.047 -22.916 -9.054 1.00 0.20 P HETATM 2291 O1P ASN A 1 -0.810 -21.995 -9.209 1.00 -0.55 O HETATM 2292 O2P ASN A 1 -2.072 -23.932 -10.225 1.00 -0.55 O HETATM 2293 O3P ASN A 1 -3.328 -22.144 -8.934 1.00 -0.55 O HETATM 2294 H43 ASN A 1 -2.163 -25.586 -8.639 1.00 0.07 H HETATM 2295 C ASN A 1 -2.377 -27.196 -6.419 1.00 0.21 C HETATM 2296 O ASN A 1 -1.859 -28.216 -6.872 1.00 -0.39 O HETATM 2297 N ASN A 1 -3.553 -27.195 -5.798 1.00 -0.26 N HETATM 2298 CA ASN A 1 -4.318 -28.422 -5.610 1.00 0.13 C HETATM 2299 C ASN A 1 -5.810 -28.169 -5.806 1.00 0.20 C HETATM 2300 O ASN A 1 -6.241 -27.026 -5.962 1.00 -0.39 O HETATM 2301 N ASN A 1 -6.594 -29.242 -5.796 1.00 -0.26 N HETATM 2302 CA ASN A 1 -8.038 -29.136 -5.973 1.00 0.13 C HETATM 2303 C ASN A 1 -8.733 -28.889 -4.637 1.00 0.20 C HETATM 2304 O ASN A 1 -8.161 -29.132 -3.574 1.00 -0.39 O HETATM 2305 N ASN A 1 -9.968 -28.404 -4.700 1.00 -0.26 N HETATM 2306 CA ASN A 1 -10.744 -28.124 -3.497 1.00 0.15 C HETATM 2307 C ASN A 1 -12.076 -28.865 -3.524 1.00 0.21 C HETATM 2308 O ASN A 1 -12.460 -29.437 -4.544 1.00 -0.39 O HETATM 2309 N ASN A 1 -12.780 -28.851 -2.396 1.00 -0.27 N HETATM 2310 CA ASN A 1 -14.070 -29.522 -2.291 1.00 0.12 C HETATM 2311 C ASN A 1 -15.185 -28.646 -2.854 1.00 0.06 C HETATM 2312 O ASN A 1 -15.161 -27.423 -2.603 1.00 -0.57 O HETATM 2313 OXT ASN A 1 -16.073 -29.191 -3.542 1.00 -0.57 O HETATM 2314 CB ASN A 1 -14.369 -29.874 -0.833 1.00 0.09 C HETATM 2315 OG1 ASN A 1 -13.221 -30.408 -0.200 1.00 -0.39 O HETATM 2316 H71 ASN A 1 -13.428 -30.619 0.703 1.00 0.21 H HETATM 2317 CG2 ASN A 1 -15.489 -30.879 -0.678 1.00 -0.04 C HETATM 2318 H72 ASN A 1 -15.651 -31.086 0.390 1.00 0.03 H HETATM 2319 H73 ASN A 1 -15.219 -31.811 -1.195 1.00 0.03 H HETATM 2320 H74 ASN A 1 -16.412 -30.470 -1.116 1.00 0.03 H HETATM 2321 H70 ASN A 1 -14.661 -28.947 -0.317 1.00 0.06 H HETATM 2322 H69 ASN A 1 -14.027 -30.453 -2.876 1.00 0.08 H HETATM 2323 H68 ASN A 1 -12.415 -28.368 -1.600 1.00 0.19 H HETATM 2324 CB ASN A 1 -10.986 -26.620 -3.359 1.00 0.08 C HETATM 2325 OG ASN A 1 -9.854 -25.968 -2.810 1.00 -0.39 O HETATM 2326 H67 ASN A 1 -10.031 -25.038 -2.735 1.00 0.21 H HETATM 2327 H65 ASN A 1 -11.851 -26.454 -2.699 1.00 0.06 H HETATM 2328 H66 ASN A 1 -11.197 -26.198 -4.353 1.00 0.06 H HETATM 2329 H64 ASN A 1 -10.170 -28.469 -2.624 1.00 0.08 H HETATM 2330 H63 ASN A 1 -10.376 -28.226 -5.595 1.00 0.19 H HETATM 