Browse entries in the PDBbind-CN Database
HEADER 4KNE_COMPLEX COMPND 4KNE_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 159 MET VAL GLY LEU ILE TRP ALA GLN ALA THR SER GLY VAL SEQRES 2 A 159 ILE GLY ARG GLY GLY ASP ILE PRO TRP ARG LEU PRO GLU SEQRES 3 A 159 ASP GLN ALA HIS PHE ARG GLU ILE THR MET GLY HIS THR SEQRES 4 A 159 ILE VAL MET GLY ARG ARG THR TRP ASP SER LEU PRO ALA SEQRES 5 A 159 LYS VAL ARG PRO LEU PRO GLY ARG ARG ASN VAL VAL LEU SEQRES 6 A 159 SER ARG GLN ALA ASP PHE MET ALA SER GLY ALA GLU VAL SEQRES 7 A 159 VAL GLY SER LEU GLU GLU ALA LEU THR SER PRO GLU THR SEQRES 8 A 159 TRP VAL ILE GLY GLY GLY GLN VAL TYR ALA LEU ALA LEU SEQRES 9 A 159 PRO TYR ALA THR ARG CYS GLU VAL THR GLU VAL ASP ILE SEQRES 10 A 159 GLY LEU PRO ARG GLU ALA GLY ASP ALA LEU ALA PRO VAL SEQRES 11 A 159 LEU ASP GLU THR TRP ARG GLY GLU THR GLY GLU TRP ARG SEQRES 12 A 159 PHE SER ARG SER GLY LEU ARG TYR ARG LEU TYR SER TYR SEQRES 13 A 159 HIS ARG SER HET UNN A 365 33 ATOM 1 N MET A 1 7.297 -3.431 13.546 1.00 28.85 N ATOM 2 CA MET A 1 7.187 -3.669 12.109 1.00 19.60 C ATOM 3 C MET A 1 6.155 -4.757 11.817 1.00 19.17 C ATOM 4 O MET A 1 6.493 -5.936 11.763 1.00 24.41 O ATOM 5 CB MET A 1 8.547 -4.081 11.525 1.00 23.32 C ATOM 6 CG MET A 1 8.737 -3.777 10.028 1.00 30.75 C ATOM 7 SD MET A 1 7.308 -4.032 8.932 1.00 32.41 S ATOM 8 CE MET A 1 7.248 -5.837 8.810 1.00 17.72 C ATOM 9 HA MET A 1 6.863 -2.740 11.640 1.00 0.00 H ATOM 10 HB2 MET A 1 9.325 -3.554 12.078 1.00 0.00 H ATOM 11 HB3 MET A 1 8.665 -5.155 11.669 1.00 0.00 H ATOM 12 HG2 MET A 1 9.545 -4.413 9.665 1.00 0.00 H ATOM 13 HG3 MET A 1 9.033 -2.731 9.942 1.00 0.00 H ATOM 14 HE1 MET A 1 8.183 -6.203 8.386 1.00 0.00 H ATOM 15 HE2 MET A 1 7.107 -6.263 9.804 1.00 0.00 H ATOM 16 HE3 MET A 1 6.418 -6.129 8.167 1.00 0.00 H ATOM 17 HN3 MET A 1 7.591 -4.309 14.020 1.00 0.00 H ATOM 18 HN2 MET A 1 6.374 -3.127 13.917 1.00 0.00 H ATOM 19 HN1 MET A 1 8.004 -2.688 13.720 1.00 0.00 H ATOM 20 N VAL A 2 4.901 -4.359 11.631 1.00 12.85 N ATOM 21 CA VAL A 2 3.874 -5.271 11.151 1.00 12.85 C ATOM 22 C VAL A 2 3.692 -5.178 9.629 1.00 12.94 C ATOM 23 O VAL A 2 3.446 -4.105 9.081 1.00 18.06 O ATOM 24 CB VAL A 2 2.527 -5.016 11.854 1.00 13.22 C ATOM 25 CG1 VAL A 2 1.400 -5.714 11.115 1.00 15.55 C ATOM 26 CG2 VAL A 2 2.592 -5.468 13.322 1.00 11.29 C ATOM 27 HA VAL A 2 4.213 -6.278 11.393 1.00 0.00 H ATOM 28 HB VAL A 2 2.324 -3.945 11.840 1.00 0.00 H ATOM 29 HG11 VAL A 2 1.345 -5.333 10.095 1.00 0.00 H ATOM 30 HG12 VAL A 2 1.591 -6.787 11.094 1.00 0.00 H ATOM 31 HG13 VAL A 2 0.457 -5.522 11.627 1.00 0.00 H ATOM 32 HG21 VAL A 2 2.817 -6.534 13.363 1.00 0.00 H ATOM 33 HG22 VAL A 2 3.373 -4.910 13.838 1.00 0.00 H ATOM 34 HG23 VAL A 2 1.631 -5.280 13.802 1.00 0.00 H ATOM 35 H VAL A 2 4.647 -3.371 11.834 1.00 0.00 H ATOM 36 N GLY A 3 3.817 -6.310 8.951 1.00 10.56 N ATOM 37 CA GLY A 3 3.697 -6.348 7.510 1.00 7.95 C ATOM 38 C GLY A 3 2.712 -7.394 7.022 1.00 10.43 C ATOM 39 O GLY A 3 2.394 -8.362 7.725 1.00 7.26 O ATOM 40 HA3 GLY A 3 4.676 -6.569 7.086 1.00 0.00 H ATOM 41 HA2 GLY A 3 3.365 -5.370 7.163 1.00 0.00 H ATOM 42 H GLY A 3 4.006 -7.193 9.468 1.00 0.00 H ATOM 43 N LEU A 4 2.218 -7.197 5.807 1.00 5.51 N ATOM 44 CA LEU A 4 1.310 -8.149 5.206 1.00 10.65 C ATOM 45 C LEU A 4 1.953 -8.672 3.938 1.00 6.98 C ATOM 46 O LEU A 4 2.455 -7.887 3.147 1.00 8.59 O ATOM 47 CB LEU A 4 -0.015 -7.467 4.867 1.00 10.86 C ATOM 48 CG LEU A 4 -1.271 -7.720 5.704 1.00 12.63 C ATOM 49 CD1 LEU A 4 -1.192 -7.123 7.115 1.00 8.62 C ATOM 50 CD2 LEU A 4 -2.478 -7.173 4.953 1.00 16.26 C ATOM 51 HA LEU A 4 1.111 -8.967 5.899 1.00 0.00 H ATOM 52 HB2 LEU A 4 0.171 -6.394 4.904 1.00 0.00 H ATOM 53 HB3 LEU A 4 -0.260 -7.757 3.845 1.00 0.00 H ATOM 54 HG LEU A 4 -1.365 -8.797 5.846 1.00 0.00 H ATOM 55 HD21 LEU A 4 -2.350 -6.103 4.792 1.00 0.00 H ATOM 56 HD22 LEU A 4 -2.566 -7.679 3.991 1.00 0.00 H ATOM 57 HD23 LEU A 4 -3.379 -7.348 5.540 1.00 0.00 H ATOM 58 HD11 LEU A 4 -0.349 -7.563 7.647 1.00 0.00 H ATOM 59 HD12 LEU A 4 -1.056 -6.044 7.044 1.00 0.00 H ATOM 60 HD13 LEU A 4 -2.115 -7.340 7.652 1.00 0.00 H ATOM 61 H LEU A 4 2.488 -6.344 5.277 1.00 0.00 H ATOM 62 N ILE A 5 1.947 -9.989 3.749 1.00 7.07 N ATOM 63 CA ILE A 5 2.453 -10.594 2.515 1.00 6.44 C ATOM 64 C ILE A 5 1.406 -11.496 1.849 1.00 7.77 C ATOM 65 O ILE A 5 0.779 -12.315 2.499 1.00 10.14 O ATOM 66 CB ILE A 5 3.791 -11.360 2.735 1.00 9.98 C ATOM 67 CG1 ILE A 5 4.254 -12.020 1.428 1.00 10.85 C ATOM 68 CG2 ILE A 5 3.674 -12.399 3.875 1.00 6.33 C ATOM 69 CD1 ILE A 5 5.715 -12.444 1.411 1.00 6.01 C ATOM 70 HA ILE A 5 2.662 -9.769 1.834 1.00 0.00 H ATOM 71 HB ILE A 5 4.545 -10.634 3.039 1.00 0.00 H ATOM 72 HG12 ILE A 5 3.641 -12.906 1.259 1.00 0.00 H ATOM 73 HG13 ILE A 5 4.097 -11.311 0.615 1.00 0.00 H ATOM 74 HD11 ILE A 5 6.348 -11.570 1.564 1.00 0.00 H ATOM 75 HD12 ILE A 5 5.892 -13.166 2.208 1.00 0.00 H ATOM 76 HD13 ILE A 5 5.949 -12.899 0.449 1.00 0.00 H ATOM 77 HG21 ILE A 5 3.412 -11.890 4.803 1.00 0.00 H ATOM 78 HG22 ILE A 5 2.899 -13.124 3.626 1.00 0.00 H ATOM 79 HG23 ILE A 5 4.628 -12.912 3.997 1.00 0.00 H ATOM 80 H ILE A 5 1.573 -10.606 4.498 1.00 0.00 H ATOM 81 N TRP A 6 1.205 -11.335 0.544 1.00 6.38 N ATOM 82 CA TRP A 6 0.229 -12.155 -0.158 1.00 7.52 C ATOM 83 C TRP A 6 0.547 -12.186 -1.644 1.00 6.88 C ATOM 84 O TRP A 6 1.340 -11.373 -2.124 1.00 9.56 O ATOM 85 CB TRP A 6 -1.217 -11.666 0.082 1.00 3.83 C ATOM 86 CG TRP A 6 -1.594 -10.407 -0.647 1.00 7.27 C ATOM 87 CD1 TRP A 6 -2.062 -10.307 -1.934 1.00 5.33 C ATOM 88 CD2 TRP A 6 -1.556 -9.068 -0.130 1.00 8.52 C ATOM 89 NE1 TRP A 6 -2.286 -8.990 -2.251 1.00 9.25 N ATOM 90 CE2 TRP A 6 -1.998 -8.209 -1.161 1.00 11.05 C ATOM 91 CE3 TRP A 6 -1.198 -8.513 1.109 1.00 8.48 C ATOM 92 CZ2 TRP A 6 -2.082 -6.821 -0.997 1.00 9.78 C ATOM 93 CZ3 TRP A 6 -1.273 -7.141 1.271 1.00 8.55 C ATOM 94 CH2 TRP A 6 -1.711 -6.308 0.220 1.00 13.96 C ATOM 95 HA TRP A 6 0.295 -13.167 0.242 1.00 0.00 H ATOM 96 HB2 TRP A 6 -1.898 -12.456 -0.234 1.00 0.00 H ATOM 97 HB3 TRP A 6 -1.340 -11.488 1.150 1.00 0.00 H ATOM 98 HE1 TRP A 6 -2.621 -8.640 -3.171 1.00 0.00 H ATOM 99 HD1 TRP A 6 -2.231 -11.149 -2.605 1.00 0.00 H ATOM 100 HZ2 TRP A 6 -2.428 -6.174 -1.803 1.00 0.00 H ATOM 101 HH2 TRP A 6 -1.756 -5.231 0.379 1.00 0.00 H ATOM 102 HZ3 TRP A 6 -0.989 -6.697 2.225 1.00 0.00 H ATOM 103 HE3 TRP A 6 -0.867 -9.151 1.928 1.00 0.00 H ATOM 104 H TRP A 6 1.749 -10.619 0.022 1.00 0.00 H ATOM 105 N ALA A 7 -0.054 -13.145 -2.345 1.00 6.25 N ATOM 106 CA ALA A 7 0.056 -13.254 -3.798 1.00 8.68 C ATOM 107 C ALA A 7 -1.351 -13.271 -4.375 1.00 7.38 C ATOM 108 O ALA A 7 -2.174 -14.078 -3.958 1.00 8.02 O ATOM 109 CB ALA A 7 0.798 -14.512 -4.199 1.00 4.21 C ATOM 110 HA ALA A 7 0.620 -12.406 -4.185 1.00 0.00 H ATOM 111 HB1 ALA A 7 1.802 -14.491 -3.775 1.00 0.00 H ATOM 112 HB2 ALA A 7 0.262 -15.384 -3.824 1.00 0.00 H ATOM 113 HB3 ALA A 7 0.863 -14.563 -5.286 1.00 0.00 H ATOM 114 H ALA A 7 -0.627 -13.848 -1.836 1.00 0.00 H ATOM 115 N GLN A 8 -1.606 -12.375 -5.327 1.00 5.73 N ATOM 116 CA GLN A 8 -2.919 -12.217 -5.922 1.00 7.14 C ATOM 117 C GLN A 8 -2.847 -12.305 -7.438 1.00 9.45 C ATOM 118 O GLN A 8 -1.837 -11.977 -8.050 1.00 5.89 O ATOM 119 CB GLN A 8 -3.510 -10.859 -5.548 1.00 10.56 C ATOM 120 CG GLN A 8 -2.675 -9.656 -6.027 1.00 10.30 C ATOM 121 CD GLN A 8 -3.351 -8.310 -5.780 1.00 14.89 C ATOM 122 OE1 GLN A 8 -3.323 -7.773 -4.661 1.00 10.18 O ATOM 123 NE2 GLN A 8 -3.969 -7.760 -6.829 1.00 13.65 N ATOM 124 HA GLN A 8 -3.549 -13.021 -5.541 1.00 0.00 H ATOM 125 HB2 GLN A 8 -4.503 -10.784 -5.990 1.00 0.00 H ATOM 126 HB3 GLN A 8 -3.592 -10.808 -4.462 1.00 0.00 H ATOM 127 HG2 GLN A 8 -1.721 -9.666 -5.500 1.00 0.00 H ATOM 128 HG3 GLN A 8 -2.498 -9.762 -7.097 1.00 0.00 H ATOM 129 HE22 GLN A 8 -3.966 -8.247 -7.748 1.00 0.00 H ATOM 130 HE21 GLN A 8 -4.453 -6.845 -6.727 1.00 0.00 H ATOM 131 H GLN A 8 -0.832 -11.764 -5.657 1.00 0.00 H ATOM 132 N ALA A 9 -3.936 -12.720 -8.066 1.00 7.30 N ATOM 133 CA ALA A 9 -4.005 -12.551 -9.501 1.00 6.63 C ATOM 134 C ALA A 9 -4.215 -11.062 -9.736 1.00 5.56 C ATOM 135 O ALA A 9 -4.291 -10.291 -8.787 1.00 6.70 O ATOM 136 CB ALA A 9 -5.130 -13.361 -10.086 1.00 10.67 C ATOM 137 HA ALA A 9 -3.095 -12.902 -9.988 1.00 0.00 H ATOM 138 HB1 ALA A 9 -4.969 -14.416 -9.865 1.00 0.00 H ATOM 139 HB2 ALA A 9 -6.075 -13.037 -9.649 1.00 0.00 H ATOM 140 HB3 ALA A 9 -5.158 -13.215 -11.166 1.00 0.00 H ATOM 141 H ALA A 9 -4.721 -13.156 -7.542 1.00 0.00 H ATOM 142 N THR A 10 -4.326 -10.653 -10.988 1.00 6.68 N ATOM 143 CA THR A 10 -4.577 -9.242 -11.272 1.00 13.06 C ATOM 144 C THR A 10 -5.881 -8.730 -10.637 1.00 9.50 C ATOM 145 O THR A 10 -5.933 -7.617 -10.089 1.00 7.82 O ATOM 146 CB THR A 10 -4.562 -8.972 -12.785 1.00 8.51 C ATOM 147 OG1 THR A 10 -3.225 -9.164 -13.271 1.00 8.11 O ATOM 148 CG2 THR A 10 -4.991 -7.541 -13.065 1.00 12.90 C ATOM 149 HA THR A 10 -3.763 -8.683 -10.811 1.00 0.00 H ATOM 150 HB THR A 10 -5.252 -9.654 -13.283 1.00 0.00 H ATOM 151 HG1 THR A 10 -2.614 -8.536 -12.810 1.00 0.00 H ATOM 152 HG23 THR A 10 -6.006 -7.389 -12.698 1.00 0.00 H ATOM 153 HG21 THR A 10 -4.313 -6.854 -12.558 1.00 0.00 H ATOM 154 HG22 THR A 10 -4.960 -7.357 -14.139 1.00 0.00 H ATOM 155 H THR A 10 -4.235 -11.334 -11.769 1.00 0.00 H ATOM 156 N SER A 11 -6.907 -9.574 -10.699 1.00 9.39 N ATOM 157 CA SER A 11 -8.261 -9.259 -10.220 1.00 15.27 C ATOM 158 C SER A 11 -8.382 -9.143 -8.701 1.00 11.16 C ATOM 159 O SER A 11 -9.451 -8.828 -8.169 1.00 8.98 O ATOM 160 CB SER A 11 -9.171 -10.385 -10.627 1.00 10.82 C ATOM 161 OG SER A 11 -8.751 -11.568 -9.958 1.00 8.45 O ATOM 162 HA SER A 11 -8.519 -8.293 -10.653 1.00 0.00 H ATOM 163 HB2 SER A 11 -9.115 -10.532 -11.706 1.00 0.00 H ATOM 164 HB3 SER A 11 -10.197 -10.148 -10.347 1.00 0.00 H ATOM 165 HG SER A 11 -9.342 -12.319 -10.216 1.00 0.00 H ATOM 166 H SER A 11 -6.741 -10.514 -11.111 1.00 0.00 H ATOM 167 N GLY A 12 -7.307 -9.453 -7.995 1.00 8.64 N ATOM 168 CA GLY A 12 -7.360 -9.444 -6.549 1.00 8.49 C ATOM 169 C GLY A 12 -7.630 -10.799 -5.932 1.00 7.08 C ATOM 170 O GLY A 12 -7.573 -10.915 -4.716 1.00 12.29 O ATOM 171 HA3 GLY A 12 -8.152 -8.763 -6.239 1.00 0.00 H ATOM 172 HA2 GLY A 12 -6.403 -9.081 -6.173 1.00 0.00 H ATOM 173 H GLY A 12 -6.422 -9.704 -8.480 1.00 0.00 H ATOM 174 N VAL A 13 -7.927 -11.819 -6.744 1.00 7.64 N ATOM 175 CA VAL A 13 -8.160 -13.177 -6.209 1.00 13.49 C ATOM 176 C VAL A 13 -6.843 -13.770 -5.683 1.00 10.25 C ATOM 177 O VAL A 13 -5.859 -13.771 -6.400 1.00 6.41 O ATOM 178 CB VAL A 13 -8.713 -14.148 -7.295 1.00 9.91 C ATOM 179 CG1 VAL A 13 -8.873 -15.540 -6.731 1.00 10.52 C ATOM 180 CG2 VAL A 13 -10.023 -13.656 -7.853 1.00 8.63 C ATOM 181 HA VAL A 13 -8.895 -13.077 -5.410 1.00 0.00 H ATOM 182 HB VAL A 13 -7.990 -14.181 -8.110 1.00 0.00 H ATOM 183 HG11 VAL A 13 -7.905 -15.906 -6.389 1.00 0.00 H ATOM 184 HG12 VAL A 13 -9.569 -15.513 -5.893 1.00 0.00 H ATOM 185 HG13 VAL A 13 -9.260 -16.202 -7.505 1.00 0.00 H ATOM 186 HG21 VAL A 13 -10.754 -13.582 -7.048 1.00 0.00 H ATOM 187 HG22 VAL A 13 -9.878 -12.675 -8.305 1.00 0.00 H ATOM 188 HG23 VAL A 13 -10.381 -14.356 -8.608 1.00 0.00 H ATOM 189 H VAL A 13 -7.995 -11.654 -7.769 1.00 0.00 H ATOM 190 N ILE A 14 -6.815 -14.251 -4.440 1.00 12.20 N ATOM 191 CA ILE A 14 -5.588 -14.836 -3.886 1.00 10.55 C ATOM 192 C ILE A 14 -5.761 -16.316 -3.578 1.00 12.80 C ATOM 193 O ILE A 14 -4.786 -17.026 -3.319 1.00 7.16 O ATOM 194 CB ILE A 14 -5.148 -14.143 -2.592 1.00 9.76 C ATOM 195 CG1 ILE A 14 -6.117 -14.487 -1.453 1.00 9.72 C ATOM 196 CG2 ILE A 14 -5.003 -12.647 -2.812 1.00 7.28 C ATOM 197 CD1 ILE A 14 -5.740 -13.916 -0.114 1.00 16.31 C ATOM 198 HA ILE A 14 -4.828 -14.696 -4.654 1.00 0.00 H ATOM 199 HB ILE A 14 -4.165 -14.511 -2.297 1.00 0.00 H ATOM 200 HG12 ILE A 14 -7.103 -14.107 -1.719 1.00 0.00 H ATOM 201 HG13 ILE A 14 -6.160 -15.572 -1.360 1.00 0.00 H ATOM 202 HD11 ILE A 14 -4.761 -14.295 0.179 1.00 0.00 H ATOM 203 HD12 ILE A 14 -5.705 -12.829 -0.181 1.00 0.00 H ATOM 204 HD13 ILE A 14 -6.482 -14.212 0.628 1.00 0.00 H ATOM 205 HG21 ILE A 14 -4.255 -12.465 -3.584 1.00 0.00 H ATOM 206 HG22 ILE A 14 -5.961 -12.233 -3.128 1.00 0.00 H ATOM 207 HG23 ILE A 14 -4.690 -12.173 -1.882 1.00 0.00 H ATOM 208 H ILE A 14 -7.674 -14.211 -3.855 1.00 0.00 H ATOM 209 N GLY A 15 -7.011 -16.774 -3.608 1.00 11.55 N ATOM 210 CA GLY A 15 -7.316 -18.163 -3.339 1.00 13.47 C ATOM 211 C GLY A 15 -8.700 -18.550 -3.823 1.00 11.31 C ATOM 212 O GLY A 15 -9.620 -17.749 -3.766 1.00 15.58 O ATOM 213 HA3 GLY A 15 -7.260 -18.333 -2.264 1.00 0.00 H ATOM 214 HA2 GLY A 15 -6.580 -18.788 -3.844 1.00 0.00 H ATOM 215 H GLY A 15 -7.787 -16.118 -3.830 1.00 0.00 H ATOM 216 N ARG A 16 -8.832 -19.771 -4.327 1.00 12.01 N ATOM 217 CA ARG A 16 -10.124 -20.313 -4.746 1.00 19.18 C ATOM 218 C ARG A 16 -10.154 -21.818 -4.502 1.00 19.18 C ATOM 219 O ARG A 16 -9.166 -22.510 -4.751 1.00 14.05 O ATOM 220 CB ARG A 16 -10.385 -20.037 -6.226 1.00 19.93 C ATOM 221 CG ARG A 16 -11.690 -20.642 -6.737 1.00 21.29 C ATOM 222 CD ARG A 16 -11.938 -20.265 -8.189 1.00 23.18 C ATOM 223 NE ARG A 16 -12.112 -18.824 -8.348 1.00 19.94 N ATOM 224 CZ ARG A 16 -12.058 -18.193 -9.513 1.00 15.02 C ATOM 225 NH1 ARG A 16 -11.841 -18.882 -10.625 1.00 18.16 N ATOM 226 NH2 ARG A 16 -12.224 -16.878 -9.567 1.00 15.75 N ATOM 227 HA ARG A 16 -10.902 -19.824 -4.160 1.00 0.00 H ATOM 228 HB2 ARG A 16 -10.423 -18.958 -6.375 1.00 0.00 H ATOM 229 HB3 ARG A 16 -9.561 -20.453 -6.806 1.00 0.00 H ATOM 230 HG2 ARG A 16 -11.635 -21.728 -6.655 1.00 0.00 H ATOM 231 HG3 ARG A 16 -12.516 -20.274 -6.128 1.00 0.00 H ATOM 232 HD2 ARG A 16 -12.838 -20.771 -8.537 1.00 0.00 H ATOM 233 HD3 ARG A 16 -11.087 -20.587 -8.789 1.00 0.00 H ATOM 234 HE ARG A 16 -12.289 -18.257 -7.494 1.00 0.00 H ATOM 235 HH12 ARG A 16 -11.798 -18.391 -11.541 1.00 0.00 H ATOM 236 HH11 ARG A 16 -11.714 -19.913 -10.581 1.00 0.00 H ATOM 237 HH22 ARG A 16 -12.181 -16.386 -10.482 1.00 0.00 H ATOM 238 HH21 ARG A 16 -12.397 -16.339 -8.694 1.00 0.00 H ATOM 239 H ARG A 16 -7.984 -20.365 -4.428 1.00 0.00 H ATOM 240 N GLY A 17 -11.285 -22.310 -4.004 1.00 21.82 N ATOM 241 CA GLY A 17 -11.464 -23.723 -3.732 1.00 17.06 C ATOM 242 C GLY A 17 -10.544 -24.285 -2.671 1.00 18.08 C ATOM 243 O GLY A 17 -10.411 -25.500 -2.539 1.00 19.92 O ATOM 244 HA3 GLY A 17 -11.290 -24.272 -4.658 1.00 0.00 H ATOM 245 HA2 GLY A 17 -12.493 -23.879 -3.407 1.00 0.00 H ATOM 246 H GLY A 17 -12.069 -21.658 -3.802 1.00 0.00 H ATOM 247 N GLY A 18 -9.909 -23.401 -1.910 1.00 20.83 N ATOM 248 CA GLY A 18 -8.954 -23.802 -0.896 1.00 15.00 C ATOM 249 C GLY A 18 -7.545 -23.823 -1.453 1.00 18.91 C ATOM 250 O GLY A 18 -6.597 -24.187 -0.753 1.00 27.24 O ATOM 251 HA3 GLY A 18 -9.211 -24.799 -0.539 1.00 0.00 H ATOM 252 HA2 GLY A 18 -8.999 -23.097 -0.066 1.00 0.00 H ATOM 253 H GLY A 18 -10.103 -22.388 -2.046 1.00 0.00 H ATOM 254 N ASP A 19 -7.404 -23.423 -2.716 1.00 20.06 N ATOM 255 CA ASP A 19 -6.108 -23.453 -3.393 1.00 14.64 C ATOM 256 C ASP A 19 -5.614 -22.088 -3.841 1.00 15.44 C ATOM 257 O ASP A 19 -6.396 -21.213 -4.208 1.00 10.15 O ATOM 258 CB ASP A 19 -6.185 -24.327 -4.649 1.00 13.82 C ATOM 259 CG ASP A 19 -6.255 -25.792 -4.331 1.00 16.13 C ATOM 260 OD1 ASP A 19 -5.775 -26.175 -3.243 1.00 15.25 O ATOM 261 OD2 ASP A 19 -6.784 -26.552 -5.169 1.00 12.70 O ATOM 262 HA ASP A 19 -5.413 -23.849 -2.652 1.00 0.00 H ATOM 263 HB2 ASP A 19 -7.075 -24.049 -5.214 1.00 0.00 H ATOM 264 HB3 ASP A 19 -5.299 -24.144 -5.257 1.00 0.00 H ATOM 265 H ASP A 19 -8.238 -23.080 -3.234 1.00 0.00 H ATOM 266 N ILE A 20 -4.297 -21.930 -3.851 1.00 14.00 N ATOM 267 CA ILE A 20 -3.685 -20.917 -4.695 1.00 9.37 C ATOM 268 C ILE A 20 -3.965 -21.373 -6.123 1.00 12.65 C ATOM 269 O ILE A 20 -3.632 -22.512 -6.488 1.00 11.31 O ATOM 270 CB ILE A 20 -2.163 -20.869 -4.497 1.00 12.42 C ATOM 271 CG1 ILE A 20 -1.804 -20.695 -3.012 1.00 12.14 C ATOM 272 CG2 ILE A 20 -1.563 -19.741 -5.322 1.00 11.65 C ATOM 273 CD1 ILE A 20 -0.329 -20.901 -2.705 1.00 14.19 C ATOM 274 HA ILE A 20 -4.081 -19.928 -4.463 1.00 0.00 H ATOM 275 HB ILE A 20 -1.745 -21.817 -4.836 1.00 0.00 H ATOM 276 HG12 ILE A 20 -2.080 -19.685 -2.708 1.00 0.00 H ATOM 277 HG13 ILE A 20 -2.379 -21.417 -2.433 1.00 0.00 H ATOM 278 HD11 ILE A 20 -0.037 -21.911 -2.991 1.00 0.00 H ATOM 279 HD12 ILE A 20 0.262 -20.178 -3.267 1.00 0.00 H ATOM 280 HD13 ILE A 20 -0.158 -20.761 -1.638 1.00 0.00 H ATOM 281 HG21 ILE A 20 -1.782 -19.908 -6.377 1.00 0.00 H ATOM 282 HG22 ILE A 20 -1.995 -18.792 -5.006 1.00 0.00 H ATOM 283 HG23 ILE A 20 -0.484 -19.718 -5.173 1.00 0.00 H ATOM 284 H ILE A 20 -3.699 -22.534 -3.252 1.00 0.00 H ATOM 285 N PRO A 21 -4.599 -20.502 -6.932 1.00 11.60 N ATOM 286 CA PRO A 21 -5.007 -20.866 -8.300 1.00 13.73 C ATOM 287 C PRO A 21 -3.906 -20.779 -9.363 1.00 7.89 C ATOM 288 O PRO A 21 -4.202 -20.525 -10.509 1.00 11.09 O ATOM 289 CB PRO A 21 -6.130 -19.870 -8.606 1.00 10.02 C ATOM 290 CG PRO A 21 -5.803 -18.686 -7.784 1.00 11.47 C ATOM 291 CD PRO A 21 -5.140 -19.193 -6.525 1.00 9.44 C ATOM 292 HA PRO A 21 -5.296 -21.916 -8.339 1.00 0.00 H ATOM 293 HD3 PRO A 21 -4.342 -18.522 -6.206 1.00 0.00 H ATOM 294 HD2 PRO A 21 -5.865 -19.303 -5.718 1.00 0.00 H ATOM 295 HG3 PRO A 21 -6.713 -18.140 -7.535 1.00 0.00 H ATOM 296 HG2 PRO A 21 -5.124 -18.029 -8.327 1.00 0.00 H ATOM 297 HB2 PRO A 21 -6.141 -19.614 -9.665 1.00 0.00 H ATOM 298 HB3 PRO A 21 -7.099 -20.281 -8.323 1.00 0.00 H ATOM 299 N TRP A 22 -2.655 -21.002 -8.982 1.00 9.66 N ATOM 300 CA TRP A 22 -1.559 -21.042 -9.948 1.00 13.95 C ATOM 301 C TRP A 22 -0.405 -21.775 -9.309 1.00 13.34 C ATOM 302 O TRP A 22 -0.437 -22.074 -8.114 1.00 16.15 O ATOM 303 CB TRP A 22 -1.107 -19.628 -10.364 1.00 13.92 C ATOM 304 CG TRP A 22 -0.735 -18.763 -9.178 1.00 11.00 C ATOM 305 CD1 TRP A 22 0.449 -18.769 -8.492 1.00 13.36 C ATOM 306 CD2 TRP A 22 -1.563 -17.790 -8.532 1.00 10.30 C ATOM 307 NE1 TRP A 22 0.401 -17.863 -7.460 1.00 10.71 N ATOM 308 CE2 TRP A 22 -0.819 -17.247 -7.468 1.00 7.55 C ATOM 309 CE3 TRP A 22 -2.857 -17.317 -8.756 1.00 9.22 C ATOM 310 CZ2 TRP A 22 -1.334 -16.271 -6.625 1.00 11.59 C ATOM 311 CZ3 TRP A 22 -3.363 -16.343 -7.909 1.00 9.87 C ATOM 312 CH2 TRP A 22 -2.610 -15.837 -6.868 1.00 8.19 C ATOM 313 HA TRP A 22 -1.900 -21.550 -10.850 1.00 0.00 H ATOM 314 HB2 TRP A 22 -0.239 -19.717 -11.018 1.00 0.00 H ATOM 315 HB3 TRP A 22 -1.921 -19.146 -10.906 1.00 0.00 H ATOM 316 HE1 TRP A 22 1.168 -17.676 -6.783 1.00 0.00 H ATOM 317 HD1 TRP A 22 1.305 -19.400 -8.730 1.00 0.00 H ATOM 318 HZ2 TRP A 22 -0.745 -15.866 -5.802 1.00 0.00 H ATOM 319 HH2 TRP A 22 -3.042 -15.072 -6.223 1.00 0.00 H ATOM 320 HZ3 TRP A 22 -4.375 -15.969 -8.068 1.00 0.00 H ATOM 321 HE3 TRP A 22 -3.457 -17.705 -9.579 1.00 0.00 H ATOM 322 H TRP A 22 -2.450 -21.152 -7.974 1.00 0.00 H ATOM 323 N ARG A 23 0.615 -22.059 -10.107 1.00 12.13 N ATOM 324 CA ARG A 23 1.842 -22.651 -9.601 1.00 16.24 C ATOM 325 C ARG A 23 2.994 -21.692 -9.871 1.00 21.35 C ATOM 326 O ARG A 23 3.298 -21.381 -11.024 1.00 16.38 O ATOM 327 CB ARG A 23 2.098 -24.001 -10.276 1.00 26.68 C ATOM 328 CG ARG A 23 3.442 -24.632 -9.934 1.00 25.65 C ATOM 329 CD ARG A 23 3.428 -25.322 -8.574 1.00 34.64 C ATOM 330 NE ARG A 23 4.599 -24.951 -7.779 1.00 30.97 N ATOM 331 CZ ARG A 23 4.641 -23.913 -6.952 1.00 19.78 C ATOM 332 NH1 ARG A 23 3.573 -23.141 -6.788 1.00 22.23 N ATOM 333 NH2 ARG A 23 5.748 -23.655 -6.273 1.00 19.51 N ATOM 334 HA ARG A 23 1.754 -22.823 -8.528 1.00 0.00 H ATOM 335 HB2 ARG A 23 1.310 -24.690 -9.971 1.00 0.00 H ATOM 336 HB3 ARG A 23 2.054 -23.856 -11.355 1.00 0.00 H ATOM 337 HG2 ARG A 23 3.688 -25.369 -10.699 1.00 0.00 H ATOM 338 HG3 ARG A 23 4.203 -23.852 -9.924 1.00 0.00 H ATOM 339 HD2 ARG A 23 3.427 -26.402 -8.723 1.00 0.00 H ATOM 340 HD3 ARG A 23 2.526 -25.030 -8.036 1.00 0.00 H ATOM 341 HE ARG A 23 5.453 -25.538 -7.867 1.00 0.00 H ATOM 342 HH12 ARG A 23 3.613 -22.330 -6.139 1.00 0.00 H ATOM 343 HH11 ARG A 23 2.697 -23.348 -7.309 1.00 0.00 H ATOM 344 HH22 ARG A 23 5.783 -22.843 -5.625 1.00 0.00 H ATOM 345 HH21 ARG A 23 6.583 -24.265 -6.388 1.00 0.00 H ATOM 346 H ARG A 23 0.535 -21.852 -11.123 1.00 0.00 H ATOM 347 N LEU A 24 3.627 -21.212 -8.806 1.00 15.85 N ATOM 348 CA LEU A 24 4.689 -20.245 -8.958 1.00 14.41 C ATOM 349 C LEU A 24 5.767 -20.470 -7.916 1.00 12.25 C ATOM 350 O LEU A 24 5.721 -19.872 -6.838 1.00 14.96 O ATOM 351 CB LEU A 24 4.131 -18.823 -8.870 1.00 13.18 C ATOM 352 CG LEU A 24 5.118 -17.691 -9.136 1.00 13.38 C ATOM 353 CD1 LEU A 24 5.818 -17.920 -10.454 1.00 9.29 C ATOM 354 CD2 LEU A 24 4.394 -16.346 -9.120 1.00 10.28 C ATOM 355 HA LEU A 24 5.139 -20.374 -9.942 1.00 0.00 H ATOM 356 HB2 LEU A 24 3.324 -18.737 -9.597 1.00 0.00 H ATOM 357 HB3 LEU A 24 3.730 -18.685 -7.866 1.00 0.00 H ATOM 358 HG LEU A 24 5.871 -17.676 -8.348 1.00 0.00 H ATOM 359 HD21 LEU A 24 3.625 -16.339 -9.893 1.00 0.00 H ATOM 360 HD22 LEU A 24 3.931 -16.195 -8.145 1.00 0.00 H ATOM 361 HD23 LEU A 24 5.110 -15.547 -9.311 1.00 0.00 H ATOM 362 HD11 LEU A 24 6.357 -18.867 -10.418 1.00 0.00 H ATOM 363 HD12 LEU A 24 5.080 -17.951 -11.255 1.00 0.00 H ATOM 364 HD13 LEU A 24 6.521 -17.107 -10.637 1.00 0.00 H ATOM 365 H LEU A 24 3.356 -21.535 -7.855 1.00 0.00 H ATOM 366 N PRO A 25 6.750 -21.328 -8.243 1.00 16.35 N ATOM 367 CA PRO A 25 7.854 -21.619 -7.313 1.00 13.76 C ATOM 368 C PRO A 25 8.672 -20.383 -6.970 1.00 13.68 C ATOM 369 O PRO A 25 9.287 -20.319 -5.908 1.00 14.57 O ATOM 370 CB PRO A 25 8.693 -22.657 -8.066 1.00 21.53 C ATOM 371 CG PRO A 25 8.269 -22.534 -9.516 1.00 20.72 C ATOM 372 CD PRO A 25 6.837 -22.127 -9.483 1.00 14.62 C ATOM 373 HA PRO A 25 7.493 -21.977 -6.348 1.00 0.00 H ATOM 374 HD3 PRO A 25 6.579 -21.527 -10.356 1.00 0.00 H ATOM 375 HD2 PRO A 25 6.182 -22.997 -9.436 1.00 0.00 H ATOM 376 HG3 PRO A 25 8.381 -23.490 -10.028 1.00 0.00 H ATOM 377 HG2 PRO A 25 8.868 -21.778 -10.025 1.00 0.00 H ATOM 378 HB2 PRO A 25 9.756 -22.441 -7.958 1.00 0.00 H ATOM 379 HB3 PRO A 25 8.488 -23.660 -7.691 1.00 0.00 H ATOM 380 N GLU A 26 8.671 -19.399 -7.853 1.00 7.90 N ATOM 381 CA GLU A 26 9.390 -18.180 -7.569 1.00 11.60 C ATOM 382 C GLU A 26 8.672 -17.385 -6.473 1.00 9.98 C ATOM 383 O GLU A 26 9.321 -16.700 -5.691 1.00 10.52 O ATOM 384 CB GLU A 26 9.582 -17.343 -8.840 1.00 12.88 C ATOM 385 CG GLU A 26 10.596 -17.923 -9.826 1.00 12.21 C ATOM 386 CD GLU A 26 9.995 -18.978 -10.742 1.00 18.92 C ATOM 387 OE1 GLU A 26 8.782 -19.322 -10.587 1.00 14.24 O ATOM 388 OE2 GLU A 26 10.746 -19.463 -11.616 1.00 18.97 O ATOM 389 HA GLU A 26 10.383 -18.440 -7.203 1.00 0.00 H ATOM 390 HB2 GLU A 26 8.620 -17.264 -9.346 1.00 0.00 H ATOM 391 HB3 GLU A 26 9.920 -16.349 -8.547 1.00 0.00 H ATOM 392 HG2 GLU A 26 10.988 -17.112 -10.440 1.00 0.00 H ATOM 393 HG3 GLU A 26 11.411 -18.376 -9.261 1.00 0.00 H ATOM 394 H GLU A 26 8.154 -19.503 -8.749 1.00 0.00 H ATOM 395 N ASP A 27 7.343 -17.499 -6.406 1.00 8.84 N ATOM 396 CA ASP A 27 6.592 -16.886 -5.324 1.00 11.54 C ATOM 397 C ASP A 27 6.899 -17.533 -3.966 1.00 12.03 C ATOM 398 O ASP A 27 7.057 -16.834 -2.964 1.00 7.89 O ATOM 399 CB ASP A 27 5.086 -16.918 -5.608 1.00 10.02 C ATOM 400 CG ASP A 27 4.259 -16.323 -4.469 1.00 12.52 C ATOM 401 OD1 ASP A 27 3.317 -16.992 -3.984 1.00 11.77 O ATOM 402 OD2 ASP A 27 4.541 -15.172 -4.069 1.00 14.00 O ATOM 403 HA ASP A 27 6.912 -15.845 -5.269 1.00 0.00 H ATOM 404 HB2 ASP A 27 4.890 -16.348 -6.516 1.00 0.00 H ATOM 405 HB3 ASP A 27 4.781 -17.954 -5.757 1.00 0.00 H ATOM 406 H ASP A 27 6.838 -18.035 -7.140 1.00 0.00 H ATOM 407 N GLN A 28 6.962 -18.862 -3.932 1.00 6.99 N ATOM 408 CA GLN A 28 7.264 -19.571 -2.687 1.00 10.01 C ATOM 409 C GLN A 28 8.647 -19.150 -2.179 1.00 12.89 C ATOM 410 O GLN A 28 8.832 -18.845 -0.996 1.00 11.24 O ATOM 411 CB GLN A 28 7.228 -21.085 -2.881 1.00 7.37 C ATOM 412 CG GLN A 28 5.881 -21.693 -3.151 1.00 11.98 C ATOM 413 CD GLN A 28 5.027 -21.643 -1.904 1.00 21.88 C ATOM 414 OE1 GLN A 28 5.574 -21.661 -0.791 1.00 17.67 O ATOM 415 NE2 GLN A 28 3.696 -21.567 -2.066 1.00 4.96 N ATOM 416 HA GLN A 28 6.501 -19.307 -1.955 1.00 0.00 H ATOM 417 HB2 GLN A 28 7.876 -21.327 -3.723 1.00 0.00 H ATOM 418 HB3 GLN A 28 7.624 -21.545 -1.976 1.00 0.00 H ATOM 419 HG2 GLN A 28 5.388 -21.137 -3.948 1.00 0.00 H ATOM 420 HG3 GLN A 28 6.009 -22.731 -3.459 1.00 0.00 H ATOM 421 HE22 GLN A 28 3.288 -21.555 -3.023 1.00 0.00 H ATOM 422 HE21 GLN A 28 3.073 -21.520 -1.235 1.00 0.00 H ATOM 423 H GLN A 28 6.794 -19.405 -4.803 1.00 0.00 H ATOM 424 N ALA A 29 9.615 -19.111 -3.087 1.00 9.48 N ATOM 425 CA ALA A 29 10.959 -18.696 -2.715 1.00 11.74 C ATOM 426 C ALA A 29 10.978 -17.228 -2.265 1.00 11.07 C ATOM 427 O ALA A 29 11.686 -16.873 -1.324 1.00 12.53 O ATOM 428 CB ALA A 29 11.916 -18.936 -3.859 1.00 5.32 C ATOM 429 HA ALA A 29 11.286 -19.299 -1.868 1.00 0.00 H ATOM 430 HB1 ALA A 29 11.926 -19.998 -4.106 1.00 0.00 H ATOM 431 HB2 ALA A 29 11.593 -18.362 -4.728 1.00 0.00 H ATOM 432 HB3 ALA A 29 12.917 -18.621 -3.566 1.00 0.00 H ATOM 433 H ALA A 29 9.411 -19.379 -4.071 1.00 0.00 H ATOM 434 N HIS A 30 10.211 -16.385 -2.956 1.00 8.01 N ATOM 435 CA HIS A 30 10.074 -14.981 -2.581 1.00 10.57 C ATOM 436 C HIS A 30 9.500 -14.848 -1.165 1.00 10.02 C ATOM 437 O HIS A 30 9.999 -14.074 -0.344 1.00 14.66 O ATOM 438 CB HIS A 30 9.175 -14.248 -3.576 1.00 7.87 C ATOM 439 CG HIS A 30 8.794 -12.859 -3.151 1.00 12.06 C ATOM 440 ND1 HIS A 30 9.723 -11.875 -2.900 1.00 8.18 N ATOM 441 CD2 HIS A 30 7.578 -12.296 -2.941 1.00 8.64 C ATOM 442 CE1 HIS A 30 9.098 -10.764 -2.542 1.00 5.21 C ATOM 443 NE2 HIS A 30 7.798 -10.991 -2.572 1.00 9.45 N ATOM 444 HA HIS A 30 11.066 -14.529 -2.598 1.00 0.00 H ATOM 445 HB2 HIS A 30 9.701 -14.183 -4.529 1.00 0.00 H ATOM 446 HB3 HIS A 30 8.262 -14.829 -3.705 1.00 0.00 H ATOM 447 HD2 HIS A 30 6.610 -12.786 -3.045 1.00 0.00 H ATOM 448 HE1 HIS A 30 9.575 -9.823 -2.269 1.00 0.00 H ATOM 449 H HIS A 30 9.695 -16.738 -3.787 1.00 0.00 H ATOM 450 N PHE A 31 8.456 -15.617 -0.891 1.00 10.88 N ATOM 451 CA PHE A 31 7.759 -15.566 0.388 1.00 15.89 C ATOM 452 C PHE A 31 8.701 -15.939 1.525 1.00 13.02 C ATOM 453 O PHE A 31 8.793 -15.245 2.546 1.00 10.49 O ATOM 454 CB PHE A 31 6.543 -16.498 0.342 1.00 10.06 C ATOM 455 CG PHE A 31 5.928 -16.764 1.683 1.00 7.55 C ATOM 456 CD1 PHE A 31 5.049 -15.852 2.246 1.00 9.48 C ATOM 457 CD2 PHE A 31 6.221 -17.931 2.376 1.00 9.80 C ATOM 458 CE1 PHE A 31 4.469 -16.084 3.480 1.00 8.63 C ATOM 459 CE2 PHE A 31 5.637 -18.182 3.616 1.00 13.01 C ATOM 460 CZ PHE A 31 4.763 -17.254 4.173 1.00 8.50 C ATOM 461 HA PHE A 31 7.412 -14.549 0.572 1.00 0.00 H ATOM 462 HB2 PHE A 31 5.787 -16.044 -0.298 1.00 0.00 H ATOM 463 HB3 PHE A 31 6.856 -17.450 -0.087 1.00 0.00 H ATOM 464 HD2 PHE A 31 6.913 -18.656 1.947 1.00 0.00 H ATOM 465 HE2 PHE A 31 5.865 -19.105 4.149 1.00 0.00 H ATOM 466 HZ PHE A 31 4.311 -17.442 5.147 1.00 0.00 H ATOM 467 HE1 PHE A 31 3.784 -15.352 3.908 1.00 0.00 H ATOM 468 HD1 PHE A 31 4.811 -14.935 1.706 1.00 0.00 H ATOM 469 H PHE A 31 8.121 -16.283 -1.617 1.00 0.00 H ATOM 470 N ARG A 32 9.403 -17.043 1.318 1.00 14.34 N ATOM 471 CA ARG A 32 10.397 -17.541 2.253 1.00 16.02 C ATOM 472 C ARG A 32 11.454 -16.473 2.501 1.00 13.81 C ATOM 473 O ARG A 32 11.800 -16.195 3.639 1.00 14.79 O ATOM 474 CB ARG A 32 11.023 -18.806 1.671 1.00 16.59 C ATOM 475 CG ARG A 32 11.961 -19.569 2.580 1.00 22.97 C ATOM 476 CD ARG A 32 12.655 -20.668 1.773 1.00 27.92 C ATOM 477 NE ARG A 32 13.347 -21.663 2.588 1.00 26.05 N ATOM 478 CZ ARG A 32 14.589 -21.527 3.050 1.00 39.12 C ATOM 479 NH1 ARG A 32 15.278 -20.423 2.790 1.00 38.16 N ATOM 480 NH2 ARG A 32 15.145 -22.490 3.780 1.00 31.10 N ATOM 481 HA ARG A 32 9.931 -17.780 3.209 1.00 0.00 H ATOM 482 HB2 ARG A 32 10.213 -19.479 1.389 1.00 0.00 H ATOM 483 HB3 ARG A 32 11.583 -18.520 0.780 1.00 0.00 H ATOM 484 HG2 ARG A 32 12.708 -18.888 2.989 1.00 0.00 H ATOM 485 HG3 ARG A 32 11.395 -20.017 3.396 1.00 0.00 H ATOM 486 HD2 ARG A 32 13.385 -20.199 1.113 1.00 0.00 H ATOM 487 HD3 ARG A 32 11.902 -21.180 1.174 1.00 0.00 H ATOM 488 HE ARG A 32 12.835 -22.537 2.824 1.00 0.00 H ATOM 489 HH12 ARG A 32 16.248 -20.318 3.151 1.00 0.00 H ATOM 490 HH11 ARG A 32 14.848 -19.663 2.225 1.00 0.00 H ATOM 491 HH22 ARG A 32 16.115 -22.377 4.137 1.00 0.00 H ATOM 492 HH21 ARG A 32 14.610 -23.356 3.993 1.00 0.00 H ATOM 493 H ARG A 32 9.234 -17.580 0.443 1.00 0.00 H ATOM 494 N GLU A 33 11.939 -15.858 1.425 1.00 16.02 N ATOM 495 CA GLU A 33 12.993 -14.841 1.495 1.00 13.45 C ATOM 496 C GLU A 33 12.619 -13.608 2.346 1.00 14.09 C ATOM 497 O GLU A 33 13.456 -13.056 3.059 1.00 15.25 O ATOM 498 CB GLU A 33 13.366 -14.419 0.067 1.00 19.10 C ATOM 499 CG GLU A 33 14.590 -13.533 -0.072 1.00 25.43 C ATOM 500 CD GLU A 33 15.110 -13.502 -1.508 1.00 27.63 C ATOM 501 OE1 GLU A 33 14.783 -12.555 -2.256 1.00 18.95 O ATOM 502 OE2 GLU A 33 15.853 -14.434 -1.891 1.00 25.28 O ATOM 503 HA GLU A 33 13.846 -15.292 2.002 1.00 0.00 H ATOM 504 HB2 GLU A 33 13.544 -15.325 -0.512 1.00 0.00 H ATOM 505 HB3 GLU A 33 12.516 -13.881 -0.354 1.00 0.00 H ATOM 506 HG2 GLU A 33 14.328 -12.519 0.230 1.00 0.00 H ATOM 507 HG3 GLU A 33 15.377 -13.913 0.580 1.00 0.00 H ATOM 508 H GLU A 33 11.553 -16.110 0.493 1.00 0.00 H ATOM 509 N ILE A 34 11.360 -13.188 2.270 1.00 8.54 N ATOM 510 CA ILE A 34 10.881 -12.019 3.007 1.00 7.25 C ATOM 511 C ILE A 34 10.679 -12.350 4.491 1.00 11.04 C ATOM 512 O ILE A 34 10.961 -11.536 5.377 1.00 9.95 O ATOM 513 CB ILE A 34 9.539 -11.503 2.388 1.00 14.55 C ATOM 514 CG1 ILE A 34 9.810 -10.738 1.093 1.00 11.50 C ATOM 515 CG2 ILE A 34 8.763 -10.621 3.352 1.00 10.85 C ATOM 516 CD1 ILE A 34 10.584 -9.486 1.318 1.00 12.01 C ATOM 517 HA ILE A 34 11.636 -11.237 2.929 1.00 0.00 H ATOM 518 HB ILE A 34 8.927 -12.380 2.175 1.00 0.00 H ATOM 519 HG12 ILE A 34 10.375 -11.382 0.419 1.00 0.00 H ATOM 520 HG13 ILE A 34 8.856 -10.481 0.633 1.00 0.00 H ATOM 521 HD11 ILE A 34 10.025 -8.829 1.984 1.00 0.00 H ATOM 522 HD12 ILE A 34 11.545 -9.731 1.770 1.00 0.00 H ATOM 523 HD13 ILE A 34 10.747 -8.985 0.364 1.00 0.00 H ATOM 524 HG21 ILE A 34 8.525 -11.189 4.251 1.00 0.00 H ATOM 525 HG22 ILE A 34 9.369 -9.755 3.618 1.00 0.00 H ATOM 526 HG23 ILE A 34 7.840 -10.289 2.876 1.00 0.00 H ATOM 527 H ILE A 34 10.693 -13.709 1.666 1.00 0.00 H ATOM 528 N THR A 35 10.202 -13.563 4.753 1.00 10.14 N ATOM 529 CA THR A 35 9.748 -13.927 6.087 1.00 13.33 C ATOM 530 C THR A 35 10.771 -14.710 6.899 1.00 11.13 C ATOM 531 O THR A 35 10.657 -14.791 8.121 1.00 10.90 O ATOM 532 CB THR A 35 8.388 -14.682 6.043 1.00 7.34 C ATOM 533 OG1 THR A 35 8.502 -15.849 5.221 1.00 10.82 O ATOM 534 CG2 THR A 35 7.335 -13.804 5.467 1.00 8.59 C ATOM 535 HA THR A 35 9.609 -12.979 6.608 1.00 0.00 H ATOM 536 HB THR A 35 8.120 -14.966 7.061 1.00 0.00 H ATOM 537 HG1 THR A 35 8.756 -15.581 4.303 1.00 0.00 H ATOM 538 HG23 THR A 35 7.234 -12.909 6.081 1.00 0.00 H ATOM 539 HG21 THR A 35 7.615 -13.521 4.452 1.00 0.00 H ATOM 540 HG22 THR A 35 6.387 -14.341 5.447 1.00 0.00 H ATOM 541 H THR A 35 10.152 -14.267 3.989 1.00 0.00 H ATOM 542 N MET A 36 11.785 -15.259 6.237 1.00 12.87 N ATOM 543 CA MET A 36 12.771 -16.088 6.932 1.00 8.49 C ATOM 544 C MET A 36 13.429 -15.343 8.095 1.00 12.81 C ATOM 545 O MET A 36 13.833 -14.192 7.951 1.00 8.81 O ATOM 546 CB MET A 36 13.823 -16.620 5.950 1.00 16.90 C ATOM 547 CG MET A 36 14.760 -17.669 6.523 1.00 13.98 C ATOM 548 SD MET A 36 13.931 -19.025 7.367 1.00 34.30 S ATOM 549 CE MET A 36 12.679 -19.508 6.188 1.00 20.24 C ATOM 550 HA MET A 36 12.239 -16.938 7.359 1.00 0.00 H ATOM 551 HB2 MET A 36 13.301 -17.060 5.100 1.00 0.00 H ATOM 552 HB3 MET A 36 14.425 -15.778 5.609 1.00 0.00 H ATOM 553 HG2 MET A 36 15.425 -17.180 7.235 1.00 0.00 H ATOM 554 HG3 MET A 36 15.348 -18.085 5.705 1.00 0.00 H ATOM 555 HE1 MET A 36 12.018 -18.663 5.995 1.00 0.00 H ATOM 556 HE2 MET A 36 13.157 -19.817 5.258 1.00 0.00 H ATOM 557 HE3 MET A 36 12.100 -20.338 6.594 1.00 0.00 H ATOM 558 H MET A 36 11.879 -15.098 5.214 1.00 0.00 H ATOM 559 N GLY A 37 13.489 -15.987 9.260 1.00 7.16 N ATOM 560 CA GLY A 37 14.153 -15.394 10.402 1.00 15.74 C ATOM 561 C GLY A 37 13.299 -14.418 11.181 1.00 15.06 C ATOM 562 O GLY A 37 13.746 -13.877 12.183 1.00 22.22 O ATOM 563 HA3 GLY A 37 15.038 -14.866 10.047 1.00 0.00 H ATOM 564 HA2 GLY A 37 14.456 -16.196 11.075 1.00 0.00 H ATOM 565 H GLY A 37 13.054 -16.927 9.350 1.00 0.00 H ATOM 566 N HIS A 38 12.066 -14.203 10.725 1.00 15.94 N ATOM 567 CA HIS A 38 11.125 -13.326 11.407 1.00 15.26 C ATOM 568 C HIS A 38 9.924 -14.118 11.912 1.00 12.82 C ATOM 569 O HIS A 38 9.871 -15.342 11.780 1.00 14.21 O ATOM 570 CB HIS A 38 10.653 -12.189 10.483 1.00 14.13 C ATOM 571 CG HIS A 38 11.767 -11.471 9.785 1.00 18.81 C ATOM 572 ND1 HIS A 38 12.845 -10.934 10.459 1.00 14.41 N ATOM 573 CD2 HIS A 38 11.972 -11.207 8.474 1.00 19.33 C ATOM 574 CE1 HIS A 38 13.669 -10.376 9.589 1.00 15.94 C ATOM 575 NE2 HIS A 38 13.163 -10.525 8.378 1.00 17.99 N ATOM 576 HA HIS A 38 11.642 -12.884 12.258 1.00 0.00 H ATOM 577 HB2 HIS A 38 9.991 -12.613 9.728 1.00 0.00 H ATOM 578 HB3 HIS A 38 10.101 -11.466 11.083 1.00 0.00 H ATOM 579 HD2 HIS A 38 11.316 -11.483 7.648 1.00 0.00 H ATOM 580 HE1 HIS A 38 14.608 -9.877 9.830 1.00 0.00 H ATOM 581 H HIS A 38 11.765 -14.679 9.851 1.00 0.00 H ATOM 582 N THR A 39 8.980 -13.407 12.515 1.00 12.59 N ATOM 583 CA THR A 39 7.723 -13.989 12.969 1.00 10.25 C ATOM 584 C THR A 39 6.729 -13.983 11.819 1.00 12.01 C ATOM 585 O THR A 39 6.643 -12.999 11.081 1.00 7.73 O ATOM 586 CB THR A 39 7.115 -13.156 14.131 1.00 14.21 C ATOM 587 OG1 THR A 39 8.027 -13.112 15.238 1.00 9.47 O ATOM 588 CG2 THR A 39 5.790 -13.740 14.594 1.00 11.45 C ATOM 589 HA THR A 39 7.921 -15.004 13.315 1.00 0.00 H ATOM 590 HB THR A 39 6.939 -12.147 13.759 1.00 0.00 H ATOM 591 HG1 THR A 39 8.876 -12.694 14.948 1.00 0.00 H ATOM 592 HG23 THR A 39 5.096 -13.774 13.754 1.00 0.00 H ATOM 593 HG21 THR A 39 5.952 -14.749 14.974 1.00 0.00 H ATOM 594 HG22 THR A 39 5.375 -13.115 15.385 1.00 0.00 H ATOM 595 H THR A 39 9.144 -12.392 12.670 1.00 0.00 H ATOM 596 N ILE A 40 5.984 -15.077 11.670 1.00 9.95 N ATOM 597 CA ILE A 40 4.834 -15.107 10.776 1.00 9.28 C ATOM 598 C ILE A 40 3.524 -15.277 11.555 1.00 6.58 C ATOM 599 O ILE A 40 3.454 -16.043 12.517 1.00 6.08 O ATOM 600 CB ILE A 40 4.964 -16.232 9.721 1.00 9.08 C ATOM 601 CG1 ILE A 40 5.076 -17.606 10.385 1.00 7.75 C ATOM 602 CG2 ILE A 40 6.193 -16.029 8.868 1.00 10.21 C ATOM 603 CD1 ILE A 40 5.074 -18.737 9.380 1.00 7.60 C ATOM 604 HA ILE A 40 4.812 -14.147 10.259 1.00 0.00 H ATOM 605 HB ILE A 40 4.066 -16.191 9.105 1.00 0.00 H ATOM 606 HG12 ILE A 40 6.005 -17.645 10.954 1.00 0.00 H ATOM 607 HG13 ILE A 40 4.231 -17.738 11.061 1.00 0.00 H ATOM 608 HD11 ILE A 40 4.145 -18.714 8.810 1.00 0.00 H ATOM 609 HD12 ILE A 40 5.920 -18.621 8.703 1.00 0.00 H ATOM 610 HD13 ILE A 40 5.156 -19.688 9.906 1.00 0.00 H ATOM 611 HG21 ILE A 40 6.122 -15.071 8.353 1.00 0.00 H ATOM 612 HG22 ILE A 40 7.079 -16.038 9.502 1.00 0.00 H ATOM 613 HG23 ILE A 40 6.262 -16.833 8.135 1.00 0.00 H ATOM 614 H ILE A 40 6.230 -15.933 12.207 1.00 0.00 H ATOM 615 N VAL A 41 2.476 -14.579 11.129 1.00 7.95 N ATOM 616 CA VAL A 41 1.188 -14.692 11.809 1.00 7.18 C ATOM 617 C VAL A 41 0.097 -15.207 10.889 1.00 6.51 C ATOM 618 O VAL A 41 -0.096 -14.684 9.799 1.00 7.00 O ATOM 619 CB VAL A 41 0.765 -13.350 12.452 1.00 12.05 C ATOM 620 CG1 VAL A 41 -0.673 -13.409 12.955 1.00 6.35 C ATOM 621 CG2 VAL A 41 1.713 -13.006 13.589 1.00 9.68 C ATOM 622 HA VAL A 41 1.322 -15.425 12.604 1.00 0.00 H ATOM 623 HB VAL A 41 0.818 -12.570 11.692 1.00 0.00 H ATOM 624 HG11 VAL A 41 -1.340 -13.621 12.120 1.00 0.00 H ATOM 625 HG12 VAL A 41 -0.763 -14.197 13.702 1.00 0.00 H ATOM 626 HG13 VAL A 41 -0.940 -12.451 13.401 1.00 0.00 H ATOM 627 HG21 VAL A 41 1.678 -13.795 14.341 1.00 0.00 H ATOM 628 HG22 VAL A 41 2.727 -12.917 13.200 1.00 0.00 H ATOM 629 HG23 VAL A 41 1.411 -12.060 14.039 1.00 0.00 H ATOM 630 H VAL A 41 2.574 -13.949 10.307 1.00 0.00 H ATOM 631 N MET A 42 -0.623 -16.234 11.333 1.00 5.87 N ATOM 632 CA MET A 42 -1.671 -16.799 10.509 1.00 9.47 C ATOM 633 C MET A 42 -2.912 -17.057 11.325 1.00 6.93 C ATOM 634 O MET A 42 -2.835 -17.224 12.530 1.00 12.08 O ATOM 635 CB MET A 42 -1.182 -18.098 9.855 1.00 7.64 C ATOM 636 CG MET A 42 -0.980 -19.250 10.830 1.00 7.80 C ATOM 637 SD MET A 42 -0.226 -20.674 10.034 1.00 11.91 S ATOM 638 CE MET A 42 1.508 -20.222 10.128 1.00 4.66 C ATOM 639 HA MET A 42 -1.922 -16.082 9.727 1.00 0.00 H ATOM 640 HB2 MET A 42 -1.917 -18.404 9.111 1.00 0.00 H ATOM 641 HB3 MET A 42 -0.231 -17.896 9.362 1.00 0.00 H ATOM 642 HG2 MET A 42 -1.948 -19.544 11.235 1.00 0.00 H ATOM 643 HG3 MET A 42 -0.334 -18.916 11.642 1.00 0.00 H ATOM 644 HE1 MET A 42 1.667 -19.285 9.594 1.00 0.00 H ATOM 645 HE2 MET A 42 1.794 -20.100 11.173 1.00 0.00 H ATOM 646 HE3 MET A 42 2.112 -21.007 9.674 1.00 0.00 H ATOM 647 H MET A 42 -0.432 -16.632 12.275 1.00 0.00 H ATOM 648 N GLY A 43 -4.059 -17.099 10.668 1.00 9.31 N ATOM 649 CA GLY A 43 -5.277 -17.539 11.314 1.00 8.09 C ATOM 650 C GLY A 43 -5.325 -19.046 11.463 1.00 8.38 C ATOM 651 O GLY A 43 -4.720 -19.774 10.681 1.00 12.54 O ATOM 652 HA3 GLY A 43 -6.130 -17.216 10.716 1.00 0.00 H ATOM 653 HA2 GLY A 43 -5.336 -17.085 12.303 1.00 0.00 H ATOM 654 H GLY A 43 -4.086 -16.811 9.669 1.00 0.00 H ATOM 655 N ARG A 44 -6.037 -19.501 12.488 1.00 15.46 N ATOM 656 CA ARG A 44 -6.221 -20.918 12.798 1.00 8.94 C ATOM 657 C ARG A 44 -6.628 -21.732 11.560 1.00 13.59 C ATOM 658 O ARG A 44 -6.212 -22.881 11.394 1.00 8.03 O ATOM 659 CB ARG A 44 -7.290 -21.052 13.896 1.00 10.02 C ATOM 660 CG ARG A 44 -7.483 -22.458 14.489 1.00 8.15 C ATOM 661 CD ARG A 44 -8.392 -23.334 13.629 1.00 9.67 C ATOM 662 NE ARG A 44 -9.800 -22.988 13.792 1.00 6.83 N ATOM 663 CZ ARG A 44 -10.785 -23.505 13.072 1.00 13.17 C ATOM 664 NH1 ARG A 44 -10.517 -24.392 12.118 1.00 12.38 N ATOM 665 NH2 ARG A 44 -12.041 -23.140 13.313 1.00 10.35 N ATOM 666 HA ARG A 44 -5.269 -21.320 13.145 1.00 0.00 H ATOM 667 HB2 ARG A 44 -7.016 -20.382 14.711 1.00 0.00 H ATOM 668 HB3 ARG A 44 -8.243 -20.736 13.473 1.00 0.00 H ATOM 669 HG2 ARG A 44 -6.509 -22.940 14.572 1.00 0.00 H ATOM 670 HG3 ARG A 44 -7.925 -22.362 15.481 1.00 0.00 H ATOM 671 HD2 ARG A 44 -8.250 -24.376 13.915 1.00 0.00 H ATOM 672 HD3 ARG A 44 -8.117 -23.206 12.582 1.00 0.00 H ATOM 673 HE ARG A 44 -10.047 -22.289 14.522 1.00 0.00 H ATOM 674 HH12 ARG A 44 -11.290 -24.798 11.553 1.00 0.00 H ATOM 675 HH11 ARG A 44 -9.534 -24.680 11.937 1.00 0.00 H ATOM 676 HH22 ARG A 44 -12.817 -23.543 12.750 1.00 0.00 H ATOM 677 HH21 ARG A 44 -12.247 -22.451 14.064 1.00 0.00 H ATOM 678 H ARG A 44 -6.493 -18.804 13.111 1.00 0.00 H ATOM 679 N ARG A 45 -7.471 -21.152 10.713 1.00 13.80 N ATOM 680 CA ARG A 45 -7.960 -21.885 9.546 1.00 13.80 C ATOM 681 C ARG A 45 -6.852 -22.127 8.530 1.00 10.59 C ATOM 682 O ARG A 45 -6.806 -23.169 7.880 1.00 16.26 O ATOM 683 CB ARG A 45 -9.155 -21.172 8.924 1.00 14.89 C ATOM 684 CG ARG A 45 -10.452 -21.427 9.700 1.00 18.40 C