Browse entries in the PDBbind-CN Database
HEADER 2M41_COMPLEX COMPND 2M41_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 B 123 ALA PRO PRO THR LEU PRO PRO TYR PHE MET LYS GLY SER SEQRES 2 B 123 ILE ILE GLN LEU ALA ASN GLY GLU LEU LYS LYS VAL GLU SEQRES 3 B 123 ASP LEU LYS THR GLU ASP PHE ILE GLN SER ALA GLU ILE SEQRES 4 B 123 SER ASN ASP LEU LYS ILE ASP SER SER THR VAL GLU ARG SEQRES 5 B 123 ILE GLU ASP SER HIS SER PRO GLY VAL ALA VAL ILE GLN SEQRES 6 B 123 PHE ALA VAL GLY GLU HIS ARG ALA GLN VAL SER VAL GLU SEQRES 7 B 123 VAL LEU VAL GLU TYR PRO PHE PHE VAL PHE GLY GLN GLY SEQRES 8 B 123 TRP SER SER CYS CYS PRO GLU ARG THR SER GLN LEU PHE SEQRES 9 B 123 ASP LEU PRO CYS SER LYS LEU SER VAL GLY ASP VAL CYS SEQRES 10 B 123 ILE SER LEU THR LEU LYS HET VAL A 124 245 ATOM 1 N ALA B 567 -21.481 16.461 -8.914 1.00 0.00 N ATOM 2 CA ALA B 567 -21.158 15.750 -7.660 1.00 0.00 C ATOM 3 C ALA B 567 -21.862 14.400 -7.619 1.00 0.00 C ATOM 4 O ALA B 567 -23.046 14.302 -7.934 1.00 0.00 O ATOM 5 CB ALA B 567 -21.558 16.591 -6.458 1.00 0.00 C ATOM 6 HA ALA B 567 -20.082 15.581 -7.624 1.00 0.00 H ATOM 7 HB1 ALA B 567 -21.016 17.537 -6.481 1.00 0.00 H ATOM 8 HB2 ALA B 567 -22.630 16.784 -6.492 1.00 0.00 H ATOM 9 HB3 ALA B 567 -21.313 16.053 -5.542 1.00 0.00 H ATOM 10 HN3 ALA B 567 -22.508 16.612 -8.971 1.00 0.00 H ATOM 11 HN2 ALA B 567 -21.168 15.890 -9.725 1.00 0.00 H ATOM 12 HN1 ALA B 567 -20.993 17.379 -8.926 1.00 0.00 H ATOM 13 N PRO B 568 -21.139 13.337 -7.251 1.00 0.00 N ATOM 14 CA PRO B 568 -21.709 12.002 -7.121 1.00 0.00 C ATOM 15 C PRO B 568 -22.306 11.766 -5.734 1.00 0.00 C ATOM 16 O PRO B 568 -22.087 12.571 -4.828 1.00 0.00 O ATOM 17 CB PRO B 568 -20.498 11.100 -7.360 1.00 0.00 C ATOM 18 CG PRO B 568 -19.319 11.887 -6.882 1.00 0.00 C ATOM 19 CD PRO B 568 -19.698 13.347 -6.940 1.00 0.00 C ATOM 20 HA PRO B 568 -22.534 11.823 -7.810 1.00 0.00 H ATOM 21 HD3 PRO B 568 -19.513 13.833 -5.982 1.00 0.00 H ATOM 22 HD2 PRO B 568 -19.138 13.861 -7.721 1.00 0.00 H ATOM 23 HG3 PRO B 568 -18.459 11.699 -7.525 1.00 0.00 H ATOM 24 HG2 PRO B 568 -19.073 11.606 -5.858 1.00 0.00 H ATOM 25 HB2 PRO B 568 -20.594 10.174 -6.794 1.00 0.00 H ATOM 26 HB3 PRO B 568 -20.398 10.868 -8.420 1.00 0.00 H ATOM 27 N PRO B 569 -23.089 10.686 -5.548 1.00 0.00 N ATOM 28 CA PRO B 569 -23.679 10.351 -4.246 1.00 0.00 C ATOM 29 C PRO B 569 -22.619 10.322 -3.149 1.00 0.00 C ATOM 30 O PRO B 569 -22.720 11.031 -2.141 1.00 0.00 O ATOM 31 CB PRO B 569 -24.284 8.954 -4.456 1.00 0.00 C ATOM 32 CG PRO B 569 -23.786 8.485 -5.786 1.00 0.00 C ATOM 33 CD PRO B 569 -23.468 9.718 -6.582 1.00 0.00 C ATOM 34 HA PRO B 569 -24.417 11.086 -3.926 1.00 0.00 H ATOM 35 HD3 PRO B 569 -22.644 9.538 -7.272 1.00 0.00 H ATOM 36 HD2 PRO B 569 -24.339 10.061 -7.140 1.00 0.00 H ATOM 37 HG3 PRO B 569 -24.554 7.899 -6.290 1.00 0.00 H ATOM 38 HG2 PRO B 569 -22.890 7.877 -5.660 1.00 0.00 H ATOM 39 HB2 PRO B 569 -23.956 8.276 -3.668 1.00 0.00 H ATOM 40 HB3 PRO B 569 -25.373 9.009 -4.457 1.00 0.00 H ATOM 41 N THR B 570 -21.601 9.508 -3.363 1.00 0.00 N ATOM 42 CA THR B 570 -20.433 9.497 -2.510 1.00 0.00 C ATOM 43 C THR B 570 -19.189 9.667 -3.367 1.00 0.00 C ATOM 44 O THR B 570 -19.296 9.833 -4.580 1.00 0.00 O ATOM 45 CB THR B 570 -20.331 8.193 -1.690 1.00 0.00 C ATOM 46 OG1 THR B 570 -20.509 7.052 -2.543 1.00 0.00 O ATOM 47 CG2 THR B 570 -21.369 8.168 -0.577 1.00 0.00 C ATOM 48 HA THR B 570 -20.520 10.322 -1.802 1.00 0.00 H ATOM 49 HB THR B 570 -19.338 8.155 -1.241 1.00 0.00 H ATOM 50 HG1 THR B 570 -20.441 6.225 -2.004 1.00 0.00 H ATOM 51 HG23 THR B 570 -21.230 9.036 0.068 1.00 0.00 H ATOM 52 HG21 THR B 570 -22.368 8.194 -1.013 1.00 0.00 H ATOM 53 HG22 THR B 570 -21.250 7.256 0.008 1.00 0.00 H ATOM 54 H THR B 570 -21.641 8.854 -4.171 1.00 0.00 H ATOM 55 N LEU B 571 -18.021 9.625 -2.752 1.00 0.00 N ATOM 56 CA LEU B 571 -16.769 9.706 -3.474 1.00 0.00 C ATOM 57 C LEU B 571 -16.591 8.502 -4.417 1.00 0.00 C ATOM 58 O LEU B 571 -17.403 7.570 -4.389 1.00 0.00 O ATOM 59 CB LEU B 571 -15.630 9.812 -2.457 1.00 0.00 C ATOM 60 CG LEU B 571 -15.863 9.063 -1.147 1.00 0.00 C ATOM 61 CD1 LEU B 571 -16.090 7.593 -1.425 1.00 0.00 C ATOM 62 CD2 LEU B 571 -14.691 9.262 -0.204 1.00 0.00 C ATOM 63 HA LEU B 571 -16.763 10.592 -4.109 1.00 0.00 H ATOM 64 HB2 LEU B 571 -14.726 9.414 -2.918 1.00 0.00 H ATOM 65 HB3 LEU B 571 -15.483 10.866 -2.223 1.00 0.00 H ATOM 66 HG LEU B 571 -16.754 9.465 -0.664 1.00 0.00 H ATOM 67 HD21 LEU B 571 -13.782 8.884 -0.671 1.00 0.00 H ATOM 68 HD22 LEU B 571 -14.576 10.324 0.011 1.00 0.00 H ATOM 69 HD23 LEU B 571 -14.877 8.720 0.724 1.00 0.00 H ATOM 70 HD11 LEU B 571 -16.964 7.476 -2.066 1.00 0.00 H ATOM 71 HD12 LEU B 571 -15.214 7.179 -1.924 1.00 0.00 H ATOM 72 HD13 LEU B 571 -16.255 7.068 -0.484 1.00 0.00 H ATOM 73 H LEU B 571 -18.000 9.531 -1.716 1.00 0.00 H ATOM 74 N PRO B 572 -15.563 8.515 -5.291 1.00 0.00 N ATOM 75 CA PRO B 572 -15.267 7.379 -6.170 1.00 0.00 C ATOM 76 C PRO B 572 -15.198 6.048 -5.407 1.00 0.00 C ATOM 77 O PRO B 572 -14.740 5.993 -4.269 1.00 0.00 O ATOM 78 CB PRO B 572 -13.908 7.732 -6.770 1.00 0.00 C ATOM 79 CG PRO B 572 -13.828 9.215 -6.711 1.00 0.00 C ATOM 80 CD PRO B 572 -14.643 9.644 -5.522 1.00 0.00 C ATOM 81 HA PRO B 572 -16.046 7.231 -6.918 1.00 0.00 H ATOM 82 HD3 PRO B 572 -14.005 9.808 -4.654 1.00 0.00 H ATOM 83 HD2 PRO B 572 -15.197 10.557 -5.741 1.00 0.00 H ATOM 84 HG3 PRO B 572 -14.236 9.650 -7.623 1.00 0.00 H ATOM 85 HG2 PRO B 572 -12.792 9.531 -6.591 1.00 0.00 H ATOM 86 HB2 PRO B 572 -13.104 7.282 -6.187 1.00 0.00 H ATOM 87 HB3 PRO B 572 -13.844 7.386 -7.802 1.00 0.00 H ATOM 88 N PRO B 573 -15.667 4.961 -6.030 1.00 0.00 N ATOM 89 CA PRO B 573 -15.768 3.647 -5.384 1.00 0.00 C ATOM 90 C PRO B 573 -14.441 2.890 -5.307 1.00 0.00 C ATOM 91 O PRO B 573 -14.347 1.855 -4.654 1.00 0.00 O ATOM 92 CB PRO B 573 -16.744 2.910 -6.287 1.00 0.00 C ATOM 93 CG PRO B 573 -16.494 3.484 -7.634 1.00 0.00 C ATOM 94 CD PRO B 573 -16.161 4.930 -7.415 1.00 0.00 C ATOM 95 HA PRO B 573 -16.079 3.736 -4.343 1.00 0.00 H ATOM 96 HD3 PRO B 573 -15.391 5.263 -8.111 1.00 0.00 H ATOM 97 HD2 PRO B 573 -17.046 5.556 -7.528 1.00 0.00 H ATOM 98 HG3 PRO B 573 -17.384 3.391 -8.256 1.00 0.00 H ATOM 99 HG2 PRO B 573 -15.660 2.972 -8.115 1.00 0.00 H ATOM 100 HB2 PRO B 573 -16.545 1.838 -6.280 1.00 0.00 H ATOM 101 HB3 PRO B 573 -17.773 3.090 -5.974 1.00 0.00 H ATOM 102 N TYR B 574 -13.426 3.387 -5.989 1.00 0.00 N ATOM 103 CA TYR B 574 -12.112 2.741 -5.977 1.00 0.00 C ATOM 104 C TYR B 574 -11.229 3.316 -4.874 1.00 0.00 C ATOM 105 O TYR B 574 -10.753 4.441 -4.982 1.00 0.00 O ATOM 106 CB TYR B 574 -11.445 2.918 -7.335 1.00 0.00 C ATOM 107 CG TYR B 574 -10.133 2.190 -7.543 1.00 0.00 C ATOM 108 CD1 TYR B 574 -10.113 0.860 -7.943 1.00 0.00 C ATOM 109 CD2 TYR B 574 -8.918 2.842 -7.375 1.00 0.00 C ATOM 110 CE1 TYR B 574 -8.920 0.198 -8.160 1.00 0.00 C ATOM 111 CE2 TYR B 574 -7.721 2.188 -7.596 1.00 0.00 C ATOM 112 CZ TYR B 574 -7.728 0.866 -7.986 1.00 0.00 C ATOM 113 OH TYR B 574 -6.537 0.211 -8.212 1.00 0.00 O ATOM 114 HA TYR B 574 -12.248 1.678 -5.776 1.00 0.00 H ATOM 115 HB3 TYR B 574 -11.260 3.983 -7.477 1.00 0.00 H ATOM 116 HB2 TYR B 574 -12.143 2.567 -8.095 1.00 0.00 H ATOM 117 HD2 TYR B 574 -8.909 3.887 -7.064 1.00 0.00 H ATOM 118 HE2 TYR B 574 -6.776 2.715 -7.463 1.00 0.00 H ATOM 119 HE1 TYR B 574 -8.922 -0.848 -8.467 1.00 0.00 H ATOM 120 HD1 TYR B 574 -11.054 0.330 -8.088 1.00 0.00 H ATOM 121 HH TYR B 574 -6.722 -0.723 -8.483 1.00 0.00 H ATOM 122 H TYR B 574 -13.562 4.255 -6.546 1.00 0.00 H ATOM 123 N PHE B 575 -11.083 2.543 -3.797 1.00 0.00 N ATOM 124 CA PHE B 575 -10.133 2.802 -2.699 1.00 0.00 C ATOM 125 C PHE B 575 -10.456 4.046 -1.864 1.00 0.00 C ATOM 126 O PHE B 575 -9.964 4.176 -0.746 1.00 0.00 O ATOM 127 CB PHE B 575 -8.674 2.812 -3.211 1.00 0.00 C ATOM 128 CG PHE B 575 -7.984 4.146 -3.280 1.00 0.00 C ATOM 129 CD1 PHE B 575 -7.291 4.636 -2.185 1.00 0.00 C ATOM 130 CD2 PHE B 575 -7.997 4.891 -4.444 1.00 0.00 C ATOM 131 CE1 PHE B 575 -6.635 5.845 -2.250 1.00 0.00 C ATOM 132 CE2 PHE B 575 -7.340 6.099 -4.517 1.00 0.00 C ATOM 133 CZ PHE B 575 -6.661 6.576 -3.418 1.00 0.00 C ATOM 134 HA PHE B 575 -10.248 1.966 -2.009 1.00 0.00 H ATOM 135 HB2 PHE B 575 -8.089 2.173 -2.550 1.00 0.00 H ATOM 136 HB3 PHE B 575 -8.675 2.390 -4.216 1.00 0.00 H ATOM 137 HD2 PHE B 575 -8.534 4.517 -5.316 1.00 0.00 H ATOM 138 HE2 PHE B 575 -7.357 6.676 -5.442 1.00 0.00 H ATOM 139 HZ PHE B 575 -6.143 7.534 -3.472 1.00 0.00 H ATOM 140 HE1 PHE B 575 -6.097 6.223 -1.381 1.00 0.00 H ATOM 141 HD1 PHE B 575 -7.265 4.058 -1.261 1.00 0.00 H ATOM 142 H PHE B 575 -11.683 1.696 -3.726 1.00 0.00 H ATOM 143 N MET B 576 -11.275 4.943 -2.385 1.00 0.00 N ATOM 144 CA MET B 576 -11.714 6.104 -1.620 1.00 0.00 C ATOM 145 C MET B 576 -12.510 5.652 -0.393 1.00 0.00 C ATOM 146 O MET B 576 -13.062 4.546 -0.372 1.00 0.00 O ATOM 147 CB MET B 576 -12.573 7.019 -2.490 1.00 0.00 C ATOM 148 CG MET B 576 -11.974 7.315 -3.853 1.00 0.00 C ATOM 149 SD MET B 576 -10.385 8.152 -3.771 1.00 0.00 S ATOM 150 CE MET B 576 -9.956 8.201 -5.510 1.00 0.00 C ATOM 151 HA MET B 576 -10.835 6.658 -1.291 1.00 0.00 H ATOM 152 HB2 MET B 576 -13.542 6.542 -2.637 1.00 0.00 H ATOM 153 HB3 MET B 576 -12.711 7.963 -1.963 1.00 0.00 H ATOM 154 HG2 MET B 576 -12.669 7.947 -4.406 1.00 0.00 H ATOM 155 HG3 MET B 576 -11.841 6.372 -4.384 1.00 0.00 H ATOM 156 HE1 MET B 576 -9.899 7.184 -5.898 1.00 0.00 H ATOM 157 HE2 MET B 576 -10.719 8.757 -6.056 1.00 0.00 H ATOM 158 HE3 MET B 576 -8.991 8.692 -5.631 1.00 0.00 H ATOM 159 H MET B 576 -11.613 4.818 -3.361 1.00 0.00 H ATOM 160 N LYS B 577 -12.571 6.512 0.619 1.00 0.00 N ATOM 161 CA LYS B 577 -13.182 6.164 1.902 1.00 0.00 C ATOM 162 C LYS B 577 -14.620 5.679 1.755 1.00 0.00 C ATOM 163 O LYS B 577 -15.470 6.372 1.206 1.00 0.00 O ATOM 164 CB LYS B 577 -13.179 7.365 2.842 1.00 0.00 C ATOM 165 CG LYS B 577 -13.714 7.038 4.227 1.00 0.00 C ATOM 166 CD LYS B 577 -13.897 8.285 5.071 1.00 0.00 C ATOM 167 CE LYS B 577 -14.353 7.939 6.477 1.00 0.00 C ATOM 168 NZ LYS B 577 -14.524 9.150 7.318 1.00 0.00 N ATOM 169 HA LYS B 577 -12.581 5.352 2.312 1.00 0.00 H ATOM 170 HB2 LYS B 577 -12.155 7.726 2.941 1.00 0.00 H ATOM 171 HB3 LYS B 577 -13.799 8.149 2.406 1.00 0.00 H ATOM 172 HG2 LYS B 577 -14.677 6.537 4.124 1.00 0.00 H ATOM 173 HG3 LYS B 577 -13.011 6.373 4.729 1.00 0.00 H ATOM 174 HD2 LYS B 577 -12.948 8.819 5.127 1.00 0.00 H ATOM 175 HD3 LYS B 577 -14.645 8.924 4.602 1.00 0.00 H ATOM 176 HE2 LYS B 577 -13.609 7.291 6.940 1.00 0.00 H ATOM 177 HE3 LYS B 577 -15.306 7.413 6.419 1.00 0.00 H ATOM 178 HZ1 LYS B 577 -13.617 9.655 7.384 1.00 0.00 H ATOM 179 HZ2 LYS B 577 -15.238 9.772 6.887 1.00 0.00 H ATOM 180 HZ3 LYS B 577 -14.836 8.869 8.269 1.00 0.00 H ATOM 181 H LYS B 577 -12.171 7.464 0.494 1.00 0.00 H ATOM 182 N GLY B 578 -14.891 4.498 2.276 1.00 0.00 N ATOM 183 CA GLY B 578 -16.245 3.996 2.289 1.00 0.00 C ATOM 184 C GLY B 578 -16.464 2.887 1.293 1.00 0.00 C ATOM 185 O GLY B 578 -17.478 2.194 1.349 1.00 0.00 O ATOM 186 HA3 GLY B 578 -16.923 4.816 2.053 1.00 0.00 H ATOM 187 HA2 GLY B 578 -16.467 3.618 3.287 1.00 0.00 H ATOM 188 H GLY B 578 -14.124 3.924 2.680 1.00 0.00 H ATOM 189 N SER B 579 -15.524 2.719 0.372 1.00 0.00 N ATOM 190 CA SER B 579 -15.598 1.625 -0.580 1.00 0.00 C ATOM 191 C SER B 579 -15.618 0.294 0.151 1.00 0.00 C ATOM 192 O SER B 579 -14.909 0.103 1.145 1.00 0.00 O ATOM 193 CB SER B 579 -14.418 1.667 -1.550 1.00 0.00 C ATOM 194 OG SER B 579 -14.432 0.548 -2.419 1.00 0.00 O ATOM 195 HA SER B 579 -16.520 1.734 -1.151 1.00 0.00 H ATOM 196 HB2 SER B 579 -13.488 1.664 -0.981 1.00 0.00 H ATOM 197 HB3 SER B 579 -14.477 2.580 -2.143 1.00 0.00 H ATOM 198 HG SER B 579 -13.659 0.600 -3.035 1.00 0.00 H ATOM 199 H SER B 579 -14.722 3.380 0.331 1.00 0.00 H ATOM 200 N ILE B 580 -16.449 -0.612 -0.328 1.00 0.00 N ATOM 201 CA ILE B 580 -16.504 -1.945 0.227 1.00 0.00 C ATOM 202 C ILE B 580 -15.564 -2.842 -0.555 1.00 0.00 C ATOM 203 O ILE B 580 -15.859 -3.266 -1.678 1.00 0.00 O ATOM 204 CB ILE B 580 -17.935 -2.522 0.227 1.00 0.00 C ATOM 205 CG1 ILE B 580 -18.823 -1.735 1.200 1.00 0.00 C ATOM 206 CG2 ILE B 580 -17.920 -4.001 0.588 1.00 0.00 C ATOM 207 CD1 ILE B 580 -18.301 -1.713 2.624 1.00 0.00 C ATOM 208 HA ILE B 580 -16.192 -1.895 1.270 1.00 0.00 H ATOM 209 HB ILE B 580 -18.348 -2.425 -0.777 1.00 0.00 H ATOM 210 HG12 ILE B 580 -18.896 -0.707 0.844 1.00 0.00 H ATOM 211 HG13 ILE B 580 -19.814 -2.188 1.204 1.00 0.00 H ATOM 212 HD11 ILE B 580 -18.233 -2.734 3.000 1.00 0.00 H ATOM 213 HD12 ILE B 580 -17.314 -1.252 2.641 1.00 0.00 H ATOM 214 HD13 ILE B 580 -18.983 -1.138 3.251 1.00 0.00 H ATOM 215 HG21 ILE B 580 -17.320 -4.546 -0.141 1.00 0.00 H ATOM 216 HG22 ILE B 580 -17.489 -4.127 1.581 1.00 0.00 H ATOM 217 HG23 ILE B 580 -18.940 -4.386 0.582 1.00 0.00 H ATOM 218 H ILE B 580 -17.076 -0.362 -1.119 1.00 0.00 H ATOM 219 N ILE B 581 -14.421 -3.088 0.041 1.00 0.00 N ATOM 220 CA ILE B 581 -13.361 -3.827 -0.601 1.00 0.00 C ATOM 221 C ILE B 581 -13.526 -5.317 -0.317 1.00 0.00 C ATOM 222 O ILE B 581 -13.655 -5.723 0.842 1.00 0.00 O ATOM 223 CB ILE B 581 -11.991 -3.340 -0.089 1.00 0.00 C ATOM 224 CG1 ILE B 581 -11.901 -1.809 -0.133 1.00 0.00 C ATOM 225 CG2 ILE B 581 -10.874 -3.945 -0.905 1.00 0.00 C ATOM 226 CD1 ILE B 581 -11.919 -1.214 -1.525 1.00 0.00 C ATOM 227 HA ILE B 581 -13.412 -3.661 -1.677 1.00 0.00 H ATOM 228 HB ILE B 581 -11.887 -3.663 0.947 1.00 0.00 H ATOM 229 HG12 ILE B 581 -12.747 -1.403 0.421 1.00 0.00 H ATOM 230 HG13 ILE B 581 -10.972 -1.509 0.353 1.00 0.00 H ATOM 231 HD11 ILE B 581 -11.071 -1.597 -2.093 1.00 0.00 H ATOM 232 HD12 ILE B 581 -12.847 -1.490 -2.025 1.00 0.00 H ATOM 233 HD13 ILE B 581 -11.851 -0.128 -1.456 1.00 0.00 H ATOM 234 HG21 ILE B 581 -10.916 -5.031 -0.826 1.00 0.00 H ATOM 235 HG22 ILE B 581 -10.987 -3.650 -1.948 1.00 0.00 H ATOM 236 HG23 ILE B 581 -9.916 -3.589 -0.527 1.00 0.00 H ATOM 237 H ILE B 581 -14.274 -2.738 1.009 1.00 0.00 H ATOM 238 N GLN B 582 -13.544 -6.121 -1.371 1.00 0.00 N ATOM 239 CA GLN B 582 -13.737 -7.554 -1.221 1.00 0.00 C ATOM 240 C GLN B 582 -12.421 -8.291 -1.324 1.00 0.00 C ATOM 241 O GLN B 582 -11.728 -8.213 -2.337 1.00 0.00 O ATOM 242 CB GLN B 582 -14.706 -8.089 -2.269 1.00 0.00 C ATOM 243 CG GLN B 582 -14.836 -9.611 -2.256 1.00 0.00 C ATOM 244 CD GLN B 582 -15.451 -10.161 -3.528 1.00 0.00 C ATOM 245 OE1 GLN B 582 -15.271 -9.605 -4.610 1.00 0.00 O ATOM 246 NE2 GLN B 582 -16.189 -11.253 -3.406 1.00 0.00 N ATOM 247 HA GLN B 582 -14.161 -7.724 -0.231 1.00 0.00 H ATOM 248 HB2 GLN B 582 -15.689 -7.657 -2.083 1.00 0.00 H ATOM 249 HB3 GLN B 582 -14.355 -7.781 -3.254 1.00 0.00 H ATOM 250 HG2 GLN B 582 -13.843 -10.044 -2.134 1.00 0.00 H ATOM 251 HG3 GLN B 582 -15.463 -9.900 -1.413 1.00 0.00 H ATOM 252 HE22 GLN B 582 -16.316 -11.693 -2.472 1.00 0.00 H ATOM 253 HE21 GLN B 582 -16.641 -11.671 -4.244 1.00 0.00 H ATOM 254 H GLN B 582 -13.418 -5.719 -2.322 1.00 0.00 H ATOM 255 N LEU B 583 -12.099 -9.018 -0.273 1.00 0.00 N ATOM 256 CA LEU B 583 -10.859 -9.762 -0.202 1.00 0.00 C ATOM 257 C LEU B 583 -10.969 -11.079 -0.950 1.00 0.00 C ATOM 258 O LEU B 583 -12.061 -11.487 -1.348 1.00 0.00 O ATOM 259 CB LEU B 583 -10.507 -10.024 1.249 1.00 0.00 C ATOM 260 CG LEU B 583 -10.435 -8.783 2.123 1.00 0.00 C ATOM 261 CD1 LEU B 583 -10.087 -9.180 3.545 1.00 0.00 C ATOM 262 CD2 LEU B 583 -9.417 -7.800 1.557 1.00 0.00 C ATOM 263 HA LEU B 583 -10.074 -9.169 -0.670 1.00 0.00 H ATOM 264 HB2 LEU B 583 -11.263 -10.689 1.666 1.00 0.00 H ATOM 265 HB3 LEU B 583 -9.535 -10.516 1.279 1.00 0.00 H ATOM 266 HG LEU B 583 -11.406 -8.288 2.133 1.00 0.00 H ATOM 267 HD21 LEU B 583 -8.435 -8.273 1.526 1.00 0.00 H ATOM 268 HD22 LEU B 583 -9.715 -7.511 0.549 1.00 0.00 H ATOM 269 HD23 LEU B 583 -9.375 -6.916 2.193 1.00 0.00 H ATOM 270 HD11 LEU B 583 -10.854 -9.851 3.931 1.00 0.00 H ATOM 271 HD12 LEU B 583 -9.122 -9.686 3.554 1.00 0.00 H ATOM 272 HD13 LEU B 583 -10.036 -8.287 4.168 1.00 0.00 H ATOM 273 H LEU B 583 -12.757 -9.059 0.531 1.00 0.00 H ATOM 274 N ALA B 584 -9.843 -11.760 -1.112 1.00 0.00 N ATOM 275 CA ALA B 584 -9.821 -13.012 -1.847 1.00 0.00 C ATOM 276 C ALA B 584 -10.568 -14.099 -1.087 1.00 