2331 CB ASN A 1 -8.587 -30.409 -6.622 1.00 0.00 C HETATM 2332 CG ASN A 1 -8.910 -30.248 -8.099 1.00 0.04 C HETATM 2333 CD ASN A 1 -8.663 -31.516 -8.891 1.00 0.17 C HETATM 2334 OE1 ASN A 1 -9.539 -32.374 -9.002 1.00 -0.40 O HETATM 2335 NE2 ASN A 1 -7.463 -31.642 -9.448 1.00 -0.30 N HETATM 2336 H61 ASN A 1 -7.243 -32.458 -9.982 1.00 0.18 H HETATM 2337 H62 ASN A 1 -6.780 -30.921 -9.333 1.00 0.18 H HETATM 2338 H59 ASN A 1 -8.280 -29.446 -8.512 1.00 0.05 H HETATM 2339 H60 ASN A 1 -9.970 -29.971 -8.200 1.00 0.05 H HETATM 2340 H57 ASN A 1 -9.507 -30.699 -6.094 1.00 0.03 H HETATM 2341 H58 ASN A 1 -7.836 -31.206 -6.515 1.00 0.03 H HETATM 2342 H56 ASN A 1 -8.246 -28.285 -6.638 1.00 0.08 H HETATM 2343 H55 ASN A 1 -6.184 -30.144 -5.664 1.00 0.19 H HETATM 2344 CB ASN A 1 -4.059 -29.000 -4.216 1.00 0.00 C HETATM 2345 CG ASN A 1 -3.493 -30.409 -4.237 1.00 0.04 C HETATM 2346 CD ASN A 1 -3.460 -31.045 -2.861 1.00 0.17 C HETATM 2347 OE1 ASN A 1 -4.394 -31.741 -2.463 1.00 -0.40 O HETATM 2348 NE2 ASN A 1 -2.380 -30.808 -2.125 1.00 -0.30 N HETATM 2349 H53 ASN A 1 -2.303 -31.201 -1.209 1.00 0.18 H HETATM 2350 H54 ASN A 1 -1.644 -30.236 -2.487 1.00 0.18 H HETATM 2351 H51 ASN A 1 -2.467 -30.371 -4.632 1.00 0.05 H HETATM 2352 H52 ASN A 1 -4.117 -31.029 -4.897 1.00 0.05 H HETATM 2353 H49 ASN A 1 -5.010 -29.016 -3.664 1.00 0.03 H HETATM 2354 H50 ASN A 1 -3.344 -28.346 -3.696 1.00 0.03 H HETATM 2355 H48 ASN A 1 -3.988 -29.156 -6.360 1.00 0.08 H HETATM 2356 H47 ASN A 1 -3.921 -26.332 -5.452 1.00 0.19 H HETATM 2357 H42 ASN A 1 -1.824 -25.284 -5.612 1.00 0.08 H HETATM 2358 H41 ASN A 1 0.135 -25.805 -7.665 1.00 0.19 H HETATM 2359 CB ASN A 1 2.190 -27.376 -7.451 1.00 -0.01 C HETATM 2360 CG ASN A 1 3.421 -28.188 -7.245 1.00 -0.03 C HETATM 2361 CD ASN A 1 3.474 -28.492 -5.775 1.00 0.04 C HETATM 2362 H39 ASN A 1 2.950 -29.432 -5.548 1.00 0.05 H HETATM 2363 H40 ASN A 1 4.514 -28.558 -5.423 1.00 0.05 H HETATM 2364 H37 ASN A 1 4.311 -27.618 -7.550 1.00 0.03 H HETATM 2365 H38 ASN A 1 3.366 -29.120 -7.827 1.00 0.03 H HETATM 2366 H35 ASN A 1 2.308 -26.707 -8.316 1.00 0.03 H HETATM 2367 H36 ASN A 1 1.318 -28.028 -7.608 1.00 0.03 H HETATM 2368 H34 ASN A 1 2.467 -25.561 -6.275 1.00 0.08 H HETATM 2369 CB ASN A 1 2.687 -28.762 -2.082 1.00 0.00 C HETATM 2370 CG ASN A 1 3.365 -29.422 -0.892 1.00 0.04 C HETATM 2371 CD ASN A 1 2.845 -30.822 -0.628 1.00 0.17 C HETATM 2372 