ATOM 685 CD ARG A 45 -11.620 -20.759 9.054 1.00 14.27 C ATOM 686 NE ARG A 45 -11.409 -19.319 8.969 1.00 17.59 N ATOM 687 HA ARG A 45 -8.297 -22.866 9.882 1.00 0.00 H ATOM 688 HB2 ARG A 45 -8.957 -20.100 8.913 1.00 0.00 H ATOM 689 HB3 ARG A 45 -9.282 -21.527 7.901 1.00 0.00 H ATOM 690 HG2 ARG A 45 -10.636 -22.501 9.739 1.00 0.00 H ATOM 691 HG3 ARG A 45 -10.340 -21.041 10.713 1.00 0.00 H ATOM 692 HD2 ARG A 45 -12.516 -20.955 9.643 1.00 0.00 H ATOM 693 HD3 ARG A 45 -11.752 -21.161 8.050 1.00 0.00 H ATOM 694 HE ARG A 45 -10.531 -18.900 9.336 1.00 0.00 H ATOM 695 H ARG A 45 -7.784 -20.174 10.880 1.00 0.00 H ATOM 696 N THR A 46 -5.942 -21.167 8.431 1.00 14.37 N ATOM 697 CA THR A 46 -4.761 -21.270 7.580 1.00 13.18 C ATOM 698 C THR A 46 -3.779 -22.361 8.072 1.00 11.98 C ATOM 699 O THR A 46 -3.294 -23.179 7.283 1.00 5.90 O ATOM 700 CB THR A 46 -4.077 -19.880 7.433 1.00 12.25 C ATOM 701 OG1 THR A 46 -4.943 -18.993 6.712 1.00 8.67 O ATOM 702 CG2 THR A 46 -2.743 -19.970 6.695 1.00 11.98 C ATOM 703 HA THR A 46 -5.086 -21.588 6.589 1.00 0.00 H ATOM 704 HB THR A 46 -3.885 -19.504 8.438 1.00 0.00 H ATOM 705 HG1 THR A 46 -5.124 -19.368 5.814 1.00 0.00 H ATOM 706 HG23 THR A 46 -2.076 -20.642 7.234 1.00 0.00 H ATOM 707 HG21 THR A 46 -2.911 -20.353 5.688 1.00 0.00 H ATOM 708 HG22 THR A 46 -2.293 -18.979 6.637 1.00 0.00 H ATOM 709 H THR A 46 -6.077 -20.299 8.987 1.00 0.00 H ATOM 710 N TRP A 47 -3.501 -22.386 9.371 1.00 8.05 N ATOM 711 CA TRP A 47 -2.690 -23.470 9.951 1.00 6.45 C ATOM 712 C TRP A 47 -3.343 -24.827 9.679 1.00 9.30 C ATOM 713 O TRP A 47 -2.652 -25.786 9.337 1.00 11.10 O ATOM 714 CB TRP A 47 -2.484 -23.253 11.460 1.00 8.21 C ATOM 715 CG TRP A 47 -1.773 -24.365 12.200 1.00 5.88 C ATOM 716 CD1 TRP A 47 -2.341 -25.461 12.772 1.00 7.54 C ATOM 717 CD2 TRP A 47 -0.358 -24.466 12.460 1.00 9.21 C ATOM 718 NE1 TRP A 47 -1.378 -26.240 13.376 1.00 10.03 N ATOM 719 CE2 TRP A 47 -0.151 -25.655 13.194 1.00 11.43 C ATOM 720 CE3 TRP A 47 0.744 -23.671 12.151 1.00 9.51 C ATOM 721 CZ2 TRP A 47 1.113 -26.064 13.612 1.00 6.97 C ATOM 722 CZ3 TRP A 47 2.008 -24.086 12.572 1.00 7.49 C ATOM 723 CH2 TRP A 47 2.174 -25.269 13.294 1.00 8.18 C ATOM 724 HA TRP A 47 -1.709 -23.459 9.475 1.00 0.00 H ATOM 725 HB2 TRP A 47 -1.902 -22.341 11.589 1.00 0.00 H ATOM 726 HB3 TRP A 47 -3.466 -23.124 11.916 1.00 0.00 H ATOM 727 HE1 TRP A 47 -1.553 -27.128 13.887 1.00 0.00 H ATOM 728 HD1 TRP A 47 -3.406 -25.690 12.755 1.00 0.00 H ATOM 729 HZ2 TRP A 47 1.249 -26.988 14.174 1.00 0.00 H ATOM 730 HH2 TRP A 47 3.174 -25.564 13.611 1.00 0.00 H ATOM 731 HZ3 TRP A 47 2.880 -23.477 12.333 1.00 0.00 H ATOM 732 HE3 TRP A 47 0.621 -22.744 11.592 1.00 0.00 H ATOM 733 H TRP A 47 -3.861 -21.629 9.987 1.00 0.00 H ATOM 734 N ASP A 48 -4.673 -24.881 9.826 1.00 8.22 N ATOM 735 CA ASP A 48 -5.473 -26.090 9.621 1.00 7.71 C ATOM 736 C ASP A 48 -5.418 -26.584 8.166 1.00 9.19 C ATOM 737 O ASP A 48 -5.629 -27.760 7.894 1.00 7.41 O ATOM 738 CB ASP A 48 -6.947 -25.829 10.008 1.00 11.03 C ATOM 739 CG ASP A 48 -7.293 -26.290 11.431 1.00 16.37 C ATOM 740 OD1 ASP A 48 -6.378 -26.561 12.226 1.00 8.32 O ATOM 741 OD2 ASP A 48 -8.498 -26.376 11.764 1.00 17.01 O ATOM 742 HA ASP A 48 -5.047 -26.863 10.260 1.00 0.00 H ATOM 743 HB2 ASP A 48 -7.140 -24.759 9.934 1.00 0.00 H ATOM 744 HB3 ASP A 48 -7.589 -26.362 9.306 1.00 0.00 H ATOM 745 H ASP A 48 -5.169 -24.010 10.103 1.00 0.00 H ATOM 746 N SER A 49 -5.158 -25.679 7.229 1.00 7.71 N ATOM 747 CA SER A 49 -5.112 -26.046 5.828 1.00 9.84 C ATOM 748 C SER A 49 -3.691 -26.442 5.376 1.00 9.39 C ATOM 749 O SER A 49 -3.510 -27.046 4.324 1.00 8.94 O ATOM 750 CB SER A 49 -5.694 -24.929 4.951 1.00 10.68 C ATOM 751 OG SER A 49 -4.899 -23.759 4.989 1.00 13.76 O ATOM 752 HA SER A 49 -5.735 -26.931 5.703 1.00 0.00 H ATOM 753 HB2 SER A 49 -6.695 -24.687 5.307 1.00 0.00 H ATOM 754 HB3 SER A 49 -5.752 -25.283 3.922 1.00 0.00 H ATOM 755 HG SER A 49 -5.307 -23.065 4.413 1.00 0.00 H ATOM 756 H SER A 49 -4.985 -24.691 7.505 1.00 0.00 H ATOM 757 N LEU A 50 -2.685 -26.116 6.172 1.00 7.69 N ATOM 758 CA LEU A 50 -1.327 -26.584 5.865 1.00 12.12 C ATOM 759 C LEU A 50 -1.167 -28.066 6.222 1.00 12.58 C ATOM 760 O LEU A 50 -1.654 -28.510 7.265 1.00 8.97 O ATOM 761 CB LEU A 50 -0.275 -25.771 6.626 1.00 9.80 C ATOM 762 CG LEU A 50 0.066 -24.322 6.266 1.00 10.32 C ATOM 763 CD1 LEU A 50 0.777 -23.660 7.444 1.00 5.74 C ATOM 764 CD2 LEU A 50 0.936 -24.262 5.004 1.00 9.27 C ATOM 765 HA LEU A 50 -1.175 -26.450 4.794 1.00 0.00 H ATOM 766 HB2 LEU A 50 -0.599 -25.756 7.667 1.00 0.00 H ATOM 767 HB3 LEU A 50 0.657 -26.330 6.545 1.00 0.00 H ATOM 768 HG LEU A 50 -0.858 -23.782 6.056 1.00 0.00 H ATOM 769 HD21 LEU A 50 1.863 -24.808 5.177 1.00 0.00 H ATOM 770 HD22 LEU A 50 0.397 -24.713 4.171 1.00 0.00 H ATOM 771 HD23 LEU A 50 1.164 -23.222 4.770 1.00 0.00 H ATOM 772 HD11 LEU A 50 0.123 -23.675 8.316 1.00 0.00 H ATOM 773 HD12 LEU A 50 1.694 -24.206 7.666 1.00 0.00 H ATOM 774 HD13 LEU A 50 1.020 -22.629 7.187 1.00 0.00 H ATOM 775 H LEU A 50 -2.856 -25.529 7.014 1.00 0.00 H ATOM 776 N PRO A 51 -0.462 -28.835 5.371 1.00 14.09 N ATOM 777 CA PRO A 51 -0.228 -30.250 5.711 1.00 12.22 C ATOM 778 C PRO A 51 0.523 -30.363 7.038 1.00 14.51 C ATOM 779 O PRO A 51 1.318 -29.477 7.352 1.00 10.29 O ATOM 780 CB PRO A 51 0.651 -30.754 4.557 1.00 13.20 C ATOM 781 CG PRO A 51 0.355 -29.818 3.401 1.00 8.97 C ATOM 782 CD PRO A 51 0.079 -28.473 4.047 1.00 11.14 C ATOM 783 HA PRO A 51 -1.150 -30.819 5.827 1.00 0.00 H ATOM 784 HD3 PRO A 51 0.996 -27.892 4.145 1.00 0.00 H ATOM 785 HD2 PRO A 51 -0.650 -27.905 3.469 1.00 0.00 H ATOM 786 HG3 PRO A 51 -0.516 -30.161 2.843 1.00 0.00 H ATOM 787 HG2 PRO A 51 1.212 -29.753 2.731 1.00 0.00 H ATOM 788 HB2 PRO A 51 1.705 -30.706 4.829 1.00 0.00 H ATOM 789 HB3 PRO A 51 0.391 -31.780 4.296 1.00 0.00 H ATOM 790 N ALA A 52 0.269 -31.422 7.810 1.00 14.08 N ATOM 791 CA ALA A 52 0.962 -31.596 9.083 1.00 11.84 C ATOM 792 C ALA A 52 2.458 -31.691 8.805 1.00 13.66 C ATOM 793 O ALA A 52 3.284 -31.263 9.609 1.00 13.56 O ATOM 794 CB ALA A 52 0.472 -32.840 9.809 1.00 10.05 C ATOM 795 HA ALA A 52 0.755 -30.743 9.730 1.00 0.00 H ATOM 796 HB1 ALA A 52 -0.597 -32.749 10.003 1.00 0.00 H ATOM 797 HB2 ALA A 52 0.656 -33.717 9.189 1.00 0.00 H ATOM 798 HB3 ALA A 52 1.007 -32.942 10.753 1.00 0.00 H ATOM 799 H ALA A 52 -0.429 -32.129 7.502 1.00 0.00 H ATOM 800 N LYS A 53 2.790 -32.233 7.638 1.00 17.82 N ATOM 801 CA LYS A 53 4.176 -32.374 7.222 1.00 14.07 C ATOM 802 C LYS A 53 4.897 -31.019 7.149 1.00 15.64 C ATOM 803 O LYS A 53 6.095 -30.924 7.438 1.00 10.81 O ATOM 804 CB LYS A 53 4.235 -33.110 5.875 1.00 15.07 C ATOM 805 CG LYS A 53 5.644 -33.196 5.240 1.00 25.64 C ATOM 806 CD LYS A 53 6.582 -34.165 6.001 1.00 12.32 C ATOM 807 CE LYS A 53 7.963 -34.202 5.331 1.00 23.73 C ATOM 808 NZ LYS A 53 8.924 -35.172 5.968 1.00 22.10 N ATOM 809 HA LYS A 53 4.701 -32.963 7.974 1.00 0.00 H ATOM 810 HB2 LYS A 53 3.870 -34.126 6.028 1.00 0.00 H ATOM 811 HB3 LYS A 53 3.580 -32.590 5.176 1.00 0.00 H ATOM 812 HG2 LYS A 53 5.543 -33.543 4.212 1.00 0.00 H ATOM 813 HG3 LYS A 53 6.091 -32.202 5.245 1.00 0.00 H ATOM 814 HD2 LYS A 53 6.690 -33.827 7.031 1.00 0.00 H ATOM 815 HD3 LYS A 53 6.150 -35.166 5.992 1.00 0.00 H ATOM 816 HE2 LYS A 53 8.397 -33.204 5.383 1.00 0.00 H ATOM 817 HE3 LYS A 53 7.831 -34.485 4.287 1.00 0.00 H ATOM 818 HZ1 LYS A 53 9.071 -34.909 6.964 1.00 0.00 H ATOM 819 HZ2 LYS A 53 8.530 -36.133 5.916 1.00 0.00 H ATOM 820 HZ3 LYS A 53 9.832 -35.141 5.462 1.00 0.00 H ATOM 821 H LYS A 53 2.036 -32.566 7.004 1.00 0.00 H ATOM 822 N VAL A 54 4.173 -29.965 6.780 1.00 12.12 N ATOM 823 CA VAL A 54 4.841 -28.687 6.538 1.00 13.29 C ATOM 824 C VAL A 54 4.783 -27.688 7.717 1.00 16.49 C ATOM 825 O VAL A 54 5.628 -26.803 7.818 1.00 19.37 O ATOM 826 CB VAL A 54 4.399 -28.033 5.207 1.00 14.92 C ATOM 827 CG1 VAL A 54 4.473 -29.046 4.054 1.00 14.70 C ATOM 828 CG2 VAL A 54 2.997 -27.484 5.336 1.00 15.44 C ATOM 829 HA VAL A 54 5.895 -28.950 6.446 1.00 0.00 H ATOM 830 HB VAL A 54 5.079 -27.211 4.984 1.00 0.00 H ATOM 831 HG11 VAL A 54 5.498 -29.401 3.950 1.00 0.00 H ATOM 832 HG12 VAL A 54 3.815 -29.888 4.269 1.00 0.00 H ATOM 833 HG13 VAL A 54 4.158 -28.565 3.128 1.00 0.00 H ATOM 834 HG21 VAL A 54 2.312 -28.295 5.581 1.00 0.00 H ATOM 835 HG22 VAL A 54 2.973 -26.735 6.128 1.00 0.00 H ATOM 836 HG23 VAL A 54 2.699 -27.027 4.392 1.00 0.00 H ATOM 837 H VAL A 54 3.143 -30.049 6.665 1.00 0.00 H ATOM 838 N ARG A 55 3.813 -27.858 8.614 1.00 15.34 N ATOM 839 CA ARG A 55 3.590 -26.918 9.715 1.00 14.26 C ATOM 840 C ARG A 55 4.301 -27.373 11.003 1.00 17.55 C ATOM 841 O ARG A 55 4.239 -28.547 11.354 1.00 18.56 O ATOM 842 CB ARG A 55 2.070 -26.749 9.949 1.00 14.36 C ATOM 843 CG ARG A 55 1.368 -27.997 10.469 1.00 13.34 C ATOM 844 CD ARG A 55 -0.150 -27.945 10.311 1.00 10.56 C ATOM 845 NE ARG A 55 -0.818 -29.050 11.010 1.00 8.05 N ATOM 846 CZ ARG A 55 -2.099 -29.389 10.836 1.00 14.70 C ATOM 847 NH1 ARG A 55 -2.848 -28.728 9.970 1.00 14.88 N ATOM 848 NH2 ARG A 55 -2.637 -30.401 11.510 1.00 7.19 N ATOM 849 HA ARG A 55 4.019 -25.954 9.440 1.00 0.00 H ATOM 850 HB2 ARG A 55 1.924 -25.949 10.674 1.00 0.00 H ATOM 851 HB3 ARG A 55 1.609 -26.468 9.002 1.00 0.00 H ATOM 852 HG2 ARG A 55 1.744 -28.860 9.920 1.00 0.00 H ATOM 853 HG3 ARG A 55 1.602 -28.111 11.527 1.00 0.00 H ATOM 854 HD2 ARG A 55 -0.395 -28.001 9.250 1.00 0.00 H ATOM 855 HD3 ARG A 55 -0.514 -27.001 10.717 1.00 0.00 H ATOM 856 HE ARG A 55 -0.257 -29.606 11.686 1.00 0.00 H ATOM 857 HH12 ARG A 55 -3.845 -28.993 9.836 1.00 0.00 H ATOM 858 HH11 ARG A 55 -2.441 -27.943 9.423 1.00 0.00 H ATOM 859 HH22 ARG A 55 -3.636 -30.652 11.363 1.00 0.00 H ATOM 860 HH21 ARG A 55 -2.059 -30.942 12.185 1.00 0.00 H ATOM 861 H ARG A 55 3.192 -28.688 8.530 1.00 0.00 H ATOM 862 N PRO A 56 4.984 -26.451 11.715 1.00 13.49 N ATOM 863 CA PRO A 56 5.140 -25.019 11.433 1.00 10.69 C ATOM 864 C PRO A 56 6.128 -24.779 10.313 1.00 12.78 C ATOM 865 O PRO A 56 7.028 -25.592 10.119 1.00 16.79 O ATOM 866 CB PRO A 56 5.740 -24.469 12.738 1.00 14.11 C ATOM 867 CG PRO A 56 6.534 -25.638 13.304 1.00 15.41 C ATOM 868 CD PRO A 56 5.725 -26.863 12.926 1.00 11.83 C ATOM 869 HA PRO A 56 4.199 -24.558 11.132 1.00 0.00 H ATOM 870 HD3 PRO A 56 6.380 -27.707 12.710 1.00 0.00 H ATOM 871 HD2 PRO A 56 5.037 -27.134 13.727 1.00 0.00 H ATOM 872 HG3 PRO A 56 6.625 -25.555 14.387 1.00 0.00 H ATOM 873 HG2 PRO A 56 7.528 -25.680 12.860 1.00 0.00 H ATOM 874 HB2 PRO A 56 6.392 -23.619 12.536 1.00 0.00 H ATOM 875 HB3 PRO A 56 4.953 -24.165 13.428 1.00 0.00 H ATOM 876 N LEU A 57 5.965 -23.671 9.599 1.00 12.88 N ATOM 877 CA LEU A 57 6.912 -23.290 8.568 1.00 14.97 C ATOM 878 C LEU A 57 8.250 -23.023 9.241 1.00 13.23 C ATOM 879 O LEU A 57 8.333 -22.225 10.170 1.00 18.39 O ATOM 880 CB LEU A 57 6.417 -22.052 7.814 1.00 10.18 C ATOM 881 CG LEU A 57 4.945 -22.055 7.381 1.00 7.71 C ATOM 882 CD1 LEU A 57 4.631 -20.847 6.486 1.00 13.23 C ATOM 883 CD2 LEU A 57 4.552 -23.348 6.672 1.00 14.77 C ATOM 884 HA LEU A 57 7.019 -24.090 7.835 1.00 0.00 H ATOM 885 HB2 LEU A 57 6.570 -21.188 8.460 1.00 0.00 H ATOM 886 HB3 LEU A 57 7.026 -21.946 6.916 1.00 0.00 H ATOM 887 HG LEU A 57 4.352 -21.985 8.293 1.00 0.00 H ATOM 888 HD21 LEU A 57 5.167 -23.473 5.781 1.00 0.00 H ATOM 889 HD22 LEU A 57 4.708 -24.192 7.344 1.00 0.00 H ATOM 890 HD23 LEU A 57 3.501 -23.299 6.386 1.00 0.00 H ATOM 891 HD11 LEU A 57 4.832 -19.927 7.035 1.00 0.00 H ATOM 892 HD12 LEU A 57 5.258 -20.884 5.595 1.00 0.00 H ATOM 893 HD13 LEU A 57 3.581 -20.875 6.195 1.00 0.00 H ATOM 894 H LEU A 57 5.141 -23.064 9.783 1.00 0.00 H ATOM 895 N PRO A 58 9.307 -23.698 8.774 1.00 20.36 N ATOM 896 CA PRO A 58 10.603 -23.710 9.468 1.00 17.53 C ATOM 897 C PRO A 58 11.408 -22.417 9.382 1.00 18.41 C ATOM 898 O PRO A 58 11.242 -21.646 8.442 1.00 23.39 O ATOM 899 CB PRO A 58 11.365 -24.839 8.760 1.00 24.12 C ATOM 900 CG PRO A 58 10.763 -24.896 7.398 1.00 24.15 C ATOM 901 CD PRO A 58 9.292 -24.602 7.609 1.00 16.22 C ATOM 902 HA PRO A 58 10.449 -23.840 10.539 1.00 0.00 H ATOM 903 HD3 PRO A 58 8.859 -24.112 6.736 1.00 0.00 H ATOM 904 HD2 PRO A 58 8.736 -25.514 7.826 1.00 0.00 H ATOM 905 HG3 PRO A 58 10.898 -25.885 6.960 1.00 0.00 H ATOM 906 HG2 PRO A 58 11.215 -24.147 6.747 1.00 0.00 H ATOM 907 HB2 PRO A 58 12.429 -24.609 8.702 1.00 0.00 H ATOM 908 HB3 PRO A 58 11.227 -25.785 9.283 1.00 0.00 H ATOM 909 N GLY A 59 12.285 -22.203 10.361 1.00 14.74 N ATOM 910 CA GLY A 59 13.169 -21.054 10.376 1.00 21.78 C ATOM 911 C GLY A 59 12.482 -19.744 10.715 1.00 25.58 C ATOM 912 O GLY A 59 13.061 -18.674 10.551 1.00 10.87 O ATOM 913 HA3 GLY A 59 13.621 -20.958 9.389 1.00 0.00 H ATOM 914 HA2 GLY A 59 13.949 -21.232 11.116 1.00 0.00 H ATOM 915 H GLY A 59 12.338 -22.886 11.144 1.00 0.00 H ATOM 916 N ARG A 60 11.238 -19.831 11.183 1.00 20.10 N ATOM 917 CA ARG A 60 10.463 -18.651 11.513 1.00 12.56 C ATOM 918 C ARG A 60 9.614 -18.898 12.742 1.00 14.02 C ATOM 919 O ARG A 60 9.248 -20.035 13.037 1.00 14.35 O ATOM 920 CB ARG A 60 9.533 -18.295 10.364 1.00 15.79 C ATOM 921 CG ARG A 60 10.200 -17.662 9.176 1.00 13.70 C ATOM 922 CD ARG A 60 9.423 -17.972 7.925 1.00 10.44 C ATOM 923 NE ARG A 60 9.583 -19.384 7.587 1.00 14.14 N ATOM 924 CZ ARG A 60 9.289 -19.905 6.405 1.00 9.07 C ATOM 925 NH1 ARG A 60 8.820 -19.122 5.433 1.00 8.67 N ATOM 926 NH2 ARG A 60 9.471 -21.199 6.194 1.00 8.25 N ATOM 927 HA ARG A 60 11.162 -17.836 11.701 1.00 0.00 H ATOM 928 HB2 ARG A 60 9.044 -19.210 10.029 1.00 0.00 H ATOM 929 HB3 ARG A 60 8.782 -17.600 10.740 1.00 0.00 H ATOM 930 HG2 ARG A 60 10.241 -16.582 9.318 1.00 0.00 H ATOM 931 HG3 ARG A 60 11.213 -18.053 9.079 1.00 0.00 H ATOM 932 HD2 ARG A 60 9.795 -17.358 7.105 1.00 0.00 H ATOM 933 HD3 ARG A 60 8.368 -17.755 8.090 1.00 0.00 H ATOM 934 HE ARG A 60 9.951 -20.021 8.322 1.00 0.00 H ATOM 935 HH12 ARG A 60 8.588 -19.528 4.504 1.00 0.00 H ATOM 936 HH11 ARG A 60 8.686 -18.105 5.604 1.00 0.00 H ATOM 937 HH22 ARG A 60 9.242 -21.612 5.268 1.00 0.00 H ATOM 938 HH21 ARG A 60 9.843 -21.803 6.955 1.00 0.00 H ATOM 939 H ARG A 60 10.811 -20.770 11.315 1.00 0.00 H ATOM 940 N ARG A 61 9.286 -17.820 13.443 1.00 13.99 N ATOM 941 CA ARG A 61 8.408 -17.891 14.605 1.00 9.62 C ATOM 942 C ARG A 61 6.957 -17.981 14.147 1.00 8.09 C ATOM 943 O ARG A 61 6.382 -16.999 13.688 1.00 9.78 O ATOM 944 CB ARG A 61 8.622 -16.654 15.466 1.00 12.53 C ATOM 945 CG ARG A 61 7.923 -16.686 16.820 1.00 10.28 C ATOM 946 CD ARG A 61 8.232 -15.442 17.590 1.00 6.85 C ATOM 947 NE ARG A 61 7.430 -15.333 18.792 1.00 6.75 N ATOM 948 CZ ARG A 61 7.241 -14.198 19.454 1.00 19.57 C ATOM 949 NH1 ARG A 61 7.804 -13.074 19.023 1.00 17.80 N ATOM 950 NH2 ARG A 61 6.487 -14.182 20.546 1.00 18.23 N ATOM 951 HA ARG A 61 8.640 -18.779 15.193 1.00 0.00 H ATOM 952 HB2 ARG A 61 9.692 -16.543 15.640 1.00 0.00 H ATOM 953 HB3 ARG A 61 8.253 -15.789 14.914 1.00 0.00 H ATOM 954 HG2 ARG A 61 6.846 -16.758 16.668 1.00 0.00 H ATOM 955 HG3 ARG A 61 8.268 -17.553 17.383 1.00 0.00 H ATOM 956 HD2 ARG A 61 8.035 -14.578 16.956 1.00 0.00 H ATOM 957 HD3 ARG A 61 9.285 -15.454 17.870 1.00 0.00 H ATOM 958 HE ARG A 61 6.976 -16.194 19.157 1.00 0.00 H ATOM 959 HH12 ARG A 61 7.655 -12.185 19.543 1.00 0.00 H ATOM 960 HH11 ARG A 61 8.393 -13.083 18.166 1.00 0.00 H ATOM 961 HH22 ARG A 61 6.340 -13.292 21.063 1.00 0.00 H ATOM 962 HH21 ARG A 61 6.043 -15.060 20.884 1.00 0.00 H ATOM 963 H ARG A 61 9.667 -16.896 13.155 1.00 0.00 H ATOM 964 N ASN A 62 6.367 -19.164 14.257 1.00 6.83 N ATOM 965 CA ASN A 62 4.973 -19.340 13.854 1.00 10.51 C ATOM 966 C ASN A 62 4.024 -18.970 14.959 1.00 9.85 C ATOM 967 O ASN A 62 4.058 -19.565 16.032 1.00 8.92 O ATOM 968 CB ASN A 62 4.667 -20.782 13.475 1.00 7.89 C ATOM 969 CG ASN A 62 5.288 -21.196 12.178 1.00 8.14 C ATOM 970 OD1 ASN A 62 4.604 -21.735 11.304 1.00 7.58 O ATOM 971 ND2 ASN A 62 6.608 -21.016 12.061 1.00 7.14 N ATOM 972 HA ASN A 62 4.836 -18.684 12.994 1.00 0.00 H ATOM 973 HB2 ASN A 62 5.043 -21.435 14.263 1.00 0.00 H ATOM 974 HB3 ASN A 62 3.586 -20.897 13.394 1.00 0.00 H ATOM 975 HD22 ASN A 62 7.140 -20.556 12.827 1.00 0.00 H ATOM 976 HD21 ASN A 62 7.103 -21.336 11.204 1.00 0.00 H ATOM 977 H ASN A 62 6.901 -19.973 14.633 1.00 0.00 H ATOM 978 N VAL A 63 3.151 -18.010 14.671 1.00 9.44 N ATOM 979 CA VAL A 63 2.086 -17.636 15.583 1.00 7.85 C ATOM 980 C VAL A 63 0.751 -17.935 14.936 1.00 7.61 C ATOM 981 O VAL A 63 0.541 -17.635 13.760 1.00 8.56 O ATOM 982 CB VAL A 63 2.178 -16.138 15.981 1.00 11.36 C ATOM 983 CG1 VAL A 63 1.048 -15.760 16.905 1.00 7.81 C ATOM 984 CG2 VAL A 63 3.547 -15.838 16.633 1.00 9.41 C ATOM 985 HA VAL A 63 2.188 -18.219 16.498 1.00 0.00 H ATOM 986 HB VAL A 63 2.089 -15.534 15.078 1.00 0.00 H ATOM 987 HG11 VAL A 63 0.096 -15.933 16.403 1.00 0.00 H ATOM 988 HG12 VAL A 63 1.100 -16.368 17.808 1.00 0.00 H ATOM 989 HG13 VAL A 63 1.134 -14.706 17.170 1.00 0.00 H ATOM 990 HG21 VAL A 63 3.665 -16.452 17.526 1.00 0.00 H ATOM 991 HG22 VAL A 63 4.343 -16.068 15.925 1.00 0.00 H ATOM 992 HG23 VAL A 63 3.595 -14.784 16.906 1.00 0.00 H ATOM 993 H VAL A 63 3.234 -17.511 13.762 1.00 0.00 H ATOM 994 N VAL A 64 -0.145 -18.544 15.704 1.00 9.05 N ATOM 995 CA VAL A 64 -1.468 -18.907 15.216 1.00 6.39 C ATOM 996 C VAL A 64 -2.527 -18.219 16.045 1.00 7.58 C ATOM 997 O VAL A 64 -2.544 -18.358 17.259 1.00 7.64 O ATOM 998 CB VAL A 64 -1.706 -20.425 15.312 1.00 7.73 C ATOM 999 CG1 VAL A 64 -3.132 -20.771 14.913 1.00 6.95 C ATOM 1000 CG2 VAL A 64 -0.693 -21.174 14.456 1.00 7.50 C ATOM 1001 HA VAL A 64 -1.526 -18.597 14.173 1.00 0.00 H ATOM 1002 HB VAL A 64 -1.568 -20.736 16.347 1.00 0.00 H ATOM 1003 HG11 VAL A 64 -3.828 -20.262 15.579 1.00 0.00 H ATOM 1004 HG12 VAL A 64 -3.309 -20.450 13.886 1.00 0.00 H ATOM 1005 HG13 VAL A 64 -3.278 -21.849 14.988 1.00 0.00 H ATOM 1006 HG21 VAL A 64 -0.796 -20.862 13.417 1.00 0.00 H ATOM 1007 HG22 VAL A 64 0.314 -20.948 14.806 1.00 0.00 H ATOM 1008 HG23 VAL A 64 -0.875 -22.246 14.535 1.00 0.00 H ATOM 1009 H VAL A 64 0.107 -18.769 16.688 1.00 0.00 H ATOM 1010 N LEU A 65 -3.405 -17.473 15.373 1.00 7.76 N ATOM 1011 CA LEU A 65 -4.497 -16.765 16.018 1.00 10.65 C ATOM 1012 C LEU A 65 -5.704 -17.680 16.145 1.00 9.72 C ATOM 1013 O LEU A 65 -6.162 -18.253 15.162 1.00 10.01 O ATOM 1014 CB LEU A 65 -4.887 -15.556 15.176 1.00 8.90 C ATOM 1015 CG LEU A 65 -5.310 -14.256 15.850 1.00 14.57 C ATOM 1016 CD1 LEU A 65 -6.311 -13.528 14.956 1.00 12.36 C ATOM 1017 CD2 LEU A 65 -5.860 -14.464 17.247 1.00 14.91 C ATOM 1018 HA LEU A 65 -4.174 -16.444 17.008 1.00 0.00 H ATOM 1019 HB2 LEU A 65 -4.027 -15.319 14.549 1.00 0.00 H ATOM 1020 HB3 LEU A 65 -5.720 -15.868 14.545 1.00 0.00 H ATOM 1021 HG LEU A 65 -4.420 -13.640 15.977 1.00 0.00 H ATOM 1022 HD21 LEU A 65 -6.735 -15.112 17.199 1.00 0.00 H ATOM 1023 HD22 LEU A 65 -5.096 -14.928 17.871 1.00 0.00 H ATOM 1024 HD23 LEU A 65 -6.143 -13.501 17.672 1.00 0.00 H ATOM 1025 HD11 LEU A 65 -5.845 -13.308 13.996 1.00 0.00 H ATOM 1026 HD12 LEU A 65 -7.185 -14.161 14.801 1.00 0.00 H ATOM 1027 HD13 LEU A 65 -6.615 -12.598 15.436 1.00 0.00 H ATOM 1028 H LEU A 65 -3.303 -17.395 14.341 1.00 0.00 H ATOM 1029 N SER A 66 -6.234 -17.797 17.355 1.00 14.99 N ATOM 1030 CA SER A 66 -7.401 -18.638 17.577 1.00 11.64 C ATOM 1031 C SER A 66 -8.164 -18.166 18.802 1.00 9.50 C ATOM 1032 O SER A 66 -7.578 -17.561 19.697 1.00 10.56 O ATOM 1033 CB SER A 66 -6.960 -20.090 17.764 1.00 7.87 C ATOM 1034 OG SER A 66 -8.073 -20.925 17.993 1.00 10.37 