0.00 C ATOM 277 O ALA B 584 -11.066 -15.054 -1.680 1.00 0.00 O ATOM 278 CB ALA B 584 -8.396 -13.457 -2.127 1.00 0.00 C ATOM 279 HA ALA B 584 -10.323 -12.844 -2.800 1.00 0.00 H ATOM 280 HB1 ALA B 584 -7.889 -12.695 -2.719 1.00 0.00 H ATOM 281 HB2 ALA B 584 -7.868 -13.597 -1.184 1.00 0.00 H ATOM 282 HB3 ALA B 584 -8.412 -14.397 -2.678 1.00 0.00 H ATOM 283 H ALA B 584 -8.960 -11.391 -0.705 1.00 0.00 H ATOM 284 N ASN B 585 -10.646 -13.943 0.230 1.00 0.00 N ATOM 285 CA ASN B 585 -11.353 -14.895 1.073 1.00 0.00 C ATOM 286 C ASN B 585 -12.848 -14.578 1.098 1.00 0.00 C ATOM 287 O ASN B 585 -13.637 -15.297 1.713 1.00 0.00 O ATOM 288 CB ASN B 585 -10.779 -14.885 2.495 1.00 0.00 C ATOM 289 CG ASN B 585 -11.048 -13.596 3.246 1.00 0.00 C ATOM 290 OD1 ASN B 585 -11.242 -12.544 2.646 1.00 0.00 O ATOM 291 ND2 ASN B 585 -11.042 -13.672 4.565 1.00 0.00 N ATOM 292 HA ASN B 585 -11.218 -15.892 0.655 1.00 0.00 H ATOM 293 HB2 ASN B 585 -11.224 -15.709 3.053 1.00 0.00 H ATOM 294 HB3 ASN B 585 -9.700 -15.030 2.433 1.00 0.00 H ATOM 295 HD22 ASN B 585 -10.873 -14.586 5.032 1.00 0.00 H ATOM 296 HD21 ASN B 585 -11.206 -12.818 5.136 1.00 0.00 H ATOM 297 H ASN B 585 -10.190 -13.119 0.670 1.00 0.00 H ATOM 298 N GLY B 586 -13.228 -13.486 0.434 1.00 0.00 N ATOM 299 CA GLY B 586 -14.628 -13.155 0.284 1.00 0.00 C ATOM 300 C GLY B 586 -15.099 -12.067 1.231 1.00 0.00 C ATOM 301 O GLY B 586 -16.266 -11.675 1.185 1.00 0.00 O ATOM 302 HA3 GLY B 586 -15.217 -14.053 0.470 1.00 0.00 H ATOM 303 HA2 GLY B 586 -14.795 -12.818 -0.739 1.00 0.00 H ATOM 304 H GLY B 586 -12.507 -12.863 0.018 1.00 0.00 H ATOM 305 N GLU B 587 -14.210 -11.571 2.084 1.00 0.00 N ATOM 306 CA GLU B 587 -14.595 -10.559 3.059 1.00 0.00 C ATOM 307 C GLU B 587 -14.923 -9.236 2.418 1.00 0.00 C ATOM 308 O GLU B 587 -14.329 -8.841 1.419 1.00 0.00 O ATOM 309 CB GLU B 587 -13.522 -10.354 4.105 1.00 0.00 C ATOM 310 CG GLU B 587 -13.405 -11.521 5.042 1.00 0.00 C ATOM 311 CD GLU B 587 -12.688 -11.181 6.326 1.00 0.00 C ATOM 312 OE1 GLU B 587 -13.302 -10.534 7.202 1.00 0.00 O ATOM 313 OE2 GLU B 587 -11.510 -11.568 6.469 1.00 0.00 O ATOM 314 HA GLU B 587 -15.496 -10.940 3.540 1.00 0.00 H ATOM 315 HB2 GLU B 587 -12.565 -10.211 3.602 1.00 0.00 H ATOM 316 HB3 GLU B 587 -13.763 -9.463 4.684 1.00 0.00 H ATOM 317 HG2 GLU B 587 -14.408 -11.871 5.287 1.00 0.00 H ATOM 318 HG3 GLU B 587 -12.856 -12.317 4.538 1.00 0.00 H ATOM 319 H GLU B 587 -13.227 -11.909 2.056 1.00 0.00 H ATOM 320 N LEU B 588 -15.872 -8.560 3.027 1.00 0.00 N ATOM 321 CA LEU B 588 -16.354 -7.283 2.541 1.00 0.00 C ATOM 322 C LEU B 588 -16.172 -6.227 3.614 1.00 0.00 C ATOM 323 O LEU B 588 -16.993 -6.100 4.521 1.00 0.00 O ATOM 324 CB LEU B 588 -17.821 -7.416 2.164 1.00 0.00 C ATOM 325 CG LEU B 588 -18.114 -8.583 1.228 1.00 0.00 C ATOM 326 CD1 LEU B 588 -19.603 -8.693 0.961 1.00 0.00 C ATOM 327 CD2 LEU B 588 -17.337 -8.421 -0.067 1.00 0.00 C ATOM 328 HA LEU B 588 -15.787 -6.981 1.660 1.00 0.00 H ATOM 329 HB2 LEU B 588 -18.399 -7.555 3.077 1.00 0.00 H ATOM 330 HB3 LEU B 588 -18.135 -6.495 1.673 1.00 0.00 H ATOM 331 HG LEU B 588 -17.793 -9.508 1.707 1.00 0.00 H ATOM 332 HD21 LEU B 588 -17.631 -7.490 -0.552 1.00 0.00 H ATOM 333 HD22 LEU B 588 -16.269 -8.396 0.152 1.00 0.00 H ATOM 334 HD23 LEU B 588 -17.555 -9.261 -0.727 1.00 0.00 H ATOM 335 HD11 LEU B 588 -20.129 -8.854 1.902 1.00 0.00 H ATOM 336 HD12 LEU B 588 -19.957 -7.772 0.499 1.00 0.00 H ATOM 337 HD13 LEU B 588 -19.790 -9.532 0.291 1.00 0.00 H ATOM 338 H LEU B 588 -16.293 -8.957 3.891 1.00 0.00 H ATOM 339 N LYS B 589 -15.088 -5.482 3.515 1.00 0.00 N ATOM 340 CA LYS B 589 -14.693 -4.576 4.575 1.00 0.00 C ATOM 341 C LYS B 589 -14.420 -3.186 4.021 1.00 0.00 C ATOM 342 O LYS B 589 -13.990 -3.035 2.879 1.00 0.00 O ATOM 343 CB LYS B 589 -13.444 -5.135 5.264 1.00 0.00 C ATOM 344 CG LYS B 589 -13.601 -6.587 5.697 1.00 0.00 C ATOM 345 CD LYS B 589 -12.300 -7.205 6.193 1.00 0.00 C ATOM 346 CE LYS B 589 -11.938 -6.744 7.596 1.00 0.00 C ATOM 347 NZ LYS B 589 -11.182 -5.465 7.599 1.00 0.00 N ATOM 348 HA LYS B 589 -15.503 -4.491 5.299 1.00 0.00 H ATOM 349 HB2 LYS B 589 -12.605 -5.068 4.571 1.00 0.00 H ATOM 350 HB3 LYS B 589 -13.234 -4.530 6.146 1.00 0.00 H ATOM 351 HG2 LYS B 589 -14.336 -6.632 6.501 1.00 0.00 H ATOM 352 HG3 LYS B 589 -13.959 -7.167 4.846 1.00 0.00 H ATOM 353 HD2 LYS B 589 -12.406 -8.290 6.197 1.00 0.00 H ATOM 354 HD3 LYS B 589 -11.496 -6.923 5.513 1.00 0.00 H ATOM 355 HE2 LYS B 589 -11.327 -7.512 8.070 1.00 0.00 H ATOM 356 HE3 LYS B 589 -12.856 -6.609 8.167 1.00 0.00 H ATOM 357 HZ1 LYS B 589 -10.299 -5.585 7.063 1.00 0.00 H ATOM 358 HZ2 LYS B 589 -11.759 -4.722 7.157 1.00 0.00 H ATOM 359 HZ3 LYS B 589 -10.961 -5.197 8.579 1.00 0.00 H ATOM 360 H LYS B 589 -14.504 -5.546 2.657 1.00 0.00 H ATOM 361 N LYS B 590 -14.696 -2.174 4.835 1.00 0.00 N ATOM 362 CA LYS B 590 -14.431 -0.792 4.465 1.00 0.00 C ATOM 363 C LYS B 590 -12.944 -0.567 4.245 1.00 0.00 C ATOM 364 O LYS B 590 -12.126 -1.129 4.980 1.00 0.00 O ATOM 365 CB LYS B 590 -14.926 0.153 5.560 1.00 0.00 C ATOM 366 CG LYS B 590 -16.426 0.364 5.574 1.00 0.00 C ATOM 367 CD LYS B 590 -16.836 1.456 4.603 1.00 0.00 C ATOM 368 CE LYS B 590 -17.700 2.501 5.289 1.00 0.00 C ATOM 369 NZ LYS B 590 -16.975 3.185 6.396 1.00 0.00 N ATOM 370 HA LYS B 590 -14.962 -0.585 3.536 1.00 0.00 H ATOM 371 HB2 LYS B 590 -14.630 -0.259 6.525 1.00 0.00 H ATOM 372 HB3 LYS B 590 -14.447 1.121 5.417 1.00 0.00 H ATOM 373 HG2 LYS B 590 -16.919 -0.566 5.292 1.00 0.00 H ATOM 374 HG3 LYS B 590 -16.736 0.647 6.580 1.00 0.00 H ATOM 375 HD2 LYS B 590 -15.941 1.937 4.209 1.00 0.00 H ATOM 376 HD3 LYS B 590 -17.399 1.011 3.783 1.00 0.00 H ATOM 377 HE2 LYS B 590 -18.586 2.013 5.696 1.00 0.00 H ATOM 378 HE3 LYS B 590 -18.003 3.246 4.553 1.00 0.00 H ATOM 379 HZ1 LYS B 590 -16.688 2.482 7.107 1.00 0.00 H ATOM 380 HZ2 LYS B 590 -16.131 3.659 6.015 1.00 0.00 H ATOM 381 HZ3 LYS B 590 -17.601 3.889 6.836 1.00 0.00 H ATOM 382 H LYS B 590 -15.114 -2.375 5.766 1.00 0.00 H ATOM 383 N VAL B 591 -12.598 0.242 3.245 1.00 0.00 N ATOM 384 CA VAL B 591 -11.194 0.523 2.925 1.00 0.00 C ATOM 385 C VAL B 591 -10.401 0.849 4.186 1.00 0.00 C ATOM 386 O VAL B 591 -9.329 0.302 4.439 1.00 0.00 O ATOM 387 CB VAL B 591 -11.046 1.734 1.991 1.00 0.00 C ATOM 388 CG1 VAL B 591 -9.636 1.794 1.442 1.00 0.00 C ATOM 389 CG2 VAL B 591 -12.062 1.712 0.872 1.00 0.00 C ATOM 390 HA VAL B 591 -10.816 -0.377 2.440 1.00 0.00 H ATOM 391 HB VAL B 591 -11.238 2.634 2.575 1.00 0.00 H ATOM 392 HG11 VAL B 591 -8.930 1.888 2.267 1.00 0.00 H ATOM 393 HG12 VAL B 591 -9.426 0.882 0.884 1.00 0.00 H ATOM 394 HG13 VAL B 591 -9.541 2.656 0.781 1.00 0.00 H ATOM 395 HG21 VAL B 591 -11.929 0.806 0.280 1.00 0.00 H ATOM 396 HG22 VAL B 591 -13.067 1.728 1.295 1.00 0.00 H ATOM 397 HG23 VAL B 591 -11.920 2.586 0.237 1.00 0.00 H ATOM 398 H VAL B 591 -13.345 0.687 2.674 1.00 0.00 H ATOM 399 N GLU B 592 -10.986 1.728 4.980 1.00 0.00 N ATOM 400 CA GLU B 592 -10.342 2.311 6.147 1.00 0.00 C ATOM 401 C GLU B 592 -10.119 1.290 7.266 1.00 0.00 C ATOM 402 O GLU B 592 -9.395 1.561 8.228 1.00 0.00 O ATOM 403 CB GLU B 592 -11.234 3.441 6.652 1.00 0.00 C ATOM 404 CG GLU B 592 -12.640 2.961 6.989 1.00 0.00 C ATOM 405 CD GLU B 592 -13.684 4.053 6.919 1.00 0.00 C ATOM 406 OE1 GLU B 592 -13.767 4.862 7.866 1.00 0.00 O ATOM 407 OE2 GLU B 592 -14.438 4.093 5.924 1.00 0.00 O ATOM 408 HA GLU B 592 -9.357 2.676 5.857 1.00 0.00 H ATOM 409 HB2 GLU B 592 -10.785 3.869 7.548 1.00 0.00 H ATOM 410 HB3 GLU B 592 -11.301 4.207 5.880 1.00 0.00 H ATOM 411 HG2 GLU B 592 -12.915 2.175 6.285 1.00 0.00 H ATOM 412 HG3 GLU B 592 -12.633 2.555 8.000 1.00 0.00 H ATOM 413 H GLU B 592 -11.960 2.019 4.759 1.00 0.00 H ATOM 414 N ASP B 593 -10.744 0.129 7.150 1.00 0.00 N ATOM 415 CA ASP B 593 -10.700 -0.868 8.213 1.00 0.00 C ATOM 416 C ASP B 593 -9.881 -2.081 7.805 1.00 0.00 C ATOM 417 O ASP B 593 -9.536 -2.918 8.641 1.00 0.00 O ATOM 418 CB ASP B 593 -12.128 -1.290 8.593 1.00 0.00 C ATOM 419 CG ASP B 593 -12.170 -2.461 9.558 1.00 0.00 C ATOM 420 OD1 ASP B 593 -11.924 -2.253 10.764 1.00 0.00 O ATOM 421 OD2 ASP B 593 -12.439 -3.597 9.112 1.00 0.00 O ATOM 422 HA ASP B 593 -10.215 -0.419 9.079 1.00 0.00 H ATOM 423 HB2 ASP B 593 -12.628 -0.440 9.057 1.00 0.00 H ATOM 424 HB3 ASP B 593 -12.660 -1.571 7.684 1.00 0.00 H ATOM 425 H ASP B 593 -11.278 -0.077 6.282 1.00 0.00 H ATOM 426 N LEU B 594 -9.565 -2.170 6.527 1.00 0.00 N ATOM 427 CA LEU B 594 -8.768 -3.269 6.020 1.00 0.00 C ATOM 428 C LEU B 594 -7.432 -3.334 6.738 1.00 0.00 C ATOM 429 O LEU B 594 -6.646 -2.385 6.712 1.00 0.00 O ATOM 430 CB LEU B 594 -8.553 -3.111 4.523 1.00 0.00 C ATOM 431 CG LEU B 594 -9.831 -3.110 3.691 1.00 0.00 C ATOM 432 CD1 LEU B 594 -9.563 -2.488 2.348 1.00 0.00 C ATOM 433 CD2 LEU B 594 -10.365 -4.518 3.504 1.00 0.00 C ATOM 434 HA LEU B 594 -9.304 -4.200 6.204 1.00 0.00 H ATOM 435 HB2 LEU B 594 -8.036 -2.167 4.352 1.00 0.00 H ATOM 436 HB3 LEU B 594 -7.926 -3.934 4.181 1.00 0.00 H ATOM 437 HG LEU B 594 -10.583 -2.527 4.223 1.00 0.00 H ATOM 438 HD21 LEU B 594 -9.617 -5.124 2.993 1.00 0.00 H ATOM 439 HD22 LEU B 594 -10.584 -4.955 4.478 1.00 0.00 H ATOM 440 HD23 LEU B 594 -11.276 -4.483 2.907 1.00 0.00 H ATOM 441 HD11 LEU B 594 -9.221 -1.462 2.486 1.00 0.00 H ATOM 442 HD12 LEU B 594 -8.795 -3.062 1.830 1.00 0.00 H ATOM 443 HD13 LEU B 594 -10.480 -2.490 1.758 1.00 0.00 H ATOM 444 H LEU B 594 -9.895 -1.435 5.869 1.00 0.00 H ATOM 445 N LYS B 595 -7.203 -4.443 7.407 1.00 0.00 N ATOM 446 CA LYS B 595 -5.961 -4.658 8.108 1.00 0.00 C ATOM 447 C LYS B 595 -4.958 -5.260 7.148 1.00 0.00 C ATOM 448 O LYS B 595 -5.346 -5.842 6.136 1.00 0.00 O ATOM 449 CB LYS B 595 -6.161 -5.587 9.309 1.00 0.00 C ATOM 450 CG LYS B 595 -7.228 -5.118 10.289 1.00 0.00 C ATOM 451 CD LYS B 595 -6.908 -3.749 10.865 1.00 0.00 C ATOM 452 CE LYS B 595 -7.935 -3.320 11.902 1.00 0.00 C ATOM 453 NZ LYS B 595 -9.317 -3.324 11.353 1.00 0.00 N ATOM 454 HA LYS B 595 -5.594 -3.703 8.483 1.00 0.00 H ATOM 455 HB2 LYS B 595 -6.447 -6.571 8.937 1.00 0.00 H ATOM 456 HB3 LYS B 595 -5.214 -5.663 9.844 1.00 0.00 H ATOM 457 HG2 LYS B 595 -8.185 -5.067 9.770 1.00 0.00 H ATOM 458 HG3 LYS B 595 -7.297 -5.837 11.106 1.00 0.00 H ATOM 459 HD2 LYS B 595 -5.925 -3.784 11.335 1.00 0.00 H ATOM 460 HD3 LYS B 595 -6.897 -3.019 10.056 1.00 0.00 H ATOM 461 HE2 LYS B 595 -7.694 -2.312 12.241 1.00 0.00 H ATOM 462 HE3 LYS B 595 -7.890 -4.007 12.747 1.00 0.00 H ATOM 463 HZ1 LYS B 595 -9.372 -2.666 10.550 1.00 0.00 H ATOM 464 HZ2 LYS B 595 -9.559 -4.284 11.033 1.00 0.00 H ATOM 465 HZ3 LYS B 595 -9.984 -3.025 12.093 1.00 0.00 H ATOM 466 H LYS B 595 -7.934 -5.182 7.431 1.00 0.00 H ATOM 467 N THR B 596 -3.683 -5.127 7.443 1.00 0.00 N ATOM 468 CA THR B 596 -2.663 -5.705 6.589 1.00 0.00 C ATOM 469 C THR B 596 -2.856 -7.218 6.488 1.00 0.00 C ATOM 470 O THR B 596 -2.685 -7.813 5.420 1.00 0.00 O ATOM 471 CB THR B 596 -1.252 -5.372 7.101 1.00 0.00 C ATOM 472 OG1 THR B 596 -0.280 -5.933 6.228 1.00 0.00 O ATOM 473 CG2 THR B 596 -1.041 -5.900 8.511 1.00 0.00 C ATOM 474 HA THR B 596 -2.765 -5.270 5.595 1.00 0.00 H ATOM 475 HB THR B 596 -1.144 -4.288 7.123 1.00 0.00 H ATOM 476 HG1 THR B 596 0.626 -5.716 6.562 1.00 0.00 H ATOM 477 HG23 THR B 596 -1.789 -5.467 9.175 1.00 0.00 H ATOM 478 HG21 THR B 596 -1.140 -6.986 8.510 1.00 0.00 H ATOM 479 HG22 THR B 596 -0.044 -5.625 8.855 1.00 0.00 H ATOM 480 H THR B 596 -3.404 -4.603 8.297 1.00 0.00 H ATOM 481 N GLU B 597 -3.279 -7.816 7.599 1.00 0.00 N ATOM 482 CA GLU B 597 -3.543 -9.244 7.671 1.00 0.00 C ATOM 483 C GLU B 597 -4.630 -9.646 6.680 1.00 0.00 C ATOM 484 O GLU B 597 -4.662 -10.780 6.206 1.00 0.00 O ATOM 485 CB GLU B 597 -3.944 -9.628 9.093 1.00 0.00 C ATOM 486 CG GLU B 597 -2.889 -9.272 10.132 1.00 0.00 C ATOM 487 CD GLU B 597 -3.280 -9.690 11.534 1.00 0.00 C ATOM 488 OE1 GLU B 597 -3.571 -10.886 11.739 1.00 0.00 O ATOM 489 OE2 GLU B 597 -3.282 -8.830 12.441 1.00 0.00 O ATOM 490 HA GLU B 597 -2.632 -9.780 7.405 1.00 0.00 H ATOM 491 HB2 GLU B 597 -4.868 -9.108 9.345 1.00 0.00 H ATOM 492 HB3 GLU B 597 -4.114 -10.704 9.126 1.00 0.00 H ATOM 493 HG2 GLU B 597 -1.957 -9.771 9.867 1.00 0.00 H ATOM 494 HG3 GLU B 597 -2.738 -8.193 10.120 1.00 0.00 H ATOM 495 H GLU B 597 -3.427 -7.238 8.451 1.00 0.00 H ATOM 496 N ASP B 598 -5.517 -8.708 6.372 1.00 0.00 N ATOM 497 CA ASP B 598 -6.594 -8.951 5.420 1.00 0.00 C ATOM 498 C ASP B 598 -6.022 -9.194 4.030 1.00 0.00 C ATOM 499 O ASP B 598 -6.405 -10.145 3.343 1.00 0.00 O ATOM 500 CB ASP B 598 -7.571 -7.769 5.377 1.00 0.00 C ATOM 501 CG ASP B 598 -8.354 -7.587 6.665 1.00 0.00 C ATOM 502 OD1 ASP B 598 -8.513 -8.567 7.419 1.00 0.00 O ATOM 503 OD2 ASP B 598 -8.824 -6.458 6.927 1.00 0.00 O ATOM 504 HA ASP B 598 -7.138 -9.837 5.748 1.00 0.00 H ATOM 505 HB2 ASP B 598 -7.004 -6.858 5.185 1.00 0.00 H ATOM 506 HB3 ASP B 598 -8.277 -7.933 4.563 1.00 0.00 H ATOM 507 H ASP B 598 -5.442 -7.774 6.822 1.00 0.00 H ATOM 508 N PHE B 599 -5.093 -8.337 3.618 1.00 0.00 N ATOM 509 CA PHE B 599 -4.462 -8.483 2.314 1.00 0.00 C ATOM 510 C PHE B 599 -3.507 -9.655 2.316 1.00 0.00 C ATOM 511 O PHE B 599 -3.416 -10.381 1.325 1.00 0.00 O ATOM 512 CB PHE B 599 -3.732 -7.208 1.876 1.00 0.00 C ATOM 513 CG PHE B 599 -4.661 -6.147 1.354 1.00 0.00 C ATOM 514 CD1 PHE B 599 -5.877 -5.898 1.972 1.00 0.00 C ATOM 515 CD2 PHE B 599 -4.324 -5.414 0.230 1.00 0.00 C ATOM 516 CE1 PHE B 599 -6.738 -4.941 1.477 1.00 0.00 C ATOM 517 CE2 PHE B 599 -5.180 -4.450 -0.268 1.00 0.00 C ATOM 518 CZ PHE B 599 -6.390 -4.215 0.355 1.00 0.00 C ATOM 519 HA PHE B 599 -5.258 -8.668 1.593 1.00 0.00 H ATOM 520 HB2 PHE B 599 -3.191 -6.806 2.733 1.00 0.00 H ATOM 521 HB3 PHE B 599 -3.023 -7.466 1.089 1.00 0.00 H ATOM 522 HD2 PHE B 599 -3.372 -5.599 -0.268 1.00 0.00 H ATOM 523 HE2 PHE B 599 -4.900 -3.876 -1.151 1.00 0.00 H ATOM 524 HZ PHE B 599 -7.069 -3.458 -0.038 1.00 0.00 H ATOM 525 HE1 PHE B 599 -7.692 -4.758 1.971 1.00 0.00 H ATOM 526 HD1 PHE B 599 -6.156 -6.466 2.860 1.00 0.00 H ATOM 527 H PHE B 599 -4.812 -7.550 4.237 1.00 0.00 H ATOM 528 N ILE B 600 -2.793 -9.835 3.426 1.00 0.00 N ATOM 529 CA ILE B 600 -1.916 -10.979 3.579 1.00 0.00 C ATOM 530 C ILE B 600 -2.656 -12.267 3.265 1.00 0.00 C ATOM 531 O ILE B 600 -2.285 -12.996 2.349 1.00 0.00 O ATOM 532 CB ILE B 600 -1.357 -11.050 5.006 1.00 0.00 C ATOM 533 CG1 ILE B 600 -0.401 -9.887 5.249 1.00 0.00 C ATOM 534 CG2 ILE B 600 -0.667 -12.382 5.248 1.00 0.00 C ATOM 535 CD1 ILE B 600 0.129 -9.824 6.661 1.00 0.00 C ATOM 536 HA ILE B 600 -1.090 -10.859 2.878 1.00 0.00 H ATOM 537 HB ILE B 600 -2.184 -10.972 5.712 1.00 0.00 H ATOM 538 HG12 ILE B 600 0.444 -9.987 4.568 1.00 0.00 H ATOM 539 HG13 ILE B 600 -0.929 -8.957 5.037 1.00 0.00 H ATOM 540 HD11 ILE B 600 -0.704 -9.712 7.356 1.00 0.00 H ATOM 541 HD12 ILE B 600 0.670 -10.743 6.886 1.00 0.00 H ATOM 542 HD13 ILE B 600 0.802 -8.972 6.758 1.00 0.00 H ATOM 543 HG21 ILE B 600 -1.384 -13.191 5.109 1.00 0.00 H ATOM 544 HG22 ILE B 600 0.155 -12.498 4.541 1.00 0.00 H ATOM 545 HG23 ILE B 600 -0.279 -12.409 6.266 1.00 0.00 H ATOM 546 H ILE B 600 -2.866 -9.142 4.198 1.00 0.00 H ATOM 547 N GLN B 601 -3.731 -12.512 4.000 1.00 0.00 N ATOM 548 CA GLN B 601 -4.533 -13.706 3.808 1.00 0.00 C ATOM 549 C GLN B 601 -4.999 -13.817 2.370 1.00 0.00 C ATOM 550 O GLN B 601 -4.812 -14.843 1.735 1.00 0.00 O ATOM 551 CB GLN B 601 -5.739 -13.697 4.743 1.00 0.00 C ATOM 552 CG GLN B 601 -5.363 -13.805 6.205 1.00 0.00 C ATOM 553 CD GLN B 601 -6.562 -13.710 7.126 1.00 0.00 C ATOM 554 OE1 GLN B 601 -7.176 -14.718 7.474 1.00 0.00 O ATOM 555 NE2 GLN B 601 -6.908 -12.495 7.520 1.00 0.00 N ATOM 556 HA GLN B 601 -3.910 -14.570 4.041 1.00 0.00 H ATOM 557 HB2 GLN B 601 -6.286 -12.766 4.594 1.00 0.00 H ATOM 558 HB3 GLN B 601 -6.382 -14.539 4.487 1.00 0.00 H ATOM 559 HG2 GLN B 601 -4.872 -14.764 6.369 1.00 0.00 H ATOM 560 HG3 GLN B 601 -4.672 -12.998 6.448 1.00 0.00 H ATOM 561 HE22 GLN B 601 -6.361 -11.670 7.202 1.00 0.00 H ATOM 562 HE21 GLN B 601 -7.727 -12.365 8.148 1.00 0.00 H ATOM 563 H GLN B 601 -4.008 -11.830 4.735 1.00 0.00 H ATOM 564 N SER B 602 -5.571 -12.744 1.851 1.00 0.00 N ATOM 565 CA SER B 602 -6.128 -12.755 0.508 1.00 0.00 C ATOM 566 C SER B 602 -5.084 -13.150 -0.540 1.00 0.00 C ATOM 567 