OE1 ASN A 1 2.531 -31.566 -1.556 1.00 -0.40 O HETATM 2373 NE2 ASN A 1 2.749 -31.186 0.646 1.00 -0.30 N HETATM 2374 H32 ASN A 1 2.412 -32.098 0.881 1.00 0.18 H HETATM 2375 H33 ASN A 1 3.013 -30.548 1.369 1.00 0.18 H HETATM 2376 H30 ASN A 1 3.187 -28.806 0.002 1.00 0.05 H HETATM 2377 H31 ASN A 1 4.446 -29.479 -1.089 1.00 0.05 H HETATM 2378 H28 ASN A 1 2.274 -29.551 -2.728 1.00 0.03 H HETATM 2379 H29 ASN A 1 1.869 -28.129 -1.708 1.00 0.03 H HETATM 2380 H27 ASN A 1 4.270 -28.550 -3.525 1.00 0.08 H HETATM 2381 H26 ASN A 1 4.299 -27.075 -1.068 1.00 0.19 H HETATM 2382 H21 ASN A 1 6.305 -26.119 -0.570 1.00 0.08 H HETATM 2383 H20 ASN A 1 7.852 -24.816 -2.765 1.00 0.19 H HETATM 2384 CB ASN A 1 10.730 -27.059 -2.276 1.00 -0.00 C HETATM 2385 CG1 ASN A 1 12.195 -26.847 -2.662 1.00 -0.05 C HETATM 2386 CD1 ASN A 1 12.381 -25.917 -3.841 1.00 -0.06 C HETATM 2387 H17 ASN A 1 13.454 -25.813 -4.060 1.00 0.02 H HETATM 2388 H18 ASN A 1 11.958 -24.930 -3.600 1.00 0.02 H HETATM 2389 H19 ASN A 1 11.866 -26.332 -4.720 1.00 0.02 H HETATM 2390 H12 ASN A 1 12.633 -27.823 -2.917 1.00 0.03 H HETATM 2391 H13 ASN A 1 12.725 -26.422 -1.797 1.00 0.03 H HETATM 2392 CG2 ASN A 1 9.971 -27.736 -3.407 1.00 -0.06 C HETATM 2393 H14 ASN A 1 8.921 -27.879 -3.110 1.00 0.02 H HETATM 2394 H15 ASN A 1 10.428 -28.713 -3.622 1.00 0.02 H HETATM 2395 H16 ASN A 1 10.015 -27.105 -4.307 1.00 0.02 H HETATM 2396 H11 ASN A 1 10.694 -27.712 -1.392 1.00 0.03 H HETATM 2397 H10 ASN A 1 9.962 -25.122 -2.839 1.00 0.08 H HETATM 2398 H9 ASN A 1 11.265 -25.409 -0.179 1.00 0.19 H HETATM 2399 CB ASN A 1 11.452 -21.605 0.221 1.00 0.10 C HETATM 2400 CG ASN A 1 12.193 -20.943 1.367 1.00 0.18 C HETATM 2401 OD1 ASN A 1 12.637 -19.800 1.256 1.00 -0.40 O HETATM 2402 ND2 ASN A 1 12.333 -21.661 2.475 1.00 -0.30 N HETATM 2403 H7 ASN A 1 12.813 -21.276 3.263 1.00 0.18 H HETATM 2404 H8 ASN A 1 11.959 -22.587 2.521 1.00 0.18 H HETATM 2405 H5 ASN A 1 10.394 -21.717 0.502 1.00 0.06 H HETATM 2406 H6 ASN A 1 11.529 -20.962 -0.668 1.00 0.06 H HETATM 2407 H4 ASN A 1 12.022 -23.607 0.785 1.00 0.11 H HETATM 2408 H1 ASN A 1 13.964 -22.370 0.112 1.00 0.20 H HETATM 2409 H2 ASN A 1 13.416 -22.252 -1.436 1.00 0.20 H HETATM 2410 H3 ASN A 1 13.806 -23.724 -0.811 1.00 0.20 H CONECT 1 2 22 23 24 CONECT 22 1 CONECT 23 1 CONECT 24 1 CONECT 2251 2252 2408 2409 2410 CONECT 2252 2251 2253 2399 2407 CONECT 2253 2252 2254 