O ATOM 1035 HA SER A 66 -8.058 -18.570 16.710 1.00 0.00 H ATOM 1036 HB2 SER A 66 -6.285 -20.152 18.617 1.00 0.00 H ATOM 1037 HB3 SER A 66 -6.440 -20.425 16.866 1.00 0.00 H ATOM 1038 HG SER A 66 -7.765 -21.858 18.111 1.00 0.00 H ATOM 1039 H SER A 66 -5.811 -17.282 18.154 1.00 0.00 H ATOM 1040 N ARG A 67 -9.467 -18.438 18.845 1.00 9.67 N ATOM 1041 CA ARG A 67 -10.234 -18.224 20.073 1.00 10.92 C ATOM 1042 C ARG A 67 -10.192 -19.438 21.010 1.00 11.97 C ATOM 1043 O ARG A 67 -10.511 -19.322 22.193 1.00 12.85 O ATOM 1044 CB ARG A 67 -11.680 -17.849 19.740 1.00 10.38 C ATOM 1045 CG ARG A 67 -11.758 -16.758 18.682 1.00 15.07 C ATOM 1046 CD ARG A 67 -12.451 -15.505 19.131 1.00 9.69 C ATOM 1047 NE ARG A 67 -13.856 -15.506 18.725 1.00 18.97 N ATOM 1048 CZ ARG A 67 -14.281 -15.280 17.483 1.00 25.63 C ATOM 1049 NH1 ARG A 67 -15.583 -15.285 17.215 1.00 26.25 N ATOM 1050 NH2 ARG A 67 -13.414 -15.018 16.508 1.00 21.71 N ATOM 1051 HA ARG A 67 -9.764 -17.397 20.605 1.00 0.00 H ATOM 1052 HB2 ARG A 67 -12.197 -18.735 19.371 1.00 0.00 H ATOM 1053 HB3 ARG A 67 -12.170 -17.495 20.647 1.00 0.00 H ATOM 1054 HG2 ARG A 67 -10.742 -16.498 18.385 1.00 0.00 H ATOM 1055 HG3 ARG A 67 -12.296 -17.156 17.821 1.00 0.00 H ATOM 1056 HD2 ARG A 67 -11.952 -14.643 18.687 1.00 0.00 H ATOM 1057 HD3 ARG A 67 -12.394 -15.436 20.217 1.00 0.00 H ATOM 1058 HE ARG A 67 -14.572 -15.696 19.455 1.00 0.00 H ATOM 1059 HH12 ARG A 67 -15.915 -15.109 16.245 1.00 0.00 H ATOM 1060 HH11 ARG A 67 -16.270 -15.465 17.975 1.00 0.00 H ATOM 1061 HH22 ARG A 67 -13.756 -14.843 15.541 1.00 0.00 H ATOM 1062 HH21 ARG A 67 -12.395 -14.988 16.713 1.00 0.00 H ATOM 1063 H ARG A 67 -9.944 -18.806 17.997 1.00 0.00 H ATOM 1064 N GLN A 68 -9.796 -20.595 20.486 1.00 9.05 N ATOM 1065 CA GLN A 68 -9.804 -21.836 21.267 1.00 12.83 C ATOM 1066 C GLN A 68 -8.522 -22.013 22.077 1.00 15.63 C ATOM 1067 O GLN A 68 -7.447 -22.294 21.520 1.00 10.02 O ATOM 1068 CB GLN A 68 -9.971 -23.056 20.360 1.00 16.45 C ATOM 1069 CG GLN A 68 -10.809 -22.842 19.120 1.00 14.24 C ATOM 1070 CD GLN A 68 -10.831 -24.089 18.246 1.00 19.08 C ATOM 1071 OE1 GLN A 68 -10.975 -25.212 18.746 1.00 18.59 O ATOM 1072 NE2 GLN A 68 -10.668 -23.901 16.942 1.00 9.02 N ATOM 1073 HA GLN A 68 -10.649 -21.759 21.951 1.00 0.00 H ATOM 1074 HB2 GLN A 68 -8.979 -23.376 20.043 1.00 0.00 H ATOM 1075 HB3 GLN A 68 -10.436 -23.848 20.946 1.00 0.00 H ATOM 1076 HG2 GLN A 68 -11.829 -22.599 19.418 1.00 0.00 H ATOM 1077 HG3 GLN A 68 -10.392 -22.014 18.547 1.00 0.00 H ATOM 1078 HE22 GLN A 68 -10.551 -22.938 16.566 1.00 0.00 H ATOM 1079 HE21 GLN A 68 -10.658 -24.716 16.296 1.00 0.00 H ATOM 1080 H GLN A 68 -9.473 -20.620 19.498 1.00 0.00 H ATOM 1081 N ALA A 69 -8.654 -21.863 23.391 1.00 16.67 N ATOM 1082 CA ALA A 69 -7.537 -21.975 24.325 1.00 12.13 C ATOM 1083 C ALA A 69 -6.854 -23.334 24.268 1.00 10.87 C ATOM 1084 O ALA A 69 -5.674 -23.459 24.590 1.00 13.91 O ATOM 1085 CB ALA A 69 -8.020 -21.697 25.748 1.00 15.96 C ATOM 1086 HA ALA A 69 -6.797 -21.232 24.027 1.00 0.00 H ATOM 1087 HB1 ALA A 69 -8.433 -20.690 25.800 1.00 0.00 H ATOM 1088 HB2 ALA A 69 -8.789 -22.421 26.017 1.00 0.00 H ATOM 1089 HB3 ALA A 69 -7.181 -21.783 26.438 1.00 0.00 H ATOM 1090 H ALA A 69 -9.599 -21.656 23.773 1.00 0.00 H ATOM 1091 N ASP A 70 -7.596 -24.356 23.865 1.00 12.00 N ATOM 1092 CA ASP A 70 -7.065 -25.710 23.854 1.00 16.25 C ATOM 1093 C ASP A 70 -6.481 -26.105 22.498 1.00 20.58 C ATOM 1094 O ASP A 70 -6.222 -27.288 22.247 1.00 12.86 O ATOM 1095 CB ASP A 70 -8.172 -26.695 24.230 1.00 19.20 C ATOM 1096 CG ASP A 70 -9.425 -26.488 23.410 1.00 22.03 C ATOM 1097 OD1 ASP A 70 -9.510 -27.063 22.308 1.00 32.68 O ATOM 1098 OD2 ASP A 70 -10.320 -25.733 23.854 1.00 29.80 O ATOM 1099 HA ASP A 70 -6.254 -25.742 24.581 1.00 0.00 H ATOM 1100 HB2 ASP A 70 -7.809 -27.710 24.067 1.00 0.00 H ATOM 1101 HB3 ASP A 70 -8.416 -26.563 25.284 1.00 0.00 H ATOM 1102 H ASP A 70 -8.573 -24.187 23.552 1.00 0.00 H ATOM 1103 N PHE A 71 -6.263 -25.135 21.615 1.00 17.06 N ATOM 1104 CA PHE A 71 -5.847 -25.502 20.265 1.00 12.50 C ATOM 1105 C PHE A 71 -4.400 -26.015 20.173 1.00 14.71 C ATOM 1106 O PHE A 71 -3.449 -25.366 20.624 1.00 13.98 O ATOM 1107 CB PHE A 71 -6.117 -24.376 19.258 1.00 11.90 C ATOM 1108 CG PHE A 71 -5.976 -24.808 17.832 1.00 16.31 C ATOM 1109 CD1 PHE A 71 -7.069 -25.284 17.127 1.00 16.73 C ATOM 1110 CD2 PHE A 71 -4.748 -24.756 17.200 1.00 12.90 C ATOM 1111 CE1 PHE A 71 -6.934 -25.688 15.816 1.00 17.43 C ATOM 1112 CE2 PHE A 71 -4.613 -25.155 15.894 1.00 15.99 C ATOM 1113 CZ PHE A 71 -5.701 -25.625 15.200 1.00 11.83 C ATOM 1114 HA PHE A 71 -6.473 -26.352 19.993 1.00 0.00 H ATOM 1115 HB2 PHE A 71 -7.133 -24.012 19.410 1.00 0.00 H ATOM 1116 HB3 PHE A 71 -5.411 -23.567 19.446 1.00 0.00 H ATOM 1117 HD2 PHE A 71 -3.877 -24.394 17.745 1.00 0.00 H ATOM 1118 HE2 PHE A 71 -3.640 -25.099 15.406 1.00 0.00 H ATOM 1119 HZ PHE A 71 -5.591 -25.948 14.165 1.00 0.00 H ATOM 1120 HE1 PHE A 71 -7.800 -26.057 15.267 1.00 0.00 H ATOM 1121 HD1 PHE A 71 -8.043 -25.340 17.612 1.00 0.00 H ATOM 1122 H PHE A 71 -6.386 -24.137 21.880 1.00 0.00 H ATOM 1123 N MET A 72 -4.256 -27.192 19.576 1.00 14.79 N ATOM 1124 CA MET A 72 -2.961 -27.826 19.402 1.00 18.02 C ATOM 1125 C MET A 72 -2.314 -27.360 18.116 1.00 13.25 C ATOM 1126 O MET A 72 -2.797 -27.679 17.030 1.00 12.91 O ATOM 1127 CB MET A 72 -3.112 -29.350 19.343 1.00 25.01 C ATOM 1128 CG MET A 72 -3.763 -29.960 20.563 1.00 33.62 C ATOM 1129 SD MET A 72 -3.778 -31.768 20.584 1.00 49.15 S ATOM 1130 CE MET A 72 -4.850 -32.026 21.993 1.00 37.60 C ATOM 1131 HA MET A 72 -2.338 -27.549 20.253 1.00 0.00 H ATOM 1132 HB2 MET A 72 -3.718 -29.599 18.472 1.00 0.00 H ATOM 1133 HB3 MET A 72 -2.120 -29.787 19.231 1.00 0.00 H ATOM 1134 HG2 MET A 72 -4.794 -29.611 20.609 1.00 0.00 H ATOM 1135 HG3 MET A 72 -3.224 -29.614 21.445 1.00 0.00 H ATOM 1136 HE1 MET A 72 -4.403 -31.569 22.876 1.00 0.00 H ATOM 1137 HE2 MET A 72 -5.821 -31.570 21.798 1.00 0.00 H ATOM 1138 HE3 MET A 72 -4.977 -33.096 22.160 1.00 0.00 H ATOM 1139 H MET A 72 -5.103 -27.679 19.219 1.00 0.00 H ATOM 1140 N ALA A 73 -1.203 -26.640 18.255 1.00 13.17 N ATOM 1141 CA ALA A 73 -0.427 -26.156 17.126 1.00 16.61 C ATOM 1142 C ALA A 73 1.054 -26.406 17.395 1.00 14.48 C ATOM 1143 O ALA A 73 1.801 -25.491 17.723 1.00 17.17 O ATOM 1144 CB ALA A 73 -0.689 -24.680 16.900 1.00 17.72 C ATOM 1145 HA ALA A 73 -0.723 -26.691 16.224 1.00 0.00 H ATOM 1146 HB1 ALA A 73 -1.749 -24.528 16.695 1.00 0.00 H ATOM 1147 HB2 ALA A 73 -0.406 -24.121 17.792 1.00 0.00 H ATOM 1148 HB3 ALA A 73 -0.100 -24.334 16.051 1.00 0.00 H ATOM 1149 H ALA A 73 -0.875 -26.414 19.216 1.00 0.00 H ATOM 1150 N SER A 74 1.453 -27.661 17.239 1.00 12.80 N ATOM 1151 CA SER A 74 2.768 -28.146 17.610 1.00 21.76 C ATOM 1152 C SER A 74 3.893 -27.406 16.901 1.00 13.87 C ATOM 1153 O SER A 74 3.878 -27.255 15.684 1.00 15.50 O ATOM 1154 CB SER A 74 2.863 -29.645 17.303 1.00 23.55 C ATOM 1155 OG SER A 74 4.047 -30.194 17.853 1.00 19.83 O ATOM 1156 HA SER A 74 2.890 -27.964 18.678 1.00 0.00 H ATOM 1157 HB2 SER A 74 2.869 -29.790 16.223 1.00 0.00 H ATOM 1158 HB3 SER A 74 2.000 -30.154 17.731 1.00 0.00 H ATOM 1159 HG SER A 74 4.834 -29.736 17.463 1.00 0.00 H ATOM 1160 H SER A 74 0.782 -28.339 16.825 1.00 0.00 H ATOM 1161 N GLY A 75 4.863 -26.943 17.677 1.00 14.82 N ATOM 1162 CA GLY A 75 6.001 -26.224 17.128 1.00 16.51 C ATOM 1163 C GLY A 75 5.704 -24.746 16.944 1.00 14.57 C ATOM 1164 O GLY A 75 6.598 -23.958 16.676 1.00 9.81 O ATOM 1165 HA3 GLY A 75 6.257 -26.655 16.160 1.00 0.00 H ATOM 1166 HA2 GLY A 75 6.847 -26.332 17.807 1.00 0.00 H ATOM 1167 H GLY A 75 4.809 -27.098 18.704 1.00 0.00 H ATOM 1168 N ALA A 76 4.435 -24.380 17.088 1.00 12.14 N ATOM 1169 CA ALA A 76 4.006 -22.996 16.955 1.00 12.39 C ATOM 1170 C ALA A 76 3.636 -22.459 18.324 1.00 11.44 C ATOM 1171 O ALA A 76 3.838 -23.138 19.329 1.00 18.72 O ATOM 1172 CB ALA A 76 2.807 -22.902 16.009 1.00 13.98 C ATOM 1173 HA ALA A 76 4.819 -22.402 16.538 1.00 0.00 H ATOM 1174 HB1 ALA A 76 3.089 -23.284 15.028 1.00 0.00 H ATOM 1175 HB2 ALA A 76 1.984 -23.494 16.408 1.00 0.00 H ATOM 1176 HB3 ALA A 76 2.497 -21.861 15.919 1.00 0.00 H ATOM 1177 H ALA A 76 3.724 -25.108 17.303 1.00 0.00 H ATOM 1178 N GLU A 77 3.116 -21.235 18.362 1.00 11.10 N ATOM 1179 CA GLU A 77 2.480 -20.713 19.558 1.00 8.38 C ATOM 1180 C GLU A 77 1.080 -20.214 19.211 1.00 7.96 C ATOM 1181 O GLU A 77 0.832 -19.759 18.089 1.00 9.99 O ATOM 1182 CB GLU A 77 3.321 -19.606 20.184 1.00 13.98 C ATOM 1183 CG GLU A 77 3.767 -18.555 19.208 1.00 12.22 C ATOM 1184 CD GLU A 77 4.579 -17.476 19.861 1.00 12.73 C ATOM 1185 OE1 GLU A 77 3.973 -16.578 20.491 1.00 11.81 O ATOM 1186 OE2 GLU A 77 5.821 -17.523 19.740 1.00 9.58 O ATOM 1187 HA GLU A 77 2.397 -21.511 20.296 1.00 0.00 H ATOM 1188 HB2 GLU A 77 2.729 -19.123 20.962 1.00 0.00 H ATOM 1189 HB3 GLU A 77 4.207 -20.058 20.630 1.00 0.00 H ATOM 1190 HG2 GLU A 77 4.372 -19.029 18.435 1.00 0.00 H ATOM 1191 HG3 GLU A 77 2.886 -18.103 18.753 1.00 0.00 H ATOM 1192 H GLU A 77 3.166 -20.637 17.513 1.00 0.00 H ATOM 1193 N VAL A 78 0.157 -20.327 20.157 1.00 5.13 N ATOM 1194 CA VAL A 78 -1.219 -19.872 19.948 1.00 6.75 C ATOM 1195 C VAL A 78 -1.558 -18.653 20.825 1.00 7.04 C ATOM 1196 O VAL A 78 -1.355 -18.685 22.031 1.00 6.24 O ATOM 1197 CB VAL A 78 -2.247 -21.008 20.210 1.00 5.57 C ATOM 1198 CG1 VAL A 78 -3.701 -20.464 20.153 1.00 9.33 C ATOM 1199 CG2 VAL A 78 -2.079 -22.167 19.222 1.00 6.62 C ATOM 1200 HA VAL A 78 -1.288 -19.575 18.901 1.00 0.00 H ATOM 1201 HB VAL A 78 -2.053 -21.391 21.212 1.00 0.00 H ATOM 1202 HG11 VAL A 78 -3.829 -19.693 20.913 1.00 0.00 H ATOM 1203 HG12 VAL A 78 -3.890 -20.040 19.167 1.00 0.00 H ATOM 1204 HG13 VAL A 78 -4.400 -21.279 20.340 1.00 0.00 H ATOM 1205 HG21 VAL A 78 -2.225 -21.801 18.206 1.00 0.00 H ATOM 1206 HG22 VAL A 78 -1.076 -22.583 19.319 1.00 0.00 H ATOM 1207 HG23 VAL A 78 -2.817 -22.939 19.441 1.00 0.00 H ATOM 1208 H VAL A 78 0.417 -20.750 21.071 1.00 0.00 H ATOM 1209 N VAL A 79 -2.052 -17.581 20.203 1.00 10.97 N ATOM 1210 CA VAL A 79 -2.493 -16.380 20.920 1.00 7.60 C ATOM 1211 C VAL A 79 -3.992 -16.145 20.651 1.00 10.20 C ATOM 1212 O VAL A 79 -4.520 -16.566 19.618 1.00 10.66 O ATOM 1213 CB VAL A 79 -1.708 -15.146 20.486 1.00 13.25 C ATOM 1214 CG1 VAL A 79 -0.217 -15.341 20.751 1.00 13.28 C ATOM 1215 CG2 VAL A 79 -1.959 -14.862 19.007 1.00 15.25 C ATOM 1216 HA VAL A 79 -2.316 -16.540 21.984 1.00 0.00 H ATOM 1217 HB VAL A 79 -2.047 -14.290 21.069 1.00 0.00 H ATOM 1218 HG11 VAL A 79 -0.057 -15.507 21.816 1.00 0.00 H ATOM 1219 HG12 VAL A 79 0.141 -16.205 20.190 1.00 0.00 H ATOM 1220 HG13 VAL A 79 0.326 -14.451 20.435 1.00 0.00 H ATOM 1221 HG21 VAL A 79 -1.639 -15.719 18.414 1.00 0.00 H ATOM 1222 HG22 VAL A 79 -3.023 -14.686 18.848 1.00 0.00 H ATOM 1223 HG23 VAL A 79 -1.394 -13.979 18.707 1.00 0.00 H ATOM 1224 H VAL A 79 -2.128 -17.598 19.166 1.00 0.00 H ATOM 1225 N GLY A 80 -4.680 -15.482 21.574 1.00 7.38 N ATOM 1226 CA GLY A 80 -6.114 -15.311 21.438 1.00 9.58 C ATOM 1227 C GLY A 80 -6.609 -13.911 21.118 1.00 10.22 C ATOM 1228 O GLY A 80 -7.791 -13.633 21.241 1.00 10.42 O ATOM 1229 HA3 GLY A 80 -6.574 -15.617 22.378 1.00 0.00 H ATOM 1230 HA2 GLY A 80 -6.451 -15.971 20.639 1.00 0.00 H ATOM 1231 H GLY A 80 -4.188 -15.083 22.399 1.00 0.00 H ATOM 1232 N SER A 81 -5.710 -13.028 20.716 1.00 7.58 N ATOM 1233 CA SER A 81 -6.091 -11.682 20.314 1.00 11.12 C ATOM 1234 C SER A 81 -5.081 -11.171 19.306 1.00 14.64 C ATOM 1235 O SER A 81 -3.919 -11.561 19.362 1.00 9.50 O ATOM 1236 CB SER A 81 -6.126 -10.747 21.524 1.00 13.04 C ATOM 1237 OG SER A 81 -4.835 -10.587 22.083 1.00 17.89 O ATOM 1238 HA SER A 81 -7.087 -11.708 19.872 1.00 0.00 H ATOM 1239 HB2 SER A 81 -6.791 -11.166 22.279 1.00 0.00 H ATOM 1240 HB3 SER A 81 -6.502 -9.773 21.211 1.00 0.00 H ATOM 1241 HG SER A 81 -4.887 -9.979 22.862 1.00 0.00 H ATOM 1242 H SER A 81 -4.707 -13.302 20.686 1.00 0.00 H ATOM 1243 N LEU A 82 -5.509 -10.294 18.395 1.00 13.42 N ATOM 1244 CA LEU A 82 -4.594 -9.747 17.399 1.00 20.79 C ATOM 1245 C LEU A 82 -3.427 -8.969 18.022 1.00 21.14 C ATOM 1246 O LEU A 82 -2.301 -9.052 17.542 1.00 21.34 O ATOM 1247 CB LEU A 82 -5.334 -8.846 16.407 1.00 27.24 C ATOM 1248 CG LEU A 82 -4.515 -8.680 15.123 1.00 32.40 C ATOM 1249 CD1 LEU A 82 -4.623 -9.918 14.243 1.00 31.93 C ATOM 1250 CD2 LEU A 82 -4.904 -7.456 14.370 1.00 29.10 C ATOM 1251 HA LEU A 82 -4.177 -10.606 16.874 1.00 0.00 H ATOM 1252 HB2 LEU A 82 -6.297 -9.294 16.164 1.00 0.00 H ATOM 1253 HB3 LEU A 82 -5.494 -7.868 16.860 1.00 0.00 H ATOM 1254 HG LEU A 82 -3.473 -8.561 15.418 1.00 0.00 H ATOM 1255 HD21 LEU A 82 -5.958 -7.518 14.098 1.00 0.00 H ATOM 1256 HD22 LEU A 82 -4.740 -6.579 14.996 1.00 0.00 H ATOM 1257 HD23 LEU A 82 -4.298 -7.378 13.467 1.00 0.00 H ATOM 1258 HD11 LEU A 82 -4.247 -10.784 14.788 1.00 0.00 H ATOM 1259 HD12 LEU A 82 -5.667 -10.081 13.974 1.00 0.00 H ATOM 1260 HD13 LEU A 82 -4.032 -9.772 13.339 1.00 0.00 H ATOM 1261 H LEU A 82 -6.506 -9.997 18.395 1.00 0.00 H ATOM 1262 N GLU A 83 -3.711 -8.219 19.084 1.00 23.73 N ATOM 1263 CA GLU A 83 -2.699 -7.433 19.790 1.00 18.62 C ATOM 1264 C GLU A 83 -1.464 -8.263 20.151 1.00 19.78 C ATOM 1265 O GLU A 83 -0.332 -7.854 19.893 1.00 30.41 O ATOM 1266 CB GLU A 83 -3.318 -6.780 21.044 1.00 23.86 C ATOM 1267 CG GLU A 83 -2.943 -7.415 22.408 1.00 23.27 C ATOM 1268 CD GLU A 83 -4.114 -7.490 23.387 1.00 28.25 C ATOM 1269 OE1 GLU A 83 -5.266 -7.712 22.945 1.00 29.02 O ATOM 1270 OE2 GLU A 83 -3.880 -7.333 24.606 1.00 26.39 O ATOM 1271 HA GLU A 83 -2.357 -6.649 19.114 1.00 0.00 H ATOM 1272 HB2 GLU A 83 -3.002 -5.737 21.065 1.00 0.00 H ATOM 1273 HB3 GLU A 83 -4.402 -6.828 20.942 1.00 0.00 H ATOM 1274 HG2 GLU A 83 -2.577 -8.426 22.229 1.00 0.00 H ATOM 1275 HG3 GLU A 83 -2.152 -6.818 22.861 1.00 0.00 H ATOM 1276 H GLU A 83 -4.693 -8.190 19.426 1.00 0.00 H ATOM 1277 N GLU A 84 -1.693 -9.455 20.681 1.00 15.65 N ATOM 1278 CA GLU A 84 -0.638 -10.282 21.215 1.00 19.52 C ATOM 1279 C GLU A 84 0.215 -10.919 20.117 1.00 20.13 C ATOM 1280 O GLU A 84 1.385 -11.238 20.325 1.00 24.71 O ATOM 1281 CB GLU A 84 -1.256 -11.364 22.099 1.00 19.17 C ATOM 1282 CG GLU A 84 -0.237 -12.166 22.847 1.00 23.00 C ATOM 1283 CD GLU A 84 0.685 -11.279 23.673 1.00 31.37 C ATOM 1284 OE1 GLU A 84 0.158 -10.464 24.462 1.00 32.94 O ATOM 1285 OE2 GLU A 84 1.922 -11.381 23.517 1.00 29.73 O ATOM 1286 HA GLU A 84 0.027 -9.647 21.801 1.00 0.00 H ATOM 1287 HB2 GLU A 84 -1.919 -10.886 22.820 1.00 0.00 H ATOM 1288 HB3 GLU A 84 -1.834 -12.039 21.468 1.00 0.00 H ATOM 1289 HG2 GLU A 84 -0.752 -12.858 23.514 1.00 0.00 H ATOM 1290 HG3 GLU A 84 0.362 -12.730 22.132 1.00 0.00 H ATOM 1291 H GLU A 84 -2.671 -9.808 20.714 1.00 0.00 H ATOM 1292 N ALA A 85 -0.380 -11.115 18.948 1.00 23.37 N ATOM 1293 CA ALA A 85 0.333 -11.706 17.823 1.00 19.78 C ATOM 1294 C ALA A 85 1.298 -10.706 17.202 1.00 25.59 C ATOM 1295 O ALA A 85 2.376 -11.066 16.732 1.00 19.43 O ATOM 1296 CB ALA A 85 -0.646 -12.183 16.782 1.00 21.51 C ATOM 1297 HA ALA A 85 0.908 -12.554 18.195 1.00 0.00 H ATOM 1298 HB1 ALA A 85 -1.305 -12.932 17.221 1.00 0.00 H ATOM 1299 HB2 ALA A 85 -1.238 -11.339 16.428 1.00 0.00 H ATOM 1300 HB3 ALA A 85 -0.101 -12.622 15.947 1.00 0.00 H ATOM 1301 H ALA A 85 -1.377 -10.841 18.832 1.00 0.00 H ATOM 1302 N LEU A 86 0.907 -9.441 17.209 1.00 24.59 N ATOM 1303 CA LEU A 86 1.625 -8.432 16.441 1.00 22.81 C ATOM 1304 C LEU A 86 2.791 -7.797 17.188 1.00 33.71 C ATOM 1305 O LEU A 86 3.274 -6.735 16.795 1.00 31.08 O ATOM 1306 CB LEU A 86 0.660 -7.355 15.965 1.00 14.80 C ATOM 1307 CG LEU A 86 -0.523 -7.838 15.122 1.00 22.77 C ATOM 1308 CD1 LEU A 86 -1.260 -6.643 14.542 1.00 26.44 C ATOM 1309 CD2 LEU A 86 -0.081 -8.790 14.006 1.00 23.69 C ATOM 1310 HA LEU A 86 2.061 -8.954 15.589 1.00 0.00 H ATOM 1311 HB2 LEU A 86 0.259 -6.853 16.846 1.00 0.00 H ATOM 1312 HB3 LEU A 86 1.226 -6.640 15.367 1.00 0.00 H ATOM 1313 HG LEU A 86 -1.194 -8.398 15.774 1.00 0.00 H ATOM 1314 HD21 LEU A 86 0.620 -8.276 13.348 1.00 0.00 H ATOM 1315 HD22 LEU A 86 0.404 -9.662 14.445 1.00 0.00 H ATOM 1316 HD23 LEU A 86 -0.953 -9.107 13.434 1.00 0.00 H ATOM 1317 HD11 LEU A 86 -1.627 -6.015 15.354 1.00 0.00 H ATOM 1318 HD12 LEU A 86 -0.579 -6.068 13.915 1.00 0.00 H ATOM 1319 HD13 LEU A 86 -2.101 -6.992 13.943 1.00 0.00 H ATOM 1320 H LEU A 86 0.076 -9.164 17.770 1.00 0.00 H ATOM 1321 N THR A 87 3.259 -8.456 18.244 1.00 23.04 N ATOM 1322 CA THR A 87 4.286 -7.871 19.094 1.00 32.67 C ATOM 1323 C THR A 87 5.680 -7.780 18.471 1.00 29.36 C ATOM 1324 O THR A 87 6.206 -6.683 18.324 1.00 44.31 O ATOM 1325 CB THR A 87 4.359 -8.577 20.464 1.00 36.41 C ATOM 1326 OG1 THR A 87 3.186 -8.251 21.222 1.00 34.01 O ATOM 1327 CG2 THR A 87 5.605 -8.132 21.233 1.00 36.38 C ATOM 1328 HA THR A 87 3.959 -6.840 19.227 1.00 0.00 H ATOM 1329 HB THR A 87 4.415 -9.654 20.306 1.00 0.00 H ATOM 1330 HG1 THR A 87 3.141 -7.271 21.353 1.00 0.00 H ATOM 1331 HG23 THR A 87 6.495 -8.381 20.655 1.00 0.00 H ATOM 1332 HG21 THR A 87 5.565 -7.055 21.395 1.00 0.00 H ATOM 1333 HG22 THR A 87 5.639 -8.645 22.194 1.00 0.00 H ATOM 1334 H THR A 87 2.887 -9.401 18.465 1.00 0.00 H ATOM 1335 N SER A 88 6.262 -8.923 18.108 1.00 32.29 N ATOM 1336 CA SER A 88 7.678 -9.040 17.703 1.00 29.02 C ATOM 1337 C SER A 88 8.237 -7.942 16.774 1.00 28.69 C ATOM 1338 O SER A 88 7.503 -7.376 15.964 1.00 32.78 O ATOM 1339 CB SER A 88 7.915 -10.429 17.080 1.00 32.29 C ATOM 1340 OG SER A 88 8.955 -10.399 16.114 1.00 28.02 O ATOM 1341 HA SER A 88 8.237 -8.900 18.628 1.00 0.00 H ATOM 1342 HB2 SER A 88 6.995 -10.763 16.600 1.00 0.00 H ATOM 1343 HB3 SER A 88 8.186 -11.130 17.870 1.00 0.00 H ATOM 1344 HG SER A 88 9.079 -11.306 15.736 1.00 0.00 H ATOM 1345 H SER A 88 5.683 -9.787 18.110 1.00 0.00 H ATOM 1346 N PRO A 89 9.546 -7.643 16.896 1.00 30.55 N ATOM 1347 CA PRO A 89 10.256 -6.635 16.096 1.00 24.52 C ATOM 1348 C PRO A 89 9.933 -6.650 14.600 1.00 28.02 C ATOM 1349 O PRO A 89 9.975 -5.602 13.950 1.00 29.77 O ATOM 1350 CB PRO A 89 11.741 -6.972 16.327 1.00 29.10 C ATOM 1351 CG PRO A 89 11.774 -7.997 17.446 1.00 30.39 C ATOM 1352 CD PRO A 89 10.387 -8.121 18.004 1.00 30.05 C ATOM 1353 HA PRO A 89 9.960 -5.633 16.406 1.00 0.00 H ATOM 1354 HD3 PRO A 89 10.155 -9.156 18.255 1.00 0.00 H ATOM 1355 HD2 PRO A 89 10.262 -7.497 18.889 1.00 0.00 H ATOM 1356 HG3 PRO A 89 12.459 -7.669 18.228 1.00 0.00 H ATOM 1357 HG2 PRO A 89 12.103 -8.960 17.056 1.00 0.00 H ATOM 1358 HB2 PRO A 89 12.180 -7.388 15.420 1.00 0.00 H ATOM 1359 HB3 PRO A 89 12.291 -6.077 16.618 1.00 0.00 H ATOM 1360 N GLU A 90 9.631 -7.818 14.054 1.00 21.78 N ATOM 1361 CA GLU A 90 9.204 -7.885 12.661 1.00 19.06 C ATOM 1362 C GLU A 90 8.231 -9.032 12.440 1.00 16.85 C ATOM 1363 O GLU A 90 8.594 -10.207 12.547 1.00 11.46 O ATOM 1364 CB GLU A 90 10.395 -7.997 11.713 1.00 17.93 C ATOM 1365 CG GLU A 90 10.057 -7.606 10.290 1.00 20.06 C ATOM 1366 CD GLU A 90 11.244 -7.713 9.355 1.00 20.27 C ATOM 1367 OE1 GLU A 90 11.119 -8.395 8.314 1.00 19.52 O ATOM 1368 OE2 GLU A 90 12.298 -7.113 9.655 1.00 23.45 O ATOM 1369 HA GLU A 90 8.687 -6.952 12.436 1.00 0.00 H ATOM 1370 HB2 GLU A 90 11.189 -7.343 12.074 1.00 0.00 H ATOM 1371 HB3 GLU A 90 10.746 -9.029 11.716 1.00 0.00 H ATOM 1372 HG2 GLU A 90 9.266 -8.262 9.926 1.00 0.00 H ATOM 1373 HG3 GLU A 90 9.702 -6.575 10.286 1.00 0.00 H ATOM 1374 H GLU A 90 9.698 -8.688 14.619 1.00 0.00 H ATOM 1375 N THR A 91 6.988 -8.669 12.146 1.00 15.88 N ATOM 1376 