O SER B 602 -5.383 -13.887 -1.481 1.00 0.00 O ATOM 568 CB SER B 602 -6.716 -11.389 0.183 1.00 0.00 C ATOM 569 OG SER B 602 -7.705 -11.037 1.127 1.00 0.00 O ATOM 570 HA SER B 602 -6.917 -13.507 0.478 1.00 0.00 H ATOM 571 HB2 SER B 602 -7.163 -11.418 -0.811 1.00 0.00 H ATOM 572 HB3 SER B 602 -5.921 -10.643 0.201 1.00 0.00 H ATOM 573 HG SER B 602 -7.301 -11.007 2.030 1.00 0.00 H ATOM 574 H SER B 602 -5.624 -11.872 2.416 1.00 0.00 H ATOM 575 N ALA B 603 -3.861 -12.677 -0.365 1.00 0.00 N ATOM 576 CA ALA B 603 -2.791 -12.989 -1.298 1.00 0.00 C ATOM 577 C ALA B 603 -2.286 -14.411 -1.091 1.00 0.00 C ATOM 578 O ALA B 603 -1.925 -15.094 -2.042 1.00 0.00 O ATOM 579 CB ALA B 603 -1.652 -12.001 -1.137 1.00 0.00 C ATOM 580 HA ALA B 603 -3.188 -12.912 -2.310 1.00 0.00 H ATOM 581 HB1 ALA B 603 -2.016 -10.993 -1.335 1.00 0.00 H ATOM 582 HB2 ALA B 603 -1.266 -12.056 -0.119 1.00 0.00 H ATOM 583 HB3 ALA B 603 -0.858 -12.246 -1.842 1.00 0.00 H ATOM 584 H ALA B 603 -3.661 -12.070 0.456 1.00 0.00 H ATOM 585 N GLU B 604 -2.285 -14.854 0.156 1.00 0.00 N ATOM 586 CA GLU B 604 -1.752 -16.163 0.510 1.00 0.00 C ATOM 587 C GLU B 604 -2.708 -17.282 0.108 1.00 0.00 C ATOM 588 O GLU B 604 -2.284 -18.349 -0.337 1.00 0.00 O ATOM 589 CB GLU B 604 -1.471 -16.227 2.005 1.00 0.00 C ATOM 590 CG GLU B 604 -0.403 -15.246 2.445 1.00 0.00 C ATOM 591 CD GLU B 604 0.112 -15.535 3.836 1.00 0.00 C ATOM 592 OE1 GLU B 604 -0.709 -15.735 4.755 1.00 0.00 O ATOM 593 OE2 GLU B 604 1.346 -15.597 4.012 1.00 0.00 O ATOM 594 HA GLU B 604 -0.821 -16.305 -0.038 1.00 0.00 H ATOM 595 HB2 GLU B 604 -2.392 -16.003 2.543 1.00 0.00 H ATOM 596 HB3 GLU B 604 -1.142 -17.236 2.255 1.00 0.00 H ATOM 597 HG2 GLU B 604 0.431 -15.300 1.745 1.00 0.00 H ATOM 598 HG3 GLU B 604 -0.824 -14.241 2.430 1.00 0.00 H ATOM 599 H GLU B 604 -2.677 -14.249 0.906 1.00 0.00 H ATOM 600 N ILE B 605 -3.995 -17.030 0.283 1.00 0.00 N ATOM 601 CA ILE B 605 -5.042 -17.963 -0.119 1.00 0.00 C ATOM 602 C ILE B 605 -5.047 -18.131 -1.640 1.00 0.00 C ATOM 603 O ILE B 605 -5.477 -19.157 -2.172 1.00 0.00 O ATOM 604 CB ILE B 605 -6.425 -17.461 0.364 1.00 0.00 C ATOM 605 CG1 ILE B 605 -6.400 -17.262 1.883 1.00 0.00 C ATOM 606 CG2 ILE B 605 -7.533 -18.429 -0.028 1.00 0.00 C ATOM 607 CD1 ILE B 605 -7.612 -16.535 2.430 1.00 0.00 C ATOM 608 HA ILE B 605 -4.840 -18.930 0.341 1.00 0.00 H ATOM 609 HB ILE B 605 -6.634 -16.507 -0.121 1.00 0.00 H ATOM 610 HG12 ILE B 605 -6.346 -18.242 2.356 1.00 0.00 H ATOM 611 HG13 ILE B 605 -5.510 -16.686 2.139 1.00 0.00 H ATOM 612 HD11 ILE B 605 -7.676 -15.546 1.977 1.00 0.00 H ATOM 613 HD12 ILE B 605 -8.512 -17.103 2.194 1.00 0.00 H ATOM 614 HD13 ILE B 605 -7.517 -16.435 3.511 1.00 0.00 H ATOM 615 HG21 ILE B 605 -7.559 -18.529 -1.113 1.00 0.00 H ATOM 616 HG22 ILE B 605 -7.340 -19.402 0.423 1.00 0.00 H ATOM 617 HG23 ILE B 605 -8.490 -18.046 0.326 1.00 0.00 H ATOM 618 H ILE B 605 -4.272 -16.130 0.725 1.00 0.00 H ATOM 619 N SER B 606 -4.538 -17.122 -2.326 1.00 0.00 N ATOM 620 CA SER B 606 -4.470 -17.126 -3.775 1.00 0.00 C ATOM 621 C SER B 606 -3.086 -17.572 -4.241 1.00 0.00 C ATOM 622 O SER B 606 -2.121 -17.536 -3.477 1.00 0.00 O ATOM 623 CB SER B 606 -4.790 -15.727 -4.292 1.00 0.00 C ATOM 624 OG SER B 606 -6.028 -15.270 -3.767 1.00 0.00 O ATOM 625 HA SER B 606 -5.200 -17.831 -4.173 1.00 0.00 H ATOM 626 HB2 SER B 606 -4.850 -15.752 -5.380 1.00 0.00 H ATOM 627 HB3 SER B 606 -3.998 -15.043 -3.988 1.00 0.00 H ATOM 628 HG SER B 606 -5.976 -15.243 -2.779 1.00 0.00 H ATOM 629 H SER B 606 -4.174 -16.297 -1.809 1.00 0.00 H ATOM 630 N ASN B 607 -2.995 -18.016 -5.487 1.00 0.00 N ATOM 631 CA ASN B 607 -1.727 -18.478 -6.038 1.00 0.00 C ATOM 632 C ASN B 607 -1.267 -17.582 -7.180 1.00 0.00 C ATOM 633 O ASN B 607 -0.109 -17.631 -7.595 1.00 0.00 O ATOM 634 CB ASN B 607 -1.844 -19.928 -6.510 1.00 0.00 C ATOM 635 CG ASN B 607 -2.034 -20.895 -5.358 1.00 0.00 C ATOM 636 OD1 ASN B 607 -3.158 -21.183 -4.948 1.00 0.00 O ATOM 637 ND2 ASN B 607 -0.935 -21.401 -4.823 1.00 0.00 N ATOM 638 HA ASN B 607 -0.978 -18.428 -5.247 1.00 0.00 H ATOM 639 HB2 ASN B 607 -2.699 -20.010 -7.182 1.00 0.00 H ATOM 640 HB3 ASN B 607 -0.934 -20.197 -7.047 1.00 0.00 H ATOM 641 HD22 ASN B 607 -0.003 -21.133 -5.198 1.00 0.00 H ATOM 642 HD21 ASN B 607 -1.003 -22.067 -4.027 1.00 0.00 H ATOM 643 H ASN B 607 -3.846 -18.035 -6.084 1.00 0.00 H ATOM 644 N ASP B 608 -2.178 -16.758 -7.683 1.00 0.00 N ATOM 645 CA ASP B 608 -1.843 -15.782 -8.718 1.00 0.00 C ATOM 646 C ASP B 608 -1.490 -14.459 -8.063 1.00 0.00 C ATOM 647 O ASP B 608 -1.152 -13.482 -8.730 1.00 0.00 O ATOM 648 CB ASP B 608 -3.014 -15.571 -9.685 1.00 0.00 C ATOM 649 CG ASP B 608 -3.468 -16.850 -10.356 1.00 0.00 C ATOM 650 OD1 ASP B 608 -2.728 -17.374 -11.215 1.00 0.00 O ATOM 651 OD2 ASP B 608 -4.571 -17.337 -10.024 1.00 0.00 O ATOM 652 HA ASP B 608 -0.994 -16.163 -9.286 1.00 0.00 H ATOM 653 HB2 ASP B 608 -3.853 -15.154 -9.128 1.00 0.00 H ATOM 654 HB3 ASP B 608 -2.705 -14.865 -10.456 1.00 0.00 H ATOM 655 H ASP B 608 -3.156 -16.808 -7.331 1.00 0.00 H ATOM 656 N LEU B 609 -1.591 -14.437 -6.745 1.00 0.00 N ATOM 657 CA LEU B 609 -1.358 -13.231 -5.971 1.00 0.00 C ATOM 658 C LEU B 609 -0.372 -13.539 -4.853 1.00 0.00 C ATOM 659 O LEU B 609 -0.316 -14.673 -4.378 1.00 0.00 O ATOM 660 CB LEU B 609 -2.688 -12.737 -5.395 1.00 0.00 C ATOM 661 CG LEU B 609 -3.852 -12.747 -6.394 1.00 0.00 C ATOM 662 CD1 LEU B 609 -5.169 -12.430 -5.715 1.00 0.00 C ATOM 663 CD2 LEU B 609 -3.595 -11.754 -7.506 1.00 0.00 C ATOM 664 HA LEU B 609 -0.939 -12.450 -6.606 1.00 0.00 H ATOM 665 HB2 LEU B 609 -2.954 -13.377 -4.554 1.00 0.00 H ATOM 666 HB3 LEU B 609 -2.549 -11.715 -5.043 1.00 0.00 H ATOM 667 HG LEU B 609 -3.921 -13.751 -6.813 1.00 0.00 H ATOM 668 HD21 LEU B 609 -3.496 -10.754 -7.083 1.00 0.00 H ATOM 669 HD22 LEU B 609 -2.676 -12.023 -8.026 1.00 0.00 H ATOM 670 HD23 LEU B 609 -4.429 -11.772 -8.207 1.00 0.00 H ATOM 671 HD11 LEU B 609 -5.368 -13.175 -4.945 1.00 0.00 H ATOM 672 HD12 LEU B 609 -5.113 -11.441 -5.260 1.00 0.00 H ATOM 673 HD13 LEU B 609 -5.970 -12.446 -6.454 1.00 0.00 H ATOM 674 H LEU B 609 -1.846 -15.313 -6.246 1.00 0.00 H ATOM 675 N LYS B 610 0.418 -12.556 -4.445 1.00 0.00 N ATOM 676 CA LYS B 610 1.402 -12.778 -3.385 1.00 0.00 C ATOM 677 C LYS B 610 1.835 -11.474 -2.723 1.00 0.00 C ATOM 678 O LYS B 610 1.856 -10.419 -3.357 1.00 0.00 O ATOM 679 CB LYS B 610 2.631 -13.506 -3.940 1.00 0.00 C ATOM 680 CG LYS B 610 3.303 -12.782 -5.089 1.00 0.00 C ATOM 681 CD LYS B 610 4.568 -13.493 -5.531 1.00 0.00 C ATOM 682 CE LYS B 610 5.209 -12.787 -6.711 1.00 0.00 C ATOM 683 NZ LYS B 610 6.457 -13.461 -7.149 1.00 0.00 N ATOM 684 HA LYS B 610 0.921 -13.396 -2.627 1.00 0.00 H ATOM 685 HB2 LYS B 610 3.356 -13.620 -3.134 1.00 0.00 H ATOM 686 HB3 LYS B 610 2.319 -14.490 -4.289 1.00 0.00 H ATOM 687 HG2 LYS B 610 2.611 -12.733 -5.930 1.00 0.00 H ATOM 688 HG3 LYS B 610 3.557 -11.771 -4.771 1.00 0.00 H ATOM 689 HD2 LYS B 610 5.274 -13.512 -4.701 1.00 0.00 H ATOM 690 HD3 LYS B 610 4.320 -14.515 -5.819 1.00 0.00 H ATOM 691 HE2 LYS B 610 5.444 -11.762 -6.423 1.00 0.00 H ATOM 692 HE3 LYS B 610 4.503 -12.777 -7.542 1.00 0.00 H ATOM 693 HZ1 LYS B 610 7.139 -13.469 -6.364 1.00 0.00 H ATOM 694 HZ2 LYS B 610 6.241 -14.438 -7.432 1.00 0.00 H ATOM 695 HZ3 LYS B 610 6.862 -12.946 -7.957 1.00 0.00 H ATOM 696 H LYS B 610 0.338 -11.616 -4.883 1.00 0.00 H ATOM 697 N ILE B 611 2.167 -11.571 -1.439 1.00 0.00 N ATOM 698 CA ILE B 611 2.682 -10.449 -0.660 1.00 0.00 C ATOM 699 C ILE B 611 4.211 -10.442 -0.707 1.00 0.00 C ATOM 700 O ILE B 611 4.835 -11.483 -0.924 1.00 0.00 O ATOM 701 CB ILE B 611 2.232 -10.565 0.818 1.00 0.00 C ATOM 702 CG1 ILE B 611 0.704 -10.619 0.917 1.00 0.00 C ATOM 703 CG2 ILE B 611 2.774 -9.420 1.655 1.00 0.00 C ATOM 704 CD1 ILE B 611 0.019 -9.264 1.009 1.00 0.00 C ATOM 705 HA ILE B 611 2.290 -9.526 -1.088 1.00 0.00 H ATOM 706 HB ILE B 611 2.642 -11.494 1.214 1.00 0.00 H ATOM 707 HG12 ILE B 611 0.325 -11.131 0.032 1.00 0.00 H ATOM 708 HG13 ILE B 611 0.442 -11.192 1.807 1.00 0.00 H ATOM 709 HD11 ILE B 611 0.372 -8.739 1.897 1.00 0.00 H ATOM 710 HD12 ILE B 611 0.255 -8.678 0.121 1.00 0.00 H ATOM 711 HD13 ILE B 611 -1.060 -9.407 1.075 1.00 0.00 H ATOM 712 HG21 ILE B 611 3.863 -9.432 1.623 1.00 0.00 H ATOM 713 HG22 ILE B 611 2.408 -8.474 1.255 1.00 0.00 H ATOM 714 HG23 ILE B 611 2.438 -9.534 2.686 1.00 0.00 H ATOM 715 H ILE B 611 2.054 -12.491 -0.967 1.00 0.00 H ATOM 716 N ASP B 612 4.811 -9.279 -0.519 1.00 0.00 N ATOM 717 CA ASP B 612 6.262 -9.178 -0.436 1.00 0.00 C ATOM 718 C ASP B 612 6.663 -8.403 0.803 1.00 0.00 C ATOM 719 O ASP B 612 5.900 -7.573 1.299 1.00 0.00 O ATOM 720 CB ASP B 612 6.854 -8.493 -1.669 1.00 0.00 C ATOM 721 CG ASP B 612 8.322 -8.814 -1.842 1.00 0.00 C ATOM 722 OD1 ASP B 612 9.169 -8.086 -1.284 1.00 0.00 O ATOM 723 OD2 ASP B 612 8.633 -9.810 -2.529 1.00 0.00 O ATOM 724 HA ASP B 612 6.655 -10.193 -0.384 1.00 0.00 H ATOM 725 HB2 ASP B 612 6.313 -8.829 -2.553 1.00 0.00 H ATOM 726 HB3 ASP B 612 6.739 -7.414 -1.563 1.00 0.00 H ATOM 727 H ASP B 612 4.235 -8.418 -0.428 1.00 0.00 H ATOM 728 N SER B 613 7.854 -8.680 1.297 1.00 0.00 N ATOM 729 CA SER B 613 8.381 -7.989 2.455 1.00 0.00 C ATOM 730 C SER B 613 9.546 -7.089 2.052 1.00 0.00 C ATOM 731 O SER B 613 10.661 -7.559 1.807 1.00 0.00 O ATOM 732 CB SER B 613 8.807 -9.001 3.523 1.00 0.00 C ATOM 733 OG SER B 613 9.581 -10.050 2.960 1.00 0.00 O ATOM 734 HA SER B 613 7.600 -7.357 2.878 1.00 0.00 H ATOM 735 HB2 SER B 613 7.916 -9.426 3.986 1.00 0.00 H ATOM 736 HB3 SER B 613 9.400 -8.489 4.281 1.00 0.00 H ATOM 737 HG SER B 613 10.394 -9.671 2.542 1.00 0.00 H ATOM 738 H SER B 613 8.431 -9.416 0.842 1.00 0.00 H ATOM 739 N SER B 614 9.271 -5.798 1.947 1.00 0.00 N ATOM 740 CA SER B 614 10.291 -4.826 1.598 1.00 0.00 C ATOM 741 C SER B 614 10.404 -3.761 2.692 1.00 0.00 C ATOM 742 O SER B 614 9.544 -2.889 2.815 1.00 0.00 O ATOM 743 CB SER B 614 9.946 -4.178 0.256 1.00 0.00 C ATOM 744 OG SER B 614 9.762 -5.158 -0.756 1.00 0.00 O ATOM 745 HA SER B 614 11.252 -5.332 1.511 1.00 0.00 H ATOM 746 HB2 SER B 614 10.758 -3.512 -0.037 1.00 0.00 H ATOM 747 HB3 SER B 614 9.027 -3.602 0.365 1.00 0.00 H ATOM 748 HG SER B 614 9.022 -5.763 -0.497 1.00 0.00 H ATOM 749 H SER B 614 8.299 -5.472 2.119 1.00 0.00 H ATOM 750 N THR B 615 11.460 -3.842 3.491 1.00 0.00 N ATOM 751 CA THR B 615 11.655 -2.912 4.597 1.00 0.00 C ATOM 752 C THR B 615 12.231 -1.592 4.111 1.00 0.00 C ATOM 753 O THR B 615 13.383 -1.536 3.691 1.00 0.00 O ATOM 754 CB THR B 615 12.610 -3.490 5.662 1.00 0.00 C ATOM 755 OG1 THR B 615 12.142 -4.769 6.106 1.00 0.00 O ATOM 756 CG2 THR B 615 12.735 -2.544 6.855 1.00 0.00 C ATOM 757 HA THR B 615 10.672 -2.748 5.038 1.00 0.00 H ATOM 758 HB THR B 615 13.593 -3.605 5.206 1.00 0.00 H ATOM 759 HG1 THR B 615 12.763 -5.128 6.788 1.00 0.00 H ATOM 760 HG23 THR B 615 13.091 -1.573 6.511 1.00 0.00 H ATOM 761 HG21 THR B 615 11.760 -2.428 7.329 1.00 0.00 H ATOM 762 HG22 THR B 615 13.442 -2.959 7.573 1.00 0.00 H ATOM 763 H THR B 615 12.166 -4.587 3.324 1.00 0.00 H ATOM 764 N VAL B 616 11.433 -0.534 4.148 1.00 0.00 N ATOM 765 CA VAL B 616 11.949 0.791 3.873 1.00 0.00 C ATOM 766 C VAL B 616 13.069 1.138 4.850 1.00 0.00 C ATOM 767 O VAL B 616 12.862 1.204 6.058 1.00 0.00 O ATOM 768 CB VAL B 616 10.843 1.867 3.924 1.00 0.00 C ATOM 769 CG1 VAL B 616 9.906 1.646 5.091 1.00 0.00 C ATOM 770 CG2 VAL B 616 11.450 3.256 4.011 1.00 0.00 C ATOM 771 HA VAL B 616 12.347 0.780 2.858 1.00 0.00 H ATOM 772 HB VAL B 616 10.267 1.784 3.002 1.00 0.00 H ATOM 773 HG11 VAL B 616 9.433 0.669 4.995 1.00 0.00 H ATOM 774 HG12 VAL B 616 10.471 1.688 6.022 1.00 0.00 H ATOM 775 HG13 VAL B 616 9.141 2.423 5.094 1.00 0.00 H ATOM 776 HG21 VAL B 616 12.057 3.330 4.914 1.00 0.00 H ATOM 777 HG22 VAL B 616 12.075 3.433 3.136 1.00 0.00 H ATOM 778 HG23 VAL B 616 10.652 3.998 4.046 1.00 0.00 H ATOM 779 H VAL B 616 10.426 -0.657 4.377 1.00 0.00 H ATOM 780 N GLU B 617 14.259 1.327 4.310 1.00 0.00 N ATOM 781 CA GLU B 617 15.423 1.657 5.105 1.00 0.00 C ATOM 782 C GLU B 617 15.671 3.154 5.099 1.00 0.00 C ATOM 783 O GLU B 617 16.378 3.674 5.959 1.00 0.00 O ATOM 784 CB GLU B 617 16.657 0.919 4.601 1.00 0.00 C ATOM 785 CG GLU B 617 16.543 -0.587 4.709 1.00 0.00 C ATOM 786 CD GLU B 617 17.890 -1.260 4.824 1.00 0.00 C ATOM 787 OE1 GLU B 617 18.560 -1.447 3.791 1.00 0.00 O ATOM 788 OE2 GLU B 617 18.293 -1.591 5.959 1.00 0.00 O ATOM 789 HA GLU B 617 15.227 1.339 6.129 1.00 0.00 H ATOM 790 HB2 GLU B 617 16.812 1.180 3.554 1.00 0.00 H ATOM 791 HB3 GLU B 617 17.517 1.244 5.187 1.00 0.00 H ATOM 792 HG2 GLU B 617 15.953 -0.831 5.592 1.00 0.00 H ATOM 793 HG3 GLU B 617 16.038 -0.965 3.820 1.00 0.00 H ATOM 794 H GLU B 617 14.364 1.236 3.279 1.00 0.00 H ATOM 795 N ARG B 618 15.107 3.846 4.118 1.00 0.00 N ATOM 796 CA ARG B 618 15.293 5.285 4.023 1.00 0.00 C ATOM 797 C ARG B 618 14.164 5.915 3.214 1.00 0.00 C ATOM 798 O ARG B 618 13.538 5.249 2.391 1.00 0.00 O ATOM 799 CB ARG B 618 16.646 5.595 3.381 1.00 0.00 C ATOM 800 CG ARG B 618 17.099 7.034 3.566 1.00 0.00 C ATOM 801 CD ARG B 618 18.241 7.389 2.627 1.00 0.00 C ATOM 802 NE ARG B 618 19.370 6.465 2.731 1.00 0.00 N ATOM 803 CZ ARG B 618 20.199 6.197 1.722 1.00 0.00 C ATOM 804 NH1 ARG B 618 20.022 6.777 0.538 1.00 0.00 N ATOM 805 NH2 ARG B 618 21.205 5.348 1.897 1.00 0.00 N ATOM 806 HA ARG B 618 15.274 5.709 5.027 1.00 0.00 H ATOM 807 HB2 ARG B 618 17.395 4.939 3.824 1.00 0.00 H ATOM 808 HB3 ARG B 618 16.574 5.392 2.312 1.00 0.00 H ATOM 809 HG2 ARG B 618 16.258 7.698 3.367 1.00 0.00 H ATOM 810 HG3 ARG B 618 17.432 7.170 4.595 1.00 0.00 H ATOM 811 HD2 ARG B 618 18.590 8.393 2.867 1.00 0.00 H ATOM 812 HD3 ARG B 618 17.869 7.370 1.603 1.00 0.00 H ATOM 813 HE ARG B 618 19.535 5.991 3.642 1.00 0.00 H ATOM 814 HH12 ARG B 618 20.671 6.565 -0.247 1.00 0.00 H ATOM 815 HH11 ARG B 618 19.235 7.442 0.397 1.00 0.00 H ATOM 816 HH22 ARG B 618 21.852 5.139 1.110 1.00 0.00 H ATOM 817 HH21 ARG B 618 21.346 4.892 2.821 1.00 0.00 H ATOM 818 H ARG B 618 14.526 3.354 3.409 1.00 0.00 H ATOM 819 N ILE B 619 13.910 7.191 3.458 1.00 0.00 N ATOM 820 CA ILE B 619 12.856 7.926 2.777 1.00 0.00 C ATOM 821 C ILE B 619 13.352 9.317 2.440 1.00 0.00 C ATOM 822 O ILE B 619 13.720 10.087 3.327 1.00 0.00 O ATOM 823 CB ILE B 619 11.583 8.027 3.644 1.00 0.00 C ATOM 824 CG1 ILE B 619 10.928 6.658 3.769 1.00 0.00 C ATOM 825 CG2 ILE B 619 10.603 9.036 3.055 1.00 0.00 C ATOM 826 CD1 ILE B 619 9.809 6.611 4.782 1.00 0.00 C ATOM 827 HA ILE B 619 12.599 7.386 1.866 1.00 0.00 H ATOM 828 HB ILE B 619 11.868 8.374 4.637 1.00 0.00 H ATOM 829 HG12 ILE B 619 10.524 6.379 2.796 1.00 0.00 H ATOM 830 HG13 ILE B 619 11.690 5.937 4.064 1.00 0.00 H ATOM 831 HD11 ILE B 619 10.199 6.876 5.765 1.00 0.00 H ATOM 832 HD12 ILE B 619 9.031 7.319 4.495 1.00 0.00 H ATOM 833 HD13 ILE B 619 9.392 5.604 4.814 1.00 0.00 H ATOM 834 HG21 ILE B 619 11.076 10.017 3.010 1.00 0.00 H ATOM 835 HG22 ILE B 619 10.320 8.722 2.050 1.00 0.00 H ATOM 836 HG23 ILE B 619 9.715 9.088 3.685 1.00 0.00 H ATOM 837 H ILE B 619 14.488 7.688 4.166 1.00 0.00 H ATOM 838 N GLU B 620 13.379 9.632 1.162 1.00 0.00 N ATOM 839 CA GLU B 620 13.939 10.893 0.719 1.00 0.00 C ATOM 840 C GLU B 620 12.957 11.652 -0.151 1.00 0.00 C ATOM 841 O GLU B 620 12.326 11.081 -1.039 1.00 0.00 O ATOM 842 CB GLU B 620 15.232 10.647 -0.053 1.00 0.00 C ATOM 843 CG GLU B 620 16.197 9.728 0.672 1.00 0.00 C ATOM 844 CD GLU B 620 17.493 9.529 -0.081 1.00 0.00 C ATOM 845 OE1 GLU B 620 18.172 10.535 -0.378 1.00 0.00 O ATOM 846 OE2 GLU B 620 17.854 8.367 -0.359 1.00 0.00 O ATOM 847 HA GLU B 620 14.152 11.497 1.601 1.00 0.00 H ATOM 848 HB2 GLU B 620 14.982 10.198 -1.014 1.00 0.00 H ATOM 849 HB3 GLU B 620 15.724 11.605 -0.219 1.00 0.00 H ATOM 850 HG2 GLU B 620 16.423 10.159 1.647 1.00 0.00 H ATOM 851 HG3 GLU B 620 15.720 8.757 0.807 1.00 0.00 H ATOM 852 H GLU B 620 12.993 8.967 0.461 1.00 0.00 H ATOM 853 N ASP B 621 12.826 12.938 0.114 1.00 0.00 N ATOM 854 CA ASP B 621 12.007 13.804 -0.714 1.00 0.00 C ATOM 855 C ASP B 621 12.726 14.076 -2.016 1.00 0.00 C ATOM 856 O ASP B 621 13.940 14.270 -2.036 1.00 0.00 O ATOM 857 CB ASP B 621 11.684 15.112 0.008 1.00 0.00 C ATOM 858 CG ASP B 621 11.160 16.186 -0.922 