2255 CONECT 2254 2253 CONECT 2255 2253 2256 2398 CONECT 2256 2255 2257 2384 2397 CONECT 2257 2256 2258 2259 CONECT 2258 2257 CONECT 2259 2257 2260 2383 CONECT 2260 2259 2261 2272 2382 CONECT 2261 2260 2262 2266 2271 CONECT 2262 2261 2263 2264 2265 CONECT 2263 2262 CONECT 2264 2262 CONECT 2265 2262 CONECT 2266 2261 2267 CONECT 2267 2266 2268 2269 2270 CONECT 2268 2267 CONECT 2269 2267 CONECT 2270 2267 CONECT 2271 2261 CONECT 2272 2260 2273 2274 CONECT 2273 2272 CONECT 2274 2272 2275 2381 CONECT 2275 2274 2276 2369 2380 CONECT 2276 2275 2277 2278 CONECT 2277 2276 CONECT 2278 2276 2279 2361 CONECT 2279 2278 2280 2359 2368 CONECT 2280 2279 2281 2282 CONECT 2281 2280 CONECT 2282 2280 2283 2358 CONECT 2283 2282 2284 2295 2357 CONECT 2284 2283 2285 2289 2294 CONECT 2285 2284 2286 2287 2288 CONECT 2286 2285 CONECT 2287 2285 CONECT 2288 2285 CONECT 2289 2284 2290 CONECT 2290 2289 2291 2292 2293 CONECT 2291 2290 CONECT 2292 2290 CONECT 2293 2290 CONECT 2294 2284 CONECT 2295 2283 2296 2297 CONECT 2296 2295 CONECT 2297 2295 2298 2356 CONECT 2298 2297 2299 2344 2355 CONECT 2299 2298 2300 2301 CONECT 2300 2299 CONECT 2301 2299 2302 2343 CONECT 2302 2301 2303 2331 2342 CONECT 2303 2302 2304 2305 CONECT 2304 2303 CONECT 2305 2303 2306 2330 CONECT 2306 2305 2307 2324 2329 CONECT 2307 2306 2308 2309 CONECT 2308 2307 CONECT 2309 2307 2310 2323 CONECT 2310 2309 2311 2314 2322 CONECT 2311 2310 2312 2313 CONECT 2312 2311 CONECT 2313 2311 CONECT 2314 2310 2315 2317 2321 CONECT 2315 2314 2316 CONECT 2316 2315 CONECT 2317 2314 2318 2319 2320 CONECT 2318 2317 CONECT 2319 2317 CONECT 2320 2317 CONECT 2321 2314 CONECT 2322 2310 CONECT 2323 2309 CONECT 2324 2306 2325 2327 2328 CONECT 2325 2324 2326 CONECT 2326 2325 CONECT 2327 2324 CONECT 2328 2324 CONECT 2329 2306 CONECT 2330 2305 CONECT 2331 2302 2332 2340 2341 CONECT 2332 2331 2333 2338 2339 CONECT 2333 2332 2334 2335 CONECT 2334 2333 CONECT 2335 2333 2336 2337 CONECT 2336 2335 CONECT 2337 2335 CONECT 2338 2332 CONECT 2339 2332 CONECT 2340 2331 CONECT 2341 2331 CONECT 2342 2302 CONECT 2343 2301 CONECT 2344 2298 2345 2353 2354 CONECT 2345 2344 2346 2351 2352 CONECT 2346 2345 2347 2348 CONECT 2347 2346 CONECT 2348 2346 2349 2350 CONECT 2349 2348 CONECT 2350 2348 CONECT 2351 2345 CONECT 2352 2345 CONECT 2353 2344 CONECT 2354 2344 CONECT 2355 2298 CONECT 2356 2297 CONECT 2357 2283 CONECT 2358 2282 