CA THR A 91 5.925 -9.633 11.925 1.00 15.57 C ATOM 1377 C THR A 91 5.333 -9.579 10.504 1.00 14.72 C ATOM 1378 O THR A 91 5.004 -8.498 9.987 1.00 11.77 O ATOM 1379 CB THR A 91 4.780 -9.393 12.911 1.00 12.93 C ATOM 1380 OG1 THR A 91 5.242 -9.634 14.242 1.00 25.53 O ATOM 1381 CG2 THR A 91 3.642 -10.320 12.618 1.00 14.65 C ATOM 1382 HA THR A 91 6.383 -10.612 12.069 1.00 0.00 H ATOM 1383 HB THR A 91 4.440 -8.362 12.812 1.00 0.00 H ATOM 1384 HG1 THR A 91 5.990 -9.019 14.447 1.00 0.00 H ATOM 1385 HG23 THR A 91 3.283 -10.143 11.604 1.00 0.00 H ATOM 1386 HG21 THR A 91 3.982 -11.351 12.710 1.00 0.00 H ATOM 1387 HG22 THR A 91 2.835 -10.138 13.328 1.00 0.00 H ATOM 1388 H THR A 91 6.767 -7.655 12.071 1.00 0.00 H ATOM 1389 N TRP A 92 5.164 -10.754 9.904 1.00 11.36 N ATOM 1390 CA TRP A 92 4.482 -10.878 8.621 1.00 10.27 C ATOM 1391 C TRP A 92 3.198 -11.686 8.705 1.00 8.32 C ATOM 1392 O TRP A 92 3.204 -12.882 8.992 1.00 15.69 O ATOM 1393 CB TRP A 92 5.415 -11.489 7.598 1.00 11.58 C ATOM 1394 CG TRP A 92 6.554 -10.587 7.325 1.00 11.90 C ATOM 1395 CD1 TRP A 92 7.803 -10.641 7.878 1.00 13.74 C ATOM 1396 CD2 TRP A 92 6.546 -9.458 6.457 1.00 16.34 C ATOM 1397 NE1 TRP A 92 8.578 -9.620 7.385 1.00 12.11 N ATOM 1398 CE2 TRP A 92 7.830 -8.880 6.510 1.00 11.15 C ATOM 1399 CE3 TRP A 92 5.581 -8.888 5.619 1.00 15.06 C ATOM 1400 CZ2 TRP A 92 8.170 -7.751 5.770 1.00 13.20 C ATOM 1401 CZ3 TRP A 92 5.923 -7.762 4.886 1.00 13.15 C ATOM 1402 CH2 TRP A 92 7.208 -7.211 4.965 1.00 11.37 C ATOM 1403 HA TRP A 92 4.199 -9.871 8.314 1.00 0.00 H ATOM 1404 HB2 TRP A 92 5.793 -12.438 7.979 1.00 0.00 H ATOM 1405 HB3 TRP A 92 4.867 -11.664 6.672 1.00 0.00 H ATOM 1406 HE1 TRP A 92 9.571 -9.439 7.636 1.00 0.00 H ATOM 1407 HD1 TRP A 92 8.135 -11.384 8.603 1.00 0.00 H ATOM 1408 HZ2 TRP A 92 9.167 -7.314 5.831 1.00 0.00 H ATOM 1409 HH2 TRP A 92 7.446 -6.330 4.369 1.00 0.00 H ATOM 1410 HZ3 TRP A 92 5.180 -7.298 4.238 1.00 0.00 H ATOM 1411 HE3 TRP A 92 4.583 -9.320 5.544 1.00 0.00 H ATOM 1412 H TRP A 92 5.530 -11.612 10.365 1.00 0.00 H ATOM 1413 N VAL A 93 2.087 -11.028 8.450 1.00 11.08 N ATOM 1414 CA VAL A 93 0.803 -11.705 8.449 1.00 5.86 C ATOM 1415 C VAL A 93 0.673 -12.437 7.114 1.00 8.18 C ATOM 1416 O VAL A 93 0.785 -11.815 6.058 1.00 7.97 O ATOM 1417 CB VAL A 93 -0.304 -10.681 8.628 1.00 6.56 C ATOM 1418 CG1 VAL A 93 -1.668 -11.340 8.588 1.00 5.32 C ATOM 1419 CG2 VAL A 93 -0.082 -9.913 9.925 1.00 13.28 C ATOM 1420 HA VAL A 93 0.727 -12.422 9.267 1.00 0.00 H ATOM 1421 HB VAL A 93 -0.274 -9.973 7.800 1.00 0.00 H ATOM 1422 HG11 VAL A 93 -1.803 -11.836 7.627 1.00 0.00 H ATOM 1423 HG12 VAL A 93 -1.739 -12.075 9.390 1.00 0.00 H ATOM 1424 HG13 VAL A 93 -2.440 -10.582 8.719 1.00 0.00 H ATOM 1425 HG21 VAL A 93 -0.091 -10.609 10.764 1.00 0.00 H ATOM 1426 HG22 VAL A 93 0.881 -9.404 9.884 1.00 0.00 H ATOM 1427 HG23 VAL A 93 -0.877 -9.179 10.052 1.00 0.00 H ATOM 1428 H VAL A 93 2.130 -10.009 8.246 1.00 0.00 H ATOM 1429 N ILE A 94 0.457 -13.751 7.147 1.00 8.38 N ATOM 1430 CA ILE A 94 0.511 -14.545 5.909 1.00 9.25 C ATOM 1431 C ILE A 94 -0.835 -15.086 5.416 1.00 6.95 C ATOM 1432 O ILE A 94 -0.902 -15.732 4.363 1.00 6.71 O ATOM 1433 CB ILE A 94 1.517 -15.708 6.009 1.00 8.70 C ATOM 1434 CG1 ILE A 94 1.026 -16.762 7.003 1.00 8.67 C ATOM 1435 CG2 ILE A 94 2.903 -15.185 6.382 1.00 8.25 C ATOM 1436 CD1 ILE A 94 1.906 -18.007 7.061 1.00 7.58 C ATOM 1437 HA ILE A 94 0.845 -13.822 5.165 1.00 0.00 H ATOM 1438 HB ILE A 94 1.595 -16.188 5.034 1.00 0.00 H ATOM 1439 HG12 ILE A 94 0.999 -16.313 7.996 1.00 0.00 H ATOM 1440 HG13 ILE A 94 0.019 -17.065 6.715 1.00 0.00 H ATOM 1441 HD11 ILE A 94 1.935 -18.476 6.077 1.00 0.00 H ATOM 1442 HD12 ILE A 94 2.915 -17.723 7.360 1.00 0.00 H ATOM 1443 HD13 ILE A 94 1.494 -18.708 7.787 1.00 0.00 H ATOM 1444 HG21 ILE A 94 3.244 -14.486 5.618 1.00 0.00 H ATOM 1445 HG22 ILE A 94 2.851 -14.677 7.345 1.00 0.00 H ATOM 1446 HG23 ILE A 94 3.600 -16.021 6.448 1.00 0.00 H ATOM 1447 H ILE A 94 0.249 -14.218 8.053 1.00 0.00 H ATOM 1448 N GLY A 95 -1.898 -14.814 6.167 1.00 11.40 N ATOM 1449 CA GLY A 95 -3.241 -15.254 5.802 1.00 9.20 C ATOM 1450 C GLY A 95 -4.031 -15.613 7.049 1.00 10.83 C ATOM 1451 O GLY A 95 -3.448 -15.777 8.109 1.00 8.15 O ATOM 1452 HA3 GLY A 95 -3.171 -16.129 5.155 1.00 0.00 H ATOM 1453 HA2 GLY A 95 -3.752 -14.451 5.270 1.00 0.00 H ATOM 1454 H GLY A 95 -1.768 -14.270 7.044 1.00 0.00 H ATOM 1455 N GLY A 96 -5.350 -15.732 6.939 1.00 7.83 N ATOM 1456 CA GLY A 96 -6.038 -15.585 5.675 1.00 18.63 C ATOM 1457 C GLY A 96 -6.887 -14.334 5.684 1.00 18.99 C ATOM 1458 O GLY A 96 -6.500 -13.341 6.292 1.00 13.67 O ATOM 1459 HA3 GLY A 96 -6.677 -16.453 5.510 1.00 0.00 H ATOM 1460 HA2 GLY A 96 -5.305 -15.517 4.872 1.00 0.00 H ATOM 1461 H GLY A 96 -5.908 -15.938 7.792 1.00 0.00 H ATOM 1462 N GLY A 97 -8.039 -14.402 5.017 1.00 20.73 N ATOM 1463 CA GLY A 97 -8.950 -13.277 4.856 1.00 13.65 C ATOM 1464 C GLY A 97 -9.315 -12.528 6.116 1.00 14.90 C ATOM 1465 O GLY A 97 -9.290 -11.298 6.128 1.00 24.59 O ATOM 1466 HA3 GLY A 97 -9.872 -13.656 4.415 1.00 0.00 H ATOM 1467 HA2 GLY A 97 -8.486 -12.568 4.170 1.00 0.00 H ATOM 1468 H GLY A 97 -8.303 -15.311 4.586 1.00 0.00 H ATOM 1469 N GLN A 98 -9.648 -13.251 7.180 1.00 15.75 N ATOM 1470 CA GLN A 98 -10.003 -12.614 8.452 1.00 17.16 C ATOM 1471 C GLN A 98 -8.791 -11.947 9.095 1.00 21.57 C ATOM 1472 O GLN A 98 -8.879 -10.855 9.660 1.00 20.25 O ATOM 1473 CB GLN A 98 -10.586 -13.631 9.442 1.00 13.04 C ATOM 1474 CG GLN A 98 -11.838 -14.326 8.967 1.00 23.91 C ATOM 1475 CD GLN A 98 -12.615 -14.970 10.098 1.00 21.16 C ATOM 1476 OE1 GLN A 98 -12.213 -14.906 11.259 1.00 15.45 O ATOM 1477 NE2 GLN A 98 -13.743 -15.586 9.764 1.00 29.44 N ATOM 1478 HA GLN A 98 -10.755 -11.858 8.224 1.00 0.00 H ATOM 1479 HB2 GLN A 98 -9.828 -14.390 9.635 1.00 0.00 H ATOM 1480 HB3 GLN A 98 -10.819 -13.108 10.369 1.00 0.00 H ATOM 1481 HG2 GLN A 98 -12.479 -13.594 8.476 1.00 0.00 H ATOM 1482 HG3 GLN A 98 -11.558 -15.099 8.252 1.00 0.00 H ATOM 1483 HE22 GLN A 98 -14.044 -15.615 8.769 1.00 0.00 H ATOM 1484 HE21 GLN A 98 -14.325 -16.039 10.497 1.00 0.00 H ATOM 1485 H GLN A 98 -9.657 -14.289 7.109 1.00 0.00 H ATOM 1486 N VAL A 99 -7.655 -12.621 9.021 1.00 17.67 N ATOM 1487 CA VAL A 99 -6.453 -12.119 9.669 1.00 17.87 C ATOM 1488 C VAL A 99 -5.845 -10.942 8.896 1.00 15.85 C ATOM 1489 O VAL A 99 -5.364 -9.984 9.496 1.00 15.39 O ATOM 1490 CB VAL A 99 -5.462 -13.267 9.918 1.00 13.96 C ATOM 1491 CG1 VAL A 99 -4.185 -12.768 10.543 1.00 13.34 C ATOM 1492 CG2 VAL A 99 -6.112 -14.266 10.836 1.00 12.35 C ATOM 1493 HA VAL A 99 -6.720 -11.716 10.646 1.00 0.00 H ATOM 1494 HB VAL A 99 -5.208 -13.726 8.962 1.00 0.00 H ATOM 1495 HG11 VAL A 99 -3.715 -12.044 9.878 1.00 0.00 H ATOM 1496 HG12 VAL A 99 -4.411 -12.293 11.498 1.00 0.00 H ATOM 1497 HG13 VAL A 99 -3.509 -13.607 10.704 1.00 0.00 H ATOM 1498 HG21 VAL A 99 -6.365 -13.780 11.779 1.00 0.00 H ATOM 1499 HG22 VAL A 99 -7.019 -14.650 10.369 1.00 0.00 H ATOM 1500 HG23 VAL A 99 -5.422 -15.088 11.023 1.00 0.00 H ATOM 1501 H VAL A 99 -7.621 -13.518 8.495 1.00 0.00 H ATOM 1502 N TYR A 100 -5.900 -11.014 7.567 1.00 15.93 N ATOM 1503 CA TYR A 100 -5.461 -9.922 6.699 1.00 13.32 C ATOM 1504 C TYR A 100 -6.225 -8.646 7.026 1.00 15.79 C ATOM 1505 O TYR A 100 -5.636 -7.598 7.287 1.00 13.92 O ATOM 1506 CB TYR A 100 -5.736 -10.293 5.246 1.00 15.81 C ATOM 1507 CG TYR A 100 -4.645 -11.083 4.571 1.00 10.77 C ATOM 1508 CD1 TYR A 100 -3.313 -10.905 4.921 1.00 6.31 C ATOM 1509 CD2 TYR A 100 -4.945 -11.987 3.568 1.00 9.80 C ATOM 1510 CE1 TYR A 100 -2.322 -11.613 4.296 1.00 9.53 C ATOM 1511 CE2 TYR A 100 -3.951 -12.704 2.931 1.00 13.05 C ATOM 1512 CZ TYR A 100 -2.641 -12.516 3.296 1.00 10.99 C ATOM 1513 OH TYR A 100 -1.634 -13.234 2.663 1.00 9.68 O ATOM 1514 HA TYR A 100 -4.395 -9.757 6.856 1.00 0.00 H ATOM 1515 HB3 TYR A 100 -5.883 -9.371 4.684 1.00 0.00 H ATOM 1516 HB2 TYR A 100 -6.651 -10.885 5.216 1.00 0.00 H ATOM 1517 HD2 TYR A 100 -5.984 -12.136 3.275 1.00 0.00 H ATOM 1518 HE2 TYR A 100 -4.205 -13.414 2.144 1.00 0.00 H ATOM 1519 HE1 TYR A 100 -1.282 -11.466 4.586 1.00 0.00 H ATOM 1520 HD1 TYR A 100 -3.053 -10.192 5.704 1.00 0.00 H ATOM 1521 HH TYR A 100 -0.757 -12.978 3.045 1.00 0.00 H ATOM 1522 H TYR A 100 -6.270 -11.882 7.129 1.00 0.00 H ATOM 1523 N ALA A 101 -7.550 -8.755 7.001 1.00 19.19 N ATOM 1524 CA ALA A 101 -8.448 -7.651 7.325 1.00 22.20 C ATOM 1525 C ALA A 101 -8.148 -7.087 8.695 1.00 21.21 C ATOM 1526 O ALA A 101 -7.983 -5.869 8.864 1.00 26.06 O ATOM 1527 CB ALA A 101 -9.905 -8.121 7.265 1.00 21.08 C ATOM 1528 HA ALA A 101 -8.291 -6.863 6.588 1.00 0.00 H ATOM 1529 HB1 ALA A 101 -10.128 -8.481 6.261 1.00 0.00 H ATOM 1530 HB2 ALA A 101 -10.055 -8.927 7.983 1.00 0.00 H ATOM 1531 HB3 ALA A 101 -10.564 -7.288 7.509 1.00 0.00 H ATOM 1532 H ALA A 101 -7.966 -9.671 6.738 1.00 0.00 H ATOM 1533 N LEU A 102 -8.097 -7.987 9.670 1.00 17.52 N ATOM 1534 CA LEU A 102 -7.829 -7.657 11.064 1.00 17.73 C ATOM 1535 C LEU A 102 -6.543 -6.871 11.223 1.00 15.85 C ATOM 1536 O LEU A 102 -6.491 -5.883 11.972 1.00 17.76 O ATOM 1537 CB LEU A 102 -7.684 -8.958 11.857 1.00 26.16 C ATOM 1538 CG LEU A 102 -8.653 -9.381 12.959 1.00 31.41 C ATOM 1539 CD1 LEU A 102 -8.261 -10.751 13.504 1.00 24.13 C ATOM 1540 CD2 LEU A 102 -8.680 -8.352 14.049 1.00 36.00 C ATOM 1541 HA LEU A 102 -8.657 -7.049 11.428 1.00 0.00 H ATOM 1542 HB2 LEU A 102 -7.700 -9.761 11.120 1.00 0.00 H ATOM 1543 HB3 LEU A 102 -6.700 -8.915 12.324 1.00 0.00 H ATOM 1544 HG LEU A 102 -9.657 -9.456 12.542 1.00 0.00 H ATOM 1545 HD21 LEU A 102 -7.681 -8.247 14.473 1.00 0.00 H ATOM 1546 HD22 LEU A 102 -9.003 -7.396 13.637 1.00 0.00 H ATOM 1547 HD23 LEU A 102 -9.375 -8.667 14.827 1.00 0.00 H ATOM 1548 HD11 LEU A 102 -8.293 -11.484 12.698 1.00 0.00 H ATOM 1549 HD12 LEU A 102 -7.252 -10.703 13.913 1.00 0.00 H ATOM 1550 HD13 LEU A 102 -8.959 -11.042 14.289 1.00 0.00 H ATOM 1551 H LEU A 102 -8.258 -8.985 9.425 1.00 0.00 H ATOM 1552 N ALA A 103 -5.498 -7.342 10.544 1.00 13.36 N ATOM 1553 CA ALA A 103 -4.151 -6.808 10.729 1.00 16.25 C ATOM 1554 C ALA A 103 -3.867 -5.576 9.870 1.00 19.50 C ATOM 1555 O ALA A 103 -2.867 -4.891 10.098 1.00 9.69 O ATOM 1556 CB ALA A 103 -3.105 -7.879 10.445 1.00 10.93 C ATOM 1557 HA ALA A 103 -4.092 -6.495 11.772 1.00 0.00 H ATOM 1558 HB1 ALA A 103 -3.250 -8.717 11.127 1.00 0.00 H ATOM 1559 HB2 ALA A 103 -3.210 -8.224 9.416 1.00 0.00 H ATOM 1560 HB3 ALA A 103 -2.109 -7.460 10.589 1.00 0.00 H ATOM 1561 H ALA A 103 -5.646 -8.113 9.862 1.00 0.00 H ATOM 1562 N LEU A 104 -4.722 -5.324 8.876 1.00 16.67 N ATOM 1563 CA LEU A 104 -4.505 -4.220 7.939 1.00 20.86 C ATOM 1564 C LEU A 104 -4.207 -2.882 8.645 1.00 15.85 C ATOM 1565 O LEU A 104 -3.143 -2.312 8.420 1.00 16.55 O ATOM 1566 CB LEU A 104 -5.669 -4.095 6.939 1.00 17.87 C ATOM 1567 CG LEU A 104 -5.340 -3.787 5.475 1.00 20.38 C ATOM 1568 CD1 LEU A 104 -6.605 -3.421 4.691 1.00 21.38 C ATOM 1569 CD2 LEU A 104 -4.299 -2.691 5.333 1.00 12.20 C ATOM 1570 HA LEU A 104 -3.607 -4.466 7.373 1.00 0.00 H ATOM 1571 HB2 LEU A 104 -6.212 -5.040 6.956 1.00 0.00 H ATOM 1572 HB3 LEU A 104 -6.319 -3.297 7.298 1.00 0.00 H ATOM 1573 HG LEU A 104 -4.915 -4.698 5.054 1.00 0.00 H ATOM 1574 HD21 LEU A 104 -4.671 -1.776 5.794 1.00 0.00 H ATOM 1575 HD22 LEU A 104 -3.378 -3.000 5.827 1.00 0.00 H ATOM 1576 HD23 LEU A 104 -4.103 -2.513 4.276 1.00 0.00 H ATOM 1577 HD11 LEU A 104 -7.305 -4.256 4.724 1.00 0.00 H ATOM 1578 HD12 LEU A 104 -7.066 -2.540 5.138 1.00 0.00 H ATOM 1579 HD13 LEU A 104 -6.340 -3.208 3.655 1.00 0.00 H ATOM 1580 H LEU A 104 -5.562 -5.926 8.765 1.00 0.00 H ATOM 1581 N PRO A 105 -5.101 -2.413 9.543 1.00 18.55 N ATOM 1582 CA PRO A 105 -4.852 -1.106 10.178 1.00 18.26 C ATOM 1583 C PRO A 105 -3.540 -1.003 10.956 1.00 19.84 C ATOM 1584 O PRO A 105 -3.108 0.112 11.260 1.00 24.77 O ATOM 1585 CB PRO A 105 -6.040 -0.945 11.143 1.00 13.65 C ATOM 1586 CG PRO A 105 -6.556 -2.315 11.360 1.00 18.67 C ATOM 1587 CD PRO A 105 -6.342 -3.027 10.059 1.00 21.41 C ATOM 1588 HA PRO A 105 -4.763 -0.333 9.415 1.00 0.00 H ATOM 1589 HD3 PRO A 105 -6.214 -4.098 10.215 1.00 0.00 H ATOM 1590 HD2 PRO A 105 -7.176 -2.857 9.378 1.00 0.00 H ATOM 1591 HG3 PRO A 105 -7.616 -2.289 11.612 1.00 0.00 H ATOM 1592 HG2 PRO A 105 -6.006 -2.808 12.161 1.00 0.00 H ATOM 1593 HB2 PRO A 105 -5.710 -0.507 12.085 1.00 0.00 H ATOM 1594 HB3 PRO A 105 -6.809 -0.313 10.700 1.00 0.00 H ATOM 1595 N TYR A 106 -2.918 -2.134 11.272 1.00 16.82 N ATOM 1596 CA TYR A 106 -1.664 -2.127 12.022 1.00 22.24 C ATOM 1597 C TYR A 106 -0.443 -2.210 11.100 1.00 15.99 C ATOM 1598 O TYR A 106 0.698 -2.037 11.535 1.00 25.69 O ATOM 1599 CB TYR A 106 -1.655 -3.272 13.045 1.00 21.51 C ATOM 1600 CG TYR A 106 -2.760 -3.175 14.073 1.00 26.42 C ATOM 1601 CD1 TYR A 106 -2.555 -2.526 15.280 1.00 30.67 C ATOM 1602 CD2 TYR A 106 -4.007 -3.728 13.836 1.00 23.50 C ATOM 1603 CE1 TYR A 106 -3.567 -2.432 16.225 1.00 28.87 C ATOM 1604 CE2 TYR A 106 -5.028 -3.632 14.770 1.00 23.81 C ATOM 1605 CZ TYR A 106 -4.801 -2.981 15.960 1.00 36.90 C ATOM 1606 OH TYR A 106 -5.805 -2.884 16.893 1.00 34.56 O ATOM 1607 HA TYR A 106 -1.598 -1.177 12.552 1.00 0.00 H ATOM 1608 HB3 TYR A 106 -0.698 -3.261 13.566 1.00 0.00 H ATOM 1609 HB2 TYR A 106 -1.765 -4.214 12.509 1.00 0.00 H ATOM 1610 HD2 TYR A 106 -4.190 -4.249 12.896 1.00 0.00 H ATOM 1611 HE2 TYR A 106 -6.004 -4.070 14.562 1.00 0.00 H ATOM 1612 HE1 TYR A 106 -3.385 -1.926 17.173 1.00 0.00 H ATOM 1613 HD1 TYR A 106 -1.582 -2.082 15.491 1.00 0.00 H ATOM 1614 HH TYR A 106 -6.575 -2.402 16.499 1.00 0.00 H ATOM 1615 H TYR A 106 -3.332 -3.042 10.980 1.00 0.00 H ATOM 1616 N ALA A 107 -0.691 -2.455 9.820 1.00 11.95 N ATOM 1617 CA ALA A 107 0.379 -2.721 8.869 1.00 13.68 C ATOM 1618 C ALA A 107 1.019 -1.435 8.349 1.00 13.31 C ATOM 1619 O ALA A 107 0.315 -0.486 7.984 1.00 7.41 O ATOM 1620 CB ALA A 107 -0.151 -3.575 7.696 1.00 11.58 C ATOM 1621 HA ALA A 107 1.155 -3.277 9.395 1.00 0.00 H ATOM 1622 HB1 ALA A 107 -0.532 -4.521 8.080 1.00 0.00 H ATOM 1623 HB2 ALA A 107 -0.953 -3.038 7.191 1.00 0.00 H ATOM 1624 HB3 ALA A 107 0.659 -3.766 6.992 1.00 0.00 H ATOM 1625 H ALA A 107 -1.676 -2.457 9.487 1.00 0.00 H ATOM 1626 N THR A 108 2.352 -1.421 8.318 1.00 11.84 N ATOM 1627 CA THR A 108 3.109 -0.343 7.697 1.00 14.68 C ATOM 1628 C THR A 108 3.907 -0.851 6.505 1.00 11.66 C ATOM 1629 O THR A 108 4.651 -0.095 5.885 1.00 12.01 O ATOM 1630 CB THR A 108 4.108 0.285 8.671 1.00 17.07 C ATOM 1631 OG1 THR A 108 4.992 -0.737 9.155 1.00 19.97 O ATOM 1632 CG2 THR A 108 3.384 0.935 9.824 1.00 17.11 C ATOM 1633 HA THR A 108 2.374 0.399 7.384 1.00 0.00 H ATOM 1634 HB THR A 108 4.683 1.054 8.154 1.00 0.00 H ATOM 1635 HG1 THR A 108 4.465 -1.435 9.619 1.00 0.00 H ATOM 1636 HG23 THR A 108 2.717 1.708 9.443 1.00 0.00 H ATOM 1637 HG21 THR A 108 2.803 0.182 10.357 1.00 0.00 H ATOM 1638 HG22 THR A 108 4.111 1.382 10.502 1.00 0.00 H ATOM 1639 H THR A 108 2.871 -2.210 8.754 1.00 0.00 H ATOM 1640 N ARG A 109 3.793 -2.138 6.202 1.00 12.18 N ATOM 1641 CA ARG A 109 4.425 -2.654 4.994 1.00 13.44 C ATOM 1642 C ARG A 109 3.559 -3.689 4.318 1.00 13.10 C ATOM 1643 O ARG A 109 2.911 -4.486 4.993 1.00 10.05 O ATOM 1644 CB ARG A 109 5.790 -3.275 5.299 1.00 11.82 C ATOM 1645 CG ARG A 109 6.947 -2.291 5.341 1.00 11.90 C ATOM 1646 CD ARG A 109 8.268 -3.018 5.562 1.00 12.71 C ATOM 1647 NE ARG A 109 8.713 -3.708 4.355 1.00 17.59 N ATOM 1648 CZ ARG A 109 9.768 -4.519 4.289 1.00 17.64 C ATOM 1649 NH1 ARG A 109 10.497 -4.768 5.375 1.00 14.98 N ATOM 1650 NH2 ARG A 109 10.087 -5.096 3.135 1.00 11.35 N ATOM 1651 HA ARG A 109 4.558 -1.804 4.325 1.00 0.00 H ATOM 1652 HB2 ARG A 109 5.729 -3.767 6.270 1.00 0.00 H ATOM 1653 HB3 ARG A 109 6.004 -4.017 4.530 1.00 0.00 H ATOM 1654 HG2 ARG A 109 6.990 -1.750 4.396 1.00 0.00 H ATOM 1655 HG3 ARG A 109 6.787 -1.585 6.156 1.00 0.00 H ATOM 1656 HD2 ARG A 109 8.140 -3.749 6.360 1.00 0.00 H ATOM 1657 HD3 ARG A 109 9.027 -2.292 5.854 1.00 0.00 H ATOM 1658 HE ARG A 109 8.167 -3.555 3.483 1.00 0.00 H ATOM 1659 HH12 ARG A 109 11.319 -5.402 5.315 1.00 0.00 H ATOM 1660 HH11 ARG A 109 10.244 -4.328 6.283 1.00 0.00 H ATOM 1661 HH22 ARG A 109 10.910 -5.730 3.080 1.00 0.00 H ATOM 1662 HH21 ARG A 109 9.514 -4.914 2.287 1.00 0.00 H ATOM 1663 H ARG A 109 3.255 -2.775 6.823 1.00 0.00 H ATOM 1664 N CYS A 110 3.568 -3.683 2.982 1.00 8.83 N ATOM 1665 CA CYS A 110 3.055 -4.805 2.221 1.00 7.61 C ATOM 1666 C CYS A 110 4.106 -5.311 1.254 1.00 11.14 C ATOM 1667 O CYS A 110 4.811 -4.515 0.632 1.00 10.38 O ATOM 1668 CB CYS A 110 1.813 -4.416 1.427 1.00 10.09 C ATOM 1669 SG CYS A 110 0.386 -4.104 2.448 1.00 13.65 S ATOM 1670 HA CYS A 110 2.793 -5.587 2.934 1.00 0.00 H ATOM 1671 HB2 CYS A 110 1.575 -5.227 0.739 1.00 0.00 H ATOM 1672 HB3 CYS A 110 2.035 -3.513 0.859 1.00 0.00 H ATOM 1673 HG CYS A 110 -0.684 -3.761 1.647 1.00 0.00 H ATOM 1674 H CYS A 110 3.950 -2.857 2.478 1.00 0.00 H ATOM 1675 N GLU A 111 4.194 -6.633 1.136 1.00 8.52 N ATOM 1676 CA GLU A 111 4.913 -7.281 0.056 1.00 12.42 C ATOM 1677 C GLU A 111 3.917 -8.147 -0.696 1.00 17.15 C ATOM 1678 O GLU A 111 3.303 -9.067 -0.125 1.00 8.07 O ATOM 1679 CB GLU A 111 6.052 -8.127 0.587 1.00 12.91 C ATOM 1680 CG GLU A 111 7.120 -7.323 1.296 1.00 15.76 C ATOM 1681 CD GLU A 111 7.986 -6.523 0.334 1.00 15.57 C ATOM 1682 OE1 GLU A 111 8.124 -6.936 -0.832 1.00 12.87 O ATOM 1683 OE2 GLU A 111 8.531 -5.482 0.751 1.00 15.47 O ATOM 1684 HA GLU A 111 5.352 -6.532 -0.603 1.00 0.00 H ATOM 1685 HB2 GLU A 111 5.644 -8.854 1.289 1.00 0.00 H ATOM 1686 HB3 GLU A 111 6.513 -8.651 -0.250 1.00 0.00 H ATOM 1687 HG2 GLU A 111 6.636 -6.633 1.987 1.00 0.00 H ATOM 1688 HG3 GLU A 111 7.759 -8.007 1.855 1.00 0.00 H ATOM 1689 H GLU A 111 3.727 -7.228 1.850 1.00 0.00 H ATOM 1690 N VAL A 112 3.733 -7.826 -1.972 1.00 11.84 N ATOM 1691 CA VAL A 112 2.716 -8.487 -2.763 1.00 9.04 C ATOM 1692 C VAL A 112 3.372 -9.095 -3.978 1.00 12.12 C ATOM 1693 O VAL A 112 4.368 -8.575 -4.478 1.00 13.72 O ATOM 1694 CB VAL A 112 1.621 -7.496 -3.218 1.00 16.02 C ATOM 1695 CG1 VAL A 112 0.481 -8.217 -3.946 1.00 13.14 C ATOM 1696 CG2 VAL A 112 1.092 -6.719 -2.041 1.00 11.95 C ATOM 1697 HA VAL A 112 2.242 -9.255 -2.151 1.00 0.00 H ATOM 1698 HB VAL A 112 2.074 -6.798 -3.922 1.00 0.00 H ATOM 1699 HG11 VAL A 112 0.877 -8.724 -4.826 1.00 0.00 H ATOM 1700 HG12 VAL A 112 0.029 -8.949 -3.276 1.00 0.00 H ATOM 1701 HG13 VAL A 112 -0.271 -7.489 -4.252 1.00 0.00 H ATOM 1702 HG21 VAL A 112 0.666 -7.410 -1.313 1.00 0.00 H ATOM 1703 HG22 VAL A 112 1.907 -6.161 -1.580 1.00 0.00 H ATOM 1704 HG23 VAL A 112 0.322 -6.026 -2.381 1.00 0.00 H ATOM 1705 H VAL A 112 4.326 -7.091 -2.408 1.00 0.00 H ATOM 1706 N THR A 113 2.825 -10.222 -4.417 1.00 12.12 N ATOM 1707 CA THR A 113 3.126 -10.785 -5.711 1.00 8.31 C ATOM 1708 C THR A 113 1.849 -10.704 -6.535 1.00 8.00 C ATOM 1709 O THR A 113 0.827 -11.285 -6.166 1.00 6.34 O ATOM 1710 CB THR A 113 3.514 -12.248 -5.591 1.00 9.85 C ATOM 1711 OG1 THR A 113 4.589 -12.374 -4.665 1.00 7.93 O ATOM 1712 CG2 THR A 113 3.946 -12.810 -6.953 1.00 9.59 C ATOM 1713 HA THR A 113 3.954 -10.241 -6.165 1.00 0.00 H ATOM 1714 HB THR A 113 2.649 -12.812 -5.241 1.00 0.00 H ATOM 1715 HG1 THR A 113 4.303 -12.032 -3.781 1.00 0.00 H ATOM 1716 HG23 THR A 113 3.124 -12.714 -7.662 1.00 0.00 H ATOM 1717 HG21 THR A 113 4.809 -12.252 -7.318 1.00 0.00 H ATOM 1718 HG22 THR A 113 4.211 -13.861 -6.843 1.00 0.00 H ATOM 1719 H THR A 113 2.151 -10.721 -3.802 1.00 0.00 