1.00 0.00 C ATOM 859 OD1 ASP B 621 9.950 16.180 -1.217 1.00 0.00 O ATOM 860 OD2 ASP B 621 11.958 17.038 -1.367 1.00 0.00 O ATOM 861 HA ASP B 621 11.061 13.303 -0.921 1.00 0.00 H ATOM 862 HB2 ASP B 621 10.929 14.912 0.769 1.00 0.00 H ATOM 863 HB3 ASP B 621 12.592 15.479 0.486 1.00 0.00 H ATOM 864 H ASP B 621 13.321 13.340 0.935 1.00 0.00 H ATOM 865 N SER B 622 11.981 14.088 -3.097 1.00 0.00 N ATOM 866 CA SER B 622 12.583 14.186 -4.415 1.00 0.00 C ATOM 867 C SER B 622 12.403 15.583 -4.999 1.00 0.00 C ATOM 868 O SER B 622 12.666 15.801 -6.185 1.00 0.00 O ATOM 869 CB SER B 622 11.979 13.136 -5.351 1.00 0.00 C ATOM 870 OG SER B 622 12.840 12.882 -6.447 1.00 0.00 O ATOM 871 HA SER B 622 13.652 13.998 -4.315 1.00 0.00 H ATOM 872 HB2 SER B 622 11.022 13.499 -5.725 1.00 0.00 H ATOM 873 HB3 SER B 622 11.823 12.210 -4.797 1.00 0.00 H ATOM 874 HG SER B 622 12.429 12.201 -7.037 1.00 0.00 H ATOM 875 H SER B 622 10.947 14.027 -3.008 1.00 0.00 H ATOM 876 N HIS B 623 11.951 16.517 -4.157 1.00 0.00 N ATOM 877 CA HIS B 623 11.725 17.915 -4.546 1.00 0.00 C ATOM 878 C HIS B 623 10.496 18.055 -5.448 1.00 0.00 C ATOM 879 O HIS B 623 9.720 19.001 -5.307 1.00 0.00 O ATOM 880 CB HIS B 623 12.968 18.503 -5.229 1.00 0.00 C ATOM 881 CG HIS B 623 12.926 19.991 -5.394 1.00 0.00 C ATOM 882 ND1 HIS B 623 12.492 20.615 -6.544 1.00 0.00 N ATOM 883 CD2 HIS B 623 13.282 20.981 -4.543 1.00 0.00 C ATOM 884 CE1 HIS B 623 12.584 21.921 -6.393 1.00 0.00 C ATOM 885 NE2 HIS B 623 13.059 22.170 -5.188 1.00 0.00 N ATOM 886 HA HIS B 623 11.535 18.481 -3.634 1.00 0.00 H ATOM 887 HB2 HIS B 623 13.842 18.249 -4.629 1.00 0.00 H ATOM 888 HB3 HIS B 623 13.063 18.051 -6.216 1.00 0.00 H ATOM 889 HD2 HIS B 623 13.673 20.856 -3.533 1.00 0.00 H ATOM 890 HE1 HIS B 623 12.313 22.669 -7.138 1.00 0.00 H ATOM 891 H HIS B 623 11.749 16.240 -3.175 1.00 0.00 H ATOM 892 N SER B 624 10.335 17.114 -6.368 1.00 0.00 N ATOM 893 CA SER B 624 9.193 17.071 -7.268 1.00 0.00 C ATOM 894 C SER B 624 7.878 17.027 -6.482 1.00 0.00 C ATOM 895 O SER B 624 7.824 16.468 -5.381 1.00 0.00 O ATOM 896 CB SER B 624 9.328 15.845 -8.172 1.00 0.00 C ATOM 897 OG SER B 624 10.575 15.855 -8.850 1.00 0.00 O ATOM 898 HA SER B 624 9.176 17.974 -7.878 1.00 0.00 H ATOM 899 HB2 SER B 624 8.522 15.851 -8.906 1.00 0.00 H ATOM 900 HB3 SER B 624 9.258 14.943 -7.564 1.00 0.00 H ATOM 901 HG SER B 624 11.310 15.846 -8.187 1.00 0.00 H ATOM 902 H SER B 624 11.059 16.372 -6.450 1.00 0.00 H ATOM 903 N PRO B 625 6.814 17.640 -7.040 1.00 0.00 N ATOM 904 CA PRO B 625 5.499 17.743 -6.390 1.00 0.00 C ATOM 905 C PRO B 625 4.992 16.428 -5.825 1.00 0.00 C ATOM 906 O PRO B 625 4.642 15.507 -6.564 1.00 0.00 O ATOM 907 CB PRO B 625 4.580 18.208 -7.509 1.00 0.00 C ATOM 908 CG PRO B 625 5.463 18.934 -8.463 1.00 0.00 C ATOM 909 CD PRO B 625 6.821 18.295 -8.363 1.00 0.00 C ATOM 910 HA PRO B 625 5.546 18.414 -5.532 1.00 0.00 H ATOM 911 HD3 PRO B 625 6.964 17.562 -9.157 1.00 0.00 H ATOM 912 HD2 PRO B 625 7.608 19.047 -8.419 1.00 0.00 H ATOM 913 HG3 PRO B 625 5.522 19.988 -8.193 1.00 0.00 H ATOM 914 HG2 PRO B 625 5.077 18.841 -9.478 1.00 0.00 H ATOM 915 HB2 PRO B 625 4.109 17.355 -7.997 1.00 0.00 H ATOM 916 HB3 PRO B 625 3.809 18.873 -7.120 1.00 0.00 H ATOM 917 N GLY B 626 4.943 16.372 -4.505 1.00 0.00 N ATOM 918 CA GLY B 626 4.440 15.212 -3.803 1.00 0.00 C ATOM 919 C GLY B 626 5.216 13.946 -4.098 1.00 0.00 C ATOM 920 O GLY B 626 4.653 12.858 -4.054 1.00 0.00 O ATOM 921 HA3 GLY B 626 3.401 15.056 -4.093 1.00 0.00 H ATOM 922 HA2 GLY B 626 4.491 15.407 -2.732 1.00 0.00 H ATOM 923 H GLY B 626 5.277 17.188 -3.954 1.00 0.00 H ATOM 924 N VAL B 627 6.502 14.074 -4.391 1.00 0.00 N ATOM 925 CA VAL B 627 7.314 12.913 -4.724 1.00 0.00 C ATOM 926 C VAL B 627 8.344 12.625 -3.648 1.00 0.00 C ATOM 927 O VAL B 627 9.130 13.497 -3.268 1.00 0.00 O ATOM 928 CB VAL B 627 8.040 13.082 -6.074 1.00 0.00 C ATOM 929 CG1 VAL B 627 8.792 11.812 -6.448 1.00 0.00 C ATOM 930 CG2 VAL B 627 7.047 13.448 -7.155 1.00 0.00 C ATOM 931 HA VAL B 627 6.622 12.074 -4.797 1.00 0.00 H ATOM 932 HB VAL B 627 8.767 13.888 -5.977 1.00 0.00 H ATOM 933 HG11 VAL B 627 9.530 11.588 -5.678 1.00 0.00 H ATOM 934 HG12 VAL B 627 8.087 10.985 -6.529 1.00 0.00 H ATOM 935 HG13 VAL B 627 9.295 11.957 -7.404 1.00 0.00 H ATOM 936 HG21 VAL B 627 6.302 12.657 -7.245 1.00 0.00 H ATOM 937 HG22 VAL B 627 6.555 14.385 -6.893 1.00 0.00 H ATOM 938 HG23 VAL B 627 7.571 13.565 -8.104 1.00 0.00 H ATOM 939 H VAL B 627 6.938 15.018 -4.383 1.00 0.00 H ATOM 940 N ALA B 628 8.330 11.401 -3.160 1.00 0.00 N ATOM 941 CA ALA B 628 9.323 10.938 -2.217 1.00 0.00 C ATOM 942 C ALA B 628 9.741 9.528 -2.575 1.00 0.00 C ATOM 943 O ALA B 628 8.903 8.661 -2.822 1.00 0.00 O ATOM 944 CB ALA B 628 8.792 10.994 -0.793 1.00 0.00 C ATOM 945 HA ALA B 628 10.191 11.594 -2.271 1.00 0.00 H ATOM 946 HB1 ALA B 628 8.527 12.022 -0.546 1.00 0.00 H ATOM 947 HB2 ALA B 628 7.909 10.360 -0.711 1.00 0.00 H ATOM 948 HB3 ALA B 628 9.560 10.640 -0.106 1.00 0.00 H ATOM 949 H ALA B 628 7.580 10.747 -3.463 1.00 0.00 H ATOM 950 N VAL B 629 11.033 9.307 -2.623 1.00 0.00 N ATOM 951 CA VAL B 629 11.555 7.998 -2.941 1.00 0.00 C ATOM 952 C VAL B 629 11.742 7.193 -1.676 1.00 0.00 C ATOM 953 O VAL B 629 12.503 7.567 -0.779 1.00 0.00 O ATOM 954 CB VAL B 629 12.874 8.066 -3.744 1.00 0.00 C ATOM 955 CG1 VAL B 629 13.712 9.236 -3.279 1.00 0.00 C ATOM 956 CG2 VAL B 629 13.661 6.762 -3.627 1.00 0.00 C ATOM 957 HA VAL B 629 10.824 7.502 -3.580 1.00 0.00 H ATOM 958 HB VAL B 629 12.623 8.210 -4.795 1.00 0.00 H ATOM 959 HG11 VAL B 629 13.156 10.162 -3.428 1.00 0.00 H ATOM 960 HG12 VAL B 629 13.945 9.117 -2.221 1.00 0.00 H ATOM 961 HG13 VAL B 629 14.637 9.270 -3.854 1.00 0.00 H ATOM 962 HG21 VAL B 629 13.900 6.576 -2.580 1.00 0.00 H ATOM 963 HG22 VAL B 629 13.059 5.940 -4.015 1.00 0.00 H ATOM 964 HG23 VAL B 629 14.583 6.843 -4.203 1.00 0.00 H ATOM 965 H VAL B 629 11.693 10.087 -2.429 1.00 0.00 H ATOM 966 N ILE B 630 11.007 6.108 -1.599 1.00 0.00 N ATOM 967 CA ILE B 630 11.121 5.202 -0.491 1.00 0.00 C ATOM 968 C ILE B 630 12.163 4.141 -0.828 1.00 0.00 C ATOM 969 O ILE B 630 12.000 3.384 -1.785 1.00 0.00 O ATOM 970 CB ILE B 630 9.772 4.527 -0.186 1.00 0.00 C ATOM 971 CG1 ILE B 630 8.621 5.533 -0.277 1.00 0.00 C ATOM 972 CG2 ILE B 630 9.807 3.902 1.193 1.00 0.00 C ATOM 973 CD1 ILE B 630 8.713 6.653 0.728 1.00 0.00 C ATOM 974 HA ILE B 630 11.424 5.762 0.393 1.00 0.00 H ATOM 975 HB ILE B 630 9.603 3.749 -0.930 1.00 0.00 H ATOM 976 HG12 ILE B 630 8.621 5.967 -1.277 1.00 0.00 H ATOM 977 HG13 ILE B 630 7.684 5.000 -0.114 1.00 0.00 H ATOM 978 HD11 ILE B 630 8.702 6.237 1.736 1.00 0.00 H ATOM 979 HD12 ILE B 630 9.640 7.205 0.571 1.00 0.00 H ATOM 980 HD13 ILE B 630 7.863 7.324 0.601 1.00 0.00 H ATOM 981 HG21 ILE B 630 10.600 3.155 1.232 1.00 0.00 H ATOM 982 HG22 ILE B 630 9.998 4.676 1.936 1.00 0.00 H ATOM 983 HG23 ILE B 630 8.848 3.427 1.400 1.00 0.00 H ATOM 984 H ILE B 630 10.327 5.900 -2.358 1.00 0.00 H ATOM 985 N GLN B 631 13.251 4.120 -0.080 1.00 0.00 N ATOM 986 CA GLN B 631 14.308 3.152 -0.311 1.00 0.00 C ATOM 987 C GLN B 631 14.004 1.872 0.444 1.00 0.00 C ATOM 988 O GLN B 631 14.034 1.851 1.675 1.00 0.00 O ATOM 989 CB GLN B 631 15.660 3.711 0.130 1.00 0.00 C ATOM 990 CG GLN B 631 16.811 2.741 -0.080 1.00 0.00 C ATOM 991 CD GLN B 631 18.134 3.293 0.404 1.00 0.00 C ATOM 992 OE1 GLN B 631 18.860 3.945 -0.344 1.00 0.00 O ATOM 993 NE2 GLN B 631 18.456 3.032 1.660 1.00 0.00 N ATOM 994 HA GLN B 631 14.357 2.939 -1.379 1.00 0.00 H ATOM 995 HB2 GLN B 631 15.863 4.617 -0.441 1.00 0.00 H ATOM 996 HB3 GLN B 631 15.604 3.956 1.191 1.00 0.00 H ATOM 997 HG2 GLN B 631 16.596 1.821 0.464 1.00 0.00 H ATOM 998 HG3 GLN B 631 16.893 2.521 -1.144 1.00 0.00 H ATOM 999 HE22 GLN B 631 17.811 2.476 2.257 1.00 0.00 H ATOM 1000 HE21 GLN B 631 19.354 3.383 2.050 1.00 0.00 H ATOM 1001 H GLN B 631 13.353 4.811 0.690 1.00 0.00 H ATOM 1002 N PHE B 632 13.710 0.817 -0.296 1.00 0.00 N ATOM 1003 CA PHE B 632 13.312 -0.450 0.296 1.00 0.00 C ATOM 1004 C PHE B 632 14.428 -1.473 0.244 1.00 0.00 C ATOM 1005 O PHE B 632 15.145 -1.573 -0.745 1.00 0.00 O ATOM 1006 CB PHE B 632 12.111 -1.033 -0.441 1.00 0.00 C ATOM 1007 CG PHE B 632 10.874 -0.195 -0.382 1.00 0.00 C ATOM 1008 CD1 PHE B 632 9.997 -0.312 0.679 1.00 0.00 C ATOM 1009 CD2 PHE B 632 10.573 0.692 -1.400 1.00 0.00 C ATOM 1010 CE1 PHE B 632 8.846 0.442 0.725 1.00 0.00 C ATOM 1011 CE2 PHE B 632 9.419 1.446 -1.362 1.00 0.00 C ATOM 1012 CZ PHE B 632 8.552 1.320 -0.297 1.00 0.00 C ATOM 1013 HA PHE B 632 13.061 -0.241 1.336 1.00 0.00 H ATOM 1014 HB2 PHE B 632 12.385 -1.161 -1.488 1.00 0.00 H ATOM 1015 HB3 PHE B 632 11.884 -2.005 -0.004 1.00 0.00 H ATOM 1016 HD2 PHE B 632 11.256 0.796 -2.243 1.00 0.00 H ATOM 1017 HE2 PHE B 632 9.193 2.140 -2.172 1.00 0.00 H ATOM 1018 HZ PHE B 632 7.638 1.912 -0.263 1.00 0.00 H ATOM 1019 HE1 PHE B 632 8.166 0.345 1.571 1.00 0.00 H ATOM 1020 HD1 PHE B 632 10.219 -1.008 1.488 1.00 0.00 H ATOM 1021 H PHE B 632 13.765 0.895 -1.332 1.00 0.00 H ATOM 1022 N ALA B 633 14.559 -2.224 1.318 1.00 0.00 N ATOM 1023 CA ALA B 633 15.394 -3.405 1.334 1.00 0.00 C ATOM 1024 C ALA B 633 14.514 -4.624 1.106 1.00 0.00 C ATOM 1025 O ALA B 633 13.848 -5.105 2.025 1.00 0.00 O ATOM 1026 CB ALA B 633 16.127 -3.513 2.658 1.00 0.00 C ATOM 1027 HA ALA B 633 16.142 -3.342 0.543 1.00 0.00 H ATOM 1028 HB1 ALA B 633 16.753 -2.632 2.798 1.00 0.00 H ATOM 1029 HB2 ALA B 633 15.402 -3.578 3.469 1.00 0.00 H ATOM 1030 HB3 ALA B 633 16.751 -4.407 2.654 1.00 0.00 H ATOM 1031 H ALA B 633 14.045 -1.959 2.183 1.00 0.00 H ATOM 1032 N VAL B 634 14.488 -5.097 -0.127 1.00 0.00 N ATOM 1033 CA VAL B 634 13.605 -6.187 -0.509 1.00 0.00 C ATOM 1034 C VAL B 634 14.147 -7.526 -0.031 1.00 0.00 C ATOM 1035 O VAL B 634 15.257 -7.927 -0.396 1.00 0.00 O ATOM 1036 CB VAL B 634 13.396 -6.229 -2.039 1.00 0.00 C ATOM 1037 CG1 VAL B 634 12.460 -7.365 -2.430 1.00 0.00 C ATOM 1038 CG2 VAL B 634 12.859 -4.896 -2.537 1.00 0.00 C ATOM 1039 HA VAL B 634 12.644 -6.004 -0.029 1.00 0.00 H ATOM 1040 HB VAL B 634 14.362 -6.412 -2.510 1.00 0.00 H ATOM 1041 HG11 VAL B 634 12.889 -8.314 -2.109 1.00 0.00 H ATOM 1042 HG12 VAL B 634 11.493 -7.220 -1.948 1.00 0.00 H ATOM 1043 HG13 VAL B 634 12.331 -7.371 -3.512 1.00 0.00 H ATOM 1044 HG21 VAL B 634 11.905 -4.686 -2.053 1.00 0.00 H ATOM 1045 HG22 VAL B 634 13.571 -4.106 -2.297 1.00 0.00 H ATOM 1046 HG23 VAL B 634 12.718 -4.943 -3.617 1.00 0.00 H ATOM 1047 H VAL B 634 15.116 -4.679 -0.843 1.00 0.00 H ATOM 1048 N GLY B 635 13.369 -8.198 0.806 1.00 0.00 N ATOM 1049 CA GLY B 635 13.730 -9.523 1.260 1.00 0.00 C ATOM 1050 C GLY B 635 14.752 -9.502 2.375 1.00 0.00 C ATOM 1051 O GLY B 635 15.255 -8.443 2.756 1.00 0.00 O ATOM 1052 HA3 GLY B 635 14.143 -10.079 0.419 1.00 0.00 H ATOM 1053 HA2 GLY B 635 12.832 -10.025 1.620 1.00 0.00 H ATOM 1054 H GLY B 635 12.485 -7.765 1.142 1.00 0.00 H ATOM 1055 N GLU B 636 15.071 -10.678 2.891 1.00 0.00 N ATOM 1056 CA GLU B 636 16.039 -10.808 3.969 1.00 0.00 C ATOM 1057 C GLU B 636 17.456 -10.597 3.451 1.00 0.00 C ATOM 1058 O GLU B 636 18.379 -10.337 4.222 1.00 0.00 O ATOM 1059 CB GLU B 636 15.904 -12.174 4.623 1.00 0.00 C ATOM 1060 CG GLU B 636 14.550 -12.395 5.271 1.00 0.00 C ATOM 1061 CD GLU B 636 14.415 -13.770 5.876 1.00 0.00 C ATOM 1062 OE1 GLU B 636 14.795 -13.948 7.050 1.00 0.00 O ATOM 1063 OE2 GLU B 636 13.931 -14.683 5.178 1.00 0.00 O ATOM 1064 HA GLU B 636 15.837 -10.039 4.715 1.00 0.00 H ATOM 1065 HB2 GLU B 636 16.053 -12.939 3.861 1.00 0.00 H ATOM 1066 HB3 GLU B 636 16.674 -12.270 5.388 1.00 0.00 H ATOM 1067 HG2 GLU B 636 14.413 -11.652 6.057 1.00 0.00 H ATOM 1068 HG3 GLU B 636 13.776 -12.268 4.514 1.00 0.00 H ATOM 1069 H GLU B 636 14.616 -11.534 2.515 1.00 0.00 H ATOM 1070 N HIS B 637 17.617 -10.700 2.135 1.00 0.00 N ATOM 1071 CA HIS B 637 18.891 -10.406 1.492 1.00 0.00 C ATOM 1072 C HIS B 637 19.019 -8.893 1.306 1.00 0.00 C ATOM 1073 O HIS B 637 20.016 -8.400 0.776 1.00 0.00 O ATOM 1074 CB HIS B 637 18.982 -11.126 0.142 1.00 0.00 C ATOM 1075 CG HIS B 637 20.382 -11.307 -0.368 1.00 0.00 C ATOM 1076 ND1 HIS B 637 21.107 -12.461 -0.164 1.00 0.00 N ATOM 1077 CD2 HIS B 637 21.181 -10.488 -1.093 1.00 0.00 C ATOM 1078 CE1 HIS B 637 22.288 -12.344 -0.738 1.00 0.00 C ATOM 1079 NE2 HIS B 637 22.359 -11.157 -1.308 1.00 0.00 N ATOM 1080 HA HIS B 637 19.709 -10.761 2.119 1.00 0.00 H ATOM 1081 HB2 HIS B 637 18.527 -12.111 0.249 1.00 0.00 H ATOM 1082 HB3 HIS B 637 18.423 -10.547 -0.593 1.00 0.00 H ATOM 1083 HD2 HIS B 637 20.934 -9.485 -1.441 1.00 0.00 H ATOM 1084 HE1 HIS B 637 23.073 -13.100 -0.741 1.00 0.00 H ATOM 1085 H HIS B 637 16.812 -10.999 1.549 1.00 0.00 H ATOM 1086 N ARG B 638 17.977 -8.184 1.763 1.00 0.00 N ATOM 1087 CA ARG B 638 17.936 -6.721 1.839 1.00 0.00 C ATOM 1088 C ARG B 638 18.551 -6.051 0.625 1.00 0.00 C ATOM 1089 O ARG B 638 19.535 -5.317 0.720 1.00 0.00 O ATOM 1090 CB ARG B 638 18.562 -6.207 3.142 1.00 0.00 C ATOM 1091 CG ARG B 638 19.856 -6.892 3.520 1.00 0.00 C ATOM 1092 CD ARG B 638 20.522 -6.230 4.712 1.00 0.00 C ATOM 1093 NE ARG B 638 21.718 -6.953 5.136 1.00 0.00 N ATOM 1094 CZ ARG B 638 22.462 -6.611 6.185 1.00 0.00 C ATOM 1095 NH1 ARG B 638 22.145 -5.544 6.910 1.00 0.00 N ATOM 1096 NH2 ARG B 638 23.529 -7.332 6.504 1.00 0.00 N ATOM 1097 HA ARG B 638 16.882 -6.443 1.843 1.00 0.00 H ATOM 1098 HB2 ARG B 638 18.759 -5.141 3.030 1.00 0.00 H ATOM 1099 HB3 ARG B 638 17.846 -6.359 3.949 1.00 0.00 H ATOM 1100 HG2 ARG B 638 19.645 -7.932 3.767 1.00 0.00 H ATOM 1101 HG3 ARG B 638 20.537 -6.853 2.670 1.00 0.00 H ATOM 1102 HD2 ARG B 638 19.815 -6.201 5.541 1.00 0.00 H ATOM 1103 HD3 ARG B 638 20.802 -5.213 4.440 1.00 0.00 H ATOM 1104 HE ARG B 638 22.006 -7.786 4.584 1.00 0.00 H ATOM 1105 HH12 ARG B 638 22.729 -5.280 7.729 1.00 0.00 H ATOM 1106 HH11 ARG B 638 21.313 -4.973 6.658 1.00 0.00 H ATOM 1107 HH22 ARG B 638 24.111 -7.065 7.324 1.00 0.00 H ATOM 1108 HH21 ARG B 638 23.784 -8.164 5.934 1.00 0.00 H ATOM 1109 H ARG B 638 17.139 -8.709 2.086 1.00 0.00 H ATOM 1110 N ALA B 639 17.949 -6.320 -0.517 1.00 0.00 N ATOM 1111 CA ALA B 639 18.344 -5.688 -1.757 1.00 0.00 C ATOM 1112 C ALA B 639 17.638 -4.349 -1.887 1.00 0.00 C ATOM 1113 O ALA B 639 16.409 -4.288 -1.941 1.00 0.00 O ATOM 1114 CB ALA B 639 18.018 -6.591 -2.927 1.00 0.00 C ATOM 1115 HA ALA B 639 19.420 -5.516 -1.755 1.00 0.00 H ATOM 1116 HB1 ALA B 639 18.555 -7.533 -2.818 1.00 0.00 H ATOM 1117 HB2 ALA B 639 16.945 -6.783 -2.948 1.00 0.00 H ATOM 1118 HB3 ALA B 639 18.320 -6.105 -3.855 1.00 0.00 H ATOM 1119 H ALA B 639 17.168 -7.006 -0.527 1.00 0.00 H ATOM 1120 N GLN B 640 18.413 -3.284 -1.933 1.00 0.00 N ATOM 1121 CA GLN B 640 17.861 -1.943 -1.844 1.00 0.00 C ATOM 1122 C GLN B 640 17.357 -1.436 -3.185 1.00 0.00 C ATOM 1123 O GLN B 640 18.047 -1.511 -4.201 1.00 0.00 O ATOM 1124 CB GLN B 640 18.887 -0.978 -1.258 1.00 0.00 C ATOM 1125 CG GLN B 640 19.189 -1.254 0.202 1.00 0.00 C ATOM 1126 CD GLN B 640 20.149 -0.254 0.803 1.00 0.00 C ATOM 1127 OE1 GLN B 640 20.998 0.309 0.112 1.00 0.00 O ATOM 1128 NE2 GLN B 640 20.033 -0.036 2.101 1.00 0.00 N ATOM 1129 HA GLN B 640 17.001 -1.995 -1.176 1.00 0.00 H ATOM 1130 HB2 GLN B 640 19.812 -1.065 -1.828 1.00 0.00 H ATOM 1131 HB3 GLN B 640 18.501 0.037 -1.348 1.00 0.00 H ATOM 1132 HG2 GLN B 640 18.255 -1.221 0.763 1.00 0.00 H ATOM 1133 HG3 GLN B 640 19.626 -2.249 0.285 1.00 0.00 H ATOM 1134 HE22 GLN B 640 19.301 -0.533 2.648 1.00 0.00 H ATOM 1135 HE21 GLN B 640 20.673 0.632 2.575 1.00 0.00 H ATOM 1136 H GLN B 640 19.441 -3.406 -2.035 1.00 0.00 H ATOM 1137 N VAL B 641 16.132 -0.938 -3.163 1.00 0.00 N ATOM 1138 CA VAL B 641 15.501 -0.345 -4.328 1.00 0.00 C ATOM 1139 C VAL B 641 15.064 1.075 -4.006 1.00 0.00 C ATOM 1140 O VAL B 641 14.320 1.302 -3.050 1.00 0.00 O ATOM 1141 CB VAL B 641 14.271 -1.160 -4.793 1.00 0.00 C ATOM 1142 CG1 VAL B 641 13.592 -0.496 -5.982 1.00 0.00 C ATOM 1143 CG2 VAL B 641 14.672 -2.584 -5.141 1.00 0.00 C ATOM 1144 HA VAL B 641 16.234 -0.344 -5.135 1.00 0.00 H ATOM 1145 HB VAL B 641 13.559 -1.190 -3.968 1.00 0.00 H ATOM 1146 HG11 VAL B 641 13.262 0.504 -5.699 1.00 0.00 H ATOM 1147 HG12 VAL B 641 14.298 -0.426 -6.810 1.00 0.00 H ATOM 1148 HG13 VAL B 641 12.731 -1.091 -6.286 1.00 0.00 H ATOM 1149 HG21 VAL B 641 15.409 -2.567 -5.944 1.00 0.00 H ATOM 1150 HG22 VAL B 641 15.102 -3.064 -4.262 1.00 0.00 H ATOM 1151 HG23 VAL B 641 13.792 -3.139 -5.465 1.00 0.00 H ATOM 1152 H VAL B 641 15.597 -0.973 -2.272 1.00 0.00 H ATOM 1153 N SER B 642 15.547 2.023 -4.784 1.00 0.00 N ATOM 1154 CA SER B 642 15.156 3.410 -4.621 1.00 0.00 C ATOM 1155 C SER B 642 14.090 3.762 -5.650 1.00 0.00 C ATOM 1156 O SER B 642 14.386 3.926 -6.835 1.00 0.00 O ATOM 1157 CB SER B 642 16.373 4.324 -4.772 1.00 0.00 C ATOM 1158 OG SER B 642 17.380 3.986 -3.831 1.00 0.00 O ATOM 1159 HA SER B 642 14.744 3.554 -3.622 1.00 0.00 H ATOM 1160 HB2 SER B 642 16.066 5.357 -4.611 1.00 0.00 H ATOM 1161 HB3 SER B 642 16.776 4.219 -5.779 1.00 0.00 H ATOM 1162 HG SER B 642 18.156 4.590 -3.948 1.00 0.00 H ATOM 1163 H SER B 642 16.224 1.771 -5.532 1.00 0.00 H ATOM 1164 N VAL B 643 12.849 3.854 -5.199 1.00 0.00 N ATOM 1165 CA VAL B 643 11.739 4.122 -6.083 1.00 0.00 C ATOM 1166 C VAL B 643 11.043 5.437 -5.717 1.00 0.00 C ATOM 1167 O VAL B 643 10.598 5.625 -4.584 1.00 0.00 O ATOM 1168 CB VAL B 643 10.737 2.948 -6.049 1.00 0.00 C ATOM 1169 CG1 VAL B 643 10.362 2.585 -4.620 1.00 0.00 C ATOM 1170 CG2 VAL B 643 9.499 3.274 -6.854 1.00 0.00 C ATOM 1171 HA VAL B 643 12.127 4.224 -7.096 1.00 0.00 H ATOM 1172 HB VAL B 643 11.225 2.084 -6.500 1.00 0.00 H ATOM 1173 HG11 VAL B 643 11.259 2.293 -4.073 1.00 0.00 H ATOM 1174 HG12 VAL B 643 9.904 3.447 -4.136 1.00 0.00 H ATOM 1175 HG13 VAL B 643 9.655 1.755 -4.631 1.00 0.00 H ATOM 1176 HG21 VAL B 643 9.018 4.159 -6.437 1.00 0.00 H ATOM 1177 HG22 VAL B 643 9.781 3.466 -7.889 1.00 0.00 H ATOM 1178 HG23 VAL B 643 8.809 2.431 -6.814 1.00 0.00 H ATOM 1179 H VAL B 643 12.669 3.730 -4.182 1.00 0.00 H ATOM 1180 N GLU B 644 10.975 6.351 -6.678 1.00 0.00 N ATOM 1181 CA GLU B 644 10.282 7.619 -6.485 1.00 0.00 C ATOM 1182 C GLU B 644 8.778 7.423 -6.612 1.00 0.00 C ATOM 1183 O GLU B 644 8.276 7.099 -7.690 1.00 0.00 O ATOM 1184 CB GLU B 644 10.750 8.655 -7.506 1.00 0.00 C ATOM 1185 CG GLU B 644 12.152 9.174 -7.254 1.00 0.00 C ATOM 1186 CD GLU B 644 12.572 10.197 -8.284 1.00 0.00 C ATOM 1187 OE1 GLU B 644 11.973 11.295 -8.316 1.00 0.00 O ATOM 1188 OE2 GLU B 644 13.493 9.908 -9.074 1.00 0.00 O ATOM 1189 HA GLU B 644 10.516 7.982 -5.484 1.00 0.00 H ATOM 1190 HB2 GLU B 644 10.725 8.198 -8.495 1.00 0.00 H ATOM 1191 HB3 GLU B 644 10.061 9.499 -7.480 1.00 0.00 H ATOM 1192 HG2 GLU B 644 12.185 9.635 -6.267 1.00 0.00 H ATOM 1193 HG3 GLU B 644 12.848 8.336 -7.286 1.00 0.00 H ATOM 1194 H GLU B 644 11.429 6.157 -7.594 1.00 0.00 H ATOM 1195 N VAL B 645 8.069 7.603 -5.513 1.00 0.00 N ATOM 1196 CA VAL B 645 6.645 7.425 -5.475 1.00 0.00 C ATOM 1197 C VAL B 645 5.977 8.714 -4.999 1.00 0.00 C ATOM 1198 O VAL B 645 6.590 9.500 -4.274 1.00 0.00 O ATOM 1199 CB VAL B 645 6.314 6.274 -4.508 1.00 0.00 C ATOM 1200 CG1 VAL B 645 4.856 6.289 -4.158 1.00 0.00 C ATOM 1201 CG2 VAL B 645 6.719 4.934 -5.103 1.00 0.00 C ATOM 1202 HA VAL B 645 6.274 7.185 -6.472 1.00 0.00 H ATOM 1203 HB VAL B 645 6.886 6.418 -3.592 1.00 0.00 H ATOM 1204 HG11 VAL B 645 4.608 7.237 -3.681 1.00 0.00 H ATOM 1205 HG12 VAL B 645 4.264 6.172 -5.066 1.00 0.00 H ATOM 1206 HG13 VAL B 645 4.639 5.469 -3.474 1.00 0.00 H ATOM 1207 HG21 VAL B 645 6.180 4.775 -6.037 1.00 0.00 H ATOM 1208 HG22 VAL B 645 7.792 4.933 -5.297 1.00 0.00 H ATOM 1209 HG23 VAL B 645 6.475 4.137 -4.400 1.00 0.00 H ATOM 1210 H VAL B 645 8.561 7.885 -4.641 1.00 0.00 H ATOM 1211 N LEU B 646 4.738 8.952 -5.424 1.00 0.00 N ATOM 1212 CA LEU B 646 3.992 10.084 -4.900 1.00 0.00 C ATOM 1213 C LEU B 646 3.572 9.804 -3.465 1.00 0.00 C ATOM 1214 O LEU B 646 3.155 8.696 -3.131 1.00 0.00 O ATOM 1215 CB LEU B 646 2.749 10.420 -5.725 1.00 0.00 C ATOM 1216 CG LEU B 646 3.008 10.981 -7.122 1.00 0.00 C ATOM 1217 CD1 LEU B 646 1.914 11.959 -7.515 1.00 0.00 C ATOM 1218 CD2 LEU B 646 4.359 11.656 -7.201 1.00 0.00 C ATOM 1219 HA LEU B 646 4.659 10.945 -4.950 1.00 0.00 H ATOM 1220 HB2 LEU B 646 2.163 9.507 -5.834 1.00 0.00 H ATOM 1221 HB3 LEU B 646 2.169 11.158 -5.171 1.00 0.00 H ATOM 1222 HG LEU B 646 3.004 10.144 -7.821 1.00 0.00 H ATOM 1223 HD21 LEU B 646 4.396 12.477 -6.485 1.00 0.00 H ATOM 1224 HD22 LEU B 646 5.140 10.932 -6.967 1.00 0.00 H ATOM 1225 HD23 LEU B 646 4.512 12.044 -8.208 1.00 0.00 H ATOM 1226 HD11 LEU B 646 0.952 11.447 -7.512 1.00 0.00 H ATOM 1227 HD12 LEU B 646 1.891 12.782 -6.801 1.00 0.00 H ATOM 1228 HD13 LEU B 646 2.117 12.347 -8.513 1.00 0.00 H ATOM 1229 H LEU B 646 4.303 8.327 -6.132 1.00 0.00 H ATOM 1230 N VAL B 647 3.656 10.825 -2.634 1.00 0.00 N ATOM 1231 CA VAL B 647 3.412 10.689 -1.202 1.00 0.00 C ATOM 1232 C VAL B 647 1.949 10.383 -0.886 1.00 0.00 C ATOM 1233 O VAL B 647 1.611 10.059 0.250 1.00 0.00 O ATOM 1234 CB VAL B 647 3.831 11.961 -0.440 1.00 0.00 C ATOM 1235 CG1 VAL B 647 5.318 12.224 -0.606 1.00 0.00 C ATOM 1236 CG2 VAL B 647 3.015 13.158 -0.904 1.00 0.00 C ATOM 1237 HA VAL B 647 4.020 9.846 -0.873 1.00 0.00 H ATOM 1238 HB VAL B 647 3.632 11.804 0.620 1.00 0.00 H ATOM 1239 HG11 VAL B 647 5.881 11.377 -0.214 1.00 0.00 H ATOM 1240 HG12 VAL B 647 5.547 12.356 -1.664 1.00 0.00 H ATOM 1241 HG13 VAL B 647 5.589 13.127 -0.059 1.00 0.00 H ATOM 1242 HG21 VAL B 647 3.177 13.315 -1.970 1.00 0.00 H ATOM 1243 HG22 VAL B 647 1.957 12.968 -0.720 1.00 0.00 H ATOM 1244 HG23 VAL B 647 3.328 14.045 -0.353 1.00 0.00 H ATOM 1245 H VAL B 647 3.905 11.761 -3.013 1.00 0.00 H ATOM 1246 N GLU B 648 1.082 10.487 -1.887 1.00 0.00 N ATOM 1247 CA GLU B 648 -0.335 10.226 -1.687 1.00 0.00 C ATOM 1248 C GLU B 648 -0.652 8.745 -1.861 1.00 0.00 C ATOM 1249 O GLU B 648 -1.800 8.329 -1.696 1.00 0.00 O ATOM 1250 CB GLU B 648 -1.192 11.066 -2.640 1.00 0.00 C ATOM 1251 CG GLU B 648 -0.853 10.888 -4.111 1.00 0.00 C ATOM 1252 CD GLU B 648 -1.857 11.568 -5.021 1.00 0.00 C ATOM 1253 OE1 GLU B 648 -1.975 12.807 -4.962 1.00 0.00 O ATOM 1254 OE2 GLU B 648 -2.529 10.866 -5.807 1.00 0.00 O ATOM 1255 HA GLU B 648 -0.577 10.512 -0.663 1.00 0.00 H ATOM 1256 HB2 GLU B 648 -2.236 10.789 -2.494 1.00 0.00 H ATOM 1257 HB3 GLU B 648 -1.057 12.117 -2.384 1.00 0.00 H ATOM 1258 HG2 GLU B 648 0.133 11.313 -4.297 1.00 0.00 H ATOM 1259 HG3 GLU B 648 -0.837 9.823 -4.341 1.00 0.00 H ATOM 1260 H GLU B 648 1.423 10.760 -2.831 1.00 0.00 H ATOM 1261 N TYR B 649 0.364 7.955 -2.199 1.00 0.00 N ATOM 1262 CA TYR B 649 0.201 6.521 -2.340 1.00 0.00 C ATOM 1263 C TYR B 649 0.143 5.856 -0.970 1.00 0.00 C ATOM 1264 O TYR B 649 1.112 5.913 -0.208 1.00 0.00 O ATOM 1265 CB TYR B 649 1.359 5.937 -3.148 1.00 0.00 C ATOM 1266 CG TYR B 649 1.228 6.100 -4.648 1.00 0.00 C ATOM 1267 CD1 TYR B 649 0.869 7.317 -5.214 1.00 0.00 C ATOM 1268 CD2 TYR B 649 1.476 5.029 -5.499 1.00 0.00 C ATOM 1269 CE1 TYR B 649 0.758 7.461 -6.583 1.00 0.00 C ATOM 1270 CE2 TYR B 649 1.373 5.167 -6.869 1.00 0.00 C ATOM 1271 CZ TYR B 649 1.013 6.384 -7.406 1.00 0.00 C ATOM 1272 OH TYR B 649 0.917 6.526 -8.772 1.00 0.00 O ATOM 1273 HA TYR B 649 -0.735 6.329 -2.865 1.00 0.00 H ATOM 1274 HB3 TYR B 649 1.425 4.872 -2.926 1.00 0.00 H ATOM 1275 HB2 TYR B 649 2.278 6.431 -2.831 1.00 0.00 H ATOM 1276 HD2 TYR B 649 1.757 4.064 -5.077 1.00 0.00 H ATOM 1277 HE2 TYR B 649 1.575 4.318 -7.522 1.00 0.00 H ATOM 1278 HE1 TYR B 649 0.470 8.421 -7.011 1.00 0.00 H ATOM 1279 HD1 TYR B 649 0.672 8.172 -4.567 1.00 0.00 H ATOM 1280 HH TYR B 649 0.650 7.455 -8.988 1.00 0.00 H ATOM 1281 H TYR B 649 1.300 8.377 -2.366 1.00 0.00 H ATOM 1282 N PRO B 650 -0.991 5.225 -0.633 1.00 0.00 N ATOM 1283 CA PRO B 650 -1.152 4.531 0.632 1.00 0.00 C ATOM 1284 C PRO B 650 -0.545 3.136 0.588 1.00 0.00 C ATOM 1285 O PRO B 650 -1.059 2.246 -0.081 1.00 0.00 O ATOM 1286 CB PRO B 650 -2.672 4.454 0.824 1.00 0.00 C ATOM 1287 CG PRO B 650 -3.293 5.013 -0.420 1.00 0.00 C ATOM 1288 CD PRO B 650 -2.204 5.126 -1.448 1.00 0.00 C ATOM 1289 HA PRO B 650 -0.645 5.046 1.448 1.00 0.00 H ATOM 1290 HD3 PRO B 650 -2.176 4.244 -2.088 1.00 0.00 H ATOM 1291 HD2 PRO B 650 -2.337 6.016 -2.064 1.00 0.00 H ATOM 1292 HG3 PRO B 650 -3.718 5.996 -0.216 1.00 0.00 H ATOM 1293 HG2 PRO B 650 -4.077 4.346 -0.778 1.00 0.00 H ATOM 1294 HB2 PRO B 650 -2.981 3.418 0.966 1.00 0.00 H ATOM 1295 HB3 PRO B 650 -2.972 5.043 1.691 1.00 0.00 H ATOM 1296 N PHE B 651 0.545 2.953 1.310 1.00 0.00 N ATOM 1297 CA PHE B 651 1.262 1.692 1.309 1.00 0.00 C ATOM 1298 C PHE B 651 0.756 0.770 2.403 1.00 0.00 C ATOM 1299 O PHE B 651 0.797 1.104 3.588 1.00 0.00 O ATOM 1300 CB PHE B 651 2.763 1.921 1.493 1.00 0.00 C ATOM 1301 CG PHE B 651 3.466 2.375 0.248 1.00 0.00 C ATOM 1302 CD1 PHE B 651 3.496 3.713 -0.101 1.00 0.00 C ATOM 1303 CD2 PHE B 651 4.104 1.457 -0.570 1.00 0.00 C ATOM 1304 CE1 PHE B 651 4.148 4.129 -1.245 1.00 0.00 C ATOM 1305 CE2 PHE B 651 4.756 1.866 -1.716 1.00 0.00 C ATOM 1306 CZ PHE B 651 4.779 3.204 -2.054 1.00 0.00 C ATOM 1307 HA PHE B 651 1.086 1.220 0.343 1.00 0.00 H ATOM 1308 HB2 PHE B 651 2.903 2.680 2.263 1.00 0.00 H ATOM 1309 HB3 PHE B 651 3.216 0.985 1.821 1.00 0.00 H ATOM 1310 HD2 PHE B 651 4.091 0.400 -0.306 1.00 0.00 H ATOM 1311 HE2 PHE B 651 5.252 1.133 -2.353 1.00 0.00 H ATOM 1312 HZ PHE B 651 5.294 3.530 -2.958 1.00 0.00 H ATOM 1313 HE1 PHE B 651 4.165 5.186 -1.509 1.00 0.00 H ATOM 1314 HD1 PHE B 651 3.000 4.447 0.534 1.00 0.00 H ATOM 1315 H PHE B 651 0.900 3.735 1.896 1.00 0.00 H ATOM 1316 N PHE B 652 0.265 -0.384 1.996 1.00 0.00 N ATOM 1317 CA PHE B 652 -0.062 -1.431 2.937 1.00 0.00 C ATOM 1318 C PHE B 652 1.228 -1.996 3.503 1.00 0.00 C ATOM 1319 O PHE B 652 2.129 -2.357 2.751 1.00 0.00 O ATOM 1320 CB PHE B 652 -0.872 -2.530 2.254 1.00 0.00 C ATOM 1321 CG PHE B 652 -2.246 -2.680 2.829 1.00 0.00 C ATOM 1322 CD1 PHE B 652 -2.418 -3.163 4.113 1.00 0.00 C ATOM 1323 CD2 PHE B 652 -3.363 -2.330 2.094 1.00 0.00 C ATOM 1324 CE1 PHE B 652 -3.679 -3.294 4.653 1.00 0.00 C ATOM 1325 CE2 PHE B 652 -4.628 -2.461 2.631 1.00 0.00 C ATOM 1326 CZ PHE B 652 -4.786 -2.943 3.912 1.00 0.00 C ATOM 1327 HA PHE B 652 -0.669 -1.022 3.744 1.00 0.00 H ATOM 1328 HB2 PHE B 652 -0.962 -2.290 1.195 1.00 0.00 H ATOM 1329 HB3 PHE B 652 -0.342 -3.476 2.367 1.00 0.00 H ATOM 1330 HD2 PHE B 652 -3.244 -1.947 1.081 1.00 0.00 H ATOM 1331 HE2 PHE B 652 -5.502 -2.183 2.042 1.00 0.00 H ATOM 1332 HZ PHE B 652 -5.784 -3.046 4.338 1.00 0.00 H ATOM 1333 HE1 PHE B 652 -3.801 -3.675 5.667 1.00 0.00 H ATOM 1334 HD1 PHE B 652 -1.547 -3.443 4.705 1.00 0.00 H ATOM 1335 H PHE B 652 0.110 -0.544 0.980 1.00 0.00 H ATOM 1336 N VAL B 653 1.342 -2.043 4.816 1.00 0.00 N ATOM 1337 CA VAL B 653 2.588 -2.456 5.428 1.00 0.00 C ATOM 1338 C VAL B 653 2.430 -3.809 6.146 1.00 0.00 C ATOM 1339 O VAL B 653 1.670 -3.927 7.107 1.00 0.00 O ATOM 1340 CB VAL B 653 3.123 -1.380 6.399 1.00 0.00 C ATOM 1341 CG1 VAL B 653 4.622 -1.470 6.503 1.00 0.00 C ATOM 1342 CG2 VAL B 653 2.745 0.023 5.958 1.00 0.00 C ATOM 1343 HA VAL B 653 3.320 -2.578 4.630 1.00 0.00 H ATOM 1344 HB VAL B 653 2.665 -1.572 7.370 1.00 0.00 H ATOM 1345 HG11 VAL B 653 4.901 -2.456 6.875 1.00 0.00 H ATOM 1346 HG12 VAL B 653 5.063 -1.313 5.519 1.00 0.00 H ATOM 1347 HG13 VAL B 653 4.984 -0.706 7.191 1.00 0.00 H ATOM 1348 HG21 VAL B 653 3.163 0.217 4.970 1.00 0.00 H ATOM 1349 HG22 VAL B 653 1.659 0.110 5.918 1.00 0.00 H ATOM 1350 HG23 VAL B 653 3.142 0.746 6.671 1.00 0.00 H ATOM 1351 H VAL B 653 0.533 -1.782 5.415 1.00 0.00 H ATOM 1352 N PHE B 654 3.230 -4.785 5.687 1.00 0.00 N ATOM 1353 CA PHE B 654 3.096 -6.226 5.997 1.00 0.00 C ATOM 1354 C PHE B 654 2.616 -6.545 7.418 1.00 0.00 C ATOM 1355 O PHE B 654 1.548 -7.116 7.594 1.00 0.00 O ATOM 1356 CB PHE B 654 4.437 -6.915 5.727 1.00 0.00 C ATOM 1357 CG PHE B 654 4.444 -8.388 6.026 1.00 0.00 C ATOM 1358 CD1 PHE B 654 3.657 -9.260 5.295 1.00 0.00 C ATOM 1359 CD2 PHE B 654 5.239 -8.898 7.040 1.00 0.00 C ATOM 1360 CE1 PHE B 654 3.661 -10.615 5.568 1.00 0.00 C ATOM 1361 CE2 PHE B 654 5.248 -10.251 7.318 1.00 0.00 C ATOM 1362 CZ PHE B 654 4.457 -11.111 6.582 1.00 0.00 C ATOM 1363 HA PHE B 654 2.309 -6.606 5.345 1.00 0.00 H ATOM 1364 HB2 PHE B 654 4.686 -6.778 4.675 1.00 0.00 H ATOM 1365 HB3 PHE B 654 5.198 -6.437 6.344 1.00 0.00 H ATOM 1366 HD2 PHE B 654 5.864 -8.224 7.625 1.00 0.00 H ATOM 1367 HE2 PHE B 654 5.879 -10.639 8.118 1.00 0.00 H ATOM 1368 HZ PHE B 654 4.461 -12.179 6.801 1.00 0.00 H ATOM 1369 HE1 PHE B 654 3.037 -11.291 4.984 1.00 0.00 H ATOM 1370 HD1 PHE B 654 3.026 -8.874 4.494 1.00 0.00 H ATOM 1371 H PHE B 654 4.011 -4.504 5.060 1.00 0.00 H ATOM 1372 N GLY B 655 3.408 -6.225 8.418 1.00 0.00 N ATOM 1373 CA GLY B 655 2.982 -6.441 9.786 1.00 0.00 C ATOM 1374 C GLY B 655 3.007 -5.148 10.552 1.00 0.00 C ATOM 1375 O GLY B 655 3.226 -5.122 11.763 1.00 0.00 O ATOM 1376 HA3 GLY B 655 3.653 -7.155 10.263 1.00 0.00 H ATOM 1377 HA2 GLY B 655 1.968 -6.841 9.788 1.00 0.00 H ATOM 1378 H GLY B 655 4.344 -5.815 8.226 1.00 0.00 H ATOM 1379 N GLN B 656 2.775 -4.069 9.830 1.00 0.00 N ATOM 1380 CA GLN B 656 2.981 -2.741 10.366 1.00 0.00 C ATOM 1381 C GLN B 656 1.701 -1.897 10.292 1.00 0.00 C ATOM 1382 O GLN B 656 1.510 -0.995 11.106 1.00 0.00 O ATOM 1383 CB GLN B 656 4.137 -2.068 9.623 1.00 0.00 C ATOM 1384 CG GLN B 656 5.510 -2.691 9.871 1.00 0.00 C ATOM 1385 CD GLN B 656 5.788 -3.960 9.073 1.00 0.00 C ATOM 1386 OE1 GLN B 656 6.526 -4.834 9.513 1.00 0.00 O ATOM 1387 NE2 GLN B 656 5.200 -4.063 7.895 1.00 0.00 N ATOM 1388 HA GLN B 656 3.239 -2.825 11.422 1.00 0.00 H ATOM 1389 HB2 GLN B 656 3.929 -2.120 8.554 1.00 0.00 H ATOM 1390 HB3 GLN B 656 4.177 -1.024 9.933 1.00 0.00 H ATOM 1391 HG2 GLN B 656 6.270 -1.953 9.612 1.00 0.00 H ATOM 1392 HG3 GLN B 656 5.587 -2.933 10.931 1.00 0.00 H ATOM 1393 HE22 GLN B 656 4.580 -3.300 7.555 1.00 0.00 H ATOM 1394 HE21 GLN B 656 5.357 -4.907 7.308 1.00 0.00 H ATOM 1395 H GLN B 656 2.436 -4.175 8.853 1.00 0.00 H ATOM 1396 N GLY B 657 0.825 -2.177 9.320 1.00 0.00 N ATOM 1397 CA GLY B 657 -0.484 -1.535 9.319 1.00 0.00 C ATOM 1398 C GLY B 657 -0.912 -0.960 7.975 1.00 0.00 C ATOM 1399 O GLY B 657 -0.263 -1.184 6.952 1.00 0.00 O ATOM 1400 HA3 GLY B 657 -0.464 -0.722 10.045 1.00 0.00 H ATOM 1401 HA2 GLY B 657 -1.225 -2.274 9.623 1.00 0.00 H ATOM 1402 H GLY B 657 1.077 -2.850 8.568 1.00 0.00 H ATOM 1403 N TRP B 658 -2.027 -0.224 7.997 1.00 0.00 N ATOM 1404 CA TRP B 658 -2.576 0.436 6.809 1.00 0.00 C ATOM 1405 C TRP B 658 -2.063 1.880 6.770 1.00 0.00 C ATOM 1406 O TRP B 658 -2.580 2.750 7.475 1.00 0.00 O ATOM 1407 CB TRP B 658 -4.120 0.392 6.875 1.00 0.00 C ATOM 1408 CG TRP B 658 -4.865 0.808 5.633 1.00 0.00 C ATOM 1409 CD1 TRP B 658 -6.199 1.099 5.580 1.00 0.00 C ATOM 1410 CD2 TRP B 658 -4.371 0.969 4.286 1.00 0.00 C ATOM 1411 NE1 TRP B 658 -6.570 1.420 4.302 1.00 0.00 N ATOM 1412 CE2 TRP B 658 -5.473 1.355 3.491 1.00 0.00 C ATOM 1413 CE3 TRP B 658 -3.122 0.831 3.666 1.00 0.00 C ATOM 1414 CZ2 TRP B 658 -5.362 1.596 2.127 1.00 0.00 C ATOM 1415 CZ3 TRP B 658 -3.021 1.075 2.310 1.00 0.00 C ATOM 1416 CH2 TRP B 658 -4.133 1.453 1.556 1.00 0.00 C ATOM 1417 HA TRP B 658 -2.258 -0.073 5.899 1.00 0.00 H ATOM 1418 HB2 TRP B 658 -4.411 -0.632 7.107 1.00 0.00 H ATOM 1419 HB3 TRP B 658 -4.435 1.050 7.685 1.00 0.00 H ATOM 1420 HE1 TRP B 658 -7.532 1.673 3.998 1.00 0.00 H ATOM 1421 HD1 TRP B 658 -6.874 1.078 6.436 1.00 0.00 H ATOM 1422 HZ2 TRP B 658 -6.228 1.889 1.534 1.00 0.00 H ATOM 1423 HH2 TRP B 658 -4.016 1.638 0.488 1.00 0.00 H ATOM 1424 HZ3 TRP B 658 -2.053 0.970 1.819 1.00 0.00 H ATOM 1425 HE3 TRP B 658 -2.246 0.536 4.243 1.00 0.00 H ATOM 1426 H TRP B 658 -2.530 -0.114 8.901 1.00 0.00 H ATOM 1427 N SER B 659 -1.047 2.134 5.951 1.00 0.00 N ATOM 1428 CA SER B 659 -0.292 3.374 6.047 1.00 0.00 C ATOM 1429 C SER B 659 -0.172 4.091 4.704 1.00 0.00 C ATOM 1430 O SER B 659 -0.558 3.565 3.670 1.00 0.00 O ATOM 1431 CB SER B 659 1.098 3.074 6.607 1.00 0.00 C ATOM 1432 OG SER B 659 1.001 2.459 7.880 1.00 0.00 O ATOM 1433 HA SER B 659 -0.834 4.043 6.716 1.00 0.00 H ATOM 1434 HB2 SER B 659 1.656 4.006 6.701 1.00 0.00 H ATOM 1435 HB3 SER B 659 1.623 2.405 5.925 1.00 0.00 H ATOM 1436 HG SER B 659 1.910 2.273 8.225 1.00 0.00 H ATOM 1437 H SER B 659 -0.787 1.433 5.228 1.00 0.00 H ATOM 1438 N SER B 660 0.315 5.323 4.757 1.00 0.00 N ATOM 1439 CA SER B 660 0.613 6.107 3.574 1.00 0.00 C ATOM 1440 C