CONECT 2359 2279 2360 2366 2367 CONECT 2360 2359 2361 2364 2365 CONECT 2361 2278 2360 2362 2363 CONECT 2362 2361 CONECT 2363 2361 CONECT 2364 2360 CONECT 2365 2360 CONECT 2366 2359 CONECT 2367 2359 CONECT 2368 2279 CONECT 2369 2275 2370 2378 2379 CONECT 2370 2369 2371 2376 2377 CONECT 2371 2370 2372 2373 CONECT 2372 2371 CONECT 2373 2371 2374 2375 CONECT 2374 2373 CONECT 2375 2373 CONECT 2376 2370 CONECT 2377 2370 CONECT 2378 2369 CONECT 2379 2369 CONECT 2380 2275 CONECT 2381 2274 CONECT 2382 2260 CONECT 2383 2259 CONECT 2384 2256 2385 2392 2396 CONECT 2385 2384 2386 2390 2391 CONECT 2386 2385 2387 2388 2389 CONECT 2387 2386 CONECT 2388 2386 CONECT 2389 2386 CONECT 2390 2385 CONECT 2391 2385 CONECT 2392 2384 2393 2394 2395 CONECT 2393 2392 CONECT 2394 2392 CONECT 2395 2392 CONECT 2396 2384 CONECT 2397 2256 CONECT 2398 2255 CONECT 2399 2252 2400 2405 2406 CONECT 2400 2399 2401 2402 CONECT 2401 2400 CONECT 2402 2400 2403 2404 CONECT 2403 2402 CONECT 2404 2402 CONECT 2405 2399 CONECT 2406 2399 CONECT 2407 2252 CONECT 2408 2251 CONECT 2409 2251 CONECT 2410 2251 MASTER 0 0 0 0 0 0 0 0 2409 1 164 11 END
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10-mer
4lnp
RCSB PDB
PDBbind
10-mer
4mdr
RCSB PDB
PDBbind
10-mer
4n84
RCSB PDB
PDBbind
10-mer
4nmo
RCSB PDB
PDBbind
10-mer
4nmp
RCSB PDB
PDBbind
10-mer
4nmq
RCSB PDB
PDBbind
10-mer
4nmr
RCSB PDB
PDBbind
10-mer
4nms
RCSB PDB
PDBbind
10-mer
4nmt
RCSB PDB
PDBbind
10-mer
4nmv
RCSB PDB
PDBbind
10-mer
4o2c
RCSB PDB
PDBbind
10-mer
4oz1
RCSB PDB
PDBbind
10-mer
4p0a
RCSB PDB
PDBbind
10-mer
4p0b
RCSB PDB
PDBbind
10-mer
4qok
RCSB PDB
PDBbind
10-mer
4rqz
RCSB PDB
PDBbind
10-mer
4u90
RCSB PDB
PDBbind
10-mer
4v11
RCSB PDB
PDBbind
10-mer
4wj5
RCSB PDB
PDBbind
10-mer
4x1n
RCSB PDB
PDBbind
10-mer
4x1p
RCSB PDB
PDBbind
10-mer
4x1q
RCSB PDB
PDBbind
10-mer
4x1r
RCSB PDB
PDBbind
10-mer
4x1s
RCSB PDB
PDBbind
10-mer
4x34
RCSB PDB
PDBbind
10-mer
4x3s
RCSB PDB
PDBbind
10-mer
4x8n
RCSB PDB
PDBbind
10-mer
4xhv
RCSB PDB
PDBbind
10-mer
4z0u
RCSB PDB
PDBbind
10-mer
4z7i
RCSB PDB
PDBbind
10-mer
4zhl
RCSB PDB
PDBbind
10-mer
4zhm
RCSB PDB
PDBbind
10-mer
5ab0
RCSB PDB
PDBbind
10-mer
5aei
RCSB PDB
PDBbind
10-mer
5azg
RCSB PDB
PDBbind
10-mer
5c0m
RCSB PDB
PDBbind
10-mer
5c11
RCSB PDB
PDBbind
10-mer
5c13
RCSB PDB
PDBbind
10-mer
5d6y
RCSB PDB
PDBbind
10-mer
5gp7
RCSB PDB
PDBbind
10-mer
5gs4
RCSB PDB
PDBbind
10-mer