H ATOM 1720 N GLU A 114 1.900 -9.965 -7.639 1.00 6.62 N ATOM 1721 CA GLU A 114 0.793 -9.960 -8.576 1.00 8.02 C ATOM 1722 C GLU A 114 1.100 -10.932 -9.712 1.00 9.20 C ATOM 1723 O GLU A 114 2.175 -10.878 -10.330 1.00 4.84 O ATOM 1724 CB GLU A 114 0.522 -8.570 -9.153 1.00 8.45 C ATOM 1725 CG GLU A 114 -0.726 -8.570 -10.057 1.00 12.77 C ATOM 1726 CD GLU A 114 -0.778 -7.419 -11.068 1.00 11.97 C ATOM 1727 OE1 GLU A 114 -0.275 -6.312 -10.783 1.00 8.75 O ATOM 1728 OE2 GLU A 114 -1.338 -7.637 -12.158 1.00 16.08 O ATOM 1729 HA GLU A 114 -0.103 -10.266 -8.035 1.00 0.00 H ATOM 1730 HB2 GLU A 114 0.366 -7.869 -8.333 1.00 0.00 H ATOM 1731 HB3 GLU A 114 1.385 -8.255 -9.739 1.00 0.00 H ATOM 1732 HG2 GLU A 114 -0.747 -9.510 -10.609 1.00 0.00 H ATOM 1733 HG3 GLU A 114 -1.608 -8.504 -9.420 1.00 0.00 H ATOM 1734 H GLU A 114 2.741 -9.385 -7.832 1.00 0.00 H ATOM 1735 N VAL A 115 0.169 -11.838 -9.980 1.00 3.78 N ATOM 1736 CA VAL A 115 0.400 -12.836 -11.013 1.00 3.90 C ATOM 1737 C VAL A 115 -0.410 -12.484 -12.244 1.00 8.91 C ATOM 1738 O VAL A 115 -1.602 -12.200 -12.146 1.00 7.33 O ATOM 1739 CB VAL A 115 0.028 -14.250 -10.517 1.00 9.12 C ATOM 1740 CG1 VAL A 115 0.553 -15.313 -11.477 1.00 7.52 C ATOM 1741 CG2 VAL A 115 0.582 -14.476 -9.133 1.00 4.57 C ATOM 1742 HA VAL A 115 1.461 -12.839 -11.262 1.00 0.00 H ATOM 1743 HB VAL A 115 -1.059 -14.329 -10.480 1.00 0.00 H ATOM 1744 HG11 VAL A 115 0.115 -15.158 -12.463 1.00 0.00 H ATOM 1745 HG12 VAL A 115 1.638 -15.236 -11.544 1.00 0.00 H ATOM 1746 HG13 VAL A 115 0.279 -16.301 -11.108 1.00 0.00 H ATOM 1747 HG21 VAL A 115 1.667 -14.379 -9.157 1.00 0.00 H ATOM 1748 HG22 VAL A 115 0.165 -13.736 -8.451 1.00 0.00 H ATOM 1749 HG23 VAL A 115 0.313 -15.477 -8.794 1.00 0.00 H ATOM 1750 H VAL A 115 -0.727 -11.835 -9.451 1.00 0.00 H ATOM 1751 N ASP A 116 0.235 -12.496 -13.405 1.00 10.98 N ATOM 1752 CA ASP A 116 -0.425 -12.043 -14.625 1.00 6.75 C ATOM 1753 C ASP A 116 -1.353 -13.112 -15.191 1.00 11.80 C ATOM 1754 O ASP A 116 -0.990 -13.837 -16.116 1.00 9.15 O ATOM 1755 CB ASP A 116 0.625 -11.670 -15.657 1.00 8.77 C ATOM 1756 CG ASP A 116 0.071 -10.826 -16.776 1.00 9.53 C ATOM 1757 OD1 ASP A 116 -1.138 -10.458 -16.754 1.00 6.96 O ATOM 1758 OD2 ASP A 116 0.865 -10.522 -17.676 1.00 6.39 O ATOM 1759 HA ASP A 116 -1.033 -11.172 -14.381 1.00 0.00 H ATOM 1760 HB2 ASP A 116 1.419 -11.112 -15.160 1.00 0.00 H ATOM 1761 HB3 ASP A 116 1.037 -12.585 -16.082 1.00 0.00 H ATOM 1762 H ASP A 116 1.219 -12.831 -13.445 1.00 0.00 H ATOM 1763 N ILE A 117 -2.554 -13.208 -14.623 1.00 13.37 N ATOM 1764 CA ILE A 117 -3.557 -14.157 -15.082 1.00 14.88 C ATOM 1765 C ILE A 117 -4.919 -13.531 -14.884 1.00 14.48 C ATOM 1766 O ILE A 117 -5.168 -12.893 -13.864 1.00 11.02 O ATOM 1767 CB ILE A 117 -3.598 -15.430 -14.236 1.00 14.68 C ATOM 1768 CG1 ILE A 117 -2.288 -15.717 -13.515 1.00 19.22 C ATOM 1769 CG2 ILE A 117 -4.018 -16.605 -15.069 1.00 17.90 C ATOM 1770 CD1 ILE A 117 -2.415 -16.897 -12.577 1.00 21.26 C ATOM 1771 HA ILE A 117 -3.311 -14.399 -16.116 1.00 0.00 H ATOM 1772 HB ILE A 117 -4.342 -15.260 -13.458 1.00 0.00 H ATOM 1773 HG12 ILE A 117 -1.517 -15.934 -14.254 1.00 0.00 H ATOM 1774 HG13 ILE A 117 -2.000 -14.837 -12.940 1.00 0.00 H ATOM 1775 HD11 ILE A 117 -3.180 -16.685 -11.830 1.00 0.00 H ATOM 1776 HD12 ILE A 117 -2.696 -17.783 -13.146 1.00 0.00 H ATOM 1777 HD13 ILE A 117 -1.460 -17.070 -12.081 1.00 0.00 H ATOM 1778 HG21 ILE A 117 -5.011 -16.421 -15.480 1.00 0.00 H ATOM 1779 HG22 ILE A 117 -3.307 -16.744 -15.883 1.00 0.00 H ATOM 1780 HG23 ILE A 117 -4.040 -17.500 -14.447 1.00 0.00 H ATOM 1781 H ILE A 117 -2.783 -12.583 -13.824 1.00 0.00 H ATOM 1782 N GLY A 118 -5.815 -13.733 -15.837 1.00 12.98 N ATOM 1783 CA GLY A 118 -7.131 -13.127 -15.758 1.00 16.42 C ATOM 1784 C GLY A 118 -8.177 -14.033 -15.126 1.00 18.18 C ATOM 1785 O GLY A 118 -8.766 -14.868 -15.816 1.00 17.38 O ATOM 1786 HA3 GLY A 118 -7.457 -12.875 -16.767 1.00 0.00 H ATOM 1787 HA2 GLY A 118 -7.057 -12.217 -15.163 1.00 0.00 H ATOM 1788 H GLY A 118 -5.573 -14.333 -16.651 1.00 0.00 H ATOM 1789 N LEU A 119 -8.407 -13.856 -13.824 1.00 16.43 N ATOM 1790 CA LEU A 119 -9.400 -14.627 -13.064 1.00 11.08 C ATOM 1791 C LEU A 119 -10.432 -13.717 -12.446 1.00 16.75 C ATOM 1792 O LEU A 119 -10.317 -13.384 -11.266 1.00 18.37 O ATOM 1793 CB LEU A 119 -8.776 -15.352 -11.878 1.00 16.69 C ATOM 1794 CG LEU A 119 -7.727 -16.443 -11.948 1.00 21.42 C ATOM 1795 CD1 LEU A 119 -6.487 -15.886 -12.553 1.00 16.12 C ATOM 1796 CD2 LEU A 119 -7.454 -16.913 -10.531 1.00 14.73 C ATOM 1797 HA LEU A 119 -9.830 -15.325 -13.782 1.00 0.00 H ATOM 1798 HB2 LEU A 119 -8.331 -14.567 -11.266 1.00 0.00 H ATOM 1799 HB3 LEU A 119 -9.615 -15.797 -11.342 1.00 0.00 H ATOM 1800 HG LEU A 119 -8.069 -17.279 -12.559 1.00 0.00 H ATOM 1801 HD21 LEU A 119 -7.091 -16.075 -9.935 1.00 0.00 H ATOM 1802 HD22 LEU A 119 -8.375 -17.299 -10.094 1.00 0.00 H ATOM 1803 HD23 LEU A 119 -6.701 -17.701 -10.550 1.00 0.00 H ATOM 1804 HD11 LEU A 119 -6.706 -15.521 -13.557 1.00 0.00 H ATOM 1805 HD12 LEU A 119 -6.122 -15.064 -11.938 1.00 0.00 H ATOM 1806 HD13 LEU A 119 -5.728 -16.666 -12.606 1.00 0.00 H ATOM 1807 H LEU A 119 -7.854 -13.134 -13.320 1.00 0.00 H ATOM 1808 N PRO A 120 -11.442 -13.318 -13.226 1.00 12.52 N ATOM 1809 CA PRO A 120 -12.543 -12.508 -12.701 1.00 15.50 C ATOM 1810 C PRO A 120 -13.046 -13.082 -11.383 1.00 14.97 C ATOM 1811 O PRO A 120 -13.243 -14.295 -11.265 1.00 16.36 O ATOM 1812 CB PRO A 120 -13.617 -12.603 -13.799 1.00 15.84 C ATOM 1813 CG PRO A 120 -13.118 -13.645 -14.776 1.00 22.91 C ATOM 1814 CD PRO A 120 -11.626 -13.646 -14.647 1.00 16.24 C ATOM 1815 HA PRO A 120 -12.256 -11.479 -12.486 1.00 0.00 H ATOM 1816 HD3 PRO A 120 -11.208 -14.624 -14.885 1.00 0.00 H ATOM 1817 HD2 PRO A 120 -11.172 -12.892 -15.290 1.00 0.00 H ATOM 1818 HG3 PRO A 120 -13.411 -13.383 -15.793 1.00 0.00 H ATOM 1819 HG2 PRO A 120 -13.522 -14.626 -14.524 1.00 0.00 H ATOM 1820 HB2 PRO A 120 -14.571 -12.910 -13.371 1.00 0.00 H ATOM 1821 HB3 PRO A 120 -13.736 -11.641 -14.298 1.00 0.00 H ATOM 1822 N ARG A 121 -13.192 -12.216 -10.388 1.00 15.07 N ATOM 1823 CA ARG A 121 -13.651 -12.635 -9.070 1.00 19.15 C ATOM 1824 C ARG A 121 -14.950 -13.429 -9.162 1.00 14.29 C ATOM 1825 O ARG A 121 -15.790 -13.182 -10.025 1.00 16.98 O ATOM 1826 CB ARG A 121 -13.880 -11.416 -8.190 1.00 21.73 C ATOM 1827 CG ARG A 121 -12.649 -10.579 -7.995 1.00 15.35 C ATOM 1828 CD ARG A 121 -12.995 -9.315 -7.232 1.00 17.00 C ATOM 1829 NE ARG A 121 -11.823 -8.468 -7.051 1.00 20.54 N ATOM 1830 CZ ARG A 121 -11.671 -7.611 -6.047 1.00 23.05 C ATOM 1831 NH1 ARG A 121 -10.567 -6.879 -5.965 1.00 22.37 N ATOM 1832 NH2 ARG A 121 -12.627 -7.488 -5.133 1.00 22.48 N ATOM 1833 HA ARG A 121 -12.880 -13.273 -8.637 1.00 0.00 H ATOM 1834 HB2 ARG A 121 -14.649 -10.797 -8.651 1.00 0.00 H ATOM 1835 HB3 ARG A 121 -14.225 -11.755 -7.213 1.00 0.00 H ATOM 1836 HG2 ARG A 121 -11.910 -11.149 -7.432 1.00 0.00 H ATOM 1837 HG3 ARG A 121 -12.236 -10.312 -8.968 1.00 0.00 H ATOM 1838 HD2 ARG A 121 -13.391 -9.588 -6.254 1.00 0.00 H ATOM 1839 HD3 ARG A 121 -13.752 -8.761 -7.787 1.00 0.00 H ATOM 1840 HE ARG A 121 -11.058 -8.539 -7.752 1.00 0.00 H ATOM 1841 HH12 ARG A 121 -10.445 -6.207 -5.180 1.00 0.00 H ATOM 1842 HH11 ARG A 121 -9.823 -6.977 -6.686 1.00 0.00 H ATOM 1843 HH22 ARG A 121 -12.511 -6.818 -4.346 1.00 0.00 H ATOM 1844 HH21 ARG A 121 -13.492 -8.062 -5.204 1.00 0.00 H ATOM 1845 H ARG A 121 -12.973 -11.213 -10.553 1.00 0.00 H ATOM 1846 N GLU A 122 -15.086 -14.408 -8.283 1.00 14.83 N ATOM 1847 CA GLU A 122 -16.306 -15.179 -8.198 1.00 17.59 C ATOM 1848 C GLU A 122 -16.703 -15.192 -6.739 1.00 19.18 C ATOM 1849 O GLU A 122 -15.841 -15.137 -5.858 1.00 17.67 O ATOM 1850 CB GLU A 122 -16.098 -16.611 -8.728 1.00 17.13 C ATOM 1851 CG GLU A 122 -15.448 -16.664 -10.116 1.00 24.97 C ATOM 1852 CD GLU A 122 -15.549 -18.022 -10.805 1.00 24.12 C ATOM 1853 OE1 GLU A 122 -15.458 -19.070 -10.127 1.00 26.07 O ATOM 1854 OE2 GLU A 122 -15.721 -18.033 -12.044 1.00 22.79 O ATOM 1855 HA GLU A 122 -17.090 -14.736 -8.813 1.00 0.00 H ATOM 1856 HB2 GLU A 122 -15.459 -17.149 -8.027 1.00 0.00 H ATOM 1857 HB3 GLU A 122 -17.069 -17.103 -8.783 1.00 0.00 H ATOM 1858 HG2 GLU A 122 -15.934 -15.922 -10.750 1.00 0.00 H ATOM 1859 HG3 GLU A 122 -14.393 -16.413 -10.009 1.00 0.00 H ATOM 1860 H GLU A 122 -14.299 -14.628 -7.640 1.00 0.00 H ATOM 1861 N ALA A 123 -18.005 -15.232 -6.486 1.00 16.98 N ATOM 1862 CA ALA A 123 -18.497 -15.462 -5.138 1.00 21.43 C ATOM 1863 C ALA A 123 -17.709 -16.603 -4.511 1.00 17.50 C ATOM 1864 O ALA A 123 -17.485 -17.628 -5.155 1.00 19.67 O ATOM 1865 CB ALA A 123 -19.966 -15.806 -5.180 1.00 20.04 C ATOM 1866 HA ALA A 123 -18.368 -14.560 -4.540 1.00 0.00 H ATOM 1867 HB1 ALA A 123 -20.518 -14.981 -5.629 1.00 0.00 H ATOM 1868 HB2 ALA A 123 -20.110 -16.708 -5.775 1.00 0.00 H ATOM 1869 HB3 ALA A 123 -20.327 -15.977 -4.166 1.00 0.00 H ATOM 1870 H ALA A 123 -18.683 -15.097 -7.263 1.00 0.00 H ATOM 1871 N GLY A 124 -17.270 -16.419 -3.269 1.00 14.10 N ATOM 1872 CA GLY A 124 -16.572 -17.474 -2.554 1.00 21.33 C ATOM 1873 C GLY A 124 -15.053 -17.358 -2.552 1.00 23.59 C ATOM 1874 O GLY A 124 -14.381 -17.890 -1.659 1.00 24.43 O ATOM 1875 HA3 GLY A 124 -16.838 -18.426 -3.013 1.00 0.00 H ATOM 1876 HA2 GLY A 124 -16.913 -17.464 -1.519 1.00 0.00 H ATOM 1877 H GLY A 124 -17.429 -15.504 -2.801 1.00 0.00 H ATOM 1878 N ASP A 125 -14.516 -16.669 -3.557 1.00 21.55 N ATOM 1879 CA ASP A 125 -13.074 -16.451 -3.689 1.00 15.51 C ATOM 1880 C ASP A 125 -12.485 -15.701 -2.504 1.00 16.40 C ATOM 1881 O ASP A 125 -13.091 -14.768 -1.994 1.00 21.78 O ATOM 1882 CB ASP A 125 -12.781 -15.627 -4.941 1.00 14.06 C ATOM 1883 CG ASP A 125 -12.878 -16.437 -6.212 1.00 16.95 C ATOM 1884 OD1 ASP A 125 -12.839 -17.689 -6.142 1.00 13.25 O ATOM 1885 OD2 ASP A 125 -12.970 -15.808 -7.283 1.00 18.89 O ATOM 1886 HA ASP A 125 -12.620 -17.440 -3.744 1.00 0.00 H ATOM 1887 HB2 ASP A 125 -13.498 -14.808 -4.994 1.00 0.00 H ATOM 1888 HB3 ASP A 125 -11.772 -15.221 -4.863 1.00 0.00 H ATOM 1889 H ASP A 125 -15.148 -16.268 -4.279 1.00 0.00 H ATOM 1890 N ALA A 126 -11.297 -16.108 -2.076 1.00 19.93 N ATOM 1891 CA ALA A 126 -10.524 -15.318 -1.128 1.00 19.10 C ATOM 1892 C ALA A 126 -9.880 -14.155 -1.884 1.00 17.66 C ATOM 1893 O ALA A 126 -9.361 -14.346 -2.990 1.00 14.09 O ATOM 1894 CB ALA A 126 -9.472 -16.176 -0.467 1.00 16.19 C ATOM 1895 HA ALA A 126 -11.174 -14.930 -0.344 1.00 0.00 H ATOM 1896 HB1 ALA A 126 -9.955 -16.997 0.063 1.00 0.00 H ATOM 1897 HB2 ALA A 126 -8.802 -16.577 -1.227 1.00 0.00 H ATOM 1898 HB3 ALA A 126 -8.903 -15.571 0.239 1.00 0.00 H ATOM 1899 H ALA A 126 -10.910 -17.008 -2.424 1.00 0.00 H ATOM 1900 N LEU A 127 -9.919 -12.963 -1.283 1.00 14.00 N ATOM 1901 CA LEU A 127 -9.553 -11.707 -1.950 1.00 13.55 C ATOM 1902 C LEU A 127 -8.433 -10.958 -1.234 1.00 14.05 C ATOM 1903 O LEU A 127 -8.319 -11.016 -0.011 1.00 10.74 O ATOM 1904 CB LEU A 127 -10.768 -10.777 -2.074 1.00 15.31 C ATOM 1905 CG LEU A 127 -12.043 -11.342 -2.715 1.00 23.85 C ATOM 1906 CD1 LEU A 127 -13.177 -10.314 -2.712 1.00 19.78 C ATOM 1907 CD2 LEU A 127 -11.765 -11.828 -4.128 1.00 16.34 C ATOM 1908 HA LEU A 127 -9.193 -11.990 -2.939 1.00 0.00 H ATOM 1909 HB2 LEU A 127 -11.029 -10.447 -1.068 1.00 0.00 H ATOM 1910 HB3 LEU A 127 -10.459 -9.917 -2.668 1.00 0.00 H ATOM 1911 HG LEU A 127 -12.365 -12.192 -2.113 1.00 0.00 H ATOM 1912 HD21 LEU A 127 -11.405 -10.996 -4.733 1.00 0.00 H ATOM 1913 HD22 LEU A 127 -11.008 -12.612 -4.099 1.00 0.00 H ATOM 1914 HD23 LEU A 127 -12.683 -12.224 -4.562 1.00 0.00 H ATOM 1915 HD11 LEU A 127 -13.404 -10.029 -1.685 1.00 0.00 H ATOM 1916 HD12 LEU A 127 -12.869 -9.433 -3.275 1.00 0.00 H ATOM 1917 HD13 LEU A 127 -14.063 -10.751 -3.174 1.00 0.00 H ATOM 1918 H LEU A 127 -10.225 -12.922 -0.290 1.00 0.00 H ATOM 1919 N ALA A 128 -7.619 -10.241 -2.005 1.00 11.98 N ATOM 1920 CA ALA A 128 -6.489 -9.511 -1.441 1.00 13.42 C ATOM 1921 C ALA A 128 -6.989 -8.373 -0.560 1.00 14.04 C ATOM 1922 O ALA A 128 -8.055 -7.819 -0.812 1.00 15.15 O ATOM 1923 CB ALA A 128 -5.609 -8.970 -2.543 1.00 13.24 C ATOM 1924 HA ALA A 128 -5.900 -10.196 -0.832 1.00 0.00 H ATOM 1925 HB1 ALA A 128 -5.233 -9.797 -3.145 1.00 0.00 H ATOM 1926 HB2 ALA A 128 -6.190 -8.295 -3.172 1.00 0.00 H ATOM 1927 HB3 ALA A 128 -4.771 -8.428 -2.104 1.00 0.00 H ATOM 1928 H ALA A 128 -7.792 -10.200 -3.030 1.00 0.00 H ATOM 1929 N PRO A 129 -6.225 -8.027 0.487 1.00 11.91 N ATOM 1930 CA PRO A 129 -6.609 -6.857 1.271 1.00 13.62 C ATOM 1931 C PRO A 129 -6.563 -5.596 0.395 1.00 15.63 C ATOM 1932 O PRO A 129 -5.712 -5.483 -0.485 1.00 13.43 O ATOM 1933 CB PRO A 129 -5.553 -6.809 2.373 1.00 17.52 C ATOM 1934 CG PRO A 129 -4.416 -7.557 1.837 1.00 12.23 C ATOM 1935 CD PRO A 129 -4.966 -8.626 0.962 1.00 17.25 C ATOM 1936 HA PRO A 129 -7.623 -6.909 1.668 1.00 0.00 H ATOM 1937 HD3 PRO A 129 -4.293 -8.842 0.132 1.00 0.00 H ATOM 1938 HD2 PRO A 129 -5.152 -9.541 1.525 1.00 0.00 H ATOM 1939 HG3 PRO A 129 -3.842 -7.999 2.651 1.00 0.00 H ATOM 1940 HG2 PRO A 129 -3.772 -6.895 1.258 1.00 0.00 H ATOM 1941 HB2 PRO A 129 -5.268 -5.779 2.587 1.00 0.00 H ATOM 1942 HB3 PRO A 129 -5.926 -7.278 3.283 1.00 0.00 H ATOM 1943 N VAL A 130 -7.505 -4.684 0.611 1.00 16.18 N ATOM 1944 CA VAL A 130 -7.636 -3.503 -0.227 1.00 12.89 C ATOM 1945 C VAL A 130 -6.639 -2.412 0.167 1.00 15.77 C ATOM 1946 O VAL A 130 -6.640 -1.942 1.299 1.00 14.45 O ATOM 1947 CB VAL A 130 -9.075 -2.944 -0.167 1.00 15.50 C ATOM 1948 CG1 VAL A 130 -9.136 -1.551 -0.771 1.00 13.79 C ATOM 1949 CG2 VAL A 130 -10.031 -3.886 -0.884 1.00 18.28 C ATOM 1950 HA VAL A 130 -7.414 -3.811 -1.249 1.00 0.00 H ATOM 1951 HB VAL A 130 -9.378 -2.870 0.878 1.00 0.00 H ATOM 1952 HG11 VAL A 130 -8.476 -0.886 -0.215 1.00 0.00 H ATOM 1953 HG12 VAL A 130 -8.817 -1.594 -1.812 1.00 0.00 H ATOM 1954 HG13 VAL A 130 -10.159 -1.178 -0.718 1.00 0.00 H ATOM 1955 HG21 VAL A 130 -9.728 -3.985 -1.926 1.00 0.00 H ATOM 1956 HG22 VAL A 130 -10.005 -4.863 -0.402 1.00 0.00 H ATOM 1957 HG23 VAL A 130 -11.042 -3.482 -0.835 1.00 0.00 H ATOM 1958 H VAL A 130 -8.167 -4.819 1.402 1.00 0.00 H ATOM 1959 N LEU A 131 -5.790 -2.005 -0.767 1.00 8.15 N ATOM 1960 CA LEU A 131 -4.889 -0.900 -0.487 1.00 16.10 C ATOM 1961 C LEU A 131 -5.574 0.421 -0.812 1.00 14.77 C ATOM 1962 O LEU A 131 -6.190 0.570 -1.867 1.00 9.46 O ATOM 1963 CB LEU A 131 -3.576 -1.036 -1.260 1.00 10.27 C ATOM 1964 CG LEU A 131 -2.849 -2.366 -1.077 1.00 12.92 C ATOM 1965 CD1 LEU A 131 -2.066 -2.744 -2.343 1.00 9.78 C ATOM 1966 CD2 LEU A 131 -1.956 -2.338 0.164 1.00 11.33 C ATOM 1967 HA LEU A 131 -4.643 -0.921 0.575 1.00 0.00 H ATOM 1968 HB2 LEU A 131 -3.795 -0.914 -2.321 1.00 0.00 H ATOM 1969 HB3 LEU A 131 -2.908 -0.239 -0.934 1.00 0.00 H ATOM 1970 HG LEU A 131 -3.596 -3.144 -0.917 1.00 0.00 H ATOM 1971 HD21 LEU A 131 -1.215 -1.546 0.059 1.00 0.00 H ATOM 1972 HD22 LEU A 131 -2.568 -2.150 1.046 1.00 0.00 H ATOM 1973 HD23 LEU A 131 -1.451 -3.298 0.269 1.00 0.00 H ATOM 1974 HD11 LEU A 131 -2.756 -2.835 -3.182 1.00 0.00 H ATOM 1975 HD12 LEU A 131 -1.330 -1.969 -2.558 1.00 0.00 H ATOM 1976 HD13 LEU A 131 -1.558 -3.695 -2.184 1.00 0.00 H ATOM 1977 H LEU A 131 -5.769 -2.474 -1.695 1.00 0.00 H ATOM 1978 N ASP A 132 -5.473 1.357 0.126 1.00 12.05 N ATOM 1979 CA ASP A 132 -5.972 2.710 -0.043 1.00 11.19 C ATOM 1980 C ASP A 132 -4.824 3.631 -0.436 1.00 16.03 C ATOM 1981 O ASP A 132 -3.703 3.170 -0.681 1.00 11.97 O ATOM 1982 CB ASP A 132 -6.643 3.193 1.255 1.00 12.43 C ATOM 1983 CG ASP A 132 -5.644 3.468 2.386 1.00 14.29 C ATOM 1984 OD1 ASP A 132 -4.459 3.099 2.273 1.00 9.20 O ATOM 1985 OD2 ASP A 132 -6.053 4.055 3.409 1.00 19.33 O ATOM 1986 HA ASP A 132 -6.719 2.725 -0.836 1.00 0.00 H ATOM 1987 HB2 ASP A 132 -7.188 4.113 1.042 1.00 0.00 H ATOM 1988 HB3 ASP A 132 -7.343 2.427 1.589 1.00 0.00 H ATOM 1989 H ASP A 132 -5.014 1.108 1.025 1.00 0.00 H ATOM 1990 N GLU A 133 -5.094 4.935 -0.450 1.00 19.67 N ATOM 1991 CA GLU A 133 -4.118 5.911 -0.914 1.00 14.69 C ATOM 1992 C GLU A 133 -3.052 6.307 0.119 1.00 13.29 C ATOM 1993 O GLU A 133 -2.230 7.190 -0.140 1.00 10.38 O ATOM 1994 CB GLU A 133 -4.830 7.156 -1.438 1.00 14.74 C ATOM 1995 CG GLU A 133 -5.859 6.847 -2.495 1.00 13.19 C ATOM 1996 CD GLU A 133 -6.366 8.074 -3.226 1.00 15.22 C ATOM 1997 OE1 GLU A 133 -5.816 9.179 -3.016 1.00 16.11 O ATOM 1998 OE2 GLU A 133 -7.319 7.923 -4.021 1.00 18.84 O ATOM 1999 HA GLU A 133 -3.571 5.413 -1.715 1.00 0.00 H ATOM 2000 HB2 GLU A 133 -5.327 7.649 -0.603 1.00 0.00 H ATOM 2001 HB3 GLU A 133 -4.085 7.828 -1.864 1.00 0.00 H ATOM 2002 HG2 GLU A 133 -5.412 6.171 -3.224 1.00 0.00 H ATOM 2003 HG3 GLU A 133 -6.707 6.355 -2.018 1.00 0.00 H ATOM 2004 H GLU A 133 -6.024 5.264 -0.122 1.00 0.00 H ATOM 2005 N THR A 134 -3.050 5.665 1.279 1.00 9.51 N ATOM 2006 CA THR A 134 -2.043 5.990 2.280 1.00 9.06 C ATOM 2007 C THR A 134 -0.720 5.330 1.926 1.00 7.51 C ATOM 2008 O THR A 134 0.331 5.731 2.425 1.00 11.00 O ATOM 2009 CB THR A 134 -2.475 5.546 3.679 1.00 17.65 C ATOM 2010 OG1 THR A 134 -2.766 4.140 3.661 1.00 19.48 O ATOM 2011 CG2 THR A 134 -3.728 6.327 4.139 1.00 16.33 C ATOM 2012 HA THR A 134 -1.925 7.074 2.287 1.00 0.00 H ATOM 2013 HB THR A 134 -1.664 5.750 4.378 1.00 0.00 H ATOM 2014 HG1 THR A 134 -3.496 3.964 3.016 1.00 0.00 H ATOM 2015 HG23 THR A 134 -3.505 7.394 4.152 1.00 0.00 H ATOM 2016 HG21 THR A 134 -4.549 6.134 3.448 1.00 0.00 H ATOM 2017 HG22 THR A 134 -4.010 6.001 5.140 1.00 0.00 H ATOM 2018 H THR A 134 -3.763 4.934 1.473 1.00 0.00 H ATOM 2019 N TRP A 135 -0.780 4.326 1.049 1.00 10.52 N ATOM 2020 CA TRP A 135 0.395 3.519 0.707 1.00 8.87 C ATOM 2021 C TRP A 135 1.259 4.150 -0.364 1.00 7.96 C ATOM 2022 O TRP A 135 0.763 4.841 -1.250 1.00 12.86 O ATOM 2023 CB TRP A 135 -0.004 2.107 0.272 1.00 5.60 C ATOM 2024 CG TRP A 135 -0.675 1.322 1.352 1.00 7.71 C ATOM 2025 CD1 TRP A 135 -2.010 1.196 1.556 1.00 9.33 C ATOM 2026 CD2 TRP A 135 -0.037 0.552 2.376 1.00 6.85 C ATOM 2027 NE1 TRP A 135 -2.253 0.389 2.644 1.00 6.19 N ATOM 2028 CE2 TRP A 135 -1.053 -0.012 3.168 1.00 11.25 C ATOM 2029 CE3 TRP A 135 1.295 0.280 2.697 1.00 9.21 C ATOM 2030 CZ2 TRP A 135 -0.780 -0.832 4.260 1.00 10.64 C ATOM 2031 CZ3 TRP A 135 1.563 -0.530 3.782 1.00 10.30 C ATOM 2032 CH2 TRP A 135 0.533 -1.076 4.549 1.00 11.14 C ATOM 2033 HA TRP A 135 0.987 3.465 1.621 1.00 0.00 H ATOM 2034 HB2 TRP A 135 -0.687 2.186 -0.574 1.00 0.00 H ATOM 2035 HB3 TRP A 135 0.895 1.573 -0.037 1.00 0.00 H ATOM 2036 HE1 TRP A 135 -3.192 0.127 3.008 1.00 0.00 H ATOM 2037 HD1 TRP A 135 -2.780 1.667 0.945 1.00 0.00 H ATOM 2038 HZ2 TRP A 135 -1.582 -1.262 4.860 1.00 0.00 H ATOM 2039 HH2 TRP A 135 0.782 -1.712 5.399 1.00 0.00 H ATOM 2040 HZ3 TRP A 135 2.598 -0.747 4.045 1.00 0.00 H ATOM 2041 HE3 TRP A 135 2.107 0.699 2.102 1.00 0.00 H ATOM 2042 H TRP A 135 -1.689 4.109 0.594 1.00 0.00 H ATOM 2043 N ARG A 136 2.560 3.893 -0.268 1.00 8.55 N ATOM 2044 CA ARG A 136 3.530 4.349 -1.248 1.00 11.09 C ATOM 2045 C ARG A 136 4.581 3.263 -1.439 1.00 12.22 C ATOM 2046 O ARG A 136 4.935 2.533 -0.501 1.00 10.00 O ATOM 2047 CB ARG A 136 4.209 5.655 -0.794 1.00 16.14 C ATOM 2048 CG ARG A 136 3.262 6.836 -0.579 1.00 14.82 C ATOM 2049 CD ARG A 136 2.879 7.530 -1.885 1.00 10.47 C ATOM 2050 NE ARG A 136 2.027 8.695 -1.656 1.00 12.64 N ATOM 2051 CZ ARG A 136 0.739 8.620 -1.319 1.00 13.04 C ATOM 2052 NH1 ARG A 136 0.158 7.437 -1.161 1.00 10.12 N ATOM 2053 NH2 ARG A 136 0.031 9.724 -1.130 1.00 8.14 N ATOM 2054 HA