SER B 660 1.787 7.023 3.864 1.00 0.00 C ATOM 1441 O SER B 660 2.032 7.384 5.017 1.00 0.00 O ATOM 1442 CB SER B 660 -0.602 6.939 3.161 1.00 0.00 C ATOM 1443 OG SER B 660 -0.296 7.783 2.065 1.00 0.00 O ATOM 1444 HA SER B 660 0.864 5.433 2.755 1.00 0.00 H ATOM 1445 HB2 SER B 660 -0.917 7.552 4.005 1.00 0.00 H ATOM 1446 HB3 SER B 660 -1.413 6.268 2.878 1.00 0.00 H ATOM 1447 HG SER B 660 -1.099 8.308 1.820 1.00 0.00 H ATOM 1448 H SER B 660 0.491 5.747 5.690 1.00 0.00 H ATOM 1449 N CYS B 661 2.511 7.391 2.815 1.00 0.00 N ATOM 1450 CA CYS B 661 3.656 8.280 2.939 1.00 0.00 C ATOM 1451 C CYS B 661 3.200 9.668 3.361 1.00 0.00 C ATOM 1452 O CYS B 661 4.003 10.498 3.789 1.00 0.00 O ATOM 1453 CB CYS B 661 4.411 8.355 1.613 1.00 0.00 C ATOM 1454 SG CYS B 661 4.946 6.748 0.984 1.00 0.00 S ATOM 1455 HA CYS B 661 4.326 7.884 3.702 1.00 0.00 H ATOM 1456 HB2 CYS B 661 5.293 8.979 1.755 1.00 0.00 H ATOM 1457 HB3 CYS B 661 3.758 8.814 0.871 1.00 0.00 H ATOM 1458 HG CYS B 661 5.615 6.923 -0.211 1.00 0.00 H ATOM 1459 H CYS B 661 2.252 7.032 1.874 1.00 0.00 H ATOM 1460 N CYS B 662 1.903 9.911 3.243 1.00 0.00 N ATOM 1461 CA CYS B 662 1.321 11.165 3.662 1.00 0.00 C ATOM 1462 C CYS B 662 -0.162 10.966 3.923 1.00 0.00 C ATOM 1463 O CYS B 662 -0.999 11.215 3.050 1.00 0.00 O ATOM 1464 CB CYS B 662 1.541 12.253 2.608 1.00 0.00 C ATOM 1465 SG CYS B 662 1.049 13.909 3.144 1.00 0.00 S ATOM 1466 HA CYS B 662 1.810 11.493 4.579 1.00 0.00 H ATOM 1467 HB2 CYS B 662 0.962 11.994 1.722 1.00 0.00 H ATOM 1468 HB3 CYS B 662 2.601 12.275 2.355 1.00 0.00 H ATOM 1469 HG CYS B 662 1.287 14.810 2.126 1.00 0.00 H ATOM 1470 H CYS B 662 1.286 9.178 2.837 1.00 0.00 H ATOM 1471 N PRO B 663 -0.502 10.492 5.133 1.00 0.00 N ATOM 1472 CA PRO B 663 -1.889 10.231 5.523 1.00 0.00 C ATOM 1473 C PRO B 663 -2.760 11.463 5.380 1.00 0.00 C ATOM 1474 O PRO B 663 -3.949 11.362 5.086 1.00 0.00 O ATOM 1475 CB PRO B 663 -1.780 9.831 6.992 1.00 0.00 C ATOM 1476 CG PRO B 663 -0.388 9.330 7.143 1.00 0.00 C ATOM 1477 CD PRO B 663 0.442 10.166 6.217 1.00 0.00 C ATOM 1478 HA PRO B 663 -2.352 9.470 4.895 1.00 0.00 H ATOM 1479 HD3 PRO B 663 0.796 11.069 6.714 1.00 0.00 H ATOM 1480 HD2 PRO B 663 1.295 9.603 5.838 1.00 0.00 H ATOM 1481 HG3 PRO B 663 -0.329 8.278 6.863 1.00 0.00 H ATOM 1482 HG2 PRO B 663 -0.049 9.450 8.172 1.00 0.00 H ATOM 1483 HB2 PRO B 663 -1.952 10.691 7.639 1.00 0.00 H ATOM 1484 HB3 PRO B 663 -2.499 9.048 7.232 1.00 0.00 H ATOM 1485 N GLU B 664 -2.152 12.622 5.578 1.00 0.00 N ATOM 1486 CA GLU B 664 -2.823 13.876 5.424 1.00 0.00 C ATOM 1487 C GLU B 664 -3.385 13.998 4.014 1.00 0.00 C ATOM 1488 O GLU B 664 -4.575 14.215 3.831 1.00 0.00 O ATOM 1489 CB GLU B 664 -1.821 14.986 5.689 1.00 0.00 C ATOM 1490 CG GLU B 664 -2.422 16.357 5.623 1.00 0.00 C ATOM 1491 CD GLU B 664 -3.211 16.711 6.865 1.00 0.00 C ATOM 1492 OE1 GLU B 664 -4.370 16.259 6.997 1.00 0.00 O ATOM 1493 OE2 GLU B 664 -2.670 17.438 7.721 1.00 0.00 O ATOM 1494 HA GLU B 664 -3.653 13.948 6.127 1.00 0.00 H ATOM 1495 HB2 GLU B 664 -1.399 14.841 6.683 1.00 0.00 H ATOM 1496 HB3 GLU B 664 -1.027 14.920 4.945 1.00 0.00 H ATOM 1497 HG2 GLU B 664 -1.619 17.084 5.501 1.00 0.00 H ATOM 1498 HG3 GLU B 664 -3.088 16.405 4.761 1.00 0.00 H ATOM 1499 H GLU B 664 -1.150 12.621 5.856 1.00 0.00 H ATOM 1500 N ARG B 665 -2.519 13.806 3.026 1.00 0.00 N ATOM 1501 CA ARG B 665 -2.889 13.965 1.626 1.00 0.00 C ATOM 1502 C ARG B 665 -3.825 12.845 1.167 1.00 0.00 C ATOM 1503 O ARG B 665 -4.805 13.106 0.470 1.00 0.00 O ATOM 1504 CB ARG B 665 -1.621 14.011 0.765 1.00 0.00 C ATOM 1505 CG ARG B 665 -1.876 14.210 -0.719 1.00 0.00 C ATOM 1506 CD ARG B 665 -0.578 14.460 -1.471 1.00 0.00 C ATOM 1507 NE ARG B 665 -0.753 14.380 -2.921 1.00 0.00 N ATOM 1508 CZ ARG B 665 -0.010 15.039 -3.810 1.00 0.00 C ATOM 1509 NH1 ARG B 665 0.944 15.875 -3.413 1.00 0.00 N ATOM 1510 NH2 ARG B 665 -0.226 14.855 -5.103 1.00 0.00 N ATOM 1511 HA ARG B 665 -3.432 14.903 1.511 1.00 0.00 H ATOM 1512 HB2 ARG B 665 -0.999 14.834 1.118 1.00 0.00 H ATOM 1513 HB3 ARG B 665 -1.086 13.071 0.896 1.00 0.00 H ATOM 1514 HG2 ARG B 665 -2.354 13.317 -1.121 1.00 0.00 H ATOM 1515 HG3 ARG B 665 -2.537 15.066 -0.855 1.00 0.00 H ATOM 1516 HD2 ARG B 665 0.155 13.714 -1.164 1.00 0.00 H ATOM 1517 HD3 ARG B 665 -0.211 15.454 -1.216 1.00 0.00 H ATOM 1518 HE ARG B 665 -1.510 13.766 -3.284 1.00 0.00 H ATOM 1519 HH12 ARG B 665 1.516 16.383 -4.117 1.00 0.00 H ATOM 1520 HH11 ARG B 665 1.118 16.021 -2.398 1.00 0.00 H ATOM 1521 HH22 ARG B 665 0.349 15.365 -5.804 1.00 0.00 H ATOM 1522 HH21 ARG B 665 -0.970 14.201 -5.418 1.00 0.00 H ATOM 1523 H ARG B 665 -1.543 13.533 3.260 1.00 0.00 H ATOM 1524 N THR B 666 -3.544 11.606 1.569 1.00 0.00 N ATOM 1525 CA THR B 666 -4.406 10.487 1.209 1.00 0.00 C ATOM 1526 C THR B 666 -5.807 10.676 1.804 1.00 0.00 C ATOM 1527 O THR B 666 -6.811 10.440 1.134 1.00 0.00 O ATOM 1528 CB THR B 666 -3.801 9.137 1.666 1.00 0.00 C ATOM 1529 OG1 THR B 666 -2.456 9.034 1.176 1.00 0.00 O ATOM 1530 CG2 THR B 666 -4.612 7.943 1.156 1.00 0.00 C ATOM 1531 HA THR B 666 -4.486 10.465 0.122 1.00 0.00 H ATOM 1532 HB THR B 666 -3.820 9.114 2.756 1.00 0.00 H ATOM 1533 HG1 THR B 666 -2.065 8.172 1.466 1.00 0.00 H ATOM 1534 HG23 THR B 666 -5.635 8.016 1.525 1.00 0.00 H ATOM 1535 HG21 THR B 666 -4.617 7.947 0.066 1.00 0.00 H ATOM 1536 HG22 THR B 666 -4.160 7.018 1.515 1.00 0.00 H ATOM 1537 H THR B 666 -2.697 11.435 2.148 1.00 0.00 H ATOM 1538 N SER B 667 -5.874 11.148 3.046 1.00 0.00 N ATOM 1539 CA SER B 667 -7.160 11.397 3.686 1.00 0.00 C ATOM 1540 C SER B 667 -7.798 12.674 3.138 1.00 0.00 C ATOM 1541 O SER B 667 -9.016 12.779 3.048 1.00 0.00 O ATOM 1542 CB SER B 667 -6.996 11.492 5.203 1.00 0.00 C ATOM 1543 OG SER B 667 -8.252 11.494 5.867 1.00 0.00 O ATOM 1544 HA SER B 667 -7.820 10.559 3.461 1.00 0.00 H ATOM 1545 HB2 SER B 667 -6.467 12.414 5.445 1.00 0.00 H ATOM 1546 HB3 SER B 667 -6.414 10.638 5.550 1.00 0.00 H ATOM 1547 HG SER B 667 -8.785 12.270 5.561 1.00 0.00 H ATOM 1548 H SER B 667 -4.996 11.342 3.568 1.00 0.00 H ATOM 1549 N GLN B 668 -6.976 13.650 2.785 1.00 0.00 N ATOM 1550 CA GLN B 668 -7.459 14.884 2.204 1.00 0.00 C ATOM 1551 C GLN B 668 -8.120 14.688 0.851 1.00 0.00 C ATOM 1552 O GLN B 668 -9.244 15.133 0.625 1.00 0.00 O ATOM 1553 CB GLN B 668 -6.309 15.836 2.061 1.00 0.00 C ATOM 1554 CG GLN B 668 -6.319 16.875 3.141 1.00 0.00 C ATOM 1555 CD GLN B 668 -7.618 17.663 3.189 1.00 0.00 C ATOM 1556 OE1 GLN B 668 -7.761 18.686 2.519 1.00 0.00 O ATOM 1557 NE2 GLN B 668 -8.570 17.202 3.986 1.00 0.00 N ATOM 1558 HA GLN B 668 -8.221 15.282 2.874 1.00 0.00 H ATOM 1559 HB2 GLN B 668 -5.376 15.276 2.117 1.00 0.00 H ATOM 1560 HB3 GLN B 668 -6.377 16.331 1.092 1.00 0.00 H ATOM 1561 HG2 GLN B 668 -6.176 16.380 4.102 1.00 0.00 H ATOM 1562 HG3 GLN B 668 -5.497 17.569 2.965 1.00 0.00 H ATOM 1563 HE22 GLN B 668 -8.412 16.334 4.537 1.00 0.00 H ATOM 1564 HE21 GLN B 668 -9.475 17.708 4.061 1.00 0.00 H ATOM 1565 H GLN B 668 -5.954 13.526 2.929 1.00 0.00 H ATOM 1566 N LEU B 669 -7.424 14.014 -0.044 1.00 0.00 N ATOM 1567 CA LEU B 669 -7.865 13.926 -1.422 1.00 0.00 C ATOM 1568 C LEU B 669 -8.796 12.742 -1.632 1.00 0.00 C ATOM 1569 O LEU B 669 -9.742 12.817 -2.409 1.00 0.00 O ATOM 1570 CB LEU B 669 -6.656 13.811 -2.347 1.00 0.00 C ATOM 1571 CG LEU B 669 -5.511 14.784 -2.044 1.00 0.00 C ATOM 1572 CD1 LEU B 669 -4.422 14.664 -3.094 1.00 0.00 C ATOM 1573 CD2 LEU B 669 -6.011 16.220 -1.946 1.00 0.00 C ATOM 1574 HA LEU B 669 -8.419 14.834 -1.659 1.00 0.00 H ATOM 1575 HB2 LEU B 669 -6.266 12.796 -2.270 1.00 0.00 H ATOM 1576 HB3 LEU B 669 -6.993 13.993 -3.368 1.00 0.00 H ATOM 1577 HG LEU B 669 -5.091 14.516 -1.075 1.00 0.00 H ATOM 1578 HD21 LEU B 669 -6.470 16.509 -2.892 1.00 0.00 H ATOM 1579 HD22 LEU B 669 -6.748 16.293 -1.146 1.00 0.00 H ATOM 1580 HD23 LEU B 669 -5.172 16.882 -1.730 1.00 0.00 H ATOM 1581 HD11 LEU B 669 -4.032 13.646 -3.097 1.00 0.00 H ATOM 1582 HD12 LEU B 669 -4.837 14.898 -4.074 1.00 0.00 H ATOM 1583 HD13 LEU B 669 -3.617 15.362 -2.863 1.00 0.00 H ATOM 1584 H LEU B 669 -6.545 13.538 0.243 1.00 0.00 H ATOM 1585 N PHE B 670 -8.522 11.654 -0.933 1.00 0.00 N ATOM 1586 CA PHE B 670 -9.266 10.418 -1.131 1.00 0.00 C ATOM 1587 C PHE B 670 -10.185 10.132 0.050 1.00 0.00 C ATOM 1588 O PHE B 670 -10.873 9.109 0.079 1.00 0.00 O ATOM 1589 CB PHE B 670 -8.285 9.263 -1.326 1.00 0.00 C ATOM 1590 CG PHE B 670 -7.213 9.570 -2.334 1.00 0.00 C ATOM 1591 CD1 PHE B 670 -7.543 9.911 -3.635 1.00 0.00 C ATOM 1592 CD2 PHE B 670 -5.877 9.515 -1.979 1.00 0.00 C ATOM 1593 CE1 PHE B 670 -6.560 10.193 -4.562 1.00 0.00 C ATOM 1594 CE2 PHE B 670 -4.889 9.796 -2.902 1.00 0.00 C ATOM 1595 CZ PHE B 670 -5.231 10.135 -4.195 1.00 0.00 C ATOM 1596 HA PHE B 670 -9.889 10.526 -2.019 1.00 0.00 H ATOM 1597 HB2 PHE B 670 -7.811 9.044 -0.369 1.00 0.00 H ATOM 1598 HB3 PHE B 670 -8.840 8.388 -1.664 1.00 0.00 H ATOM 1599 HD2 PHE B 670 -5.601 9.247 -0.959 1.00 0.00 H ATOM 1600 HE2 PHE B 670 -3.840 9.750 -2.609 1.00 0.00 H ATOM 1601 HZ PHE B 670 -4.453 10.357 -4.925 1.00 0.00 H ATOM 1602 HE1 PHE B 670 -6.833 10.461 -5.583 1.00 0.00 H ATOM 1603 HD1 PHE B 670 -8.591 9.957 -3.930 1.00 0.00 H ATOM 1604 H PHE B 670 -7.759 11.681 -0.227 1.00 0.00 H ATOM 1605 N ASP B 671 -10.176 11.045 1.024 1.00 0.00 N ATOM 1606 CA ASP B 671 -10.977 10.914 2.247 1.00 0.00 C ATOM 1607 C ASP B 671 -10.530 9.713 3.076 1.00 0.00 C ATOM 1608 O ASP B 671 -11.149 9.382 4.085 1.00 0.00 O ATOM 1609 CB ASP B 671 -12.470 10.789 1.925 1.00 0.00 C ATOM 1610 CG ASP B 671 -13.106 12.092 1.482 1.00 0.00 C ATOM 1611 OD1 ASP B 671 -12.702 12.638 0.434 1.00 0.00 O ATOM 1612 OD2 ASP B 671 -14.032 12.565 2.173 1.00 0.00 O ATOM 1613 HA ASP B 671 -10.819 11.822 2.830 1.00 0.00 H ATOM 1614 HB2 ASP B 671 -12.591 10.057 1.126 1.00 0.00 H ATOM 1615 HB3 ASP B 671 -12.987 10.439 2.818 1.00 0.00 H ATOM 1616 H ASP B 671 -9.575 11.886 0.911 1.00 0.00 H ATOM 1617 N LEU B 672 -9.426 9.100 2.681 1.00 0.00 N ATOM 1618 CA LEU B 672 -9.045 7.810 3.227 1.00 0.00 C ATOM 1619 C LEU B 672 -7.964 7.959 4.287 1.00 0.00 C ATOM 1620 O LEU B 672 -6.869 8.441 4.002 1.00 0.00 O ATOM 1621 CB LEU B 672 -8.564 6.879 2.108 1.00 0.00 C ATOM 1622 CG LEU B 672 -8.231 5.460 2.568 1.00 0.00 C ATOM 1623 CD1 LEU B 672 -9.502 4.732 2.980 1.00 0.00 C ATOM 1624 CD2 LEU B 672 -7.497 4.689 1.480 1.00 0.00 C ATOM 1625 HA LEU B 672 -9.924 7.372 3.699 1.00 0.00 H ATOM 1626 HB2 LEU B 672 -9.349 6.818 1.354 1.00 0.00 H ATOM 1627 HB3 LEU B 672 -7.668 7.313 1.664 1.00 0.00 H ATOM 1628 HG LEU B 672 -7.569 5.526 3.432 1.00 0.00 H ATOM 1629 HD21 LEU B 672 -8.126 4.630 0.592 1.00 0.00 H ATOM 1630 HD22 LEU B 672 -6.568 5.204 1.235 1.00 0.00 H ATOM 1631 HD23 LEU B 672 -7.274 3.683 1.837 1.00 0.00 H ATOM 1632 HD11 LEU B 672 -9.979 5.271 3.798 1.00 0.00 H ATOM 1633 HD12 LEU B 672 -10.183 4.683 2.130 1.00 0.00 H ATOM 1634 HD13 LEU B 672 -9.252 3.722 3.306 1.00 0.00 H ATOM 1635 H LEU B 672 -8.820 9.551 1.966 1.00 0.00 H ATOM 1636 N PRO B 673 -8.258 7.541 5.525 1.00 0.00 N ATOM 1637 CA PRO B 673 -7.310 7.647 6.628 1.00 0.00 C ATOM 1638 C PRO B 673 -6.165 6.653 6.486 1.00 0.00 C ATOM 1639 O PRO B 673 -6.344 5.541 5.981 1.00 0.00 O ATOM 1640 CB PRO B 673 -8.152 7.334 7.863 1.00 0.00 C ATOM 1641 CG PRO B 673 -9.280 6.499 7.364 1.00 0.00 C ATOM 1642 CD PRO B 673 -9.523 6.913 5.938 1.00 0.00 C ATOM 1643 HA PRO B 673 -6.836 8.628 6.671 1.00 0.00 H ATOM 1644 HD3 PRO B 673 -9.746 6.046 5.316 1.00 0.00 H ATOM 1645 HD2 PRO B 673 -10.347 7.624 5.876 1.00 0.00 H ATOM 1646 HG3 PRO B 673 -10.173 6.675 7.964 1.00 0.00 H ATOM 1647 HG2 PRO B 673 -9.015 5.443 7.409 1.00 0.00 H ATOM 1648 HB2 PRO B 673 -7.564 6.784 8.598 1.00 0.00 H ATOM 1649 HB3 PRO B 673 -8.526 8.253 8.314 1.00 0.00 H ATOM 1650 N CYS B 674 -4.990 7.065 6.923 1.00 0.00 N ATOM 1651 CA CYS B 674 -3.793 6.248 6.805 1.00 0.00 C ATOM 1652 C CYS B 674 -2.867 6.477 7.991 1.00 0.00 C ATOM 1653 O CYS B 674 -2.891 7.534 8.620 1.00 0.00 O ATOM 1654 CB CYS B 674 -3.075 6.582 5.491 1.00 0.00 C ATOM 1655 SG CYS B 674 -3.900 5.933 4.021 1.00 0.00 S ATOM 1656 HA CYS B 674 -4.079 5.196 6.801 1.00 0.00 H ATOM 1657 HB2 CYS B 674 -2.069 6.164 5.533 1.00 0.00 H ATOM 1658 HB3 CYS B 674 -3.013 7.666 5.400 1.00 0.00 H ATOM 1659 HG CYS B 674 -5.172 6.462 3.938 1.00 0.00 H ATOM 1660 H CYS B 674 -4.918 8.003 7.366 1.00 0.00 H ATOM 1661 N SER B 675 -2.082 5.465 8.308 1.00 0.00 N ATOM 1662 CA SER B 675 -1.028 5.589 9.300 1.00 0.00 C ATOM 1663 C SER B 675 0.224 6.085 8.592 1.00 0.00 C ATOM 1664 O SER B 675 0.304 6.004 7.373 1.00 0.00 O ATOM 1665 CB SER B 675 -0.782 4.235 9.969 1.00 0.00 C ATOM 1666 OG SER B 675 -1.994 3.688 10.473 1.00 0.00 O ATOM 1667 HA SER B 675 -1.311 6.296 10.080 1.00 0.00 H ATOM 1668 HB2 SER B 675 -0.080 4.366 10.793 1.00 0.00 H ATOM 1669 HB3 SER B 675 -0.357 3.548 9.237 1.00 0.00 H ATOM 1670 HG SER B 675 -2.633 3.563 9.728 1.00 0.00 H ATOM 1671 H SER B 675 -2.222 4.550 7.833 1.00 0.00 H ATOM 1672 N LYS B 676 1.183 6.630 9.316 1.00 0.00 N ATOM 1673 CA LYS B 676 2.365 7.168 8.664 1.00 0.00 C ATOM 1674 C LYS B 676 3.297 6.058 8.203 1.00 0.00 C ATOM 1675 O LYS B 676 3.777 5.256 9.006 1.00 0.00 O ATOM 1676 CB LYS B 676 3.121 8.133 9.571 1.00 0.00 C ATOM 1677 CG LYS B 676 4.323 8.769 8.891 1.00 0.00 C ATOM 1678 CD LYS B 676 3.915 9.542 7.644 1.00 0.00 C ATOM 1679 CE LYS B 676 5.100 10.242 6.999 1.00 0.00 C ATOM 1680 NZ LYS B 676 5.710 11.255 7.900 1.00 0.00 N ATOM 1681 HA LYS B 676 2.017 7.719 7.791 1.00 0.00 H ATOM 1682 HB2 LYS B 676 2.439 8.924 9.882 1.00 0.00 H ATOM 1683 HB3 LYS B 676 3.467 7.587 10.449 1.00 0.00 H ATOM 1684 HG2 LYS B 676 4.805 9.453 9.590 1.00 0.00 H ATOM 1685 HG3 LYS B 676 5.026 7.985 8.608 1.00 0.00 H ATOM 1686 HD2 LYS B 676 3.481 8.848 6.925 1.00 0.00 H ATOM 1687 HD3 LYS B 676 3.171 10.289 7.920 1.00 0.00 H ATOM 1688 HE2 LYS B 676 4.763 10.738 6.089 1.00 0.00 H ATOM 1689 HE3 LYS B 676 5.854 9.496 6.746 1.00 0.00 H ATOM 1690 HZ1 LYS B 676 5.000 11.975 8.141 1.00 0.00 H ATOM 1691 HZ2 LYS B 676 6.042 10.789 8.769 1.00 0.00 H ATOM 1692 HZ3 LYS B 676 6.514 11.706 7.418 1.00 0.00 H ATOM 1693 H LYS B 676 1.093 6.674 10.351 1.00 0.00 H ATOM 1694 N LEU B 677 3.532 6.016 6.902 1.00 0.00 N ATOM 1695 CA LEU B 677 4.503 5.107 6.325 1.00 0.00 C ATOM 1696 C LEU B 677 5.891 5.725 6.461 1.00 0.00 C ATOM 1697 O LEU B 677 6.213 6.714 5.794 1.00 0.00 O ATOM 1698 CB LEU B 677 4.137 4.818 4.852 1.00 0.00 C ATOM 1699 CG LEU B 677 4.991 3.773 4.111 1.00 0.00 C ATOM 1700 CD1 LEU B 677 6.336 4.340 3.678 1.00 0.00 C ATOM 1701 CD2 LEU B 677 5.188 2.542 4.976 1.00 0.00 C ATOM 1702 HA LEU B 677 4.499 4.153 6.852 1.00 0.00 H ATOM 1703 HB2 LEU B 677 3.103 4.473 4.832 1.00 0.00 H ATOM 1704 HB3 LEU B 677 4.216 5.756 4.303 1.00 0.00 H ATOM 1705 HG LEU B 677 4.451 3.490 3.207 1.00 0.00 H ATOM 1706 HD21 LEU B 677 5.694 2.825 5.899 1.00 0.00 H ATOM 1707 HD22 LEU B 677 4.217 2.106 5.211 1.00 0.00 H ATOM 1708 HD23 LEU B 677 5.794 1.814 4.437 1.00 0.00 H ATOM 1709 HD11 LEU B 677 6.174 5.185 3.009 1.00 0.00 H ATOM 1710 HD12 LEU B 677 6.889 4.672 4.557 1.00 0.00 H ATOM 1711 HD13 LEU B 677 6.904 3.568 3.159 1.00 0.00 H ATOM 1712 H LEU B 677 3.004 6.655 6.274 1.00 0.00 H ATOM 1713 N SER B 678 6.689 5.165 7.354 1.00 0.00 N ATOM 1714 CA SER B 678 8.021 5.680 7.620 1.00 0.00 C ATOM 1715 C SER B 678 9.071 4.580 7.515 1.00 0.00 C ATOM 1716 O SER B 678 8.745 3.399 7.386 1.00 0.00 O ATOM 1717 CB SER B 678 8.072 6.316 9.011 1.00 0.00 C ATOM 1718 OG SER B 678 7.088 7.330 9.152 1.00 0.00 O ATOM 1719 HA SER B 678 8.244 6.437 6.868 1.00 0.00 H ATOM 1720 HB2 SER B 678 9.058 6.754 9.165 1.00 0.00 H ATOM 1721 HB3 SER B 678 7.897 5.545 9.761 1.00 0.00 H ATOM 1722 HG SER B 678 7.146 7.721 10.060 1.00 0.00 H ATOM 1723 H SER B 678 6.354 4.333 7.880 1.00 0.00 H ATOM 1724 N VAL B 679 10.333 4.984 7.556 1.00 0.00 N ATOM 1725 CA VAL B 679 11.452 4.063 7.512 1.00 0.00 C ATOM 1726 C VAL B 679 11.377 3.030 8.642 1.00 0.00 C ATOM 1727 O VAL B 679 11.236 3.373 9.816 1.00 0.00 O ATOM 1728 CB VAL B 679 12.781 4.850 7.547 1.00 0.00 C ATOM 1729 CG1 VAL B 679 12.719 5.976 8.565 1.00 0.00 C ATOM 1730 CG2 VAL B 679 13.964 3.940 7.828 1.00 0.00 C ATOM 1731 HA VAL B 679 11.405 3.506 6.576 1.00 0.00 H ATOM 1732 HB VAL B 679 