5gtr
RCSB PDB
PDBbind
10-mer
5iaw
RCSB PDB
PDBbind
10-mer
5j31
RCSB PDB
PDBbind
10-mer
5jzi
RCSB PDB
PDBbind
10-mer
5myo
RCSB PDB
PDBbind
10-mer
5n1y
RCSB PDB
PDBbind
10-mer
5nx2
RCSB PDB
PDBbind
10-mer
5t6z
RCSB PDB
PDBbind
10-mer
5t70
RCSB PDB
PDBbind
10-mer
5t8r
RCSB PDB
PDBbind
10-mer
5vnb
RCSB PDB
PDBbind
10-mer
5w7i
RCSB PDB
PDBbind
10-mer
5w7j
RCSB PDB
PDBbind
10-mer
5wkf
RCSB PDB
PDBbind
10-mer
5wkh
RCSB PDB
PDBbind
10-mer
6ar2
RCSB PDB
PDBbind
10-mer
6buu
RCSB PDB
PDBbind
10-mer
6fkp
RCSB PDB
PDBbind
10-mer
6mim
RCSB PDB
PDBbind
10-mer
6qtx
RCSB PDB
PDBbind
10-mer
6pek
RCSB PDB
PDBbind
10-mer
6iiw
RCSB PDB
PDBbind
10-mer
6hzx
RCSB PDB
PDBbind
10-mer
6hoi
RCSB PDB
PDBbind
10-mer
6dkp
RCSB PDB
PDBbind
10-mer
6a8n
RCSB PDB
PDBbind
10-mer
5zys
RCSB PDB
PDBbind
10-mer
Entry Information
PDB ID
2jql
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
the yeast Dun1 FHA domain
Ligand Name
10-mer
EC.Number
E.C.2.7.11.1
Resolution
NMR
Affinity (Kd/Ki/IC50)
Kd=0.3uM
Release Year
2008
Protein/NA Sequence
Check fasta file
Primary Reference
(2008) Mol.Cell Vol. 30: pp. 767-778
Ligand Properties
Formula
C
4
5
H
8
1
N
1
4
O
2
5
P
2
Molecular Weight
1280.150
Exact Mass
1279.500
No. of atoms
167
No. of bonds
167
Polar Surface Area
697.89
LOGP Value
-13.19 (
Computed with XLOGP3
)
-5.37 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 15
No. of Hydrogen Bond Acceptors: 23
No. of Rotatable Bonds: 47
No. of Nitrogen and Oxygen Atoms: 39
No. of Rings: 1
Canonical SMILES
CC[C@@H]([C@@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CO)CCC(=O)N)CCC(=O)N)CCC(=O)N)NC(=O)[C@H](CC(=O)N)[NH3+])C
InChI String
InChI=1S/C45H82N14O25P2/c1-6-18(2)32(55-36(66)22(46)16-31(50)65)41(71)58-35(21(5)84-86(80,81)82)43(73)53-25(11-14-30(49)64)44(74)59-15-7-8-27(59)40(70)57-34(20(4)83-85(77,78)79)42(72)52-24(10-13-29(48)63)37(67)51-23(9-12-28(47)62)38(68)54-26(17-60)39(69)56-33(19(3)61)45(75)76/h18-27,32-35,60-61,77-82,85-86H,6-17,46H2,1-5H3,(H2,47,62)(H2,48,63)(H2,49,64)(H2,50,65)(H,51,67)(H,52,72)(H,53,73)(H,54,68)(H,55,66)(H,56,69)(H,57,70)(H,58,71)(H,75,76)/p+1/t18-,19+,20+,21+,22-,23-,24-,25-,26-,27-,32-,33-,34-,35-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P39009
P22216
Entrez Gene ID
NCBI Entrez Gene ID:
851457
855950
ASD
Information of known allosteric effects of PDB entries
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