ARG A 136 3.015 4.548 -2.188 1.00 0.00 H ATOM 2055 HB2 ARG A 136 4.724 5.459 0.146 1.00 0.00 H ATOM 2056 HB3 ARG A 136 4.937 5.939 -1.554 1.00 0.00 H ATOM 2057 HG2 ARG A 136 2.354 6.472 -0.098 1.00 0.00 H ATOM 2058 HG3 ARG A 136 3.751 7.561 0.071 1.00 0.00 H ATOM 2059 HD2 ARG A 136 2.344 6.821 -2.517 1.00 0.00 H ATOM 2060 HD3 ARG A 136 3.788 7.853 -2.392 1.00 0.00 H ATOM 2061 HE ARG A 136 2.450 9.639 -1.762 1.00 0.00 H ATOM 2062 HH12 ARG A 136 -0.847 7.382 -0.898 1.00 0.00 H ATOM 2063 HH11 ARG A 136 0.708 6.565 -1.300 1.00 0.00 H ATOM 2064 HH22 ARG A 136 -0.973 9.659 -0.867 1.00 0.00 H ATOM 2065 HH21 ARG A 136 0.479 10.655 -1.244 1.00 0.00 H ATOM 2066 H ARG A 136 2.898 3.341 0.546 1.00 0.00 H ATOM 2067 N GLY A 137 5.105 3.149 -2.649 1.00 12.29 N ATOM 2068 CA GLY A 137 6.175 2.200 -2.843 1.00 11.73 C ATOM 2069 C GLY A 137 6.514 1.872 -4.270 1.00 15.82 C ATOM 2070 O GLY A 137 6.264 2.654 -5.194 1.00 13.32 O ATOM 2071 HA3 GLY A 137 5.893 1.272 -2.345 1.00 0.00 H ATOM 2072 HA2 GLY A 137 7.070 2.606 -2.372 1.00 0.00 H ATOM 2073 H GLY A 137 4.755 3.728 -3.439 1.00 0.00 H ATOM 2074 N GLU A 138 7.079 0.685 -4.443 1.00 12.72 N ATOM 2075 CA GLU A 138 7.568 0.268 -5.740 1.00 15.23 C ATOM 2076 C GLU A 138 6.718 -0.850 -6.324 1.00 16.85 C ATOM 2077 O GLU A 138 6.535 -1.898 -5.704 1.00 12.66 O ATOM 2078 CB GLU A 138 9.037 -0.160 -5.648 1.00 15.07 C ATOM 2079 CG GLU A 138 9.999 0.968 -5.279 1.00 17.23 C ATOM 2080 CD GLU A 138 9.871 1.419 -3.833 1.00 18.71 C ATOM 2081 OE1 GLU A 138 10.076 0.581 -2.930 1.00 19.02 O ATOM 2082 OE2 GLU A 138 9.557 2.607 -3.597 1.00 17.00 O ATOM 2083 HA GLU A 138 7.495 1.122 -6.413 1.00 0.00 H ATOM 2084 HB2 GLU A 138 9.119 -0.940 -4.891 1.00 0.00 H ATOM 2085 HB3 GLU A 138 9.337 -0.562 -6.616 1.00 0.00 H ATOM 2086 HG2 GLU A 138 11.019 0.621 -5.444 1.00 0.00 H ATOM 2087 HG3 GLU A 138 9.797 1.821 -5.927 1.00 0.00 H ATOM 2088 H GLU A 138 7.173 0.041 -3.631 1.00 0.00 H ATOM 2089 N THR A 139 6.189 -0.603 -7.515 1.00 11.85 N ATOM 2090 CA THR A 139 5.564 -1.656 -8.290 1.00 17.19 C ATOM 2091 C THR A 139 6.620 -2.102 -9.284 1.00 18.87 C ATOM 2092 O THR A 139 6.945 -1.361 -10.223 1.00 16.39 O ATOM 2093 CB THR A 139 4.326 -1.167 -9.040 1.00 13.22 C ATOM 2094 OG1 THR A 139 3.405 -0.581 -8.109 1.00 10.44 O ATOM 2095 CG2 THR A 139 3.651 -2.332 -9.738 1.00 14.39 C ATOM 2096 HA THR A 139 5.225 -2.460 -7.637 1.00 0.00 H ATOM 2097 HB THR A 139 4.628 -0.426 -9.781 1.00 0.00 H ATOM 2098 HG1 THR A 139 3.139 -1.259 -7.438 1.00 0.00 H ATOM 2099 HG23 THR A 139 4.346 -2.781 -10.447 1.00 0.00 H ATOM 2100 HG21 THR A 139 3.354 -3.075 -8.998 1.00 0.00 H ATOM 2101 HG22 THR A 139 2.769 -1.974 -10.269 1.00 0.00 H ATOM 2102 H THR A 139 6.223 0.363 -7.899 1.00 0.00 H ATOM 2103 N GLY A 140 7.173 -3.297 -9.065 1.00 13.47 N ATOM 2104 CA GLY A 140 8.298 -3.772 -9.853 1.00 12.84 C ATOM 2105 C GLY A 140 7.991 -4.252 -11.271 1.00 14.48 C ATOM 2106 O GLY A 140 6.828 -4.360 -11.688 1.00 7.25 O ATOM 2107 HA3 GLY A 140 8.751 -4.604 -9.314 1.00 0.00 H ATOM 2108 HA2 GLY A 140 9.016 -2.956 -9.929 1.00 0.00 H ATOM 2109 H GLY A 140 6.789 -3.903 -8.312 1.00 0.00 H ATOM 2110 N GLU A 141 9.059 -4.563 -12.004 1.00 7.85 N ATOM 2111 CA GLU A 141 8.935 -4.980 -13.398 1.00 11.37 C ATOM 2112 C GLU A 141 8.342 -6.380 -13.553 1.00 11.73 C ATOM 2113 O GLU A 141 8.511 -7.249 -12.694 1.00 14.40 O ATOM 2114 CB GLU A 141 10.286 -4.894 -14.120 1.00 12.00 C ATOM 2115 CG GLU A 141 10.873 -3.485 -14.203 1.00 12.74 C ATOM 2116 CD GLU A 141 9.902 -2.452 -14.760 1.00 11.77 C ATOM 2117 OE1 GLU A 141 9.242 -2.720 -15.786 1.00 12.69 O ATOM 2118 OE2 GLU A 141 9.796 -1.365 -14.160 1.00 12.86 O ATOM 2119 HA GLU A 141 8.236 -4.284 -13.861 1.00 0.00 H ATOM 2120 HB2 GLU A 141 10.996 -5.528 -13.590 1.00 0.00 H ATOM 2121 HB3 GLU A 141 10.154 -5.268 -15.135 1.00 0.00 H ATOM 2122 HG2 GLU A 141 11.169 -3.175 -13.201 1.00 0.00 H ATOM 2123 HG3 GLU A 141 11.752 -3.515 -14.847 1.00 0.00 H ATOM 2124 H GLU A 141 10.004 -4.507 -11.573 1.00 0.00 H ATOM 2125 N TRP A 142 7.624 -6.589 -14.653 1.00 13.93 N ATOM 2126 CA TRP A 142 7.118 -7.920 -14.971 1.00 13.30 C ATOM 2127 C TRP A 142 8.294 -8.863 -15.206 1.00 9.56 C ATOM 2128 O TRP A 142 9.354 -8.445 -15.681 1.00 12.58 O ATOM 2129 CB TRP A 142 6.258 -7.899 -16.222 1.00 7.08 C ATOM 2130 CG TRP A 142 4.896 -7.273 -16.067 1.00 15.49 C ATOM 2131 CD1 TRP A 142 4.447 -6.140 -16.684 1.00 13.27 C ATOM 2132 CD2 TRP A 142 3.790 -7.770 -15.294 1.00 8.92 C ATOM 2133 NE1 TRP A 142 3.153 -5.894 -16.331 1.00 12.59 N ATOM 2134 CE2 TRP A 142 2.720 -6.881 -15.484 1.00 8.43 C ATOM 2135 CE3 TRP A 142 3.607 -8.877 -14.462 1.00 8.45 C ATOM 2136 CZ2 TRP A 142 1.475 -7.057 -14.864 1.00 11.91 C ATOM 2137 CZ3 TRP A 142 2.371 -9.055 -13.852 1.00 14.73 C ATOM 2138 CH2 TRP A 142 1.326 -8.148 -14.049 1.00 10.26 C ATOM 2139 HA TRP A 142 6.510 -8.260 -14.133 1.00 0.00 H ATOM 2140 HB2 TRP A 142 6.797 -7.344 -16.990 1.00 0.00 H ATOM 2141 HB3 TRP A 142 6.118 -8.929 -16.550 1.00 0.00 H ATOM 2142 HE1 TRP A 142 2.584 -5.085 -16.654 1.00 0.00 H ATOM 2143 HD1 TRP A 142 5.037 -5.522 -17.360 1.00 0.00 H ATOM 2144 HZ2 TRP A 142 0.658 -6.354 -15.024 1.00 0.00 H ATOM 2145 HH2 TRP A 142 0.374 -8.312 -13.544 1.00 0.00 H ATOM 2146 HZ3 TRP A 142 2.213 -9.919 -13.207 1.00 0.00 H ATOM 2147 HE3 TRP A 142 4.417 -9.587 -14.295 1.00 0.00 H ATOM 2148 H TRP A 142 7.421 -5.795 -15.293 1.00 0.00 H ATOM 2149 N ARG A 143 8.083 -10.138 -14.889 1.00 9.54 N ATOM 2150 CA ARG A 143 9.135 -11.140 -14.920 1.00 14.46 C ATOM 2151 C ARG A 143 8.525 -12.495 -15.284 1.00 11.47 C ATOM 2152 O ARG A 143 7.448 -12.866 -14.786 1.00 8.47 O ATOM 2153 CB ARG A 143 9.782 -11.205 -13.541 1.00 15.36 C ATOM 2154 CG ARG A 143 11.208 -11.714 -13.493 1.00 13.84 C ATOM 2155 CD ARG A 143 11.676 -11.704 -12.043 1.00 20.17 C ATOM 2156 NE ARG A 143 11.548 -10.366 -11.471 1.00 24.57 N ATOM 2157 CZ ARG A 143 11.681 -10.073 -10.180 1.00 25.75 C ATOM 2158 NH1 ARG A 143 11.935 -11.034 -9.298 1.00 20.62 N ATOM 2159 NH2 ARG A 143 11.551 -8.814 -9.773 1.00 15.52 N ATOM 2160 HA ARG A 143 9.889 -10.882 -15.663 1.00 0.00 H ATOM 2161 HB2 ARG A 143 9.774 -10.199 -13.122 1.00 0.00 H ATOM 2162 HB3 ARG A 143 9.174 -11.861 -12.919 1.00 0.00 H ATOM 2163 HG2 ARG A 143 11.250 -12.730 -13.886 1.00 0.00 H ATOM 2164 HG3 ARG A 143 11.850 -11.067 -14.091 1.00 0.00 H ATOM 2165 HD2 ARG A 143 12.720 -12.014 -12.001 1.00 0.00 H ATOM 2166 HD3 ARG A 143 11.068 -12.401 -11.465 1.00 0.00 H ATOM 2167 HE ARG A 143 11.337 -9.583 -12.122 1.00 0.00 H ATOM 2168 HH12 ARG A 143 12.038 -10.800 -8.290 1.00 0.00 H ATOM 2169 HH11 ARG A 143 12.031 -12.020 -9.616 1.00 0.00 H ATOM 2170 HH22 ARG A 143 11.654 -8.580 -8.765 1.00 0.00 H ATOM 2171 HH21 ARG A 143 11.346 -8.063 -10.463 1.00 0.00 H ATOM 2172 H ARG A 143 7.125 -10.430 -14.607 1.00 0.00 H ATOM 2173 N PHE A 144 9.203 -13.224 -16.160 1.00 10.44 N ATOM 2174 CA PHE A 144 8.782 -14.570 -16.509 1.00 8.97 C ATOM 2175 C PHE A 144 9.340 -15.563 -15.521 1.00 12.62 C ATOM 2176 O PHE A 144 10.551 -15.599 -15.288 1.00 12.33 O ATOM 2177 CB PHE A 144 9.270 -14.946 -17.906 1.00 11.68 C ATOM 2178 CG PHE A 144 8.346 -14.514 -18.995 1.00 10.69 C ATOM 2179 CD1 PHE A 144 6.973 -14.634 -18.837 1.00 9.95 C ATOM 2180 CD2 PHE A 144 8.843 -13.957 -20.165 1.00 12.68 C ATOM 2181 CE1 PHE A 144 6.115 -14.227 -19.846 1.00 9.25 C ATOM 2182 CE2 PHE A 144 7.995 -13.550 -21.164 1.00 12.36 C ATOM 2183 CZ PHE A 144 6.632 -13.683 -21.006 1.00 12.05 C ATOM 2184 HA PHE A 144 7.692 -14.594 -16.487 1.00 0.00 H ATOM 2185 HB2 PHE A 144 10.240 -14.478 -18.070 1.00 0.00 H ATOM 2186 HB3 PHE A 144 9.378 -16.030 -17.954 1.00 0.00 H ATOM 2187 HD2 PHE A 144 9.919 -13.842 -20.292 1.00 0.00 H ATOM 2188 HE2 PHE A 144 8.399 -13.122 -22.082 1.00 0.00 H ATOM 2189 HZ PHE A 144 5.959 -13.358 -21.800 1.00 0.00 H ATOM 2190 HE1 PHE A 144 5.037 -14.336 -19.725 1.00 0.00 H ATOM 2191 HD1 PHE A 144 6.567 -15.050 -17.915 1.00 0.00 H ATOM 2192 H PHE A 144 10.053 -12.824 -16.606 1.00 0.00 H ATOM 2193 N SER A 145 8.465 -16.372 -14.936 1.00 10.06 N ATOM 2194 CA SER A 145 8.940 -17.512 -14.158 1.00 12.14 C ATOM 2195 C SER A 145 9.408 -18.589 -15.119 1.00 13.03 C ATOM 2196 O SER A 145 9.203 -18.481 -16.327 1.00 11.13 O ATOM 2197 CB SER A 145 7.825 -18.088 -13.301 1.00 11.80 C ATOM 2198 OG SER A 145 6.905 -18.793 -14.104 1.00 15.26 O ATOM 2199 HA SER A 145 9.750 -17.180 -13.508 1.00 0.00 H ATOM 2200 HB2 SER A 145 7.308 -17.276 -12.790 1.00 0.00 H ATOM 2201 HB3 SER A 145 8.252 -18.767 -12.563 1.00 0.00 H ATOM 2202 HG SER A 145 6.514 -18.178 -14.773 1.00 0.00 H ATOM 2203 H SER A 145 7.445 -16.194 -15.032 1.00 0.00 H ATOM 2204 N ARG A 146 9.997 -19.643 -14.569 1.00 13.02 N ATOM 2205 CA ARG A 146 10.528 -20.746 -15.362 1.00 11.33 C ATOM 2206 C ARG A 146 9.475 -21.394 -16.254 1.00 14.77 C ATOM 2207 O ARG A 146 9.789 -21.867 -17.338 1.00 15.83 O ATOM 2208 CB ARG A 146 11.145 -21.784 -14.433 1.00 18.23 C ATOM 2209 CG ARG A 146 12.194 -22.659 -15.087 1.00 30.01 C ATOM 2210 CD ARG A 146 13.094 -23.282 -14.024 1.00 36.22 C ATOM 2211 NE ARG A 146 13.900 -22.257 -13.362 1.00 40.33 N ATOM 2212 CZ ARG A 146 14.898 -22.506 -12.520 1.00 40.41 C ATOM 2213 NH1 ARG A 146 15.568 -21.496 -11.979 1.00 32.64 N ATOM 2214 NH2 ARG A 146 15.228 -23.760 -12.227 1.00 35.42 N ATOM 2215 HA ARG A 146 11.288 -20.336 -16.027 1.00 0.00 H ATOM 2216 HB2 ARG A 146 11.609 -21.261 -13.596 1.00 0.00 H ATOM 2217 HB3 ARG A 146 10.347 -22.427 -14.061 1.00 0.00 H ATOM 2218 HG2 ARG A 146 11.702 -23.451 -15.652 1.00 0.00 H ATOM 2219 HG3 ARG A 146 12.799 -22.054 -15.762 1.00 0.00 H ATOM 2220 HD2 ARG A 146 13.756 -24.008 -14.496 1.00 0.00 H ATOM 2221 HD3 ARG A 146 12.475 -23.786 -13.281 1.00 0.00 H ATOM 2222 HE ARG A 146 13.676 -21.262 -13.565 1.00 0.00 H ATOM 2223 HH12 ARG A 146 16.350 -21.684 -11.320 1.00 0.00 H ATOM 2224 HH11 ARG A 146 15.311 -20.516 -12.215 1.00 0.00 H ATOM 2225 HH22 ARG A 146 16.009 -23.952 -11.568 1.00 0.00 H ATOM 2226 HH21 ARG A 146 14.705 -24.549 -12.657 1.00 0.00 H ATOM 2227 H ARG A 146 10.083 -19.684 -13.533 1.00 0.00 H ATOM 2228 N SER A 147 8.225 -21.415 -15.800 1.00 11.68 N ATOM 2229 CA SER A 147 7.159 -22.022 -16.574 1.00 11.19 C ATOM 2230 C SER A 147 6.572 -21.057 -17.608 1.00 14.77 C ATOM 2231 O SER A 147 5.777 -21.465 -18.457 1.00 15.72 O ATOM 2232 CB SER A 147 6.040 -22.488 -15.649 1.00 12.69 C ATOM 2233 OG SER A 147 5.298 -21.366 -15.203 1.00 15.63 O ATOM 2234 HA SER A 147 7.595 -22.869 -17.104 1.00 0.00 H ATOM 2235 HB2 SER A 147 6.469 -23.005 -14.791 1.00 0.00 H ATOM 2236 HB3 SER A 147 5.381 -23.168 -16.189 1.00 0.00 H ATOM 2237 HG SER A 147 5.897 -20.749 -14.712 1.00 0.00 H ATOM 2238 H SER A 147 8.009 -20.990 -14.876 1.00 0.00 H ATOM 2239 N GLY A 148 6.935 -19.780 -17.516 1.00 12.25 N ATOM 2240 CA GLY A 148 6.417 -18.778 -18.434 1.00 15.07 C ATOM 2241 C GLY A 148 5.198 -18.034 -17.915 1.00 16.31 C ATOM 2242 O GLY A 148 4.613 -17.205 -18.618 1.00 11.83 O ATOM 2243 HA3 GLY A 148 6.145 -19.274 -19.365 1.00 0.00 H ATOM 2244 HA2 GLY A 148 7.205 -18.051 -18.628 1.00 0.00 H ATOM 2245 H GLY A 148 7.603 -19.493 -16.772 1.00 0.00 H ATOM 2246 N LEU A 149 4.799 -18.343 -16.686 1.00 14.01 N ATOM 2247 CA LEU A 149 3.795 -17.542 -15.992 1.00 17.26 C ATOM 2248 C LEU A 149 4.419 -16.199 -15.582 1.00 10.68 C ATOM 2249 O LEU A 149 5.532 -16.161 -15.044 1.00 8.99 O ATOM 2250 CB LEU A 149 3.259 -18.297 -14.767 1.00 16.49 C ATOM 2251 CG LEU A 149 2.133 -17.643 -13.964 1.00 17.23 C ATOM 2252 CD1 LEU A 149 0.905 -17.403 -14.835 1.00 11.92 C ATOM 2253 CD2 LEU A 149 1.773 -18.480 -12.726 1.00 15.39 C ATOM 2254 HA LEU A 149 2.953 -17.354 -16.658 1.00 0.00 H ATOM 2255 HB2 LEU A 149 2.893 -19.263 -15.115 1.00 0.00 H ATOM 2256 HB3 LEU A 149 4.097 -18.451 -14.087 1.00 0.00 H ATOM 2257 HG LEU A 149 2.494 -16.674 -13.618 1.00 0.00 H ATOM 2258 HD21 LEU A 149 1.445 -19.471 -13.041 1.00 0.00 H ATOM 2259 HD22 LEU A 149 2.649 -18.573 -12.084 1.00 0.00 H ATOM 2260 HD23 LEU A 149 0.970 -17.988 -12.177 1.00 0.00 H ATOM 2261 HD11 LEU A 149 1.171 -16.745 -15.663 1.00 0.00 H ATOM 2262 HD12 LEU A 149 0.547 -18.355 -15.226 1.00 0.00 H ATOM 2263 HD13 LEU A 149 0.122 -16.937 -14.237 1.00 0.00 H ATOM 2264 H LEU A 149 5.210 -19.171 -16.209 1.00 0.00 H ATOM 2265 N ARG A 150 3.718 -15.101 -15.868 1.00 9.19 N ATOM 2266 CA ARG A 150 4.256 -13.778 -15.581 1.00 13.28 C ATOM 2267 C ARG A 150 3.816 -13.290 -14.207 1.00 7.24 C ATOM 2268 O ARG A 150 2.659 -13.458 -13.814 1.00 6.21 O ATOM 2269 CB ARG A 150 3.865 -12.760 -16.666 1.00 5.88 C ATOM 2270 CG ARG A 150 4.928 -11.684 -16.880 1.00 14.78 C ATOM 2271 CD ARG A 150 4.784 -10.911 -18.190 1.00 7.98 C ATOM 2272 NE ARG A 150 3.504 -10.229 -18.294 1.00 9.60 N ATOM 2273 CZ ARG A 150 3.330 -9.070 -18.914 1.00 9.13 C ATOM 2274 NH1 ARG A 150 4.374 -8.468 -19.456 1.00 9.22 N ATOM 2275 NH2 ARG A 150 2.116 -8.527 -18.997 1.00 6.09 N ATOM 2276 HA ARG A 150 5.342 -13.866 -15.581 1.00 0.00 H ATOM 2277 HB2 ARG A 150 3.714 -13.292 -17.605 1.00 0.00 H ATOM 2278 HB3 ARG A 150 2.934 -12.276 -16.371 1.00 0.00 H ATOM 2279 HG2 ARG A 150 4.866 -10.974 -16.055 1.00 0.00 H ATOM 2280 HG3 ARG A 150 5.907 -12.164 -16.872 1.00 0.00 H ATOM 2281 HD2 ARG A 150 4.877 -11.610 -19.021 1.00 0.00 H ATOM 2282 HD3 ARG A 150 5.581 -10.170 -18.249 1.00 0.00 H ATOM 2283 HE ARG A 150 2.675 -10.678 -17.855 1.00 0.00 H ATOM 2284 HH12 ARG A 150 4.253 -7.558 -19.946 1.00 0.00 H ATOM 2285 HH11 ARG A 150 5.316 -8.904 -19.393 1.00 0.00 H ATOM 2286 HH22 ARG A 150 1.985 -7.618 -19.484 1.00 0.00 H ATOM 2287 HH21 ARG A 150 1.299 -9.013 -18.574 1.00 0.00 H ATOM 2288 H ARG A 150 2.777 -15.190 -16.301 1.00 0.00 H ATOM 2289 N TYR A 151 4.739 -12.670 -13.487 1.00 8.43 N ATOM 2290 CA TYR A 151 4.429 -12.145 -12.156 1.00 9.27 C ATOM 2291 C TYR A 151 5.260 -10.885 -11.879 1.00 9.23 C ATOM 2292 O TYR A 151 6.332 -10.698 -12.459 1.00 10.04 O ATOM 2293 CB TYR A 151 4.718 -13.220 -11.099 1.00 5.55 C ATOM 2294 CG TYR A 151 6.193 -13.500 -10.941 1.00 10.07 C ATOM 2295 CD1 TYR A 151 6.937 -12.835 -9.978 1.00 7.29 C ATOM 2296 CD2 TYR A 151 6.853 -14.395 -11.773 1.00 10.11 C ATOM 2297 CE1 TYR A 151 8.282 -13.070 -9.832 1.00 15.43 C ATOM 2298 CE2 TYR A 151 8.217 -14.631 -11.633 1.00 9.15 C ATOM 2299 CZ TYR A 151 8.917 -13.961 -10.660 1.00 11.27 C ATOM 2300 OH TYR A 151 10.268 -14.166 -10.495 1.00 21.64 O ATOM 2301 HA TYR A 151 3.373 -11.878 -12.111 1.00 0.00 H ATOM 2302 HB3 TYR A 151 4.217 -14.142 -11.393 1.00 0.00 H ATOM 2303 HB2 TYR A 151 4.322 -12.883 -10.141 1.00 0.00 H ATOM 2304 HD2 TYR A 151 6.294 -14.920 -12.547 1.00 0.00 H ATOM 2305 HE2 TYR A 151 8.724 -15.339 -12.288 1.00 0.00 H ATOM 2306 HE1 TYR A 151 8.845 -12.549 -9.058 1.00 0.00 H ATOM 2307 HD1 TYR A 151 6.446 -12.113 -9.326 1.00 0.00 H ATOM 2308 HH TYR A 151 10.742 -13.924 -11.330 1.00 0.00 H ATOM 2309 H TYR A 151 5.698 -12.555 -13.873 1.00 0.00 H ATOM 2310 N ARG A 152 4.774 -10.023 -10.994 1.00 6.92 N ATOM 2311 CA ARG A 152 5.573 -8.882 -10.551 1.00 9.35 C ATOM 2312 C ARG A 152 5.407 -8.682 -9.046 1.00 12.47 C ATOM 2313 O ARG A 152 4.466 -9.208 -8.436 1.00 11.00 O ATOM 2314 CB ARG A 152 5.210 -7.593 -11.310 1.00 8.83 C ATOM 2315 CG ARG A 152 3.766 -7.117 -11.121 1.00 10.09 C ATOM 2316 CD ARG A 152 3.469 -5.840 -11.916 1.00 9.52 C ATOM 2317 NE ARG A 152 2.100 -5.345 -11.721 1.00 11.47 N ATOM 2318 CZ ARG A 152 1.588 -4.313 -12.391 1.00 15.59 C ATOM 2319 NH1 ARG A 152 2.349 -3.699 -13.285 1.00 9.04 N ATOM 2320 NH2 ARG A 152 0.319 -3.905 -12.186 1.00 4.07 N ATOM 2321 HA ARG A 152 6.617 -9.102 -10.773 1.00 0.00 H ATOM 2322 HB2 ARG A 152 5.875 -6.800 -10.969 1.00 0.00 H ATOM 2323 HB3 ARG A 152 5.372 -7.769 -12.373 1.00 0.00 H ATOM 2324 HG2 ARG A 152 3.090 -7.904 -11.455 1.00 0.00 H ATOM 2325 HG3 ARG A 152 3.597 -6.919 -10.063 1.00 0.00 H ATOM 2326 HD2 ARG A 152 3.615 -6.049 -12.976 1.00 0.00 H ATOM 2327 HD3 ARG A 152 4.167 -5.064 -11.600 1.00 0.00 H ATOM 2328 HE ARG A 152 1.498 -5.826 -11.023 1.00 0.00 H ATOM 2329 HH12 ARG A 152 1.973 -2.891 -13.821 1.00 0.00 H ATOM 2330 HH11 ARG A 152 3.323 -4.025 -13.451 1.00 0.00 H ATOM 2331 HH22 ARG A 152 -0.060 -3.097 -12.720 1.00 0.00 H ATOM 2332 HH21 ARG A 152 -0.280 -4.398 -11.494 1.00 0.00 H ATOM 2333 H ARG A 152 3.816 -10.161 -10.613 1.00 0.00 H ATOM 2334 N LEU A 153 6.326 -7.928 -8.457 1.00 9.59 N ATOM 2335 CA LEU A 153 6.339 -7.718 -7.013 1.00 12.14 C ATOM 2336 C LEU A 153 6.040 -6.267 -6.617 1.00 15.85 C ATOM 2337 O LEU A 153 6.655 -5.330 -7.160 1.00 18.16 O ATOM 2338 CB LEU A 153 7.699 -8.157 -6.447 1.00 8.67 C ATOM 2339 CG LEU A 153 8.092 -9.573 -6.851 1.00 11.32 C ATOM 2340 CD1 LEU A 153 9.547 -9.879 -6.553 1.00 6.97 C ATOM 2341 CD2 LEU A 153 7.178 -10.588 -6.163 1.00 10.15 C ATOM 2342 HA LEU A 153 5.540 -8.324 -6.587 1.00 0.00 H ATOM 2343 HB2 LEU A 153 8.463 -7.469 -6.809 1.00 0.00 H ATOM 2344 HB3 LEU A 153 7.653 -8.107 -5.359 1.00 0.00 H ATOM 2345 HG LEU A 153 7.969 -9.648 -7.931 1.00 0.00 H ATOM 2346 HD21 LEU A 153 7.271 -10.485 -5.082 1.00 0.00 H ATOM 2347 HD22 LEU A 153 6.145 -10.404 -6.459 1.00 0.00 H ATOM 2348 HD23 LEU A 153 7.468 -11.596 -6.459 1.00 0.00 H ATOM 2349 HD11 LEU A 153 10.183 -9.184 -7.102 1.00 0.00 H ATOM 2350 HD12 LEU A 153 9.728 -9.772 -5.483 1.00 0.00 H ATOM 2351 HD13 LEU A 153 9.773 -10.900 -6.861 1.00 0.00 H ATOM 2352 H LEU A 153 7.057 -7.474 -9.041 1.00 0.00 H ATOM 2353 N TYR A 154 5.089 -6.093 -5.691 1.00 6.70 N ATOM 2354 CA TYR A 154 4.855 -4.803 -5.038 1.00 10.76 C ATOM 2355 C TYR A 154 5.608 -4.761 -3.709 1.00 13.15 C ATOM 2356 O TYR A 154 5.574 -5.727 -2.937 1.00 12.66 O ATOM 2357 CB TYR A 154 3.379 -4.611 -4.667 1.00 14.27 C ATOM 2358 CG TYR A 154 2.351 -4.794 -5.751 1.00 15.42 C ATOM 2359 CD1 TYR A 154 2.708 -4.888 -7.093 1.00 12.94 C ATOM 2360 CD2 TYR A 154 0.995 -4.838 -5.423 1.00 11.43 C ATOM 2361 CE1 TYR A 154 1.737 -5.049 -8.074 1.00 12.58 C ATOM 2362 CE2 TYR A 154 0.039 -4.991 -6.380 1.00 16.17 C ATOM 2363 CZ TYR A 154 0.403 -5.096 -7.706 1.00 13.04 C ATOM 2364 OH TYR A 154 -0.581 -5.241 -8.658 1.00 11.16 O ATOM 2365 HA TYR A 154 5.181 -4.036 -5.740 1.00 0.00 H ATOM 2366 HB3 TYR A 154 3.270 -3.597 -4.283 1.00 0.00 H ATOM 2367 HB2 TYR A 154 3.147 -5.324 -3.876 1.00 0.00 H ATOM 2368 HD2 TYR A 154 0.695 -4.748 -4.379 1.00 0.00 H ATOM 2369 HE2 TYR A 154 -1.013 -5.030 -6.098 1.00 0.00 H ATOM 2370 HE1 TYR A 154 2.023 -5.137 -9.122 1.00 0.00 H ATOM 2371 HD1 TYR A 154 3.759 -4.835 -7.377 1.00 0.00 H ATOM 2372 HH TYR A 154 -0.165 -5.302 -9.554 1.00 0.00 H ATOM 2373 H TYR A 154 4.494 -6.904 -5.425 1.00 0.00 H ATOM 2374 N SER A 155 6.244 -3.633 -3.416 1.00 8.82 N ATOM 2375 CA SER A 155 6.815 -3.410 -2.087 1.00 10.85 C ATOM 2376 C SER A 155 6.363 -2.053 -1.525 1.00 10.36 C ATOM 2377 O SER A 155 7.009 -1.040 -1.779 1.00 17.62 O ATOM 2378 CB SER A 155 8.349 -3.493 -2.157 1.00 10.88 C ATOM 2379 OG SER A 155 8.926 -3.260 -0.891 1.00 13.03 O ATOM 2380 HA SER A 155 6.455 -4.187 -1.412 1.00 0.00 H ATOM 2381 HB2 SER A 155 8.715 -2.744 -2.859 1.00 0.00 H ATOM 2382 HB3 SER A 155 8.637 -4.486 -2.503 1.00 0.00 H ATOM 2383 HG SER A 155 9.912 -3.319 -0.963 1.00 0.00 H ATOM 2384 H SER A 155 6.338 -2.895 -4.143 1.00 0.00 H ATOM 2385 N TYR A 156 5.247 -2.029 -0.787 1.00 10.18 N ATOM 2386 CA TYR A 156 4.648 -0.771 -0.307 1.00 8.78 C ATOM 2387 C TYR A 156 4.767 -0.545 1.187 1.00 9.95 C ATOM 2388 O TYR A 156 4.882 -1.490 1.958 1.00 12.32 O ATOM 2389 CB TYR A 156 3.155 -0.692 -0.631 1.00 8.42 C ATOM 2390 CG TYR A 156 2.804 -0.893 -2.070 1.00 