12.926 5.286 6.559 1.00 0.00 H ATOM 1733 HG11 VAL B 679 11.913 6.660 8.299 1.00 0.00 H ATOM 1734 HG12 VAL B 679 12.532 5.559 9.555 1.00 0.00 H ATOM 1735 HG13 VAL B 679 13.667 6.513 8.569 1.00 0.00 H ATOM 1736 HG21 VAL B 679 13.826 3.455 8.794 1.00 0.00 H ATOM 1737 HG22 VAL B 679 14.033 3.183 7.046 1.00 0.00 H ATOM 1738 HG23 VAL B 679 14.880 4.531 7.845 1.00 0.00 H ATOM 1739 H VAL B 679 10.528 6.003 7.622 1.00 0.00 H ATOM 1740 N GLY B 680 11.478 1.763 8.264 1.00 0.00 N ATOM 1741 CA GLY B 680 11.278 0.673 9.194 1.00 0.00 C ATOM 1742 C GLY B 680 10.024 -0.121 8.889 1.00 0.00 C ATOM 1743 O GLY B 680 9.884 -1.264 9.324 1.00 0.00 O ATOM 1744 HA3 GLY B 680 11.198 1.082 10.201 1.00 0.00 H ATOM 1745 HA2 GLY B 680 12.138 0.005 9.141 1.00 0.00 H ATOM 1746 H GLY B 680 11.707 1.547 7.273 1.00 0.00 H ATOM 1747 N ASP B 681 9.112 0.474 8.126 1.00 0.00 N ATOM 1748 CA ASP B 681 7.848 -0.184 7.819 1.00 0.00 C ATOM 1749 C ASP B 681 7.992 -1.108 6.614 1.00 0.00 C ATOM 1750 O ASP B 681 8.204 -0.661 5.491 1.00 0.00 O ATOM 1751 CB ASP B 681 6.726 0.835 7.565 1.00 0.00 C ATOM 1752 CG ASP B 681 6.288 1.569 8.820 1.00 0.00 C ATOM 1753 OD1 ASP B 681 5.733 0.918 9.731 1.00 0.00 O ATOM 1754 OD2 ASP B 681 6.464 2.802 8.900 1.00 0.00 O ATOM 1755 HA ASP B 681 7.577 -0.780 8.691 1.00 0.00 H ATOM 1756 HB2 ASP B 681 7.081 1.568 6.841 1.00 0.00 H ATOM 1757 HB3 ASP B 681 5.865 0.307 7.154 1.00 0.00 H ATOM 1758 H ASP B 681 9.303 1.422 7.743 1.00 0.00 H ATOM 1759 N VAL B 682 7.861 -2.405 6.848 1.00 0.00 N ATOM 1760 CA VAL B 682 7.989 -3.384 5.774 1.00 0.00 C ATOM 1761 C VAL B 682 6.779 -3.319 4.851 1.00 0.00 C ATOM 1762 O VAL B 682 5.714 -3.824 5.183 1.00 0.00 O ATOM 1763 CB VAL B 682 8.113 -4.818 6.333 1.00 0.00 C ATOM 1764 CG1 VAL B 682 8.209 -5.832 5.207 1.00 0.00 C ATOM 1765 CG2 VAL B 682 9.303 -4.940 7.266 1.00 0.00 C ATOM 1766 HA VAL B 682 8.895 -3.141 5.218 1.00 0.00 H ATOM 1767 HB VAL B 682 7.211 -5.030 6.907 1.00 0.00 H ATOM 1768 HG11 VAL B 682 7.313 -5.772 4.589 1.00 0.00 H ATOM 1769 HG12 VAL B 682 9.087 -5.615 4.599 1.00 0.00 H ATOM 1770 HG13 VAL B 682 8.295 -6.834 5.628 1.00 0.00 H ATOM 1771 HG21 VAL B 682 10.216 -4.697 6.722 1.00 0.00 H ATOM 1772 HG22 VAL B 682 9.181 -4.249 8.100 1.00 0.00 H ATOM 1773 HG23 VAL B 682 9.364 -5.961 7.643 1.00 0.00 H ATOM 1774 H VAL B 682 7.663 -2.732 7.815 1.00 0.00 H ATOM 1775 N CYS B 683 6.959 -2.752 3.676 1.00 0.00 N ATOM 1776 CA CYS B 683 5.841 -2.488 2.788 1.00 0.00 C ATOM 1777 C CYS B 683 5.449 -3.723 2.000 1.00 0.00 C ATOM 1778 O CYS B 683 6.296 -4.518 1.585 1.00 0.00 O ATOM 1779 CB CYS B 683 6.174 -1.332 1.850 1.00 0.00 C ATOM 1780 SG CYS B 683 6.415 0.238 2.712 1.00 0.00 S ATOM 1781 HA CYS B 683 4.985 -2.208 3.402 1.00 0.00 H ATOM 1782 HB2 CYS B 683 5.356 -1.215 1.139 1.00 0.00 H ATOM 1783 HB3 CYS B 683 7.090 -1.576 1.311 1.00 0.00 H ATOM 1784 HG CYS B 683 7.457 0.114 3.608 1.00 0.00 H ATOM 1785 H CYS B 683 7.920 -2.488 3.379 1.00 0.00 H ATOM 1786 N ILE B 684 4.149 -3.877 1.830 1.00 0.00 N ATOM 1787 CA ILE B 684 3.581 -4.982 1.091 1.00 0.00 C ATOM 1788 C ILE B 684 3.654 -4.724 -0.411 1.00 0.00 C ATOM 1789 O ILE B 684 2.989 -3.823 -0.922 1.00 0.00 O ATOM 1790 CB ILE B 684 2.099 -5.193 1.487 1.00 0.00 C ATOM 1791 CG1 ILE B 684 1.993 -5.809 2.879 1.00 0.00 C ATOM 1792 CG2 ILE B 684 1.360 -6.054 0.468 1.00 0.00 C ATOM 1793 CD1 ILE B 684 0.569 -5.902 3.386 1.00 0.00 C ATOM 1794 HA ILE B 684 4.159 -5.874 1.334 1.00 0.00 H ATOM 1795 HB ILE B 684 1.624 -4.212 1.501 1.00 0.00 H ATOM 1796 HG12 ILE B 684 2.415 -6.813 2.846 1.00 0.00 H ATOM 1797 HG13 ILE B 684 2.568 -5.197 3.573 1.00 0.00 H ATOM 1798 HD11 ILE B 684 0.136 -4.903 3.435 1.00 0.00 H ATOM 1799 HD12 ILE B 684 -0.017 -6.521 2.707 1.00 0.00 H ATOM 1800 HD13 ILE B 684 0.567 -6.349 4.380 1.00 0.00 H ATOM 1801 HG21 ILE B 684 1.389 -5.567 -0.507 1.00 0.00 H ATOM 1802 HG22 ILE B 684 1.841 -7.030 0.402 1.00 0.00 H ATOM 1803 HG23 ILE B 684 0.324 -6.178 0.783 1.00 0.00 H ATOM 1804 H ILE B 684 3.506 -3.173 2.246 1.00 0.00 H ATOM 1805 N SER B 685 4.475 -5.481 -1.113 1.00 0.00 N ATOM 1806 CA SER B 685 4.393 -5.499 -2.559 1.00 0.00 C ATOM 1807 C SER B 685 3.515 -6.662 -2.953 1.00 0.00 C ATOM 1808 O SER B 685 3.824 -7.811 -2.647 1.00 0.00 O ATOM 1809 CB SER B 685 5.771 -5.649 -3.201 1.00 0.00 C ATOM 1810 OG SER B 685 5.723 -5.409 -4.600 1.00 0.00 O ATOM 1811 HA SER B 685 3.977 -4.554 -2.909 1.00 0.00 H ATOM 1812 HB2 SER B 685 6.134 -6.662 -3.027 1.00 0.00 H ATOM 1813 HB3 SER B 685 6.455 -4.935 -2.742 1.00 0.00 H ATOM 1814 HG SER B 685 6.630 -5.514 -4.983 1.00 0.00 H ATOM 1815 H SER B 685 5.183 -6.067 -0.627 1.00 0.00 H ATOM 1816 N LEU B 686 2.414 -6.379 -3.604 1.00 0.00 N ATOM 1817 CA LEU B 686 1.493 -7.419 -3.949 1.00 0.00 C ATOM 1818 C LEU B 686 1.467 -7.625 -5.447 1.00 0.00 C ATOM 1819 O LEU B 686 1.342 -6.678 -6.216 1.00 0.00 O ATOM 1820 CB LEU B 686 0.116 -7.084 -3.403 1.00 0.00 C ATOM 1821 CG LEU B 686 -0.562 -8.245 -2.701 1.00 0.00 C ATOM 1822 CD1 LEU B 686 -1.525 -7.745 -1.650 1.00 0.00 C ATOM 1823 CD2 LEU B 686 -1.273 -9.121 -3.715 1.00 0.00 C ATOM 1824 HA LEU B 686 1.817 -8.357 -3.498 1.00 0.00 H ATOM 1825 HB2 LEU B 686 0.218 -6.264 -2.692 1.00 0.00 H ATOM 1826 HB3 LEU B 686 -0.516 -6.767 -4.233 1.00 0.00 H ATOM 1827 HG LEU B 686 0.198 -8.843 -2.199 1.00 0.00 H ATOM 1828 HD21 LEU B 686 -2.024 -8.531 -4.240 1.00 0.00 H ATOM 1829 HD22 LEU B 686 -0.548 -9.508 -4.431 1.00 0.00 H ATOM 1830 HD23 LEU B 686 -1.756 -9.951 -3.200 1.00 0.00 H ATOM 1831 HD11 LEU B 686 -0.981 -7.155 -0.912 1.00 0.00 H ATOM 1832 HD12 LEU B 686 -2.287 -7.125 -2.123 1.00 0.00 H ATOM 1833 HD13 LEU B 686 -1.999 -8.595 -1.160 1.00 0.00 H ATOM 1834 H LEU B 686 2.208 -5.395 -3.871 1.00 0.00 H ATOM 1835 N THR B 687 1.600 -8.865 -5.854 1.00 0.00 N ATOM 1836 CA THR B 687 1.680 -9.182 -7.254 1.00 0.00 C ATOM 1837 C THR B 687 0.332 -9.642 -7.785 1.00 0.00 C ATOM 1838 O THR B 687 -0.233 -10.629 -7.315 1.00 0.00 O ATOM 1839 CB THR B 687 2.726 -10.277 -7.494 1.00 0.00 C ATOM 1840 OG1 THR B 687 3.997 -9.861 -6.976 1.00 0.00 O ATOM 1841 CG2 THR B 687 2.851 -10.596 -8.969 1.00 0.00 C ATOM 1842 HA THR B 687 1.976 -8.277 -7.786 1.00 0.00 H ATOM 1843 HB THR B 687 2.400 -11.179 -6.975 1.00 0.00 H ATOM 1844 HG1 THR B 687 4.666 -10.573 -7.135 1.00 0.00 H ATOM 1845 HG23 THR B 687 1.881 -10.911 -9.355 1.00 0.00 H ATOM 1846 HG21 THR B 687 3.185 -9.707 -9.505 1.00 0.00 H ATOM 1847 HG22 THR B 687 3.576 -11.398 -9.106 1.00 0.00 H ATOM 1848 H THR B 687 1.648 -9.631 -5.152 1.00 0.00 H ATOM 1849 N LEU B 688 -0.182 -8.899 -8.748 1.00 0.00 N ATOM 1850 CA LEU B 688 -1.378 -9.292 -9.462 1.00 0.00 C ATOM 1851 C LEU B 688 -0.969 -9.927 -10.781 1.00 0.00 C ATOM 1852 O LEU B 688 -0.684 -9.223 -11.750 1.00 0.00 O ATOM 1853 CB LEU B 688 -2.263 -8.068 -9.728 1.00 0.00 C ATOM 1854 CG LEU B 688 -3.517 -7.923 -8.858 1.00 0.00 C ATOM 1855 CD1 LEU B 688 -4.533 -8.996 -9.207 1.00 0.00 C ATOM 1856 CD2 LEU B 688 -3.173 -7.970 -7.373 1.00 0.00 C ATOM 1857 HA LEU B 688 -1.945 -10.005 -8.863 1.00 0.00 H ATOM 1858 HB2 LEU B 688 -1.651 -7.179 -9.577 1.00 0.00 H ATOM 1859 HB3 LEU B 688 -2.586 -8.113 -10.768 1.00 0.00 H ATOM 1860 HG LEU B 688 -3.956 -6.947 -9.065 1.00 0.00 H ATOM 1861 HD21 LEU B 688 -2.699 -8.924 -7.141 1.00 0.00 H ATOM 1862 HD22 LEU B 688 -2.489 -7.155 -7.134 1.00 0.00 H ATOM 1863 HD23 LEU B 688 -4.086 -7.864 -6.786 1.00 0.00 H ATOM 1864 HD11 LEU B 688 -4.815 -8.900 -10.255 1.00 0.00 H ATOM 1865 HD12 LEU B 688 -4.094 -9.979 -9.036 1.00 0.00 H ATOM 1866 HD13 LEU B 688 -5.416 -8.877 -8.579 1.00 0.00 H ATOM 1867 H LEU B 688 0.286 -8.005 -9.001 1.00 0.00 H ATOM 1868 N LYS B 689 -0.921 -11.248 -10.814 1.00 0.00 N ATOM 1869 CA LYS B 689 -0.484 -11.965 -11.994 1.00 0.00 C ATOM 1870 C LYS B 689 -1.492 -11.825 -13.124 1.00 0.00 C ATOM 1871 O LYS B 689 -1.259 -10.999 -14.029 1.00 0.00 O ATOM 1872 CB LYS B 689 -0.254 -13.434 -11.659 1.00 0.00 C ATOM 1873 CG LYS B 689 1.095 -13.701 -11.011 1.00 0.00 C ATOM 1874 CD LYS B 689 2.252 -13.378 -11.950 1.00 0.00 C ATOM 1875 CE LYS B 689 2.242 -14.269 -13.182 1.00 0.00 C ATOM 1876 NZ LYS B 689 3.381 -13.974 -14.090 1.00 0.00 N ATOM 1877 HA LYS B 689 0.457 -11.530 -12.331 1.00 0.00 H ATOM 1878 OXT LYS B 689 -2.520 -12.532 -13.097 1.00 0.00 O ATOM 1879 HB2 LYS B 689 -1.037 -13.759 -10.974 1.00 0.00 H ATOM 1880 HB3 LYS B 689 -0.316 -14.013 -12.581 1.00 0.00 H ATOM 1881 HG2 LYS B 689 1.184 -13.085 -10.116 1.00 0.00 H ATOM 1882 HG3 LYS B 689 1.150 -14.753 -10.733 1.00 0.00 H ATOM 1883 HD2 LYS B 689 2.172 -12.338 -12.265 1.00 0.00 H ATOM 1884 HD3 LYS B 689 3.191 -13.523 -11.416 1.00 0.00 H ATOM 1885 HE2 LYS B 689 1.309 -14.111 -13.724 1.00 0.00 H ATOM 1886 HE3 LYS B 689 2.305 -15.310 -12.865 1.00 0.00 H ATOM 1887 HZ1 LYS B 689 3.325 -12.984 -14.403 1.00 0.00 H ATOM 1888 HZ2 LYS B 689 4.276 -14.129 -13.583 1.00 0.00 H ATOM 1889 HZ3 LYS B 689 3.336 -14.604 -14.917 1.00 0.00 H ATOM 1890 H LYS B 689 -1.204 -11.786 -9.970 1.00 0.00 H TER 1891 LYS B 689 HETATM 1892 N VAL A 1 -18.895 -4.760 -5.209 1.00 0.24 N HETATM 1893 CA VAL A 1 -17.586 -4.649 -4.522 1.00 0.07 C HETATM 1894 C VAL A 1 -16.478 -4.320 -5.501 1.00 0.23 C HETATM 1895 O VAL A 1 -16.687 -4.272 -6.712 1.00 -0.39 O HETATM 1896 N VAL A 1 -15.297 -4.096 -4.955 1.00 -0.26 N HETATM 1897 CA VAL A 1 -14.103 -3.912 -5.751 1.00 0.14 C HETATM 1898 C VAL A 1 -13.075 -4.958 -5.371 1.00 0.21 C HETATM 1899 O VAL A 1 -12.928 -5.275 -4.186 1.00 -0.39 O HETATM 1900 N VAL A 1 -12.381 -5.536 -6.366 1.00 -0.25 N HETATM 1901 CA VAL A 1 -11.287 -6.473 -6.117 1.00 0.13 C HETATM 1902 C VAL A 1 -10.283 -5.859 -5.155 1.00 0.20 C HETATM 1903 O VAL A 1 -9.800 -4.747 -5.395 1.00 -0.39 O HETATM 1904 N VAL A 1 -9.980 -6.580 -4.077 1.00 -0.26 N HETATM 1905 CA VAL A 1 -9.241 -6.029 -2.949 1.00 0.14 C HETATM 1906 C VAL A 1 -7.955 -5.296 -3.346 1.00 0.21 C HETATM 1907 O VAL A 1 -7.520 -4.388 -2.636 1.00 -0.39 O HETATM 1908 N VAL A 1 -7.336 -5.677 -4.467 1.00 -0.26 N HETATM 1909 CA VAL A 1 -6.202 -4.921 -4.989 1.00 0.14 C HETATM 1910 C VAL A 1 -6.664 -3.565 -5.548 1.00 0.21 C HETATM 1911 O VAL A 1 -6.658 -3.326 -6.752 1.00 -0.39 O HETATM 1912 N VAL A 1 -7.082 -2.684 -4.659 1.00 -0.26 N HETATM 1913 CA VAL A 1 -7.594 -1.383 -5.052 1.00 0.15 C HETATM 1914 C VAL A 1 -6.812 -0.262 -4.360 1.00 0.21 C HETATM 1915 O VAL A 1 -6.848 0.893 -4.779 1.00 -0.39 O HETATM 1916 N VAL A 1 -6.087 -0.623 -3.311 1.00 -0.26 N HETATM 1917 CA VAL A 1 -5.419 0.355 -2.452 1.00 0.13 C HETATM 1918 C VAL A 1 -3.999 -0.091 -2.124 1.00 0.20 C HETATM 1919 O VAL A 1 -3.271 0.610 -1.431 1.00 -0.39 O HETATM 1920 N VAL A 1 -3.610 -1.261 -2.621 1.00 -0.26 N HETATM 1921 CA VAL A 1 -2.282 -1.779 -2.382 1.00 0.13 C HETATM 1922 C VAL A 1 -1.355 -1.408 -3.541 1.00 0.21 C HETATM 1923 O VAL A 1 -1.524 -1.880 -4.667 1.00 -0.39 O HETATM 1924 N VAL A 1 -0.389 -0.519 -3.287 1.00 -0.25 N HETATM 1925 CA VAL A 1 0.554 -0.075 -4.299 1.00 0.13 C HETATM 1926 C VAL A 1 1.767 -0.988 -4.380 1.00 0.20 C HETATM 1927 O VAL A 1 1.967 -1.857 -3.529 1.00 -0.39 O HETATM 1928 N VAL A 1 2.573 -0.789 -5.402 1.00 -0.26 N HETATM 1929 CA VAL A 1 3.765 -1.587 -5.585 1.00 0.14 C HETATM 1930 C VAL A 1 4.979 -0.684 -5.468 1.00 0.21 C HETATM 1931 O VAL A 1 4.993 0.412 -6.027 1.00 -0.39 O HETATM 1932 N VAL A 1 5.992 -1.134 -4.743 1.00 -0.26 N HETATM 1933 CA VAL A 1 7.201 -0.339 -4.554 1.00 0.13 C HETATM 1934 C VAL A 1 8.115 -0.452 -5.782 1.00 0.20 C HETATM 1935 O VAL A 1 9.335 -0.501 -5.669 1.00 -0.39 O HETATM 1936 N VAL A 1 7.484 -0.423 -6.964 1.00 -0.26 N HETATM 1937 CA VAL A 1 8.142 -0.713 -8.239 1.00 0.13 C HETATM 1938 C VAL A 1 8.446 -2.206 -8.336 1.00 0.21 C HETATM 1939 O VAL A 1 8.450 -2.905 -7.322 1.00 -0.39 O HETATM 1940 N VAL A 1 8.643 -2.731 -9.560 1.00 -0.25 N HETATM 1941 CA VAL A 1 9.013 -4.132 -9.767 1.00 0.13 C HETATM 1942 C VAL A 1 10.210 -4.534 -8.913 1.00 0.20 C HETATM 1943 O VAL A 1 11.354 -4.186 -9.217 1.00 -0.39 O HETATM 1944 N VAL A 1 9.929 -5.245 -7.833 1.00 -0.26 N HETATM 1945 CA VAL A 1 10.953 -5.677 -6.905 1.00 0.15 C HETATM 1946 C VAL A 1 11.827 -6.765 -7.521 1.00 0.21 C HETATM 1947 O VAL A 1 11.455 -7.389 -8.518 1.00 -0.39 O HETATM 1948 N VAL A 1 12.992 -6.972 -6.936 1.00 -0.27 N HETATM 1949 CA VAL A 1 13.928 -7.956 -7.429 1.00 0.10 C HETATM 1950 C VAL A 1 13.852 -9.233 -6.605 1.00 0.06 C HETATM 1951 O VAL A 1 13.307 -10.232 -7.118 1.00 -0.57 O HETATM 1952 OXT VAL A 1 14.299 -9.228 -5.443 1.00 -0.57 O HETATM 1953 CB VAL A 1 15.350 -7.382 -7.453 1.00 -0.00 C HETATM 1954 CG VAL A 1 15.744 -6.634 -6.186 1.00 0.04 C HETATM 1955 CD VAL A 1 17.054 -5.888 -6.339 1.00 0.17 C HETATM 1956 OE1 VAL A 1 17.941 -6.306 -7.086 1.00 -0.40 O HETATM 1957 NE2 VAL A 1 17.182 -4.772 -5.641 1.00 -0.30 N HETATM 1958 H120 VAL A 1 18.025 -4.238 -5.702 1.00 0.18 H HETATM 1959 H121 VAL A 1 16.436 -4.462 -5.052 1.00 0.18 H HETATM 1960 H118 VAL A 1 15.844 -7.359 -5.365 1.00 0.05 H HETATM 1961 H119 VAL A 1 14.952 -5.911 -5.942 1.00 0.05 H HETATM 1962 H116 VAL A 1 15.427 -6.687 -8.302 1.00 0.03 H HETATM 1963 H117 VAL A 1 16.055 -8.214 -7.596 1.00 0.03 H HETATM 1964 H115 VAL A 1 13.647 -8.205 -8.463 1.00 0.07 H HETATM 1965 H114 VAL A 1 13.233 -6.433 -6.129 1.00 0.19 H HETATM 1966 CB VAL A 1 10.297 -6.169 -5.613 1.00 0.08 C HETATM 1967 OG VAL A 1 9.189 -7.010 -5.895 1.00 -0.39 O HETATM 1968 H113 VAL A 1 8.799 -7.302 -5.080 1.00 0.21 H HETATM 1969 H111 VAL A 1 9.952 -5.301 -5.032 1.00 0.06 H HETATM 1970 H112 VAL A 1 11.037 -6.733 -5.026 1.00 0.06 H HETATM 1971 H110 VAL A 1 11.594 -4.815 -6.666 1.00 0.08 H HETATM 1972 H109 VAL A 1 8.977 -5.492 -7.652 1.00 0.19 H HETATM 1973 CB VAL A 1 9.363 -4.212 -11.260 1.00 -0.01 C HETATM 1974 CG VAL A 1 9.406 -2.799 -11.743 1.00 -0.03 C HETATM 1975 CD VAL A 1 8.501 -2.022 -10.837 1.00 0.04 C HETATM 1976 H107 VAL A 1 8.829 -0.976 -10.749 1.00 0.05 H HETATM 1977 H108 VAL A 1 7.461 -2.051 -11.194 1.00 0.05 H HETATM 1978 H105 VAL A 1 9.049 -2.740 -12.782 1.00 0.03 H HETATM 1979 H106 VAL A 1 10.432 -2.407 -11.685 1.00 0.03 H HETATM 1980 H103 VAL A 1 8.594 -4.780 -11.804 1.00 0.03 H HETATM 1981 H104 VAL A 1 10.342 -4.694 -11.399 1.00 0.03 H HETATM 1982 H102 VAL A 1 8.165 -4.791 -9.532 1.00 0.08 H HETATM 1983 CB VAL A 1 9.406 0.127 -8.416 1.00 -0.02 C HETATM 1984 H99 VAL A 1 9.875 -0.115 -9.381 1.00 0.03 H HETATM 1985 H100 VAL A 1 10.111 -0.094 -7.601 1.00 0.03 H HETATM 1986 H101 VAL A 1 9.143 1.195 -8.393 1.00 0.03 H HETATM 1987 H98 VAL A 1 7.447 -0.451 -9.051 1.00 0.08 H HETATM 1988 H97 VAL A 1 6.511 -0.191 -6.976 1.00 0.19 H HETATM 1989 CB VAL A 1 7.913 -0.717 -3.216 1.00 -0.01 C HETATM 1990 CG VAL A 1 8.617 -2.096 -3.059 1.00 -0.04 C HETATM 1991 CD1 VAL A 1 7.904 -3.217 -3.792 1.00 -0.06 C HETATM 1992 H91 VAL A 1 8.450 -4.160 -3.641 1.00 0.02 H HETATM 1993 H92 VAL A 1 7.863 -2.985 -4.867 1.00 0.02 H HETATM 1994 H93 VAL A 1 6.881 -3.319 -3.400 1.00 0.02 H HETATM 1995 CD2 VAL A 1 10.086 -2.020 -3.466 1.00 -0.06 C HETATM 1996 H94 VAL A 1 10.576 -1.200 -2.920 1.00 0.02 H HETATM 1997 H95 VAL A 1 10.158 -1.834 -4.548 1.00 0.02 H HETATM 1998 H96 VAL A 1 10.583 -2.971 -3.224 1.00 0.02 H HETATM 1999 H90 VAL A 1 8.589 -2.347 -1.988 1.00 0.03 H HETATM 2000 H88 VAL A 1 7.150 -0.661 -2.426 1.00 0.03 H HETATM 2001 H89 VAL A 1 8.681 0.051 -3.039 1.00 0.03 H HETATM 2002 H87 VAL A 1 6.897 0.715 -4.471 1.00 0.08 H HETATM 2003 H86 VAL A 1 5.927 -2.036 -4.317 1.00 0.19 H HETATM 2004 CB VAL A 1 3.747 -2.275 -6.955 1.00 0.02 C HETATM 2005 CG VAL A 1 2.380 -2.731 -7.390 1.00 -0.04 C HETATM 2006 CD1 VAL A 1 1.622 -3.578 -6.593 1.00 -0.06 C HETATM 2007 CE1 VAL A 1 0.365 -3.988 -6.997 1.00 -0.07 C HETATM 2008 CZ VAL A 1 -0.148 -3.556 -8.204 1.00 -0.07 C HETATM 2009 CE2 VAL A 1 0.597 -2.715 -9.006 1.00 -0.07 C HETATM 2010 CD2 VAL A 1 1.852 -2.306 -8.598 1.00 -0.06 C HETATM 2011 H82 VAL A 1 2.431 -1.644 -9.232 1.00 0.06 H HETATM 2012 H84 VAL A 1 0.198 -2.376 -9.955 1.00 0.06 H HETATM 2013 H85 VAL A 1 -1.134 -3.877 -8.521 1.00 0.06 H HETATM 2014 H83 VAL A 1 -0.218 -4.649 -6.366 1.00 0.06 H HETATM 2015 H81 VAL A 1 2.019 -3.921 -5.645 1.00 0.06 H HETATM 2016 H79 VAL A 1 4.407 -3.154 -6.910 1.00 0.05 H HETATM 2017 H80 VAL A 1 4.130 -1.566 -7.704 1.00 0.05 H HETATM 2018 H78 VAL A 1 3.809 -2.357 -4.801 1.00 