12.23 C ATOM 2391 CD1 TYR A 156 3.609 -0.377 -3.082 1.00 14.16 C ATOM 2392 CD2 TYR A 156 1.667 -1.585 -2.421 1.00 12.09 C ATOM 2393 CE1 TYR A 156 3.288 -0.561 -4.415 1.00 17.49 C ATOM 2394 CE2 TYR A 156 1.335 -1.781 -3.750 1.00 19.82 C ATOM 2395 CZ TYR A 156 2.149 -1.270 -4.741 1.00 11.86 C ATOM 2396 OH TYR A 156 1.820 -1.464 -6.061 1.00 6.86 O ATOM 2397 HA TYR A 156 5.222 -0.007 -0.831 1.00 0.00 H ATOM 2398 HB3 TYR A 156 2.796 0.292 -0.331 1.00 0.00 H ATOM 2399 HB2 TYR A 156 2.642 -1.458 -0.049 1.00 0.00 H ATOM 2400 HD2 TYR A 156 1.019 -1.984 -1.641 1.00 0.00 H ATOM 2401 HE2 TYR A 156 0.435 -2.336 -4.013 1.00 0.00 H ATOM 2402 HE1 TYR A 156 3.926 -0.151 -5.198 1.00 0.00 H ATOM 2403 HD1 TYR A 156 4.507 0.181 -2.820 1.00 0.00 H ATOM 2404 HH TYR A 156 2.503 -1.037 -6.636 1.00 0.00 H ATOM 2405 H TYR A 156 4.786 -2.929 -0.544 1.00 0.00 H ATOM 2406 N HIS A 157 4.648 0.717 1.588 1.00 8.89 N ATOM 2407 CA HIS A 157 4.854 1.113 2.975 1.00 13.06 C ATOM 2408 C HIS A 157 4.143 2.416 3.305 1.00 9.23 C ATOM 2409 O HIS A 157 3.810 3.179 2.414 1.00 7.69 O ATOM 2410 CB HIS A 157 6.345 1.297 3.245 1.00 14.33 C ATOM 2411 CG HIS A 157 7.032 2.179 2.250 1.00 21.42 C ATOM 2412 ND1 HIS A 157 7.767 1.682 1.195 1.00 18.45 N ATOM 2413 CD2 HIS A 157 7.087 3.528 2.141 1.00 16.72 C ATOM 2414 CE1 HIS A 157 8.244 2.686 0.480 1.00 15.91 C ATOM 2415 NE2 HIS A 157 7.854 3.817 1.040 1.00 18.27 N ATOM 2416 HA HIS A 157 4.441 0.322 3.601 1.00 0.00 H ATOM 2417 HB2 HIS A 157 6.464 1.737 4.235 1.00 0.00 H ATOM 2418 HB3 HIS A 157 6.822 0.317 3.224 1.00 0.00 H ATOM 2419 HD2 HIS A 157 6.611 4.250 2.804 1.00 0.00 H ATOM 2420 HE1 HIS A 157 8.855 2.596 -0.418 1.00 0.00 H ATOM 2421 H HIS A 157 4.400 1.446 0.889 1.00 0.00 H ATOM 2422 N ARG A 158 3.940 2.657 4.597 1.00 12.90 N ATOM 2423 CA ARG A 158 3.357 3.891 5.102 1.00 13.18 C ATOM 2424 C ARG A 158 3.764 4.142 6.560 1.00 21.04 C ATOM 2425 O ARG A 158 4.495 3.340 7.183 1.00 13.13 O ATOM 2426 CB ARG A 158 1.828 3.842 5.011 1.00 8.20 C ATOM 2427 CG ARG A 158 1.194 2.678 5.778 1.00 12.95 C ATOM 2428 CD ARG A 158 -0.333 2.670 5.613 1.00 15.64 C ATOM 2429 NE ARG A 158 -0.996 1.647 6.433 1.00 11.83 N ATOM 2430 CZ ARG A 158 -2.311 1.445 6.464 1.00 13.15 C ATOM 2431 NH1 ARG A 158 -3.133 2.190 5.726 1.00 11.03 N ATOM 2432 NH2 ARG A 158 -2.811 0.497 7.241 1.00 18.51 N ATOM 2433 HA ARG A 158 3.734 4.706 4.484 1.00 0.00 H ATOM 2434 HB2 ARG A 158 1.431 4.774 5.413 1.00 0.00 H ATOM 2435 HB3 ARG A 158 1.550 3.753 3.961 1.00 0.00 H ATOM 2436 HG2 ARG A 158 1.598 1.740 5.398 1.00 0.00 H ATOM 2437 HG3 ARG A 158 1.437 2.775 6.836 1.00 0.00 H ATOM 2438 HD2 ARG A 158 -0.568 2.481 4.566 1.00 0.00 H ATOM 2439 HD3 ARG A 158 -0.718 3.648 5.900 1.00 0.00 H ATOM 2440 HE ARG A 158 -0.398 1.040 7.029 1.00 0.00 H ATOM 2441 HH12 ARG A 158 -4.159 2.022 5.760 1.00 0.00 H ATOM 2442 HH11 ARG A 158 -2.749 2.940 5.116 1.00 0.00 H ATOM 2443 HH22 ARG A 158 -3.838 0.335 7.269 1.00 0.00 H ATOM 2444 HH21 ARG A 158 -2.177 -0.086 7.824 1.00 0.00 H ATOM 2445 H ARG A 158 4.212 1.924 5.283 1.00 0.00 H ATOM 2446 N SER A 159 3.274 5.260 7.094 1.00 17.71 N ATOM 2447 CA SER A 159 3.415 5.587 8.509 1.00 18.23 C ATOM 2448 C SER A 159 2.468 4.737 9.344 1.00 19.25 C ATOM 2449 O SER A 159 2.802 4.367 10.470 1.00 26.23 O ATOM 2450 CB SER A 159 3.096 7.067 8.752 1.00 13.00 C ATOM 2451 OG SER A 159 4.075 7.900 8.172 1.00 17.49 O ATOM 2452 HA SER A 159 4.445 5.384 8.801 1.00 0.00 H ATOM 2453 OXT SER A 159 1.346 4.423 8.916 1.00 26.79 O ATOM 2454 HB2 SER A 159 3.061 7.252 9.826 1.00 0.00 H ATOM 2455 HB3 SER A 159 2.126 7.299 8.313 1.00 0.00 H ATOM 2456 HG SER A 159 3.844 8.847 8.344 1.00 0.00 H ATOM 2457 H SER A 159 2.770 5.928 6.476 1.00 0.00 H TER 2458 SER A 159 HETATM 2459 O HOH 1 -2.194 -24.398 -5.262 1.00 13.51 O HETATM 2460 O HOH 2 4.611 -11.230 -2.150 1.00 7.92 O HETATM 2461 O HOH 3 6.097 -19.966 17.762 1.00 18.14 O HETATM 2462 O HOH 4 -4.960 -0.141 2.661 1.00 9.52 O HETATM 2463 O HOH 5 6.877 -3.874 18.041 1.00 30.79 O HETATM 2464 O HOH 6 4.948 -27.208 20.600 1.00 23.40 O HETATM 2465 O HOH 7 -2.301 -16.775 -2.936 1.00 10.98 O HETATM 2466 O HOH 8 6.945 -8.231 -2.818 1.00 10.99 O HETATM 2467 O HOH 9 2.976 -21.064 -5.301 1.00 20.44 O HETATM 2468 O HOH 10 11.083 -10.765 13.214 1.00 25.65 O HETATM 2469 O HOH 11 -3.946 -30.316 7.340 1.00 14.44 O HETATM 2470 O HOH 12 9.200 -22.810 12.995 1.00 15.81 O HETATM 2471 O HOH 13 12.337 -6.900 3.469 1.00 17.36 O HETATM 2472 O HOH 14 -3.266 -10.128 -16.029 1.00 15.58 O HETATM 2473 O HOH 15 8.005 -21.213 3.383 1.00 11.73 O HETATM 2474 O HOH 16 -9.337 -24.538 7.141 1.00 16.91 O HETATM 2475 O HOH 17 13.813 -18.474 -0.520 1.00 18.01 O HETATM 2476 O HOH 18 -9.164 -11.352 21.656 1.00 19.68 O HETATM 2477 O HOH 19 8.701 -4.349 -5.685 1.00 27.14 O HETATM 2478 O HOH 20 15.636 -18.622 10.012 1.00 22.12 O HETATM 2479 O HOH 21 -1.686 -5.681 -14.109 1.00 15.32 O HETATM 2480 O HOH 22 -7.503 -24.867 2.135 1.00 19.48 O HETATM 2481 O HOH 23 7.631 -3.103 2.124 1.00 9.91 O HETATM 2482 O HOH 24 -0.825 -8.382 -18.662 1.00 9.29 O HETATM 2483 O HOH 25 -15.029 -18.938 -5.793 1.00 15.67 O HETATM 2484 O HOH 26 8.612 -7.389 -10.000 1.00 14.15 O HETATM 2485 O HOH 27 5.175 1.801 -11.235 1.00 7.88 O HETATM 2486 O HOH 28 -2.969 -16.101 2.339 1.00 12.09 O HETATM 2487 O HOH 29 -8.455 3.918 4.210 1.00 23.54 O HETATM 2488 O HOH 30 11.428 -3.548 -0.978 1.00 21.59 O HETATM 2489 O HOH 31 7.011 1.651 -9.124 1.00 18.89 O HETATM 2490 O HOH 32 4.659 -3.412 -13.609 1.00 11.81 O HETATM 2491 O HOH 33 13.343 -4.445 7.305 1.00 27.76 O HETATM 2492 O HOH 34 -5.310 -4.028 -2.646 1.00 11.44 O HETATM 2493 O HOH 35 -5.196 -21.796 3.455 1.00 20.33 O HETATM 2494 O HOH 36 10.618 -25.115 12.990 1.00 25.10 O HETATM 2495 O HOH 37 1.667 -18.213 -5.198 1.00 12.80 O HETATM 2496 O HOH 38 -7.098 -11.612 -12.963 1.00 9.29 O HETATM 2497 O HOH 39 -9.401 -4.925 9.910 1.00 24.97 O HETATM 2498 O HOH 40 -8.899 -10.586 24.322 1.00 25.25 O HETATM 2499 O HOH 41 16.069 -14.374 13.554 1.00 17.22 O HETATM 2500 O HOH 42 -13.288 -17.855 16.051 1.00 13.09 O HETATM 2501 O HOH 43 11.193 -3.452 -7.093 1.00 32.38 O HETATM 2502 O HOH 44 6.133 -2.737 15.757 1.00 22.92 O HETATM 2503 O HOH 45 6.393 -30.476 10.381 1.00 20.29 O HETATM 2504 O HOH 46 -2.827 -4.269 -7.349 1.00 17.08 O HETATM 2505 O HOH 47 5.538 -6.592 14.602 1.00 28.22 O HETATM 2506 O HOH 48 -0.261 -29.276 15.340 1.00 16.43 O HETATM 2507 O HOH 49 1.737 -1.535 -14.515 1.00 26.94 O HETATM 2508 O HOH 50 -3.461 2.922 10.240 1.00 19.33 O HETATM 2509 O HOH 51 13.576 -21.022 -1.929 1.00 19.15 O HETATM 2510 O HOH 52 -1.566 -28.126 22.522 1.00 12.23 O HETATM 2511 O HOH 53 11.057 -21.803 -1.715 1.00 18.56 O HETATM 2512 O HOH 54 4.576 -21.232 1.555 1.00 8.47 O HETATM 2513 O HOH 55 8.148 -32.252 11.628 1.00 19.57 O HETATM 2514 O HOH 56 11.688 -22.208 -4.430 1.00 14.78 O HETATM 2515 O HOH 57 12.341 -15.023 14.860 1.00 22.43 O HETATM 2516 O HOH 58 10.381 -13.098 15.754 1.00 10.58 O HETATM 2517 O HOH 59 -10.011 -15.035 22.122 1.00 11.98 O HETATM 2518 O HOH 60 -3.584 -5.034 -4.509 1.00 13.62 O HETATM 2519 O HOH 61 -11.241 -12.625 1.353 1.00 15.59 O HETATM 2520 O HOH 62 7.388 -21.798 15.330 1.00 16.52 O HETATM 2521 O HOH 63 -11.482 -11.653 23.782 1.00 26.87 O HETATM 2522 O HOH 64 6.947 -28.819 15.422 1.00 24.01 O HETATM 2523 O HOH 65 15.252 -17.971 1.692 1.00 18.50 O HETATM 2524 O HOH 66 12.343 -7.002 6.165 1.00 19.21 O HETATM 2525 O HOH 67 11.441 -12.378 -16.937 1.00 14.21 O HETATM 2526 O HOH 68 -4.010 -28.475 23.037 1.00 24.54 O HETATM 2527 O HOH 69 -8.930 -5.434 2.946 1.00 15.91 O HETATM 2528 O HOH 70 -4.620 -19.058 3.942 1.00 14.63 O HETATM 2529 O HOH 71 -0.805 2.426 9.686 1.00 29.27 O HETATM 2530 O HOH 72 5.994 -24.798 -11.768 1.00 22.67 O HETATM 2531 O HOH 73 -18.496 -15.561 17.358 1.00 28.43 O HETATM 2532 O HOH 74 -12.804 -9.464 -11.523 1.00 22.61 O HETATM 2533 O HOH 75 3.350 -29.386 13.580 1.00 15.55 O HETATM 2534 O HOH 76 3.024 6.526 2.811 1.00 17.61 O HETATM 2535 O HOH 77 -7.734 -5.343 -4.142 1.00 17.95 O HETATM 2536 O HOH 78 13.221 -10.237 14.302 1.00 28.51 O HETATM 2537 O HOH 79 9.067 -24.772 16.838 1.00 17.06 O HETATM 2538 O HOH 80 -2.944 -17.739 -0.077 1.00 11.10 O HETATM 2539 O HOH 81 2.865 -15.575 22.133 1.00 15.47 O HETATM 2540 O HOH 82 -11.050 -20.710 24.259 1.00 16.98 O HETATM 2541 O HOH 83 5.064 -21.302 -12.661 1.00 18.14 O HETATM 2542 O HOH 84 0.623 -24.126 -6.301 1.00 23.29 O HETATM 2543 O HOH 85 8.389 -4.493 -16.552 1.00 13.21 O HETATM 2544 O HOH 86 -9.735 -20.374 -1.477 1.00 17.34 O HETATM 2545 O HOH 87 7.651 -0.651 8.910 1.00 19.67 O HETATM 2546 O HOH 88 7.093 -29.518 18.168 1.00 17.98 O HETATM 2547 O HOH 89 6.063 -30.525 16.811 1.00 23.39 O HETATM 2548 O HOH 90 7.783 -21.706 -12.515 1.00 21.83 O HETATM 2549 O HOH 91 -12.320 -19.198 -1.072 1.00 15.43 O HETATM 2550 O HOH 92 3.462 0.266 19.569 1.00 32.00 O HETATM 2551 O HOH 93 -8.373 -0.807 2.929 1.00 14.71 O HETATM 2552 O HOH 94 -8.979 -27.515 14.242 1.00 22.25 O HETATM 2553 O HOH 95 8.580 -24.467 -12.487 1.00 30.96 O HETATM 2554 O HOH 96 1.869 -23.947 21.441 1.00 8.39 O HETATM 2555 O HOH 97 11.308 -22.107 -10.868 1.00 14.18 O HETATM 2556 O HOH 98 6.018 -1.013 13.742 1.00 32.15 O HETATM 2557 O HOH 99 -0.425 -25.813 20.618 1.00 12.42 O HETATM 2558 O HOH 100 -0.136 -21.926 -13.096 1.00 16.37 O HETATM 2559 O HOH 101 5.037 -10.903 16.906 1.00 24.15 O HETATM 2560 O HOH 102 -13.418 -20.485 -3.494 1.00 23.23 O HETATM 2561 O HOH 103 -7.197 -5.917 -6.389 1.00 15.00 O HETATM 2562 O HOH 104 11.332 -9.318 5.946 1.00 17.61 O HETATM 2563 O HOH 105 3.466 -12.813 22.126 1.00 19.59 O HETATM 2564 O HOH 106 10.422 -22.591 0.816 1.00 20.26 O HETATM 2565 O HOH 107 -8.295 -20.907 3.731 1.00 23.83 O HETATM 2566 O HOH 108 7.368 -21.069 0.683 1.00 16.80 O HETATM 2567 O HOH 109 10.939 -21.504 14.782 1.00 20.27 O HETATM 2568 O HOH 110 -13.329 -12.936 16.908 1.00 25.78 O HETATM 2569 O HOH 111 0.761 -29.880 13.388 1.00 12.84 O HETATM 2570 O HOH 112 -7.894 -27.804 7.112 1.00 17.64 O HETATM 2571 O HOH 113 -7.848 -19.887 0.085 1.00 17.44 O HETATM 2572 O HOH 114 11.552 -15.369 -12.565 1.00 14.58 O HETATM 2573 O HOH 115 15.700 -24.365 -9.549 1.00 20.99 O HETATM 2574 O HOH 116 -0.380 -3.394 -15.768 1.00 22.67 O HETATM 2575 O HOH 117 -9.031 -9.972 -14.235 1.00 25.07 O HETATM 2576 O HOH 118 -5.498 -5.979 -7.687 1.00 18.66 O HETATM 2577 O HOH 119 6.652 -3.286 -13.889 1.00 18.17 O HETATM 2578 O HOH 120 8.170 -28.988 12.536 1.00 26.59 O HETATM 2579 O HOH 121 16.269 -13.090 8.623 1.00 30.64 O HETATM 2580 O HOH 122 2.425 -22.019 0.483 1.00 7.81 O HETATM 2581 O HOH 123 -3.204 -20.392 0.618 1.00 15.10 O HETATM 2582 O HOH 124 3.839 -1.684 11.623 1.00 20.88 O HETATM 2583 O HOH 125 6.172 -0.202 -13.538 1.00 18.25 O HETATM 2584 O HOH 126 3.849 -31.380 12.557 1.00 21.83 O HETATM 2585 O HOH 127 -12.534 -22.881 22.986 1.00 23.19 O HETATM 2586 O HOH 128 3.992 -11.452 23.680 1.00 27.67 O HETATM 2587 O HOH 129 14.480 -12.932 5.902 1.00 17.04 O HETATM 2588 O HOH 130 -13.377 -18.181 4.137 1.00 21.54 O HETATM 2589 O HOH 131 10.295 0.167 17.766 1.00 27.17 O HETATM 2590 O HOH 132 13.350 -23.340 0.225 1.00 37.08 O HETATM 2591 O HOH 133 -6.447 -28.419 13.925 1.00 18.48 O HETATM 2592 O HOH 134 5.834 -33.082 11.041 1.00 18.40 O HETATM 2593 O HOH 135 -5.449 -16.354 2.608 1.00 16.23 O HETATM 2594 O HOH 136 10.824 -5.361 -4.493 1.00 33.91 O HETATM 2595 O HOH 137 -6.997 -7.488 24.951 1.00 27.83 O HETATM 2596 O HOH 138 -2.050 -3.994 3.093 1.00 21.70 O HETATM 2597 O HOH 139 -1.013 -1.958 -6.159 1.00 16.77 O HETATM 2598 O HOH 140 -1.127 -0.900 -17.128 1.00 28.70 O HETATM 2599 O HOH 141 -11.335 -25.013 8.974 1.00 23.75 O HETATM 2600 O HOH 142 -14.394 -21.348 14.505 1.00 28.45 O HETATM 2601 O HOH 143 -13.663 -24.969 19.368 1.00 32.14 O HETATM 2602 O HOH 144 -11.975 -13.620 5.502 1.00 24.72 O HETATM 2603 O HOH 145 -9.611 -1.645 13.126 1.00 22.23 O HETATM 2604 O HOH 146 -7.556 -1.705 14.469 1.00 19.87 O HETATM 2605 O HOH 147 -18.508 -12.315 -11.095 1.00 26.97 O HETATM 2606 O HOH 148 9.788 -6.504 -17.625 1.00 17.18 O HETATM 2607 O HOH 149 6.265 -3.715 -16.161 1.00 20.62 O HETATM 2608 O HOH 150 -12.343 -24.789 -7.415 1.00 24.01 O HETATM 2609 O HOH 151 -9.656 -22.397 4.980 1.00 14.08 O HETATM 2610 O HOH 152 8.449 -20.709 17.335 1.00 23.15 O HETATM 2611 O HOH 153 7.239 1.401 -12.183 1.00 21.58 O HETATM 2612 O HOH 154 -2.712 -4.424 -12.750 1.00 21.00 O HETATM 2613 O HOH 155 -14.642 -24.819 -5.832 1.00 22.40 O HETATM 2614 O HOH 156 15.391 -10.333 5.492 1.00 29.56 O HETATM 2615 O HOH 157 -9.441 -9.881 3.361 1.00 15.10 O HETATM 2616 O HOH 158 -13.511 -16.656 -12.772 1.00 19.42 O HETATM 2617 O HOH 159 -4.139 -28.785 13.940 1.00 13.33 O HETATM 2618 O HOH 160 -13.362 -23.276 17.317 1.00 33.01 O HETATM 2619 O HOH 161 14.985 1.842 9.947 1.00 28.43 O HETATM 2620 O HOH 162 -16.412 -20.328 -3.534 1.00 24.21 O HETATM 2621 O HOH 163 9.833 -0.311 1.389 1.00 27.30 O HETATM 2622 O HOH 164 14.396 -6.468 8.542 1.00 32.27 O HETATM 2623 O HOH 165 9.450 -0.285 4.061 1.00 23.12 O HETATM 2624 O HOH 166 12.102 -19.522 14.392 1.00 25.56 O HETATM 2625 O HOH 167 13.541 -9.534 5.600 1.00 25.26 O HETATM 2626 O HOH 168 2.215 0.629 16.736 1.00 22.48 O HETATM 2627 O HOH 169 10.337 -12.516 18.310 1.00 24.36 O HETATM 2628 O HOH 170 10.390 -26.746 15.023 1.00 24.92 O HETATM 2629 O HOH 171 -6.368 -28.852 18.492 1.00 22.72 O HETATM 2630 O HOH 172 1.588 -6.396 21.116 1.00 27.88 O HETATM 2631 O HOH 173 3.641 -1.433 -15.911 1.00 23.57 O HETATM 2632 O HOH 174 -9.008 -25.951 -5.254 1.00 23.86 O HETATM 2633 O HOH 175 9.591 0.146 -1.043 1.00 21.69 O HETATM 2634 O HOH 176 12.566 2.647 11.408 1.00 26.04 O HETATM 2635 O HOH 177 1.406 -14.613 -17.219 1.00 7.15 O HETATM 2636 O HOH 178 -2.380 -28.446 14.557 1.00 17.81 O HETATM 2637 O HOH 179 -16.084 -13.199 17.605 1.00 17.34 O HETATM 2638 O HOH 180 -19.760 -15.978 -8.526 1.00 21.06 O HETATM 2639 O HOH 181 11.825 -1.525 4.702 1.00 23.89 O HETATM 2640 O HOH 182 4.637 -35.478 9.816 1.00 32.45 O HETATM 2641 O HOH 183 15.579 -22.716 -15.632 1.00 19.28 O HETATM 2642 O HOH 184 -16.076 -11.126 -11.514 1.00 23.66 O HETATM 2643 O HOH 185 0.619 -27.769 21.977 1.00 20.24 O HETATM 2644 O HOH 186 -1.274 -15.073 -0.670 1.00 7.07 O HETATM 2645 O HOH 187 12.724 -23.878 12.342 1.00 21.19 O HETATM 2646 O HOH 188 -8.663 -9.426 19.682 1.00 23.23 O HETATM 2647 O HOH 189 3.142 2.464 15.157 1.00 26.50 O HETATM 2648 O HOH 190 11.309 -6.644 -9.001 1.00 20.87 O HETATM 2649 O HOH 191 -8.354 -23.024 -7.510 1.00 23.03 O HETATM 2650 O HOH 192 -13.333 -20.481 5.318 1.00 24.26 O HETATM 2651 O HOH 193 -9.494 -4.569 6.408 1.00 21.36 O HETATM 2652 O HOH 194 -16.524 -9.373 -9.749 1.00 26.66 O HETATM 2653 O HOH 195 4.825 -31.011 14.472 1.00 27.63 O HETATM 2654 O HOH 196 -10.628 -27.083 10.471 1.00 23.67 O HETATM 2655 O HOH 197 9.746 -27.357 11.456 1.00 27.41 O HETATM 2656 O HOH 198 6.771 3.154 7.315 1.00 19.97 O HETATM 2657 O HOH 199 9.530 -21.692 -4.237 1.00 20.89 O HETATM 2658 O HOH 200 13.101 -10.927 17.075 1.00 31.25 O HETATM 2659 O HOH 201 -8.326 -8.291 -13.673 1.00 29.73 O HETATM 2660 O HOH 202 13.033 -18.068 -12.462 1.00 26.65 O HETATM 2661 O HOH 203 -11.795 -21.273 -11.479 1.00 25.67 O HETATM 2662 O HOH 204 -11.872 -10.408 10.638 1.00 25.81 O HETATM 2663 O HOH 205 -9.104 5.632 6.431 1.00 26.28 O HETATM 2664 N1 UNN A 206 3.200 -16.310 -1.333 1.00 -0.30 N HETATM 2665 C2 UNN A 206 3.198 -15.026 -0.898 1.00 0.13 C HETATM 2666 N3 UNN A 206 2.640 -14.686 0.278 1.00 -0.30 N HETATM 2667 C4 UNN A 206 2.034 -15.607 1.060 1.00 0.23 C HETATM 2668 N5 UNN A 206 1.984 -16.955 0.675 1.00 -0.12 N HETATM 2669 C6 UNN A 206 2.523 -17.375 -0.615 1.00 0.18 C HETATM 2670 C9 UNN A 206 3.310 -18.685 -0.613 1.00 -0.00 C HETATM 2671 H7 UNN A 206 3.666 -18.901 -1.631 1.00 0.03 H HETATM 2672 H8 UNN A 206 2.659 -19.503 -0.271 1.00 0.03 H HETATM 2673 H9 UNN A 206 4.172 -18.594 0.065 1.00 0.03 H HETATM 2674 C10 UNN A 206 1.257 -17.581 -1.430 1.00 -0.00 C HETATM 2675 H10 UNN A 206 1.524 -17.906 -2.446 1.00 0.03 H HETATM 2676 H11 UNN A 206 0.697 -16.636 -1.483 1.00 0.03 H HETATM 2677 H12 UNN A 206 0.634 -18.350 -0.951 1.00 0.03 H HETATM 2678 C11 UNN A 206 1.378 -17.872 1.559 1.00 0.29 C HETATM 2679 C12 UNN A 206 2.250 -18.565 2.408 1.00 0.15 C HETATM 2680 C13 UNN A 206 1.775 -19.489 3.330 1.00 0.11 C HETATM 2681 C14 UNN A 206 0.402 -19.681 3.400 1.00 0.22 C HETATM 2682 C15 UNN A 206 -0.472 -18.993 2.569 1.00 0.11 C HETATM 2683 C16 UNN A 206 0.013 -18.073 1.655 1.00 0.15 C HETATM 2684 H16 UNN A 206 -0.669 -17.517 1.022 1.00 0.14 H HETATM 2685 H15 UNN A 206 -1.538 -19.177 2.636 1.00 0.12 H HETATM 2686 CL17 UNN A 206 -0.245 -20.851 4.575 1.00 0.11 CL HETATM 2687 H14 UNN A 206 2.452 -20.041 3.972 1.00 0.12 H HETATM 2688 H13 UNN A 206 3.316 -18.377 2.344 1.00 0.14 H HETATM 2689 N8 UNN A 206 1.479 -15.241 2.237 1.00 -0.33 N HETATM 2690 H5 UNN A 206 1.507 -14.255 2.535 1.00 0.17 H HETATM 2691 H6 UNN A 206 1.028 -15.948 2.836 1.00 0.17 H HETATM 2692 H2 UNN A 206 2.675 -13.705 0.589 1.00 0.19 H HETATM 2693 N7 UNN A 206 3.778 -14.069 -1.644 1.00 -0.35 N HETATM 2694 H3 UNN A 206 4.210 -14.311 -2.547 1.00 0.16 H HETATM 2695 H4 UNN A 206 3.790 -13.094 -1.312 1.00 0.16 H HETATM 2696 H1 UNN A 206 3.700 -16.538 -2.204 1.00 0.17 H CONECT 1 2 17 18 19 CONECT 17 1 CONECT 18 1 CONECT 19 1 CONECT 2664 2665 2669 2696 CONECT 2665 2664 2666 2693 CONECT 2666 2665 2667 2692 CONECT 2667 2666 2668 2689 CONECT 2668 2667 2669 2678 CONECT 2669 2664 2668 2670 2674 CONECT 2670 2669 2671 2672 2673 CONECT 2671 2670 CONECT 2672 2670 CONECT 2673 2670 CONECT 2674 2669 2675 2676 2677 CONECT 2675 2674 CONECT 2676 2674 CONECT 2677 2674 CONECT 2678 2668 2679 2683 CONECT 2679 2678 2680 2688 CONECT 2680 2679 2681 2687 CONECT 2681 2680 2682 2686 CONECT 2682 2681 2683 2685 CONECT 2683 2678 2682 2684 CONECT 2684 2683 CONECT 2685 2682 CONECT 2686 2681 CONECT 2687 2680 CONECT 2688 2679 CONECT 2689 2667 2690 2691 CONECT 2690 2689 CONECT 2691 2689 CONECT 2692 2666 CONECT 2693 2665 2694 2695 CONECT 2694 2693 CONECT 2695 2693 CONECT 2696 2664 MASTER 0 0 0 0 0 0 0 0 2695 1 37 13 END
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Structure:
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Related entries of code: 4kne
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4km0
RCSB PDB
PDBbind
179aa, >4KM0_1|Chains... *
4km2
RCSB PDB
PDBbind
179aa, >4KM2_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4kne
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Dihydrofolate reductase
Ligand Name
1CY
EC.Number
E.C.1.5.1.3
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=1.26uM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) Structure Vol. 22: pp. 94-103
Ligand Properties
Formula
C
1
1
H
1
6
ClN
5
Molecular Weight
253.731
Exact Mass
253.109
No. of atoms
33
No. of bonds
34
Polar Surface Area
73.69
LOGP Value
3.12 (
Computed with XLOGP3
)
2.49 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 0
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 2
Canonical SMILES
NC1[NH+]C(=[NH+]C(N1c1ccc(cc1)Cl)(C)C)N
InChI String
InChI=1S/C11H16ClN5/c1-11(2)16-9(13)15-10(14)17(11)8-5-3-7(12)4-6-8/h3-6,10H,14H2,1-2H3,(H3,13,15,16)/p+2
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):
P9WNX1
Entrez Gene ID
NCBI Entrez Gene ID:
887777
ASD
Information of known allosteric effects of PDB entries
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