0.08 H HETATM 2019 H77 VAL A 1 2.357 -0.072 -6.065 1.00 0.19 H HETATM 2020 CB VAL A 1 0.952 1.307 -3.793 1.00 -0.01 C HETATM 2021 CG VAL A 1 0.899 1.189 -2.308 1.00 -0.03 C HETATM 2022 CD VAL A 1 -0.131 0.127 -1.990 1.00 0.04 C HETATM 2023 H75 VAL A 1 0.266 -0.598 -1.264 1.00 0.05 H HETATM 2024 H76 VAL A 1 -1.050 0.581 -1.590 1.00 0.05 H HETATM 2025 H73 VAL A 1 0.602 2.150 -1.862 1.00 0.03 H HETATM 2026 H74 VAL A 1 1.883 0.891 -1.916 1.00 0.03 H HETATM 2027 H71 VAL A 1 0.244 2.070 -4.148 1.00 0.03 H HETATM 2028 H72 VAL A 1 1.968 1.566 -4.127 1.00 0.03 H HETATM 2029 H70 VAL A 1 0.074 -0.015 -5.287 1.00 0.08 H HETATM 2030 CB VAL A 1 -2.309 -3.314 -2.163 1.00 -0.01 C HETATM 2031 CG1 VAL A 1 -3.043 -4.032 -3.289 1.00 -0.06 C HETATM 2032 H64 VAL A 1 -3.040 -5.115 -3.097 1.00 0.02 H HETATM 2033 H65 VAL A 1 -2.538 -3.828 -4.245 1.00 0.02 H HETATM 2034 H66 VAL A 1 -4.081 -3.671 -3.338 1.00 0.02 H HETATM 2035 CG2 VAL A 1 -0.904 -3.854 -2.021 1.00 -0.06 C HETATM 2036 H67 VAL A 1 -0.389 -3.326 -1.205 1.00 0.02 H HETATM 2037 H68 VAL A 1 -0.355 -3.700 -2.962 1.00 0.02 H HETATM 2038 H69 VAL A 1 -0.946 -4.929 -1.793 1.00 0.02 H HETATM 2039 H63 VAL A 1 -2.849 -3.513 -1.226 1.00 0.03 H HETATM 2040 H62 VAL A 1 -1.891 -1.312 -1.466 1.00 0.08 H HETATM 2041 H61 VAL A 1 -4.251 -1.795 -3.173 1.00 0.19 H HETATM 2042 CB VAL A 1 -6.220 0.531 -1.161 1.00 -0.01 C HETATM 2043 CG VAL A 1 -7.327 -0.509 -0.954 1.00 -0.04 C HETATM 2044 CD1 VAL A 1 -7.534 -0.791 0.515 1.00 -0.06 C HETATM 2045 H55 VAL A 1 -8.332 -1.539 0.636 1.00 0.02 H HETATM 2046 H56 VAL A 1 -7.821 0.138 1.030 1.00 0.02 H HETATM 2047 H57 VAL A 1 -6.600 -1.178 0.949 1.00 0.02 H HETATM 2048 CD2 VAL A 1 -8.636 -0.036 -1.573 1.00 -0.06 C HETATM 2049 H58 VAL A 1 -8.483 0.169 -2.643 1.00 0.02 H HETATM 2050 H59 VAL A 1 -8.970 0.882 -1.068 1.00 0.02 H HETATM 2051 H60 VAL A 1 -9.401 -0.818 -1.455 1.00 0.02 H HETATM 2052 H54 VAL A 1 -7.022 -1.442 -1.450 1.00 0.03 H HETATM 2053 H52 VAL A 1 -6.684 1.528 -1.178 1.00 0.03 H HETATM 2054 H53 VAL A 1 -5.523 0.465 -0.312 1.00 0.03 H HETATM 2055 H51 VAL A 1 -5.374 1.319 -2.980 1.00 0.08 H HETATM 2056 H50 VAL A 1 -5.993 -1.596 -3.100 1.00 0.19 H HETATM 2057 CB VAL A 1 -9.089 -1.311 -4.698 1.00 0.08 C HETATM 2058 OG VAL A 1 -9.655 -0.049 -5.011 1.00 -0.39 O HETATM 2059 H49 VAL A 1 -9.203 0.629 -4.523 1.00 0.21 H HETATM 2060 H47 VAL A 1 -9.207 -1.494 -3.620 1.00 0.06 H HETATM 2061 H48 VAL A 1 -9.624 -2.089 -5.263 1.00 0.06 H HETATM 2062 H46 VAL A 1 -7.480 -1.268 -6.140 1.00 0.08 H HETATM 2063 H45 VAL A 1 -7.045 -2.919 -3.688 1.00 0.19 H HETATM 2064 CB VAL A 1 -5.439 -5.729 -6.053 1.00 0.01 C HETATM 2065 CG VAL A 1 -6.234 -6.094 -7.279 1.00 -0.00 C HETATM 2066 ND1 VAL A 1 -6.105 -5.438 -8.486 1.00 -0.33 N HETATM 2067 CE1 VAL A 1 -6.905 -5.992 -9.376 1.00 0.09 C HETATM 2068 NE2 VAL A 1 -7.552 -6.984 -8.793 1.00 -0.28 N HETATM 2069 CD2 VAL A 1 -7.150 -7.067 -7.484 1.00 0.03 C HETATM 2070 H42 VAL A 1 -7.504 -7.785 -6.745 1.00 0.07 H HETATM 2071 H44 VAL A 1 -8.245 -7.596 -9.247 1.00 0.24 H HETATM 2072 H43 VAL A 1 -7.013 -5.684 -10.415 1.00 0.12 H HETATM 2073 H40 VAL A 1 -5.089 -6.661 -5.585 1.00 0.04 H HETATM 2074 H41 VAL A 1 -4.573 -5.133 -6.375 1.00 0.04 H HETATM 2075 H39 VAL A 1 -5.512 -4.726 -4.155 1.00 0.08 H HETATM 2076 H38 VAL A 1 -7.654 -6.490 -4.955 1.00 0.19 H HETATM 2077 CB VAL A 1 -8.947 -7.109 -1.908 1.00 0.00 C HETATM 2078 CG VAL A 1 -8.304 -8.342 -2.458 1.00 -0.04 C HETATM 2079 CD1 VAL A 1 -8.910 -9.344 -3.158 1.00 0.02 C HETATM 2080 NE1 VAL A 1 -7.996 -10.310 -3.485 1.00 -0.29 N HETATM 2081 CE2 VAL A 1 -6.777 -9.951 -2.978 1.00 0.06 C HETATM 2082 CD2 VAL A 1 -6.937 -8.720 -2.320 1.00 -0.02 C HETATM 2083 CE3 VAL A 1 -5.828 -8.132 -1.712 1.00 -0.07 C HETATM 2084 CZ3 VAL A 1 -4.616 -8.784 -1.776 1.00 -0.08 C HETATM 2085 CH2 VAL A 1 -4.489 -10.009 -2.435 1.00 -0.08 C HETATM 2086 CZ2 VAL A 1 -5.555 -10.604 -3.039 1.00 -0.04 C HETATM 2087 H35 VAL A 1 -5.452 -11.555 -3.550 1.00 0.05 H HETATM 2088 H37 VAL A 1 -3.521 -10.497 -2.466 1.00 0.05 H HETATM 2089 H36 VAL A 1 -3.746 -8.339 -1.307 1.00 0.05 H HETATM 2090 H34 VAL A 1 -5.918 -7.181 -1.199 1.00 0.05 H HETATM 2091 H33 VAL A 1 -8.194 -11.165 -4.024 1.00 0.22 H HETATM 2092 H32 VAL A 1 -9.967 -9.372 -3.419 1.00 0.08 H HETATM 2093 H30 VAL A 1 -9.897 -7.399 -1.436 1.00 0.04 H HETATM 2094 H31 VAL A 1 -8.276 -6.681 -1.149 1.00 0.04 H HETATM 2095 H29 VAL A 1 -9.897 -5.285 -2.474 1.00 0.08 H HETATM 2096 H28 VAL A 1 -10.271 -7.536 -4.040 1.00 0.19 H HETATM 2097 CB VAL A 1 -10.666 -6.680 -7.500 1.00 -0.01 C HETATM 2098 CG VAL A 1 -11.757 -6.367 -8.462 1.00 -0.03 C HETATM 2099 CD VAL A 1 -12.610 -5.316 -7.807 1.00 0.04 C HETATM 2100 H26 VAL A 1 -12.290 -4.307 -8.107 1.00 0.05 H HETATM 2101 H27 VAL A 1 -13.671 -5.455 -8.062 1.00 0.05 H HETATM 2102 H24 VAL A 1 -12.354 -7.268 -8.667 1.00 0.03 H HETATM 2103 H25 VAL A 1 -11.336 -5.984 -9.403 1.00 0.03 H HETATM 2104 H22 VAL A 1 -10.330 -7.720 -7.621 1.00 0.03 H HETATM 2105 H23 VAL A 1 -9.814 -6.000 -7.647 1.00 0.03 H HETATM 2106 H21 VAL A 1 -11.662 -7.422 -5.707 1.00 0.08 H HETATM 2107 CB VAL A 1 -13.529 -2.511 -5.541 1.00 0.02 C HETATM 2108 CG VAL A 1 -14.119 -1.493 -6.466 1.00 -0.04 C HETATM 2109 CD1 VAL A 1 -15.468 -1.199 -6.423 1.00 -0.06 C HETATM 2110 CE1 VAL A 1 -16.015 -0.273 -7.283 1.00 -0.07 C HETATM 2111 CZ VAL A 1 -15.210 0.370 -8.203 1.00 -0.07 C HETATM 2112 CE2 VAL A 1 -13.862 0.082 -8.257 1.00 -0.07 C HETATM 2113 CD2 VAL A 1 -13.323 -0.845 -7.390 1.00 -0.06 C HETATM 2114 H17 VAL A 1 -12.263 -1.067 -7.434 1.00 0.06 H HETATM 2115 H19 VAL A 1 -13.228 0.583 -8.979 1.00 0.06 H HETATM 2116 H20 VAL A 1 -15.637 1.100 -8.882 1.00 0.06 H HETATM 2117 H18 VAL A 1 -17.075 -0.049 -7.238 1.00 0.06 H HETATM 2118 H16 VAL A 1 -16.104 -1.703 -5.704 1.00 0.06 H HETATM 2119 H14 VAL A 1 -12.442 -2.549 -5.708 1.00 0.05 H HETATM 2120 H15 VAL A 1 -13.730 -2.201 -4.505 1.00 0.05 H HETATM 2121 H13 VAL A 1 -14.361 -4.033 -6.813 1.00 0.08 H HETATM 2122 H12 VAL A 1 -15.225 -4.052 -3.958 1.00 0.19 H HETATM 2123 CB VAL A 1 -17.191 -5.953 -3.803 1.00 0.01 C HETATM 2124 CG1 VAL A 1 -18.049 -6.195 -2.585 1.00 -0.06 C HETATM 2125 H6 VAL A 1 -17.739 -7.132 -2.099 1.00 0.02 H HETATM 2126 H7 VAL A 1 -19.104 -6.271 -2.889 1.00 0.02 H HETATM 2127 H8 VAL A 1 -17.929 -5.359 -1.880 1.00 0.02 H HETATM 2128 CG2 VAL A 1 -17.265 -7.137 -4.753 1.00 -0.06 C HETATM 2129 H9 VAL A 1 -16.634 -6.941 -5.633 1.00 0.02 H HETATM 2130 H10 VAL A 1 -18.307 -7.285 -5.074 1.00 0.02 H HETATM 2131 H11 VAL A 1 -16.908 -8.042 -4.240 1.00 0.02 H HETATM 2132 H5 VAL A 1 -16.148 -5.851 -3.467 1.00 0.04 H HETATM 2133 H4 VAL A 1 -17.659 -3.842 -3.778 1.00 0.11 H HETATM 2134 H1 VAL A 1 -19.111 -3.887 -5.663 1.00 0.20 H HETATM 2135 H2 VAL A 1 -19.612 -4.973 -4.534 1.00 0.20 H HETATM 2136 H3 VAL A 1 -18.852 -5.495 -5.897 1.00 0.20 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 1892 1893 2134 2135 2136 CONECT 1893 1892 1894 2123 2133 CONECT 1894 1893 1895 1896 CONECT 1895 1894 CONECT 1896 1894 1897 2122 CONECT 1897 1896 1898 2107 2121 CONECT 1898 1897 1899 1900 CONECT 1899 1898 CONECT 1900 1898 1901 2099 CONECT 1901 1900 1902 2097 2106 CONECT 1902 1901 1903 1904 CONECT 1903 1902 CONECT 1904 1902 1905 2096 CONECT 1905 1904 1906 2077 2095 CONECT 1906 1905 1907 1908 CONECT 1907 1906 CONECT 1908 1906 1909 2076 CONECT 1909 1908 1910 2064 2075 CONECT 1910 1909 1911 1912 CONECT 1911 1910 CONECT 1912 1910 1913 2063 CONECT 1913 1912 1914 2057 2062 CONECT 1914 1913 1915 1916 CONECT 1915 1914 CONECT 1916 1914 1917 2056 CONECT 1917 1916 1918 2042 2055 CONECT 1918 1917 1919 1920 CONECT 1919 1918 CONECT 1920 1918 1921 2041 CONECT 1921 1920 1922 2030 2040 CONECT 1922 1921 1923 1924 CONECT 1923 1922 CONECT 1924 1922 1925 2022 CONECT 1925 1924 1926 2020 2029 CONECT 1926 1925 1927 1928 CONECT 1927 1926 CONECT 1928 1926 1929 2019 CONECT 1929 1928 1930 2004 2018 CONECT 1930 1929 1931 1932 CONECT 1931 1930 CONECT 1932 1930 1933 2003 CONECT 1933 1932 1934 1989 2002 CONECT 1934 1933 1935 1936 CONECT 1935 1934 CONECT 1936 1934 1937 1988 CONECT 1937 1936 1938 1983 1987 CONECT 1938 1937 1939 1940 CONECT 1939 1938 CONECT 1940 1938 1941 1975 CONECT 1941 1940 1942 1973 1982 CONECT 1942 1941 1943 1944 CONECT 1943 1942 CONECT 1944 1942 1945 1972 CONECT 1945 1944 1946 1966 1971 CONECT 1946 1945 1947 1948 CONECT 1947 1946 CONECT 1948 1946 1949 1965 CONECT 1949 1948 1950 1953 1964 CONECT 1950 1949 1951 1952 CONECT 1951 1950 CONECT 1952 1950 CONECT 1953 1949 1954 1962 1963 CONECT 1954 1953 1955 1960 1961 CONECT 1955 1954 1956 1957 CONECT 1956 1955 CONECT 1957 1955 1958 1959 CONECT 1958 1957 CONECT 1959 1957 CONECT 1960 1954 CONECT 1961 1954 CONECT 1962 1953 CONECT 1963 1953 CONECT 1964 1949 CONECT 1965 1948 CONECT 1966 1945 1967 1969 1970 CONECT 1967 1966 1968 CONECT 1968 1967 CONECT 1969 1966 CONECT 1970 1966 CONECT 1971 1945 CONECT 1972 1944 CONECT 1973 1941 1974 1980 1981 CONECT 1974 1973 1975 1978 1979 CONECT 1975 1940 1974 1976 1977 CONECT 1976 1975 CONECT 1977 1975 CONECT 1978 1974 CONECT 1979 1974 CONECT 1980 1973 CONECT 1981 1973 CONECT 1982 1941 CONECT 1983 1937 1984 1985 1986 CONECT 1984 1983 CONECT 1985 1983 CONECT 1986 1983 CONECT 1987 1937 CONECT 1988 1936 CONECT 1989 1933 1990 2000 2001 CONECT 1990 1989 1991 1995 1999 CONECT 1991 1990 1992 1993 1994 CONECT 1992 1991 CONECT 1993 1991 CONECT 1994 1991 CONECT 1995 1990 1996 1997 1998 CONECT 1996 1995 CONECT 1997 1995 CONECT 1998 1995 CONECT 1999 1990 CONECT 2000 1989 CONECT 2001 1989 CONECT 2002 1933 CONECT 2003 1932 CONECT 2004 1929 2005 2016 2017 CONECT 2005 2004 2006 2010 CONECT 2006 2005 2007 2015 CONECT 2007 2006 2008 2014 CONECT 2008 2007 2009 2013 CONECT 2009 2008 2010 2012 CONECT 2010 2005 2009 2011 CONECT 2011 2010 CONECT 2012 2009 CONECT 2013 2008 CONECT 2014 2007 CONECT 2015 2006 CONECT 2016 2004 CONECT 2017 2004 CONECT 2018 1929 CONECT 2019 1928 CONECT 2020 1925 2021 2027 2028 CONECT 2021 2020 2022 2025 2026 CONECT 2022 1924 2021 2023 2024 CONECT 2023 2022 CONECT 2024 2022 CONECT 2025 2021 CONECT 2026 2021 CONECT 2027 2020 CONECT 2028 2020 CONECT 2029 1925 CONECT 2030 1921 2031 2035 2039 CONECT 2031 2030 2032 2033 2034 CONECT 2032 2031 CONECT 2033 2031 CONECT 2034 2031 CONECT 2035 2030 2036 2037 2038 CONECT 2036 2035 CONECT 2037 2035 CONECT 2038 2035 CONECT 2039 2030 CONECT 2040 1921 CONECT 2041 1920 CONECT 2042 1917 2043 2053 2054 CONECT 2043 2042 2044 2048 2052 CONECT 2044 2043 2045 2046 2047 CONECT 2045 2044 CONECT 2046 2044 CONECT 2047 2044 CONECT 2048 2043 2049 2050 2051 CONECT 2049 2048 CONECT 2050 2048 CONECT 2051 2048 CONECT 2052 2043 CONECT 2053 2042 CONECT 2054 2042 CONECT 2055 1917 CONECT 2056 1916 CONECT 2057 1913 2058 2060 2061 CONECT 2058 2057 2059 CONECT 2059 2058 CONECT 2060 2057 CONECT 2061 2057 CONECT 2062 1913 CONECT 2063 1912 CONECT 2064 1909 2065 2073 2074 CONECT 2065 2064 2066 2069 CONECT 2066 2065 2067 CONECT 2067 2066 2068 2072 CONECT 2068 2067 2069 2071 CONECT 2069 2065 2068 2070 CONECT 2070 2069 CONECT 2071 2068 CONECT 2072 2067 CONECT 2073 2064 CONECT 2074 2064 CONECT 2075 1909 CONECT 2076 1908 CONECT 2077 1905 2078 2093 2094 CONECT 2078 2077 2079 2082 CONECT 2079 2078 2080 2092 CONECT 2080 2079 2081 2091 CONECT 2081 2080 2082 2086 CONECT 2082 2078 2081 2083 CONECT 2083 2082 2084 2090 CONECT 2084 2083 2085 2089 CONECT 2085 2084 2086 2088 CONECT 2086 2081 2085 2087 CONECT 2087 2086 CONECT 2088 2085 CONECT 2089 2084 CONECT 2090 2083 CONECT 2091 2080 CONECT 2092 2079 CONECT 2093 2077 CONECT 2094 2077 CONECT 2095 1905 CONECT 2096 1904 CONECT 2097 1901 2098 2104 2105 CONECT 2098 2097 2099 2102 2103 CONECT 2099 1900 2098 2100 2101 CONECT 2100 2099 CONECT 2101 2099 CONECT 2102 2098 CONECT 2103 2098 CONECT 2104 2097 CONECT 2105 2097 CONECT 2106 1901 CONECT 2107 1897 2108 2119 2120 CONECT 2108 2107 2109 2113 CONECT 2109 2108 2110 2118 CONECT 2110 2109 2111 2117 CONECT 2111 2110 2112 2116 CONECT 2112 2111 2113 2115 CONECT 2113 2108 2112 2114 CONECT 2114 2113 CONECT 2115 2112 CONECT 2116 2111 CONECT 2117 2110 CONECT 2118 2109 CONECT 2119 2107 CONECT 2120 2107 CONECT 2121 1897 CONECT 2122 1896 CONECT 2123 1893 2124 2128 2132 CONECT 2124 2123 2125 2126 2127 CONECT 2125 2124 CONECT 2126 2124 CONECT 2127 2124 CONECT 2128 2123 2129 2130 2131 CONECT 2129 2128 CONECT 2130 2128 CONECT 2131 2128 CONECT 2132 2123 CONECT 2133 1893 CONECT 2134 1892 CONECT 2135 1892 CONECT 2136 1892 MASTER 0 0 0 0 0 0 0 0 2135 1 249 10 END
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28aa, >4J2L_2|Chains... *
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15-mer
4psx
RCSB PDB
PDBbind
15-mer
4r1e
RCSB PDB
PDBbind
15-mer
4r3s
RCSB PDB
PDBbind
15-mer
4rrv
RCSB PDB
PDBbind
15-mer
4u0a
RCSB PDB
PDBbind
15-mer
4u0b
RCSB PDB
PDBbind
15-mer
4u6x
RCSB PDB
PDBbind
15-mer
4u6y
RCSB PDB
PDBbind
15-mer
4xyn
RCSB PDB
PDBbind
15-mer
5cfa
RCSB PDB
PDBbind
15-mer
5cin
RCSB PDB
PDBbind
15-mer
5cqx
RCSB PDB
PDBbind
15-mer
5dif
RCSB PDB
PDBbind
15-mer
5epp
RCSB PDB
PDBbind
15-mer
5etf
RCSB PDB
PDBbind
15-mer
5fb0
RCSB PDB
PDBbind
15-mer
5fb1
RCSB PDB
PDBbind
15-mer
5h5q
RCSB PDB
PDBbind
15-mer
5h5r
RCSB PDB
PDBbind
15-mer
5ix1
RCSB PDB
PDBbind
15-mer
5izu
RCSB PDB
PDBbind
15-mer
5j19
RCSB PDB
PDBbind
15-mer
5j9k
RCSB PDB
PDBbind
15-mer
5jlz
RCSB PDB
PDBbind
15-mer
5ksu
RCSB PDB
PDBbind
15-mer
5ksv
RCSB PDB
PDBbind
15-mer
5kzp
RCSB PDB
PDBbind
15-mer
5lax
RCSB PDB
PDBbind
15-mer
5mlo
RCSB PDB
PDBbind
15-mer
5o45
RCSB PDB
PDBbind
15-mer
5svz
RCSB PDB
PDBbind
15-mer
5t1i
RCSB PDB
PDBbind
15-mer
5twg
RCSB PDB
PDBbind
15-mer
5u66
RCSB PDB
PDBbind
15-mer
5ul6
RCSB PDB
PDBbind
15-mer
5uwj
RCSB PDB
PDBbind
15-mer
5v4b
RCSB PDB
PDBbind
15-mer
5vb9
RCSB PDB
PDBbind
15-mer
5vzy
RCSB PDB
PDBbind
15-mer
5wir
RCSB PDB
PDBbind
15-mer
5ypo
RCSB PDB
PDBbind
15-mer
5znp
RCSB PDB
PDBbind
15-mer
5zuj
RCSB PDB
PDBbind
15-mer
6atv
RCSB PDB
PDBbind
15-mer
6b5m
RCSB PDB
PDBbind
15-mer
6b5o
RCSB PDB
PDBbind
15-mer
6b5r
RCSB PDB
PDBbind
15-mer
6b5t
RCSB PDB
PDBbind
15-mer
6biz
RCSB PDB
PDBbind
15-mer
6f0y
RCSB PDB
PDBbind
15-mer
6rmm
RCSB PDB
PDBbind
15-mer
6rml
RCSB PDB
PDBbind
15-mer
6q9t
RCSB PDB
PDBbind
15-mer
6hol
RCSB PDB
PDBbind
15-mer
6e5x
RCSB PDB
PDBbind
15-mer
6bnt
RCSB PDB
PDBbind
15-mer
5zk9
RCSB PDB
PDBbind
15-mer
5zjz
RCSB PDB
PDBbind
15-mer
5vtb
RCSB PDB
PDBbind
15-mer
6a5e
RCSB PDB
PDBbind
15-mer
Entry Information
PDB ID
2m41
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Ataxin-1
Ligand Name
15-mer
EC.Number
E.C.-.-.-.-
Resolution
NMR
Affinity (Kd/Ki/IC50)
Kd=8uM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
(2013) Plos One Vol. 8: pp. e76456-e76456
Ligand Properties
Formula
C
8
6
H
1
2
2
N
1
9
O
1
9
Molecular Weight
1726.000
Exact Mass
1724.920
No. of atoms
246
No. of bonds
253
Polar Surface Area
573.99
LOGP Value
1.22 (
Computed with XLOGP3
)
2.65 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 17
No. of Hydrogen Bond Acceptors: 20
No. of Rotatable Bonds: 60
No. of Nitrogen and Oxygen Atoms: 38
No. of Rings: 8
Canonical SMILES
OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CO)C)CC(C)C)Cc1ccccc1)C(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])Cc1ccccc1)Cc1nc[nH]c1
InChI String
InChI=1S/C86H121N19O19/c1-46(2)35-58(72(109)92-50(9)83(120)103-32-18-27-66(103)81(118)101-65(44-107)77(114)93-57(86(123)124)30-31-69(87)108)94-73(110)60(37-51-21-12-10-13-22-51)97-80(117)68-29-20-34-105(68)85(122)71(49(7)8)102-76(113)59(36-47(3)4)95-78(115)64(43-106)100-75(112)62(40-54-42-89-45-91-54)96-74(111)61(39-53-41-90-56-26-17-16-25-55(53)56)98-79(116)67-28-19-33-104(67)84(121)63(38-52-23-14-11-15-24-52)99-82(119)70(88)48(5)6/h10-17,21-26,41-42,45-50,57-68,70-71,90,106-107H,18-20,27-40,43-44,88H2,1-9H3,(H2,87,108)(H,89,91)(H,92,109)(H,93,114)(H,94,110)(H,95,115)(H,96,111)(H,97,117)(H,98,116)(H,99,119)(H,100,112)(H,101,118)(H,102,113)(H,123,124)/p+1/t50-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,70-,71-/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):
P54253
Q96RK0
Entrez Gene ID
NCBI Entrez Gene ID:
6310
23152
ASD
Information of known allosteric effects of PDB entries
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